NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
575089 | 2lzu | 18778 | cing | 4-filtered-FRED | STAR | entry | full | 1111 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2lzu # This FRED archive file contains, for PDB entry <2lzu>: # # - Coordinates and sequence information from the PDB mmCIF file # - NMR restraints from the PDB MR file # # In this file, the coordinates and NMR restraints share the same atom names, # and in this way can differ from the data deposited at the wwPDB. To achieve # this aim, the NMR restraints were parsed from their original format files, and # the coordinates and NMR restraints information were subsequently harmonized. # # Due to the complexity of this harmonization process and the filtering process # used in creating these files, the NMR restraints information in these files # may differ significantly from that in the originally deposited file. Other # modifications could have occurred to the NMR restraints information, or data # could have been lost because of parsing or conversion errors. The PDB file # remains the authoritative reference for the atomic coordinates and the # originally deposited restraints files remain the primary reference for these # data. # # This file is generated at the BioMagResBank (BMRB) in collaboration with the # PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and # the CMBI/IMM group at the Radboud University of Nijmegen. # # Several software packages were used to produce this file: # # - Wattos (BMRB and CMBI/IMM). # - FormatConverter and NMRStarExport (PDBe). # - CCPN framework (http://www.ccpn.ac.uk/). # # More information about this process can be found in the references below. # Please cite the original reference for this PDB entry. # # JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL # Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED # containing converted and filtered sets of experimental NMR restraints and # coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12. # # WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL # Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy: # development of a software pipeline. Proteins 59, 687-696. # # JF Doreleijers, WF Vranken, C Schulte, J Lin, JR Wedell, CJ Penkett, GW Vuister, # G Vriend, JL Markley, and EL Ulrich (2009). The NMR Restraints Grid at BMRB for # 5,266 Protein and Nucleic Acid PDB Entries. J Biomol. NMR 45, 389?396. save_Conversion_project_for_entry_Name_1 _Study_list.Sf_category study_list _Study_list.Entry_ID 1 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project for entry 1" NMR . 1 1 stop_ save_ save_originalConstraints_1 _Entry.PDB_coordinate_file_version . _Entry.Sf_category entry_information _Entry.ID 1 _Entry.Title "Data for entry 1" _Entry.NMR_STAR_version 3.1.0.8 _Entry.Experimental_method NMR _Entry.Details . save_ save_assembly_2lzu _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 2lzu _Assembly.Number_of_components 3 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "free and other bound" _Assembly.Molecular_mass 8434.36 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 $LIM_domain_containing_protein_2 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_LIM_domain_containing_protein_2 _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "LIM domain containing protein 2" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code RAQVKETCAACQKTVYPMERLVADKLIFHNSCFCCKHCHTKLSLGSYAALHGEFYCKPHFQQLFKSKGNYDE _Entity.Number_of_monomers 72 loop_ _Entity_comp_index.ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 ARG . 1 1 2 ALA . 1 1 3 GLN . 1 1 4 VAL . 1 1 5 LYS . 1 1 6 GLU . 1 1 7 THR . 1 1 8 CYS . 1 1 9 ALA . 1 1 10 ALA . 1 1 11 CYS . 1 1 12 GLN . 1 1 13 LYS . 1 1 14 THR . 1 1 15 VAL . 1 1 16 TYR . 1 1 17 PRO . 1 1 18 MET . 1 1 19 GLU . 1 1 20 ARG . 1 1 21 LEU . 1 1 22 VAL . 1 1 23 ALA . 1 1 24 ASP . 1 1 25 LYS . 1 1 26 LEU . 1 1 27 ILE . 1 1 28 PHE . 1 1 29 HIS . 1 1 30 ASN . 1 1 31 SER . 1 1 32 CYS . 1 1 33 PHE . 1 1 34 CYS . 1 1 35 CYS . 1 1 36 LYS . 1 1 37 HIS . 1 1 38 CYS . 1 1 39 HIS . 1 1 40 THR . 1 1 41 LYS . 1 1 42 LEU . 1 1 43 SER . 1 1 44 LEU . 1 1 45 GLY . 1 1 46 SER . 1 1 47 TYR . 1 1 48 ALA . 1 1 49 ALA . 1 1 50 LEU . 1 1 51 HIS . 1 1 52 GLY . 1 1 53 GLU . 1 1 54 PHE . 1 1 55 TYR . 1 1 56 CYS . 1 1 57 LYS . 1 1 58 PRO . 1 1 59 HIS . 1 1 60 PHE . 1 1 61 GLN . 1 1 62 GLN . 1 1 63 LEU . 1 1 64 PHE . 1 1 65 LYS . 1 1 66 SER . 1 1 67 LYS . 1 1 68 GLY . 1 1 69 ASN . 1 1 70 TYR . 1 1 71 ASP . 1 1 72 GLU . 1 1 stop_ loop_ _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID ARG 1 1 1 1 ALA 2 2 1 1 GLN 3 3 1 1 VAL 4 4 1 1 LYS 5 5 1 1 GLU 6 6 1 1 THR 7 7 1 1 CYS 8 8 1 1 ALA 9 9 1 1 ALA 10 10 1 1 CYS 11 11 1 1 GLN 12 12 1 1 LYS 13 13 1 1 THR 14 14 1 1 VAL 15 15 1 1 TYR 16 16 1 1 PRO 17 17 1 1 MET 18 18 1 1 GLU 19 19 1 1 ARG 20 20 1 1 LEU 21 21 1 1 VAL 22 22 1 1 ALA 23 23 1 1 ASP 24 24 1 1 LYS 25 25 1 1 LEU 26 26 1 1 ILE 27 27 1 1 PHE 28 28 1 1 HIS 29 29 1 1 ASN 30 30 1 1 SER 31 31 1 1 CYS 32 32 1 1 PHE 33 33 1 1 CYS 34 34 1 1 CYS 35 35 1 1 LYS 36 36 1 1 HIS 37 37 1 1 CYS 38 38 1 1 HIS 39 39 1 1 THR 40 40 1 1 LYS 41 41 1 1 LEU 42 42 1 1 SER 43 43 1 1 LEU 44 44 1 1 GLY 45 45 1 1 SER 46 46 1 1 TYR 47 47 1 1 ALA 48 48 1 1 ALA 49 49 1 1 LEU 50 50 1 1 HIS 51 51 1 1 GLY 52 52 1 1 GLU 53 53 1 1 PHE 54 54 1 1 TYR 55 55 1 1 CYS 56 56 1 1 LYS 57 57 1 1 PRO 58 58 1 1 HIS 59 59 1 1 PHE 60 60 1 1 GLN 61 61 1 1 GLN 62 62 1 1 LEU 63 63 1 1 PHE 64 64 1 1 LYS 65 65 1 1 SER 66 66 1 1 LYS 67 67 1 1 GLY 68 68 1 1 ASN 69 69 1 1 TYR 70 70 1 1 ASP 71 71 1 1 GLU 72 72 1 1 stop_ save_ save_ZINC_ION _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 2 _Entity.Name "ZINC ION" _Entity.Type non-polymer loop_ _Entity_comp_index.ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 ZN $ZN 1 2 stop_ save_ save_ZN _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID ZN _Chem_comp.Type non-polymer save_ save_CNS/XPLOR_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 121 1 . . . 1 1 122 1 . . . 1 1 123 1 . . . 1 1 124 1 . . . 1 1 125 1 . . . 1 1 126 1 . . . 1 1 127 1 . . . 1 1 128 1 . . . 1 1 129 1 . . . 1 1 130 1 . . . 1 1 131 1 . . . 1 1 132 1 . . . 1 1 133 1 . . . 1 1 134 1 . . . 1 1 135 1 . . . 1 1 136 1 . . . 1 1 137 1 . . . 1 1 138 1 . . . 1 1 139 1 . . . 1 1 140 1 . . . 1 1 141 1 . . . 1 1 142 1 . . . 1 1 143 1 . . . 1 1 144 1 . . . 1 1 145 1 . . . 1 1 146 1 . . . 1 1 147 1 . . . 1 1 148 1 . . . 1 1 149 1 . . . 1 1 150 1 . . . 1 1 151 1 . . . 1 1 152 1 . . . 1 1 153 1 . . . 1 1 154 1 . . . 1 1 155 1 . . . 1 1 156 1 . . . 1 1 157 1 . . . 1 1 158 1 . . . 1 1 159 1 . . . 1 1 160 1 . . . 1 1 161 1 . . . 1 1 162 1 . . . 1 1 163 1 . . . 1 1 164 1 . . . 1 1 165 1 . . . 1 1 166 1 . . . 1 1 167 1 . . . 1 1 168 1 . . . 1 1 169 1 . . . 1 1 170 1 . . . 1 1 171 1 . . . 1 1 172 1 . . . 1 1 173 1 . . . 1 1 174 1 . . . 1 1 175 1 . . . 1 1 176 1 . . . 1 1 177 1 . . . 1 1 178 1 . . . 1 1 179 1 . . . 1 1 180 1 . . . 1 1 181 1 . . . 1 1 182 1 . . . 1 1 183 1 . . . 1 1 184 1 . . . 1 1 185 1 . . . 1 1 186 1 . . . 1 1 187 1 . . . 1 1 188 1 . . . 1 1 189 1 . . . 1 1 190 1 . . . 1 1 191 1 . . . 1 1 192 1 . . . 1 1 193 1 . . . 1 1 194 1 . . . 1 1 195 1 . . . 1 1 196 1 . . . 1 1 197 1 . . . 1 1 198 1 . . . 1 1 199 1 . . . 1 1 200 1 . . . 1 1 201 1 . . . 1 1 202 1 . . . 1 1 203 1 . . . 1 1 204 1 . . . 1 1 205 1 . . . 1 1 206 1 . . . 1 1 207 1 . . . 1 1 208 1 . . . 1 1 209 1 . . . 1 1 210 1 . . . 1 1 211 1 . . . 1 1 212 1 . . . 1 1 213 1 . . . 1 1 214 1 . . . 1 1 215 1 . . . 1 1 216 1 . . . 1 1 217 1 . . . 1 1 218 1 . . . 1 1 219 1 . . . 1 1 220 1 . . . 1 1 221 1 . . . 1 1 222 1 . . . 1 1 223 1 . . . 1 1 224 1 . . . 1 1 225 1 . . . 1 1 226 1 . . . 1 1 227 1 . . . 1 1 228 1 . . . 1 1 229 1 . . . 1 1 230 1 . . . 1 1 231 1 . . . 1 1 232 1 . . . 1 1 233 1 . . . 1 1 234 1 . . . 1 1 235 1 . . . 1 1 236 1 . . . 1 1 237 1 . . . 1 1 238 1 . . . 1 1 239 1 . . . 1 1 240 1 . . . 1 1 241 1 . . . 1 1 242 1 . . . 1 1 243 1 . . . 1 1 244 1 . . . 1 1 245 1 . . . 1 1 246 1 . . . 1 1 247 1 . . . 1 1 248 1 . . . 1 1 249 1 . . . 1 1 250 1 . . . 1 1 251 1 . . . 1 1 252 1 . . . 1 1 253 1 . . . 1 1 254 1 . . . 1 1 255 1 . . . 1 1 256 1 . . . 1 1 257 1 . . . 1 1 258 1 . . . 1 1 259 1 . . . 1 1 260 1 . . . 1 1 261 1 . . . 1 1 262 1 . . . 1 1 263 1 . . . 1 1 264 1 . . . 1 1 265 1 . . . 1 1 266 1 . . . 1 1 267 1 . . . 1 1 268 1 . . . 1 1 269 1 . . . 1 1 270 1 . . . 1 1 271 1 . . . 1 1 272 1 . . . 1 1 273 1 . . . 1 1 274 1 . . . 1 1 275 1 . . . 1 1 276 1 . . . 1 1 277 1 . . . 1 1 278 1 . . . 1 1 279 1 . . . 1 1 280 1 . . . 1 1 281 1 . . . 1 1 282 1 . . . 1 1 283 1 . . . 1 1 284 1 . . . 1 1 285 1 . . . 1 1 286 1 . . . 1 1 287 1 . . . 1 1 288 1 . . . 1 1 289 1 . . . 1 1 290 1 . . . 1 1 291 1 . . . 1 1 292 1 . . . 1 1 293 1 . . . 1 1 294 1 . . . 1 1 295 1 . . . 1 1 296 1 . . . 1 1 297 1 . . . 1 1 298 1 . . . 1 1 299 1 . . . 1 1 300 1 . . . 1 1 301 1 . . . 1 1 302 1 . . . 1 1 303 1 . . . 1 1 304 1 . . . 1 1 305 1 . . . 1 1 306 1 . . . 1 1 307 1 . . . 1 1 308 1 . . . 1 1 309 1 . . . 1 1 310 1 . . . 1 1 311 1 . . . 1 1 312 1 . . . 1 1 313 1 . . . 1 1 314 1 . . . 1 1 315 1 . . . 1 1 316 1 . . . 1 1 317 1 . . . 1 1 318 1 . . . 1 1 319 1 . . . 1 1 320 1 . . . 1 1 321 1 . . . 1 1 322 1 . . . 1 1 323 1 . . . 1 1 324 1 . . . 1 1 325 1 . . . 1 1 326 1 . . . 1 1 327 1 . . . 1 1 328 1 . . . 1 1 329 1 . . . 1 1 330 1 . . . 1 1 331 1 . . . 1 1 332 1 . . . 1 1 333 1 . . . 1 1 334 1 . . . 1 1 335 1 . . . 1 1 336 1 . . . 1 1 337 1 . . . 1 1 338 1 . . . 1 1 339 1 . . . 1 1 340 1 . . . 1 1 341 1 . . . 1 1 342 1 . . . 1 1 343 1 . . . 1 1 344 1 . . . 1 1 345 1 . . . 1 1 346 1 . . . 1 1 347 1 . . . 1 1 348 1 . . . 1 1 349 1 . . . 1 1 350 1 . . . 1 1 351 1 . . . 1 1 352 1 . . . 1 1 353 1 . . . 1 1 354 1 . . . 1 1 355 1 . . . 1 1 356 1 . . . 1 1 357 1 . . . 1 1 358 1 . . . 1 1 359 1 . . . 1 1 360 1 . . . 1 1 361 1 . . . 1 1 362 1 . . . 1 1 363 1 . . . 1 1 364 1 . . . 1 1 365 1 . . . 1 1 366 1 . . . 1 1 367 1 . . . 1 1 368 1 . . . 1 1 369 1 . . . 1 1 370 1 . . . 1 1 371 1 . . . 1 1 372 1 . . . 1 1 373 1 . . . 1 1 374 1 . . . 1 1 375 1 . . . 1 1 376 1 . . . 1 1 377 1 . . . 1 1 378 1 . . . 1 1 379 1 . . . 1 1 380 1 . . . 1 1 381 1 . . . 1 1 382 1 . . . 1 1 383 1 . . . 1 1 384 1 . . . 1 1 385 1 . . . 1 1 386 1 . . . 1 1 387 1 . . . 1 1 388 1 . . . 1 1 389 1 . . . 1 1 390 1 . . . 1 1 391 1 . . . 1 1 392 1 . . . 1 1 393 1 . . . 1 1 394 1 . . . 1 1 395 1 . . . 1 1 396 1 . . . 1 1 397 1 . . . 1 1 398 1 . . . 1 1 399 1 . . . 1 1 400 1 . . . 1 1 401 1 . . . 1 1 402 1 . . . 1 1 403 1 . . . 1 1 404 1 . . . 1 1 405 1 . . . 1 1 406 1 . . . 1 1 407 1 . . . 1 1 408 1 . . . 1 1 409 1 . . . 1 1 410 1 . . . 1 1 411 1 . . . 1 1 412 1 . . . 1 1 413 1 . . . 1 1 414 1 . . . 1 1 415 1 . . . 1 1 416 1 . . . 1 1 417 1 . . . 1 1 418 1 . . . 1 1 419 1 . . . 1 1 420 1 . . . 1 1 421 1 . . . 1 1 422 1 . . . 1 1 423 1 . . . 1 1 424 1 . . . 1 1 425 1 . . . 1 1 426 1 . . . 1 1 427 1 . . . 1 1 428 1 . . . 1 1 429 1 . . . 1 1 430 1 . . . 1 1 431 1 . . . 1 1 432 1 . . . 1 1 433 1 . . . 1 1 434 1 . . . 1 1 435 1 . . . 1 1 436 1 . . . 1 1 437 1 . . . 1 1 438 1 . . . 1 1 439 1 . . . 1 1 440 1 . . . 1 1 441 1 . . . 1 1 442 1 . . . 1 1 443 1 . . . 1 1 444 1 . . . 1 1 445 1 . . . 1 1 446 1 . . . 1 1 447 1 . . . 1 1 448 1 . . . 1 1 449 1 . . . 1 1 450 1 . . . 1 1 451 1 . . . 1 1 452 1 . . . 1 1 453 1 . . . 1 1 454 1 . . . 1 1 455 1 . . . 1 1 456 1 . . . 1 1 457 1 . . . 1 1 458 1 . . . 1 1 459 1 . . . 1 1 460 1 . . . 1 1 461 1 . . . 1 1 462 1 . . . 1 1 463 1 . . . 1 1 464 1 . . . 1 1 465 1 . . . 1 1 466 1 . . . 1 1 467 1 . . . 1 1 468 1 . . . 1 1 469 1 . . . 1 1 470 1 . . . 1 1 471 1 . . . 1 1 472 1 . . . 1 1 473 1 . . . 1 1 474 1 . . . 1 1 475 1 . . . 1 1 476 1 . . . 1 1 477 1 . . . 1 1 478 1 . . . 1 1 479 1 . . . 1 1 480 1 . . . 1 1 481 1 . . . 1 1 482 1 . . . 1 1 483 1 . . . 1 1 484 1 . . . 1 1 485 1 . . . 1 1 486 1 . . . 1 1 487 1 . . . 1 1 488 1 . . . 1 1 489 1 . . . 1 1 490 1 . . . 1 1 491 1 . . . 1 1 492 1 . . . 1 1 493 1 . . . 1 1 494 1 . . . 1 1 495 1 . . . 1 1 496 1 . . . 1 1 497 1 . . . 1 1 498 1 . . . 1 1 499 1 . . . 1 1 500 1 . . . 1 1 501 1 . . . 1 1 502 1 . . . 1 1 503 1 . . . 1 1 504 1 . . . 1 1 505 1 . . . 1 1 506 1 . . . 1 1 507 1 . . . 1 1 508 1 . . . 1 1 509 1 . . . 1 1 510 1 . . . 1 1 511 1 . . . 1 1 512 1 . . . 1 1 513 1 . . . 1 1 514 1 . . . 1 1 515 1 . . . 1 1 516 1 . . . 1 1 517 1 . . . 1 1 518 1 . . . 1 1 519 1 . . . 1 1 520 1 . . . 1 1 521 1 . . . 1 1 522 1 . . . 1 1 523 1 . . . 1 1 524 1 . . . 1 1 525 1 . . . 1 1 526 1 . . . 1 1 527 1 . . . 1 1 528 1 . . . 1 1 529 1 . . . 1 1 530 1 . . . 1 1 531 1 . . . 1 1 532 1 . . . 1 1 533 1 . . . 1 1 534 1 . . . 1 1 535 1 . . . 1 1 536 1 . . . 1 1 537 1 . . . 1 1 538 1 . . . 1 1 539 1 . . . 1 1 540 1 . . . 1 1 541 1 . . . 1 1 542 1 . . . 1 1 543 1 . . . 1 1 544 1 . . . 1 1 545 1 . . . 1 1 546 1 . . . 1 1 547 1 . . . 1 1 548 1 . . . 1 1 549 1 . . . 1 1 550 1 . . . 1 1 551 1 . . . 1 1 552 1 . . . 1 1 553 1 . . . 1 1 554 1 . . . 1 1 555 1 . . . 1 1 556 1 . . . 1 1 557 1 . . . 1 1 558 1 . . . 1 1 559 1 . . . 1 1 560 1 . . . 1 1 561 1 . . . 1 1 562 1 . . . 1 1 563 1 . . . 1 1 564 1 . . . 1 1 565 1 . . . 1 1 566 1 . . . 1 1 567 1 . . . 1 1 568 1 . . . 1 1 569 1 . . . 1 1 570 1 . . . 1 1 571 1 . . . 1 1 572 1 . . . 1 1 573 1 . . . 1 1 574 1 . . . 1 1 575 1 . . . 1 1 576 1 . . . 1 1 577 1 . . . 1 1 578 1 . . . 1 1 579 1 . . . 1 1 580 1 . . . 1 1 581 1 . . . 1 1 582 1 . . . 1 1 583 1 . . . 1 1 584 1 . . . 1 1 585 1 . . . 1 1 586 1 . . . 1 1 587 1 . . . 1 1 588 1 . . . 1 1 589 1 . . . 1 1 590 1 . . . 1 1 591 1 . . . 1 1 592 1 . . . 1 1 593 1 . . . 1 1 594 1 . . . 1 1 595 1 . . . 1 1 596 1 . . . 1 1 597 1 . . . 1 1 598 1 . . . 1 1 599 1 . . . 1 1 600 1 . . . 1 1 601 1 . . . 1 1 602 1 . . . 1 1 603 1 . . . 1 1 604 1 . . . 1 1 605 1 . . . 1 1 606 1 . . . 1 1 607 1 . . . 1 1 608 1 . . . 1 1 609 1 . . . 1 1 610 1 . . . 1 1 611 1 . . . 1 1 612 1 . . . 1 1 613 1 . . . 1 1 614 1 . . . 1 1 615 1 . . . 1 1 616 1 . . . 1 1 617 1 . . . 1 1 618 1 . . . 1 1 619 1 . . . 1 1 620 1 . . . 1 1 621 1 . . . 1 1 622 1 . . . 1 1 623 1 . . . 1 1 624 1 . . . 1 1 625 1 . . . 1 1 626 1 . . . 1 1 627 1 . . . 1 1 628 1 . . . 1 1 629 1 . . . 1 1 630 1 . . . 1 1 631 1 . . . 1 1 632 1 . . . 1 1 633 1 . . . 1 1 634 1 . . . 1 1 635 1 . . . 1 1 636 1 . . . 1 1 637 1 . . . 1 1 638 1 . . . 1 1 639 1 . . . 1 1 640 1 . . . 1 1 641 1 . . . 1 1 642 1 . . . 1 1 643 1 . . . 1 1 644 1 . . . 1 1 645 1 . . . 1 1 646 1 . . . 1 1 647 1 . . . 1 1 648 1 . . . 1 1 649 1 . . . 1 1 650 1 . . . 1 1 651 1 . . . 1 1 652 1 . . . 1 1 653 1 . . . 1 1 654 1 . . . 1 1 655 1 . . . 1 1 656 1 . . . 1 1 657 1 . . . 1 1 658 1 . . . 1 1 659 1 . . . 1 1 660 1 . . . 1 1 661 1 . . . 1 1 662 1 . . . 1 1 663 1 . . . 1 1 664 1 . . . 1 1 665 1 . . . 1 1 666 1 . . . 1 1 667 1 . . . 1 1 668 1 . . . 1 1 669 1 . . . 1 1 670 1 . . . 1 1 671 1 . . . 1 1 672 1 . . . 1 1 673 1 . . . 1 1 674 1 . . . 1 1 675 1 . . . 1 1 676 1 . . . 1 1 677 1 . . . 1 1 678 1 . . . 1 1 679 1 . . . 1 1 680 1 . . . 1 1 681 1 . . . 1 1 682 1 . . . 1 1 683 1 . . . 1 1 684 1 . . . 1 1 685 1 . . . 1 1 686 1 . . . 1 1 687 1 . . . 1 1 688 1 . . . 1 1 689 1 . . . 1 1 690 1 . . . 1 1 691 1 . . . 1 1 692 1 . . . 1 1 693 1 . . . 1 1 694 1 . . . 1 1 695 1 . . . 1 1 696 1 . . . 1 1 697 1 . . . 1 1 698 1 . . . 1 1 699 1 . . . 1 1 700 1 . . . 1 1 701 1 . . . 1 1 702 1 . . . 1 1 703 1 . . . 1 1 704 1 . . . 1 1 705 1 . . . 1 1 706 1 . . . 1 1 707 1 . . . 1 1 708 1 . . . 1 1 709 1 . . . 1 1 710 1 . . . 1 1 711 1 . . . 1 1 712 1 . . . 1 1 713 1 . . . 1 1 714 1 . . . 1 1 715 1 . . . 1 1 716 1 . . . 1 1 717 1 . . . 1 1 718 1 . . . 1 1 719 1 . . . 1 1 720 1 . . . 1 1 721 1 . . . 1 1 722 1 . . . 1 1 723 1 . . . 1 1 724 1 . . . 1 1 725 1 . . . 1 1 726 1 . . . 1 1 727 1 . . . 1 1 728 1 . . . 1 1 729 1 . . . 1 1 730 1 . . . 1 1 731 1 . . . 1 1 732 1 . . . 1 1 733 1 . . . 1 1 734 1 . . . 1 1 735 1 . . . 1 1 736 1 . . . 1 1 737 1 . . . 1 1 738 1 . . . 1 1 739 1 . . . 1 1 740 1 . . . 1 1 741 1 . . . 1 1 742 1 . . . 1 1 743 1 . . . 1 1 744 1 . . . 1 1 745 1 . . . 1 1 746 1 . . . 1 1 747 1 . . . 1 1 748 1 . . . 1 1 749 1 . . . 1 1 750 1 . . . 1 1 751 1 . . . 1 1 752 1 . . . 1 1 753 1 . . . 1 1 754 1 . . . 1 1 755 1 . . . 1 1 756 1 . . . 1 1 757 1 . . . 1 1 758 1 . . . 1 1 759 1 . . . 1 1 760 1 . . . 1 1 761 1 . . . 1 1 762 1 . . . 1 1 763 1 . . . 1 1 764 1 . . . 1 1 765 1 . . . 1 1 766 1 . . . 1 1 767 1 . . . 1 1 768 1 . . . 1 1 769 1 . . . 1 1 770 1 . . . 1 1 771 1 . . . 1 1 772 1 . . . 1 1 773 1 . . . 1 1 774 1 . . . 1 1 775 1 . . . 1 1 776 1 . . . 1 1 777 1 . . . 1 1 778 1 . . . 1 1 779 1 . . . 1 1 780 1 . . . 1 1 781 1 . . . 1 1 782 1 . . . 1 1 783 1 . . . 1 1 784 1 . . . 1 1 785 1 . . . 1 1 786 1 . . . 1 1 787 1 . . . 1 1 788 1 . . . 1 1 789 1 . . . 1 1 790 1 . . . 1 1 791 1 . . . 1 1 792 1 . . . 1 1 793 1 . . . 1 1 794 1 . . . 1 1 795 1 . . . 1 1 796 1 . . . 1 1 797 1 . . . 1 1 798 1 . . . 1 1 799 1 . . . 1 1 800 1 . . . 1 1 801 1 . . . 1 1 802 1 . . . 1 1 803 1 . . . 1 1 804 1 . . . 1 1 805 1 . . . 1 1 806 1 . . . 1 1 807 1 . . . 1 1 808 1 . . . 1 1 809 1 . . . 1 1 810 1 . . . 1 1 811 1 . . . 1 1 812 1 . . . 1 1 813 1 . . . 1 1 814 1 . . . 1 1 815 1 . . . 1 1 816 1 . . . 1 1 817 1 . . . 1 1 818 1 . . . 1 1 819 1 . . . 1 1 820 1 . . . 1 1 821 1 . . . 1 1 822 1 . . . 1 1 823 1 . . . 1 1 824 1 . . . 1 1 825 1 . . . 1 1 826 1 . . . 1 1 827 1 . . . 1 1 828 1 . . . 1 1 829 1 . . . 1 1 830 1 . . . 1 1 831 1 . . . 1 1 832 1 . . . 1 1 833 1 . . . 1 1 834 1 . . . 1 1 835 1 . . . 1 1 836 1 . . . 1 1 837 1 . . . 1 1 838 1 . . . 1 1 839 1 . . . 1 1 840 1 . . . 1 1 841 1 . . . 1 1 842 1 . . . 1 1 843 1 . . . 1 1 844 1 . . . 1 1 845 1 . . . 1 1 846 1 . . . 1 1 847 1 . . . 1 1 848 1 . . . 1 1 849 1 . . . 1 1 850 1 . . . 1 1 851 1 . . . 1 1 852 1 . . . 1 1 853 1 . . . 1 1 854 1 . . . 1 1 855 1 . . . 1 1 856 1 . . . 1 1 857 1 . . . 1 1 858 1 . . . 1 1 859 1 . . . 1 1 860 1 . . . 1 1 861 1 . . . 1 1 862 1 . . . 1 1 863 1 . . . 1 1 864 1 . . . 1 1 865 1 . . . 1 1 866 1 . . . 1 1 867 1 . . . 1 1 868 1 . . . 1 1 869 1 . . . 1 1 870 1 . . . 1 1 871 1 . . . 1 1 872 1 . . . 1 1 873 1 . . . 1 1 874 1 . . . 1 1 875 1 . . . 1 1 876 1 . . . 1 1 877 1 . . . 1 1 878 1 . . . 1 1 879 1 . . . 1 1 880 1 . . . 1 1 881 1 . . . 1 1 882 1 . . . 1 1 883 1 . . . 1 1 884 1 . . . 1 1 885 1 . . . 1 1 886 1 . . . 1 1 887 1 . . . 1 1 888 1 . . . 1 1 889 1 . . . 1 1 890 1 . . . 1 1 891 1 . . . 1 1 892 1 . . . 1 1 893 1 . . . 1 1 894 1 . . . 1 1 895 1 . . . 1 1 896 1 . . . 1 1 897 1 . . . 1 1 898 1 . . . 1 1 899 1 . . . 1 1 900 1 . . . 1 1 901 1 . . . 1 1 902 1 . . . 1 1 903 1 . . . 1 1 904 1 . . . 1 1 905 1 . . . 1 1 906 1 . . . 1 1 907 1 . . . 1 1 908 1 . . . 1 1 909 1 . . . 1 1 910 1 . . . 1 1 911 1 . . . 1 1 912 1 . . . 1 1 913 1 . . . 1 1 914 1 . . . 1 1 915 1 . . . 1 1 916 1 . . . 1 1 917 1 . . . 1 1 918 1 . . . 1 1 919 1 . . . 1 1 920 1 . . . 1 1 921 1 . . . 1 1 922 1 . . . 1 1 923 1 . . . 1 1 924 1 . . . 1 1 925 1 . . . 1 1 926 1 . . . 1 1 927 1 . . . 1 1 928 1 . . . 1 1 929 1 . . . 1 1 930 1 . . . 1 1 931 1 . . . 1 1 932 1 . . . 1 1 933 1 . . . 1 1 934 1 . . . 1 1 935 1 . . . 1 1 936 1 . . . 1 1 937 1 . . . 1 1 938 1 . . . 1 1 939 1 . . . 1 1 940 1 . . . 1 1 941 1 . . . 1 1 942 1 . . . 1 1 943 1 . . . 1 1 944 1 . . . 1 1 945 1 . . . 1 1 946 1 . . . 1 1 947 1 . . . 1 1 948 1 . . . 1 1 949 1 . . . 1 1 950 1 . . . 1 1 951 1 . . . 1 1 952 1 . . . 1 1 953 1 . . . 1 1 954 1 . . . 1 1 955 1 . . . 1 1 956 1 . . . 1 1 957 1 . . . 1 1 958 1 . . . 1 1 959 1 . . . 1 1 960 1 . . . 1 1 961 1 . . . 1 1 962 1 . . . 1 1 963 1 . . . 1 1 964 1 . . . 1 1 965 1 . . . 1 1 966 1 . . . 1 1 967 1 . . . 1 1 968 1 . . . 1 1 969 1 . . . 1 1 970 1 . . . 1 1 971 1 . . . 1 1 972 1 . . . 1 1 973 1 . . . 1 1 974 1 . . . 1 1 975 1 . . . 1 1 976 1 . . . 1 1 977 1 . . . 1 1 978 1 . . . 1 1 979 1 . . . 1 1 980 1 . . . 1 1 981 1 . . . 1 1 982 1 . . . 1 1 983 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 6 GLU HA A 41 . HA 1 1 1 1 2 1 1 6 GLU HG3 A 41 . HG1 1 1 2 1 1 1 1 6 GLU HG3 A 41 . HG1 1 1 2 1 2 1 1 20 ARG HB2 A 55 . HB2 1 1 3 1 1 1 1 7 THR HA A 42 . HA 1 1 3 1 2 1 1 7 THR HB A 42 . HB 1 1 4 1 1 1 1 7 THR HA A 42 . HA 1 1 4 1 2 1 1 8 CYS H A 43 . HN 1 1 5 1 1 1 1 7 THR HB A 42 . HB 1 1 5 1 2 1 1 8 CYS H A 43 . HN 1 1 6 1 1 1 1 8 CYS HA A 43 . HA 1 1 6 1 2 1 1 9 ALA H A 44 . HN 1 1 7 1 1 1 1 8 CYS HA A 43 . HA 1 1 7 1 2 1 1 8 CYS HB3 A 43 . HB2 1 1 8 1 1 1 1 8 CYS H A 43 . HN 1 1 8 1 2 1 1 8 CYS HB3 A 43 . HB2 1 1 9 1 1 1 1 26 LEU HB3 A 61 . HB1 1 1 9 1 2 1 1 27 ILE H A 62 . HN 1 1 10 1 1 1 1 10 ALA H A 45 . HN 1 1 10 1 2 1 1 10 ALA HA A 45 . HA 1 1 11 1 1 1 1 10 ALA H A 45 . HN 1 1 11 1 2 1 1 10 ALA MB A 45 . HB1 1 1 12 1 1 1 1 10 ALA MB A 45 . HB1 1 1 12 1 2 1 1 11 CYS H A 46 . HN 1 1 13 1 1 1 1 11 CYS HA A 46 . HA 1 1 13 1 2 1 1 11 CYS HB2 A 46 . HB2 1 1 14 1 1 1 1 11 CYS HA A 46 . HA 1 1 14 1 2 1 1 11 CYS HB3 A 46 . HB1 1 1 15 1 1 1 1 11 CYS H A 46 . HN 1 1 15 1 2 1 1 11 CYS HB3 A 46 . HB1 1 1 16 1 1 1 1 7 THR MG A 42 . HG21 1 1 16 1 2 1 1 12 GLN HA A 47 . HA 1 1 17 1 1 1 1 13 LYS HA A 48 . HA 1 1 17 1 2 1 1 13 LYS HD2 A 48 . HD2 1 1 18 1 1 1 1 13 LYS HD2 A 48 . HD2 1 1 18 1 2 1 1 13 LYS HE3 A 48 . HE2 1 1 19 1 1 1 1 13 LYS HA A 48 . HA 1 1 19 1 2 1 1 13 LYS HG3 A 48 . HG1 1 1 20 1 1 1 1 13 LYS HA A 48 . HA 1 1 20 1 2 1 1 13 LYS HG2 A 48 . HG2 1 1 21 1 1 1 1 13 LYS HB2 A 48 . HB2 1 1 21 1 2 1 1 13 LYS HG3 A 48 . HG1 1 1 22 1 1 1 1 13 LYS HB3 A 48 . HB1 1 1 22 1 2 1 1 13 LYS HG3 A 48 . HG1 1 1 23 1 1 1 1 13 LYS HB3 A 48 . HB1 1 1 23 1 2 1 1 13 LYS HG2 A 48 . HG2 1 1 24 1 1 1 1 13 LYS HB2 A 48 . HB2 1 1 24 1 2 1 1 13 LYS HG2 A 48 . HG2 1 1 25 1 1 1 1 13 LYS QE A 48 . HE1 1 1 25 1 2 1 1 13 LYS HG2 A 48 . HG2 1 1 26 1 1 1 1 14 THR HA A 49 . HA 1 1 26 1 2 1 1 15 VAL MG2 A 50 . HG21 1 1 27 1 1 1 1 14 THR MG A 49 . HG21 1 1 27 1 2 1 1 15 VAL H A 50 . HN 1 1 28 1 1 1 1 14 THR H A 49 . HN 1 1 28 1 2 1 1 14 THR MG A 49 . HG21 1 1 29 1 1 1 1 15 VAL H A 50 . HN 1 1 29 1 2 1 1 15 VAL HA A 50 . HA 1 1 30 1 1 1 1 15 VAL HA A 50 . HA 1 1 30 1 2 1 1 16 TYR H A 51 . HN 1 1 31 1 1 1 1 15 VAL HB A 50 . HB 1 1 31 1 2 1 1 20 ARG HB2 A 55 . HB2 1 1 32 1 1 1 1 15 VAL H A 50 . HN 1 1 32 1 2 1 1 15 VAL HB A 50 . HB 1 1 33 1 1 1 1 15 VAL HB A 50 . HB 1 1 33 1 2 1 1 15 VAL MG1 A 50 . HG11 1 1 34 1 1 1 1 15 VAL MG1 A 50 . HG11 1 1 34 1 2 1 1 19 GLU HB3 A 54 . HB1 1 1 35 1 1 1 1 15 VAL MG1 A 50 . HG11 1 1 35 1 2 1 1 29 HIS HA A 64 . HA 1 1 36 1 1 1 1 15 VAL H A 50 . HN 1 1 36 1 2 1 1 15 VAL MG1 A 50 . HG11 1 1 37 1 1 1 1 15 VAL MG1 A 50 . HG11 1 1 37 1 2 1 1 16 TYR H A 51 . HN 1 1 38 1 1 1 1 15 VAL HB A 50 . HB 1 1 38 1 2 1 1 15 VAL MG2 A 50 . HG21 1 1 39 1 1 1 1 15 VAL MG1 A 50 . HG11 1 1 39 1 2 1 1 15 VAL MG2 A 50 . HG21 1 1 40 1 1 1 1 6 GLU HB2 A 41 . HB1 1 1 40 1 2 1 1 15 VAL MG2 A 50 . HG21 1 1 41 1 1 1 1 8 CYS HB2 A 43 . HB1 1 1 41 1 2 1 1 15 VAL MG2 A 50 . HG21 1 1 42 1 1 1 1 8 CYS HB3 A 43 . HB2 1 1 42 1 2 1 1 15 VAL MG2 A 50 . HG21 1 1 43 1 1 1 1 8 CYS HA A 43 . HA 1 1 43 1 2 1 1 15 VAL MG2 A 50 . HG21 1 1 44 1 1 1 1 8 CYS H A 43 . HN 1 1 44 1 2 1 1 15 VAL MG2 A 50 . HG21 1 1 45 1 1 1 1 15 VAL H A 50 . HN 1 1 45 1 2 1 1 15 VAL MG2 A 50 . HG21 1 1 46 1 1 1 1 15 VAL MG2 A 50 . HG21 1 1 46 1 2 1 1 28 PHE H A 63 . HN 1 1 47 1 1 1 1 16 TYR HB3 A 51 . HB1 1 1 47 1 2 1 1 17 PRO QD A 52 . HD1 1 1 48 1 1 1 1 16 TYR HA A 51 . HA 1 1 48 1 2 1 1 16 TYR HB2 A 51 . HB2 1 1 49 1 1 1 1 16 TYR HA A 51 . HA 1 1 49 1 2 1 1 16 TYR HB3 A 51 . HB1 1 1 50 1 1 1 1 16 TYR HB3 A 51 . HB1 1 1 50 1 2 1 1 16 TYR QD A 51 . HD1 1 1 51 1 1 1 1 16 TYR HB2 A 51 . HB2 1 1 51 1 2 1 1 16 TYR QD A 51 . HD1 1 1 52 1 1 1 1 16 TYR H A 51 . HN 1 1 52 1 2 1 1 16 TYR HB2 A 51 . HB2 1 1 53 1 1 1 1 17 PRO HA A 52 . HA 1 1 53 1 2 1 1 20 ARG HD2 A 55 . HD1 1 1 54 1 1 1 1 17 PRO HA A 52 . HA 1 1 54 1 2 1 1 20 ARG H A 55 . HN 1 1 55 1 1 1 1 17 PRO HA A 52 . HA 1 1 55 1 2 1 1 17 PRO HB2 A 52 . HB1 1 1 56 1 1 1 1 36 LYS H A 71 . HN 1 1 56 1 2 1 1 36 LYS HB3 A 71 . HB2 1 1 57 1 1 1 1 17 PRO HD3 A 52 . HD2 1 1 57 1 2 1 1 17 PRO HG2 A 52 . HG2 1 1 58 1 1 1 1 17 PRO HD3 A 52 . HD2 1 1 58 1 2 1 1 17 PRO HG3 A 52 . HG1 1 1 59 1 1 1 1 61 GLN H A 96 . HN 1 1 59 1 2 1 1 61 GLN HB2 A 96 . HB1 1 1 60 1 1 1 1 18 MET HA A 53 . HA 1 1 60 1 2 1 1 18 MET HG3 A 53 . HG2 1 1 61 1 1 1 1 18 MET H A 53 . HN 1 1 61 1 2 1 1 18 MET HA A 53 . HA 1 1 62 1 1 1 1 18 MET HA A 53 . HA 1 1 62 1 2 1 1 19 GLU H A 54 . HN 1 1 63 1 1 1 1 19 GLU HA A 54 . HA 1 1 63 1 2 1 1 19 GLU HB3 A 54 . HB1 1 1 64 1 1 1 1 19 GLU HA A 54 . HA 1 1 64 1 2 1 1 20 ARG H A 55 . HN 1 1 65 1 1 1 1 20 ARG HA A 55 . HA 1 1 65 1 2 1 1 20 ARG HB2 A 55 . HB2 1 1 66 1 1 1 1 20 ARG HA A 55 . HA 1 1 66 1 2 1 1 20 ARG HG3 A 55 . HG1 1 1 67 1 1 1 1 20 ARG HA A 55 . HA 1 1 67 1 2 1 1 20 ARG HG2 A 55 . HG2 1 1 68 1 1 1 1 20 ARG HA A 55 . HA 1 1 68 1 2 1 1 20 ARG HB3 A 55 . HB1 1 1 69 1 1 1 1 20 ARG H A 55 . HN 1 1 69 1 2 1 1 20 ARG HA A 55 . HA 1 1 70 1 1 1 1 20 ARG HA A 55 . HA 1 1 70 1 2 1 1 21 LEU H A 56 . HN 1 1 71 1 1 1 1 15 VAL MG1 A 50 . HG11 1 1 71 1 2 1 1 20 ARG HB3 A 55 . HB1 1 1 72 1 1 1 1 15 VAL HB A 50 . HB 1 1 72 1 2 1 1 20 ARG HB3 A 55 . HB1 1 1 73 1 1 1 1 20 ARG HD2 A 55 . HD1 1 1 73 1 2 1 1 20 ARG HG2 A 55 . HG2 1 1 74 1 1 1 1 20 ARG HD2 A 55 . HD1 1 1 74 1 2 1 1 20 ARG HG3 A 55 . HG1 1 1 75 1 1 1 1 20 ARG HD3 A 55 . HD2 1 1 75 1 2 1 1 20 ARG HG3 A 55 . HG1 1 1 76 1 1 1 1 20 ARG HD3 A 55 . HD2 1 1 76 1 2 1 1 20 ARG HG2 A 55 . HG2 1 1 77 1 1 1 1 20 ARG HB3 A 55 . HB1 1 1 77 1 2 1 1 20 ARG HD3 A 55 . HD2 1 1 78 1 1 1 1 20 ARG HB2 A 55 . HB2 1 1 78 1 2 1 1 20 ARG HD3 A 55 . HD2 1 1 79 1 1 1 1 20 ARG HB2 A 55 . HB2 1 1 79 1 2 1 1 20 ARG HD2 A 55 . HD1 1 1 80 1 1 1 1 21 LEU HB2 A 56 . HB2 1 1 80 1 2 1 1 21 LEU MD2 A 56 . HD21 1 1 81 1 1 1 1 21 LEU MD2 A 56 . HD21 1 1 81 1 2 1 1 21 LEU HG A 56 . HG 1 1 82 1 1 1 1 63 LEU H A 98 . HN 1 1 82 1 2 1 1 63 LEU HG A 98 . HG 1 1 83 1 1 1 1 21 LEU HA A 56 . HA 1 1 83 1 2 1 1 22 VAL H A 57 . HN 1 1 84 1 1 1 1 22 VAL H A 57 . HN 1 1 84 1 2 1 1 22 VAL MG1 A 57 . HG11 1 1 85 1 1 1 1 22 VAL MG2 A 57 . HG21 1 1 85 1 2 1 1 25 LYS HA A 60 . HA 1 1 86 1 1 1 1 22 VAL HB A 57 . HB 1 1 86 1 2 1 1 22 VAL MG1 A 57 . HG11 1 1 87 1 1 1 1 22 VAL HB A 57 . HB 1 1 87 1 2 1 1 22 VAL MG2 A 57 . HG21 1 1 88 1 1 1 1 23 ALA HA A 58 . HA 1 1 88 1 2 1 1 44 LEU MD2 A 79 . HD21 1 1 89 1 1 1 1 15 VAL MG1 A 50 . HG11 1 1 89 1 2 1 1 28 PHE HA A 63 . HA 1 1 90 1 1 1 1 24 ASP H A 59 . HN 1 1 90 1 2 1 1 24 ASP HA A 59 . HA 1 1 91 1 1 1 1 25 LYS H A 60 . HN 1 1 91 1 2 1 1 25 LYS HA A 60 . HA 1 1 92 1 1 1 1 61 GLN HA A 96 . HA 1 1 92 1 2 1 1 65 LYS H A 100 . HN 1 1 93 1 1 1 1 61 GLN HA A 96 . HA 1 1 93 1 2 1 1 61 GLN QG A 96 . HG1 1 1 94 1 1 1 1 25 LYS HB3 A 60 . HB1 1 1 94 1 2 1 1 25 LYS HG3 A 60 . HG1 1 1 95 1 1 1 1 25 LYS HB2 A 60 . HB2 1 1 95 1 2 1 1 25 LYS HG3 A 60 . HG1 1 1 96 1 1 1 1 25 LYS H A 60 . HN 1 1 96 1 2 1 1 25 LYS HB2 A 60 . HB2 1 1 97 1 1 1 1 26 LEU HA A 61 . HA 1 1 97 1 2 1 1 26 LEU HG A 61 . HG 1 1 98 1 1 1 1 26 LEU HA A 61 . HA 1 1 98 1 2 1 1 26 LEU HB3 A 61 . HB1 1 1 99 1 1 1 1 26 LEU HA A 61 . HA 1 1 99 1 2 1 1 27 ILE H A 62 . HN 1 1 100 1 1 1 1 26 LEU H A 61 . HN 1 1 100 1 2 1 1 26 LEU HA A 61 . HA 1 1 101 1 1 1 1 26 LEU HB2 A 61 . HB2 1 1 101 1 2 1 1 26 LEU HG A 61 . HG 1 1 102 1 1 1 1 26 LEU H A 61 . HN 1 1 102 1 2 1 1 26 LEU HB3 A 61 . HB1 1 1 103 1 1 1 1 26 LEU H A 61 . HN 1 1 103 1 2 1 1 26 LEU MD2 A 61 . HD21 1 1 104 1 1 1 1 26 LEU HA A 61 . HA 1 1 104 1 2 1 1 26 LEU MD2 A 61 . HD21 1 1 105 1 1 1 1 26 LEU MD2 A 61 . HD21 1 1 105 1 2 1 1 26 LEU HG A 61 . HG 1 1 106 1 1 1 1 27 ILE HA A 62 . HA 1 1 106 1 2 1 1 27 ILE HG13 A 62 . HG12 1 1 107 1 1 1 1 27 ILE H A 62 . HN 1 1 107 1 2 1 1 27 ILE HA A 62 . HA 1 1 108 1 1 1 1 27 ILE HA A 62 . HA 1 1 108 1 2 1 1 28 PHE H A 63 . HN 1 1 109 1 1 1 1 27 ILE H A 62 . HN 1 1 109 1 2 1 1 27 ILE HB A 62 . HB 1 1 110 1 1 1 1 15 VAL MG2 A 50 . HG21 1 1 110 1 2 1 1 27 ILE MG A 62 . HG21 1 1 111 1 1 1 1 20 ARG HG3 A 55 . HG1 1 1 111 1 2 1 1 27 ILE MG A 62 . HG21 1 1 112 1 1 1 1 27 ILE HB A 62 . HB 1 1 112 1 2 1 1 27 ILE MG A 62 . HG21 1 1 113 1 1 1 1 27 ILE HA A 62 . HA 1 1 113 1 2 1 1 27 ILE MG A 62 . HG21 1 1 114 1 1 1 1 27 ILE H A 62 . HN 1 1 114 1 2 1 1 27 ILE MG A 62 . HG21 1 1 115 1 1 1 1 27 ILE MG A 62 . HG21 1 1 115 1 2 1 1 28 PHE H A 63 . HN 1 1 116 1 1 1 1 27 ILE HB A 62 . HB 1 1 116 1 2 1 1 27 ILE MD A 62 . HD11 1 1 117 1 1 1 1 28 PHE HA A 63 . HA 1 1 117 1 2 1 1 28 PHE HB2 A 63 . HB2 1 1 118 1 1 1 1 28 PHE HA A 63 . HA 1 1 118 1 2 1 1 28 PHE QD A 63 . HD1 1 1 119 1 1 1 1 28 PHE H A 63 . HN 1 1 119 1 2 1 1 28 PHE HA A 63 . HA 1 1 120 1 1 1 1 28 PHE H A 63 . HN 1 1 120 1 2 1 1 28 PHE HB3 A 63 . HB1 1 1 121 1 1 1 1 30 ASN HA A 65 . HA 1 1 121 1 2 1 1 30 ASN HB3 A 65 . HB2 1 1 122 1 1 1 1 30 ASN H A 65 . HN 1 1 122 1 2 1 1 30 ASN HA A 65 . HA 1 1 123 1 1 1 1 30 ASN H A 65 . HN 1 1 123 1 2 1 1 30 ASN HB2 A 65 . HB1 1 1 124 1 1 1 1 31 SER HA A 66 . HA 1 1 124 1 2 1 1 32 CYS H A 67 . HN 1 1 125 1 1 1 1 32 CYS HA A 67 . HA 1 1 125 1 2 1 1 32 CYS HB2 A 67 . HB2 1 1 126 1 1 1 1 32 CYS H A 67 . HN 1 1 126 1 2 1 1 32 CYS HB3 A 67 . HB1 1 1 127 1 1 1 1 33 PHE HA A 68 . HA 1 1 127 1 2 1 1 34 CYS H A 69 . HN 1 1 128 1 1 1 1 33 PHE HB3 A 68 . HB1 1 1 128 1 2 1 1 33 PHE HD1 A 68 . HD1 1 1 129 1 1 1 1 34 CYS HA A 69 . HA 1 1 129 1 2 1 1 34 CYS HB2 A 69 . HB1 1 1 130 1 1 1 1 34 CYS HA A 69 . HA 1 1 130 1 2 1 1 34 CYS HB3 A 69 . HB2 1 1 131 1 1 1 1 34 CYS H A 69 . HN 1 1 131 1 2 1 1 34 CYS HA A 69 . HA 1 1 132 1 1 1 1 34 CYS HA A 69 . HA 1 1 132 1 2 1 1 42 LEU H A 77 . HN 1 1 133 1 1 1 1 34 CYS HA A 69 . HA 1 1 133 1 2 1 1 35 CYS H A 70 . HN 1 1 134 1 1 1 1 34 CYS HB3 A 69 . HB2 1 1 134 1 2 1 1 39 HIS HA A 74 . HA 1 1 135 1 1 1 1 34 CYS H A 69 . HN 1 1 135 1 2 1 1 34 CYS HB2 A 69 . HB1 1 1 136 1 1 1 1 35 CYS HA A 70 . HA 1 1 136 1 2 1 1 35 CYS HB2 A 70 . HB2 1 1 137 1 1 1 1 35 CYS HA A 70 . HA 1 1 137 1 2 1 1 42 LEU QD A 77 . HD21 1 1 138 1 1 1 1 35 CYS HA A 70 . HA 1 1 138 1 2 1 1 36 LYS H A 71 . HN 1 1 139 1 1 1 1 35 CYS HB3 A 70 . HB1 1 1 139 1 2 1 1 40 THR H A 75 . HN 1 1 140 1 1 1 1 35 CYS HB2 A 70 . HB2 1 1 140 1 2 1 1 36 LYS H A 71 . HN 1 1 141 1 1 1 1 36 LYS HA A 71 . HA 1 1 141 1 2 1 1 36 LYS HG3 A 71 . HG1 1 1 142 1 1 1 1 36 LYS HA A 71 . HA 1 1 142 1 2 1 1 36 LYS HB3 A 71 . HB2 1 1 143 1 1 1 1 36 LYS HA A 71 . HA 1 1 143 1 2 1 1 36 LYS HE2 A 71 . HE2 1 1 144 1 1 1 1 36 LYS H A 71 . HN 1 1 144 1 2 1 1 36 LYS HA A 71 . HA 1 1 145 1 1 1 1 36 LYS HA A 71 . HA 1 1 145 1 2 1 1 36 LYS HB2 A 71 . HB1 1 1 146 1 1 1 1 37 HIS HA A 72 . HA 1 1 146 1 2 1 1 37 HIS HB2 A 72 . HB2 1 1 147 1 1 1 1 37 HIS HA A 72 . HA 1 1 147 1 2 1 1 38 CYS H A 73 . HN 1 1 148 1 1 1 1 37 HIS H A 72 . HN 1 1 148 1 2 1 1 37 HIS HA A 72 . HA 1 1 149 1 1 1 1 37 HIS QB A 72 . HB1 1 1 149 1 2 1 1 55 TYR QE A 90 . HE1 1 1 150 1 1 1 1 37 HIS H A 72 . HN 1 1 150 1 2 1 1 37 HIS QB A 72 . HB1 1 1 151 1 1 1 1 38 CYS HA A 73 . HA 1 1 151 1 2 1 1 38 CYS HB3 A 73 . HB1 1 1 152 1 1 1 1 38 CYS HA A 73 . HA 1 1 152 1 2 1 1 38 CYS HB2 A 73 . HB2 1 1 153 1 1 1 1 38 CYS H A 73 . HN 1 1 153 1 2 1 1 38 CYS HA A 73 . HA 1 1 154 1 1 1 1 38 CYS H A 73 . HN 1 1 154 1 2 1 1 38 CYS HB3 A 73 . HB1 1 1 155 1 1 1 1 39 HIS HA A 74 . HA 1 1 155 1 2 1 1 39 HIS HB2 A 74 . HB2 1 1 156 1 1 1 1 39 HIS HA A 74 . HA 1 1 156 1 2 1 1 40 THR H A 75 . HN 1 1 157 1 1 1 1 39 HIS QB A 74 . HB1 1 1 157 1 2 1 1 40 THR H A 75 . HN 1 1 158 1 1 1 1 40 THR H A 75 . HN 1 1 158 1 2 1 1 40 THR HB A 75 . HB 1 1 159 1 1 1 1 41 LYS HA A 76 . HA 1 1 159 1 2 1 1 41 LYS HB2 A 76 . HB2 1 1 160 1 1 1 1 21 LEU HB3 A 56 . HB1 1 1 160 1 2 1 1 30 ASN HA A 65 . HA 1 1 161 1 1 1 1 21 LEU MD1 A 56 . HD11 1 1 161 1 2 1 1 30 ASN HA A 65 . HA 1 1 162 1 1 1 1 41 LYS HA A 76 . HA 1 1 162 1 2 1 1 41 LYS HD2 A 76 . HD2 1 1 163 1 1 1 1 41 LYS HA A 76 . HA 1 1 163 1 2 1 1 42 LEU H A 77 . HN 1 1 164 1 1 1 1 42 LEU HA A 77 . HA 1 1 164 1 2 1 1 42 LEU HB2 A 77 . HB2 1 1 165 1 1 1 1 42 LEU HA A 77 . HA 1 1 165 1 2 1 1 42 LEU HB3 A 77 . HB1 1 1 166 1 1 1 1 42 LEU HB2 A 77 . HB2 1 1 166 1 2 1 1 42 LEU QD A 77 . HD11 1 1 167 1 1 1 1 42 LEU QD A 77 . HD11 1 1 167 1 2 1 1 54 PHE HB3 A 89 . HB1 1 1 168 1 1 1 1 42 LEU QD A 77 . HD11 1 1 168 1 2 1 1 56 CYS HA A 91 . HA 1 1 169 1 1 1 1 42 LEU MD1 A 77 . HD11 1 1 169 1 2 1 1 42 LEU MD2 A 77 . HD21 1 1 170 1 1 1 1 42 LEU QD A 77 . HD21 1 1 170 1 2 1 1 56 CYS QB A 91 . HB1 1 1 171 1 1 1 1 35 CYS H A 70 . HN 1 1 171 1 2 1 1 42 LEU QD A 77 . HD21 1 1 172 1 1 1 1 42 LEU QD A 77 . HD21 1 1 172 1 2 1 1 57 LYS H A 92 . HN 1 1 173 1 1 1 1 42 LEU QD A 77 . HD21 1 1 173 1 2 1 1 56 CYS H A 91 . HN 1 1 174 1 1 1 1 44 LEU HA A 79 . HA 1 1 174 1 2 1 1 44 LEU HB2 A 79 . HB2 1 1 175 1 1 1 1 44 LEU HA A 79 . HA 1 1 175 1 2 1 1 44 LEU HB3 A 79 . HB1 1 1 176 1 1 1 1 44 LEU HB2 A 79 . HB2 1 1 176 1 2 1 1 44 LEU MD1 A 79 . HD11 1 1 177 1 1 1 1 44 LEU MD2 A 79 . HD21 1 1 177 1 2 1 1 44 LEU HG A 79 . HG 1 1 178 1 1 1 1 44 LEU HA A 79 . HA 1 1 178 1 2 1 1 44 LEU MD2 A 79 . HD21 1 1 179 1 1 1 1 47 TYR HA A 82 . HA 1 1 179 1 2 1 1 47 TYR HB3 A 82 . HB1 1 1 180 1 1 1 1 47 TYR HA A 82 . HA 1 1 180 1 2 1 1 47 TYR HB2 A 82 . HB2 1 1 181 1 1 1 1 47 TYR H A 82 . HN 1 1 181 1 2 1 1 47 TYR HA A 82 . HA 1 1 182 1 1 1 1 47 TYR HA A 82 . HA 1 1 182 1 2 1 1 57 LYS H A 92 . HN 1 1 183 1 1 1 1 47 TYR HA A 82 . HA 1 1 183 1 2 1 1 48 ALA H A 83 . HN 1 1 184 1 1 1 1 48 ALA HA A 83 . HA 1 1 184 1 2 1 1 49 ALA H A 84 . HN 1 1 185 1 1 1 1 48 ALA H A 83 . HN 1 1 185 1 2 1 1 48 ALA HA A 83 . HA 1 1 186 1 1 1 1 49 ALA H A 84 . HN 1 1 186 1 2 1 1 49 ALA HA A 84 . HA 1 1 187 1 1 1 1 49 ALA HA A 84 . HA 1 1 187 1 2 1 1 50 LEU H A 85 . HN 1 1 188 1 1 1 1 49 ALA HA A 84 . HA 1 1 188 1 2 1 1 49 ALA MB A 84 . HB1 1 1 189 1 1 1 1 49 ALA H A 84 . HN 1 1 189 1 2 1 1 49 ALA MB A 84 . HB1 1 1 190 1 1 1 1 50 LEU HA A 85 . HA 1 1 190 1 2 1 1 50 LEU HB3 A 85 . HB1 1 1 191 1 1 1 1 50 LEU MD1 A 85 . HD11 1 1 191 1 2 1 1 64 PHE QD A 99 . HD1 1 1 192 1 1 1 1 51 HIS HA A 86 . HA 1 1 192 1 2 1 1 51 HIS HB2 A 86 . HB2 1 1 193 1 1 1 1 52 GLY HA2 A 87 . HA1 1 1 193 1 2 1 1 53 GLU H A 88 . HN 1 1 194 1 1 1 1 52 GLY H A 87 . HN 1 1 194 1 2 1 1 52 GLY HA2 A 87 . HA1 1 1 195 1 1 1 1 53 GLU HA A 88 . HA 1 1 195 1 2 1 1 53 GLU HG3 A 88 . HG1 1 1 196 1 1 1 1 53 GLU HA A 88 . HA 1 1 196 1 2 1 1 53 GLU HB3 A 88 . HB1 1 1 197 1 1 1 1 53 GLU H A 88 . HN 1 1 197 1 2 1 1 53 GLU HA A 88 . HA 1 1 198 1 1 1 1 53 GLU HA A 88 . HA 1 1 198 1 2 1 1 54 PHE H A 89 . HN 1 1 199 1 1 1 1 53 GLU HA A 88 . HA 1 1 199 1 2 1 1 53 GLU HG2 A 88 . HG2 1 1 200 1 1 1 1 53 GLU HB3 A 88 . HB1 1 1 200 1 2 1 1 53 GLU HG2 A 88 . HG2 1 1 201 1 1 1 1 54 PHE HA A 89 . HA 1 1 201 1 2 1 1 54 PHE HD1 A 89 . HD1 1 1 202 1 1 1 1 54 PHE HA A 89 . HA 1 1 202 1 2 1 1 55 TYR H A 90 . HN 1 1 203 1 1 1 1 54 PHE H A 89 . HN 1 1 203 1 2 1 1 54 PHE HB3 A 89 . HB1 1 1 204 1 1 1 1 54 PHE HB3 A 89 . HB1 1 1 204 1 2 1 1 55 TYR H A 90 . HN 1 1 205 1 1 1 1 55 TYR HA A 90 . HA 1 1 205 1 2 1 1 55 TYR HB3 A 90 . HB2 1 1 206 1 1 1 1 55 TYR HA A 90 . HA 1 1 206 1 2 1 1 55 TYR HB2 A 90 . HB1 1 1 207 1 1 1 1 55 TYR H A 90 . HN 1 1 207 1 2 1 1 55 TYR HB2 A 90 . HB1 1 1 208 1 1 1 1 56 CYS HA A 91 . HA 1 1 208 1 2 1 1 56 CYS QB A 91 . HB1 1 1 209 1 1 1 1 56 CYS HA A 91 . HA 1 1 209 1 2 1 1 57 LYS H A 92 . HN 1 1 210 1 1 1 1 56 CYS H A 91 . HN 1 1 210 1 2 1 1 56 CYS HA A 91 . HA 1 1 211 1 1 1 1 56 CYS QB A 91 . HB1 1 1 211 1 2 1 1 58 PRO HD2 A 93 . HD2 1 1 212 1 1 1 1 56 CYS QB A 91 . HB2 1 1 212 1 2 1 1 57 LYS H A 92 . HN 1 1 213 1 1 1 1 56 CYS H A 91 . HN 1 1 213 1 2 1 1 56 CYS QB A 91 . HB2 1 1 214 1 1 1 1 57 LYS HA A 92 . HA 1 1 214 1 2 1 1 57 LYS HG3 A 92 . HG2 1 1 215 1 1 1 1 57 LYS H A 92 . HN 1 1 215 1 2 1 1 57 LYS HA A 92 . HA 1 1 216 1 1 1 1 57 LYS HA A 92 . HA 1 1 216 1 2 1 1 60 PHE H A 95 . HN 1 1 217 1 1 1 1 57 LYS H A 92 . HN 1 1 217 1 2 1 1 57 LYS QB A 92 . HB1 1 1 218 1 1 1 1 58 PRO HB2 A 93 . HB1 1 1 218 1 2 1 1 59 HIS H A 94 . HN 1 1 219 1 1 1 1 58 PRO HA A 93 . HA 1 1 219 1 2 1 1 58 PRO HB3 A 93 . HB2 1 1 220 1 1 1 1 58 PRO HD3 A 93 . HD1 1 1 220 1 2 1 1 58 PRO HG3 A 93 . HG1 1 1 221 1 1 1 1 58 PRO HD2 A 93 . HD2 1 1 221 1 2 1 1 58 PRO HG3 A 93 . HG1 1 1 222 1 1 1 1 58 PRO HD3 A 93 . HD1 1 1 222 1 2 1 1 58 PRO HG2 A 93 . HG2 1 1 223 1 1 1 1 58 PRO HD2 A 93 . HD2 1 1 223 1 2 1 1 58 PRO HG2 A 93 . HG2 1 1 224 1 1 1 1 57 LYS H A 92 . HN 1 1 224 1 2 1 1 58 PRO HD3 A 93 . HD1 1 1 225 1 1 1 1 59 HIS HA A 94 . HA 1 1 225 1 2 1 1 59 HIS HB2 A 94 . HB2 1 1 226 1 1 1 1 59 HIS HA A 94 . HA 1 1 226 1 2 1 1 62 GLN H A 97 . HN 1 1 227 1 1 1 1 59 HIS H A 94 . HN 1 1 227 1 2 1 1 59 HIS HA A 94 . HA 1 1 228 1 1 1 1 59 HIS H A 94 . HN 1 1 228 1 2 1 1 59 HIS HB3 A 94 . HB1 1 1 229 1 1 1 1 60 PHE HA A 95 . HA 1 1 229 1 2 1 1 60 PHE HB2 A 95 . HB1 1 1 230 1 1 1 1 60 PHE HA A 95 . HA 1 1 230 1 2 1 1 60 PHE HB3 A 95 . HB2 1 1 231 1 1 1 1 60 PHE HA A 95 . HA 1 1 231 1 2 1 1 64 PHE HB2 A 99 . HB2 1 1 232 1 1 1 1 60 PHE H A 95 . HN 1 1 232 1 2 1 1 60 PHE HA A 95 . HA 1 1 233 1 1 1 1 60 PHE HA A 95 . HA 1 1 233 1 2 1 1 63 LEU H A 98 . HN 1 1 234 1 1 1 1 61 GLN HA A 96 . HA 1 1 234 1 2 1 1 61 GLN HB2 A 96 . HB1 1 1 235 1 1 1 1 61 GLN HB2 A 96 . HB1 1 1 235 1 2 1 1 62 GLN H A 97 . HN 1 1 236 1 1 1 1 61 GLN HB2 A 96 . HB1 1 1 236 1 2 1 1 61 GLN QG A 96 . HG2 1 1 237 1 1 1 1 61 GLN HB3 A 96 . HB2 1 1 237 1 2 1 1 61 GLN QG A 96 . HG2 1 1 238 1 1 1 1 61 GLN H A 96 . HN 1 1 238 1 2 1 1 61 GLN QG A 96 . HG1 1 1 239 1 1 1 1 62 GLN HA A 97 . HA 1 1 239 1 2 1 1 62 GLN HB3 A 97 . HB1 1 1 240 1 1 1 1 62 GLN H A 97 . HN 1 1 240 1 2 1 1 62 GLN HA A 97 . HA 1 1 241 1 1 1 1 62 GLN H A 97 . HN 1 1 241 1 2 1 1 62 GLN HB3 A 97 . HB1 1 1 242 1 1 1 1 61 GLN QG A 96 . HG1 1 1 242 1 2 1 1 68 GLY H A 103 . HN 1 1 243 1 1 1 1 63 LEU HA A 98 . HA 1 1 243 1 2 1 1 63 LEU HG A 98 . HG 1 1 244 1 1 1 1 63 LEU HA A 98 . HA 1 1 244 1 2 1 1 63 LEU MD2 A 98 . HD21 1 1 245 1 1 1 1 63 LEU H A 98 . HN 1 1 245 1 2 1 1 63 LEU HA A 98 . HA 1 1 246 1 1 1 1 63 LEU HA A 98 . HA 1 1 246 1 2 1 1 64 PHE H A 99 . HN 1 1 247 1 1 1 1 63 LEU HA A 98 . HA 1 1 247 1 2 1 1 63 LEU HB2 A 98 . HB1 1 1 248 1 1 1 1 63 LEU HB2 A 98 . HB1 1 1 248 1 2 1 1 63 LEU HG A 98 . HG 1 1 249 1 1 1 1 63 LEU H A 98 . HN 1 1 249 1 2 1 1 63 LEU HB2 A 98 . HB1 1 1 250 1 1 1 1 63 LEU H A 98 . HN 1 1 250 1 2 1 1 63 LEU HB3 A 98 . HB2 1 1 251 1 1 1 1 63 LEU MD2 A 98 . HD21 1 1 251 1 2 1 1 63 LEU HG A 98 . HG 1 1 252 1 1 1 1 50 LEU MD2 A 85 . HD21 1 1 252 1 2 1 1 64 PHE HB2 A 99 . HB2 1 1 253 1 1 1 1 64 PHE HB3 A 99 . HB1 1 1 253 1 2 1 1 64 PHE HD1 A 99 . HD1 1 1 254 1 1 1 1 64 PHE H A 99 . HN 1 1 254 1 2 1 1 64 PHE HB2 A 99 . HB2 1 1 255 1 1 1 1 64 PHE HA A 99 . HA 1 1 255 1 2 1 1 64 PHE HB3 A 99 . HB1 1 1 256 1 1 1 1 64 PHE H A 99 . HN 1 1 256 1 2 1 1 64 PHE HA A 99 . HA 1 1 257 1 1 1 1 32 CYS H A 67 . HN 1 1 257 1 2 1 1 32 CYS HA A 67 . HA 1 1 258 1 1 1 1 4 VAL HA A 39 . HA 1 1 258 1 2 1 1 5 LYS H A 40 . HN 1 1 259 1 1 1 1 4 VAL MG1 A 39 . HG11 1 1 259 1 2 1 1 5 LYS H A 40 . HN 1 1 260 1 1 1 1 5 LYS H A 40 . HN 1 1 260 1 2 1 1 5 LYS HB3 A 40 . HB2 1 1 261 1 1 1 1 5 LYS H A 40 . HN 1 1 261 1 2 1 1 6 GLU HG3 A 41 . HG1 1 1 262 1 1 1 1 5 LYS HA A 40 . HA 1 1 262 1 2 1 1 6 GLU H A 41 . HN 1 1 263 1 1 1 1 6 GLU H A 41 . HN 1 1 263 1 2 1 1 6 GLU HB2 A 41 . HB1 1 1 264 1 1 1 1 6 GLU H A 41 . HN 1 1 264 1 2 1 1 6 GLU HB3 A 41 . HB2 1 1 265 1 1 1 1 6 GLU H A 41 . HN 1 1 265 1 2 1 1 6 GLU HG3 A 41 . HG1 1 1 266 1 1 1 1 6 GLU H A 41 . HN 1 1 266 1 2 1 1 6 GLU HG2 A 41 . HG2 1 1 267 1 1 1 1 6 GLU H A 41 . HN 1 1 267 1 2 1 1 15 VAL HB A 50 . HB 1 1 268 1 1 1 1 6 GLU H A 41 . HN 1 1 268 1 2 1 1 14 THR MG A 49 . HG21 1 1 269 1 1 1 1 6 GLU H A 41 . HN 1 1 269 1 2 1 1 7 THR H A 42 . HN 1 1 270 1 1 1 1 6 GLU HA A 41 . HA 1 1 270 1 2 1 1 7 THR H A 42 . HN 1 1 271 1 1 1 1 7 THR H A 42 . HN 1 1 271 1 2 1 1 7 THR HB A 42 . HB 1 1 272 1 1 1 1 7 THR H A 42 . HN 1 1 272 1 2 1 1 7 THR MG A 42 . HG21 1 1 273 1 1 1 1 6 GLU HB2 A 41 . HB1 1 1 273 1 2 1 1 7 THR H A 42 . HN 1 1 274 1 1 1 1 6 GLU HB3 A 41 . HB2 1 1 274 1 2 1 1 7 THR H A 42 . HN 1 1 275 1 1 1 1 6 GLU HG3 A 41 . HG1 1 1 275 1 2 1 1 7 THR H A 42 . HN 1 1 276 1 1 1 1 6 GLU HG2 A 41 . HG2 1 1 276 1 2 1 1 7 THR H A 42 . HN 1 1 277 1 1 1 1 8 CYS H A 43 . HN 1 1 277 1 2 1 1 13 LYS H A 48 . HN 1 1 278 1 1 1 1 8 CYS H A 43 . HN 1 1 278 1 2 1 1 29 HIS HE1 A 64 . HE1 1 1 279 1 1 1 1 8 CYS H A 43 . HN 1 1 279 1 2 1 1 28 PHE HA A 63 . HA 1 1 280 1 1 1 1 8 CYS H A 43 . HN 1 1 280 1 2 1 1 8 CYS HA A 43 . HA 1 1 281 1 1 1 1 8 CYS H A 43 . HN 1 1 281 1 2 1 1 8 CYS HB2 A 43 . HB1 1 1 282 1 1 1 1 8 CYS H A 43 . HN 1 1 282 1 2 1 1 15 VAL HB A 50 . HB 1 1 283 1 1 1 1 7 THR MG A 42 . HG21 1 1 283 1 2 1 1 8 CYS H A 43 . HN 1 1 284 1 1 1 1 8 CYS H A 43 . HN 1 1 284 1 2 1 1 27 ILE MG A 62 . HG21 1 1 285 1 1 1 1 9 ALA H A 44 . HN 1 1 285 1 2 1 1 29 HIS H A 64 . HN 1 1 286 1 1 1 1 9 ALA H A 44 . HN 1 1 286 1 2 1 1 13 LYS H A 48 . HN 1 1 287 1 1 1 1 9 ALA H A 44 . HN 1 1 287 1 2 1 1 27 ILE H A 62 . HN 1 1 288 1 1 1 1 9 ALA H A 44 . HN 1 1 288 1 2 1 1 28 PHE QD A 63 . HD1 1 1 289 1 1 1 1 9 ALA H A 44 . HN 1 1 289 1 2 1 1 28 PHE HA A 63 . HA 1 1 290 1 1 1 1 9 ALA H A 44 . HN 1 1 290 1 2 1 1 9 ALA HA A 44 . HA 1 1 291 1 1 1 1 8 CYS HB2 A 43 . HB1 1 1 291 1 2 1 1 9 ALA H A 44 . HN 1 1 292 1 1 1 1 9 ALA H A 44 . HN 1 1 292 1 2 1 1 10 ALA MB A 45 . HB1 1 1 293 1 1 1 1 9 ALA H A 44 . HN 1 1 293 1 2 1 1 27 ILE HB A 62 . HB 1 1 294 1 1 1 1 9 ALA H A 44 . HN 1 1 294 1 2 1 1 9 ALA MB A 44 . HB1 1 1 295 1 1 1 1 8 CYS HB3 A 43 . HB2 1 1 295 1 2 1 1 9 ALA H A 44 . HN 1 1 296 1 1 1 1 9 ALA H A 44 . HN 1 1 296 1 2 1 1 15 VAL MG2 A 50 . HG21 1 1 297 1 1 1 1 9 ALA H A 44 . HN 1 1 297 1 2 1 1 10 ALA H A 45 . HN 1 1 298 1 1 1 1 10 ALA H A 45 . HN 1 1 298 1 2 1 1 28 PHE QE A 63 . HE1 1 1 299 1 1 1 1 10 ALA H A 45 . HN 1 1 299 1 2 1 1 28 PHE HA A 63 . HA 1 1 300 1 1 1 1 10 ALA H A 45 . HN 1 1 300 1 2 1 1 32 CYS HB2 A 67 . HB2 1 1 301 1 1 1 1 8 CYS HB3 A 43 . HB2 1 1 301 1 2 1 1 10 ALA H A 45 . HN 1 1 302 1 1 1 1 10 ALA H A 45 . HN 1 1 302 1 2 1 1 28 PHE HB3 A 63 . HB1 1 1 303 1 1 1 1 9 ALA MB A 44 . HB1 1 1 303 1 2 1 1 10 ALA H A 45 . HN 1 1 304 1 1 1 1 11 CYS H A 46 . HN 1 1 304 1 2 1 1 11 CYS HA A 46 . HA 1 1 305 1 1 1 1 11 CYS H A 46 . HN 1 1 305 1 2 1 1 12 GLN HA A 47 . HA 1 1 306 1 1 1 1 11 CYS H A 46 . HN 1 1 306 1 2 1 1 12 GLN HG3 A 47 . HG1 1 1 307 1 1 1 1 9 ALA MB A 44 . HB1 1 1 307 1 2 1 1 11 CYS H A 46 . HN 1 1 308 1 1 1 1 10 ALA H A 45 . HN 1 1 308 1 2 1 1 11 CYS H A 46 . HN 1 1 309 1 1 1 1 9 ALA H A 44 . HN 1 1 309 1 2 1 1 11 CYS H A 46 . HN 1 1 310 1 1 1 1 9 ALA H A 44 . HN 1 1 310 1 2 1 1 12 GLN H A 47 . HN 1 1 311 1 1 1 1 10 ALA H A 45 . HN 1 1 311 1 2 1 1 12 GLN H A 47 . HN 1 1 312 1 1 1 1 12 GLN H A 47 . HN 1 1 312 1 2 1 1 29 HIS HE1 A 64 . HE1 1 1 313 1 1 1 1 12 GLN H A 47 . HN 1 1 313 1 2 1 1 12 GLN HA A 47 . HA 1 1 314 1 1 1 1 11 CYS HB3 A 46 . HB1 1 1 314 1 2 1 1 12 GLN H A 47 . HN 1 1 315 1 1 1 1 12 GLN H A 47 . HN 1 1 315 1 2 1 1 12 GLN HB2 A 47 . HB2 1 1 316 1 1 1 1 12 GLN H A 47 . HN 1 1 316 1 2 1 1 12 GLN HB3 A 47 . HB1 1 1 317 1 1 1 1 12 GLN H A 47 . HN 1 1 317 1 2 1 1 12 GLN HG3 A 47 . HG1 1 1 318 1 1 1 1 12 GLN H A 47 . HN 1 1 318 1 2 1 1 12 GLN HG2 A 47 . HG2 1 1 319 1 1 1 1 9 ALA MB A 44 . HB1 1 1 319 1 2 1 1 12 GLN H A 47 . HN 1 1 320 1 1 1 1 13 LYS H A 48 . HN 1 1 320 1 2 1 1 14 THR H A 49 . HN 1 1 321 1 1 1 1 13 LYS H A 48 . HN 1 1 321 1 2 1 1 29 HIS HE1 A 64 . HE1 1 1 322 1 1 1 1 13 LYS H A 48 . HN 1 1 322 1 2 1 1 13 LYS HA A 48 . HA 1 1 323 1 1 1 1 12 GLN HA A 47 . HA 1 1 323 1 2 1 1 13 LYS H A 48 . HN 1 1 324 1 1 1 1 7 THR HB A 42 . HB 1 1 324 1 2 1 1 13 LYS H A 48 . HN 1 1 325 1 1 1 1 8 CYS HB3 A 43 . HB2 1 1 325 1 2 1 1 13 LYS H A 48 . HN 1 1 326 1 1 1 1 13 LYS H A 48 . HN 1 1 326 1 2 1 1 13 LYS HE3 A 48 . HE2 1 1 327 1 1 1 1 12 GLN HB2 A 47 . HB2 1 1 327 1 2 1 1 13 LYS H A 48 . HN 1 1 328 1 1 1 1 12 GLN HB3 A 47 . HB1 1 1 328 1 2 1 1 13 LYS H A 48 . HN 1 1 329 1 1 1 1 13 LYS H A 48 . HN 1 1 329 1 2 1 1 13 LYS HB2 A 48 . HB2 1 1 330 1 1 1 1 13 LYS H A 48 . HN 1 1 330 1 2 1 1 13 LYS HG3 A 48 . HG1 1 1 331 1 1 1 1 13 LYS H A 48 . HN 1 1 331 1 2 1 1 13 LYS HG2 A 48 . HG2 1 1 332 1 1 1 1 13 LYS H A 48 . HN 1 1 332 1 2 1 1 13 LYS HD2 A 48 . HD2 1 1 333 1 1 1 1 7 THR MG A 42 . HG21 1 1 333 1 2 1 1 13 LYS H A 48 . HN 1 1 334 1 1 1 1 13 LYS H A 48 . HN 1 1 334 1 2 1 1 15 VAL MG2 A 50 . HG21 1 1 335 1 1 1 1 14 THR H A 49 . HN 1 1 335 1 2 1 1 15 VAL H A 50 . HN 1 1 336 1 1 1 1 14 THR H A 49 . HN 1 1 336 1 2 1 1 29 HIS HE1 A 64 . HE1 1 1 337 1 1 1 1 13 LYS HA A 48 . HA 1 1 337 1 2 1 1 14 THR H A 49 . HN 1 1 338 1 1 1 1 14 THR H A 49 . HN 1 1 338 1 2 1 1 14 THR HA A 49 . HA 1 1 339 1 1 1 1 14 THR H A 49 . HN 1 1 339 1 2 1 1 14 THR HB A 49 . HB 1 1 340 1 1 1 1 13 LYS HB3 A 48 . HB1 1 1 340 1 2 1 1 14 THR H A 49 . HN 1 1 341 1 1 1 1 14 THR HA A 49 . HA 1 1 341 1 2 1 1 15 VAL H A 50 . HN 1 1 342 1 1 1 1 14 THR HB A 49 . HB 1 1 342 1 2 1 1 15 VAL H A 50 . HN 1 1 343 1 1 1 1 13 LYS HB3 A 48 . HB1 1 1 343 1 2 1 1 15 VAL H A 50 . HN 1 1 344 1 1 1 1 7 THR HA A 42 . HA 1 1 344 1 2 1 1 15 VAL H A 50 . HN 1 1 345 1 1 1 1 13 LYS HA A 48 . HA 1 1 345 1 2 1 1 15 VAL H A 50 . HN 1 1 346 1 1 1 1 15 VAL H A 50 . HN 1 1 346 1 2 1 1 16 TYR H A 51 . HN 1 1 347 1 1 1 1 16 TYR H A 51 . HN 1 1 347 1 2 1 1 16 TYR HD1 A 51 . HD1 1 1 348 1 1 1 1 16 TYR H A 51 . HN 1 1 348 1 2 1 1 16 TYR HA A 51 . HA 1 1 349 1 1 1 1 16 TYR H A 51 . HN 1 1 349 1 2 1 1 19 GLU HB3 A 54 . HB1 1 1 350 1 1 1 1 15 VAL HB A 50 . HB 1 1 350 1 2 1 1 16 TYR H A 51 . HN 1 1 351 1 1 1 1 14 THR MG A 49 . HG21 1 1 351 1 2 1 1 16 TYR H A 51 . HN 1 1 352 1 1 1 1 15 VAL MG2 A 50 . HG21 1 1 352 1 2 1 1 16 TYR H A 51 . HN 1 1 353 1 1 1 1 17 PRO HA A 52 . HA 1 1 353 1 2 1 1 18 MET H A 53 . HN 1 1 354 1 1 1 1 16 TYR HB2 A 51 . HB2 1 1 354 1 2 1 1 18 MET H A 53 . HN 1 1 355 1 1 1 1 18 MET H A 53 . HN 1 1 355 1 2 1 1 18 MET HG2 A 53 . HG1 1 1 356 1 1 1 1 18 MET H A 53 . HN 1 1 356 1 2 1 1 18 MET HG3 A 53 . HG2 1 1 357 1 1 1 1 18 MET H A 53 . HN 1 1 357 1 2 1 1 18 MET HB2 A 53 . HB2 1 1 358 1 1 1 1 18 MET H A 53 . HN 1 1 358 1 2 1 1 19 GLU HG3 A 54 . HG1 1 1 359 1 1 1 1 17 PRO HB2 A 52 . HB1 1 1 359 1 2 1 1 18 MET H A 53 . HN 1 1 360 1 1 1 1 16 TYR H A 51 . HN 1 1 360 1 2 1 1 19 GLU H A 54 . HN 1 1 361 1 1 1 1 19 GLU H A 54 . HN 1 1 361 1 2 1 1 21 LEU H A 56 . HN 1 1 362 1 1 1 1 18 MET H A 53 . HN 1 1 362 1 2 1 1 19 GLU H A 54 . HN 1 1 363 1 1 1 1 19 GLU H A 54 . HN 1 1 363 1 2 1 1 20 ARG H A 55 . HN 1 1 364 1 1 1 1 19 GLU H A 54 . HN 1 1 364 1 2 1 1 19 GLU HA A 54 . HA 1 1 365 1 1 1 1 17 PRO HA A 52 . HA 1 1 365 1 2 1 1 19 GLU H A 54 . HN 1 1 366 1 1 1 1 19 GLU H A 54 . HN 1 1 366 1 2 1 1 20 ARG HA A 55 . HA 1 1 367 1 1 1 1 16 TYR HB2 A 51 . HB2 1 1 367 1 2 1 1 19 GLU H A 54 . HN 1 1 368 1 1 1 1 19 GLU H A 54 . HN 1 1 368 1 2 1 1 19 GLU HG2 A 54 . HG2 1 1 369 1 1 1 1 19 GLU H A 54 . HN 1 1 369 1 2 1 1 19 GLU HG3 A 54 . HG1 1 1 370 1 1 1 1 18 MET QB A 53 . HB1 1 1 370 1 2 1 1 19 GLU H A 54 . HN 1 1 371 1 1 1 1 15 VAL MG1 A 50 . HG11 1 1 371 1 2 1 1 19 GLU H A 54 . HN 1 1 372 1 1 1 1 16 TYR H A 51 . HN 1 1 372 1 2 1 1 20 ARG H A 55 . HN 1 1 373 1 1 1 1 20 ARG H A 55 . HN 1 1 373 1 2 1 1 21 LEU H A 56 . HN 1 1 374 1 1 1 1 18 MET HA A 53 . HA 1 1 374 1 2 1 1 20 ARG H A 55 . HN 1 1 375 1 1 1 1 20 ARG H A 55 . HN 1 1 375 1 2 1 1 20 ARG HD2 A 55 . HD1 1 1 376 1 1 1 1 20 ARG H A 55 . HN 1 1 376 1 2 1 1 20 ARG HD3 A 55 . HD2 1 1 377 1 1 1 1 19 GLU HB2 A 54 . HB2 1 1 377 1 2 1 1 20 ARG H A 55 . HN 1 1 378 1 1 1 1 19 GLU HG3 A 54 . HG1 1 1 378 1 2 1 1 20 ARG H A 55 . HN 1 1 379 1 1 1 1 19 GLU HB3 A 54 . HB1 1 1 379 1 2 1 1 20 ARG H A 55 . HN 1 1 380 1 1 1 1 20 ARG H A 55 . HN 1 1 380 1 2 1 1 20 ARG HB3 A 55 . HB1 1 1 381 1 1 1 1 20 ARG H A 55 . HN 1 1 381 1 2 1 1 20 ARG HB2 A 55 . HB2 1 1 382 1 1 1 1 20 ARG H A 55 . HN 1 1 382 1 2 1 1 20 ARG HG2 A 55 . HG2 1 1 383 1 1 1 1 20 ARG H A 55 . HN 1 1 383 1 2 1 1 20 ARG HG3 A 55 . HG1 1 1 384 1 1 1 1 15 VAL MG1 A 50 . HG11 1 1 384 1 2 1 1 20 ARG H A 55 . HN 1 1 385 1 1 1 1 21 LEU H A 56 . HN 1 1 385 1 2 1 1 28 PHE HA A 63 . HA 1 1 386 1 1 1 1 21 LEU H A 56 . HN 1 1 386 1 2 1 1 22 VAL HA A 57 . HA 1 1 387 1 1 1 1 21 LEU H A 56 . HN 1 1 387 1 2 1 1 21 LEU HA A 56 . HA 1 1 388 1 1 1 1 21 LEU H A 56 . HN 1 1 388 1 2 1 1 30 ASN HB3 A 65 . HB2 1 1 389 1 1 1 1 20 ARG HB2 A 55 . HB2 1 1 389 1 2 1 1 21 LEU H A 56 . HN 1 1 390 1 1 1 1 20 ARG HB3 A 55 . HB1 1 1 390 1 2 1 1 21 LEU H A 56 . HN 1 1 391 1 1 1 1 20 ARG HG2 A 55 . HG2 1 1 391 1 2 1 1 21 LEU H A 56 . HN 1 1 392 1 1 1 1 21 LEU H A 56 . HN 1 1 392 1 2 1 1 21 LEU HB3 A 56 . HB1 1 1 393 1 1 1 1 21 LEU H A 56 . HN 1 1 393 1 2 1 1 21 LEU HB2 A 56 . HB2 1 1 394 1 1 1 1 21 LEU H A 56 . HN 1 1 394 1 2 1 1 21 LEU MD2 A 56 . HD21 1 1 395 1 1 1 1 21 LEU H A 56 . HN 1 1 395 1 2 1 1 21 LEU MD1 A 56 . HD11 1 1 396 1 1 1 1 15 VAL MG1 A 50 . HG11 1 1 396 1 2 1 1 21 LEU H A 56 . HN 1 1 397 1 1 1 1 21 LEU H A 56 . HN 1 1 397 1 2 1 1 22 VAL H A 57 . HN 1 1 398 1 1 1 1 22 VAL H A 57 . HN 1 1 398 1 2 1 1 22 VAL HB A 57 . HB 1 1 399 1 1 1 1 21 LEU HG A 56 . HG 1 1 399 1 2 1 1 22 VAL H A 57 . HN 1 1 400 1 1 1 1 21 LEU MD2 A 56 . HD21 1 1 400 1 2 1 1 22 VAL H A 57 . HN 1 1 401 1 1 1 1 23 ALA H A 58 . HN 1 1 401 1 2 1 1 28 PHE QD A 63 . HD1 1 1 402 1 1 1 1 22 VAL HA A 57 . HA 1 1 402 1 2 1 1 23 ALA H A 58 . HN 1 1 403 1 1 1 1 23 ALA H A 58 . HN 1 1 403 1 2 1 1 23 ALA HA A 58 . HA 1 1 404 1 1 1 1 23 ALA H A 58 . HN 1 1 404 1 2 1 1 27 ILE HA A 62 . HA 1 1 405 1 1 1 1 23 ALA H A 58 . HN 1 1 405 1 2 1 1 26 LEU HB2 A 61 . HB2 1 1 406 1 1 1 1 22 VAL HB A 57 . HB 1 1 406 1 2 1 1 23 ALA H A 58 . HN 1 1 407 1 1 1 1 23 ALA H A 58 . HN 1 1 407 1 2 1 1 26 LEU MD1 A 61 . HD11 1 1 408 1 1 1 1 23 ALA H A 58 . HN 1 1 408 1 2 1 1 23 ALA MB A 58 . HB1 1 1 409 1 1 1 1 22 VAL MG2 A 57 . HG21 1 1 409 1 2 1 1 23 ALA H A 58 . HN 1 1 410 1 1 1 1 21 LEU MD2 A 56 . HD21 1 1 410 1 2 1 1 23 ALA H A 58 . HN 1 1 411 1 1 1 1 24 ASP H A 59 . HN 1 1 411 1 2 1 1 25 LYS H A 60 . HN 1 1 412 1 1 1 1 23 ALA HA A 58 . HA 1 1 412 1 2 1 1 24 ASP H A 59 . HN 1 1 413 1 1 1 1 24 ASP H A 59 . HN 1 1 413 1 2 1 1 25 LYS HA A 60 . HA 1 1 414 1 1 1 1 24 ASP H A 59 . HN 1 1 414 1 2 1 1 24 ASP HB3 A 59 . HB1 1 1 415 1 1 1 1 24 ASP H A 59 . HN 1 1 415 1 2 1 1 24 ASP HB2 A 59 . HB2 1 1 416 1 1 1 1 24 ASP H A 59 . HN 1 1 416 1 2 1 1 44 LEU MD2 A 79 . HD21 1 1 417 1 1 1 1 22 VAL MG2 A 57 . HG21 1 1 417 1 2 1 1 24 ASP H A 59 . HN 1 1 418 1 1 1 1 23 ALA MB A 58 . HB1 1 1 418 1 2 1 1 24 ASP H A 59 . HN 1 1 419 1 1 1 1 24 ASP HA A 59 . HA 1 1 419 1 2 1 1 25 LYS H A 60 . HN 1 1 420 1 1 1 1 25 LYS H A 60 . HN 1 1 420 1 2 1 1 25 LYS HB3 A 60 . HB1 1 1 421 1 1 1 1 25 LYS H A 60 . HN 1 1 421 1 2 1 1 25 LYS QD A 60 . HD1 1 1 422 1 1 1 1 22 VAL MG2 A 57 . HG21 1 1 422 1 2 1 1 25 LYS H A 60 . HN 1 1 423 1 1 1 1 25 LYS H A 60 . HN 1 1 423 1 2 1 1 25 LYS HG3 A 60 . HG1 1 1 424 1 1 1 1 23 ALA H A 58 . HN 1 1 424 1 2 1 1 26 LEU H A 61 . HN 1 1 425 1 1 1 1 26 LEU H A 61 . HN 1 1 425 1 2 1 1 28 PHE QE A 63 . HE1 1 1 426 1 1 1 1 24 ASP HA A 59 . HA 1 1 426 1 2 1 1 26 LEU H A 61 . HN 1 1 427 1 1 1 1 25 LYS HA A 60 . HA 1 1 427 1 2 1 1 26 LEU H A 61 . HN 1 1 428 1 1 1 1 24 ASP HB3 A 59 . HB1 1 1 428 1 2 1 1 26 LEU H A 61 . HN 1 1 429 1 1 1 1 24 ASP HB2 A 59 . HB2 1 1 429 1 2 1 1 26 LEU H A 61 . HN 1 1 430 1 1 1 1 26 LEU H A 61 . HN 1 1 430 1 2 1 1 26 LEU HB2 A 61 . HB2 1 1 431 1 1 1 1 26 LEU H A 61 . HN 1 1 431 1 2 1 1 26 LEU HG A 61 . HG 1 1 432 1 1 1 1 23 ALA MB A 58 . HB1 1 1 432 1 2 1 1 26 LEU H A 61 . HN 1 1 433 1 1 1 1 22 VAL MG2 A 57 . HG21 1 1 433 1 2 1 1 26 LEU H A 61 . HN 1 1 434 1 1 1 1 26 LEU H A 61 . HN 1 1 434 1 2 1 1 26 LEU MD1 A 61 . HD11 1 1 435 1 1 1 1 27 ILE H A 62 . HN 1 1 435 1 2 1 1 28 PHE H A 63 . HN 1 1 436 1 1 1 1 26 LEU H A 61 . HN 1 1 436 1 2 1 1 27 ILE H A 62 . HN 1 1 437 1 1 1 1 26 LEU HB2 A 61 . HB2 1 1 437 1 2 1 1 27 ILE H A 62 . HN 1 1 438 1 1 1 1 27 ILE H A 62 . HN 1 1 438 1 2 1 1 27 ILE HG12 A 62 . HG11 1 1 439 1 1 1 1 27 ILE H A 62 . HN 1 1 439 1 2 1 1 27 ILE HG13 A 62 . HG12 1 1 440 1 1 1 1 27 ILE H A 62 . HN 1 1 440 1 2 1 1 27 ILE MD A 62 . HD11 1 1 441 1 1 1 1 22 VAL HA A 57 . HA 1 1 441 1 2 1 1 28 PHE H A 63 . HN 1 1 442 1 1 1 1 28 PHE H A 63 . HN 1 1 442 1 2 1 1 28 PHE HB2 A 63 . HB2 1 1 443 1 1 1 1 27 ILE HB A 62 . HB 1 1 443 1 2 1 1 28 PHE H A 63 . HN 1 1 444 1 1 1 1 27 ILE MD A 62 . HD11 1 1 444 1 2 1 1 28 PHE H A 63 . HN 1 1 445 1 1 1 1 28 PHE H A 63 . HN 1 1 445 1 2 1 1 29 HIS H A 64 . HN 1 1 446 1 1 1 1 29 HIS H A 64 . HN 1 1 446 1 2 1 1 32 CYS H A 67 . HN 1 1 447 1 1 1 1 29 HIS H A 64 . HN 1 1 447 1 2 1 1 29 HIS HD2 A 64 . HD2 1 1 448 1 1 1 1 28 PHE HA A 63 . HA 1 1 448 1 2 1 1 29 HIS H A 64 . HN 1 1 449 1 1 1 1 8 CYS HA A 43 . HA 1 1 449 1 2 1 1 29 HIS H A 64 . HN 1 1 450 1 1 1 1 29 HIS H A 64 . HN 1 1 450 1 2 1 1 29 HIS HB2 A 64 . HB2 1 1 451 1 1 1 1 29 HIS H A 64 . HN 1 1 451 1 2 1 1 29 HIS HB3 A 64 . HB1 1 1 452 1 1 1 1 28 PHE HB2 A 63 . HB2 1 1 452 1 2 1 1 29 HIS H A 64 . HN 1 1 453 1 1 1 1 10 ALA MB A 45 . HB1 1 1 453 1 2 1 1 29 HIS H A 64 . HN 1 1 454 1 1 1 1 15 VAL MG1 A 50 . HG11 1 1 454 1 2 1 1 29 HIS H A 64 . HN 1 1 455 1 1 1 1 15 VAL MG2 A 50 . HG21 1 1 455 1 2 1 1 29 HIS H A 64 . HN 1 1 456 1 1 1 1 30 ASN H A 65 . HN 1 1 456 1 2 1 1 31 SER H A 66 . HN 1 1 457 1 1 1 1 29 HIS H A 64 . HN 1 1 457 1 2 1 1 30 ASN H A 65 . HN 1 1 458 1 1 1 1 29 HIS HD2 A 64 . HD2 1 1 458 1 2 1 1 30 ASN H A 65 . HN 1 1 459 1 1 1 1 29 HIS HA A 64 . HA 1 1 459 1 2 1 1 30 ASN H A 65 . HN 1 1 460 1 1 1 1 20 ARG HA A 55 . HA 1 1 460 1 2 1 1 30 ASN H A 65 . HN 1 1 461 1 1 1 1 29 HIS HB2 A 64 . HB2 1 1 461 1 2 1 1 30 ASN H A 65 . HN 1 1 462 1 1 1 1 29 HIS HB3 A 64 . HB1 1 1 462 1 2 1 1 30 ASN H A 65 . HN 1 1 463 1 1 1 1 30 ASN H A 65 . HN 1 1 463 1 2 1 1 30 ASN HB3 A 65 . HB2 1 1 464 1 1 1 1 19 GLU HB3 A 54 . HB1 1 1 464 1 2 1 1 30 ASN H A 65 . HN 1 1 465 1 1 1 1 21 LEU HB2 A 56 . HB2 1 1 465 1 2 1 1 30 ASN H A 65 . HN 1 1 466 1 1 1 1 15 VAL MG2 A 50 . HG21 1 1 466 1 2 1 1 30 ASN H A 65 . HN 1 1 467 1 1 1 1 31 SER H A 66 . HN 1 1 467 1 2 1 1 31 SER HB2 A 66 . HB1 1 1 468 1 1 1 1 29 HIS HB3 A 64 . HB1 1 1 468 1 2 1 1 31 SER H A 66 . HN 1 1 469 1 1 1 1 30 ASN HB2 A 65 . HB1 1 1 469 1 2 1 1 31 SER H A 66 . HN 1 1 470 1 1 1 1 30 ASN H A 65 . HN 1 1 470 1 2 1 1 32 CYS H A 67 . HN 1 1 471 1 1 1 1 31 SER H A 66 . HN 1 1 471 1 2 1 1 32 CYS H A 67 . HN 1 1 472 1 1 1 1 32 CYS H A 67 . HN 1 1 472 1 2 1 1 33 PHE QE A 68 . HE1 1 1 473 1 1 1 1 32 CYS H A 67 . HN 1 1 473 1 2 1 1 32 CYS HB2 A 67 . HB2 1 1 474 1 1 1 1 30 ASN H A 65 . HN 1 1 474 1 2 1 1 33 PHE H A 68 . HN 1 1 475 1 1 1 1 31 SER H A 66 . HN 1 1 475 1 2 1 1 33 PHE H A 68 . HN 1 1 476 1 1 1 1 32 CYS HA A 67 . HA 1 1 476 1 2 1 1 33 PHE H A 68 . HN 1 1 477 1 1 1 1 33 PHE H A 68 . HN 1 1 477 1 2 1 1 33 PHE HA A 68 . HA 1 1 478 1 1 1 1 33 PHE H A 68 . HN 1 1 478 1 2 1 1 33 PHE HB2 A 68 . HB2 1 1 479 1 1 1 1 33 PHE H A 68 . HN 1 1 479 1 2 1 1 33 PHE HB3 A 68 . HB1 1 1 480 1 1 1 1 32 CYS HB3 A 67 . HB1 1 1 480 1 2 1 1 33 PHE H A 68 . HN 1 1 481 1 1 1 1 21 LEU MD2 A 56 . HD21 1 1 481 1 2 1 1 33 PHE H A 68 . HN 1 1 482 1 1 1 1 33 PHE QD A 68 . HD1 1 1 482 1 2 1 1 34 CYS H A 69 . HN 1 1 483 1 1 1 1 33 PHE HB2 A 68 . HB2 1 1 483 1 2 1 1 34 CYS H A 69 . HN 1 1 484 1 1 1 1 34 CYS H A 69 . HN 1 1 484 1 2 1 1 34 CYS HB3 A 69 . HB2 1 1 485 1 1 1 1 34 CYS H A 69 . HN 1 1 485 1 2 1 1 42 LEU HG A 77 . HG 1 1 486 1 1 1 1 34 CYS H A 69 . HN 1 1 486 1 2 1 1 42 LEU QD A 77 . HD11 1 1 487 1 1 1 1 35 CYS H A 70 . HN 1 1 487 1 2 1 1 36 LYS H A 71 . HN 1 1 488 1 1 1 1 35 CYS H A 70 . HN 1 1 488 1 2 1 1 55 TYR HA A 90 . HA 1 1 489 1 1 1 1 35 CYS H A 70 . HN 1 1 489 1 2 1 1 39 HIS HA A 74 . HA 1 1 490 1 1 1 1 35 CYS H A 70 . HN 1 1 490 1 2 1 1 35 CYS HA A 70 . HA 1 1 491 1 1 1 1 35 CYS H A 70 . HN 1 1 491 1 2 1 1 35 CYS HB2 A 70 . HB2 1 1 492 1 1 1 1 35 CYS H A 70 . HN 1 1 492 1 2 1 1 35 CYS HB3 A 70 . HB1 1 1 493 1 1 1 1 34 CYS HB2 A 69 . HB1 1 1 493 1 2 1 1 35 CYS H A 70 . HN 1 1 494 1 1 1 1 34 CYS HB3 A 69 . HB2 1 1 494 1 2 1 1 35 CYS H A 70 . HN 1 1 495 1 1 1 1 35 CYS H A 70 . HN 1 1 495 1 2 1 1 40 THR MG A 75 . HG21 1 1 496 1 1 1 1 35 CYS H A 70 . HN 1 1 496 1 2 1 1 42 LEU HG A 77 . HG 1 1 497 1 1 1 1 36 LYS H A 71 . HN 1 1 497 1 2 1 1 37 HIS H A 72 . HN 1 1 498 1 1 1 1 36 LYS H A 71 . HN 1 1 498 1 2 1 1 55 TYR HA A 90 . HA 1 1 499 1 1 1 1 36 LYS H A 71 . HN 1 1 499 1 2 1 1 37 HIS QB A 72 . HB1 1 1 500 1 1 1 1 35 CYS HB3 A 70 . HB1 1 1 500 1 2 1 1 36 LYS H A 71 . HN 1 1 501 1 1 1 1 34 CYS HB3 A 69 . HB2 1 1 501 1 2 1 1 36 LYS H A 71 . HN 1 1 502 1 1 1 1 36 LYS H A 71 . HN 1 1 502 1 2 1 1 36 LYS HD2 A 71 . HD2 1 1 503 1 1 1 1 36 LYS H A 71 . HN 1 1 503 1 2 1 1 36 LYS HB2 A 71 . HB1 1 1 504 1 1 1 1 36 LYS H A 71 . HN 1 1 504 1 2 1 1 36 LYS HG2 A 71 . HG2 1 1 505 1 1 1 1 36 LYS H A 71 . HN 1 1 505 1 2 1 1 42 LEU QD A 77 . HD11 1 1 506 1 1 1 1 37 HIS H A 72 . HN 1 1 506 1 2 1 1 38 CYS H A 73 . HN 1 1 507 1 1 1 1 37 HIS H A 72 . HN 1 1 507 1 2 1 1 55 TYR QE A 90 . HE1 1 1 508 1 1 1 1 37 HIS H A 72 . HN 1 1 508 1 2 1 1 55 TYR HA A 90 . HA 1 1 509 1 1 1 1 35 CYS HA A 70 . HA 1 1 509 1 2 1 1 37 HIS H A 72 . HN 1 1 510 1 1 1 1 36 LYS HA A 71 . HA 1 1 510 1 2 1 1 37 HIS H A 72 . HN 1 1 511 1 1 1 1 35 CYS HB2 A 70 . HB2 1 1 511 1 2 1 1 37 HIS H A 72 . HN 1 1 512 1 1 1 1 37 HIS H A 72 . HN 1 1 512 1 2 1 1 37 HIS HB2 A 72 . HB2 1 1 513 1 1 1 1 36 LYS HB3 A 71 . HB2 1 1 513 1 2 1 1 37 HIS H A 72 . HN 1 1 514 1 1 1 1 36 LYS HG3 A 71 . HG1 1 1 514 1 2 1 1 37 HIS H A 72 . HN 1 1 515 1 1 1 1 37 HIS H A 72 . HN 1 1 515 1 2 1 1 63 LEU MD1 A 98 . HD11 1 1 516 1 1 1 1 38 CYS H A 73 . HN 1 1 516 1 2 1 1 40 THR MG A 75 . HG21 1 1 517 1 1 1 1 37 HIS QB A 72 . HB1 1 1 517 1 2 1 1 38 CYS H A 73 . HN 1 1 518 1 1 1 1 38 CYS H A 73 . HN 1 1 518 1 2 1 1 38 CYS HB2 A 73 . HB2 1 1 519 1 1 1 1 37 HIS HD2 A 72 . HD2 1 1 519 1 2 1 1 38 CYS H A 73 . HN 1 1 520 1 1 1 1 38 CYS H A 73 . HN 1 1 520 1 2 1 1 55 TYR QD A 90 . HD1 1 1 521 1 1 1 1 39 HIS HD2 A 74 . HD2 1 1 521 1 2 1 1 40 THR H A 75 . HN 1 1 522 1 1 1 1 34 CYS HA A 69 . HA 1 1 522 1 2 1 1 40 THR H A 75 . HN 1 1 523 1 1 1 1 38 CYS HA A 73 . HA 1 1 523 1 2 1 1 40 THR H A 75 . HN 1 1 524 1 1 1 1 38 CYS HB3 A 73 . HB1 1 1 524 1 2 1 1 40 THR H A 75 . HN 1 1 525 1 1 1 1 40 THR H A 75 . HN 1 1 525 1 2 1 1 40 THR MG A 75 . HG21 1 1 526 1 1 1 1 40 THR MG A 75 . HG21 1 1 526 1 2 1 1 41 LYS H A 76 . HN 1 1 527 1 1 1 1 41 LYS H A 76 . HN 1 1 527 1 2 1 1 41 LYS HB3 A 76 . HB1 1 1 528 1 1 1 1 41 LYS H A 76 . HN 1 1 528 1 2 1 1 41 LYS HB2 A 76 . HB2 1 1 529 1 1 1 1 40 THR HA A 75 . HA 1 1 529 1 2 1 1 41 LYS H A 76 . HN 1 1 530 1 1 1 1 34 CYS HA A 69 . HA 1 1 530 1 2 1 1 41 LYS H A 76 . HN 1 1 531 1 1 1 1 43 SER H A 78 . HN 1 1 531 1 2 1 1 44 LEU H A 79 . HN 1 1 532 1 1 1 1 33 PHE QD A 68 . HD1 1 1 532 1 2 1 1 43 SER H A 78 . HN 1 1 533 1 1 1 1 43 SER H A 78 . HN 1 1 533 1 2 1 1 43 SER HA A 78 . HA 1 1 534 1 1 1 1 42 LEU H A 77 . HN 1 1 534 1 2 1 1 47 TYR HB3 A 82 . HB1 1 1 535 1 1 1 1 34 CYS HB3 A 69 . HB2 1 1 535 1 2 1 1 42 LEU H A 77 . HN 1 1 536 1 1 1 1 34 CYS HB2 A 69 . HB1 1 1 536 1 2 1 1 42 LEU H A 77 . HN 1 1 537 1 1 1 1 41 LYS HB3 A 76 . HB1 1 1 537 1 2 1 1 42 LEU H A 77 . HN 1 1 538 1 1 1 1 41 LYS HG3 A 76 . HG2 1 1 538 1 2 1 1 42 LEU H A 77 . HN 1 1 539 1 1 1 1 42 LEU H A 77 . HN 1 1 539 1 2 1 1 42 LEU HG A 77 . HG 1 1 540 1 1 1 1 42 LEU H A 77 . HN 1 1 540 1 2 1 1 42 LEU QD A 77 . HD21 1 1 541 1 1 1 1 42 LEU H A 77 . HN 1 1 541 1 2 1 1 42 LEU HB2 A 77 . HB2 1 1 542 1 1 1 1 42 LEU H A 77 . HN 1 1 542 1 2 1 1 42 LEU HB3 A 77 . HB1 1 1 543 1 1 1 1 34 CYS H A 69 . HN 1 1 543 1 2 1 1 42 LEU H A 77 . HN 1 1 544 1 1 1 1 35 CYS H A 70 . HN 1 1 544 1 2 1 1 42 LEU H A 77 . HN 1 1 545 1 1 1 1 43 SER H A 78 . HN 1 1 545 1 2 1 1 43 SER HB3 A 78 . HB1 1 1 546 1 1 1 1 43 SER H A 78 . HN 1 1 546 1 2 1 1 47 TYR HB2 A 82 . HB2 1 1 547 1 1 1 1 43 SER H A 78 . HN 1 1 547 1 2 1 1 47 TYR HB3 A 82 . HB1 1 1 548 1 1 1 1 42 LEU HG A 77 . HG 1 1 548 1 2 1 1 43 SER H A 78 . HN 1 1 549 1 1 1 1 42 LEU HB3 A 77 . HB1 1 1 549 1 2 1 1 43 SER H A 78 . HN 1 1 550 1 1 1 1 42 LEU QD A 77 . HD11 1 1 550 1 2 1 1 43 SER H A 78 . HN 1 1 551 1 1 1 1 43 SER HB2 A 78 . HB2 1 1 551 1 2 1 1 44 LEU H A 79 . HN 1 1 552 1 1 1 1 43 SER HA A 78 . HA 1 1 552 1 2 1 1 44 LEU H A 79 . HN 1 1 553 1 1 1 1 44 LEU H A 79 . HN 1 1 553 1 2 1 1 44 LEU HB3 A 79 . HB1 1 1 554 1 1 1 1 44 LEU H A 79 . HN 1 1 554 1 2 1 1 44 LEU HB2 A 79 . HB2 1 1 555 1 1 1 1 44 LEU H A 79 . HN 1 1 555 1 2 1 1 44 LEU MD2 A 79 . HD21 1 1 556 1 1 1 1 44 LEU H A 79 . HN 1 1 556 1 2 1 1 44 LEU MD1 A 79 . HD11 1 1 557 1 1 1 1 44 LEU H A 79 . HN 1 1 557 1 2 1 1 46 SER H A 81 . HN 1 1 558 1 1 1 1 46 SER H A 81 . HN 1 1 558 1 2 1 1 47 TYR QD A 82 . HD1 1 1 559 1 1 1 1 46 SER H A 81 . HN 1 1 559 1 2 1 1 47 TYR HA A 82 . HA 1 1 560 1 1 1 1 46 SER H A 81 . HN 1 1 560 1 2 1 1 46 SER HA A 81 . HA 1 1 561 1 1 1 1 46 SER H A 81 . HN 1 1 561 1 2 1 1 46 SER HB3 A 81 . HB1 1 1 562 1 1 1 1 46 SER H A 81 . HN 1 1 562 1 2 1 1 47 TYR HB3 A 82 . HB1 1 1 563 1 1 1 1 47 TYR H A 82 . HN 1 1 563 1 2 1 1 47 TYR HD1 A 82 . HD1 1 1 564 1 1 1 1 33 PHE QE A 68 . HE1 1 1 564 1 2 1 1 47 TYR H A 82 . HN 1 1 565 1 1 1 1 46 SER HA A 81 . HA 1 1 565 1 2 1 1 47 TYR H A 82 . HN 1 1 566 1 1 1 1 46 SER HB2 A 81 . HB2 1 1 566 1 2 1 1 47 TYR H A 82 . HN 1 1 567 1 1 1 1 47 TYR H A 82 . HN 1 1 567 1 2 1 1 47 TYR HB3 A 82 . HB1 1 1 568 1 1 1 1 47 TYR H A 82 . HN 1 1 568 1 2 1 1 47 TYR HB2 A 82 . HB2 1 1 569 1 1 1 1 47 TYR H A 82 . HN 1 1 569 1 2 1 1 57 LYS QD A 92 . HD1 1 1 570 1 1 1 1 47 TYR H A 82 . HN 1 1 570 1 2 1 1 57 LYS HG3 A 92 . HG2 1 1 571 1 1 1 1 47 TYR H A 82 . HN 1 1 571 1 2 1 1 57 LYS HG2 A 92 . HG1 1 1 572 1 1 1 1 42 LEU QD A 77 . HD21 1 1 572 1 2 1 1 47 TYR H A 82 . HN 1 1 573 1 1 1 1 42 LEU HB2 A 77 . HB2 1 1 573 1 2 1 1 47 TYR H A 82 . HN 1 1 574 1 1 1 1 47 TYR H A 82 . HN 1 1 574 1 2 1 1 48 ALA H A 83 . HN 1 1 575 1 1 1 1 47 TYR QE A 82 . HE1 1 1 575 1 2 1 1 48 ALA H A 83 . HN 1 1 576 1 1 1 1 48 ALA H A 83 . HN 1 1 576 1 2 1 1 56 CYS HA A 91 . HA 1 1 577 1 1 1 1 47 TYR HB2 A 82 . HB2 1 1 577 1 2 1 1 48 ALA H A 83 . HN 1 1 578 1 1 1 1 47 TYR HB3 A 82 . HB1 1 1 578 1 2 1 1 48 ALA H A 83 . HN 1 1 579 1 1 1 1 48 ALA H A 83 . HN 1 1 579 1 2 1 1 54 PHE HB3 A 89 . HB1 1 1 580 1 1 1 1 48 ALA H A 83 . HN 1 1 580 1 2 1 1 57 LYS HG2 A 92 . HG1 1 1 581 1 1 1 1 48 ALA H A 83 . HN 1 1 581 1 2 1 1 49 ALA MB A 84 . HB1 1 1 582 1 1 1 1 48 ALA H A 83 . HN 1 1 582 1 2 1 1 48 ALA MB A 83 . HB1 1 1 583 1 1 1 1 42 LEU QD A 77 . HD11 1 1 583 1 2 1 1 48 ALA H A 83 . HN 1 1 584 1 1 1 1 48 ALA MB A 83 . HB1 1 1 584 1 2 1 1 49 ALA H A 84 . HN 1 1 585 1 1 1 1 47 TYR QE A 82 . HE1 1 1 585 1 2 1 1 49 ALA H A 84 . HN 1 1 586 1 1 1 1 47 TYR QD A 82 . HD1 1 1 586 1 2 1 1 49 ALA H A 84 . HN 1 1 587 1 1 1 1 49 ALA H A 84 . HN 1 1 587 1 2 1 1 50 LEU H A 85 . HN 1 1 588 1 1 1 1 50 LEU H A 85 . HN 1 1 588 1 2 1 1 53 GLU H A 88 . HN 1 1 589 1 1 1 1 50 LEU H A 85 . HN 1 1 589 1 2 1 1 54 PHE HA A 89 . HA 1 1 590 1 1 1 1 50 LEU H A 85 . HN 1 1 590 1 2 1 1 50 LEU HA A 85 . HA 1 1 591 1 1 1 1 50 LEU H A 85 . HN 1 1 591 1 2 1 1 53 GLU HB2 A 88 . HB2 1 1 592 1 1 1 1 50 LEU H A 85 . HN 1 1 592 1 2 1 1 50 LEU HB2 A 85 . HB2 1 1 593 1 1 1 1 50 LEU H A 85 . HN 1 1 593 1 2 1 1 50 LEU HB3 A 85 . HB1 1 1 594 1 1 1 1 49 ALA MB A 84 . HB1 1 1 594 1 2 1 1 50 LEU H A 85 . HN 1 1 595 1 1 1 1 50 LEU H A 85 . HN 1 1 595 1 2 1 1 50 LEU MD1 A 85 . HD11 1 1 596 1 1 1 1 50 LEU H A 85 . HN 1 1 596 1 2 1 1 50 LEU MD2 A 85 . HD21 1 1 597 1 1 1 1 49 ALA MB A 84 . HB1 1 1 597 1 2 1 1 52 GLY H A 87 . HN 1 1 598 1 1 1 1 51 HIS HA A 86 . HA 1 1 598 1 2 1 1 52 GLY H A 87 . HN 1 1 599 1 1 1 1 52 GLY H A 87 . HN 1 1 599 1 2 1 1 53 GLU H A 88 . HN 1 1 600 1 1 1 1 49 ALA HA A 84 . HA 1 1 600 1 2 1 1 53 GLU H A 88 . HN 1 1 601 1 1 1 1 51 HIS QB A 86 . HB1 1 1 601 1 2 1 1 53 GLU H A 88 . HN 1 1 602 1 1 1 1 53 GLU H A 88 . HN 1 1 602 1 2 1 1 53 GLU HB3 A 88 . HB1 1 1 603 1 1 1 1 53 GLU H A 88 . HN 1 1 603 1 2 1 1 53 GLU HB2 A 88 . HB2 1 1 604 1 1 1 1 53 GLU H A 88 . HN 1 1 604 1 2 1 1 53 GLU HG3 A 88 . HG1 1 1 605 1 1 1 1 53 GLU H A 88 . HN 1 1 605 1 2 1 1 53 GLU HG2 A 88 . HG2 1 1 606 1 1 1 1 50 LEU HB2 A 85 . HB2 1 1 606 1 2 1 1 53 GLU H A 88 . HN 1 1 607 1 1 1 1 49 ALA MB A 84 . HB1 1 1 607 1 2 1 1 53 GLU H A 88 . HN 1 1 608 1 1 1 1 36 LYS H A 71 . HN 1 1 608 1 2 1 1 54 PHE H A 89 . HN 1 1 609 1 1 1 1 50 LEU H A 85 . HN 1 1 609 1 2 1 1 54 PHE H A 89 . HN 1 1 610 1 1 1 1 53 GLU H A 88 . HN 1 1 610 1 2 1 1 54 PHE H A 89 . HN 1 1 611 1 1 1 1 54 PHE H A 89 . HN 1 1 611 1 2 1 1 55 TYR QE A 90 . HE1 1 1 612 1 1 1 1 49 ALA HA A 84 . HA 1 1 612 1 2 1 1 54 PHE H A 89 . HN 1 1 613 1 1 1 1 54 PHE H A 89 . HN 1 1 613 1 2 1 1 54 PHE HB2 A 89 . HB2 1 1 614 1 1 1 1 53 GLU HB2 A 88 . HB2 1 1 614 1 2 1 1 54 PHE H A 89 . HN 1 1 615 1 1 1 1 36 LYS H A 71 . HN 1 1 615 1 2 1 1 55 TYR H A 90 . HN 1 1 616 1 1 1 1 48 ALA H A 83 . HN 1 1 616 1 2 1 1 55 TYR H A 90 . HN 1 1 617 1 1 1 1 55 TYR H A 90 . HN 1 1 617 1 2 1 1 55 TYR HD1 A 90 . HD1 1 1 618 1 1 1 1 49 ALA HA A 84 . HA 1 1 618 1 2 1 1 55 TYR H A 90 . HN 1 1 619 1 1 1 1 35 CYS HA A 70 . HA 1 1 619 1 2 1 1 55 TYR H A 90 . HN 1 1 620 1 1 1 1 55 TYR H A 90 . HN 1 1 620 1 2 1 1 55 TYR HB3 A 90 . HB2 1 1 621 1 1 1 1 49 ALA MB A 84 . HB1 1 1 621 1 2 1 1 55 TYR H A 90 . HN 1 1 622 1 1 1 1 48 ALA MB A 83 . HB1 1 1 622 1 2 1 1 55 TYR H A 90 . HN 1 1 623 1 1 1 1 56 CYS H A 91 . HN 1 1 623 1 2 1 1 57 LYS H A 92 . HN 1 1 624 1 1 1 1 55 TYR HA A 90 . HA 1 1 624 1 2 1 1 56 CYS H A 91 . HN 1 1 625 1 1 1 1 35 CYS HA A 70 . HA 1 1 625 1 2 1 1 56 CYS H A 91 . HN 1 1 626 1 1 1 1 56 CYS H A 91 . HN 1 1 626 1 2 1 1 59 HIS HB2 A 94 . HB2 1 1 627 1 1 1 1 40 THR MG A 75 . HG21 1 1 627 1 2 1 1 56 CYS H A 91 . HN 1 1 628 1 1 1 1 57 LYS H A 92 . HN 1 1 628 1 2 1 1 57 LYS HG3 A 92 . HG2 1 1 629 1 1 1 1 57 LYS H A 92 . HN 1 1 629 1 2 1 1 57 LYS HG2 A 92 . HG1 1 1 630 1 1 1 1 57 LYS H A 92 . HN 1 1 630 1 2 1 1 57 LYS HD3 A 92 . HD2 1 1 631 1 1 1 1 57 LYS H A 92 . HN 1 1 631 1 2 1 1 57 LYS HB2 A 92 . HB2 1 1 632 1 1 1 1 59 HIS H A 94 . HN 1 1 632 1 2 1 1 60 PHE HB3 A 95 . HB2 1 1 633 1 1 1 1 59 HIS H A 94 . HN 1 1 633 1 2 1 1 59 HIS HB2 A 94 . HB2 1 1 634 1 1 1 1 58 PRO HA A 93 . HA 1 1 634 1 2 1 1 59 HIS H A 94 . HN 1 1 635 1 1 1 1 59 HIS H A 94 . HN 1 1 635 1 2 1 1 59 HIS HD2 A 94 . HD2 1 1 636 1 1 1 1 59 HIS H A 94 . HN 1 1 636 1 2 1 1 60 PHE H A 95 . HN 1 1 637 1 1 1 1 56 CYS H A 91 . HN 1 1 637 1 2 1 1 59 HIS H A 94 . HN 1 1 638 1 1 1 1 56 CYS H A 91 . HN 1 1 638 1 2 1 1 60 PHE H A 95 . HN 1 1 639 1 1 1 1 60 PHE H A 95 . HN 1 1 639 1 2 1 1 61 GLN H A 96 . HN 1 1 640 1 1 1 1 60 PHE H A 95 . HN 1 1 640 1 2 1 1 60 PHE HD1 A 95 . HD1 1 1 641 1 1 1 1 55 TYR HA A 90 . HA 1 1 641 1 2 1 1 60 PHE H A 95 . HN 1 1 642 1 1 1 1 59 HIS HA A 94 . HA 1 1 642 1 2 1 1 60 PHE H A 95 . HN 1 1 643 1 1 1 1 58 PRO HA A 93 . HA 1 1 643 1 2 1 1 60 PHE H A 95 . HN 1 1 644 1 1 1 1 59 HIS HB2 A 94 . HB2 1 1 644 1 2 1 1 60 PHE H A 95 . HN 1 1 645 1 1 1 1 60 PHE H A 95 . HN 1 1 645 1 2 1 1 60 PHE HB2 A 95 . HB1 1 1 646 1 1 1 1 60 PHE H A 95 . HN 1 1 646 1 2 1 1 60 PHE HB3 A 95 . HB2 1 1 647 1 1 1 1 48 ALA MB A 83 . HB1 1 1 647 1 2 1 1 60 PHE H A 95 . HN 1 1 648 1 1 1 1 59 HIS HD2 A 94 . HD2 1 1 648 1 2 1 1 61 GLN H A 96 . HN 1 1 649 1 1 1 1 57 LYS HA A 92 . HA 1 1 649 1 2 1 1 61 GLN H A 96 . HN 1 1 650 1 1 1 1 61 GLN H A 96 . HN 1 1 650 1 2 1 1 61 GLN HA A 96 . HA 1 1 651 1 1 1 1 60 PHE HB3 A 95 . HB2 1 1 651 1 2 1 1 61 GLN H A 96 . HN 1 1 652 1 1 1 1 60 PHE HB2 A 95 . HB1 1 1 652 1 2 1 1 61 GLN H A 96 . HN 1 1 653 1 1 1 1 61 GLN H A 96 . HN 1 1 653 1 2 1 1 61 GLN HB3 A 96 . HB2 1 1 654 1 1 1 1 61 GLN H A 96 . HN 1 1 654 1 2 1 1 62 GLN H A 97 . HN 1 1 655 1 1 1 1 62 GLN H A 97 . HN 1 1 655 1 2 1 1 62 GLN HG3 A 97 . HG2 1 1 656 1 1 1 1 62 GLN H A 97 . HN 1 1 656 1 2 1 1 62 GLN HB2 A 97 . HB2 1 1 657 1 1 1 1 62 GLN H A 97 . HN 1 1 657 1 2 1 1 62 GLN HG2 A 97 . HG1 1 1 658 1 1 1 1 58 PRO HB2 A 93 . HB1 1 1 658 1 2 1 1 62 GLN H A 97 . HN 1 1 659 1 1 1 1 62 GLN H A 97 . HN 1 1 659 1 2 1 1 63 LEU HB3 A 98 . HB2 1 1 660 1 1 1 1 63 LEU H A 98 . HN 1 1 660 1 2 1 1 64 PHE H A 99 . HN 1 1 661 1 1 1 1 55 TYR QE A 90 . HE1 1 1 661 1 2 1 1 63 LEU H A 98 . HN 1 1 662 1 1 1 1 62 GLN HA A 97 . HA 1 1 662 1 2 1 1 63 LEU H A 98 . HN 1 1 663 1 1 1 1 59 HIS HB3 A 94 . HB1 1 1 663 1 2 1 1 63 LEU H A 98 . HN 1 1 664 1 1 1 1 63 LEU H A 98 . HN 1 1 664 1 2 1 1 64 PHE HB2 A 99 . HB2 1 1 665 1 1 1 1 62 GLN HG3 A 97 . HG2 1 1 665 1 2 1 1 63 LEU H A 98 . HN 1 1 666 1 1 1 1 62 GLN HB3 A 97 . HB1 1 1 666 1 2 1 1 63 LEU H A 98 . HN 1 1 667 1 1 1 1 62 GLN HB2 A 97 . HB2 1 1 667 1 2 1 1 63 LEU H A 98 . HN 1 1 668 1 1 1 1 63 LEU H A 98 . HN 1 1 668 1 2 1 1 63 LEU MD1 A 98 . HD11 1 1 669 1 1 1 1 61 GLN H A 96 . HN 1 1 669 1 2 1 1 64 PHE H A 99 . HN 1 1 670 1 1 1 1 55 TYR QE A 90 . HE1 1 1 670 1 2 1 1 64 PHE H A 99 . HN 1 1 671 1 1 1 1 64 PHE H A 99 . HN 1 1 671 1 2 1 1 64 PHE HB3 A 99 . HB1 1 1 672 1 1 1 1 63 LEU HG A 98 . HG 1 1 672 1 2 1 1 64 PHE H A 99 . HN 1 1 673 1 1 1 1 63 LEU HB3 A 98 . HB2 1 1 673 1 2 1 1 64 PHE H A 99 . HN 1 1 674 1 1 1 1 63 LEU HB2 A 98 . HB1 1 1 674 1 2 1 1 64 PHE H A 99 . HN 1 1 675 1 1 1 1 63 LEU MD1 A 98 . HD11 1 1 675 1 2 1 1 64 PHE H A 99 . HN 1 1 676 1 1 1 1 55 TYR QE A 90 . HE1 1 1 676 1 2 1 1 65 LYS H A 100 . HN 1 1 677 1 1 1 1 65 LYS H A 100 . HN 1 1 677 1 2 1 1 65 LYS HA A 100 . HA 1 1 678 1 1 1 1 64 PHE HB2 A 99 . HB2 1 1 678 1 2 1 1 65 LYS H A 100 . HN 1 1 679 1 1 1 1 65 LYS H A 100 . HN 1 1 679 1 2 1 1 65 LYS HB2 A 100 . HB1 1 1 680 1 1 1 1 65 LYS H A 100 . HN 1 1 680 1 2 1 1 65 LYS HB3 A 100 . HB2 1 1 681 1 1 1 1 65 LYS H A 100 . HN 1 1 681 1 2 1 1 65 LYS HG2 A 100 . HG1 1 1 682 1 1 1 1 65 LYS H A 100 . HN 1 1 682 1 2 1 1 65 LYS HG3 A 100 . HG2 1 1 683 1 1 1 1 57 LYS H A 92 . HN 1 1 683 1 2 1 1 68 GLY H A 103 . HN 1 1 684 1 1 1 1 70 TYR H A 105 . HN 1 1 684 1 2 1 1 71 ASP HA A 106 . HA 1 1 685 1 1 1 1 70 TYR H A 105 . HN 1 1 685 1 2 1 1 70 TYR HB2 A 105 . HB1 1 1 686 1 1 1 1 70 TYR H A 105 . HN 1 1 686 1 2 1 1 70 TYR HB3 A 105 . HB2 1 1 687 1 1 1 1 71 ASP H A 106 . HN 1 1 687 1 2 1 1 71 ASP HA A 106 . HA 1 1 688 1 1 1 1 71 ASP H A 106 . HN 1 1 688 1 2 1 1 71 ASP HB2 A 106 . HB1 1 1 689 1 1 1 1 71 ASP H A 106 . HN 1 1 689 1 2 1 1 71 ASP HB3 A 106 . HB2 1 1 690 1 1 1 1 70 TYR HB2 A 105 . HB1 1 1 690 1 2 1 1 71 ASP H A 106 . HN 1 1 691 1 1 1 1 70 TYR HB3 A 105 . HB2 1 1 691 1 2 1 1 71 ASP H A 106 . HN 1 1 692 1 1 1 1 72 GLU H A 107 . HN 1 1 692 1 2 1 1 72 GLU HA A 107 . HA 1 1 693 1 1 1 1 71 ASP HA A 106 . HA 1 1 693 1 2 1 1 72 GLU H A 107 . HN 1 1 694 1 1 1 1 71 ASP HB2 A 106 . HB1 1 1 694 1 2 1 1 72 GLU H A 107 . HN 1 1 695 1 1 1 1 71 ASP HB3 A 106 . HB2 1 1 695 1 2 1 1 72 GLU H A 107 . HN 1 1 696 1 1 1 1 72 GLU H A 107 . HN 1 1 696 1 2 1 1 72 GLU HG3 A 107 . HG2 1 1 697 1 1 1 1 72 GLU H A 107 . HN 1 1 697 1 2 1 1 72 GLU HB2 A 107 . HB1 1 1 698 1 1 1 1 72 GLU H A 107 . HN 1 1 698 1 2 1 1 72 GLU HB3 A 107 . HB2 1 1 699 1 1 1 1 8 CYS H A 43 . HN 1 1 699 1 2 1 1 12 GLN HB3 A 47 . HB1 1 1 700 1 1 1 1 60 PHE QD A 95 . HD1 1 1 700 1 2 1 1 61 GLN H A 96 . HN 1 1 701 1 1 1 1 33 PHE H A 68 . HN 1 1 701 1 2 1 1 33 PHE HD1 A 68 . HD1 1 1 702 1 1 1 1 37 HIS H A 72 . HN 1 1 702 1 2 1 1 37 HIS HD2 A 72 . HD2 1 1 703 1 1 1 1 6 GLU HA A 41 . HA 1 1 703 1 2 1 1 6 GLU HG2 A 41 . HG2 1 1 704 1 1 1 1 7 THR HA A 42 . HA 1 1 704 1 2 1 1 7 THR MG A 42 . HG21 1 1 705 1 1 1 1 8 CYS HA A 43 . HA 1 1 705 1 2 1 1 8 CYS HB2 A 43 . HB1 1 1 706 1 1 1 1 9 ALA HA A 44 . HA 1 1 706 1 2 1 1 9 ALA MB A 44 . HB1 1 1 707 1 1 1 1 10 ALA HA A 45 . HA 1 1 707 1 2 1 1 10 ALA MB A 45 . HB1 1 1 708 1 1 1 1 12 GLN HA A 47 . HA 1 1 708 1 2 1 1 12 GLN HB3 A 47 . HB1 1 1 709 1 1 1 1 12 GLN HA A 47 . HA 1 1 709 1 2 1 1 12 GLN HG2 A 47 . HG2 1 1 710 1 1 1 1 12 GLN HA A 47 . HA 1 1 710 1 2 1 1 12 GLN HG3 A 47 . HG1 1 1 711 1 1 1 1 14 THR HA A 49 . HA 1 1 711 1 2 1 1 14 THR MG A 49 . HG21 1 1 712 1 1 1 1 14 THR HB A 49 . HB 1 1 712 1 2 1 1 14 THR MG A 49 . HG21 1 1 713 1 1 1 1 15 VAL HA A 50 . HA 1 1 713 1 2 1 1 15 VAL HB A 50 . HB 1 1 714 1 1 1 1 15 VAL HA A 50 . HA 1 1 714 1 2 1 1 15 VAL MG1 A 50 . HG11 1 1 715 1 1 1 1 15 VAL HA A 50 . HA 1 1 715 1 2 1 1 15 VAL MG2 A 50 . HG21 1 1 716 1 1 1 1 16 TYR HB3 A 51 . HB1 1 1 716 1 2 1 1 16 TYR HD1 A 51 . HD1 1 1 717 1 1 1 1 16 TYR HB2 A 51 . HB2 1 1 717 1 2 1 1 16 TYR HD1 A 51 . HD1 1 1 718 1 1 1 1 18 MET HA A 53 . HA 1 1 718 1 2 1 1 18 MET HG2 A 53 . HG1 1 1 719 1 1 1 1 18 MET HA A 53 . HA 1 1 719 1 2 1 1 18 MET HB2 A 53 . HB2 1 1 720 1 1 1 1 19 GLU HA A 54 . HA 1 1 720 1 2 1 1 19 GLU HB2 A 54 . HB2 1 1 721 1 1 1 1 19 GLU HA A 54 . HA 1 1 721 1 2 1 1 19 GLU HG2 A 54 . HG2 1 1 722 1 1 1 1 21 LEU HA A 56 . HA 1 1 722 1 2 1 1 21 LEU HB2 A 56 . HB2 1 1 723 1 1 1 1 22 VAL HA A 57 . HA 1 1 723 1 2 1 1 22 VAL MG1 A 57 . HG11 1 1 724 1 1 1 1 24 ASP HA A 59 . HA 1 1 724 1 2 1 1 24 ASP HB3 A 59 . HB1 1 1 725 1 1 1 1 26 LEU HA A 61 . HA 1 1 725 1 2 1 1 26 LEU HB2 A 61 . HB2 1 1 726 1 1 1 1 26 LEU HB2 A 61 . HB2 1 1 726 1 2 1 1 26 LEU MD1 A 61 . HD11 1 1 727 1 1 1 1 27 ILE HA A 62 . HA 1 1 727 1 2 1 1 27 ILE HB A 62 . HB 1 1 728 1 1 1 1 27 ILE HA A 62 . HA 1 1 728 1 2 1 1 27 ILE MD A 62 . HD11 1 1 729 1 1 1 1 27 ILE MD A 62 . HD11 1 1 729 1 2 1 1 27 ILE HG13 A 62 . HG12 1 1 730 1 1 1 1 27 ILE HG13 A 62 . HG12 1 1 730 1 2 1 1 27 ILE MG A 62 . HG21 1 1 731 1 1 1 1 28 PHE HB2 A 63 . HB2 1 1 731 1 2 1 1 28 PHE HD1 A 63 . HD1 1 1 732 1 1 1 1 28 PHE HB3 A 63 . HB1 1 1 732 1 2 1 1 28 PHE HD1 A 63 . HD1 1 1 733 1 1 1 1 29 HIS HB2 A 64 . HB2 1 1 733 1 2 1 1 29 HIS HD2 A 64 . HD2 1 1 734 1 1 1 1 29 HIS HB3 A 64 . HB1 1 1 734 1 2 1 1 29 HIS HD2 A 64 . HD2 1 1 735 1 1 1 1 30 ASN HA A 65 . HA 1 1 735 1 2 1 1 30 ASN HB2 A 65 . HB1 1 1 736 1 1 1 1 31 SER HA A 66 . HA 1 1 736 1 2 1 1 31 SER HB3 A 66 . HB2 1 1 737 1 1 1 1 31 SER HA A 66 . HA 1 1 737 1 2 1 1 31 SER HB2 A 66 . HB1 1 1 738 1 1 1 1 32 CYS HA A 67 . HA 1 1 738 1 2 1 1 32 CYS HB3 A 67 . HB1 1 1 739 1 1 1 1 33 PHE HA A 68 . HA 1 1 739 1 2 1 1 33 PHE HB3 A 68 . HB1 1 1 740 1 1 1 1 33 PHE HB2 A 68 . HB2 1 1 740 1 2 1 1 33 PHE HD1 A 68 . HD1 1 1 741 1 1 1 1 36 LYS HD2 A 71 . HD2 1 1 741 1 2 1 1 36 LYS HE2 A 71 . HE2 1 1 742 1 1 1 1 36 LYS HD3 A 71 . HD1 1 1 742 1 2 1 1 36 LYS HE2 A 71 . HE2 1 1 743 1 1 1 1 36 LYS HE2 A 71 . HE2 1 1 743 1 2 1 1 36 LYS HG2 A 71 . HG2 1 1 744 1 1 1 1 36 LYS HE2 A 71 . HE2 1 1 744 1 2 1 1 36 LYS HG3 A 71 . HG1 1 1 745 1 1 1 1 39 HIS HB2 A 74 . HB2 1 1 745 1 2 1 1 39 HIS HD2 A 74 . HD2 1 1 746 1 1 1 1 42 LEU HA A 77 . HA 1 1 746 1 2 1 1 42 LEU QD A 77 . HD11 1 1 747 1 1 1 1 43 SER HA A 78 . HA 1 1 747 1 2 1 1 43 SER HB2 A 78 . HB2 1 1 748 1 1 1 1 43 SER HA A 78 . HA 1 1 748 1 2 1 1 43 SER HB3 A 78 . HB1 1 1 749 1 1 1 1 44 LEU HA A 79 . HA 1 1 749 1 2 1 1 44 LEU MD1 A 79 . HD11 1 1 750 1 1 1 1 46 SER HA A 81 . HA 1 1 750 1 2 1 1 46 SER HB3 A 81 . HB1 1 1 751 1 1 1 1 46 SER HA A 81 . HA 1 1 751 1 2 1 1 46 SER HB2 A 81 . HB2 1 1 752 1 1 1 1 47 TYR HB2 A 82 . HB2 1 1 752 1 2 1 1 47 TYR HD1 A 82 . HD1 1 1 753 1 1 1 1 48 ALA HA A 83 . HA 1 1 753 1 2 1 1 48 ALA MB A 83 . HB1 1 1 754 1 1 1 1 50 LEU HA A 85 . HA 1 1 754 1 2 1 1 50 LEU MD1 A 85 . HD11 1 1 755 1 1 1 1 50 LEU MD2 A 85 . HD21 1 1 755 1 2 1 1 50 LEU HG A 85 . HG 1 1 756 1 1 1 1 51 HIS HB2 A 86 . HB2 1 1 756 1 2 1 1 51 HIS HD2 A 86 . HD2 1 1 757 1 1 1 1 50 LEU MD1 A 85 . HD11 1 1 757 1 2 1 1 51 HIS HE1 A 86 . HE1 1 1 758 1 1 1 1 50 LEU MD2 A 85 . HD21 1 1 758 1 2 1 1 51 HIS HE1 A 86 . HE1 1 1 759 1 1 1 1 54 PHE HA A 89 . HA 1 1 759 1 2 1 1 54 PHE HB2 A 89 . HB2 1 1 760 1 1 1 1 54 PHE HA A 89 . HA 1 1 760 1 2 1 1 54 PHE HB3 A 89 . HB1 1 1 761 1 1 1 1 54 PHE HB3 A 89 . HB1 1 1 761 1 2 1 1 54 PHE HD1 A 89 . HD1 1 1 762 1 1 1 1 55 TYR HB3 A 90 . HB2 1 1 762 1 2 1 1 55 TYR HD1 A 90 . HD1 1 1 763 1 1 1 1 57 LYS HA A 92 . HA 1 1 763 1 2 1 1 57 LYS HB2 A 92 . HB2 1 1 764 1 1 1 1 60 PHE HB2 A 95 . HB1 1 1 764 1 2 1 1 60 PHE HD1 A 95 . HD1 1 1 765 1 1 1 1 60 PHE HB3 A 95 . HB2 1 1 765 1 2 1 1 60 PHE HD1 A 95 . HD1 1 1 766 1 1 1 1 62 GLN HA A 97 . HA 1 1 766 1 2 1 1 62 GLN HB2 A 97 . HB2 1 1 767 1 1 1 1 62 GLN HA A 97 . HA 1 1 767 1 2 1 1 62 GLN HG2 A 97 . HG1 1 1 768 1 1 1 1 63 LEU MD1 A 98 . HD11 1 1 768 1 2 1 1 63 LEU MD2 A 98 . HD21 1 1 769 1 1 1 1 64 PHE HA A 99 . HA 1 1 769 1 2 1 1 64 PHE HB2 A 99 . HB2 1 1 770 1 1 1 1 64 PHE HB2 A 99 . HB2 1 1 770 1 2 1 1 64 PHE HD1 A 99 . HD1 1 1 771 1 1 1 1 49 ALA MB A 84 . HB1 1 1 771 1 2 1 1 54 PHE QD A 89 . HD1 1 1 772 1 1 1 1 49 ALA MB A 84 . HB1 1 1 772 1 2 1 1 54 PHE QE A 89 . HE1 1 1 773 1 1 1 1 15 VAL MG2 A 50 . HG21 1 1 773 1 2 1 1 29 HIS HE1 A 64 . HE1 1 1 774 1 1 1 1 9 ALA MB A 44 . HB1 1 1 774 1 2 1 1 54 PHE HZ A 89 . HZ 1 1 775 1 1 1 1 60 PHE QE A 95 . HE1 1 1 775 1 2 1 1 64 PHE QD A 99 . HD1 1 1 776 1 1 1 1 60 PHE QD A 95 . HD1 1 1 776 1 2 1 1 64 PHE QD A 99 . HD1 1 1 777 1 1 1 1 28 PHE HZ A 63 . HZ 1 1 777 1 2 1 1 54 PHE QE A 89 . HE1 1 1 778 1 1 1 1 28 PHE HZ A 63 . HZ 1 1 778 1 2 1 1 54 PHE QD A 89 . HD1 1 1 779 1 1 1 1 55 TYR QD A 90 . HD1 1 1 779 1 2 1 1 60 PHE QD A 95 . HD1 1 1 780 1 1 1 1 55 TYR HA A 90 . HA 1 1 780 1 2 1 1 55 TYR QD A 90 . HD1 1 1 781 1 1 1 1 33 PHE QE A 68 . HE1 1 1 781 1 2 1 1 47 TYR QD A 82 . HD1 1 1 782 1 1 1 1 28 PHE QE A 63 . HE1 1 1 782 1 2 1 1 33 PHE QE A 68 . HE1 1 1 783 1 1 1 1 28 PHE QD A 63 . HD1 1 1 783 1 2 1 1 33 PHE QD A 68 . HD1 1 1 784 1 1 1 1 28 PHE QE A 63 . HE1 1 1 784 1 2 1 1 33 PHE QD A 68 . HD1 1 1 785 1 1 1 1 44 LEU HA A 79 . HA 1 1 785 1 2 1 1 47 TYR QE A 82 . HE1 1 1 786 1 1 1 1 47 TYR QD A 82 . HD1 1 1 786 1 2 1 1 48 ALA HA A 83 . HA 1 1 787 1 1 1 1 64 PHE HA A 99 . HA 1 1 787 1 2 1 1 64 PHE QD A 99 . HD1 1 1 788 1 1 1 1 59 HIS HA A 94 . HA 1 1 788 1 2 1 1 59 HIS HD2 A 94 . HD2 1 1 789 1 1 1 1 14 THR HB A 49 . HB 1 1 789 1 2 1 1 16 TYR QE A 51 . HE1 1 1 790 1 1 1 1 8 CYS HB3 A 43 . HB2 1 1 790 1 2 1 1 29 HIS HE1 A 64 . HE1 1 1 791 1 1 1 1 47 TYR HB2 A 82 . HB2 1 1 791 1 2 1 1 47 TYR QD A 82 . HD1 1 1 792 1 1 1 1 55 TYR HB2 A 90 . HB1 1 1 792 1 2 1 1 55 TYR QD A 90 . HD1 1 1 793 1 1 1 1 26 LEU HB2 A 61 . HB2 1 1 793 1 2 1 1 28 PHE QE A 63 . HE1 1 1 794 1 1 1 1 53 GLU HB2 A 88 . HB2 1 1 794 1 2 1 1 55 TYR QD A 90 . HD1 1 1 795 1 1 1 1 8 CYS HB2 A 43 . HB1 1 1 795 1 2 1 1 29 HIS HE1 A 64 . HE1 1 1 796 1 1 1 1 59 HIS HD2 A 94 . HD2 1 1 796 1 2 1 1 62 GLN HB2 A 97 . HB2 1 1 797 1 1 1 1 36 LYS HB3 A 71 . HB2 1 1 797 1 2 1 1 55 TYR QE A 90 . HE1 1 1 798 1 1 1 1 10 ALA MB A 45 . HB1 1 1 798 1 2 1 1 28 PHE QD A 63 . HD1 1 1 799 1 1 1 1 10 ALA MB A 45 . HB1 1 1 799 1 2 1 1 28 PHE QE A 63 . HE1 1 1 800 1 1 1 1 10 ALA MB A 45 . HB1 1 1 800 1 2 1 1 54 PHE QD A 89 . HD1 1 1 801 1 1 1 1 50 LEU HB2 A 85 . HB2 1 1 801 1 2 1 1 64 PHE QD A 99 . HD1 1 1 802 1 1 1 1 50 LEU HB2 A 85 . HB2 1 1 802 1 2 1 1 60 PHE QE A 95 . HE1 1 1 803 1 1 1 1 50 LEU HB3 A 85 . HB1 1 1 803 1 2 1 1 60 PHE QE A 95 . HE1 1 1 804 1 1 1 1 50 LEU HB3 A 85 . HB1 1 1 804 1 2 1 1 64 PHE QD A 99 . HD1 1 1 805 1 1 1 1 36 LYS HB2 A 71 . HB1 1 1 805 1 2 1 1 55 TYR QE A 90 . HE1 1 1 806 1 1 1 1 26 LEU MD1 A 61 . HD11 1 1 806 1 2 1 1 28 PHE QE A 63 . HE1 1 1 807 1 1 1 1 47 TYR QE A 82 . HE1 1 1 807 1 2 1 1 49 ALA MB A 84 . HB1 1 1 808 1 1 1 1 44 LEU MD1 A 79 . HD11 1 1 808 1 2 1 1 47 TYR QE A 82 . HE1 1 1 809 1 1 1 1 26 LEU MD1 A 61 . HD11 1 1 809 1 2 1 1 54 PHE QE A 89 . HE1 1 1 810 1 1 1 1 44 LEU MD2 A 79 . HD21 1 1 810 1 2 1 1 47 TYR QE A 82 . HE1 1 1 811 1 1 1 1 50 LEU HG A 85 . HG 1 1 811 1 2 1 1 51 HIS HD2 A 86 . HD2 1 1 812 1 1 1 1 9 ALA MB A 44 . HB1 1 1 812 1 2 1 1 28 PHE QE A 63 . HE1 1 1 813 1 1 1 1 26 LEU HB3 A 61 . HB1 1 1 813 1 2 1 1 28 PHE QD A 63 . HD1 1 1 814 1 1 1 1 9 ALA MB A 44 . HB1 1 1 814 1 2 1 1 28 PHE QD A 63 . HD1 1 1 815 1 1 1 1 14 THR MG A 49 . HG21 1 1 815 1 2 1 1 16 TYR QE A 51 . HE1 1 1 816 1 1 1 1 14 THR MG A 49 . HG21 1 1 816 1 2 1 1 16 TYR QD A 51 . HD1 1 1 817 1 1 1 1 50 LEU MD1 A 85 . HD11 1 1 817 1 2 1 1 60 PHE QE A 95 . HE1 1 1 818 1 1 1 1 50 LEU MD1 A 85 . HD11 1 1 818 1 2 1 1 51 HIS HD2 A 86 . HD2 1 1 819 1 1 1 1 23 ALA MB A 58 . HB1 1 1 819 1 2 1 1 28 PHE QE A 63 . HE1 1 1 820 1 1 1 1 48 ALA MB A 83 . HB1 1 1 820 1 2 1 1 60 PHE QD A 95 . HD1 1 1 821 1 1 1 1 23 ALA MB A 58 . HB1 1 1 821 1 2 1 1 47 TYR QE A 82 . HE1 1 1 822 1 1 1 1 48 ALA MB A 83 . HB1 1 1 822 1 2 1 1 60 PHE QE A 95 . HE1 1 1 823 1 1 1 1 23 ALA MB A 58 . HB1 1 1 823 1 2 1 1 54 PHE QE A 89 . HE1 1 1 824 1 1 1 1 55 TYR QE A 90 . HE1 1 1 824 1 2 1 1 63 LEU HB2 A 98 . HB1 1 1 825 1 1 1 1 21 LEU MD2 A 56 . HD21 1 1 825 1 2 1 1 28 PHE QD A 63 . HD1 1 1 826 1 1 1 1 55 TYR QE A 90 . HE1 1 1 826 1 2 1 1 63 LEU MD1 A 98 . HD11 1 1 827 1 1 1 1 50 LEU MD2 A 85 . HD21 1 1 827 1 2 1 1 64 PHE QD A 99 . HD1 1 1 828 1 1 1 1 50 LEU MD2 A 85 . HD21 1 1 828 1 2 1 1 60 PHE QE A 95 . HE1 1 1 829 1 1 1 1 50 LEU MD2 A 85 . HD21 1 1 829 1 2 1 1 51 HIS HD2 A 86 . HD2 1 1 830 1 1 1 1 37 HIS HD2 A 72 . HD2 1 1 830 1 2 1 1 59 HIS HE1 A 94 . HE1 1 1 831 1 1 1 1 38 CYS HA A 73 . HA 1 1 831 1 2 1 1 59 HIS HE1 A 94 . HE1 1 1 832 1 1 1 1 19 GLU HB2 A 54 . HB2 1 1 832 1 2 1 1 29 HIS HD2 A 64 . HD2 1 1 833 1 1 1 1 19 GLU HB3 A 54 . HB1 1 1 833 1 2 1 1 29 HIS HD2 A 64 . HD2 1 1 834 1 1 1 1 15 VAL MG1 A 50 . HG11 1 1 834 1 2 1 1 29 HIS HD2 A 64 . HD2 1 1 835 1 1 1 1 37 HIS HE1 A 72 . HE1 1 1 835 1 2 1 1 63 LEU MD2 A 98 . HD21 1 1 836 1 1 1 1 37 HIS HE1 A 72 . HE1 1 1 836 1 2 1 1 63 LEU MD1 A 98 . HD11 1 1 837 1 1 1 1 26 LEU MD1 A 61 . HD11 1 1 837 1 2 1 1 28 PHE HZ A 63 . HZ 1 1 838 1 1 1 1 33 PHE HZ A 68 . HZ 1 1 838 1 2 1 1 47 TYR QE A 82 . HE1 1 1 839 1 1 1 1 47 TYR HA A 82 . HA 1 1 839 1 2 1 1 56 CYS HA A 91 . HA 1 1 840 1 1 1 1 33 PHE HB3 A 68 . HB1 1 1 840 1 2 1 1 33 PHE QD A 68 . HD1 1 1 841 1 1 1 1 33 PHE HZ A 68 . HZ 1 1 841 1 2 1 1 44 LEU MD2 A 79 . HD21 1 1 842 1 1 1 1 33 PHE QE A 68 . HE1 1 1 842 1 2 1 1 44 LEU MD2 A 79 . HD21 1 1 843 1 1 1 1 42 LEU QD A 77 . HD21 1 1 843 1 2 1 1 47 TYR HA A 82 . HA 1 1 844 1 1 1 1 21 LEU MD1 A 56 . HD11 1 1 844 1 2 1 1 33 PHE QE A 68 . HE1 1 1 845 1 1 1 1 23 ALA MB A 58 . HB1 1 1 845 1 2 1 1 33 PHE QE A 68 . HE1 1 1 846 1 1 1 1 23 ALA MB A 58 . HB1 1 1 846 1 2 1 1 33 PHE HZ A 68 . HZ 1 1 847 1 1 1 1 21 LEU MD2 A 56 . HD21 1 1 847 1 2 1 1 33 PHE QE A 68 . HE1 1 1 848 1 1 1 1 15 VAL MG2 A 50 . HG21 1 1 848 1 2 1 1 28 PHE HA A 63 . HA 1 1 849 1 1 1 1 10 ALA HA A 45 . HA 1 1 849 1 2 1 1 54 PHE QE A 89 . HE1 1 1 850 1 1 1 1 54 PHE HA A 89 . HA 1 1 850 1 2 1 1 54 PHE QD A 89 . HD1 1 1 851 1 1 1 1 33 PHE QE A 68 . HE1 1 1 851 1 2 1 1 43 SER HA A 78 . HA 1 1 852 1 1 1 1 33 PHE QD A 68 . HD1 1 1 852 1 2 1 1 43 SER HA A 78 . HA 1 1 853 1 1 1 1 49 ALA HA A 84 . HA 1 1 853 1 2 1 1 54 PHE HA A 89 . HA 1 1 854 1 1 1 1 22 VAL HA A 57 . HA 1 1 854 1 2 1 1 27 ILE HA A 62 . HA 1 1 855 1 1 1 1 22 VAL HA A 57 . HA 1 1 855 1 2 1 1 22 VAL HB A 57 . HB 1 1 856 1 1 1 1 49 ALA MB A 84 . HB1 1 1 856 1 2 1 1 54 PHE HA A 89 . HA 1 1 857 1 1 1 1 34 CYS HA A 69 . HA 1 1 857 1 2 1 1 42 LEU HG A 77 . HG 1 1 858 1 1 1 1 22 VAL HA A 57 . HA 1 1 858 1 2 1 1 22 VAL MG2 A 57 . HG21 1 1 859 1 1 1 1 22 VAL HA A 57 . HA 1 1 859 1 2 1 1 27 ILE MD A 62 . HD11 1 1 860 1 1 1 1 34 CYS HA A 69 . HA 1 1 860 1 2 1 1 42 LEU QD A 77 . HD11 1 1 861 1 1 1 1 44 LEU HA A 79 . HA 1 1 861 1 2 1 1 47 TYR QD A 82 . HD1 1 1 862 1 1 1 1 8 CYS HA A 43 . HA 1 1 862 1 2 1 1 28 PHE HA A 63 . HA 1 1 863 1 1 1 1 35 CYS HA A 70 . HA 1 1 863 1 2 1 1 55 TYR HA A 90 . HA 1 1 864 1 1 1 1 7 THR HA A 42 . HA 1 1 864 1 2 1 1 14 THR HA A 49 . HA 1 1 865 1 1 1 1 12 GLN HA A 47 . HA 1 1 865 1 2 1 1 12 GLN HB2 A 47 . HB2 1 1 866 1 1 1 1 17 PRO HA A 52 . HA 1 1 866 1 2 1 1 17 PRO HB3 A 52 . HB2 1 1 867 1 1 1 1 34 CYS HB2 A 69 . HB1 1 1 867 1 2 1 1 39 HIS HA A 74 . HA 1 1 868 1 1 1 1 19 GLU HA A 54 . HA 1 1 868 1 2 1 1 19 GLU HG3 A 54 . HG1 1 1 869 1 1 1 1 53 GLU HA A 88 . HA 1 1 869 1 2 1 1 53 GLU HB2 A 88 . HB2 1 1 870 1 1 1 1 57 LYS HA A 92 . HA 1 1 870 1 2 1 1 57 LYS QB A 92 . HB1 1 1 871 1 1 1 1 36 LYS HA A 71 . HA 1 1 871 1 2 1 1 36 LYS HD2 A 71 . HD2 1 1 872 1 1 1 1 57 LYS HA A 92 . HA 1 1 872 1 2 1 1 57 LYS HG2 A 92 . HG1 1 1 873 1 1 1 1 7 THR HA A 42 . HA 1 1 873 1 2 1 1 14 THR MG A 49 . HG21 1 1 874 1 1 1 1 48 ALA MB A 83 . HB1 1 1 874 1 2 1 1 57 LYS HA A 92 . HA 1 1 875 1 1 1 1 21 LEU MD2 A 56 . HD21 1 1 875 1 2 1 1 30 ASN HA A 65 . HA 1 1 876 1 1 1 1 7 THR HA A 42 . HA 1 1 876 1 2 1 1 15 VAL MG2 A 50 . HG21 1 1 877 1 1 1 1 38 CYS HB2 A 73 . HB2 1 1 877 1 2 1 1 59 HIS HE1 A 94 . HE1 1 1 878 1 1 1 1 15 VAL HA A 50 . HA 1 1 878 1 2 1 1 29 HIS HD2 A 64 . HD2 1 1 879 1 1 1 1 55 TYR HB3 A 90 . HB2 1 1 879 1 2 1 1 55 TYR QD A 90 . HD1 1 1 880 1 1 1 1 60 PHE HA A 95 . HA 1 1 880 1 2 1 1 60 PHE QD A 95 . HD1 1 1 881 1 1 1 1 60 PHE HA A 95 . HA 1 1 881 1 2 1 1 64 PHE QD A 99 . HD1 1 1 882 1 1 1 1 39 HIS HA A 74 . HA 1 1 882 1 2 1 1 39 HIS QB A 74 . HB1 1 1 883 1 1 1 1 14 THR HA A 49 . HA 1 1 883 1 2 1 1 14 THR HB A 49 . HB 1 1 884 1 1 1 1 62 GLN HA A 97 . HA 1 1 884 1 2 1 1 62 GLN HG3 A 97 . HG2 1 1 885 1 1 1 1 61 GLN HA A 96 . HA 1 1 885 1 2 1 1 61 GLN HB3 A 96 . HB2 1 1 886 1 1 1 1 57 LYS QB A 92 . HB1 1 1 886 1 2 1 1 58 PRO HD3 A 93 . HD1 1 1 887 1 1 1 1 25 LYS HA A 60 . HA 1 1 887 1 2 1 1 25 LYS HB3 A 60 . HB1 1 1 888 1 1 1 1 25 LYS HA A 60 . HA 1 1 888 1 2 1 1 25 LYS HB2 A 60 . HB2 1 1 889 1 1 1 1 10 ALA MB A 45 . HB1 1 1 889 1 2 1 1 32 CYS HB2 A 67 . HB2 1 1 890 1 1 1 1 25 LYS HA A 60 . HA 1 1 890 1 2 1 1 25 LYS HG2 A 60 . HG2 1 1 891 1 1 1 1 25 LYS HA A 60 . HA 1 1 891 1 2 1 1 25 LYS HG3 A 60 . HG1 1 1 892 1 1 1 1 35 CYS HB2 A 70 . HB2 1 1 892 1 2 1 1 40 THR MG A 75 . HG21 1 1 893 1 1 1 1 7 THR HB A 42 . HB 1 1 893 1 2 1 1 7 THR MG A 42 . HG21 1 1 894 1 1 1 1 15 VAL MG1 A 50 . HG11 1 1 894 1 2 1 1 20 ARG HA A 55 . HA 1 1 895 1 1 1 1 54 PHE HB2 A 89 . HB2 1 1 895 1 2 1 1 54 PHE QD A 89 . HD1 1 1 896 1 1 1 1 47 TYR HB3 A 82 . HB1 1 1 896 1 2 1 1 47 TYR QD A 82 . HD1 1 1 897 1 1 1 1 55 TYR QD A 90 . HD1 1 1 897 1 2 1 1 59 HIS HB3 A 94 . HB1 1 1 898 1 1 1 1 59 HIS HB3 A 94 . HB1 1 1 898 1 2 1 1 59 HIS HD2 A 94 . HD2 1 1 899 1 1 1 1 51 HIS QB A 86 . HB1 1 1 899 1 2 1 1 51 HIS HD2 A 86 . HD2 1 1 900 1 1 1 1 60 PHE HB3 A 95 . HB2 1 1 900 1 2 1 1 60 PHE QD A 95 . HD1 1 1 901 1 1 1 1 60 PHE HB2 A 95 . HB1 1 1 901 1 2 1 1 60 PHE QD A 95 . HD1 1 1 902 1 1 1 1 64 PHE HB2 A 99 . HB2 1 1 902 1 2 1 1 64 PHE QD A 99 . HD1 1 1 903 1 1 1 1 55 TYR QE A 90 . HE1 1 1 903 1 2 1 1 59 HIS HB3 A 94 . HB1 1 1 904 1 1 1 1 28 PHE HB2 A 63 . HB2 1 1 904 1 2 1 1 28 PHE QD A 63 . HD1 1 1 905 1 1 1 1 33 PHE HB2 A 68 . HB2 1 1 905 1 2 1 1 33 PHE QD A 68 . HD1 1 1 906 1 1 1 1 37 HIS HD2 A 72 . HD2 1 1 906 1 2 1 1 38 CYS HB3 A 73 . HB1 1 1 907 1 1 1 1 37 HIS QB A 72 . HB1 1 1 907 1 2 1 1 37 HIS HD2 A 72 . HD2 1 1 908 1 1 1 1 51 HIS HA A 86 . HA 1 1 908 1 2 1 1 51 HIS QB A 86 . HB1 1 1 909 1 1 1 1 37 HIS HA A 72 . HA 1 1 909 1 2 1 1 37 HIS QB A 72 . HB1 1 1 910 1 1 1 1 59 HIS HA A 94 . HA 1 1 910 1 2 1 1 59 HIS HB3 A 94 . HB1 1 1 911 1 1 1 1 35 CYS HA A 70 . HA 1 1 911 1 2 1 1 35 CYS HB3 A 70 . HB1 1 1 912 1 1 1 1 24 ASP HA A 59 . HA 1 1 912 1 2 1 1 24 ASP HB2 A 59 . HB2 1 1 913 1 1 1 1 33 PHE HA A 68 . HA 1 1 913 1 2 1 1 33 PHE HB2 A 68 . HB2 1 1 914 1 1 1 1 57 LYS HA A 92 . HA 1 1 914 1 2 1 1 60 PHE HB3 A 95 . HB2 1 1 915 1 1 1 1 57 LYS HA A 92 . HA 1 1 915 1 2 1 1 60 PHE HB2 A 95 . HB1 1 1 916 1 1 1 1 36 LYS QE A 71 . HE1 1 1 916 1 2 1 1 36 LYS HG3 A 71 . HG1 1 1 917 1 1 1 1 36 LYS QE A 71 . HE1 1 1 917 1 2 1 1 36 LYS HG2 A 71 . HG2 1 1 918 1 1 1 1 36 LYS HD2 A 71 . HD2 1 1 918 1 2 1 1 36 LYS QE A 71 . HE1 1 1 919 1 1 1 1 36 LYS HD3 A 71 . HD1 1 1 919 1 2 1 1 36 LYS QE A 71 . HE1 1 1 920 1 1 1 1 48 ALA MB A 83 . HB1 1 1 920 1 2 1 1 60 PHE HB2 A 95 . HB1 1 1 921 1 1 1 1 48 ALA MB A 83 . HB1 1 1 921 1 2 1 1 60 PHE HB3 A 95 . HB2 1 1 922 1 1 1 1 42 LEU QD A 77 . HD11 1 1 922 1 2 1 1 47 TYR HB2 A 82 . HB2 1 1 923 1 1 1 1 42 LEU QD A 77 . HD11 1 1 923 1 2 1 1 54 PHE HB2 A 89 . HB2 1 1 924 1 1 1 1 54 PHE HB3 A 89 . HB1 1 1 924 1 2 1 1 54 PHE QD A 89 . HD1 1 1 925 1 1 1 1 64 PHE HB3 A 99 . HB1 1 1 925 1 2 1 1 64 PHE QD A 99 . HD1 1 1 926 1 1 1 1 53 GLU HB2 A 88 . HB2 1 1 926 1 2 1 1 55 TYR QE A 90 . HE1 1 1 927 1 1 1 1 28 PHE HB3 A 63 . HB1 1 1 927 1 2 1 1 28 PHE QD A 63 . HD1 1 1 928 1 1 1 1 28 PHE HA A 63 . HA 1 1 928 1 2 1 1 28 PHE HB3 A 63 . HB1 1 1 929 1 1 1 1 18 MET HA A 53 . HA 1 1 929 1 2 1 1 18 MET QB A 53 . HB1 1 1 930 1 1 1 1 18 MET QB A 53 . HB1 1 1 930 1 2 1 1 18 MET HG3 A 53 . HG2 1 1 931 1 1 1 1 18 MET QB A 53 . HB1 1 1 931 1 2 1 1 18 MET HG2 A 53 . HG1 1 1 932 1 1 1 1 53 GLU HB3 A 88 . HB1 1 1 932 1 2 1 1 55 TYR QE A 90 . HE1 1 1 933 1 1 1 1 50 LEU HA A 85 . HA 1 1 933 1 2 1 1 50 LEU HB2 A 85 . HB2 1 1 934 1 1 1 1 10 ALA MB A 45 . HB1 1 1 934 1 2 1 1 28 PHE HB2 A 63 . HB2 1 1 935 1 1 1 1 10 ALA MB A 45 . HB1 1 1 935 1 2 1 1 33 PHE HB3 A 68 . HB1 1 1 936 1 1 1 1 27 ILE HB A 62 . HB 1 1 936 1 2 1 1 27 ILE HG13 A 62 . HG12 1 1 937 1 1 1 1 44 LEU HB3 A 79 . HB1 1 1 937 1 2 1 1 44 LEU MD1 A 79 . HD11 1 1 938 1 1 1 1 44 LEU HB3 A 79 . HB1 1 1 938 1 2 1 1 44 LEU MD2 A 79 . HD21 1 1 939 1 1 1 1 50 LEU HB2 A 85 . HB2 1 1 939 1 2 1 1 50 LEU HG A 85 . HG 1 1 940 1 1 1 1 50 LEU HB3 A 85 . HB1 1 1 940 1 2 1 1 50 LEU MD2 A 85 . HD21 1 1 941 1 1 1 1 50 LEU HB2 A 85 . HB2 1 1 941 1 2 1 1 50 LEU MD2 A 85 . HD21 1 1 942 1 1 1 1 26 LEU MD1 A 61 . HD11 1 1 942 1 2 1 1 54 PHE HZ A 89 . HZ 1 1 943 1 1 1 1 44 LEU MD2 A 79 . HD21 1 1 943 1 2 1 1 47 TYR QD A 82 . HD1 1 1 944 1 1 1 1 22 VAL MG2 A 57 . HG21 1 1 944 1 2 1 1 27 ILE HA A 62 . HA 1 1 945 1 1 1 1 40 THR HB A 75 . HB 1 1 945 1 2 1 1 40 THR MG A 75 . HG21 1 1 946 1 1 1 1 7 THR MG A 42 . HG21 1 1 946 1 2 1 1 14 THR HA A 49 . HA 1 1 947 1 1 1 1 63 LEU HA A 98 . HA 1 1 947 1 2 1 1 63 LEU HB3 A 98 . HB2 1 1 948 1 1 1 1 35 CYS HB3 A 70 . HB1 1 1 948 1 2 1 1 42 LEU QD A 77 . HD21 1 1 949 1 1 1 1 40 THR MG A 75 . HG21 1 1 949 1 2 1 1 56 CYS QB A 91 . HB1 1 1 950 1 1 1 1 35 CYS HB3 A 70 . HB1 1 1 950 1 2 1 1 40 THR MG A 75 . HG21 1 1 951 1 1 1 1 57 LYS QB A 92 . HB1 1 1 951 1 2 1 1 57 LYS HG2 A 92 . HG1 1 1 952 1 1 1 1 26 LEU MD1 A 61 . HD11 1 1 952 1 2 1 1 26 LEU HG A 61 . HG 1 1 953 1 1 1 1 44 LEU MD1 A 79 . HD11 1 1 953 1 2 1 1 44 LEU HG A 79 . HG 1 1 954 1 1 1 1 50 LEU HB2 A 85 . HB2 1 1 954 1 2 1 1 50 LEU MD1 A 85 . HD11 1 1 955 1 1 1 1 21 LEU HB2 A 56 . HB2 1 1 955 1 2 1 1 21 LEU MD1 A 56 . HD11 1 1 956 1 1 1 1 20 ARG HB3 A 55 . HB1 1 1 956 1 2 1 1 20 ARG HG3 A 55 . HG1 1 1 957 1 1 1 1 27 ILE HB A 62 . HB 1 1 957 1 2 1 1 27 ILE HG12 A 62 . HG11 1 1 958 1 1 1 1 27 ILE HG12 A 62 . HG11 1 1 958 1 2 1 1 27 ILE MG A 62 . HG21 1 1 959 1 1 1 1 21 LEU MD1 A 56 . HD11 1 1 959 1 2 1 1 21 LEU HG A 56 . HG 1 1 960 1 1 1 1 50 LEU HB3 A 85 . HB1 1 1 960 1 2 1 1 50 LEU HG A 85 . HG 1 1 961 1 1 1 1 27 ILE MD A 62 . HD11 1 1 961 1 2 1 1 27 ILE HG12 A 62 . HG11 1 1 962 1 1 1 1 21 LEU MD1 A 56 . HD11 1 1 962 1 2 1 1 44 LEU MD1 A 79 . HD11 1 1 963 1 1 1 1 50 LEU MD1 A 85 . HD11 1 1 963 1 2 1 1 50 LEU HG A 85 . HG 1 1 964 1 1 1 1 21 LEU MD1 A 56 . HD11 1 1 964 1 2 1 1 44 LEU MD2 A 79 . HD21 1 1 965 1 1 1 1 22 VAL MG1 A 57 . HG11 1 1 965 1 2 1 1 27 ILE MD A 62 . HD11 1 1 966 1 1 1 1 26 LEU MD1 A 61 . HD11 1 1 966 1 2 1 1 26 LEU MD2 A 61 . HD21 1 1 967 1 1 1 1 44 LEU MD1 A 79 . HD11 1 1 967 1 2 1 1 44 LEU MD2 A 79 . HD21 1 1 968 1 1 1 1 7 THR MG A 42 . HG21 1 1 968 1 2 1 1 14 THR MG A 49 . HG21 1 1 969 1 1 1 1 27 ILE MD A 62 . HD11 1 1 969 1 2 1 1 27 ILE MG A 62 . HG21 1 1 970 1 1 1 1 22 VAL MG2 A 57 . HG21 1 1 970 1 2 1 1 27 ILE MD A 62 . HD11 1 1 971 1 1 1 1 50 LEU MD1 A 85 . HD11 1 1 971 1 2 1 1 50 LEU MD2 A 85 . HD21 1 1 972 1 1 1 1 42 LEU HB3 A 77 . HB1 1 1 972 1 2 1 1 42 LEU QD A 77 . HD21 1 1 973 1 1 1 1 55 TYR QD A 90 . HD1 1 1 973 1 2 1 1 63 LEU MD1 A 98 . HD11 1 1 974 1 1 1 1 23 ALA HA A 58 . HA 1 1 974 1 2 1 1 23 ALA MB A 58 . HB1 1 1 975 1 1 1 1 63 LEU MD1 A 98 . HD11 1 1 975 1 2 1 1 63 LEU HG A 98 . HG 1 1 976 1 1 1 1 21 LEU MD2 A 56 . HD21 1 1 976 1 2 1 1 44 LEU MD2 A 79 . HD21 1 1 977 1 1 1 1 63 LEU HB3 A 98 . HB2 1 1 977 1 2 1 1 63 LEU MD1 A 98 . HD11 1 1 978 1 1 1 1 23 ALA MB A 58 . HB1 1 1 978 1 2 1 1 44 LEU MD2 A 79 . HD21 1 1 979 1 1 1 1 21 LEU MD1 A 56 . HD11 1 1 979 1 2 1 1 21 LEU MD2 A 56 . HD21 1 1 980 1 1 1 1 21 LEU MD2 A 56 . HD21 1 1 980 1 2 1 1 23 ALA MB A 58 . HB1 1 1 981 1 1 1 1 33 PHE QD A 68 . HD1 1 1 981 1 2 1 1 42 LEU QD A 77 . HD11 1 1 982 1 1 1 1 33 PHE QE A 68 . HE1 1 1 982 1 2 1 1 42 LEU QD A 77 . HD11 1 1 983 1 1 1 1 42 LEU QD A 77 . HD11 1 1 983 1 2 1 1 47 TYR HB3 A 82 . HB1 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 2.842 1.87 3.814 1 1 2 1 . . . . . 2.707 1.791 3.623 1 1 3 1 . . . . . 2.397 1.679 3.115 1 1 4 1 . . . . . 2.014 1.507 2.521 1 1 5 1 . . . . . 2.518 1.725 3.311 1 1 6 1 . . . . . 1.973 1.486 2.46 1 1 7 1 . . . . . 2.18 1.586 2.774 1 1 8 1 . . . . . 2.37 1.668 3.072 1 1 9 1 . . . . . 2.563 1.742 3.384 1 1 10 1 . . . . . 2.567 1.743 3.391 1 1 11 1 . . . . . 2.287 1.633 2.941 1 1 12 1 . . . . . 2.665 1.766 3.564 1 1 13 1 . . . . . 1.999 1.499 2.499 1 1 14 1 . . . . . 2.058 1.529 2.587 1 1 15 1 . . . . . 2.634 1.767 3.501 1 1 16 1 . . . . . 2.624 1.763 3.485 1 1 17 1 . . . . . 2.763 1.809 3.717 1 1 18 1 . . . . . 2.338 1.655 3.021 1 1 19 1 . . . . . 2.805 1.821 3.789 1 1 20 1 . . . . . 2.917 1.854 3.98 1 1 21 1 . . . . . 2.617 1.761 3.473 1 1 22 1 . . . . . 2.694 1.786 3.602 1 1 23 1 . . . . . 2.656 1.774 3.538 1 1 24 1 . . . . . 2.674 1.78 3.568 1 1 25 1 . . . . . 2.783 1.815 3.751 1 1 26 1 . . . . . 2.806 1.821 3.791 1 1 27 1 . . . . . 2.132 1.564 2.7 1 1 28 1 . . . . . 2.756 1.807 3.705 1 1 29 1 . . . . . 2.741 1.802 3.68 1 1 30 1 . . . . . 2.043 1.521 2.565 1 1 31 1 . . . . . 1.783 1.386 2.18 1 1 32 1 . . . . . 2.588 1.751 3.425 1 1 33 1 . . . . . 1.883 1.44 2.326 1 1 34 1 . . . . . 2.429 1.692 3.166 1 1 35 1 . . . . . 2.257 1.62 2.894 1 1 36 1 . . . . . 2.88 1.948 3.812 1 1 37 1 . . . . . 2.377 1.67 3.084 1 1 38 1 . . . . . 1.989 1.494 2.484 1 1 39 1 . . . . . 1.817 1.404 2.23 1 1 40 1 . . . . . 2.672 1.779 3.565 1 1 41 1 . . . . . 2.032 1.516 2.548 1 1 42 1 . . . . . 2.323 1.648 2.998 1 1 43 1 . . . . . 2.108 1.552 2.664 1 1 44 1 . . . . . 2.293 1.636 2.95 1 1 45 1 . . . . . 2.183 1.588 2.778 1 1 46 1 . . . . . 2.783 1.815 3.751 1 1 47 1 . . . . . 2.474 1.709 3.239 1 1 48 1 . . . . . 2.494 1.716 3.272 1 1 49 1 . . . . . 2.708 1.792 3.624 1 1 50 1 . . . . . 2.814 1.824 3.804 1 1 51 1 . . . . . 2.689 1.785 3.593 1 1 52 1 . . . . . 2.543 1.734 3.352 1 1 53 1 . . . . . 2.614 1.76 3.468 1 1 54 1 . . . . . 2.81 1.823 3.797 1 1 55 1 . . . . . 2.349 1.659 3.039 1 1 56 1 . . . . . 2.608 1.758 3.458 1 1 57 1 . . . . . 2.257 1.62 2.894 1 1 58 1 . . . . . 2.33 1.651 3.009 1 1 59 1 . . . . . 2.712 1.793 3.631 1 1 60 1 . . . . . 2.303 1.64 2.966 1 1 61 1 . . . . . 2.648 1.772 3.524 1 1 62 1 . . . . . 2.734 1.8 3.668 1 1 63 1 . . . . . 2.15 1.572 2.728 1 1 64 1 . . . . . 2.821 1.826 3.816 1 1 65 1 . . . . . 2.259 1.621 2.897 1 1 66 1 . . . . . 2.505 1.721 3.289 1 1 67 1 . . . . . 2.531 1.73 3.332 1 1 68 1 . . . . . 2.277 1.629 2.925 1 1 69 1 . . . . . 2.53 1.73 3.33 1 1 70 1 . . . . . 1.954 1.477 2.431 1 1 71 1 . . . . . 2.775 1.813 3.737 1 1 72 1 . . . . . 2.894 1.986 3.802 1 1 73 1 . . . . . 2.553 1.738 3.368 1 1 74 1 . . . . . 2.546 1.736 3.356 1 1 75 1 . . . . . 2.611 1.759 3.463 1 1 76 1 . . . . . 2.656 1.774 3.538 1 1 77 1 . . . . . 2.341 1.656 3.026 1 1 78 1 . . . . . 2.537 1.733 3.341 1 1 79 1 . . . . . 2.524 1.728 3.32 1 1 80 1 . . . . . 2.402 1.681 3.123 1 1 81 1 . . . . . 1.946 1.473 2.419 1 1 82 1 . . . . . 2.655 1.774 3.536 1 1 83 1 . . . . . 1.956 1.478 2.434 1 1 84 1 . . . . . 2.165 1.579 2.751 1 1 85 1 . . . . . 2.377 1.671 3.083 1 1 86 1 . . . . . 1.891 1.444 2.338 1 1 87 1 . . . . . 1.907 1.453 2.361 1 1 88 1 . . . . . 2.905 1.957 3.853 1 1 89 1 . . . . . 2.334 1.653 3.015 1 1 90 1 . . . . . 2.058 1.529 2.587 1 1 91 1 . . . . . 2.121 1.559 2.683 1 1 92 1 . . . . . 2.586 1.75 3.422 1 1 93 1 . . . . . 2.46 1.703 3.189 1 1 94 1 . . . . . 2.595 1.754 3.436 1 1 95 1 . . . . . 2.608 1.758 3.458 1 1 96 1 . . . . . 2.812 1.824 3.8 1 1 97 1 . . . . . 2.585 1.75 3.42 1 1 98 1 . . . . . 1.938 1.468 2.408 1 1 99 1 . . . . . 2.034 1.517 2.551 1 1 100 1 . . . . . 2.391 1.676 3.106 1 1 101 1 . . . . . 2.589 1.751 3.427 1 1 102 1 . . . . . 2.753 1.805 3.701 1 1 103 1 . . . . . 2.69 1.786 3.594 1 1 104 1 . . . . . 1.807 1.399 2.215 1 1 105 1 . . . . . 1.926 1.462 2.39 1 1 106 1 . . . . . 2.673 1.78 3.566 1 1 107 1 . . . . . 2.687 1.785 3.589 1 1 108 1 . . . . . 2.088 1.543 2.633 1 1 109 1 . . . . . 2.368 1.667 3.069 1 1 110 1 . . . . . 2.353 1.661 3.045 1 1 111 1 . . . . . 1.994 1.497 2.491 1 1 112 1 . . . . . 1.838 1.416 2.26 1 1 113 1 . . . . . 2.064 1.532 2.596 1 1 114 1 . . . . . 2.775 1.813 3.737 1 1 115 1 . . . . . 2.452 1.673 3.231 1 1 116 1 . . . . . 2.557 1.763 3.351 1 1 117 1 . . . . . 2.395 1.678 3.112 1 1 118 1 . . . . . 2.741 1.802 3.68 1 1 119 1 . . . . . 2.466 1.706 3.226 1 1 120 1 . . . . . 2.703 1.79 3.616 1 1 121 1 . . . . . 2.064 1.532 2.596 1 1 122 1 . . . . . 2.216 1.602 2.83 1 1 123 1 . . . . . 2.481 1.711 3.251 1 1 124 1 . . . . . 2.788 1.816 3.76 1 1 125 1 . . . . . 2.259 1.621 2.897 1 1 126 1 . . . . . 2.696 1.787 3.605 1 1 127 1 . . . . . 2.081 1.54 2.622 1 1 128 1 . . . . . 2.526 1.728 3.324 1 1 129 1 . . . . . 2.303 1.64 2.966 1 1 130 1 . . . . . 2.345 1.658 3.032 1 1 131 1 . . . . . 2.637 1.768 3.506 1 1 132 1 . . . . . 2.383 1.673 3.093 1 1 133 1 . . . . . 2.119 1.558 2.68 1 1 134 1 . . . . . 2.403 1.681 3.125 1 1 135 1 . . . . . 2.698 1.788 3.608 1 1 136 1 . . . . . 2.481 1.712 3.25 1 1 137 1 . . . . . 2.551 1.961 3.365 1 1 138 1 . . . . . 2.091 1.545 2.637 1 1 139 1 . . . . . 2.152 1.573 2.731 1 1 140 1 . . . . . 2.75 1.805 3.695 1 1 141 1 . . . . . 2.251 1.618 2.884 1 1 142 1 . . . . . 2.187 1.589 2.785 1 1 143 1 . . . . . 2.245 1.615 2.875 1 1 144 1 . . . . . 2.422 1.689 3.155 1 1 145 1 . . . . . 2.251 1.618 2.884 1 1 146 1 . . . . . 1.999 1.499 2.499 1 1 147 1 . . . . . 2.718 1.795 3.641 1 1 148 1 . . . . . 2.447 1.699 3.195 1 1 149 1 . . . . . 2.63 1.766 3.494 1 1 150 1 . . . . . 2.33 1.651 3.009 1 1 151 1 . . . . . 2.185 1.588 2.782 1 1 152 1 . . . . . 2.112 1.555 2.669 1 1 153 1 . . . . . 2.37 1.668 3.072 1 1 154 1 . . . . . 2.59 1.751 3.429 1 1 155 1 . . . . . 2.132 1.564 2.7 1 1 156 1 . . . . . 1.961 1.48 2.442 1 1 157 1 . . . . . 2.828 1.828 3.828 1 1 158 1 . . . . . 2.138 1.567 2.709 1 1 159 1 . . . . . 2.052 1.526 2.578 1 1 160 1 . . . . . 2.496 1.717 3.275 1 1 161 1 . . . . . 2.262 1.622 2.902 1 1 162 1 . . . . . 2.432 1.609 3.255 1 1 163 1 . . . . . 2.007 1.504 2.51 1 1 164 1 . . . . . 2.254 1.619 2.889 1 1 165 1 . . . . . 2.625 1.764 3.486 1 1 166 1 . . . . . 2.259 1.621 2.897 1 1 167 1 . . . . . 2.419 1.687 3.151 1 1 168 1 . . . . . . 1.816 2.525 1 1 169 1 . . . . . 1.94 1.469 2.411 1 1 170 1 . . . . . 1.934 1.67 2.401 1 1 171 1 . . . . . 2.504 1.978 3.288 1 1 172 1 . . . . . 2.812 1.824 3.8 1 1 173 1 . . . . . 2.486 1.713 3.259 1 1 174 1 . . . . . 2.237 1.611 2.863 1 1 175 1 . . . . . 2.221 1.604 2.838 1 1 176 1 . . . . . 2.638 1.755 3.521 1 1 177 1 . . . . . 2.007 1.504 2.51 1 1 178 1 . . . . . 1.901 1.449 2.353 1 1 179 1 . . . . . 2.165 1.579 2.751 1 1 180 1 . . . . . 2.134 1.565 2.703 1 1 181 1 . . . . . 2.603 1.756 3.45 1 1 182 1 . . . . . 2.753 1.805 3.701 1 1 183 1 . . . . . 2.088 1.543 2.633 1 1 184 1 . . . . . 1.941 1.47 2.412 1 1 185 1 . . . . . 2.455 1.702 3.208 1 1 186 1 . . . . . 2.522 1.727 3.317 1 1 187 1 . . . . . 1.944 1.471 2.417 1 1 188 1 . . . . . 1.935 1.467 2.403 1 1 189 1 . . . . . 2.034 1.517 2.551 1 1 190 1 . . . . . 2.316 1.645 2.987 1 1 191 1 . . . . . 2.689 1.785 3.593 1 1 192 1 . . . . . 2.081 1.54 2.622 1 1 193 1 . . . . . 2.755 1.807 3.703 1 1 194 1 . . . . . 2.296 1.637 2.955 1 1 195 1 . . . . . 2.33 1.651 3.009 1 1 196 1 . . . . . 2.299 1.638 2.96 1 1 197 1 . . . . . 2.831 1.829 3.833 1 1 198 1 . . . . . 2.201 1.595 2.807 1 1 199 1 . . . . . 2.654 1.774 3.534 1 1 200 1 . . . . . 2.393 1.677 3.109 1 1 201 1 . . . . . 2.881 1.911 3.851 1 1 202 1 . . . . . 2.093 1.546 2.64 1 1 203 1 . . . . . 2.661 1.776 3.546 1 1 204 1 . . . . . 2.859 1.838 3.88 1 1 205 1 . . . . . 2.296 1.637 2.955 1 1 206 1 . . . . . 2.532 1.731 3.333 1 1 207 1 . . . . . 2.607 1.757 3.457 1 1 208 1 . . . . . 2.178 1.621 2.771 1 1 209 1 . . . . . 2.152 1.573 2.731 1 1 210 1 . . . . . 2.805 1.821 3.789 1 1 211 1 . . . . . 2.667 1.778 3.556 1 1 212 1 . . . . . 2.615 1.76 3.47 1 1 213 1 . . . . . 2.951 1.863 3.419 1 1 214 1 . . . . . 2.682 1.783 3.581 1 1 215 1 . . . . . 2.444 1.697 3.191 1 1 216 1 . . . . . 2.749 1.805 3.693 1 1 217 1 . . . . . 2.378 1.671 3.085 1 1 218 1 . . . . . 2.868 1.84 3.896 1 1 219 1 . . . . . 2.462 1.704 3.22 1 1 220 1 . . . . . 2.043 1.521 2.565 1 1 221 1 . . . . . 2.245 1.615 2.875 1 1 222 1 . . . . . 2.412 1.685 3.139 1 1 223 1 . . . . . 2.433 1.693 3.173 1 1 224 1 . . . . . 2.511 1.723 3.299 1 1 225 1 . . . . . 2.513 1.723 3.303 1 1 226 1 . . . . . 2.68 1.782 3.578 1 1 227 1 . . . . . 2.762 1.809 3.715 1 1 228 1 . . . . . 2.764 1.809 3.719 1 1 229 1 . . . . . 2.313 1.644 2.982 1 1 230 1 . . . . . 2.5 1.719 3.281 1 1 231 1 . . . . . 2.76 1.808 3.712 1 1 232 1 . . . . . 2.537 1.732 3.342 1 1 233 1 . . . . . 3.2 2.049 4.351 1 1 234 1 . . . . . 2.523 1.727 3.319 1 1 235 1 . . . . . 2.756 1.807 3.705 1 1 236 1 . . . . . 2.156 1.575 2.737 1 1 237 1 . . . . . 2.403 1.681 3.125 1 1 238 1 . . . . . 2.638 1.782 3.508 1 1 239 1 . . . . . 2.18 1.586 2.774 1 1 240 1 . . . . . 2.254 1.619 2.889 1 1 241 1 . . . . . 2.556 1.74 3.372 1 1 242 1 . . . . . 2.841 1.832 3.85 1 1 243 1 . . . . . 2.408 1.683 3.133 1 1 244 1 . . . . . 1.852 1.423 2.281 1 1 245 1 . . . . . 2.414 1.686 3.142 1 1 246 1 . . . . . 2.765 1.809 3.721 1 1 247 1 . . . . . 2.408 1.683 3.133 1 1 248 1 . . . . . 2.729 1.798 3.66 1 1 249 1 . . . . . 2.646 1.771 3.521 1 1 250 1 . . . . . 2.575 1.746 3.404 1 1 251 1 . . . . . 1.968 1.484 2.452 1 1 252 1 . . . . . 3.137 2.031 4.243 1 1 253 1 . . . . . 2.89 1.976 3.804 1 1 254 1 . . . . . 2.421 1.688 3.154 1 1 255 1 . . . . . 2.219 1.604 2.834 1 1 256 1 . . . . . 2.369 1.667 3.071 1 1 257 1 . . . . . 2.507 1.721 3.293 1 1 258 1 . . . . . 2.658 1.775 3.541 1 1 259 1 . . . . . 3.833 1.997 5.669 1 1 260 1 . . . . . 3.297 1.939 4.655 1 1 261 1 . . . . . 3.97 2.0 5.94 1 1 262 1 . . . . . 2.142 1.569 2.715 1 1 263 1 . . . . . 2.824 1.827 3.821 1 1 264 1 . . . . . 2.851 1.835 3.867 1 1 265 1 . . . . . 3.202 1.92 4.484 1 1 266 1 . . . . . 3.121 1.903 4.339 1 1 267 1 . . . . . 3.667 1.987 5.347 1 1 268 1 . . . . . 3.778 1.994 5.562 1 1 269 1 . . . . . 3.472 1.965 4.979 1 1 270 1 . . . . . 2.106 1.552 2.66 1 1 271 1 . . . . . 2.809 1.822 3.796 1 1 272 1 . . . . . 3.123 1.904 4.342 1 1 273 1 . . . . . 2.957 1.864 4.05 1 1 274 1 . . . . . 3.223 1.925 4.521 1 1 275 1 . . . . . 3.615 2.058 5.172 1 1 276 1 . . . . . 3.676 1.987 5.365 1 1 277 1 . . . . . 2.771 1.811 3.731 1 1 278 1 . . . . . 3.79 1.995 5.585 1 1 279 1 . . . . . 4.068 2.0 6.136 1 1 280 1 . . . . . 2.544 1.735 3.353 1 1 281 1 . . . . . 2.696 1.787 3.605 1 1 282 1 . . . . . 3.839 1.997 5.681 1 1 283 1 . . . . . 3.039 1.885 4.193 1 1 284 1 . . . . . 3.915 1.999 5.831 1 1 285 1 . . . . . 3.772 1.993 5.551 1 1 286 1 . . . . . 3.908 1.999 5.817 1 1 287 1 . . . . . 3.655 1.985 5.325 1 1 288 1 . . . . . 3.802 1.995 5.609 1 1 289 1 . . . . . 2.868 1.84 3.896 1 1 290 1 . . . . . 2.344 1.657 3.031 1 1 291 1 . . . . . 3.442 1.961 4.923 1 1 292 1 . . . . . 4.039 2.0 6.078 1 1 293 1 . . . . . 4.215 1.994 6.436 1 1 294 1 . . . . . 2.418 1.687 3.149 1 1 295 1 . . . . . 3.655 1.985 5.325 1 1 296 1 . . . . . 3.472 1.965 4.979 1 1 297 1 . . . . . 2.722 1.796 3.648 1 1 298 1 . . . . . 3.166 1.913 4.419 1 1 299 1 . . . . . 3.551 1.974 5.128 1 1 300 1 . . . . . 3.71 1.989 5.431 1 1 301 1 . . . . . 3.278 1.935 4.621 1 1 302 1 . . . . . 3.582 1.978 5.186 1 1 303 1 . . . . . 2.889 1.846 3.932 1 1 304 1 . . . . . 2.752 1.805 3.699 1 1 305 1 . . . . . 2.926 1.856 3.996 1 1 306 1 . . . . . 3.19 1.918 4.462 1 1 307 1 . . . . . 3.772 1.993 5.551 1 1 308 1 . . . . . 2.355 1.662 3.048 1 1 309 1 . . . . . 3.372 1.95 4.794 1 1 310 1 . . . . . 3.826 1.996 5.656 1 1 311 1 . . . . . 3.224 1.925 4.523 1 1 312 1 . . . . . 3.71 1.989 5.431 1 1 313 1 . . . . . 2.101 1.549 2.653 1 1 314 1 . . . . . 4.053 1.999 6.107 1 1 315 1 . . . . . 3.068 1.892 4.244 1 1 316 1 . . . . . 3.113 2.024 4.202 1 1 317 1 . . . . . 2.696 1.787 3.605 1 1 318 1 . . . . . 2.675 1.78 3.57 1 1 319 1 . . . . . 3.244 1.928 4.56 1 1 320 1 . . . . . 3.59 1.979 5.201 1 1 321 1 . . . . . 3.107 1.9 4.314 1 1 322 1 . . . . . 2.737 1.801 3.673 1 1 323 1 . . . . . 2.707 1.791 3.623 1 1 324 1 . . . . . 3.993 2.188 5.798 1 1 325 1 . . . . . 2.802 1.821 3.783 1 1 326 1 . . . . . 3.978 2.0 5.956 1 1 327 1 . . . . . 3.553 1.975 5.131 1 1 328 1 . . . . . 3.342 1.946 4.738 1 1 329 1 . . . . . 2.459 1.703 3.215 1 1 330 1 . . . . . 2.956 1.864 4.048 1 1 331 1 . . . . . 2.768 1.81 3.726 1 1 332 1 . . . . . 2.864 1.839 3.889 1 1 333 1 . . . . . 3.683 1.987 5.379 1 1 334 1 . . . . . 4.049 2.0 6.098 1 1 335 1 . . . . . 3.34 1.946 4.734 1 1 336 1 . . . . . 4.168 1.997 6.339 1 1 337 1 . . . . . 2.254 1.619 2.889 1 1 338 1 . . . . . 2.749 1.805 3.693 1 1 339 1 . . . . . 2.336 1.654 3.018 1 1 340 1 . . . . . 2.629 1.765 3.493 1 1 341 1 . . . . . 2.096 1.547 2.645 1 1 342 1 . . . . . 2.851 1.835 3.867 1 1 343 1 . . . . . 3.978 2.0 5.956 1 1 344 1 . . . . . 2.564 1.742 3.386 1 1 345 1 . . . . . 3.991 2.0 5.982 1 1 346 1 . . . . . 3.683 1.987 5.379 1 1 347 1 . . . . . 3.051 1.887 4.215 1 1 348 1 . . . . . 2.955 1.863 4.047 1 1 349 1 . . . . . 3.114 1.902 4.326 1 1 350 1 . . . . . 3.843 1.997 5.689 1 1 351 1 . . . . . 3.89 1.998 5.782 1 1 352 1 . . . . . 3.302 1.939 4.665 1 1 353 1 . . . . . 3.514 1.971 5.057 1 1 354 1 . . . . . 3.954 2.0 5.908 1 1 355 1 . . . . . 3.458 1.963 4.953 1 1 356 1 . . . . . 3.435 1.96 4.91 1 1 357 1 . . . . . 2.67 1.779 3.561 1 1 358 1 . . . . . 3.207 1.922 4.492 1 1 359 1 . . . . . 3.301 1.939 4.663 1 1 360 1 . . . . . 3.582 1.978 5.186 1 1 361 1 . . . . . 3.915 1.999 5.831 1 1 362 1 . . . . . 2.688 1.785 3.591 1 1 363 1 . . . . . 2.187 1.589 2.785 1 1 364 1 . . . . . 2.828 1.828 3.828 1 1 365 1 . . . . . 3.63 1.983 5.277 1 1 366 1 . . . . . 3.401 1.955 4.847 1 1 367 1 . . . . . 4.012 2.0 6.024 1 1 368 1 . . . . . 2.678 1.782 3.574 1 1 369 1 . . . . . 2.616 1.761 3.471 1 1 370 1 . . . . . 3.055 1.888 4.222 1 1 371 1 . . . . . 3.66 1.986 5.334 1 1 372 1 . . . . . 3.97 2.0 5.94 1 1 373 1 . . . . . 3.254 1.93 4.578 1 1 374 1 . . . . . 3.395 1.954 4.836 1 1 375 1 . . . . . 3.876 1.998 5.754 1 1 376 1 . . . . . 3.923 1.999 5.847 1 1 377 1 . . . . . 3.351 1.948 4.754 1 1 378 1 . . . . . 3.314 1.941 4.687 1 1 379 1 . . . . . 3.271 1.934 4.608 1 1 380 1 . . . . . 2.472 1.708 3.236 1 1 381 1 . . . . . 2.501 1.719 3.283 1 1 382 1 . . . . . 3.315 1.942 4.688 1 1 383 1 . . . . . 3.394 1.954 4.834 1 1 384 1 . . . . . 3.236 1.927 4.545 1 1 385 1 . . . . . 3.879 1.998 5.76 1 1 386 1 . . . . . 3.553 1.975 5.131 1 1 387 1 . . . . . 2.832 1.83 3.834 1 1 388 1 . . . . . 4.228 1.993 6.463 1 1 389 1 . . . . . 3.109 1.901 4.317 1 1 390 1 . . . . . 3.14 1.907 4.373 1 1 391 1 . . . . . 2.686 1.784 3.588 1 1 392 1 . . . . . 2.498 1.718 3.278 1 1 393 1 . . . . . 2.847 1.834 3.86 1 1 394 1 . . . . . 3.77 1.994 5.546 1 1 395 1 . . . . . 3.118 1.903 4.333 1 1 396 1 . . . . . 2.795 1.818 3.772 1 1 397 1 . . . . . 3.923 1.999 5.847 1 1 398 1 . . . . . 2.544 1.735 3.353 1 1 399 1 . . . . . 2.688 1.785 3.591 1 1 400 1 . . . . . 3.178 1.916 4.44 1 1 401 1 . . . . . 3.464 1.964 4.964 1 1 402 1 . . . . . 2.301 1.639 2.963 1 1 403 1 . . . . . 2.795 1.818 3.772 1 1 404 1 . . . . . 2.781 1.814 3.748 1 1 405 1 . . . . . 3.79 1.995 5.585 1 1 406 1 . . . . . 3.531 1.972 5.09 1 1 407 1 . . . . . 4.209 1.994 6.424 1 1 408 1 . . . . . 2.71 1.792 3.628 1 1 409 1 . . . . . 2.691 1.786 3.596 1 1 410 1 . . . . . 4.049 2.0 6.098 1 1 411 1 . . . . . 2.675 1.78 3.57 1 1 412 1 . . . . . 2.148 1.571 2.725 1 1 413 1 . . . . . 4.063 2.0 6.126 1 1 414 1 . . . . . 3.125 1.904 4.346 1 1 415 1 . . . . . 3.17 1.914 4.426 1 1 416 1 . . . . . 3.574 1.977 5.171 1 1 417 1 . . . . . 3.211 1.923 4.499 1 1 418 1 . . . . . 2.957 1.864 4.05 1 1 419 1 . . . . . 2.596 1.753 3.439 1 1 420 1 . . . . . 2.912 1.852 3.972 1 1 421 1 . . . . . 3.79 1.995 5.585 1 1 422 1 . . . . . 3.17 1.914 4.426 1 1 423 1 . . . . . 3.482 2.195 4.769 1 1 424 1 . . . . . 2.943 1.86 4.026 1 1 425 1 . . . . . 3.897 1.999 5.795 1 1 426 1 . . . . . 3.442 1.961 4.923 1 1 427 1 . . . . . 2.836 1.831 3.841 1 1 428 1 . . . . . 3.7 1.988 5.412 1 1 429 1 . . . . . 3.657 1.985 5.329 1 1 430 1 . . . . . 2.54 1.733 3.347 1 1 431 1 . . . . . 2.71 1.792 3.628 1 1 432 1 . . . . . 3.713 1.99 5.436 1 1 433 1 . . . . . 3.302 1.939 4.665 1 1 434 1 . . . . . 3.152 1.91 4.394 1 1 435 1 . . . . . 3.366 1.95 4.782 1 1 436 1 . . . . . 3.923 1.999 5.847 1 1 437 1 . . . . . 3.064 1.891 4.237 1 1 438 1 . . . . . 2.917 1.854 3.98 1 1 439 1 . . . . . 3.117 1.902 4.332 1 1 440 1 . . . . . 3.224 1.925 4.523 1 1 441 1 . . . . . 3.301 1.939 4.663 1 1 442 1 . . . . . 3.143 1.908 4.378 1 1 443 1 . . . . . 3.557 1.975 5.139 1 1 444 1 . . . . . 2.962 1.865 4.059 1 1 445 1 . . . . . 3.5 1.969 5.031 1 1 446 1 . . . . . 3.446 1.962 4.93 1 1 447 1 . . . . . 4.162 1.997 6.327 1 1 448 1 . . . . . 2.45 1.7 3.2 1 1 449 1 . . . . . 3.444 1.961 4.927 1 1 450 1 . . . . . 2.961 1.865 4.057 1 1 451 1 . . . . . 2.946 1.861 4.031 1 1 452 1 . . . . . 2.613 1.759 3.467 1 1 453 1 . . . . . 4.247 1.992 6.502 1 1 454 1 . . . . . 3.639 1.984 5.294 1 1 455 1 . . . . . 3.238 1.927 4.549 1 1 456 1 . . . . . 3.346 1.947 4.745 1 1 457 1 . . . . . 3.784 1.994 5.574 1 1 458 1 . . . . . 4.234 1.993 6.475 1 1 459 1 . . . . . 2.365 1.666 3.064 1 1 460 1 . . . . . 3.41 1.956 4.864 1 1 461 1 . . . . . 3.569 1.977 5.161 1 1 462 1 . . . . . 3.203 1.92 4.486 1 1 463 1 . . . . . 2.872 1.945 3.799 1 1 464 1 . . . . . 3.169 1.914 4.424 1 1 465 1 . . . . . 3.615 1.981 5.249 1 1 466 1 . . . . . 4.14 1.998 6.282 1 1 467 1 . . . . . 3.142 1.908 4.376 1 1 468 1 . . . . . 3.641 1.984 5.298 1 1 469 1 . . . . . 3.444 1.961 4.927 1 1 470 1 . . . . . 3.653 1.985 5.321 1 1 471 1 . . . . . 3.057 1.889 4.225 1 1 472 1 . . . . . 4.151 1.997 6.305 1 1 473 1 . . . . . 2.737 1.801 3.673 1 1 474 1 . . . . . 4.082 1.999 6.165 1 1 475 1 . . . . . 3.966 2.0 5.932 1 1 476 1 . . . . . 3.169 1.914 4.424 1 1 477 1 . . . . . 2.761 1.808 3.714 1 1 478 1 . . . . . 2.691 1.786 3.596 1 1 479 1 . . . . . 2.743 1.803 3.683 1 1 480 1 . . . . . 3.224 1.925 4.523 1 1 481 1 . . . . . 4.14 1.998 6.282 1 1 482 1 . . . . . 3.367 1.95 4.784 1 1 483 1 . . . . . 3.737 1.992 5.482 1 1 484 1 . . . . . 2.975 1.868 4.082 1 1 485 1 . . . . . 3.912 1.999 5.825 1 1 486 1 . . . . . 3.41 1.956 4.864 1 1 487 1 . . . . . 3.275 1.934 4.616 1 1 488 1 . . . . . 3.811 1.996 5.626 1 1 489 1 . . . . . 3.007 1.876 4.138 1 1 490 1 . . . . . 2.792 1.818 3.766 1 1 491 1 . . . . . 2.62 1.762 3.478 1 1 492 1 . . . . . 2.662 1.776 3.548 1 1 493 1 . . . . . 2.936 1.859 4.013 1 1 494 1 . . . . . 2.898 1.848 3.948 1 1 495 1 . . . . . 3.341 1.946 4.736 1 1 496 1 . . . . . 3.06 1.89 4.23 1 1 497 1 . . . . . 2.828 1.828 3.828 1 1 498 1 . . . . . 2.771 1.811 3.731 1 1 499 1 . . . . . 3.412 1.957 4.867 1 1 500 1 . . . . . 3.425 1.959 4.891 1 1 501 1 . . . . . 4.261 1.992 6.53 1 1 502 1 . . . . . 3.287 1.937 4.637 1 1 503 1 . . . . . 2.686 1.784 3.588 1 1 504 1 . . . . . 3.331 1.944 4.718 1 1 505 1 . . . . . 3.836 1.997 5.675 1 1 506 1 . . . . . 2.374 1.669 3.079 1 1 507 1 . . . . . 3.38 1.952 4.808 1 1 508 1 . . . . . 3.601 1.98 5.222 1 1 509 1 . . . . . 3.565 1.977 5.153 1 1 510 1 . . . . . 3.185 1.917 4.453 1 1 511 1 . . . . . 3.475 1.965 4.985 1 1 512 1 . . . . . 2.29 1.635 2.945 1 1 513 1 . . . . . 3.449 1.962 4.936 1 1 514 1 . . . . . 3.297 1.939 4.655 1 1 515 1 . . . . . 4.017 2.0 6.034 1 1 516 1 . . . . . 4.254 1.992 6.516 1 1 517 1 . . . . . 2.478 1.711 3.245 1 1 518 1 . . . . . 2.785 1.816 3.754 1 1 519 1 . . . . . 3.974 2.0 5.948 1 1 520 1 . . . . . 4.087 1.999 6.175 1 1 521 1 . . . . . 4.168 1.997 6.339 1 1 522 1 . . . . . 3.934 1.999 5.869 1 1 523 1 . . . . . 3.62 1.982 5.258 1 1 524 1 . . . . . 3.942 2.0 5.884 1 1 525 1 . . . . . 2.678 1.782 3.574 1 1 526 1 . . . . . 2.954 1.863 4.045 1 1 527 1 . . . . . 2.525 1.706 3.344 1 1 528 1 . . . . . 2.674 1.869 3.479 1 1 529 1 . . . . . 1.954 1.477 2.431 1 1 530 1 . . . . . 4.003 2.0 6.006 1 1 531 1 . . . . . 3.826 1.996 5.656 1 1 532 1 . . . . . 3.688 1.988 5.388 1 1 533 1 . . . . . 2.713 1.793 3.633 1 1 534 1 . . . . . 4.113 1.999 6.227 1 1 535 1 . . . . . 3.954 2.0 5.908 1 1 536 1 . . . . . 4.077 1.999 6.155 1 1 537 1 . . . . . 3.112 1.901 4.323 1 1 538 1 . . . . . 3.555 1.93 5.18 1 1 539 1 . . . . . 2.792 1.818 3.766 1 1 540 1 . . . . . 3.12 1.956 4.336 1 1 541 1 . . . . . 3.109 1.901 4.317 1 1 542 1 . . . . . 2.948 1.862 4.034 1 1 543 1 . . . . . 3.805 1.995 5.615 1 1 544 1 . . . . . 3.092 1.897 4.287 1 1 545 1 . . . . . 2.572 1.745 3.399 1 1 546 1 . . . . . 3.833 1.997 5.669 1 1 547 1 . . . . . 3.637 1.984 5.29 1 1 548 1 . . . . . 3.901 1.999 5.803 1 1 549 1 . . . . . 3.047 1.887 4.207 1 1 550 1 . . . . . 3.747 1.992 5.502 1 1 551 1 . . . . . 3.017 1.879 4.155 1 1 552 1 . . . . . 2.668 1.779 3.557 1 1 553 1 . . . . . 2.969 1.867 4.071 1 1 554 1 . . . . . 2.743 1.803 3.683 1 1 555 1 . . . . . 3.708 1.989 5.427 1 1 556 1 . . . . . 3.95 2.0 5.9 1 1 557 1 . . . . . 3.784 1.994 5.574 1 1 558 1 . . . . . 3.254 1.93 4.578 1 1 559 1 . . . . . 4.215 1.994 6.436 1 1 560 1 . . . . . 2.568 1.744 3.392 1 1 561 1 . . . . . 2.574 1.746 3.402 1 1 562 1 . . . . . 3.919 1.999 5.839 1 1 563 1 . . . . . 2.864 1.942 3.786 1 1 564 1 . . . . . 4.003 2.0 6.006 1 1 565 1 . . . . . 2.504 1.72 3.288 1 1 566 1 . . . . . 3.031 1.883 4.179 1 1 567 1 . . . . . 2.765 1.81 3.72 1 1 568 1 . . . . . 3.214 1.923 4.505 1 1 569 1 . . . . . 3.45 1.962 4.938 1 1 570 1 . . . . . 3.723 1.99 5.456 1 1 571 1 . . . . . 3.849 1.997 5.701 1 1 572 1 . . . . . 3.927 2.0 5.854 1 1 573 1 . . . . . 3.726 1.991 5.461 1 1 574 1 . . . . . 3.615 1.981 5.249 1 1 575 1 . . . . . 3.723 1.99 5.456 1 1 576 1 . . . . . 3.472 1.965 4.979 1 1 577 1 . . . . . 2.57 1.744 3.396 1 1 578 1 . . . . . 2.755 1.806 3.704 1 1 579 1 . . . . . 4.162 1.997 6.327 1 1 580 1 . . . . . 4.145 1.997 6.293 1 1 581 1 . . . . . 4.108 1.999 6.217 1 1 582 1 . . . . . 2.653 1.773 3.533 1 1 583 1 . . . . . 3.546 1.974 5.118 1 1 584 1 . . . . . 2.542 1.734 3.35 1 1 585 1 . . . . . 3.319 1.942 4.696 1 1 586 1 . . . . . 3.195 1.919 4.471 1 1 587 1 . . . . . 3.237 1.927 4.547 1 1 588 1 . . . . . 2.641 1.769 3.513 1 1 589 1 . . . . . 3.265 1.932 4.598 1 1 590 1 . . . . . 2.74 1.802 3.678 1 1 591 1 . . . . . 3.688 1.988 5.388 1 1 592 1 . . . . . 2.788 1.816 3.76 1 1 593 1 . . . . . 2.859 1.837 3.881 1 1 594 1 . . . . . 2.775 1.813 3.737 1 1 595 1 . . . . . 3.66 1.986 5.334 1 1 596 1 . . . . . 3.761 1.993 5.529 1 1 597 1 . . . . . 4.008 2.0 6.016 1 1 598 1 . . . . . 2.74 1.802 3.678 1 1 599 1 . . . . . 2.836 1.831 3.841 1 1 600 1 . . . . . 3.873 2.178 5.568 1 1 601 1 . . . . . 3.624 1.982 5.266 1 1 602 1 . . . . . 3.091 1.897 4.285 1 1 603 1 . . . . . 2.641 1.769 3.513 1 1 604 1 . . . . . 2.668 1.779 3.557 1 1 605 1 . . . . . 2.961 1.865 4.057 1 1 606 1 . . . . . 3.958 2.0 5.916 1 1 607 1 . . . . . 3.747 1.992 5.502 1 1 608 1 . . . . . 3.705 1.989 5.421 1 1 609 1 . . . . . 3.683 1.987 5.379 1 1 610 1 . . . . . 3.688 1.988 5.388 1 1 611 1 . . . . . 4.077 1.999 6.155 1 1 612 1 . . . . . 4.087 1.999 6.175 1 1 613 1 . . . . . 2.67 1.779 3.561 1 1 614 1 . . . . . 2.921 1.854 3.988 1 1 615 1 . . . . . 3.551 1.974 5.128 1 1 616 1 . . . . . 2.981 1.87 4.092 1 1 617 1 . . . . . 3.788 2.116 5.46 1 1 618 1 . . . . . 3.061 1.89 4.232 1 1 619 1 . . . . . 3.703 1.989 5.417 1 1 620 1 . . . . . 3.106 1.9 4.312 1 1 621 1 . . . . . 4.063 2.0 6.126 1 1 622 1 . . . . . 3.563 1.976 5.15 1 1 623 1 . . . . . 3.708 1.989 5.427 1 1 624 1 . . . . . 2.384 1.673 3.095 1 1 625 1 . . . . . 2.972 1.868 4.076 1 1 626 1 . . . . . 2.673 1.78 3.566 1 1 627 1 . . . . . 3.814 1.996 5.632 1 1 628 1 . . . . . 2.941 1.859 4.023 1 1 629 1 . . . . . 3.332 1.944 4.72 1 1 630 1 . . . . . 3.77 1.994 5.546 1 1 631 1 . . . . . 2.495 1.717 3.273 1 1 632 1 . . . . . 3.622 1.982 5.262 1 1 633 1 . . . . . 2.658 1.775 3.541 1 1 634 1 . . . . . 3.285 1.936 4.634 1 1 635 1 . . . . . 3.628 1.983 5.273 1 1 636 1 . . . . . 2.498 1.718 3.278 1 1 637 1 . . . . . 3.54 1.973 5.107 1 1 638 1 . . . . . 3.781 1.994 5.568 1 1 639 1 . . . . . 2.443 1.697 3.189 1 1 640 1 . . . . . 3.447 1.962 4.932 1 1 641 1 . . . . . 4.179 1.996 6.362 1 1 642 1 . . . . . 3.225 1.925 4.525 1 1 643 1 . . . . . 3.497 1.969 5.025 1 1 644 1 . . . . . 2.82 1.826 3.814 1 1 645 1 . . . . . 2.535 1.732 3.338 1 1 646 1 . . . . . 2.58 1.748 3.412 1 1 647 1 . . . . . 3.38 1.952 4.808 1 1 648 1 . . . . . 4.129 1.998 6.26 1 1 649 1 . . . . . 3.008 1.877 4.139 1 1 650 1 . . . . . 2.508 1.722 3.294 1 1 651 1 . . . . . 2.737 1.801 3.673 1 1 652 1 . . . . . 3.013 1.878 4.148 1 1 653 1 . . . . . 2.422 1.689 3.155 1 1 654 1 . . . . . 2.607 1.757 3.457 1 1 655 1 . . . . . 2.948 1.862 4.034 1 1 656 1 . . . . . 2.33 1.651 3.009 1 1 657 1 . . . . . 2.683 1.783 3.583 1 1 658 1 . . . . . 3.862 1.997 5.727 1 1 659 1 . . . . . 4.068 2.0 6.136 1 1 660 1 . . . . . 2.4 1.68 3.12 1 1 661 1 . . . . . 3.767 1.993 5.541 1 1 662 1 . . . . . 3.257 1.931 4.583 1 1 663 1 . . . . . 4.203 1.995 6.411 1 1 664 1 . . . . . 4.247 1.992 6.502 1 1 665 1 . . . . . 4.123 1.998 6.248 1 1 666 1 . . . . . 2.851 1.835 3.867 1 1 667 1 . . . . . 2.872 1.841 3.903 1 1 668 1 . . . . . 3.249 1.929 4.569 1 1 669 1 . . . . . 3.991 2.0 5.982 1 1 670 1 . . . . . 2.881 1.844 3.918 1 1 671 1 . . . . . 2.678 1.782 3.574 1 1 672 1 . . . . . 3.644 1.985 5.303 1 1 673 1 . . . . . 2.971 1.868 4.074 1 1 674 1 . . . . . 3.113 1.902 4.324 1 1 675 1 . . . . . 3.808 1.996 5.62 1 1 676 1 . . . . . 4.035 2.0 6.07 1 1 677 1 . . . . . 2.813 1.824 3.802 1 1 678 1 . . . . . 3.434 1.96 4.908 1 1 679 1 . . . . . 2.885 1.845 3.925 1 1 680 1 . . . . . 2.889 1.846 3.932 1 1 681 1 . . . . . 3.375 1.951 4.799 1 1 682 1 . . . . . 3.362 1.949 4.775 1 1 683 1 . . . . . 4.035 2.0 6.07 1 1 684 1 . . . . . 3.676 1.987 5.365 1 1 685 1 . . . . . 3.582 1.978 5.186 1 1 686 1 . . . . . 3.66 1.986 5.334 1 1 687 1 . . . . . 2.68 1.782 3.578 1 1 688 1 . . . . . 3.027 1.882 4.172 1 1 689 1 . . . . . 3.042 1.885 4.199 1 1 690 1 . . . . . 3.667 1.987 5.347 1 1 691 1 . . . . . 3.609 1.981 5.237 1 1 692 1 . . . . . 2.939 1.859 4.019 1 1 693 1 . . . . . 2.576 1.747 3.405 1 1 694 1 . . . . . 3.503 1.969 5.037 1 1 695 1 . . . . . 3.503 1.969 5.037 1 1 696 1 . . . . . 3.395 1.954 4.836 1 1 697 1 . . . . . 3.12 1.903 4.337 1 1 698 1 . . . . . 3.296 1.938 4.654 1 1 699 1 . . . . . 3.546 1.974 5.118 1 1 700 1 . . . . . 3.276 1.935 4.617 1 1 701 1 . . . . . 3.348 1.947 4.749 1 1 702 1 . . . . . 4.274 1.99 6.558 1 1 703 1 . . . . . 2.543 1.735 3.351 1 1 704 1 . . . . . 1.869 1.432 2.306 1 1 705 1 . . . . . 2.372 1.582 3.162 1 1 706 1 . . . . . 1.646 1.307 1.985 1 1 707 1 . . . . . 1.727 1.354 2.1 1 1 708 1 . . . . . 2.275 1.628 2.922 1 1 709 1 . . . . . 2.311 1.644 2.978 1 1 710 1 . . . . . 2.137 1.566 2.708 1 1 711 1 . . . . . 1.864 1.43 2.298 1 1 712 1 . . . . . 1.768 1.377 2.159 1 1 713 1 . . . . . 2.482 1.712 3.252 1 1 714 1 . . . . . 2.133 1.564 2.702 1 1 715 1 . . . . . 2.084 1.541 2.627 1 1 716 1 . . . . . 2.611 1.759 3.463 1 1 717 1 . . . . . 2.67 1.779 3.561 1 1 718 1 . . . . . 2.48 1.711 3.249 1 1 719 1 . . . . . 1.915 1.456 2.374 1 1 720 1 . . . . . 2.357 1.663 3.051 1 1 721 1 . . . . . 2.386 1.674 3.098 1 1 722 1 . . . . . 2.185 1.588 2.782 1 1 723 1 . . . . . 2.609 1.758 3.46 1 1 724 1 . . . . . 2.23 1.609 2.851 1 1 725 1 . . . . . 2.249 1.617 2.881 1 1 726 1 . . . . . 2.242 1.614 2.87 1 1 727 1 . . . . . 2.55 1.737 3.363 1 1 728 1 . . . . . 2.223 1.605 2.841 1 1 729 1 . . . . . 2.111 1.554 2.668 1 1 730 1 . . . . . 2.346 1.658 3.034 1 1 731 1 . . . . . 2.512 1.7 3.324 1 1 732 1 . . . . . 2.987 2.033 3.941 1 1 733 1 . . . . . 2.766 1.81 3.722 1 1 734 1 . . . . . 2.524 1.728 3.32 1 1 735 1 . . . . . 2.068 1.533 2.603 1 1 736 1 . . . . . 1.931 1.465 2.397 1 1 737 1 . . . . . 1.915 1.456 2.374 1 1 738 1 . . . . . 2.478 1.711 3.245 1 1 739 1 . . . . . 2.399 1.679 3.119 1 1 740 1 . . . . . 2.967 2.025 3.909 1 1 741 1 . . . . . 2.364 1.666 3.062 1 1 742 1 . . . . . 2.334 1.653 3.015 1 1 743 1 . . . . . 2.513 1.723 3.303 1 1 744 1 . . . . . 2.507 1.721 3.293 1 1 745 1 . . . . . 2.481 1.711 3.251 1 1 746 1 . . . . . 2.711 1.792 3.63 1 1 747 1 . . . . . 2.176 1.584 2.768 1 1 748 1 . . . . . 1.897 1.447 2.347 1 1 749 1 . . . . . 2.425 1.69 3.16 1 1 750 1 . . . . . 2.02 1.51 2.53 1 1 751 1 . . . . . 2.155 1.574 2.736 1 1 752 1 . . . . . 2.946 1.97 3.922 1 1 753 1 . . . . . 1.737 1.36 2.114 1 1 754 1 . . . . . 1.834 1.414 2.254 1 1 755 1 . . . . . 2.093 1.545 2.641 1 1 756 1 . . . . . 2.422 1.688 3.156 1 1 757 1 . . . . . 2.847 1.834 3.86 1 1 758 1 . . . . . 2.994 1.873 4.115 1 1 759 1 . . . . . 2.579 1.748 3.41 1 1 760 1 . . . . . 2.473 1.709 3.237 1 1 761 1 . . . . . 2.863 1.923 3.803 1 1 762 1 . . . . . 2.869 1.881 3.857 1 1 763 1 . . . . . 2.409 1.699 3.119 1 1 764 1 . . . . . 2.971 2.026 3.916 1 1 765 1 . . . . . 2.647 1.816 3.478 1 1 766 1 . . . . . 2.478 1.685 3.271 1 1 767 1 . . . . . 2.334 1.653 3.015 1 1 768 1 . . . . . 1.739 1.361 2.117 1 1 769 1 . . . . . 2.271 1.626 2.916 1 1 770 1 . . . . . 2.945 1.97 3.92 1 1 771 1 . . . . . 2.102 1.549 2.655 1 1 772 1 . . . . . 2.49 1.691 3.289 1 1 773 1 . . . . . 2.288 1.634 2.942 1 1 774 1 . . . . . 2.389 1.676 3.102 1 1 775 1 . . . . . 1.785 1.371 2.199 1 1 776 1 . . . . . 2.202 1.596 2.808 1 1 777 1 . . . . . 2.501 1.719 3.283 1 1 778 1 . . . . . 2.672 1.78 3.564 1 1 779 1 . . . . . 2.496 1.693 3.299 1 1 780 1 . . . . . 2.327 1.65 3.004 1 1 781 1 . . . . . 2.37 1.668 3.072 1 1 782 1 . . . . . 2.594 1.753 3.435 1 1 783 1 . . . . . 2.613 1.76 3.466 1 1 784 1 . . . . . 2.729 1.798 3.66 1 1 785 1 . . . . . 2.082 1.54 2.624 1 1 786 1 . . . . . 2.331 1.652 3.01 1 1 787 1 . . . . . 2.04 1.52 2.56 1 1 788 1 . . . . . 1.769 1.378 2.16 1 1 789 1 . . . . . 2.555 1.739 3.371 1 1 790 1 . . . . . 2.347 1.658 3.036 1 1 791 1 . . . . . 2.964 1.979 3.949 1 1 792 1 . . . . . 2.305 1.641 2.969 1 1 793 1 . . . . . 2.427 1.69 3.164 1 1 794 1 . . . . . 2.192 1.591 2.793 1 1 795 1 . . . . . 2.176 1.584 2.768 1 1 796 1 . . . . . 2.586 1.774 3.398 1 1 797 1 . . . . . 2.579 1.748 3.41 1 1 798 1 . . . . . 2.188 1.59 2.786 1 1 799 1 . . . . . 2.251 1.618 2.884 1 1 800 1 . . . . . 2.603 1.756 3.45 1 1 801 1 . . . . . 2.459 1.703 3.215 1 1 802 1 . . . . . 2.574 1.746 3.402 1 1 803 1 . . . . . 2.432 1.693 3.171 1 1 804 1 . . . . . 2.886 1.95 3.822 1 1 805 1 . . . . . 2.511 1.723 3.299 1 1 806 1 . . . . . 2.334 1.653 3.015 1 1 807 1 . . . . . 2.49 1.634 3.346 1 1 808 1 . . . . . 2.547 1.736 3.358 1 1 809 1 . . . . . 2.209 1.599 2.819 1 1 810 1 . . . . . 2.068 1.533 2.603 1 1 811 1 . . . . . 2.46 1.703 3.217 1 1 812 1 . . . . . 2.244 1.614 2.874 1 1 813 1 . . . . . 2.525 1.728 3.322 1 1 814 1 . . . . . 2.482 1.712 3.252 1 1 815 1 . . . . . 2.439 1.696 3.182 1 1 816 1 . . . . . 2.608 1.758 3.458 1 1 817 1 . . . . . 2.62 1.747 3.393 1 1 818 1 . . . . . 2.703 1.781 3.625 1 1 819 1 . . . . . 2.245 1.615 2.875 1 1 820 1 . . . . . 2.163 1.578 2.748 1 1 821 1 . . . . . 2.445 1.698 3.192 1 1 822 1 . . . . . 2.568 1.744 3.392 1 1 823 1 . . . . . 2.67 1.779 3.561 1 1 824 1 . . . . . 2.501 1.719 3.283 1 1 825 1 . . . . . 2.315 1.645 2.985 1 1 826 1 . . . . . 2.156 1.575 2.737 1 1 827 1 . . . . . 2.511 1.723 3.299 1 1 828 1 . . . . . 2.451 1.7 3.202 1 1 829 1 . . . . . 2.504 1.72 3.288 1 1 830 1 . . . . . 2.316 1.646 2.986 1 1 831 1 . . . . . 2.986 2.084 3.888 1 1 832 1 . . . . . 2.238 1.612 2.864 1 1 833 1 . . . . . 2.435 1.694 3.176 1 1 834 1 . . . . . 2.229 1.608 2.85 1 1 835 1 . . . . . 2.221 1.604 2.838 1 1 836 1 . . . . . 2.563 1.742 3.384 1 1 837 1 . . . . . 2.395 1.678 3.112 1 1 838 1 . . . . . 2.596 1.754 3.438 1 1 839 1 . . . . . 2.65 1.76 3.54 1 1 840 1 . . . . . 2.995 2.037 3.953 1 1 841 1 . . . . . 2.599 1.754 3.444 1 1 842 1 . . . . . 2.559 1.74 3.378 1 1 843 1 . . . . . 2.442 1.7 3.187 1 1 844 1 . . . . . 2.129 1.562 2.696 1 1 845 1 . . . . . 2.191 1.591 2.791 1 1 846 1 . . . . . 2.263 1.623 2.903 1 1 847 1 . . . . . 2.23 1.609 2.851 1 1 848 1 . . . . . 2.65 1.772 3.528 1 1 849 1 . . . . . 2.729 1.798 3.66 1 1 850 1 . . . . . 2.85 1.959 3.741 1 1 851 1 . . . . . 2.428 1.691 3.165 1 1 852 1 . . . . . 2.616 1.76 3.472 1 1 853 1 . . . . . 2.124 1.56 2.688 1 1 854 1 . . . . . 2.326 1.65 3.002 1 1 855 1 . . . . . 2.621 1.762 3.48 1 1 856 1 . . . . . 2.464 1.705 3.223 1 1 857 1 . . . . . 2.209 1.599 2.819 1 1 858 1 . . . . . 2.084 1.541 2.627 1 1 859 1 . . . . . 2.535 1.732 3.338 1 1 860 1 . . . . . 2.506 1.764 3.291 1 1 861 1 . . . . . 2.422 1.659 3.185 1 1 862 1 . . . . . 2.24 1.613 2.867 1 1 863 1 . . . . . 2.107 1.552 2.662 1 1 864 1 . . . . . 1.766 1.376 2.156 1 1 865 1 . . . . . 2.342 1.657 3.027 1 1 866 1 . . . . . 2.217 1.602 2.832 1 1 867 1 . . . . . 2.297 1.637 2.957 1 1 868 1 . . . . . 2.52 1.726 3.314 1 1 869 1 . . . . . 2.424 1.689 3.159 1 1 870 1 . . . . . 2.142 1.568 2.716 1 1 871 1 . . . . . 2.532 1.731 3.333 1 1 872 1 . . . . . 2.39 1.676 3.104 1 1 873 1 . . . . . 2.289 1.634 2.944 1 1 874 1 . . . . . 2.493 1.716 3.27 1 1 875 1 . . . . . 2.312 1.644 2.98 1 1 876 1 . . . . . 2.29 1.634 2.946 1 1 877 1 . . . . . 2.358 1.663 3.053 1 1 878 1 . . . . . 2.577 1.771 3.383 1 1 879 1 . . . . . 2.979 1.985 3.973 1 1 880 1 . . . . . 2.173 1.583 2.763 1 1 881 1 . . . . . 2.586 1.733 3.439 1 1 882 1 . . . . . 2.178 1.585 2.771 1 1 883 1 . . . . . 2.216 1.602 2.83 1 1 884 1 . . . . . 2.356 1.662 3.05 1 1 885 1 . . . . . 2.317 1.646 2.988 1 1 886 1 . . . . . 2.296 1.637 2.955 1 1 887 1 . . . . . 2.257 1.62 2.894 1 1 888 1 . . . . . 2.037 1.518 2.556 1 1 889 1 . . . . . 2.444 1.615 3.273 1 1 890 1 . . . . . 2.521 1.726 3.316 1 1 891 1 . . . . . 2.332 1.652 3.012 1 1 892 1 . . . . . 2.452 1.701 3.203 1 1 893 1 . . . . . 1.821 1.406 2.236 1 1 894 1 . . . . . 2.011 1.505 2.517 1 1 895 1 . . . . . 2.332 1.652 3.012 1 1 896 1 . . . . . 2.286 1.633 2.939 1 1 897 1 . . . . . 2.202 1.596 2.808 1 1 898 1 . . . . . 2.484 1.713 3.255 1 1 899 1 . . . . . 2.613 1.76 3.466 1 1 900 1 . . . . . 2.613 1.801 3.425 1 1 901 1 . . . . . 2.997 2.037 3.957 1 1 902 1 . . . . . 2.961 2.022 3.9 1 1 903 1 . . . . . 2.335 1.654 3.016 1 1 904 1 . . . . . 2.208 1.599 2.817 1 1 905 1 . . . . . 2.959 2.021 3.897 1 1 906 1 . . . . . 2.727 1.797 3.657 1 1 907 1 . . . . . 2.402 1.681 3.123 1 1 908 1 . . . . . 2.169 1.581 2.757 1 1 909 1 . . . . . 2.214 1.601 2.827 1 1 910 1 . . . . . 2.078 1.538 2.618 1 1 911 1 . . . . . 2.309 1.642 2.976 1 1 912 1 . . . . . 2.348 1.671 3.025 1 1 913 1 . . . . . 2.48 1.711 3.249 1 1 914 1 . . . . . 2.453 1.701 3.205 1 1 915 1 . . . . . 2.65 1.772 3.528 1 1 916 1 . . . . . 2.52 1.726 3.314 1 1 917 1 . . . . . 2.494 1.716 3.272 1 1 918 1 . . . . . 2.432 1.693 3.171 1 1 919 1 . . . . . 2.356 1.662 3.05 1 1 920 1 . . . . . 2.444 1.697 3.191 1 1 921 1 . . . . . 2.569 1.744 3.394 1 1 922 1 . . . . . 2.565 1.743 3.387 1 1 923 1 . . . . . 2.593 1.753 3.433 1 1 924 1 . . . . . 2.616 1.646 3.586 1 1 925 1 . . . . . 2.868 1.88 3.856 1 1 926 1 . . . . . 2.459 1.703 3.215 1 1 927 1 . . . . . 2.906 1.941 3.871 1 1 928 1 . . . . . 2.498 1.718 3.278 1 1 929 1 . . . . . 2.006 1.503 2.509 1 1 930 1 . . . . . 2.219 1.603 2.835 1 1 931 1 . . . . . 2.289 1.634 2.944 1 1 932 1 . . . . . 2.4 1.68 3.12 1 1 933 1 . . . . . 2.359 1.664 3.054 1 1 934 1 . . . . . 2.525 1.728 3.322 1 1 935 1 . . . . . 1.993 1.497 2.489 1 1 936 1 . . . . . 2.085 1.542 2.628 1 1 937 1 . . . . . 2.119 1.558 2.68 1 1 938 1 . . . . . 2.535 1.753 3.317 1 1 939 1 . . . . . 2.252 1.618 2.886 1 1 940 1 . . . . . 2.319 1.647 2.991 1 1 941 1 . . . . . 2.218 1.603 2.833 1 1 942 1 . . . . . 2.422 1.688 3.156 1 1 943 1 . . . . . 2.553 1.738 3.368 1 1 944 1 . . . . . 2.736 1.8 3.672 1 1 945 1 . . . . . 1.821 1.406 2.236 1 1 946 1 . . . . . 2.141 1.568 2.714 1 1 947 1 . . . . . 2.331 1.652 3.01 1 1 948 1 . . . . . 2.375 1.67 3.08 1 1 949 1 . . . . . 2.565 1.743 3.387 1 1 950 1 . . . . . 2.376 1.671 3.081 1 1 951 1 . . . . . 2.478 1.711 3.245 1 1 952 1 . . . . . 2.059 1.529 2.589 1 1 953 1 . . . . . 1.858 1.427 2.289 1 1 954 1 . . . . . 2.25 1.617 2.883 1 1 955 1 . . . . . 2.233 1.609 2.857 1 1 956 1 . . . . . 2.328 1.65 3.006 1 1 957 1 . . . . . 2.527 1.729 3.325 1 1 958 1 . . . . . 2.408 1.683 3.133 1 1 959 1 . . . . . 1.959 1.479 2.439 1 1 960 1 . . . . . 2.48 1.711 3.249 1 1 961 1 . . . . . 2.266 1.624 2.908 1 1 962 1 . . . . . 2.507 1.721 3.293 1 1 963 1 . . . . . 2.001 1.501 2.501 1 1 964 1 . . . . . 2.328 1.65 3.006 1 1 965 1 . . . . . 2.443 1.621 3.265 1 1 966 1 . . . . . 1.744 1.364 2.124 1 1 967 1 . . . . . 1.741 1.362 2.12 1 1 968 1 . . . . . 2.212 1.6 2.824 1 1 969 1 . . . . . 1.867 1.431 2.303 1 1 970 1 . . . . . 1.919 1.459 2.379 1 1 971 1 . . . . . 1.852 1.423 2.281 1 1 972 1 . . . . . 2.678 1.782 3.257 1 1 973 1 . . . . . 2.945 2.036 3.854 1 1 974 1 . . . . . 1.808 1.399 2.217 1 1 975 1 . . . . . 2.111 1.554 2.668 1 1 976 1 . . . . . 2.374 1.67 3.078 1 1 977 1 . . . . . 2.312 1.644 2.98 1 1 978 1 . . . . . 2.148 1.571 2.725 1 1 979 1 . . . . . 1.895 1.446 2.344 1 1 980 1 . . . . . 2.131 1.563 2.699 1 1 981 1 . . . . . 2.476 1.709 3.243 1 1 982 1 . . . . . 2.643 1.77 3.516 1 1 983 1 . . . . . 2.654 1.774 3.534 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_5_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 2 _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 2 2 1 . . . 1 2 3 1 2 . OR 1 2 3 2 . 3 . 1 2 3 3 . . . 1 2 4 1 . . . 1 2 5 1 . . . 1 2 6 1 2 . OR 1 2 6 2 . 3 . 1 2 6 3 . . . 1 2 7 1 . . . 1 2 8 1 . . . 1 2 9 1 . . . 1 2 10 1 . . . 1 2 11 1 . . . 1 2 12 1 . . . 1 2 13 1 . . . 1 2 14 1 . . . 1 2 15 1 . . . 1 2 16 1 . . . 1 2 17 1 . . . 1 2 18 1 . . . 1 2 19 1 . . . 1 2 20 1 . . . 1 2 21 1 . . . 1 2 22 1 . . . 1 2 23 1 . . . 1 2 24 1 . . . 1 2 25 1 . . . 1 2 26 1 . . . 1 2 27 1 . . . 1 2 28 1 . . . 1 2 29 1 . . . 1 2 30 1 . . . 1 2 31 1 . . . 1 2 32 1 . . . 1 2 33 1 . . . 1 2 34 1 . . . 1 2 35 1 . . . 1 2 36 1 . . . 1 2 37 1 . . . 1 2 38 1 . . . 1 2 39 1 . . . 1 2 40 1 . . . 1 2 41 1 . . . 1 2 42 1 . . . 1 2 43 1 . . . 1 2 44 1 . . . 1 2 45 1 . . . 1 2 46 1 . . . 1 2 47 1 . . . 1 2 48 1 . . . 1 2 49 1 2 . OR 1 2 49 2 . 3 . 1 2 49 3 . . . 1 2 50 1 . . . 1 2 51 1 2 . OR 1 2 51 2 . 3 . 1 2 51 3 . . . 1 2 52 1 . . . 1 2 53 1 . . . 1 2 54 1 . . . 1 2 55 1 . . . 1 2 56 1 2 . OR 1 2 56 2 . 3 . 1 2 56 3 . . . 1 2 57 1 . . . 1 2 58 1 . . . 1 2 59 1 2 . OR 1 2 59 2 . 3 . 1 2 59 3 . . . 1 2 60 1 . . . 1 2 61 1 2 . OR 1 2 61 2 . 3 . 1 2 61 3 . . . 1 2 62 1 2 . OR 1 2 62 2 . 3 . 1 2 62 3 . . . 1 2 63 1 . . . 1 2 64 1 . . . 1 2 65 1 . . . 1 2 66 1 . . . 1 2 67 1 . . . 1 2 68 1 . . . 1 2 69 1 2 . OR 1 2 69 2 . 3 . 1 2 69 3 . . . 1 2 70 1 2 . OR 1 2 70 2 . 3 . 1 2 70 3 . . . 1 2 71 1 . . . 1 2 72 1 . . . 1 2 73 1 . . . 1 2 74 1 . . . 1 2 75 1 2 . OR 1 2 75 2 . 3 . 1 2 75 3 . . . 1 2 76 1 2 . OR 1 2 76 2 . 3 . 1 2 76 3 . . . 1 2 77 1 2 . OR 1 2 77 2 . 3 . 1 2 77 3 . . . 1 2 78 1 . . . 1 2 79 1 . . . 1 2 80 1 2 . OR 1 2 80 2 . 3 . 1 2 80 3 . . . 1 2 81 1 . . . 1 2 82 1 2 . OR 1 2 82 2 . 3 . 1 2 82 3 . . . 1 2 83 1 . . . 1 2 84 1 . . . 1 2 85 1 2 . OR 1 2 85 2 . 3 . 1 2 85 3 . 4 . 1 2 85 4 . . . 1 2 86 1 2 . OR 1 2 86 2 . 3 . 1 2 86 3 . . . 1 2 87 1 . . . 1 2 88 1 . . . 1 2 89 1 2 . OR 1 2 89 2 . 3 . 1 2 89 3 . . . 1 2 90 1 2 . OR 1 2 90 2 . 3 . 1 2 90 3 . . . 1 2 91 1 . . . 1 2 92 1 . . . 1 2 93 1 . . . 1 2 94 1 2 . OR 1 2 94 2 . 3 . 1 2 94 3 . . . 1 2 95 1 2 . OR 1 2 95 2 . 3 . 1 2 95 3 . . . 1 2 96 1 . . . 1 2 97 1 2 . OR 1 2 97 2 . 3 . 1 2 97 3 . . . 1 2 98 1 . . . 1 2 99 1 . . . 1 2 100 1 . . . 1 2 101 1 2 . OR 1 2 101 2 . 3 . 1 2 101 3 . . . 1 2 102 1 . . . 1 2 103 1 . . . 1 2 104 1 . . . 1 2 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 8 CYS HB2 A 43 . HB1 1 2 1 1 1 1 1 12 GLN HG3 A 47 . HG1 1 2 1 1 2 1 1 12 GLN HA A 47 . HA 1 2 2 1 1 1 1 22 VAL MG2 A 57 . HG21 1 2 2 1 2 1 1 25 LYS H A 60 . HN 1 2 2 1 2 1 1 26 LEU H A 61 . HN 1 2 3 2 1 1 1 21 LEU HA A 56 . HA 1 2 3 2 2 1 1 22 VAL MG1 A 57 . HG11 1 2 3 3 1 1 1 22 VAL MG2 A 57 . HG21 1 2 3 3 2 1 1 23 ALA HA A 58 . HA 1 2 3 3 2 1 1 26 LEU HA A 61 . HA 1 2 4 1 1 1 1 25 LYS H A 60 . HN 1 2 4 1 1 1 1 26 LEU H A 61 . HN 1 2 4 1 2 1 1 25 LYS HB3 A 60 . HB1 1 2 5 1 1 1 1 33 PHE HB2 A 68 . HB2 1 2 5 1 2 1 1 34 CYS H A 69 . HN 1 2 5 1 2 1 1 54 PHE QE A 89 . HE1 1 2 6 2 1 1 1 35 CYS HB3 A 70 . HB1 1 2 6 2 2 1 1 40 THR H A 75 . HN 1 2 6 3 1 1 1 37 HIS QB A 72 . HB1 1 2 6 3 2 1 1 38 CYS H A 73 . HN 1 2 7 1 1 1 1 41 LYS H A 76 . HN 1 2 7 1 2 1 1 41 LYS QB A 76 . HB1 1 2 8 1 1 1 1 43 SER H A 78 . HN 1 2 8 1 2 1 1 43 SER QB A 78 . HB1 1 2 9 1 1 1 1 47 TYR QD A 82 . HD1 1 2 9 1 1 1 1 54 PHE QD A 89 . HD1 1 2 9 1 2 1 1 49 ALA HA A 84 . HA 1 2 10 1 1 1 1 36 LYS H A 71 . HN 1 2 10 1 1 1 1 56 CYS H A 91 . HN 1 2 10 1 2 1 1 55 TYR HA A 90 . HA 1 2 11 1 1 1 1 24 ASP HB2 A 59 . HB2 1 2 11 1 2 1 1 25 LYS H A 60 . HN 1 2 11 1 2 1 1 26 LEU H A 61 . HN 1 2 12 1 1 1 1 61 GLN QG A 96 . HG1 1 2 12 1 1 1 1 62 GLN HG3 A 97 . HG2 1 2 12 1 2 1 1 62 GLN H A 97 . HN 1 2 13 1 1 1 1 37 HIS QB A 72 . HB1 1 2 13 1 1 1 1 59 HIS HB3 A 94 . HB1 1 2 13 1 2 1 1 63 LEU MD1 A 98 . HD11 1 2 14 1 1 1 1 60 PHE HA A 95 . HA 1 2 14 1 1 1 1 63 LEU HA A 98 . HA 1 2 14 1 2 1 1 63 LEU MD1 A 98 . HD11 1 2 15 1 1 1 1 55 TYR QE A 90 . HE1 1 2 15 1 1 1 1 64 PHE QD A 99 . HD1 1 2 15 1 2 1 1 63 LEU MD2 A 98 . HD21 1 2 16 1 1 1 1 9 ALA H A 44 . HN 1 2 16 1 2 1 1 15 VAL MG1 A 50 . HG11 1 2 16 1 2 1 1 23 ALA MB A 58 . HB1 1 2 17 1 1 1 1 11 CYS H A 46 . HN 1 2 17 1 2 1 1 29 HIS HE1 A 64 . HE1 1 2 17 1 2 1 1 54 PHE QD A 89 . HD1 1 2 18 1 1 1 1 23 ALA H A 58 . HN 1 2 18 1 2 1 1 25 LYS H A 60 . HN 1 2 18 1 2 1 1 26 LEU H A 61 . HN 1 2 19 1 1 1 1 23 ALA HA A 58 . HA 1 2 19 1 1 1 1 26 LEU HA A 61 . HA 1 2 19 1 2 1 1 25 LYS H A 60 . HN 1 2 20 1 1 1 1 26 LEU HB3 A 61 . HB1 1 2 20 1 1 1 1 26 LEU MD2 A 61 . HD21 1 2 20 1 2 1 1 27 ILE H A 62 . HN 1 2 21 1 1 1 1 21 LEU HB3 A 56 . HB1 1 2 21 1 1 1 1 27 ILE HG13 A 62 . HG12 1 2 21 1 2 1 1 28 PHE H A 63 . HN 1 2 22 1 1 1 1 8 CYS HB2 A 43 . HB1 1 2 22 1 1 1 1 28 PHE HB3 A 63 . HB1 1 2 22 1 2 1 1 29 HIS H A 64 . HN 1 2 23 1 1 1 1 15 VAL HB A 50 . HB 1 2 23 1 1 1 1 21 LEU HB3 A 56 . HB1 1 2 23 1 2 1 1 29 HIS H A 64 . HN 1 2 24 1 1 1 1 19 GLU HB2 A 54 . HB2 1 2 24 1 1 1 1 19 GLU HG2 A 54 . HG2 1 2 24 1 2 1 1 30 ASN H A 65 . HN 1 2 25 1 1 1 1 31 SER HB2 A 66 . HB1 1 2 25 1 1 1 1 43 SER HB2 A 78 . HB2 1 2 25 1 2 1 1 32 CYS H A 67 . HN 1 2 26 1 1 1 1 29 HIS H A 64 . HN 1 2 26 1 1 1 1 35 CYS H A 70 . HN 1 2 26 1 2 1 1 33 PHE H A 68 . HN 1 2 27 1 1 1 1 21 LEU MD1 A 56 . HD11 1 2 27 1 1 1 1 42 LEU QD A 77 . HD21 1 2 27 1 2 1 1 33 PHE H A 68 . HN 1 2 28 1 1 1 1 37 HIS H A 72 . HN 1 2 28 1 2 1 1 55 TYR HB3 A 90 . HB2 1 2 28 1 2 1 1 59 HIS HB2 A 94 . HB2 1 2 29 1 1 1 1 36 LYS H A 71 . HN 1 2 29 1 1 1 1 56 CYS H A 91 . HN 1 2 29 1 2 1 1 40 THR H A 75 . HN 1 2 30 1 1 1 1 39 HIS HA A 74 . HA 1 2 30 1 1 1 1 40 THR HB A 75 . HB 1 2 30 1 2 1 1 40 THR H A 75 . HN 1 2 31 1 1 1 1 33 PHE QR A 68 . HD1 1 2 31 1 2 1 1 42 LEU H A 77 . HN 1 2 32 1 1 1 1 42 LEU HA A 77 . HA 1 2 32 1 1 1 1 44 LEU HA A 79 . HA 1 2 32 1 2 1 1 46 SER H A 81 . HN 1 2 33 1 1 1 1 41 LYS HB3 A 76 . HB1 1 2 33 1 1 1 1 44 LEU HB2 A 79 . HB2 1 2 33 1 2 1 1 46 SER H A 81 . HN 1 2 34 1 1 1 1 53 GLU H A 88 . HN 1 2 34 1 2 1 1 55 TYR QE A 90 . HE1 1 2 34 1 2 1 1 64 PHE QD A 99 . HD1 1 2 35 1 1 1 1 50 LEU HA A 85 . HA 1 2 35 1 1 1 1 51 HIS HA A 86 . HA 1 2 35 1 2 1 1 53 GLU H A 88 . HN 1 2 36 1 1 1 1 36 LYS HD2 A 71 . HD2 1 2 36 1 1 1 1 53 GLU HB3 A 88 . HB1 1 2 36 1 2 1 1 54 PHE H A 89 . HN 1 2 37 1 1 1 1 57 LYS QB A 92 . HB1 1 2 37 1 1 1 1 58 PRO HG3 A 93 . HG1 1 2 37 1 2 1 1 59 HIS H A 94 . HN 1 2 38 1 1 1 1 58 PRO HB3 A 93 . HB2 1 2 38 1 1 1 1 61 GLN HB3 A 96 . HB2 1 2 38 1 2 1 1 60 PHE H A 95 . HN 1 2 39 1 1 1 1 60 PHE H A 95 . HN 1 2 39 1 2 1 1 61 GLN HB2 A 96 . HB1 1 2 39 1 2 1 1 62 GLN HB2 A 97 . HB2 1 2 40 1 1 1 1 48 ALA MB A 83 . HB1 1 2 40 1 1 1 1 63 LEU HB2 A 98 . HB1 1 2 40 1 2 1 1 61 GLN H A 96 . HN 1 2 41 1 1 1 1 61 GLN HA A 96 . HA 1 2 41 1 1 1 1 63 LEU HA A 98 . HA 1 2 41 1 2 1 1 64 PHE H A 99 . HN 1 2 42 1 1 1 1 61 GLN HB2 A 96 . HB1 1 2 42 1 1 1 1 64 PHE HB3 A 99 . HB1 1 2 42 1 2 1 1 65 LYS H A 100 . HN 1 2 43 1 1 1 1 32 CYS H A 67 . HN 1 2 43 1 2 1 1 44 LEU HB2 A 79 . HB2 1 2 43 1 2 1 1 44 LEU HG A 79 . HG 1 2 44 1 1 1 1 8 CYS HB2 A 43 . HB1 1 2 44 1 1 1 1 28 PHE HB3 A 63 . HB1 1 2 44 1 2 1 1 32 CYS H A 67 . HN 1 2 45 1 1 1 1 26 LEU MD1 A 61 . HD11 1 2 45 1 2 1 1 54 PHE QE A 89 . HE1 1 2 45 1 2 1 1 54 PHE HZ A 89 . HZ 1 2 46 1 1 1 1 42 LEU QD A 77 . HD11 1 2 46 1 2 1 1 47 TYR QD A 82 . HD1 1 2 46 1 2 1 1 54 PHE QD A 89 . HD1 1 2 47 1 1 1 1 55 TYR QD A 90 . HD1 1 2 47 1 2 1 1 64 PHE QR A 99 . HD1 1 2 48 1 1 1 1 28 PHE HA A 63 . HA 1 2 48 1 1 1 1 33 PHE QE A 68 . HE1 1 2 48 1 2 1 1 28 PHE QD A 63 . HD1 1 2 49 2 1 1 1 47 TYR HA A 82 . HA 1 2 49 2 2 1 1 47 TYR QD A 82 . HD1 1 2 49 3 1 1 1 49 ALA HA A 84 . HA 1 2 49 3 2 1 1 54 PHE QD A 89 . HD1 1 2 50 1 1 1 1 55 TYR QE A 90 . HE1 1 2 50 1 1 1 1 64 PHE QD A 99 . HD1 1 2 50 1 2 1 1 60 PHE HA A 95 . HA 1 2 51 2 1 1 1 33 PHE HB2 A 68 . HB2 1 2 51 2 2 1 1 54 PHE QD A 89 . HD1 1 2 51 3 1 1 1 55 TYR QD A 90 . HD1 1 2 51 3 2 1 1 59 HIS HB3 A 94 . HB1 1 2 52 1 1 1 1 55 TYR HB2 A 90 . HB1 1 2 52 1 1 1 1 64 PHE HB2 A 99 . HB2 1 2 52 1 2 1 1 60 PHE QD A 95 . HD1 1 2 53 1 1 1 1 53 GLU HB2 A 88 . HB2 1 2 53 1 2 1 1 55 TYR QE A 90 . HE1 1 2 53 1 2 1 1 64 PHE HZ A 99 . HZ 1 2 54 1 1 1 1 36 LYS HD2 A 71 . HD2 1 2 54 1 1 1 1 53 GLU HB3 A 88 . HB1 1 2 54 1 2 1 1 55 TYR QE A 90 . HE1 1 2 55 1 1 1 1 21 LEU HB3 A 56 . HB1 1 2 55 1 1 1 1 21 LEU HG A 56 . HG 1 2 55 1 2 1 1 28 PHE QD A 63 . HD1 1 2 56 2 1 1 1 44 LEU MD2 A 79 . HD21 1 2 56 2 2 1 1 47 TYR QD A 82 . HD1 1 2 56 3 1 1 1 55 TYR QD A 90 . HD1 1 2 56 3 2 1 1 63 LEU HB3 A 98 . HB2 1 2 57 1 1 1 1 26 LEU HB3 A 61 . HB1 1 2 57 1 1 1 1 44 LEU MD2 A 79 . HD21 1 2 57 1 2 1 1 28 PHE QE A 63 . HE1 1 2 58 1 1 1 1 9 ALA MB A 44 . HB1 1 2 58 1 2 1 1 54 PHE QE A 89 . HE1 1 2 58 1 2 1 1 54 PHE HZ A 89 . HZ 1 2 59 2 1 1 1 21 LEU MD1 A 56 . HD11 1 2 59 2 2 1 1 28 PHE QD A 63 . HD1 1 2 59 3 1 1 1 50 LEU MD1 A 85 . HD11 1 2 59 3 2 1 1 64 PHE QR A 99 . HD1 1 2 60 1 1 1 1 50 LEU MD2 A 85 . HD21 1 2 60 1 2 1 1 64 PHE QR A 99 . HD1 1 2 61 2 1 1 1 39 HIS HA A 74 . HA 1 2 61 2 2 1 1 39 HIS HD2 A 74 . HD2 1 2 61 3 1 1 1 50 LEU HA A 85 . HA 1 2 61 3 2 1 1 60 PHE QE A 95 . HE1 1 2 62 2 1 1 1 33 PHE QD A 68 . HD1 1 2 62 2 2 1 1 54 PHE QD A 89 . HD1 1 2 62 3 1 1 1 33 PHE QE A 68 . HE1 1 2 62 3 2 1 1 47 TYR QD A 82 . HD1 1 2 63 1 1 1 1 28 PHE QD A 63 . HD1 1 2 63 1 2 1 1 33 PHE QR A 68 . HD1 1 2 64 1 1 1 1 28 PHE QE A 63 . HE1 1 2 64 1 2 1 1 33 PHE QR A 68 . HD1 1 2 65 1 1 1 1 47 TYR HA A 82 . HA 1 2 65 1 1 1 1 49 ALA HA A 84 . HA 1 2 65 1 2 1 1 48 ALA MB A 83 . HB1 1 2 66 1 1 1 1 34 CYS HA A 69 . HA 1 2 66 1 1 1 1 54 PHE HA A 89 . HA 1 2 66 1 2 1 1 42 LEU QD A 77 . HD21 1 2 67 1 1 1 1 42 LEU QD A 77 . HD11 1 2 67 1 2 1 1 54 PHE HA A 89 . HA 1 2 67 1 2 1 1 56 CYS HA A 91 . HA 1 2 68 1 1 1 1 19 GLU HA A 54 . HA 1 2 68 1 2 1 1 19 GLU HB2 A 54 . HB2 1 2 68 1 2 1 1 19 GLU HG2 A 54 . HG2 1 2 69 2 1 1 1 19 GLU HA A 54 . HA 1 2 69 2 2 1 1 19 GLU HB3 A 54 . HB1 1 2 69 3 1 1 1 53 GLU HA A 88 . HA 1 2 69 3 2 1 1 53 GLU HG2 A 88 . HG2 1 2 70 2 1 1 1 17 PRO HB3 A 52 . HB2 1 2 70 2 2 1 1 18 MET HA A 53 . HA 1 2 70 3 1 1 1 34 CYS HB3 A 69 . HB2 1 2 70 3 2 1 1 39 HIS HA A 74 . HA 1 2 71 1 1 1 1 58 PRO HA A 93 . HA 1 2 71 1 2 1 1 58 PRO HB3 A 93 . HB2 1 2 71 1 2 1 1 61 GLN HB3 A 96 . HB2 1 2 72 1 1 1 1 7 THR MG A 42 . HG21 1 2 72 1 2 1 1 12 GLN HA A 47 . HA 1 2 72 1 2 1 1 14 THR HA A 49 . HA 1 2 73 1 1 1 1 8 CYS HA A 43 . HA 1 2 73 1 1 1 1 14 THR HA A 49 . HA 1 2 73 1 2 1 1 15 VAL MG2 A 50 . HG21 1 2 74 1 1 1 1 21 LEU HA A 56 . HA 1 2 74 1 1 1 1 23 ALA HA A 58 . HA 1 2 74 1 2 1 1 21 LEU MD2 A 56 . HD21 1 2 75 2 1 1 1 9 ALA HA A 44 . HA 1 2 75 2 2 1 1 12 GLN HG3 A 47 . HG1 1 2 75 3 1 1 1 62 GLN HA A 97 . HA 1 2 75 3 2 1 1 62 GLN HG2 A 97 . HG1 1 2 76 2 1 1 1 20 ARG HA A 55 . HA 1 2 76 2 2 1 1 20 ARG HG3 A 55 . HG1 1 2 76 3 1 1 1 46 SER HB2 A 81 . HB2 1 2 76 3 2 1 1 57 LYS HG2 A 92 . HG1 1 2 77 2 1 1 1 18 MET HA A 53 . HA 1 2 77 2 2 1 1 18 MET HG3 A 53 . HG2 1 2 77 3 1 1 1 64 PHE HA A 99 . HA 1 2 77 3 2 1 1 64 PHE HB2 A 99 . HB2 1 2 78 1 1 1 1 10 ALA MB A 45 . HB1 1 2 78 1 2 1 1 28 PHE HB2 A 63 . HB2 1 2 78 1 2 1 1 32 CYS HB3 A 67 . HB1 1 2 79 1 1 1 1 35 CYS HB3 A 70 . HB1 1 2 79 1 1 1 1 56 CYS QB A 91 . HB1 1 2 79 1 2 1 1 40 THR MG A 75 . HG21 1 2 80 2 1 1 1 26 LEU HA A 61 . HA 1 2 80 2 2 1 1 26 LEU HB2 A 61 . HB2 1 2 80 3 1 1 1 64 PHE HA A 99 . HA 1 2 80 3 2 1 1 64 PHE HB3 A 99 . HB1 1 2 81 1 1 1 1 21 LEU HA A 56 . HA 1 2 81 1 2 1 1 21 LEU HB3 A 56 . HB1 1 2 81 1 2 1 1 21 LEU HG A 56 . HG 1 2 82 2 1 1 1 21 LEU HG A 56 . HG 1 2 82 2 2 1 1 44 LEU MD2 A 79 . HD21 1 2 82 3 1 1 1 63 LEU HB3 A 98 . HB2 1 2 82 3 2 1 1 63 LEU HG A 98 . HG 1 2 83 1 1 1 1 9 ALA MB A 44 . HB1 1 2 83 1 1 1 1 26 LEU MD2 A 61 . HD21 1 2 83 1 2 1 1 54 PHE QE A 89 . HE1 1 2 84 1 1 1 1 9 ALA MB A 44 . HB1 1 2 84 1 1 1 1 26 LEU HB3 A 61 . HB1 1 2 84 1 2 1 1 28 PHE QE A 63 . HE1 1 2 85 2 1 1 1 15 VAL MG1 A 50 . HG11 1 2 85 2 2 1 1 29 HIS HE1 A 64 . HE1 1 2 85 3 1 1 1 23 ALA MB A 58 . HB1 1 2 85 3 1 1 1 48 ALA MB A 83 . HB1 1 2 85 3 2 1 1 47 TYR QD A 82 . HD1 1 2 85 4 1 1 1 23 ALA MB A 58 . HB1 1 2 85 4 2 1 1 54 PHE QD A 89 . HD1 1 2 86 2 1 1 1 21 LEU MD1 A 56 . HD11 1 2 86 2 2 1 1 30 ASN HA A 65 . HA 1 2 86 3 1 1 1 35 CYS HA A 70 . HA 1 2 86 3 2 1 1 42 LEU QD A 77 . HD21 1 2 87 1 1 1 1 22 VAL MG2 A 57 . HG21 1 2 87 1 2 1 1 23 ALA HA A 58 . HA 1 2 87 1 2 1 1 26 LEU HA A 61 . HA 1 2 88 1 1 1 1 26 LEU HA A 61 . HA 1 2 88 1 2 1 1 26 LEU HB3 A 61 . HB1 1 2 88 1 2 1 1 26 LEU MD2 A 61 . HD21 1 2 89 2 1 1 1 26 LEU HA A 61 . HA 1 2 89 2 2 1 1 26 LEU MD1 A 61 . HD11 1 2 89 3 1 1 1 39 HIS HA A 74 . HA 1 2 89 3 2 1 1 40 THR MG A 75 . HG21 1 2 90 2 1 1 1 14 THR HB A 49 . HB 1 2 90 2 2 1 1 14 THR MG A 49 . HG21 1 2 90 3 1 1 1 22 VAL MG2 A 57 . HG21 1 2 90 3 2 1 1 25 LYS HA A 60 . HA 1 2 91 1 1 1 1 44 LEU HB2 A 79 . HB2 1 2 91 1 1 1 1 44 LEU HG A 79 . HG 1 2 91 1 2 1 1 44 LEU MD2 A 79 . HD21 1 2 92 1 1 1 1 22 VAL HB A 57 . HB 1 2 92 1 2 1 1 22 VAL QG A 57 . HG11 1 2 93 1 1 1 1 15 VAL MG1 A 50 . HG11 1 2 93 1 1 1 1 27 ILE MG A 62 . HG21 1 2 93 1 2 1 1 20 ARG HB2 A 55 . HB2 1 2 94 2 1 1 1 20 ARG HG3 A 55 . HG1 1 2 94 2 2 1 1 27 ILE MD A 62 . HD11 1 2 94 3 1 1 1 40 THR MG A 75 . HG21 1 2 94 3 2 1 1 42 LEU QD A 77 . HD21 1 2 95 2 1 1 1 20 ARG HG2 A 55 . HG2 1 2 95 2 2 1 1 27 ILE MD A 62 . HD11 1 2 95 3 1 1 1 50 LEU HB3 A 85 . HB1 1 2 95 3 2 1 1 50 LEU MD1 A 85 . HD11 1 2 96 1 1 1 1 26 LEU HB3 A 61 . HB1 1 2 96 1 1 1 1 26 LEU MD2 A 61 . HD21 1 2 96 1 2 1 1 26 LEU MD1 A 61 . HD11 1 2 97 2 1 1 1 20 ARG HG2 A 55 . HG2 1 2 97 2 2 1 1 22 VAL MG1 A 57 . HG11 1 2 97 3 1 1 1 22 VAL MG2 A 57 . HG21 1 2 97 3 2 1 1 25 LYS HG3 A 60 . HG1 1 2 98 1 1 1 1 22 VAL QG A 57 . HG11 1 2 98 1 2 1 1 27 ILE MG A 62 . HG21 1 2 99 1 1 1 1 22 VAL QG A 57 . HG11 1 2 99 1 2 1 1 27 ILE MD A 62 . HD11 1 2 100 1 1 1 1 15 VAL MG1 A 50 . HG11 1 2 100 1 1 1 1 23 ALA MB A 58 . HB1 1 2 100 1 2 1 1 28 PHE QD A 63 . HD1 1 2 101 2 1 1 1 15 VAL MG1 A 50 . HG11 1 2 101 2 2 1 1 28 PHE HA A 63 . HA 1 2 101 3 1 1 1 23 ALA MB A 58 . HB1 1 2 101 3 2 1 1 33 PHE QE A 68 . HE1 1 2 102 1 1 1 1 63 LEU HA A 98 . HA 1 2 102 1 2 1 1 63 LEU HB2 A 98 . HB1 1 2 102 1 2 1 1 63 LEU MD2 A 98 . HD21 1 2 103 1 1 1 1 21 LEU HB3 A 56 . HB1 1 2 103 1 1 1 1 21 LEU HG A 56 . HG 1 2 103 1 2 1 1 21 LEU MD2 A 56 . HD21 1 2 104 1 1 1 1 63 LEU HB2 A 98 . HB1 1 2 104 1 1 1 1 63 LEU MD2 A 98 . HD21 1 2 104 1 2 1 1 63 LEU MD1 A 98 . HD11 1 2 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 2.42 1.688 3.152 1 2 2 1 . . . . . 2.19 1.591 2.789 1 2 3 2 . . . . . 2.435 1.694 3.176 1 2 3 3 . . . . . 2.435 1.694 3.176 1 2 4 1 . . . . . 2.845 1.833 3.857 1 2 5 1 . . . . . 2.813 1.86 3.766 1 2 6 2 . . . . . 2.397 1.679 3.115 1 2 6 3 . . . . . 2.397 1.679 3.115 1 2 7 1 . . . . . 2.432 1.693 3.171 1 2 8 1 . . . . . 2.808 1.823 3.793 1 2 9 1 . . . . . 2.499 1.718 3.28 1 2 10 1 . . . . . 2.062 1.53 2.594 1 2 11 1 . . . . . 2.385 1.674 3.096 1 2 12 1 . . . . . 2.723 1.796 3.65 1 2 13 1 . . . . . 2.365 1.666 3.064 1 2 14 1 . . . . . 2.623 1.763 3.483 1 2 15 1 . . . . . 2.723 1.796 3.65 1 2 16 1 . . . . . 3.879 1.998 5.76 1 2 17 1 . . . . . 3.886 1.998 5.774 1 2 18 1 . . . . . 2.859 1.837 3.881 1 2 19 1 . . . . . 3.435 1.96 4.91 1 2 20 1 . . . . . 2.509 1.722 3.296 1 2 21 1 . . . . . 3.1 1.899 4.301 1 2 22 1 . . . . . 2.998 1.875 4.121 1 2 23 1 . . . . . 4.261 1.992 6.53 1 2 24 1 . . . . . 3.178 1.916 4.44 1 2 25 1 . . . . . 3.528 1.972 5.084 1 2 26 1 . . . . . 4.209 1.994 6.424 1 2 27 1 . . . . . 3.89 1.998 5.782 1 2 28 1 . . . . . 3.796 1.995 5.597 1 2 29 1 . . . . . 3.737 1.992 5.482 1 2 30 1 . . . . . 1.888 1.442 2.334 1 2 31 1 . . . . . 4.108 2.389 5.827 1 2 32 1 . . . . . 3.196 1.919 4.473 1 2 33 1 . . . . . 4.103 1.999 6.207 1 2 34 1 . . . . . 3.938 1.999 5.877 1 2 35 1 . . . . . 3.397 1.955 4.839 1 2 36 1 . . . . . 2.71 1.792 3.628 1 2 37 1 . . . . . 3.544 1.974 5.114 1 2 38 1 . . . . . 3.592 1.979 5.205 1 2 39 1 . . . . . 3.467 1.964 4.97 1 2 40 1 . . . . . 3.79 1.995 5.585 1 2 41 1 . . . . . 2.839 1.831 3.847 1 2 42 1 . . . . . 3.416 1.957 4.875 1 2 43 1 . . . . . 4.447 2.192 6.702 1 2 44 1 . . . . . 4.417 1.978 6.856 1 2 45 1 . . . . . 2.346 1.658 3.034 1 2 46 1 . . . . . 2.667 1.867 3.467 1 2 47 1 . . . . . 2.59 1.752 3.428 1 2 48 1 . . . . . 2.274 1.628 2.92 1 2 49 2 . . . . . 2.48 1.711 3.249 1 2 49 3 . . . . . 2.48 1.711 3.249 1 2 50 1 . . . . . 2.507 1.698 3.316 1 2 51 2 . . . . . 2.222 1.605 2.839 1 2 51 3 . . . . . 2.222 1.605 2.839 1 2 52 1 . . . . . 2.586 1.75 3.422 1 2 53 1 . . . . . 2.623 1.789 3.457 1 2 54 1 . . . . . 2.387 1.675 3.099 1 2 55 1 . . . . . 2.652 1.773 3.531 1 2 56 2 . . . . . 2.384 1.674 3.094 1 2 56 3 . . . . . 2.384 1.674 3.094 1 2 57 1 . . . . . 2.512 1.723 3.301 1 2 58 1 . . . . . 2.424 1.689 3.159 1 2 59 2 . . . . . 2.48 1.711 3.249 1 2 59 3 . . . . . 2.48 1.711 3.249 1 2 60 1 . . . . . 2.326 1.65 3.002 1 2 61 2 . . . . . 2.882 1.973 3.791 1 2 61 3 . . . . . 2.882 1.973 3.791 1 2 62 2 . . . . . 2.357 1.663 3.051 1 2 62 3 . . . . . 2.357 1.663 3.051 1 2 63 1 . . . . . 2.576 1.747 3.405 1 2 64 1 . . . . . 2.654 1.774 3.534 1 2 65 1 . . . . . 2.654 1.774 3.534 1 2 66 1 . . . . . 2.546 1.736 3.356 1 2 67 1 . . . . . 2.654 1.774 3.534 1 2 68 1 . . . . . 2.172 1.582 2.762 1 2 69 2 . . . . . 2.33 1.651 3.009 1 2 69 3 . . . . . 2.33 1.651 3.009 1 2 70 2 . . . . . 2.398 1.679 3.117 1 2 70 3 . . . . . 2.398 1.679 3.117 1 2 71 1 . . . . . 2.109 1.553 2.665 1 2 72 1 . . . . . 1.995 1.497 2.493 1 2 73 1 . . . . . 2.215 1.602 2.828 1 2 74 1 . . . . . 2.363 1.665 3.061 1 2 75 2 . . . . . 2.255 1.62 2.89 1 2 75 3 . . . . . 2.255 1.62 2.89 1 2 76 2 . . . . . 2.636 1.768 3.504 1 2 76 3 . . . . . 2.636 1.768 3.504 1 2 77 2 . . . . . 2.312 1.644 2.98 1 2 77 3 . . . . . 2.312 1.644 2.98 1 2 78 1 . . . . . 2.435 1.694 3.176 1 2 79 1 . . . . . 2.307 1.642 2.972 1 2 80 2 . . . . . 2.233 1.61 2.856 1 2 80 3 . . . . . 2.233 1.61 2.856 1 2 81 1 . . . . . 2.052 1.526 2.578 1 2 82 2 . . . . . 2.454 1.701 3.207 1 2 82 3 . . . . . 2.454 1.701 3.207 1 2 83 1 . . . . . 2.574 1.746 3.402 1 2 84 1 . . . . . 2.347 1.658 3.036 1 2 85 2 . . . . . 2.582 1.749 3.415 1 2 85 3 . . . . . 2.582 1.749 3.415 1 2 85 4 . . . . . 2.582 1.749 3.415 1 2 86 2 . . . . . 2.108 1.552 2.664 1 2 86 3 . . . . . 2.108 1.552 2.664 1 2 87 1 . . . . . 2.517 1.725 3.309 1 2 88 1 . . . . . 1.863 1.429 2.297 1 2 89 2 . . . . . 2.798 1.818 3.778 1 2 89 3 . . . . . 2.798 1.818 3.778 1 2 90 2 . . . . . 1.729 1.355 2.103 1 2 90 3 . . . . . 1.729 1.355 2.103 1 2 91 1 . . . . . 2.014 1.507 2.521 1 2 92 1 . . . . . 2.031 1.515 2.547 1 2 93 1 . . . . . 2.474 1.709 3.239 1 2 94 2 . . . . . 2.261 1.622 2.9 1 2 94 3 . . . . . 2.261 1.622 2.9 1 2 95 2 . . . . . 2.342 1.656 3.028 1 2 95 3 . . . . . 2.342 1.656 3.028 1 2 96 1 . . . . . 1.724 1.352 2.096 1 2 97 2 . . . . . 2.511 1.723 3.299 1 2 97 3 . . . . . 2.511 1.723 3.299 1 2 98 1 . . . . . 2.598 1.754 3.442 1 2 99 1 . . . . . 2.046 1.523 2.569 1 2 100 1 . . . . . 2.731 1.793 3.669 1 2 101 2 . . . . . 2.287 1.633 2.941 1 2 101 3 . . . . . 2.287 1.633 2.941 1 2 102 1 . . . . . 1.847 1.42 2.274 1 2 103 1 . . . . . 2.068 1.533 2.603 1 2 104 1 . . . . . 1.736 1.359 2.113 1 2 stop_ save_ save_CNS/XPLOR_distance_constraints_4_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 3 _Distance_constraint_list.Constraint_type "hydrogen bond" _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 3 2 1 . . . 1 3 3 1 . . . 1 3 4 1 . . . 1 3 5 1 . . . 1 3 6 1 . . . 1 3 7 1 . . . 1 3 8 1 . . . 1 3 9 1 . . . 1 3 10 1 . . . 1 3 11 1 . . . 1 3 12 1 . . . 1 3 13 1 . . . 1 3 14 1 . . . 1 3 15 1 . . . 1 3 16 1 . . . 1 3 17 1 . . . 1 3 18 1 . . . 1 3 19 1 . . . 1 3 20 1 . . . 1 3 21 1 . . . 1 3 22 1 . . . 1 3 23 1 . . . 1 3 24 1 . . . 1 3 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 6 GLU O A 41 . O 1 3 1 1 2 1 1 15 VAL H A 50 . HN 1 3 2 1 1 1 1 6 GLU O A 41 . O 1 3 2 1 2 1 1 15 VAL N A 50 . N 1 3 3 1 1 1 1 8 CYS H A 43 . HN 1 3 3 1 2 1 1 13 LYS O A 48 . O 1 3 4 1 1 1 1 8 CYS N A 43 . N 1 3 4 1 2 1 1 13 LYS O A 48 . O 1 3 5 1 1 1 1 23 ALA O A 58 . O 1 3 5 1 2 1 1 26 LEU H A 61 . HN 1 3 6 1 1 1 1 23 ALA O A 58 . O 1 3 6 1 2 1 1 26 LEU N A 61 . N 1 3 7 1 1 1 1 23 ALA H A 58 . HN 1 3 7 1 2 1 1 26 LEU O A 61 . O 1 3 8 1 1 1 1 23 ALA N A 58 . N 1 3 8 1 2 1 1 26 LEU O A 61 . O 1 3 9 1 1 1 1 21 LEU H A 56 . HN 1 3 9 1 2 1 1 28 PHE O A 63 . O 1 3 10 1 1 1 1 21 LEU N A 56 . N 1 3 10 1 2 1 1 28 PHE O A 63 . O 1 3 11 1 1 1 1 21 LEU O A 56 . O 1 3 11 1 2 1 1 28 PHE H A 63 . HN 1 3 12 1 1 1 1 21 LEU O A 56 . O 1 3 12 1 2 1 1 28 PHE N A 63 . N 1 3 13 1 1 1 1 50 LEU O A 85 . O 1 3 13 1 2 1 1 53 GLU H A 88 . HN 1 3 14 1 1 1 1 50 LEU O A 85 . O 1 3 14 1 2 1 1 53 GLU N A 88 . N 1 3 15 1 1 1 1 50 LEU H A 85 . HN 1 3 15 1 2 1 1 53 GLU O A 88 . O 1 3 16 1 1 1 1 50 LEU N A 85 . N 1 3 16 1 2 1 1 53 GLU O A 88 . O 1 3 17 1 1 1 1 48 ALA O A 83 . O 1 3 17 1 2 1 1 55 TYR H A 90 . HN 1 3 18 1 1 1 1 48 ALA O A 83 . O 1 3 18 1 2 1 1 55 TYR N A 90 . N 1 3 19 1 1 1 1 57 LYS O A 92 . O 1 3 19 1 2 1 1 61 GLN H A 96 . HN 1 3 20 1 1 1 1 57 LYS O A 92 . O 1 3 20 1 2 1 1 61 GLN N A 96 . N 1 3 21 1 1 1 1 59 HIS O A 94 . O 1 3 21 1 2 1 1 63 LEU H A 98 . HN 1 3 22 1 1 1 1 59 HIS O A 94 . O 1 3 22 1 2 1 1 63 LEU N A 98 . N 1 3 23 1 1 1 1 60 PHE O A 95 . O 1 3 23 1 2 1 1 64 PHE H A 99 . HN 1 3 24 1 1 1 1 60 PHE O A 95 . O 1 3 24 1 2 1 1 64 PHE N A 99 . N 1 3 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 1.8 1.8 2.3 1 3 2 1 . . . . . 2.8 2.8 3.3 1 3 3 1 . . . . . 1.8 1.8 2.3 1 3 4 1 . . . . . 2.8 2.8 3.3 1 3 5 1 . . . . . 1.8 1.8 2.3 1 3 6 1 . . . . . 2.8 2.8 3.3 1 3 7 1 . . . . . 1.8 1.8 2.3 1 3 8 1 . . . . . 2.8 2.8 3.3 1 3 9 1 . . . . . 1.8 1.8 2.3 1 3 10 1 . . . . . 2.8 2.8 3.3 1 3 11 1 . . . . . 1.8 1.8 2.3 1 3 12 1 . . . . . 2.8 2.8 3.3 1 3 13 1 . . . . . 1.8 1.8 2.3 1 3 14 1 . . . . . 2.8 2.8 3.3 1 3 15 1 . . . . . 1.8 1.8 2.3 1 3 16 1 . . . . . 2.8 2.8 3.3 1 3 17 1 . . . . . 1.8 1.8 2.3 1 3 18 1 . . . . . 2.8 2.8 3.3 1 3 19 1 . . . . . 1.8 1.8 2.3 1 3 20 1 . . . . . 2.8 2.8 3.3 1 3 21 1 . . . . . 1.8 1.8 2.3 1 3 22 1 . . . . . 2.8 2.8 3.3 1 3 23 1 . . . . . 1.8 1.8 2.3 1 3 24 1 . . . . . 2.8 2.8 3.3 1 3 stop_ save_ save_conformer_family_coord_set_1 _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Entry_ID 1 _Conformer_family_coord_set.ID 1 loop_ _Atom_site.Model_ID _Atom_site.ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Occupancy _Atom_site.Uncertainty _Atom_site.PDBX_label_asym_ID _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID 1 1 1 1 1 ARG C C -21.170 6.816 0.796 1.00 . A A . 36 ARG C 1 1 1 2 1 1 1 ARG CA C -22.038 8.042 0.710 1.00 . A A . 36 ARG CA 1 1 1 3 1 1 1 ARG CB C -23.180 7.924 1.706 1.00 . A A . 36 ARG CB 1 1 1 4 1 1 1 ARG CD C -23.060 10.145 2.817 1.00 . A A . 36 ARG CD 1 1 1 5 1 1 1 ARG CG C -23.917 9.209 1.989 1.00 . A A . 36 ARG CG 1 1 1 6 1 1 1 ARG CZ C -23.792 11.916 4.388 1.00 . A A . 36 ARG CZ 1 1 1 7 1 1 1 ARG H1 H -21.767 8.271 -1.321 1.00 . A A . 36 ARG H1 1 1 1 8 1 1 1 ARG H2 H -23.127 9.063 -0.751 1.00 . A A . 36 ARG H2 1 1 1 9 1 1 1 ARG H3 H -23.120 7.372 -0.912 1.00 . A A . 36 ARG H3 1 1 1 10 1 1 1 ARG HA H -21.440 8.906 0.954 1.00 . A A . 36 ARG HA 1 1 1 11 1 1 1 ARG HB2 H -23.894 7.196 1.354 1.00 . A A . 36 ARG HB2 1 1 1 12 1 1 1 ARG HB3 H -22.758 7.576 2.636 1.00 . A A . 36 ARG HB3 1 1 1 13 1 1 1 ARG HD2 H -22.775 9.638 3.725 1.00 . A A . 36 ARG HD2 1 1 1 14 1 1 1 ARG HD3 H -22.171 10.403 2.261 1.00 . A A . 36 ARG HD3 1 1 1 15 1 1 1 ARG HE H -24.231 11.793 2.405 1.00 . A A . 36 ARG HE 1 1 1 16 1 1 1 ARG HG2 H -24.151 9.685 1.048 1.00 . A A . 36 ARG HG2 1 1 1 17 1 1 1 ARG HG3 H -24.829 8.991 2.525 1.00 . A A . 36 ARG HG3 1 1 1 18 1 1 1 ARG HH11 H -22.688 10.460 5.346 1.00 . A A . 36 ARG HH11 1 1 1 19 1 1 1 ARG HH12 H -23.213 11.753 6.320 1.00 . A A . 36 ARG HH12 1 1 1 20 1 1 1 ARG HH21 H -24.896 13.539 3.850 1.00 . A A . 36 ARG HH21 1 1 1 21 1 1 1 ARG HH22 H -24.452 13.468 5.499 1.00 . A A . 36 ARG HH22 1 1 1 22 1 1 1 ARG N N -22.556 8.203 -0.647 1.00 . A A . 36 ARG N 1 1 1 23 1 1 1 ARG NE N -23.768 11.366 3.164 1.00 . A A . 36 ARG NE 1 1 1 24 1 1 1 ARG NH1 N -23.188 11.326 5.413 1.00 . A A . 36 ARG NH1 1 1 1 25 1 1 1 ARG NH2 N -24.422 13.051 4.587 1.00 . A A . 36 ARG NH2 1 1 1 26 1 1 1 ARG O O -21.442 5.809 0.141 1.00 . A A . 36 ARG O 1 1 1 27 1 1 2 ALA C C -19.635 4.943 2.955 1.00 . A A . 37 ALA C 1 1 1 28 1 1 2 ALA CA C -19.212 5.804 1.770 1.00 . A A . 37 ALA CA 1 1 1 29 1 1 2 ALA CB C -17.795 6.319 1.956 1.00 . A A . 37 ALA CB 1 1 1 30 1 1 2 ALA H H -19.946 7.736 2.073 1.00 . A A . 37 ALA H 1 1 1 31 1 1 2 ALA HA H -19.240 5.201 0.874 1.00 . A A . 37 ALA HA 1 1 1 32 1 1 2 ALA HB1 H -17.743 6.914 2.856 1.00 . A A . 37 ALA HB1 1 1 1 33 1 1 2 ALA HB2 H -17.515 6.924 1.106 1.00 . A A . 37 ALA HB2 1 1 1 34 1 1 2 ALA HB3 H -17.122 5.478 2.042 1.00 . A A . 37 ALA HB3 1 1 1 35 1 1 2 ALA N N -20.125 6.901 1.589 1.00 . A A . 37 ALA N 1 1 1 36 1 1 2 ALA O O -19.528 5.355 4.117 1.00 . A A . 37 ALA O 1 1 1 37 1 1 3 GLN C C -20.125 1.433 3.122 1.00 . A A . 38 GLN C 1 1 1 38 1 1 3 GLN CA C -20.564 2.798 3.633 1.00 . A A . 38 GLN CA 1 1 1 39 1 1 3 GLN CB C -22.085 2.800 3.831 1.00 . A A . 38 GLN CB 1 1 1 40 1 1 3 GLN CD C -24.079 1.682 4.872 1.00 . A A . 38 GLN CD 1 1 1 41 1 1 3 GLN CG C -22.577 1.749 4.807 1.00 . A A . 38 GLN CG 1 1 1 42 1 1 3 GLN H H -20.332 3.609 1.698 1.00 . A A . 38 GLN H 1 1 1 43 1 1 3 GLN HA H -20.071 3.017 4.568 1.00 . A A . 38 GLN HA 1 1 1 44 1 1 3 GLN HB2 H -22.392 3.765 4.202 1.00 . A A . 38 GLN HB2 1 1 1 45 1 1 3 GLN HB3 H -22.564 2.623 2.880 1.00 . A A . 38 GLN HB3 1 1 1 46 1 1 3 GLN HE21 H -24.093 2.986 6.332 1.00 . A A . 38 GLN HE21 1 1 1 47 1 1 3 GLN HE22 H -25.639 2.408 5.824 1.00 . A A . 38 GLN HE22 1 1 1 48 1 1 3 GLN HG2 H -22.205 0.785 4.491 1.00 . A A . 38 GLN HG2 1 1 1 49 1 1 3 GLN HG3 H -22.196 1.978 5.791 1.00 . A A . 38 GLN HG3 1 1 1 50 1 1 3 GLN N N -20.173 3.796 2.647 1.00 . A A . 38 GLN N 1 1 1 51 1 1 3 GLN NE2 N -24.661 2.426 5.757 1.00 . A A . 38 GLN NE2 1 1 1 52 1 1 3 GLN O O -19.311 0.739 3.737 1.00 . A A . 38 GLN O 1 1 1 53 1 1 3 GLN OE1 O -24.711 0.939 4.119 1.00 . A A . 38 GLN OE1 1 1 1 54 1 1 4 VAL C C -19.775 0.219 -0.096 1.00 . A A . 39 VAL C 1 1 1 55 1 1 4 VAL CA C -20.342 -0.152 1.296 1.00 . A A . 39 VAL CA 1 1 1 56 1 1 4 VAL CB C -21.610 -1.070 1.210 1.00 . A A . 39 VAL CB 1 1 1 57 1 1 4 VAL CG1 C -22.716 -0.454 0.361 1.00 . A A . 39 VAL CG1 1 1 1 58 1 1 4 VAL CG2 C -21.264 -2.492 0.766 1.00 . A A . 39 VAL CG2 1 1 1 59 1 1 4 VAL H H -21.306 1.681 1.553 1.00 . A A . 39 VAL H 1 1 1 60 1 1 4 VAL HA H -19.565 -0.644 1.863 1.00 . A A . 39 VAL HA 1 1 1 61 1 1 4 VAL HB H -22.006 -1.119 2.214 1.00 . A A . 39 VAL HB 1 1 1 62 1 1 4 VAL HG11 H -23.014 0.489 0.796 1.00 . A A . 39 VAL HG11 1 1 1 63 1 1 4 VAL HG12 H -23.564 -1.121 0.326 1.00 . A A . 39 VAL HG12 1 1 1 64 1 1 4 VAL HG13 H -22.348 -0.286 -0.640 1.00 . A A . 39 VAL HG13 1 1 1 65 1 1 4 VAL HG21 H -20.570 -2.929 1.469 1.00 . A A . 39 VAL HG21 1 1 1 66 1 1 4 VAL HG22 H -20.812 -2.463 -0.215 1.00 . A A . 39 VAL HG22 1 1 1 67 1 1 4 VAL HG23 H -22.164 -3.087 0.730 1.00 . A A . 39 VAL HG23 1 1 1 68 1 1 4 VAL N N -20.654 1.083 1.978 1.00 . A A . 39 VAL N 1 1 1 69 1 1 4 VAL O O -19.857 -0.522 -1.085 1.00 . A A . 39 VAL O 1 1 1 70 1 1 5 LYS C C -17.328 2.660 -0.836 1.00 . A A . 40 LYS C 1 1 1 71 1 1 5 LYS CA C -18.580 1.978 -1.287 1.00 . A A . 40 LYS CA 1 1 1 72 1 1 5 LYS CB C -19.471 2.988 -2.010 1.00 . A A . 40 LYS CB 1 1 1 73 1 1 5 LYS CD C -21.480 3.470 -3.375 1.00 . A A . 40 LYS CD 1 1 1 74 1 1 5 LYS CE C -22.550 2.879 -4.256 1.00 . A A . 40 LYS CE 1 1 1 75 1 1 5 LYS CG C -20.632 2.390 -2.754 1.00 . A A . 40 LYS CG 1 1 1 76 1 1 5 LYS H H -19.235 1.933 0.694 1.00 . A A . 40 LYS H 1 1 1 77 1 1 5 LYS HA H -18.323 1.175 -1.961 1.00 . A A . 40 LYS HA 1 1 1 78 1 1 5 LYS HB2 H -19.861 3.690 -1.288 1.00 . A A . 40 LYS HB2 1 1 1 79 1 1 5 LYS HB3 H -18.861 3.531 -2.716 1.00 . A A . 40 LYS HB3 1 1 1 80 1 1 5 LYS HD2 H -21.951 4.043 -2.589 1.00 . A A . 40 LYS HD2 1 1 1 81 1 1 5 LYS HD3 H -20.849 4.118 -3.963 1.00 . A A . 40 LYS HD3 1 1 1 82 1 1 5 LYS HE2 H -23.104 2.163 -3.668 1.00 . A A . 40 LYS HE2 1 1 1 83 1 1 5 LYS HE3 H -23.217 3.664 -4.578 1.00 . A A . 40 LYS HE3 1 1 1 84 1 1 5 LYS HG2 H -20.258 1.743 -3.533 1.00 . A A . 40 LYS HG2 1 1 1 85 1 1 5 LYS HG3 H -21.235 1.815 -2.067 1.00 . A A . 40 LYS HG3 1 1 1 86 1 1 5 LYS HZ1 H -21.455 2.854 -6.040 1.00 . A A . 40 LYS HZ1 1 1 1 87 1 1 5 LYS HZ2 H -22.750 1.796 -6.029 1.00 . A A . 40 LYS HZ2 1 1 1 88 1 1 5 LYS HZ3 H -21.347 1.411 -5.174 1.00 . A A . 40 LYS HZ3 1 1 1 89 1 1 5 LYS N N -19.224 1.408 -0.131 1.00 . A A . 40 LYS N 1 1 1 90 1 1 5 LYS NZ N -21.986 2.187 -5.442 1.00 . A A . 40 LYS NZ 1 1 1 91 1 1 5 LYS O O -17.305 3.871 -0.608 1.00 . A A . 40 LYS O 1 1 1 92 1 1 6 GLU C C -14.290 2.778 -1.458 1.00 . A A . 41 GLU C 1 1 1 93 1 1 6 GLU CA C -15.054 2.396 -0.248 1.00 . A A . 41 GLU CA 1 1 1 94 1 1 6 GLU CB C -14.296 1.314 0.484 1.00 . A A . 41 GLU CB 1 1 1 95 1 1 6 GLU CD C -15.105 1.805 2.805 1.00 . A A . 41 GLU CD 1 1 1 96 1 1 6 GLU CG C -15.006 0.794 1.703 1.00 . A A . 41 GLU CG 1 1 1 97 1 1 6 GLU H H -16.405 0.935 -0.864 1.00 . A A . 41 GLU H 1 1 1 98 1 1 6 GLU HA H -15.195 3.241 0.407 1.00 . A A . 41 GLU HA 1 1 1 99 1 1 6 GLU HB2 H -14.135 0.488 -0.192 1.00 . A A . 41 GLU HB2 1 1 1 100 1 1 6 GLU HB3 H -13.338 1.709 0.790 1.00 . A A . 41 GLU HB3 1 1 1 101 1 1 6 GLU HG2 H -16.000 0.469 1.432 1.00 . A A . 41 GLU HG2 1 1 1 102 1 1 6 GLU HG3 H -14.434 -0.045 2.063 1.00 . A A . 41 GLU HG3 1 1 1 103 1 1 6 GLU N N -16.318 1.891 -0.671 1.00 . A A . 41 GLU N 1 1 1 104 1 1 6 GLU O O -14.364 2.097 -2.464 1.00 . A A . 41 GLU O 1 1 1 105 1 1 6 GLU OE1 O -15.915 2.735 2.716 1.00 . A A . 41 GLU OE1 1 1 1 106 1 1 6 GLU OE2 O -14.364 1.682 3.792 1.00 . A A . 41 GLU OE2 1 1 1 107 1 1 7 THR C C -11.346 3.979 -2.152 1.00 . A A . 42 THR C 1 1 1 108 1 1 7 THR CA C -12.807 4.168 -2.528 1.00 . A A . 42 THR CA 1 1 1 109 1 1 7 THR CB C -13.083 5.579 -3.044 1.00 . A A . 42 THR CB 1 1 1 110 1 1 7 THR CG2 C -13.109 5.532 -4.565 1.00 . A A . 42 THR CG2 1 1 1 111 1 1 7 THR H H -13.550 4.374 -0.591 1.00 . A A . 42 THR H 1 1 1 112 1 1 7 THR HA H -13.086 3.444 -3.283 1.00 . A A . 42 THR HA 1 1 1 113 1 1 7 THR HB H -12.281 6.229 -2.729 1.00 . A A . 42 THR HB 1 1 1 114 1 1 7 THR HG1 H -14.314 6.152 -1.651 1.00 . A A . 42 THR HG1 1 1 1 115 1 1 7 THR HG21 H -13.328 6.512 -4.964 1.00 . A A . 42 THR HG21 1 1 1 116 1 1 7 THR HG22 H -13.882 4.834 -4.863 1.00 . A A . 42 THR HG22 1 1 1 117 1 1 7 THR HG23 H -12.155 5.185 -4.933 1.00 . A A . 42 THR HG23 1 1 1 118 1 1 7 THR N N -13.585 3.832 -1.406 1.00 . A A . 42 THR N 1 1 1 119 1 1 7 THR O O -10.932 4.281 -1.030 1.00 . A A . 42 THR O 1 1 1 120 1 1 7 THR OG1 O -14.401 6.000 -2.602 1.00 . A A . 42 THR OG1 1 1 1 121 1 1 8 CYS C C -8.252 4.179 -2.966 1.00 . A A . 43 CYS C 1 1 1 122 1 1 8 CYS CA C -9.257 3.046 -2.842 1.00 . A A . 43 CYS CA 1 1 1 123 1 1 8 CYS CB C -8.977 1.924 -3.821 1.00 . A A . 43 CYS CB 1 1 1 124 1 1 8 CYS H H -10.955 3.426 -3.986 1.00 . A A . 43 CYS H 1 1 1 125 1 1 8 CYS HA H -9.230 2.619 -1.850 1.00 . A A . 43 CYS HA 1 1 1 126 1 1 8 CYS HB2 H -9.275 1.006 -3.337 1.00 . A A . 43 CYS HB2 1 1 1 127 1 1 8 CYS HB3 H -9.586 2.030 -4.705 1.00 . A A . 43 CYS HB3 1 1 1 128 1 1 8 CYS N N -10.598 3.477 -3.072 1.00 . A A . 43 CYS N 1 1 1 129 1 1 8 CYS O O -8.438 5.091 -3.748 1.00 . A A . 43 CYS O 1 1 1 130 1 1 8 CYS SG S -7.288 1.664 -4.291 1.00 . A A . 43 CYS SG 1 1 1 131 1 1 9 ALA C C -4.907 4.653 -3.001 1.00 . A A . 44 ALA C 1 1 1 132 1 1 9 ALA CA C -6.138 5.114 -2.219 1.00 . A A . 44 ALA CA 1 1 1 133 1 1 9 ALA CB C -5.725 5.474 -0.824 1.00 . A A . 44 ALA CB 1 1 1 134 1 1 9 ALA H H -7.139 3.380 -1.525 1.00 . A A . 44 ALA H 1 1 1 135 1 1 9 ALA HA H -6.538 6.005 -2.675 1.00 . A A . 44 ALA HA 1 1 1 136 1 1 9 ALA HB1 H -5.032 6.298 -0.903 1.00 . A A . 44 ALA HB1 1 1 1 137 1 1 9 ALA HB2 H -5.237 4.623 -0.374 1.00 . A A . 44 ALA HB2 1 1 1 138 1 1 9 ALA HB3 H -6.599 5.775 -0.270 1.00 . A A . 44 ALA HB3 1 1 1 139 1 1 9 ALA N N -7.187 4.108 -2.181 1.00 . A A . 44 ALA N 1 1 1 140 1 1 9 ALA O O -3.994 5.445 -3.251 1.00 . A A . 44 ALA O 1 1 1 141 1 1 10 ALA C C -3.929 2.777 -5.572 1.00 . A A . 45 ALA C 1 1 1 142 1 1 10 ALA CA C -3.707 2.844 -4.068 1.00 . A A . 45 ALA CA 1 1 1 143 1 1 10 ALA CB C -3.366 1.480 -3.508 1.00 . A A . 45 ALA CB 1 1 1 144 1 1 10 ALA H H -5.635 2.783 -3.236 1.00 . A A . 45 ALA H 1 1 1 145 1 1 10 ALA HA H -2.879 3.508 -3.869 1.00 . A A . 45 ALA HA 1 1 1 146 1 1 10 ALA HB1 H -4.139 0.774 -3.775 1.00 . A A . 45 ALA HB1 1 1 1 147 1 1 10 ALA HB2 H -3.296 1.554 -2.428 1.00 . A A . 45 ALA HB2 1 1 1 148 1 1 10 ALA HB3 H -2.420 1.158 -3.917 1.00 . A A . 45 ALA HB3 1 1 1 149 1 1 10 ALA N N -4.873 3.382 -3.387 1.00 . A A . 45 ALA N 1 1 1 150 1 1 10 ALA O O -2.997 2.586 -6.346 1.00 . A A . 45 ALA O 1 1 1 151 1 1 11 CYS C C -6.815 3.743 -7.635 1.00 . A A . 46 CYS C 1 1 1 152 1 1 11 CYS CA C -5.540 2.906 -7.366 1.00 . A A . 46 CYS CA 1 1 1 153 1 1 11 CYS CB C -5.580 1.461 -7.949 1.00 . A A . 46 CYS CB 1 1 1 154 1 1 11 CYS H H -5.871 2.976 -5.283 1.00 . A A . 46 CYS H 1 1 1 155 1 1 11 CYS HA H -4.735 3.441 -7.849 1.00 . A A . 46 CYS HA 1 1 1 156 1 1 11 CYS HB2 H -4.946 1.197 -8.778 1.00 . A A . 46 CYS HB2 1 1 1 157 1 1 11 CYS HB3 H -4.922 1.037 -7.200 1.00 . A A . 46 CYS HB3 1 1 1 158 1 1 11 CYS N N -5.178 2.896 -5.970 1.00 . A A . 46 CYS N 1 1 1 159 1 1 11 CYS O O -7.288 3.821 -8.755 1.00 . A A . 46 CYS O 1 1 1 160 1 1 11 CYS SG S -7.086 0.481 -7.730 1.00 . A A . 46 CYS SG 1 1 1 161 1 1 12 GLN C C -9.754 4.726 -7.324 1.00 . A A . 47 GLN C 1 1 1 162 1 1 12 GLN CA C -8.520 5.293 -6.627 1.00 . A A . 47 GLN CA 1 1 1 163 1 1 12 GLN CB C -8.172 6.633 -7.196 1.00 . A A . 47 GLN CB 1 1 1 164 1 1 12 GLN CD C -6.663 8.651 -7.028 1.00 . A A . 47 GLN CD 1 1 1 165 1 1 12 GLN CG C -7.209 7.418 -6.338 1.00 . A A . 47 GLN CG 1 1 1 166 1 1 12 GLN H H -6.899 4.327 -5.695 1.00 . A A . 47 GLN H 1 1 1 167 1 1 12 GLN HA H -8.779 5.447 -5.590 1.00 . A A . 47 GLN HA 1 1 1 168 1 1 12 GLN HB2 H -7.796 6.528 -8.203 1.00 . A A . 47 GLN HB2 1 1 1 169 1 1 12 GLN HB3 H -9.125 7.142 -7.191 1.00 . A A . 47 GLN HB3 1 1 1 170 1 1 12 GLN HE21 H -6.648 7.732 -8.796 1.00 . A A . 47 GLN HE21 1 1 1 171 1 1 12 GLN HE22 H -6.095 9.356 -8.795 1.00 . A A . 47 GLN HE22 1 1 1 172 1 1 12 GLN HG2 H -7.732 7.729 -5.445 1.00 . A A . 47 GLN HG2 1 1 1 173 1 1 12 GLN HG3 H -6.398 6.760 -6.064 1.00 . A A . 47 GLN HG3 1 1 1 174 1 1 12 GLN N N -7.335 4.394 -6.570 1.00 . A A . 47 GLN N 1 1 1 175 1 1 12 GLN NE2 N -6.453 8.572 -8.326 1.00 . A A . 47 GLN NE2 1 1 1 176 1 1 12 GLN O O -10.485 5.441 -8.005 1.00 . A A . 47 GLN O 1 1 1 177 1 1 12 GLN OE1 O -6.382 9.666 -6.384 1.00 . A A . 47 GLN OE1 1 1 1 178 1 1 13 LYS C C -11.978 2.356 -6.562 1.00 . A A . 48 LYS C 1 1 1 179 1 1 13 LYS CA C -11.129 2.812 -7.705 1.00 . A A . 48 LYS CA 1 1 1 180 1 1 13 LYS CB C -10.681 1.623 -8.552 1.00 . A A . 48 LYS CB 1 1 1 181 1 1 13 LYS CD C -10.450 2.958 -10.695 1.00 . A A . 48 LYS CD 1 1 1 182 1 1 13 LYS CE C -11.687 2.347 -11.332 1.00 . A A . 48 LYS CE 1 1 1 183 1 1 13 LYS CG C -9.775 1.994 -9.722 1.00 . A A . 48 LYS CG 1 1 1 184 1 1 13 LYS H H -9.367 2.955 -6.596 1.00 . A A . 48 LYS H 1 1 1 185 1 1 13 LYS HA H -11.681 3.512 -8.314 1.00 . A A . 48 LYS HA 1 1 1 186 1 1 13 LYS HB2 H -10.139 0.932 -7.924 1.00 . A A . 48 LYS HB2 1 1 1 187 1 1 13 LYS HB3 H -11.556 1.128 -8.945 1.00 . A A . 48 LYS HB3 1 1 1 188 1 1 13 LYS HD2 H -10.737 3.844 -10.149 1.00 . A A . 48 LYS HD2 1 1 1 189 1 1 13 LYS HD3 H -9.745 3.223 -11.469 1.00 . A A . 48 LYS HD3 1 1 1 190 1 1 13 LYS HE2 H -11.393 1.468 -11.883 1.00 . A A . 48 LYS HE2 1 1 1 191 1 1 13 LYS HE3 H -12.378 2.064 -10.552 1.00 . A A . 48 LYS HE3 1 1 1 192 1 1 13 LYS HG2 H -8.886 2.464 -9.327 1.00 . A A . 48 LYS HG2 1 1 1 193 1 1 13 LYS HG3 H -9.499 1.089 -10.238 1.00 . A A . 48 LYS HG3 1 1 1 194 1 1 13 LYS HZ1 H -12.727 4.124 -11.769 1.00 . A A . 48 LYS HZ1 1 1 1 195 1 1 13 LYS HZ2 H -13.146 2.808 -12.746 1.00 . A A . 48 LYS HZ2 1 1 1 196 1 1 13 LYS HZ3 H -11.690 3.597 -12.981 1.00 . A A . 48 LYS HZ3 1 1 1 197 1 1 13 LYS N N -9.984 3.475 -7.143 1.00 . A A . 48 LYS N 1 1 1 198 1 1 13 LYS NZ N -12.362 3.281 -12.255 1.00 . A A . 48 LYS NZ 1 1 1 199 1 1 13 LYS O O -11.462 2.159 -5.470 1.00 . A A . 48 LYS O 1 1 1 200 1 1 14 THR C C -13.925 0.360 -5.418 1.00 . A A . 49 THR C 1 1 1 201 1 1 14 THR CA C -14.134 1.846 -5.715 1.00 . A A . 49 THR CA 1 1 1 202 1 1 14 THR CB C -15.581 2.121 -6.067 1.00 . A A . 49 THR CB 1 1 1 203 1 1 14 THR CG2 C -16.436 1.995 -4.835 1.00 . A A . 49 THR CG2 1 1 1 204 1 1 14 THR H H -13.627 2.444 -7.655 1.00 . A A . 49 THR H 1 1 1 205 1 1 14 THR HA H -13.879 2.405 -4.833 1.00 . A A . 49 THR HA 1 1 1 206 1 1 14 THR HB H -15.852 1.361 -6.772 1.00 . A A . 49 THR HB 1 1 1 207 1 1 14 THR HG1 H -15.302 3.482 -7.462 1.00 . A A . 49 THR HG1 1 1 1 208 1 1 14 THR HG21 H -15.985 2.654 -4.103 1.00 . A A . 49 THR HG21 1 1 1 209 1 1 14 THR HG22 H -16.428 0.971 -4.491 1.00 . A A . 49 THR HG22 1 1 1 210 1 1 14 THR HG23 H -17.445 2.318 -5.044 1.00 . A A . 49 THR HG23 1 1 1 211 1 1 14 THR N N -13.255 2.259 -6.767 1.00 . A A . 49 THR N 1 1 1 212 1 1 14 THR O O -14.021 -0.484 -6.320 1.00 . A A . 49 THR O 1 1 1 213 1 1 14 THR OG1 O -15.708 3.475 -6.586 1.00 . A A . 49 THR OG1 1 1 1 214 1 1 15 VAL C C -14.520 -2.018 -3.412 1.00 . A A . 50 VAL C 1 1 1 215 1 1 15 VAL CA C -13.275 -1.251 -3.735 1.00 . A A . 50 VAL CA 1 1 1 216 1 1 15 VAL CB C -12.386 -1.223 -2.452 1.00 . A A . 50 VAL CB 1 1 1 217 1 1 15 VAL CG1 C -11.509 -2.442 -2.420 1.00 . A A . 50 VAL CG1 1 1 1 218 1 1 15 VAL CG2 C -11.566 0.054 -2.362 1.00 . A A . 50 VAL CG2 1 1 1 219 1 1 15 VAL H H -13.738 0.792 -3.515 1.00 . A A . 50 VAL H 1 1 1 220 1 1 15 VAL HA H -12.717 -1.729 -4.527 1.00 . A A . 50 VAL HA 1 1 1 221 1 1 15 VAL HB H -13.000 -1.323 -1.563 1.00 . A A . 50 VAL HB 1 1 1 222 1 1 15 VAL HG11 H -10.812 -2.357 -1.600 1.00 . A A . 50 VAL HG11 1 1 1 223 1 1 15 VAL HG12 H -10.962 -2.518 -3.350 1.00 . A A . 50 VAL HG12 1 1 1 224 1 1 15 VAL HG13 H -12.116 -3.325 -2.286 1.00 . A A . 50 VAL HG13 1 1 1 225 1 1 15 VAL HG21 H -10.994 0.164 -3.273 1.00 . A A . 50 VAL HG21 1 1 1 226 1 1 15 VAL HG22 H -10.894 0.016 -1.517 1.00 . A A . 50 VAL HG22 1 1 1 227 1 1 15 VAL HG23 H -12.221 0.906 -2.255 1.00 . A A . 50 VAL HG23 1 1 1 228 1 1 15 VAL N N -13.640 0.071 -4.175 1.00 . A A . 50 VAL N 1 1 1 229 1 1 15 VAL O O -15.443 -1.482 -2.786 1.00 . A A . 50 VAL O 1 1 1 230 1 1 16 TYR C C -15.412 -4.862 -2.289 1.00 . A A . 51 TYR C 1 1 1 231 1 1 16 TYR CA C -15.707 -4.059 -3.554 1.00 . A A . 51 TYR CA 1 1 1 232 1 1 16 TYR CB C -16.051 -4.926 -4.778 1.00 . A A . 51 TYR CB 1 1 1 233 1 1 16 TYR CD1 C -16.913 -2.875 -5.957 1.00 . A A . 51 TYR CD1 1 1 1 234 1 1 16 TYR CD2 C -15.878 -4.553 -7.278 1.00 . A A . 51 TYR CD2 1 1 1 235 1 1 16 TYR CE1 C -17.121 -2.102 -7.072 1.00 . A A . 51 TYR CE1 1 1 1 236 1 1 16 TYR CE2 C -16.085 -3.788 -8.411 1.00 . A A . 51 TYR CE2 1 1 1 237 1 1 16 TYR CG C -16.290 -4.106 -6.033 1.00 . A A . 51 TYR CG 1 1 1 238 1 1 16 TYR CZ C -16.707 -2.559 -8.299 1.00 . A A . 51 TYR CZ 1 1 1 239 1 1 16 TYR H H -13.814 -3.619 -4.328 1.00 . A A . 51 TYR H 1 1 1 240 1 1 16 TYR HA H -16.527 -3.394 -3.330 1.00 . A A . 51 TYR HA 1 1 1 241 1 1 16 TYR HB2 H -15.215 -5.572 -4.981 1.00 . A A . 51 TYR HB2 1 1 1 242 1 1 16 TYR HB3 H -16.938 -5.509 -4.583 1.00 . A A . 51 TYR HB3 1 1 1 243 1 1 16 TYR HD1 H -17.226 -2.536 -4.982 1.00 . A A . 51 TYR HD1 1 1 1 244 1 1 16 TYR HD2 H -15.393 -5.514 -7.357 1.00 . A A . 51 TYR HD2 1 1 1 245 1 1 16 TYR HE1 H -17.609 -1.142 -6.972 1.00 . A A . 51 TYR HE1 1 1 1 246 1 1 16 TYR HE2 H -15.758 -4.152 -9.374 1.00 . A A . 51 TYR HE2 1 1 1 247 1 1 16 TYR HH H -16.686 -0.870 -9.184 1.00 . A A . 51 TYR HH 1 1 1 248 1 1 16 TYR N N -14.569 -3.241 -3.831 1.00 . A A . 51 TYR N 1 1 1 249 1 1 16 TYR O O -14.241 -5.110 -2.001 1.00 . A A . 51 TYR O 1 1 1 250 1 1 16 TYR OH O -16.910 -1.777 -9.424 1.00 . A A . 51 TYR OH 1 1 1 251 1 1 17 PRO C C -15.222 -6.948 -0.020 1.00 . A A . 52 PRO C 1 1 1 252 1 1 17 PRO CA C -16.308 -5.881 -0.185 1.00 . A A . 52 PRO CA 1 1 1 253 1 1 17 PRO CB C -17.669 -6.483 0.069 1.00 . A A . 52 PRO CB 1 1 1 254 1 1 17 PRO CD C -17.880 -5.205 -1.924 1.00 . A A . 52 PRO CD 1 1 1 255 1 1 17 PRO CG C -18.600 -5.597 -0.672 1.00 . A A . 52 PRO CG 1 1 1 256 1 1 17 PRO HA H -16.140 -5.117 0.553 1.00 . A A . 52 PRO HA 1 1 1 257 1 1 17 PRO HB2 H -17.648 -7.486 -0.319 1.00 . A A . 52 PRO HB2 1 1 1 258 1 1 17 PRO HB3 H -17.879 -6.501 1.129 1.00 . A A . 52 PRO HB3 1 1 1 259 1 1 17 PRO HD2 H -18.111 -5.893 -2.724 1.00 . A A . 52 PRO HD2 1 1 1 260 1 1 17 PRO HD3 H -18.144 -4.197 -2.206 1.00 . A A . 52 PRO HD3 1 1 1 261 1 1 17 PRO HG2 H -19.506 -6.132 -0.912 1.00 . A A . 52 PRO HG2 1 1 1 262 1 1 17 PRO HG3 H -18.826 -4.721 -0.082 1.00 . A A . 52 PRO HG3 1 1 1 263 1 1 17 PRO N N -16.451 -5.291 -1.537 1.00 . A A . 52 PRO N 1 1 1 264 1 1 17 PRO O O -14.470 -6.904 0.953 1.00 . A A . 52 PRO O 1 1 1 265 1 1 18 MET C C -12.669 -8.403 -0.960 1.00 . A A . 53 MET C 1 1 1 266 1 1 18 MET CA C -14.098 -8.931 -0.822 1.00 . A A . 53 MET CA 1 1 1 267 1 1 18 MET CB C -14.335 -10.073 -1.808 1.00 . A A . 53 MET CB 1 1 1 268 1 1 18 MET CE C -12.268 -13.678 -2.279 1.00 . A A . 53 MET CE 1 1 1 269 1 1 18 MET CG C -13.365 -11.230 -1.614 1.00 . A A . 53 MET CG 1 1 1 270 1 1 18 MET H H -15.662 -7.811 -1.767 1.00 . A A . 53 MET H 1 1 1 271 1 1 18 MET HA H -14.193 -9.325 0.177 1.00 . A A . 53 MET HA 1 1 1 272 1 1 18 MET HB2 H -15.333 -10.445 -1.634 1.00 . A A . 53 MET HB2 1 1 1 273 1 1 18 MET HB3 H -14.245 -9.706 -2.820 1.00 . A A . 53 MET HB3 1 1 1 274 1 1 18 MET HE1 H -11.310 -13.186 -2.351 1.00 . A A . 53 MET HE1 1 1 1 275 1 1 18 MET HE2 H -12.268 -14.556 -2.907 1.00 . A A . 53 MET HE2 1 1 1 276 1 1 18 MET HE3 H -12.448 -13.967 -1.254 1.00 . A A . 53 MET HE3 1 1 1 277 1 1 18 MET HG2 H -12.364 -10.836 -1.672 1.00 . A A . 53 MET HG2 1 1 1 278 1 1 18 MET HG3 H -13.520 -11.634 -0.625 1.00 . A A . 53 MET HG3 1 1 1 279 1 1 18 MET N N -15.092 -7.864 -0.968 1.00 . A A . 53 MET N 1 1 1 280 1 1 18 MET O O -11.743 -8.894 -0.310 1.00 . A A . 53 MET O 1 1 1 281 1 1 18 MET SD S -13.565 -12.556 -2.819 1.00 . A A . 53 MET SD 1 1 1 282 1 1 19 GLU C C -10.851 -5.701 -1.109 1.00 . A A . 54 GLU C 1 1 1 283 1 1 19 GLU CA C -11.206 -6.837 -2.045 1.00 . A A . 54 GLU CA 1 1 1 284 1 1 19 GLU CB C -11.189 -6.386 -3.499 1.00 . A A . 54 GLU CB 1 1 1 285 1 1 19 GLU CD C -11.520 -7.109 -5.885 1.00 . A A . 54 GLU CD 1 1 1 286 1 1 19 GLU CG C -11.530 -7.518 -4.448 1.00 . A A . 54 GLU CG 1 1 1 287 1 1 19 GLU H H -13.286 -6.897 -2.106 1.00 . A A . 54 GLU H 1 1 1 288 1 1 19 GLU HA H -10.484 -7.631 -1.925 1.00 . A A . 54 GLU HA 1 1 1 289 1 1 19 GLU HB2 H -11.913 -5.596 -3.633 1.00 . A A . 54 GLU HB2 1 1 1 290 1 1 19 GLU HB3 H -10.213 -6.004 -3.757 1.00 . A A . 54 GLU HB3 1 1 1 291 1 1 19 GLU HG2 H -10.822 -8.319 -4.302 1.00 . A A . 54 GLU HG2 1 1 1 292 1 1 19 GLU HG3 H -12.515 -7.880 -4.195 1.00 . A A . 54 GLU HG3 1 1 1 293 1 1 19 GLU N N -12.509 -7.366 -1.736 1.00 . A A . 54 GLU N 1 1 1 294 1 1 19 GLU O O -9.694 -5.308 -1.018 1.00 . A A . 54 GLU O 1 1 1 295 1 1 19 GLU OE1 O -10.460 -7.202 -6.532 1.00 . A A . 54 GLU OE1 1 1 1 296 1 1 19 GLU OE2 O -12.584 -6.708 -6.404 1.00 . A A . 54 GLU OE2 1 1 1 297 1 1 20 ARG C C -10.911 -4.515 1.747 1.00 . A A . 55 ARG C 1 1 1 298 1 1 20 ARG CA C -11.707 -4.099 0.526 1.00 . A A . 55 ARG CA 1 1 1 299 1 1 20 ARG CB C -13.067 -3.499 0.880 1.00 . A A . 55 ARG CB 1 1 1 300 1 1 20 ARG CD C -14.545 -2.566 2.670 1.00 . A A . 55 ARG CD 1 1 1 301 1 1 20 ARG CG C -13.112 -2.643 2.139 1.00 . A A . 55 ARG CG 1 1 1 302 1 1 20 ARG CZ C -15.664 -1.877 4.814 1.00 . A A . 55 ARG CZ 1 1 1 303 1 1 20 ARG H H -12.754 -5.569 -0.556 1.00 . A A . 55 ARG H 1 1 1 304 1 1 20 ARG HA H -11.125 -3.342 0.026 1.00 . A A . 55 ARG HA 1 1 1 305 1 1 20 ARG HB2 H -13.316 -2.843 0.053 1.00 . A A . 55 ARG HB2 1 1 1 306 1 1 20 ARG HB3 H -13.803 -4.275 0.912 1.00 . A A . 55 ARG HB3 1 1 1 307 1 1 20 ARG HD2 H -15.182 -2.160 1.898 1.00 . A A . 55 ARG HD2 1 1 1 308 1 1 20 ARG HD3 H -14.865 -3.571 2.896 1.00 . A A . 55 ARG HD3 1 1 1 309 1 1 20 ARG HE H -14.018 -1.014 3.972 1.00 . A A . 55 ARG HE 1 1 1 310 1 1 20 ARG HG2 H -12.443 -3.080 2.866 1.00 . A A . 55 ARG HG2 1 1 1 311 1 1 20 ARG HG3 H -12.765 -1.650 1.895 1.00 . A A . 55 ARG HG3 1 1 1 312 1 1 20 ARG HH11 H -16.512 -3.554 3.987 1.00 . A A . 55 ARG HH11 1 1 1 313 1 1 20 ARG HH12 H -17.276 -3.005 5.393 1.00 . A A . 55 ARG HH12 1 1 1 314 1 1 20 ARG HH21 H -15.104 -0.276 5.955 1.00 . A A . 55 ARG HH21 1 1 1 315 1 1 20 ARG HH22 H -16.457 -1.117 6.536 1.00 . A A . 55 ARG HH22 1 1 1 316 1 1 20 ARG N N -11.860 -5.190 -0.416 1.00 . A A . 55 ARG N 1 1 1 317 1 1 20 ARG NE N -14.682 -1.733 3.886 1.00 . A A . 55 ARG NE 1 1 1 318 1 1 20 ARG NH1 N -16.538 -2.873 4.724 1.00 . A A . 55 ARG NH1 1 1 1 319 1 1 20 ARG NH2 N -15.745 -1.034 5.830 1.00 . A A . 55 ARG NH2 1 1 1 320 1 1 20 ARG O O -11.387 -5.231 2.639 1.00 . A A . 55 ARG O 1 1 1 321 1 1 21 LEU C C -8.334 -2.947 3.271 1.00 . A A . 56 LEU C 1 1 1 322 1 1 21 LEU CA C -8.733 -4.312 2.733 1.00 . A A . 56 LEU CA 1 1 1 323 1 1 21 LEU CB C -7.533 -5.077 2.100 1.00 . A A . 56 LEU CB 1 1 1 324 1 1 21 LEU CD1 C -5.455 -6.388 2.395 1.00 . A A . 56 LEU CD1 1 1 1 325 1 1 21 LEU CD2 C -5.337 -3.983 2.652 1.00 . A A . 56 LEU CD2 1 1 1 326 1 1 21 LEU CG C -6.215 -5.199 2.889 1.00 . A A . 56 LEU CG 1 1 1 327 1 1 21 LEU H H -9.423 -3.637 0.905 1.00 . A A . 56 LEU H 1 1 1 328 1 1 21 LEU HA H -9.158 -4.912 3.523 1.00 . A A . 56 LEU HA 1 1 1 329 1 1 21 LEU HB2 H -7.869 -6.079 1.886 1.00 . A A . 56 LEU HB2 1 1 1 330 1 1 21 LEU HB3 H -7.313 -4.602 1.155 1.00 . A A . 56 LEU HB3 1 1 1 331 1 1 21 LEU HD11 H -4.588 -6.536 3.019 1.00 . A A . 56 LEU HD11 1 1 1 332 1 1 21 LEU HD12 H -5.130 -6.165 1.388 1.00 . A A . 56 LEU HD12 1 1 1 333 1 1 21 LEU HD13 H -6.085 -7.265 2.403 1.00 . A A . 56 LEU HD13 1 1 1 334 1 1 21 LEU HD21 H -5.090 -3.913 1.603 1.00 . A A . 56 LEU HD21 1 1 1 335 1 1 21 LEU HD22 H -4.434 -4.077 3.235 1.00 . A A . 56 LEU HD22 1 1 1 336 1 1 21 LEU HD23 H -5.870 -3.095 2.957 1.00 . A A . 56 LEU HD23 1 1 1 337 1 1 21 LEU HG H -6.398 -5.292 3.948 1.00 . A A . 56 LEU HG 1 1 1 338 1 1 21 LEU N N -9.708 -4.116 1.713 1.00 . A A . 56 LEU N 1 1 1 339 1 1 21 LEU O O -8.548 -1.929 2.612 1.00 . A A . 56 LEU O 1 1 1 340 1 1 22 VAL C C -5.869 -1.827 5.479 1.00 . A A . 57 VAL C 1 1 1 341 1 1 22 VAL CA C -7.323 -1.690 5.016 1.00 . A A . 57 VAL CA 1 1 1 342 1 1 22 VAL CB C -8.251 -1.157 6.160 1.00 . A A . 57 VAL CB 1 1 1 343 1 1 22 VAL CG1 C -8.562 -2.227 7.200 1.00 . A A . 57 VAL CG1 1 1 1 344 1 1 22 VAL CG2 C -7.642 0.072 6.819 1.00 . A A . 57 VAL CG2 1 1 1 345 1 1 22 VAL H H -7.701 -3.741 4.971 1.00 . A A . 57 VAL H 1 1 1 346 1 1 22 VAL HA H -7.329 -0.969 4.211 1.00 . A A . 57 VAL HA 1 1 1 347 1 1 22 VAL HB H -9.187 -0.862 5.709 1.00 . A A . 57 VAL HB 1 1 1 348 1 1 22 VAL HG11 H -9.185 -1.801 7.972 1.00 . A A . 57 VAL HG11 1 1 1 349 1 1 22 VAL HG12 H -7.642 -2.596 7.629 1.00 . A A . 57 VAL HG12 1 1 1 350 1 1 22 VAL HG13 H -9.092 -3.034 6.716 1.00 . A A . 57 VAL HG13 1 1 1 351 1 1 22 VAL HG21 H -7.535 0.850 6.077 1.00 . A A . 57 VAL HG21 1 1 1 352 1 1 22 VAL HG22 H -6.665 -0.179 7.204 1.00 . A A . 57 VAL HG22 1 1 1 353 1 1 22 VAL HG23 H -8.273 0.422 7.623 1.00 . A A . 57 VAL HG23 1 1 1 354 1 1 22 VAL N N -7.799 -2.914 4.450 1.00 . A A . 57 VAL N 1 1 1 355 1 1 22 VAL O O -5.575 -2.489 6.486 1.00 . A A . 57 VAL O 1 1 1 356 1 1 23 ALA C C -3.249 0.126 5.578 1.00 . A A . 58 ALA C 1 1 1 357 1 1 23 ALA CA C -3.566 -1.259 5.127 1.00 . A A . 58 ALA CA 1 1 1 358 1 1 23 ALA CB C -2.649 -1.644 3.942 1.00 . A A . 58 ALA CB 1 1 1 359 1 1 23 ALA H H -5.239 -0.751 3.926 1.00 . A A . 58 ALA H 1 1 1 360 1 1 23 ALA HA H -3.433 -1.955 5.939 1.00 . A A . 58 ALA HA 1 1 1 361 1 1 23 ALA HB1 H -2.708 -0.885 3.173 1.00 . A A . 58 ALA HB1 1 1 1 362 1 1 23 ALA HB2 H -2.953 -2.581 3.501 1.00 . A A . 58 ALA HB2 1 1 1 363 1 1 23 ALA HB3 H -1.618 -1.733 4.251 1.00 . A A . 58 ALA HB3 1 1 1 364 1 1 23 ALA N N -4.959 -1.249 4.727 1.00 . A A . 58 ALA N 1 1 1 365 1 1 23 ALA O O -3.626 1.069 4.894 1.00 . A A . 58 ALA O 1 1 1 366 1 1 24 ASP C C -3.318 2.583 7.289 1.00 . A A . 59 ASP C 1 1 1 367 1 1 24 ASP CA C -2.170 1.592 7.241 1.00 . A A . 59 ASP CA 1 1 1 368 1 1 24 ASP CB C -0.992 2.178 6.508 1.00 . A A . 59 ASP CB 1 1 1 369 1 1 24 ASP CG C 0.072 1.143 6.144 1.00 . A A . 59 ASP CG 1 1 1 370 1 1 24 ASP H H -2.281 -0.544 7.194 1.00 . A A . 59 ASP H 1 1 1 371 1 1 24 ASP HA H -1.874 1.420 8.265 1.00 . A A . 59 ASP HA 1 1 1 372 1 1 24 ASP HB2 H -1.281 2.959 5.825 1.00 . A A . 59 ASP HB2 1 1 1 373 1 1 24 ASP HB3 H -0.514 2.697 7.331 1.00 . A A . 59 ASP HB3 1 1 1 374 1 1 24 ASP N N -2.547 0.264 6.707 1.00 . A A . 59 ASP N 1 1 1 375 1 1 24 ASP O O -3.145 3.772 7.007 1.00 . A A . 59 ASP O 1 1 1 376 1 1 24 ASP OD1 O -0.039 0.476 5.111 1.00 . A A . 59 ASP OD1 1 1 1 377 1 1 24 ASP OD2 O 1.027 0.953 6.962 1.00 . A A . 59 ASP OD2 1 1 1 378 1 1 25 LYS C C -6.246 3.337 6.383 1.00 . A A . 60 LYS C 1 1 1 379 1 1 25 LYS CA C -5.724 2.833 7.716 1.00 . A A . 60 LYS CA 1 1 1 380 1 1 25 LYS CB C -5.675 3.922 8.712 1.00 . A A . 60 LYS CB 1 1 1 381 1 1 25 LYS CD C -4.728 2.696 10.716 1.00 . A A . 60 LYS CD 1 1 1 382 1 1 25 LYS CE C -4.883 2.495 12.212 1.00 . A A . 60 LYS CE 1 1 1 383 1 1 25 LYS CG C -5.900 3.480 10.142 1.00 . A A . 60 LYS CG 1 1 1 384 1 1 25 LYS H H -4.520 1.123 7.848 1.00 . A A . 60 LYS H 1 1 1 385 1 1 25 LYS HA H -6.423 2.120 8.107 1.00 . A A . 60 LYS HA 1 1 1 386 1 1 25 LYS HB2 H -4.658 4.242 8.617 1.00 . A A . 60 LYS HB2 1 1 1 387 1 1 25 LYS HB3 H -6.369 4.693 8.428 1.00 . A A . 60 LYS HB3 1 1 1 388 1 1 25 LYS HD2 H -4.670 1.734 10.231 1.00 . A A . 60 LYS HD2 1 1 1 389 1 1 25 LYS HD3 H -3.818 3.246 10.528 1.00 . A A . 60 LYS HD3 1 1 1 390 1 1 25 LYS HE2 H -5.850 2.055 12.405 1.00 . A A . 60 LYS HE2 1 1 1 391 1 1 25 LYS HE3 H -4.108 1.827 12.558 1.00 . A A . 60 LYS HE3 1 1 1 392 1 1 25 LYS HG2 H -6.120 4.343 10.740 1.00 . A A . 60 LYS HG2 1 1 1 393 1 1 25 LYS HG3 H -6.773 2.841 10.134 1.00 . A A . 60 LYS HG3 1 1 1 394 1 1 25 LYS HZ1 H -5.513 4.464 12.666 1.00 . A A . 60 LYS HZ1 1 1 1 395 1 1 25 LYS HZ2 H -3.865 4.227 12.752 1.00 . A A . 60 LYS HZ2 1 1 1 396 1 1 25 LYS HZ3 H -4.850 3.632 13.978 1.00 . A A . 60 LYS HZ3 1 1 1 397 1 1 25 LYS N N -4.492 2.076 7.638 1.00 . A A . 60 LYS N 1 1 1 398 1 1 25 LYS NZ N -4.783 3.780 12.950 1.00 . A A . 60 LYS NZ 1 1 1 399 1 1 25 LYS O O -7.251 4.052 6.329 1.00 . A A . 60 LYS O 1 1 1 400 1 1 26 LEU C C -6.852 2.173 3.458 1.00 . A A . 61 LEU C 1 1 1 401 1 1 26 LEU CA C -6.009 3.327 3.991 1.00 . A A . 61 LEU CA 1 1 1 402 1 1 26 LEU CB C -4.812 3.559 3.101 1.00 . A A . 61 LEU CB 1 1 1 403 1 1 26 LEU CD1 C -2.591 4.625 2.693 1.00 . A A . 61 LEU CD1 1 1 1 404 1 1 26 LEU CD2 C -4.422 5.966 3.704 1.00 . A A . 61 LEU CD2 1 1 1 405 1 1 26 LEU CG C -3.794 4.585 3.604 1.00 . A A . 61 LEU CG 1 1 1 406 1 1 26 LEU H H -4.695 2.531 5.411 1.00 . A A . 61 LEU H 1 1 1 407 1 1 26 LEU HA H -6.604 4.221 4.031 1.00 . A A . 61 LEU HA 1 1 1 408 1 1 26 LEU HB2 H -4.329 2.601 3.012 1.00 . A A . 61 LEU HB2 1 1 1 409 1 1 26 LEU HB3 H -5.165 3.866 2.128 1.00 . A A . 61 LEU HB3 1 1 1 410 1 1 26 LEU HD11 H -1.848 5.297 3.095 1.00 . A A . 61 LEU HD11 1 1 1 411 1 1 26 LEU HD12 H -2.902 4.975 1.720 1.00 . A A . 61 LEU HD12 1 1 1 412 1 1 26 LEU HD13 H -2.180 3.630 2.601 1.00 . A A . 61 LEU HD13 1 1 1 413 1 1 26 LEU HD21 H -5.243 5.939 4.405 1.00 . A A . 61 LEU HD21 1 1 1 414 1 1 26 LEU HD22 H -4.787 6.268 2.733 1.00 . A A . 61 LEU HD22 1 1 1 415 1 1 26 LEU HD23 H -3.681 6.672 4.047 1.00 . A A . 61 LEU HD23 1 1 1 416 1 1 26 LEU HG H -3.457 4.294 4.589 1.00 . A A . 61 LEU HG 1 1 1 417 1 1 26 LEU N N -5.563 2.999 5.320 1.00 . A A . 61 LEU N 1 1 1 418 1 1 26 LEU O O -6.466 1.007 3.584 1.00 . A A . 61 LEU O 1 1 1 419 1 1 27 ILE C C -8.667 1.197 0.934 1.00 . A A . 62 ILE C 1 1 1 420 1 1 27 ILE CA C -8.884 1.430 2.418 1.00 . A A . 62 ILE CA 1 1 1 421 1 1 27 ILE CB C -10.373 1.801 2.616 1.00 . A A . 62 ILE CB 1 1 1 422 1 1 27 ILE CD1 C -10.347 1.543 5.166 1.00 . A A . 62 ILE CD1 1 1 1 423 1 1 27 ILE CG1 C -10.636 2.430 3.983 1.00 . A A . 62 ILE CG1 1 1 1 424 1 1 27 ILE CG2 C -11.209 0.560 2.481 1.00 . A A . 62 ILE CG2 1 1 1 425 1 1 27 ILE H H -8.253 3.408 2.740 1.00 . A A . 62 ILE H 1 1 1 426 1 1 27 ILE HA H -8.664 0.526 2.968 1.00 . A A . 62 ILE HA 1 1 1 427 1 1 27 ILE HB H -10.663 2.494 1.841 1.00 . A A . 62 ILE HB 1 1 1 428 1 1 27 ILE HD11 H -9.302 1.272 5.152 1.00 . A A . 62 ILE HD11 1 1 1 429 1 1 27 ILE HD12 H -10.949 0.648 5.098 1.00 . A A . 62 ILE HD12 1 1 1 430 1 1 27 ILE HD13 H -10.573 2.069 6.083 1.00 . A A . 62 ILE HD13 1 1 1 431 1 1 27 ILE HG12 H -10.008 3.299 4.067 1.00 . A A . 62 ILE HG12 1 1 1 432 1 1 27 ILE HG13 H -11.671 2.731 4.030 1.00 . A A . 62 ILE HG13 1 1 1 433 1 1 27 ILE HG21 H -11.072 0.131 1.501 1.00 . A A . 62 ILE HG21 1 1 1 434 1 1 27 ILE HG22 H -12.240 0.828 2.655 1.00 . A A . 62 ILE HG22 1 1 1 435 1 1 27 ILE HG23 H -10.865 -0.121 3.246 1.00 . A A . 62 ILE HG23 1 1 1 436 1 1 27 ILE N N -7.990 2.475 2.878 1.00 . A A . 62 ILE N 1 1 1 437 1 1 27 ILE O O -8.782 2.132 0.126 1.00 . A A . 62 ILE O 1 1 1 438 1 1 28 PHE C C -8.117 -1.852 -1.082 1.00 . A A . 63 PHE C 1 1 1 439 1 1 28 PHE CA C -8.060 -0.386 -0.776 1.00 . A A . 63 PHE CA 1 1 1 440 1 1 28 PHE CB C -6.847 0.287 -1.377 1.00 . A A . 63 PHE CB 1 1 1 441 1 1 28 PHE CD1 C -5.104 -0.883 0.048 1.00 . A A . 63 PHE CD1 1 1 1 442 1 1 28 PHE CD2 C -4.983 1.445 -0.327 1.00 . A A . 63 PHE CD2 1 1 1 443 1 1 28 PHE CE1 C -3.967 -0.802 0.821 1.00 . A A . 63 PHE CE1 1 1 1 444 1 1 28 PHE CE2 C -3.875 1.518 0.424 1.00 . A A . 63 PHE CE2 1 1 1 445 1 1 28 PHE CG C -5.618 0.267 -0.539 1.00 . A A . 63 PHE CG 1 1 1 446 1 1 28 PHE CZ C -3.351 0.412 1.005 1.00 . A A . 63 PHE CZ 1 1 1 447 1 1 28 PHE H H -8.219 -0.700 1.284 1.00 . A A . 63 PHE H 1 1 1 448 1 1 28 PHE HA H -8.913 0.020 -1.298 1.00 . A A . 63 PHE HA 1 1 1 449 1 1 28 PHE HB2 H -6.622 -0.017 -2.386 1.00 . A A . 63 PHE HB2 1 1 1 450 1 1 28 PHE HB3 H -7.120 1.334 -1.382 1.00 . A A . 63 PHE HB3 1 1 1 451 1 1 28 PHE HD1 H -5.577 -1.846 -0.090 1.00 . A A . 63 PHE HD1 1 1 1 452 1 1 28 PHE HD2 H -5.378 2.343 -0.779 1.00 . A A . 63 PHE HD2 1 1 1 453 1 1 28 PHE HE1 H -3.560 -1.694 1.276 1.00 . A A . 63 PHE HE1 1 1 1 454 1 1 28 PHE HE2 H -3.405 2.476 0.553 1.00 . A A . 63 PHE HE2 1 1 1 455 1 1 28 PHE HZ H -2.447 0.530 1.590 1.00 . A A . 63 PHE HZ 1 1 1 456 1 1 28 PHE N N -8.304 -0.010 0.586 1.00 . A A . 63 PHE N 1 1 1 457 1 1 28 PHE O O -8.268 -2.684 -0.202 1.00 . A A . 63 PHE O 1 1 1 458 1 1 29 HIS C C -6.709 -4.098 -2.426 1.00 . A A . 64 HIS C 1 1 1 459 1 1 29 HIS CA C -7.986 -3.462 -2.899 1.00 . A A . 64 HIS CA 1 1 1 460 1 1 29 HIS CB C -7.920 -3.392 -4.436 1.00 . A A . 64 HIS CB 1 1 1 461 1 1 29 HIS CD2 C -10.148 -3.042 -5.598 1.00 . A A . 64 HIS CD2 1 1 1 462 1 1 29 HIS CE1 C -10.062 -0.878 -5.823 1.00 . A A . 64 HIS CE1 1 1 1 463 1 1 29 HIS CG C -8.997 -2.603 -5.086 1.00 . A A . 64 HIS CG 1 1 1 464 1 1 29 HIS H H -8.104 -1.397 -3.002 1.00 . A A . 64 HIS H 1 1 1 465 1 1 29 HIS HA H -8.851 -4.038 -2.610 1.00 . A A . 64 HIS HA 1 1 1 466 1 1 29 HIS HB2 H -6.989 -2.946 -4.743 1.00 . A A . 64 HIS HB2 1 1 1 467 1 1 29 HIS HB3 H -7.964 -4.398 -4.826 1.00 . A A . 64 HIS HB3 1 1 1 468 1 1 29 HIS HD2 H -10.483 -4.067 -5.611 1.00 . A A . 64 HIS HD2 1 1 1 469 1 1 29 HIS HE1 H -10.337 0.138 -6.062 1.00 . A A . 64 HIS HE1 1 1 1 470 1 1 29 HIS HE2 H -11.545 -2.009 -6.735 1.00 . A A . 64 HIS HE2 1 1 1 471 1 1 29 HIS N N -8.059 -2.130 -2.360 1.00 . A A . 64 HIS N 1 1 1 472 1 1 29 HIS ND1 N -8.938 -1.216 -5.226 1.00 . A A . 64 HIS ND1 1 1 1 473 1 1 29 HIS NE2 N -10.825 -1.951 -6.066 1.00 . A A . 64 HIS NE2 1 1 1 474 1 1 29 HIS O O -5.623 -3.516 -2.548 1.00 . A A . 64 HIS O 1 1 1 475 1 1 30 ASN C C -4.726 -6.328 -2.553 1.00 . A A . 65 ASN C 1 1 1 476 1 1 30 ASN CA C -5.715 -6.062 -1.427 1.00 . A A . 65 ASN CA 1 1 1 477 1 1 30 ASN CB C -6.161 -7.382 -0.727 1.00 . A A . 65 ASN CB 1 1 1 478 1 1 30 ASN CG C -7.144 -8.271 -1.501 1.00 . A A . 65 ASN CG 1 1 1 479 1 1 30 ASN H H -7.758 -5.604 -1.734 1.00 . A A . 65 ASN H 1 1 1 480 1 1 30 ASN HA H -5.206 -5.452 -0.695 1.00 . A A . 65 ASN HA 1 1 1 481 1 1 30 ASN HB2 H -5.287 -7.979 -0.519 1.00 . A A . 65 ASN HB2 1 1 1 482 1 1 30 ASN HB3 H -6.621 -7.120 0.215 1.00 . A A . 65 ASN HB3 1 1 1 483 1 1 30 ASN HD21 H -7.888 -8.927 0.210 1.00 . A A . 65 ASN HD21 1 1 1 484 1 1 30 ASN HD22 H -8.603 -9.596 -1.199 1.00 . A A . 65 ASN HD22 1 1 1 485 1 1 30 ASN N N -6.844 -5.272 -1.874 1.00 . A A . 65 ASN N 1 1 1 486 1 1 30 ASN ND2 N -7.956 -8.997 -0.768 1.00 . A A . 65 ASN ND2 1 1 1 487 1 1 30 ASN O O -3.544 -6.448 -2.325 1.00 . A A . 65 ASN O 1 1 1 488 1 1 30 ASN OD1 O -7.172 -8.313 -2.734 1.00 . A A . 65 ASN OD1 1 1 1 489 1 1 31 SER C C -3.781 -5.479 -5.582 1.00 . A A . 66 SER C 1 1 1 490 1 1 31 SER CA C -4.516 -6.697 -4.937 1.00 . A A . 66 SER CA 1 1 1 491 1 1 31 SER CB C -5.491 -7.301 -5.900 1.00 . A A . 66 SER CB 1 1 1 492 1 1 31 SER H H -6.219 -6.408 -3.843 1.00 . A A . 66 SER H 1 1 1 493 1 1 31 SER HA H -3.779 -7.464 -4.763 1.00 . A A . 66 SER HA 1 1 1 494 1 1 31 SER HB2 H -5.073 -7.169 -6.883 1.00 . A A . 66 SER HB2 1 1 1 495 1 1 31 SER HB3 H -5.603 -8.354 -5.688 1.00 . A A . 66 SER HB3 1 1 1 496 1 1 31 SER HG H -7.036 -6.297 -6.635 1.00 . A A . 66 SER HG 1 1 1 497 1 1 31 SER N N -5.245 -6.459 -3.732 1.00 . A A . 66 SER N 1 1 1 498 1 1 31 SER O O -2.947 -5.682 -6.464 1.00 . A A . 66 SER O 1 1 1 499 1 1 31 SER OG O -6.768 -6.652 -5.776 1.00 . A A . 66 SER OG 1 1 1 500 1 1 32 CYS C C -2.312 -2.406 -5.544 1.00 . A A . 67 CYS C 1 1 1 501 1 1 32 CYS CA C -3.559 -3.127 -6.008 1.00 . A A . 67 CYS CA 1 1 1 502 1 1 32 CYS CB C -4.653 -2.106 -6.303 1.00 . A A . 67 CYS CB 1 1 1 503 1 1 32 CYS H H -4.520 -4.063 -4.328 1.00 . A A . 67 CYS H 1 1 1 504 1 1 32 CYS HA H -3.310 -3.578 -6.957 1.00 . A A . 67 CYS HA 1 1 1 505 1 1 32 CYS HB2 H -4.183 -1.233 -6.731 1.00 . A A . 67 CYS HB2 1 1 1 506 1 1 32 CYS HB3 H -5.417 -2.507 -6.951 1.00 . A A . 67 CYS HB3 1 1 1 507 1 1 32 CYS N N -4.047 -4.236 -5.171 1.00 . A A . 67 CYS N 1 1 1 508 1 1 32 CYS O O -1.591 -1.847 -6.390 1.00 . A A . 67 CYS O 1 1 1 509 1 1 32 CYS SG S -5.436 -1.406 -4.881 1.00 . A A . 67 CYS SG 1 1 1 510 1 1 33 PHE C C 0.414 -2.075 -4.127 1.00 . A A . 68 PHE C 1 1 1 511 1 1 33 PHE CA C -0.956 -1.537 -3.803 1.00 . A A . 68 PHE CA 1 1 1 512 1 1 33 PHE CB C -1.095 -1.051 -2.350 1.00 . A A . 68 PHE CB 1 1 1 513 1 1 33 PHE CD1 C -2.473 -2.842 -1.215 1.00 . A A . 68 PHE CD1 1 1 1 514 1 1 33 PHE CD2 C -0.389 -2.198 -0.262 1.00 . A A . 68 PHE CD2 1 1 1 515 1 1 33 PHE CE1 C -2.673 -3.732 -0.173 1.00 . A A . 68 PHE CE1 1 1 1 516 1 1 33 PHE CE2 C -0.588 -3.073 0.773 1.00 . A A . 68 PHE CE2 1 1 1 517 1 1 33 PHE CG C -1.321 -2.066 -1.268 1.00 . A A . 68 PHE CG 1 1 1 518 1 1 33 PHE CZ C -1.726 -3.838 0.820 1.00 . A A . 68 PHE CZ 1 1 1 519 1 1 33 PHE H H -2.520 -2.947 -3.631 1.00 . A A . 68 PHE H 1 1 1 520 1 1 33 PHE HA H -1.052 -0.671 -4.443 1.00 . A A . 68 PHE HA 1 1 1 521 1 1 33 PHE HB2 H -0.110 -0.699 -2.089 1.00 . A A . 68 PHE HB2 1 1 1 522 1 1 33 PHE HB3 H -1.824 -0.260 -2.264 1.00 . A A . 68 PHE HB3 1 1 1 523 1 1 33 PHE HD1 H -3.212 -2.751 -1.997 1.00 . A A . 68 PHE HD1 1 1 1 524 1 1 33 PHE HD2 H 0.508 -1.599 -0.297 1.00 . A A . 68 PHE HD2 1 1 1 525 1 1 33 PHE HE1 H -3.571 -4.331 -0.117 1.00 . A A . 68 PHE HE1 1 1 1 526 1 1 33 PHE HE2 H 0.148 -3.159 1.557 1.00 . A A . 68 PHE HE2 1 1 1 527 1 1 33 PHE HZ H -1.863 -4.521 1.643 1.00 . A A . 68 PHE HZ 1 1 1 528 1 1 33 PHE N N -2.029 -2.382 -4.260 1.00 . A A . 68 PHE N 1 1 1 529 1 1 33 PHE O O 0.890 -3.061 -3.548 1.00 . A A . 68 PHE O 1 1 1 530 1 1 34 CYS C C 3.219 -0.618 -5.328 1.00 . A A . 69 CYS C 1 1 1 531 1 1 34 CYS CA C 2.283 -1.772 -5.587 1.00 . A A . 69 CYS CA 1 1 1 532 1 1 34 CYS CB C 2.183 -2.024 -7.089 1.00 . A A . 69 CYS CB 1 1 1 533 1 1 34 CYS H H 0.567 -0.663 -5.487 1.00 . A A . 69 CYS H 1 1 1 534 1 1 34 CYS HA H 2.638 -2.670 -5.104 1.00 . A A . 69 CYS HA 1 1 1 535 1 1 34 CYS HB2 H 1.959 -1.108 -7.615 1.00 . A A . 69 CYS HB2 1 1 1 536 1 1 34 CYS HB3 H 3.149 -2.372 -7.421 1.00 . A A . 69 CYS HB3 1 1 1 537 1 1 34 CYS HG H -0.181 -2.883 -7.000 1.00 . A A . 69 CYS HG 1 1 1 538 1 1 34 CYS N N 1.009 -1.438 -5.085 1.00 . A A . 69 CYS N 1 1 1 539 1 1 34 CYS O O 2.775 0.460 -4.930 1.00 . A A . 69 CYS O 1 1 1 540 1 1 34 CYS SG S 0.965 -3.277 -7.545 1.00 . A A . 69 CYS SG 1 1 1 541 1 1 35 CYS C C 5.302 1.255 -6.442 1.00 . A A . 70 CYS C 1 1 1 542 1 1 35 CYS CA C 5.486 0.178 -5.380 1.00 . A A . 70 CYS CA 1 1 1 543 1 1 35 CYS CB C 6.888 -0.450 -5.386 1.00 . A A . 70 CYS CB 1 1 1 544 1 1 35 CYS H H 4.762 -1.749 -5.809 1.00 . A A . 70 CYS H 1 1 1 545 1 1 35 CYS HA H 5.316 0.631 -4.416 1.00 . A A . 70 CYS HA 1 1 1 546 1 1 35 CYS HB2 H 6.957 -0.977 -4.447 1.00 . A A . 70 CYS HB2 1 1 1 547 1 1 35 CYS HB3 H 6.976 -1.183 -6.172 1.00 . A A . 70 CYS HB3 1 1 1 548 1 1 35 CYS N N 4.493 -0.848 -5.534 1.00 . A A . 70 CYS N 1 1 1 549 1 1 35 CYS O O 4.931 0.987 -7.583 1.00 . A A . 70 CYS O 1 1 1 550 1 1 35 CYS SG S 8.326 0.673 -5.409 1.00 . A A . 70 CYS SG 1 1 1 551 1 1 36 LYS C C 6.515 3.825 -7.804 1.00 . A A . 71 LYS C 1 1 1 552 1 1 36 LYS CA C 5.328 3.618 -6.861 1.00 . A A . 71 LYS CA 1 1 1 553 1 1 36 LYS CB C 5.139 4.845 -5.982 1.00 . A A . 71 LYS CB 1 1 1 554 1 1 36 LYS CD C 3.044 5.691 -7.012 1.00 . A A . 71 LYS CD 1 1 1 555 1 1 36 LYS CE C 2.649 6.280 -8.330 1.00 . A A . 71 LYS CE 1 1 1 556 1 1 36 LYS CG C 4.497 5.989 -6.714 1.00 . A A . 71 LYS CG 1 1 1 557 1 1 36 LYS H H 5.773 2.546 -5.084 1.00 . A A . 71 LYS H 1 1 1 558 1 1 36 LYS HA H 4.450 3.516 -7.481 1.00 . A A . 71 LYS HA 1 1 1 559 1 1 36 LYS HB2 H 4.543 4.588 -5.119 1.00 . A A . 71 LYS HB2 1 1 1 560 1 1 36 LYS HB3 H 6.120 5.153 -5.665 1.00 . A A . 71 LYS HB3 1 1 1 561 1 1 36 LYS HD2 H 2.874 4.625 -7.025 1.00 . A A . 71 LYS HD2 1 1 1 562 1 1 36 LYS HD3 H 2.435 6.135 -6.239 1.00 . A A . 71 LYS HD3 1 1 1 563 1 1 36 LYS HE2 H 3.325 5.803 -9.024 1.00 . A A . 71 LYS HE2 1 1 1 564 1 1 36 LYS HE3 H 1.628 6.005 -8.555 1.00 . A A . 71 LYS HE3 1 1 1 565 1 1 36 LYS HG2 H 4.555 6.885 -6.116 1.00 . A A . 71 LYS HG2 1 1 1 566 1 1 36 LYS HG3 H 5.020 6.143 -7.646 1.00 . A A . 71 LYS HG3 1 1 1 567 1 1 36 LYS HZ1 H 3.813 8.023 -8.207 1.00 . A A . 71 LYS HZ1 1 1 1 568 1 1 36 LYS HZ2 H 2.243 8.240 -7.668 1.00 . A A . 71 LYS HZ2 1 1 1 569 1 1 36 LYS HZ3 H 2.562 8.123 -9.313 1.00 . A A . 71 LYS HZ3 1 1 1 570 1 1 36 LYS N N 5.518 2.458 -6.030 1.00 . A A . 71 LYS N 1 1 1 571 1 1 36 LYS NZ N 2.824 7.753 -8.377 1.00 . A A . 71 LYS NZ 1 1 1 572 1 1 36 LYS O O 6.449 4.623 -8.746 1.00 . A A . 71 LYS O 1 1 1 573 1 1 37 HIS C C 8.848 2.052 -9.343 1.00 . A A . 72 HIS C 1 1 1 574 1 1 37 HIS CA C 8.763 3.259 -8.413 1.00 . A A . 72 HIS CA 1 1 1 575 1 1 37 HIS CB C 10.049 3.437 -7.600 1.00 . A A . 72 HIS CB 1 1 1 576 1 1 37 HIS CD2 C 12.137 3.167 -9.127 1.00 . A A . 72 HIS CD2 1 1 1 577 1 1 37 HIS CE1 C 12.697 5.264 -9.193 1.00 . A A . 72 HIS CE1 1 1 1 578 1 1 37 HIS CG C 11.243 3.888 -8.410 1.00 . A A . 72 HIS CG 1 1 1 579 1 1 37 HIS H H 7.621 2.546 -6.766 1.00 . A A . 72 HIS H 1 1 1 580 1 1 37 HIS HA H 8.605 4.135 -9.024 1.00 . A A . 72 HIS HA 1 1 1 581 1 1 37 HIS HB2 H 9.871 4.191 -6.848 1.00 . A A . 72 HIS HB2 1 1 1 582 1 1 37 HIS HB3 H 10.298 2.502 -7.121 1.00 . A A . 72 HIS HB3 1 1 1 583 1 1 37 HIS HD2 H 12.131 2.098 -9.280 1.00 . A A . 72 HIS HD2 1 1 1 584 1 1 37 HIS HE1 H 13.240 6.175 -9.392 1.00 . A A . 72 HIS HE1 1 1 1 585 1 1 37 HIS HE2 H 13.985 3.833 -9.850 1.00 . A A . 72 HIS HE2 1 1 1 586 1 1 37 HIS N N 7.605 3.135 -7.549 1.00 . A A . 72 HIS N 1 1 1 587 1 1 37 HIS ND1 N 11.599 5.208 -8.462 1.00 . A A . 72 HIS ND1 1 1 1 588 1 1 37 HIS NE2 N 13.056 4.056 -9.619 1.00 . A A . 72 HIS NE2 1 1 1 589 1 1 37 HIS O O 9.246 2.176 -10.500 1.00 . A A . 72 HIS O 1 1 1 590 1 1 38 CYS C C 7.066 -0.918 -9.410 1.00 . A A . 73 CYS C 1 1 1 591 1 1 38 CYS CA C 8.420 -0.288 -9.638 1.00 . A A . 73 CYS CA 1 1 1 592 1 1 38 CYS CB C 9.555 -1.219 -9.194 1.00 . A A . 73 CYS CB 1 1 1 593 1 1 38 CYS H H 8.070 0.825 -7.952 1.00 . A A . 73 CYS H 1 1 1 594 1 1 38 CYS HA H 8.580 0.018 -10.660 1.00 . A A . 73 CYS HA 1 1 1 595 1 1 38 CYS HB2 H 9.771 -1.965 -9.934 1.00 . A A . 73 CYS HB2 1 1 1 596 1 1 38 CYS HB3 H 10.405 -0.564 -9.163 1.00 . A A . 73 CYS HB3 1 1 1 597 1 1 38 CYS N N 8.436 0.902 -8.854 1.00 . A A . 73 CYS N 1 1 1 598 1 1 38 CYS O O 6.639 -0.965 -8.276 1.00 . A A . 73 CYS O 1 1 1 599 1 1 38 CYS SG S 9.396 -2.021 -7.568 1.00 . A A . 73 CYS SG 1 1 1 600 1 1 39 HIS C C 5.038 -3.353 -9.621 1.00 . A A . 74 HIS C 1 1 1 601 1 1 39 HIS CA C 4.991 -1.925 -10.192 1.00 . A A . 74 HIS CA 1 1 1 602 1 1 39 HIS CB C 4.110 -1.853 -11.446 1.00 . A A . 74 HIS CB 1 1 1 603 1 1 39 HIS CD2 C 1.747 -0.908 -10.826 1.00 . A A . 74 HIS CD2 1 1 1 604 1 1 39 HIS CE1 C 0.598 -2.761 -10.938 1.00 . A A . 74 HIS CE1 1 1 1 605 1 1 39 HIS CG C 2.616 -1.901 -11.155 1.00 . A A . 74 HIS CG 1 1 1 606 1 1 39 HIS H H 6.769 -1.434 -11.324 1.00 . A A . 74 HIS H 1 1 1 607 1 1 39 HIS HA H 4.557 -1.311 -9.414 1.00 . A A . 74 HIS HA 1 1 1 608 1 1 39 HIS HB2 H 4.321 -0.935 -11.970 1.00 . A A . 74 HIS HB2 1 1 1 609 1 1 39 HIS HB3 H 4.356 -2.694 -12.077 1.00 . A A . 74 HIS HB3 1 1 1 610 1 1 39 HIS HD1 H 2.170 -3.961 -11.401 1.00 . A A . 74 HIS HD1 1 1 1 611 1 1 39 HIS HD2 H 1.991 0.134 -10.681 1.00 . A A . 74 HIS HD2 1 1 1 612 1 1 39 HIS HE1 H -0.219 -3.467 -10.913 1.00 . A A . 74 HIS HE1 1 1 1 613 1 1 39 HIS HE2 H -0.344 -0.984 -10.621 1.00 . A A . 74 HIS HE2 1 1 1 614 1 1 39 HIS N N 6.366 -1.401 -10.428 1.00 . A A . 74 HIS N 1 1 1 615 1 1 39 HIS ND1 N 1.858 -3.047 -11.211 1.00 . A A . 74 HIS ND1 1 1 1 616 1 1 39 HIS NE2 N 0.506 -1.475 -10.700 1.00 . A A . 74 HIS NE2 1 1 1 617 1 1 39 HIS O O 4.440 -4.300 -10.146 1.00 . A A . 74 HIS O 1 1 1 618 1 1 40 THR C C 4.738 -4.760 -6.845 1.00 . A A . 75 THR C 1 1 1 619 1 1 40 THR CA C 5.934 -4.627 -7.785 1.00 . A A . 75 THR CA 1 1 1 620 1 1 40 THR CB C 7.298 -4.514 -7.023 1.00 . A A . 75 THR CB 1 1 1 621 1 1 40 THR CG2 C 7.290 -5.044 -5.601 1.00 . A A . 75 THR CG2 1 1 1 622 1 1 40 THR H H 6.242 -2.639 -8.296 1.00 . A A . 75 THR H 1 1 1 623 1 1 40 THR HA H 5.975 -5.479 -8.446 1.00 . A A . 75 THR HA 1 1 1 624 1 1 40 THR HB H 7.499 -3.451 -6.994 1.00 . A A . 75 THR HB 1 1 1 625 1 1 40 THR HG1 H 8.014 -5.491 -8.561 1.00 . A A . 75 THR HG1 1 1 1 626 1 1 40 THR HG21 H 6.863 -6.035 -5.564 1.00 . A A . 75 THR HG21 1 1 1 627 1 1 40 THR HG22 H 6.724 -4.327 -5.020 1.00 . A A . 75 THR HG22 1 1 1 628 1 1 40 THR HG23 H 8.306 -5.052 -5.233 1.00 . A A . 75 THR HG23 1 1 1 629 1 1 40 THR N N 5.770 -3.459 -8.567 1.00 . A A . 75 THR N 1 1 1 630 1 1 40 THR O O 4.472 -3.856 -6.027 1.00 . A A . 75 THR O 1 1 1 631 1 1 40 THR OG1 O 8.380 -5.057 -7.782 1.00 . A A . 75 THR OG1 1 1 1 632 1 1 41 LYS C C 3.285 -6.610 -4.860 1.00 . A A . 76 LYS C 1 1 1 633 1 1 41 LYS CA C 2.815 -6.117 -6.226 1.00 . A A . 76 LYS CA 1 1 1 634 1 1 41 LYS CB C 1.921 -7.134 -6.982 1.00 . A A . 76 LYS CB 1 1 1 635 1 1 41 LYS CD C 0.334 -8.127 -5.207 1.00 . A A . 76 LYS CD 1 1 1 636 1 1 41 LYS CE C 0.744 -9.583 -5.431 1.00 . A A . 76 LYS CE 1 1 1 637 1 1 41 LYS CG C 0.468 -7.292 -6.477 1.00 . A A . 76 LYS CG 1 1 1 638 1 1 41 LYS H H 4.235 -6.470 -7.727 1.00 . A A . 76 LYS H 1 1 1 639 1 1 41 LYS HA H 2.275 -5.192 -6.083 1.00 . A A . 76 LYS HA 1 1 1 640 1 1 41 LYS HB2 H 1.874 -6.834 -8.018 1.00 . A A . 76 LYS HB2 1 1 1 641 1 1 41 LYS HB3 H 2.406 -8.097 -6.932 1.00 . A A . 76 LYS HB3 1 1 1 642 1 1 41 LYS HD2 H 0.972 -7.697 -4.449 1.00 . A A . 76 LYS HD2 1 1 1 643 1 1 41 LYS HD3 H -0.693 -8.094 -4.874 1.00 . A A . 76 LYS HD3 1 1 1 644 1 1 41 LYS HE2 H 1.791 -9.620 -5.694 1.00 . A A . 76 LYS HE2 1 1 1 645 1 1 41 LYS HE3 H 0.595 -10.116 -4.503 1.00 . A A . 76 LYS HE3 1 1 1 646 1 1 41 LYS HG2 H 0.068 -6.311 -6.273 1.00 . A A . 76 LYS HG2 1 1 1 647 1 1 41 LYS HG3 H -0.118 -7.751 -7.259 1.00 . A A . 76 LYS HG3 1 1 1 648 1 1 41 LYS HZ1 H -1.074 -10.183 -6.338 1.00 . A A . 76 LYS HZ1 1 1 1 649 1 1 41 LYS HZ2 H 0.176 -11.262 -6.513 1.00 . A A . 76 LYS HZ2 1 1 1 650 1 1 41 LYS HZ3 H 0.172 -9.861 -7.448 1.00 . A A . 76 LYS HZ3 1 1 1 651 1 1 41 LYS N N 3.987 -5.834 -7.021 1.00 . A A . 76 LYS N 1 1 1 652 1 1 41 LYS NZ N -0.050 -10.245 -6.507 1.00 . A A . 76 LYS NZ 1 1 1 653 1 1 41 LYS O O 3.526 -7.793 -4.639 1.00 . A A . 76 LYS O 1 1 1 654 1 1 42 LEU C C 2.917 -5.806 -1.613 1.00 . A A . 77 LEU C 1 1 1 655 1 1 42 LEU CA C 3.996 -5.808 -2.654 1.00 . A A . 77 LEU CA 1 1 1 656 1 1 42 LEU CB C 5.014 -4.701 -2.436 1.00 . A A . 77 LEU CB 1 1 1 657 1 1 42 LEU CD1 C 3.533 -2.694 -1.697 1.00 . A A . 77 LEU CD1 1 1 1 658 1 1 42 LEU CD2 C 5.682 -2.354 -2.775 1.00 . A A . 77 LEU CD2 1 1 1 659 1 1 42 LEU CG C 4.519 -3.242 -2.707 1.00 . A A . 77 LEU CG 1 1 1 660 1 1 42 LEU H H 3.282 -4.748 -4.323 1.00 . A A . 77 LEU H 1 1 1 661 1 1 42 LEU HA H 4.522 -6.747 -2.596 1.00 . A A . 77 LEU HA 1 1 1 662 1 1 42 LEU HB2 H 5.567 -4.773 -1.513 1.00 . A A . 77 LEU HB2 1 1 1 663 1 1 42 LEU HB3 H 5.692 -4.861 -3.263 1.00 . A A . 77 LEU HB3 1 1 1 664 1 1 42 LEU HD11 H 2.727 -3.387 -1.496 1.00 . A A . 77 LEU HD11 1 1 1 665 1 1 42 LEU HD12 H 3.127 -1.761 -2.065 1.00 . A A . 77 LEU HD12 1 1 1 666 1 1 42 LEU HD13 H 4.098 -2.503 -0.802 1.00 . A A . 77 LEU HD13 1 1 1 667 1 1 42 LEU HD21 H 5.361 -1.357 -3.040 1.00 . A A . 77 LEU HD21 1 1 1 668 1 1 42 LEU HD22 H 6.392 -2.730 -3.497 1.00 . A A . 77 LEU HD22 1 1 1 669 1 1 42 LEU HD23 H 6.144 -2.323 -1.800 1.00 . A A . 77 LEU HD23 1 1 1 670 1 1 42 LEU HG H 4.047 -3.212 -3.677 1.00 . A A . 77 LEU HG 1 1 1 671 1 1 42 LEU N N 3.482 -5.655 -4.008 1.00 . A A . 77 LEU N 1 1 1 672 1 1 42 LEU O O 3.182 -5.704 -0.417 1.00 . A A . 77 LEU O 1 1 1 673 1 1 43 SER C C 0.587 -6.910 -0.168 1.00 . A A . 78 SER C 1 1 1 674 1 1 43 SER CA C 0.570 -5.849 -1.278 1.00 . A A . 78 SER CA 1 1 1 675 1 1 43 SER CB C -0.575 -6.110 -2.186 1.00 . A A . 78 SER CB 1 1 1 676 1 1 43 SER H H 1.622 -5.959 -3.046 1.00 . A A . 78 SER H 1 1 1 677 1 1 43 SER HA H 0.428 -4.867 -0.869 1.00 . A A . 78 SER HA 1 1 1 678 1 1 43 SER HB2 H -0.542 -7.160 -2.404 1.00 . A A . 78 SER HB2 1 1 1 679 1 1 43 SER HB3 H -1.504 -5.862 -1.695 1.00 . A A . 78 SER HB3 1 1 1 680 1 1 43 SER HG H 0.022 -4.526 -3.221 1.00 . A A . 78 SER HG 1 1 1 681 1 1 43 SER N N 1.727 -5.886 -2.079 1.00 . A A . 78 SER N 1 1 1 682 1 1 43 SER O O 1.016 -8.045 -0.389 1.00 . A A . 78 SER O 1 1 1 683 1 1 43 SER OG O -0.448 -5.355 -3.388 1.00 . A A . 78 SER OG 1 1 1 684 1 1 44 LEU C C 0.853 -8.424 2.457 1.00 . A A . 79 LEU C 1 1 1 685 1 1 44 LEU CA C -0.092 -7.240 2.236 1.00 . A A . 79 LEU CA 1 1 1 686 1 1 44 LEU CB C -1.551 -7.657 2.331 1.00 . A A . 79 LEU CB 1 1 1 687 1 1 44 LEU CD1 C -1.563 -8.154 4.820 1.00 . A A . 79 LEU CD1 1 1 1 688 1 1 44 LEU CD2 C -2.272 -5.919 4.006 1.00 . A A . 79 LEU CD2 1 1 1 689 1 1 44 LEU CG C -2.238 -7.404 3.692 1.00 . A A . 79 LEU CG 1 1 1 690 1 1 44 LEU H H -0.044 -5.508 1.059 1.00 . A A . 79 LEU H 1 1 1 691 1 1 44 LEU HA H 0.096 -6.562 3.053 1.00 . A A . 79 LEU HA 1 1 1 692 1 1 44 LEU HB2 H -2.095 -7.144 1.548 1.00 . A A . 79 LEU HB2 1 1 1 693 1 1 44 LEU HB3 H -1.580 -8.717 2.134 1.00 . A A . 79 LEU HB3 1 1 1 694 1 1 44 LEU HD11 H -0.550 -7.789 4.917 1.00 . A A . 79 LEU HD11 1 1 1 695 1 1 44 LEU HD12 H -1.562 -9.211 4.601 1.00 . A A . 79 LEU HD12 1 1 1 696 1 1 44 LEU HD13 H -2.104 -7.962 5.734 1.00 . A A . 79 LEU HD13 1 1 1 697 1 1 44 LEU HD21 H -2.831 -5.401 3.242 1.00 . A A . 79 LEU HD21 1 1 1 698 1 1 44 LEU HD22 H -1.264 -5.536 4.027 1.00 . A A . 79 LEU HD22 1 1 1 699 1 1 44 LEU HD23 H -2.740 -5.763 4.966 1.00 . A A . 79 LEU HD23 1 1 1 700 1 1 44 LEU HG H -3.255 -7.757 3.638 1.00 . A A . 79 LEU HG 1 1 1 701 1 1 44 LEU N N 0.138 -6.467 1.008 1.00 . A A . 79 LEU N 1 1 1 702 1 1 44 LEU O O 0.659 -9.506 1.914 1.00 . A A . 79 LEU O 1 1 1 703 1 1 45 GLY C C 4.105 -8.644 3.838 1.00 . A A . 80 GLY C 1 1 1 704 1 1 45 GLY CA C 2.777 -9.252 3.577 1.00 . A A . 80 GLY CA 1 1 1 705 1 1 45 GLY H H 1.943 -7.350 3.728 1.00 . A A . 80 GLY H 1 1 1 706 1 1 45 GLY HA2 H 2.444 -9.792 4.450 1.00 . A A . 80 GLY HA2 1 1 1 707 1 1 45 GLY HA3 H 2.848 -9.926 2.738 1.00 . A A . 80 GLY HA3 1 1 1 708 1 1 45 GLY N N 1.832 -8.219 3.283 1.00 . A A . 80 GLY N 1 1 1 709 1 1 45 GLY O O 4.646 -8.746 4.939 1.00 . A A . 80 GLY O 1 1 1 710 1 1 46 SER C C 5.800 -6.019 2.112 1.00 . A A . 81 SER C 1 1 1 711 1 1 46 SER CA C 5.842 -7.261 2.985 1.00 . A A . 81 SER CA 1 1 1 712 1 1 46 SER CB C 7.026 -8.177 2.648 1.00 . A A . 81 SER CB 1 1 1 713 1 1 46 SER H H 4.173 -7.992 1.973 1.00 . A A . 81 SER H 1 1 1 714 1 1 46 SER HA H 5.918 -6.959 4.017 1.00 . A A . 81 SER HA 1 1 1 715 1 1 46 SER HB2 H 7.925 -7.592 2.518 1.00 . A A . 81 SER HB2 1 1 1 716 1 1 46 SER HB3 H 7.155 -8.870 3.465 1.00 . A A . 81 SER HB3 1 1 1 717 1 1 46 SER HG H 5.842 -9.123 1.430 1.00 . A A . 81 SER HG 1 1 1 718 1 1 46 SER N N 4.629 -7.991 2.842 1.00 . A A . 81 SER N 1 1 1 719 1 1 46 SER O O 5.958 -6.092 0.891 1.00 . A A . 81 SER O 1 1 1 720 1 1 46 SER OG O 6.790 -8.934 1.460 1.00 . A A . 81 SER OG 1 1 1 721 1 1 47 TYR C C 6.059 -2.543 2.854 1.00 . A A . 82 TYR C 1 1 1 722 1 1 47 TYR CA C 5.493 -3.661 2.027 1.00 . A A . 82 TYR CA 1 1 1 723 1 1 47 TYR CB C 4.021 -3.388 1.626 1.00 . A A . 82 TYR CB 1 1 1 724 1 1 47 TYR CD1 C 3.094 -1.949 3.472 1.00 . A A . 82 TYR CD1 1 1 1 725 1 1 47 TYR CD2 C 1.956 -3.980 3.007 1.00 . A A . 82 TYR CD2 1 1 1 726 1 1 47 TYR CE1 C 2.175 -1.632 4.424 1.00 . A A . 82 TYR CE1 1 1 1 727 1 1 47 TYR CE2 C 1.026 -3.671 3.985 1.00 . A A . 82 TYR CE2 1 1 1 728 1 1 47 TYR CG C 3.018 -3.115 2.743 1.00 . A A . 82 TYR CG 1 1 1 729 1 1 47 TYR CZ C 1.146 -2.491 4.684 1.00 . A A . 82 TYR CZ 1 1 1 730 1 1 47 TYR H H 5.511 -4.812 3.714 1.00 . A A . 82 TYR H 1 1 1 731 1 1 47 TYR HA H 6.092 -3.716 1.126 1.00 . A A . 82 TYR HA 1 1 1 732 1 1 47 TYR HB2 H 3.968 -2.535 0.972 1.00 . A A . 82 TYR HB2 1 1 1 733 1 1 47 TYR HB3 H 3.677 -4.243 1.070 1.00 . A A . 82 TYR HB3 1 1 1 734 1 1 47 TYR HD1 H 3.930 -1.298 3.265 1.00 . A A . 82 TYR HD1 1 1 1 735 1 1 47 TYR HD2 H 1.849 -4.908 2.466 1.00 . A A . 82 TYR HD2 1 1 1 736 1 1 47 TYR HE1 H 2.266 -0.709 4.977 1.00 . A A . 82 TYR HE1 1 1 1 737 1 1 47 TYR HE2 H 0.218 -4.356 4.193 1.00 . A A . 82 TYR HE2 1 1 1 738 1 1 47 TYR HH H 0.068 -1.193 5.461 1.00 . A A . 82 TYR HH 1 1 1 739 1 1 47 TYR N N 5.602 -4.883 2.735 1.00 . A A . 82 TYR N 1 1 1 740 1 1 47 TYR O O 6.359 -2.730 4.034 1.00 . A A . 82 TYR O 1 1 1 741 1 1 47 TYR OH O 0.209 -2.148 5.622 1.00 . A A . 82 TYR OH 1 1 1 742 1 1 48 ALA C C 5.740 0.879 2.441 1.00 . A A . 83 ALA C 1 1 1 743 1 1 48 ALA CA C 6.648 -0.240 2.916 1.00 . A A . 83 ALA CA 1 1 1 744 1 1 48 ALA CB C 8.096 0.066 2.619 1.00 . A A . 83 ALA CB 1 1 1 745 1 1 48 ALA H H 6.092 -1.366 1.266 1.00 . A A . 83 ALA H 1 1 1 746 1 1 48 ALA HA H 6.520 -0.400 3.976 1.00 . A A . 83 ALA HA 1 1 1 747 1 1 48 ALA HB1 H 8.378 0.982 3.116 1.00 . A A . 83 ALA HB1 1 1 1 748 1 1 48 ALA HB2 H 8.229 0.176 1.553 1.00 . A A . 83 ALA HB2 1 1 1 749 1 1 48 ALA HB3 H 8.712 -0.743 2.982 1.00 . A A . 83 ALA HB3 1 1 1 750 1 1 48 ALA N N 6.250 -1.429 2.234 1.00 . A A . 83 ALA N 1 1 1 751 1 1 48 ALA O O 5.689 1.180 1.265 1.00 . A A . 83 ALA O 1 1 1 752 1 1 49 ALA C C 4.450 3.832 3.440 1.00 . A A . 84 ALA C 1 1 1 753 1 1 49 ALA CA C 4.078 2.480 2.900 1.00 . A A . 84 ALA CA 1 1 1 754 1 1 49 ALA CB C 2.662 2.104 3.301 1.00 . A A . 84 ALA CB 1 1 1 755 1 1 49 ALA H H 5.107 1.255 4.269 1.00 . A A . 84 ALA H 1 1 1 756 1 1 49 ALA HA H 4.113 2.511 1.820 1.00 . A A . 84 ALA HA 1 1 1 757 1 1 49 ALA HB1 H 1.979 2.831 2.886 1.00 . A A . 84 ALA HB1 1 1 1 758 1 1 49 ALA HB2 H 2.573 2.085 4.377 1.00 . A A . 84 ALA HB2 1 1 1 759 1 1 49 ALA HB3 H 2.429 1.130 2.896 1.00 . A A . 84 ALA HB3 1 1 1 760 1 1 49 ALA N N 5.015 1.472 3.317 1.00 . A A . 84 ALA N 1 1 1 761 1 1 49 ALA O O 4.986 3.950 4.552 1.00 . A A . 84 ALA O 1 1 1 762 1 1 50 LEU C C 3.181 6.931 2.673 1.00 . A A . 85 LEU C 1 1 1 763 1 1 50 LEU CA C 4.423 6.183 3.047 1.00 . A A . 85 LEU CA 1 1 1 764 1 1 50 LEU CB C 5.616 6.795 2.289 1.00 . A A . 85 LEU CB 1 1 1 765 1 1 50 LEU CD1 C 6.597 8.314 3.983 1.00 . A A . 85 LEU CD1 1 1 1 766 1 1 50 LEU CD2 C 6.830 8.881 1.614 1.00 . A A . 85 LEU CD2 1 1 1 767 1 1 50 LEU CG C 5.956 8.231 2.642 1.00 . A A . 85 LEU CG 1 1 1 768 1 1 50 LEU H H 3.861 4.712 1.741 1.00 . A A . 85 LEU H 1 1 1 769 1 1 50 LEU HA H 4.603 6.234 4.108 1.00 . A A . 85 LEU HA 1 1 1 770 1 1 50 LEU HB2 H 6.497 6.225 2.530 1.00 . A A . 85 LEU HB2 1 1 1 771 1 1 50 LEU HB3 H 5.430 6.740 1.230 1.00 . A A . 85 LEU HB3 1 1 1 772 1 1 50 LEU HD11 H 6.726 9.367 4.187 1.00 . A A . 85 LEU HD11 1 1 1 773 1 1 50 LEU HD12 H 7.553 7.814 3.899 1.00 . A A . 85 LEU HD12 1 1 1 774 1 1 50 LEU HD13 H 5.968 7.851 4.727 1.00 . A A . 85 LEU HD13 1 1 1 775 1 1 50 LEU HD21 H 7.749 8.323 1.504 1.00 . A A . 85 LEU HD21 1 1 1 776 1 1 50 LEU HD22 H 7.066 9.874 1.966 1.00 . A A . 85 LEU HD22 1 1 1 777 1 1 50 LEU HD23 H 6.314 8.935 0.667 1.00 . A A . 85 LEU HD23 1 1 1 778 1 1 50 LEU HG H 5.028 8.776 2.688 1.00 . A A . 85 LEU HG 1 1 1 779 1 1 50 LEU N N 4.214 4.838 2.653 1.00 . A A . 85 LEU N 1 1 1 780 1 1 50 LEU O O 2.446 6.494 1.783 1.00 . A A . 85 LEU O 1 1 1 781 1 1 51 HIS C C 1.964 9.264 1.535 1.00 . A A . 86 HIS C 1 1 1 782 1 1 51 HIS CA C 1.851 8.924 3.017 1.00 . A A . 86 HIS CA 1 1 1 783 1 1 51 HIS CB C 1.926 10.213 3.888 1.00 . A A . 86 HIS CB 1 1 1 784 1 1 51 HIS CD2 C 4.184 11.404 3.219 1.00 . A A . 86 HIS CD2 1 1 1 785 1 1 51 HIS CE1 C 5.157 11.331 5.152 1.00 . A A . 86 HIS CE1 1 1 1 786 1 1 51 HIS CG C 3.325 10.798 4.078 1.00 . A A . 86 HIS CG 1 1 1 787 1 1 51 HIS H H 3.423 8.153 4.205 1.00 . A A . 86 HIS H 1 1 1 788 1 1 51 HIS HA H 0.905 8.432 3.195 1.00 . A A . 86 HIS HA 1 1 1 789 1 1 51 HIS HB2 H 1.325 10.975 3.415 1.00 . A A . 86 HIS HB2 1 1 1 790 1 1 51 HIS HB3 H 1.513 10.004 4.864 1.00 . A A . 86 HIS HB3 1 1 1 791 1 1 51 HIS HD1 H 3.625 10.413 6.124 1.00 . A A . 86 HIS HD1 1 1 1 792 1 1 51 HIS HD2 H 4.051 11.541 2.159 1.00 . A A . 86 HIS HD2 1 1 1 793 1 1 51 HIS HE1 H 5.900 11.416 5.927 1.00 . A A . 86 HIS HE1 1 1 1 794 1 1 51 HIS HE2 H 5.877 12.486 3.673 1.00 . A A . 86 HIS HE2 1 1 1 795 1 1 51 HIS N N 2.911 8.002 3.384 1.00 . A A . 86 HIS N 1 1 1 796 1 1 51 HIS ND1 N 3.978 10.773 5.280 1.00 . A A . 86 HIS ND1 1 1 1 797 1 1 51 HIS NE2 N 5.304 11.725 3.918 1.00 . A A . 86 HIS NE2 1 1 1 798 1 1 51 HIS O O 2.990 9.761 1.080 1.00 . A A . 86 HIS O 1 1 1 799 1 1 52 GLY C C 1.369 8.011 -1.444 1.00 . A A . 87 GLY C 1 1 1 800 1 1 52 GLY CA C 0.973 9.204 -0.601 1.00 . A A . 87 GLY CA 1 1 1 801 1 1 52 GLY H H 0.175 8.486 1.187 1.00 . A A . 87 GLY H 1 1 1 802 1 1 52 GLY HA2 H -0.006 9.534 -0.915 1.00 . A A . 87 GLY HA2 1 1 1 803 1 1 52 GLY HA3 H 1.682 9.998 -0.784 1.00 . A A . 87 GLY HA3 1 1 1 804 1 1 52 GLY N N 0.953 8.936 0.796 1.00 . A A . 87 GLY N 1 1 1 805 1 1 52 GLY O O 0.628 7.634 -2.352 1.00 . A A . 87 GLY O 1 1 1 806 1 1 53 GLU C C 3.381 5.069 -1.307 1.00 . A A . 88 GLU C 1 1 1 807 1 1 53 GLU CA C 3.025 6.352 -2.028 1.00 . A A . 88 GLU CA 1 1 1 808 1 1 53 GLU CB C 4.264 6.902 -2.753 1.00 . A A . 88 GLU CB 1 1 1 809 1 1 53 GLU CD C 5.225 8.884 -3.985 1.00 . A A . 88 GLU CD 1 1 1 810 1 1 53 GLU CG C 3.994 8.221 -3.458 1.00 . A A . 88 GLU CG 1 1 1 811 1 1 53 GLU H H 2.923 7.503 -0.259 1.00 . A A . 88 GLU H 1 1 1 812 1 1 53 GLU HA H 2.276 6.138 -2.775 1.00 . A A . 88 GLU HA 1 1 1 813 1 1 53 GLU HB2 H 5.121 6.985 -2.100 1.00 . A A . 88 GLU HB2 1 1 1 814 1 1 53 GLU HB3 H 4.517 6.188 -3.523 1.00 . A A . 88 GLU HB3 1 1 1 815 1 1 53 GLU HG2 H 3.315 8.042 -4.278 1.00 . A A . 88 GLU HG2 1 1 1 816 1 1 53 GLU HG3 H 3.516 8.885 -2.752 1.00 . A A . 88 GLU HG3 1 1 1 817 1 1 53 GLU N N 2.485 7.364 -1.127 1.00 . A A . 88 GLU N 1 1 1 818 1 1 53 GLU O O 3.900 5.080 -0.194 1.00 . A A . 88 GLU O 1 1 1 819 1 1 53 GLU OE1 O 5.806 8.398 -4.961 1.00 . A A . 88 GLU OE1 1 1 1 820 1 1 53 GLU OE2 O 5.604 9.951 -3.462 1.00 . A A . 88 GLU OE2 1 1 1 821 1 1 54 PHE C C 4.702 2.299 -2.146 1.00 . A A . 89 PHE C 1 1 1 822 1 1 54 PHE CA C 3.430 2.675 -1.455 1.00 . A A . 89 PHE CA 1 1 1 823 1 1 54 PHE CB C 2.278 1.710 -1.797 1.00 . A A . 89 PHE CB 1 1 1 824 1 1 54 PHE CD1 C 0.229 3.136 -2.035 1.00 . A A . 89 PHE CD1 1 1 1 825 1 1 54 PHE CD2 C 0.506 1.897 -0.007 1.00 . A A . 89 PHE CD2 1 1 1 826 1 1 54 PHE CE1 C -0.930 3.680 -1.557 1.00 . A A . 89 PHE CE1 1 1 1 827 1 1 54 PHE CE2 C -0.650 2.454 0.476 1.00 . A A . 89 PHE CE2 1 1 1 828 1 1 54 PHE CG C 0.968 2.233 -1.273 1.00 . A A . 89 PHE CG 1 1 1 829 1 1 54 PHE CZ C -1.365 3.351 -0.310 1.00 . A A . 89 PHE CZ 1 1 1 830 1 1 54 PHE H H 2.719 4.007 -2.852 1.00 . A A . 89 PHE H 1 1 1 831 1 1 54 PHE HA H 3.574 2.734 -0.385 1.00 . A A . 89 PHE HA 1 1 1 832 1 1 54 PHE HB2 H 2.196 1.632 -2.872 1.00 . A A . 89 PHE HB2 1 1 1 833 1 1 54 PHE HB3 H 2.468 0.734 -1.383 1.00 . A A . 89 PHE HB3 1 1 1 834 1 1 54 PHE HD1 H 0.572 3.397 -3.025 1.00 . A A . 89 PHE HD1 1 1 1 835 1 1 54 PHE HD2 H 1.039 1.200 0.622 1.00 . A A . 89 PHE HD2 1 1 1 836 1 1 54 PHE HE1 H -1.503 4.377 -2.151 1.00 . A A . 89 PHE HE1 1 1 1 837 1 1 54 PHE HE2 H -1.007 2.174 1.459 1.00 . A A . 89 PHE HE2 1 1 1 838 1 1 54 PHE HZ H -2.271 3.813 0.051 1.00 . A A . 89 PHE HZ 1 1 1 839 1 1 54 PHE N N 3.123 3.975 -1.963 1.00 . A A . 89 PHE N 1 1 1 840 1 1 54 PHE O O 4.837 2.511 -3.351 1.00 . A A . 89 PHE O 1 1 1 841 1 1 55 TYR C C 7.434 0.290 -1.565 1.00 . A A . 90 TYR C 1 1 1 842 1 1 55 TYR CA C 6.929 1.645 -1.979 1.00 . A A . 90 TYR CA 1 1 1 843 1 1 55 TYR CB C 7.784 2.735 -1.358 1.00 . A A . 90 TYR CB 1 1 1 844 1 1 55 TYR CD1 C 7.555 4.642 -2.976 1.00 . A A . 90 TYR CD1 1 1 1 845 1 1 55 TYR CD2 C 9.741 3.827 -2.506 1.00 . A A . 90 TYR CD2 1 1 1 846 1 1 55 TYR CE1 C 8.081 5.593 -3.812 1.00 . A A . 90 TYR CE1 1 1 1 847 1 1 55 TYR CE2 C 10.273 4.776 -3.344 1.00 . A A . 90 TYR CE2 1 1 1 848 1 1 55 TYR CG C 8.377 3.737 -2.305 1.00 . A A . 90 TYR CG 1 1 1 849 1 1 55 TYR CZ C 9.442 5.656 -3.995 1.00 . A A . 90 TYR CZ 1 1 1 850 1 1 55 TYR H H 5.481 1.530 -0.501 1.00 . A A . 90 TYR H 1 1 1 851 1 1 55 TYR HA H 6.926 1.766 -3.052 1.00 . A A . 90 TYR HA 1 1 1 852 1 1 55 TYR HB2 H 7.049 3.366 -0.875 1.00 . A A . 90 TYR HB2 1 1 1 853 1 1 55 TYR HB3 H 8.503 2.380 -0.637 1.00 . A A . 90 TYR HB3 1 1 1 854 1 1 55 TYR HD1 H 6.484 4.606 -2.840 1.00 . A A . 90 TYR HD1 1 1 1 855 1 1 55 TYR HD2 H 10.408 3.141 -2.006 1.00 . A A . 90 TYR HD2 1 1 1 856 1 1 55 TYR HE1 H 7.409 6.278 -4.309 1.00 . A A . 90 TYR HE1 1 1 1 857 1 1 55 TYR HE2 H 11.342 4.835 -3.487 1.00 . A A . 90 TYR HE2 1 1 1 858 1 1 55 TYR HH H 9.471 7.422 -4.699 1.00 . A A . 90 TYR HH 1 1 1 859 1 1 55 TYR N N 5.634 1.810 -1.435 1.00 . A A . 90 TYR N 1 1 1 860 1 1 55 TYR O O 6.997 -0.262 -0.564 1.00 . A A . 90 TYR O 1 1 1 861 1 1 55 TYR OH O 9.977 6.610 -4.819 1.00 . A A . 90 TYR OH 1 1 1 862 1 1 56 CYS C C 9.921 -1.282 -0.945 1.00 . A A . 91 CYS C 1 1 1 863 1 1 56 CYS CA C 8.827 -1.552 -1.926 1.00 . A A . 91 CYS CA 1 1 1 864 1 1 56 CYS CB C 9.349 -2.385 -3.107 1.00 . A A . 91 CYS CB 1 1 1 865 1 1 56 CYS H H 8.581 0.145 -3.165 1.00 . A A . 91 CYS H 1 1 1 866 1 1 56 CYS HA H 8.043 -2.094 -1.412 1.00 . A A . 91 CYS HA 1 1 1 867 1 1 56 CYS HB2 H 9.635 -3.359 -2.740 1.00 . A A . 91 CYS HB2 1 1 1 868 1 1 56 CYS HB3 H 8.575 -2.529 -3.838 1.00 . A A . 91 CYS HB3 1 1 1 869 1 1 56 CYS N N 8.298 -0.290 -2.335 1.00 . A A . 91 CYS N 1 1 1 870 1 1 56 CYS O O 10.539 -0.213 -1.033 1.00 . A A . 91 CYS O 1 1 1 871 1 1 56 CYS SG S 10.768 -1.677 -3.948 1.00 . A A . 91 CYS SG 1 1 1 872 1 1 57 LYS C C 12.584 -1.554 0.354 1.00 . A A . 92 LYS C 1 1 1 873 1 1 57 LYS CA C 11.197 -1.956 0.971 1.00 . A A . 92 LYS CA 1 1 1 874 1 1 57 LYS CB C 11.322 -3.167 1.903 1.00 . A A . 92 LYS CB 1 1 1 875 1 1 57 LYS CD C 10.227 -4.690 3.591 1.00 . A A . 92 LYS CD 1 1 1 876 1 1 57 LYS CE C 8.921 -5.067 4.270 1.00 . A A . 92 LYS CE 1 1 1 877 1 1 57 LYS CG C 10.034 -3.517 2.641 1.00 . A A . 92 LYS CG 1 1 1 878 1 1 57 LYS H H 9.620 -2.989 0.018 1.00 . A A . 92 LYS H 1 1 1 879 1 1 57 LYS HA H 10.854 -1.113 1.554 1.00 . A A . 92 LYS HA 1 1 1 880 1 1 57 LYS HB2 H 11.598 -4.019 1.301 1.00 . A A . 92 LYS HB2 1 1 1 881 1 1 57 LYS HB3 H 12.097 -2.983 2.631 1.00 . A A . 92 LYS HB3 1 1 1 882 1 1 57 LYS HD2 H 10.590 -5.538 3.029 1.00 . A A . 92 LYS HD2 1 1 1 883 1 1 57 LYS HD3 H 10.952 -4.418 4.343 1.00 . A A . 92 LYS HD3 1 1 1 884 1 1 57 LYS HE2 H 8.532 -4.196 4.774 1.00 . A A . 92 LYS HE2 1 1 1 885 1 1 57 LYS HE3 H 8.219 -5.380 3.510 1.00 . A A . 92 LYS HE3 1 1 1 886 1 1 57 LYS HG2 H 9.714 -2.659 3.212 1.00 . A A . 92 LYS HG2 1 1 1 887 1 1 57 LYS HG3 H 9.275 -3.772 1.915 1.00 . A A . 92 LYS HG3 1 1 1 888 1 1 57 LYS HZ1 H 8.166 -6.448 5.644 1.00 . A A . 92 LYS HZ1 1 1 1 889 1 1 57 LYS HZ2 H 9.658 -5.853 6.065 1.00 . A A . 92 LYS HZ2 1 1 1 890 1 1 57 LYS HZ3 H 9.533 -7.007 4.835 1.00 . A A . 92 LYS HZ3 1 1 1 891 1 1 57 LYS N N 10.170 -2.181 -0.033 1.00 . A A . 92 LYS N 1 1 1 892 1 1 57 LYS NZ N 9.088 -6.166 5.254 1.00 . A A . 92 LYS NZ 1 1 1 893 1 1 57 LYS O O 13.180 -0.580 0.830 1.00 . A A . 92 LYS O 1 1 1 894 1 1 58 PRO C C 14.349 -0.367 -1.871 1.00 . A A . 93 PRO C 1 1 1 895 1 1 58 PRO CA C 14.372 -1.819 -1.362 1.00 . A A . 93 PRO CA 1 1 1 896 1 1 58 PRO CB C 14.538 -2.768 -2.541 1.00 . A A . 93 PRO CB 1 1 1 897 1 1 58 PRO CD C 12.539 -3.433 -1.419 1.00 . A A . 93 PRO CD 1 1 1 898 1 1 58 PRO CG C 13.686 -3.948 -2.221 1.00 . A A . 93 PRO CG 1 1 1 899 1 1 58 PRO HA H 15.203 -1.930 -0.682 1.00 . A A . 93 PRO HA 1 1 1 900 1 1 58 PRO HB2 H 14.210 -2.258 -3.433 1.00 . A A . 93 PRO HB2 1 1 1 901 1 1 58 PRO HB3 H 15.583 -3.024 -2.629 1.00 . A A . 93 PRO HB3 1 1 1 902 1 1 58 PRO HD2 H 11.720 -3.185 -2.081 1.00 . A A . 93 PRO HD2 1 1 1 903 1 1 58 PRO HD3 H 12.226 -4.175 -0.699 1.00 . A A . 93 PRO HD3 1 1 1 904 1 1 58 PRO HG2 H 13.325 -4.403 -3.131 1.00 . A A . 93 PRO HG2 1 1 1 905 1 1 58 PRO HG3 H 14.235 -4.672 -1.642 1.00 . A A . 93 PRO HG3 1 1 1 906 1 1 58 PRO N N 13.100 -2.228 -0.741 1.00 . A A . 93 PRO N 1 1 1 907 1 1 58 PRO O O 15.267 0.413 -1.587 1.00 . A A . 93 PRO O 1 1 1 908 1 1 59 HIS C C 12.989 2.394 -2.047 1.00 . A A . 94 HIS C 1 1 1 909 1 1 59 HIS CA C 13.203 1.372 -3.140 1.00 . A A . 94 HIS CA 1 1 1 910 1 1 59 HIS CB C 12.128 1.522 -4.241 1.00 . A A . 94 HIS CB 1 1 1 911 1 1 59 HIS CD2 C 13.783 1.002 -6.123 1.00 . A A . 94 HIS CD2 1 1 1 912 1 1 59 HIS CE1 C 12.358 0.251 -7.592 1.00 . A A . 94 HIS CE1 1 1 1 913 1 1 59 HIS CG C 12.549 1.029 -5.591 1.00 . A A . 94 HIS CG 1 1 1 914 1 1 59 HIS H H 12.601 -0.652 -2.806 1.00 . A A . 94 HIS H 1 1 1 915 1 1 59 HIS HA H 14.166 1.592 -3.578 1.00 . A A . 94 HIS HA 1 1 1 916 1 1 59 HIS HB2 H 11.241 0.977 -3.954 1.00 . A A . 94 HIS HB2 1 1 1 917 1 1 59 HIS HB3 H 11.882 2.567 -4.337 1.00 . A A . 94 HIS HB3 1 1 1 918 1 1 59 HIS HD2 H 14.679 1.336 -5.622 1.00 . A A . 94 HIS HD2 1 1 1 919 1 1 59 HIS HE1 H 11.944 -0.155 -8.505 1.00 . A A . 94 HIS HE1 1 1 1 920 1 1 59 HIS HE2 H 14.354 0.573 -8.092 1.00 . A A . 94 HIS HE2 1 1 1 921 1 1 59 HIS N N 13.308 0.004 -2.611 1.00 . A A . 94 HIS N 1 1 1 922 1 1 59 HIS ND1 N 11.640 0.559 -6.519 1.00 . A A . 94 HIS ND1 1 1 1 923 1 1 59 HIS NE2 N 13.664 0.507 -7.393 1.00 . A A . 94 HIS NE2 1 1 1 924 1 1 59 HIS O O 13.505 3.498 -2.125 1.00 . A A . 94 HIS O 1 1 1 925 1 1 60 PHE C C 13.251 3.288 0.787 1.00 . A A . 95 PHE C 1 1 1 926 1 1 60 PHE CA C 11.951 2.865 0.107 1.00 . A A . 95 PHE CA 1 1 1 927 1 1 60 PHE CB C 11.073 2.071 1.072 1.00 . A A . 95 PHE CB 1 1 1 928 1 1 60 PHE CD1 C 9.326 3.800 1.429 1.00 . A A . 95 PHE CD1 1 1 1 929 1 1 60 PHE CD2 C 10.187 2.684 3.327 1.00 . A A . 95 PHE CD2 1 1 1 930 1 1 60 PHE CE1 C 8.479 4.518 2.219 1.00 . A A . 95 PHE CE1 1 1 1 931 1 1 60 PHE CE2 C 9.325 3.399 4.139 1.00 . A A . 95 PHE CE2 1 1 1 932 1 1 60 PHE CG C 10.189 2.880 1.965 1.00 . A A . 95 PHE CG 1 1 1 933 1 1 60 PHE CZ C 8.469 4.321 3.581 1.00 . A A . 95 PHE CZ 1 1 1 934 1 1 60 PHE H H 11.917 1.083 -1.006 1.00 . A A . 95 PHE H 1 1 1 935 1 1 60 PHE HA H 11.416 3.745 -0.225 1.00 . A A . 95 PHE HA 1 1 1 936 1 1 60 PHE HB2 H 10.434 1.418 0.497 1.00 . A A . 95 PHE HB2 1 1 1 937 1 1 60 PHE HB3 H 11.715 1.468 1.696 1.00 . A A . 95 PHE HB3 1 1 1 938 1 1 60 PHE HD1 H 9.321 3.970 0.363 1.00 . A A . 95 PHE HD1 1 1 1 939 1 1 60 PHE HD2 H 10.867 1.962 3.750 1.00 . A A . 95 PHE HD2 1 1 1 940 1 1 60 PHE HE1 H 7.823 5.230 1.744 1.00 . A A . 95 PHE HE1 1 1 1 941 1 1 60 PHE HE2 H 9.329 3.241 5.207 1.00 . A A . 95 PHE HE2 1 1 1 942 1 1 60 PHE HZ H 7.793 4.885 4.206 1.00 . A A . 95 PHE HZ 1 1 1 943 1 1 60 PHE N N 12.268 2.002 -1.018 1.00 . A A . 95 PHE N 1 1 1 944 1 1 60 PHE O O 13.420 4.438 1.161 1.00 . A A . 95 PHE O 1 1 1 945 1 1 61 GLN C C 16.323 3.525 0.643 1.00 . A A . 96 GLN C 1 1 1 946 1 1 61 GLN CA C 15.485 2.587 1.492 1.00 . A A . 96 GLN CA 1 1 1 947 1 1 61 GLN CB C 16.235 1.290 1.672 1.00 . A A . 96 GLN CB 1 1 1 948 1 1 61 GLN CD C 16.358 -0.942 2.830 1.00 . A A . 96 GLN CD 1 1 1 949 1 1 61 GLN CG C 15.628 0.382 2.699 1.00 . A A . 96 GLN CG 1 1 1 950 1 1 61 GLN H H 13.944 1.435 0.605 1.00 . A A . 96 GLN H 1 1 1 951 1 1 61 GLN HA H 15.342 3.030 2.466 1.00 . A A . 96 GLN HA 1 1 1 952 1 1 61 GLN HB2 H 16.237 0.768 0.726 1.00 . A A . 96 GLN HB2 1 1 1 953 1 1 61 GLN HB3 H 17.251 1.511 1.961 1.00 . A A . 96 GLN HB3 1 1 1 954 1 1 61 GLN HE21 H 16.821 -0.948 0.907 1.00 . A A . 96 GLN HE21 1 1 1 955 1 1 61 GLN HE22 H 17.423 -2.269 1.840 1.00 . A A . 96 GLN HE22 1 1 1 956 1 1 61 GLN HG2 H 15.655 0.890 3.652 1.00 . A A . 96 GLN HG2 1 1 1 957 1 1 61 GLN HG3 H 14.600 0.212 2.411 1.00 . A A . 96 GLN HG3 1 1 1 958 1 1 61 GLN N N 14.165 2.340 0.916 1.00 . A A . 96 GLN N 1 1 1 959 1 1 61 GLN NE2 N 16.904 -1.431 1.753 1.00 . A A . 96 GLN NE2 1 1 1 960 1 1 61 GLN O O 16.881 4.477 1.142 1.00 . A A . 96 GLN O 1 1 1 961 1 1 61 GLN OE1 O 16.400 -1.534 3.905 1.00 . A A . 96 GLN OE1 1 1 1 962 1 1 62 GLN C C 16.686 5.435 -1.784 1.00 . A A . 97 GLN C 1 1 1 963 1 1 62 GLN CA C 17.237 4.027 -1.525 1.00 . A A . 97 GLN CA 1 1 1 964 1 1 62 GLN CB C 17.314 3.276 -2.845 1.00 . A A . 97 GLN CB 1 1 1 965 1 1 62 GLN CD C 17.832 1.126 -4.038 1.00 . A A . 97 GLN CD 1 1 1 966 1 1 62 GLN CG C 18.032 1.942 -2.778 1.00 . A A . 97 GLN CG 1 1 1 967 1 1 62 GLN H H 15.880 2.518 -1.034 1.00 . A A . 97 GLN H 1 1 1 968 1 1 62 GLN HA H 18.235 4.080 -1.117 1.00 . A A . 97 GLN HA 1 1 1 969 1 1 62 GLN HB2 H 16.305 3.086 -3.186 1.00 . A A . 97 GLN HB2 1 1 1 970 1 1 62 GLN HB3 H 17.810 3.902 -3.566 1.00 . A A . 97 GLN HB3 1 1 1 971 1 1 62 GLN HE21 H 16.263 0.293 -3.222 1.00 . A A . 97 GLN HE21 1 1 1 972 1 1 62 GLN HE22 H 16.649 -0.252 -4.826 1.00 . A A . 97 GLN HE22 1 1 1 973 1 1 62 GLN HG2 H 19.089 2.116 -2.641 1.00 . A A . 97 GLN HG2 1 1 1 974 1 1 62 GLN HG3 H 17.644 1.382 -1.941 1.00 . A A . 97 GLN HG3 1 1 1 975 1 1 62 GLN N N 16.389 3.261 -0.643 1.00 . A A . 97 GLN N 1 1 1 976 1 1 62 GLN NE2 N 16.811 0.309 -4.036 1.00 . A A . 97 GLN NE2 1 1 1 977 1 1 62 GLN O O 17.374 6.444 -1.573 1.00 . A A . 97 GLN O 1 1 1 978 1 1 62 GLN OE1 O 18.590 1.228 -4.996 1.00 . A A . 97 GLN OE1 1 1 1 979 1 1 63 LEU C C 14.336 7.587 -1.448 1.00 . A A . 98 LEU C 1 1 1 980 1 1 63 LEU CA C 14.808 6.715 -2.597 1.00 . A A . 98 LEU CA 1 1 1 981 1 1 63 LEU CB C 13.672 6.379 -3.525 1.00 . A A . 98 LEU CB 1 1 1 982 1 1 63 LEU CD1 C 13.004 5.009 -5.461 1.00 . A A . 98 LEU CD1 1 1 1 983 1 1 63 LEU CD2 C 14.475 6.930 -5.818 1.00 . A A . 98 LEU CD2 1 1 1 984 1 1 63 LEU CG C 14.107 5.809 -4.871 1.00 . A A . 98 LEU CG 1 1 1 985 1 1 63 LEU H H 14.918 4.657 -2.214 1.00 . A A . 98 LEU H 1 1 1 986 1 1 63 LEU HA H 15.534 7.257 -3.179 1.00 . A A . 98 LEU HA 1 1 1 987 1 1 63 LEU HB2 H 13.052 5.652 -3.021 1.00 . A A . 98 LEU HB2 1 1 1 988 1 1 63 LEU HB3 H 13.093 7.272 -3.703 1.00 . A A . 98 LEU HB3 1 1 1 989 1 1 63 LEU HD11 H 12.129 5.633 -5.565 1.00 . A A . 98 LEU HD11 1 1 1 990 1 1 63 LEU HD12 H 12.803 4.190 -4.790 1.00 . A A . 98 LEU HD12 1 1 1 991 1 1 63 LEU HD13 H 13.307 4.633 -6.427 1.00 . A A . 98 LEU HD13 1 1 1 992 1 1 63 LEU HD21 H 14.726 6.518 -6.784 1.00 . A A . 98 LEU HD21 1 1 1 993 1 1 63 LEU HD22 H 15.314 7.483 -5.420 1.00 . A A . 98 LEU HD22 1 1 1 994 1 1 63 LEU HD23 H 13.619 7.581 -5.916 1.00 . A A . 98 LEU HD23 1 1 1 995 1 1 63 LEU HG H 14.974 5.176 -4.746 1.00 . A A . 98 LEU HG 1 1 1 996 1 1 63 LEU N N 15.446 5.485 -2.189 1.00 . A A . 98 LEU N 1 1 1 997 1 1 63 LEU O O 14.539 8.806 -1.461 1.00 . A A . 98 LEU O 1 1 1 998 1 1 64 PHE C C 14.054 7.762 1.882 1.00 . A A . 99 PHE C 1 1 1 999 1 1 64 PHE CA C 13.185 7.781 0.632 1.00 . A A . 99 PHE CA 1 1 1 1000 1 1 64 PHE CB C 11.747 7.365 0.974 1.00 . A A . 99 PHE CB 1 1 1 1001 1 1 64 PHE CD1 C 10.898 8.751 -0.982 1.00 . A A . 99 PHE CD1 1 1 1 1002 1 1 64 PHE CD2 C 9.442 7.141 0.011 1.00 . A A . 99 PHE CD2 1 1 1 1003 1 1 64 PHE CE1 C 9.909 9.095 -1.880 1.00 . A A . 99 PHE CE1 1 1 1 1004 1 1 64 PHE CE2 C 8.457 7.491 -0.890 1.00 . A A . 99 PHE CE2 1 1 1 1005 1 1 64 PHE CG C 10.679 7.763 -0.020 1.00 . A A . 99 PHE CG 1 1 1 1006 1 1 64 PHE CZ C 8.695 8.469 -1.835 1.00 . A A . 99 PHE CZ 1 1 1 1007 1 1 64 PHE H H 13.617 6.015 -0.434 1.00 . A A . 99 PHE H 1 1 1 1008 1 1 64 PHE HA H 13.160 8.801 0.291 1.00 . A A . 99 PHE HA 1 1 1 1009 1 1 64 PHE HB2 H 11.738 6.289 0.883 1.00 . A A . 99 PHE HB2 1 1 1 1010 1 1 64 PHE HB3 H 11.467 7.649 1.974 1.00 . A A . 99 PHE HB3 1 1 1 1011 1 1 64 PHE HD1 H 11.850 9.255 -1.041 1.00 . A A . 99 PHE HD1 1 1 1 1012 1 1 64 PHE HD2 H 9.238 6.380 0.754 1.00 . A A . 99 PHE HD2 1 1 1 1013 1 1 64 PHE HE1 H 10.072 9.860 -2.624 1.00 . A A . 99 PHE HE1 1 1 1 1014 1 1 64 PHE HE2 H 7.497 6.998 -0.852 1.00 . A A . 99 PHE HE2 1 1 1 1015 1 1 64 PHE HZ H 7.936 8.752 -2.547 1.00 . A A . 99 PHE HZ 1 1 1 1016 1 1 64 PHE N N 13.731 6.989 -0.446 1.00 . A A . 99 PHE N 1 1 1 1017 1 1 64 PHE O O 13.980 8.661 2.710 1.00 . A A . 99 PHE O 1 1 1 1018 1 1 65 LYS C C 15.068 6.431 4.433 1.00 . A A . 100 LYS C 1 1 1 1019 1 1 65 LYS CA C 15.802 6.489 3.109 1.00 . A A . 100 LYS CA 1 1 1 1020 1 1 65 LYS CB C 16.926 7.529 3.116 1.00 . A A . 100 LYS CB 1 1 1 1021 1 1 65 LYS CD C 18.906 8.508 1.913 1.00 . A A . 100 LYS CD 1 1 1 1022 1 1 65 LYS CE C 19.854 8.343 0.734 1.00 . A A . 100 LYS CE 1 1 1 1023 1 1 65 LYS CG C 17.823 7.452 1.892 1.00 . A A . 100 LYS CG 1 1 1 1024 1 1 65 LYS H H 14.884 6.024 1.298 1.00 . A A . 100 LYS H 1 1 1 1025 1 1 65 LYS HA H 16.236 5.513 2.944 1.00 . A A . 100 LYS HA 1 1 1 1026 1 1 65 LYS HB2 H 16.501 8.519 3.179 1.00 . A A . 100 LYS HB2 1 1 1 1027 1 1 65 LYS HB3 H 17.527 7.335 3.989 1.00 . A A . 100 LYS HB3 1 1 1 1028 1 1 65 LYS HD2 H 18.449 9.486 1.864 1.00 . A A . 100 LYS HD2 1 1 1 1029 1 1 65 LYS HD3 H 19.466 8.412 2.831 1.00 . A A . 100 LYS HD3 1 1 1 1030 1 1 65 LYS HE2 H 20.609 9.112 0.779 1.00 . A A . 100 LYS HE2 1 1 1 1031 1 1 65 LYS HE3 H 20.331 7.377 0.812 1.00 . A A . 100 LYS HE3 1 1 1 1032 1 1 65 LYS HG2 H 18.288 6.478 1.861 1.00 . A A . 100 LYS HG2 1 1 1 1033 1 1 65 LYS HG3 H 17.216 7.585 1.009 1.00 . A A . 100 LYS HG3 1 1 1 1034 1 1 65 LYS HZ1 H 18.451 7.676 -0.698 1.00 . A A . 100 LYS HZ1 1 1 1 1035 1 1 65 LYS HZ2 H 19.847 8.326 -1.343 1.00 . A A . 100 LYS HZ2 1 1 1 1036 1 1 65 LYS HZ3 H 18.689 9.350 -0.686 1.00 . A A . 100 LYS HZ3 1 1 1 1037 1 1 65 LYS N N 14.880 6.711 1.994 1.00 . A A . 100 LYS N 1 1 1 1038 1 1 65 LYS NZ N 19.157 8.431 -0.571 1.00 . A A . 100 LYS NZ 1 1 1 1039 1 1 65 LYS O O 15.577 6.844 5.475 1.00 . A A . 100 LYS O 1 1 1 1040 1 1 66 SER C C 13.072 4.500 6.265 1.00 . A A . 101 SER C 1 1 1 1041 1 1 66 SER CA C 13.021 5.839 5.505 1.00 . A A . 101 SER CA 1 1 1 1042 1 1 66 SER CB C 11.634 6.207 5.047 1.00 . A A . 101 SER CB 1 1 1 1043 1 1 66 SER H H 13.555 5.527 3.533 1.00 . A A . 101 SER H 1 1 1 1044 1 1 66 SER HA H 13.349 6.613 6.182 1.00 . A A . 101 SER HA 1 1 1 1045 1 1 66 SER HB2 H 10.903 5.835 5.750 1.00 . A A . 101 SER HB2 1 1 1 1046 1 1 66 SER HB3 H 11.558 7.280 4.965 1.00 . A A . 101 SER HB3 1 1 1 1047 1 1 66 SER HG H 10.685 6.143 3.360 1.00 . A A . 101 SER HG 1 1 1 1048 1 1 66 SER N N 13.882 5.893 4.381 1.00 . A A . 101 SER N 1 1 1 1049 1 1 66 SER O O 13.682 4.427 7.328 1.00 . A A . 101 SER O 1 1 1 1050 1 1 66 SER OG O 11.393 5.633 3.767 1.00 . A A . 101 SER OG 1 1 1 1051 1 1 67 LYS C C 13.065 1.022 5.712 1.00 . A A . 102 LYS C 1 1 1 1052 1 1 67 LYS CA C 12.428 2.187 6.481 1.00 . A A . 102 LYS CA 1 1 1 1053 1 1 67 LYS CB C 10.993 1.847 6.935 1.00 . A A . 102 LYS CB 1 1 1 1054 1 1 67 LYS CD C 11.631 0.934 9.194 1.00 . A A . 102 LYS CD 1 1 1 1055 1 1 67 LYS CE C 11.580 -0.260 10.123 1.00 . A A . 102 LYS CE 1 1 1 1056 1 1 67 LYS CG C 10.902 0.654 7.886 1.00 . A A . 102 LYS CG 1 1 1 1057 1 1 67 LYS H H 12.065 3.528 4.843 1.00 . A A . 102 LYS H 1 1 1 1058 1 1 67 LYS HA H 13.031 2.353 7.361 1.00 . A A . 102 LYS HA 1 1 1 1059 1 1 67 LYS HB2 H 10.573 2.707 7.434 1.00 . A A . 102 LYS HB2 1 1 1 1060 1 1 67 LYS HB3 H 10.401 1.624 6.060 1.00 . A A . 102 LYS HB3 1 1 1 1061 1 1 67 LYS HD2 H 12.666 1.159 8.983 1.00 . A A . 102 LYS HD2 1 1 1 1062 1 1 67 LYS HD3 H 11.166 1.779 9.679 1.00 . A A . 102 LYS HD3 1 1 1 1063 1 1 67 LYS HE2 H 10.547 -0.532 10.271 1.00 . A A . 102 LYS HE2 1 1 1 1064 1 1 67 LYS HE3 H 12.101 -1.081 9.654 1.00 . A A . 102 LYS HE3 1 1 1 1065 1 1 67 LYS HG2 H 9.863 0.454 8.103 1.00 . A A . 102 LYS HG2 1 1 1 1066 1 1 67 LYS HG3 H 11.348 -0.208 7.412 1.00 . A A . 102 LYS HG3 1 1 1 1067 1 1 67 LYS HZ1 H 11.734 0.822 11.905 1.00 . A A . 102 LYS HZ1 1 1 1 1068 1 1 67 LYS HZ2 H 13.211 0.271 11.316 1.00 . A A . 102 LYS HZ2 1 1 1 1069 1 1 67 LYS HZ3 H 12.142 -0.809 12.043 1.00 . A A . 102 LYS HZ3 1 1 1 1070 1 1 67 LYS N N 12.469 3.444 5.733 1.00 . A A . 102 LYS N 1 1 1 1071 1 1 67 LYS NZ N 12.207 0.027 11.430 1.00 . A A . 102 LYS NZ 1 1 1 1072 1 1 67 LYS O O 14.251 0.774 5.867 1.00 . A A . 102 LYS O 1 1 1 1073 1 1 68 GLY C C 12.974 -1.996 5.075 1.00 . A A . 103 GLY C 1 1 1 1074 1 1 68 GLY CA C 12.812 -0.798 4.175 1.00 . A A . 103 GLY CA 1 1 1 1075 1 1 68 GLY H H 11.378 0.594 4.671 1.00 . A A . 103 GLY H 1 1 1 1076 1 1 68 GLY HA2 H 12.174 -1.051 3.344 1.00 . A A . 103 GLY HA2 1 1 1 1077 1 1 68 GLY HA3 H 13.792 -0.543 3.811 1.00 . A A . 103 GLY HA3 1 1 1 1078 1 1 68 GLY N N 12.300 0.342 4.863 1.00 . A A . 103 GLY N 1 1 1 1079 1 1 68 GLY O O 11.987 -2.562 5.538 1.00 . A A . 103 GLY O 1 1 1 1080 1 1 69 ASN C C 14.546 -4.798 5.381 1.00 . A A . 104 ASN C 1 1 1 1081 1 1 69 ASN CA C 14.660 -3.471 6.147 1.00 . A A . 104 ASN CA 1 1 1 1082 1 1 69 ASN CB C 13.942 -3.540 7.514 1.00 . A A . 104 ASN CB 1 1 1 1083 1 1 69 ASN CG C 14.453 -4.653 8.414 1.00 . A A . 104 ASN CG 1 1 1 1084 1 1 69 ASN H H 14.939 -1.789 4.928 1.00 . A A . 104 ASN H 1 1 1 1085 1 1 69 ASN HA H 15.715 -3.313 6.318 1.00 . A A . 104 ASN HA 1 1 1 1086 1 1 69 ASN HB2 H 14.077 -2.601 8.032 1.00 . A A . 104 ASN HB2 1 1 1 1087 1 1 69 ASN HB3 H 12.888 -3.696 7.340 1.00 . A A . 104 ASN HB3 1 1 1 1088 1 1 69 ASN HD21 H 16.364 -4.222 8.007 1.00 . A A . 104 ASN HD21 1 1 1 1089 1 1 69 ASN HD22 H 16.079 -5.552 9.069 1.00 . A A . 104 ASN HD22 1 1 1 1090 1 1 69 ASN N N 14.227 -2.337 5.329 1.00 . A A . 104 ASN N 1 1 1 1091 1 1 69 ASN ND2 N 15.750 -4.820 8.502 1.00 . A A . 104 ASN ND2 1 1 1 1092 1 1 69 ASN O O 13.555 -5.521 5.484 1.00 . A A . 104 ASN O 1 1 1 1093 1 1 69 ASN OD1 O 13.666 -5.294 9.115 1.00 . A A . 104 ASN OD1 1 1 1 1094 1 1 70 TYR C C 17.038 -6.895 4.235 1.00 . A A . 105 TYR C 1 1 1 1095 1 1 70 TYR CA C 15.697 -6.325 3.847 1.00 . A A . 105 TYR CA 1 1 1 1096 1 1 70 TYR CB C 15.630 -6.117 2.331 1.00 . A A . 105 TYR CB 1 1 1 1097 1 1 70 TYR CD1 C 13.219 -6.061 1.651 1.00 . A A . 105 TYR CD1 1 1 1 1098 1 1 70 TYR CD2 C 14.481 -7.994 1.105 1.00 . A A . 105 TYR CD2 1 1 1 1099 1 1 70 TYR CE1 C 12.106 -6.616 1.060 1.00 . A A . 105 TYR CE1 1 1 1 1100 1 1 70 TYR CE2 C 13.370 -8.557 0.511 1.00 . A A . 105 TYR CE2 1 1 1 1101 1 1 70 TYR CG C 14.419 -6.734 1.685 1.00 . A A . 105 TYR CG 1 1 1 1102 1 1 70 TYR CZ C 12.185 -7.860 0.494 1.00 . A A . 105 TYR CZ 1 1 1 1103 1 1 70 TYR H H 16.229 -4.370 4.415 1.00 . A A . 105 TYR H 1 1 1 1104 1 1 70 TYR HA H 14.916 -6.999 4.171 1.00 . A A . 105 TYR HA 1 1 1 1105 1 1 70 TYR HB2 H 15.619 -5.059 2.118 1.00 . A A . 105 TYR HB2 1 1 1 1106 1 1 70 TYR HB3 H 16.508 -6.557 1.883 1.00 . A A . 105 TYR HB3 1 1 1 1107 1 1 70 TYR HD1 H 13.164 -5.081 2.100 1.00 . A A . 105 TYR HD1 1 1 1 1108 1 1 70 TYR HD2 H 15.414 -8.538 1.122 1.00 . A A . 105 TYR HD2 1 1 1 1109 1 1 70 TYR HE1 H 11.170 -6.078 1.037 1.00 . A A . 105 TYR HE1 1 1 1 1110 1 1 70 TYR HE2 H 13.434 -9.538 0.064 1.00 . A A . 105 TYR HE2 1 1 1 1111 1 1 70 TYR HH H 11.027 -9.345 0.131 1.00 . A A . 105 TYR HH 1 1 1 1112 1 1 70 TYR N N 15.547 -5.060 4.563 1.00 . A A . 105 TYR N 1 1 1 1113 1 1 70 TYR O O 18.003 -6.807 3.477 1.00 . A A . 105 TYR O 1 1 1 1114 1 1 70 TYR OH O 11.070 -8.408 -0.090 1.00 . A A . 105 TYR OH 1 1 1 1115 1 1 71 ASP C C 19.308 -6.719 6.255 1.00 . A A . 106 ASP C 1 1 1 1116 1 1 71 ASP CA C 18.328 -7.877 6.151 1.00 . A A . 106 ASP CA 1 1 1 1117 1 1 71 ASP CB C 18.981 -9.216 5.629 1.00 . A A . 106 ASP CB 1 1 1 1118 1 1 71 ASP CG C 19.598 -9.201 4.233 1.00 . A A . 106 ASP CG 1 1 1 1119 1 1 71 ASP H H 16.234 -7.527 5.943 1.00 . A A . 106 ASP H 1 1 1 1120 1 1 71 ASP HA H 17.993 -8.014 7.171 1.00 . A A . 106 ASP HA 1 1 1 1121 1 1 71 ASP HB2 H 19.765 -9.495 6.315 1.00 . A A . 106 ASP HB2 1 1 1 1122 1 1 71 ASP HB3 H 18.226 -9.987 5.660 1.00 . A A . 106 ASP HB3 1 1 1 1123 1 1 71 ASP N N 17.086 -7.431 5.463 1.00 . A A . 106 ASP N 1 1 1 1124 1 1 71 ASP O O 20.535 -6.869 6.269 1.00 . A A . 106 ASP O 1 1 1 1125 1 1 71 ASP OD1 O 20.778 -8.807 4.081 1.00 . A A . 106 ASP OD1 1 1 1 1126 1 1 71 ASP OD2 O 18.950 -9.669 3.280 1.00 . A A . 106 ASP OD2 1 1 1 1127 1 1 72 GLU C C 18.778 -3.601 7.654 1.00 . A A . 107 GLU C 1 1 1 1128 1 1 72 GLU CA C 19.382 -4.301 6.471 1.00 . A A . 107 GLU CA 1 1 1 1129 1 1 72 GLU CB C 19.172 -3.452 5.212 1.00 . A A . 107 GLU CB 1 1 1 1130 1 1 72 GLU CD C 19.497 -3.181 2.750 1.00 . A A . 107 GLU CD 1 1 1 1131 1 1 72 GLU CG C 19.759 -4.038 3.950 1.00 . A A . 107 GLU CG 1 1 1 1132 1 1 72 GLU H H 17.737 -5.550 6.360 1.00 . A A . 107 GLU H 1 1 1 1133 1 1 72 GLU HA H 20.436 -4.468 6.631 1.00 . A A . 107 GLU HA 1 1 1 1134 1 1 72 GLU HB2 H 18.111 -3.323 5.056 1.00 . A A . 107 GLU HB2 1 1 1 1135 1 1 72 GLU HB3 H 19.617 -2.482 5.373 1.00 . A A . 107 GLU HB3 1 1 1 1136 1 1 72 GLU HG2 H 20.828 -4.122 4.079 1.00 . A A . 107 GLU HG2 1 1 1 1137 1 1 72 GLU HG3 H 19.334 -5.017 3.784 1.00 . A A . 107 GLU HG3 1 1 1 1138 1 1 72 GLU N N 18.716 -5.558 6.351 1.00 . A A . 107 GLU N 1 1 1 1139 1 1 72 GLU O O 17.649 -3.085 7.526 1.00 . A A . 107 GLU O 1 1 1 1140 1 1 72 GLU OXT O 19.375 -3.608 8.720 1.00 . A A . 107 GLU OXT 1 1 1 1141 1 1 72 GLU OE1 O 20.144 -2.135 2.613 1.00 . A A . 107 GLU OE1 1 1 1 1142 1 1 72 GLU OE2 O 18.638 -3.543 1.904 1.00 . A A . 107 GLU OE2 1 1 1 1143 2 2 1 ZN ZN ZN -7.239 -0.208 -5.571 1.00 . B A . 201 ZN ZN 1 1 1 1144 3 2 1 ZN ZN ZN 10.151 -0.624 -5.921 1.00 . C A . 202 ZN ZN 1 1 2 1145 1 1 1 ARG C C -26.969 -0.786 5.792 1.00 . A A . 36 ARG C 1 1 2 1146 1 1 1 ARG CA C -28.283 -1.522 5.918 1.00 . A A . 36 ARG CA 1 1 2 1147 1 1 1 ARG CB C -28.854 -1.301 7.316 1.00 . A A . 36 ARG CB 1 1 2 1148 1 1 1 ARG CD C -29.580 0.310 9.088 1.00 . A A . 36 ARG CD 1 1 2 1149 1 1 1 ARG CG C -29.111 0.156 7.659 1.00 . A A . 36 ARG CG 1 1 2 1150 1 1 1 ARG CZ C -29.644 2.218 10.686 1.00 . A A . 36 ARG CZ 1 1 2 1151 1 1 1 ARG H1 H -28.965 -3.466 5.760 1.00 . A A . 36 ARG H1 1 1 2 1152 1 1 1 ARG H2 H -27.351 -3.320 6.306 1.00 . A A . 36 ARG H2 1 1 2 1153 1 1 1 ARG H3 H -27.715 -3.065 4.703 1.00 . A A . 36 ARG H3 1 1 2 1154 1 1 1 ARG HA H -28.977 -1.138 5.185 1.00 . A A . 36 ARG HA 1 1 2 1155 1 1 1 ARG HB2 H -29.791 -1.831 7.391 1.00 . A A . 36 ARG HB2 1 1 2 1156 1 1 1 ARG HB3 H -28.162 -1.702 8.040 1.00 . A A . 36 ARG HB3 1 1 2 1157 1 1 1 ARG HD2 H -30.503 -0.237 9.210 1.00 . A A . 36 ARG HD2 1 1 2 1158 1 1 1 ARG HD3 H -28.829 -0.109 9.740 1.00 . A A . 36 ARG HD3 1 1 2 1159 1 1 1 ARG HE H -30.094 2.291 8.708 1.00 . A A . 36 ARG HE 1 1 2 1160 1 1 1 ARG HG2 H -28.196 0.715 7.528 1.00 . A A . 36 ARG HG2 1 1 2 1161 1 1 1 ARG HG3 H -29.870 0.543 6.995 1.00 . A A . 36 ARG HG3 1 1 2 1162 1 1 1 ARG HH11 H -28.906 0.500 11.521 1.00 . A A . 36 ARG HH11 1 1 2 1163 1 1 1 ARG HH12 H -29.025 1.802 12.601 1.00 . A A . 36 ARG HH12 1 1 2 1164 1 1 1 ARG HH21 H -30.246 4.109 10.200 1.00 . A A . 36 ARG HH21 1 1 2 1165 1 1 1 ARG HH22 H -29.831 3.896 11.831 1.00 . A A . 36 ARG HH22 1 1 2 1166 1 1 1 ARG N N -28.078 -2.936 5.669 1.00 . A A . 36 ARG N 1 1 2 1167 1 1 1 ARG NE N -29.798 1.713 9.451 1.00 . A A . 36 ARG NE 1 1 2 1168 1 1 1 ARG NH1 N -29.164 1.458 11.670 1.00 . A A . 36 ARG NH1 1 1 2 1169 1 1 1 ARG NH2 N -29.921 3.490 10.920 1.00 . A A . 36 ARG NH2 1 1 2 1170 1 1 1 ARG O O -26.006 -1.124 6.484 1.00 . A A . 36 ARG O 1 1 2 1171 1 1 2 ALA C C -24.548 0.413 4.211 1.00 . A A . 37 ALA C 1 1 2 1172 1 1 2 ALA CA C -25.831 1.102 4.664 1.00 . A A . 37 ALA CA 1 1 2 1173 1 1 2 ALA CB C -25.595 2.006 5.874 1.00 . A A . 37 ALA CB 1 1 2 1174 1 1 2 ALA H H -27.732 0.311 4.314 1.00 . A A . 37 ALA H 1 1 2 1175 1 1 2 ALA HA H -26.140 1.739 3.847 1.00 . A A . 37 ALA HA 1 1 2 1176 1 1 2 ALA HB1 H -25.242 1.413 6.704 1.00 . A A . 37 ALA HB1 1 1 2 1177 1 1 2 ALA HB2 H -26.522 2.485 6.152 1.00 . A A . 37 ALA HB2 1 1 2 1178 1 1 2 ALA HB3 H -24.859 2.757 5.628 1.00 . A A . 37 ALA HB3 1 1 2 1179 1 1 2 ALA N N -26.945 0.189 4.888 1.00 . A A . 37 ALA N 1 1 2 1180 1 1 2 ALA O O -23.889 -0.322 4.970 1.00 . A A . 37 ALA O 1 1 2 1181 1 1 3 GLN C C -21.824 0.857 3.065 1.00 . A A . 38 GLN C 1 1 2 1182 1 1 3 GLN CA C -22.985 0.136 2.401 1.00 . A A . 38 GLN CA 1 1 2 1183 1 1 3 GLN CB C -22.949 0.349 0.872 1.00 . A A . 38 GLN CB 1 1 2 1184 1 1 3 GLN CD C -25.413 -0.160 0.329 1.00 . A A . 38 GLN CD 1 1 2 1185 1 1 3 GLN CG C -23.952 -0.487 0.051 1.00 . A A . 38 GLN CG 1 1 2 1186 1 1 3 GLN H H -24.824 1.134 2.388 1.00 . A A . 38 GLN H 1 1 2 1187 1 1 3 GLN HA H -22.920 -0.918 2.620 1.00 . A A . 38 GLN HA 1 1 2 1188 1 1 3 GLN HB2 H -23.157 1.389 0.674 1.00 . A A . 38 GLN HB2 1 1 2 1189 1 1 3 GLN HB3 H -21.953 0.129 0.518 1.00 . A A . 38 GLN HB3 1 1 2 1190 1 1 3 GLN HE21 H -25.943 -2.000 -0.138 1.00 . A A . 38 GLN HE21 1 1 2 1191 1 1 3 GLN HE22 H -27.219 -0.938 0.327 1.00 . A A . 38 GLN HE22 1 1 2 1192 1 1 3 GLN HG2 H -23.768 -0.319 -1.000 1.00 . A A . 38 GLN HG2 1 1 2 1193 1 1 3 GLN HG3 H -23.783 -1.531 0.270 1.00 . A A . 38 GLN HG3 1 1 2 1194 1 1 3 GLN N N -24.214 0.628 2.969 1.00 . A A . 38 GLN N 1 1 2 1195 1 1 3 GLN NE2 N -26.269 -1.121 0.159 1.00 . A A . 38 GLN NE2 1 1 2 1196 1 1 3 GLN O O -21.866 2.090 3.252 1.00 . A A . 38 GLN O 1 1 2 1197 1 1 3 GLN OE1 O -25.760 0.972 0.687 1.00 . A A . 38 GLN OE1 1 1 2 1198 1 1 4 VAL C C -18.810 1.512 3.238 1.00 . A A . 39 VAL C 1 1 2 1199 1 1 4 VAL CA C -19.688 0.673 4.157 1.00 . A A . 39 VAL CA 1 1 2 1200 1 1 4 VAL CB C -18.843 -0.397 4.924 1.00 . A A . 39 VAL CB 1 1 2 1201 1 1 4 VAL CG1 C -19.668 -1.027 6.037 1.00 . A A . 39 VAL CG1 1 1 2 1202 1 1 4 VAL CG2 C -18.314 -1.483 3.988 1.00 . A A . 39 VAL CG2 1 1 2 1203 1 1 4 VAL H H -20.847 -0.850 3.257 1.00 . A A . 39 VAL H 1 1 2 1204 1 1 4 VAL HA H -20.105 1.352 4.886 1.00 . A A . 39 VAL HA 1 1 2 1205 1 1 4 VAL HB H -18.004 0.108 5.380 1.00 . A A . 39 VAL HB 1 1 2 1206 1 1 4 VAL HG11 H -20.536 -1.507 5.611 1.00 . A A . 39 VAL HG11 1 1 2 1207 1 1 4 VAL HG12 H -19.986 -0.261 6.729 1.00 . A A . 39 VAL HG12 1 1 2 1208 1 1 4 VAL HG13 H -19.072 -1.759 6.560 1.00 . A A . 39 VAL HG13 1 1 2 1209 1 1 4 VAL HG21 H -17.698 -1.031 3.224 1.00 . A A . 39 VAL HG21 1 1 2 1210 1 1 4 VAL HG22 H -19.142 -1.997 3.525 1.00 . A A . 39 VAL HG22 1 1 2 1211 1 1 4 VAL HG23 H -17.723 -2.189 4.554 1.00 . A A . 39 VAL HG23 1 1 2 1212 1 1 4 VAL N N -20.824 0.110 3.457 1.00 . A A . 39 VAL N 1 1 2 1213 1 1 4 VAL O O -18.399 1.068 2.157 1.00 . A A . 39 VAL O 1 1 2 1214 1 1 5 LYS C C -16.289 3.439 3.284 1.00 . A A . 40 LYS C 1 1 2 1215 1 1 5 LYS CA C -17.728 3.614 2.893 1.00 . A A . 40 LYS CA 1 1 2 1216 1 1 5 LYS CB C -18.168 5.097 3.007 1.00 . A A . 40 LYS CB 1 1 2 1217 1 1 5 LYS CD C -17.618 7.517 2.422 1.00 . A A . 40 LYS CD 1 1 2 1218 1 1 5 LYS CE C -16.442 8.470 2.170 1.00 . A A . 40 LYS CE 1 1 2 1219 1 1 5 LYS CG C -17.170 6.074 2.356 1.00 . A A . 40 LYS CG 1 1 2 1220 1 1 5 LYS H H -18.865 2.995 4.539 1.00 . A A . 40 LYS H 1 1 2 1221 1 1 5 LYS HA H -17.819 3.301 1.863 1.00 . A A . 40 LYS HA 1 1 2 1222 1 1 5 LYS HB2 H -19.129 5.216 2.529 1.00 . A A . 40 LYS HB2 1 1 2 1223 1 1 5 LYS HB3 H -18.257 5.352 4.052 1.00 . A A . 40 LYS HB3 1 1 2 1224 1 1 5 LYS HD2 H -18.376 7.686 1.670 1.00 . A A . 40 LYS HD2 1 1 2 1225 1 1 5 LYS HD3 H -18.028 7.716 3.402 1.00 . A A . 40 LYS HD3 1 1 2 1226 1 1 5 LYS HE2 H -16.833 9.472 2.083 1.00 . A A . 40 LYS HE2 1 1 2 1227 1 1 5 LYS HE3 H -15.774 8.422 3.017 1.00 . A A . 40 LYS HE3 1 1 2 1228 1 1 5 LYS HG2 H -16.222 5.990 2.866 1.00 . A A . 40 LYS HG2 1 1 2 1229 1 1 5 LYS HG3 H -17.037 5.788 1.323 1.00 . A A . 40 LYS HG3 1 1 2 1230 1 1 5 LYS HZ1 H -16.306 8.140 0.097 1.00 . A A . 40 LYS HZ1 1 1 2 1231 1 1 5 LYS HZ2 H -15.155 7.267 0.995 1.00 . A A . 40 LYS HZ2 1 1 2 1232 1 1 5 LYS HZ3 H -14.982 8.911 0.771 1.00 . A A . 40 LYS HZ3 1 1 2 1233 1 1 5 LYS N N -18.543 2.719 3.657 1.00 . A A . 40 LYS N 1 1 2 1234 1 1 5 LYS NZ N -15.686 8.162 0.932 1.00 . A A . 40 LYS NZ 1 1 2 1235 1 1 5 LYS O O -15.733 4.182 4.119 1.00 . A A . 40 LYS O 1 1 2 1236 1 1 6 GLU C C -13.733 2.792 1.725 1.00 . A A . 41 GLU C 1 1 2 1237 1 1 6 GLU CA C -14.337 2.218 2.933 1.00 . A A . 41 GLU CA 1 1 2 1238 1 1 6 GLU CB C -14.022 0.753 2.968 1.00 . A A . 41 GLU CB 1 1 2 1239 1 1 6 GLU CD C -14.385 0.379 5.439 1.00 . A A . 41 GLU CD 1 1 2 1240 1 1 6 GLU CG C -14.752 -0.013 4.025 1.00 . A A . 41 GLU CG 1 1 2 1241 1 1 6 GLU H H -16.249 1.785 2.246 1.00 . A A . 41 GLU H 1 1 2 1242 1 1 6 GLU HA H -13.982 2.705 3.829 1.00 . A A . 41 GLU HA 1 1 2 1243 1 1 6 GLU HB2 H -14.274 0.326 2.009 1.00 . A A . 41 GLU HB2 1 1 2 1244 1 1 6 GLU HB3 H -12.962 0.632 3.133 1.00 . A A . 41 GLU HB3 1 1 2 1245 1 1 6 GLU HG2 H -15.817 0.101 3.881 1.00 . A A . 41 GLU HG2 1 1 2 1246 1 1 6 GLU HG3 H -14.454 -1.029 3.844 1.00 . A A . 41 GLU HG3 1 1 2 1247 1 1 6 GLU N N -15.719 2.422 2.771 1.00 . A A . 41 GLU N 1 1 2 1248 1 1 6 GLU O O -14.133 2.454 0.614 1.00 . A A . 41 GLU O 1 1 2 1249 1 1 6 GLU OE1 O -13.419 -0.186 5.996 1.00 . A A . 41 GLU OE1 1 1 2 1250 1 1 6 GLU OE2 O -15.065 1.225 6.029 1.00 . A A . 41 GLU OE2 1 1 2 1251 1 1 7 THR C C -10.759 3.910 0.754 1.00 . A A . 42 THR C 1 1 2 1252 1 1 7 THR CA C -12.233 4.208 0.744 1.00 . A A . 42 THR CA 1 1 2 1253 1 1 7 THR CB C -12.479 5.720 0.684 1.00 . A A . 42 THR CB 1 1 2 1254 1 1 7 THR CG2 C -12.715 6.117 -0.770 1.00 . A A . 42 THR CG2 1 1 2 1255 1 1 7 THR H H -12.478 3.781 2.792 1.00 . A A . 42 THR H 1 1 2 1256 1 1 7 THR HA H -12.720 3.736 -0.100 1.00 . A A . 42 THR HA 1 1 2 1257 1 1 7 THR HB H -11.588 6.215 1.038 1.00 . A A . 42 THR HB 1 1 2 1258 1 1 7 THR HG1 H -13.553 5.641 2.298 1.00 . A A . 42 THR HG1 1 1 2 1259 1 1 7 THR HG21 H -11.853 5.851 -1.364 1.00 . A A . 42 THR HG21 1 1 2 1260 1 1 7 THR HG22 H -12.891 7.179 -0.842 1.00 . A A . 42 THR HG22 1 1 2 1261 1 1 7 THR HG23 H -13.581 5.580 -1.134 1.00 . A A . 42 THR HG23 1 1 2 1262 1 1 7 THR N N -12.806 3.611 1.883 1.00 . A A . 42 THR N 1 1 2 1263 1 1 7 THR O O -10.110 3.949 1.802 1.00 . A A . 42 THR O 1 1 2 1264 1 1 7 THR OG1 O -13.685 6.045 1.430 1.00 . A A . 42 THR OG1 1 1 2 1265 1 1 8 CYS C C -7.944 4.316 -0.541 1.00 . A A . 43 CYS C 1 1 2 1266 1 1 8 CYS CA C -8.924 3.170 -0.559 1.00 . A A . 43 CYS CA 1 1 2 1267 1 1 8 CYS CB C -8.900 2.366 -1.846 1.00 . A A . 43 CYS CB 1 1 2 1268 1 1 8 CYS H H -10.800 3.798 -1.185 1.00 . A A . 43 CYS H 1 1 2 1269 1 1 8 CYS HA H -8.733 2.486 0.248 1.00 . A A . 43 CYS HA 1 1 2 1270 1 1 8 CYS HB2 H -9.163 1.350 -1.587 1.00 . A A . 43 CYS HB2 1 1 2 1271 1 1 8 CYS HB3 H -9.689 2.741 -2.470 1.00 . A A . 43 CYS HB3 1 1 2 1272 1 1 8 CYS N N -10.252 3.632 -0.388 1.00 . A A . 43 CYS N 1 1 2 1273 1 1 8 CYS O O -8.290 5.419 -0.877 1.00 . A A . 43 CYS O 1 1 2 1274 1 1 8 CYS SG S -7.368 2.241 -2.760 1.00 . A A . 43 CYS SG 1 1 2 1275 1 1 9 ALA C C -4.672 4.860 -1.123 1.00 . A A . 44 ALA C 1 1 2 1276 1 1 9 ALA CA C -5.717 5.076 -0.039 1.00 . A A . 44 ALA CA 1 1 2 1277 1 1 9 ALA CB C -5.063 5.092 1.315 1.00 . A A . 44 ALA CB 1 1 2 1278 1 1 9 ALA H H -6.580 3.172 0.298 1.00 . A A . 44 ALA H 1 1 2 1279 1 1 9 ALA HA H -6.188 6.036 -0.183 1.00 . A A . 44 ALA HA 1 1 2 1280 1 1 9 ALA HB1 H -5.832 5.260 2.052 1.00 . A A . 44 ALA HB1 1 1 2 1281 1 1 9 ALA HB2 H -4.357 5.907 1.326 1.00 . A A . 44 ALA HB2 1 1 2 1282 1 1 9 ALA HB3 H -4.564 4.152 1.494 1.00 . A A . 44 ALA HB3 1 1 2 1283 1 1 9 ALA N N -6.749 4.061 -0.077 1.00 . A A . 44 ALA N 1 1 2 1284 1 1 9 ALA O O -3.849 5.718 -1.380 1.00 . A A . 44 ALA O 1 1 2 1285 1 1 10 ALA C C -4.136 3.826 -4.180 1.00 . A A . 45 ALA C 1 1 2 1286 1 1 10 ALA CA C -3.706 3.412 -2.775 1.00 . A A . 45 ALA CA 1 1 2 1287 1 1 10 ALA CB C -3.338 1.950 -2.707 1.00 . A A . 45 ALA CB 1 1 2 1288 1 1 10 ALA H H -5.445 3.083 -1.613 1.00 . A A . 45 ALA H 1 1 2 1289 1 1 10 ALA HA H -2.831 3.991 -2.520 1.00 . A A . 45 ALA HA 1 1 2 1290 1 1 10 ALA HB1 H -2.489 1.768 -3.349 1.00 . A A . 45 ALA HB1 1 1 2 1291 1 1 10 ALA HB2 H -4.176 1.345 -3.020 1.00 . A A . 45 ALA HB2 1 1 2 1292 1 1 10 ALA HB3 H -3.071 1.714 -1.683 1.00 . A A . 45 ALA HB3 1 1 2 1293 1 1 10 ALA N N -4.720 3.721 -1.783 1.00 . A A . 45 ALA N 1 1 2 1294 1 1 10 ALA O O -3.309 4.139 -5.023 1.00 . A A . 45 ALA O 1 1 2 1295 1 1 11 CYS C C -7.169 5.215 -5.407 1.00 . A A . 46 CYS C 1 1 2 1296 1 1 11 CYS CA C -5.991 4.275 -5.675 1.00 . A A . 46 CYS CA 1 1 2 1297 1 1 11 CYS CB C -6.358 3.079 -6.581 1.00 . A A . 46 CYS CB 1 1 2 1298 1 1 11 CYS H H -6.017 3.477 -3.711 1.00 . A A . 46 CYS H 1 1 2 1299 1 1 11 CYS HA H -5.218 4.861 -6.151 1.00 . A A . 46 CYS HA 1 1 2 1300 1 1 11 CYS HB2 H -5.919 2.972 -7.558 1.00 . A A . 46 CYS HB2 1 1 2 1301 1 1 11 CYS HB3 H -5.671 2.390 -6.105 1.00 . A A . 46 CYS HB3 1 1 2 1302 1 1 11 CYS N N -5.424 3.818 -4.412 1.00 . A A . 46 CYS N 1 1 2 1303 1 1 11 CYS O O -7.782 5.770 -6.318 1.00 . A A . 46 CYS O 1 1 2 1304 1 1 11 CYS SG S -7.950 2.271 -6.295 1.00 . A A . 46 CYS SG 1 1 2 1305 1 1 12 GLN C C -9.858 6.079 -4.166 1.00 . A A . 47 GLN C 1 1 2 1306 1 1 12 GLN CA C -8.468 6.259 -3.576 1.00 . A A . 47 GLN CA 1 1 2 1307 1 1 12 GLN CB C -8.009 7.691 -3.480 1.00 . A A . 47 GLN CB 1 1 2 1308 1 1 12 GLN CD C -6.220 9.198 -2.439 1.00 . A A . 47 GLN CD 1 1 2 1309 1 1 12 GLN CG C -6.834 7.822 -2.516 1.00 . A A . 47 GLN CG 1 1 2 1310 1 1 12 GLN H H -6.855 4.965 -3.452 1.00 . A A . 47 GLN H 1 1 2 1311 1 1 12 GLN HA H -8.549 5.897 -2.561 1.00 . A A . 47 GLN HA 1 1 2 1312 1 1 12 GLN HB2 H -7.750 8.078 -4.454 1.00 . A A . 47 GLN HB2 1 1 2 1313 1 1 12 GLN HB3 H -8.847 8.222 -3.057 1.00 . A A . 47 GLN HB3 1 1 2 1314 1 1 12 GLN HE21 H -7.944 10.052 -2.884 1.00 . A A . 47 GLN HE21 1 1 2 1315 1 1 12 GLN HE22 H -6.622 11.112 -2.603 1.00 . A A . 47 GLN HE22 1 1 2 1316 1 1 12 GLN HG2 H -7.189 7.562 -1.529 1.00 . A A . 47 GLN HG2 1 1 2 1317 1 1 12 GLN HG3 H -6.086 7.102 -2.811 1.00 . A A . 47 GLN HG3 1 1 2 1318 1 1 12 GLN N N -7.431 5.399 -4.110 1.00 . A A . 47 GLN N 1 1 2 1319 1 1 12 GLN NE2 N -7.001 10.210 -2.668 1.00 . A A . 47 GLN NE2 1 1 2 1320 1 1 12 GLN O O -10.538 7.026 -4.491 1.00 . A A . 47 GLN O 1 1 2 1321 1 1 12 GLN OE1 O -5.027 9.343 -2.165 1.00 . A A . 47 GLN OE1 1 1 2 1322 1 1 13 LYS C C -12.242 3.677 -3.697 1.00 . A A . 48 LYS C 1 1 2 1323 1 1 13 LYS CA C -11.559 4.453 -4.786 1.00 . A A . 48 LYS CA 1 1 2 1324 1 1 13 LYS CB C -11.407 3.591 -6.031 1.00 . A A . 48 LYS CB 1 1 2 1325 1 1 13 LYS CD C -11.385 5.557 -7.627 1.00 . A A . 48 LYS CD 1 1 2 1326 1 1 13 LYS CE C -12.661 5.239 -8.389 1.00 . A A . 48 LYS CE 1 1 2 1327 1 1 13 LYS CG C -10.667 4.293 -7.163 1.00 . A A . 48 LYS CG 1 1 2 1328 1 1 13 LYS H H -9.629 4.134 -4.051 1.00 . A A . 48 LYS H 1 1 2 1329 1 1 13 LYS HA H -12.139 5.334 -5.014 1.00 . A A . 48 LYS HA 1 1 2 1330 1 1 13 LYS HB2 H -10.848 2.707 -5.758 1.00 . A A . 48 LYS HB2 1 1 2 1331 1 1 13 LYS HB3 H -12.389 3.293 -6.366 1.00 . A A . 48 LYS HB3 1 1 2 1332 1 1 13 LYS HD2 H -11.623 6.153 -6.760 1.00 . A A . 48 LYS HD2 1 1 2 1333 1 1 13 LYS HD3 H -10.719 6.116 -8.268 1.00 . A A . 48 LYS HD3 1 1 2 1334 1 1 13 LYS HE2 H -13.277 4.583 -7.793 1.00 . A A . 48 LYS HE2 1 1 2 1335 1 1 13 LYS HE3 H -13.200 6.155 -8.577 1.00 . A A . 48 LYS HE3 1 1 2 1336 1 1 13 LYS HG2 H -9.681 4.563 -6.811 1.00 . A A . 48 LYS HG2 1 1 2 1337 1 1 13 LYS HG3 H -10.573 3.604 -7.987 1.00 . A A . 48 LYS HG3 1 1 2 1338 1 1 13 LYS HZ1 H -13.234 4.371 -10.196 1.00 . A A . 48 LYS HZ1 1 1 2 1339 1 1 13 LYS HZ2 H -11.853 3.687 -9.533 1.00 . A A . 48 LYS HZ2 1 1 2 1340 1 1 13 LYS HZ3 H -11.771 5.193 -10.261 1.00 . A A . 48 LYS HZ3 1 1 2 1341 1 1 13 LYS N N -10.249 4.844 -4.297 1.00 . A A . 48 LYS N 1 1 2 1342 1 1 13 LYS NZ N -12.366 4.583 -9.669 1.00 . A A . 48 LYS NZ 1 1 2 1343 1 1 13 LYS O O -11.567 3.114 -2.849 1.00 . A A . 48 LYS O 1 1 2 1344 1 1 14 THR C C -14.044 1.483 -2.768 1.00 . A A . 49 THR C 1 1 2 1345 1 1 14 THR CA C -14.281 2.994 -2.653 1.00 . A A . 49 THR CA 1 1 2 1346 1 1 14 THR CB C -15.751 3.299 -2.765 1.00 . A A . 49 THR CB 1 1 2 1347 1 1 14 THR CG2 C -16.419 3.044 -1.435 1.00 . A A . 49 THR CG2 1 1 2 1348 1 1 14 THR H H -14.064 4.223 -4.312 1.00 . A A . 49 THR H 1 1 2 1349 1 1 14 THR HA H -13.939 3.320 -1.688 1.00 . A A . 49 THR HA 1 1 2 1350 1 1 14 THR HB H -16.162 2.638 -3.507 1.00 . A A . 49 THR HB 1 1 2 1351 1 1 14 THR HG1 H -16.428 4.712 -3.927 1.00 . A A . 49 THR HG1 1 1 2 1352 1 1 14 THR HG21 H -17.435 3.410 -1.451 1.00 . A A . 49 THR HG21 1 1 2 1353 1 1 14 THR HG22 H -15.825 3.545 -0.680 1.00 . A A . 49 THR HG22 1 1 2 1354 1 1 14 THR HG23 H -16.414 1.978 -1.249 1.00 . A A . 49 THR HG23 1 1 2 1355 1 1 14 THR N N -13.546 3.705 -3.662 1.00 . A A . 49 THR N 1 1 2 1356 1 1 14 THR O O -14.141 0.900 -3.871 1.00 . A A . 49 THR O 1 1 2 1357 1 1 14 THR OG1 O -15.911 4.693 -3.111 1.00 . A A . 49 THR OG1 1 1 2 1358 1 1 15 VAL C C -14.600 -1.306 -1.237 1.00 . A A . 50 VAL C 1 1 2 1359 1 1 15 VAL CA C -13.371 -0.525 -1.601 1.00 . A A . 50 VAL CA 1 1 2 1360 1 1 15 VAL CB C -12.273 -0.839 -0.551 1.00 . A A . 50 VAL CB 1 1 2 1361 1 1 15 VAL CG1 C -11.408 -1.955 -1.054 1.00 . A A . 50 VAL CG1 1 1 2 1362 1 1 15 VAL CG2 C -11.449 0.384 -0.231 1.00 . A A . 50 VAL CG2 1 1 2 1363 1 1 15 VAL H H -13.716 1.404 -0.823 1.00 . A A . 50 VAL H 1 1 2 1364 1 1 15 VAL HA H -13.004 -0.807 -2.578 1.00 . A A . 50 VAL HA 1 1 2 1365 1 1 15 VAL HB H -12.718 -1.232 0.357 1.00 . A A . 50 VAL HB 1 1 2 1366 1 1 15 VAL HG11 H -11.039 -1.702 -2.037 1.00 . A A . 50 VAL HG11 1 1 2 1367 1 1 15 VAL HG12 H -11.965 -2.879 -1.095 1.00 . A A . 50 VAL HG12 1 1 2 1368 1 1 15 VAL HG13 H -10.561 -2.057 -0.391 1.00 . A A . 50 VAL HG13 1 1 2 1369 1 1 15 VAL HG21 H -12.087 1.133 0.213 1.00 . A A . 50 VAL HG21 1 1 2 1370 1 1 15 VAL HG22 H -11.056 0.779 -1.160 1.00 . A A . 50 VAL HG22 1 1 2 1371 1 1 15 VAL HG23 H -10.644 0.138 0.445 1.00 . A A . 50 VAL HG23 1 1 2 1372 1 1 15 VAL N N -13.705 0.875 -1.652 1.00 . A A . 50 VAL N 1 1 2 1373 1 1 15 VAL O O -15.400 -0.876 -0.394 1.00 . A A . 50 VAL O 1 1 2 1374 1 1 16 TYR C C -15.442 -4.491 -0.867 1.00 . A A . 51 TYR C 1 1 2 1375 1 1 16 TYR CA C -15.912 -3.245 -1.612 1.00 . A A . 51 TYR CA 1 1 2 1376 1 1 16 TYR CB C -16.595 -3.566 -2.952 1.00 . A A . 51 TYR CB 1 1 2 1377 1 1 16 TYR CD1 C -17.484 -1.238 -3.276 1.00 . A A . 51 TYR CD1 1 1 2 1378 1 1 16 TYR CD2 C -16.411 -2.272 -5.120 1.00 . A A . 51 TYR CD2 1 1 2 1379 1 1 16 TYR CE1 C -17.699 -0.100 -4.020 1.00 . A A . 51 TYR CE1 1 1 2 1380 1 1 16 TYR CE2 C -16.625 -1.140 -5.881 1.00 . A A . 51 TYR CE2 1 1 2 1381 1 1 16 TYR CG C -16.841 -2.335 -3.803 1.00 . A A . 51 TYR CG 1 1 2 1382 1 1 16 TYR CZ C -17.267 -0.054 -5.322 1.00 . A A . 51 TYR CZ 1 1 2 1383 1 1 16 TYR H H -14.083 -2.745 -2.481 1.00 . A A . 51 TYR H 1 1 2 1384 1 1 16 TYR HA H -16.588 -2.688 -0.977 1.00 . A A . 51 TYR HA 1 1 2 1385 1 1 16 TYR HB2 H -15.952 -4.213 -3.521 1.00 . A A . 51 TYR HB2 1 1 2 1386 1 1 16 TYR HB3 H -17.545 -4.049 -2.777 1.00 . A A . 51 TYR HB3 1 1 2 1387 1 1 16 TYR HD1 H -17.801 -1.307 -2.249 1.00 . A A . 51 TYR HD1 1 1 2 1388 1 1 16 TYR HD2 H -15.910 -3.124 -5.555 1.00 . A A . 51 TYR HD2 1 1 2 1389 1 1 16 TYR HE1 H -18.206 0.747 -3.581 1.00 . A A . 51 TYR HE1 1 1 2 1390 1 1 16 TYR HE2 H -16.285 -1.106 -6.905 1.00 . A A . 51 TYR HE2 1 1 2 1391 1 1 16 TYR HH H -17.850 0.810 -6.916 1.00 . A A . 51 TYR HH 1 1 2 1392 1 1 16 TYR N N -14.765 -2.428 -1.852 1.00 . A A . 51 TYR N 1 1 2 1393 1 1 16 TYR O O -14.266 -4.827 -0.988 1.00 . A A . 51 TYR O 1 1 2 1394 1 1 16 TYR OH O -17.473 1.083 -6.069 1.00 . A A . 51 TYR OH 1 1 2 1395 1 1 17 PRO C C -14.950 -7.343 0.254 1.00 . A A . 52 PRO C 1 1 2 1396 1 1 17 PRO CA C -15.912 -6.287 0.830 1.00 . A A . 52 PRO CA 1 1 2 1397 1 1 17 PRO CB C -17.230 -6.928 1.203 1.00 . A A . 52 PRO CB 1 1 2 1398 1 1 17 PRO CD C -17.778 -4.964 -0.048 1.00 . A A . 52 PRO CD 1 1 2 1399 1 1 17 PRO CG C -18.224 -5.824 1.102 1.00 . A A . 52 PRO CG 1 1 2 1400 1 1 17 PRO HA H -15.464 -5.891 1.725 1.00 . A A . 52 PRO HA 1 1 2 1401 1 1 17 PRO HB2 H -17.406 -7.717 0.493 1.00 . A A . 52 PRO HB2 1 1 2 1402 1 1 17 PRO HB3 H -17.176 -7.337 2.201 1.00 . A A . 52 PRO HB3 1 1 2 1403 1 1 17 PRO HD2 H -18.247 -5.288 -0.966 1.00 . A A . 52 PRO HD2 1 1 2 1404 1 1 17 PRO HD3 H -18.001 -3.926 0.146 1.00 . A A . 52 PRO HD3 1 1 2 1405 1 1 17 PRO HG2 H -19.205 -6.230 0.912 1.00 . A A . 52 PRO HG2 1 1 2 1406 1 1 17 PRO HG3 H -18.231 -5.252 2.017 1.00 . A A . 52 PRO HG3 1 1 2 1407 1 1 17 PRO N N -16.314 -5.187 -0.098 1.00 . A A . 52 PRO N 1 1 2 1408 1 1 17 PRO O O -14.085 -7.862 0.979 1.00 . A A . 52 PRO O 1 1 2 1409 1 1 18 MET C C -12.777 -8.106 -1.840 1.00 . A A . 53 MET C 1 1 2 1410 1 1 18 MET CA C -14.214 -8.621 -1.681 1.00 . A A . 53 MET CA 1 1 2 1411 1 1 18 MET CB C -14.782 -8.972 -3.043 1.00 . A A . 53 MET CB 1 1 2 1412 1 1 18 MET CE C -13.479 -11.475 -6.101 1.00 . A A . 53 MET CE 1 1 2 1413 1 1 18 MET CG C -13.988 -10.010 -3.805 1.00 . A A . 53 MET CG 1 1 2 1414 1 1 18 MET H H -15.780 -7.193 -1.544 1.00 . A A . 53 MET H 1 1 2 1415 1 1 18 MET HA H -14.189 -9.522 -1.088 1.00 . A A . 53 MET HA 1 1 2 1416 1 1 18 MET HB2 H -15.777 -9.360 -2.889 1.00 . A A . 53 MET HB2 1 1 2 1417 1 1 18 MET HB3 H -14.833 -8.072 -3.637 1.00 . A A . 53 MET HB3 1 1 2 1418 1 1 18 MET HE1 H -13.744 -11.735 -7.115 1.00 . A A . 53 MET HE1 1 1 2 1419 1 1 18 MET HE2 H -13.508 -12.361 -5.484 1.00 . A A . 53 MET HE2 1 1 2 1420 1 1 18 MET HE3 H -12.485 -11.054 -6.084 1.00 . A A . 53 MET HE3 1 1 2 1421 1 1 18 MET HG2 H -12.963 -9.676 -3.847 1.00 . A A . 53 MET HG2 1 1 2 1422 1 1 18 MET HG3 H -14.032 -10.941 -3.260 1.00 . A A . 53 MET HG3 1 1 2 1423 1 1 18 MET N N -15.077 -7.640 -1.024 1.00 . A A . 53 MET N 1 1 2 1424 1 1 18 MET O O -11.821 -8.865 -1.715 1.00 . A A . 53 MET O 1 1 2 1425 1 1 18 MET SD S -14.642 -10.272 -5.465 1.00 . A A . 53 MET SD 1 1 2 1426 1 1 19 GLU C C -10.768 -5.553 -1.135 1.00 . A A . 54 GLU C 1 1 2 1427 1 1 19 GLU CA C -11.326 -6.250 -2.354 1.00 . A A . 54 GLU CA 1 1 2 1428 1 1 19 GLU CB C -11.419 -5.250 -3.496 1.00 . A A . 54 GLU CB 1 1 2 1429 1 1 19 GLU CD C -11.836 -4.858 -5.933 1.00 . A A . 54 GLU CD 1 1 2 1430 1 1 19 GLU CG C -11.931 -5.834 -4.788 1.00 . A A . 54 GLU CG 1 1 2 1431 1 1 19 GLU H H -13.401 -6.217 -2.074 1.00 . A A . 54 GLU H 1 1 2 1432 1 1 19 GLU HA H -10.659 -7.043 -2.653 1.00 . A A . 54 GLU HA 1 1 2 1433 1 1 19 GLU HB2 H -12.096 -4.462 -3.197 1.00 . A A . 54 GLU HB2 1 1 2 1434 1 1 19 GLU HB3 H -10.447 -4.814 -3.675 1.00 . A A . 54 GLU HB3 1 1 2 1435 1 1 19 GLU HG2 H -11.361 -6.721 -5.014 1.00 . A A . 54 GLU HG2 1 1 2 1436 1 1 19 GLU HG3 H -12.966 -6.106 -4.649 1.00 . A A . 54 GLU HG3 1 1 2 1437 1 1 19 GLU N N -12.630 -6.821 -2.086 1.00 . A A . 54 GLU N 1 1 2 1438 1 1 19 GLU O O -9.575 -5.289 -1.066 1.00 . A A . 54 GLU O 1 1 2 1439 1 1 19 GLU OE1 O -10.775 -4.798 -6.592 1.00 . A A . 54 GLU OE1 1 1 2 1440 1 1 19 GLU OE2 O -12.819 -4.150 -6.217 1.00 . A A . 54 GLU OE2 1 1 2 1441 1 1 20 ARG C C -10.314 -5.289 1.901 1.00 . A A . 55 ARG C 1 1 2 1442 1 1 20 ARG CA C -11.276 -4.532 1.015 1.00 . A A . 55 ARG CA 1 1 2 1443 1 1 20 ARG CB C -12.502 -4.016 1.766 1.00 . A A . 55 ARG CB 1 1 2 1444 1 1 20 ARG CD C -13.538 -3.458 3.920 1.00 . A A . 55 ARG CD 1 1 2 1445 1 1 20 ARG CG C -12.249 -3.518 3.158 1.00 . A A . 55 ARG CG 1 1 2 1446 1 1 20 ARG CZ C -13.626 -3.347 6.387 1.00 . A A . 55 ARG CZ 1 1 2 1447 1 1 20 ARG H H -12.573 -5.528 -0.321 1.00 . A A . 55 ARG H 1 1 2 1448 1 1 20 ARG HA H -10.727 -3.674 0.666 1.00 . A A . 55 ARG HA 1 1 2 1449 1 1 20 ARG HB2 H -12.859 -3.139 1.241 1.00 . A A . 55 ARG HB2 1 1 2 1450 1 1 20 ARG HB3 H -13.301 -4.723 1.755 1.00 . A A . 55 ARG HB3 1 1 2 1451 1 1 20 ARG HD2 H -14.274 -2.940 3.325 1.00 . A A . 55 ARG HD2 1 1 2 1452 1 1 20 ARG HD3 H -13.872 -4.471 4.086 1.00 . A A . 55 ARG HD3 1 1 2 1453 1 1 20 ARG HE H -13.177 -1.834 5.190 1.00 . A A . 55 ARG HE 1 1 2 1454 1 1 20 ARG HG2 H -11.558 -4.183 3.654 1.00 . A A . 55 ARG HG2 1 1 2 1455 1 1 20 ARG HG3 H -11.822 -2.527 3.110 1.00 . A A . 55 ARG HG3 1 1 2 1456 1 1 20 ARG HH11 H -13.800 -5.284 5.732 1.00 . A A . 55 ARG HH11 1 1 2 1457 1 1 20 ARG HH12 H -14.015 -5.079 7.403 1.00 . A A . 55 ARG HH12 1 1 2 1458 1 1 20 ARG HH21 H -13.461 -1.585 7.333 1.00 . A A . 55 ARG HH21 1 1 2 1459 1 1 20 ARG HH22 H -13.781 -2.910 8.375 1.00 . A A . 55 ARG HH22 1 1 2 1460 1 1 20 ARG N N -11.642 -5.255 -0.186 1.00 . A A . 55 ARG N 1 1 2 1461 1 1 20 ARG NE N -13.394 -2.800 5.207 1.00 . A A . 55 ARG NE 1 1 2 1462 1 1 20 ARG NH1 N -13.822 -4.656 6.513 1.00 . A A . 55 ARG NH1 1 1 2 1463 1 1 20 ARG NH2 N -13.626 -2.574 7.443 1.00 . A A . 55 ARG NH2 1 1 2 1464 1 1 20 ARG O O -10.651 -6.281 2.569 1.00 . A A . 55 ARG O 1 1 2 1465 1 1 21 LEU C C -7.547 -4.121 3.422 1.00 . A A . 56 LEU C 1 1 2 1466 1 1 21 LEU CA C -8.016 -5.290 2.571 1.00 . A A . 56 LEU CA 1 1 2 1467 1 1 21 LEU CB C -6.932 -5.767 1.560 1.00 . A A . 56 LEU CB 1 1 2 1468 1 1 21 LEU CD1 C -4.848 -7.001 1.111 1.00 . A A . 56 LEU CD1 1 1 2 1469 1 1 21 LEU CD2 C -4.672 -4.776 2.060 1.00 . A A . 56 LEU CD2 1 1 2 1470 1 1 21 LEU CG C -5.504 -6.052 2.057 1.00 . A A . 56 LEU CG 1 1 2 1471 1 1 21 LEU H H -8.957 -4.133 1.167 1.00 . A A . 56 LEU H 1 1 2 1472 1 1 21 LEU HA H -8.316 -6.119 3.193 1.00 . A A . 56 LEU HA 1 1 2 1473 1 1 21 LEU HB2 H -7.291 -6.672 1.095 1.00 . A A . 56 LEU HB2 1 1 2 1474 1 1 21 LEU HB3 H -6.870 -5.013 0.789 1.00 . A A . 56 LEU HB3 1 1 2 1475 1 1 21 LEU HD11 H -3.857 -7.216 1.475 1.00 . A A . 56 LEU HD11 1 1 2 1476 1 1 21 LEU HD12 H -4.763 -6.507 0.154 1.00 . A A . 56 LEU HD12 1 1 2 1477 1 1 21 LEU HD13 H -5.423 -7.911 1.025 1.00 . A A . 56 LEU HD13 1 1 2 1478 1 1 21 LEU HD21 H -4.600 -4.391 1.054 1.00 . A A . 56 LEU HD21 1 1 2 1479 1 1 21 LEU HD22 H -3.683 -4.982 2.442 1.00 . A A . 56 LEU HD22 1 1 2 1480 1 1 21 LEU HD23 H -5.153 -4.041 2.689 1.00 . A A . 56 LEU HD23 1 1 2 1481 1 1 21 LEU HG H -5.513 -6.462 3.055 1.00 . A A . 56 LEU HG 1 1 2 1482 1 1 21 LEU N N -9.131 -4.846 1.821 1.00 . A A . 56 LEU N 1 1 2 1483 1 1 21 LEU O O -7.937 -2.979 3.178 1.00 . A A . 56 LEU O 1 1 2 1484 1 1 22 VAL C C -4.704 -3.585 5.404 1.00 . A A . 57 VAL C 1 1 2 1485 1 1 22 VAL CA C -6.205 -3.353 5.209 1.00 . A A . 57 VAL CA 1 1 2 1486 1 1 22 VAL CB C -6.953 -3.160 6.573 1.00 . A A . 57 VAL CB 1 1 2 1487 1 1 22 VAL CG1 C -7.082 -4.462 7.348 1.00 . A A . 57 VAL CG1 1 1 2 1488 1 1 22 VAL CG2 C -6.272 -2.095 7.418 1.00 . A A . 57 VAL CG2 1 1 2 1489 1 1 22 VAL H H -6.590 -5.328 4.640 1.00 . A A . 57 VAL H 1 1 2 1490 1 1 22 VAL HA H -6.310 -2.445 4.634 1.00 . A A . 57 VAL HA 1 1 2 1491 1 1 22 VAL HB H -7.954 -2.822 6.352 1.00 . A A . 57 VAL HB 1 1 2 1492 1 1 22 VAL HG11 H -7.590 -4.274 8.282 1.00 . A A . 57 VAL HG11 1 1 2 1493 1 1 22 VAL HG12 H -6.100 -4.869 7.537 1.00 . A A . 57 VAL HG12 1 1 2 1494 1 1 22 VAL HG13 H -7.660 -5.158 6.759 1.00 . A A . 57 VAL HG13 1 1 2 1495 1 1 22 VAL HG21 H -6.788 -1.975 8.359 1.00 . A A . 57 VAL HG21 1 1 2 1496 1 1 22 VAL HG22 H -6.297 -1.159 6.877 1.00 . A A . 57 VAL HG22 1 1 2 1497 1 1 22 VAL HG23 H -5.245 -2.381 7.593 1.00 . A A . 57 VAL HG23 1 1 2 1498 1 1 22 VAL N N -6.779 -4.391 4.418 1.00 . A A . 57 VAL N 1 1 2 1499 1 1 22 VAL O O -4.283 -4.610 5.949 1.00 . A A . 57 VAL O 1 1 2 1500 1 1 23 ALA C C -2.174 -1.714 6.187 1.00 . A A . 58 ALA C 1 1 2 1501 1 1 23 ALA CA C -2.468 -2.766 5.144 1.00 . A A . 58 ALA CA 1 1 2 1502 1 1 23 ALA CB C -1.664 -2.520 3.835 1.00 . A A . 58 ALA CB 1 1 2 1503 1 1 23 ALA H H -4.290 -1.911 4.420 1.00 . A A . 58 ALA H 1 1 2 1504 1 1 23 ALA HA H -2.253 -3.744 5.547 1.00 . A A . 58 ALA HA 1 1 2 1505 1 1 23 ALA HB1 H -1.914 -1.557 3.408 1.00 . A A . 58 ALA HB1 1 1 2 1506 1 1 23 ALA HB2 H -1.869 -3.288 3.100 1.00 . A A . 58 ALA HB2 1 1 2 1507 1 1 23 ALA HB3 H -0.601 -2.541 4.028 1.00 . A A . 58 ALA HB3 1 1 2 1508 1 1 23 ALA N N -3.897 -2.675 4.900 1.00 . A A . 58 ALA N 1 1 2 1509 1 1 23 ALA O O -2.598 -0.608 6.012 1.00 . A A . 58 ALA O 1 1 2 1510 1 1 24 ASP C C -2.434 -0.871 9.123 1.00 . A A . 59 ASP C 1 1 2 1511 1 1 24 ASP CA C -1.125 -1.284 8.467 1.00 . A A . 59 ASP CA 1 1 2 1512 1 1 24 ASP CB C -0.112 -0.086 8.389 1.00 . A A . 59 ASP CB 1 1 2 1513 1 1 24 ASP CG C -0.192 0.847 7.221 1.00 . A A . 59 ASP CG 1 1 2 1514 1 1 24 ASP H H -0.930 -2.927 7.166 1.00 . A A . 59 ASP H 1 1 2 1515 1 1 24 ASP HA H -0.735 -2.036 9.141 1.00 . A A . 59 ASP HA 1 1 2 1516 1 1 24 ASP HB2 H -0.498 0.539 9.185 1.00 . A A . 59 ASP HB2 1 1 2 1517 1 1 24 ASP HB3 H 0.896 -0.327 8.686 1.00 . A A . 59 ASP HB3 1 1 2 1518 1 1 24 ASP N N -1.373 -2.065 7.208 1.00 . A A . 59 ASP N 1 1 2 1519 1 1 24 ASP O O -2.831 -1.437 10.150 1.00 . A A . 59 ASP O 1 1 2 1520 1 1 24 ASP OD1 O -1.058 1.759 7.241 1.00 . A A . 59 ASP OD1 1 1 2 1521 1 1 24 ASP OD2 O 0.647 0.721 6.288 1.00 . A A . 59 ASP OD2 1 1 2 1522 1 1 25 LYS C C -5.080 1.346 7.775 1.00 . A A . 60 LYS C 1 1 2 1523 1 1 25 LYS CA C -4.401 0.529 8.911 1.00 . A A . 60 LYS CA 1 1 2 1524 1 1 25 LYS CB C -4.361 1.307 10.202 1.00 . A A . 60 LYS CB 1 1 2 1525 1 1 25 LYS CD C -5.656 2.183 12.155 1.00 . A A . 60 LYS CD 1 1 2 1526 1 1 25 LYS CE C -5.396 3.655 11.872 1.00 . A A . 60 LYS CE 1 1 2 1527 1 1 25 LYS CG C -5.713 1.379 10.886 1.00 . A A . 60 LYS CG 1 1 2 1528 1 1 25 LYS H H -2.653 0.393 7.705 1.00 . A A . 60 LYS H 1 1 2 1529 1 1 25 LYS HA H -4.970 -0.371 9.052 1.00 . A A . 60 LYS HA 1 1 2 1530 1 1 25 LYS HB2 H -3.643 0.855 10.869 1.00 . A A . 60 LYS HB2 1 1 2 1531 1 1 25 LYS HB3 H -4.053 2.307 9.950 1.00 . A A . 60 LYS HB3 1 1 2 1532 1 1 25 LYS HD2 H -6.581 2.069 12.700 1.00 . A A . 60 LYS HD2 1 1 2 1533 1 1 25 LYS HD3 H -4.830 1.785 12.726 1.00 . A A . 60 LYS HD3 1 1 2 1534 1 1 25 LYS HE2 H -4.422 3.764 11.419 1.00 . A A . 60 LYS HE2 1 1 2 1535 1 1 25 LYS HE3 H -6.155 4.015 11.194 1.00 . A A . 60 LYS HE3 1 1 2 1536 1 1 25 LYS HG2 H -6.417 1.837 10.207 1.00 . A A . 60 LYS HG2 1 1 2 1537 1 1 25 LYS HG3 H -6.034 0.371 11.100 1.00 . A A . 60 LYS HG3 1 1 2 1538 1 1 25 LYS HZ1 H -4.709 4.148 13.773 1.00 . A A . 60 LYS HZ1 1 1 2 1539 1 1 25 LYS HZ2 H -6.369 4.388 13.542 1.00 . A A . 60 LYS HZ2 1 1 2 1540 1 1 25 LYS HZ3 H -5.269 5.462 12.868 1.00 . A A . 60 LYS HZ3 1 1 2 1541 1 1 25 LYS N N -3.101 0.060 8.508 1.00 . A A . 60 LYS N 1 1 2 1542 1 1 25 LYS NZ N -5.433 4.460 13.099 1.00 . A A . 60 LYS NZ 1 1 2 1543 1 1 25 LYS O O -6.052 2.095 7.989 1.00 . A A . 60 LYS O 1 1 2 1544 1 1 26 LEU C C -6.050 0.813 4.771 1.00 . A A . 61 LEU C 1 1 2 1545 1 1 26 LEU CA C -5.147 1.818 5.421 1.00 . A A . 61 LEU CA 1 1 2 1546 1 1 26 LEU CB C -4.077 2.226 4.436 1.00 . A A . 61 LEU CB 1 1 2 1547 1 1 26 LEU CD1 C -2.012 3.465 3.816 1.00 . A A . 61 LEU CD1 1 1 2 1548 1 1 26 LEU CD2 C -3.676 4.527 5.340 1.00 . A A . 61 LEU CD2 1 1 2 1549 1 1 26 LEU CG C -3.025 3.219 4.917 1.00 . A A . 61 LEU CG 1 1 2 1550 1 1 26 LEU H H -3.780 0.636 6.449 1.00 . A A . 61 LEU H 1 1 2 1551 1 1 26 LEU HA H -5.716 2.683 5.713 1.00 . A A . 61 LEU HA 1 1 2 1552 1 1 26 LEU HB2 H -3.583 1.314 4.149 1.00 . A A . 61 LEU HB2 1 1 2 1553 1 1 26 LEU HB3 H -4.571 2.638 3.569 1.00 . A A . 61 LEU HB3 1 1 2 1554 1 1 26 LEU HD11 H -1.554 2.528 3.534 1.00 . A A . 61 LEU HD11 1 1 2 1555 1 1 26 LEU HD12 H -1.251 4.150 4.159 1.00 . A A . 61 LEU HD12 1 1 2 1556 1 1 26 LEU HD13 H -2.513 3.888 2.959 1.00 . A A . 61 LEU HD13 1 1 2 1557 1 1 26 LEU HD21 H -4.354 4.344 6.160 1.00 . A A . 61 LEU HD21 1 1 2 1558 1 1 26 LEU HD22 H -4.228 4.936 4.507 1.00 . A A . 61 LEU HD22 1 1 2 1559 1 1 26 LEU HD23 H -2.914 5.228 5.649 1.00 . A A . 61 LEU HD23 1 1 2 1560 1 1 26 LEU HG H -2.504 2.802 5.766 1.00 . A A . 61 LEU HG 1 1 2 1561 1 1 26 LEU N N -4.571 1.202 6.586 1.00 . A A . 61 LEU N 1 1 2 1562 1 1 26 LEU O O -5.638 -0.332 4.538 1.00 . A A . 61 LEU O 1 1 2 1563 1 1 27 ILE C C -8.179 0.437 2.418 1.00 . A A . 62 ILE C 1 1 2 1564 1 1 27 ILE CA C -8.194 0.286 3.921 1.00 . A A . 62 ILE CA 1 1 2 1565 1 1 27 ILE CB C -9.634 0.573 4.414 1.00 . A A . 62 ILE CB 1 1 2 1566 1 1 27 ILE CD1 C -9.338 -0.389 6.787 1.00 . A A . 62 ILE CD1 1 1 2 1567 1 1 27 ILE CG1 C -9.700 0.808 5.933 1.00 . A A . 62 ILE CG1 1 1 2 1568 1 1 27 ILE CG2 C -10.501 -0.595 4.062 1.00 . A A . 62 ILE CG2 1 1 2 1569 1 1 27 ILE H H -7.500 2.150 4.557 1.00 . A A . 62 ILE H 1 1 2 1570 1 1 27 ILE HA H -7.900 -0.714 4.207 1.00 . A A . 62 ILE HA 1 1 2 1571 1 1 27 ILE HB H -10.005 1.447 3.900 1.00 . A A . 62 ILE HB 1 1 2 1572 1 1 27 ILE HD11 H -9.402 -0.125 7.832 1.00 . A A . 62 ILE HD11 1 1 2 1573 1 1 27 ILE HD12 H -8.331 -0.696 6.550 1.00 . A A . 62 ILE HD12 1 1 2 1574 1 1 27 ILE HD13 H -10.019 -1.200 6.575 1.00 . A A . 62 ILE HD13 1 1 2 1575 1 1 27 ILE HG12 H -9.001 1.592 6.168 1.00 . A A . 62 ILE HG12 1 1 2 1576 1 1 27 ILE HG13 H -10.697 1.130 6.197 1.00 . A A . 62 ILE HG13 1 1 2 1577 1 1 27 ILE HG21 H -10.478 -0.751 2.994 1.00 . A A . 62 ILE HG21 1 1 2 1578 1 1 27 ILE HG22 H -11.501 -0.408 4.422 1.00 . A A . 62 ILE HG22 1 1 2 1579 1 1 27 ILE HG23 H -10.075 -1.448 4.571 1.00 . A A . 62 ILE HG23 1 1 2 1580 1 1 27 ILE N N -7.244 1.208 4.462 1.00 . A A . 62 ILE N 1 1 2 1581 1 1 27 ILE O O -8.428 1.522 1.900 1.00 . A A . 62 ILE O 1 1 2 1582 1 1 28 PHE C C -7.872 -1.919 -0.380 1.00 . A A . 63 PHE C 1 1 2 1583 1 1 28 PHE CA C -7.775 -0.595 0.299 1.00 . A A . 63 PHE CA 1 1 2 1584 1 1 28 PHE CB C -6.636 0.259 -0.250 1.00 . A A . 63 PHE CB 1 1 2 1585 1 1 28 PHE CD1 C -4.754 -1.225 0.587 1.00 . A A . 63 PHE CD1 1 1 2 1586 1 1 28 PHE CD2 C -4.528 1.124 0.634 1.00 . A A . 63 PHE CD2 1 1 2 1587 1 1 28 PHE CE1 C -3.498 -1.339 1.132 1.00 . A A . 63 PHE CE1 1 1 2 1588 1 1 28 PHE CE2 C -3.298 1.006 1.164 1.00 . A A . 63 PHE CE2 1 1 2 1589 1 1 28 PHE CG C -5.280 0.032 0.332 1.00 . A A . 63 PHE CG 1 1 2 1590 1 1 28 PHE CZ C -2.768 -0.211 1.419 1.00 . A A . 63 PHE CZ 1 1 2 1591 1 1 28 PHE H H -7.680 -1.457 2.215 1.00 . A A . 63 PHE H 1 1 2 1592 1 1 28 PHE HA H -8.685 -0.090 0.015 1.00 . A A . 63 PHE HA 1 1 2 1593 1 1 28 PHE HB2 H -6.568 0.234 -1.325 1.00 . A A . 63 PHE HB2 1 1 2 1594 1 1 28 PHE HB3 H -6.885 1.264 0.063 1.00 . A A . 63 PHE HB3 1 1 2 1595 1 1 28 PHE HD1 H -5.309 -2.125 0.361 1.00 . A A . 63 PHE HD1 1 1 2 1596 1 1 28 PHE HD2 H -4.924 2.109 0.441 1.00 . A A . 63 PHE HD2 1 1 2 1597 1 1 28 PHE HE1 H -3.083 -2.316 1.331 1.00 . A A . 63 PHE HE1 1 1 2 1598 1 1 28 PHE HE2 H -2.730 1.896 1.379 1.00 . A A . 63 PHE HE2 1 1 2 1599 1 1 28 PHE HZ H -1.771 -0.253 1.837 1.00 . A A . 63 PHE HZ 1 1 2 1600 1 1 28 PHE N N -7.849 -0.614 1.733 1.00 . A A . 63 PHE N 1 1 2 1601 1 1 28 PHE O O -7.837 -2.953 0.248 1.00 . A A . 63 PHE O 1 1 2 1602 1 1 29 HIS C C -6.718 -3.605 -2.536 1.00 . A A . 64 HIS C 1 1 2 1603 1 1 29 HIS CA C -8.103 -2.988 -2.549 1.00 . A A . 64 HIS CA 1 1 2 1604 1 1 29 HIS CB C -8.391 -2.513 -3.982 1.00 . A A . 64 HIS CB 1 1 2 1605 1 1 29 HIS CD2 C -10.827 -1.857 -4.471 1.00 . A A . 64 HIS CD2 1 1 2 1606 1 1 29 HIS CE1 C -10.616 0.298 -4.214 1.00 . A A . 64 HIS CE1 1 1 2 1607 1 1 29 HIS CG C -9.555 -1.580 -4.148 1.00 . A A . 64 HIS CG 1 1 2 1608 1 1 29 HIS H H -8.221 -0.974 -2.079 1.00 . A A . 64 HIS H 1 1 2 1609 1 1 29 HIS HA H -8.860 -3.690 -2.234 1.00 . A A . 64 HIS HA 1 1 2 1610 1 1 29 HIS HB2 H -7.544 -1.948 -4.335 1.00 . A A . 64 HIS HB2 1 1 2 1611 1 1 29 HIS HB3 H -8.547 -3.370 -4.619 1.00 . A A . 64 HIS HB3 1 1 2 1612 1 1 29 HIS HD2 H -11.222 -2.842 -4.657 1.00 . A A . 64 HIS HD2 1 1 2 1613 1 1 29 HIS HE1 H -10.850 1.348 -4.133 1.00 . A A . 64 HIS HE1 1 1 2 1614 1 1 29 HIS HE2 H -12.397 -0.531 -4.896 1.00 . A A . 64 HIS HE2 1 1 2 1615 1 1 29 HIS N N -8.064 -1.847 -1.671 1.00 . A A . 64 HIS N 1 1 2 1616 1 1 29 HIS ND1 N -9.424 -0.202 -3.984 1.00 . A A . 64 HIS ND1 1 1 2 1617 1 1 29 HIS NE2 N -11.503 -0.665 -4.512 1.00 . A A . 64 HIS NE2 1 1 2 1618 1 1 29 HIS O O -5.703 -2.899 -2.575 1.00 . A A . 64 HIS O 1 1 2 1619 1 1 30 ASN C C -4.598 -5.475 -3.645 1.00 . A A . 65 ASN C 1 1 2 1620 1 1 30 ASN CA C -5.472 -5.658 -2.415 1.00 . A A . 65 ASN CA 1 1 2 1621 1 1 30 ASN CB C -5.758 -7.151 -2.143 1.00 . A A . 65 ASN CB 1 1 2 1622 1 1 30 ASN CG C -6.749 -7.858 -3.086 1.00 . A A . 65 ASN CG 1 1 2 1623 1 1 30 ASN H H -7.517 -5.423 -2.411 1.00 . A A . 65 ASN H 1 1 2 1624 1 1 30 ASN HA H -4.922 -5.280 -1.567 1.00 . A A . 65 ASN HA 1 1 2 1625 1 1 30 ASN HB2 H -4.822 -7.669 -2.227 1.00 . A A . 65 ASN HB2 1 1 2 1626 1 1 30 ASN HB3 H -6.122 -7.257 -1.132 1.00 . A A . 65 ASN HB3 1 1 2 1627 1 1 30 ASN HD21 H -7.199 -9.110 -1.641 1.00 . A A . 65 ASN HD21 1 1 2 1628 1 1 30 ASN HD22 H -8.047 -9.351 -3.121 1.00 . A A . 65 ASN HD22 1 1 2 1629 1 1 30 ASN N N -6.687 -4.909 -2.464 1.00 . A A . 65 ASN N 1 1 2 1630 1 1 30 ASN ND2 N -7.391 -8.869 -2.574 1.00 . A A . 65 ASN ND2 1 1 2 1631 1 1 30 ASN O O -3.398 -5.417 -3.539 1.00 . A A . 65 ASN O 1 1 2 1632 1 1 30 ASN OD1 O -6.918 -7.521 -4.257 1.00 . A A . 65 ASN OD1 1 1 2 1633 1 1 31 SER C C -3.975 -3.914 -6.419 1.00 . A A . 66 SER C 1 1 2 1634 1 1 31 SER CA C -4.562 -5.293 -6.042 1.00 . A A . 66 SER CA 1 1 2 1635 1 1 31 SER CB C -5.535 -5.762 -7.080 1.00 . A A . 66 SER CB 1 1 2 1636 1 1 31 SER H H -6.195 -5.425 -4.785 1.00 . A A . 66 SER H 1 1 2 1637 1 1 31 SER HA H -3.749 -6.000 -6.068 1.00 . A A . 66 SER HA 1 1 2 1638 1 1 31 SER HB2 H -5.145 -5.439 -8.030 1.00 . A A . 66 SER HB2 1 1 2 1639 1 1 31 SER HB3 H -5.592 -6.840 -7.055 1.00 . A A . 66 SER HB3 1 1 2 1640 1 1 31 SER HG H -7.460 -5.941 -6.901 1.00 . A A . 66 SER HG 1 1 2 1641 1 1 31 SER N N -5.216 -5.394 -4.774 1.00 . A A . 66 SER N 1 1 2 1642 1 1 31 SER O O -3.218 -3.816 -7.393 1.00 . A A . 66 SER O 1 1 2 1643 1 1 31 SER OG O -6.842 -5.205 -6.848 1.00 . A A . 66 SER OG 1 1 2 1644 1 1 32 CYS C C -2.635 -0.947 -5.699 1.00 . A A . 67 CYS C 1 1 2 1645 1 1 32 CYS CA C -3.920 -1.555 -6.215 1.00 . A A . 67 CYS CA 1 1 2 1646 1 1 32 CYS CB C -5.081 -0.580 -6.122 1.00 . A A . 67 CYS CB 1 1 2 1647 1 1 32 CYS H H -4.665 -2.973 -4.791 1.00 . A A . 67 CYS H 1 1 2 1648 1 1 32 CYS HA H -3.751 -1.730 -7.267 1.00 . A A . 67 CYS HA 1 1 2 1649 1 1 32 CYS HB2 H -4.701 0.411 -6.322 1.00 . A A . 67 CYS HB2 1 1 2 1650 1 1 32 CYS HB3 H -5.828 -0.850 -6.851 1.00 . A A . 67 CYS HB3 1 1 2 1651 1 1 32 CYS N N -4.266 -2.867 -5.683 1.00 . A A . 67 CYS N 1 1 2 1652 1 1 32 CYS O O -2.054 -0.085 -6.377 1.00 . A A . 67 CYS O 1 1 2 1653 1 1 32 CYS SG S -5.840 -0.503 -4.511 1.00 . A A . 67 CYS SG 1 1 2 1654 1 1 33 PHE C C 0.288 -1.284 -4.590 1.00 . A A . 68 PHE C 1 1 2 1655 1 1 33 PHE CA C -0.986 -0.718 -4.027 1.00 . A A . 68 PHE CA 1 1 2 1656 1 1 33 PHE CB C -0.946 -0.595 -2.493 1.00 . A A . 68 PHE CB 1 1 2 1657 1 1 33 PHE CD1 C -2.259 -2.596 -1.680 1.00 . A A . 68 PHE CD1 1 1 2 1658 1 1 33 PHE CD2 C -0.095 -2.190 -0.783 1.00 . A A . 68 PHE CD2 1 1 2 1659 1 1 33 PHE CE1 C -2.391 -3.703 -0.851 1.00 . A A . 68 PHE CE1 1 1 2 1660 1 1 33 PHE CE2 C -0.224 -3.278 0.046 1.00 . A A . 68 PHE CE2 1 1 2 1661 1 1 33 PHE CG C -1.106 -1.832 -1.653 1.00 . A A . 68 PHE CG 1 1 2 1662 1 1 33 PHE CZ C -1.366 -4.035 0.015 1.00 . A A . 68 PHE CZ 1 1 2 1663 1 1 33 PHE H H -2.574 -2.108 -4.064 1.00 . A A . 68 PHE H 1 1 2 1664 1 1 33 PHE HA H -1.048 0.281 -4.435 1.00 . A A . 68 PHE HA 1 1 2 1665 1 1 33 PHE HB2 H 0.088 -0.365 -2.287 1.00 . A A . 68 PHE HB2 1 1 2 1666 1 1 33 PHE HB3 H -1.600 0.182 -2.128 1.00 . A A . 68 PHE HB3 1 1 2 1667 1 1 33 PHE HD1 H -3.050 -2.322 -2.363 1.00 . A A . 68 PHE HD1 1 1 2 1668 1 1 33 PHE HD2 H 0.807 -1.595 -0.768 1.00 . A A . 68 PHE HD2 1 1 2 1669 1 1 33 PHE HE1 H -3.296 -4.293 -0.865 1.00 . A A . 68 PHE HE1 1 1 2 1670 1 1 33 PHE HE2 H 0.570 -3.540 0.729 1.00 . A A . 68 PHE HE2 1 1 2 1671 1 1 33 PHE HZ H -1.442 -4.886 0.678 1.00 . A A . 68 PHE HZ 1 1 2 1672 1 1 33 PHE N N -2.156 -1.365 -4.547 1.00 . A A . 68 PHE N 1 1 2 1673 1 1 33 PHE O O 0.763 -2.337 -4.180 1.00 . A A . 68 PHE O 1 1 2 1674 1 1 34 CYS C C 2.979 0.212 -5.886 1.00 . A A . 69 CYS C 1 1 2 1675 1 1 34 CYS CA C 2.022 -0.923 -6.190 1.00 . A A . 69 CYS CA 1 1 2 1676 1 1 34 CYS CB C 1.845 -1.084 -7.698 1.00 . A A . 69 CYS CB 1 1 2 1677 1 1 34 CYS H H 0.268 0.144 -5.925 1.00 . A A . 69 CYS H 1 1 2 1678 1 1 34 CYS HA H 2.389 -1.847 -5.770 1.00 . A A . 69 CYS HA 1 1 2 1679 1 1 34 CYS HB2 H 1.637 -0.141 -8.180 1.00 . A A . 69 CYS HB2 1 1 2 1680 1 1 34 CYS HB3 H 2.792 -1.430 -8.078 1.00 . A A . 69 CYS HB3 1 1 2 1681 1 1 34 CYS HG H -0.451 -2.120 -7.375 1.00 . A A . 69 CYS HG 1 1 2 1682 1 1 34 CYS N N 0.779 -0.616 -5.580 1.00 . A A . 69 CYS N 1 1 2 1683 1 1 34 CYS O O 2.554 1.256 -5.359 1.00 . A A . 69 CYS O 1 1 2 1684 1 1 34 CYS SG S 0.601 -2.318 -8.160 1.00 . A A . 69 CYS SG 1 1 2 1685 1 1 35 CYS C C 4.953 2.239 -6.849 1.00 . A A . 70 CYS C 1 1 2 1686 1 1 35 CYS CA C 5.229 1.060 -5.947 1.00 . A A . 70 CYS CA 1 1 2 1687 1 1 35 CYS CB C 6.643 0.511 -6.123 1.00 . A A . 70 CYS CB 1 1 2 1688 1 1 35 CYS H H 4.506 -0.845 -6.564 1.00 . A A . 70 CYS H 1 1 2 1689 1 1 35 CYS HA H 5.105 1.389 -4.927 1.00 . A A . 70 CYS HA 1 1 2 1690 1 1 35 CYS HB2 H 6.815 -0.131 -5.277 1.00 . A A . 70 CYS HB2 1 1 2 1691 1 1 35 CYS HB3 H 6.687 -0.056 -7.039 1.00 . A A . 70 CYS HB3 1 1 2 1692 1 1 35 CYS N N 4.246 0.019 -6.175 1.00 . A A . 70 CYS N 1 1 2 1693 1 1 35 CYS O O 4.565 2.107 -8.014 1.00 . A A . 70 CYS O 1 1 2 1694 1 1 35 CYS SG S 8.026 1.689 -6.095 1.00 . A A . 70 CYS SG 1 1 2 1695 1 1 36 LYS C C 5.882 4.952 -7.934 1.00 . A A . 71 LYS C 1 1 2 1696 1 1 36 LYS CA C 4.814 4.631 -6.902 1.00 . A A . 71 LYS CA 1 1 2 1697 1 1 36 LYS CB C 4.742 5.731 -5.853 1.00 . A A . 71 LYS CB 1 1 2 1698 1 1 36 LYS CD C 2.638 7.152 -6.257 1.00 . A A . 71 LYS CD 1 1 2 1699 1 1 36 LYS CE C 1.991 6.407 -7.375 1.00 . A A . 71 LYS CE 1 1 2 1700 1 1 36 LYS CG C 4.161 7.080 -6.312 1.00 . A A . 71 LYS CG 1 1 2 1701 1 1 36 LYS H H 5.352 3.345 -5.316 1.00 . A A . 71 LYS H 1 1 2 1702 1 1 36 LYS HA H 3.860 4.566 -7.391 1.00 . A A . 71 LYS HA 1 1 2 1703 1 1 36 LYS HB2 H 4.165 5.378 -5.012 1.00 . A A . 71 LYS HB2 1 1 2 1704 1 1 36 LYS HB3 H 5.757 5.892 -5.533 1.00 . A A . 71 LYS HB3 1 1 2 1705 1 1 36 LYS HD2 H 2.311 6.709 -5.329 1.00 . A A . 71 LYS HD2 1 1 2 1706 1 1 36 LYS HD3 H 2.333 8.188 -6.288 1.00 . A A . 71 LYS HD3 1 1 2 1707 1 1 36 LYS HE2 H 2.495 6.767 -8.256 1.00 . A A . 71 LYS HE2 1 1 2 1708 1 1 36 LYS HE3 H 2.167 5.349 -7.248 1.00 . A A . 71 LYS HE3 1 1 2 1709 1 1 36 LYS HG2 H 4.542 7.896 -5.726 1.00 . A A . 71 LYS HG2 1 1 2 1710 1 1 36 LYS HG3 H 4.465 7.230 -7.337 1.00 . A A . 71 LYS HG3 1 1 2 1711 1 1 36 LYS HZ1 H 0.356 7.680 -7.565 1.00 . A A . 71 LYS HZ1 1 1 2 1712 1 1 36 LYS HZ2 H 0.050 6.380 -6.560 1.00 . A A . 71 LYS HZ2 1 1 2 1713 1 1 36 LYS HZ3 H 0.108 6.168 -8.231 1.00 . A A . 71 LYS HZ3 1 1 2 1714 1 1 36 LYS N N 5.088 3.380 -6.264 1.00 . A A . 71 LYS N 1 1 2 1715 1 1 36 LYS NZ N 0.542 6.665 -7.429 1.00 . A A . 71 LYS NZ 1 1 2 1716 1 1 36 LYS O O 5.593 5.560 -8.956 1.00 . A A . 71 LYS O 1 1 2 1717 1 1 37 HIS C C 8.255 3.751 -9.696 1.00 . A A . 72 HIS C 1 1 2 1718 1 1 37 HIS CA C 8.202 4.810 -8.596 1.00 . A A . 72 HIS CA 1 1 2 1719 1 1 37 HIS CB C 9.543 4.917 -7.851 1.00 . A A . 72 HIS CB 1 1 2 1720 1 1 37 HIS CD2 C 11.532 4.887 -9.550 1.00 . A A . 72 HIS CD2 1 1 2 1721 1 1 37 HIS CE1 C 12.174 6.950 -9.274 1.00 . A A . 72 HIS CE1 1 1 2 1722 1 1 37 HIS CG C 10.697 5.491 -8.667 1.00 . A A . 72 HIS CG 1 1 2 1723 1 1 37 HIS H H 7.271 3.999 -6.866 1.00 . A A . 72 HIS H 1 1 2 1724 1 1 37 HIS HA H 7.977 5.760 -9.057 1.00 . A A . 72 HIS HA 1 1 2 1725 1 1 37 HIS HB2 H 9.405 5.561 -6.996 1.00 . A A . 72 HIS HB2 1 1 2 1726 1 1 37 HIS HB3 H 9.830 3.934 -7.507 1.00 . A A . 72 HIS HB3 1 1 2 1727 1 1 37 HIS HD2 H 11.479 3.865 -9.894 1.00 . A A . 72 HIS HD2 1 1 2 1728 1 1 37 HIS HE1 H 12.762 7.856 -9.321 1.00 . A A . 72 HIS HE1 1 1 2 1729 1 1 37 HIS HE2 H 13.327 5.652 -10.363 1.00 . A A . 72 HIS HE2 1 1 2 1730 1 1 37 HIS N N 7.110 4.521 -7.680 1.00 . A A . 72 HIS N 1 1 2 1731 1 1 37 HIS ND1 N 11.100 6.796 -8.504 1.00 . A A . 72 HIS ND1 1 1 2 1732 1 1 37 HIS NE2 N 12.463 5.827 -9.925 1.00 . A A . 72 HIS NE2 1 1 2 1733 1 1 37 HIS O O 8.480 4.077 -10.859 1.00 . A A . 72 HIS O 1 1 2 1734 1 1 38 CYS C C 6.701 0.664 -10.089 1.00 . A A . 73 CYS C 1 1 2 1735 1 1 38 CYS CA C 7.983 1.449 -10.315 1.00 . A A . 73 CYS CA 1 1 2 1736 1 1 38 CYS CB C 9.221 0.544 -10.181 1.00 . A A . 73 CYS CB 1 1 2 1737 1 1 38 CYS H H 7.821 2.252 -8.412 1.00 . A A . 73 CYS H 1 1 2 1738 1 1 38 CYS HA H 8.008 1.944 -11.273 1.00 . A A . 73 CYS HA 1 1 2 1739 1 1 38 CYS HB2 H 9.386 -0.017 -11.080 1.00 . A A . 73 CYS HB2 1 1 2 1740 1 1 38 CYS HB3 H 10.028 1.247 -10.125 1.00 . A A . 73 CYS HB3 1 1 2 1741 1 1 38 CYS N N 8.023 2.492 -9.337 1.00 . A A . 73 CYS N 1 1 2 1742 1 1 38 CYS O O 6.424 0.298 -8.968 1.00 . A A . 73 CYS O 1 1 2 1743 1 1 38 CYS SG S 9.316 -0.590 -8.739 1.00 . A A . 73 CYS SG 1 1 2 1744 1 1 39 HIS C C 4.795 -1.823 -10.690 1.00 . A A . 74 HIS C 1 1 2 1745 1 1 39 HIS CA C 4.647 -0.311 -10.861 1.00 . A A . 74 HIS CA 1 1 2 1746 1 1 39 HIS CB C 3.521 0.096 -11.851 1.00 . A A . 74 HIS CB 1 1 2 1747 1 1 39 HIS CD2 C 3.415 -1.237 -14.087 1.00 . A A . 74 HIS CD2 1 1 2 1748 1 1 39 HIS CE1 C 4.354 0.245 -15.380 1.00 . A A . 74 HIS CE1 1 1 2 1749 1 1 39 HIS CG C 3.751 -0.179 -13.316 1.00 . A A . 74 HIS CG 1 1 2 1750 1 1 39 HIS H H 6.225 0.600 -12.014 1.00 . A A . 74 HIS H 1 1 2 1751 1 1 39 HIS HA H 4.349 0.016 -9.870 1.00 . A A . 74 HIS HA 1 1 2 1752 1 1 39 HIS HB2 H 2.631 -0.441 -11.565 1.00 . A A . 74 HIS HB2 1 1 2 1753 1 1 39 HIS HB3 H 3.335 1.153 -11.726 1.00 . A A . 74 HIS HB3 1 1 2 1754 1 1 39 HIS HD1 H 4.703 1.601 -13.907 1.00 . A A . 74 HIS HD1 1 1 2 1755 1 1 39 HIS HD2 H 2.935 -2.147 -13.754 1.00 . A A . 74 HIS HD2 1 1 2 1756 1 1 39 HIS HE1 H 4.759 0.743 -16.248 1.00 . A A . 74 HIS HE1 1 1 2 1757 1 1 39 HIS HE2 H 3.464 -1.387 -16.170 1.00 . A A . 74 HIS HE2 1 1 2 1758 1 1 39 HIS N N 5.931 0.369 -11.105 1.00 . A A . 74 HIS N 1 1 2 1759 1 1 39 HIS ND1 N 4.339 0.724 -14.162 1.00 . A A . 74 HIS ND1 1 1 2 1760 1 1 39 HIS NE2 N 3.800 -0.941 -15.362 1.00 . A A . 74 HIS NE2 1 1 2 1761 1 1 39 HIS O O 4.326 -2.623 -11.490 1.00 . A A . 74 HIS O 1 1 2 1762 1 1 40 THR C C 4.557 -3.882 -8.257 1.00 . A A . 75 THR C 1 1 2 1763 1 1 40 THR CA C 5.654 -3.540 -9.257 1.00 . A A . 75 THR CA 1 1 2 1764 1 1 40 THR CB C 7.080 -3.810 -8.660 1.00 . A A . 75 THR CB 1 1 2 1765 1 1 40 THR CG2 C 7.315 -3.063 -7.350 1.00 . A A . 75 THR CG2 1 1 2 1766 1 1 40 THR H H 5.898 -1.467 -9.114 1.00 . A A . 75 THR H 1 1 2 1767 1 1 40 THR HA H 5.513 -4.147 -10.139 1.00 . A A . 75 THR HA 1 1 2 1768 1 1 40 THR HB H 7.781 -3.453 -9.398 1.00 . A A . 75 THR HB 1 1 2 1769 1 1 40 THR HG1 H 8.041 -5.318 -7.842 1.00 . A A . 75 THR HG1 1 1 2 1770 1 1 40 THR HG21 H 8.298 -3.300 -6.971 1.00 . A A . 75 THR HG21 1 1 2 1771 1 1 40 THR HG22 H 6.568 -3.354 -6.627 1.00 . A A . 75 THR HG22 1 1 2 1772 1 1 40 THR HG23 H 7.245 -2.001 -7.531 1.00 . A A . 75 THR HG23 1 1 2 1773 1 1 40 THR N N 5.483 -2.181 -9.646 1.00 . A A . 75 THR N 1 1 2 1774 1 1 40 THR O O 4.243 -3.059 -7.345 1.00 . A A . 75 THR O 1 1 2 1775 1 1 40 THR OG1 O 7.284 -5.214 -8.434 1.00 . A A . 75 THR OG1 1 1 2 1776 1 1 41 LYS C C 3.437 -5.973 -6.319 1.00 . A A . 76 LYS C 1 1 2 1777 1 1 41 LYS CA C 2.843 -5.498 -7.639 1.00 . A A . 76 LYS CA 1 1 2 1778 1 1 41 LYS CB C 2.084 -6.624 -8.381 1.00 . A A . 76 LYS CB 1 1 2 1779 1 1 41 LYS CD C 0.753 -7.900 -6.579 1.00 . A A . 76 LYS CD 1 1 2 1780 1 1 41 LYS CE C 1.387 -9.266 -6.871 1.00 . A A . 76 LYS CE 1 1 2 1781 1 1 41 LYS CG C 0.696 -7.016 -7.825 1.00 . A A . 76 LYS CG 1 1 2 1782 1 1 41 LYS H H 4.202 -5.578 -9.230 1.00 . A A . 76 LYS H 1 1 2 1783 1 1 41 LYS HA H 2.170 -4.676 -7.445 1.00 . A A . 76 LYS HA 1 1 2 1784 1 1 41 LYS HB2 H 1.965 -6.341 -9.414 1.00 . A A . 76 LYS HB2 1 1 2 1785 1 1 41 LYS HB3 H 2.718 -7.497 -8.339 1.00 . A A . 76 LYS HB3 1 1 2 1786 1 1 41 LYS HD2 H 1.347 -7.394 -5.833 1.00 . A A . 76 LYS HD2 1 1 2 1787 1 1 41 LYS HD3 H -0.249 -8.044 -6.203 1.00 . A A . 76 LYS HD3 1 1 2 1788 1 1 41 LYS HE2 H 2.419 -9.133 -7.159 1.00 . A A . 76 LYS HE2 1 1 2 1789 1 1 41 LYS HE3 H 1.351 -9.857 -5.968 1.00 . A A . 76 LYS HE3 1 1 2 1790 1 1 41 LYS HG2 H 0.163 -6.113 -7.570 1.00 . A A . 76 LYS HG2 1 1 2 1791 1 1 41 LYS HG3 H 0.151 -7.533 -8.601 1.00 . A A . 76 LYS HG3 1 1 2 1792 1 1 41 LYS HZ1 H 0.733 -9.513 -8.861 1.00 . A A . 76 LYS HZ1 1 1 2 1793 1 1 41 LYS HZ2 H -0.334 -10.093 -7.716 1.00 . A A . 76 LYS HZ2 1 1 2 1794 1 1 41 LYS HZ3 H 1.056 -10.961 -8.063 1.00 . A A . 76 LYS HZ3 1 1 2 1795 1 1 41 LYS N N 3.919 -5.019 -8.476 1.00 . A A . 76 LYS N 1 1 2 1796 1 1 41 LYS NZ N 0.674 -10.001 -7.945 1.00 . A A . 76 LYS NZ 1 1 2 1797 1 1 41 LYS O O 3.779 -7.137 -6.143 1.00 . A A . 76 LYS O 1 1 2 1798 1 1 42 LEU C C 3.077 -5.489 -3.108 1.00 . A A . 77 LEU C 1 1 2 1799 1 1 42 LEU CA C 4.142 -5.262 -4.126 1.00 . A A . 77 LEU CA 1 1 2 1800 1 1 42 LEU CB C 5.088 -4.111 -3.769 1.00 . A A . 77 LEU CB 1 1 2 1801 1 1 42 LEU CD1 C 3.547 -2.349 -2.667 1.00 . A A . 77 LEU CD1 1 1 2 1802 1 1 42 LEU CD2 C 5.623 -1.712 -3.719 1.00 . A A . 77 LEU CD2 1 1 2 1803 1 1 42 LEU CG C 4.509 -2.662 -3.788 1.00 . A A . 77 LEU CG 1 1 2 1804 1 1 42 LEU H H 3.324 -4.129 -5.682 1.00 . A A . 77 LEU H 1 1 2 1805 1 1 42 LEU HA H 4.729 -6.165 -4.187 1.00 . A A . 77 LEU HA 1 1 2 1806 1 1 42 LEU HB2 H 5.638 -4.282 -2.858 1.00 . A A . 77 LEU HB2 1 1 2 1807 1 1 42 LEU HB3 H 5.773 -4.108 -4.606 1.00 . A A . 77 LEU HB3 1 1 2 1808 1 1 42 LEU HD11 H 2.760 -3.087 -2.594 1.00 . A A . 77 LEU HD11 1 1 2 1809 1 1 42 LEU HD12 H 3.128 -1.361 -2.820 1.00 . A A . 77 LEU HD12 1 1 2 1810 1 1 42 LEU HD13 H 4.141 -2.344 -1.768 1.00 . A A . 77 LEU HD13 1 1 2 1811 1 1 42 LEU HD21 H 6.103 -1.820 -2.759 1.00 . A A . 77 LEU HD21 1 1 2 1812 1 1 42 LEU HD22 H 5.253 -0.704 -3.835 1.00 . A A . 77 LEU HD22 1 1 2 1813 1 1 42 LEU HD23 H 6.337 -1.942 -4.495 1.00 . A A . 77 LEU HD23 1 1 2 1814 1 1 42 LEU HG H 4.009 -2.490 -4.729 1.00 . A A . 77 LEU HG 1 1 2 1815 1 1 42 LEU N N 3.589 -5.040 -5.433 1.00 . A A . 77 LEU N 1 1 2 1816 1 1 42 LEU O O 3.358 -5.761 -1.938 1.00 . A A . 77 LEU O 1 1 2 1817 1 1 43 SER C C 0.728 -6.830 -1.951 1.00 . A A . 78 SER C 1 1 2 1818 1 1 43 SER CA C 0.711 -5.541 -2.776 1.00 . A A . 78 SER CA 1 1 2 1819 1 1 43 SER CB C -0.419 -5.592 -3.743 1.00 . A A . 78 SER CB 1 1 2 1820 1 1 43 SER H H 1.724 -5.285 -4.532 1.00 . A A . 78 SER H 1 1 2 1821 1 1 43 SER HA H 0.566 -4.676 -2.157 1.00 . A A . 78 SER HA 1 1 2 1822 1 1 43 SER HB2 H -0.491 -6.615 -4.061 1.00 . A A . 78 SER HB2 1 1 2 1823 1 1 43 SER HB3 H -1.337 -5.281 -3.265 1.00 . A A . 78 SER HB3 1 1 2 1824 1 1 43 SER HG H 0.031 -3.847 -4.511 1.00 . A A . 78 SER HG 1 1 2 1825 1 1 43 SER N N 1.867 -5.427 -3.575 1.00 . A A . 78 SER N 1 1 2 1826 1 1 43 SER O O 1.051 -7.898 -2.468 1.00 . A A . 78 SER O 1 1 2 1827 1 1 43 SER OG O -0.140 -4.736 -4.854 1.00 . A A . 78 SER OG 1 1 2 1828 1 1 44 LEU C C 1.170 -8.910 0.151 1.00 . A A . 79 LEU C 1 1 2 1829 1 1 44 LEU CA C 0.217 -7.713 0.327 1.00 . A A . 79 LEU CA 1 1 2 1830 1 1 44 LEU CB C -1.224 -8.141 0.456 1.00 . A A . 79 LEU CB 1 1 2 1831 1 1 44 LEU CD1 C -0.979 -9.494 2.536 1.00 . A A . 79 LEU CD1 1 1 2 1832 1 1 44 LEU CD2 C -1.612 -7.106 2.730 1.00 . A A . 79 LEU CD2 1 1 2 1833 1 1 44 LEU CG C -1.734 -8.380 1.890 1.00 . A A . 79 LEU CG 1 1 2 1834 1 1 44 LEU H H 0.122 -5.763 -0.425 1.00 . A A . 79 LEU H 1 1 2 1835 1 1 44 LEU HA H 0.498 -7.247 1.256 1.00 . A A . 79 LEU HA 1 1 2 1836 1 1 44 LEU HB2 H -1.820 -7.381 -0.023 1.00 . A A . 79 LEU HB2 1 1 2 1837 1 1 44 LEU HB3 H -1.316 -9.062 -0.096 1.00 . A A . 79 LEU HB3 1 1 2 1838 1 1 44 LEU HD11 H -1.114 -10.379 1.933 1.00 . A A . 79 LEU HD11 1 1 2 1839 1 1 44 LEU HD12 H -1.342 -9.643 3.540 1.00 . A A . 79 LEU HD12 1 1 2 1840 1 1 44 LEU HD13 H 0.061 -9.207 2.540 1.00 . A A . 79 LEU HD13 1 1 2 1841 1 1 44 LEU HD21 H -2.061 -7.261 3.699 1.00 . A A . 79 LEU HD21 1 1 2 1842 1 1 44 LEU HD22 H -2.080 -6.266 2.238 1.00 . A A . 79 LEU HD22 1 1 2 1843 1 1 44 LEU HD23 H -0.565 -6.886 2.868 1.00 . A A . 79 LEU HD23 1 1 2 1844 1 1 44 LEU HG H -2.772 -8.673 1.866 1.00 . A A . 79 LEU HG 1 1 2 1845 1 1 44 LEU N N 0.341 -6.676 -0.695 1.00 . A A . 79 LEU N 1 1 2 1846 1 1 44 LEU O O 0.809 -9.938 -0.447 1.00 . A A . 79 LEU O 1 1 2 1847 1 1 45 GLY C C 4.646 -9.232 1.087 1.00 . A A . 80 GLY C 1 1 2 1848 1 1 45 GLY CA C 3.351 -9.801 0.630 1.00 . A A . 80 GLY CA 1 1 2 1849 1 1 45 GLY H H 2.558 -7.954 1.194 1.00 . A A . 80 GLY H 1 1 2 1850 1 1 45 GLY HA2 H 3.074 -10.631 1.263 1.00 . A A . 80 GLY HA2 1 1 2 1851 1 1 45 GLY HA3 H 3.457 -10.133 -0.392 1.00 . A A . 80 GLY HA3 1 1 2 1852 1 1 45 GLY N N 2.344 -8.775 0.702 1.00 . A A . 80 GLY N 1 1 2 1853 1 1 45 GLY O O 5.169 -9.591 2.145 1.00 . A A . 80 GLY O 1 1 2 1854 1 1 46 SER C C 6.169 -6.178 0.077 1.00 . A A . 81 SER C 1 1 2 1855 1 1 46 SER CA C 6.304 -7.577 0.656 1.00 . A A . 81 SER CA 1 1 2 1856 1 1 46 SER CB C 7.558 -8.315 0.157 1.00 . A A . 81 SER CB 1 1 2 1857 1 1 46 SER H H 4.695 -8.126 -0.537 1.00 . A A . 81 SER H 1 1 2 1858 1 1 46 SER HA H 6.338 -7.502 1.733 1.00 . A A . 81 SER HA 1 1 2 1859 1 1 46 SER HB2 H 8.424 -7.677 0.254 1.00 . A A . 81 SER HB2 1 1 2 1860 1 1 46 SER HB3 H 7.686 -9.197 0.766 1.00 . A A . 81 SER HB3 1 1 2 1861 1 1 46 SER HG H 7.310 -9.683 -1.188 1.00 . A A . 81 SER HG 1 1 2 1862 1 1 46 SER N N 5.135 -8.318 0.319 1.00 . A A . 81 SER N 1 1 2 1863 1 1 46 SER O O 6.297 -5.969 -1.129 1.00 . A A . 81 SER O 1 1 2 1864 1 1 46 SER OG O 7.432 -8.725 -1.203 1.00 . A A . 81 SER OG 1 1 2 1865 1 1 47 TYR C C 6.233 -2.919 1.489 1.00 . A A . 82 TYR C 1 1 2 1866 1 1 47 TYR CA C 5.651 -3.890 0.512 1.00 . A A . 82 TYR CA 1 1 2 1867 1 1 47 TYR CB C 4.122 -3.654 0.376 1.00 . A A . 82 TYR CB 1 1 2 1868 1 1 47 TYR CD1 C 3.364 -2.858 2.659 1.00 . A A . 82 TYR CD1 1 1 2 1869 1 1 47 TYR CD2 C 2.388 -4.854 1.814 1.00 . A A . 82 TYR CD2 1 1 2 1870 1 1 47 TYR CE1 C 2.602 -2.946 3.790 1.00 . A A . 82 TYR CE1 1 1 2 1871 1 1 47 TYR CE2 C 1.620 -4.948 2.955 1.00 . A A . 82 TYR CE2 1 1 2 1872 1 1 47 TYR CG C 3.285 -3.803 1.648 1.00 . A A . 82 TYR CG 1 1 2 1873 1 1 47 TYR CZ C 1.735 -3.988 3.939 1.00 . A A . 82 TYR CZ 1 1 2 1874 1 1 47 TYR H H 5.871 -5.383 1.902 1.00 . A A . 82 TYR H 1 1 2 1875 1 1 47 TYR HA H 6.110 -3.720 -0.452 1.00 . A A . 82 TYR HA 1 1 2 1876 1 1 47 TYR HB2 H 3.945 -2.647 0.035 1.00 . A A . 82 TYR HB2 1 1 2 1877 1 1 47 TYR HB3 H 3.733 -4.340 -0.360 1.00 . A A . 82 TYR HB3 1 1 2 1878 1 1 47 TYR HD1 H 4.067 -2.050 2.532 1.00 . A A . 82 TYR HD1 1 1 2 1879 1 1 47 TYR HD2 H 2.285 -5.614 1.054 1.00 . A A . 82 TYR HD2 1 1 2 1880 1 1 47 TYR HE1 H 2.687 -2.194 4.560 1.00 . A A . 82 TYR HE1 1 1 2 1881 1 1 47 TYR HE2 H 0.935 -5.774 3.068 1.00 . A A . 82 TYR HE2 1 1 2 1882 1 1 47 TYR HH H 0.627 -3.176 5.227 1.00 . A A . 82 TYR HH 1 1 2 1883 1 1 47 TYR N N 5.915 -5.225 0.931 1.00 . A A . 82 TYR N 1 1 2 1884 1 1 47 TYR O O 6.675 -3.304 2.570 1.00 . A A . 82 TYR O 1 1 2 1885 1 1 47 TYR OH O 0.966 -4.064 5.074 1.00 . A A . 82 TYR OH 1 1 2 1886 1 1 48 ALA C C 5.675 0.498 1.695 1.00 . A A . 83 ALA C 1 1 2 1887 1 1 48 ALA CA C 6.652 -0.630 1.950 1.00 . A A . 83 ALA CA 1 1 2 1888 1 1 48 ALA CB C 8.072 -0.204 1.686 1.00 . A A . 83 ALA CB 1 1 2 1889 1 1 48 ALA H H 6.062 -1.465 0.164 1.00 . A A . 83 ALA H 1 1 2 1890 1 1 48 ALA HA H 6.557 -0.970 2.970 1.00 . A A . 83 ALA HA 1 1 2 1891 1 1 48 ALA HB1 H 8.736 -1.033 1.879 1.00 . A A . 83 ALA HB1 1 1 2 1892 1 1 48 ALA HB2 H 8.325 0.620 2.337 1.00 . A A . 83 ALA HB2 1 1 2 1893 1 1 48 ALA HB3 H 8.172 0.105 0.655 1.00 . A A . 83 ALA HB3 1 1 2 1894 1 1 48 ALA N N 6.286 -1.699 1.091 1.00 . A A . 83 ALA N 1 1 2 1895 1 1 48 ALA O O 5.341 0.786 0.554 1.00 . A A . 83 ALA O 1 1 2 1896 1 1 49 ALA C C 4.580 3.336 3.317 1.00 . A A . 84 ALA C 1 1 2 1897 1 1 49 ALA CA C 4.205 2.128 2.518 1.00 . A A . 84 ALA CA 1 1 2 1898 1 1 49 ALA CB C 2.813 1.645 2.878 1.00 . A A . 84 ALA CB 1 1 2 1899 1 1 49 ALA H H 5.428 0.828 3.621 1.00 . A A . 84 ALA H 1 1 2 1900 1 1 49 ALA HA H 4.208 2.387 1.470 1.00 . A A . 84 ALA HA 1 1 2 1901 1 1 49 ALA HB1 H 2.103 2.437 2.696 1.00 . A A . 84 ALA HB1 1 1 2 1902 1 1 49 ALA HB2 H 2.785 1.351 3.917 1.00 . A A . 84 ALA HB2 1 1 2 1903 1 1 49 ALA HB3 H 2.567 0.795 2.259 1.00 . A A . 84 ALA HB3 1 1 2 1904 1 1 49 ALA N N 5.162 1.082 2.711 1.00 . A A . 84 ALA N 1 1 2 1905 1 1 49 ALA O O 4.985 3.211 4.480 1.00 . A A . 84 ALA O 1 1 2 1906 1 1 50 LEU C C 3.576 6.610 3.112 1.00 . A A . 85 LEU C 1 1 2 1907 1 1 50 LEU CA C 4.741 5.710 3.367 1.00 . A A . 85 LEU CA 1 1 2 1908 1 1 50 LEU CB C 6.022 6.368 2.823 1.00 . A A . 85 LEU CB 1 1 2 1909 1 1 50 LEU CD1 C 7.015 7.371 4.865 1.00 . A A . 85 LEU CD1 1 1 2 1910 1 1 50 LEU CD2 C 7.380 8.503 2.710 1.00 . A A . 85 LEU CD2 1 1 2 1911 1 1 50 LEU CG C 6.434 7.659 3.523 1.00 . A A . 85 LEU CG 1 1 2 1912 1 1 50 LEU H H 4.177 4.566 1.775 1.00 . A A . 85 LEU H 1 1 2 1913 1 1 50 LEU HA H 4.856 5.529 4.422 1.00 . A A . 85 LEU HA 1 1 2 1914 1 1 50 LEU HB2 H 6.808 5.659 3.013 1.00 . A A . 85 LEU HB2 1 1 2 1915 1 1 50 LEU HB3 H 5.954 6.542 1.763 1.00 . A A . 85 LEU HB3 1 1 2 1916 1 1 50 LEU HD11 H 6.318 6.797 5.455 1.00 . A A . 85 LEU HD11 1 1 2 1917 1 1 50 LEU HD12 H 7.198 8.324 5.339 1.00 . A A . 85 LEU HD12 1 1 2 1918 1 1 50 LEU HD13 H 7.937 6.826 4.715 1.00 . A A . 85 LEU HD13 1 1 2 1919 1 1 50 LEU HD21 H 8.279 7.945 2.493 1.00 . A A . 85 LEU HD21 1 1 2 1920 1 1 50 LEU HD22 H 7.629 9.375 3.298 1.00 . A A . 85 LEU HD22 1 1 2 1921 1 1 50 LEU HD23 H 6.903 8.809 1.790 1.00 . A A . 85 LEU HD23 1 1 2 1922 1 1 50 LEU HG H 5.531 8.223 3.687 1.00 . A A . 85 LEU HG 1 1 2 1923 1 1 50 LEU N N 4.474 4.483 2.712 1.00 . A A . 85 LEU N 1 1 2 1924 1 1 50 LEU O O 2.827 6.393 2.164 1.00 . A A . 85 LEU O 1 1 2 1925 1 1 51 HIS C C 2.563 9.219 2.411 1.00 . A A . 86 HIS C 1 1 2 1926 1 1 51 HIS CA C 2.393 8.594 3.793 1.00 . A A . 86 HIS CA 1 1 2 1927 1 1 51 HIS CB C 2.504 9.669 4.917 1.00 . A A . 86 HIS CB 1 1 2 1928 1 1 51 HIS CD2 C 4.912 10.709 4.557 1.00 . A A . 86 HIS CD2 1 1 2 1929 1 1 51 HIS CE1 C 5.689 10.393 6.562 1.00 . A A . 86 HIS CE1 1 1 2 1930 1 1 51 HIS CG C 3.925 10.111 5.282 1.00 . A A . 86 HIS CG 1 1 2 1931 1 1 51 HIS H H 3.878 7.503 4.834 1.00 . A A . 86 HIS H 1 1 2 1932 1 1 51 HIS HA H 1.415 8.139 3.843 1.00 . A A . 86 HIS HA 1 1 2 1933 1 1 51 HIS HB2 H 1.965 10.549 4.602 1.00 . A A . 86 HIS HB2 1 1 2 1934 1 1 51 HIS HB3 H 2.039 9.279 5.810 1.00 . A A . 86 HIS HB3 1 1 2 1935 1 1 51 HIS HD1 H 3.998 9.544 7.314 1.00 . A A . 86 HIS HD1 1 1 2 1936 1 1 51 HIS HD2 H 4.881 10.960 3.508 1.00 . A A . 86 HIS HD2 1 1 2 1937 1 1 51 HIS HE1 H 6.363 10.353 7.402 1.00 . A A . 86 HIS HE1 1 1 2 1938 1 1 51 HIS HE2 H 6.897 11.142 5.123 1.00 . A A . 86 HIS HE2 1 1 2 1939 1 1 51 HIS N N 3.374 7.551 3.994 1.00 . A A . 86 HIS N 1 1 2 1940 1 1 51 HIS ND1 N 4.458 9.935 6.536 1.00 . A A . 86 HIS ND1 1 1 2 1941 1 1 51 HIS NE2 N 5.988 10.869 5.385 1.00 . A A . 86 HIS NE2 1 1 2 1942 1 1 51 HIS O O 3.626 9.741 2.078 1.00 . A A . 86 HIS O 1 1 2 1943 1 1 52 GLY C C 1.856 8.633 -0.790 1.00 . A A . 87 GLY C 1 1 2 1944 1 1 52 GLY CA C 1.560 9.658 0.297 1.00 . A A . 87 GLY CA 1 1 2 1945 1 1 52 GLY H H 0.751 8.591 1.892 1.00 . A A . 87 GLY H 1 1 2 1946 1 1 52 GLY HA2 H 0.599 10.107 0.095 1.00 . A A . 87 GLY HA2 1 1 2 1947 1 1 52 GLY HA3 H 2.320 10.425 0.262 1.00 . A A . 87 GLY HA3 1 1 2 1948 1 1 52 GLY N N 1.540 9.101 1.610 1.00 . A A . 87 GLY N 1 1 2 1949 1 1 52 GLY O O 1.170 8.609 -1.821 1.00 . A A . 87 GLY O 1 1 2 1950 1 1 53 GLU C C 3.573 5.453 -1.094 1.00 . A A . 88 GLU C 1 1 2 1951 1 1 53 GLU CA C 3.291 6.856 -1.625 1.00 . A A . 88 GLU CA 1 1 2 1952 1 1 53 GLU CB C 4.567 7.396 -2.304 1.00 . A A . 88 GLU CB 1 1 2 1953 1 1 53 GLU CD C 5.694 9.385 -3.410 1.00 . A A . 88 GLU CD 1 1 2 1954 1 1 53 GLU CG C 4.419 8.813 -2.837 1.00 . A A . 88 GLU CG 1 1 2 1955 1 1 53 GLU H H 3.269 7.688 0.309 1.00 . A A . 88 GLU H 1 1 2 1956 1 1 53 GLU HA H 2.512 6.828 -2.369 1.00 . A A . 88 GLU HA 1 1 2 1957 1 1 53 GLU HB2 H 5.417 7.343 -1.641 1.00 . A A . 88 GLU HB2 1 1 2 1958 1 1 53 GLU HB3 H 4.750 6.770 -3.166 1.00 . A A . 88 GLU HB3 1 1 2 1959 1 1 53 GLU HG2 H 3.658 8.805 -3.601 1.00 . A A . 88 GLU HG2 1 1 2 1960 1 1 53 GLU HG3 H 4.080 9.429 -2.019 1.00 . A A . 88 GLU HG3 1 1 2 1961 1 1 53 GLU N N 2.853 7.767 -0.575 1.00 . A A . 88 GLU N 1 1 2 1962 1 1 53 GLU O O 4.139 5.281 -0.015 1.00 . A A . 88 GLU O 1 1 2 1963 1 1 53 GLU OE1 O 6.038 9.082 -4.577 1.00 . A A . 88 GLU OE1 1 1 2 1964 1 1 53 GLU OE2 O 6.356 10.192 -2.737 1.00 . A A . 88 GLU OE2 1 1 2 1965 1 1 54 PHE C C 4.747 2.807 -2.376 1.00 . A A . 89 PHE C 1 1 2 1966 1 1 54 PHE CA C 3.537 3.097 -1.561 1.00 . A A . 89 PHE CA 1 1 2 1967 1 1 54 PHE CB C 2.364 2.158 -1.920 1.00 . A A . 89 PHE CB 1 1 2 1968 1 1 54 PHE CD1 C 0.327 3.593 -1.569 1.00 . A A . 89 PHE CD1 1 1 2 1969 1 1 54 PHE CD2 C 0.751 1.835 -0.011 1.00 . A A . 89 PHE CD2 1 1 2 1970 1 1 54 PHE CE1 C -0.779 3.968 -0.858 1.00 . A A . 89 PHE CE1 1 1 2 1971 1 1 54 PHE CE2 C -0.348 2.215 0.710 1.00 . A A . 89 PHE CE2 1 1 2 1972 1 1 54 PHE CG C 1.111 2.520 -1.162 1.00 . A A . 89 PHE CG 1 1 2 1973 1 1 54 PHE CZ C -1.118 3.290 0.282 1.00 . A A . 89 PHE CZ 1 1 2 1974 1 1 54 PHE H H 2.736 4.611 -2.706 1.00 . A A . 89 PHE H 1 1 2 1975 1 1 54 PHE HA H 3.779 3.025 -0.509 1.00 . A A . 89 PHE HA 1 1 2 1976 1 1 54 PHE HB2 H 2.156 2.167 -2.980 1.00 . A A . 89 PHE HB2 1 1 2 1977 1 1 54 PHE HB3 H 2.643 1.159 -1.632 1.00 . A A . 89 PHE HB3 1 1 2 1978 1 1 54 PHE HD1 H 0.585 4.129 -2.470 1.00 . A A . 89 PHE HD1 1 1 2 1979 1 1 54 PHE HD2 H 1.323 0.991 0.343 1.00 . A A . 89 PHE HD2 1 1 2 1980 1 1 54 PHE HE1 H -1.377 4.805 -1.188 1.00 . A A . 89 PHE HE1 1 1 2 1981 1 1 54 PHE HE2 H -0.612 1.658 1.601 1.00 . A A . 89 PHE HE2 1 1 2 1982 1 1 54 PHE HZ H -1.986 3.606 0.841 1.00 . A A . 89 PHE HZ 1 1 2 1983 1 1 54 PHE N N 3.223 4.458 -1.874 1.00 . A A . 89 PHE N 1 1 2 1984 1 1 54 PHE O O 4.793 3.143 -3.562 1.00 . A A . 89 PHE O 1 1 2 1985 1 1 55 TYR C C 7.510 0.794 -2.246 1.00 . A A . 90 TYR C 1 1 2 1986 1 1 55 TYR CA C 6.989 2.180 -2.423 1.00 . A A . 90 TYR CA 1 1 2 1987 1 1 55 TYR CB C 7.890 3.192 -1.719 1.00 . A A . 90 TYR CB 1 1 2 1988 1 1 55 TYR CD1 C 7.465 5.203 -3.137 1.00 . A A . 90 TYR CD1 1 1 2 1989 1 1 55 TYR CD2 C 9.716 4.524 -2.826 1.00 . A A . 90 TYR CD2 1 1 2 1990 1 1 55 TYR CE1 C 7.871 6.255 -3.905 1.00 . A A . 90 TYR CE1 1 1 2 1991 1 1 55 TYR CE2 C 10.134 5.584 -3.601 1.00 . A A . 90 TYR CE2 1 1 2 1992 1 1 55 TYR CG C 8.376 4.314 -2.583 1.00 . A A . 90 TYR CG 1 1 2 1993 1 1 55 TYR CZ C 9.202 6.448 -4.137 1.00 . A A . 90 TYR CZ 1 1 2 1994 1 1 55 TYR H H 5.617 1.823 -0.903 1.00 . A A . 90 TYR H 1 1 2 1995 1 1 55 TYR HA H 6.906 2.446 -3.466 1.00 . A A . 90 TYR HA 1 1 2 1996 1 1 55 TYR HB2 H 7.180 3.738 -1.111 1.00 . A A . 90 TYR HB2 1 1 2 1997 1 1 55 TYR HB3 H 8.668 2.778 -1.098 1.00 . A A . 90 TYR HB3 1 1 2 1998 1 1 55 TYR HD1 H 6.410 5.062 -2.958 1.00 . A A . 90 TYR HD1 1 1 2 1999 1 1 55 TYR HD2 H 10.448 3.849 -2.409 1.00 . A A . 90 TYR HD2 1 1 2 2000 1 1 55 TYR HE1 H 7.134 6.927 -4.317 1.00 . A A . 90 TYR HE1 1 1 2 2001 1 1 55 TYR HE2 H 11.190 5.730 -3.773 1.00 . A A . 90 TYR HE2 1 1 2 2002 1 1 55 TYR HH H 9.191 8.296 -4.527 1.00 . A A . 90 TYR HH 1 1 2 2003 1 1 55 TYR N N 5.728 2.249 -1.787 1.00 . A A . 90 TYR N 1 1 2 2004 1 1 55 TYR O O 7.170 0.129 -1.292 1.00 . A A . 90 TYR O 1 1 2 2005 1 1 55 TYR OH O 9.604 7.510 -4.912 1.00 . A A . 90 TYR OH 1 1 2 2006 1 1 56 CYS C C 9.954 -0.894 -2.037 1.00 . A A . 91 CYS C 1 1 2 2007 1 1 56 CYS CA C 8.807 -0.995 -2.997 1.00 . A A . 91 CYS CA 1 1 2 2008 1 1 56 CYS CB C 9.261 -1.630 -4.327 1.00 . A A . 91 CYS CB 1 1 2 2009 1 1 56 CYS H H 8.494 0.856 -3.958 1.00 . A A . 91 CYS H 1 1 2 2010 1 1 56 CYS HA H 8.025 -1.597 -2.553 1.00 . A A . 91 CYS HA 1 1 2 2011 1 1 56 CYS HB2 H 9.573 -2.645 -4.133 1.00 . A A . 91 CYS HB2 1 1 2 2012 1 1 56 CYS HB3 H 8.439 -1.665 -5.021 1.00 . A A . 91 CYS HB3 1 1 2 2013 1 1 56 CYS N N 8.276 0.317 -3.173 1.00 . A A . 91 CYS N 1 1 2 2014 1 1 56 CYS O O 10.586 0.156 -2.014 1.00 . A A . 91 CYS O 1 1 2 2015 1 1 56 CYS SG S 10.634 -0.788 -5.142 1.00 . A A . 91 CYS SG 1 1 2 2016 1 1 57 LYS C C 12.664 -1.410 -0.960 1.00 . A A . 92 LYS C 1 1 2 2017 1 1 57 LYS CA C 11.313 -1.880 -0.323 1.00 . A A . 92 LYS CA 1 1 2 2018 1 1 57 LYS CB C 11.449 -3.257 0.328 1.00 . A A . 92 LYS CB 1 1 2 2019 1 1 57 LYS CD C 10.369 -5.091 1.639 1.00 . A A . 92 LYS CD 1 1 2 2020 1 1 57 LYS CE C 9.162 -5.546 2.452 1.00 . A A . 92 LYS CE 1 1 2 2021 1 1 57 LYS CG C 10.193 -3.704 1.070 1.00 . A A . 92 LYS CG 1 1 2 2022 1 1 57 LYS H H 9.643 -2.693 -1.229 1.00 . A A . 92 LYS H 1 1 2 2023 1 1 57 LYS HA H 11.040 -1.172 0.446 1.00 . A A . 92 LYS HA 1 1 2 2024 1 1 57 LYS HB2 H 11.658 -3.986 -0.440 1.00 . A A . 92 LYS HB2 1 1 2 2025 1 1 57 LYS HB3 H 12.271 -3.240 1.028 1.00 . A A . 92 LYS HB3 1 1 2 2026 1 1 57 LYS HD2 H 10.516 -5.785 0.824 1.00 . A A . 92 LYS HD2 1 1 2 2027 1 1 57 LYS HD3 H 11.245 -5.090 2.269 1.00 . A A . 92 LYS HD3 1 1 2 2028 1 1 57 LYS HE2 H 8.308 -5.612 1.796 1.00 . A A . 92 LYS HE2 1 1 2 2029 1 1 57 LYS HE3 H 9.377 -6.527 2.849 1.00 . A A . 92 LYS HE3 1 1 2 2030 1 1 57 LYS HG2 H 10.003 -3.017 1.881 1.00 . A A . 92 LYS HG2 1 1 2 2031 1 1 57 LYS HG3 H 9.349 -3.704 0.396 1.00 . A A . 92 LYS HG3 1 1 2 2032 1 1 57 LYS HZ1 H 9.669 -4.291 4.097 1.00 . A A . 92 LYS HZ1 1 1 2 2033 1 1 57 LYS HZ2 H 8.269 -5.151 4.282 1.00 . A A . 92 LYS HZ2 1 1 2 2034 1 1 57 LYS HZ3 H 8.250 -3.810 3.292 1.00 . A A . 92 LYS HZ3 1 1 2 2035 1 1 57 LYS N N 10.230 -1.913 -1.270 1.00 . A A . 92 LYS N 1 1 2 2036 1 1 57 LYS NZ N 8.831 -4.629 3.577 1.00 . A A . 92 LYS NZ 1 1 2 2037 1 1 57 LYS O O 13.305 -0.538 -0.369 1.00 . A A . 92 LYS O 1 1 2 2038 1 1 58 PRO C C 14.244 0.156 -3.056 1.00 . A A . 93 PRO C 1 1 2 2039 1 1 58 PRO CA C 14.313 -1.375 -2.825 1.00 . A A . 93 PRO CA 1 1 2 2040 1 1 58 PRO CB C 14.361 -2.109 -4.167 1.00 . A A . 93 PRO CB 1 1 2 2041 1 1 58 PRO CD C 12.479 -2.980 -3.003 1.00 . A A . 93 PRO CD 1 1 2 2042 1 1 58 PRO CG C 13.563 -3.346 -3.955 1.00 . A A . 93 PRO CG 1 1 2 2043 1 1 58 PRO HA H 15.191 -1.606 -2.240 1.00 . A A . 93 PRO HA 1 1 2 2044 1 1 58 PRO HB2 H 13.926 -1.478 -4.928 1.00 . A A . 93 PRO HB2 1 1 2 2045 1 1 58 PRO HB3 H 15.385 -2.337 -4.421 1.00 . A A . 93 PRO HB3 1 1 2 2046 1 1 58 PRO HD2 H 11.622 -2.632 -3.560 1.00 . A A . 93 PRO HD2 1 1 2 2047 1 1 58 PRO HD3 H 12.215 -3.830 -2.392 1.00 . A A . 93 PRO HD3 1 1 2 2048 1 1 58 PRO HG2 H 13.139 -3.688 -4.887 1.00 . A A . 93 PRO HG2 1 1 2 2049 1 1 58 PRO HG3 H 14.174 -4.120 -3.522 1.00 . A A . 93 PRO HG3 1 1 2 2050 1 1 58 PRO N N 13.091 -1.895 -2.186 1.00 . A A . 93 PRO N 1 1 2 2051 1 1 58 PRO O O 15.146 0.890 -2.660 1.00 . A A . 93 PRO O 1 1 2 2052 1 1 59 HIS C C 12.818 2.870 -2.605 1.00 . A A . 94 HIS C 1 1 2 2053 1 1 59 HIS CA C 12.987 2.087 -3.882 1.00 . A A . 94 HIS CA 1 1 2 2054 1 1 59 HIS CB C 11.857 2.430 -4.875 1.00 . A A . 94 HIS CB 1 1 2 2055 1 1 59 HIS CD2 C 13.426 2.338 -6.877 1.00 . A A . 94 HIS CD2 1 1 2 2056 1 1 59 HIS CE1 C 11.961 1.838 -8.401 1.00 . A A . 94 HIS CE1 1 1 2 2057 1 1 59 HIS CG C 12.222 2.227 -6.305 1.00 . A A . 94 HIS CG 1 1 2 2058 1 1 59 HIS H H 12.434 0.008 -3.888 1.00 . A A . 94 HIS H 1 1 2 2059 1 1 59 HIS HA H 13.925 2.408 -4.312 1.00 . A A . 94 HIS HA 1 1 2 2060 1 1 59 HIS HB2 H 10.995 1.814 -4.666 1.00 . A A . 94 HIS HB2 1 1 2 2061 1 1 59 HIS HB3 H 11.594 3.468 -4.746 1.00 . A A . 94 HIS HB3 1 1 2 2062 1 1 59 HIS HD2 H 14.335 2.581 -6.348 1.00 . A A . 94 HIS HD2 1 1 2 2063 1 1 59 HIS HE1 H 11.511 1.602 -9.356 1.00 . A A . 94 HIS HE1 1 1 2 2064 1 1 59 HIS HE2 H 13.954 1.631 -8.753 1.00 . A A . 94 HIS HE2 1 1 2 2065 1 1 59 HIS N N 13.144 0.640 -3.636 1.00 . A A . 94 HIS N 1 1 2 2066 1 1 59 HIS ND1 N 11.289 1.915 -7.262 1.00 . A A . 94 HIS ND1 1 1 2 2067 1 1 59 HIS NE2 N 13.267 2.087 -8.218 1.00 . A A . 94 HIS NE2 1 1 2 2068 1 1 59 HIS O O 13.252 4.000 -2.507 1.00 . A A . 94 HIS O 1 1 2 2069 1 1 60 PHE C C 13.323 3.130 0.289 1.00 . A A . 95 PHE C 1 1 2 2070 1 1 60 PHE CA C 11.962 2.871 -0.355 1.00 . A A . 95 PHE CA 1 1 2 2071 1 1 60 PHE CB C 11.136 1.886 0.475 1.00 . A A . 95 PHE CB 1 1 2 2072 1 1 60 PHE CD1 C 9.714 3.573 1.642 1.00 . A A . 95 PHE CD1 1 1 2 2073 1 1 60 PHE CD2 C 10.546 1.739 2.895 1.00 . A A . 95 PHE CD2 1 1 2 2074 1 1 60 PHE CE1 C 9.060 4.042 2.752 1.00 . A A . 95 PHE CE1 1 1 2 2075 1 1 60 PHE CE2 C 9.884 2.194 4.012 1.00 . A A . 95 PHE CE2 1 1 2 2076 1 1 60 PHE CG C 10.465 2.421 1.698 1.00 . A A . 95 PHE CG 1 1 2 2077 1 1 60 PHE CZ C 9.140 3.355 3.942 1.00 . A A . 95 PHE CZ 1 1 2 2078 1 1 60 PHE H H 11.837 1.364 -1.812 1.00 . A A . 95 PHE H 1 1 2 2079 1 1 60 PHE HA H 11.420 3.801 -0.463 1.00 . A A . 95 PHE HA 1 1 2 2080 1 1 60 PHE HB2 H 10.365 1.464 -0.151 1.00 . A A . 95 PHE HB2 1 1 2 2081 1 1 60 PHE HB3 H 11.800 1.089 0.776 1.00 . A A . 95 PHE HB3 1 1 2 2082 1 1 60 PHE HD1 H 9.645 4.117 0.712 1.00 . A A . 95 PHE HD1 1 1 2 2083 1 1 60 PHE HD2 H 11.131 0.835 2.948 1.00 . A A . 95 PHE HD2 1 1 2 2084 1 1 60 PHE HE1 H 8.488 4.952 2.680 1.00 . A A . 95 PHE HE1 1 1 2 2085 1 1 60 PHE HE2 H 9.957 1.647 4.940 1.00 . A A . 95 PHE HE2 1 1 2 2086 1 1 60 PHE HZ H 8.617 3.718 4.814 1.00 . A A . 95 PHE HZ 1 1 2 2087 1 1 60 PHE N N 12.186 2.271 -1.648 1.00 . A A . 95 PHE N 1 1 2 2088 1 1 60 PHE O O 13.584 4.211 0.812 1.00 . A A . 95 PHE O 1 1 2 2089 1 1 61 GLN C C 16.406 3.236 -0.054 1.00 . A A . 96 GLN C 1 1 2 2090 1 1 61 GLN CA C 15.543 2.241 0.735 1.00 . A A . 96 GLN CA 1 1 2 2091 1 1 61 GLN CB C 16.218 0.878 0.818 1.00 . A A . 96 GLN CB 1 1 2 2092 1 1 61 GLN CD C 16.229 -1.429 1.881 1.00 . A A . 96 GLN CD 1 1 2 2093 1 1 61 GLN CG C 15.539 -0.081 1.787 1.00 . A A . 96 GLN CG 1 1 2 2094 1 1 61 GLN H H 13.904 1.292 -0.197 1.00 . A A . 96 GLN H 1 1 2 2095 1 1 61 GLN HA H 15.460 2.637 1.736 1.00 . A A . 96 GLN HA 1 1 2 2096 1 1 61 GLN HB2 H 16.204 0.431 -0.164 1.00 . A A . 96 GLN HB2 1 1 2 2097 1 1 61 GLN HB3 H 17.242 1.014 1.132 1.00 . A A . 96 GLN HB3 1 1 2 2098 1 1 61 GLN HE21 H 17.990 -0.592 1.556 1.00 . A A . 96 GLN HE21 1 1 2 2099 1 1 61 GLN HE22 H 17.994 -2.292 1.753 1.00 . A A . 96 GLN HE22 1 1 2 2100 1 1 61 GLN HG2 H 15.529 0.363 2.771 1.00 . A A . 96 GLN HG2 1 1 2 2101 1 1 61 GLN HG3 H 14.522 -0.236 1.458 1.00 . A A . 96 GLN HG3 1 1 2 2102 1 1 61 GLN N N 14.185 2.136 0.228 1.00 . A A . 96 GLN N 1 1 2 2103 1 1 61 GLN NE2 N 17.521 -1.434 1.722 1.00 . A A . 96 GLN NE2 1 1 2 2104 1 1 61 GLN O O 17.145 4.014 0.531 1.00 . A A . 96 GLN O 1 1 2 2105 1 1 61 GLN OE1 O 15.587 -2.463 2.120 1.00 . A A . 96 GLN OE1 1 1 2 2106 1 1 62 GLN C C 16.666 5.515 -2.223 1.00 . A A . 97 GLN C 1 1 2 2107 1 1 62 GLN CA C 17.156 4.050 -2.202 1.00 . A A . 97 GLN CA 1 1 2 2108 1 1 62 GLN CB C 17.138 3.499 -3.629 1.00 . A A . 97 GLN CB 1 1 2 2109 1 1 62 GLN CD C 17.677 1.587 -5.222 1.00 . A A . 97 GLN CD 1 1 2 2110 1 1 62 GLN CG C 17.795 2.137 -3.802 1.00 . A A . 97 GLN CG 1 1 2 2111 1 1 62 GLN H H 15.764 2.539 -1.841 1.00 . A A . 97 GLN H 1 1 2 2112 1 1 62 GLN HA H 18.176 4.006 -1.851 1.00 . A A . 97 GLN HA 1 1 2 2113 1 1 62 GLN HB2 H 16.109 3.413 -3.946 1.00 . A A . 97 GLN HB2 1 1 2 2114 1 1 62 GLN HB3 H 17.633 4.210 -4.264 1.00 . A A . 97 GLN HB3 1 1 2 2115 1 1 62 GLN HE21 H 19.392 0.631 -5.016 1.00 . A A . 97 GLN HE21 1 1 2 2116 1 1 62 GLN HE22 H 18.622 0.444 -6.536 1.00 . A A . 97 GLN HE22 1 1 2 2117 1 1 62 GLN HG2 H 18.844 2.227 -3.560 1.00 . A A . 97 GLN HG2 1 1 2 2118 1 1 62 GLN HG3 H 17.331 1.438 -3.121 1.00 . A A . 97 GLN HG3 1 1 2 2119 1 1 62 GLN N N 16.338 3.188 -1.377 1.00 . A A . 97 GLN N 1 1 2 2120 1 1 62 GLN NE2 N 18.648 0.818 -5.631 1.00 . A A . 97 GLN NE2 1 1 2 2121 1 1 62 GLN O O 17.416 6.443 -1.910 1.00 . A A . 97 GLN O 1 1 2 2122 1 1 62 GLN OE1 O 16.705 1.860 -5.948 1.00 . A A . 97 GLN OE1 1 1 2 2123 1 1 63 LEU C C 14.420 7.698 -1.422 1.00 . A A . 98 LEU C 1 1 2 2124 1 1 63 LEU CA C 14.814 7.008 -2.714 1.00 . A A . 98 LEU CA 1 1 2 2125 1 1 63 LEU CB C 13.639 6.899 -3.643 1.00 . A A . 98 LEU CB 1 1 2 2126 1 1 63 LEU CD1 C 12.804 6.043 -5.782 1.00 . A A . 98 LEU CD1 1 1 2 2127 1 1 63 LEU CD2 C 14.446 7.856 -5.814 1.00 . A A . 98 LEU CD2 1 1 2 2128 1 1 63 LEU CG C 13.991 6.595 -5.094 1.00 . A A . 98 LEU CG 1 1 2 2129 1 1 63 LEU H H 14.836 4.913 -2.676 1.00 . A A . 98 LEU H 1 1 2 2130 1 1 63 LEU HA H 15.548 7.613 -3.223 1.00 . A A . 98 LEU HA 1 1 2 2131 1 1 63 LEU HB2 H 13.022 6.099 -3.265 1.00 . A A . 98 LEU HB2 1 1 2 2132 1 1 63 LEU HB3 H 13.079 7.822 -3.608 1.00 . A A . 98 LEU HB3 1 1 2 2133 1 1 63 LEU HD11 H 11.997 6.755 -5.704 1.00 . A A . 98 LEU HD11 1 1 2 2134 1 1 63 LEU HD12 H 12.539 5.122 -5.288 1.00 . A A . 98 LEU HD12 1 1 2 2135 1 1 63 LEU HD13 H 13.039 5.858 -6.819 1.00 . A A . 98 LEU HD13 1 1 2 2136 1 1 63 LEU HD21 H 15.375 8.213 -5.397 1.00 . A A . 98 LEU HD21 1 1 2 2137 1 1 63 LEU HD22 H 13.683 8.609 -5.680 1.00 . A A . 98 LEU HD22 1 1 2 2138 1 1 63 LEU HD23 H 14.554 7.659 -6.872 1.00 . A A . 98 LEU HD23 1 1 2 2139 1 1 63 LEU HG H 14.792 5.872 -5.140 1.00 . A A . 98 LEU HG 1 1 2 2140 1 1 63 LEU N N 15.417 5.696 -2.547 1.00 . A A . 98 LEU N 1 1 2 2141 1 1 63 LEU O O 14.620 8.899 -1.275 1.00 . A A . 98 LEU O 1 1 2 2142 1 1 64 PHE C C 14.333 7.345 1.889 1.00 . A A . 99 PHE C 1 1 2 2143 1 1 64 PHE CA C 13.355 7.565 0.744 1.00 . A A . 99 PHE CA 1 1 2 2144 1 1 64 PHE CB C 11.968 7.022 1.139 1.00 . A A . 99 PHE CB 1 1 2 2145 1 1 64 PHE CD1 C 10.949 8.507 -0.635 1.00 . A A . 99 PHE CD1 1 1 2 2146 1 1 64 PHE CD2 C 9.540 6.944 0.482 1.00 . A A . 99 PHE CD2 1 1 2 2147 1 1 64 PHE CE1 C 9.878 8.931 -1.381 1.00 . A A . 99 PHE CE1 1 1 2 2148 1 1 64 PHE CE2 C 8.470 7.377 -0.271 1.00 . A A . 99 PHE CE2 1 1 2 2149 1 1 64 PHE CG C 10.801 7.504 0.311 1.00 . A A . 99 PHE CG 1 1 2 2150 1 1 64 PHE CZ C 8.646 8.371 -1.201 1.00 . A A . 99 PHE CZ 1 1 2 2151 1 1 64 PHE H H 13.662 6.001 -0.657 1.00 . A A . 99 PHE H 1 1 2 2152 1 1 64 PHE HA H 13.268 8.628 0.585 1.00 . A A . 99 PHE HA 1 1 2 2153 1 1 64 PHE HB2 H 12.002 5.974 0.883 1.00 . A A . 99 PHE HB2 1 1 2 2154 1 1 64 PHE HB3 H 11.768 7.141 2.191 1.00 . A A . 99 PHE HB3 1 1 2 2155 1 1 64 PHE HD1 H 11.915 8.963 -0.796 1.00 . A A . 99 PHE HD1 1 1 2 2156 1 1 64 PHE HD2 H 9.381 6.166 1.217 1.00 . A A . 99 PHE HD2 1 1 2 2157 1 1 64 PHE HE1 H 9.992 9.710 -2.117 1.00 . A A . 99 PHE HE1 1 1 2 2158 1 1 64 PHE HE2 H 7.495 6.934 -0.128 1.00 . A A . 99 PHE HE2 1 1 2 2159 1 1 64 PHE HZ H 7.822 8.724 -1.801 1.00 . A A . 99 PHE HZ 1 1 2 2160 1 1 64 PHE N N 13.826 6.956 -0.500 1.00 . A A . 99 PHE N 1 1 2 2161 1 1 64 PHE O O 14.263 8.005 2.937 1.00 . A A . 99 PHE O 1 1 2 2162 1 1 65 LYS C C 15.596 5.434 3.853 1.00 . A A . 100 LYS C 1 1 2 2163 1 1 65 LYS CA C 16.257 5.943 2.585 1.00 . A A . 100 LYS CA 1 1 2 2164 1 1 65 LYS CB C 17.335 7.013 2.857 1.00 . A A . 100 LYS CB 1 1 2 2165 1 1 65 LYS CD C 19.603 7.529 3.886 1.00 . A A . 100 LYS CD 1 1 2 2166 1 1 65 LYS CE C 20.157 8.084 2.588 1.00 . A A . 100 LYS CE 1 1 2 2167 1 1 65 LYS CG C 18.540 6.472 3.628 1.00 . A A . 100 LYS CG 1 1 2 2168 1 1 65 LYS H H 15.223 5.946 0.782 1.00 . A A . 100 LYS H 1 1 2 2169 1 1 65 LYS HA H 16.718 5.085 2.117 1.00 . A A . 100 LYS HA 1 1 2 2170 1 1 65 LYS HB2 H 17.676 7.401 1.909 1.00 . A A . 100 LYS HB2 1 1 2 2171 1 1 65 LYS HB3 H 16.894 7.816 3.429 1.00 . A A . 100 LYS HB3 1 1 2 2172 1 1 65 LYS HD2 H 19.168 8.335 4.457 1.00 . A A . 100 LYS HD2 1 1 2 2173 1 1 65 LYS HD3 H 20.409 7.086 4.452 1.00 . A A . 100 LYS HD3 1 1 2 2174 1 1 65 LYS HE2 H 20.499 7.264 1.974 1.00 . A A . 100 LYS HE2 1 1 2 2175 1 1 65 LYS HE3 H 19.365 8.607 2.075 1.00 . A A . 100 LYS HE3 1 1 2 2176 1 1 65 LYS HG2 H 18.183 6.086 4.570 1.00 . A A . 100 LYS HG2 1 1 2 2177 1 1 65 LYS HG3 H 18.972 5.661 3.059 1.00 . A A . 100 LYS HG3 1 1 2 2178 1 1 65 LYS HZ1 H 21.628 9.394 1.914 1.00 . A A . 100 LYS HZ1 1 1 2 2179 1 1 65 LYS HZ2 H 22.062 8.510 3.276 1.00 . A A . 100 LYS HZ2 1 1 2 2180 1 1 65 LYS HZ3 H 20.988 9.806 3.419 1.00 . A A . 100 LYS HZ3 1 1 2 2181 1 1 65 LYS N N 15.245 6.394 1.651 1.00 . A A . 100 LYS N 1 1 2 2182 1 1 65 LYS NZ N 21.275 9.010 2.814 1.00 . A A . 100 LYS NZ 1 1 2 2183 1 1 65 LYS O O 15.928 5.825 4.963 1.00 . A A . 100 LYS O 1 1 2 2184 1 1 66 SER C C 14.235 2.560 4.968 1.00 . A A . 101 SER C 1 1 2 2185 1 1 66 SER CA C 13.921 4.058 4.784 1.00 . A A . 101 SER CA 1 1 2 2186 1 1 66 SER CB C 12.432 4.339 4.618 1.00 . A A . 101 SER CB 1 1 2 2187 1 1 66 SER H H 14.419 4.281 2.764 1.00 . A A . 101 SER H 1 1 2 2188 1 1 66 SER HA H 14.283 4.584 5.655 1.00 . A A . 101 SER HA 1 1 2 2189 1 1 66 SER HB2 H 12.282 5.361 4.304 1.00 . A A . 101 SER HB2 1 1 2 2190 1 1 66 SER HB3 H 12.029 3.677 3.866 1.00 . A A . 101 SER HB3 1 1 2 2191 1 1 66 SER HG H 12.057 4.788 6.454 1.00 . A A . 101 SER HG 1 1 2 2192 1 1 66 SER N N 14.637 4.574 3.674 1.00 . A A . 101 SER N 1 1 2 2193 1 1 66 SER O O 15.242 2.067 4.444 1.00 . A A . 101 SER O 1 1 2 2194 1 1 66 SER OG O 11.729 4.117 5.838 1.00 . A A . 101 SER OG 1 1 2 2195 1 1 67 LYS C C 13.756 -0.580 5.016 1.00 . A A . 102 LYS C 1 1 2 2196 1 1 67 LYS CA C 13.674 0.493 6.111 1.00 . A A . 102 LYS CA 1 1 2 2197 1 1 67 LYS CB C 12.798 0.029 7.284 1.00 . A A . 102 LYS CB 1 1 2 2198 1 1 67 LYS CD C 10.512 -0.504 8.212 1.00 . A A . 102 LYS CD 1 1 2 2199 1 1 67 LYS CE C 10.948 -1.876 8.730 1.00 . A A . 102 LYS CE 1 1 2 2200 1 1 67 LYS CG C 11.307 -0.071 6.984 1.00 . A A . 102 LYS CG 1 1 2 2201 1 1 67 LYS H H 12.539 2.282 5.954 1.00 . A A . 102 LYS H 1 1 2 2202 1 1 67 LYS HA H 14.680 0.560 6.500 1.00 . A A . 102 LYS HA 1 1 2 2203 1 1 67 LYS HB2 H 13.143 -0.946 7.591 1.00 . A A . 102 LYS HB2 1 1 2 2204 1 1 67 LYS HB3 H 12.934 0.718 8.104 1.00 . A A . 102 LYS HB3 1 1 2 2205 1 1 67 LYS HD2 H 10.659 0.229 8.991 1.00 . A A . 102 LYS HD2 1 1 2 2206 1 1 67 LYS HD3 H 9.464 -0.541 7.951 1.00 . A A . 102 LYS HD3 1 1 2 2207 1 1 67 LYS HE2 H 10.807 -2.606 7.947 1.00 . A A . 102 LYS HE2 1 1 2 2208 1 1 67 LYS HE3 H 11.993 -1.834 9.000 1.00 . A A . 102 LYS HE3 1 1 2 2209 1 1 67 LYS HG2 H 10.957 0.898 6.662 1.00 . A A . 102 LYS HG2 1 1 2 2210 1 1 67 LYS HG3 H 11.158 -0.789 6.191 1.00 . A A . 102 LYS HG3 1 1 2 2211 1 1 67 LYS HZ1 H 9.156 -2.336 9.685 1.00 . A A . 102 LYS HZ1 1 1 2 2212 1 1 67 LYS HZ2 H 10.292 -1.617 10.700 1.00 . A A . 102 LYS HZ2 1 1 2 2213 1 1 67 LYS HZ3 H 10.468 -3.222 10.257 1.00 . A A . 102 LYS HZ3 1 1 2 2214 1 1 67 LYS N N 13.382 1.851 5.689 1.00 . A A . 102 LYS N 1 1 2 2215 1 1 67 LYS NZ N 10.168 -2.287 9.915 1.00 . A A . 102 LYS NZ 1 1 2 2216 1 1 67 LYS O O 14.760 -1.285 4.955 1.00 . A A . 102 LYS O 1 1 2 2217 1 1 68 GLY C C 12.407 -3.075 3.975 1.00 . A A . 103 GLY C 1 1 2 2218 1 1 68 GLY CA C 12.752 -1.808 3.239 1.00 . A A . 103 GLY CA 1 1 2 2219 1 1 68 GLY H H 11.959 -0.131 4.057 1.00 . A A . 103 GLY H 1 1 2 2220 1 1 68 GLY HA2 H 12.029 -1.630 2.457 1.00 . A A . 103 GLY HA2 1 1 2 2221 1 1 68 GLY HA3 H 13.738 -1.912 2.811 1.00 . A A . 103 GLY HA3 1 1 2 2222 1 1 68 GLY N N 12.736 -0.718 4.144 1.00 . A A . 103 GLY N 1 1 2 2223 1 1 68 GLY O O 11.226 -3.342 4.222 1.00 . A A . 103 GLY O 1 1 2 2224 1 1 69 ASN C C 14.653 -5.701 5.315 1.00 . A A . 104 ASN C 1 1 2 2225 1 1 69 ASN CA C 13.291 -5.072 5.129 1.00 . A A . 104 ASN CA 1 1 2 2226 1 1 69 ASN CB C 12.398 -6.092 4.397 1.00 . A A . 104 ASN CB 1 1 2 2227 1 1 69 ASN CG C 12.125 -7.367 5.191 1.00 . A A . 104 ASN CG 1 1 2 2228 1 1 69 ASN H H 14.333 -3.475 4.165 1.00 . A A . 104 ASN H 1 1 2 2229 1 1 69 ASN HA H 12.862 -4.843 6.093 1.00 . A A . 104 ASN HA 1 1 2 2230 1 1 69 ASN HB2 H 11.443 -5.625 4.204 1.00 . A A . 104 ASN HB2 1 1 2 2231 1 1 69 ASN HB3 H 12.861 -6.360 3.459 1.00 . A A . 104 ASN HB3 1 1 2 2232 1 1 69 ASN HD21 H 11.917 -6.355 6.888 1.00 . A A . 104 ASN HD21 1 1 2 2233 1 1 69 ASN HD22 H 11.711 -8.059 6.990 1.00 . A A . 104 ASN HD22 1 1 2 2234 1 1 69 ASN N N 13.433 -3.816 4.369 1.00 . A A . 104 ASN N 1 1 2 2235 1 1 69 ASN ND2 N 11.902 -7.246 6.474 1.00 . A A . 104 ASN ND2 1 1 2 2236 1 1 69 ASN O O 14.975 -6.224 6.376 1.00 . A A . 104 ASN O 1 1 2 2237 1 1 69 ASN OD1 O 12.051 -8.458 4.617 1.00 . A A . 104 ASN OD1 1 1 2 2238 1 1 70 TYR C C 17.853 -5.235 4.444 1.00 . A A . 105 TYR C 1 1 2 2239 1 1 70 TYR CA C 16.749 -6.265 4.286 1.00 . A A . 105 TYR CA 1 1 2 2240 1 1 70 TYR CB C 16.940 -7.115 3.009 1.00 . A A . 105 TYR CB 1 1 2 2241 1 1 70 TYR CD1 C 15.837 -5.707 1.194 1.00 . A A . 105 TYR CD1 1 1 2 2242 1 1 70 TYR CD2 C 18.133 -6.286 0.936 1.00 . A A . 105 TYR CD2 1 1 2 2243 1 1 70 TYR CE1 C 15.870 -5.025 -0.003 1.00 . A A . 105 TYR CE1 1 1 2 2244 1 1 70 TYR CE2 C 18.169 -5.610 -0.264 1.00 . A A . 105 TYR CE2 1 1 2 2245 1 1 70 TYR CG C 16.969 -6.350 1.689 1.00 . A A . 105 TYR CG 1 1 2 2246 1 1 70 TYR CZ C 17.036 -4.984 -0.729 1.00 . A A . 105 TYR CZ 1 1 2 2247 1 1 70 TYR H H 15.199 -5.107 3.494 1.00 . A A . 105 TYR H 1 1 2 2248 1 1 70 TYR HA H 16.776 -6.921 5.143 1.00 . A A . 105 TYR HA 1 1 2 2249 1 1 70 TYR HB2 H 17.877 -7.646 3.087 1.00 . A A . 105 TYR HB2 1 1 2 2250 1 1 70 TYR HB3 H 16.139 -7.837 2.958 1.00 . A A . 105 TYR HB3 1 1 2 2251 1 1 70 TYR HD1 H 14.921 -5.741 1.765 1.00 . A A . 105 TYR HD1 1 1 2 2252 1 1 70 TYR HD2 H 19.023 -6.779 1.300 1.00 . A A . 105 TYR HD2 1 1 2 2253 1 1 70 TYR HE1 H 14.983 -4.531 -0.371 1.00 . A A . 105 TYR HE1 1 1 2 2254 1 1 70 TYR HE2 H 19.084 -5.572 -0.836 1.00 . A A . 105 TYR HE2 1 1 2 2255 1 1 70 TYR HH H 16.912 -3.374 -1.755 1.00 . A A . 105 TYR HH 1 1 2 2256 1 1 70 TYR N N 15.455 -5.627 4.283 1.00 . A A . 105 TYR N 1 1 2 2257 1 1 70 TYR O O 17.590 -4.031 4.442 1.00 . A A . 105 TYR O 1 1 2 2258 1 1 70 TYR OH O 17.073 -4.310 -1.929 1.00 . A A . 105 TYR OH 1 1 2 2259 1 1 71 ASP C C 21.306 -5.199 3.794 1.00 . A A . 106 ASP C 1 1 2 2260 1 1 71 ASP CA C 20.224 -4.850 4.792 1.00 . A A . 106 ASP CA 1 1 2 2261 1 1 71 ASP CB C 20.765 -5.019 6.217 1.00 . A A . 106 ASP CB 1 1 2 2262 1 1 71 ASP CG C 22.039 -4.235 6.487 1.00 . A A . 106 ASP CG 1 1 2 2263 1 1 71 ASP H H 19.193 -6.678 4.583 1.00 . A A . 106 ASP H 1 1 2 2264 1 1 71 ASP HA H 19.919 -3.824 4.655 1.00 . A A . 106 ASP HA 1 1 2 2265 1 1 71 ASP HB2 H 20.014 -4.687 6.919 1.00 . A A . 106 ASP HB2 1 1 2 2266 1 1 71 ASP HB3 H 20.965 -6.066 6.385 1.00 . A A . 106 ASP HB3 1 1 2 2267 1 1 71 ASP N N 19.062 -5.706 4.596 1.00 . A A . 106 ASP N 1 1 2 2268 1 1 71 ASP O O 21.974 -6.239 3.919 1.00 . A A . 106 ASP O 1 1 2 2269 1 1 71 ASP OD1 O 21.954 -3.044 6.816 1.00 . A A . 106 ASP OD1 1 1 2 2270 1 1 71 ASP OD2 O 23.148 -4.822 6.433 1.00 . A A . 106 ASP OD2 1 1 2 2271 1 1 72 GLU C C 22.825 -3.193 1.282 1.00 . A A . 107 GLU C 1 1 2 2272 1 1 72 GLU CA C 22.461 -4.571 1.801 1.00 . A A . 107 GLU CA 1 1 2 2273 1 1 72 GLU CB C 21.961 -5.491 0.672 1.00 . A A . 107 GLU CB 1 1 2 2274 1 1 72 GLU CD C 22.412 -6.663 -1.493 1.00 . A A . 107 GLU CD 1 1 2 2275 1 1 72 GLU CG C 22.998 -5.830 -0.388 1.00 . A A . 107 GLU CG 1 1 2 2276 1 1 72 GLU H H 20.834 -3.630 2.668 1.00 . A A . 107 GLU H 1 1 2 2277 1 1 72 GLU HA H 23.323 -5.009 2.282 1.00 . A A . 107 GLU HA 1 1 2 2278 1 1 72 GLU HB2 H 21.620 -6.418 1.109 1.00 . A A . 107 GLU HB2 1 1 2 2279 1 1 72 GLU HB3 H 21.124 -5.014 0.183 1.00 . A A . 107 GLU HB3 1 1 2 2280 1 1 72 GLU HG2 H 23.387 -4.915 -0.808 1.00 . A A . 107 GLU HG2 1 1 2 2281 1 1 72 GLU HG3 H 23.804 -6.381 0.073 1.00 . A A . 107 GLU HG3 1 1 2 2282 1 1 72 GLU N N 21.439 -4.395 2.789 1.00 . A A . 107 GLU N 1 1 2 2283 1 1 72 GLU O O 22.269 -2.757 0.259 1.00 . A A . 107 GLU O 1 1 2 2284 1 1 72 GLU OXT O 23.597 -2.494 1.966 1.00 . A A . 107 GLU OXT 1 1 2 2285 1 1 72 GLU OE1 O 21.694 -6.115 -2.344 1.00 . A A . 107 GLU OE1 1 1 2 2286 1 1 72 GLU OE2 O 22.649 -7.888 -1.525 1.00 . A A . 107 GLU OE2 1 1 2 2287 2 2 1 ZN ZN ZN -7.733 0.813 -4.523 1.00 . B A . 201 ZN ZN 1 1 2 2288 3 2 1 ZN ZN ZN 9.899 0.570 -6.851 1.00 . C A . 202 ZN ZN 1 1 3 2289 1 1 1 ARG C C -21.879 0.366 8.369 1.00 . A A . 36 ARG C 1 1 3 2290 1 1 1 ARG CA C -21.424 1.350 9.418 1.00 . A A . 36 ARG CA 1 1 3 2291 1 1 1 ARG CB C -19.950 1.704 9.173 1.00 . A A . 36 ARG CB 1 1 3 2292 1 1 1 ARG CD C -19.876 4.041 8.118 1.00 . A A . 36 ARG CD 1 1 3 2293 1 1 1 ARG CG C -19.682 2.526 7.912 1.00 . A A . 36 ARG CG 1 1 3 2294 1 1 1 ARG CZ C -21.977 5.397 7.930 1.00 . A A . 36 ARG CZ 1 1 3 2295 1 1 1 ARG H1 H -21.018 -0.141 10.800 1.00 . A A . 36 ARG H1 1 1 3 2296 1 1 1 ARG H2 H -22.585 0.466 10.874 1.00 . A A . 36 ARG H2 1 1 3 2297 1 1 1 ARG H3 H -21.309 1.375 11.488 1.00 . A A . 36 ARG H3 1 1 3 2298 1 1 1 ARG HA H -22.031 2.240 9.363 1.00 . A A . 36 ARG HA 1 1 3 2299 1 1 1 ARG HB2 H -19.579 2.264 10.018 1.00 . A A . 36 ARG HB2 1 1 3 2300 1 1 1 ARG HB3 H -19.394 0.781 9.099 1.00 . A A . 36 ARG HB3 1 1 3 2301 1 1 1 ARG HD2 H -19.176 4.367 8.872 1.00 . A A . 36 ARG HD2 1 1 3 2302 1 1 1 ARG HD3 H -19.635 4.536 7.189 1.00 . A A . 36 ARG HD3 1 1 3 2303 1 1 1 ARG HE H -21.561 4.072 9.399 1.00 . A A . 36 ARG HE 1 1 3 2304 1 1 1 ARG HG2 H -18.666 2.354 7.590 1.00 . A A . 36 ARG HG2 1 1 3 2305 1 1 1 ARG HG3 H -20.359 2.190 7.140 1.00 . A A . 36 ARG HG3 1 1 3 2306 1 1 1 ARG HH11 H -20.827 5.534 6.225 1.00 . A A . 36 ARG HH11 1 1 3 2307 1 1 1 ARG HH12 H -22.159 6.565 6.266 1.00 . A A . 36 ARG HH12 1 1 3 2308 1 1 1 ARG HH21 H -23.393 5.510 9.380 1.00 . A A . 36 ARG HH21 1 1 3 2309 1 1 1 ARG HH22 H -23.641 6.566 8.066 1.00 . A A . 36 ARG HH22 1 1 3 2310 1 1 1 ARG N N -21.588 0.726 10.728 1.00 . A A . 36 ARG N 1 1 3 2311 1 1 1 ARG NE N -21.236 4.452 8.549 1.00 . A A . 36 ARG NE 1 1 3 2312 1 1 1 ARG NH1 N -21.629 5.852 6.734 1.00 . A A . 36 ARG NH1 1 1 3 2313 1 1 1 ARG NH2 N -23.078 5.850 8.490 1.00 . A A . 36 ARG NH2 1 1 3 2314 1 1 1 ARG O O -21.242 -0.667 8.171 1.00 . A A . 36 ARG O 1 1 3 2315 1 1 2 ALA C C -23.055 0.219 5.332 1.00 . A A . 37 ALA C 1 1 3 2316 1 1 2 ALA CA C -23.504 -0.224 6.702 1.00 . A A . 37 ALA CA 1 1 3 2317 1 1 2 ALA CB C -25.011 -0.266 6.768 1.00 . A A . 37 ALA CB 1 1 3 2318 1 1 2 ALA H H -23.467 1.486 7.929 1.00 . A A . 37 ALA H 1 1 3 2319 1 1 2 ALA HA H -23.126 -1.218 6.893 1.00 . A A . 37 ALA HA 1 1 3 2320 1 1 2 ALA HB1 H -25.318 -0.579 7.754 1.00 . A A . 37 ALA HB1 1 1 3 2321 1 1 2 ALA HB2 H -25.383 -0.961 6.031 1.00 . A A . 37 ALA HB2 1 1 3 2322 1 1 2 ALA HB3 H -25.407 0.717 6.562 1.00 . A A . 37 ALA HB3 1 1 3 2323 1 1 2 ALA N N -22.977 0.659 7.720 1.00 . A A . 37 ALA N 1 1 3 2324 1 1 2 ALA O O -22.662 -0.600 4.496 1.00 . A A . 37 ALA O 1 1 3 2325 1 1 3 GLN C C -21.222 2.191 3.749 1.00 . A A . 38 GLN C 1 1 3 2326 1 1 3 GLN CA C -22.715 2.061 3.833 1.00 . A A . 38 GLN CA 1 1 3 2327 1 1 3 GLN CB C -23.397 3.402 3.572 1.00 . A A . 38 GLN CB 1 1 3 2328 1 1 3 GLN CD C -25.318 2.331 2.352 1.00 . A A . 38 GLN CD 1 1 3 2329 1 1 3 GLN CG C -24.903 3.300 3.440 1.00 . A A . 38 GLN CG 1 1 3 2330 1 1 3 GLN H H -23.414 2.112 5.809 1.00 . A A . 38 GLN H 1 1 3 2331 1 1 3 GLN HA H -23.035 1.362 3.074 1.00 . A A . 38 GLN HA 1 1 3 2332 1 1 3 GLN HB2 H -23.174 4.071 4.391 1.00 . A A . 38 GLN HB2 1 1 3 2333 1 1 3 GLN HB3 H -23.004 3.823 2.659 1.00 . A A . 38 GLN HB3 1 1 3 2334 1 1 3 GLN HE21 H -25.219 3.762 1.005 1.00 . A A . 38 GLN HE21 1 1 3 2335 1 1 3 GLN HE22 H -25.693 2.211 0.426 1.00 . A A . 38 GLN HE22 1 1 3 2336 1 1 3 GLN HG2 H -25.321 2.965 4.377 1.00 . A A . 38 GLN HG2 1 1 3 2337 1 1 3 GLN HG3 H -25.295 4.275 3.196 1.00 . A A . 38 GLN HG3 1 1 3 2338 1 1 3 GLN N N -23.105 1.509 5.100 1.00 . A A . 38 GLN N 1 1 3 2339 1 1 3 GLN NE2 N -25.418 2.812 1.151 1.00 . A A . 38 GLN NE2 1 1 3 2340 1 1 3 GLN O O -20.639 3.158 4.245 1.00 . A A . 38 GLN O 1 1 3 2341 1 1 3 GLN OE1 O -25.517 1.136 2.598 1.00 . A A . 38 GLN OE1 1 1 3 2342 1 1 4 VAL C C -18.801 2.211 1.898 1.00 . A A . 39 VAL C 1 1 3 2343 1 1 4 VAL CA C -19.200 1.173 2.959 1.00 . A A . 39 VAL CA 1 1 3 2344 1 1 4 VAL CB C -18.698 -0.277 2.600 1.00 . A A . 39 VAL CB 1 1 3 2345 1 1 4 VAL CG1 C -19.441 -0.868 1.403 1.00 . A A . 39 VAL CG1 1 1 3 2346 1 1 4 VAL CG2 C -17.191 -0.307 2.368 1.00 . A A . 39 VAL CG2 1 1 3 2347 1 1 4 VAL H H -21.157 0.448 2.850 1.00 . A A . 39 VAL H 1 1 3 2348 1 1 4 VAL HA H -18.748 1.474 3.893 1.00 . A A . 39 VAL HA 1 1 3 2349 1 1 4 VAL HB H -18.920 -0.908 3.449 1.00 . A A . 39 VAL HB 1 1 3 2350 1 1 4 VAL HG11 H -19.063 -1.859 1.196 1.00 . A A . 39 VAL HG11 1 1 3 2351 1 1 4 VAL HG12 H -19.293 -0.237 0.539 1.00 . A A . 39 VAL HG12 1 1 3 2352 1 1 4 VAL HG13 H -20.497 -0.925 1.626 1.00 . A A . 39 VAL HG13 1 1 3 2353 1 1 4 VAL HG21 H -16.886 -1.309 2.103 1.00 . A A . 39 VAL HG21 1 1 3 2354 1 1 4 VAL HG22 H -16.684 -0.010 3.273 1.00 . A A . 39 VAL HG22 1 1 3 2355 1 1 4 VAL HG23 H -16.934 0.373 1.570 1.00 . A A . 39 VAL HG23 1 1 3 2356 1 1 4 VAL N N -20.616 1.201 3.167 1.00 . A A . 39 VAL N 1 1 3 2357 1 1 4 VAL O O -19.225 2.145 0.738 1.00 . A A . 39 VAL O 1 1 3 2358 1 1 5 LYS C C -16.120 4.469 1.830 1.00 . A A . 40 LYS C 1 1 3 2359 1 1 5 LYS CA C -17.574 4.235 1.471 1.00 . A A . 40 LYS CA 1 1 3 2360 1 1 5 LYS CB C -18.413 5.520 1.614 1.00 . A A . 40 LYS CB 1 1 3 2361 1 1 5 LYS CD C -18.874 7.878 0.885 1.00 . A A . 40 LYS CD 1 1 3 2362 1 1 5 LYS CE C -18.394 9.057 0.053 1.00 . A A . 40 LYS CE 1 1 3 2363 1 1 5 LYS CG C -17.993 6.661 0.693 1.00 . A A . 40 LYS CG 1 1 3 2364 1 1 5 LYS H H -17.863 3.261 3.291 1.00 . A A . 40 LYS H 1 1 3 2365 1 1 5 LYS HA H -17.632 3.871 0.455 1.00 . A A . 40 LYS HA 1 1 3 2366 1 1 5 LYS HB2 H -19.446 5.284 1.410 1.00 . A A . 40 LYS HB2 1 1 3 2367 1 1 5 LYS HB3 H -18.330 5.864 2.634 1.00 . A A . 40 LYS HB3 1 1 3 2368 1 1 5 LYS HD2 H -19.884 7.632 0.592 1.00 . A A . 40 LYS HD2 1 1 3 2369 1 1 5 LYS HD3 H -18.863 8.155 1.929 1.00 . A A . 40 LYS HD3 1 1 3 2370 1 1 5 LYS HE2 H -19.066 9.888 0.206 1.00 . A A . 40 LYS HE2 1 1 3 2371 1 1 5 LYS HE3 H -17.406 9.331 0.393 1.00 . A A . 40 LYS HE3 1 1 3 2372 1 1 5 LYS HG2 H -16.970 6.931 0.909 1.00 . A A . 40 LYS HG2 1 1 3 2373 1 1 5 LYS HG3 H -18.067 6.328 -0.331 1.00 . A A . 40 LYS HG3 1 1 3 2374 1 1 5 LYS HZ1 H -17.645 8.011 -1.607 1.00 . A A . 40 LYS HZ1 1 1 3 2375 1 1 5 LYS HZ2 H -18.109 9.606 -1.938 1.00 . A A . 40 LYS HZ2 1 1 3 2376 1 1 5 LYS HZ3 H -19.269 8.437 -1.728 1.00 . A A . 40 LYS HZ3 1 1 3 2377 1 1 5 LYS N N -18.074 3.203 2.333 1.00 . A A . 40 LYS N 1 1 3 2378 1 1 5 LYS NZ N -18.340 8.755 -1.389 1.00 . A A . 40 LYS NZ 1 1 3 2379 1 1 5 LYS O O -15.724 5.521 2.341 1.00 . A A . 40 LYS O 1 1 3 2380 1 1 6 GLU C C -13.266 3.844 0.607 1.00 . A A . 41 GLU C 1 1 3 2381 1 1 6 GLU CA C -13.942 3.517 1.893 1.00 . A A . 41 GLU CA 1 1 3 2382 1 1 6 GLU CB C -13.437 2.167 2.346 1.00 . A A . 41 GLU CB 1 1 3 2383 1 1 6 GLU CD C -13.846 2.250 4.860 1.00 . A A . 41 GLU CD 1 1 3 2384 1 1 6 GLU CG C -14.145 1.579 3.536 1.00 . A A . 41 GLU CG 1 1 3 2385 1 1 6 GLU H H -15.719 2.638 1.241 1.00 . A A . 41 GLU H 1 1 3 2386 1 1 6 GLU HA H -13.737 4.259 2.649 1.00 . A A . 41 GLU HA 1 1 3 2387 1 1 6 GLU HB2 H -13.540 1.474 1.524 1.00 . A A . 41 GLU HB2 1 1 3 2388 1 1 6 GLU HB3 H -12.387 2.258 2.581 1.00 . A A . 41 GLU HB3 1 1 3 2389 1 1 6 GLU HG2 H -15.211 1.583 3.367 1.00 . A A . 41 GLU HG2 1 1 3 2390 1 1 6 GLU HG3 H -13.772 0.568 3.571 1.00 . A A . 41 GLU HG3 1 1 3 2391 1 1 6 GLU N N -15.346 3.458 1.625 1.00 . A A . 41 GLU N 1 1 3 2392 1 1 6 GLU O O -13.604 3.278 -0.432 1.00 . A A . 41 GLU O 1 1 3 2393 1 1 6 GLU OE1 O -14.334 3.368 5.115 1.00 . A A . 41 GLU OE1 1 1 3 2394 1 1 6 GLU OE2 O -13.165 1.624 5.700 1.00 . A A . 41 GLU OE2 1 1 3 2395 1 1 7 THR C C -10.184 4.670 -0.320 1.00 . A A . 42 THR C 1 1 3 2396 1 1 7 THR CA C -11.641 5.025 -0.556 1.00 . A A . 42 THR CA 1 1 3 2397 1 1 7 THR CB C -11.782 6.497 -0.957 1.00 . A A . 42 THR CB 1 1 3 2398 1 1 7 THR CG2 C -11.772 6.596 -2.474 1.00 . A A . 42 THR CG2 1 1 3 2399 1 1 7 THR H H -12.069 5.098 1.503 1.00 . A A . 42 THR H 1 1 3 2400 1 1 7 THR HA H -12.064 4.390 -1.323 1.00 . A A . 42 THR HA 1 1 3 2401 1 1 7 THR HB H -10.937 7.045 -0.569 1.00 . A A . 42 THR HB 1 1 3 2402 1 1 7 THR HG1 H -13.254 6.528 0.312 1.00 . A A . 42 THR HG1 1 1 3 2403 1 1 7 THR HG21 H -12.615 6.027 -2.846 1.00 . A A . 42 THR HG21 1 1 3 2404 1 1 7 THR HG22 H -10.851 6.187 -2.862 1.00 . A A . 42 THR HG22 1 1 3 2405 1 1 7 THR HG23 H -11.872 7.628 -2.775 1.00 . A A . 42 THR HG23 1 1 3 2406 1 1 7 THR N N -12.342 4.714 0.641 1.00 . A A . 42 THR N 1 1 3 2407 1 1 7 THR O O -9.689 4.782 0.796 1.00 . A A . 42 THR O 1 1 3 2408 1 1 7 THR OG1 O -13.061 6.989 -0.513 1.00 . A A . 42 THR OG1 1 1 3 2409 1 1 8 CYS C C -7.161 4.771 -1.359 1.00 . A A . 43 CYS C 1 1 3 2410 1 1 8 CYS CA C -8.218 3.704 -1.265 1.00 . A A . 43 CYS CA 1 1 3 2411 1 1 8 CYS CB C -8.094 2.659 -2.342 1.00 . A A . 43 CYS CB 1 1 3 2412 1 1 8 CYS H H -9.948 4.319 -2.236 1.00 . A A . 43 CYS H 1 1 3 2413 1 1 8 CYS HA H -8.154 3.194 -0.320 1.00 . A A . 43 CYS HA 1 1 3 2414 1 1 8 CYS HB2 H -8.400 1.717 -1.913 1.00 . A A . 43 CYS HB2 1 1 3 2415 1 1 8 CYS HB3 H -8.799 2.909 -3.113 1.00 . A A . 43 CYS HB3 1 1 3 2416 1 1 8 CYS N N -9.532 4.240 -1.349 1.00 . A A . 43 CYS N 1 1 3 2417 1 1 8 CYS O O -7.367 5.800 -1.980 1.00 . A A . 43 CYS O 1 1 3 2418 1 1 8 CYS SG S -6.483 2.359 -3.046 1.00 . A A . 43 CYS SG 1 1 3 2419 1 1 9 ALA C C -3.805 4.999 -1.640 1.00 . A A . 44 ALA C 1 1 3 2420 1 1 9 ALA CA C -4.942 5.463 -0.732 1.00 . A A . 44 ALA CA 1 1 3 2421 1 1 9 ALA CB C -4.429 5.664 0.664 1.00 . A A . 44 ALA CB 1 1 3 2422 1 1 9 ALA H H -5.992 3.725 -0.162 1.00 . A A . 44 ALA H 1 1 3 2423 1 1 9 ALA HA H -5.310 6.416 -1.079 1.00 . A A . 44 ALA HA 1 1 3 2424 1 1 9 ALA HB1 H -5.255 5.968 1.287 1.00 . A A . 44 ALA HB1 1 1 3 2425 1 1 9 ALA HB2 H -3.690 6.448 0.631 1.00 . A A . 44 ALA HB2 1 1 3 2426 1 1 9 ALA HB3 H -3.997 4.744 1.027 1.00 . A A . 44 ALA HB3 1 1 3 2427 1 1 9 ALA N N -6.047 4.534 -0.713 1.00 . A A . 44 ALA N 1 1 3 2428 1 1 9 ALA O O -2.886 5.752 -1.922 1.00 . A A . 44 ALA O 1 1 3 2429 1 1 10 ALA C C -3.042 3.446 -4.401 1.00 . A A . 45 ALA C 1 1 3 2430 1 1 10 ALA CA C -2.782 3.243 -2.920 1.00 . A A . 45 ALA CA 1 1 3 2431 1 1 10 ALA CB C -2.562 1.781 -2.585 1.00 . A A . 45 ALA CB 1 1 3 2432 1 1 10 ALA H H -4.656 3.203 -1.964 1.00 . A A . 45 ALA H 1 1 3 2433 1 1 10 ALA HA H -1.889 3.789 -2.659 1.00 . A A . 45 ALA HA 1 1 3 2434 1 1 10 ALA HB1 H -2.430 1.701 -1.512 1.00 . A A . 45 ALA HB1 1 1 3 2435 1 1 10 ALA HB2 H -1.677 1.426 -3.092 1.00 . A A . 45 ALA HB2 1 1 3 2436 1 1 10 ALA HB3 H -3.418 1.198 -2.891 1.00 . A A . 45 ALA HB3 1 1 3 2437 1 1 10 ALA N N -3.871 3.769 -2.121 1.00 . A A . 45 ALA N 1 1 3 2438 1 1 10 ALA O O -2.118 3.624 -5.197 1.00 . A A . 45 ALA O 1 1 3 2439 1 1 11 CYS C C -5.907 4.635 -6.202 1.00 . A A . 46 CYS C 1 1 3 2440 1 1 11 CYS CA C -4.719 3.661 -6.115 1.00 . A A . 46 CYS CA 1 1 3 2441 1 1 11 CYS CB C -4.972 2.300 -6.811 1.00 . A A . 46 CYS CB 1 1 3 2442 1 1 11 CYS H H -4.978 3.339 -4.052 1.00 . A A . 46 CYS H 1 1 3 2443 1 1 11 CYS HA H -3.886 4.145 -6.603 1.00 . A A . 46 CYS HA 1 1 3 2444 1 1 11 CYS HB2 H -4.417 2.033 -7.694 1.00 . A A . 46 CYS HB2 1 1 3 2445 1 1 11 CYS HB3 H -4.342 1.729 -6.139 1.00 . A A . 46 CYS HB3 1 1 3 2446 1 1 11 CYS N N -4.304 3.463 -4.751 1.00 . A A . 46 CYS N 1 1 3 2447 1 1 11 CYS O O -6.404 4.935 -7.279 1.00 . A A . 46 CYS O 1 1 3 2448 1 1 11 CYS SG S -6.591 1.515 -6.574 1.00 . A A . 46 CYS SG 1 1 3 2449 1 1 12 GLN C C -8.693 5.834 -5.590 1.00 . A A . 47 GLN C 1 1 3 2450 1 1 12 GLN CA C -7.382 6.142 -4.858 1.00 . A A . 47 GLN CA 1 1 3 2451 1 1 12 GLN CB C -6.864 7.528 -5.122 1.00 . A A . 47 GLN CB 1 1 3 2452 1 1 12 GLN CD C -5.017 9.191 -4.508 1.00 . A A . 47 GLN CD 1 1 3 2453 1 1 12 GLN CG C -5.809 7.961 -4.104 1.00 . A A . 47 GLN CG 1 1 3 2454 1 1 12 GLN H H -5.853 4.902 -4.190 1.00 . A A . 47 GLN H 1 1 3 2455 1 1 12 GLN HA H -7.629 6.091 -3.807 1.00 . A A . 47 GLN HA 1 1 3 2456 1 1 12 GLN HB2 H -6.476 7.607 -6.127 1.00 . A A . 47 GLN HB2 1 1 3 2457 1 1 12 GLN HB3 H -7.735 8.151 -4.986 1.00 . A A . 47 GLN HB3 1 1 3 2458 1 1 12 GLN HE21 H -6.491 9.838 -5.654 1.00 . A A . 47 GLN HE21 1 1 3 2459 1 1 12 GLN HE22 H -5.083 10.830 -5.599 1.00 . A A . 47 GLN HE22 1 1 3 2460 1 1 12 GLN HG2 H -6.304 8.176 -3.169 1.00 . A A . 47 GLN HG2 1 1 3 2461 1 1 12 GLN HG3 H -5.127 7.136 -3.960 1.00 . A A . 47 GLN HG3 1 1 3 2462 1 1 12 GLN N N -6.315 5.149 -5.016 1.00 . A A . 47 GLN N 1 1 3 2463 1 1 12 GLN NE2 N -5.585 10.031 -5.330 1.00 . A A . 47 GLN NE2 1 1 3 2464 1 1 12 GLN O O -9.302 6.697 -6.221 1.00 . A A . 47 GLN O 1 1 3 2465 1 1 12 GLN OE1 O -3.866 9.353 -4.100 1.00 . A A . 47 GLN OE1 1 1 3 2466 1 1 13 LYS C C -11.158 3.630 -4.840 1.00 . A A . 48 LYS C 1 1 3 2467 1 1 13 LYS CA C -10.347 4.101 -6.012 1.00 . A A . 48 LYS CA 1 1 3 2468 1 1 13 LYS CB C -10.069 2.924 -6.945 1.00 . A A . 48 LYS CB 1 1 3 2469 1 1 13 LYS CD C -9.773 4.319 -9.042 1.00 . A A . 48 LYS CD 1 1 3 2470 1 1 13 LYS CE C -11.049 3.839 -9.728 1.00 . A A . 48 LYS CE 1 1 3 2471 1 1 13 LYS CG C -9.175 3.257 -8.132 1.00 . A A . 48 LYS CG 1 1 3 2472 1 1 13 LYS H H -8.564 3.979 -4.960 1.00 . A A . 48 LYS H 1 1 3 2473 1 1 13 LYS HA H -10.873 4.882 -6.537 1.00 . A A . 48 LYS HA 1 1 3 2474 1 1 13 LYS HB2 H -9.574 2.151 -6.378 1.00 . A A . 48 LYS HB2 1 1 3 2475 1 1 13 LYS HB3 H -11.009 2.540 -7.310 1.00 . A A . 48 LYS HB3 1 1 3 2476 1 1 13 LYS HD2 H -9.994 5.174 -8.422 1.00 . A A . 48 LYS HD2 1 1 3 2477 1 1 13 LYS HD3 H -9.038 4.592 -9.786 1.00 . A A . 48 LYS HD3 1 1 3 2478 1 1 13 LYS HE2 H -10.809 2.969 -10.320 1.00 . A A . 48 LYS HE2 1 1 3 2479 1 1 13 LYS HE3 H -11.776 3.571 -8.977 1.00 . A A . 48 LYS HE3 1 1 3 2480 1 1 13 LYS HG2 H -8.230 3.620 -7.754 1.00 . A A . 48 LYS HG2 1 1 3 2481 1 1 13 LYS HG3 H -9.009 2.350 -8.690 1.00 . A A . 48 LYS HG3 1 1 3 2482 1 1 13 LYS HZ1 H -12.474 4.487 -11.093 1.00 . A A . 48 LYS HZ1 1 1 3 2483 1 1 13 LYS HZ2 H -10.946 5.162 -11.349 1.00 . A A . 48 LYS HZ2 1 1 3 2484 1 1 13 LYS HZ3 H -11.913 5.710 -10.079 1.00 . A A . 48 LYS HZ3 1 1 3 2485 1 1 13 LYS N N -9.107 4.607 -5.469 1.00 . A A . 48 LYS N 1 1 3 2486 1 1 13 LYS NZ N -11.628 4.870 -10.621 1.00 . A A . 48 LYS NZ 1 1 3 2487 1 1 13 LYS O O -10.585 3.307 -3.804 1.00 . A A . 48 LYS O 1 1 3 2488 1 1 14 THR C C -13.139 1.721 -3.646 1.00 . A A . 49 THR C 1 1 3 2489 1 1 14 THR CA C -13.302 3.231 -3.891 1.00 . A A . 49 THR CA 1 1 3 2490 1 1 14 THR CB C -14.734 3.566 -4.221 1.00 . A A . 49 THR CB 1 1 3 2491 1 1 14 THR CG2 C -15.563 3.555 -2.956 1.00 . A A . 49 THR CG2 1 1 3 2492 1 1 14 THR H H -12.866 3.997 -5.773 1.00 . A A . 49 THR H 1 1 3 2493 1 1 14 THR HA H -13.026 3.755 -2.994 1.00 . A A . 49 THR HA 1 1 3 2494 1 1 14 THR HB H -15.086 2.805 -4.893 1.00 . A A . 49 THR HB 1 1 3 2495 1 1 14 THR HG1 H -14.929 4.774 -5.757 1.00 . A A . 49 THR HG1 1 1 3 2496 1 1 14 THR HG21 H -15.042 4.192 -2.251 1.00 . A A . 49 THR HG21 1 1 3 2497 1 1 14 THR HG22 H -15.646 2.542 -2.584 1.00 . A A . 49 THR HG22 1 1 3 2498 1 1 14 THR HG23 H -16.546 3.955 -3.153 1.00 . A A . 49 THR HG23 1 1 3 2499 1 1 14 THR N N -12.444 3.663 -4.953 1.00 . A A . 49 THR N 1 1 3 2500 1 1 14 THR O O -13.174 0.910 -4.593 1.00 . A A . 49 THR O 1 1 3 2501 1 1 14 THR OG1 O -14.774 4.892 -4.810 1.00 . A A . 49 THR OG1 1 1 3 2502 1 1 15 VAL C C -13.946 -0.685 -1.666 1.00 . A A . 50 VAL C 1 1 3 2503 1 1 15 VAL CA C -12.662 -0.020 -2.045 1.00 . A A . 50 VAL CA 1 1 3 2504 1 1 15 VAL CB C -11.693 -0.163 -0.844 1.00 . A A . 50 VAL CB 1 1 3 2505 1 1 15 VAL CG1 C -10.859 -1.403 -1.016 1.00 . A A . 50 VAL CG1 1 1 3 2506 1 1 15 VAL CG2 C -10.826 1.059 -0.682 1.00 . A A . 50 VAL CG2 1 1 3 2507 1 1 15 VAL H H -13.017 2.041 -1.701 1.00 . A A . 50 VAL H 1 1 3 2508 1 1 15 VAL HA H -12.218 -0.500 -2.906 1.00 . A A . 50 VAL HA 1 1 3 2509 1 1 15 VAL HB H -12.253 -0.342 0.068 1.00 . A A . 50 VAL HB 1 1 3 2510 1 1 15 VAL HG11 H -10.113 -1.438 -0.237 1.00 . A A . 50 VAL HG11 1 1 3 2511 1 1 15 VAL HG12 H -10.369 -1.384 -1.978 1.00 . A A . 50 VAL HG12 1 1 3 2512 1 1 15 VAL HG13 H -11.486 -2.280 -0.948 1.00 . A A . 50 VAL HG13 1 1 3 2513 1 1 15 VAL HG21 H -10.116 0.920 0.118 1.00 . A A . 50 VAL HG21 1 1 3 2514 1 1 15 VAL HG22 H -11.461 1.904 -0.461 1.00 . A A . 50 VAL HG22 1 1 3 2515 1 1 15 VAL HG23 H -10.312 1.240 -1.616 1.00 . A A . 50 VAL HG23 1 1 3 2516 1 1 15 VAL N N -12.932 1.357 -2.400 1.00 . A A . 50 VAL N 1 1 3 2517 1 1 15 VAL O O -14.815 -0.067 -1.046 1.00 . A A . 50 VAL O 1 1 3 2518 1 1 16 TYR C C -14.894 -3.712 -0.684 1.00 . A A . 51 TYR C 1 1 3 2519 1 1 16 TYR CA C -15.258 -2.654 -1.724 1.00 . A A . 51 TYR CA 1 1 3 2520 1 1 16 TYR CB C -15.824 -3.243 -3.017 1.00 . A A . 51 TYR CB 1 1 3 2521 1 1 16 TYR CD1 C -16.758 -1.044 -3.794 1.00 . A A . 51 TYR CD1 1 1 3 2522 1 1 16 TYR CD2 C -15.659 -2.400 -5.395 1.00 . A A . 51 TYR CD2 1 1 3 2523 1 1 16 TYR CE1 C -17.017 -0.096 -4.757 1.00 . A A . 51 TYR CE1 1 1 3 2524 1 1 16 TYR CE2 C -15.909 -1.454 -6.367 1.00 . A A . 51 TYR CE2 1 1 3 2525 1 1 16 TYR CG C -16.080 -2.206 -4.090 1.00 . A A . 51 TYR CG 1 1 3 2526 1 1 16 TYR CZ C -16.590 -0.306 -6.042 1.00 . A A . 51 TYR CZ 1 1 3 2527 1 1 16 TYR H H -13.340 -2.380 -2.477 1.00 . A A . 51 TYR H 1 1 3 2528 1 1 16 TYR HA H -15.968 -1.968 -1.288 1.00 . A A . 51 TYR HA 1 1 3 2529 1 1 16 TYR HB2 H -15.104 -3.929 -3.425 1.00 . A A . 51 TYR HB2 1 1 3 2530 1 1 16 TYR HB3 H -16.751 -3.757 -2.814 1.00 . A A . 51 TYR HB3 1 1 3 2531 1 1 16 TYR HD1 H -17.071 -0.895 -2.774 1.00 . A A . 51 TYR HD1 1 1 3 2532 1 1 16 TYR HD2 H -15.125 -3.303 -5.649 1.00 . A A . 51 TYR HD2 1 1 3 2533 1 1 16 TYR HE1 H -17.549 0.805 -4.497 1.00 . A A . 51 TYR HE1 1 1 3 2534 1 1 16 TYR HE2 H -15.575 -1.615 -7.380 1.00 . A A . 51 TYR HE2 1 1 3 2535 1 1 16 TYR HH H -16.782 1.504 -6.600 1.00 . A A . 51 TYR HH 1 1 3 2536 1 1 16 TYR N N -14.074 -1.918 -2.021 1.00 . A A . 51 TYR N 1 1 3 2537 1 1 16 TYR O O -13.724 -4.079 -0.602 1.00 . A A . 51 TYR O 1 1 3 2538 1 1 16 TYR OH O -16.858 0.635 -7.021 1.00 . A A . 51 TYR OH 1 1 3 2539 1 1 17 PRO C C -14.603 -6.236 1.113 1.00 . A A . 52 PRO C 1 1 3 2540 1 1 17 PRO CA C -15.622 -5.099 1.288 1.00 . A A . 52 PRO CA 1 1 3 2541 1 1 17 PRO CB C -16.989 -5.673 1.605 1.00 . A A . 52 PRO CB 1 1 3 2542 1 1 17 PRO CD C -17.334 -4.023 -0.093 1.00 . A A . 52 PRO CD 1 1 3 2543 1 1 17 PRO CG C -17.949 -4.637 1.136 1.00 . A A . 52 PRO CG 1 1 3 2544 1 1 17 PRO HA H -15.310 -4.507 2.131 1.00 . A A . 52 PRO HA 1 1 3 2545 1 1 17 PRO HB2 H -17.072 -6.596 1.058 1.00 . A A . 52 PRO HB2 1 1 3 2546 1 1 17 PRO HB3 H -17.075 -5.863 2.665 1.00 . A A . 52 PRO HB3 1 1 3 2547 1 1 17 PRO HD2 H -17.684 -4.529 -0.981 1.00 . A A . 52 PRO HD2 1 1 3 2548 1 1 17 PRO HD3 H -17.562 -2.969 -0.146 1.00 . A A . 52 PRO HD3 1 1 3 2549 1 1 17 PRO HG2 H -18.898 -5.093 0.894 1.00 . A A . 52 PRO HG2 1 1 3 2550 1 1 17 PRO HG3 H -18.079 -3.888 1.903 1.00 . A A . 52 PRO HG3 1 1 3 2551 1 1 17 PRO N N -15.876 -4.239 0.098 1.00 . A A . 52 PRO N 1 1 3 2552 1 1 17 PRO O O -13.802 -6.482 2.018 1.00 . A A . 52 PRO O 1 1 3 2553 1 1 18 MET C C -12.242 -7.537 -0.412 1.00 . A A . 53 MET C 1 1 3 2554 1 1 18 MET CA C -13.682 -8.016 -0.258 1.00 . A A . 53 MET CA 1 1 3 2555 1 1 18 MET CB C -14.094 -8.836 -1.474 1.00 . A A . 53 MET CB 1 1 3 2556 1 1 18 MET CE C -15.319 -11.523 -2.772 1.00 . A A . 53 MET CE 1 1 3 2557 1 1 18 MET CG C -13.209 -10.052 -1.714 1.00 . A A . 53 MET CG 1 1 3 2558 1 1 18 MET H H -15.229 -6.635 -0.741 1.00 . A A . 53 MET H 1 1 3 2559 1 1 18 MET HA H -13.718 -8.659 0.606 1.00 . A A . 53 MET HA 1 1 3 2560 1 1 18 MET HB2 H -15.102 -9.178 -1.302 1.00 . A A . 53 MET HB2 1 1 3 2561 1 1 18 MET HB3 H -14.066 -8.210 -2.353 1.00 . A A . 53 MET HB3 1 1 3 2562 1 1 18 MET HE1 H -15.726 -12.118 -3.575 1.00 . A A . 53 MET HE1 1 1 3 2563 1 1 18 MET HE2 H -15.952 -10.662 -2.613 1.00 . A A . 53 MET HE2 1 1 3 2564 1 1 18 MET HE3 H -15.284 -12.114 -1.869 1.00 . A A . 53 MET HE3 1 1 3 2565 1 1 18 MET HG2 H -12.186 -9.715 -1.778 1.00 . A A . 53 MET HG2 1 1 3 2566 1 1 18 MET HG3 H -13.303 -10.702 -0.858 1.00 . A A . 53 MET HG3 1 1 3 2567 1 1 18 MET N N -14.605 -6.902 -0.033 1.00 . A A . 53 MET N 1 1 3 2568 1 1 18 MET O O -11.307 -8.160 0.098 1.00 . A A . 53 MET O 1 1 3 2569 1 1 18 MET SD S -13.658 -10.980 -3.202 1.00 . A A . 53 MET SD 1 1 3 2570 1 1 19 GLU C C -10.272 -4.978 -0.283 1.00 . A A . 54 GLU C 1 1 3 2571 1 1 19 GLU CA C -10.743 -5.913 -1.357 1.00 . A A . 54 GLU CA 1 1 3 2572 1 1 19 GLU CB C -10.740 -5.195 -2.696 1.00 . A A . 54 GLU CB 1 1 3 2573 1 1 19 GLU CD C -11.034 -5.374 -5.175 1.00 . A A . 54 GLU CD 1 1 3 2574 1 1 19 GLU CG C -11.170 -6.067 -3.850 1.00 . A A . 54 GLU CG 1 1 3 2575 1 1 19 GLU H H -12.833 -5.846 -1.308 1.00 . A A . 54 GLU H 1 1 3 2576 1 1 19 GLU HA H -10.071 -6.757 -1.418 1.00 . A A . 54 GLU HA 1 1 3 2577 1 1 19 GLU HB2 H -11.424 -4.362 -2.632 1.00 . A A . 54 GLU HB2 1 1 3 2578 1 1 19 GLU HB3 H -9.754 -4.809 -2.901 1.00 . A A . 54 GLU HB3 1 1 3 2579 1 1 19 GLU HG2 H -10.564 -6.960 -3.849 1.00 . A A . 54 GLU HG2 1 1 3 2580 1 1 19 GLU HG3 H -12.204 -6.345 -3.704 1.00 . A A . 54 GLU HG3 1 1 3 2581 1 1 19 GLU N N -12.068 -6.404 -1.057 1.00 . A A . 54 GLU N 1 1 3 2582 1 1 19 GLU O O -9.086 -4.725 -0.162 1.00 . A A . 54 GLU O 1 1 3 2583 1 1 19 GLU OE1 O -11.922 -4.579 -5.533 1.00 . A A . 54 GLU OE1 1 1 3 2584 1 1 19 GLU OE2 O -10.038 -5.618 -5.892 1.00 . A A . 54 GLU OE2 1 1 3 2585 1 1 20 ARG C C -10.108 -4.208 2.669 1.00 . A A . 55 ARG C 1 1 3 2586 1 1 20 ARG CA C -10.926 -3.571 1.570 1.00 . A A . 55 ARG CA 1 1 3 2587 1 1 20 ARG CB C -12.191 -2.867 2.073 1.00 . A A . 55 ARG CB 1 1 3 2588 1 1 20 ARG CD C -13.442 -1.876 3.971 1.00 . A A . 55 ARG CD 1 1 3 2589 1 1 20 ARG CG C -12.075 -2.216 3.419 1.00 . A A . 55 ARG CG 1 1 3 2590 1 1 20 ARG CZ C -13.592 -1.673 6.438 1.00 . A A . 55 ARG CZ 1 1 3 2591 1 1 20 ARG H H -12.141 -4.750 0.332 1.00 . A A . 55 ARG H 1 1 3 2592 1 1 20 ARG HA H -10.288 -2.822 1.130 1.00 . A A . 55 ARG HA 1 1 3 2593 1 1 20 ARG HB2 H -12.364 -2.044 1.392 1.00 . A A . 55 ARG HB2 1 1 3 2594 1 1 20 ARG HB3 H -13.055 -3.492 2.013 1.00 . A A . 55 ARG HB3 1 1 3 2595 1 1 20 ARG HD2 H -13.977 -1.291 3.240 1.00 . A A . 55 ARG HD2 1 1 3 2596 1 1 20 ARG HD3 H -13.990 -2.790 4.134 1.00 . A A . 55 ARG HD3 1 1 3 2597 1 1 20 ARG HE H -13.074 -0.200 5.189 1.00 . A A . 55 ARG HE 1 1 3 2598 1 1 20 ARG HG2 H -11.557 -2.890 4.084 1.00 . A A . 55 ARG HG2 1 1 3 2599 1 1 20 ARG HG3 H -11.499 -1.307 3.319 1.00 . A A . 55 ARG HG3 1 1 3 2600 1 1 20 ARG HH11 H -14.155 -3.523 5.751 1.00 . A A . 55 ARG HH11 1 1 3 2601 1 1 20 ARG HH12 H -14.209 -3.368 7.430 1.00 . A A . 55 ARG HH12 1 1 3 2602 1 1 20 ARG HH21 H -13.151 0.032 7.418 1.00 . A A . 55 ARG HH21 1 1 3 2603 1 1 20 ARG HH22 H -13.590 -1.261 8.440 1.00 . A A . 55 ARG HH22 1 1 3 2604 1 1 20 ARG N N -11.212 -4.486 0.502 1.00 . A A . 55 ARG N 1 1 3 2605 1 1 20 ARG NE N -13.345 -1.150 5.243 1.00 . A A . 55 ARG NE 1 1 3 2606 1 1 20 ARG NH1 N -14.009 -2.929 6.551 1.00 . A A . 55 ARG NH1 1 1 3 2607 1 1 20 ARG NH2 N -13.441 -0.924 7.507 1.00 . A A . 55 ARG NH2 1 1 3 2608 1 1 20 ARG O O -10.552 -5.097 3.410 1.00 . A A . 55 ARG O 1 1 3 2609 1 1 21 LEU C C -7.361 -2.869 4.197 1.00 . A A . 56 LEU C 1 1 3 2610 1 1 21 LEU CA C -7.887 -4.165 3.589 1.00 . A A . 56 LEU CA 1 1 3 2611 1 1 21 LEU CB C -6.797 -4.928 2.785 1.00 . A A . 56 LEU CB 1 1 3 2612 1 1 21 LEU CD1 C -4.909 -6.502 2.713 1.00 . A A . 56 LEU CD1 1 1 3 2613 1 1 21 LEU CD2 C -4.480 -4.243 3.496 1.00 . A A . 56 LEU CD2 1 1 3 2614 1 1 21 LEU CG C -5.504 -5.369 3.485 1.00 . A A . 56 LEU CG 1 1 3 2615 1 1 21 LEU H H -8.653 -3.201 1.930 1.00 . A A . 56 LEU H 1 1 3 2616 1 1 21 LEU HA H -8.291 -4.808 4.357 1.00 . A A . 56 LEU HA 1 1 3 2617 1 1 21 LEU HB2 H -7.253 -5.817 2.379 1.00 . A A . 56 LEU HB2 1 1 3 2618 1 1 21 LEU HB3 H -6.525 -4.298 1.952 1.00 . A A . 56 LEU HB3 1 1 3 2619 1 1 21 LEU HD11 H -4.621 -6.129 1.740 1.00 . A A . 56 LEU HD11 1 1 3 2620 1 1 21 LEU HD12 H -5.638 -7.290 2.601 1.00 . A A . 56 LEU HD12 1 1 3 2621 1 1 21 LEU HD13 H -4.038 -6.866 3.233 1.00 . A A . 56 LEU HD13 1 1 3 2622 1 1 21 LEU HD21 H -4.216 -3.986 2.481 1.00 . A A . 56 LEU HD21 1 1 3 2623 1 1 21 LEU HD22 H -3.601 -4.552 4.041 1.00 . A A . 56 LEU HD22 1 1 3 2624 1 1 21 LEU HD23 H -4.914 -3.381 3.981 1.00 . A A . 56 LEU HD23 1 1 3 2625 1 1 21 LEU HG H -5.693 -5.679 4.501 1.00 . A A . 56 LEU HG 1 1 3 2626 1 1 21 LEU N N -8.906 -3.803 2.665 1.00 . A A . 56 LEU N 1 1 3 2627 1 1 21 LEU O O -7.592 -1.792 3.648 1.00 . A A . 56 LEU O 1 1 3 2628 1 1 22 VAL C C -4.663 -2.000 6.290 1.00 . A A . 57 VAL C 1 1 3 2629 1 1 22 VAL CA C -6.132 -1.784 5.916 1.00 . A A . 57 VAL CA 1 1 3 2630 1 1 22 VAL CB C -6.989 -1.249 7.117 1.00 . A A . 57 VAL CB 1 1 3 2631 1 1 22 VAL CG1 C -7.331 -2.339 8.118 1.00 . A A . 57 VAL CG1 1 1 3 2632 1 1 22 VAL CG2 C -6.302 -0.072 7.809 1.00 . A A . 57 VAL CG2 1 1 3 2633 1 1 22 VAL H H -6.565 -3.818 5.757 1.00 . A A . 57 VAL H 1 1 3 2634 1 1 22 VAL HA H -6.139 -1.032 5.140 1.00 . A A . 57 VAL HA 1 1 3 2635 1 1 22 VAL HB H -7.924 -0.896 6.708 1.00 . A A . 57 VAL HB 1 1 3 2636 1 1 22 VAL HG11 H -7.895 -3.111 7.616 1.00 . A A . 57 VAL HG11 1 1 3 2637 1 1 22 VAL HG12 H -7.925 -1.920 8.917 1.00 . A A . 57 VAL HG12 1 1 3 2638 1 1 22 VAL HG13 H -6.421 -2.757 8.519 1.00 . A A . 57 VAL HG13 1 1 3 2639 1 1 22 VAL HG21 H -6.905 0.276 8.635 1.00 . A A . 57 VAL HG21 1 1 3 2640 1 1 22 VAL HG22 H -6.177 0.730 7.096 1.00 . A A . 57 VAL HG22 1 1 3 2641 1 1 22 VAL HG23 H -5.333 -0.383 8.168 1.00 . A A . 57 VAL HG23 1 1 3 2642 1 1 22 VAL N N -6.701 -2.952 5.314 1.00 . A A . 57 VAL N 1 1 3 2643 1 1 22 VAL O O -4.340 -2.705 7.256 1.00 . A A . 57 VAL O 1 1 3 2644 1 1 23 ALA C C -1.986 -0.256 6.574 1.00 . A A . 58 ALA C 1 1 3 2645 1 1 23 ALA CA C -2.349 -1.518 5.821 1.00 . A A . 58 ALA CA 1 1 3 2646 1 1 23 ALA CB C -1.485 -1.727 4.554 1.00 . A A . 58 ALA CB 1 1 3 2647 1 1 23 ALA H H -4.106 -0.862 4.770 1.00 . A A . 58 ALA H 1 1 3 2648 1 1 23 ALA HA H -2.238 -2.354 6.499 1.00 . A A . 58 ALA HA 1 1 3 2649 1 1 23 ALA HB1 H -1.633 -0.906 3.868 1.00 . A A . 58 ALA HB1 1 1 3 2650 1 1 23 ALA HB2 H -1.744 -2.655 4.056 1.00 . A A . 58 ALA HB2 1 1 3 2651 1 1 23 ALA HB3 H -0.437 -1.779 4.812 1.00 . A A . 58 ALA HB3 1 1 3 2652 1 1 23 ALA N N -3.772 -1.418 5.511 1.00 . A A . 58 ALA N 1 1 3 2653 1 1 23 ALA O O -2.385 0.813 6.164 1.00 . A A . 58 ALA O 1 1 3 2654 1 1 24 ASP C C -2.204 1.117 9.257 1.00 . A A . 59 ASP C 1 1 3 2655 1 1 24 ASP CA C -0.920 0.564 8.713 1.00 . A A . 59 ASP CA 1 1 3 2656 1 1 24 ASP CB C 0.143 1.690 8.449 1.00 . A A . 59 ASP CB 1 1 3 2657 1 1 24 ASP CG C 0.132 2.419 7.137 1.00 . A A . 59 ASP CG 1 1 3 2658 1 1 24 ASP H H -0.713 -1.251 7.713 1.00 . A A . 59 ASP H 1 1 3 2659 1 1 24 ASP HA H -0.568 -0.069 9.517 1.00 . A A . 59 ASP HA 1 1 3 2660 1 1 24 ASP HB2 H -0.232 2.459 9.114 1.00 . A A . 59 ASP HB2 1 1 3 2661 1 1 24 ASP HB3 H 1.133 1.464 8.809 1.00 . A A . 59 ASP HB3 1 1 3 2662 1 1 24 ASP N N -1.192 -0.413 7.633 1.00 . A A . 59 ASP N 1 1 3 2663 1 1 24 ASP O O -2.681 0.681 10.316 1.00 . A A . 59 ASP O 1 1 3 2664 1 1 24 ASP OD1 O -0.763 3.276 6.937 1.00 . A A . 59 ASP OD1 1 1 3 2665 1 1 24 ASP OD2 O 1.071 2.221 6.334 1.00 . A A . 59 ASP OD2 1 1 3 2666 1 1 25 LYS C C -4.663 3.261 7.593 1.00 . A A . 60 LYS C 1 1 3 2667 1 1 25 LYS CA C -4.042 2.589 8.837 1.00 . A A . 60 LYS CA 1 1 3 2668 1 1 25 LYS CB C -3.913 3.539 10.004 1.00 . A A . 60 LYS CB 1 1 3 2669 1 1 25 LYS CD C -4.972 4.704 11.899 1.00 . A A . 60 LYS CD 1 1 3 2670 1 1 25 LYS CE C -6.245 5.000 12.659 1.00 . A A . 60 LYS CE 1 1 3 2671 1 1 25 LYS CG C -5.222 3.870 10.680 1.00 . A A . 60 LYS CG 1 1 3 2672 1 1 25 LYS H H -2.305 2.195 7.683 1.00 . A A . 60 LYS H 1 1 3 2673 1 1 25 LYS HA H -4.661 1.760 9.121 1.00 . A A . 60 LYS HA 1 1 3 2674 1 1 25 LYS HB2 H -3.240 3.113 10.734 1.00 . A A . 60 LYS HB2 1 1 3 2675 1 1 25 LYS HB3 H -3.491 4.449 9.615 1.00 . A A . 60 LYS HB3 1 1 3 2676 1 1 25 LYS HD2 H -4.302 4.149 12.538 1.00 . A A . 60 LYS HD2 1 1 3 2677 1 1 25 LYS HD3 H -4.498 5.621 11.583 1.00 . A A . 60 LYS HD3 1 1 3 2678 1 1 25 LYS HE2 H -6.906 5.577 12.030 1.00 . A A . 60 LYS HE2 1 1 3 2679 1 1 25 LYS HE3 H -6.722 4.065 12.916 1.00 . A A . 60 LYS HE3 1 1 3 2680 1 1 25 LYS HG2 H -5.846 4.418 9.989 1.00 . A A . 60 LYS HG2 1 1 3 2681 1 1 25 LYS HG3 H -5.708 2.946 10.957 1.00 . A A . 60 LYS HG3 1 1 3 2682 1 1 25 LYS HZ1 H -6.853 5.853 14.451 1.00 . A A . 60 LYS HZ1 1 1 3 2683 1 1 25 LYS HZ2 H -5.617 6.712 13.701 1.00 . A A . 60 LYS HZ2 1 1 3 2684 1 1 25 LYS HZ3 H -5.284 5.266 14.495 1.00 . A A . 60 LYS HZ3 1 1 3 2685 1 1 25 LYS N N -2.786 1.997 8.516 1.00 . A A . 60 LYS N 1 1 3 2686 1 1 25 LYS NZ N -5.978 5.758 13.897 1.00 . A A . 60 LYS NZ 1 1 3 2687 1 1 25 LYS O O -5.434 4.220 7.682 1.00 . A A . 60 LYS O 1 1 3 2688 1 1 26 LEU C C -5.756 2.142 4.661 1.00 . A A . 61 LEU C 1 1 3 2689 1 1 26 LEU CA C -4.857 3.216 5.200 1.00 . A A . 61 LEU CA 1 1 3 2690 1 1 26 LEU CB C -3.749 3.476 4.212 1.00 . A A . 61 LEU CB 1 1 3 2691 1 1 26 LEU CD1 C -1.589 4.516 3.578 1.00 . A A . 61 LEU CD1 1 1 3 2692 1 1 26 LEU CD2 C -3.250 5.839 4.882 1.00 . A A . 61 LEU CD2 1 1 3 2693 1 1 26 LEU CG C -2.664 4.455 4.639 1.00 . A A . 61 LEU CG 1 1 3 2694 1 1 26 LEU H H -3.674 2.011 6.410 1.00 . A A . 61 LEU H 1 1 3 2695 1 1 26 LEU HA H -5.419 4.119 5.359 1.00 . A A . 61 LEU HA 1 1 3 2696 1 1 26 LEU HB2 H -3.297 2.519 4.022 1.00 . A A . 61 LEU HB2 1 1 3 2697 1 1 26 LEU HB3 H -4.196 3.833 3.296 1.00 . A A . 61 LEU HB3 1 1 3 2698 1 1 26 LEU HD11 H -2.009 4.918 2.668 1.00 . A A . 61 LEU HD11 1 1 3 2699 1 1 26 LEU HD12 H -1.237 3.511 3.386 1.00 . A A . 61 LEU HD12 1 1 3 2700 1 1 26 LEU HD13 H -0.769 5.134 3.909 1.00 . A A . 61 LEU HD13 1 1 3 2701 1 1 26 LEU HD21 H -2.464 6.514 5.187 1.00 . A A . 61 LEU HD21 1 1 3 2702 1 1 26 LEU HD22 H -3.992 5.785 5.664 1.00 . A A . 61 LEU HD22 1 1 3 2703 1 1 26 LEU HD23 H -3.706 6.204 3.974 1.00 . A A . 61 LEU HD23 1 1 3 2704 1 1 26 LEU HG H -2.211 4.107 5.555 1.00 . A A . 61 LEU HG 1 1 3 2705 1 1 26 LEU N N -4.320 2.752 6.448 1.00 . A A . 61 LEU N 1 1 3 2706 1 1 26 LEU O O -5.383 0.963 4.667 1.00 . A A . 61 LEU O 1 1 3 2707 1 1 27 ILE C C -7.711 1.425 2.223 1.00 . A A . 62 ILE C 1 1 3 2708 1 1 27 ILE CA C -7.850 1.536 3.728 1.00 . A A . 62 ILE CA 1 1 3 2709 1 1 27 ILE CB C -9.319 1.936 4.041 1.00 . A A . 62 ILE CB 1 1 3 2710 1 1 27 ILE CD1 C -9.236 1.439 6.563 1.00 . A A . 62 ILE CD1 1 1 3 2711 1 1 27 ILE CG1 C -9.502 2.453 5.476 1.00 . A A . 62 ILE CG1 1 1 3 2712 1 1 27 ILE CG2 C -10.205 0.746 3.835 1.00 . A A . 62 ILE CG2 1 1 3 2713 1 1 27 ILE H H -7.154 3.459 4.122 1.00 . A A . 62 ILE H 1 1 3 2714 1 1 27 ILE HA H -7.615 0.593 4.202 1.00 . A A . 62 ILE HA 1 1 3 2715 1 1 27 ILE HB H -9.617 2.706 3.344 1.00 . A A . 62 ILE HB 1 1 3 2716 1 1 27 ILE HD11 H -9.411 1.883 7.532 1.00 . A A . 62 ILE HD11 1 1 3 2717 1 1 27 ILE HD12 H -8.207 1.124 6.486 1.00 . A A . 62 ILE HD12 1 1 3 2718 1 1 27 ILE HD13 H -9.884 0.585 6.426 1.00 . A A . 62 ILE HD13 1 1 3 2719 1 1 27 ILE HG12 H -8.812 3.267 5.620 1.00 . A A . 62 ILE HG12 1 1 3 2720 1 1 27 ILE HG13 H -10.511 2.823 5.593 1.00 . A A . 62 ILE HG13 1 1 3 2721 1 1 27 ILE HG21 H -11.223 1.030 4.052 1.00 . A A . 62 ILE HG21 1 1 3 2722 1 1 27 ILE HG22 H -9.869 0.000 4.542 1.00 . A A . 62 ILE HG22 1 1 3 2723 1 1 27 ILE HG23 H -10.104 0.388 2.821 1.00 . A A . 62 ILE HG23 1 1 3 2724 1 1 27 ILE N N -6.909 2.514 4.190 1.00 . A A . 62 ILE N 1 1 3 2725 1 1 27 ILE O O -7.800 2.428 1.510 1.00 . A A . 62 ILE O 1 1 3 2726 1 1 28 PHE C C -7.428 -1.426 -0.084 1.00 . A A . 63 PHE C 1 1 3 2727 1 1 28 PHE CA C -7.276 -0.014 0.351 1.00 . A A . 63 PHE CA 1 1 3 2728 1 1 28 PHE CB C -6.063 0.654 -0.265 1.00 . A A . 63 PHE CB 1 1 3 2729 1 1 28 PHE CD1 C -4.318 -0.728 0.956 1.00 . A A . 63 PHE CD1 1 1 3 2730 1 1 28 PHE CD2 C -4.047 1.605 0.698 1.00 . A A . 63 PHE CD2 1 1 3 2731 1 1 28 PHE CE1 C -3.128 -0.775 1.640 1.00 . A A . 63 PHE CE1 1 1 3 2732 1 1 28 PHE CE2 C -2.886 1.552 1.365 1.00 . A A . 63 PHE CE2 1 1 3 2733 1 1 28 PHE CG C -4.784 0.491 0.474 1.00 . A A . 63 PHE CG 1 1 3 2734 1 1 28 PHE CZ C -2.411 0.380 1.843 1.00 . A A . 63 PHE CZ 1 1 3 2735 1 1 28 PHE H H -7.340 -0.508 2.390 1.00 . A A . 63 PHE H 1 1 3 2736 1 1 28 PHE HA H -8.134 0.480 -0.080 1.00 . A A . 63 PHE HA 1 1 3 2737 1 1 28 PHE HB2 H -5.921 0.430 -1.309 1.00 . A A . 63 PHE HB2 1 1 3 2738 1 1 28 PHE HB3 H -6.275 1.710 -0.160 1.00 . A A . 63 PHE HB3 1 1 3 2739 1 1 28 PHE HD1 H -4.867 -1.647 0.802 1.00 . A A . 63 PHE HD1 1 1 3 2740 1 1 28 PHE HD2 H -4.403 2.554 0.327 1.00 . A A . 63 PHE HD2 1 1 3 2741 1 1 28 PHE HE1 H -2.757 -1.718 2.016 1.00 . A A . 63 PHE HE1 1 1 3 2742 1 1 28 PHE HE2 H -2.327 2.461 1.509 1.00 . A A . 63 PHE HE2 1 1 3 2743 1 1 28 PHE HZ H -1.466 0.402 2.369 1.00 . A A . 63 PHE HZ 1 1 3 2744 1 1 28 PHE N N -7.429 0.243 1.755 1.00 . A A . 63 PHE N 1 1 3 2745 1 1 28 PHE O O -7.558 -2.328 0.722 1.00 . A A . 63 PHE O 1 1 3 2746 1 1 29 HIS C C -6.224 -3.564 -1.774 1.00 . A A . 64 HIS C 1 1 3 2747 1 1 29 HIS CA C -7.521 -2.839 -2.064 1.00 . A A . 64 HIS CA 1 1 3 2748 1 1 29 HIS CB C -7.611 -2.600 -3.590 1.00 . A A . 64 HIS CB 1 1 3 2749 1 1 29 HIS CD2 C -9.930 -1.909 -4.437 1.00 . A A . 64 HIS CD2 1 1 3 2750 1 1 29 HIS CE1 C -9.613 0.251 -4.478 1.00 . A A . 64 HIS CE1 1 1 3 2751 1 1 29 HIS CG C -8.677 -1.646 -4.030 1.00 . A A . 64 HIS CG 1 1 3 2752 1 1 29 HIS H H -7.500 -0.776 -1.946 1.00 . A A . 64 HIS H 1 1 3 2753 1 1 29 HIS HA H -8.378 -3.409 -1.736 1.00 . A A . 64 HIS HA 1 1 3 2754 1 1 29 HIS HB2 H -6.689 -2.165 -3.936 1.00 . A A . 64 HIS HB2 1 1 3 2755 1 1 29 HIS HB3 H -7.774 -3.541 -4.092 1.00 . A A . 64 HIS HB3 1 1 3 2756 1 1 29 HIS HD2 H -10.371 -2.889 -4.509 1.00 . A A . 64 HIS HD2 1 1 3 2757 1 1 29 HIS HE1 H -9.790 1.311 -4.588 1.00 . A A . 64 HIS HE1 1 1 3 2758 1 1 29 HIS HE2 H -11.406 -0.576 -5.140 1.00 . A A . 64 HIS HE2 1 1 3 2759 1 1 29 HIS N N -7.472 -1.573 -1.385 1.00 . A A . 64 HIS N 1 1 3 2760 1 1 29 HIS ND1 N -8.477 -0.265 -4.054 1.00 . A A . 64 HIS ND1 1 1 3 2761 1 1 29 HIS NE2 N -10.525 -0.703 -4.722 1.00 . A A . 64 HIS NE2 1 1 3 2762 1 1 29 HIS O O -5.130 -3.017 -1.954 1.00 . A A . 64 HIS O 1 1 3 2763 1 1 30 ASN C C -4.286 -5.815 -2.124 1.00 . A A . 65 ASN C 1 1 3 2764 1 1 30 ASN CA C -5.272 -5.647 -0.968 1.00 . A A . 65 ASN CA 1 1 3 2765 1 1 30 ASN CB C -5.827 -7.027 -0.539 1.00 . A A . 65 ASN CB 1 1 3 2766 1 1 30 ASN CG C -6.609 -7.795 -1.626 1.00 . A A . 65 ASN CG 1 1 3 2767 1 1 30 ASN H H -7.264 -5.128 -1.138 1.00 . A A . 65 ASN H 1 1 3 2768 1 1 30 ASN HA H -4.757 -5.221 -0.121 1.00 . A A . 65 ASN HA 1 1 3 2769 1 1 30 ASN HB2 H -4.995 -7.636 -0.237 1.00 . A A . 65 ASN HB2 1 1 3 2770 1 1 30 ASN HB3 H -6.478 -6.886 0.311 1.00 . A A . 65 ASN HB3 1 1 3 2771 1 1 30 ASN HD21 H -6.006 -9.513 -0.871 1.00 . A A . 65 ASN HD21 1 1 3 2772 1 1 30 ASN HD22 H -7.035 -9.612 -2.258 1.00 . A A . 65 ASN HD22 1 1 3 2773 1 1 30 ASN N N -6.364 -4.773 -1.306 1.00 . A A . 65 ASN N 1 1 3 2774 1 1 30 ASN ND2 N -6.543 -9.099 -1.581 1.00 . A A . 65 ASN ND2 1 1 3 2775 1 1 30 ASN O O -3.082 -5.906 -1.919 1.00 . A A . 65 ASN O 1 1 3 2776 1 1 30 ASN OD1 O -7.259 -7.209 -2.495 1.00 . A A . 65 ASN OD1 1 1 3 2777 1 1 31 SER C C -3.341 -4.835 -5.065 1.00 . A A . 66 SER C 1 1 3 2778 1 1 31 SER CA C -4.084 -6.079 -4.503 1.00 . A A . 66 SER CA 1 1 3 2779 1 1 31 SER CB C -5.016 -6.689 -5.535 1.00 . A A . 66 SER CB 1 1 3 2780 1 1 31 SER H H -5.795 -5.818 -3.379 1.00 . A A . 66 SER H 1 1 3 2781 1 1 31 SER HA H -3.329 -6.822 -4.313 1.00 . A A . 66 SER HA 1 1 3 2782 1 1 31 SER HB2 H -4.505 -6.650 -6.483 1.00 . A A . 66 SER HB2 1 1 3 2783 1 1 31 SER HB3 H -5.220 -7.718 -5.279 1.00 . A A . 66 SER HB3 1 1 3 2784 1 1 31 SER HG H -6.966 -6.562 -5.354 1.00 . A A . 66 SER HG 1 1 3 2785 1 1 31 SER N N -4.820 -5.887 -3.302 1.00 . A A . 66 SER N 1 1 3 2786 1 1 31 SER O O -2.417 -4.997 -5.873 1.00 . A A . 66 SER O 1 1 3 2787 1 1 31 SER OG O -6.248 -5.963 -5.600 1.00 . A A . 66 SER OG 1 1 3 2788 1 1 32 CYS C C -1.902 -1.827 -4.890 1.00 . A A . 67 CYS C 1 1 3 2789 1 1 32 CYS CA C -3.194 -2.455 -5.379 1.00 . A A . 67 CYS CA 1 1 3 2790 1 1 32 CYS CB C -4.273 -1.385 -5.537 1.00 . A A . 67 CYS CB 1 1 3 2791 1 1 32 CYS H H -4.198 -3.502 -3.803 1.00 . A A . 67 CYS H 1 1 3 2792 1 1 32 CYS HA H -2.989 -2.830 -6.370 1.00 . A A . 67 CYS HA 1 1 3 2793 1 1 32 CYS HB2 H -3.820 -0.501 -5.961 1.00 . A A . 67 CYS HB2 1 1 3 2794 1 1 32 CYS HB3 H -5.082 -1.744 -6.155 1.00 . A A . 67 CYS HB3 1 1 3 2795 1 1 32 CYS N N -3.678 -3.622 -4.629 1.00 . A A . 67 CYS N 1 1 3 2796 1 1 32 CYS O O -1.262 -1.080 -5.645 1.00 . A A . 67 CYS O 1 1 3 2797 1 1 32 CYS SG S -4.962 -0.786 -4.015 1.00 . A A . 67 CYS SG 1 1 3 2798 1 1 33 PHE C C 0.948 -2.097 -3.584 1.00 . A A . 68 PHE C 1 1 3 2799 1 1 33 PHE CA C -0.326 -1.390 -3.203 1.00 . A A . 68 PHE CA 1 1 3 2800 1 1 33 PHE CB C -0.363 -0.997 -1.714 1.00 . A A . 68 PHE CB 1 1 3 2801 1 1 33 PHE CD1 C -1.826 -2.755 -0.645 1.00 . A A . 68 PHE CD1 1 1 3 2802 1 1 33 PHE CD2 C 0.337 -2.342 0.256 1.00 . A A . 68 PHE CD2 1 1 3 2803 1 1 33 PHE CE1 C -2.052 -3.708 0.338 1.00 . A A . 68 PHE CE1 1 1 3 2804 1 1 33 PHE CE2 C 0.117 -3.278 1.234 1.00 . A A . 68 PHE CE2 1 1 3 2805 1 1 33 PHE CG C -0.625 -2.066 -0.693 1.00 . A A . 68 PHE CG 1 1 3 2806 1 1 33 PHE CZ C -1.071 -3.960 1.278 1.00 . A A . 68 PHE CZ 1 1 3 2807 1 1 33 PHE H H -1.970 -2.707 -3.091 1.00 . A A . 68 PHE H 1 1 3 2808 1 1 33 PHE HA H -0.321 -0.478 -3.784 1.00 . A A . 68 PHE HA 1 1 3 2809 1 1 33 PHE HB2 H 0.667 -0.774 -1.487 1.00 . A A . 68 PHE HB2 1 1 3 2810 1 1 33 PHE HB3 H -0.999 -0.144 -1.529 1.00 . A A . 68 PHE HB3 1 1 3 2811 1 1 33 PHE HD1 H -2.576 -2.541 -1.392 1.00 . A A . 68 PHE HD1 1 1 3 2812 1 1 33 PHE HD2 H 1.276 -1.808 0.219 1.00 . A A . 68 PHE HD2 1 1 3 2813 1 1 33 PHE HE1 H -2.992 -4.240 0.384 1.00 . A A . 68 PHE HE1 1 1 3 2814 1 1 33 PHE HE2 H 0.874 -3.477 1.977 1.00 . A A . 68 PHE HE2 1 1 3 2815 1 1 33 PHE HZ H -1.215 -4.692 2.058 1.00 . A A . 68 PHE HZ 1 1 3 2816 1 1 33 PHE N N -1.497 -2.073 -3.668 1.00 . A A . 68 PHE N 1 1 3 2817 1 1 33 PHE O O 1.360 -3.073 -2.963 1.00 . A A . 68 PHE O 1 1 3 2818 1 1 34 CYS C C 3.736 -0.939 -4.960 1.00 . A A . 69 CYS C 1 1 3 2819 1 1 34 CYS CA C 2.762 -2.083 -5.136 1.00 . A A . 69 CYS CA 1 1 3 2820 1 1 34 CYS CB C 2.654 -2.474 -6.613 1.00 . A A . 69 CYS CB 1 1 3 2821 1 1 34 CYS H H 1.062 -0.925 -5.145 1.00 . A A . 69 CYS H 1 1 3 2822 1 1 34 CYS HA H 3.077 -2.936 -4.554 1.00 . A A . 69 CYS HA 1 1 3 2823 1 1 34 CYS HB2 H 2.519 -1.607 -7.242 1.00 . A A . 69 CYS HB2 1 1 3 2824 1 1 34 CYS HB3 H 3.597 -2.918 -6.885 1.00 . A A . 69 CYS HB3 1 1 3 2825 1 1 34 CYS HG H 0.216 -3.043 -7.107 1.00 . A A . 69 CYS HG 1 1 3 2826 1 1 34 CYS N N 1.511 -1.637 -4.646 1.00 . A A . 69 CYS N 1 1 3 2827 1 1 34 CYS O O 3.317 0.168 -4.596 1.00 . A A . 69 CYS O 1 1 3 2828 1 1 34 CYS SG S 1.361 -3.700 -6.959 1.00 . A A . 69 CYS SG 1 1 3 2829 1 1 35 CYS C C 5.732 0.924 -6.098 1.00 . A A . 70 CYS C 1 1 3 2830 1 1 35 CYS CA C 5.989 -0.138 -5.045 1.00 . A A . 70 CYS CA 1 1 3 2831 1 1 35 CYS CB C 7.413 -0.703 -5.087 1.00 . A A . 70 CYS CB 1 1 3 2832 1 1 35 CYS H H 5.276 -2.103 -5.397 1.00 . A A . 70 CYS H 1 1 3 2833 1 1 35 CYS HA H 5.825 0.324 -4.084 1.00 . A A . 70 CYS HA 1 1 3 2834 1 1 35 CYS HB2 H 7.549 -1.183 -4.130 1.00 . A A . 70 CYS HB2 1 1 3 2835 1 1 35 CYS HB3 H 7.515 -1.458 -5.851 1.00 . A A . 70 CYS HB3 1 1 3 2836 1 1 35 CYS N N 5.010 -1.190 -5.157 1.00 . A A . 70 CYS N 1 1 3 2837 1 1 35 CYS O O 5.300 0.639 -7.216 1.00 . A A . 70 CYS O 1 1 3 2838 1 1 35 CYS SG S 8.767 0.504 -5.213 1.00 . A A . 70 CYS SG 1 1 3 2839 1 1 36 LYS C C 6.750 3.544 -7.496 1.00 . A A . 71 LYS C 1 1 3 2840 1 1 36 LYS CA C 5.614 3.268 -6.523 1.00 . A A . 71 LYS CA 1 1 3 2841 1 1 36 LYS CB C 5.380 4.496 -5.651 1.00 . A A . 71 LYS CB 1 1 3 2842 1 1 36 LYS CD C 3.029 4.825 -6.303 1.00 . A A . 71 LYS CD 1 1 3 2843 1 1 36 LYS CE C 2.232 5.280 -7.491 1.00 . A A . 71 LYS CE 1 1 3 2844 1 1 36 LYS CG C 4.419 5.452 -6.286 1.00 . A A . 71 LYS CG 1 1 3 2845 1 1 36 LYS H H 6.231 2.272 -4.772 1.00 . A A . 71 LYS H 1 1 3 2846 1 1 36 LYS HA H 4.722 3.099 -7.106 1.00 . A A . 71 LYS HA 1 1 3 2847 1 1 36 LYS HB2 H 4.952 4.184 -4.709 1.00 . A A . 71 LYS HB2 1 1 3 2848 1 1 36 LYS HB3 H 6.323 4.985 -5.479 1.00 . A A . 71 LYS HB3 1 1 3 2849 1 1 36 LYS HD2 H 3.094 3.748 -6.312 1.00 . A A . 71 LYS HD2 1 1 3 2850 1 1 36 LYS HD3 H 2.512 5.134 -5.406 1.00 . A A . 71 LYS HD3 1 1 3 2851 1 1 36 LYS HE2 H 2.848 5.036 -8.343 1.00 . A A . 71 LYS HE2 1 1 3 2852 1 1 36 LYS HE3 H 1.313 4.714 -7.538 1.00 . A A . 71 LYS HE3 1 1 3 2853 1 1 36 LYS HG2 H 4.399 6.378 -5.733 1.00 . A A . 71 LYS HG2 1 1 3 2854 1 1 36 LYS HG3 H 4.732 5.631 -7.303 1.00 . A A . 71 LYS HG3 1 1 3 2855 1 1 36 LYS HZ1 H 1.396 6.979 -6.618 1.00 . A A . 71 LYS HZ1 1 1 3 2856 1 1 36 LYS HZ2 H 1.389 6.996 -8.303 1.00 . A A . 71 LYS HZ2 1 1 3 2857 1 1 36 LYS HZ3 H 2.816 7.297 -7.475 1.00 . A A . 71 LYS HZ3 1 1 3 2858 1 1 36 LYS N N 5.923 2.142 -5.698 1.00 . A A . 71 LYS N 1 1 3 2859 1 1 36 LYS NZ N 1.944 6.730 -7.466 1.00 . A A . 71 LYS NZ 1 1 3 2860 1 1 36 LYS O O 6.568 4.222 -8.502 1.00 . A A . 71 LYS O 1 1 3 2861 1 1 37 HIS C C 9.245 2.069 -9.013 1.00 . A A . 72 HIS C 1 1 3 2862 1 1 37 HIS CA C 9.067 3.246 -8.039 1.00 . A A . 72 HIS CA 1 1 3 2863 1 1 37 HIS CB C 10.304 3.452 -7.165 1.00 . A A . 72 HIS CB 1 1 3 2864 1 1 37 HIS CD2 C 12.429 3.683 -8.644 1.00 . A A . 72 HIS CD2 1 1 3 2865 1 1 37 HIS CE1 C 12.788 5.798 -8.268 1.00 . A A . 72 HIS CE1 1 1 3 2866 1 1 37 HIS CG C 11.452 4.163 -7.836 1.00 . A A . 72 HIS CG 1 1 3 2867 1 1 37 HIS H H 7.985 2.457 -6.395 1.00 . A A . 72 HIS H 1 1 3 2868 1 1 37 HIS HA H 8.877 4.147 -8.601 1.00 . A A . 72 HIS HA 1 1 3 2869 1 1 37 HIS HB2 H 10.007 4.058 -6.323 1.00 . A A . 72 HIS HB2 1 1 3 2870 1 1 37 HIS HB3 H 10.657 2.494 -6.811 1.00 . A A . 72 HIS HB3 1 1 3 2871 1 1 37 HIS HD2 H 12.524 2.670 -9.008 1.00 . A A . 72 HIS HD2 1 1 3 2872 1 1 37 HIS HE1 H 13.261 6.770 -8.255 1.00 . A A . 72 HIS HE1 1 1 3 2873 1 1 37 HIS HE2 H 14.227 4.634 -9.138 1.00 . A A . 72 HIS HE2 1 1 3 2874 1 1 37 HIS N N 7.915 3.011 -7.199 1.00 . A A . 72 HIS N 1 1 3 2875 1 1 37 HIS ND1 N 11.678 5.500 -7.609 1.00 . A A . 72 HIS ND1 1 1 3 2876 1 1 37 HIS NE2 N 13.275 4.731 -8.910 1.00 . A A . 72 HIS NE2 1 1 3 2877 1 1 37 HIS O O 9.722 2.238 -10.140 1.00 . A A . 72 HIS O 1 1 3 2878 1 1 38 CYS C C 7.607 -1.061 -9.096 1.00 . A A . 73 CYS C 1 1 3 2879 1 1 38 CYS CA C 8.876 -0.276 -9.398 1.00 . A A . 73 CYS CA 1 1 3 2880 1 1 38 CYS CB C 10.126 -1.098 -9.063 1.00 . A A . 73 CYS CB 1 1 3 2881 1 1 38 CYS H H 8.435 0.763 -7.699 1.00 . A A . 73 CYS H 1 1 3 2882 1 1 38 CYS HA H 8.940 0.077 -10.414 1.00 . A A . 73 CYS HA 1 1 3 2883 1 1 38 CYS HB2 H 10.395 -1.749 -9.870 1.00 . A A . 73 CYS HB2 1 1 3 2884 1 1 38 CYS HB3 H 10.897 -0.354 -9.014 1.00 . A A . 73 CYS HB3 1 1 3 2885 1 1 38 CYS N N 8.831 0.885 -8.582 1.00 . A A . 73 CYS N 1 1 3 2886 1 1 38 CYS O O 7.249 -1.147 -7.943 1.00 . A A . 73 CYS O 1 1 3 2887 1 1 38 CYS SG S 10.131 -2.029 -7.496 1.00 . A A . 73 CYS SG 1 1 3 2888 1 1 39 HIS C C 5.871 -3.744 -9.170 1.00 . A A . 74 HIS C 1 1 3 2889 1 1 39 HIS CA C 5.648 -2.361 -9.800 1.00 . A A . 74 HIS CA 1 1 3 2890 1 1 39 HIS CB C 4.693 -2.413 -11.017 1.00 . A A . 74 HIS CB 1 1 3 2891 1 1 39 HIS CD2 C 5.471 -4.236 -12.696 1.00 . A A . 74 HIS CD2 1 1 3 2892 1 1 39 HIS CE1 C 6.125 -2.914 -14.300 1.00 . A A . 74 HIS CE1 1 1 3 2893 1 1 39 HIS CG C 5.267 -2.965 -12.287 1.00 . A A . 74 HIS CG 1 1 3 2894 1 1 39 HIS H H 7.277 -1.582 -10.991 1.00 . A A . 74 HIS H 1 1 3 2895 1 1 39 HIS HA H 5.164 -1.794 -9.013 1.00 . A A . 74 HIS HA 1 1 3 2896 1 1 39 HIS HB2 H 3.859 -3.042 -10.749 1.00 . A A . 74 HIS HB2 1 1 3 2897 1 1 39 HIS HB3 H 4.327 -1.416 -11.208 1.00 . A A . 74 HIS HB3 1 1 3 2898 1 1 39 HIS HD1 H 5.654 -1.184 -13.328 1.00 . A A . 74 HIS HD1 1 1 3 2899 1 1 39 HIS HD2 H 5.250 -5.134 -12.137 1.00 . A A . 74 HIS HD2 1 1 3 2900 1 1 39 HIS HE1 H 6.524 -2.553 -15.236 1.00 . A A . 74 HIS HE1 1 1 3 2901 1 1 39 HIS HE2 H 5.974 -4.907 -14.601 1.00 . A A . 74 HIS HE2 1 1 3 2902 1 1 39 HIS N N 6.924 -1.629 -10.076 1.00 . A A . 74 HIS N 1 1 3 2903 1 1 39 HIS ND1 N 5.685 -2.168 -13.319 1.00 . A A . 74 HIS ND1 1 1 3 2904 1 1 39 HIS NE2 N 6.007 -4.173 -13.950 1.00 . A A . 74 HIS NE2 1 1 3 2905 1 1 39 HIS O O 5.390 -4.767 -9.640 1.00 . A A . 74 HIS O 1 1 3 2906 1 1 40 THR C C 5.721 -5.169 -6.411 1.00 . A A . 75 THR C 1 1 3 2907 1 1 40 THR CA C 6.910 -4.841 -7.297 1.00 . A A . 75 THR CA 1 1 3 2908 1 1 40 THR CB C 8.196 -4.541 -6.478 1.00 . A A . 75 THR CB 1 1 3 2909 1 1 40 THR CG2 C 8.224 -5.152 -5.089 1.00 . A A . 75 THR CG2 1 1 3 2910 1 1 40 THR H H 6.966 -2.835 -7.880 1.00 . A A . 75 THR H 1 1 3 2911 1 1 40 THR HA H 7.105 -5.682 -7.943 1.00 . A A . 75 THR HA 1 1 3 2912 1 1 40 THR HB H 8.224 -3.464 -6.385 1.00 . A A . 75 THR HB 1 1 3 2913 1 1 40 THR HG1 H 9.737 -4.049 -7.572 1.00 . A A . 75 THR HG1 1 1 3 2914 1 1 40 THR HG21 H 9.201 -5.003 -4.654 1.00 . A A . 75 THR HG21 1 1 3 2915 1 1 40 THR HG22 H 7.954 -6.197 -5.109 1.00 . A A . 75 THR HG22 1 1 3 2916 1 1 40 THR HG23 H 7.506 -4.577 -4.518 1.00 . A A . 75 THR HG23 1 1 3 2917 1 1 40 THR N N 6.609 -3.720 -8.114 1.00 . A A . 75 THR N 1 1 3 2918 1 1 40 THR O O 5.158 -4.273 -5.743 1.00 . A A . 75 THR O 1 1 3 2919 1 1 40 THR OG1 O 9.368 -4.876 -7.224 1.00 . A A . 75 THR OG1 1 1 3 2920 1 1 41 LYS C C 4.542 -7.047 -4.215 1.00 . A A . 76 LYS C 1 1 3 2921 1 1 41 LYS CA C 4.191 -6.901 -5.684 1.00 . A A . 76 LYS CA 1 1 3 2922 1 1 41 LYS CB C 3.705 -8.221 -6.228 1.00 . A A . 76 LYS CB 1 1 3 2923 1 1 41 LYS CD C 1.269 -7.671 -6.360 1.00 . A A . 76 LYS CD 1 1 3 2924 1 1 41 LYS CE C -0.118 -8.131 -5.993 1.00 . A A . 76 LYS CE 1 1 3 2925 1 1 41 LYS CG C 2.320 -8.590 -5.755 1.00 . A A . 76 LYS CG 1 1 3 2926 1 1 41 LYS H H 5.854 -7.092 -6.932 1.00 . A A . 76 LYS H 1 1 3 2927 1 1 41 LYS HA H 3.410 -6.164 -5.790 1.00 . A A . 76 LYS HA 1 1 3 2928 1 1 41 LYS HB2 H 3.710 -8.192 -7.307 1.00 . A A . 76 LYS HB2 1 1 3 2929 1 1 41 LYS HB3 H 4.388 -8.986 -5.887 1.00 . A A . 76 LYS HB3 1 1 3 2930 1 1 41 LYS HD2 H 1.409 -6.666 -5.989 1.00 . A A . 76 LYS HD2 1 1 3 2931 1 1 41 LYS HD3 H 1.373 -7.681 -7.434 1.00 . A A . 76 LYS HD3 1 1 3 2932 1 1 41 LYS HE2 H -0.223 -9.173 -6.253 1.00 . A A . 76 LYS HE2 1 1 3 2933 1 1 41 LYS HE3 H -0.239 -8.021 -4.925 1.00 . A A . 76 LYS HE3 1 1 3 2934 1 1 41 LYS HG2 H 2.120 -9.611 -6.029 1.00 . A A . 76 LYS HG2 1 1 3 2935 1 1 41 LYS HG3 H 2.290 -8.500 -4.679 1.00 . A A . 76 LYS HG3 1 1 3 2936 1 1 41 LYS HZ1 H -1.217 -6.361 -6.377 1.00 . A A . 76 LYS HZ1 1 1 3 2937 1 1 41 LYS HZ2 H -2.102 -7.793 -6.505 1.00 . A A . 76 LYS HZ2 1 1 3 2938 1 1 41 LYS HZ3 H -1.023 -7.373 -7.706 1.00 . A A . 76 LYS HZ3 1 1 3 2939 1 1 41 LYS N N 5.337 -6.435 -6.418 1.00 . A A . 76 LYS N 1 1 3 2940 1 1 41 LYS NZ N -1.174 -7.358 -6.677 1.00 . A A . 76 LYS NZ 1 1 3 2941 1 1 41 LYS O O 4.907 -8.121 -3.722 1.00 . A A . 76 LYS O 1 1 3 2942 1 1 42 LEU C C 3.510 -5.910 -1.320 1.00 . A A . 77 LEU C 1 1 3 2943 1 1 42 LEU CA C 4.751 -5.881 -2.150 1.00 . A A . 77 LEU CA 1 1 3 2944 1 1 42 LEU CB C 5.634 -4.670 -1.884 1.00 . A A . 77 LEU CB 1 1 3 2945 1 1 42 LEU CD1 C 4.046 -2.728 -1.352 1.00 . A A . 77 LEU CD1 1 1 3 2946 1 1 42 LEU CD2 C 6.205 -2.356 -2.354 1.00 . A A . 77 LEU CD2 1 1 3 2947 1 1 42 LEU CG C 5.087 -3.286 -2.292 1.00 . A A . 77 LEU CG 1 1 3 2948 1 1 42 LEU H H 4.183 -5.179 -4.067 1.00 . A A . 77 LEU H 1 1 3 2949 1 1 42 LEU HA H 5.318 -6.765 -1.902 1.00 . A A . 77 LEU HA 1 1 3 2950 1 1 42 LEU HB2 H 5.994 -4.637 -0.869 1.00 . A A . 77 LEU HB2 1 1 3 2951 1 1 42 LEU HB3 H 6.467 -4.823 -2.556 1.00 . A A . 77 LEU HB3 1 1 3 2952 1 1 42 LEU HD11 H 3.578 -1.860 -1.793 1.00 . A A . 77 LEU HD11 1 1 3 2953 1 1 42 LEU HD12 H 4.606 -2.392 -0.493 1.00 . A A . 77 LEU HD12 1 1 3 2954 1 1 42 LEU HD13 H 3.319 -3.476 -1.069 1.00 . A A . 77 LEU HD13 1 1 3 2955 1 1 42 LEU HD21 H 5.863 -1.402 -2.727 1.00 . A A . 77 LEU HD21 1 1 3 2956 1 1 42 LEU HD22 H 6.984 -2.757 -2.986 1.00 . A A . 77 LEU HD22 1 1 3 2957 1 1 42 LEU HD23 H 6.589 -2.217 -1.355 1.00 . A A . 77 LEU HD23 1 1 3 2958 1 1 42 LEU HG H 4.666 -3.340 -3.285 1.00 . A A . 77 LEU HG 1 1 3 2959 1 1 42 LEU N N 4.458 -5.968 -3.553 1.00 . A A . 77 LEU N 1 1 3 2960 1 1 42 LEU O O 3.570 -5.902 -0.091 1.00 . A A . 77 LEU O 1 1 3 2961 1 1 43 SER C C 1.056 -7.156 -0.409 1.00 . A A . 78 SER C 1 1 3 2962 1 1 43 SER CA C 1.120 -5.974 -1.367 1.00 . A A . 78 SER CA 1 1 3 2963 1 1 43 SER CB C 0.099 -6.176 -2.450 1.00 . A A . 78 SER CB 1 1 3 2964 1 1 43 SER H H 2.419 -5.942 -2.975 1.00 . A A . 78 SER H 1 1 3 2965 1 1 43 SER HA H 0.902 -5.049 -0.868 1.00 . A A . 78 SER HA 1 1 3 2966 1 1 43 SER HB2 H 0.072 -7.235 -2.623 1.00 . A A . 78 SER HB2 1 1 3 2967 1 1 43 SER HB3 H -0.868 -5.828 -2.117 1.00 . A A . 78 SER HB3 1 1 3 2968 1 1 43 SER HG H 0.691 -4.565 -3.389 1.00 . A A . 78 SER HG 1 1 3 2969 1 1 43 SER N N 2.387 -5.951 -2.000 1.00 . A A . 78 SER N 1 1 3 2970 1 1 43 SER O O 1.472 -8.273 -0.771 1.00 . A A . 78 SER O 1 1 3 2971 1 1 43 SER OG O 0.487 -5.480 -3.636 1.00 . A A . 78 SER OG 1 1 3 2972 1 1 44 LEU C C 1.313 -9.010 1.905 1.00 . A A . 79 LEU C 1 1 3 2973 1 1 44 LEU CA C 0.351 -7.809 1.884 1.00 . A A . 79 LEU CA 1 1 3 2974 1 1 44 LEU CB C -1.106 -8.183 2.073 1.00 . A A . 79 LEU CB 1 1 3 2975 1 1 44 LEU CD1 C -0.972 -8.831 4.470 1.00 . A A . 79 LEU CD1 1 1 3 2976 1 1 44 LEU CD2 C -1.530 -6.470 3.897 1.00 . A A . 79 LEU CD2 1 1 3 2977 1 1 44 LEU CG C -1.664 -7.946 3.483 1.00 . A A . 79 LEU CG 1 1 3 2978 1 1 44 LEU H H 0.229 -5.960 0.901 1.00 . A A . 79 LEU H 1 1 3 2979 1 1 44 LEU HA H 0.650 -7.237 2.747 1.00 . A A . 79 LEU HA 1 1 3 2980 1 1 44 LEU HB2 H -1.686 -7.602 1.375 1.00 . A A . 79 LEU HB2 1 1 3 2981 1 1 44 LEU HB3 H -1.207 -9.231 1.840 1.00 . A A . 79 LEU HB3 1 1 3 2982 1 1 44 LEU HD11 H -1.131 -9.850 4.153 1.00 . A A . 79 LEU HD11 1 1 3 2983 1 1 44 LEU HD12 H -1.382 -8.664 5.454 1.00 . A A . 79 LEU HD12 1 1 3 2984 1 1 44 LEU HD13 H 0.082 -8.603 4.446 1.00 . A A . 79 LEU HD13 1 1 3 2985 1 1 44 LEU HD21 H -2.169 -5.852 3.285 1.00 . A A . 79 LEU HD21 1 1 3 2986 1 1 44 LEU HD22 H -0.517 -6.122 3.758 1.00 . A A . 79 LEU HD22 1 1 3 2987 1 1 44 LEU HD23 H -1.810 -6.344 4.932 1.00 . A A . 79 LEU HD23 1 1 3 2988 1 1 44 LEU HG H -2.710 -8.207 3.492 1.00 . A A . 79 LEU HG 1 1 3 2989 1 1 44 LEU N N 0.523 -6.883 0.767 1.00 . A A . 79 LEU N 1 1 3 2990 1 1 44 LEU O O 0.948 -10.147 1.581 1.00 . A A . 79 LEU O 1 1 3 2991 1 1 45 GLY C C 4.783 -9.073 2.912 1.00 . A A . 80 GLY C 1 1 3 2992 1 1 45 GLY CA C 3.554 -9.715 2.369 1.00 . A A . 80 GLY CA 1 1 3 2993 1 1 45 GLY H H 2.777 -7.784 2.410 1.00 . A A . 80 GLY H 1 1 3 2994 1 1 45 GLY HA2 H 3.216 -10.488 3.044 1.00 . A A . 80 GLY HA2 1 1 3 2995 1 1 45 GLY HA3 H 3.776 -10.148 1.405 1.00 . A A . 80 GLY HA3 1 1 3 2996 1 1 45 GLY N N 2.535 -8.719 2.246 1.00 . A A . 80 GLY N 1 1 3 2997 1 1 45 GLY O O 5.016 -9.085 4.123 1.00 . A A . 80 GLY O 1 1 3 2998 1 1 46 SER C C 6.678 -6.342 1.818 1.00 . A A . 81 SER C 1 1 3 2999 1 1 46 SER CA C 6.696 -7.712 2.466 1.00 . A A . 81 SER CA 1 1 3 3000 1 1 46 SER CB C 7.955 -8.509 2.099 1.00 . A A . 81 SER CB 1 1 3 3001 1 1 46 SER H H 5.253 -8.432 1.105 1.00 . A A . 81 SER H 1 1 3 3002 1 1 46 SER HA H 6.650 -7.592 3.538 1.00 . A A . 81 SER HA 1 1 3 3003 1 1 46 SER HB2 H 8.830 -7.901 2.278 1.00 . A A . 81 SER HB2 1 1 3 3004 1 1 46 SER HB3 H 8.007 -9.394 2.715 1.00 . A A . 81 SER HB3 1 1 3 3005 1 1 46 SER HG H 7.512 -8.192 0.235 1.00 . A A . 81 SER HG 1 1 3 3006 1 1 46 SER N N 5.518 -8.435 2.054 1.00 . A A . 81 SER N 1 1 3 3007 1 1 46 SER O O 6.912 -6.219 0.612 1.00 . A A . 81 SER O 1 1 3 3008 1 1 46 SER OG O 7.943 -8.904 0.725 1.00 . A A . 81 SER OG 1 1 3 3009 1 1 47 TYR C C 6.800 -2.939 2.994 1.00 . A A . 82 TYR C 1 1 3 3010 1 1 47 TYR CA C 6.233 -4.005 2.070 1.00 . A A . 82 TYR CA 1 1 3 3011 1 1 47 TYR CB C 4.729 -3.746 1.780 1.00 . A A . 82 TYR CB 1 1 3 3012 1 1 47 TYR CD1 C 3.802 -2.861 3.962 1.00 . A A . 82 TYR CD1 1 1 3 3013 1 1 47 TYR CD2 C 2.850 -4.862 3.096 1.00 . A A . 82 TYR CD2 1 1 3 3014 1 1 47 TYR CE1 C 2.950 -2.911 5.030 1.00 . A A . 82 TYR CE1 1 1 3 3015 1 1 47 TYR CE2 C 1.994 -4.915 4.166 1.00 . A A . 82 TYR CE2 1 1 3 3016 1 1 47 TYR CG C 3.782 -3.829 2.975 1.00 . A A . 82 TYR CG 1 1 3 3017 1 1 47 TYR CZ C 2.048 -3.946 5.130 1.00 . A A . 82 TYR CZ 1 1 3 3018 1 1 47 TYR H H 6.294 -5.433 3.571 1.00 . A A . 82 TYR H 1 1 3 3019 1 1 47 TYR HA H 6.765 -3.950 1.132 1.00 . A A . 82 TYR HA 1 1 3 3020 1 1 47 TYR HB2 H 4.587 -2.781 1.322 1.00 . A A . 82 TYR HB2 1 1 3 3021 1 1 47 TYR HB3 H 4.407 -4.489 1.066 1.00 . A A . 82 TYR HB3 1 1 3 3022 1 1 47 TYR HD1 H 4.524 -2.063 3.875 1.00 . A A . 82 TYR HD1 1 1 3 3023 1 1 47 TYR HD2 H 2.772 -5.643 2.354 1.00 . A A . 82 TYR HD2 1 1 3 3024 1 1 47 TYR HE1 H 2.999 -2.129 5.772 1.00 . A A . 82 TYR HE1 1 1 3 3025 1 1 47 TYR HE2 H 1.287 -5.725 4.249 1.00 . A A . 82 TYR HE2 1 1 3 3026 1 1 47 TYR HH H 0.990 -3.095 6.453 1.00 . A A . 82 TYR HH 1 1 3 3027 1 1 47 TYR N N 6.407 -5.324 2.601 1.00 . A A . 82 TYR N 1 1 3 3028 1 1 47 TYR O O 7.163 -3.215 4.141 1.00 . A A . 82 TYR O 1 1 3 3029 1 1 47 TYR OH O 1.183 -4.004 6.194 1.00 . A A . 82 TYR OH 1 1 3 3030 1 1 48 ALA C C 6.361 0.517 2.768 1.00 . A A . 83 ALA C 1 1 3 3031 1 1 48 ALA CA C 7.301 -0.588 3.198 1.00 . A A . 83 ALA CA 1 1 3 3032 1 1 48 ALA CB C 8.738 -0.211 2.882 1.00 . A A . 83 ALA CB 1 1 3 3033 1 1 48 ALA H H 6.728 -1.621 1.509 1.00 . A A . 83 ALA H 1 1 3 3034 1 1 48 ALA HA H 7.198 -0.782 4.255 1.00 . A A . 83 ALA HA 1 1 3 3035 1 1 48 ALA HB1 H 8.992 0.713 3.385 1.00 . A A . 83 ALA HB1 1 1 3 3036 1 1 48 ALA HB2 H 8.852 -0.082 1.816 1.00 . A A . 83 ALA HB2 1 1 3 3037 1 1 48 ALA HB3 H 9.395 -0.996 3.225 1.00 . A A . 83 ALA HB3 1 1 3 3038 1 1 48 ALA N N 6.921 -1.754 2.463 1.00 . A A . 83 ALA N 1 1 3 3039 1 1 48 ALA O O 6.293 0.857 1.601 1.00 . A A . 83 ALA O 1 1 3 3040 1 1 49 ALA C C 5.007 3.370 3.888 1.00 . A A . 84 ALA C 1 1 3 3041 1 1 49 ALA CA C 4.685 2.060 3.254 1.00 . A A . 84 ALA CA 1 1 3 3042 1 1 49 ALA CB C 3.260 1.634 3.565 1.00 . A A . 84 ALA CB 1 1 3 3043 1 1 49 ALA H H 5.686 0.807 4.606 1.00 . A A . 84 ALA H 1 1 3 3044 1 1 49 ALA HA H 4.773 2.168 2.183 1.00 . A A . 84 ALA HA 1 1 3 3045 1 1 49 ALA HB1 H 3.116 1.588 4.634 1.00 . A A . 84 ALA HB1 1 1 3 3046 1 1 49 ALA HB2 H 3.082 0.655 3.145 1.00 . A A . 84 ALA HB2 1 1 3 3047 1 1 49 ALA HB3 H 2.571 2.344 3.133 1.00 . A A . 84 ALA HB3 1 1 3 3048 1 1 49 ALA N N 5.619 1.056 3.659 1.00 . A A . 84 ALA N 1 1 3 3049 1 1 49 ALA O O 5.208 3.447 5.109 1.00 . A A . 84 ALA O 1 1 3 3050 1 1 50 LEU C C 4.082 6.496 3.279 1.00 . A A . 85 LEU C 1 1 3 3051 1 1 50 LEU CA C 5.299 5.696 3.577 1.00 . A A . 85 LEU CA 1 1 3 3052 1 1 50 LEU CB C 6.520 6.339 2.901 1.00 . A A . 85 LEU CB 1 1 3 3053 1 1 50 LEU CD1 C 7.523 7.687 4.740 1.00 . A A . 85 LEU CD1 1 1 3 3054 1 1 50 LEU CD2 C 7.690 8.532 2.435 1.00 . A A . 85 LEU CD2 1 1 3 3055 1 1 50 LEU CG C 6.865 7.738 3.405 1.00 . A A . 85 LEU CG 1 1 3 3056 1 1 50 LEU H H 4.894 4.323 2.122 1.00 . A A . 85 LEU H 1 1 3 3057 1 1 50 LEU HA H 5.463 5.653 4.641 1.00 . A A . 85 LEU HA 1 1 3 3058 1 1 50 LEU HB2 H 7.350 5.705 3.151 1.00 . A A . 85 LEU HB2 1 1 3 3059 1 1 50 LEU HB3 H 6.423 6.376 1.830 1.00 . A A . 85 LEU HB3 1 1 3 3060 1 1 50 LEU HD11 H 7.680 8.709 5.053 1.00 . A A . 85 LEU HD11 1 1 3 3061 1 1 50 LEU HD12 H 8.466 7.176 4.614 1.00 . A A . 85 LEU HD12 1 1 3 3062 1 1 50 LEU HD13 H 6.891 7.167 5.443 1.00 . A A . 85 LEU HD13 1 1 3 3063 1 1 50 LEU HD21 H 8.622 8.019 2.243 1.00 . A A . 85 LEU HD21 1 1 3 3064 1 1 50 LEU HD22 H 7.887 9.496 2.884 1.00 . A A . 85 LEU HD22 1 1 3 3065 1 1 50 LEU HD23 H 7.142 8.666 1.514 1.00 . A A . 85 LEU HD23 1 1 3 3066 1 1 50 LEU HG H 5.926 8.249 3.543 1.00 . A A . 85 LEU HG 1 1 3 3067 1 1 50 LEU N N 5.064 4.390 3.092 1.00 . A A . 85 LEU N 1 1 3 3068 1 1 50 LEU O O 3.321 6.145 2.381 1.00 . A A . 85 LEU O 1 1 3 3069 1 1 51 HIS C C 2.840 8.927 2.365 1.00 . A A . 86 HIS C 1 1 3 3070 1 1 51 HIS CA C 2.789 8.454 3.822 1.00 . A A . 86 HIS CA 1 1 3 3071 1 1 51 HIS CB C 2.873 9.659 4.822 1.00 . A A . 86 HIS CB 1 1 3 3072 1 1 51 HIS CD2 C 5.137 10.828 4.133 1.00 . A A . 86 HIS CD2 1 1 3 3073 1 1 51 HIS CE1 C 6.072 10.915 6.085 1.00 . A A . 86 HIS CE1 1 1 3 3074 1 1 51 HIS CG C 4.263 10.275 5.012 1.00 . A A . 86 HIS CG 1 1 3 3075 1 1 51 HIS H H 4.405 7.577 4.882 1.00 . A A . 86 HIS H 1 1 3 3076 1 1 51 HIS HA H 1.863 7.929 3.989 1.00 . A A . 86 HIS HA 1 1 3 3077 1 1 51 HIS HB2 H 2.223 10.445 4.469 1.00 . A A . 86 HIS HB2 1 1 3 3078 1 1 51 HIS HB3 H 2.521 9.327 5.787 1.00 . A A . 86 HIS HB3 1 1 3 3079 1 1 51 HIS HD1 H 4.529 10.068 7.104 1.00 . A A . 86 HIS HD1 1 1 3 3080 1 1 51 HIS HD2 H 5.015 10.891 3.064 1.00 . A A . 86 HIS HD2 1 1 3 3081 1 1 51 HIS HE1 H 6.813 11.076 6.851 1.00 . A A . 86 HIS HE1 1 1 3 3082 1 1 51 HIS HE2 H 6.824 11.957 4.542 1.00 . A A . 86 HIS HE2 1 1 3 3083 1 1 51 HIS N N 3.853 7.511 4.075 1.00 . A A . 86 HIS N 1 1 3 3084 1 1 51 HIS ND1 N 4.888 10.351 6.232 1.00 . A A . 86 HIS ND1 1 1 3 3085 1 1 51 HIS NE2 N 6.239 11.215 4.827 1.00 . A A . 86 HIS NE2 1 1 3 3086 1 1 51 HIS O O 3.821 9.511 1.922 1.00 . A A . 86 HIS O 1 1 3 3087 1 1 52 GLY C C 2.158 7.955 -0.723 1.00 . A A . 87 GLY C 1 1 3 3088 1 1 52 GLY CA C 1.774 9.057 0.262 1.00 . A A . 87 GLY CA 1 1 3 3089 1 1 52 GLY H H 1.051 8.158 2.019 1.00 . A A . 87 GLY H 1 1 3 3090 1 1 52 GLY HA2 H 0.777 9.396 0.024 1.00 . A A . 87 GLY HA2 1 1 3 3091 1 1 52 GLY HA3 H 2.457 9.884 0.134 1.00 . A A . 87 GLY HA3 1 1 3 3092 1 1 52 GLY N N 1.807 8.655 1.634 1.00 . A A . 87 GLY N 1 1 3 3093 1 1 52 GLY O O 1.445 7.761 -1.717 1.00 . A A . 87 GLY O 1 1 3 3094 1 1 53 GLU C C 4.146 4.927 -0.813 1.00 . A A . 88 GLU C 1 1 3 3095 1 1 53 GLU CA C 3.723 6.222 -1.454 1.00 . A A . 88 GLU CA 1 1 3 3096 1 1 53 GLU CB C 4.862 6.747 -2.343 1.00 . A A . 88 GLU CB 1 1 3 3097 1 1 53 GLU CD C 5.559 8.549 -3.977 1.00 . A A . 88 GLU CD 1 1 3 3098 1 1 53 GLU CG C 4.506 8.035 -3.043 1.00 . A A . 88 GLU CG 1 1 3 3099 1 1 53 GLU H H 3.719 7.246 0.393 1.00 . A A . 88 GLU H 1 1 3 3100 1 1 53 GLU HA H 2.868 6.041 -2.088 1.00 . A A . 88 GLU HA 1 1 3 3101 1 1 53 GLU HB2 H 5.784 6.842 -1.792 1.00 . A A . 88 GLU HB2 1 1 3 3102 1 1 53 GLU HB3 H 5.010 6.011 -3.120 1.00 . A A . 88 GLU HB3 1 1 3 3103 1 1 53 GLU HG2 H 3.609 7.851 -3.618 1.00 . A A . 88 GLU HG2 1 1 3 3104 1 1 53 GLU HG3 H 4.286 8.767 -2.282 1.00 . A A . 88 GLU HG3 1 1 3 3105 1 1 53 GLU N N 3.253 7.210 -0.473 1.00 . A A . 88 GLU N 1 1 3 3106 1 1 53 GLU O O 4.746 4.902 0.263 1.00 . A A . 88 GLU O 1 1 3 3107 1 1 53 GLU OE1 O 6.646 8.918 -3.523 1.00 . A A . 88 GLU OE1 1 1 3 3108 1 1 53 GLU OE2 O 5.296 8.620 -5.194 1.00 . A A . 88 GLU OE2 1 1 3 3109 1 1 54 PHE C C 5.382 2.151 -1.770 1.00 . A A . 89 PHE C 1 1 3 3110 1 1 54 PHE CA C 4.144 2.543 -1.051 1.00 . A A . 89 PHE CA 1 1 3 3111 1 1 54 PHE CB C 2.945 1.644 -1.374 1.00 . A A . 89 PHE CB 1 1 3 3112 1 1 54 PHE CD1 C 0.989 3.214 -1.391 1.00 . A A . 89 PHE CD1 1 1 3 3113 1 1 54 PHE CD2 C 1.320 1.840 0.529 1.00 . A A . 89 PHE CD2 1 1 3 3114 1 1 54 PHE CE1 C -0.081 3.810 -0.799 1.00 . A A . 89 PHE CE1 1 1 3 3115 1 1 54 PHE CE2 C 0.253 2.448 1.133 1.00 . A A . 89 PHE CE2 1 1 3 3116 1 1 54 PHE CG C 1.708 2.215 -0.739 1.00 . A A . 89 PHE CG 1 1 3 3117 1 1 54 PHE CZ C -0.449 3.440 0.459 1.00 . A A . 89 PHE CZ 1 1 3 3118 1 1 54 PHE H H 3.434 3.945 -2.372 1.00 . A A . 89 PHE H 1 1 3 3119 1 1 54 PHE HA H 4.324 2.557 0.014 1.00 . A A . 89 PHE HA 1 1 3 3120 1 1 54 PHE HB2 H 2.804 1.616 -2.444 1.00 . A A . 89 PHE HB2 1 1 3 3121 1 1 54 PHE HB3 H 3.111 0.644 -1.009 1.00 . A A . 89 PHE HB3 1 1 3 3122 1 1 54 PHE HD1 H 1.283 3.507 -2.388 1.00 . A A . 89 PHE HD1 1 1 3 3123 1 1 54 PHE HD2 H 1.853 1.066 1.061 1.00 . A A . 89 PHE HD2 1 1 3 3124 1 1 54 PHE HE1 H -0.628 4.584 -1.317 1.00 . A A . 89 PHE HE1 1 1 3 3125 1 1 54 PHE HE2 H -0.043 2.138 2.126 1.00 . A A . 89 PHE HE2 1 1 3 3126 1 1 54 PHE HZ H -1.288 3.937 0.921 1.00 . A A . 89 PHE HZ 1 1 3 3127 1 1 54 PHE N N 3.855 3.865 -1.494 1.00 . A A . 89 PHE N 1 1 3 3128 1 1 54 PHE O O 5.488 2.331 -2.985 1.00 . A A . 89 PHE O 1 1 3 3129 1 1 55 TYR C C 8.117 0.173 -1.264 1.00 . A A . 90 TYR C 1 1 3 3130 1 1 55 TYR CA C 7.618 1.545 -1.609 1.00 . A A . 90 TYR CA 1 1 3 3131 1 1 55 TYR CB C 8.467 2.623 -0.944 1.00 . A A . 90 TYR CB 1 1 3 3132 1 1 55 TYR CD1 C 8.040 4.509 -2.535 1.00 . A A . 90 TYR CD1 1 1 3 3133 1 1 55 TYR CD2 C 10.298 3.985 -1.991 1.00 . A A . 90 TYR CD2 1 1 3 3134 1 1 55 TYR CE1 C 8.451 5.529 -3.339 1.00 . A A . 90 TYR CE1 1 1 3 3135 1 1 55 TYR CE2 C 10.726 5.012 -2.796 1.00 . A A . 90 TYR CE2 1 1 3 3136 1 1 55 TYR CG C 8.954 3.713 -1.844 1.00 . A A . 90 TYR CG 1 1 3 3137 1 1 55 TYR CZ C 9.792 5.788 -3.472 1.00 . A A . 90 TYR CZ 1 1 3 3138 1 1 55 TYR H H 6.187 1.396 -0.127 1.00 . A A . 90 TYR H 1 1 3 3139 1 1 55 TYR HA H 7.605 1.714 -2.675 1.00 . A A . 90 TYR HA 1 1 3 3140 1 1 55 TYR HB2 H 7.694 3.196 -0.446 1.00 . A A . 90 TYR HB2 1 1 3 3141 1 1 55 TYR HB3 H 9.206 2.296 -0.232 1.00 . A A . 90 TYR HB3 1 1 3 3142 1 1 55 TYR HD1 H 6.979 4.329 -2.437 1.00 . A A . 90 TYR HD1 1 1 3 3143 1 1 55 TYR HD2 H 11.025 3.380 -1.472 1.00 . A A . 90 TYR HD2 1 1 3 3144 1 1 55 TYR HE1 H 7.704 6.114 -3.856 1.00 . A A . 90 TYR HE1 1 1 3 3145 1 1 55 TYR HE2 H 11.789 5.205 -2.871 1.00 . A A . 90 TYR HE2 1 1 3 3146 1 1 55 TYR HH H 9.723 7.608 -4.015 1.00 . A A . 90 TYR HH 1 1 3 3147 1 1 55 TYR N N 6.328 1.685 -1.060 1.00 . A A . 90 TYR N 1 1 3 3148 1 1 55 TYR O O 7.741 -0.385 -0.245 1.00 . A A . 90 TYR O 1 1 3 3149 1 1 55 TYR OH O 10.202 6.814 -4.288 1.00 . A A . 90 TYR OH 1 1 3 3150 1 1 56 CYS C C 10.507 -1.526 -0.802 1.00 . A A . 91 CYS C 1 1 3 3151 1 1 56 CYS CA C 9.405 -1.716 -1.787 1.00 . A A . 91 CYS CA 1 1 3 3152 1 1 56 CYS CB C 9.904 -2.490 -3.019 1.00 . A A . 91 CYS CB 1 1 3 3153 1 1 56 CYS H H 9.159 0.041 -2.942 1.00 . A A . 91 CYS H 1 1 3 3154 1 1 56 CYS HA H 8.586 -2.250 -1.323 1.00 . A A . 91 CYS HA 1 1 3 3155 1 1 56 CYS HB2 H 10.179 -3.486 -2.711 1.00 . A A . 91 CYS HB2 1 1 3 3156 1 1 56 CYS HB3 H 9.112 -2.582 -3.742 1.00 . A A . 91 CYS HB3 1 1 3 3157 1 1 56 CYS N N 8.904 -0.416 -2.116 1.00 . A A . 91 CYS N 1 1 3 3158 1 1 56 CYS O O 11.100 -0.439 -0.791 1.00 . A A . 91 CYS O 1 1 3 3159 1 1 56 CYS SG S 11.322 -1.757 -3.849 1.00 . A A . 91 CYS SG 1 1 3 3160 1 1 57 LYS C C 13.193 -1.912 0.346 1.00 . A A . 92 LYS C 1 1 3 3161 1 1 57 LYS CA C 11.851 -2.359 0.994 1.00 . A A . 92 LYS CA 1 1 3 3162 1 1 57 LYS CB C 12.009 -3.618 1.852 1.00 . A A . 92 LYS CB 1 1 3 3163 1 1 57 LYS CD C 10.933 -5.243 3.466 1.00 . A A . 92 LYS CD 1 1 3 3164 1 1 57 LYS CE C 12.038 -5.128 4.509 1.00 . A A . 92 LYS CE 1 1 3 3165 1 1 57 LYS CG C 10.762 -3.957 2.670 1.00 . A A . 92 LYS CG 1 1 3 3166 1 1 57 LYS H H 10.263 -3.334 -0.041 1.00 . A A . 92 LYS H 1 1 3 3167 1 1 57 LYS HA H 11.536 -1.545 1.630 1.00 . A A . 92 LYS HA 1 1 3 3168 1 1 57 LYS HB2 H 12.241 -4.459 1.216 1.00 . A A . 92 LYS HB2 1 1 3 3169 1 1 57 LYS HB3 H 12.828 -3.454 2.536 1.00 . A A . 92 LYS HB3 1 1 3 3170 1 1 57 LYS HD2 H 10.003 -5.470 3.965 1.00 . A A . 92 LYS HD2 1 1 3 3171 1 1 57 LYS HD3 H 11.175 -6.037 2.777 1.00 . A A . 92 LYS HD3 1 1 3 3172 1 1 57 LYS HE2 H 12.957 -4.845 4.020 1.00 . A A . 92 LYS HE2 1 1 3 3173 1 1 57 LYS HE3 H 11.762 -4.364 5.220 1.00 . A A . 92 LYS HE3 1 1 3 3174 1 1 57 LYS HG2 H 10.565 -3.150 3.360 1.00 . A A . 92 LYS HG2 1 1 3 3175 1 1 57 LYS HG3 H 9.922 -4.066 1.999 1.00 . A A . 92 LYS HG3 1 1 3 3176 1 1 57 LYS HZ1 H 12.988 -6.262 5.964 1.00 . A A . 92 LYS HZ1 1 1 3 3177 1 1 57 LYS HZ2 H 12.612 -7.125 4.575 1.00 . A A . 92 LYS HZ2 1 1 3 3178 1 1 57 LYS HZ3 H 11.401 -6.752 5.680 1.00 . A A . 92 LYS HZ3 1 1 3 3179 1 1 57 LYS N N 10.790 -2.505 0.012 1.00 . A A . 92 LYS N 1 1 3 3180 1 1 57 LYS NZ N 12.265 -6.394 5.227 1.00 . A A . 92 LYS NZ 1 1 3 3181 1 1 57 LYS O O 13.773 -0.936 0.820 1.00 . A A . 92 LYS O 1 1 3 3182 1 1 58 PRO C C 14.847 -0.607 -1.876 1.00 . A A . 93 PRO C 1 1 3 3183 1 1 58 PRO CA C 14.890 -2.098 -1.481 1.00 . A A . 93 PRO CA 1 1 3 3184 1 1 58 PRO CB C 14.933 -2.958 -2.743 1.00 . A A . 93 PRO CB 1 1 3 3185 1 1 58 PRO CD C 13.081 -3.737 -1.476 1.00 . A A . 93 PRO CD 1 1 3 3186 1 1 58 PRO CG C 14.158 -4.172 -2.403 1.00 . A A . 93 PRO CG 1 1 3 3187 1 1 58 PRO HA H 15.768 -2.285 -0.880 1.00 . A A . 93 PRO HA 1 1 3 3188 1 1 58 PRO HB2 H 14.479 -2.417 -3.561 1.00 . A A . 93 PRO HB2 1 1 3 3189 1 1 58 PRO HB3 H 15.956 -3.199 -2.988 1.00 . A A . 93 PRO HB3 1 1 3 3190 1 1 58 PRO HD2 H 12.203 -3.478 -2.050 1.00 . A A . 93 PRO HD2 1 1 3 3191 1 1 58 PRO HD3 H 12.853 -4.517 -0.765 1.00 . A A . 93 PRO HD3 1 1 3 3192 1 1 58 PRO HG2 H 13.730 -4.608 -3.293 1.00 . A A . 93 PRO HG2 1 1 3 3193 1 1 58 PRO HG3 H 14.788 -4.890 -1.906 1.00 . A A . 93 PRO HG3 1 1 3 3194 1 1 58 PRO N N 13.663 -2.542 -0.795 1.00 . A A . 93 PRO N 1 1 3 3195 1 1 58 PRO O O 15.806 0.131 -1.653 1.00 . A A . 93 PRO O 1 1 3 3196 1 1 59 HIS C C 13.447 2.172 -1.707 1.00 . A A . 94 HIS C 1 1 3 3197 1 1 59 HIS CA C 13.614 1.238 -2.865 1.00 . A A . 94 HIS CA 1 1 3 3198 1 1 59 HIS CB C 12.522 1.479 -3.916 1.00 . A A . 94 HIS CB 1 1 3 3199 1 1 59 HIS CD2 C 14.175 1.281 -5.852 1.00 . A A . 94 HIS CD2 1 1 3 3200 1 1 59 HIS CE1 C 12.778 0.543 -7.368 1.00 . A A . 94 HIS CE1 1 1 3 3201 1 1 59 HIS CG C 12.953 1.148 -5.305 1.00 . A A . 94 HIS CG 1 1 3 3202 1 1 59 HIS H H 12.997 -0.797 -2.587 1.00 . A A . 94 HIS H 1 1 3 3203 1 1 59 HIS HA H 14.565 1.485 -3.312 1.00 . A A . 94 HIS HA 1 1 3 3204 1 1 59 HIS HB2 H 11.665 0.865 -3.682 1.00 . A A . 94 HIS HB2 1 1 3 3205 1 1 59 HIS HB3 H 12.236 2.520 -3.889 1.00 . A A . 94 HIS HB3 1 1 3 3206 1 1 59 HIS HD2 H 15.053 1.625 -5.318 1.00 . A A . 94 HIS HD2 1 1 3 3207 1 1 59 HIS HE1 H 12.370 0.191 -8.308 1.00 . A A . 94 HIS HE1 1 1 3 3208 1 1 59 HIS HE2 H 14.677 1.190 -7.880 1.00 . A A . 94 HIS HE2 1 1 3 3209 1 1 59 HIS N N 13.737 -0.164 -2.452 1.00 . A A . 94 HIS N 1 1 3 3210 1 1 59 HIS ND1 N 12.070 0.685 -6.255 1.00 . A A . 94 HIS ND1 1 1 3 3211 1 1 59 HIS NE2 N 14.064 0.898 -7.169 1.00 . A A . 94 HIS NE2 1 1 3 3212 1 1 59 HIS O O 13.966 3.273 -1.725 1.00 . A A . 94 HIS O 1 1 3 3213 1 1 60 PHE C C 13.864 2.755 1.167 1.00 . A A . 95 PHE C 1 1 3 3214 1 1 60 PHE CA C 12.529 2.537 0.472 1.00 . A A . 95 PHE CA 1 1 3 3215 1 1 60 PHE CB C 11.536 1.830 1.392 1.00 . A A . 95 PHE CB 1 1 3 3216 1 1 60 PHE CD1 C 10.237 3.798 2.189 1.00 . A A . 95 PHE CD1 1 1 3 3217 1 1 60 PHE CD2 C 11.211 2.380 3.792 1.00 . A A . 95 PHE CD2 1 1 3 3218 1 1 60 PHE CE1 C 9.730 4.588 3.194 1.00 . A A . 95 PHE CE1 1 1 3 3219 1 1 60 PHE CE2 C 10.707 3.159 4.800 1.00 . A A . 95 PHE CE2 1 1 3 3220 1 1 60 PHE CG C 10.986 2.687 2.483 1.00 . A A . 95 PHE CG 1 1 3 3221 1 1 60 PHE CZ C 9.965 4.268 4.503 1.00 . A A . 95 PHE CZ 1 1 3 3222 1 1 60 PHE H H 12.356 0.834 -0.740 1.00 . A A . 95 PHE H 1 1 3 3223 1 1 60 PHE HA H 12.130 3.501 0.187 1.00 . A A . 95 PHE HA 1 1 3 3224 1 1 60 PHE HB2 H 10.712 1.445 0.811 1.00 . A A . 95 PHE HB2 1 1 3 3225 1 1 60 PHE HB3 H 12.051 1.000 1.851 1.00 . A A . 95 PHE HB3 1 1 3 3226 1 1 60 PHE HD1 H 10.050 4.048 1.156 1.00 . A A . 95 PHE HD1 1 1 3 3227 1 1 60 PHE HD2 H 11.800 1.510 4.037 1.00 . A A . 95 PHE HD2 1 1 3 3228 1 1 60 PHE HE1 H 9.153 5.464 2.950 1.00 . A A . 95 PHE HE1 1 1 3 3229 1 1 60 PHE HE2 H 10.901 2.879 5.823 1.00 . A A . 95 PHE HE2 1 1 3 3230 1 1 60 PHE HZ H 9.565 4.883 5.295 1.00 . A A . 95 PHE HZ 1 1 3 3231 1 1 60 PHE N N 12.750 1.735 -0.702 1.00 . A A . 95 PHE N 1 1 3 3232 1 1 60 PHE O O 14.180 3.858 1.582 1.00 . A A . 95 PHE O 1 1 3 3233 1 1 61 GLN C C 16.931 2.662 1.033 1.00 . A A . 96 GLN C 1 1 3 3234 1 1 61 GLN CA C 15.978 1.764 1.829 1.00 . A A . 96 GLN CA 1 1 3 3235 1 1 61 GLN CB C 16.554 0.363 2.039 1.00 . A A . 96 GLN CB 1 1 3 3236 1 1 61 GLN CD C 16.329 -1.855 3.272 1.00 . A A . 96 GLN CD 1 1 3 3237 1 1 61 GLN CG C 15.811 -0.441 3.106 1.00 . A A . 96 GLN CG 1 1 3 3238 1 1 61 GLN H H 14.338 0.841 0.888 1.00 . A A . 96 GLN H 1 1 3 3239 1 1 61 GLN HA H 15.854 2.229 2.795 1.00 . A A . 96 GLN HA 1 1 3 3240 1 1 61 GLN HB2 H 16.491 -0.172 1.104 1.00 . A A . 96 GLN HB2 1 1 3 3241 1 1 61 GLN HB3 H 17.590 0.446 2.333 1.00 . A A . 96 GLN HB3 1 1 3 3242 1 1 61 GLN HE21 H 17.658 -1.222 4.569 1.00 . A A . 96 GLN HE21 1 1 3 3243 1 1 61 GLN HE22 H 17.682 -2.918 4.225 1.00 . A A . 96 GLN HE22 1 1 3 3244 1 1 61 GLN HG2 H 15.915 0.081 4.045 1.00 . A A . 96 GLN HG2 1 1 3 3245 1 1 61 GLN HG3 H 14.759 -0.479 2.855 1.00 . A A . 96 GLN HG3 1 1 3 3246 1 1 61 GLN N N 14.656 1.703 1.240 1.00 . A A . 96 GLN N 1 1 3 3247 1 1 61 GLN NE2 N 17.314 -2.017 4.106 1.00 . A A . 96 GLN NE2 1 1 3 3248 1 1 61 GLN O O 17.684 3.438 1.615 1.00 . A A . 96 GLN O 1 1 3 3249 1 1 61 GLN OE1 O 15.848 -2.799 2.636 1.00 . A A . 96 GLN OE1 1 1 3 3250 1 1 62 GLN C C 17.323 4.846 -1.174 1.00 . A A . 97 GLN C 1 1 3 3251 1 1 62 GLN CA C 17.774 3.377 -1.098 1.00 . A A . 97 GLN CA 1 1 3 3252 1 1 62 GLN CB C 17.822 2.795 -2.508 1.00 . A A . 97 GLN CB 1 1 3 3253 1 1 62 GLN CD C 18.469 0.917 -4.028 1.00 . A A . 97 GLN CD 1 1 3 3254 1 1 62 GLN CG C 18.540 1.467 -2.625 1.00 . A A . 97 GLN CG 1 1 3 3255 1 1 62 GLN H H 16.320 1.931 -0.748 1.00 . A A . 97 GLN H 1 1 3 3256 1 1 62 GLN HA H 18.771 3.328 -0.689 1.00 . A A . 97 GLN HA 1 1 3 3257 1 1 62 GLN HB2 H 16.817 2.656 -2.890 1.00 . A A . 97 GLN HB2 1 1 3 3258 1 1 62 GLN HB3 H 18.323 3.508 -3.134 1.00 . A A . 97 GLN HB3 1 1 3 3259 1 1 62 GLN HE21 H 16.815 -0.028 -3.577 1.00 . A A . 97 GLN HE21 1 1 3 3260 1 1 62 GLN HE22 H 17.381 -0.220 -5.204 1.00 . A A . 97 GLN HE22 1 1 3 3261 1 1 62 GLN HG2 H 19.577 1.604 -2.358 1.00 . A A . 97 GLN HG2 1 1 3 3262 1 1 62 GLN HG3 H 18.081 0.759 -1.950 1.00 . A A . 97 GLN HG3 1 1 3 3263 1 1 62 GLN N N 16.903 2.569 -0.287 1.00 . A A . 97 GLN N 1 1 3 3264 1 1 62 GLN NE2 N 17.455 0.146 -4.296 1.00 . A A . 97 GLN NE2 1 1 3 3265 1 1 62 GLN O O 18.089 5.762 -0.849 1.00 . A A . 97 GLN O 1 1 3 3266 1 1 62 GLN OE1 O 19.328 1.193 -4.868 1.00 . A A . 97 GLN OE1 1 1 3 3267 1 1 63 LEU C C 15.144 7.118 -0.502 1.00 . A A . 98 LEU C 1 1 3 3268 1 1 63 LEU CA C 15.538 6.380 -1.774 1.00 . A A . 98 LEU CA 1 1 3 3269 1 1 63 LEU CB C 14.350 6.254 -2.704 1.00 . A A . 98 LEU CB 1 1 3 3270 1 1 63 LEU CD1 C 13.464 5.207 -4.769 1.00 . A A . 98 LEU CD1 1 1 3 3271 1 1 63 LEU CD2 C 15.191 6.930 -4.960 1.00 . A A . 98 LEU CD2 1 1 3 3272 1 1 63 LEU CG C 14.681 5.777 -4.123 1.00 . A A . 98 LEU CG 1 1 3 3273 1 1 63 LEU H H 15.483 4.282 -1.673 1.00 . A A . 98 LEU H 1 1 3 3274 1 1 63 LEU HA H 16.287 6.951 -2.296 1.00 . A A . 98 LEU HA 1 1 3 3275 1 1 63 LEU HB2 H 13.671 5.544 -2.253 1.00 . A A . 98 LEU HB2 1 1 3 3276 1 1 63 LEU HB3 H 13.857 7.212 -2.769 1.00 . A A . 98 LEU HB3 1 1 3 3277 1 1 63 LEU HD11 H 12.690 5.959 -4.788 1.00 . A A . 98 LEU HD11 1 1 3 3278 1 1 63 LEU HD12 H 13.141 4.355 -4.190 1.00 . A A . 98 LEU HD12 1 1 3 3279 1 1 63 LEU HD13 H 13.703 4.899 -5.776 1.00 . A A . 98 LEU HD13 1 1 3 3280 1 1 63 LEU HD21 H 14.449 7.714 -4.943 1.00 . A A . 98 LEU HD21 1 1 3 3281 1 1 63 LEU HD22 H 15.314 6.599 -5.982 1.00 . A A . 98 LEU HD22 1 1 3 3282 1 1 63 LEU HD23 H 16.125 7.301 -4.565 1.00 . A A . 98 LEU HD23 1 1 3 3283 1 1 63 LEU HG H 15.450 5.020 -4.089 1.00 . A A . 98 LEU HG 1 1 3 3284 1 1 63 LEU N N 16.082 5.051 -1.542 1.00 . A A . 98 LEU N 1 1 3 3285 1 1 63 LEU O O 15.497 8.288 -0.317 1.00 . A A . 98 LEU O 1 1 3 3286 1 1 64 PHE C C 14.819 6.771 2.834 1.00 . A A . 99 PHE C 1 1 3 3287 1 1 64 PHE CA C 13.973 7.097 1.600 1.00 . A A . 99 PHE CA 1 1 3 3288 1 1 64 PHE CB C 12.484 6.761 1.822 1.00 . A A . 99 PHE CB 1 1 3 3289 1 1 64 PHE CD1 C 11.888 8.491 0.057 1.00 . A A . 99 PHE CD1 1 1 3 3290 1 1 64 PHE CD2 C 10.236 6.883 0.662 1.00 . A A . 99 PHE CD2 1 1 3 3291 1 1 64 PHE CE1 C 11.013 9.041 -0.850 1.00 . A A . 99 PHE CE1 1 1 3 3292 1 1 64 PHE CE2 C 9.365 7.444 -0.246 1.00 . A A . 99 PHE CE2 1 1 3 3293 1 1 64 PHE CG C 11.518 7.396 0.831 1.00 . A A . 99 PHE CG 1 1 3 3294 1 1 64 PHE CZ C 9.759 8.521 -1.000 1.00 . A A . 99 PHE CZ 1 1 3 3295 1 1 64 PHE H H 14.266 5.486 0.268 1.00 . A A . 99 PHE H 1 1 3 3296 1 1 64 PHE HA H 14.061 8.159 1.439 1.00 . A A . 99 PHE HA 1 1 3 3297 1 1 64 PHE HB2 H 12.411 5.718 1.545 1.00 . A A . 99 PHE HB2 1 1 3 3298 1 1 64 PHE HB3 H 12.156 6.896 2.838 1.00 . A A . 99 PHE HB3 1 1 3 3299 1 1 64 PHE HD1 H 12.873 8.922 0.153 1.00 . A A . 99 PHE HD1 1 1 3 3300 1 1 64 PHE HD2 H 9.891 6.043 1.247 1.00 . A A . 99 PHE HD2 1 1 3 3301 1 1 64 PHE HE1 H 11.297 9.890 -1.450 1.00 . A A . 99 PHE HE1 1 1 3 3302 1 1 64 PHE HE2 H 8.375 7.032 -0.363 1.00 . A A . 99 PHE HE2 1 1 3 3303 1 1 64 PHE HZ H 9.088 8.969 -1.717 1.00 . A A . 99 PHE HZ 1 1 3 3304 1 1 64 PHE N N 14.477 6.435 0.406 1.00 . A A . 99 PHE N 1 1 3 3305 1 1 64 PHE O O 14.565 7.263 3.931 1.00 . A A . 99 PHE O 1 1 3 3306 1 1 65 LYS C C 16.291 5.009 4.899 1.00 . A A . 100 LYS C 1 1 3 3307 1 1 65 LYS CA C 16.845 5.529 3.582 1.00 . A A . 100 LYS CA 1 1 3 3308 1 1 65 LYS CB C 17.853 6.644 3.821 1.00 . A A . 100 LYS CB 1 1 3 3309 1 1 65 LYS CD C 19.740 8.089 2.933 1.00 . A A . 100 LYS CD 1 1 3 3310 1 1 65 LYS CE C 19.171 9.516 3.083 1.00 . A A . 100 LYS CE 1 1 3 3311 1 1 65 LYS CG C 18.690 7.014 2.611 1.00 . A A . 100 LYS CG 1 1 3 3312 1 1 65 LYS H H 15.878 5.503 1.725 1.00 . A A . 100 LYS H 1 1 3 3313 1 1 65 LYS HA H 17.378 4.706 3.129 1.00 . A A . 100 LYS HA 1 1 3 3314 1 1 65 LYS HB2 H 17.327 7.524 4.156 1.00 . A A . 100 LYS HB2 1 1 3 3315 1 1 65 LYS HB3 H 18.515 6.308 4.602 1.00 . A A . 100 LYS HB3 1 1 3 3316 1 1 65 LYS HD2 H 20.222 7.822 3.862 1.00 . A A . 100 LYS HD2 1 1 3 3317 1 1 65 LYS HD3 H 20.479 8.086 2.147 1.00 . A A . 100 LYS HD3 1 1 3 3318 1 1 65 LYS HE2 H 19.999 10.184 3.266 1.00 . A A . 100 LYS HE2 1 1 3 3319 1 1 65 LYS HE3 H 18.703 9.792 2.150 1.00 . A A . 100 LYS HE3 1 1 3 3320 1 1 65 LYS HG2 H 19.194 6.128 2.257 1.00 . A A . 100 LYS HG2 1 1 3 3321 1 1 65 LYS HG3 H 18.030 7.384 1.841 1.00 . A A . 100 LYS HG3 1 1 3 3322 1 1 65 LYS HZ1 H 18.572 9.315 5.087 1.00 . A A . 100 LYS HZ1 1 1 3 3323 1 1 65 LYS HZ2 H 17.268 9.274 3.985 1.00 . A A . 100 LYS HZ2 1 1 3 3324 1 1 65 LYS HZ3 H 18.030 10.704 4.339 1.00 . A A . 100 LYS HZ3 1 1 3 3325 1 1 65 LYS N N 15.827 5.921 2.609 1.00 . A A . 100 LYS N 1 1 3 3326 1 1 65 LYS NZ N 18.197 9.689 4.192 1.00 . A A . 100 LYS NZ 1 1 3 3327 1 1 65 LYS O O 16.713 5.442 5.972 1.00 . A A . 100 LYS O 1 1 3 3328 1 1 66 SER C C 14.296 2.134 5.589 1.00 . A A . 101 SER C 1 1 3 3329 1 1 66 SER CA C 14.812 3.493 5.991 1.00 . A A . 101 SER CA 1 1 3 3330 1 1 66 SER CB C 13.673 4.373 6.558 1.00 . A A . 101 SER CB 1 1 3 3331 1 1 66 SER H H 15.038 3.792 3.953 1.00 . A A . 101 SER H 1 1 3 3332 1 1 66 SER HA H 15.591 3.386 6.729 1.00 . A A . 101 SER HA 1 1 3 3333 1 1 66 SER HB2 H 14.060 5.357 6.782 1.00 . A A . 101 SER HB2 1 1 3 3334 1 1 66 SER HB3 H 12.891 4.460 5.818 1.00 . A A . 101 SER HB3 1 1 3 3335 1 1 66 SER HG H 12.233 4.193 7.851 1.00 . A A . 101 SER HG 1 1 3 3336 1 1 66 SER N N 15.374 4.100 4.822 1.00 . A A . 101 SER N 1 1 3 3337 1 1 66 SER O O 14.088 1.888 4.406 1.00 . A A . 101 SER O 1 1 3 3338 1 1 66 SER OG O 13.120 3.823 7.752 1.00 . A A . 101 SER OG 1 1 3 3339 1 1 67 LYS C C 12.164 -0.123 6.772 1.00 . A A . 102 LYS C 1 1 3 3340 1 1 67 LYS CA C 13.577 -0.039 6.231 1.00 . A A . 102 LYS CA 1 1 3 3341 1 1 67 LYS CB C 14.466 -1.243 6.685 1.00 . A A . 102 LYS CB 1 1 3 3342 1 1 67 LYS CD C 15.775 -0.344 8.719 1.00 . A A . 102 LYS CD 1 1 3 3343 1 1 67 LYS CE C 17.168 -0.553 8.142 1.00 . A A . 102 LYS CE 1 1 3 3344 1 1 67 LYS CG C 14.766 -1.373 8.192 1.00 . A A . 102 LYS CG 1 1 3 3345 1 1 67 LYS H H 14.333 1.501 7.457 1.00 . A A . 102 LYS H 1 1 3 3346 1 1 67 LYS HA H 13.486 -0.057 5.153 1.00 . A A . 102 LYS HA 1 1 3 3347 1 1 67 LYS HB2 H 13.970 -2.152 6.379 1.00 . A A . 102 LYS HB2 1 1 3 3348 1 1 67 LYS HB3 H 15.404 -1.185 6.152 1.00 . A A . 102 LYS HB3 1 1 3 3349 1 1 67 LYS HD2 H 15.443 0.648 8.456 1.00 . A A . 102 LYS HD2 1 1 3 3350 1 1 67 LYS HD3 H 15.832 -0.425 9.794 1.00 . A A . 102 LYS HD3 1 1 3 3351 1 1 67 LYS HE2 H 17.127 -0.470 7.067 1.00 . A A . 102 LYS HE2 1 1 3 3352 1 1 67 LYS HE3 H 17.817 0.216 8.532 1.00 . A A . 102 LYS HE3 1 1 3 3353 1 1 67 LYS HG2 H 13.840 -1.249 8.732 1.00 . A A . 102 LYS HG2 1 1 3 3354 1 1 67 LYS HG3 H 15.147 -2.368 8.365 1.00 . A A . 102 LYS HG3 1 1 3 3355 1 1 67 LYS HZ1 H 17.747 -1.974 9.533 1.00 . A A . 102 LYS HZ1 1 1 3 3356 1 1 67 LYS HZ2 H 18.704 -1.956 8.166 1.00 . A A . 102 LYS HZ2 1 1 3 3357 1 1 67 LYS HZ3 H 17.163 -2.661 8.117 1.00 . A A . 102 LYS HZ3 1 1 3 3358 1 1 67 LYS N N 14.125 1.249 6.532 1.00 . A A . 102 LYS N 1 1 3 3359 1 1 67 LYS NZ N 17.724 -1.872 8.498 1.00 . A A . 102 LYS NZ 1 1 3 3360 1 1 67 LYS O O 11.960 -0.158 7.987 1.00 . A A . 102 LYS O 1 1 3 3361 1 1 68 GLY C C 9.273 -0.802 7.211 1.00 . A A . 103 GLY C 1 1 3 3362 1 1 68 GLY CA C 9.789 0.142 6.187 1.00 . A A . 103 GLY CA 1 1 3 3363 1 1 68 GLY H H 11.494 -0.046 4.916 1.00 . A A . 103 GLY H 1 1 3 3364 1 1 68 GLY HA2 H 9.644 1.144 6.558 1.00 . A A . 103 GLY HA2 1 1 3 3365 1 1 68 GLY HA3 H 9.207 0.030 5.285 1.00 . A A . 103 GLY HA3 1 1 3 3366 1 1 68 GLY N N 11.211 -0.023 5.854 1.00 . A A . 103 GLY N 1 1 3 3367 1 1 68 GLY O O 8.864 -0.381 8.306 1.00 . A A . 103 GLY O 1 1 3 3368 1 1 69 ASN C C 10.006 -3.424 8.702 1.00 . A A . 104 ASN C 1 1 3 3369 1 1 69 ASN CA C 8.852 -3.085 7.783 1.00 . A A . 104 ASN CA 1 1 3 3370 1 1 69 ASN CB C 8.392 -4.344 7.024 1.00 . A A . 104 ASN CB 1 1 3 3371 1 1 69 ASN CG C 7.716 -5.392 7.920 1.00 . A A . 104 ASN CG 1 1 3 3372 1 1 69 ASN H H 9.621 -2.321 5.992 1.00 . A A . 104 ASN H 1 1 3 3373 1 1 69 ASN HA H 8.031 -2.693 8.365 1.00 . A A . 104 ASN HA 1 1 3 3374 1 1 69 ASN HB2 H 7.689 -4.056 6.256 1.00 . A A . 104 ASN HB2 1 1 3 3375 1 1 69 ASN HB3 H 9.254 -4.798 6.558 1.00 . A A . 104 ASN HB3 1 1 3 3376 1 1 69 ASN HD21 H 6.730 -6.115 6.379 1.00 . A A . 104 ASN HD21 1 1 3 3377 1 1 69 ASN HD22 H 6.449 -6.879 7.897 1.00 . A A . 104 ASN HD22 1 1 3 3378 1 1 69 ASN N N 9.293 -2.065 6.876 1.00 . A A . 104 ASN N 1 1 3 3379 1 1 69 ASN ND2 N 6.891 -6.202 7.343 1.00 . A A . 104 ASN ND2 1 1 3 3380 1 1 69 ASN O O 10.727 -4.410 8.493 1.00 . A A . 104 ASN O 1 1 3 3381 1 1 69 ASN OD1 O 7.961 -5.484 9.120 1.00 . A A . 104 ASN OD1 1 1 3 3382 1 1 70 TYR C C 10.613 -3.771 11.630 1.00 . A A . 105 TYR C 1 1 3 3383 1 1 70 TYR CA C 11.230 -2.810 10.638 1.00 . A A . 105 TYR CA 1 1 3 3384 1 1 70 TYR CB C 11.652 -1.499 11.322 1.00 . A A . 105 TYR CB 1 1 3 3385 1 1 70 TYR CD1 C 12.580 -2.067 13.603 1.00 . A A . 105 TYR CD1 1 1 3 3386 1 1 70 TYR CD2 C 14.096 -1.392 11.909 1.00 . A A . 105 TYR CD2 1 1 3 3387 1 1 70 TYR CE1 C 13.619 -2.216 14.483 1.00 . A A . 105 TYR CE1 1 1 3 3388 1 1 70 TYR CE2 C 15.144 -1.540 12.785 1.00 . A A . 105 TYR CE2 1 1 3 3389 1 1 70 TYR CG C 12.798 -1.653 12.299 1.00 . A A . 105 TYR CG 1 1 3 3390 1 1 70 TYR CZ C 14.900 -1.953 14.071 1.00 . A A . 105 TYR CZ 1 1 3 3391 1 1 70 TYR H H 9.714 -1.736 9.656 1.00 . A A . 105 TYR H 1 1 3 3392 1 1 70 TYR HA H 12.083 -3.277 10.168 1.00 . A A . 105 TYR HA 1 1 3 3393 1 1 70 TYR HB2 H 11.959 -0.792 10.566 1.00 . A A . 105 TYR HB2 1 1 3 3394 1 1 70 TYR HB3 H 10.807 -1.095 11.858 1.00 . A A . 105 TYR HB3 1 1 3 3395 1 1 70 TYR HD1 H 11.569 -2.274 13.921 1.00 . A A . 105 TYR HD1 1 1 3 3396 1 1 70 TYR HD2 H 14.278 -1.069 10.896 1.00 . A A . 105 TYR HD2 1 1 3 3397 1 1 70 TYR HE1 H 13.425 -2.543 15.493 1.00 . A A . 105 TYR HE1 1 1 3 3398 1 1 70 TYR HE2 H 16.152 -1.330 12.461 1.00 . A A . 105 TYR HE2 1 1 3 3399 1 1 70 TYR HH H 16.581 -1.405 14.783 1.00 . A A . 105 TYR HH 1 1 3 3400 1 1 70 TYR N N 10.239 -2.567 9.645 1.00 . A A . 105 TYR N 1 1 3 3401 1 1 70 TYR O O 9.729 -3.393 12.419 1.00 . A A . 105 TYR O 1 1 3 3402 1 1 70 TYR OH O 15.941 -2.107 14.954 1.00 . A A . 105 TYR OH 1 1 3 3403 1 1 71 ASP C C 11.540 -6.668 13.213 1.00 . A A . 106 ASP C 1 1 3 3404 1 1 71 ASP CA C 10.442 -6.020 12.400 1.00 . A A . 106 ASP CA 1 1 3 3405 1 1 71 ASP CB C 9.730 -7.064 11.525 1.00 . A A . 106 ASP CB 1 1 3 3406 1 1 71 ASP CG C 8.634 -7.845 12.239 1.00 . A A . 106 ASP CG 1 1 3 3407 1 1 71 ASP H H 11.741 -5.251 10.942 1.00 . A A . 106 ASP H 1 1 3 3408 1 1 71 ASP HA H 9.724 -5.556 13.059 1.00 . A A . 106 ASP HA 1 1 3 3409 1 1 71 ASP HB2 H 9.276 -6.557 10.687 1.00 . A A . 106 ASP HB2 1 1 3 3410 1 1 71 ASP HB3 H 10.463 -7.763 11.151 1.00 . A A . 106 ASP HB3 1 1 3 3411 1 1 71 ASP N N 11.024 -5.000 11.567 1.00 . A A . 106 ASP N 1 1 3 3412 1 1 71 ASP O O 11.574 -7.877 13.401 1.00 . A A . 106 ASP O 1 1 3 3413 1 1 71 ASP OD1 O 8.897 -8.529 13.247 1.00 . A A . 106 ASP OD1 1 1 3 3414 1 1 71 ASP OD2 O 7.462 -7.780 11.785 1.00 . A A . 106 ASP OD2 1 1 3 3415 1 1 72 GLU C C 13.059 -6.235 15.937 1.00 . A A . 107 GLU C 1 1 3 3416 1 1 72 GLU CA C 13.517 -6.380 14.498 1.00 . A A . 107 GLU CA 1 1 3 3417 1 1 72 GLU CB C 14.863 -5.661 14.283 1.00 . A A . 107 GLU CB 1 1 3 3418 1 1 72 GLU CD C 16.876 -5.290 12.811 1.00 . A A . 107 GLU CD 1 1 3 3419 1 1 72 GLU CG C 15.442 -5.778 12.884 1.00 . A A . 107 GLU CG 1 1 3 3420 1 1 72 GLU H H 12.459 -4.921 13.410 1.00 . A A . 107 GLU H 1 1 3 3421 1 1 72 GLU HA H 13.624 -7.431 14.274 1.00 . A A . 107 GLU HA 1 1 3 3422 1 1 72 GLU HB2 H 14.723 -4.612 14.495 1.00 . A A . 107 GLU HB2 1 1 3 3423 1 1 72 GLU HB3 H 15.585 -6.058 14.982 1.00 . A A . 107 GLU HB3 1 1 3 3424 1 1 72 GLU HG2 H 15.418 -6.815 12.586 1.00 . A A . 107 GLU HG2 1 1 3 3425 1 1 72 GLU HG3 H 14.839 -5.191 12.206 1.00 . A A . 107 GLU HG3 1 1 3 3426 1 1 72 GLU N N 12.479 -5.869 13.649 1.00 . A A . 107 GLU N 1 1 3 3427 1 1 72 GLU O O 13.480 -5.277 16.617 1.00 . A A . 107 GLU O 1 1 3 3428 1 1 72 GLU OXT O 12.205 -7.028 16.374 1.00 . A A . 107 GLU OXT 1 1 3 3429 1 1 72 GLU OE1 O 17.115 -4.084 12.580 1.00 . A A . 107 GLU OE1 1 1 3 3430 1 1 72 GLU OE2 O 17.794 -6.117 12.980 1.00 . A A . 107 GLU OE2 1 1 3 3431 2 2 1 ZN ZN ZN -6.699 0.601 -4.483 1.00 . B A . 201 ZN ZN 1 1 3 3432 3 2 1 ZN ZN ZN 10.681 -0.641 -5.756 1.00 . C A . 202 ZN ZN 1 1 4 3433 1 1 1 ARG C C -20.190 -0.942 11.402 1.00 . A A . 36 ARG C 1 1 4 3434 1 1 1 ARG CA C -19.473 -1.231 12.713 1.00 . A A . 36 ARG CA 1 1 4 3435 1 1 1 ARG CB C -19.580 -2.742 13.005 1.00 . A A . 36 ARG CB 1 1 4 3436 1 1 1 ARG CD C -18.986 -4.730 14.405 1.00 . A A . 36 ARG CD 1 1 4 3437 1 1 1 ARG CG C -18.950 -3.208 14.305 1.00 . A A . 36 ARG CG 1 1 4 3438 1 1 1 ARG CZ C -18.368 -6.418 12.647 1.00 . A A . 36 ARG CZ 1 1 4 3439 1 1 1 ARG H1 H -19.982 0.582 13.532 1.00 . A A . 36 ARG H1 1 1 4 3440 1 1 1 ARG H2 H -19.616 -0.564 14.705 1.00 . A A . 36 ARG H2 1 1 4 3441 1 1 1 ARG H3 H -21.086 -0.621 13.863 1.00 . A A . 36 ARG H3 1 1 4 3442 1 1 1 ARG HA H -18.433 -0.956 12.633 1.00 . A A . 36 ARG HA 1 1 4 3443 1 1 1 ARG HB2 H -20.625 -3.011 13.033 1.00 . A A . 36 ARG HB2 1 1 4 3444 1 1 1 ARG HB3 H -19.113 -3.278 12.192 1.00 . A A . 36 ARG HB3 1 1 4 3445 1 1 1 ARG HD2 H -18.684 -5.024 15.399 1.00 . A A . 36 ARG HD2 1 1 4 3446 1 1 1 ARG HD3 H -19.995 -5.069 14.220 1.00 . A A . 36 ARG HD3 1 1 4 3447 1 1 1 ARG HE H -17.172 -4.983 13.410 1.00 . A A . 36 ARG HE 1 1 4 3448 1 1 1 ARG HG2 H -17.924 -2.875 14.339 1.00 . A A . 36 ARG HG2 1 1 4 3449 1 1 1 ARG HG3 H -19.497 -2.786 15.133 1.00 . A A . 36 ARG HG3 1 1 4 3450 1 1 1 ARG HH11 H -20.361 -6.496 13.103 1.00 . A A . 36 ARG HH11 1 1 4 3451 1 1 1 ARG HH12 H -19.837 -7.688 12.019 1.00 . A A . 36 ARG HH12 1 1 4 3452 1 1 1 ARG HH21 H -16.464 -6.651 11.885 1.00 . A A . 36 ARG HH21 1 1 4 3453 1 1 1 ARG HH22 H -17.612 -7.752 11.301 1.00 . A A . 36 ARG HH22 1 1 4 3454 1 1 1 ARG N N -20.067 -0.426 13.780 1.00 . A A . 36 ARG N 1 1 4 3455 1 1 1 ARG NE N -18.079 -5.366 13.431 1.00 . A A . 36 ARG NE 1 1 4 3456 1 1 1 ARG NH1 N -19.602 -6.894 12.586 1.00 . A A . 36 ARG NH1 1 1 4 3457 1 1 1 ARG NH2 N -17.416 -6.971 11.902 1.00 . A A . 36 ARG NH2 1 1 4 3458 1 1 1 ARG O O -20.942 -1.782 10.901 1.00 . A A . 36 ARG O 1 1 4 3459 1 1 2 ALA C C -19.695 1.052 8.546 1.00 . A A . 37 ALA C 1 1 4 3460 1 1 2 ALA CA C -20.669 0.577 9.610 1.00 . A A . 37 ALA CA 1 1 4 3461 1 1 2 ALA CB C -21.762 1.608 9.852 1.00 . A A . 37 ALA CB 1 1 4 3462 1 1 2 ALA H H -19.387 0.883 11.272 1.00 . A A . 37 ALA H 1 1 4 3463 1 1 2 ALA HA H -21.140 -0.326 9.252 1.00 . A A . 37 ALA HA 1 1 4 3464 1 1 2 ALA HB1 H -22.333 1.747 8.946 1.00 . A A . 37 ALA HB1 1 1 4 3465 1 1 2 ALA HB2 H -21.309 2.546 10.130 1.00 . A A . 37 ALA HB2 1 1 4 3466 1 1 2 ALA HB3 H -22.414 1.269 10.643 1.00 . A A . 37 ALA HB3 1 1 4 3467 1 1 2 ALA N N -19.993 0.233 10.848 1.00 . A A . 37 ALA N 1 1 4 3468 1 1 2 ALA O O -20.098 1.386 7.425 1.00 . A A . 37 ALA O 1 1 4 3469 1 1 3 GLN C C -17.024 0.330 7.035 1.00 . A A . 38 GLN C 1 1 4 3470 1 1 3 GLN CA C -17.414 1.491 7.934 1.00 . A A . 38 GLN CA 1 1 4 3471 1 1 3 GLN CB C -16.189 2.084 8.634 1.00 . A A . 38 GLN CB 1 1 4 3472 1 1 3 GLN CD C -15.237 3.914 10.083 1.00 . A A . 38 GLN CD 1 1 4 3473 1 1 3 GLN CG C -16.481 3.330 9.451 1.00 . A A . 38 GLN CG 1 1 4 3474 1 1 3 GLN H H -18.146 0.764 9.764 1.00 . A A . 38 GLN H 1 1 4 3475 1 1 3 GLN HA H -17.884 2.250 7.330 1.00 . A A . 38 GLN HA 1 1 4 3476 1 1 3 GLN HB2 H -15.767 1.340 9.293 1.00 . A A . 38 GLN HB2 1 1 4 3477 1 1 3 GLN HB3 H -15.453 2.338 7.885 1.00 . A A . 38 GLN HB3 1 1 4 3478 1 1 3 GLN HE21 H -16.295 4.636 11.586 1.00 . A A . 38 GLN HE21 1 1 4 3479 1 1 3 GLN HE22 H -14.595 4.926 11.629 1.00 . A A . 38 GLN HE22 1 1 4 3480 1 1 3 GLN HG2 H -16.917 4.076 8.802 1.00 . A A . 38 GLN HG2 1 1 4 3481 1 1 3 GLN HG3 H -17.183 3.079 10.233 1.00 . A A . 38 GLN HG3 1 1 4 3482 1 1 3 GLN N N -18.424 1.065 8.874 1.00 . A A . 38 GLN N 1 1 4 3483 1 1 3 GLN NE2 N -15.395 4.552 11.203 1.00 . A A . 38 GLN NE2 1 1 4 3484 1 1 3 GLN O O -16.040 -0.368 7.283 1.00 . A A . 38 GLN O 1 1 4 3485 1 1 3 GLN OE1 O -14.132 3.805 9.546 1.00 . A A . 38 GLN OE1 1 1 4 3486 1 1 4 VAL C C -17.572 -0.481 3.655 1.00 . A A . 39 VAL C 1 1 4 3487 1 1 4 VAL CA C -17.647 -0.999 5.094 1.00 . A A . 39 VAL CA 1 1 4 3488 1 1 4 VAL CB C -18.778 -2.062 5.208 1.00 . A A . 39 VAL CB 1 1 4 3489 1 1 4 VAL CG1 C -18.724 -2.769 6.557 1.00 . A A . 39 VAL CG1 1 1 4 3490 1 1 4 VAL CG2 C -20.143 -1.409 5.012 1.00 . A A . 39 VAL CG2 1 1 4 3491 1 1 4 VAL H H -18.624 0.684 5.954 1.00 . A A . 39 VAL H 1 1 4 3492 1 1 4 VAL HA H -16.708 -1.472 5.341 1.00 . A A . 39 VAL HA 1 1 4 3493 1 1 4 VAL HB H -18.639 -2.799 4.431 1.00 . A A . 39 VAL HB 1 1 4 3494 1 1 4 VAL HG11 H -17.770 -3.262 6.671 1.00 . A A . 39 VAL HG11 1 1 4 3495 1 1 4 VAL HG12 H -19.516 -3.501 6.614 1.00 . A A . 39 VAL HG12 1 1 4 3496 1 1 4 VAL HG13 H -18.850 -2.042 7.346 1.00 . A A . 39 VAL HG13 1 1 4 3497 1 1 4 VAL HG21 H -20.186 -0.963 4.030 1.00 . A A . 39 VAL HG21 1 1 4 3498 1 1 4 VAL HG22 H -20.282 -0.642 5.759 1.00 . A A . 39 VAL HG22 1 1 4 3499 1 1 4 VAL HG23 H -20.919 -2.153 5.105 1.00 . A A . 39 VAL HG23 1 1 4 3500 1 1 4 VAL N N -17.845 0.093 6.037 1.00 . A A . 39 VAL N 1 1 4 3501 1 1 4 VAL O O -17.494 -1.257 2.699 1.00 . A A . 39 VAL O 1 1 4 3502 1 1 5 LYS C C -16.374 2.446 2.305 1.00 . A A . 40 LYS C 1 1 4 3503 1 1 5 LYS CA C -17.517 1.472 2.221 1.00 . A A . 40 LYS CA 1 1 4 3504 1 1 5 LYS CB C -18.827 2.181 1.859 1.00 . A A . 40 LYS CB 1 1 4 3505 1 1 5 LYS CD C -21.309 2.003 1.391 1.00 . A A . 40 LYS CD 1 1 4 3506 1 1 5 LYS CE C -21.262 2.638 0.005 1.00 . A A . 40 LYS CE 1 1 4 3507 1 1 5 LYS CG C -20.030 1.248 1.732 1.00 . A A . 40 LYS CG 1 1 4 3508 1 1 5 LYS H H -17.654 1.391 4.308 1.00 . A A . 40 LYS H 1 1 4 3509 1 1 5 LYS HA H -17.280 0.719 1.483 1.00 . A A . 40 LYS HA 1 1 4 3510 1 1 5 LYS HB2 H -19.043 2.910 2.625 1.00 . A A . 40 LYS HB2 1 1 4 3511 1 1 5 LYS HB3 H -18.684 2.688 0.917 1.00 . A A . 40 LYS HB3 1 1 4 3512 1 1 5 LYS HD2 H -22.140 1.314 1.423 1.00 . A A . 40 LYS HD2 1 1 4 3513 1 1 5 LYS HD3 H -21.458 2.777 2.128 1.00 . A A . 40 LYS HD3 1 1 4 3514 1 1 5 LYS HE2 H -22.142 3.252 -0.118 1.00 . A A . 40 LYS HE2 1 1 4 3515 1 1 5 LYS HE3 H -20.388 3.267 -0.062 1.00 . A A . 40 LYS HE3 1 1 4 3516 1 1 5 LYS HG2 H -19.832 0.537 0.945 1.00 . A A . 40 LYS HG2 1 1 4 3517 1 1 5 LYS HG3 H -20.167 0.722 2.666 1.00 . A A . 40 LYS HG3 1 1 4 3518 1 1 5 LYS HZ1 H -22.080 1.041 -1.086 1.00 . A A . 40 LYS HZ1 1 1 4 3519 1 1 5 LYS HZ2 H -20.407 1.001 -1.051 1.00 . A A . 40 LYS HZ2 1 1 4 3520 1 1 5 LYS HZ3 H -21.205 2.111 -2.013 1.00 . A A . 40 LYS HZ3 1 1 4 3521 1 1 5 LYS N N -17.608 0.818 3.512 1.00 . A A . 40 LYS N 1 1 4 3522 1 1 5 LYS NZ N -21.229 1.635 -1.089 1.00 . A A . 40 LYS NZ 1 1 4 3523 1 1 5 LYS O O -16.554 3.663 2.385 1.00 . A A . 40 LYS O 1 1 4 3524 1 1 6 GLU C C -13.403 3.126 1.298 1.00 . A A . 41 GLU C 1 1 4 3525 1 1 6 GLU CA C -13.979 2.573 2.558 1.00 . A A . 41 GLU CA 1 1 4 3526 1 1 6 GLU CB C -12.999 1.568 3.132 1.00 . A A . 41 GLU CB 1 1 4 3527 1 1 6 GLU CD C -13.457 2.095 5.518 1.00 . A A . 41 GLU CD 1 1 4 3528 1 1 6 GLU CG C -13.419 1.018 4.469 1.00 . A A . 41 GLU CG 1 1 4 3529 1 1 6 GLU H H -15.177 0.929 2.085 1.00 . A A . 41 GLU H 1 1 4 3530 1 1 6 GLU HA H -14.126 3.349 3.293 1.00 . A A . 41 GLU HA 1 1 4 3531 1 1 6 GLU HB2 H -12.911 0.744 2.439 1.00 . A A . 41 GLU HB2 1 1 4 3532 1 1 6 GLU HB3 H -12.032 2.034 3.243 1.00 . A A . 41 GLU HB3 1 1 4 3533 1 1 6 GLU HG2 H -14.410 0.600 4.360 1.00 . A A . 41 GLU HG2 1 1 4 3534 1 1 6 GLU HG3 H -12.725 0.238 4.750 1.00 . A A . 41 GLU HG3 1 1 4 3535 1 1 6 GLU N N -15.217 1.883 2.305 1.00 . A A . 41 GLU N 1 1 4 3536 1 1 6 GLU O O -13.710 2.661 0.233 1.00 . A A . 41 GLU O 1 1 4 3537 1 1 6 GLU OE1 O -12.380 2.483 6.025 1.00 . A A . 41 GLU OE1 1 1 4 3538 1 1 6 GLU OE2 O -14.540 2.609 5.816 1.00 . A A . 41 GLU OE2 1 1 4 3539 1 1 7 THR C C -10.410 4.276 0.448 1.00 . A A . 42 THR C 1 1 4 3540 1 1 7 THR CA C -11.902 4.577 0.246 1.00 . A A . 42 THR CA 1 1 4 3541 1 1 7 THR CB C -12.114 6.064 -0.012 1.00 . A A . 42 THR CB 1 1 4 3542 1 1 7 THR CG2 C -12.213 6.292 -1.516 1.00 . A A . 42 THR CG2 1 1 4 3543 1 1 7 THR H H -12.411 4.536 2.275 1.00 . A A . 42 THR H 1 1 4 3544 1 1 7 THR HA H -12.300 3.997 -0.577 1.00 . A A . 42 THR HA 1 1 4 3545 1 1 7 THR HB H -11.255 6.599 0.361 1.00 . A A . 42 THR HB 1 1 4 3546 1 1 7 THR HG1 H -13.376 6.121 1.472 1.00 . A A . 42 THR HG1 1 1 4 3547 1 1 7 THR HG21 H -12.367 7.341 -1.718 1.00 . A A . 42 THR HG21 1 1 4 3548 1 1 7 THR HG22 H -13.054 5.726 -1.893 1.00 . A A . 42 THR HG22 1 1 4 3549 1 1 7 THR HG23 H -11.308 5.953 -1.998 1.00 . A A . 42 THR HG23 1 1 4 3550 1 1 7 THR N N -12.585 4.121 1.403 1.00 . A A . 42 THR N 1 1 4 3551 1 1 7 THR O O -9.884 4.360 1.574 1.00 . A A . 42 THR O 1 1 4 3552 1 1 7 THR OG1 O -13.369 6.469 0.572 1.00 . A A . 42 THR OG1 1 1 4 3553 1 1 8 CYS C C -7.407 4.591 -0.710 1.00 . A A . 43 CYS C 1 1 4 3554 1 1 8 CYS CA C -8.409 3.447 -0.615 1.00 . A A . 43 CYS CA 1 1 4 3555 1 1 8 CYS CB C -8.293 2.458 -1.774 1.00 . A A . 43 CYS CB 1 1 4 3556 1 1 8 CYS H H -10.246 3.973 -1.469 1.00 . A A . 43 CYS H 1 1 4 3557 1 1 8 CYS HA H -8.242 2.899 0.300 1.00 . A A . 43 CYS HA 1 1 4 3558 1 1 8 CYS HB2 H -8.557 1.490 -1.374 1.00 . A A . 43 CYS HB2 1 1 4 3559 1 1 8 CYS HB3 H -9.020 2.694 -2.536 1.00 . A A . 43 CYS HB3 1 1 4 3560 1 1 8 CYS N N -9.770 3.910 -0.614 1.00 . A A . 43 CYS N 1 1 4 3561 1 1 8 CYS O O -7.724 5.669 -1.188 1.00 . A A . 43 CYS O 1 1 4 3562 1 1 8 CYS SG S -6.693 2.215 -2.530 1.00 . A A . 43 CYS SG 1 1 4 3563 1 1 9 ALA C C -4.083 4.980 -1.300 1.00 . A A . 44 ALA C 1 1 4 3564 1 1 9 ALA CA C -5.136 5.332 -0.253 1.00 . A A . 44 ALA CA 1 1 4 3565 1 1 9 ALA CB C -4.480 5.436 1.096 1.00 . A A . 44 ALA CB 1 1 4 3566 1 1 9 ALA H H -6.060 3.500 0.253 1.00 . A A . 44 ALA H 1 1 4 3567 1 1 9 ALA HA H -5.557 6.299 -0.483 1.00 . A A . 44 ALA HA 1 1 4 3568 1 1 9 ALA HB1 H -5.237 5.652 1.832 1.00 . A A . 44 ALA HB1 1 1 4 3569 1 1 9 ALA HB2 H -3.774 6.251 1.043 1.00 . A A . 44 ALA HB2 1 1 4 3570 1 1 9 ALA HB3 H -3.966 4.516 1.327 1.00 . A A . 44 ALA HB3 1 1 4 3571 1 1 9 ALA N N -6.208 4.353 -0.206 1.00 . A A . 44 ALA N 1 1 4 3572 1 1 9 ALA O O -3.328 5.824 -1.727 1.00 . A A . 44 ALA O 1 1 4 3573 1 1 10 ALA C C -3.446 3.509 -4.096 1.00 . A A . 45 ALA C 1 1 4 3574 1 1 10 ALA CA C -3.036 3.273 -2.648 1.00 . A A . 45 ALA CA 1 1 4 3575 1 1 10 ALA CB C -2.724 1.812 -2.382 1.00 . A A . 45 ALA CB 1 1 4 3576 1 1 10 ALA H H -4.746 3.088 -1.447 1.00 . A A . 45 ALA H 1 1 4 3577 1 1 10 ALA HA H -2.143 3.849 -2.454 1.00 . A A . 45 ALA HA 1 1 4 3578 1 1 10 ALA HB1 H -2.463 1.710 -1.335 1.00 . A A . 45 ALA HB1 1 1 4 3579 1 1 10 ALA HB2 H -1.894 1.503 -3.000 1.00 . A A . 45 ALA HB2 1 1 4 3580 1 1 10 ALA HB3 H -3.590 1.206 -2.599 1.00 . A A . 45 ALA HB3 1 1 4 3581 1 1 10 ALA N N -4.061 3.728 -1.731 1.00 . A A . 45 ALA N 1 1 4 3582 1 1 10 ALA O O -2.609 3.697 -4.976 1.00 . A A . 45 ALA O 1 1 4 3583 1 1 11 CYS C C -6.489 4.706 -5.596 1.00 . A A . 46 CYS C 1 1 4 3584 1 1 11 CYS CA C -5.274 3.758 -5.648 1.00 . A A . 46 CYS CA 1 1 4 3585 1 1 11 CYS CB C -5.519 2.433 -6.429 1.00 . A A . 46 CYS CB 1 1 4 3586 1 1 11 CYS H H -5.334 3.311 -3.579 1.00 . A A . 46 CYS H 1 1 4 3587 1 1 11 CYS HA H -4.495 4.312 -6.152 1.00 . A A . 46 CYS HA 1 1 4 3588 1 1 11 CYS HB2 H -5.032 2.253 -7.373 1.00 . A A . 46 CYS HB2 1 1 4 3589 1 1 11 CYS HB3 H -4.790 1.866 -5.862 1.00 . A A . 46 CYS HB3 1 1 4 3590 1 1 11 CYS N N -4.736 3.499 -4.332 1.00 . A A . 46 CYS N 1 1 4 3591 1 1 11 CYS O O -7.005 5.140 -6.620 1.00 . A A . 46 CYS O 1 1 4 3592 1 1 11 CYS SG S -7.049 1.505 -6.101 1.00 . A A . 46 CYS SG 1 1 4 3593 1 1 12 GLN C C -9.319 5.644 -4.718 1.00 . A A . 47 GLN C 1 1 4 3594 1 1 12 GLN CA C -7.989 5.996 -4.065 1.00 . A A . 47 GLN CA 1 1 4 3595 1 1 12 GLN CB C -7.576 7.435 -4.295 1.00 . A A . 47 GLN CB 1 1 4 3596 1 1 12 GLN CD C -5.943 9.237 -3.568 1.00 . A A . 47 GLN CD 1 1 4 3597 1 1 12 GLN CG C -6.507 7.865 -3.313 1.00 . A A . 47 GLN CG 1 1 4 3598 1 1 12 GLN H H -6.385 4.727 -3.582 1.00 . A A . 47 GLN H 1 1 4 3599 1 1 12 GLN HA H -8.137 5.877 -3.001 1.00 . A A . 47 GLN HA 1 1 4 3600 1 1 12 GLN HB2 H -7.219 7.563 -5.306 1.00 . A A . 47 GLN HB2 1 1 4 3601 1 1 12 GLN HB3 H -8.454 8.039 -4.123 1.00 . A A . 47 GLN HB3 1 1 4 3602 1 1 12 GLN HE21 H -5.693 9.492 -1.633 1.00 . A A . 47 GLN HE21 1 1 4 3603 1 1 12 GLN HE22 H -5.190 10.807 -2.624 1.00 . A A . 47 GLN HE22 1 1 4 3604 1 1 12 GLN HG2 H -6.946 7.857 -2.327 1.00 . A A . 47 GLN HG2 1 1 4 3605 1 1 12 GLN HG3 H -5.716 7.133 -3.348 1.00 . A A . 47 GLN HG3 1 1 4 3606 1 1 12 GLN N N -6.884 5.063 -4.353 1.00 . A A . 47 GLN N 1 1 4 3607 1 1 12 GLN NE2 N -5.576 9.913 -2.511 1.00 . A A . 47 GLN NE2 1 1 4 3608 1 1 12 GLN O O -10.039 6.496 -5.205 1.00 . A A . 47 GLN O 1 1 4 3609 1 1 12 GLN OE1 O -5.854 9.693 -4.705 1.00 . A A . 47 GLN OE1 1 1 4 3610 1 1 13 LYS C C -11.593 3.234 -4.063 1.00 . A A . 48 LYS C 1 1 4 3611 1 1 13 LYS CA C -10.866 3.856 -5.218 1.00 . A A . 48 LYS CA 1 1 4 3612 1 1 13 LYS CB C -10.564 2.811 -6.286 1.00 . A A . 48 LYS CB 1 1 4 3613 1 1 13 LYS CD C -10.314 4.513 -8.188 1.00 . A A . 48 LYS CD 1 1 4 3614 1 1 13 LYS CE C -11.546 4.113 -8.981 1.00 . A A . 48 LYS CE 1 1 4 3615 1 1 13 LYS CG C -9.691 3.333 -7.432 1.00 . A A . 48 LYS CG 1 1 4 3616 1 1 13 LYS H H -9.017 3.769 -4.254 1.00 . A A . 48 LYS H 1 1 4 3617 1 1 13 LYS HA H -11.452 4.662 -5.635 1.00 . A A . 48 LYS HA 1 1 4 3618 1 1 13 LYS HB2 H -10.039 1.993 -5.815 1.00 . A A . 48 LYS HB2 1 1 4 3619 1 1 13 LYS HB3 H -11.498 2.445 -6.681 1.00 . A A . 48 LYS HB3 1 1 4 3620 1 1 13 LYS HD2 H -10.592 5.276 -7.477 1.00 . A A . 48 LYS HD2 1 1 4 3621 1 1 13 LYS HD3 H -9.577 4.921 -8.864 1.00 . A A . 48 LYS HD3 1 1 4 3622 1 1 13 LYS HE2 H -12.264 3.673 -8.307 1.00 . A A . 48 LYS HE2 1 1 4 3623 1 1 13 LYS HE3 H -11.970 5.000 -9.427 1.00 . A A . 48 LYS HE3 1 1 4 3624 1 1 13 LYS HG2 H -8.747 3.656 -7.018 1.00 . A A . 48 LYS HG2 1 1 4 3625 1 1 13 LYS HG3 H -9.512 2.518 -8.112 1.00 . A A . 48 LYS HG3 1 1 4 3626 1 1 13 LYS HZ1 H -12.096 2.904 -10.577 1.00 . A A . 48 LYS HZ1 1 1 4 3627 1 1 13 LYS HZ2 H -10.848 2.261 -9.647 1.00 . A A . 48 LYS HZ2 1 1 4 3628 1 1 13 LYS HZ3 H -10.525 3.513 -10.714 1.00 . A A . 48 LYS HZ3 1 1 4 3629 1 1 13 LYS N N -9.634 4.390 -4.684 1.00 . A A . 48 LYS N 1 1 4 3630 1 1 13 LYS NZ N -11.233 3.139 -10.049 1.00 . A A . 48 LYS NZ 1 1 4 3631 1 1 13 LYS O O -10.952 2.871 -3.074 1.00 . A A . 48 LYS O 1 1 4 3632 1 1 14 THR C C -13.421 1.159 -2.848 1.00 . A A . 49 THR C 1 1 4 3633 1 1 14 THR CA C -13.673 2.665 -3.049 1.00 . A A . 49 THR CA 1 1 4 3634 1 1 14 THR CB C -15.142 2.921 -3.309 1.00 . A A . 49 THR CB 1 1 4 3635 1 1 14 THR CG2 C -15.872 3.037 -1.989 1.00 . A A . 49 THR CG2 1 1 4 3636 1 1 14 THR H H -13.377 3.495 -4.919 1.00 . A A . 49 THR H 1 1 4 3637 1 1 14 THR HA H -13.398 3.176 -2.145 1.00 . A A . 49 THR HA 1 1 4 3638 1 1 14 THR HB H -15.527 2.083 -3.860 1.00 . A A . 49 THR HB 1 1 4 3639 1 1 14 THR HG1 H -16.067 4.077 -4.578 1.00 . A A . 49 THR HG1 1 1 4 3640 1 1 14 THR HG21 H -15.340 3.775 -1.400 1.00 . A A . 49 THR HG21 1 1 4 3641 1 1 14 THR HG22 H -15.861 2.082 -1.483 1.00 . A A . 49 THR HG22 1 1 4 3642 1 1 14 THR HG23 H -16.887 3.365 -2.151 1.00 . A A . 49 THR HG23 1 1 4 3643 1 1 14 THR N N -12.887 3.185 -4.126 1.00 . A A . 49 THR N 1 1 4 3644 1 1 14 THR O O -13.538 0.360 -3.788 1.00 . A A . 49 THR O 1 1 4 3645 1 1 14 THR OG1 O -15.283 4.172 -4.024 1.00 . A A . 49 THR OG1 1 1 4 3646 1 1 15 VAL C C -13.959 -1.152 -0.636 1.00 . A A . 50 VAL C 1 1 4 3647 1 1 15 VAL CA C -12.738 -0.547 -1.268 1.00 . A A . 50 VAL CA 1 1 4 3648 1 1 15 VAL CB C -11.606 -0.638 -0.211 1.00 . A A . 50 VAL CB 1 1 4 3649 1 1 15 VAL CG1 C -10.752 -1.832 -0.498 1.00 . A A . 50 VAL CG1 1 1 4 3650 1 1 15 VAL CG2 C -10.778 0.611 -0.160 1.00 . A A . 50 VAL CG2 1 1 4 3651 1 1 15 VAL H H -13.038 1.510 -0.953 1.00 . A A . 50 VAL H 1 1 4 3652 1 1 15 VAL HA H -12.423 -1.075 -2.157 1.00 . A A . 50 VAL HA 1 1 4 3653 1 1 15 VAL HB H -12.032 -0.835 0.767 1.00 . A A . 50 VAL HB 1 1 4 3654 1 1 15 VAL HG11 H -9.919 -1.846 0.189 1.00 . A A . 50 VAL HG11 1 1 4 3655 1 1 15 VAL HG12 H -10.379 -1.773 -1.510 1.00 . A A . 50 VAL HG12 1 1 4 3656 1 1 15 VAL HG13 H -11.335 -2.734 -0.376 1.00 . A A . 50 VAL HG13 1 1 4 3657 1 1 15 VAL HG21 H -11.394 1.443 0.145 1.00 . A A . 50 VAL HG21 1 1 4 3658 1 1 15 VAL HG22 H -10.418 0.797 -1.162 1.00 . A A . 50 VAL HG22 1 1 4 3659 1 1 15 VAL HG23 H -9.953 0.485 0.527 1.00 . A A . 50 VAL HG23 1 1 4 3660 1 1 15 VAL N N -13.050 0.807 -1.640 1.00 . A A . 50 VAL N 1 1 4 3661 1 1 15 VAL O O -14.611 -0.521 0.213 1.00 . A A . 50 VAL O 1 1 4 3662 1 1 16 TYR C C -14.888 -4.082 0.478 1.00 . A A . 51 TYR C 1 1 4 3663 1 1 16 TYR CA C -15.407 -3.025 -0.491 1.00 . A A . 51 TYR CA 1 1 4 3664 1 1 16 TYR CB C -16.201 -3.627 -1.652 1.00 . A A . 51 TYR CB 1 1 4 3665 1 1 16 TYR CD1 C -17.122 -1.430 -2.396 1.00 . A A . 51 TYR CD1 1 1 4 3666 1 1 16 TYR CD2 C -16.196 -2.843 -4.055 1.00 . A A . 51 TYR CD2 1 1 4 3667 1 1 16 TYR CE1 C -17.409 -0.483 -3.344 1.00 . A A . 51 TYR CE1 1 1 4 3668 1 1 16 TYR CE2 C -16.482 -1.900 -5.021 1.00 . A A . 51 TYR CE2 1 1 4 3669 1 1 16 TYR CG C -16.517 -2.615 -2.725 1.00 . A A . 51 TYR CG 1 1 4 3670 1 1 16 TYR CZ C -17.088 -0.719 -4.654 1.00 . A A . 51 TYR CZ 1 1 4 3671 1 1 16 TYR H H -13.718 -2.785 -1.694 1.00 . A A . 51 TYR H 1 1 4 3672 1 1 16 TYR HA H -16.015 -2.311 0.043 1.00 . A A . 51 TYR HA 1 1 4 3673 1 1 16 TYR HB2 H -15.609 -4.398 -2.111 1.00 . A A . 51 TYR HB2 1 1 4 3674 1 1 16 TYR HB3 H -17.131 -4.039 -1.292 1.00 . A A . 51 TYR HB3 1 1 4 3675 1 1 16 TYR HD1 H -17.355 -1.274 -1.356 1.00 . A A . 51 TYR HD1 1 1 4 3676 1 1 16 TYR HD2 H -15.721 -3.772 -4.334 1.00 . A A . 51 TYR HD2 1 1 4 3677 1 1 16 TYR HE1 H -17.885 0.442 -3.055 1.00 . A A . 51 TYR HE1 1 1 4 3678 1 1 16 TYR HE2 H -16.229 -2.087 -6.053 1.00 . A A . 51 TYR HE2 1 1 4 3679 1 1 16 TYR HH H -17.121 1.100 -5.263 1.00 . A A . 51 TYR HH 1 1 4 3680 1 1 16 TYR N N -14.270 -2.336 -1.023 1.00 . A A . 51 TYR N 1 1 4 3681 1 1 16 TYR O O -13.715 -4.410 0.396 1.00 . A A . 51 TYR O 1 1 4 3682 1 1 16 TYR OH O -17.379 0.234 -5.607 1.00 . A A . 51 TYR OH 1 1 4 3683 1 1 17 PRO C C -14.316 -6.685 2.019 1.00 . A A . 52 PRO C 1 1 4 3684 1 1 17 PRO CA C -15.268 -5.559 2.467 1.00 . A A . 52 PRO CA 1 1 4 3685 1 1 17 PRO CB C -16.562 -6.157 2.975 1.00 . A A . 52 PRO CB 1 1 4 3686 1 1 17 PRO CD C -17.180 -4.391 1.491 1.00 . A A . 52 PRO CD 1 1 4 3687 1 1 17 PRO CG C -17.574 -5.093 2.760 1.00 . A A . 52 PRO CG 1 1 4 3688 1 1 17 PRO HA H -14.803 -5.022 3.276 1.00 . A A . 52 PRO HA 1 1 4 3689 1 1 17 PRO HB2 H -16.748 -7.040 2.390 1.00 . A A . 52 PRO HB2 1 1 4 3690 1 1 17 PRO HB3 H -16.464 -6.418 4.018 1.00 . A A . 52 PRO HB3 1 1 4 3691 1 1 17 PRO HD2 H -17.709 -4.810 0.648 1.00 . A A . 52 PRO HD2 1 1 4 3692 1 1 17 PRO HD3 H -17.384 -3.333 1.570 1.00 . A A . 52 PRO HD3 1 1 4 3693 1 1 17 PRO HG2 H -18.554 -5.536 2.667 1.00 . A A . 52 PRO HG2 1 1 4 3694 1 1 17 PRO HG3 H -17.553 -4.403 3.589 1.00 . A A . 52 PRO HG3 1 1 4 3695 1 1 17 PRO N N -15.722 -4.638 1.392 1.00 . A A . 52 PRO N 1 1 4 3696 1 1 17 PRO O O -13.370 -7.026 2.744 1.00 . A A . 52 PRO O 1 1 4 3697 1 1 18 MET C C -12.297 -7.825 -0.027 1.00 . A A . 53 MET C 1 1 4 3698 1 1 18 MET CA C -13.706 -8.312 0.338 1.00 . A A . 53 MET CA 1 1 4 3699 1 1 18 MET CB C -14.358 -8.953 -0.873 1.00 . A A . 53 MET CB 1 1 4 3700 1 1 18 MET CE C -13.258 -12.248 -3.142 1.00 . A A . 53 MET CE 1 1 4 3701 1 1 18 MET CG C -13.614 -10.165 -1.390 1.00 . A A . 53 MET CG 1 1 4 3702 1 1 18 MET H H -15.283 -6.893 0.295 1.00 . A A . 53 MET H 1 1 4 3703 1 1 18 MET HA H -13.625 -9.059 1.112 1.00 . A A . 53 MET HA 1 1 4 3704 1 1 18 MET HB2 H -15.346 -9.265 -0.572 1.00 . A A . 53 MET HB2 1 1 4 3705 1 1 18 MET HB3 H -14.434 -8.225 -1.667 1.00 . A A . 53 MET HB3 1 1 4 3706 1 1 18 MET HE1 H -13.286 -12.872 -2.263 1.00 . A A . 53 MET HE1 1 1 4 3707 1 1 18 MET HE2 H -12.249 -11.896 -3.302 1.00 . A A . 53 MET HE2 1 1 4 3708 1 1 18 MET HE3 H -13.587 -12.817 -3.999 1.00 . A A . 53 MET HE3 1 1 4 3709 1 1 18 MET HG2 H -12.593 -9.875 -1.584 1.00 . A A . 53 MET HG2 1 1 4 3710 1 1 18 MET HG3 H -13.625 -10.923 -0.620 1.00 . A A . 53 MET HG3 1 1 4 3711 1 1 18 MET N N -14.536 -7.227 0.840 1.00 . A A . 53 MET N 1 1 4 3712 1 1 18 MET O O -11.305 -8.528 0.173 1.00 . A A . 53 MET O 1 1 4 3713 1 1 18 MET SD S -14.343 -10.847 -2.890 1.00 . A A . 53 MET SD 1 1 4 3714 1 1 19 GLU C C -10.304 -5.224 0.085 1.00 . A A . 54 GLU C 1 1 4 3715 1 1 19 GLU CA C -10.950 -6.081 -0.984 1.00 . A A . 54 GLU CA 1 1 4 3716 1 1 19 GLU CB C -11.199 -5.245 -2.225 1.00 . A A . 54 GLU CB 1 1 4 3717 1 1 19 GLU CD C -12.258 -5.163 -4.498 1.00 . A A . 54 GLU CD 1 1 4 3718 1 1 19 GLU CG C -11.918 -6.009 -3.308 1.00 . A A . 54 GLU CG 1 1 4 3719 1 1 19 GLU H H -12.997 -6.033 -0.542 1.00 . A A . 54 GLU H 1 1 4 3720 1 1 19 GLU HA H -10.299 -6.901 -1.244 1.00 . A A . 54 GLU HA 1 1 4 3721 1 1 19 GLU HB2 H -11.797 -4.388 -1.956 1.00 . A A . 54 GLU HB2 1 1 4 3722 1 1 19 GLU HB3 H -10.252 -4.904 -2.616 1.00 . A A . 54 GLU HB3 1 1 4 3723 1 1 19 GLU HG2 H -11.288 -6.828 -3.618 1.00 . A A . 54 GLU HG2 1 1 4 3724 1 1 19 GLU HG3 H -12.828 -6.409 -2.885 1.00 . A A . 54 GLU HG3 1 1 4 3725 1 1 19 GLU N N -12.207 -6.610 -0.513 1.00 . A A . 54 GLU N 1 1 4 3726 1 1 19 GLU O O -9.098 -5.003 0.049 1.00 . A A . 54 GLU O 1 1 4 3727 1 1 19 GLU OE1 O -13.355 -4.563 -4.527 1.00 . A A . 54 GLU OE1 1 1 4 3728 1 1 19 GLU OE2 O -11.452 -5.108 -5.447 1.00 . A A . 54 GLU OE2 1 1 4 3729 1 1 20 ARG C C -9.710 -4.622 3.063 1.00 . A A . 55 ARG C 1 1 4 3730 1 1 20 ARG CA C -10.669 -3.932 2.130 1.00 . A A . 55 ARG CA 1 1 4 3731 1 1 20 ARG CB C -11.851 -3.286 2.872 1.00 . A A . 55 ARG CB 1 1 4 3732 1 1 20 ARG CD C -12.753 -2.378 5.031 1.00 . A A . 55 ARG CD 1 1 4 3733 1 1 20 ARG CG C -11.503 -2.657 4.206 1.00 . A A . 55 ARG CG 1 1 4 3734 1 1 20 ARG CZ C -13.096 -1.944 7.473 1.00 . A A . 55 ARG CZ 1 1 4 3735 1 1 20 ARG H H -12.051 -5.068 1.013 1.00 . A A . 55 ARG H 1 1 4 3736 1 1 20 ARG HA H -10.110 -3.144 1.655 1.00 . A A . 55 ARG HA 1 1 4 3737 1 1 20 ARG HB2 H -12.204 -2.460 2.265 1.00 . A A . 55 ARG HB2 1 1 4 3738 1 1 20 ARG HB3 H -12.641 -4.000 2.983 1.00 . A A . 55 ARG HB3 1 1 4 3739 1 1 20 ARG HD2 H -13.410 -1.741 4.457 1.00 . A A . 55 ARG HD2 1 1 4 3740 1 1 20 ARG HD3 H -13.257 -3.312 5.227 1.00 . A A . 55 ARG HD3 1 1 4 3741 1 1 20 ARG HE H -11.722 -1.059 6.272 1.00 . A A . 55 ARG HE 1 1 4 3742 1 1 20 ARG HG2 H -10.834 -3.318 4.736 1.00 . A A . 55 ARG HG2 1 1 4 3743 1 1 20 ARG HG3 H -10.991 -1.726 4.016 1.00 . A A . 55 ARG HG3 1 1 4 3744 1 1 20 ARG HH11 H -14.314 -3.457 6.776 1.00 . A A . 55 ARG HH11 1 1 4 3745 1 1 20 ARG HH12 H -14.558 -3.061 8.401 1.00 . A A . 55 ARG HH12 1 1 4 3746 1 1 20 ARG HH21 H -12.064 -0.532 8.549 1.00 . A A . 55 ARG HH21 1 1 4 3747 1 1 20 ARG HH22 H -13.248 -1.377 9.426 1.00 . A A . 55 ARG HH22 1 1 4 3748 1 1 20 ARG N N -11.110 -4.795 1.049 1.00 . A A . 55 ARG N 1 1 4 3749 1 1 20 ARG NE N -12.445 -1.723 6.312 1.00 . A A . 55 ARG NE 1 1 4 3750 1 1 20 ARG NH1 N -14.048 -2.883 7.555 1.00 . A A . 55 ARG NH1 1 1 4 3751 1 1 20 ARG NH2 N -12.778 -1.239 8.552 1.00 . A A . 55 ARG NH2 1 1 4 3752 1 1 20 ARG O O -10.073 -5.483 3.865 1.00 . A A . 55 ARG O 1 1 4 3753 1 1 21 LEU C C -6.840 -3.447 4.308 1.00 . A A . 56 LEU C 1 1 4 3754 1 1 21 LEU CA C -7.398 -4.685 3.635 1.00 . A A . 56 LEU CA 1 1 4 3755 1 1 21 LEU CB C -6.373 -5.349 2.668 1.00 . A A . 56 LEU CB 1 1 4 3756 1 1 21 LEU CD1 C -4.392 -6.785 2.319 1.00 . A A . 56 LEU CD1 1 1 4 3757 1 1 21 LEU CD2 C -4.040 -4.529 3.127 1.00 . A A . 56 LEU CD2 1 1 4 3758 1 1 21 LEU CG C -4.975 -5.726 3.198 1.00 . A A . 56 LEU CG 1 1 4 3759 1 1 21 LEU H H -8.328 -3.659 2.130 1.00 . A A . 56 LEU H 1 1 4 3760 1 1 21 LEU HA H -7.713 -5.404 4.377 1.00 . A A . 56 LEU HA 1 1 4 3761 1 1 21 LEU HB2 H -6.822 -6.253 2.287 1.00 . A A . 56 LEU HB2 1 1 4 3762 1 1 21 LEU HB3 H -6.242 -4.675 1.834 1.00 . A A . 56 LEU HB3 1 1 4 3763 1 1 21 LEU HD11 H -4.205 -6.347 1.348 1.00 . A A . 56 LEU HD11 1 1 4 3764 1 1 21 LEU HD12 H -5.085 -7.608 2.228 1.00 . A A . 56 LEU HD12 1 1 4 3765 1 1 21 LEU HD13 H -3.463 -7.123 2.744 1.00 . A A . 56 LEU HD13 1 1 4 3766 1 1 21 LEU HD21 H -3.081 -4.792 3.547 1.00 . A A . 56 LEU HD21 1 1 4 3767 1 1 21 LEU HD22 H -4.470 -3.716 3.693 1.00 . A A . 56 LEU HD22 1 1 4 3768 1 1 21 LEU HD23 H -3.917 -4.227 2.098 1.00 . A A . 56 LEU HD23 1 1 4 3769 1 1 21 LEU HG H -5.021 -6.069 4.221 1.00 . A A . 56 LEU HG 1 1 4 3770 1 1 21 LEU N N -8.510 -4.271 2.876 1.00 . A A . 56 LEU N 1 1 4 3771 1 1 21 LEU O O -7.120 -2.320 3.884 1.00 . A A . 56 LEU O 1 1 4 3772 1 1 22 VAL C C -3.985 -2.807 6.160 1.00 . A A . 57 VAL C 1 1 4 3773 1 1 22 VAL CA C -5.479 -2.542 5.999 1.00 . A A . 57 VAL CA 1 1 4 3774 1 1 22 VAL CB C -6.173 -2.216 7.360 1.00 . A A . 57 VAL CB 1 1 4 3775 1 1 22 VAL CG1 C -6.272 -3.435 8.263 1.00 . A A . 57 VAL CG1 1 1 4 3776 1 1 22 VAL CG2 C -5.468 -1.084 8.067 1.00 . A A . 57 VAL CG2 1 1 4 3777 1 1 22 VAL H H -5.940 -4.535 5.683 1.00 . A A . 57 VAL H 1 1 4 3778 1 1 22 VAL HA H -5.590 -1.689 5.345 1.00 . A A . 57 VAL HA 1 1 4 3779 1 1 22 VAL HB H -7.181 -1.897 7.140 1.00 . A A . 57 VAL HB 1 1 4 3780 1 1 22 VAL HG11 H -6.856 -4.191 7.760 1.00 . A A . 57 VAL HG11 1 1 4 3781 1 1 22 VAL HG12 H -6.765 -3.149 9.180 1.00 . A A . 57 VAL HG12 1 1 4 3782 1 1 22 VAL HG13 H -5.283 -3.811 8.477 1.00 . A A . 57 VAL HG13 1 1 4 3783 1 1 22 VAL HG21 H -5.498 -0.212 7.431 1.00 . A A . 57 VAL HG21 1 1 4 3784 1 1 22 VAL HG22 H -4.439 -1.360 8.248 1.00 . A A . 57 VAL HG22 1 1 4 3785 1 1 22 VAL HG23 H -5.971 -0.869 8.998 1.00 . A A . 57 VAL HG23 1 1 4 3786 1 1 22 VAL N N -6.101 -3.633 5.341 1.00 . A A . 57 VAL N 1 1 4 3787 1 1 22 VAL O O -3.581 -3.834 6.720 1.00 . A A . 57 VAL O 1 1 4 3788 1 1 23 ALA C C -1.293 -0.716 6.287 1.00 . A A . 58 ALA C 1 1 4 3789 1 1 23 ALA CA C -1.741 -2.045 5.758 1.00 . A A . 58 ALA CA 1 1 4 3790 1 1 23 ALA CB C -1.061 -2.330 4.392 1.00 . A A . 58 ALA CB 1 1 4 3791 1 1 23 ALA H H -3.550 -1.185 5.089 1.00 . A A . 58 ALA H 1 1 4 3792 1 1 23 ALA HA H -1.519 -2.837 6.456 1.00 . A A . 58 ALA HA 1 1 4 3793 1 1 23 ALA HB1 H 0.008 -2.454 4.492 1.00 . A A . 58 ALA HB1 1 1 4 3794 1 1 23 ALA HB2 H -1.216 -1.485 3.733 1.00 . A A . 58 ALA HB2 1 1 4 3795 1 1 23 ALA HB3 H -1.478 -3.206 3.915 1.00 . A A . 58 ALA HB3 1 1 4 3796 1 1 23 ALA N N -3.178 -1.944 5.595 1.00 . A A . 58 ALA N 1 1 4 3797 1 1 23 ALA O O -1.719 0.299 5.750 1.00 . A A . 58 ALA O 1 1 4 3798 1 1 24 ASP C C -1.103 1.520 8.270 1.00 . A A . 59 ASP C 1 1 4 3799 1 1 24 ASP CA C 0.052 0.579 7.925 1.00 . A A . 59 ASP CA 1 1 4 3800 1 1 24 ASP CB C 1.100 1.294 7.077 1.00 . A A . 59 ASP CB 1 1 4 3801 1 1 24 ASP CG C 2.126 0.367 6.404 1.00 . A A . 59 ASP CG 1 1 4 3802 1 1 24 ASP H H -0.074 -1.558 7.640 1.00 . A A . 59 ASP H 1 1 4 3803 1 1 24 ASP HA H 0.502 0.293 8.865 1.00 . A A . 59 ASP HA 1 1 4 3804 1 1 24 ASP HB2 H 0.719 2.151 6.548 1.00 . A A . 59 ASP HB2 1 1 4 3805 1 1 24 ASP HB3 H 1.701 1.720 7.874 1.00 . A A . 59 ASP HB3 1 1 4 3806 1 1 24 ASP N N -0.413 -0.701 7.306 1.00 . A A . 59 ASP N 1 1 4 3807 1 1 24 ASP O O -1.003 2.752 8.135 1.00 . A A . 59 ASP O 1 1 4 3808 1 1 24 ASP OD1 O 1.782 -0.384 5.492 1.00 . A A . 59 ASP OD1 1 1 4 3809 1 1 24 ASP OD2 O 3.330 0.386 6.828 1.00 . A A . 59 ASP OD2 1 1 4 3810 1 1 25 LYS C C -4.141 2.256 7.830 1.00 . A A . 60 LYS C 1 1 4 3811 1 1 25 LYS CA C -3.466 1.527 9.032 1.00 . A A . 60 LYS CA 1 1 4 3812 1 1 25 LYS CB C -3.385 2.367 10.295 1.00 . A A . 60 LYS CB 1 1 4 3813 1 1 25 LYS CD C -4.613 3.441 12.163 1.00 . A A . 60 LYS CD 1 1 4 3814 1 1 25 LYS CE C -5.957 3.959 12.639 1.00 . A A . 60 LYS CE 1 1 4 3815 1 1 25 LYS CG C -4.731 2.808 10.819 1.00 . A A . 60 LYS CG 1 1 4 3816 1 1 25 LYS H H -2.107 -0.056 8.850 1.00 . A A . 60 LYS H 1 1 4 3817 1 1 25 LYS HA H -4.113 0.689 9.237 1.00 . A A . 60 LYS HA 1 1 4 3818 1 1 25 LYS HB2 H -2.884 1.798 11.064 1.00 . A A . 60 LYS HB2 1 1 4 3819 1 1 25 LYS HB3 H -2.804 3.240 10.052 1.00 . A A . 60 LYS HB3 1 1 4 3820 1 1 25 LYS HD2 H -4.239 2.705 12.859 1.00 . A A . 60 LYS HD2 1 1 4 3821 1 1 25 LYS HD3 H -3.906 4.249 12.067 1.00 . A A . 60 LYS HD3 1 1 4 3822 1 1 25 LYS HE2 H -5.855 4.312 13.655 1.00 . A A . 60 LYS HE2 1 1 4 3823 1 1 25 LYS HE3 H -6.256 4.780 12.005 1.00 . A A . 60 LYS HE3 1 1 4 3824 1 1 25 LYS HG2 H -5.158 3.522 10.131 1.00 . A A . 60 LYS HG2 1 1 4 3825 1 1 25 LYS HG3 H -5.379 1.948 10.889 1.00 . A A . 60 LYS HG3 1 1 4 3826 1 1 25 LYS HZ1 H -7.891 3.283 13.008 1.00 . A A . 60 LYS HZ1 1 1 4 3827 1 1 25 LYS HZ2 H -6.721 2.059 13.120 1.00 . A A . 60 LYS HZ2 1 1 4 3828 1 1 25 LYS HZ3 H -7.217 2.636 11.616 1.00 . A A . 60 LYS HZ3 1 1 4 3829 1 1 25 LYS N N -2.191 0.907 8.707 1.00 . A A . 60 LYS N 1 1 4 3830 1 1 25 LYS NZ N -7.009 2.911 12.600 1.00 . A A . 60 LYS NZ 1 1 4 3831 1 1 25 LYS O O -5.201 2.880 7.952 1.00 . A A . 60 LYS O 1 1 4 3832 1 1 26 LEU C C -5.111 1.626 4.947 1.00 . A A . 61 LEU C 1 1 4 3833 1 1 26 LEU CA C -4.145 2.680 5.486 1.00 . A A . 61 LEU CA 1 1 4 3834 1 1 26 LEU CB C -3.070 2.992 4.477 1.00 . A A . 61 LEU CB 1 1 4 3835 1 1 26 LEU CD1 C -0.870 4.024 3.905 1.00 . A A . 61 LEU CD1 1 1 4 3836 1 1 26 LEU CD2 C -2.476 5.289 5.324 1.00 . A A . 61 LEU CD2 1 1 4 3837 1 1 26 LEU CG C -1.941 3.911 4.962 1.00 . A A . 61 LEU CG 1 1 4 3838 1 1 26 LEU H H -2.658 1.731 6.615 1.00 . A A . 61 LEU H 1 1 4 3839 1 1 26 LEU HA H -4.688 3.576 5.730 1.00 . A A . 61 LEU HA 1 1 4 3840 1 1 26 LEU HB2 H -2.651 2.041 4.193 1.00 . A A . 61 LEU HB2 1 1 4 3841 1 1 26 LEU HB3 H -3.536 3.442 3.612 1.00 . A A . 61 LEU HB3 1 1 4 3842 1 1 26 LEU HD11 H -0.520 3.034 3.647 1.00 . A A . 61 LEU HD11 1 1 4 3843 1 1 26 LEU HD12 H -0.049 4.611 4.288 1.00 . A A . 61 LEU HD12 1 1 4 3844 1 1 26 LEU HD13 H -1.278 4.502 3.026 1.00 . A A . 61 LEU HD13 1 1 4 3845 1 1 26 LEU HD21 H -1.659 5.914 5.652 1.00 . A A . 61 LEU HD21 1 1 4 3846 1 1 26 LEU HD22 H -3.198 5.197 6.121 1.00 . A A . 61 LEU HD22 1 1 4 3847 1 1 26 LEU HD23 H -2.945 5.733 4.458 1.00 . A A . 61 LEU HD23 1 1 4 3848 1 1 26 LEU HG H -1.491 3.476 5.843 1.00 . A A . 61 LEU HG 1 1 4 3849 1 1 26 LEU N N -3.547 2.158 6.680 1.00 . A A . 61 LEU N 1 1 4 3850 1 1 26 LEU O O -4.746 0.447 4.817 1.00 . A A . 61 LEU O 1 1 4 3851 1 1 27 ILE C C -7.421 1.035 2.733 1.00 . A A . 62 ILE C 1 1 4 3852 1 1 27 ILE CA C -7.343 1.074 4.252 1.00 . A A . 62 ILE CA 1 1 4 3853 1 1 27 ILE CB C -8.742 1.474 4.798 1.00 . A A . 62 ILE CB 1 1 4 3854 1 1 27 ILE CD1 C -8.347 0.735 7.231 1.00 . A A . 62 ILE CD1 1 1 4 3855 1 1 27 ILE CG1 C -8.702 1.860 6.285 1.00 . A A . 62 ILE CG1 1 1 4 3856 1 1 27 ILE CG2 C -9.684 0.327 4.620 1.00 . A A . 62 ILE CG2 1 1 4 3857 1 1 27 ILE H H -6.569 2.973 4.672 1.00 . A A . 62 ILE H 1 1 4 3858 1 1 27 ILE HA H -7.071 0.104 4.638 1.00 . A A . 62 ILE HA 1 1 4 3859 1 1 27 ILE HB H -9.114 2.310 4.225 1.00 . A A . 62 ILE HB 1 1 4 3860 1 1 27 ILE HD11 H -8.321 1.102 8.247 1.00 . A A . 62 ILE HD11 1 1 4 3861 1 1 27 ILE HD12 H -7.381 0.337 6.959 1.00 . A A . 62 ILE HD12 1 1 4 3862 1 1 27 ILE HD13 H -9.085 -0.049 7.147 1.00 . A A . 62 ILE HD13 1 1 4 3863 1 1 27 ILE HG12 H -7.952 2.624 6.403 1.00 . A A . 62 ILE HG12 1 1 4 3864 1 1 27 ILE HG13 H -9.662 2.262 6.575 1.00 . A A . 62 ILE HG13 1 1 4 3865 1 1 27 ILE HG21 H -9.266 -0.498 5.181 1.00 . A A . 62 ILE HG21 1 1 4 3866 1 1 27 ILE HG22 H -9.764 0.086 3.570 1.00 . A A . 62 ILE HG22 1 1 4 3867 1 1 27 ILE HG23 H -10.641 0.602 5.035 1.00 . A A . 62 ILE HG23 1 1 4 3868 1 1 27 ILE N N -6.326 2.024 4.647 1.00 . A A . 62 ILE N 1 1 4 3869 1 1 27 ILE O O -7.702 2.057 2.089 1.00 . A A . 62 ILE O 1 1 4 3870 1 1 28 PHE C C -7.251 -1.691 0.232 1.00 . A A . 63 PHE C 1 1 4 3871 1 1 28 PHE CA C -7.114 -0.288 0.741 1.00 . A A . 63 PHE CA 1 1 4 3872 1 1 28 PHE CB C -5.966 0.444 0.086 1.00 . A A . 63 PHE CB 1 1 4 3873 1 1 28 PHE CD1 C -4.109 -0.990 1.064 1.00 . A A . 63 PHE CD1 1 1 4 3874 1 1 28 PHE CD2 C -3.901 1.358 0.980 1.00 . A A . 63 PHE CD2 1 1 4 3875 1 1 28 PHE CE1 C -2.871 -1.065 1.659 1.00 . A A . 63 PHE CE1 1 1 4 3876 1 1 28 PHE CE2 C -2.696 1.280 1.556 1.00 . A A . 63 PHE CE2 1 1 4 3877 1 1 28 PHE CG C -4.631 0.252 0.717 1.00 . A A . 63 PHE CG 1 1 4 3878 1 1 28 PHE CZ C -2.160 0.086 1.902 1.00 . A A . 63 PHE CZ 1 1 4 3879 1 1 28 PHE H H -6.972 -0.904 2.731 1.00 . A A . 63 PHE H 1 1 4 3880 1 1 28 PHE HA H -8.009 0.212 0.405 1.00 . A A . 63 PHE HA 1 1 4 3881 1 1 28 PHE HB2 H -5.898 0.295 -0.980 1.00 . A A . 63 PHE HB2 1 1 4 3882 1 1 28 PHE HB3 H -6.187 1.485 0.280 1.00 . A A . 63 PHE HB3 1 1 4 3883 1 1 28 PHE HD1 H -4.654 -1.905 0.876 1.00 . A A . 63 PHE HD1 1 1 4 3884 1 1 28 PHE HD2 H -4.303 2.324 0.714 1.00 . A A . 63 PHE HD2 1 1 4 3885 1 1 28 PHE HE1 H -2.458 -2.027 1.926 1.00 . A A . 63 PHE HE1 1 1 4 3886 1 1 28 PHE HE2 H -2.155 2.190 1.736 1.00 . A A . 63 PHE HE2 1 1 4 3887 1 1 28 PHE HZ H -1.175 0.089 2.353 1.00 . A A . 63 PHE HZ 1 1 4 3888 1 1 28 PHE N N -7.140 -0.116 2.167 1.00 . A A . 63 PHE N 1 1 4 3889 1 1 28 PHE O O -7.297 -2.636 0.985 1.00 . A A . 63 PHE O 1 1 4 3890 1 1 29 HIS C C -6.063 -3.685 -1.651 1.00 . A A . 64 HIS C 1 1 4 3891 1 1 29 HIS CA C -7.413 -3.023 -1.802 1.00 . A A . 64 HIS CA 1 1 4 3892 1 1 29 HIS CB C -7.625 -2.741 -3.306 1.00 . A A . 64 HIS CB 1 1 4 3893 1 1 29 HIS CD2 C -10.020 -2.142 -3.976 1.00 . A A . 64 HIS CD2 1 1 4 3894 1 1 29 HIS CE1 C -9.808 0.026 -3.934 1.00 . A A . 64 HIS CE1 1 1 4 3895 1 1 29 HIS CG C -8.756 -1.835 -3.634 1.00 . A A . 64 HIS CG 1 1 4 3896 1 1 29 HIS H H -7.479 -0.957 -1.588 1.00 . A A . 64 HIS H 1 1 4 3897 1 1 29 HIS HA H -8.209 -3.653 -1.436 1.00 . A A . 64 HIS HA 1 1 4 3898 1 1 29 HIS HB2 H -6.752 -2.251 -3.702 1.00 . A A . 64 HIS HB2 1 1 4 3899 1 1 29 HIS HB3 H -7.779 -3.673 -3.828 1.00 . A A . 64 HIS HB3 1 1 4 3900 1 1 29 HIS HD2 H -10.428 -3.135 -4.055 1.00 . A A . 64 HIS HD2 1 1 4 3901 1 1 29 HIS HE1 H -10.041 1.079 -3.991 1.00 . A A . 64 HIS HE1 1 1 4 3902 1 1 29 HIS HE2 H -11.650 -0.865 -4.368 1.00 . A A . 64 HIS HE2 1 1 4 3903 1 1 29 HIS N N -7.373 -1.778 -1.072 1.00 . A A . 64 HIS N 1 1 4 3904 1 1 29 HIS ND1 N -8.623 -0.456 -3.603 1.00 . A A . 64 HIS ND1 1 1 4 3905 1 1 29 HIS NE2 N -10.689 -0.959 -4.167 1.00 . A A . 64 HIS NE2 1 1 4 3906 1 1 29 HIS O O -5.012 -3.040 -1.730 1.00 . A A . 64 HIS O 1 1 4 3907 1 1 30 ASN C C -4.053 -5.777 -2.505 1.00 . A A . 65 ASN C 1 1 4 3908 1 1 30 ASN CA C -4.929 -5.780 -1.259 1.00 . A A . 65 ASN CA 1 1 4 3909 1 1 30 ASN CB C -5.314 -7.238 -0.905 1.00 . A A . 65 ASN CB 1 1 4 3910 1 1 30 ASN CG C -6.134 -7.969 -1.976 1.00 . A A . 65 ASN CG 1 1 4 3911 1 1 30 ASN H H -6.994 -5.375 -1.353 1.00 . A A . 65 ASN H 1 1 4 3912 1 1 30 ASN HA H -4.363 -5.374 -0.436 1.00 . A A . 65 ASN HA 1 1 4 3913 1 1 30 ASN HB2 H -4.411 -7.808 -0.745 1.00 . A A . 65 ASN HB2 1 1 4 3914 1 1 30 ASN HB3 H -5.882 -7.234 0.014 1.00 . A A . 65 ASN HB3 1 1 4 3915 1 1 30 ASN HD21 H -5.294 -9.657 -1.454 1.00 . A A . 65 ASN HD21 1 1 4 3916 1 1 30 ASN HD22 H -6.430 -9.758 -2.751 1.00 . A A . 65 ASN HD22 1 1 4 3917 1 1 30 ASN N N -6.110 -4.958 -1.428 1.00 . A A . 65 ASN N 1 1 4 3918 1 1 30 ASN ND2 N -5.940 -9.248 -2.072 1.00 . A A . 65 ASN ND2 1 1 4 3919 1 1 30 ASN O O -2.843 -5.827 -2.416 1.00 . A A . 65 ASN O 1 1 4 3920 1 1 30 ASN OD1 O -6.936 -7.372 -2.712 1.00 . A A . 65 ASN OD1 1 1 4 3921 1 1 31 SER C C -3.360 -4.554 -5.409 1.00 . A A . 66 SER C 1 1 4 3922 1 1 31 SER CA C -4.053 -5.840 -4.911 1.00 . A A . 66 SER CA 1 1 4 3923 1 1 31 SER CB C -5.112 -6.257 -5.886 1.00 . A A . 66 SER CB 1 1 4 3924 1 1 31 SER H H -5.662 -5.673 -3.631 1.00 . A A . 66 SER H 1 1 4 3925 1 1 31 SER HA H -3.330 -6.639 -4.898 1.00 . A A . 66 SER HA 1 1 4 3926 1 1 31 SER HB2 H -4.698 -6.176 -6.878 1.00 . A A . 66 SER HB2 1 1 4 3927 1 1 31 SER HB3 H -5.407 -7.277 -5.689 1.00 . A A . 66 SER HB3 1 1 4 3928 1 1 31 SER HG H -7.042 -5.956 -5.787 1.00 . A A . 66 SER HG 1 1 4 3929 1 1 31 SER N N -4.684 -5.753 -3.632 1.00 . A A . 66 SER N 1 1 4 3930 1 1 31 SER O O -2.530 -4.623 -6.322 1.00 . A A . 66 SER O 1 1 4 3931 1 1 31 SER OG O -6.248 -5.413 -5.754 1.00 . A A . 66 SER OG 1 1 4 3932 1 1 32 CYS C C -1.948 -1.556 -5.076 1.00 . A A . 67 CYS C 1 1 4 3933 1 1 32 CYS CA C -3.265 -2.174 -5.495 1.00 . A A . 67 CYS CA 1 1 4 3934 1 1 32 CYS CB C -4.400 -1.147 -5.471 1.00 . A A . 67 CYS CB 1 1 4 3935 1 1 32 CYS H H -4.063 -3.408 -3.930 1.00 . A A . 67 CYS H 1 1 4 3936 1 1 32 CYS HA H -3.136 -2.456 -6.530 1.00 . A A . 67 CYS HA 1 1 4 3937 1 1 32 CYS HB2 H -4.011 -0.196 -5.800 1.00 . A A . 67 CYS HB2 1 1 4 3938 1 1 32 CYS HB3 H -5.208 -1.466 -6.112 1.00 . A A . 67 CYS HB3 1 1 4 3939 1 1 32 CYS N N -3.645 -3.413 -4.821 1.00 . A A . 67 CYS N 1 1 4 3940 1 1 32 CYS O O -1.345 -0.808 -5.863 1.00 . A A . 67 CYS O 1 1 4 3941 1 1 32 CYS SG S -5.078 -0.813 -3.853 1.00 . A A . 67 CYS SG 1 1 4 3942 1 1 33 PHE C C 0.986 -1.820 -3.938 1.00 . A A . 68 PHE C 1 1 4 3943 1 1 33 PHE CA C -0.288 -1.146 -3.465 1.00 . A A . 68 PHE CA 1 1 4 3944 1 1 33 PHE CB C -0.258 -0.826 -1.962 1.00 . A A . 68 PHE CB 1 1 4 3945 1 1 33 PHE CD1 C -1.589 -2.681 -0.869 1.00 . A A . 68 PHE CD1 1 1 4 3946 1 1 33 PHE CD2 C 0.651 -2.269 -0.167 1.00 . A A . 68 PHE CD2 1 1 4 3947 1 1 33 PHE CE1 C -1.688 -3.700 0.067 1.00 . A A . 68 PHE CE1 1 1 4 3948 1 1 33 PHE CE2 C 0.553 -3.266 0.753 1.00 . A A . 68 PHE CE2 1 1 4 3949 1 1 33 PHE CG C -0.408 -1.956 -0.992 1.00 . A A . 68 PHE CG 1 1 4 3950 1 1 33 PHE CZ C -0.609 -3.979 0.875 1.00 . A A . 68 PHE CZ 1 1 4 3951 1 1 33 PHE H H -1.889 -2.511 -3.318 1.00 . A A . 68 PHE H 1 1 4 3952 1 1 33 PHE HA H -0.322 -0.209 -4.002 1.00 . A A . 68 PHE HA 1 1 4 3953 1 1 33 PHE HB2 H 0.779 -0.585 -1.786 1.00 . A A . 68 PHE HB2 1 1 4 3954 1 1 33 PHE HB3 H -0.902 -0.003 -1.687 1.00 . A A . 68 PHE HB3 1 1 4 3955 1 1 33 PHE HD1 H -2.425 -2.448 -1.512 1.00 . A A . 68 PHE HD1 1 1 4 3956 1 1 33 PHE HD2 H 1.572 -1.711 -0.253 1.00 . A A . 68 PHE HD2 1 1 4 3957 1 1 33 PHE HE1 H -2.602 -4.266 0.189 1.00 . A A . 68 PHE HE1 1 1 4 3958 1 1 33 PHE HE2 H 1.396 -3.487 1.390 1.00 . A A . 68 PHE HE2 1 1 4 3959 1 1 33 PHE HZ H -0.655 -4.764 1.611 1.00 . A A . 68 PHE HZ 1 1 4 3960 1 1 33 PHE N N -1.470 -1.837 -3.891 1.00 . A A . 68 PHE N 1 1 4 3961 1 1 33 PHE O O 1.383 -2.885 -3.458 1.00 . A A . 68 PHE O 1 1 4 3962 1 1 34 CYS C C 3.752 -0.433 -5.385 1.00 . A A . 69 CYS C 1 1 4 3963 1 1 34 CYS CA C 2.815 -1.613 -5.457 1.00 . A A . 69 CYS CA 1 1 4 3964 1 1 34 CYS CB C 2.630 -2.073 -6.897 1.00 . A A . 69 CYS CB 1 1 4 3965 1 1 34 CYS H H 1.197 -0.395 -5.291 1.00 . A A . 69 CYS H 1 1 4 3966 1 1 34 CYS HA H 3.188 -2.430 -4.860 1.00 . A A . 69 CYS HA 1 1 4 3967 1 1 34 CYS HB2 H 2.351 -1.253 -7.542 1.00 . A A . 69 CYS HB2 1 1 4 3968 1 1 34 CYS HB3 H 3.591 -2.426 -7.227 1.00 . A A . 69 CYS HB3 1 1 4 3969 1 1 34 CYS HG H 0.280 -2.891 -7.360 1.00 . A A . 69 CYS HG 1 1 4 3970 1 1 34 CYS N N 1.585 -1.205 -4.905 1.00 . A A . 69 CYS N 1 1 4 3971 1 1 34 CYS O O 3.311 0.671 -5.047 1.00 . A A . 69 CYS O 1 1 4 3972 1 1 34 CYS SG S 1.454 -3.440 -7.078 1.00 . A A . 69 CYS SG 1 1 4 3973 1 1 35 CYS C C 5.639 1.471 -6.655 1.00 . A A . 70 CYS C 1 1 4 3974 1 1 35 CYS CA C 5.990 0.423 -5.623 1.00 . A A . 70 CYS CA 1 1 4 3975 1 1 35 CYS CB C 7.406 -0.125 -5.814 1.00 . A A . 70 CYS CB 1 1 4 3976 1 1 35 CYS H H 5.304 -1.556 -5.897 1.00 . A A . 70 CYS H 1 1 4 3977 1 1 35 CYS HA H 5.921 0.880 -4.649 1.00 . A A . 70 CYS HA 1 1 4 3978 1 1 35 CYS HB2 H 7.623 -0.719 -4.941 1.00 . A A . 70 CYS HB2 1 1 4 3979 1 1 35 CYS HB3 H 7.423 -0.744 -6.696 1.00 . A A . 70 CYS HB3 1 1 4 3980 1 1 35 CYS N N 5.022 -0.649 -5.657 1.00 . A A . 70 CYS N 1 1 4 3981 1 1 35 CYS O O 5.118 1.196 -7.751 1.00 . A A . 70 CYS O 1 1 4 3982 1 1 35 CYS SG S 8.776 1.074 -5.919 1.00 . A A . 70 CYS SG 1 1 4 3983 1 1 36 LYS C C 6.591 3.983 -8.133 1.00 . A A . 71 LYS C 1 1 4 3984 1 1 36 LYS CA C 5.552 3.811 -7.041 1.00 . A A . 71 LYS CA 1 1 4 3985 1 1 36 LYS CB C 5.503 5.042 -6.156 1.00 . A A . 71 LYS CB 1 1 4 3986 1 1 36 LYS CD C 3.355 6.329 -6.716 1.00 . A A . 71 LYS CD 1 1 4 3987 1 1 36 LYS CE C 2.704 5.406 -7.696 1.00 . A A . 71 LYS CE 1 1 4 3988 1 1 36 LYS CG C 4.882 6.290 -6.784 1.00 . A A . 71 LYS CG 1 1 4 3989 1 1 36 LYS H H 6.205 2.749 -5.338 1.00 . A A . 71 LYS H 1 1 4 3990 1 1 36 LYS HA H 4.590 3.675 -7.496 1.00 . A A . 71 LYS HA 1 1 4 3991 1 1 36 LYS HB2 H 4.963 4.807 -5.251 1.00 . A A . 71 LYS HB2 1 1 4 3992 1 1 36 LYS HB3 H 6.525 5.264 -5.901 1.00 . A A . 71 LYS HB3 1 1 4 3993 1 1 36 LYS HD2 H 3.047 6.042 -5.722 1.00 . A A . 71 LYS HD2 1 1 4 3994 1 1 36 LYS HD3 H 3.035 7.340 -6.912 1.00 . A A . 71 LYS HD3 1 1 4 3995 1 1 36 LYS HE2 H 3.212 5.607 -8.625 1.00 . A A . 71 LYS HE2 1 1 4 3996 1 1 36 LYS HE3 H 2.871 4.385 -7.388 1.00 . A A . 71 LYS HE3 1 1 4 3997 1 1 36 LYS HG2 H 5.244 7.190 -6.324 1.00 . A A . 71 LYS HG2 1 1 4 3998 1 1 36 LYS HG3 H 5.167 6.305 -7.825 1.00 . A A . 71 LYS HG3 1 1 4 3999 1 1 36 LYS HZ1 H 1.062 6.633 -8.110 1.00 . A A . 71 LYS HZ1 1 1 4 4000 1 1 36 LYS HZ2 H 0.778 5.522 -6.883 1.00 . A A . 71 LYS HZ2 1 1 4 4001 1 1 36 LYS HZ3 H 0.813 5.016 -8.490 1.00 . A A . 71 LYS HZ3 1 1 4 4002 1 1 36 LYS N N 5.855 2.667 -6.252 1.00 . A A . 71 LYS N 1 1 4 4003 1 1 36 LYS NZ N 1.249 5.659 -7.799 1.00 . A A . 71 LYS NZ 1 1 4 4004 1 1 36 LYS O O 6.265 4.334 -9.254 1.00 . A A . 71 LYS O 1 1 4 4005 1 1 37 HIS C C 8.940 2.662 -9.751 1.00 . A A . 72 HIS C 1 1 4 4006 1 1 37 HIS CA C 8.894 3.855 -8.786 1.00 . A A . 72 HIS CA 1 1 4 4007 1 1 37 HIS CB C 10.230 4.067 -8.081 1.00 . A A . 72 HIS CB 1 1 4 4008 1 1 37 HIS CD2 C 12.114 4.052 -9.876 1.00 . A A . 72 HIS CD2 1 1 4 4009 1 1 37 HIS CE1 C 12.749 6.113 -9.613 1.00 . A A . 72 HIS CE1 1 1 4 4010 1 1 37 HIS CG C 11.326 4.643 -8.946 1.00 . A A . 72 HIS CG 1 1 4 4011 1 1 37 HIS H H 8.033 3.320 -6.928 1.00 . A A . 72 HIS H 1 1 4 4012 1 1 37 HIS HA H 8.649 4.741 -9.354 1.00 . A A . 72 HIS HA 1 1 4 4013 1 1 37 HIS HB2 H 10.068 4.761 -7.270 1.00 . A A . 72 HIS HB2 1 1 4 4014 1 1 37 HIS HB3 H 10.573 3.123 -7.679 1.00 . A A . 72 HIS HB3 1 1 4 4015 1 1 37 HIS HD2 H 12.048 3.033 -10.229 1.00 . A A . 72 HIS HD2 1 1 4 4016 1 1 37 HIS HE1 H 13.321 7.026 -9.682 1.00 . A A . 72 HIS HE1 1 1 4 4017 1 1 37 HIS HE2 H 13.886 4.803 -10.700 1.00 . A A . 72 HIS HE2 1 1 4 4018 1 1 37 HIS N N 7.831 3.672 -7.820 1.00 . A A . 72 HIS N 1 1 4 4019 1 1 37 HIS ND1 N 11.723 5.945 -8.793 1.00 . A A . 72 HIS ND1 1 1 4 4020 1 1 37 HIS NE2 N 13.014 4.998 -10.291 1.00 . A A . 72 HIS NE2 1 1 4 4021 1 1 37 HIS O O 9.253 2.820 -10.929 1.00 . A A . 72 HIS O 1 1 4 4022 1 1 38 CYS C C 7.256 -0.417 -9.776 1.00 . A A . 73 CYS C 1 1 4 4023 1 1 38 CYS CA C 8.542 0.323 -10.104 1.00 . A A . 73 CYS CA 1 1 4 4024 1 1 38 CYS CB C 9.775 -0.566 -9.887 1.00 . A A . 73 CYS CB 1 1 4 4025 1 1 38 CYS H H 8.375 1.345 -8.321 1.00 . A A . 73 CYS H 1 1 4 4026 1 1 38 CYS HA H 8.545 0.694 -11.117 1.00 . A A . 73 CYS HA 1 1 4 4027 1 1 38 CYS HB2 H 9.936 -1.239 -10.705 1.00 . A A . 73 CYS HB2 1 1 4 4028 1 1 38 CYS HB3 H 10.584 0.137 -9.925 1.00 . A A . 73 CYS HB3 1 1 4 4029 1 1 38 CYS N N 8.612 1.475 -9.259 1.00 . A A . 73 CYS N 1 1 4 4030 1 1 38 CYS O O 6.971 -0.632 -8.620 1.00 . A A . 73 CYS O 1 1 4 4031 1 1 38 CYS SG S 9.893 -1.476 -8.315 1.00 . A A . 73 CYS SG 1 1 4 4032 1 1 39 HIS C C 5.358 -2.959 -10.113 1.00 . A A . 74 HIS C 1 1 4 4033 1 1 39 HIS CA C 5.201 -1.478 -10.452 1.00 . A A . 74 HIS CA 1 1 4 4034 1 1 39 HIS CB C 4.126 -1.221 -11.537 1.00 . A A . 74 HIS CB 1 1 4 4035 1 1 39 HIS CD2 C 4.614 -2.764 -13.583 1.00 . A A . 74 HIS CD2 1 1 4 4036 1 1 39 HIS CE1 C 4.970 -1.210 -15.064 1.00 . A A . 74 HIS CE1 1 1 4 4037 1 1 39 HIS CG C 4.498 -1.571 -12.956 1.00 . A A . 74 HIS CG 1 1 4 4038 1 1 39 HIS H H 6.787 -0.679 -11.671 1.00 . A A . 74 HIS H 1 1 4 4039 1 1 39 HIS HA H 4.848 -1.041 -9.524 1.00 . A A . 74 HIS HA 1 1 4 4040 1 1 39 HIS HB2 H 3.261 -1.813 -11.278 1.00 . A A . 74 HIS HB2 1 1 4 4041 1 1 39 HIS HB3 H 3.853 -0.176 -11.498 1.00 . A A . 74 HIS HB3 1 1 4 4042 1 1 39 HIS HD1 H 4.735 0.352 -13.798 1.00 . A A . 74 HIS HD1 1 1 4 4043 1 1 39 HIS HD2 H 4.497 -3.739 -13.131 1.00 . A A . 74 HIS HD2 1 1 4 4044 1 1 39 HIS HE1 H 5.181 -0.707 -15.997 1.00 . A A . 74 HIS HE1 1 1 4 4045 1 1 39 HIS HE2 H 4.677 -3.118 -15.627 1.00 . A A . 74 HIS HE2 1 1 4 4046 1 1 39 HIS N N 6.486 -0.818 -10.746 1.00 . A A . 74 HIS N 1 1 4 4047 1 1 39 HIS ND1 N 4.732 -0.624 -13.919 1.00 . A A . 74 HIS ND1 1 1 4 4048 1 1 39 HIS NE2 N 4.906 -2.509 -14.891 1.00 . A A . 74 HIS NE2 1 1 4 4049 1 1 39 HIS O O 4.821 -3.845 -10.773 1.00 . A A . 74 HIS O 1 1 4 4050 1 1 40 THR C C 5.276 -4.860 -7.532 1.00 . A A . 75 THR C 1 1 4 4051 1 1 40 THR CA C 6.322 -4.536 -8.611 1.00 . A A . 75 THR CA 1 1 4 4052 1 1 40 THR CB C 7.787 -4.713 -8.086 1.00 . A A . 75 THR CB 1 1 4 4053 1 1 40 THR CG2 C 8.047 -3.919 -6.806 1.00 . A A . 75 THR CG2 1 1 4 4054 1 1 40 THR H H 6.502 -2.437 -8.624 1.00 . A A . 75 THR H 1 1 4 4055 1 1 40 THR HA H 6.161 -5.202 -9.448 1.00 . A A . 75 THR HA 1 1 4 4056 1 1 40 THR HB H 8.446 -4.350 -8.861 1.00 . A A . 75 THR HB 1 1 4 4057 1 1 40 THR HG1 H 9.027 -6.153 -7.731 1.00 . A A . 75 THR HG1 1 1 4 4058 1 1 40 THR HG21 H 7.883 -2.869 -6.996 1.00 . A A . 75 THR HG21 1 1 4 4059 1 1 40 THR HG22 H 9.068 -4.069 -6.487 1.00 . A A . 75 THR HG22 1 1 4 4060 1 1 40 THR HG23 H 7.373 -4.255 -6.033 1.00 . A A . 75 THR HG23 1 1 4 4061 1 1 40 THR N N 6.097 -3.208 -9.082 1.00 . A A . 75 THR N 1 1 4 4062 1 1 40 THR O O 5.001 -4.020 -6.645 1.00 . A A . 75 THR O 1 1 4 4063 1 1 40 THR OG1 O 8.070 -6.089 -7.838 1.00 . A A . 75 THR OG1 1 1 4 4064 1 1 41 LYS C C 4.201 -6.805 -5.377 1.00 . A A . 76 LYS C 1 1 4 4065 1 1 41 LYS CA C 3.604 -6.465 -6.748 1.00 . A A . 76 LYS CA 1 1 4 4066 1 1 41 LYS CB C 2.902 -7.683 -7.316 1.00 . A A . 76 LYS CB 1 1 4 4067 1 1 41 LYS CD C 0.481 -7.116 -6.956 1.00 . A A . 76 LYS CD 1 1 4 4068 1 1 41 LYS CE C -0.819 -7.556 -6.296 1.00 . A A . 76 LYS CE 1 1 4 4069 1 1 41 LYS CG C 1.625 -8.056 -6.601 1.00 . A A . 76 LYS CG 1 1 4 4070 1 1 41 LYS H H 4.919 -6.612 -8.395 1.00 . A A . 76 LYS H 1 1 4 4071 1 1 41 LYS HA H 2.891 -5.661 -6.636 1.00 . A A . 76 LYS HA 1 1 4 4072 1 1 41 LYS HB2 H 2.677 -7.516 -8.359 1.00 . A A . 76 LYS HB2 1 1 4 4073 1 1 41 LYS HB3 H 3.585 -8.515 -7.232 1.00 . A A . 76 LYS HB3 1 1 4 4074 1 1 41 LYS HD2 H 0.724 -6.121 -6.616 1.00 . A A . 76 LYS HD2 1 1 4 4075 1 1 41 LYS HD3 H 0.347 -7.110 -8.027 1.00 . A A . 76 LYS HD3 1 1 4 4076 1 1 41 LYS HE2 H -0.704 -7.484 -5.224 1.00 . A A . 76 LYS HE2 1 1 4 4077 1 1 41 LYS HE3 H -1.609 -6.890 -6.612 1.00 . A A . 76 LYS HE3 1 1 4 4078 1 1 41 LYS HG2 H 1.364 -9.070 -6.849 1.00 . A A . 76 LYS HG2 1 1 4 4079 1 1 41 LYS HG3 H 1.813 -7.992 -5.540 1.00 . A A . 76 LYS HG3 1 1 4 4080 1 1 41 LYS HZ1 H -0.496 -9.636 -6.284 1.00 . A A . 76 LYS HZ1 1 1 4 4081 1 1 41 LYS HZ2 H -1.241 -9.073 -7.677 1.00 . A A . 76 LYS HZ2 1 1 4 4082 1 1 41 LYS HZ3 H -2.118 -9.195 -6.253 1.00 . A A . 76 LYS HZ3 1 1 4 4083 1 1 41 LYS N N 4.653 -6.024 -7.655 1.00 . A A . 76 LYS N 1 1 4 4084 1 1 41 LYS NZ N -1.187 -8.948 -6.646 1.00 . A A . 76 LYS NZ 1 1 4 4085 1 1 41 LYS O O 4.535 -7.950 -5.079 1.00 . A A . 76 LYS O 1 1 4 4086 1 1 42 LEU C C 3.900 -5.946 -2.164 1.00 . A A . 77 LEU C 1 1 4 4087 1 1 42 LEU CA C 4.922 -5.885 -3.263 1.00 . A A . 77 LEU CA 1 1 4 4088 1 1 42 LEU CB C 5.921 -4.745 -3.083 1.00 . A A . 77 LEU CB 1 1 4 4089 1 1 42 LEU CD1 C 4.445 -2.795 -2.199 1.00 . A A . 77 LEU CD1 1 1 4 4090 1 1 42 LEU CD2 C 6.561 -2.390 -3.345 1.00 . A A . 77 LEU CD2 1 1 4 4091 1 1 42 LEU CG C 5.399 -3.291 -3.281 1.00 . A A . 77 LEU CG 1 1 4 4092 1 1 42 LEU H H 4.030 -4.946 -4.954 1.00 . A A . 77 LEU H 1 1 4 4093 1 1 42 LEU HA H 5.476 -6.810 -3.228 1.00 . A A . 77 LEU HA 1 1 4 4094 1 1 42 LEU HB2 H 6.493 -4.817 -2.172 1.00 . A A . 77 LEU HB2 1 1 4 4095 1 1 42 LEU HB3 H 6.586 -4.874 -3.927 1.00 . A A . 77 LEU HB3 1 1 4 4096 1 1 42 LEU HD11 H 4.012 -1.840 -2.470 1.00 . A A . 77 LEU HD11 1 1 4 4097 1 1 42 LEU HD12 H 5.069 -2.626 -1.338 1.00 . A A . 77 LEU HD12 1 1 4 4098 1 1 42 LEU HD13 H 3.680 -3.518 -1.949 1.00 . A A . 77 LEU HD13 1 1 4 4099 1 1 42 LEU HD21 H 7.078 -2.438 -2.400 1.00 . A A . 77 LEU HD21 1 1 4 4100 1 1 42 LEU HD22 H 6.223 -1.380 -3.522 1.00 . A A . 77 LEU HD22 1 1 4 4101 1 1 42 LEU HD23 H 7.231 -2.704 -4.132 1.00 . A A . 77 LEU HD23 1 1 4 4102 1 1 42 LEU HG H 4.901 -3.227 -4.236 1.00 . A A . 77 LEU HG 1 1 4 4103 1 1 42 LEU N N 4.338 -5.803 -4.590 1.00 . A A . 77 LEU N 1 1 4 4104 1 1 42 LEU O O 4.239 -6.144 -0.978 1.00 . A A . 77 LEU O 1 1 4 4105 1 1 43 SER C C 1.512 -6.979 -0.781 1.00 . A A . 78 SER C 1 1 4 4106 1 1 43 SER CA C 1.570 -5.732 -1.649 1.00 . A A . 78 SER CA 1 1 4 4107 1 1 43 SER CB C 0.321 -5.637 -2.495 1.00 . A A . 78 SER CB 1 1 4 4108 1 1 43 SER H H 2.484 -5.655 -3.506 1.00 . A A . 78 SER H 1 1 4 4109 1 1 43 SER HA H 1.624 -4.842 -1.043 1.00 . A A . 78 SER HA 1 1 4 4110 1 1 43 SER HB2 H -0.548 -5.792 -1.873 1.00 . A A . 78 SER HB2 1 1 4 4111 1 1 43 SER HB3 H 0.269 -4.665 -2.962 1.00 . A A . 78 SER HB3 1 1 4 4112 1 1 43 SER HG H 0.960 -7.339 -3.226 1.00 . A A . 78 SER HG 1 1 4 4113 1 1 43 SER N N 2.664 -5.774 -2.553 1.00 . A A . 78 SER N 1 1 4 4114 1 1 43 SER O O 1.651 -8.096 -1.284 1.00 . A A . 78 SER O 1 1 4 4115 1 1 43 SER OG O 0.359 -6.635 -3.515 1.00 . A A . 78 SER OG 1 1 4 4116 1 1 44 LEU C C 2.067 -8.973 1.376 1.00 . A A . 79 LEU C 1 1 4 4117 1 1 44 LEU CA C 1.114 -7.776 1.529 1.00 . A A . 79 LEU CA 1 1 4 4118 1 1 44 LEU CB C -0.337 -8.191 1.667 1.00 . A A . 79 LEU CB 1 1 4 4119 1 1 44 LEU CD1 C -0.263 -8.725 4.136 1.00 . A A . 79 LEU CD1 1 1 4 4120 1 1 44 LEU CD2 C -0.920 -6.451 3.394 1.00 . A A . 79 LEU CD2 1 1 4 4121 1 1 44 LEU CG C -0.960 -7.930 3.053 1.00 . A A . 79 LEU CG 1 1 4 4122 1 1 44 LEU H H 1.144 -5.822 0.774 1.00 . A A . 79 LEU H 1 1 4 4123 1 1 44 LEU HA H 1.403 -7.292 2.449 1.00 . A A . 79 LEU HA 1 1 4 4124 1 1 44 LEU HB2 H -0.881 -7.635 0.911 1.00 . A A . 79 LEU HB2 1 1 4 4125 1 1 44 LEU HB3 H -0.407 -9.246 1.446 1.00 . A A . 79 LEU HB3 1 1 4 4126 1 1 44 LEU HD11 H 0.772 -8.418 4.193 1.00 . A A . 79 LEU HD11 1 1 4 4127 1 1 44 LEU HD12 H -0.323 -9.778 3.906 1.00 . A A . 79 LEU HD12 1 1 4 4128 1 1 44 LEU HD13 H -0.748 -8.532 5.081 1.00 . A A . 79 LEU HD13 1 1 4 4129 1 1 44 LEU HD21 H -1.233 -6.303 4.416 1.00 . A A . 79 LEU HD21 1 1 4 4130 1 1 44 LEU HD22 H -1.619 -5.947 2.745 1.00 . A A . 79 LEU HD22 1 1 4 4131 1 1 44 LEU HD23 H 0.073 -6.051 3.242 1.00 . A A . 79 LEU HD23 1 1 4 4132 1 1 44 LEU HG H -1.992 -8.242 3.028 1.00 . A A . 79 LEU HG 1 1 4 4133 1 1 44 LEU N N 1.253 -6.754 0.498 1.00 . A A . 79 LEU N 1 1 4 4134 1 1 44 LEU O O 1.657 -10.133 1.432 1.00 . A A . 79 LEU O 1 1 4 4135 1 1 45 GLY C C 5.582 -9.138 1.617 1.00 . A A . 80 GLY C 1 1 4 4136 1 1 45 GLY CA C 4.321 -9.677 1.051 1.00 . A A . 80 GLY CA 1 1 4 4137 1 1 45 GLY H H 3.555 -7.731 1.010 1.00 . A A . 80 GLY H 1 1 4 4138 1 1 45 GLY HA2 H 4.007 -10.547 1.609 1.00 . A A . 80 GLY HA2 1 1 4 4139 1 1 45 GLY HA3 H 4.482 -9.939 0.015 1.00 . A A . 80 GLY HA3 1 1 4 4140 1 1 45 GLY N N 3.310 -8.670 1.143 1.00 . A A . 80 GLY N 1 1 4 4141 1 1 45 GLY O O 5.997 -9.504 2.706 1.00 . A A . 80 GLY O 1 1 4 4142 1 1 46 SER C C 7.273 -6.124 0.782 1.00 . A A . 81 SER C 1 1 4 4143 1 1 46 SER CA C 7.333 -7.530 1.339 1.00 . A A . 81 SER CA 1 1 4 4144 1 1 46 SER CB C 8.574 -8.294 0.852 1.00 . A A . 81 SER CB 1 1 4 4145 1 1 46 SER H H 5.766 -7.958 0.046 1.00 . A A . 81 SER H 1 1 4 4146 1 1 46 SER HA H 7.329 -7.490 2.418 1.00 . A A . 81 SER HA 1 1 4 4147 1 1 46 SER HB2 H 9.461 -7.702 1.026 1.00 . A A . 81 SER HB2 1 1 4 4148 1 1 46 SER HB3 H 8.638 -9.222 1.399 1.00 . A A . 81 SER HB3 1 1 4 4149 1 1 46 SER HG H 8.558 -9.548 -0.628 1.00 . A A . 81 SER HG 1 1 4 4150 1 1 46 SER N N 6.148 -8.214 0.914 1.00 . A A . 81 SER N 1 1 4 4151 1 1 46 SER O O 7.423 -5.918 -0.427 1.00 . A A . 81 SER O 1 1 4 4152 1 1 46 SER OG O 8.487 -8.589 -0.540 1.00 . A A . 81 SER OG 1 1 4 4153 1 1 47 TYR C C 7.448 -2.829 2.062 1.00 . A A . 82 TYR C 1 1 4 4154 1 1 47 TYR CA C 6.829 -3.840 1.145 1.00 . A A . 82 TYR CA 1 1 4 4155 1 1 47 TYR CB C 5.316 -3.555 0.951 1.00 . A A . 82 TYR CB 1 1 4 4156 1 1 47 TYR CD1 C 4.569 -2.464 3.091 1.00 . A A . 82 TYR CD1 1 1 4 4157 1 1 47 TYR CD2 C 3.410 -4.436 2.447 1.00 . A A . 82 TYR CD2 1 1 4 4158 1 1 47 TYR CE1 C 3.764 -2.325 4.177 1.00 . A A . 82 TYR CE1 1 1 4 4159 1 1 47 TYR CE2 C 2.596 -4.306 3.563 1.00 . A A . 82 TYR CE2 1 1 4 4160 1 1 47 TYR CG C 4.430 -3.503 2.202 1.00 . A A . 82 TYR CG 1 1 4 4161 1 1 47 TYR CZ C 2.784 -3.236 4.418 1.00 . A A . 82 TYR CZ 1 1 4 4162 1 1 47 TYR H H 6.982 -5.271 2.601 1.00 . A A . 82 TYR H 1 1 4 4163 1 1 47 TYR HA H 7.308 -3.757 0.180 1.00 . A A . 82 TYR HA 1 1 4 4164 1 1 47 TYR HB2 H 5.207 -2.585 0.491 1.00 . A A . 82 TYR HB2 1 1 4 4165 1 1 47 TYR HB3 H 4.914 -4.297 0.279 1.00 . A A . 82 TYR HB3 1 1 4 4166 1 1 47 TYR HD1 H 5.365 -1.761 2.899 1.00 . A A . 82 TYR HD1 1 1 4 4167 1 1 47 TYR HD2 H 3.242 -5.278 1.791 1.00 . A A . 82 TYR HD2 1 1 4 4168 1 1 47 TYR HE1 H 3.903 -1.494 4.852 1.00 . A A . 82 TYR HE1 1 1 4 4169 1 1 47 TYR HE2 H 1.822 -5.037 3.748 1.00 . A A . 82 TYR HE2 1 1 4 4170 1 1 47 TYR HH H 1.782 -2.094 5.497 1.00 . A A . 82 TYR HH 1 1 4 4171 1 1 47 TYR N N 7.029 -5.156 1.626 1.00 . A A . 82 TYR N 1 1 4 4172 1 1 47 TYR O O 7.870 -3.156 3.171 1.00 . A A . 82 TYR O 1 1 4 4173 1 1 47 TYR OH O 1.966 -3.055 5.501 1.00 . A A . 82 TYR OH 1 1 4 4174 1 1 48 ALA C C 6.948 0.559 2.129 1.00 . A A . 83 ALA C 1 1 4 4175 1 1 48 ALA CA C 7.950 -0.537 2.376 1.00 . A A . 83 ALA CA 1 1 4 4176 1 1 48 ALA CB C 9.336 -0.090 1.977 1.00 . A A . 83 ALA CB 1 1 4 4177 1 1 48 ALA H H 7.335 -1.457 0.639 1.00 . A A . 83 ALA H 1 1 4 4178 1 1 48 ALA HA H 7.945 -0.829 3.415 1.00 . A A . 83 ALA HA 1 1 4 4179 1 1 48 ALA HB1 H 9.340 0.194 0.935 1.00 . A A . 83 ALA HB1 1 1 4 4180 1 1 48 ALA HB2 H 10.030 -0.904 2.127 1.00 . A A . 83 ALA HB2 1 1 4 4181 1 1 48 ALA HB3 H 9.626 0.754 2.584 1.00 . A A . 83 ALA HB3 1 1 4 4182 1 1 48 ALA N N 7.549 -1.638 1.582 1.00 . A A . 83 ALA N 1 1 4 4183 1 1 48 ALA O O 6.793 1.018 1.015 1.00 . A A . 83 ALA O 1 1 4 4184 1 1 49 ALA C C 5.651 3.255 3.572 1.00 . A A . 84 ALA C 1 1 4 4185 1 1 49 ALA CA C 5.271 1.982 2.898 1.00 . A A . 84 ALA CA 1 1 4 4186 1 1 49 ALA CB C 3.899 1.512 3.345 1.00 . A A . 84 ALA CB 1 1 4 4187 1 1 49 ALA H H 6.392 0.614 4.025 1.00 . A A . 84 ALA H 1 1 4 4188 1 1 49 ALA HA H 5.228 2.155 1.832 1.00 . A A . 84 ALA HA 1 1 4 4189 1 1 49 ALA HB1 H 3.663 0.585 2.844 1.00 . A A . 84 ALA HB1 1 1 4 4190 1 1 49 ALA HB2 H 3.167 2.257 3.071 1.00 . A A . 84 ALA HB2 1 1 4 4191 1 1 49 ALA HB3 H 3.890 1.362 4.414 1.00 . A A . 84 ALA HB3 1 1 4 4192 1 1 49 ALA N N 6.259 0.975 3.122 1.00 . A A . 84 ALA N 1 1 4 4193 1 1 49 ALA O O 6.140 3.244 4.710 1.00 . A A . 84 ALA O 1 1 4 4194 1 1 50 LEU C C 4.396 6.339 3.308 1.00 . A A . 85 LEU C 1 1 4 4195 1 1 50 LEU CA C 5.695 5.623 3.418 1.00 . A A . 85 LEU CA 1 1 4 4196 1 1 50 LEU CB C 6.744 6.401 2.611 1.00 . A A . 85 LEU CB 1 1 4 4197 1 1 50 LEU CD1 C 8.003 7.651 4.366 1.00 . A A . 85 LEU CD1 1 1 4 4198 1 1 50 LEU CD2 C 7.744 8.680 2.146 1.00 . A A . 85 LEU CD2 1 1 4 4199 1 1 50 LEU CG C 7.115 7.774 3.170 1.00 . A A . 85 LEU CG 1 1 4 4200 1 1 50 LEU H H 5.148 4.301 1.949 1.00 . A A . 85 LEU H 1 1 4 4201 1 1 50 LEU HA H 6.010 5.541 4.445 1.00 . A A . 85 LEU HA 1 1 4 4202 1 1 50 LEU HB2 H 7.639 5.809 2.634 1.00 . A A . 85 LEU HB2 1 1 4 4203 1 1 50 LEU HB3 H 6.412 6.513 1.593 1.00 . A A . 85 LEU HB3 1 1 4 4204 1 1 50 LEU HD11 H 7.530 7.037 5.116 1.00 . A A . 85 LEU HD11 1 1 4 4205 1 1 50 LEU HD12 H 8.143 8.653 4.743 1.00 . A A . 85 LEU HD12 1 1 4 4206 1 1 50 LEU HD13 H 8.940 7.219 4.042 1.00 . A A . 85 LEU HD13 1 1 4 4207 1 1 50 LEU HD21 H 7.962 9.619 2.636 1.00 . A A . 85 LEU HD21 1 1 4 4208 1 1 50 LEU HD22 H 7.057 8.838 1.330 1.00 . A A . 85 LEU HD22 1 1 4 4209 1 1 50 LEU HD23 H 8.661 8.240 1.783 1.00 . A A . 85 LEU HD23 1 1 4 4210 1 1 50 LEU HG H 6.196 8.230 3.502 1.00 . A A . 85 LEU HG 1 1 4 4211 1 1 50 LEU N N 5.476 4.332 2.879 1.00 . A A . 85 LEU N 1 1 4 4212 1 1 50 LEU O O 3.555 5.966 2.485 1.00 . A A . 85 LEU O 1 1 4 4213 1 1 51 HIS C C 2.926 8.718 2.634 1.00 . A A . 86 HIS C 1 1 4 4214 1 1 51 HIS CA C 3.046 8.173 4.063 1.00 . A A . 86 HIS CA 1 1 4 4215 1 1 51 HIS CB C 3.163 9.329 5.105 1.00 . A A . 86 HIS CB 1 1 4 4216 1 1 51 HIS CD2 C 5.321 10.627 4.323 1.00 . A A . 86 HIS CD2 1 1 4 4217 1 1 51 HIS CE1 C 6.433 10.556 6.175 1.00 . A A . 86 HIS CE1 1 1 4 4218 1 1 51 HIS CG C 4.547 9.972 5.223 1.00 . A A . 86 HIS CG 1 1 4 4219 1 1 51 HIS H H 4.844 7.413 4.886 1.00 . A A . 86 HIS H 1 1 4 4220 1 1 51 HIS HA H 2.169 7.585 4.289 1.00 . A A . 86 HIS HA 1 1 4 4221 1 1 51 HIS HB2 H 2.467 10.112 4.845 1.00 . A A . 86 HIS HB2 1 1 4 4222 1 1 51 HIS HB3 H 2.901 8.937 6.076 1.00 . A A . 86 HIS HB3 1 1 4 4223 1 1 51 HIS HD1 H 5.006 9.561 7.237 1.00 . A A . 86 HIS HD1 1 1 4 4224 1 1 51 HIS HD2 H 5.104 10.789 3.279 1.00 . A A . 86 HIS HD2 1 1 4 4225 1 1 51 HIS HE1 H 7.241 10.661 6.880 1.00 . A A . 86 HIS HE1 1 1 4 4226 1 1 51 HIS HE2 H 7.008 11.754 4.667 1.00 . A A . 86 HIS HE2 1 1 4 4227 1 1 51 HIS N N 4.196 7.308 4.157 1.00 . A A . 86 HIS N 1 1 4 4228 1 1 51 HIS ND1 N 5.284 9.951 6.379 1.00 . A A . 86 HIS ND1 1 1 4 4229 1 1 51 HIS NE2 N 6.473 10.975 4.944 1.00 . A A . 86 HIS NE2 1 1 4 4230 1 1 51 HIS O O 3.826 9.389 2.132 1.00 . A A . 86 HIS O 1 1 4 4231 1 1 52 GLY C C 2.007 7.872 -0.453 1.00 . A A . 87 GLY C 1 1 4 4232 1 1 52 GLY CA C 1.628 8.860 0.651 1.00 . A A . 87 GLY CA 1 1 4 4233 1 1 52 GLY H H 1.189 7.801 2.411 1.00 . A A . 87 GLY H 1 1 4 4234 1 1 52 GLY HA2 H 0.580 9.095 0.542 1.00 . A A . 87 GLY HA2 1 1 4 4235 1 1 52 GLY HA3 H 2.202 9.765 0.516 1.00 . A A . 87 GLY HA3 1 1 4 4236 1 1 52 GLY N N 1.847 8.389 1.985 1.00 . A A . 87 GLY N 1 1 4 4237 1 1 52 GLY O O 1.266 7.747 -1.430 1.00 . A A . 87 GLY O 1 1 4 4238 1 1 53 GLU C C 4.127 4.961 -0.908 1.00 . A A . 88 GLU C 1 1 4 4239 1 1 53 GLU CA C 3.600 6.288 -1.416 1.00 . A A . 88 GLU CA 1 1 4 4240 1 1 53 GLU CB C 4.657 6.964 -2.311 1.00 . A A . 88 GLU CB 1 1 4 4241 1 1 53 GLU CD C 5.159 8.983 -3.758 1.00 . A A . 88 GLU CD 1 1 4 4242 1 1 53 GLU CG C 4.184 8.297 -2.856 1.00 . A A . 88 GLU CG 1 1 4 4243 1 1 53 GLU H H 3.651 7.176 0.515 1.00 . A A . 88 GLU H 1 1 4 4244 1 1 53 GLU HA H 2.722 6.109 -2.019 1.00 . A A . 88 GLU HA 1 1 4 4245 1 1 53 GLU HB2 H 5.608 7.054 -1.807 1.00 . A A . 88 GLU HB2 1 1 4 4246 1 1 53 GLU HB3 H 4.799 6.316 -3.165 1.00 . A A . 88 GLU HB3 1 1 4 4247 1 1 53 GLU HG2 H 3.281 8.115 -3.420 1.00 . A A . 88 GLU HG2 1 1 4 4248 1 1 53 GLU HG3 H 3.947 8.926 -2.013 1.00 . A A . 88 GLU HG3 1 1 4 4249 1 1 53 GLU N N 3.142 7.168 -0.325 1.00 . A A . 88 GLU N 1 1 4 4250 1 1 53 GLU O O 4.780 4.888 0.133 1.00 . A A . 88 GLU O 1 1 4 4251 1 1 53 GLU OE1 O 6.072 9.675 -3.268 1.00 . A A . 88 GLU OE1 1 1 4 4252 1 1 53 GLU OE2 O 5.000 8.897 -4.978 1.00 . A A . 88 GLU OE2 1 1 4 4253 1 1 54 PHE C C 5.440 2.314 -2.191 1.00 . A A . 89 PHE C 1 1 4 4254 1 1 54 PHE CA C 4.249 2.594 -1.325 1.00 . A A . 89 PHE CA 1 1 4 4255 1 1 54 PHE CB C 3.074 1.629 -1.595 1.00 . A A . 89 PHE CB 1 1 4 4256 1 1 54 PHE CD1 C 1.049 3.097 -1.364 1.00 . A A . 89 PHE CD1 1 1 4 4257 1 1 54 PHE CD2 C 1.547 1.592 0.426 1.00 . A A . 89 PHE CD2 1 1 4 4258 1 1 54 PHE CE1 C -0.011 3.593 -0.668 1.00 . A A . 89 PHE CE1 1 1 4 4259 1 1 54 PHE CE2 C 0.491 2.105 1.127 1.00 . A A . 89 PHE CE2 1 1 4 4260 1 1 54 PHE CG C 1.850 2.084 -0.836 1.00 . A A . 89 PHE CG 1 1 4 4261 1 1 54 PHE CZ C -0.288 3.112 0.569 1.00 . A A . 89 PHE CZ 1 1 4 4262 1 1 54 PHE H H 3.354 4.029 -2.491 1.00 . A A . 89 PHE H 1 1 4 4263 1 1 54 PHE HA H 4.533 2.559 -0.283 1.00 . A A . 89 PHE HA 1 1 4 4264 1 1 54 PHE HB2 H 2.839 1.638 -2.650 1.00 . A A . 89 PHE HB2 1 1 4 4265 1 1 54 PHE HB3 H 3.335 0.627 -1.304 1.00 . A A . 89 PHE HB3 1 1 4 4266 1 1 54 PHE HD1 H 1.269 3.479 -2.349 1.00 . A A . 89 PHE HD1 1 1 4 4267 1 1 54 PHE HD2 H 2.124 0.805 0.885 1.00 . A A . 89 PHE HD2 1 1 4 4268 1 1 54 PHE HE1 H -0.629 4.377 -1.083 1.00 . A A . 89 PHE HE1 1 1 4 4269 1 1 54 PHE HE2 H 0.259 1.705 2.106 1.00 . A A . 89 PHE HE2 1 1 4 4270 1 1 54 PHE HZ H -1.119 3.541 1.104 1.00 . A A . 89 PHE HZ 1 1 4 4271 1 1 54 PHE N N 3.848 3.925 -1.655 1.00 . A A . 89 PHE N 1 1 4 4272 1 1 54 PHE O O 5.434 2.617 -3.398 1.00 . A A . 89 PHE O 1 1 4 4273 1 1 55 TYR C C 8.273 0.344 -2.033 1.00 . A A . 90 TYR C 1 1 4 4274 1 1 55 TYR CA C 7.706 1.728 -2.278 1.00 . A A . 90 TYR CA 1 1 4 4275 1 1 55 TYR CB C 8.581 2.797 -1.621 1.00 . A A . 90 TYR CB 1 1 4 4276 1 1 55 TYR CD1 C 8.041 4.848 -2.980 1.00 . A A . 90 TYR CD1 1 1 4 4277 1 1 55 TYR CD2 C 10.319 4.164 -2.824 1.00 . A A . 90 TYR CD2 1 1 4 4278 1 1 55 TYR CE1 C 8.404 5.913 -3.761 1.00 . A A . 90 TYR CE1 1 1 4 4279 1 1 55 TYR CE2 C 10.682 5.234 -3.604 1.00 . A A . 90 TYR CE2 1 1 4 4280 1 1 55 TYR CG C 8.997 3.943 -2.497 1.00 . A A . 90 TYR CG 1 1 4 4281 1 1 55 TYR CZ C 9.724 6.106 -4.068 1.00 . A A . 90 TYR CZ 1 1 4 4282 1 1 55 TYR H H 6.411 1.452 -0.694 1.00 . A A . 90 TYR H 1 1 4 4283 1 1 55 TYR HA H 7.606 1.949 -3.330 1.00 . A A . 90 TYR HA 1 1 4 4284 1 1 55 TYR HB2 H 7.843 3.326 -1.031 1.00 . A A . 90 TYR HB2 1 1 4 4285 1 1 55 TYR HB3 H 9.376 2.436 -0.989 1.00 . A A . 90 TYR HB3 1 1 4 4286 1 1 55 TYR HD1 H 6.994 4.725 -2.742 1.00 . A A . 90 TYR HD1 1 1 4 4287 1 1 55 TYR HD2 H 11.084 3.488 -2.472 1.00 . A A . 90 TYR HD2 1 1 4 4288 1 1 55 TYR HE1 H 7.647 6.594 -4.119 1.00 . A A . 90 TYR HE1 1 1 4 4289 1 1 55 TYR HE2 H 11.725 5.394 -3.839 1.00 . A A . 90 TYR HE2 1 1 4 4290 1 1 55 TYR HH H 9.625 7.951 -4.529 1.00 . A A . 90 TYR HH 1 1 4 4291 1 1 55 TYR N N 6.460 1.808 -1.614 1.00 . A A . 90 TYR N 1 1 4 4292 1 1 55 TYR O O 7.899 -0.323 -1.068 1.00 . A A . 90 TYR O 1 1 4 4293 1 1 55 TYR OH O 10.092 7.169 -4.849 1.00 . A A . 90 TYR OH 1 1 4 4294 1 1 56 CYS C C 10.877 -1.192 -1.769 1.00 . A A . 91 CYS C 1 1 4 4295 1 1 56 CYS CA C 9.713 -1.411 -2.674 1.00 . A A . 91 CYS CA 1 1 4 4296 1 1 56 CYS CB C 10.181 -2.094 -3.964 1.00 . A A . 91 CYS CB 1 1 4 4297 1 1 56 CYS H H 9.331 0.386 -3.714 1.00 . A A . 91 CYS H 1 1 4 4298 1 1 56 CYS HA H 8.972 -2.026 -2.181 1.00 . A A . 91 CYS HA 1 1 4 4299 1 1 56 CYS HB2 H 10.563 -3.071 -3.710 1.00 . A A . 91 CYS HB2 1 1 4 4300 1 1 56 CYS HB3 H 9.360 -2.234 -4.644 1.00 . A A . 91 CYS HB3 1 1 4 4301 1 1 56 CYS N N 9.109 -0.132 -2.915 1.00 . A A . 91 CYS N 1 1 4 4302 1 1 56 CYS O O 11.420 -0.082 -1.776 1.00 . A A . 91 CYS O 1 1 4 4303 1 1 56 CYS SG S 11.479 -1.211 -4.840 1.00 . A A . 91 CYS SG 1 1 4 4304 1 1 57 LYS C C 13.679 -1.481 -0.812 1.00 . A A . 92 LYS C 1 1 4 4305 1 1 57 LYS CA C 12.389 -2.021 -0.112 1.00 . A A . 92 LYS CA 1 1 4 4306 1 1 57 LYS CB C 12.631 -3.310 0.680 1.00 . A A . 92 LYS CB 1 1 4 4307 1 1 57 LYS CD C 11.716 -4.947 2.354 1.00 . A A . 92 LYS CD 1 1 4 4308 1 1 57 LYS CE C 10.517 -5.320 3.222 1.00 . A A . 92 LYS CE 1 1 4 4309 1 1 57 LYS CG C 11.470 -3.660 1.598 1.00 . A A . 92 LYS CG 1 1 4 4310 1 1 57 LYS H H 10.785 -3.030 -1.036 1.00 . A A . 92 LYS H 1 1 4 4311 1 1 57 LYS HA H 12.087 -1.250 0.583 1.00 . A A . 92 LYS HA 1 1 4 4312 1 1 57 LYS HB2 H 12.756 -4.123 -0.020 1.00 . A A . 92 LYS HB2 1 1 4 4313 1 1 57 LYS HB3 H 13.528 -3.220 1.271 1.00 . A A . 92 LYS HB3 1 1 4 4314 1 1 57 LYS HD2 H 11.900 -5.741 1.645 1.00 . A A . 92 LYS HD2 1 1 4 4315 1 1 57 LYS HD3 H 12.584 -4.822 2.984 1.00 . A A . 92 LYS HD3 1 1 4 4316 1 1 57 LYS HE2 H 9.664 -5.492 2.583 1.00 . A A . 92 LYS HE2 1 1 4 4317 1 1 57 LYS HE3 H 10.751 -6.231 3.754 1.00 . A A . 92 LYS HE3 1 1 4 4318 1 1 57 LYS HG2 H 11.352 -2.860 2.314 1.00 . A A . 92 LYS HG2 1 1 4 4319 1 1 57 LYS HG3 H 10.566 -3.752 1.016 1.00 . A A . 92 LYS HG3 1 1 4 4320 1 1 57 LYS HZ1 H 10.932 -4.043 4.883 1.00 . A A . 92 LYS HZ1 1 1 4 4321 1 1 57 LYS HZ2 H 9.330 -4.530 4.761 1.00 . A A . 92 LYS HZ2 1 1 4 4322 1 1 57 LYS HZ3 H 9.905 -3.374 3.734 1.00 . A A . 92 LYS HZ3 1 1 4 4323 1 1 57 LYS N N 11.270 -2.175 -1.019 1.00 . A A . 92 LYS N 1 1 4 4324 1 1 57 LYS NZ N 10.167 -4.263 4.206 1.00 . A A . 92 LYS NZ 1 1 4 4325 1 1 57 LYS O O 14.249 -0.499 -0.316 1.00 . A A . 92 LYS O 1 1 4 4326 1 1 58 PRO C C 15.175 -0.013 -3.078 1.00 . A A . 93 PRO C 1 1 4 4327 1 1 58 PRO CA C 15.303 -1.506 -2.709 1.00 . A A . 93 PRO CA 1 1 4 4328 1 1 58 PRO CB C 15.374 -2.358 -3.975 1.00 . A A . 93 PRO CB 1 1 4 4329 1 1 58 PRO CD C 13.560 -3.215 -2.714 1.00 . A A . 93 PRO CD 1 1 4 4330 1 1 58 PRO CG C 14.680 -3.619 -3.611 1.00 . A A . 93 PRO CG 1 1 4 4331 1 1 58 PRO HA H 16.198 -1.648 -2.120 1.00 . A A . 93 PRO HA 1 1 4 4332 1 1 58 PRO HB2 H 14.871 -1.840 -4.779 1.00 . A A . 93 PRO HB2 1 1 4 4333 1 1 58 PRO HB3 H 16.409 -2.526 -4.232 1.00 . A A . 93 PRO HB3 1 1 4 4334 1 1 58 PRO HD2 H 12.695 -2.958 -3.309 1.00 . A A . 93 PRO HD2 1 1 4 4335 1 1 58 PRO HD3 H 13.320 -4.012 -2.027 1.00 . A A . 93 PRO HD3 1 1 4 4336 1 1 58 PRO HG2 H 14.310 -4.121 -4.490 1.00 . A A . 93 PRO HG2 1 1 4 4337 1 1 58 PRO HG3 H 15.346 -4.272 -3.073 1.00 . A A . 93 PRO HG3 1 1 4 4338 1 1 58 PRO N N 14.119 -2.033 -2.000 1.00 . A A . 93 PRO N 1 1 4 4339 1 1 58 PRO O O 16.078 0.780 -2.800 1.00 . A A . 93 PRO O 1 1 4 4340 1 1 59 HIS C C 13.698 2.661 -2.827 1.00 . A A . 94 HIS C 1 1 4 4341 1 1 59 HIS CA C 13.839 1.784 -4.040 1.00 . A A . 94 HIS CA 1 1 4 4342 1 1 59 HIS CB C 12.654 2.011 -5.008 1.00 . A A . 94 HIS CB 1 1 4 4343 1 1 59 HIS CD2 C 14.116 1.812 -7.104 1.00 . A A . 94 HIS CD2 1 1 4 4344 1 1 59 HIS CE1 C 12.591 1.047 -8.468 1.00 . A A . 94 HIS CE1 1 1 4 4345 1 1 59 HIS CG C 12.951 1.687 -6.440 1.00 . A A . 94 HIS CG 1 1 4 4346 1 1 59 HIS H H 13.356 -0.298 -3.854 1.00 . A A . 94 HIS H 1 1 4 4347 1 1 59 HIS HA H 14.748 2.090 -4.537 1.00 . A A . 94 HIS HA 1 1 4 4348 1 1 59 HIS HB2 H 11.822 1.395 -4.702 1.00 . A A . 94 HIS HB2 1 1 4 4349 1 1 59 HIS HB3 H 12.363 3.047 -4.954 1.00 . A A . 94 HIS HB3 1 1 4 4350 1 1 59 HIS HD2 H 15.038 2.182 -6.680 1.00 . A A . 94 HIS HD2 1 1 4 4351 1 1 59 HIS HE1 H 12.118 0.663 -9.362 1.00 . A A . 94 HIS HE1 1 1 4 4352 1 1 59 HIS HE2 H 14.446 1.641 -9.172 1.00 . A A . 94 HIS HE2 1 1 4 4353 1 1 59 HIS N N 14.048 0.376 -3.673 1.00 . A A . 94 HIS N 1 1 4 4354 1 1 59 HIS ND1 N 11.983 1.212 -7.301 1.00 . A A . 94 HIS ND1 1 1 4 4355 1 1 59 HIS NE2 N 13.888 1.404 -8.395 1.00 . A A . 94 HIS NE2 1 1 4 4356 1 1 59 HIS O O 14.125 3.805 -2.830 1.00 . A A . 94 HIS O 1 1 4 4357 1 1 60 PHE C C 14.238 3.181 0.063 1.00 . A A . 95 PHE C 1 1 4 4358 1 1 60 PHE CA C 12.896 2.835 -0.553 1.00 . A A . 95 PHE CA 1 1 4 4359 1 1 60 PHE CB C 12.077 1.971 0.393 1.00 . A A . 95 PHE CB 1 1 4 4360 1 1 60 PHE CD1 C 10.539 3.691 1.298 1.00 . A A . 95 PHE CD1 1 1 4 4361 1 1 60 PHE CD2 C 11.760 2.381 2.843 1.00 . A A . 95 PHE CD2 1 1 4 4362 1 1 60 PHE CE1 C 9.941 4.359 2.325 1.00 . A A . 95 PHE CE1 1 1 4 4363 1 1 60 PHE CE2 C 11.154 3.047 3.883 1.00 . A A . 95 PHE CE2 1 1 4 4364 1 1 60 PHE CG C 11.455 2.699 1.537 1.00 . A A . 95 PHE CG 1 1 4 4365 1 1 60 PHE CZ C 10.242 4.040 3.623 1.00 . A A . 95 PHE CZ 1 1 4 4366 1 1 60 PHE H H 12.818 1.183 -1.850 1.00 . A A . 95 PHE H 1 1 4 4367 1 1 60 PHE HA H 12.353 3.744 -0.768 1.00 . A A . 95 PHE HA 1 1 4 4368 1 1 60 PHE HB2 H 11.286 1.494 -0.166 1.00 . A A . 95 PHE HB2 1 1 4 4369 1 1 60 PHE HB3 H 12.727 1.209 0.794 1.00 . A A . 95 PHE HB3 1 1 4 4370 1 1 60 PHE HD1 H 10.295 3.948 0.279 1.00 . A A . 95 PHE HD1 1 1 4 4371 1 1 60 PHE HD2 H 12.479 1.603 3.051 1.00 . A A . 95 PHE HD2 1 1 4 4372 1 1 60 PHE HE1 H 9.232 5.136 2.095 1.00 . A A . 95 PHE HE1 1 1 4 4373 1 1 60 PHE HE2 H 11.396 2.793 4.904 1.00 . A A . 95 PHE HE2 1 1 4 4374 1 1 60 PHE HZ H 9.763 4.566 4.436 1.00 . A A . 95 PHE HZ 1 1 4 4375 1 1 60 PHE N N 13.116 2.118 -1.787 1.00 . A A . 95 PHE N 1 1 4 4376 1 1 60 PHE O O 14.413 4.259 0.631 1.00 . A A . 95 PHE O 1 1 4 4377 1 1 61 GLN C C 17.225 3.577 -0.370 1.00 . A A . 96 GLN C 1 1 4 4378 1 1 61 GLN CA C 16.539 2.471 0.397 1.00 . A A . 96 GLN CA 1 1 4 4379 1 1 61 GLN CB C 17.348 1.198 0.245 1.00 . A A . 96 GLN CB 1 1 4 4380 1 1 61 GLN CD C 17.648 -1.193 0.928 1.00 . A A . 96 GLN CD 1 1 4 4381 1 1 61 GLN CG C 16.933 0.113 1.181 1.00 . A A . 96 GLN CG 1 1 4 4382 1 1 61 GLN H H 14.949 1.399 -0.471 1.00 . A A . 96 GLN H 1 1 4 4383 1 1 61 GLN HA H 16.507 2.726 1.446 1.00 . A A . 96 GLN HA 1 1 4 4384 1 1 61 GLN HB2 H 17.226 0.833 -0.764 1.00 . A A . 96 GLN HB2 1 1 4 4385 1 1 61 GLN HB3 H 18.391 1.418 0.409 1.00 . A A . 96 GLN HB3 1 1 4 4386 1 1 61 GLN HE21 H 19.124 -0.651 2.117 1.00 . A A . 96 GLN HE21 1 1 4 4387 1 1 61 GLN HE22 H 19.271 -2.212 1.398 1.00 . A A . 96 GLN HE22 1 1 4 4388 1 1 61 GLN HG2 H 17.146 0.442 2.188 1.00 . A A . 96 GLN HG2 1 1 4 4389 1 1 61 GLN HG3 H 15.866 -0.028 1.065 1.00 . A A . 96 GLN HG3 1 1 4 4390 1 1 61 GLN N N 15.181 2.263 -0.062 1.00 . A A . 96 GLN N 1 1 4 4391 1 1 61 GLN NE2 N 18.791 -1.369 1.538 1.00 . A A . 96 GLN NE2 1 1 4 4392 1 1 61 GLN O O 17.791 4.475 0.223 1.00 . A A . 96 GLN O 1 1 4 4393 1 1 61 GLN OE1 O 17.178 -2.035 0.161 1.00 . A A . 96 GLN OE1 1 1 4 4394 1 1 62 GLN C C 17.211 5.853 -2.515 1.00 . A A . 97 GLN C 1 1 4 4395 1 1 62 GLN CA C 17.846 4.465 -2.503 1.00 . A A . 97 GLN CA 1 1 4 4396 1 1 62 GLN CB C 17.901 3.913 -3.908 1.00 . A A . 97 GLN CB 1 1 4 4397 1 1 62 GLN CD C 18.787 2.130 -5.442 1.00 . A A . 97 GLN CD 1 1 4 4398 1 1 62 GLN CG C 18.687 2.629 -4.024 1.00 . A A . 97 GLN CG 1 1 4 4399 1 1 62 GLN H H 16.635 2.826 -2.133 1.00 . A A . 97 GLN H 1 1 4 4400 1 1 62 GLN HA H 18.859 4.534 -2.145 1.00 . A A . 97 GLN HA 1 1 4 4401 1 1 62 GLN HB2 H 16.889 3.712 -4.236 1.00 . A A . 97 GLN HB2 1 1 4 4402 1 1 62 GLN HB3 H 18.343 4.651 -4.551 1.00 . A A . 97 GLN HB3 1 1 4 4403 1 1 62 GLN HE21 H 20.523 1.311 -5.027 1.00 . A A . 97 GLN HE21 1 1 4 4404 1 1 62 GLN HE22 H 19.962 1.088 -6.643 1.00 . A A . 97 GLN HE22 1 1 4 4405 1 1 62 GLN HG2 H 19.687 2.804 -3.655 1.00 . A A . 97 GLN HG2 1 1 4 4406 1 1 62 GLN HG3 H 18.208 1.873 -3.422 1.00 . A A . 97 GLN HG3 1 1 4 4407 1 1 62 GLN N N 17.146 3.527 -1.675 1.00 . A A . 97 GLN N 1 1 4 4408 1 1 62 GLN NE2 N 19.858 1.450 -5.736 1.00 . A A . 97 GLN NE2 1 1 4 4409 1 1 62 GLN O O 17.882 6.862 -2.276 1.00 . A A . 97 GLN O 1 1 4 4410 1 1 62 GLN OE1 O 17.896 2.362 -6.273 1.00 . A A . 97 GLN OE1 1 1 4 4411 1 1 63 LEU C C 14.860 7.800 -1.611 1.00 . A A . 98 LEU C 1 1 4 4412 1 1 63 LEU CA C 15.229 7.135 -2.936 1.00 . A A . 98 LEU CA 1 1 4 4413 1 1 63 LEU CB C 14.005 6.870 -3.781 1.00 . A A . 98 LEU CB 1 1 4 4414 1 1 63 LEU CD1 C 13.124 5.784 -5.831 1.00 . A A . 98 LEU CD1 1 1 4 4415 1 1 63 LEU CD2 C 14.690 7.633 -6.062 1.00 . A A . 98 LEU CD2 1 1 4 4416 1 1 63 LEU CG C 14.309 6.442 -5.224 1.00 . A A . 98 LEU CG 1 1 4 4417 1 1 63 LEU H H 15.437 5.055 -2.884 1.00 . A A . 98 LEU H 1 1 4 4418 1 1 63 LEU HA H 15.865 7.798 -3.502 1.00 . A A . 98 LEU HA 1 1 4 4419 1 1 63 LEU HB2 H 13.464 6.075 -3.289 1.00 . A A . 98 LEU HB2 1 1 4 4420 1 1 63 LEU HB3 H 13.381 7.751 -3.799 1.00 . A A . 98 LEU HB3 1 1 4 4421 1 1 63 LEU HD11 H 13.332 5.550 -6.865 1.00 . A A . 98 LEU HD11 1 1 4 4422 1 1 63 LEU HD12 H 12.273 6.445 -5.753 1.00 . A A . 98 LEU HD12 1 1 4 4423 1 1 63 LEU HD13 H 12.940 4.871 -5.288 1.00 . A A . 98 LEU HD13 1 1 4 4424 1 1 63 LEU HD21 H 14.805 7.319 -7.089 1.00 . A A . 98 LEU HD21 1 1 4 4425 1 1 63 LEU HD22 H 15.611 8.061 -5.694 1.00 . A A . 98 LEU HD22 1 1 4 4426 1 1 63 LEU HD23 H 13.890 8.356 -5.993 1.00 . A A . 98 LEU HD23 1 1 4 4427 1 1 63 LEU HG H 15.135 5.747 -5.233 1.00 . A A . 98 LEU HG 1 1 4 4428 1 1 63 LEU N N 15.939 5.895 -2.782 1.00 . A A . 98 LEU N 1 1 4 4429 1 1 63 LEU O O 15.094 8.997 -1.422 1.00 . A A . 98 LEU O 1 1 4 4430 1 1 64 PHE C C 14.910 7.486 1.719 1.00 . A A . 99 PHE C 1 1 4 4431 1 1 64 PHE CA C 13.913 7.643 0.585 1.00 . A A . 99 PHE CA 1 1 4 4432 1 1 64 PHE CB C 12.519 7.171 0.999 1.00 . A A . 99 PHE CB 1 1 4 4433 1 1 64 PHE CD1 C 11.468 8.953 -0.467 1.00 . A A . 99 PHE CD1 1 1 4 4434 1 1 64 PHE CD2 C 10.206 7.004 0.058 1.00 . A A . 99 PHE CD2 1 1 4 4435 1 1 64 PHE CE1 C 10.416 9.431 -1.213 1.00 . A A . 99 PHE CE1 1 1 4 4436 1 1 64 PHE CE2 C 9.155 7.485 -0.686 1.00 . A A . 99 PHE CE2 1 1 4 4437 1 1 64 PHE CG C 11.378 7.724 0.182 1.00 . A A . 99 PHE CG 1 1 4 4438 1 1 64 PHE CZ C 9.266 8.699 -1.324 1.00 . A A . 99 PHE CZ 1 1 4 4439 1 1 64 PHE H H 14.234 6.068 -0.797 1.00 . A A . 99 PHE H 1 1 4 4440 1 1 64 PHE HA H 13.862 8.701 0.390 1.00 . A A . 99 PHE HA 1 1 4 4441 1 1 64 PHE HB2 H 12.490 6.122 0.746 1.00 . A A . 99 PHE HB2 1 1 4 4442 1 1 64 PHE HB3 H 12.340 7.301 2.052 1.00 . A A . 99 PHE HB3 1 1 4 4443 1 1 64 PHE HD1 H 12.366 9.548 -0.398 1.00 . A A . 99 PHE HD1 1 1 4 4444 1 1 64 PHE HD2 H 10.108 6.055 0.564 1.00 . A A . 99 PHE HD2 1 1 4 4445 1 1 64 PHE HE1 H 10.477 10.382 -1.718 1.00 . A A . 99 PHE HE1 1 1 4 4446 1 1 64 PHE HE2 H 8.248 6.906 -0.770 1.00 . A A . 99 PHE HE2 1 1 4 4447 1 1 64 PHE HZ H 8.453 9.091 -1.915 1.00 . A A . 99 PHE HZ 1 1 4 4448 1 1 64 PHE N N 14.356 7.031 -0.657 1.00 . A A . 99 PHE N 1 1 4 4449 1 1 64 PHE O O 14.905 8.250 2.671 1.00 . A A . 99 PHE O 1 1 4 4450 1 1 65 LYS C C 16.392 5.933 3.917 1.00 . A A . 100 LYS C 1 1 4 4451 1 1 65 LYS CA C 16.880 6.197 2.499 1.00 . A A . 100 LYS CA 1 1 4 4452 1 1 65 LYS CB C 17.878 7.350 2.461 1.00 . A A . 100 LYS CB 1 1 4 4453 1 1 65 LYS CD C 19.266 8.894 1.011 1.00 . A A . 100 LYS CD 1 1 4 4454 1 1 65 LYS CE C 18.414 10.127 1.302 1.00 . A A . 100 LYS CE 1 1 4 4455 1 1 65 LYS CG C 18.446 7.616 1.068 1.00 . A A . 100 LYS CG 1 1 4 4456 1 1 65 LYS H H 15.677 5.860 0.822 1.00 . A A . 100 LYS H 1 1 4 4457 1 1 65 LYS HA H 17.377 5.308 2.141 1.00 . A A . 100 LYS HA 1 1 4 4458 1 1 65 LYS HB2 H 17.387 8.240 2.823 1.00 . A A . 100 LYS HB2 1 1 4 4459 1 1 65 LYS HB3 H 18.692 7.093 3.119 1.00 . A A . 100 LYS HB3 1 1 4 4460 1 1 65 LYS HD2 H 20.059 8.838 1.743 1.00 . A A . 100 LYS HD2 1 1 4 4461 1 1 65 LYS HD3 H 19.694 8.989 0.024 1.00 . A A . 100 LYS HD3 1 1 4 4462 1 1 65 LYS HE2 H 18.025 10.067 2.307 1.00 . A A . 100 LYS HE2 1 1 4 4463 1 1 65 LYS HE3 H 19.044 10.999 1.222 1.00 . A A . 100 LYS HE3 1 1 4 4464 1 1 65 LYS HG2 H 19.079 6.790 0.783 1.00 . A A . 100 LYS HG2 1 1 4 4465 1 1 65 LYS HG3 H 17.627 7.694 0.367 1.00 . A A . 100 LYS HG3 1 1 4 4466 1 1 65 LYS HZ1 H 17.618 10.338 -0.631 1.00 . A A . 100 LYS HZ1 1 1 4 4467 1 1 65 LYS HZ2 H 16.751 11.140 0.562 1.00 . A A . 100 LYS HZ2 1 1 4 4468 1 1 65 LYS HZ3 H 16.609 9.486 0.420 1.00 . A A . 100 LYS HZ3 1 1 4 4469 1 1 65 LYS N N 15.779 6.472 1.580 1.00 . A A . 100 LYS N 1 1 4 4470 1 1 65 LYS NZ N 17.284 10.270 0.350 1.00 . A A . 100 LYS NZ 1 1 4 4471 1 1 65 LYS O O 17.048 6.311 4.892 1.00 . A A . 100 LYS O 1 1 4 4472 1 1 66 SER C C 14.883 3.550 5.771 1.00 . A A . 101 SER C 1 1 4 4473 1 1 66 SER CA C 14.674 5.008 5.313 1.00 . A A . 101 SER CA 1 1 4 4474 1 1 66 SER CB C 13.192 5.438 5.343 1.00 . A A . 101 SER CB 1 1 4 4475 1 1 66 SER H H 14.828 4.957 3.205 1.00 . A A . 101 SER H 1 1 4 4476 1 1 66 SER HA H 15.216 5.627 6.012 1.00 . A A . 101 SER HA 1 1 4 4477 1 1 66 SER HB2 H 13.125 6.503 5.176 1.00 . A A . 101 SER HB2 1 1 4 4478 1 1 66 SER HB3 H 12.659 4.924 4.557 1.00 . A A . 101 SER HB3 1 1 4 4479 1 1 66 SER HG H 11.914 5.811 6.767 1.00 . A A . 101 SER HG 1 1 4 4480 1 1 66 SER N N 15.261 5.269 4.026 1.00 . A A . 101 SER N 1 1 4 4481 1 1 66 SER O O 15.856 3.251 6.478 1.00 . A A . 101 SER O 1 1 4 4482 1 1 66 SER OG O 12.580 5.137 6.584 1.00 . A A . 101 SER OG 1 1 4 4483 1 1 67 LYS C C 14.838 0.384 4.796 1.00 . A A . 102 LYS C 1 1 4 4484 1 1 67 LYS CA C 14.097 1.269 5.789 1.00 . A A . 102 LYS CA 1 1 4 4485 1 1 67 LYS CB C 12.717 0.682 6.127 1.00 . A A . 102 LYS CB 1 1 4 4486 1 1 67 LYS CD C 12.726 0.966 8.625 1.00 . A A . 102 LYS CD 1 1 4 4487 1 1 67 LYS CE C 11.958 1.483 9.830 1.00 . A A . 102 LYS CE 1 1 4 4488 1 1 67 LYS CG C 12.009 1.298 7.327 1.00 . A A . 102 LYS CG 1 1 4 4489 1 1 67 LYS H H 13.293 2.912 4.744 1.00 . A A . 102 LYS H 1 1 4 4490 1 1 67 LYS HA H 14.685 1.281 6.694 1.00 . A A . 102 LYS HA 1 1 4 4491 1 1 67 LYS HB2 H 12.075 0.808 5.267 1.00 . A A . 102 LYS HB2 1 1 4 4492 1 1 67 LYS HB3 H 12.838 -0.376 6.310 1.00 . A A . 102 LYS HB3 1 1 4 4493 1 1 67 LYS HD2 H 12.826 -0.106 8.710 1.00 . A A . 102 LYS HD2 1 1 4 4494 1 1 67 LYS HD3 H 13.707 1.417 8.612 1.00 . A A . 102 LYS HD3 1 1 4 4495 1 1 67 LYS HE2 H 11.925 2.562 9.784 1.00 . A A . 102 LYS HE2 1 1 4 4496 1 1 67 LYS HE3 H 10.952 1.091 9.801 1.00 . A A . 102 LYS HE3 1 1 4 4497 1 1 67 LYS HG2 H 11.984 2.372 7.205 1.00 . A A . 102 LYS HG2 1 1 4 4498 1 1 67 LYS HG3 H 10.999 0.918 7.374 1.00 . A A . 102 LYS HG3 1 1 4 4499 1 1 67 LYS HZ1 H 12.040 1.398 11.916 1.00 . A A . 102 LYS HZ1 1 1 4 4500 1 1 67 LYS HZ2 H 13.547 1.493 11.190 1.00 . A A . 102 LYS HZ2 1 1 4 4501 1 1 67 LYS HZ3 H 12.687 0.049 11.155 1.00 . A A . 102 LYS HZ3 1 1 4 4502 1 1 67 LYS N N 14.013 2.646 5.351 1.00 . A A . 102 LYS N 1 1 4 4503 1 1 67 LYS NZ N 12.598 1.083 11.097 1.00 . A A . 102 LYS NZ 1 1 4 4504 1 1 67 LYS O O 16.071 0.445 4.721 1.00 . A A . 102 LYS O 1 1 4 4505 1 1 68 GLY C C 15.275 -2.480 3.913 1.00 . A A . 103 GLY C 1 1 4 4506 1 1 68 GLY CA C 14.718 -1.334 3.118 1.00 . A A . 103 GLY CA 1 1 4 4507 1 1 68 GLY H H 13.125 -0.278 3.906 1.00 . A A . 103 GLY H 1 1 4 4508 1 1 68 GLY HA2 H 14.016 -1.688 2.382 1.00 . A A . 103 GLY HA2 1 1 4 4509 1 1 68 GLY HA3 H 15.548 -0.853 2.631 1.00 . A A . 103 GLY HA3 1 1 4 4510 1 1 68 GLY N N 14.097 -0.367 3.974 1.00 . A A . 103 GLY N 1 1 4 4511 1 1 68 GLY O O 16.309 -3.047 3.577 1.00 . A A . 103 GLY O 1 1 4 4512 1 1 69 ASN C C 14.059 -4.948 5.862 1.00 . A A . 104 ASN C 1 1 4 4513 1 1 69 ASN CA C 15.033 -3.818 5.877 1.00 . A A . 104 ASN CA 1 1 4 4514 1 1 69 ASN CB C 15.146 -3.245 7.295 1.00 . A A . 104 ASN CB 1 1 4 4515 1 1 69 ASN CG C 16.295 -2.276 7.462 1.00 . A A . 104 ASN CG 1 1 4 4516 1 1 69 ASN H H 13.737 -2.367 5.138 1.00 . A A . 104 ASN H 1 1 4 4517 1 1 69 ASN HA H 16.005 -4.171 5.569 1.00 . A A . 104 ASN HA 1 1 4 4518 1 1 69 ASN HB2 H 14.232 -2.721 7.531 1.00 . A A . 104 ASN HB2 1 1 4 4519 1 1 69 ASN HB3 H 15.274 -4.055 7.996 1.00 . A A . 104 ASN HB3 1 1 4 4520 1 1 69 ASN HD21 H 17.491 -3.760 7.928 1.00 . A A . 104 ASN HD21 1 1 4 4521 1 1 69 ASN HD22 H 18.209 -2.187 7.918 1.00 . A A . 104 ASN HD22 1 1 4 4522 1 1 69 ASN N N 14.597 -2.802 4.965 1.00 . A A . 104 ASN N 1 1 4 4523 1 1 69 ASN ND2 N 17.443 -2.788 7.802 1.00 . A A . 104 ASN ND2 1 1 4 4524 1 1 69 ASN O O 13.030 -4.893 5.183 1.00 . A A . 104 ASN O 1 1 4 4525 1 1 69 ASN OD1 O 16.146 -1.069 7.287 1.00 . A A . 104 ASN OD1 1 1 4 4526 1 1 70 TYR C C 12.457 -6.925 7.758 1.00 . A A . 105 TYR C 1 1 4 4527 1 1 70 TYR CA C 13.508 -7.121 6.691 1.00 . A A . 105 TYR CA 1 1 4 4528 1 1 70 TYR CB C 14.328 -8.390 6.903 1.00 . A A . 105 TYR CB 1 1 4 4529 1 1 70 TYR CD1 C 14.719 -9.355 4.615 1.00 . A A . 105 TYR CD1 1 1 4 4530 1 1 70 TYR CD2 C 16.549 -8.295 5.707 1.00 . A A . 105 TYR CD2 1 1 4 4531 1 1 70 TYR CE1 C 15.512 -9.620 3.526 1.00 . A A . 105 TYR CE1 1 1 4 4532 1 1 70 TYR CE2 C 17.349 -8.553 4.618 1.00 . A A . 105 TYR CE2 1 1 4 4533 1 1 70 TYR CG C 15.220 -8.692 5.724 1.00 . A A . 105 TYR CG 1 1 4 4534 1 1 70 TYR CZ C 16.824 -9.217 3.530 1.00 . A A . 105 TYR CZ 1 1 4 4535 1 1 70 TYR H H 15.186 -5.959 7.135 1.00 . A A . 105 TYR H 1 1 4 4536 1 1 70 TYR HA H 12.995 -7.195 5.743 1.00 . A A . 105 TYR HA 1 1 4 4537 1 1 70 TYR HB2 H 14.951 -8.267 7.777 1.00 . A A . 105 TYR HB2 1 1 4 4538 1 1 70 TYR HB3 H 13.663 -9.229 7.046 1.00 . A A . 105 TYR HB3 1 1 4 4539 1 1 70 TYR HD1 H 13.686 -9.668 4.617 1.00 . A A . 105 TYR HD1 1 1 4 4540 1 1 70 TYR HD2 H 16.957 -7.779 6.562 1.00 . A A . 105 TYR HD2 1 1 4 4541 1 1 70 TYR HE1 H 15.102 -10.140 2.673 1.00 . A A . 105 TYR HE1 1 1 4 4542 1 1 70 TYR HE2 H 18.382 -8.237 4.620 1.00 . A A . 105 TYR HE2 1 1 4 4543 1 1 70 TYR HH H 17.058 -9.415 1.662 1.00 . A A . 105 TYR HH 1 1 4 4544 1 1 70 TYR N N 14.357 -5.971 6.606 1.00 . A A . 105 TYR N 1 1 4 4545 1 1 70 TYR O O 12.308 -7.727 8.688 1.00 . A A . 105 TYR O 1 1 4 4546 1 1 70 TYR OH O 17.624 -9.490 2.443 1.00 . A A . 105 TYR OH 1 1 4 4547 1 1 71 ASP C C 9.416 -6.216 7.971 1.00 . A A . 106 ASP C 1 1 4 4548 1 1 71 ASP CA C 10.648 -5.484 8.472 1.00 . A A . 106 ASP CA 1 1 4 4549 1 1 71 ASP CB C 10.435 -3.940 8.544 1.00 . A A . 106 ASP CB 1 1 4 4550 1 1 71 ASP CG C 10.260 -3.272 7.186 1.00 . A A . 106 ASP CG 1 1 4 4551 1 1 71 ASP H H 12.015 -5.195 6.921 1.00 . A A . 106 ASP H 1 1 4 4552 1 1 71 ASP HA H 10.879 -5.858 9.458 1.00 . A A . 106 ASP HA 1 1 4 4553 1 1 71 ASP HB2 H 9.550 -3.737 9.128 1.00 . A A . 106 ASP HB2 1 1 4 4554 1 1 71 ASP HB3 H 11.289 -3.496 9.036 1.00 . A A . 106 ASP HB3 1 1 4 4555 1 1 71 ASP N N 11.759 -5.825 7.631 1.00 . A A . 106 ASP N 1 1 4 4556 1 1 71 ASP O O 8.568 -5.678 7.246 1.00 . A A . 106 ASP O 1 1 4 4557 1 1 71 ASP OD1 O 11.255 -3.129 6.445 1.00 . A A . 106 ASP OD1 1 1 4 4558 1 1 71 ASP OD2 O 9.138 -2.879 6.821 1.00 . A A . 106 ASP OD2 1 1 4 4559 1 1 72 GLU C C 7.417 -8.506 9.171 1.00 . A A . 107 GLU C 1 1 4 4560 1 1 72 GLU CA C 8.280 -8.305 7.939 1.00 . A A . 107 GLU CA 1 1 4 4561 1 1 72 GLU CB C 8.759 -9.627 7.279 1.00 . A A . 107 GLU CB 1 1 4 4562 1 1 72 GLU CD C 10.303 -11.631 7.329 1.00 . A A . 107 GLU CD 1 1 4 4563 1 1 72 GLU CG C 9.821 -10.399 8.055 1.00 . A A . 107 GLU CG 1 1 4 4564 1 1 72 GLU H H 10.128 -7.857 8.776 1.00 . A A . 107 GLU H 1 1 4 4565 1 1 72 GLU HA H 7.688 -7.748 7.228 1.00 . A A . 107 GLU HA 1 1 4 4566 1 1 72 GLU HB2 H 7.904 -10.276 7.164 1.00 . A A . 107 GLU HB2 1 1 4 4567 1 1 72 GLU HB3 H 9.151 -9.402 6.298 1.00 . A A . 107 GLU HB3 1 1 4 4568 1 1 72 GLU HG2 H 10.668 -9.753 8.231 1.00 . A A . 107 GLU HG2 1 1 4 4569 1 1 72 GLU HG3 H 9.398 -10.702 9.001 1.00 . A A . 107 GLU HG3 1 1 4 4570 1 1 72 GLU N N 9.377 -7.468 8.280 1.00 . A A . 107 GLU N 1 1 4 4571 1 1 72 GLU O O 7.812 -9.252 10.098 1.00 . A A . 107 GLU O 1 1 4 4572 1 1 72 GLU OXT O 6.372 -7.848 9.269 1.00 . A A . 107 GLU OXT 1 1 4 4573 1 1 72 GLU OE1 O 9.671 -12.704 7.454 1.00 . A A . 107 GLU OE1 1 1 4 4574 1 1 72 GLU OE2 O 11.351 -11.565 6.642 1.00 . A A . 107 GLU OE2 1 1 4 4575 2 2 1 ZN ZN ZN -6.917 0.525 -4.059 1.00 . B A . 201 ZN ZN 1 1 4 4576 3 2 1 ZN ZN ZN 10.632 -0.090 -6.655 1.00 . C A . 202 ZN ZN 1 1 5 4577 1 1 1 ARG C C -16.350 -2.772 6.865 1.00 . A A . 36 ARG C 1 1 5 4578 1 1 1 ARG CA C -16.207 -1.786 8.015 1.00 . A A . 36 ARG CA 1 1 5 4579 1 1 1 ARG CB C -17.056 -0.535 7.725 1.00 . A A . 36 ARG CB 1 1 5 4580 1 1 1 ARG CD C -17.423 0.123 10.139 1.00 . A A . 36 ARG CD 1 1 5 4581 1 1 1 ARG CG C -16.964 0.583 8.764 1.00 . A A . 36 ARG CG 1 1 5 4582 1 1 1 ARG CZ C -17.243 1.030 12.458 1.00 . A A . 36 ARG CZ 1 1 5 4583 1 1 1 ARG H1 H -14.434 -0.995 7.277 1.00 . A A . 36 ARG H1 1 1 5 4584 1 1 1 ARG H2 H -14.258 -2.304 8.324 1.00 . A A . 36 ARG H2 1 1 5 4585 1 1 1 ARG H3 H -14.634 -0.791 8.953 1.00 . A A . 36 ARG H3 1 1 5 4586 1 1 1 ARG HA H -16.540 -2.255 8.928 1.00 . A A . 36 ARG HA 1 1 5 4587 1 1 1 ARG HB2 H -16.742 -0.128 6.776 1.00 . A A . 36 ARG HB2 1 1 5 4588 1 1 1 ARG HB3 H -18.089 -0.839 7.643 1.00 . A A . 36 ARG HB3 1 1 5 4589 1 1 1 ARG HD2 H -18.444 -0.226 10.079 1.00 . A A . 36 ARG HD2 1 1 5 4590 1 1 1 ARG HD3 H -16.779 -0.683 10.450 1.00 . A A . 36 ARG HD3 1 1 5 4591 1 1 1 ARG HE H -17.375 2.110 10.760 1.00 . A A . 36 ARG HE 1 1 5 4592 1 1 1 ARG HG2 H -15.940 0.918 8.832 1.00 . A A . 36 ARG HG2 1 1 5 4593 1 1 1 ARG HG3 H -17.582 1.409 8.444 1.00 . A A . 36 ARG HG3 1 1 5 4594 1 1 1 ARG HH11 H -17.204 -1.007 12.405 1.00 . A A . 36 ARG HH11 1 1 5 4595 1 1 1 ARG HH12 H -17.123 -0.327 13.971 1.00 . A A . 36 ARG HH12 1 1 5 4596 1 1 1 ARG HH21 H -17.216 3.010 12.857 1.00 . A A . 36 ARG HH21 1 1 5 4597 1 1 1 ARG HH22 H -17.094 2.008 14.248 1.00 . A A . 36 ARG HH22 1 1 5 4598 1 1 1 ARG N N -14.797 -1.433 8.154 1.00 . A A . 36 ARG N 1 1 5 4599 1 1 1 ARG NE N -17.342 1.197 11.131 1.00 . A A . 36 ARG NE 1 1 5 4600 1 1 1 ARG NH1 N -17.186 -0.185 12.980 1.00 . A A . 36 ARG NH1 1 1 5 4601 1 1 1 ARG NH2 N -17.189 2.088 13.252 1.00 . A A . 36 ARG NH2 1 1 5 4602 1 1 1 ARG O O -15.724 -2.603 5.838 1.00 . A A . 36 ARG O 1 1 5 4603 1 1 2 ALA C C -18.802 -4.784 5.526 1.00 . A A . 37 ALA C 1 1 5 4604 1 1 2 ALA CA C -17.354 -4.787 5.986 1.00 . A A . 37 ALA CA 1 1 5 4605 1 1 2 ALA CB C -16.943 -6.173 6.449 1.00 . A A . 37 ALA CB 1 1 5 4606 1 1 2 ALA H H -17.593 -3.930 7.908 1.00 . A A . 37 ALA H 1 1 5 4607 1 1 2 ALA HA H -16.731 -4.502 5.151 1.00 . A A . 37 ALA HA 1 1 5 4608 1 1 2 ALA HB1 H -17.048 -6.869 5.631 1.00 . A A . 37 ALA HB1 1 1 5 4609 1 1 2 ALA HB2 H -17.573 -6.482 7.269 1.00 . A A . 37 ALA HB2 1 1 5 4610 1 1 2 ALA HB3 H -15.913 -6.152 6.773 1.00 . A A . 37 ALA HB3 1 1 5 4611 1 1 2 ALA N N -17.144 -3.802 7.042 1.00 . A A . 37 ALA N 1 1 5 4612 1 1 2 ALA O O -19.187 -5.533 4.630 1.00 . A A . 37 ALA O 1 1 5 4613 1 1 3 GLN C C -21.190 -2.428 5.182 1.00 . A A . 38 GLN C 1 1 5 4614 1 1 3 GLN CA C -21.005 -3.809 5.782 1.00 . A A . 38 GLN CA 1 1 5 4615 1 1 3 GLN CB C -21.929 -3.994 6.988 1.00 . A A . 38 GLN CB 1 1 5 4616 1 1 3 GLN CD C -22.765 -5.545 8.811 1.00 . A A . 38 GLN CD 1 1 5 4617 1 1 3 GLN CG C -21.861 -5.382 7.606 1.00 . A A . 38 GLN CG 1 1 5 4618 1 1 3 GLN H H -19.282 -3.477 6.952 1.00 . A A . 38 GLN H 1 1 5 4619 1 1 3 GLN HA H -21.235 -4.551 5.032 1.00 . A A . 38 GLN HA 1 1 5 4620 1 1 3 GLN HB2 H -21.658 -3.272 7.744 1.00 . A A . 38 GLN HB2 1 1 5 4621 1 1 3 GLN HB3 H -22.947 -3.807 6.680 1.00 . A A . 38 GLN HB3 1 1 5 4622 1 1 3 GLN HE21 H -22.965 -7.466 8.427 1.00 . A A . 38 GLN HE21 1 1 5 4623 1 1 3 GLN HE22 H -23.821 -6.876 9.809 1.00 . A A . 38 GLN HE22 1 1 5 4624 1 1 3 GLN HG2 H -22.160 -6.100 6.859 1.00 . A A . 38 GLN HG2 1 1 5 4625 1 1 3 GLN HG3 H -20.840 -5.576 7.904 1.00 . A A . 38 GLN HG3 1 1 5 4626 1 1 3 GLN N N -19.611 -3.973 6.173 1.00 . A A . 38 GLN N 1 1 5 4627 1 1 3 GLN NE2 N -23.228 -6.746 9.040 1.00 . A A . 38 GLN NE2 1 1 5 4628 1 1 3 GLN O O -22.261 -2.071 4.693 1.00 . A A . 38 GLN O 1 1 5 4629 1 1 3 GLN OE1 O -23.032 -4.596 9.540 1.00 . A A . 38 GLN OE1 1 1 5 4630 1 1 4 VAL C C -18.964 -0.246 3.690 1.00 . A A . 39 VAL C 1 1 5 4631 1 1 4 VAL CA C -20.094 -0.314 4.712 1.00 . A A . 39 VAL CA 1 1 5 4632 1 1 4 VAL CB C -19.798 0.700 5.880 1.00 . A A . 39 VAL CB 1 1 5 4633 1 1 4 VAL CG1 C -19.955 2.147 5.426 1.00 . A A . 39 VAL CG1 1 1 5 4634 1 1 4 VAL CG2 C -20.680 0.439 7.089 1.00 . A A . 39 VAL CG2 1 1 5 4635 1 1 4 VAL H H -19.270 -2.061 5.499 1.00 . A A . 39 VAL H 1 1 5 4636 1 1 4 VAL HA H -21.041 -0.081 4.247 1.00 . A A . 39 VAL HA 1 1 5 4637 1 1 4 VAL HB H -18.768 0.568 6.175 1.00 . A A . 39 VAL HB 1 1 5 4638 1 1 4 VAL HG11 H -20.968 2.310 5.091 1.00 . A A . 39 VAL HG11 1 1 5 4639 1 1 4 VAL HG12 H -19.273 2.343 4.611 1.00 . A A . 39 VAL HG12 1 1 5 4640 1 1 4 VAL HG13 H -19.735 2.811 6.249 1.00 . A A . 39 VAL HG13 1 1 5 4641 1 1 4 VAL HG21 H -20.419 1.125 7.881 1.00 . A A . 39 VAL HG21 1 1 5 4642 1 1 4 VAL HG22 H -20.550 -0.578 7.427 1.00 . A A . 39 VAL HG22 1 1 5 4643 1 1 4 VAL HG23 H -21.709 0.598 6.804 1.00 . A A . 39 VAL HG23 1 1 5 4644 1 1 4 VAL N N -20.118 -1.673 5.198 1.00 . A A . 39 VAL N 1 1 5 4645 1 1 4 VAL O O -18.041 -1.062 3.741 1.00 . A A . 39 VAL O 1 1 5 4646 1 1 5 LYS C C -16.943 1.678 2.330 1.00 . A A . 40 LYS C 1 1 5 4647 1 1 5 LYS CA C -18.080 0.884 1.750 1.00 . A A . 40 LYS CA 1 1 5 4648 1 1 5 LYS CB C -18.698 1.644 0.577 1.00 . A A . 40 LYS CB 1 1 5 4649 1 1 5 LYS CD C -20.566 1.865 -1.087 1.00 . A A . 40 LYS CD 1 1 5 4650 1 1 5 LYS CE C -21.850 1.253 -1.615 1.00 . A A . 40 LYS CE 1 1 5 4651 1 1 5 LYS CG C -19.935 0.986 -0.018 1.00 . A A . 40 LYS CG 1 1 5 4652 1 1 5 LYS H H -19.778 1.339 2.842 1.00 . A A . 40 LYS H 1 1 5 4653 1 1 5 LYS HA H -17.729 -0.081 1.414 1.00 . A A . 40 LYS HA 1 1 5 4654 1 1 5 LYS HB2 H -18.968 2.632 0.916 1.00 . A A . 40 LYS HB2 1 1 5 4655 1 1 5 LYS HB3 H -17.956 1.737 -0.201 1.00 . A A . 40 LYS HB3 1 1 5 4656 1 1 5 LYS HD2 H -20.780 2.836 -0.667 1.00 . A A . 40 LYS HD2 1 1 5 4657 1 1 5 LYS HD3 H -19.867 1.977 -1.903 1.00 . A A . 40 LYS HD3 1 1 5 4658 1 1 5 LYS HE2 H -21.606 0.319 -2.097 1.00 . A A . 40 LYS HE2 1 1 5 4659 1 1 5 LYS HE3 H -22.517 1.069 -0.786 1.00 . A A . 40 LYS HE3 1 1 5 4660 1 1 5 LYS HG2 H -19.654 0.042 -0.461 1.00 . A A . 40 LYS HG2 1 1 5 4661 1 1 5 LYS HG3 H -20.653 0.814 0.770 1.00 . A A . 40 LYS HG3 1 1 5 4662 1 1 5 LYS HZ1 H -21.905 2.338 -3.406 1.00 . A A . 40 LYS HZ1 1 1 5 4663 1 1 5 LYS HZ2 H -22.851 3.007 -2.167 1.00 . A A . 40 LYS HZ2 1 1 5 4664 1 1 5 LYS HZ3 H -23.368 1.629 -2.971 1.00 . A A . 40 LYS HZ3 1 1 5 4665 1 1 5 LYS N N -19.051 0.694 2.786 1.00 . A A . 40 LYS N 1 1 5 4666 1 1 5 LYS NZ N -22.528 2.120 -2.603 1.00 . A A . 40 LYS NZ 1 1 5 4667 1 1 5 LYS O O -17.161 2.627 3.093 1.00 . A A . 40 LYS O 1 1 5 4668 1 1 6 GLU C C -13.827 2.543 1.413 1.00 . A A . 41 GLU C 1 1 5 4669 1 1 6 GLU CA C -14.557 1.863 2.528 1.00 . A A . 41 GLU CA 1 1 5 4670 1 1 6 GLU CB C -13.740 0.714 3.042 1.00 . A A . 41 GLU CB 1 1 5 4671 1 1 6 GLU CD C -14.238 0.340 5.483 1.00 . A A . 41 GLU CD 1 1 5 4672 1 1 6 GLU CG C -14.487 -0.093 4.067 1.00 . A A . 41 GLU CG 1 1 5 4673 1 1 6 GLU H H -15.676 0.590 1.316 1.00 . A A . 41 GLU H 1 1 5 4674 1 1 6 GLU HA H -14.774 2.542 3.338 1.00 . A A . 41 GLU HA 1 1 5 4675 1 1 6 GLU HB2 H -13.476 0.073 2.214 1.00 . A A . 41 GLU HB2 1 1 5 4676 1 1 6 GLU HB3 H -12.838 1.092 3.498 1.00 . A A . 41 GLU HB3 1 1 5 4677 1 1 6 GLU HG2 H -15.532 0.091 3.857 1.00 . A A . 41 GLU HG2 1 1 5 4678 1 1 6 GLU HG3 H -14.312 -1.142 3.923 1.00 . A A . 41 GLU HG3 1 1 5 4679 1 1 6 GLU N N -15.770 1.299 1.989 1.00 . A A . 41 GLU N 1 1 5 4680 1 1 6 GLU O O -14.060 2.229 0.273 1.00 . A A . 41 GLU O 1 1 5 4681 1 1 6 GLU OE1 O -14.915 1.243 5.966 1.00 . A A . 41 GLU OE1 1 1 5 4682 1 1 6 GLU OE2 O -13.374 -0.258 6.164 1.00 . A A . 41 GLU OE2 1 1 5 4683 1 1 7 THR C C -10.782 3.752 0.707 1.00 . A A . 42 THR C 1 1 5 4684 1 1 7 THR CA C -12.270 4.089 0.607 1.00 . A A . 42 THR CA 1 1 5 4685 1 1 7 THR CB C -12.468 5.604 0.552 1.00 . A A . 42 THR CB 1 1 5 4686 1 1 7 THR CG2 C -12.805 6.002 -0.880 1.00 . A A . 42 THR CG2 1 1 5 4687 1 1 7 THR H H -12.777 3.686 2.632 1.00 . A A . 42 THR H 1 1 5 4688 1 1 7 THR HA H -12.691 3.642 -0.286 1.00 . A A . 42 THR HA 1 1 5 4689 1 1 7 THR HB H -11.543 6.084 0.834 1.00 . A A . 42 THR HB 1 1 5 4690 1 1 7 THR HG1 H -13.941 5.160 1.767 1.00 . A A . 42 THR HG1 1 1 5 4691 1 1 7 THR HG21 H -12.978 7.067 -0.933 1.00 . A A . 42 THR HG21 1 1 5 4692 1 1 7 THR HG22 H -13.696 5.471 -1.189 1.00 . A A . 42 THR HG22 1 1 5 4693 1 1 7 THR HG23 H -11.985 5.732 -1.530 1.00 . A A . 42 THR HG23 1 1 5 4694 1 1 7 THR N N -12.980 3.469 1.695 1.00 . A A . 42 THR N 1 1 5 4695 1 1 7 THR O O -10.212 3.702 1.805 1.00 . A A . 42 THR O 1 1 5 4696 1 1 7 THR OG1 O -13.576 5.968 1.388 1.00 . A A . 42 THR OG1 1 1 5 4697 1 1 8 CYS C C -7.860 4.245 -0.500 1.00 . A A . 43 CYS C 1 1 5 4698 1 1 8 CYS CA C -8.814 3.084 -0.520 1.00 . A A . 43 CYS CA 1 1 5 4699 1 1 8 CYS CB C -8.672 2.225 -1.761 1.00 . A A . 43 CYS CB 1 1 5 4700 1 1 8 CYS H H -10.660 3.672 -1.274 1.00 . A A . 43 CYS H 1 1 5 4701 1 1 8 CYS HA H -8.635 2.452 0.332 1.00 . A A . 43 CYS HA 1 1 5 4702 1 1 8 CYS HB2 H -8.877 1.206 -1.468 1.00 . A A . 43 CYS HB2 1 1 5 4703 1 1 8 CYS HB3 H -9.446 2.524 -2.442 1.00 . A A . 43 CYS HB3 1 1 5 4704 1 1 8 CYS N N -10.176 3.517 -0.431 1.00 . A A . 43 CYS N 1 1 5 4705 1 1 8 CYS O O -8.176 5.325 -0.968 1.00 . A A . 43 CYS O 1 1 5 4706 1 1 8 CYS SG S -7.080 2.180 -2.597 1.00 . A A . 43 CYS SG 1 1 5 4707 1 1 9 ALA C C -4.613 4.895 -0.880 1.00 . A A . 44 ALA C 1 1 5 4708 1 1 9 ALA CA C -5.707 5.061 0.163 1.00 . A A . 44 ALA CA 1 1 5 4709 1 1 9 ALA CB C -5.104 5.069 1.528 1.00 . A A . 44 ALA CB 1 1 5 4710 1 1 9 ALA H H -6.563 3.161 0.509 1.00 . A A . 44 ALA H 1 1 5 4711 1 1 9 ALA HA H -6.187 6.016 0.020 1.00 . A A . 44 ALA HA 1 1 5 4712 1 1 9 ALA HB1 H -4.555 4.154 1.690 1.00 . A A . 44 ALA HB1 1 1 5 4713 1 1 9 ALA HB2 H -5.899 5.180 2.248 1.00 . A A . 44 ALA HB2 1 1 5 4714 1 1 9 ALA HB3 H -4.438 5.917 1.568 1.00 . A A . 44 ALA HB3 1 1 5 4715 1 1 9 ALA N N -6.711 4.032 0.080 1.00 . A A . 44 ALA N 1 1 5 4716 1 1 9 ALA O O -3.873 5.828 -1.155 1.00 . A A . 44 ALA O 1 1 5 4717 1 1 10 ALA C C -3.828 3.827 -3.831 1.00 . A A . 45 ALA C 1 1 5 4718 1 1 10 ALA CA C -3.452 3.447 -2.411 1.00 . A A . 45 ALA CA 1 1 5 4719 1 1 10 ALA CB C -3.036 1.993 -2.313 1.00 . A A . 45 ALA CB 1 1 5 4720 1 1 10 ALA H H -5.207 3.027 -1.339 1.00 . A A . 45 ALA H 1 1 5 4721 1 1 10 ALA HA H -2.611 4.057 -2.114 1.00 . A A . 45 ALA HA 1 1 5 4722 1 1 10 ALA HB1 H -2.161 1.826 -2.924 1.00 . A A . 45 ALA HB1 1 1 5 4723 1 1 10 ALA HB2 H -3.844 1.362 -2.652 1.00 . A A . 45 ALA HB2 1 1 5 4724 1 1 10 ALA HB3 H -2.806 1.772 -1.278 1.00 . A A . 45 ALA HB3 1 1 5 4725 1 1 10 ALA N N -4.530 3.720 -1.487 1.00 . A A . 45 ALA N 1 1 5 4726 1 1 10 ALA O O -2.978 4.195 -4.625 1.00 . A A . 45 ALA O 1 1 5 4727 1 1 11 CYS C C -6.856 5.030 -5.354 1.00 . A A . 46 CYS C 1 1 5 4728 1 1 11 CYS CA C -5.600 4.142 -5.452 1.00 . A A . 46 CYS CA 1 1 5 4729 1 1 11 CYS CB C -5.795 2.899 -6.356 1.00 . A A . 46 CYS CB 1 1 5 4730 1 1 11 CYS H H -5.728 3.439 -3.452 1.00 . A A . 46 CYS H 1 1 5 4731 1 1 11 CYS HA H -4.824 4.760 -5.882 1.00 . A A . 46 CYS HA 1 1 5 4732 1 1 11 CYS HB2 H -5.266 2.818 -7.291 1.00 . A A . 46 CYS HB2 1 1 5 4733 1 1 11 CYS HB3 H -5.100 2.275 -5.809 1.00 . A A . 46 CYS HB3 1 1 5 4734 1 1 11 CYS N N -5.105 3.760 -4.137 1.00 . A A . 46 CYS N 1 1 5 4735 1 1 11 CYS O O -7.402 5.488 -6.363 1.00 . A A . 46 CYS O 1 1 5 4736 1 1 11 CYS SG S -7.347 1.976 -6.195 1.00 . A A . 46 CYS SG 1 1 5 4737 1 1 12 GLN C C -9.721 5.774 -4.450 1.00 . A A . 47 GLN C 1 1 5 4738 1 1 12 GLN CA C -8.417 6.134 -3.745 1.00 . A A . 47 GLN CA 1 1 5 4739 1 1 12 GLN CB C -8.101 7.593 -3.847 1.00 . A A . 47 GLN CB 1 1 5 4740 1 1 12 GLN CD C -6.531 9.413 -3.107 1.00 . A A . 47 GLN CD 1 1 5 4741 1 1 12 GLN CG C -6.998 7.999 -2.904 1.00 . A A . 47 GLN CG 1 1 5 4742 1 1 12 GLN H H -6.728 4.980 -3.341 1.00 . A A . 47 GLN H 1 1 5 4743 1 1 12 GLN HA H -8.558 5.918 -2.696 1.00 . A A . 47 GLN HA 1 1 5 4744 1 1 12 GLN HB2 H -7.859 7.864 -4.864 1.00 . A A . 47 GLN HB2 1 1 5 4745 1 1 12 GLN HB3 H -9.012 8.070 -3.522 1.00 . A A . 47 GLN HB3 1 1 5 4746 1 1 12 GLN HE21 H -5.165 8.792 -4.376 1.00 . A A . 47 GLN HE21 1 1 5 4747 1 1 12 GLN HE22 H -5.180 10.484 -4.091 1.00 . A A . 47 GLN HE22 1 1 5 4748 1 1 12 GLN HG2 H -7.373 7.904 -1.895 1.00 . A A . 47 GLN HG2 1 1 5 4749 1 1 12 GLN HG3 H -6.181 7.310 -3.039 1.00 . A A . 47 GLN HG3 1 1 5 4750 1 1 12 GLN N N -7.260 5.303 -4.096 1.00 . A A . 47 GLN N 1 1 5 4751 1 1 12 GLN NE2 N -5.543 9.583 -3.935 1.00 . A A . 47 GLN NE2 1 1 5 4752 1 1 12 GLN O O -10.446 6.632 -4.929 1.00 . A A . 47 GLN O 1 1 5 4753 1 1 12 GLN OE1 O -7.061 10.351 -2.500 1.00 . A A . 47 GLN OE1 1 1 5 4754 1 1 13 LYS C C -11.903 3.249 -3.931 1.00 . A A . 48 LYS C 1 1 5 4755 1 1 13 LYS CA C -11.201 3.959 -5.048 1.00 . A A . 48 LYS CA 1 1 5 4756 1 1 13 LYS CB C -10.864 2.978 -6.164 1.00 . A A . 48 LYS CB 1 1 5 4757 1 1 13 LYS CD C -10.981 4.686 -8.027 1.00 . A A . 48 LYS CD 1 1 5 4758 1 1 13 LYS CE C -12.319 4.155 -8.558 1.00 . A A . 48 LYS CE 1 1 5 4759 1 1 13 LYS CG C -10.151 3.600 -7.357 1.00 . A A . 48 LYS CG 1 1 5 4760 1 1 13 LYS H H -9.351 3.876 -4.131 1.00 . A A . 48 LYS H 1 1 5 4761 1 1 13 LYS HA H -11.823 4.757 -5.425 1.00 . A A . 48 LYS HA 1 1 5 4762 1 1 13 LYS HB2 H -10.211 2.218 -5.761 1.00 . A A . 48 LYS HB2 1 1 5 4763 1 1 13 LYS HB3 H -11.775 2.511 -6.507 1.00 . A A . 48 LYS HB3 1 1 5 4764 1 1 13 LYS HD2 H -11.165 5.438 -7.274 1.00 . A A . 48 LYS HD2 1 1 5 4765 1 1 13 LYS HD3 H -10.411 5.119 -8.835 1.00 . A A . 48 LYS HD3 1 1 5 4766 1 1 13 LYS HE2 H -12.897 3.773 -7.730 1.00 . A A . 48 LYS HE2 1 1 5 4767 1 1 13 LYS HE3 H -12.858 4.972 -9.016 1.00 . A A . 48 LYS HE3 1 1 5 4768 1 1 13 LYS HG2 H -9.229 4.039 -7.006 1.00 . A A . 48 LYS HG2 1 1 5 4769 1 1 13 LYS HG3 H -9.921 2.820 -8.062 1.00 . A A . 48 LYS HG3 1 1 5 4770 1 1 13 LYS HZ1 H -11.630 2.264 -9.151 1.00 . A A . 48 LYS HZ1 1 1 5 4771 1 1 13 LYS HZ2 H -11.620 3.395 -10.383 1.00 . A A . 48 LYS HZ2 1 1 5 4772 1 1 13 LYS HZ3 H -13.075 2.728 -9.861 1.00 . A A . 48 LYS HZ3 1 1 5 4773 1 1 13 LYS N N -9.992 4.512 -4.494 1.00 . A A . 48 LYS N 1 1 5 4774 1 1 13 LYS NZ N -12.148 3.074 -9.547 1.00 . A A . 48 LYS NZ 1 1 5 4775 1 1 13 LYS O O -11.260 2.866 -2.962 1.00 . A A . 48 LYS O 1 1 5 4776 1 1 14 THR C C -13.631 0.997 -2.915 1.00 . A A . 49 THR C 1 1 5 4777 1 1 14 THR CA C -13.948 2.509 -2.976 1.00 . A A . 49 THR CA 1 1 5 4778 1 1 14 THR CB C -15.426 2.725 -3.216 1.00 . A A . 49 THR CB 1 1 5 4779 1 1 14 THR CG2 C -16.183 2.528 -1.929 1.00 . A A . 49 THR CG2 1 1 5 4780 1 1 14 THR H H -13.678 3.517 -4.774 1.00 . A A . 49 THR H 1 1 5 4781 1 1 14 THR HA H -13.691 2.950 -2.030 1.00 . A A . 49 THR HA 1 1 5 4782 1 1 14 THR HB H -15.742 1.994 -3.935 1.00 . A A . 49 THR HB 1 1 5 4783 1 1 14 THR HG1 H -16.088 4.563 -2.961 1.00 . A A . 49 THR HG1 1 1 5 4784 1 1 14 THR HG21 H -16.138 1.488 -1.634 1.00 . A A . 49 THR HG21 1 1 5 4785 1 1 14 THR HG22 H -17.208 2.850 -2.036 1.00 . A A . 49 THR HG22 1 1 5 4786 1 1 14 THR HG23 H -15.666 3.124 -1.184 1.00 . A A . 49 THR HG23 1 1 5 4787 1 1 14 THR N N -13.188 3.152 -4.005 1.00 . A A . 49 THR N 1 1 5 4788 1 1 14 THR O O -13.614 0.308 -3.939 1.00 . A A . 49 THR O 1 1 5 4789 1 1 14 THR OG1 O -15.639 4.083 -3.667 1.00 . A A . 49 THR OG1 1 1 5 4790 1 1 15 VAL C C -14.231 -1.570 -1.027 1.00 . A A . 50 VAL C 1 1 5 4791 1 1 15 VAL CA C -13.015 -0.870 -1.521 1.00 . A A . 50 VAL CA 1 1 5 4792 1 1 15 VAL CB C -11.891 -1.093 -0.480 1.00 . A A . 50 VAL CB 1 1 5 4793 1 1 15 VAL CG1 C -10.962 -2.161 -0.982 1.00 . A A . 50 VAL CG1 1 1 5 4794 1 1 15 VAL CG2 C -11.144 0.177 -0.205 1.00 . A A . 50 VAL CG2 1 1 5 4795 1 1 15 VAL H H -13.424 1.109 -0.952 1.00 . A A . 50 VAL H 1 1 5 4796 1 1 15 VAL HA H -12.686 -1.256 -2.474 1.00 . A A . 50 VAL HA 1 1 5 4797 1 1 15 VAL HB H -12.300 -1.494 0.443 1.00 . A A . 50 VAL HB 1 1 5 4798 1 1 15 VAL HG11 H -10.603 -1.886 -1.964 1.00 . A A . 50 VAL HG11 1 1 5 4799 1 1 15 VAL HG12 H -11.471 -3.111 -1.033 1.00 . A A . 50 VAL HG12 1 1 5 4800 1 1 15 VAL HG13 H -10.116 -2.225 -0.314 1.00 . A A . 50 VAL HG13 1 1 5 4801 1 1 15 VAL HG21 H -10.314 -0.002 0.460 1.00 . A A . 50 VAL HG21 1 1 5 4802 1 1 15 VAL HG22 H -11.827 0.890 0.233 1.00 . A A . 50 VAL HG22 1 1 5 4803 1 1 15 VAL HG23 H -10.793 0.556 -1.156 1.00 . A A . 50 VAL HG23 1 1 5 4804 1 1 15 VAL N N -13.350 0.510 -1.727 1.00 . A A . 50 VAL N 1 1 5 4805 1 1 15 VAL O O -14.956 -1.045 -0.168 1.00 . A A . 50 VAL O 1 1 5 4806 1 1 16 TYR C C -15.092 -4.690 -0.421 1.00 . A A . 51 TYR C 1 1 5 4807 1 1 16 TYR CA C -15.611 -3.483 -1.193 1.00 . A A . 51 TYR CA 1 1 5 4808 1 1 16 TYR CB C -16.349 -3.874 -2.477 1.00 . A A . 51 TYR CB 1 1 5 4809 1 1 16 TYR CD1 C -17.360 -1.671 -3.093 1.00 . A A . 51 TYR CD1 1 1 5 4810 1 1 16 TYR CD2 C -15.791 -2.619 -4.594 1.00 . A A . 51 TYR CD2 1 1 5 4811 1 1 16 TYR CE1 C -17.501 -0.572 -3.917 1.00 . A A . 51 TYR CE1 1 1 5 4812 1 1 16 TYR CE2 C -15.920 -1.533 -5.432 1.00 . A A . 51 TYR CE2 1 1 5 4813 1 1 16 TYR CG C -16.514 -2.701 -3.412 1.00 . A A . 51 TYR CG 1 1 5 4814 1 1 16 TYR CZ C -16.776 -0.507 -5.090 1.00 . A A . 51 TYR CZ 1 1 5 4815 1 1 16 TYR H H -13.857 -3.076 -2.225 1.00 . A A . 51 TYR H 1 1 5 4816 1 1 16 TYR HA H -16.250 -2.883 -0.563 1.00 . A A . 51 TYR HA 1 1 5 4817 1 1 16 TYR HB2 H -15.800 -4.635 -3.004 1.00 . A A . 51 TYR HB2 1 1 5 4818 1 1 16 TYR HB3 H -17.335 -4.240 -2.231 1.00 . A A . 51 TYR HB3 1 1 5 4819 1 1 16 TYR HD1 H -17.897 -1.762 -2.164 1.00 . A A . 51 TYR HD1 1 1 5 4820 1 1 16 TYR HD2 H -15.122 -3.426 -4.855 1.00 . A A . 51 TYR HD2 1 1 5 4821 1 1 16 TYR HE1 H -18.175 0.225 -3.643 1.00 . A A . 51 TYR HE1 1 1 5 4822 1 1 16 TYR HE2 H -15.347 -1.493 -6.347 1.00 . A A . 51 TYR HE2 1 1 5 4823 1 1 16 TYR HH H -16.787 0.313 -6.829 1.00 . A A . 51 TYR HH 1 1 5 4824 1 1 16 TYR N N -14.471 -2.710 -1.556 1.00 . A A . 51 TYR N 1 1 5 4825 1 1 16 TYR O O -13.927 -5.030 -0.598 1.00 . A A . 51 TYR O 1 1 5 4826 1 1 16 TYR OH O -16.900 0.597 -5.915 1.00 . A A . 51 TYR OH 1 1 5 4827 1 1 17 PRO C C -14.534 -7.499 0.717 1.00 . A A . 52 PRO C 1 1 5 4828 1 1 17 PRO CA C -15.452 -6.428 1.347 1.00 . A A . 52 PRO CA 1 1 5 4829 1 1 17 PRO CB C -16.748 -7.061 1.805 1.00 . A A . 52 PRO CB 1 1 5 4830 1 1 17 PRO CD C -17.363 -5.106 0.569 1.00 . A A . 52 PRO CD 1 1 5 4831 1 1 17 PRO CG C -17.759 -5.973 1.727 1.00 . A A . 52 PRO CG 1 1 5 4832 1 1 17 PRO HA H -14.951 -6.015 2.206 1.00 . A A . 52 PRO HA 1 1 5 4833 1 1 17 PRO HB2 H -16.960 -7.866 1.124 1.00 . A A . 52 PRO HB2 1 1 5 4834 1 1 17 PRO HB3 H -16.637 -7.442 2.809 1.00 . A A . 52 PRO HB3 1 1 5 4835 1 1 17 PRO HD2 H -17.897 -5.404 -0.321 1.00 . A A . 52 PRO HD2 1 1 5 4836 1 1 17 PRO HD3 H -17.555 -4.068 0.794 1.00 . A A . 52 PRO HD3 1 1 5 4837 1 1 17 PRO HG2 H -18.737 -6.400 1.558 1.00 . A A . 52 PRO HG2 1 1 5 4838 1 1 17 PRO HG3 H -17.756 -5.401 2.644 1.00 . A A . 52 PRO HG3 1 1 5 4839 1 1 17 PRO N N -15.911 -5.353 0.423 1.00 . A A . 52 PRO N 1 1 5 4840 1 1 17 PRO O O -13.576 -7.967 1.358 1.00 . A A . 52 PRO O 1 1 5 4841 1 1 18 MET C C -12.566 -8.379 -1.511 1.00 . A A . 53 MET C 1 1 5 4842 1 1 18 MET CA C -14.009 -8.843 -1.262 1.00 . A A . 53 MET CA 1 1 5 4843 1 1 18 MET CB C -14.679 -9.134 -2.595 1.00 . A A . 53 MET CB 1 1 5 4844 1 1 18 MET CE C -13.659 -11.584 -5.790 1.00 . A A . 53 MET CE 1 1 5 4845 1 1 18 MET CG C -13.976 -10.171 -3.435 1.00 . A A . 53 MET CG 1 1 5 4846 1 1 18 MET H H -15.555 -7.416 -0.980 1.00 . A A . 53 MET H 1 1 5 4847 1 1 18 MET HA H -13.986 -9.756 -0.691 1.00 . A A . 53 MET HA 1 1 5 4848 1 1 18 MET HB2 H -15.673 -9.499 -2.387 1.00 . A A . 53 MET HB2 1 1 5 4849 1 1 18 MET HB3 H -14.747 -8.218 -3.163 1.00 . A A . 53 MET HB3 1 1 5 4850 1 1 18 MET HE1 H -13.961 -11.768 -6.810 1.00 . A A . 53 MET HE1 1 1 5 4851 1 1 18 MET HE2 H -13.779 -12.491 -5.215 1.00 . A A . 53 MET HE2 1 1 5 4852 1 1 18 MET HE3 H -12.624 -11.277 -5.768 1.00 . A A . 53 MET HE3 1 1 5 4853 1 1 18 MET HG2 H -12.932 -9.903 -3.497 1.00 . A A . 53 MET HG2 1 1 5 4854 1 1 18 MET HG3 H -14.066 -11.126 -2.941 1.00 . A A . 53 MET HG3 1 1 5 4855 1 1 18 MET N N -14.792 -7.842 -0.531 1.00 . A A . 53 MET N 1 1 5 4856 1 1 18 MET O O -11.628 -9.187 -1.527 1.00 . A A . 53 MET O 1 1 5 4857 1 1 18 MET SD S -14.684 -10.296 -5.087 1.00 . A A . 53 MET SD 1 1 5 4858 1 1 19 GLU C C -10.508 -5.747 -0.875 1.00 . A A . 54 GLU C 1 1 5 4859 1 1 19 GLU CA C -11.106 -6.533 -2.019 1.00 . A A . 54 GLU CA 1 1 5 4860 1 1 19 GLU CB C -11.257 -5.649 -3.236 1.00 . A A . 54 GLU CB 1 1 5 4861 1 1 19 GLU CD C -11.812 -5.596 -5.682 1.00 . A A . 54 GLU CD 1 1 5 4862 1 1 19 GLU CG C -11.791 -6.404 -4.423 1.00 . A A . 54 GLU CG 1 1 5 4863 1 1 19 GLU H H -13.146 -6.477 -1.588 1.00 . A A . 54 GLU H 1 1 5 4864 1 1 19 GLU HA H -10.439 -7.342 -2.276 1.00 . A A . 54 GLU HA 1 1 5 4865 1 1 19 GLU HB2 H -11.943 -4.850 -2.997 1.00 . A A . 54 GLU HB2 1 1 5 4866 1 1 19 GLU HB3 H -10.301 -5.223 -3.500 1.00 . A A . 54 GLU HB3 1 1 5 4867 1 1 19 GLU HG2 H -11.195 -7.291 -4.556 1.00 . A A . 54 GLU HG2 1 1 5 4868 1 1 19 GLU HG3 H -12.800 -6.712 -4.191 1.00 . A A . 54 GLU HG3 1 1 5 4869 1 1 19 GLU N N -12.391 -7.095 -1.683 1.00 . A A . 54 GLU N 1 1 5 4870 1 1 19 GLU O O -9.320 -5.429 -0.896 1.00 . A A . 54 GLU O 1 1 5 4871 1 1 19 GLU OE1 O -10.748 -5.107 -6.100 1.00 . A A . 54 GLU OE1 1 1 5 4872 1 1 19 GLU OE2 O -12.894 -5.492 -6.305 1.00 . A A . 54 GLU OE2 1 1 5 4873 1 1 20 ARG C C -9.907 -5.331 2.125 1.00 . A A . 55 ARG C 1 1 5 4874 1 1 20 ARG CA C -10.920 -4.634 1.241 1.00 . A A . 55 ARG CA 1 1 5 4875 1 1 20 ARG CB C -12.107 -4.100 2.042 1.00 . A A . 55 ARG CB 1 1 5 4876 1 1 20 ARG CD C -12.913 -3.424 4.291 1.00 . A A . 55 ARG CD 1 1 5 4877 1 1 20 ARG CG C -11.735 -3.492 3.361 1.00 . A A . 55 ARG CG 1 1 5 4878 1 1 20 ARG CZ C -12.186 -3.213 6.662 1.00 . A A . 55 ARG CZ 1 1 5 4879 1 1 20 ARG H H -12.267 -5.726 0.057 1.00 . A A . 55 ARG H 1 1 5 4880 1 1 20 ARG HA H -10.409 -3.784 0.821 1.00 . A A . 55 ARG HA 1 1 5 4881 1 1 20 ARG HB2 H -12.567 -3.300 1.479 1.00 . A A . 55 ARG HB2 1 1 5 4882 1 1 20 ARG HB3 H -12.852 -4.851 2.172 1.00 . A A . 55 ARG HB3 1 1 5 4883 1 1 20 ARG HD2 H -13.739 -2.957 3.777 1.00 . A A . 55 ARG HD2 1 1 5 4884 1 1 20 ARG HD3 H -13.195 -4.432 4.556 1.00 . A A . 55 ARG HD3 1 1 5 4885 1 1 20 ARG HE H -12.669 -1.702 5.432 1.00 . A A . 55 ARG HE 1 1 5 4886 1 1 20 ARG HG2 H -10.958 -4.087 3.818 1.00 . A A . 55 ARG HG2 1 1 5 4887 1 1 20 ARG HG3 H -11.365 -2.492 3.187 1.00 . A A . 55 ARG HG3 1 1 5 4888 1 1 20 ARG HH11 H -12.413 -5.171 6.106 1.00 . A A . 55 ARG HH11 1 1 5 4889 1 1 20 ARG HH12 H -11.872 -4.961 7.694 1.00 . A A . 55 ARG HH12 1 1 5 4890 1 1 20 ARG HH21 H -11.915 -1.404 7.549 1.00 . A A . 55 ARG HH21 1 1 5 4891 1 1 20 ARG HH22 H -11.549 -2.757 8.552 1.00 . A A . 55 ARG HH22 1 1 5 4892 1 1 20 ARG N N -11.334 -5.426 0.108 1.00 . A A . 55 ARG N 1 1 5 4893 1 1 20 ARG NE N -12.577 -2.687 5.507 1.00 . A A . 55 ARG NE 1 1 5 4894 1 1 20 ARG NH1 N -12.151 -4.529 6.831 1.00 . A A . 55 ARG NH1 1 1 5 4895 1 1 20 ARG NH2 N -11.863 -2.402 7.666 1.00 . A A . 55 ARG NH2 1 1 5 4896 1 1 20 ARG O O -10.211 -6.273 2.883 1.00 . A A . 55 ARG O 1 1 5 4897 1 1 21 LEU C C -7.197 -4.060 3.562 1.00 . A A . 56 LEU C 1 1 5 4898 1 1 21 LEU CA C -7.608 -5.266 2.741 1.00 . A A . 56 LEU CA 1 1 5 4899 1 1 21 LEU CB C -6.506 -5.739 1.751 1.00 . A A . 56 LEU CB 1 1 5 4900 1 1 21 LEU CD1 C -4.452 -7.037 1.340 1.00 . A A . 56 LEU CD1 1 1 5 4901 1 1 21 LEU CD2 C -4.246 -4.836 2.375 1.00 . A A . 56 LEU CD2 1 1 5 4902 1 1 21 LEU CG C -5.112 -6.086 2.290 1.00 . A A . 56 LEU CG 1 1 5 4903 1 1 21 LEU H H -8.574 -4.198 1.289 1.00 . A A . 56 LEU H 1 1 5 4904 1 1 21 LEU HA H -7.876 -6.072 3.404 1.00 . A A . 56 LEU HA 1 1 5 4905 1 1 21 LEU HB2 H -6.878 -6.618 1.247 1.00 . A A . 56 LEU HB2 1 1 5 4906 1 1 21 LEU HB3 H -6.393 -4.963 1.008 1.00 . A A . 56 LEU HB3 1 1 5 4907 1 1 21 LEU HD11 H -4.346 -6.548 0.384 1.00 . A A . 56 LEU HD11 1 1 5 4908 1 1 21 LEU HD12 H -5.051 -7.930 1.237 1.00 . A A . 56 LEU HD12 1 1 5 4909 1 1 21 LEU HD13 H -3.475 -7.288 1.719 1.00 . A A . 56 LEU HD13 1 1 5 4910 1 1 21 LEU HD21 H -3.285 -5.081 2.803 1.00 . A A . 56 LEU HD21 1 1 5 4911 1 1 21 LEU HD22 H -4.738 -4.104 2.999 1.00 . A A . 56 LEU HD22 1 1 5 4912 1 1 21 LEU HD23 H -4.106 -4.427 1.385 1.00 . A A . 56 LEU HD23 1 1 5 4913 1 1 21 LEU HG H -5.179 -6.530 3.271 1.00 . A A . 56 LEU HG 1 1 5 4914 1 1 21 LEU N N -8.731 -4.876 1.985 1.00 . A A . 56 LEU N 1 1 5 4915 1 1 21 LEU O O -7.612 -2.937 3.271 1.00 . A A . 56 LEU O 1 1 5 4916 1 1 22 VAL C C -4.512 -3.347 5.718 1.00 . A A . 57 VAL C 1 1 5 4917 1 1 22 VAL CA C -5.992 -3.191 5.378 1.00 . A A . 57 VAL CA 1 1 5 4918 1 1 22 VAL CB C -6.887 -2.982 6.642 1.00 . A A . 57 VAL CB 1 1 5 4919 1 1 22 VAL CG1 C -7.107 -4.270 7.411 1.00 . A A . 57 VAL CG1 1 1 5 4920 1 1 22 VAL CG2 C -6.317 -1.911 7.543 1.00 . A A . 57 VAL CG2 1 1 5 4921 1 1 22 VAL H H -6.187 -5.183 4.827 1.00 . A A . 57 VAL H 1 1 5 4922 1 1 22 VAL HA H -6.080 -2.311 4.758 1.00 . A A . 57 VAL HA 1 1 5 4923 1 1 22 VAL HB H -7.854 -2.649 6.296 1.00 . A A . 57 VAL HB 1 1 5 4924 1 1 22 VAL HG11 H -7.637 -4.968 6.780 1.00 . A A . 57 VAL HG11 1 1 5 4925 1 1 22 VAL HG12 H -7.689 -4.067 8.298 1.00 . A A . 57 VAL HG12 1 1 5 4926 1 1 22 VAL HG13 H -6.150 -4.689 7.684 1.00 . A A . 57 VAL HG13 1 1 5 4927 1 1 22 VAL HG21 H -6.286 -0.974 7.006 1.00 . A A . 57 VAL HG21 1 1 5 4928 1 1 22 VAL HG22 H -5.311 -2.184 7.821 1.00 . A A . 57 VAL HG22 1 1 5 4929 1 1 22 VAL HG23 H -6.931 -1.805 8.425 1.00 . A A . 57 VAL HG23 1 1 5 4930 1 1 22 VAL N N -6.452 -4.271 4.585 1.00 . A A . 57 VAL N 1 1 5 4931 1 1 22 VAL O O -4.120 -4.242 6.476 1.00 . A A . 57 VAL O 1 1 5 4932 1 1 23 ALA C C -1.947 -1.323 6.229 1.00 . A A . 58 ALA C 1 1 5 4933 1 1 23 ALA CA C -2.268 -2.550 5.421 1.00 . A A . 58 ALA CA 1 1 5 4934 1 1 23 ALA CB C -1.437 -2.564 4.116 1.00 . A A . 58 ALA CB 1 1 5 4935 1 1 23 ALA H H -4.057 -1.811 4.543 1.00 . A A . 58 ALA H 1 1 5 4936 1 1 23 ALA HA H -2.064 -3.442 5.994 1.00 . A A . 58 ALA HA 1 1 5 4937 1 1 23 ALA HB1 H -0.381 -2.649 4.329 1.00 . A A . 58 ALA HB1 1 1 5 4938 1 1 23 ALA HB2 H -1.572 -1.634 3.577 1.00 . A A . 58 ALA HB2 1 1 5 4939 1 1 23 ALA HB3 H -1.729 -3.379 3.467 1.00 . A A . 58 ALA HB3 1 1 5 4940 1 1 23 ALA N N -3.686 -2.510 5.129 1.00 . A A . 58 ALA N 1 1 5 4941 1 1 23 ALA O O -2.352 -0.240 5.855 1.00 . A A . 58 ALA O 1 1 5 4942 1 1 24 ASP C C -1.998 0.497 8.625 1.00 . A A . 59 ASP C 1 1 5 4943 1 1 24 ASP CA C -0.808 -0.378 8.229 1.00 . A A . 59 ASP CA 1 1 5 4944 1 1 24 ASP CB C 0.318 0.514 7.727 1.00 . A A . 59 ASP CB 1 1 5 4945 1 1 24 ASP CG C 1.360 -0.142 6.828 1.00 . A A . 59 ASP CG 1 1 5 4946 1 1 24 ASP H H -0.825 -2.387 7.476 1.00 . A A . 59 ASP H 1 1 5 4947 1 1 24 ASP HA H -0.481 -0.868 9.134 1.00 . A A . 59 ASP HA 1 1 5 4948 1 1 24 ASP HB2 H -0.093 1.452 7.393 1.00 . A A . 59 ASP HB2 1 1 5 4949 1 1 24 ASP HB3 H 0.849 0.743 8.643 1.00 . A A . 59 ASP HB3 1 1 5 4950 1 1 24 ASP N N -1.174 -1.488 7.294 1.00 . A A . 59 ASP N 1 1 5 4951 1 1 24 ASP O O -1.878 1.732 8.734 1.00 . A A . 59 ASP O 1 1 5 4952 1 1 24 ASP OD1 O 1.722 -1.338 7.049 1.00 . A A . 59 ASP OD1 1 1 5 4953 1 1 24 ASP OD2 O 1.869 0.544 5.923 1.00 . A A . 59 ASP OD2 1 1 5 4954 1 1 25 LYS C C -5.063 1.271 8.003 1.00 . A A . 60 LYS C 1 1 5 4955 1 1 25 LYS CA C -4.417 0.471 9.171 1.00 . A A . 60 LYS CA 1 1 5 4956 1 1 25 LYS CB C -4.323 1.272 10.484 1.00 . A A . 60 LYS CB 1 1 5 4957 1 1 25 LYS CD C -5.523 2.172 12.532 1.00 . A A . 60 LYS CD 1 1 5 4958 1 1 25 LYS CE C -4.879 3.552 12.546 1.00 . A A . 60 LYS CE 1 1 5 4959 1 1 25 LYS CG C -5.675 1.597 11.125 1.00 . A A . 60 LYS CG 1 1 5 4960 1 1 25 LYS H H -3.112 -1.113 8.653 1.00 . A A . 60 LYS H 1 1 5 4961 1 1 25 LYS HA H -5.078 -0.365 9.333 1.00 . A A . 60 LYS HA 1 1 5 4962 1 1 25 LYS HB2 H -3.719 0.725 11.194 1.00 . A A . 60 LYS HB2 1 1 5 4963 1 1 25 LYS HB3 H -3.834 2.198 10.234 1.00 . A A . 60 LYS HB3 1 1 5 4964 1 1 25 LYS HD2 H -6.498 2.242 12.988 1.00 . A A . 60 LYS HD2 1 1 5 4965 1 1 25 LYS HD3 H -4.915 1.493 13.113 1.00 . A A . 60 LYS HD3 1 1 5 4966 1 1 25 LYS HE2 H -4.711 3.845 13.572 1.00 . A A . 60 LYS HE2 1 1 5 4967 1 1 25 LYS HE3 H -3.930 3.497 12.034 1.00 . A A . 60 LYS HE3 1 1 5 4968 1 1 25 LYS HG2 H -6.189 2.321 10.509 1.00 . A A . 60 LYS HG2 1 1 5 4969 1 1 25 LYS HG3 H -6.260 0.690 11.171 1.00 . A A . 60 LYS HG3 1 1 5 4970 1 1 25 LYS HZ1 H -5.262 5.512 11.985 1.00 . A A . 60 LYS HZ1 1 1 5 4971 1 1 25 LYS HZ2 H -6.665 4.651 12.328 1.00 . A A . 60 LYS HZ2 1 1 5 4972 1 1 25 LYS HZ3 H -5.842 4.394 10.880 1.00 . A A . 60 LYS HZ3 1 1 5 4973 1 1 25 LYS N N -3.136 -0.144 8.797 1.00 . A A . 60 LYS N 1 1 5 4974 1 1 25 LYS NZ N -5.721 4.582 11.895 1.00 . A A . 60 LYS NZ 1 1 5 4975 1 1 25 LYS O O -6.192 1.757 8.106 1.00 . A A . 60 LYS O 1 1 5 4976 1 1 26 LEU C C -5.785 0.944 4.982 1.00 . A A . 61 LEU C 1 1 5 4977 1 1 26 LEU CA C -4.905 1.966 5.684 1.00 . A A . 61 LEU CA 1 1 5 4978 1 1 26 LEU CB C -3.787 2.372 4.750 1.00 . A A . 61 LEU CB 1 1 5 4979 1 1 26 LEU CD1 C -1.624 3.512 4.307 1.00 . A A . 61 LEU CD1 1 1 5 4980 1 1 26 LEU CD2 C -3.377 4.672 5.623 1.00 . A A . 61 LEU CD2 1 1 5 4981 1 1 26 LEU CG C -2.745 3.332 5.305 1.00 . A A . 61 LEU CG 1 1 5 4982 1 1 26 LEU H H -3.438 1.013 6.859 1.00 . A A . 61 LEU H 1 1 5 4983 1 1 26 LEU HA H -5.491 2.828 5.943 1.00 . A A . 61 LEU HA 1 1 5 4984 1 1 26 LEU HB2 H -3.300 1.457 4.464 1.00 . A A . 61 LEU HB2 1 1 5 4985 1 1 26 LEU HB3 H -4.236 2.813 3.872 1.00 . A A . 61 LEU HB3 1 1 5 4986 1 1 26 LEU HD11 H -1.195 2.549 4.068 1.00 . A A . 61 LEU HD11 1 1 5 4987 1 1 26 LEU HD12 H -0.864 4.150 4.732 1.00 . A A . 61 LEU HD12 1 1 5 4988 1 1 26 LEU HD13 H -2.019 3.965 3.410 1.00 . A A . 61 LEU HD13 1 1 5 4989 1 1 26 LEU HD21 H -3.812 5.088 4.726 1.00 . A A . 61 LEU HD21 1 1 5 4990 1 1 26 LEU HD22 H -2.616 5.343 5.994 1.00 . A A . 61 LEU HD22 1 1 5 4991 1 1 26 LEU HD23 H -4.144 4.543 6.372 1.00 . A A . 61 LEU HD23 1 1 5 4992 1 1 26 LEU HG H -2.331 2.925 6.216 1.00 . A A . 61 LEU HG 1 1 5 4993 1 1 26 LEU N N -4.361 1.364 6.890 1.00 . A A . 61 LEU N 1 1 5 4994 1 1 26 LEU O O -5.371 -0.203 4.792 1.00 . A A . 61 LEU O 1 1 5 4995 1 1 27 ILE C C -7.771 0.519 2.462 1.00 . A A . 62 ILE C 1 1 5 4996 1 1 27 ILE CA C -7.887 0.409 3.975 1.00 . A A . 62 ILE CA 1 1 5 4997 1 1 27 ILE CB C -9.361 0.723 4.356 1.00 . A A . 62 ILE CB 1 1 5 4998 1 1 27 ILE CD1 C -9.287 -0.261 6.736 1.00 . A A . 62 ILE CD1 1 1 5 4999 1 1 27 ILE CG1 C -9.552 0.944 5.868 1.00 . A A . 62 ILE CG1 1 1 5 5000 1 1 27 ILE CG2 C -10.232 -0.406 3.911 1.00 . A A . 62 ILE CG2 1 1 5 5001 1 1 27 ILE H H -7.241 2.278 4.652 1.00 . A A . 62 ILE H 1 1 5 5002 1 1 27 ILE HA H -7.634 -0.591 4.298 1.00 . A A . 62 ILE HA 1 1 5 5003 1 1 27 ILE HB H -9.668 1.612 3.827 1.00 . A A . 62 ILE HB 1 1 5 5004 1 1 27 ILE HD11 H -9.446 -0.005 7.774 1.00 . A A . 62 ILE HD11 1 1 5 5005 1 1 27 ILE HD12 H -8.265 -0.577 6.595 1.00 . A A . 62 ILE HD12 1 1 5 5006 1 1 27 ILE HD13 H -9.953 -1.063 6.454 1.00 . A A . 62 ILE HD13 1 1 5 5007 1 1 27 ILE HG12 H -8.866 1.714 6.175 1.00 . A A . 62 ILE HG12 1 1 5 5008 1 1 27 ILE HG13 H -10.563 1.277 6.049 1.00 . A A . 62 ILE HG13 1 1 5 5009 1 1 27 ILE HG21 H -10.145 -0.538 2.843 1.00 . A A . 62 ILE HG21 1 1 5 5010 1 1 27 ILE HG22 H -11.249 -0.202 4.208 1.00 . A A . 62 ILE HG22 1 1 5 5011 1 1 27 ILE HG23 H -9.869 -1.287 4.420 1.00 . A A . 62 ILE HG23 1 1 5 5012 1 1 27 ILE N N -6.964 1.341 4.576 1.00 . A A . 62 ILE N 1 1 5 5013 1 1 27 ILE O O -7.918 1.611 1.907 1.00 . A A . 62 ILE O 1 1 5 5014 1 1 28 PHE C C -7.433 -1.969 -0.272 1.00 . A A . 63 PHE C 1 1 5 5015 1 1 28 PHE CA C -7.329 -0.620 0.375 1.00 . A A . 63 PHE CA 1 1 5 5016 1 1 28 PHE CB C -6.185 0.213 -0.173 1.00 . A A . 63 PHE CB 1 1 5 5017 1 1 28 PHE CD1 C -4.266 -1.198 0.684 1.00 . A A . 63 PHE CD1 1 1 5 5018 1 1 28 PHE CD2 C -4.214 1.153 0.911 1.00 . A A . 63 PHE CD2 1 1 5 5019 1 1 28 PHE CE1 C -3.037 -1.267 1.302 1.00 . A A . 63 PHE CE1 1 1 5 5020 1 1 28 PHE CE2 C -3.012 1.081 1.509 1.00 . A A . 63 PHE CE2 1 1 5 5021 1 1 28 PHE CG C -4.863 0.036 0.486 1.00 . A A . 63 PHE CG 1 1 5 5022 1 1 28 PHE CZ C -2.410 -0.114 1.712 1.00 . A A . 63 PHE CZ 1 1 5 5023 1 1 28 PHE H H -7.329 -1.414 2.320 1.00 . A A . 63 PHE H 1 1 5 5024 1 1 28 PHE HA H -8.234 -0.126 0.055 1.00 . A A . 63 PHE HA 1 1 5 5025 1 1 28 PHE HB2 H -6.072 0.143 -1.243 1.00 . A A . 63 PHE HB2 1 1 5 5026 1 1 28 PHE HB3 H -6.459 1.227 0.084 1.00 . A A . 63 PHE HB3 1 1 5 5027 1 1 28 PHE HD1 H -4.745 -2.113 0.365 1.00 . A A . 63 PHE HD1 1 1 5 5028 1 1 28 PHE HD2 H -4.675 2.117 0.757 1.00 . A A . 63 PHE HD2 1 1 5 5029 1 1 28 PHE HE1 H -2.565 -2.225 1.459 1.00 . A A . 63 PHE HE1 1 1 5 5030 1 1 28 PHE HE2 H -2.527 1.990 1.819 1.00 . A A . 63 PHE HE2 1 1 5 5031 1 1 28 PHE HZ H -1.437 -0.117 2.185 1.00 . A A . 63 PHE HZ 1 1 5 5032 1 1 28 PHE N N -7.454 -0.579 1.812 1.00 . A A . 63 PHE N 1 1 5 5033 1 1 28 PHE O O -7.458 -2.982 0.385 1.00 . A A . 63 PHE O 1 1 5 5034 1 1 29 HIS C C -6.227 -3.763 -2.388 1.00 . A A . 64 HIS C 1 1 5 5035 1 1 29 HIS CA C -7.594 -3.105 -2.424 1.00 . A A . 64 HIS CA 1 1 5 5036 1 1 29 HIS CB C -7.868 -2.673 -3.877 1.00 . A A . 64 HIS CB 1 1 5 5037 1 1 29 HIS CD2 C -10.307 -2.068 -4.397 1.00 . A A . 64 HIS CD2 1 1 5 5038 1 1 29 HIS CE1 C -10.131 0.093 -4.160 1.00 . A A . 64 HIS CE1 1 1 5 5039 1 1 29 HIS CG C -9.035 -1.765 -4.069 1.00 . A A . 64 HIS CG 1 1 5 5040 1 1 29 HIS H H -7.651 -1.070 -2.017 1.00 . A A . 64 HIS H 1 1 5 5041 1 1 29 HIS HA H -8.368 -3.782 -2.096 1.00 . A A . 64 HIS HA 1 1 5 5042 1 1 29 HIS HB2 H -7.022 -2.122 -4.250 1.00 . A A . 64 HIS HB2 1 1 5 5043 1 1 29 HIS HB3 H -8.023 -3.547 -4.490 1.00 . A A . 64 HIS HB3 1 1 5 5044 1 1 29 HIS HD2 H -10.690 -3.061 -4.566 1.00 . A A . 64 HIS HD2 1 1 5 5045 1 1 29 HIS HE1 H -10.391 1.139 -4.100 1.00 . A A . 64 HIS HE1 1 1 5 5046 1 1 29 HIS HE2 H -11.974 -0.767 -4.556 1.00 . A A . 64 HIS HE2 1 1 5 5047 1 1 29 HIS N N -7.553 -1.934 -1.575 1.00 . A A . 64 HIS N 1 1 5 5048 1 1 29 HIS ND1 N -8.931 -0.387 -3.917 1.00 . A A . 64 HIS ND1 1 1 5 5049 1 1 29 HIS NE2 N -11.001 -0.881 -4.453 1.00 . A A . 64 HIS NE2 1 1 5 5050 1 1 29 HIS O O -5.187 -3.093 -2.417 1.00 . A A . 64 HIS O 1 1 5 5051 1 1 30 ASN C C -4.213 -5.731 -3.535 1.00 . A A . 65 ASN C 1 1 5 5052 1 1 30 ASN CA C -5.049 -5.858 -2.264 1.00 . A A . 65 ASN CA 1 1 5 5053 1 1 30 ASN CB C -5.386 -7.328 -1.958 1.00 . A A . 65 ASN CB 1 1 5 5054 1 1 30 ASN CG C -6.451 -7.934 -2.853 1.00 . A A . 65 ASN CG 1 1 5 5055 1 1 30 ASN H H -7.089 -5.541 -2.251 1.00 . A A . 65 ASN H 1 1 5 5056 1 1 30 ASN HA H -4.455 -5.482 -1.446 1.00 . A A . 65 ASN HA 1 1 5 5057 1 1 30 ASN HB2 H -4.489 -7.902 -2.089 1.00 . A A . 65 ASN HB2 1 1 5 5058 1 1 30 ASN HB3 H -5.713 -7.410 -0.932 1.00 . A A . 65 ASN HB3 1 1 5 5059 1 1 30 ASN HD21 H -7.868 -7.545 -1.496 1.00 . A A . 65 ASN HD21 1 1 5 5060 1 1 30 ASN HD22 H -8.401 -8.310 -2.940 1.00 . A A . 65 ASN HD22 1 1 5 5061 1 1 30 ASN N N -6.238 -5.062 -2.299 1.00 . A A . 65 ASN N 1 1 5 5062 1 1 30 ASN ND2 N -7.688 -7.927 -2.384 1.00 . A A . 65 ASN ND2 1 1 5 5063 1 1 30 ASN O O -3.003 -5.857 -3.490 1.00 . A A . 65 ASN O 1 1 5 5064 1 1 30 ASN OD1 O -6.161 -8.454 -3.934 1.00 . A A . 65 ASN OD1 1 1 5 5065 1 1 31 SER C C -3.552 -4.062 -6.242 1.00 . A A . 66 SER C 1 1 5 5066 1 1 31 SER CA C -4.220 -5.434 -5.943 1.00 . A A . 66 SER CA 1 1 5 5067 1 1 31 SER CB C -5.231 -5.763 -7.026 1.00 . A A . 66 SER CB 1 1 5 5068 1 1 31 SER H H -5.848 -5.468 -4.638 1.00 . A A . 66 SER H 1 1 5 5069 1 1 31 SER HA H -3.455 -6.193 -5.997 1.00 . A A . 66 SER HA 1 1 5 5070 1 1 31 SER HB2 H -4.755 -5.621 -7.984 1.00 . A A . 66 SER HB2 1 1 5 5071 1 1 31 SER HB3 H -5.543 -6.793 -6.930 1.00 . A A . 66 SER HB3 1 1 5 5072 1 1 31 SER HG H -7.075 -5.397 -6.466 1.00 . A A . 66 SER HG 1 1 5 5073 1 1 31 SER N N -4.871 -5.545 -4.652 1.00 . A A . 66 SER N 1 1 5 5074 1 1 31 SER O O -2.767 -3.956 -7.198 1.00 . A A . 66 SER O 1 1 5 5075 1 1 31 SER OG O -6.370 -4.920 -6.920 1.00 . A A . 66 SER OG 1 1 5 5076 1 1 32 CYS C C -2.173 -1.080 -5.406 1.00 . A A . 67 CYS C 1 1 5 5077 1 1 32 CYS CA C -3.450 -1.694 -5.939 1.00 . A A . 67 CYS CA 1 1 5 5078 1 1 32 CYS CB C -4.610 -0.713 -5.822 1.00 . A A . 67 CYS CB 1 1 5 5079 1 1 32 CYS H H -4.205 -3.151 -4.559 1.00 . A A . 67 CYS H 1 1 5 5080 1 1 32 CYS HA H -3.285 -1.828 -6.998 1.00 . A A . 67 CYS HA 1 1 5 5081 1 1 32 CYS HB2 H -4.224 0.279 -6.001 1.00 . A A . 67 CYS HB2 1 1 5 5082 1 1 32 CYS HB3 H -5.379 -0.959 -6.537 1.00 . A A . 67 CYS HB3 1 1 5 5083 1 1 32 CYS N N -3.811 -3.026 -5.452 1.00 . A A . 67 CYS N 1 1 5 5084 1 1 32 CYS O O -1.602 -0.197 -6.067 1.00 . A A . 67 CYS O 1 1 5 5085 1 1 32 CYS SG S -5.346 -0.599 -4.203 1.00 . A A . 67 CYS SG 1 1 5 5086 1 1 33 PHE C C 0.758 -1.331 -4.283 1.00 . A A . 68 PHE C 1 1 5 5087 1 1 33 PHE CA C -0.545 -0.807 -3.731 1.00 . A A . 68 PHE CA 1 1 5 5088 1 1 33 PHE CB C -0.531 -0.652 -2.198 1.00 . A A . 68 PHE CB 1 1 5 5089 1 1 33 PHE CD1 C -1.784 -2.704 -1.408 1.00 . A A . 68 PHE CD1 1 1 5 5090 1 1 33 PHE CD2 C 0.296 -2.156 -0.402 1.00 . A A . 68 PHE CD2 1 1 5 5091 1 1 33 PHE CE1 C -1.903 -3.796 -0.560 1.00 . A A . 68 PHE CE1 1 1 5 5092 1 1 33 PHE CE2 C 0.184 -3.229 0.448 1.00 . A A . 68 PHE CE2 1 1 5 5093 1 1 33 PHE CG C -0.678 -1.876 -1.335 1.00 . A A . 68 PHE CG 1 1 5 5094 1 1 33 PHE CZ C -0.910 -4.051 0.374 1.00 . A A . 68 PHE CZ 1 1 5 5095 1 1 33 PHE H H -2.082 -2.250 -3.779 1.00 . A A . 68 PHE H 1 1 5 5096 1 1 33 PHE HA H -0.631 0.183 -4.158 1.00 . A A . 68 PHE HA 1 1 5 5097 1 1 33 PHE HB2 H 0.494 -0.397 -1.981 1.00 . A A . 68 PHE HB2 1 1 5 5098 1 1 33 PHE HB3 H -1.207 0.120 -1.861 1.00 . A A . 68 PHE HB3 1 1 5 5099 1 1 33 PHE HD1 H -2.545 -2.488 -2.143 1.00 . A A . 68 PHE HD1 1 1 5 5100 1 1 33 PHE HD2 H 1.157 -1.506 -0.356 1.00 . A A . 68 PHE HD2 1 1 5 5101 1 1 33 PHE HE1 H -2.774 -4.433 -0.616 1.00 . A A . 68 PHE HE1 1 1 5 5102 1 1 33 PHE HE2 H 0.952 -3.427 1.180 1.00 . A A . 68 PHE HE2 1 1 5 5103 1 1 33 PHE HZ H -0.971 -4.888 1.055 1.00 . A A . 68 PHE HZ 1 1 5 5104 1 1 33 PHE N N -1.693 -1.490 -4.257 1.00 . A A . 68 PHE N 1 1 5 5105 1 1 33 PHE O O 1.298 -2.337 -3.831 1.00 . A A . 68 PHE O 1 1 5 5106 1 1 34 CYS C C 3.365 0.232 -5.632 1.00 . A A . 69 CYS C 1 1 5 5107 1 1 34 CYS CA C 2.443 -0.930 -5.949 1.00 . A A . 69 CYS CA 1 1 5 5108 1 1 34 CYS CB C 2.238 -1.035 -7.463 1.00 . A A . 69 CYS CB 1 1 5 5109 1 1 34 CYS H H 0.643 0.052 -5.655 1.00 . A A . 69 CYS H 1 1 5 5110 1 1 34 CYS HA H 2.851 -1.855 -5.572 1.00 . A A . 69 CYS HA 1 1 5 5111 1 1 34 CYS HB2 H 2.044 -0.069 -7.903 1.00 . A A . 69 CYS HB2 1 1 5 5112 1 1 34 CYS HB3 H 3.168 -1.394 -7.872 1.00 . A A . 69 CYS HB3 1 1 5 5113 1 1 34 CYS HG H -0.169 -1.832 -7.350 1.00 . A A . 69 CYS HG 1 1 5 5114 1 1 34 CYS N N 1.198 -0.673 -5.306 1.00 . A A . 69 CYS N 1 1 5 5115 1 1 34 CYS O O 2.918 1.245 -5.085 1.00 . A A . 69 CYS O 1 1 5 5116 1 1 34 CYS SG S 0.949 -2.207 -7.958 1.00 . A A . 69 CYS SG 1 1 5 5117 1 1 35 CYS C C 5.342 2.291 -6.652 1.00 . A A . 70 CYS C 1 1 5 5118 1 1 35 CYS CA C 5.594 1.137 -5.711 1.00 . A A . 70 CYS CA 1 1 5 5119 1 1 35 CYS CB C 7.011 0.574 -5.834 1.00 . A A . 70 CYS CB 1 1 5 5120 1 1 35 CYS H H 4.916 -0.747 -6.374 1.00 . A A . 70 CYS H 1 1 5 5121 1 1 35 CYS HA H 5.440 1.475 -4.697 1.00 . A A . 70 CYS HA 1 1 5 5122 1 1 35 CYS HB2 H 7.151 -0.034 -4.957 1.00 . A A . 70 CYS HB2 1 1 5 5123 1 1 35 CYS HB3 H 7.070 -0.034 -6.723 1.00 . A A . 70 CYS HB3 1 1 5 5124 1 1 35 CYS N N 4.630 0.088 -5.948 1.00 . A A . 70 CYS N 1 1 5 5125 1 1 35 CYS O O 4.994 2.125 -7.827 1.00 . A A . 70 CYS O 1 1 5 5126 1 1 35 CYS SG S 8.422 1.719 -5.808 1.00 . A A . 70 CYS SG 1 1 5 5127 1 1 36 LYS C C 6.350 4.985 -7.777 1.00 . A A . 71 LYS C 1 1 5 5128 1 1 36 LYS CA C 5.204 4.655 -6.823 1.00 . A A . 71 LYS CA 1 1 5 5129 1 1 36 LYS CB C 4.957 5.801 -5.849 1.00 . A A . 71 LYS CB 1 1 5 5130 1 1 36 LYS CD C 2.793 6.987 -6.644 1.00 . A A . 71 LYS CD 1 1 5 5131 1 1 36 LYS CE C 2.399 6.050 -7.744 1.00 . A A . 71 LYS CE 1 1 5 5132 1 1 36 LYS CG C 4.315 7.065 -6.448 1.00 . A A . 71 LYS CG 1 1 5 5133 1 1 36 LYS H H 5.698 3.451 -5.154 1.00 . A A . 71 LYS H 1 1 5 5134 1 1 36 LYS HA H 4.315 4.507 -7.407 1.00 . A A . 71 LYS HA 1 1 5 5135 1 1 36 LYS HB2 H 4.354 5.457 -5.022 1.00 . A A . 71 LYS HB2 1 1 5 5136 1 1 36 LYS HB3 H 5.928 6.070 -5.472 1.00 . A A . 71 LYS HB3 1 1 5 5137 1 1 36 LYS HD2 H 2.352 6.625 -5.727 1.00 . A A . 71 LYS HD2 1 1 5 5138 1 1 36 LYS HD3 H 2.417 7.976 -6.860 1.00 . A A . 71 LYS HD3 1 1 5 5139 1 1 36 LYS HE2 H 3.096 6.272 -8.534 1.00 . A A . 71 LYS HE2 1 1 5 5140 1 1 36 LYS HE3 H 2.535 5.035 -7.399 1.00 . A A . 71 LYS HE3 1 1 5 5141 1 1 36 LYS HG2 H 4.520 7.935 -5.855 1.00 . A A . 71 LYS HG2 1 1 5 5142 1 1 36 LYS HG3 H 4.765 7.204 -7.419 1.00 . A A . 71 LYS HG3 1 1 5 5143 1 1 36 LYS HZ1 H 0.341 6.118 -7.367 1.00 . A A . 71 LYS HZ1 1 1 5 5144 1 1 36 LYS HZ2 H 0.730 5.554 -8.904 1.00 . A A . 71 LYS HZ2 1 1 5 5145 1 1 36 LYS HZ3 H 0.860 7.198 -8.552 1.00 . A A . 71 LYS HZ3 1 1 5 5146 1 1 36 LYS N N 5.465 3.447 -6.109 1.00 . A A . 71 LYS N 1 1 5 5147 1 1 36 LYS NZ N 0.993 6.241 -8.169 1.00 . A A . 71 LYS NZ 1 1 5 5148 1 1 36 LYS O O 6.165 5.700 -8.745 1.00 . A A . 71 LYS O 1 1 5 5149 1 1 37 HIS C C 8.791 3.624 -9.460 1.00 . A A . 72 HIS C 1 1 5 5150 1 1 37 HIS CA C 8.660 4.714 -8.378 1.00 . A A . 72 HIS CA 1 1 5 5151 1 1 37 HIS CB C 9.941 4.856 -7.550 1.00 . A A . 72 HIS CB 1 1 5 5152 1 1 37 HIS CD2 C 12.041 4.918 -9.071 1.00 . A A . 72 HIS CD2 1 1 5 5153 1 1 37 HIS CE1 C 12.479 7.038 -8.870 1.00 . A A . 72 HIS CE1 1 1 5 5154 1 1 37 HIS CG C 11.100 5.485 -8.285 1.00 . A A . 72 HIS CG 1 1 5 5155 1 1 37 HIS H H 7.618 3.845 -6.743 1.00 . A A . 72 HIS H 1 1 5 5156 1 1 37 HIS HA H 8.452 5.652 -8.871 1.00 . A A . 72 HIS HA 1 1 5 5157 1 1 37 HIS HB2 H 9.718 5.481 -6.699 1.00 . A A . 72 HIS HB2 1 1 5 5158 1 1 37 HIS HB3 H 10.246 3.880 -7.205 1.00 . A A . 72 HIS HB3 1 1 5 5159 1 1 37 HIS HD2 H 12.101 3.879 -9.360 1.00 . A A . 72 HIS HD2 1 1 5 5160 1 1 37 HIS HE1 H 12.987 7.988 -8.939 1.00 . A A . 72 HIS HE1 1 1 5 5161 1 1 37 HIS HE2 H 13.494 5.889 -10.222 1.00 . A A . 72 HIS HE2 1 1 5 5162 1 1 37 HIS N N 7.523 4.437 -7.519 1.00 . A A . 72 HIS N 1 1 5 5163 1 1 37 HIS ND1 N 11.374 6.830 -8.163 1.00 . A A . 72 HIS ND1 1 1 5 5164 1 1 37 HIS NE2 N 12.908 5.916 -9.434 1.00 . A A . 72 HIS NE2 1 1 5 5165 1 1 37 HIS O O 9.238 3.895 -10.578 1.00 . A A . 72 HIS O 1 1 5 5166 1 1 38 CYS C C 7.100 0.550 -9.827 1.00 . A A . 73 CYS C 1 1 5 5167 1 1 38 CYS CA C 8.380 1.324 -10.072 1.00 . A A . 73 CYS CA 1 1 5 5168 1 1 38 CYS CB C 9.602 0.427 -9.860 1.00 . A A . 73 CYS CB 1 1 5 5169 1 1 38 CYS H H 8.038 2.195 -8.243 1.00 . A A . 73 CYS H 1 1 5 5170 1 1 38 CYS HA H 8.434 1.781 -11.047 1.00 . A A . 73 CYS HA 1 1 5 5171 1 1 38 CYS HB2 H 9.795 -0.170 -10.730 1.00 . A A . 73 CYS HB2 1 1 5 5172 1 1 38 CYS HB3 H 10.410 1.128 -9.777 1.00 . A A . 73 CYS HB3 1 1 5 5173 1 1 38 CYS N N 8.388 2.402 -9.130 1.00 . A A . 73 CYS N 1 1 5 5174 1 1 38 CYS O O 6.801 0.272 -8.687 1.00 . A A . 73 CYS O 1 1 5 5175 1 1 38 CYS SG S 9.614 -0.653 -8.396 1.00 . A A . 73 CYS SG 1 1 5 5176 1 1 39 HIS C C 5.204 -1.991 -10.253 1.00 . A A . 74 HIS C 1 1 5 5177 1 1 39 HIS CA C 5.055 -0.493 -10.532 1.00 . A A . 74 HIS CA 1 1 5 5178 1 1 39 HIS CB C 3.910 -0.173 -11.527 1.00 . A A . 74 HIS CB 1 1 5 5179 1 1 39 HIS CD2 C 4.181 -1.683 -13.642 1.00 . A A . 74 HIS CD2 1 1 5 5180 1 1 39 HIS CE1 C 4.365 -0.098 -15.127 1.00 . A A . 74 HIS CE1 1 1 5 5181 1 1 39 HIS CG C 4.133 -0.500 -12.983 1.00 . A A . 74 HIS CG 1 1 5 5182 1 1 39 HIS H H 6.643 0.334 -11.750 1.00 . A A . 74 HIS H 1 1 5 5183 1 1 39 HIS HA H 4.769 -0.097 -9.563 1.00 . A A . 74 HIS HA 1 1 5 5184 1 1 39 HIS HB2 H 3.047 -0.738 -11.207 1.00 . A A . 74 HIS HB2 1 1 5 5185 1 1 39 HIS HB3 H 3.680 0.878 -11.440 1.00 . A A . 74 HIS HB3 1 1 5 5186 1 1 39 HIS HD1 H 4.242 1.436 -13.784 1.00 . A A . 74 HIS HD1 1 1 5 5187 1 1 39 HIS HD2 H 4.115 -2.666 -13.195 1.00 . A A . 74 HIS HD2 1 1 5 5188 1 1 39 HIS HE1 H 4.474 0.427 -16.064 1.00 . A A . 74 HIS HE1 1 1 5 5189 1 1 39 HIS HE2 H 4.070 -2.036 -15.678 1.00 . A A . 74 HIS HE2 1 1 5 5190 1 1 39 HIS N N 6.338 0.187 -10.827 1.00 . A A . 74 HIS N 1 1 5 5191 1 1 39 HIS ND1 N 4.254 0.467 -13.949 1.00 . A A . 74 HIS ND1 1 1 5 5192 1 1 39 HIS NE2 N 4.326 -1.402 -14.971 1.00 . A A . 74 HIS NE2 1 1 5 5193 1 1 39 HIS O O 4.603 -2.840 -10.904 1.00 . A A . 74 HIS O 1 1 5 5194 1 1 40 THR C C 5.065 -3.963 -7.858 1.00 . A A . 75 THR C 1 1 5 5195 1 1 40 THR CA C 6.197 -3.630 -8.833 1.00 . A A . 75 THR CA 1 1 5 5196 1 1 40 THR CB C 7.612 -3.835 -8.182 1.00 . A A . 75 THR CB 1 1 5 5197 1 1 40 THR CG2 C 7.765 -3.032 -6.895 1.00 . A A . 75 THR CG2 1 1 5 5198 1 1 40 THR H H 6.461 -1.538 -8.835 1.00 . A A . 75 THR H 1 1 5 5199 1 1 40 THR HA H 6.100 -4.262 -9.703 1.00 . A A . 75 THR HA 1 1 5 5200 1 1 40 THR HB H 8.352 -3.497 -8.893 1.00 . A A . 75 THR HB 1 1 5 5201 1 1 40 THR HG1 H 7.478 -5.757 -8.606 1.00 . A A . 75 THR HG1 1 1 5 5202 1 1 40 THR HG21 H 8.745 -3.204 -6.473 1.00 . A A . 75 THR HG21 1 1 5 5203 1 1 40 THR HG22 H 7.008 -3.338 -6.189 1.00 . A A . 75 THR HG22 1 1 5 5204 1 1 40 THR HG23 H 7.648 -1.982 -7.115 1.00 . A A . 75 THR HG23 1 1 5 5205 1 1 40 THR N N 6.001 -2.288 -9.276 1.00 . A A . 75 THR N 1 1 5 5206 1 1 40 THR O O 4.696 -3.119 -6.997 1.00 . A A . 75 THR O 1 1 5 5207 1 1 40 THR OG1 O 7.852 -5.222 -7.891 1.00 . A A . 75 THR OG1 1 1 5 5208 1 1 41 LYS C C 3.886 -5.978 -5.849 1.00 . A A . 76 LYS C 1 1 5 5209 1 1 41 LYS CA C 3.341 -5.540 -7.216 1.00 . A A . 76 LYS CA 1 1 5 5210 1 1 41 LYS CB C 2.551 -6.667 -7.944 1.00 . A A . 76 LYS CB 1 1 5 5211 1 1 41 LYS CD C 1.127 -7.757 -6.074 1.00 . A A . 76 LYS CD 1 1 5 5212 1 1 41 LYS CE C 1.722 -9.158 -6.212 1.00 . A A . 76 LYS CE 1 1 5 5213 1 1 41 LYS CG C 1.131 -6.997 -7.403 1.00 . A A . 76 LYS CG 1 1 5 5214 1 1 41 LYS H H 4.793 -5.723 -8.738 1.00 . A A . 76 LYS H 1 1 5 5215 1 1 41 LYS HA H 2.700 -4.682 -7.074 1.00 . A A . 76 LYS HA 1 1 5 5216 1 1 41 LYS HB2 H 2.455 -6.400 -8.985 1.00 . A A . 76 LYS HB2 1 1 5 5217 1 1 41 LYS HB3 H 3.156 -7.557 -7.869 1.00 . A A . 76 LYS HB3 1 1 5 5218 1 1 41 LYS HD2 H 1.710 -7.201 -5.356 1.00 . A A . 76 LYS HD2 1 1 5 5219 1 1 41 LYS HD3 H 0.107 -7.837 -5.726 1.00 . A A . 76 LYS HD3 1 1 5 5220 1 1 41 LYS HE2 H 1.113 -9.736 -6.890 1.00 . A A . 76 LYS HE2 1 1 5 5221 1 1 41 LYS HE3 H 2.723 -9.077 -6.610 1.00 . A A . 76 LYS HE3 1 1 5 5222 1 1 41 LYS HG2 H 0.595 -6.071 -7.263 1.00 . A A . 76 LYS HG2 1 1 5 5223 1 1 41 LYS HG3 H 0.618 -7.587 -8.149 1.00 . A A . 76 LYS HG3 1 1 5 5224 1 1 41 LYS HZ1 H 2.155 -10.827 -5.036 1.00 . A A . 76 LYS HZ1 1 1 5 5225 1 1 41 LYS HZ2 H 0.857 -9.915 -4.454 1.00 . A A . 76 LYS HZ2 1 1 5 5226 1 1 41 LYS HZ3 H 2.437 -9.361 -4.277 1.00 . A A . 76 LYS HZ3 1 1 5 5227 1 1 41 LYS N N 4.457 -5.117 -8.041 1.00 . A A . 76 LYS N 1 1 5 5228 1 1 41 LYS NZ N 1.786 -9.862 -4.914 1.00 . A A . 76 LYS NZ 1 1 5 5229 1 1 41 LYS O O 4.126 -7.147 -5.591 1.00 . A A . 76 LYS O 1 1 5 5230 1 1 42 LEU C C 3.552 -5.419 -2.672 1.00 . A A . 77 LEU C 1 1 5 5231 1 1 42 LEU CA C 4.635 -5.187 -3.680 1.00 . A A . 77 LEU CA 1 1 5 5232 1 1 42 LEU CB C 5.523 -3.997 -3.322 1.00 . A A . 77 LEU CB 1 1 5 5233 1 1 42 LEU CD1 C 3.946 -2.279 -2.207 1.00 . A A . 77 LEU CD1 1 1 5 5234 1 1 42 LEU CD2 C 5.921 -1.578 -3.425 1.00 . A A . 77 LEU CD2 1 1 5 5235 1 1 42 LEU CG C 4.868 -2.588 -3.369 1.00 . A A . 77 LEU CG 1 1 5 5236 1 1 42 LEU H H 3.944 -4.100 -5.355 1.00 . A A . 77 LEU H 1 1 5 5237 1 1 42 LEU HA H 5.258 -6.066 -3.700 1.00 . A A . 77 LEU HA 1 1 5 5238 1 1 42 LEU HB2 H 6.049 -4.132 -2.391 1.00 . A A . 77 LEU HB2 1 1 5 5239 1 1 42 LEU HB3 H 6.240 -3.964 -4.132 1.00 . A A . 77 LEU HB3 1 1 5 5240 1 1 42 LEU HD11 H 3.474 -1.317 -2.365 1.00 . A A . 77 LEU HD11 1 1 5 5241 1 1 42 LEU HD12 H 4.565 -2.219 -1.327 1.00 . A A . 77 LEU HD12 1 1 5 5242 1 1 42 LEU HD13 H 3.205 -3.056 -2.084 1.00 . A A . 77 LEU HD13 1 1 5 5243 1 1 42 LEU HD21 H 5.484 -0.606 -3.599 1.00 . A A . 77 LEU HD21 1 1 5 5244 1 1 42 LEU HD22 H 6.635 -1.828 -4.195 1.00 . A A . 77 LEU HD22 1 1 5 5245 1 1 42 LEU HD23 H 6.419 -1.560 -2.468 1.00 . A A . 77 LEU HD23 1 1 5 5246 1 1 42 LEU HG H 4.297 -2.499 -4.280 1.00 . A A . 77 LEU HG 1 1 5 5247 1 1 42 LEU N N 4.113 -5.006 -5.020 1.00 . A A . 77 LEU N 1 1 5 5248 1 1 42 LEU O O 3.822 -5.621 -1.479 1.00 . A A . 77 LEU O 1 1 5 5249 1 1 43 SER C C 1.242 -6.831 -1.561 1.00 . A A . 78 SER C 1 1 5 5250 1 1 43 SER CA C 1.184 -5.536 -2.368 1.00 . A A . 78 SER CA 1 1 5 5251 1 1 43 SER CB C 0.039 -5.605 -3.319 1.00 . A A . 78 SER CB 1 1 5 5252 1 1 43 SER H H 2.219 -5.194 -4.105 1.00 . A A . 78 SER H 1 1 5 5253 1 1 43 SER HA H 1.023 -4.687 -1.730 1.00 . A A . 78 SER HA 1 1 5 5254 1 1 43 SER HB2 H 0.035 -6.609 -3.697 1.00 . A A . 78 SER HB2 1 1 5 5255 1 1 43 SER HB3 H -0.888 -5.402 -2.802 1.00 . A A . 78 SER HB3 1 1 5 5256 1 1 43 SER HG H 0.520 -3.823 -4.026 1.00 . A A . 78 SER HG 1 1 5 5257 1 1 43 SER N N 2.342 -5.374 -3.153 1.00 . A A . 78 SER N 1 1 5 5258 1 1 43 SER O O 1.662 -7.879 -2.073 1.00 . A A . 78 SER O 1 1 5 5259 1 1 43 SER OG O 0.216 -4.671 -4.380 1.00 . A A . 78 SER OG 1 1 5 5260 1 1 44 LEU C C 1.722 -8.896 0.560 1.00 . A A . 79 LEU C 1 1 5 5261 1 1 44 LEU CA C 0.712 -7.749 0.689 1.00 . A A . 79 LEU CA 1 1 5 5262 1 1 44 LEU CB C -0.709 -8.242 0.770 1.00 . A A . 79 LEU CB 1 1 5 5263 1 1 44 LEU CD1 C -0.528 -9.403 2.966 1.00 . A A . 79 LEU CD1 1 1 5 5264 1 1 44 LEU CD2 C -1.264 -7.052 2.919 1.00 . A A . 79 LEU CD2 1 1 5 5265 1 1 44 LEU CG C -1.289 -8.386 2.185 1.00 . A A . 79 LEU CG 1 1 5 5266 1 1 44 LEU H H 0.553 -5.803 -0.044 1.00 . A A . 79 LEU H 1 1 5 5267 1 1 44 LEU HA H 0.935 -7.272 1.629 1.00 . A A . 79 LEU HA 1 1 5 5268 1 1 44 LEU HB2 H -1.304 -7.542 0.206 1.00 . A A . 79 LEU HB2 1 1 5 5269 1 1 44 LEU HB3 H -0.739 -9.204 0.286 1.00 . A A . 79 LEU HB3 1 1 5 5270 1 1 44 LEU HD11 H -0.559 -10.333 2.422 1.00 . A A . 79 LEU HD11 1 1 5 5271 1 1 44 LEU HD12 H -0.978 -9.502 3.942 1.00 . A A . 79 LEU HD12 1 1 5 5272 1 1 44 LEU HD13 H 0.488 -9.044 3.037 1.00 . A A . 79 LEU HD13 1 1 5 5273 1 1 44 LEU HD21 H -0.246 -6.736 3.090 1.00 . A A . 79 LEU HD21 1 1 5 5274 1 1 44 LEU HD22 H -1.774 -7.149 3.864 1.00 . A A . 79 LEU HD22 1 1 5 5275 1 1 44 LEU HD23 H -1.766 -6.305 2.324 1.00 . A A . 79 LEU HD23 1 1 5 5276 1 1 44 LEU HG H -2.313 -8.720 2.126 1.00 . A A . 79 LEU HG 1 1 5 5277 1 1 44 LEU N N 0.822 -6.703 -0.317 1.00 . A A . 79 LEU N 1 1 5 5278 1 1 44 LEU O O 1.401 -9.982 0.090 1.00 . A A . 79 LEU O 1 1 5 5279 1 1 45 GLY C C 5.187 -9.029 1.574 1.00 . A A . 80 GLY C 1 1 5 5280 1 1 45 GLY CA C 3.955 -9.630 1.002 1.00 . A A . 80 GLY CA 1 1 5 5281 1 1 45 GLY H H 3.124 -7.732 1.304 1.00 . A A . 80 GLY H 1 1 5 5282 1 1 45 GLY HA2 H 3.641 -10.468 1.606 1.00 . A A . 80 GLY HA2 1 1 5 5283 1 1 45 GLY HA3 H 4.158 -9.963 -0.005 1.00 . A A . 80 GLY HA3 1 1 5 5284 1 1 45 GLY N N 2.916 -8.634 0.987 1.00 . A A . 80 GLY N 1 1 5 5285 1 1 45 GLY O O 5.663 -9.423 2.627 1.00 . A A . 80 GLY O 1 1 5 5286 1 1 46 SER C C 6.673 -5.891 0.759 1.00 . A A . 81 SER C 1 1 5 5287 1 1 46 SER CA C 6.803 -7.285 1.336 1.00 . A A . 81 SER CA 1 1 5 5288 1 1 46 SER CB C 8.116 -7.987 0.929 1.00 . A A . 81 SER CB 1 1 5 5289 1 1 46 SER H H 5.242 -7.815 0.047 1.00 . A A . 81 SER H 1 1 5 5290 1 1 46 SER HA H 6.745 -7.216 2.413 1.00 . A A . 81 SER HA 1 1 5 5291 1 1 46 SER HB2 H 8.965 -7.369 1.176 1.00 . A A . 81 SER HB2 1 1 5 5292 1 1 46 SER HB3 H 8.168 -8.913 1.481 1.00 . A A . 81 SER HB3 1 1 5 5293 1 1 46 SER HG H 7.260 -8.585 -0.698 1.00 . A A . 81 SER HG 1 1 5 5294 1 1 46 SER N N 5.670 -8.047 0.900 1.00 . A A . 81 SER N 1 1 5 5295 1 1 46 SER O O 6.813 -5.694 -0.453 1.00 . A A . 81 SER O 1 1 5 5296 1 1 46 SER OG O 8.150 -8.294 -0.460 1.00 . A A . 81 SER OG 1 1 5 5297 1 1 47 TYR C C 6.632 -2.587 2.057 1.00 . A A . 82 TYR C 1 1 5 5298 1 1 47 TYR CA C 6.077 -3.626 1.118 1.00 . A A . 82 TYR CA 1 1 5 5299 1 1 47 TYR CB C 4.537 -3.447 0.939 1.00 . A A . 82 TYR CB 1 1 5 5300 1 1 47 TYR CD1 C 3.731 -2.630 3.196 1.00 . A A . 82 TYR CD1 1 1 5 5301 1 1 47 TYR CD2 C 2.791 -4.654 2.369 1.00 . A A . 82 TYR CD2 1 1 5 5302 1 1 47 TYR CE1 C 2.960 -2.713 4.320 1.00 . A A . 82 TYR CE1 1 1 5 5303 1 1 47 TYR CE2 C 2.002 -4.749 3.507 1.00 . A A . 82 TYR CE2 1 1 5 5304 1 1 47 TYR CG C 3.677 -3.587 2.199 1.00 . A A . 82 TYR CG 1 1 5 5305 1 1 47 TYR CZ C 2.101 -3.764 4.486 1.00 . A A . 82 TYR CZ 1 1 5 5306 1 1 47 TYR H H 6.366 -5.080 2.565 1.00 . A A . 82 TYR H 1 1 5 5307 1 1 47 TYR HA H 6.541 -3.505 0.150 1.00 . A A . 82 TYR HA 1 1 5 5308 1 1 47 TYR HB2 H 4.316 -2.484 0.508 1.00 . A A . 82 TYR HB2 1 1 5 5309 1 1 47 TYR HB3 H 4.207 -4.193 0.234 1.00 . A A . 82 TYR HB3 1 1 5 5310 1 1 47 TYR HD1 H 4.422 -1.812 3.070 1.00 . A A . 82 TYR HD1 1 1 5 5311 1 1 47 TYR HD2 H 2.715 -5.416 1.607 1.00 . A A . 82 TYR HD2 1 1 5 5312 1 1 47 TYR HE1 H 3.032 -1.940 5.071 1.00 . A A . 82 TYR HE1 1 1 5 5313 1 1 47 TYR HE2 H 1.326 -5.587 3.610 1.00 . A A . 82 TYR HE2 1 1 5 5314 1 1 47 TYR HH H 1.240 -2.911 5.945 1.00 . A A . 82 TYR HH 1 1 5 5315 1 1 47 TYR N N 6.366 -4.938 1.592 1.00 . A A . 82 TYR N 1 1 5 5316 1 1 47 TYR O O 7.003 -2.892 3.192 1.00 . A A . 82 TYR O 1 1 5 5317 1 1 47 TYR OH O 1.327 -3.826 5.630 1.00 . A A . 82 TYR OH 1 1 5 5318 1 1 48 ALA C C 6.097 0.833 2.077 1.00 . A A . 83 ALA C 1 1 5 5319 1 1 48 ALA CA C 7.072 -0.275 2.382 1.00 . A A . 83 ALA CA 1 1 5 5320 1 1 48 ALA CB C 8.496 0.138 2.070 1.00 . A A . 83 ALA CB 1 1 5 5321 1 1 48 ALA H H 6.450 -1.213 0.656 1.00 . A A . 83 ALA H 1 1 5 5322 1 1 48 ALA HA H 6.993 -0.550 3.424 1.00 . A A . 83 ALA HA 1 1 5 5323 1 1 48 ALA HB1 H 8.580 0.386 1.022 1.00 . A A . 83 ALA HB1 1 1 5 5324 1 1 48 ALA HB2 H 9.163 -0.678 2.304 1.00 . A A . 83 ALA HB2 1 1 5 5325 1 1 48 ALA HB3 H 8.757 0.998 2.668 1.00 . A A . 83 ALA HB3 1 1 5 5326 1 1 48 ALA N N 6.688 -1.394 1.592 1.00 . A A . 83 ALA N 1 1 5 5327 1 1 48 ALA O O 5.744 1.052 0.924 1.00 . A A . 83 ALA O 1 1 5 5328 1 1 49 ALA C C 5.017 3.772 3.532 1.00 . A A . 84 ALA C 1 1 5 5329 1 1 49 ALA CA C 4.641 2.500 2.836 1.00 . A A . 84 ALA CA 1 1 5 5330 1 1 49 ALA CB C 3.272 2.028 3.272 1.00 . A A . 84 ALA CB 1 1 5 5331 1 1 49 ALA H H 5.923 1.310 3.979 1.00 . A A . 84 ALA H 1 1 5 5332 1 1 49 ALA HA H 4.599 2.672 1.770 1.00 . A A . 84 ALA HA 1 1 5 5333 1 1 49 ALA HB1 H 3.264 1.854 4.338 1.00 . A A . 84 ALA HB1 1 1 5 5334 1 1 49 ALA HB2 H 3.039 1.110 2.752 1.00 . A A . 84 ALA HB2 1 1 5 5335 1 1 49 ALA HB3 H 2.543 2.782 3.013 1.00 . A A . 84 ALA HB3 1 1 5 5336 1 1 49 ALA N N 5.614 1.483 3.065 1.00 . A A . 84 ALA N 1 1 5 5337 1 1 49 ALA O O 5.506 3.750 4.673 1.00 . A A . 84 ALA O 1 1 5 5338 1 1 50 LEU C C 3.857 6.978 3.125 1.00 . A A . 85 LEU C 1 1 5 5339 1 1 50 LEU CA C 5.062 6.143 3.417 1.00 . A A . 85 LEU CA 1 1 5 5340 1 1 50 LEU CB C 6.306 6.802 2.795 1.00 . A A . 85 LEU CB 1 1 5 5341 1 1 50 LEU CD1 C 7.421 7.968 4.682 1.00 . A A . 85 LEU CD1 1 1 5 5342 1 1 50 LEU CD2 C 7.547 8.968 2.446 1.00 . A A . 85 LEU CD2 1 1 5 5343 1 1 50 LEU CG C 6.708 8.148 3.385 1.00 . A A . 85 LEU CG 1 1 5 5344 1 1 50 LEU H H 4.493 4.868 1.929 1.00 . A A . 85 LEU H 1 1 5 5345 1 1 50 LEU HA H 5.205 6.040 4.479 1.00 . A A . 85 LEU HA 1 1 5 5346 1 1 50 LEU HB2 H 7.121 6.144 3.042 1.00 . A A . 85 LEU HB2 1 1 5 5347 1 1 50 LEU HB3 H 6.219 6.893 1.726 1.00 . A A . 85 LEU HB3 1 1 5 5348 1 1 50 LEU HD11 H 6.816 7.394 5.366 1.00 . A A . 85 LEU HD11 1 1 5 5349 1 1 50 LEU HD12 H 7.577 8.963 5.077 1.00 . A A . 85 LEU HD12 1 1 5 5350 1 1 50 LEU HD13 H 8.359 7.473 4.473 1.00 . A A . 85 LEU HD13 1 1 5 5351 1 1 50 LEU HD21 H 7.783 9.902 2.936 1.00 . A A . 85 LEU HD21 1 1 5 5352 1 1 50 LEU HD22 H 6.998 9.153 1.535 1.00 . A A . 85 LEU HD22 1 1 5 5353 1 1 50 LEU HD23 H 8.462 8.439 2.222 1.00 . A A . 85 LEU HD23 1 1 5 5354 1 1 50 LEU HG H 5.801 8.694 3.590 1.00 . A A . 85 LEU HG 1 1 5 5355 1 1 50 LEU N N 4.827 4.866 2.857 1.00 . A A . 85 LEU N 1 1 5 5356 1 1 50 LEU O O 3.101 6.678 2.204 1.00 . A A . 85 LEU O 1 1 5 5357 1 1 51 HIS C C 2.762 9.525 2.315 1.00 . A A . 86 HIS C 1 1 5 5358 1 1 51 HIS CA C 2.622 8.952 3.722 1.00 . A A . 86 HIS CA 1 1 5 5359 1 1 51 HIS CB C 2.725 10.067 4.804 1.00 . A A . 86 HIS CB 1 1 5 5360 1 1 51 HIS CD2 C 5.087 11.188 4.462 1.00 . A A . 86 HIS CD2 1 1 5 5361 1 1 51 HIS CE1 C 5.964 10.657 6.376 1.00 . A A . 86 HIS CE1 1 1 5 5362 1 1 51 HIS CG C 4.148 10.497 5.155 1.00 . A A . 86 HIS CG 1 1 5 5363 1 1 51 HIS H H 4.164 7.964 4.774 1.00 . A A . 86 HIS H 1 1 5 5364 1 1 51 HIS HA H 1.657 8.474 3.806 1.00 . A A . 86 HIS HA 1 1 5 5365 1 1 51 HIS HB2 H 2.198 10.942 4.452 1.00 . A A . 86 HIS HB2 1 1 5 5366 1 1 51 HIS HB3 H 2.251 9.715 5.709 1.00 . A A . 86 HIS HB3 1 1 5 5367 1 1 51 HIS HD1 H 4.335 9.664 7.080 1.00 . A A . 86 HIS HD1 1 1 5 5368 1 1 51 HIS HD2 H 5.016 11.544 3.447 1.00 . A A . 86 HIS HD2 1 1 5 5369 1 1 51 HIS HE1 H 6.682 10.541 7.172 1.00 . A A . 86 HIS HE1 1 1 5 5370 1 1 51 HIS HE2 H 6.868 11.985 5.154 1.00 . A A . 86 HIS HE2 1 1 5 5371 1 1 51 HIS N N 3.635 7.950 3.948 1.00 . A A . 86 HIS N 1 1 5 5372 1 1 51 HIS ND1 N 4.745 10.182 6.351 1.00 . A A . 86 HIS ND1 1 1 5 5373 1 1 51 HIS NE2 N 6.197 11.270 5.248 1.00 . A A . 86 HIS NE2 1 1 5 5374 1 1 51 HIS O O 3.814 10.066 1.947 1.00 . A A . 86 HIS O 1 1 5 5375 1 1 52 GLY C C 2.037 8.746 -0.831 1.00 . A A . 87 GLY C 1 1 5 5376 1 1 52 GLY CA C 1.752 9.832 0.197 1.00 . A A . 87 GLY CA 1 1 5 5377 1 1 52 GLY H H 0.939 8.896 1.875 1.00 . A A . 87 GLY H 1 1 5 5378 1 1 52 GLY HA2 H 0.791 10.271 -0.024 1.00 . A A . 87 GLY HA2 1 1 5 5379 1 1 52 GLY HA3 H 2.510 10.597 0.110 1.00 . A A . 87 GLY HA3 1 1 5 5380 1 1 52 GLY N N 1.739 9.356 1.536 1.00 . A A . 87 GLY N 1 1 5 5381 1 1 52 GLY O O 1.347 8.670 -1.843 1.00 . A A . 87 GLY O 1 1 5 5382 1 1 53 GLU C C 3.784 5.557 -0.992 1.00 . A A . 88 GLU C 1 1 5 5383 1 1 53 GLU CA C 3.479 6.924 -1.595 1.00 . A A . 88 GLU CA 1 1 5 5384 1 1 53 GLU CB C 4.746 7.438 -2.288 1.00 . A A . 88 GLU CB 1 1 5 5385 1 1 53 GLU CD C 5.889 9.416 -3.350 1.00 . A A . 88 GLU CD 1 1 5 5386 1 1 53 GLU CG C 4.599 8.832 -2.858 1.00 . A A . 88 GLU CG 1 1 5 5387 1 1 53 GLU H H 3.470 7.857 0.295 1.00 . A A . 88 GLU H 1 1 5 5388 1 1 53 GLU HA H 2.704 6.840 -2.342 1.00 . A A . 88 GLU HA 1 1 5 5389 1 1 53 GLU HB2 H 5.595 7.399 -1.622 1.00 . A A . 88 GLU HB2 1 1 5 5390 1 1 53 GLU HB3 H 4.934 6.781 -3.125 1.00 . A A . 88 GLU HB3 1 1 5 5391 1 1 53 GLU HG2 H 3.887 8.791 -3.668 1.00 . A A . 88 GLU HG2 1 1 5 5392 1 1 53 GLU HG3 H 4.197 9.463 -2.079 1.00 . A A . 88 GLU HG3 1 1 5 5393 1 1 53 GLU N N 3.040 7.895 -0.586 1.00 . A A . 88 GLU N 1 1 5 5394 1 1 53 GLU O O 4.360 5.456 0.089 1.00 . A A . 88 GLU O 1 1 5 5395 1 1 53 GLU OE1 O 6.292 9.139 -4.492 1.00 . A A . 88 GLU OE1 1 1 5 5396 1 1 53 GLU OE2 O 6.495 10.226 -2.619 1.00 . A A . 88 GLU OE2 1 1 5 5397 1 1 54 PHE C C 5.012 2.864 -2.155 1.00 . A A . 89 PHE C 1 1 5 5398 1 1 54 PHE CA C 3.804 3.186 -1.329 1.00 . A A . 89 PHE CA 1 1 5 5399 1 1 54 PHE CB C 2.641 2.206 -1.576 1.00 . A A . 89 PHE CB 1 1 5 5400 1 1 54 PHE CD1 C 0.597 3.619 -1.133 1.00 . A A . 89 PHE CD1 1 1 5 5401 1 1 54 PHE CD2 C 1.124 1.881 0.421 1.00 . A A . 89 PHE CD2 1 1 5 5402 1 1 54 PHE CE1 C -0.484 3.983 -0.370 1.00 . A A . 89 PHE CE1 1 1 5 5403 1 1 54 PHE CE2 C 0.047 2.250 1.189 1.00 . A A . 89 PHE CE2 1 1 5 5404 1 1 54 PHE CG C 1.420 2.563 -0.755 1.00 . A A . 89 PHE CG 1 1 5 5405 1 1 54 PHE CZ C -0.757 3.308 0.787 1.00 . A A . 89 PHE CZ 1 1 5 5406 1 1 54 PHE H H 2.944 4.610 -2.544 1.00 . A A . 89 PHE H 1 1 5 5407 1 1 54 PHE HA H 4.075 3.200 -0.282 1.00 . A A . 89 PHE HA 1 1 5 5408 1 1 54 PHE HB2 H 2.382 2.151 -2.623 1.00 . A A . 89 PHE HB2 1 1 5 5409 1 1 54 PHE HB3 H 2.971 1.231 -1.262 1.00 . A A . 89 PHE HB3 1 1 5 5410 1 1 54 PHE HD1 H 0.812 4.152 -2.047 1.00 . A A . 89 PHE HD1 1 1 5 5411 1 1 54 PHE HD2 H 1.732 1.054 0.757 1.00 . A A . 89 PHE HD2 1 1 5 5412 1 1 54 PHE HE1 H -1.121 4.803 -0.667 1.00 . A A . 89 PHE HE1 1 1 5 5413 1 1 54 PHE HE2 H -0.174 1.699 2.097 1.00 . A A . 89 PHE HE2 1 1 5 5414 1 1 54 PHE HZ H -1.605 3.615 1.381 1.00 . A A . 89 PHE HZ 1 1 5 5415 1 1 54 PHE N N 3.446 4.518 -1.711 1.00 . A A . 89 PHE N 1 1 5 5416 1 1 54 PHE O O 5.067 3.206 -3.348 1.00 . A A . 89 PHE O 1 1 5 5417 1 1 55 TYR C C 7.791 0.799 -1.978 1.00 . A A . 90 TYR C 1 1 5 5418 1 1 55 TYR CA C 7.253 2.182 -2.208 1.00 . A A . 90 TYR CA 1 1 5 5419 1 1 55 TYR CB C 8.146 3.199 -1.527 1.00 . A A . 90 TYR CB 1 1 5 5420 1 1 55 TYR CD1 C 7.679 5.211 -2.934 1.00 . A A . 90 TYR CD1 1 1 5 5421 1 1 55 TYR CD2 C 9.950 4.608 -2.576 1.00 . A A . 90 TYR CD2 1 1 5 5422 1 1 55 TYR CE1 C 8.065 6.292 -3.669 1.00 . A A . 90 TYR CE1 1 1 5 5423 1 1 55 TYR CE2 C 10.350 5.696 -3.322 1.00 . A A . 90 TYR CE2 1 1 5 5424 1 1 55 TYR CG C 8.609 4.345 -2.372 1.00 . A A . 90 TYR CG 1 1 5 5425 1 1 55 TYR CZ C 9.396 6.537 -3.865 1.00 . A A . 90 TYR CZ 1 1 5 5426 1 1 55 TYR H H 5.869 1.854 -0.680 1.00 . A A . 90 TYR H 1 1 5 5427 1 1 55 TYR HA H 7.178 2.422 -3.256 1.00 . A A . 90 TYR HA 1 1 5 5428 1 1 55 TYR HB2 H 7.418 3.744 -0.935 1.00 . A A . 90 TYR HB2 1 1 5 5429 1 1 55 TYR HB3 H 8.918 2.789 -0.899 1.00 . A A . 90 TYR HB3 1 1 5 5430 1 1 55 TYR HD1 H 6.623 5.033 -2.787 1.00 . A A . 90 TYR HD1 1 1 5 5431 1 1 55 TYR HD2 H 10.692 3.947 -2.154 1.00 . A A . 90 TYR HD2 1 1 5 5432 1 1 55 TYR HE1 H 7.311 6.941 -4.089 1.00 . A A . 90 TYR HE1 1 1 5 5433 1 1 55 TYR HE2 H 11.403 5.888 -3.466 1.00 . A A . 90 TYR HE2 1 1 5 5434 1 1 55 TYR HH H 9.250 8.366 -4.245 1.00 . A A . 90 TYR HH 1 1 5 5435 1 1 55 TYR N N 5.986 2.274 -1.565 1.00 . A A . 90 TYR N 1 1 5 5436 1 1 55 TYR O O 7.433 0.146 -1.012 1.00 . A A . 90 TYR O 1 1 5 5437 1 1 55 TYR OH O 9.774 7.634 -4.593 1.00 . A A . 90 TYR OH 1 1 5 5438 1 1 56 CYS C C 10.263 -0.927 -1.694 1.00 . A A . 91 CYS C 1 1 5 5439 1 1 56 CYS CA C 9.136 -0.993 -2.682 1.00 . A A . 91 CYS CA 1 1 5 5440 1 1 56 CYS CB C 9.584 -1.638 -4.004 1.00 . A A . 91 CYS CB 1 1 5 5441 1 1 56 CYS H H 8.842 0.861 -3.649 1.00 . A A . 91 CYS H 1 1 5 5442 1 1 56 CYS HA H 8.358 -1.599 -2.238 1.00 . A A . 91 CYS HA 1 1 5 5443 1 1 56 CYS HB2 H 9.861 -2.663 -3.812 1.00 . A A . 91 CYS HB2 1 1 5 5444 1 1 56 CYS HB3 H 8.760 -1.651 -4.697 1.00 . A A . 91 CYS HB3 1 1 5 5445 1 1 56 CYS N N 8.605 0.320 -2.871 1.00 . A A . 91 CYS N 1 1 5 5446 1 1 56 CYS O O 10.895 0.129 -1.595 1.00 . A A . 91 CYS O 1 1 5 5447 1 1 56 CYS SG S 10.968 -0.820 -4.822 1.00 . A A . 91 CYS SG 1 1 5 5448 1 1 57 LYS C C 12.940 -1.529 -0.591 1.00 . A A . 92 LYS C 1 1 5 5449 1 1 57 LYS CA C 11.573 -1.996 0.006 1.00 . A A . 92 LYS CA 1 1 5 5450 1 1 57 LYS CB C 11.638 -3.379 0.691 1.00 . A A . 92 LYS CB 1 1 5 5451 1 1 57 LYS CD C 10.259 -5.148 1.958 1.00 . A A . 92 LYS CD 1 1 5 5452 1 1 57 LYS CE C 11.202 -5.311 3.129 1.00 . A A . 92 LYS CE 1 1 5 5453 1 1 57 LYS CG C 10.303 -3.743 1.359 1.00 . A A . 92 LYS CG 1 1 5 5454 1 1 57 LYS H H 9.964 -2.785 -1.060 1.00 . A A . 92 LYS H 1 1 5 5455 1 1 57 LYS HA H 11.292 -1.262 0.748 1.00 . A A . 92 LYS HA 1 1 5 5456 1 1 57 LYS HB2 H 11.877 -4.131 -0.047 1.00 . A A . 92 LYS HB2 1 1 5 5457 1 1 57 LYS HB3 H 12.406 -3.367 1.449 1.00 . A A . 92 LYS HB3 1 1 5 5458 1 1 57 LYS HD2 H 9.253 -5.355 2.291 1.00 . A A . 92 LYS HD2 1 1 5 5459 1 1 57 LYS HD3 H 10.529 -5.855 1.187 1.00 . A A . 92 LYS HD3 1 1 5 5460 1 1 57 LYS HE2 H 12.219 -5.302 2.766 1.00 . A A . 92 LYS HE2 1 1 5 5461 1 1 57 LYS HE3 H 11.057 -4.483 3.807 1.00 . A A . 92 LYS HE3 1 1 5 5462 1 1 57 LYS HG2 H 10.116 -3.037 2.154 1.00 . A A . 92 LYS HG2 1 1 5 5463 1 1 57 LYS HG3 H 9.515 -3.646 0.627 1.00 . A A . 92 LYS HG3 1 1 5 5464 1 1 57 LYS HZ1 H 11.676 -6.719 4.608 1.00 . A A . 92 LYS HZ1 1 1 5 5465 1 1 57 LYS HZ2 H 11.003 -7.408 3.242 1.00 . A A . 92 LYS HZ2 1 1 5 5466 1 1 57 LYS HZ3 H 10.040 -6.576 4.324 1.00 . A A . 92 LYS HZ3 1 1 5 5467 1 1 57 LYS N N 10.519 -1.983 -0.977 1.00 . A A . 92 LYS N 1 1 5 5468 1 1 57 LYS NZ N 10.971 -6.575 3.859 1.00 . A A . 92 LYS NZ 1 1 5 5469 1 1 57 LYS O O 13.601 -0.697 0.037 1.00 . A A . 92 LYS O 1 1 5 5470 1 1 58 PRO C C 14.541 0.067 -2.683 1.00 . A A . 93 PRO C 1 1 5 5471 1 1 58 PRO CA C 14.606 -1.458 -2.434 1.00 . A A . 93 PRO CA 1 1 5 5472 1 1 58 PRO CB C 14.708 -2.202 -3.765 1.00 . A A . 93 PRO CB 1 1 5 5473 1 1 58 PRO CD C 12.762 -3.036 -2.676 1.00 . A A . 93 PRO CD 1 1 5 5474 1 1 58 PRO CG C 13.866 -3.415 -3.598 1.00 . A A . 93 PRO CG 1 1 5 5475 1 1 58 PRO HA H 15.469 -1.674 -1.822 1.00 . A A . 93 PRO HA 1 1 5 5476 1 1 58 PRO HB2 H 14.342 -1.563 -4.554 1.00 . A A . 93 PRO HB2 1 1 5 5477 1 1 58 PRO HB3 H 15.739 -2.458 -3.960 1.00 . A A . 93 PRO HB3 1 1 5 5478 1 1 58 PRO HD2 H 11.933 -2.657 -3.254 1.00 . A A . 93 PRO HD2 1 1 5 5479 1 1 58 PRO HD3 H 12.451 -3.884 -2.085 1.00 . A A . 93 PRO HD3 1 1 5 5480 1 1 58 PRO HG2 H 13.465 -3.720 -4.553 1.00 . A A . 93 PRO HG2 1 1 5 5481 1 1 58 PRO HG3 H 14.442 -4.214 -3.164 1.00 . A A . 93 PRO HG3 1 1 5 5482 1 1 58 PRO N N 13.374 -1.979 -1.823 1.00 . A A . 93 PRO N 1 1 5 5483 1 1 58 PRO O O 15.453 0.800 -2.313 1.00 . A A . 93 PRO O 1 1 5 5484 1 1 59 HIS C C 13.157 2.831 -2.353 1.00 . A A . 94 HIS C 1 1 5 5485 1 1 59 HIS CA C 13.331 1.989 -3.581 1.00 . A A . 94 HIS CA 1 1 5 5486 1 1 59 HIS CB C 12.239 2.325 -4.603 1.00 . A A . 94 HIS CB 1 1 5 5487 1 1 59 HIS CD2 C 13.857 2.163 -6.564 1.00 . A A . 94 HIS CD2 1 1 5 5488 1 1 59 HIS CE1 C 12.395 1.669 -8.113 1.00 . A A . 94 HIS CE1 1 1 5 5489 1 1 59 HIS CG C 12.635 2.087 -6.015 1.00 . A A . 94 HIS CG 1 1 5 5490 1 1 59 HIS H H 12.731 -0.072 -3.528 1.00 . A A . 94 HIS H 1 1 5 5491 1 1 59 HIS HA H 14.282 2.274 -4.005 1.00 . A A . 94 HIS HA 1 1 5 5492 1 1 59 HIS HB2 H 11.361 1.731 -4.400 1.00 . A A . 94 HIS HB2 1 1 5 5493 1 1 59 HIS HB3 H 11.988 3.369 -4.504 1.00 . A A . 94 HIS HB3 1 1 5 5494 1 1 59 HIS HD2 H 14.758 2.401 -6.014 1.00 . A A . 94 HIS HD2 1 1 5 5495 1 1 59 HIS HE1 H 11.947 1.434 -9.070 1.00 . A A . 94 HIS HE1 1 1 5 5496 1 1 59 HIS HE2 H 14.413 1.939 -8.588 1.00 . A A . 94 HIS HE2 1 1 5 5497 1 1 59 HIS N N 13.456 0.547 -3.287 1.00 . A A . 94 HIS N 1 1 5 5498 1 1 59 HIS ND1 N 11.711 1.781 -6.980 1.00 . A A . 94 HIS ND1 1 1 5 5499 1 1 59 HIS NE2 N 13.706 1.897 -7.904 1.00 . A A . 94 HIS NE2 1 1 5 5500 1 1 59 HIS O O 13.638 3.948 -2.307 1.00 . A A . 94 HIS O 1 1 5 5501 1 1 60 PHE C C 13.588 3.269 0.544 1.00 . A A . 95 PHE C 1 1 5 5502 1 1 60 PHE CA C 12.250 3.026 -0.143 1.00 . A A . 95 PHE CA 1 1 5 5503 1 1 60 PHE CB C 11.324 2.209 0.746 1.00 . A A . 95 PHE CB 1 1 5 5504 1 1 60 PHE CD1 C 9.714 3.971 1.391 1.00 . A A . 95 PHE CD1 1 1 5 5505 1 1 60 PHE CD2 C 10.809 2.801 3.110 1.00 . A A . 95 PHE CD2 1 1 5 5506 1 1 60 PHE CE1 C 9.037 4.709 2.305 1.00 . A A . 95 PHE CE1 1 1 5 5507 1 1 60 PHE CE2 C 10.127 3.542 4.049 1.00 . A A . 95 PHE CE2 1 1 5 5508 1 1 60 PHE CG C 10.607 3.010 1.776 1.00 . A A . 95 PHE CG 1 1 5 5509 1 1 60 PHE CZ C 9.237 4.501 3.643 1.00 . A A . 95 PHE CZ 1 1 5 5510 1 1 60 PHE H H 12.109 1.400 -1.456 1.00 . A A . 95 PHE H 1 1 5 5511 1 1 60 PHE HA H 11.788 3.982 -0.357 1.00 . A A . 95 PHE HA 1 1 5 5512 1 1 60 PHE HB2 H 10.585 1.715 0.134 1.00 . A A . 95 PHE HB2 1 1 5 5513 1 1 60 PHE HB3 H 11.916 1.462 1.253 1.00 . A A . 95 PHE HB3 1 1 5 5514 1 1 60 PHE HD1 H 9.545 4.156 0.342 1.00 . A A . 95 PHE HD1 1 1 5 5515 1 1 60 PHE HD2 H 11.514 2.044 3.421 1.00 . A A . 95 PHE HD2 1 1 5 5516 1 1 60 PHE HE1 H 8.345 5.452 1.948 1.00 . A A . 95 PHE HE1 1 1 5 5517 1 1 60 PHE HE2 H 10.294 3.370 5.100 1.00 . A A . 95 PHE HE2 1 1 5 5518 1 1 60 PHE HZ H 8.698 5.087 4.372 1.00 . A A . 95 PHE HZ 1 1 5 5519 1 1 60 PHE N N 12.485 2.306 -1.367 1.00 . A A . 95 PHE N 1 1 5 5520 1 1 60 PHE O O 13.857 4.357 1.011 1.00 . A A . 95 PHE O 1 1 5 5521 1 1 61 GLN C C 16.671 3.286 0.354 1.00 . A A . 96 GLN C 1 1 5 5522 1 1 61 GLN CA C 15.770 2.331 1.127 1.00 . A A . 96 GLN CA 1 1 5 5523 1 1 61 GLN CB C 16.410 0.951 1.224 1.00 . A A . 96 GLN CB 1 1 5 5524 1 1 61 GLN CD C 16.223 -1.378 2.184 1.00 . A A . 96 GLN CD 1 1 5 5525 1 1 61 GLN CG C 15.711 0.046 2.207 1.00 . A A . 96 GLN CG 1 1 5 5526 1 1 61 GLN H H 14.132 1.391 0.172 1.00 . A A . 96 GLN H 1 1 5 5527 1 1 61 GLN HA H 15.660 2.723 2.127 1.00 . A A . 96 GLN HA 1 1 5 5528 1 1 61 GLN HB2 H 16.371 0.484 0.251 1.00 . A A . 96 GLN HB2 1 1 5 5529 1 1 61 GLN HB3 H 17.440 1.055 1.531 1.00 . A A . 96 GLN HB3 1 1 5 5530 1 1 61 GLN HE21 H 14.897 -1.804 0.820 1.00 . A A . 96 GLN HE21 1 1 5 5531 1 1 61 GLN HE22 H 15.905 -3.127 1.308 1.00 . A A . 96 GLN HE22 1 1 5 5532 1 1 61 GLN HG2 H 15.832 0.451 3.201 1.00 . A A . 96 GLN HG2 1 1 5 5533 1 1 61 GLN HG3 H 14.660 0.040 1.955 1.00 . A A . 96 GLN HG3 1 1 5 5534 1 1 61 GLN N N 14.426 2.245 0.558 1.00 . A A . 96 GLN N 1 1 5 5535 1 1 61 GLN NE2 N 15.624 -2.187 1.360 1.00 . A A . 96 GLN NE2 1 1 5 5536 1 1 61 GLN O O 17.446 4.022 0.945 1.00 . A A . 96 GLN O 1 1 5 5537 1 1 61 GLN OE1 O 17.141 -1.746 2.904 1.00 . A A . 96 GLN OE1 1 1 5 5538 1 1 62 GLN C C 16.973 5.542 -1.837 1.00 . A A . 97 GLN C 1 1 5 5539 1 1 62 GLN CA C 17.441 4.073 -1.778 1.00 . A A . 97 GLN CA 1 1 5 5540 1 1 62 GLN CB C 17.464 3.507 -3.186 1.00 . A A . 97 GLN CB 1 1 5 5541 1 1 62 GLN CD C 18.023 1.606 -4.726 1.00 . A A . 97 GLN CD 1 1 5 5542 1 1 62 GLN CG C 18.082 2.133 -3.311 1.00 . A A . 97 GLN CG 1 1 5 5543 1 1 62 GLN H H 16.010 2.609 -1.421 1.00 . A A . 97 GLN H 1 1 5 5544 1 1 62 GLN HA H 18.451 4.032 -1.399 1.00 . A A . 97 GLN HA 1 1 5 5545 1 1 62 GLN HB2 H 16.459 3.453 -3.584 1.00 . A A . 97 GLN HB2 1 1 5 5546 1 1 62 GLN HB3 H 18.039 4.191 -3.780 1.00 . A A . 97 GLN HB3 1 1 5 5547 1 1 62 GLN HE21 H 16.280 0.800 -4.358 1.00 . A A . 97 GLN HE21 1 1 5 5548 1 1 62 GLN HE22 H 16.885 0.558 -5.960 1.00 . A A . 97 GLN HE22 1 1 5 5549 1 1 62 GLN HG2 H 19.118 2.198 -3.017 1.00 . A A . 97 GLN HG2 1 1 5 5550 1 1 62 GLN HG3 H 17.561 1.448 -2.659 1.00 . A A . 97 GLN HG3 1 1 5 5551 1 1 62 GLN N N 16.608 3.235 -0.961 1.00 . A A . 97 GLN N 1 1 5 5552 1 1 62 GLN NE2 N 16.960 0.924 -5.052 1.00 . A A . 97 GLN NE2 1 1 5 5553 1 1 62 GLN O O 17.742 6.463 -1.575 1.00 . A A . 97 GLN O 1 1 5 5554 1 1 62 GLN OE1 O 18.938 1.816 -5.519 1.00 . A A . 97 GLN OE1 1 1 5 5555 1 1 63 LEU C C 14.784 7.774 -1.119 1.00 . A A . 98 LEU C 1 1 5 5556 1 1 63 LEU CA C 15.173 7.072 -2.396 1.00 . A A . 98 LEU CA 1 1 5 5557 1 1 63 LEU CB C 13.985 6.965 -3.316 1.00 . A A . 98 LEU CB 1 1 5 5558 1 1 63 LEU CD1 C 13.092 5.979 -5.382 1.00 . A A . 98 LEU CD1 1 1 5 5559 1 1 63 LEU CD2 C 14.784 7.730 -5.552 1.00 . A A . 98 LEU CD2 1 1 5 5560 1 1 63 LEU CG C 14.307 6.542 -4.744 1.00 . A A . 98 LEU CG 1 1 5 5561 1 1 63 LEU H H 15.130 4.971 -2.321 1.00 . A A . 98 LEU H 1 1 5 5562 1 1 63 LEU HA H 15.919 7.656 -2.913 1.00 . A A . 98 LEU HA 1 1 5 5563 1 1 63 LEU HB2 H 13.313 6.237 -2.886 1.00 . A A . 98 LEU HB2 1 1 5 5564 1 1 63 LEU HB3 H 13.486 7.922 -3.346 1.00 . A A . 98 LEU HB3 1 1 5 5565 1 1 63 LEU HD11 H 12.793 5.114 -4.812 1.00 . A A . 98 LEU HD11 1 1 5 5566 1 1 63 LEU HD12 H 13.313 5.700 -6.402 1.00 . A A . 98 LEU HD12 1 1 5 5567 1 1 63 LEU HD13 H 12.306 6.719 -5.355 1.00 . A A . 98 LEU HD13 1 1 5 5568 1 1 63 LEU HD21 H 15.706 8.118 -5.147 1.00 . A A . 98 LEU HD21 1 1 5 5569 1 1 63 LEU HD22 H 14.024 8.496 -5.501 1.00 . A A . 98 LEU HD22 1 1 5 5570 1 1 63 LEU HD23 H 14.918 7.442 -6.585 1.00 . A A . 98 LEU HD23 1 1 5 5571 1 1 63 LEU HG H 15.088 5.797 -4.747 1.00 . A A . 98 LEU HG 1 1 5 5572 1 1 63 LEU N N 15.727 5.741 -2.190 1.00 . A A . 98 LEU N 1 1 5 5573 1 1 63 LEU O O 15.105 8.936 -0.918 1.00 . A A . 98 LEU O 1 1 5 5574 1 1 64 PHE C C 14.557 7.413 2.143 1.00 . A A . 99 PHE C 1 1 5 5575 1 1 64 PHE CA C 13.647 7.695 0.976 1.00 . A A . 99 PHE CA 1 1 5 5576 1 1 64 PHE CB C 12.203 7.280 1.293 1.00 . A A . 99 PHE CB 1 1 5 5577 1 1 64 PHE CD1 C 11.403 8.979 -0.415 1.00 . A A . 99 PHE CD1 1 1 5 5578 1 1 64 PHE CD2 C 9.869 7.331 0.364 1.00 . A A . 99 PHE CD2 1 1 5 5579 1 1 64 PHE CE1 C 10.425 9.503 -1.228 1.00 . A A . 99 PHE CE1 1 1 5 5580 1 1 64 PHE CE2 C 8.894 7.861 -0.451 1.00 . A A . 99 PHE CE2 1 1 5 5581 1 1 64 PHE CG C 11.139 7.878 0.397 1.00 . A A . 99 PHE CG 1 1 5 5582 1 1 64 PHE CZ C 9.178 8.946 -1.247 1.00 . A A . 99 PHE CZ 1 1 5 5583 1 1 64 PHE H H 13.925 6.119 -0.395 1.00 . A A . 99 PHE H 1 1 5 5584 1 1 64 PHE HA H 13.666 8.761 0.818 1.00 . A A . 99 PHE HA 1 1 5 5585 1 1 64 PHE HB2 H 12.165 6.234 1.026 1.00 . A A . 99 PHE HB2 1 1 5 5586 1 1 64 PHE HB3 H 11.952 7.409 2.333 1.00 . A A . 99 PHE HB3 1 1 5 5587 1 1 64 PHE HD1 H 12.381 9.433 -0.422 1.00 . A A . 99 PHE HD1 1 1 5 5588 1 1 64 PHE HD2 H 9.629 6.483 0.992 1.00 . A A . 99 PHE HD2 1 1 5 5589 1 1 64 PHE HE1 H 10.623 10.356 -1.859 1.00 . A A . 99 PHE HE1 1 1 5 5590 1 1 64 PHE HE2 H 7.908 7.421 -0.465 1.00 . A A . 99 PHE HE2 1 1 5 5591 1 1 64 PHE HZ H 8.425 9.371 -1.893 1.00 . A A . 99 PHE HZ 1 1 5 5592 1 1 64 PHE N N 14.126 7.066 -0.233 1.00 . A A . 99 PHE N 1 1 5 5593 1 1 64 PHE O O 14.465 8.038 3.190 1.00 . A A . 99 PHE O 1 1 5 5594 1 1 65 LYS C C 15.826 5.592 4.173 1.00 . A A . 100 LYS C 1 1 5 5595 1 1 65 LYS CA C 16.453 5.993 2.838 1.00 . A A . 100 LYS CA 1 1 5 5596 1 1 65 LYS CB C 17.548 7.068 2.988 1.00 . A A . 100 LYS CB 1 1 5 5597 1 1 65 LYS CD C 19.855 7.677 3.812 1.00 . A A . 100 LYS CD 1 1 5 5598 1 1 65 LYS CE C 19.386 8.822 4.701 1.00 . A A . 100 LYS CE 1 1 5 5599 1 1 65 LYS CG C 18.812 6.580 3.679 1.00 . A A . 100 LYS CG 1 1 5 5600 1 1 65 LYS H H 15.390 5.977 1.055 1.00 . A A . 100 LYS H 1 1 5 5601 1 1 65 LYS HA H 16.895 5.106 2.408 1.00 . A A . 100 LYS HA 1 1 5 5602 1 1 65 LYS HB2 H 17.819 7.428 2.007 1.00 . A A . 100 LYS HB2 1 1 5 5603 1 1 65 LYS HB3 H 17.136 7.886 3.560 1.00 . A A . 100 LYS HB3 1 1 5 5604 1 1 65 LYS HD2 H 20.744 7.250 4.250 1.00 . A A . 100 LYS HD2 1 1 5 5605 1 1 65 LYS HD3 H 20.087 8.061 2.830 1.00 . A A . 100 LYS HD3 1 1 5 5606 1 1 65 LYS HE2 H 20.170 9.562 4.749 1.00 . A A . 100 LYS HE2 1 1 5 5607 1 1 65 LYS HE3 H 18.508 9.271 4.262 1.00 . A A . 100 LYS HE3 1 1 5 5608 1 1 65 LYS HG2 H 18.545 6.222 4.661 1.00 . A A . 100 LYS HG2 1 1 5 5609 1 1 65 LYS HG3 H 19.227 5.768 3.100 1.00 . A A . 100 LYS HG3 1 1 5 5610 1 1 65 LYS HZ1 H 18.822 9.183 6.683 1.00 . A A . 100 LYS HZ1 1 1 5 5611 1 1 65 LYS HZ2 H 19.878 7.884 6.509 1.00 . A A . 100 LYS HZ2 1 1 5 5612 1 1 65 LYS HZ3 H 18.266 7.715 6.088 1.00 . A A . 100 LYS HZ3 1 1 5 5613 1 1 65 LYS N N 15.439 6.442 1.915 1.00 . A A . 100 LYS N 1 1 5 5614 1 1 65 LYS NZ N 19.069 8.374 6.076 1.00 . A A . 100 LYS NZ 1 1 5 5615 1 1 65 LYS O O 16.282 5.981 5.231 1.00 . A A . 100 LYS O 1 1 5 5616 1 1 66 SER C C 13.573 2.986 5.165 1.00 . A A . 101 SER C 1 1 5 5617 1 1 66 SER CA C 14.064 4.434 5.288 1.00 . A A . 101 SER CA 1 1 5 5618 1 1 66 SER CB C 12.884 5.415 5.496 1.00 . A A . 101 SER CB 1 1 5 5619 1 1 66 SER H H 14.474 4.458 3.243 1.00 . A A . 101 SER H 1 1 5 5620 1 1 66 SER HA H 14.734 4.515 6.130 1.00 . A A . 101 SER HA 1 1 5 5621 1 1 66 SER HB2 H 13.257 6.428 5.477 1.00 . A A . 101 SER HB2 1 1 5 5622 1 1 66 SER HB3 H 12.173 5.284 4.693 1.00 . A A . 101 SER HB3 1 1 5 5623 1 1 66 SER HG H 12.710 5.705 7.398 1.00 . A A . 101 SER HG 1 1 5 5624 1 1 66 SER N N 14.777 4.811 4.106 1.00 . A A . 101 SER N 1 1 5 5625 1 1 66 SER O O 13.630 2.400 4.075 1.00 . A A . 101 SER O 1 1 5 5626 1 1 66 SER OG O 12.217 5.205 6.734 1.00 . A A . 101 SER OG 1 1 5 5627 1 1 67 LYS C C 13.251 0.010 5.656 1.00 . A A . 102 LYS C 1 1 5 5628 1 1 67 LYS CA C 12.561 1.108 6.494 1.00 . A A . 102 LYS CA 1 1 5 5629 1 1 67 LYS CB C 11.008 1.103 6.377 1.00 . A A . 102 LYS CB 1 1 5 5630 1 1 67 LYS CD C 10.552 -1.371 6.881 1.00 . A A . 102 LYS CD 1 1 5 5631 1 1 67 LYS CE C 9.917 -2.358 7.848 1.00 . A A . 102 LYS CE 1 1 5 5632 1 1 67 LYS CG C 10.274 0.069 7.262 1.00 . A A . 102 LYS CG 1 1 5 5633 1 1 67 LYS H H 13.172 3.024 7.093 1.00 . A A . 102 LYS H 1 1 5 5634 1 1 67 LYS HA H 12.814 0.870 7.517 1.00 . A A . 102 LYS HA 1 1 5 5635 1 1 67 LYS HB2 H 10.649 2.080 6.665 1.00 . A A . 102 LYS HB2 1 1 5 5636 1 1 67 LYS HB3 H 10.737 0.922 5.348 1.00 . A A . 102 LYS HB3 1 1 5 5637 1 1 67 LYS HD2 H 10.159 -1.553 5.892 1.00 . A A . 102 LYS HD2 1 1 5 5638 1 1 67 LYS HD3 H 11.622 -1.525 6.872 1.00 . A A . 102 LYS HD3 1 1 5 5639 1 1 67 LYS HE2 H 8.854 -2.181 7.882 1.00 . A A . 102 LYS HE2 1 1 5 5640 1 1 67 LYS HE3 H 10.096 -3.360 7.485 1.00 . A A . 102 LYS HE3 1 1 5 5641 1 1 67 LYS HG2 H 10.599 0.207 8.282 1.00 . A A . 102 LYS HG2 1 1 5 5642 1 1 67 LYS HG3 H 9.212 0.257 7.202 1.00 . A A . 102 LYS HG3 1 1 5 5643 1 1 67 LYS HZ1 H 10.309 -1.283 9.598 1.00 . A A . 102 LYS HZ1 1 1 5 5644 1 1 67 LYS HZ2 H 11.487 -2.441 9.229 1.00 . A A . 102 LYS HZ2 1 1 5 5645 1 1 67 LYS HZ3 H 9.994 -2.917 9.841 1.00 . A A . 102 LYS HZ3 1 1 5 5646 1 1 67 LYS N N 13.123 2.449 6.299 1.00 . A A . 102 LYS N 1 1 5 5647 1 1 67 LYS NZ N 10.467 -2.237 9.216 1.00 . A A . 102 LYS NZ 1 1 5 5648 1 1 67 LYS O O 14.378 -0.381 5.990 1.00 . A A . 102 LYS O 1 1 5 5649 1 1 68 GLY C C 13.237 -2.757 4.735 1.00 . A A . 103 GLY C 1 1 5 5650 1 1 68 GLY CA C 13.152 -1.565 3.819 1.00 . A A . 103 GLY CA 1 1 5 5651 1 1 68 GLY H H 11.818 -0.015 4.176 1.00 . A A . 103 GLY H 1 1 5 5652 1 1 68 GLY HA2 H 12.506 -1.792 2.984 1.00 . A A . 103 GLY HA2 1 1 5 5653 1 1 68 GLY HA3 H 14.142 -1.332 3.459 1.00 . A A . 103 GLY HA3 1 1 5 5654 1 1 68 GLY N N 12.625 -0.437 4.538 1.00 . A A . 103 GLY N 1 1 5 5655 1 1 68 GLY O O 12.215 -3.266 5.145 1.00 . A A . 103 GLY O 1 1 5 5656 1 1 69 ASN C C 16.158 -4.774 5.579 1.00 . A A . 104 ASN C 1 1 5 5657 1 1 69 ASN CA C 14.831 -4.234 6.004 1.00 . A A . 104 ASN CA 1 1 5 5658 1 1 69 ASN CB C 13.844 -5.450 6.055 1.00 . A A . 104 ASN CB 1 1 5 5659 1 1 69 ASN CG C 13.015 -5.555 7.348 1.00 . A A . 104 ASN CG 1 1 5 5660 1 1 69 ASN H H 15.210 -2.706 4.594 1.00 . A A . 104 ASN H 1 1 5 5661 1 1 69 ASN HA H 14.925 -3.787 6.983 1.00 . A A . 104 ASN HA 1 1 5 5662 1 1 69 ASN HB2 H 13.152 -5.373 5.230 1.00 . A A . 104 ASN HB2 1 1 5 5663 1 1 69 ASN HB3 H 14.416 -6.359 5.941 1.00 . A A . 104 ASN HB3 1 1 5 5664 1 1 69 ASN HD21 H 14.430 -6.633 8.240 1.00 . A A . 104 ASN HD21 1 1 5 5665 1 1 69 ASN HD22 H 13.023 -6.329 9.170 1.00 . A A . 104 ASN HD22 1 1 5 5666 1 1 69 ASN N N 14.462 -3.164 5.038 1.00 . A A . 104 ASN N 1 1 5 5667 1 1 69 ASN ND2 N 13.541 -6.232 8.342 1.00 . A A . 104 ASN ND2 1 1 5 5668 1 1 69 ASN O O 17.181 -4.535 6.232 1.00 . A A . 104 ASN O 1 1 5 5669 1 1 69 ASN OD1 O 11.902 -5.033 7.439 1.00 . A A . 104 ASN OD1 1 1 5 5670 1 1 70 TYR C C 17.639 -7.215 4.912 1.00 . A A . 105 TYR C 1 1 5 5671 1 1 70 TYR CA C 17.266 -6.164 3.881 1.00 . A A . 105 TYR CA 1 1 5 5672 1 1 70 TYR CB C 18.463 -5.276 3.494 1.00 . A A . 105 TYR CB 1 1 5 5673 1 1 70 TYR CD1 C 20.366 -6.828 2.845 1.00 . A A . 105 TYR CD1 1 1 5 5674 1 1 70 TYR CD2 C 19.164 -5.713 1.123 1.00 . A A . 105 TYR CD2 1 1 5 5675 1 1 70 TYR CE1 C 21.150 -7.452 1.896 1.00 . A A . 105 TYR CE1 1 1 5 5676 1 1 70 TYR CE2 C 19.939 -6.336 0.174 1.00 . A A . 105 TYR CE2 1 1 5 5677 1 1 70 TYR CG C 19.359 -5.944 2.473 1.00 . A A . 105 TYR CG 1 1 5 5678 1 1 70 TYR CZ C 20.929 -7.202 0.562 1.00 . A A . 105 TYR CZ 1 1 5 5679 1 1 70 TYR H H 15.321 -5.411 3.883 1.00 . A A . 105 TYR H 1 1 5 5680 1 1 70 TYR HA H 16.889 -6.689 3.014 1.00 . A A . 105 TYR HA 1 1 5 5681 1 1 70 TYR HB2 H 18.101 -4.348 3.076 1.00 . A A . 105 TYR HB2 1 1 5 5682 1 1 70 TYR HB3 H 19.054 -5.067 4.374 1.00 . A A . 105 TYR HB3 1 1 5 5683 1 1 70 TYR HD1 H 20.533 -7.020 3.895 1.00 . A A . 105 TYR HD1 1 1 5 5684 1 1 70 TYR HD2 H 18.387 -5.030 0.816 1.00 . A A . 105 TYR HD2 1 1 5 5685 1 1 70 TYR HE1 H 21.931 -8.134 2.197 1.00 . A A . 105 TYR HE1 1 1 5 5686 1 1 70 TYR HE2 H 19.768 -6.140 -0.872 1.00 . A A . 105 TYR HE2 1 1 5 5687 1 1 70 TYR HH H 21.687 -8.775 -0.183 1.00 . A A . 105 TYR HH 1 1 5 5688 1 1 70 TYR N N 16.144 -5.420 4.416 1.00 . A A . 105 TYR N 1 1 5 5689 1 1 70 TYR O O 18.746 -7.244 5.476 1.00 . A A . 105 TYR O 1 1 5 5690 1 1 70 TYR OH O 21.703 -7.832 -0.394 1.00 . A A . 105 TYR OH 1 1 5 5691 1 1 71 ASP C C 16.769 -10.434 5.514 1.00 . A A . 106 ASP C 1 1 5 5692 1 1 71 ASP CA C 16.748 -9.069 6.197 1.00 . A A . 106 ASP CA 1 1 5 5693 1 1 71 ASP CB C 15.547 -8.912 7.142 1.00 . A A . 106 ASP CB 1 1 5 5694 1 1 71 ASP CG C 15.584 -9.807 8.356 1.00 . A A . 106 ASP CG 1 1 5 5695 1 1 71 ASP H H 15.827 -7.950 4.671 1.00 . A A . 106 ASP H 1 1 5 5696 1 1 71 ASP HA H 17.664 -8.928 6.752 1.00 . A A . 106 ASP HA 1 1 5 5697 1 1 71 ASP HB2 H 15.507 -7.889 7.484 1.00 . A A . 106 ASP HB2 1 1 5 5698 1 1 71 ASP HB3 H 14.644 -9.121 6.588 1.00 . A A . 106 ASP HB3 1 1 5 5699 1 1 71 ASP N N 16.662 -8.041 5.182 1.00 . A A . 106 ASP N 1 1 5 5700 1 1 71 ASP O O 16.469 -11.475 6.096 1.00 . A A . 106 ASP O 1 1 5 5701 1 1 71 ASP OD1 O 16.569 -9.753 9.119 1.00 . A A . 106 ASP OD1 1 1 5 5702 1 1 71 ASP OD2 O 14.593 -10.528 8.601 1.00 . A A . 106 ASP OD2 1 1 5 5703 1 1 72 GLU C C 18.672 -12.023 3.456 1.00 . A A . 107 GLU C 1 1 5 5704 1 1 72 GLU CA C 17.234 -11.570 3.445 1.00 . A A . 107 GLU CA 1 1 5 5705 1 1 72 GLU CB C 16.780 -11.295 2.017 1.00 . A A . 107 GLU CB 1 1 5 5706 1 1 72 GLU CD C 14.912 -10.771 0.437 1.00 . A A . 107 GLU CD 1 1 5 5707 1 1 72 GLU CG C 15.301 -11.000 1.872 1.00 . A A . 107 GLU CG 1 1 5 5708 1 1 72 GLU H H 17.334 -9.530 3.862 1.00 . A A . 107 GLU H 1 1 5 5709 1 1 72 GLU HA H 16.615 -12.343 3.875 1.00 . A A . 107 GLU HA 1 1 5 5710 1 1 72 GLU HB2 H 17.328 -10.440 1.651 1.00 . A A . 107 GLU HB2 1 1 5 5711 1 1 72 GLU HB3 H 17.023 -12.148 1.403 1.00 . A A . 107 GLU HB3 1 1 5 5712 1 1 72 GLU HG2 H 14.731 -11.833 2.255 1.00 . A A . 107 GLU HG2 1 1 5 5713 1 1 72 GLU HG3 H 15.067 -10.111 2.438 1.00 . A A . 107 GLU HG3 1 1 5 5714 1 1 72 GLU N N 17.114 -10.396 4.258 1.00 . A A . 107 GLU N 1 1 5 5715 1 1 72 GLU O O 19.489 -11.464 2.697 1.00 . A A . 107 GLU O 1 1 5 5716 1 1 72 GLU OXT O 19.010 -12.909 4.260 1.00 . A A . 107 GLU OXT 1 1 5 5717 1 1 72 GLU OE1 O 14.937 -11.729 -0.361 1.00 . A A . 107 GLU OE1 1 1 5 5718 1 1 72 GLU OE2 O 14.546 -9.635 0.077 1.00 . A A . 107 GLU OE2 1 1 5 5719 2 2 1 ZN ZN ZN -7.245 0.672 -4.320 1.00 . B A . 201 ZN ZN 1 1 5 5720 3 2 1 ZN ZN ZN 10.254 0.521 -6.555 1.00 . C A . 202 ZN ZN 1 1 6 5721 1 1 1 ARG C C -25.632 1.846 -0.052 1.00 . A A . 36 ARG C 1 1 6 5722 1 1 1 ARG CA C -26.250 2.162 -1.428 1.00 . A A . 36 ARG CA 1 1 6 5723 1 1 1 ARG CB C -25.254 2.872 -2.384 1.00 . A A . 36 ARG CB 1 1 6 5724 1 1 1 ARG CD C -24.042 4.958 -3.107 1.00 . A A . 36 ARG CD 1 1 6 5725 1 1 1 ARG CG C -24.909 4.319 -2.031 1.00 . A A . 36 ARG CG 1 1 6 5726 1 1 1 ARG CZ C -24.330 5.689 -5.488 1.00 . A A . 36 ARG CZ 1 1 6 5727 1 1 1 ARG H1 H -28.188 2.386 -0.735 1.00 . A A . 36 ARG H1 1 1 6 5728 1 1 1 ARG H2 H -27.930 3.156 -2.203 1.00 . A A . 36 ARG H2 1 1 6 5729 1 1 1 ARG H3 H -27.327 3.815 -0.775 1.00 . A A . 36 ARG H3 1 1 6 5730 1 1 1 ARG HA H -26.542 1.217 -1.863 1.00 . A A . 36 ARG HA 1 1 6 5731 1 1 1 ARG HB2 H -24.329 2.314 -2.388 1.00 . A A . 36 ARG HB2 1 1 6 5732 1 1 1 ARG HB3 H -25.667 2.853 -3.381 1.00 . A A . 36 ARG HB3 1 1 6 5733 1 1 1 ARG HD2 H -23.819 5.973 -2.813 1.00 . A A . 36 ARG HD2 1 1 6 5734 1 1 1 ARG HD3 H -23.123 4.397 -3.195 1.00 . A A . 36 ARG HD3 1 1 6 5735 1 1 1 ARG HE H -25.520 4.412 -4.486 1.00 . A A . 36 ARG HE 1 1 6 5736 1 1 1 ARG HG2 H -25.818 4.890 -1.931 1.00 . A A . 36 ARG HG2 1 1 6 5737 1 1 1 ARG HG3 H -24.370 4.330 -1.095 1.00 . A A . 36 ARG HG3 1 1 6 5738 1 1 1 ARG HH11 H -22.696 6.587 -4.607 1.00 . A A . 36 ARG HH11 1 1 6 5739 1 1 1 ARG HH12 H -22.962 7.032 -6.215 1.00 . A A . 36 ARG HH12 1 1 6 5740 1 1 1 ARG HH21 H -25.842 5.028 -6.698 1.00 . A A . 36 ARG HH21 1 1 6 5741 1 1 1 ARG HH22 H -24.753 6.117 -7.438 1.00 . A A . 36 ARG HH22 1 1 6 5742 1 1 1 ARG N N -27.495 2.927 -1.288 1.00 . A A . 36 ARG N 1 1 6 5743 1 1 1 ARG NE N -24.717 4.980 -4.419 1.00 . A A . 36 ARG NE 1 1 6 5744 1 1 1 ARG NH1 N -23.260 6.480 -5.430 1.00 . A A . 36 ARG NH1 1 1 6 5745 1 1 1 ARG NH2 N -25.025 5.607 -6.618 1.00 . A A . 36 ARG NH2 1 1 6 5746 1 1 1 ARG O O -24.585 2.390 0.342 1.00 . A A . 36 ARG O 1 1 6 5747 1 1 2 ALA C C -24.956 -0.648 1.962 1.00 . A A . 37 ALA C 1 1 6 5748 1 1 2 ALA CA C -25.850 0.581 2.007 1.00 . A A . 37 ALA CA 1 1 6 5749 1 1 2 ALA CB C -27.055 0.332 2.904 1.00 . A A . 37 ALA CB 1 1 6 5750 1 1 2 ALA H H -27.046 0.480 0.275 1.00 . A A . 37 ALA H 1 1 6 5751 1 1 2 ALA HA H -25.286 1.410 2.410 1.00 . A A . 37 ALA HA 1 1 6 5752 1 1 2 ALA HB1 H -27.666 1.221 2.949 1.00 . A A . 37 ALA HB1 1 1 6 5753 1 1 2 ALA HB2 H -26.720 0.068 3.896 1.00 . A A . 37 ALA HB2 1 1 6 5754 1 1 2 ALA HB3 H -27.636 -0.482 2.497 1.00 . A A . 37 ALA HB3 1 1 6 5755 1 1 2 ALA N N -26.277 0.947 0.670 1.00 . A A . 37 ALA N 1 1 6 5756 1 1 2 ALA O O -25.435 -1.794 1.993 1.00 . A A . 37 ALA O 1 1 6 5757 1 1 3 GLN C C -21.396 -0.820 2.338 1.00 . A A . 38 GLN C 1 1 6 5758 1 1 3 GLN CA C -22.677 -1.438 1.824 1.00 . A A . 38 GLN CA 1 1 6 5759 1 1 3 GLN CB C -22.492 -1.921 0.373 1.00 . A A . 38 GLN CB 1 1 6 5760 1 1 3 GLN CD C -21.815 -4.263 1.047 1.00 . A A . 38 GLN CD 1 1 6 5761 1 1 3 GLN CG C -21.480 -3.055 0.197 1.00 . A A . 38 GLN CG 1 1 6 5762 1 1 3 GLN H H -23.367 0.522 1.835 1.00 . A A . 38 GLN H 1 1 6 5763 1 1 3 GLN HA H -22.977 -2.261 2.455 1.00 . A A . 38 GLN HA 1 1 6 5764 1 1 3 GLN HB2 H -23.446 -2.255 -0.008 1.00 . A A . 38 GLN HB2 1 1 6 5765 1 1 3 GLN HB3 H -22.166 -1.078 -0.217 1.00 . A A . 38 GLN HB3 1 1 6 5766 1 1 3 GLN HE21 H -22.913 -5.002 -0.405 1.00 . A A . 38 GLN HE21 1 1 6 5767 1 1 3 GLN HE22 H -22.859 -5.927 1.049 1.00 . A A . 38 GLN HE22 1 1 6 5768 1 1 3 GLN HG2 H -21.468 -3.357 -0.839 1.00 . A A . 38 GLN HG2 1 1 6 5769 1 1 3 GLN HG3 H -20.502 -2.695 0.482 1.00 . A A . 38 GLN HG3 1 1 6 5770 1 1 3 GLN N N -23.682 -0.407 1.868 1.00 . A A . 38 GLN N 1 1 6 5771 1 1 3 GLN NE2 N -22.593 -5.151 0.511 1.00 . A A . 38 GLN NE2 1 1 6 5772 1 1 3 GLN O O -21.238 0.401 2.252 1.00 . A A . 38 GLN O 1 1 6 5773 1 1 3 GLN OE1 O -21.367 -4.376 2.198 1.00 . A A . 38 GLN OE1 1 1 6 5774 1 1 4 VAL C C -18.315 -0.872 2.242 1.00 . A A . 39 VAL C 1 1 6 5775 1 1 4 VAL CA C -19.254 -1.143 3.407 1.00 . A A . 39 VAL CA 1 1 6 5776 1 1 4 VAL CB C -18.590 -2.146 4.389 1.00 . A A . 39 VAL CB 1 1 6 5777 1 1 4 VAL CG1 C -17.339 -1.537 5.016 1.00 . A A . 39 VAL CG1 1 1 6 5778 1 1 4 VAL CG2 C -19.570 -2.583 5.467 1.00 . A A . 39 VAL CG2 1 1 6 5779 1 1 4 VAL H H -20.707 -2.592 2.931 1.00 . A A . 39 VAL H 1 1 6 5780 1 1 4 VAL HA H -19.448 -0.213 3.920 1.00 . A A . 39 VAL HA 1 1 6 5781 1 1 4 VAL HB H -18.288 -3.016 3.823 1.00 . A A . 39 VAL HB 1 1 6 5782 1 1 4 VAL HG11 H -17.610 -0.646 5.564 1.00 . A A . 39 VAL HG11 1 1 6 5783 1 1 4 VAL HG12 H -16.637 -1.276 4.239 1.00 . A A . 39 VAL HG12 1 1 6 5784 1 1 4 VAL HG13 H -16.886 -2.250 5.689 1.00 . A A . 39 VAL HG13 1 1 6 5785 1 1 4 VAL HG21 H -20.420 -3.064 5.007 1.00 . A A . 39 VAL HG21 1 1 6 5786 1 1 4 VAL HG22 H -19.903 -1.713 6.013 1.00 . A A . 39 VAL HG22 1 1 6 5787 1 1 4 VAL HG23 H -19.084 -3.271 6.143 1.00 . A A . 39 VAL HG23 1 1 6 5788 1 1 4 VAL N N -20.514 -1.630 2.888 1.00 . A A . 39 VAL N 1 1 6 5789 1 1 4 VAL O O -17.706 -1.791 1.686 1.00 . A A . 39 VAL O 1 1 6 5790 1 1 5 LYS C C -16.480 1.850 1.187 1.00 . A A . 40 LYS C 1 1 6 5791 1 1 5 LYS CA C -17.441 0.778 0.747 1.00 . A A . 40 LYS CA 1 1 6 5792 1 1 5 LYS CB C -18.312 1.199 -0.446 1.00 . A A . 40 LYS CB 1 1 6 5793 1 1 5 LYS CD C -19.941 0.403 -2.227 1.00 . A A . 40 LYS CD 1 1 6 5794 1 1 5 LYS CE C -20.628 -0.836 -2.793 1.00 . A A . 40 LYS CE 1 1 6 5795 1 1 5 LYS CG C -19.120 0.032 -1.008 1.00 . A A . 40 LYS CG 1 1 6 5796 1 1 5 LYS H H -18.736 1.060 2.345 1.00 . A A . 40 LYS H 1 1 6 5797 1 1 5 LYS HA H -16.856 -0.085 0.463 1.00 . A A . 40 LYS HA 1 1 6 5798 1 1 5 LYS HB2 H -18.995 1.972 -0.126 1.00 . A A . 40 LYS HB2 1 1 6 5799 1 1 5 LYS HB3 H -17.679 1.584 -1.231 1.00 . A A . 40 LYS HB3 1 1 6 5800 1 1 5 LYS HD2 H -20.691 1.123 -1.937 1.00 . A A . 40 LYS HD2 1 1 6 5801 1 1 5 LYS HD3 H -19.297 0.829 -2.980 1.00 . A A . 40 LYS HD3 1 1 6 5802 1 1 5 LYS HE2 H -19.870 -1.566 -3.032 1.00 . A A . 40 LYS HE2 1 1 6 5803 1 1 5 LYS HE3 H -21.278 -1.249 -2.037 1.00 . A A . 40 LYS HE3 1 1 6 5804 1 1 5 LYS HG2 H -18.442 -0.764 -1.277 1.00 . A A . 40 LYS HG2 1 1 6 5805 1 1 5 LYS HG3 H -19.781 -0.323 -0.231 1.00 . A A . 40 LYS HG3 1 1 6 5806 1 1 5 LYS HZ1 H -20.824 -0.209 -4.787 1.00 . A A . 40 LYS HZ1 1 1 6 5807 1 1 5 LYS HZ2 H -22.147 0.156 -3.826 1.00 . A A . 40 LYS HZ2 1 1 6 5808 1 1 5 LYS HZ3 H -21.886 -1.426 -4.338 1.00 . A A . 40 LYS HZ3 1 1 6 5809 1 1 5 LYS N N -18.243 0.370 1.852 1.00 . A A . 40 LYS N 1 1 6 5810 1 1 5 LYS NZ N -21.414 -0.559 -4.007 1.00 . A A . 40 LYS NZ 1 1 6 5811 1 1 5 LYS O O -16.846 3.016 1.419 1.00 . A A . 40 LYS O 1 1 6 5812 1 1 6 GLU C C -13.529 2.890 0.657 1.00 . A A . 41 GLU C 1 1 6 5813 1 1 6 GLU CA C -14.181 2.231 1.833 1.00 . A A . 41 GLU CA 1 1 6 5814 1 1 6 GLU CB C -13.180 1.284 2.468 1.00 . A A . 41 GLU CB 1 1 6 5815 1 1 6 GLU CD C -13.854 1.341 4.878 1.00 . A A . 41 GLU CD 1 1 6 5816 1 1 6 GLU CG C -13.738 0.501 3.633 1.00 . A A . 41 GLU CG 1 1 6 5817 1 1 6 GLU H H -15.090 0.499 1.105 1.00 . A A . 41 GLU H 1 1 6 5818 1 1 6 GLU HA H -14.513 2.946 2.569 1.00 . A A . 41 GLU HA 1 1 6 5819 1 1 6 GLU HB2 H -12.838 0.587 1.718 1.00 . A A . 41 GLU HB2 1 1 6 5820 1 1 6 GLU HB3 H -12.337 1.859 2.821 1.00 . A A . 41 GLU HB3 1 1 6 5821 1 1 6 GLU HG2 H -14.728 0.173 3.348 1.00 . A A . 41 GLU HG2 1 1 6 5822 1 1 6 GLU HG3 H -13.118 -0.364 3.809 1.00 . A A . 41 GLU HG3 1 1 6 5823 1 1 6 GLU N N -15.279 1.429 1.351 1.00 . A A . 41 GLU N 1 1 6 5824 1 1 6 GLU O O -13.675 2.422 -0.449 1.00 . A A . 41 GLU O 1 1 6 5825 1 1 6 GLU OE1 O -14.830 2.105 5.013 1.00 . A A . 41 GLU OE1 1 1 6 5826 1 1 6 GLU OE2 O -12.971 1.270 5.730 1.00 . A A . 41 GLU OE2 1 1 6 5827 1 1 7 THR C C -10.657 4.285 -0.002 1.00 . A A . 42 THR C 1 1 6 5828 1 1 7 THR CA C -12.149 4.524 -0.238 1.00 . A A . 42 THR CA 1 1 6 5829 1 1 7 THR CB C -12.442 6.007 -0.436 1.00 . A A . 42 THR CB 1 1 6 5830 1 1 7 THR CG2 C -12.524 6.280 -1.930 1.00 . A A . 42 THR CG2 1 1 6 5831 1 1 7 THR H H -12.788 4.382 1.737 1.00 . A A . 42 THR H 1 1 6 5832 1 1 7 THR HA H -12.473 3.966 -1.108 1.00 . A A . 42 THR HA 1 1 6 5833 1 1 7 THR HB H -11.617 6.571 -0.028 1.00 . A A . 42 THR HB 1 1 6 5834 1 1 7 THR HG1 H -13.572 6.400 1.097 1.00 . A A . 42 THR HG1 1 1 6 5835 1 1 7 THR HG21 H -13.313 5.669 -2.347 1.00 . A A . 42 THR HG21 1 1 6 5836 1 1 7 THR HG22 H -11.584 6.031 -2.402 1.00 . A A . 42 THR HG22 1 1 6 5837 1 1 7 THR HG23 H -12.752 7.321 -2.099 1.00 . A A . 42 THR HG23 1 1 6 5838 1 1 7 THR N N -12.855 3.961 0.854 1.00 . A A . 42 THR N 1 1 6 5839 1 1 7 THR O O -10.164 4.380 1.128 1.00 . A A . 42 THR O 1 1 6 5840 1 1 7 THR OG1 O -13.736 6.330 0.146 1.00 . A A . 42 THR OG1 1 1 6 5841 1 1 8 CYS C C -7.608 4.668 -0.958 1.00 . A A . 43 CYS C 1 1 6 5842 1 1 8 CYS CA C -8.610 3.529 -1.009 1.00 . A A . 43 CYS CA 1 1 6 5843 1 1 8 CYS CB C -8.404 2.636 -2.221 1.00 . A A . 43 CYS CB 1 1 6 5844 1 1 8 CYS H H -10.398 4.092 -1.929 1.00 . A A . 43 CYS H 1 1 6 5845 1 1 8 CYS HA H -8.496 2.908 -0.132 1.00 . A A . 43 CYS HA 1 1 6 5846 1 1 8 CYS HB2 H -8.664 1.633 -1.922 1.00 . A A . 43 CYS HB2 1 1 6 5847 1 1 8 CYS HB3 H -9.083 2.916 -3.012 1.00 . A A . 43 CYS HB3 1 1 6 5848 1 1 8 CYS N N -9.972 3.978 -1.053 1.00 . A A . 43 CYS N 1 1 6 5849 1 1 8 CYS O O -7.822 5.711 -1.529 1.00 . A A . 43 CYS O 1 1 6 5850 1 1 8 CYS SG S -6.757 2.511 -2.874 1.00 . A A . 43 CYS SG 1 1 6 5851 1 1 9 ALA C C -4.322 5.198 -1.149 1.00 . A A . 44 ALA C 1 1 6 5852 1 1 9 ALA CA C -5.454 5.435 -0.154 1.00 . A A . 44 ALA CA 1 1 6 5853 1 1 9 ALA CB C -4.893 5.428 1.231 1.00 . A A . 44 ALA CB 1 1 6 5854 1 1 9 ALA H H -6.436 3.595 0.228 1.00 . A A . 44 ALA H 1 1 6 5855 1 1 9 ALA HA H -5.884 6.410 -0.323 1.00 . A A . 44 ALA HA 1 1 6 5856 1 1 9 ALA HB1 H -4.424 4.473 1.417 1.00 . A A . 44 ALA HB1 1 1 6 5857 1 1 9 ALA HB2 H -5.699 5.613 1.923 1.00 . A A . 44 ALA HB2 1 1 6 5858 1 1 9 ALA HB3 H -4.160 6.217 1.282 1.00 . A A . 44 ALA HB3 1 1 6 5859 1 1 9 ALA N N -6.508 4.442 -0.265 1.00 . A A . 44 ALA N 1 1 6 5860 1 1 9 ALA O O -3.475 6.068 -1.353 1.00 . A A . 44 ALA O 1 1 6 5861 1 1 10 ALA C C -3.562 3.986 -4.121 1.00 . A A . 45 ALA C 1 1 6 5862 1 1 10 ALA CA C -3.220 3.676 -2.674 1.00 . A A . 45 ALA CA 1 1 6 5863 1 1 10 ALA CB C -2.854 2.215 -2.493 1.00 . A A . 45 ALA CB 1 1 6 5864 1 1 10 ALA H H -5.041 3.392 -1.655 1.00 . A A . 45 ALA H 1 1 6 5865 1 1 10 ALA HA H -2.364 4.272 -2.397 1.00 . A A . 45 ALA HA 1 1 6 5866 1 1 10 ALA HB1 H -2.642 2.047 -1.444 1.00 . A A . 45 ALA HB1 1 1 6 5867 1 1 10 ALA HB2 H -1.982 1.984 -3.087 1.00 . A A . 45 ALA HB2 1 1 6 5868 1 1 10 ALA HB3 H -3.680 1.589 -2.799 1.00 . A A . 45 ALA HB3 1 1 6 5869 1 1 10 ALA N N -4.308 4.032 -1.777 1.00 . A A . 45 ALA N 1 1 6 5870 1 1 10 ALA O O -2.687 4.074 -4.970 1.00 . A A . 45 ALA O 1 1 6 5871 1 1 11 CYS C C -6.596 5.309 -5.690 1.00 . A A . 46 CYS C 1 1 6 5872 1 1 11 CYS CA C -5.307 4.455 -5.713 1.00 . A A . 46 CYS CA 1 1 6 5873 1 1 11 CYS CB C -5.381 3.188 -6.621 1.00 . A A . 46 CYS CB 1 1 6 5874 1 1 11 CYS H H -5.479 3.988 -3.664 1.00 . A A . 46 CYS H 1 1 6 5875 1 1 11 CYS HA H -4.540 5.103 -6.109 1.00 . A A . 46 CYS HA 1 1 6 5876 1 1 11 CYS HB2 H -4.815 3.139 -7.536 1.00 . A A . 46 CYS HB2 1 1 6 5877 1 1 11 CYS HB3 H -4.648 2.629 -6.051 1.00 . A A . 46 CYS HB3 1 1 6 5878 1 1 11 CYS N N -4.840 4.124 -4.392 1.00 . A A . 46 CYS N 1 1 6 5879 1 1 11 CYS O O -7.120 5.675 -6.730 1.00 . A A . 46 CYS O 1 1 6 5880 1 1 11 CYS SG S -6.842 2.108 -6.513 1.00 . A A . 46 CYS SG 1 1 6 5881 1 1 12 GLN C C -9.528 6.081 -4.969 1.00 . A A . 47 GLN C 1 1 6 5882 1 1 12 GLN CA C -8.267 6.511 -4.230 1.00 . A A . 47 GLN CA 1 1 6 5883 1 1 12 GLN CB C -7.978 7.977 -4.422 1.00 . A A . 47 GLN CB 1 1 6 5884 1 1 12 GLN CD C -6.527 9.927 -3.693 1.00 . A A . 47 GLN CD 1 1 6 5885 1 1 12 GLN CG C -7.016 8.527 -3.390 1.00 . A A . 47 GLN CG 1 1 6 5886 1 1 12 GLN H H -6.565 5.411 -3.654 1.00 . A A . 47 GLN H 1 1 6 5887 1 1 12 GLN HA H -8.474 6.363 -3.180 1.00 . A A . 47 GLN HA 1 1 6 5888 1 1 12 GLN HB2 H -7.609 8.156 -5.419 1.00 . A A . 47 GLN HB2 1 1 6 5889 1 1 12 GLN HB3 H -8.929 8.472 -4.289 1.00 . A A . 47 GLN HB3 1 1 6 5890 1 1 12 GLN HE21 H -6.522 9.566 -5.642 1.00 . A A . 47 GLN HE21 1 1 6 5891 1 1 12 GLN HE22 H -6.013 11.140 -5.169 1.00 . A A . 47 GLN HE22 1 1 6 5892 1 1 12 GLN HG2 H -7.521 8.544 -2.435 1.00 . A A . 47 GLN HG2 1 1 6 5893 1 1 12 GLN HG3 H -6.174 7.855 -3.328 1.00 . A A . 47 GLN HG3 1 1 6 5894 1 1 12 GLN N N -7.058 5.664 -4.463 1.00 . A A . 47 GLN N 1 1 6 5895 1 1 12 GLN NE2 N -6.342 10.240 -4.950 1.00 . A A . 47 GLN NE2 1 1 6 5896 1 1 12 GLN O O -10.347 6.905 -5.386 1.00 . A A . 47 GLN O 1 1 6 5897 1 1 12 GLN OE1 O -6.266 10.712 -2.776 1.00 . A A . 47 GLN OE1 1 1 6 5898 1 1 13 LYS C C -11.580 3.498 -4.651 1.00 . A A . 48 LYS C 1 1 6 5899 1 1 13 LYS CA C -10.846 4.227 -5.720 1.00 . A A . 48 LYS CA 1 1 6 5900 1 1 13 LYS CB C -10.431 3.273 -6.839 1.00 . A A . 48 LYS CB 1 1 6 5901 1 1 13 LYS CD C -10.304 5.126 -8.584 1.00 . A A . 48 LYS CD 1 1 6 5902 1 1 13 LYS CE C -11.611 4.737 -9.256 1.00 . A A . 48 LYS CE 1 1 6 5903 1 1 13 LYS CG C -9.597 3.928 -7.939 1.00 . A A . 48 LYS CG 1 1 6 5904 1 1 13 LYS H H -9.023 4.200 -4.721 1.00 . A A . 48 LYS H 1 1 6 5905 1 1 13 LYS HA H -11.467 5.018 -6.113 1.00 . A A . 48 LYS HA 1 1 6 5906 1 1 13 LYS HB2 H -9.844 2.476 -6.407 1.00 . A A . 48 LYS HB2 1 1 6 5907 1 1 13 LYS HB3 H -11.319 2.848 -7.285 1.00 . A A . 48 LYS HB3 1 1 6 5908 1 1 13 LYS HD2 H -10.513 5.866 -7.826 1.00 . A A . 48 LYS HD2 1 1 6 5909 1 1 13 LYS HD3 H -9.644 5.553 -9.325 1.00 . A A . 48 LYS HD3 1 1 6 5910 1 1 13 LYS HE2 H -11.399 4.045 -10.057 1.00 . A A . 48 LYS HE2 1 1 6 5911 1 1 13 LYS HE3 H -12.240 4.253 -8.524 1.00 . A A . 48 LYS HE3 1 1 6 5912 1 1 13 LYS HG2 H -8.672 4.273 -7.500 1.00 . A A . 48 LYS HG2 1 1 6 5913 1 1 13 LYS HG3 H -9.377 3.185 -8.687 1.00 . A A . 48 LYS HG3 1 1 6 5914 1 1 13 LYS HZ1 H -13.189 5.610 -10.294 1.00 . A A . 48 LYS HZ1 1 1 6 5915 1 1 13 LYS HZ2 H -11.718 6.430 -10.474 1.00 . A A . 48 LYS HZ2 1 1 6 5916 1 1 13 LYS HZ3 H -12.590 6.566 -9.044 1.00 . A A . 48 LYS HZ3 1 1 6 5917 1 1 13 LYS N N -9.692 4.805 -5.093 1.00 . A A . 48 LYS N 1 1 6 5918 1 1 13 LYS NZ N -12.322 5.910 -9.805 1.00 . A A . 48 LYS NZ 1 1 6 5919 1 1 13 LYS O O -10.969 3.111 -3.654 1.00 . A A . 48 LYS O 1 1 6 5920 1 1 14 THR C C -13.340 1.246 -3.732 1.00 . A A . 49 THR C 1 1 6 5921 1 1 14 THR CA C -13.644 2.746 -3.793 1.00 . A A . 49 THR CA 1 1 6 5922 1 1 14 THR CB C -15.109 2.983 -4.067 1.00 . A A . 49 THR CB 1 1 6 5923 1 1 14 THR CG2 C -15.890 2.840 -2.784 1.00 . A A . 49 THR CG2 1 1 6 5924 1 1 14 THR H H -13.312 3.715 -5.589 1.00 . A A . 49 THR H 1 1 6 5925 1 1 14 THR HA H -13.405 3.182 -2.839 1.00 . A A . 49 THR HA 1 1 6 5926 1 1 14 THR HB H -15.431 2.238 -4.770 1.00 . A A . 49 THR HB 1 1 6 5927 1 1 14 THR HG1 H -15.507 4.906 -3.819 1.00 . A A . 49 THR HG1 1 1 6 5928 1 1 14 THR HG21 H -15.833 1.818 -2.440 1.00 . A A . 49 THR HG21 1 1 6 5929 1 1 14 THR HG22 H -16.918 3.135 -2.929 1.00 . A A . 49 THR HG22 1 1 6 5930 1 1 14 THR HG23 H -15.408 3.481 -2.056 1.00 . A A . 49 THR HG23 1 1 6 5931 1 1 14 THR N N -12.853 3.377 -4.789 1.00 . A A . 49 THR N 1 1 6 5932 1 1 14 THR O O -13.348 0.546 -4.764 1.00 . A A . 49 THR O 1 1 6 5933 1 1 14 THR OG1 O -15.273 4.332 -4.556 1.00 . A A . 49 THR OG1 1 1 6 5934 1 1 15 VAL C C -13.935 -1.274 -1.873 1.00 . A A . 50 VAL C 1 1 6 5935 1 1 15 VAL CA C -12.689 -0.578 -2.302 1.00 . A A . 50 VAL CA 1 1 6 5936 1 1 15 VAL CB C -11.645 -0.742 -1.159 1.00 . A A . 50 VAL CB 1 1 6 5937 1 1 15 VAL CG1 C -10.736 -1.898 -1.466 1.00 . A A . 50 VAL CG1 1 1 6 5938 1 1 15 VAL CG2 C -10.858 0.522 -0.935 1.00 . A A . 50 VAL CG2 1 1 6 5939 1 1 15 VAL H H -13.102 1.399 -1.780 1.00 . A A . 50 VAL H 1 1 6 5940 1 1 15 VAL HA H -12.280 -0.986 -3.215 1.00 . A A . 50 VAL HA 1 1 6 5941 1 1 15 VAL HB H -12.148 -1.027 -0.241 1.00 . A A . 50 VAL HB 1 1 6 5942 1 1 15 VAL HG11 H -10.293 -1.751 -2.441 1.00 . A A . 50 VAL HG11 1 1 6 5943 1 1 15 VAL HG12 H -11.285 -2.827 -1.447 1.00 . A A . 50 VAL HG12 1 1 6 5944 1 1 15 VAL HG13 H -9.943 -1.920 -0.732 1.00 . A A . 50 VAL HG13 1 1 6 5945 1 1 15 VAL HG21 H -11.519 1.302 -0.589 1.00 . A A . 50 VAL HG21 1 1 6 5946 1 1 15 VAL HG22 H -10.453 0.825 -1.892 1.00 . A A . 50 VAL HG22 1 1 6 5947 1 1 15 VAL HG23 H -10.064 0.357 -0.222 1.00 . A A . 50 VAL HG23 1 1 6 5948 1 1 15 VAL N N -13.037 0.785 -2.545 1.00 . A A . 50 VAL N 1 1 6 5949 1 1 15 VAL O O -14.704 -0.744 -1.054 1.00 . A A . 50 VAL O 1 1 6 5950 1 1 16 TYR C C -14.890 -4.300 -1.195 1.00 . A A . 51 TYR C 1 1 6 5951 1 1 16 TYR CA C -15.332 -3.147 -2.079 1.00 . A A . 51 TYR CA 1 1 6 5952 1 1 16 TYR CB C -16.019 -3.596 -3.380 1.00 . A A . 51 TYR CB 1 1 6 5953 1 1 16 TYR CD1 C -17.044 -1.390 -3.965 1.00 . A A . 51 TYR CD1 1 1 6 5954 1 1 16 TYR CD2 C -15.665 -2.407 -5.595 1.00 . A A . 51 TYR CD2 1 1 6 5955 1 1 16 TYR CE1 C -17.257 -0.311 -4.800 1.00 . A A . 51 TYR CE1 1 1 6 5956 1 1 16 TYR CE2 C -15.871 -1.336 -6.447 1.00 . A A . 51 TYR CE2 1 1 6 5957 1 1 16 TYR CG C -16.254 -2.443 -4.338 1.00 . A A . 51 TYR CG 1 1 6 5958 1 1 16 TYR CZ C -16.670 -0.287 -6.038 1.00 . A A . 51 TYR CZ 1 1 6 5959 1 1 16 TYR H H -13.504 -2.802 -3.018 1.00 . A A . 51 TYR H 1 1 6 5960 1 1 16 TYR HA H -15.988 -2.497 -1.518 1.00 . A A . 51 TYR HA 1 1 6 5961 1 1 16 TYR HB2 H -15.402 -4.314 -3.890 1.00 . A A . 51 TYR HB2 1 1 6 5962 1 1 16 TYR HB3 H -16.979 -4.032 -3.149 1.00 . A A . 51 TYR HB3 1 1 6 5963 1 1 16 TYR HD1 H -17.483 -1.448 -2.982 1.00 . A A . 51 TYR HD1 1 1 6 5964 1 1 16 TYR HD2 H -15.042 -3.231 -5.907 1.00 . A A . 51 TYR HD2 1 1 6 5965 1 1 16 TYR HE1 H -17.884 0.509 -4.484 1.00 . A A . 51 TYR HE1 1 1 6 5966 1 1 16 TYR HE2 H -15.407 -1.322 -7.422 1.00 . A A . 51 TYR HE2 1 1 6 5967 1 1 16 TYR HH H -17.117 0.454 -7.744 1.00 . A A . 51 TYR HH 1 1 6 5968 1 1 16 TYR N N -14.161 -2.411 -2.404 1.00 . A A . 51 TYR N 1 1 6 5969 1 1 16 TYR O O -13.709 -4.639 -1.241 1.00 . A A . 51 TYR O 1 1 6 5970 1 1 16 TYR OH O -16.873 0.798 -6.873 1.00 . A A . 51 TYR OH 1 1 6 5971 1 1 17 PRO C C -14.465 -7.042 0.074 1.00 . A A . 52 PRO C 1 1 6 5972 1 1 17 PRO CA C -15.405 -5.951 0.611 1.00 . A A . 52 PRO CA 1 1 6 5973 1 1 17 PRO CB C -16.738 -6.555 0.994 1.00 . A A . 52 PRO CB 1 1 6 5974 1 1 17 PRO CD C -17.228 -4.597 -0.298 1.00 . A A . 52 PRO CD 1 1 6 5975 1 1 17 PRO CG C -17.712 -5.436 0.858 1.00 . A A . 52 PRO CG 1 1 6 5976 1 1 17 PRO HA H -14.957 -5.518 1.488 1.00 . A A . 52 PRO HA 1 1 6 5977 1 1 17 PRO HB2 H -16.923 -7.355 0.300 1.00 . A A . 52 PRO HB2 1 1 6 5978 1 1 17 PRO HB3 H -16.696 -6.942 2.001 1.00 . A A . 52 PRO HB3 1 1 6 5979 1 1 17 PRO HD2 H -17.737 -4.876 -1.208 1.00 . A A . 52 PRO HD2 1 1 6 5980 1 1 17 PRO HD3 H -17.380 -3.548 -0.090 1.00 . A A . 52 PRO HD3 1 1 6 5981 1 1 17 PRO HG2 H -18.696 -5.830 0.653 1.00 . A A . 52 PRO HG2 1 1 6 5982 1 1 17 PRO HG3 H -17.727 -4.850 1.765 1.00 . A A . 52 PRO HG3 1 1 6 5983 1 1 17 PRO N N -15.783 -4.910 -0.378 1.00 . A A . 52 PRO N 1 1 6 5984 1 1 17 PRO O O -13.531 -7.435 0.753 1.00 . A A . 52 PRO O 1 1 6 5985 1 1 18 MET C C -12.361 -8.052 -1.908 1.00 . A A . 53 MET C 1 1 6 5986 1 1 18 MET CA C -13.839 -8.492 -1.795 1.00 . A A . 53 MET CA 1 1 6 5987 1 1 18 MET CB C -14.388 -8.802 -3.192 1.00 . A A . 53 MET CB 1 1 6 5988 1 1 18 MET CE C -13.038 -11.279 -6.277 1.00 . A A . 53 MET CE 1 1 6 5989 1 1 18 MET CG C -13.612 -9.864 -3.952 1.00 . A A . 53 MET CG 1 1 6 5990 1 1 18 MET H H -15.425 -7.079 -1.658 1.00 . A A . 53 MET H 1 1 6 5991 1 1 18 MET HA H -13.882 -9.398 -1.211 1.00 . A A . 53 MET HA 1 1 6 5992 1 1 18 MET HB2 H -15.399 -9.158 -3.065 1.00 . A A . 53 MET HB2 1 1 6 5993 1 1 18 MET HB3 H -14.399 -7.893 -3.777 1.00 . A A . 53 MET HB3 1 1 6 5994 1 1 18 MET HE1 H -12.026 -10.916 -6.179 1.00 . A A . 53 MET HE1 1 1 6 5995 1 1 18 MET HE2 H -13.250 -11.469 -7.319 1.00 . A A . 53 MET HE2 1 1 6 5996 1 1 18 MET HE3 H -13.151 -12.195 -5.718 1.00 . A A . 53 MET HE3 1 1 6 5997 1 1 18 MET HG2 H -12.569 -9.590 -3.926 1.00 . A A . 53 MET HG2 1 1 6 5998 1 1 18 MET HG3 H -13.738 -10.805 -3.437 1.00 . A A . 53 MET HG3 1 1 6 5999 1 1 18 MET N N -14.673 -7.465 -1.158 1.00 . A A . 53 MET N 1 1 6 6000 1 1 18 MET O O -11.446 -8.882 -1.852 1.00 . A A . 53 MET O 1 1 6 6001 1 1 18 MET SD S -14.181 -10.044 -5.657 1.00 . A A . 53 MET SD 1 1 6 6002 1 1 19 GLU C C -10.277 -5.402 -1.111 1.00 . A A . 54 GLU C 1 1 6 6003 1 1 19 GLU CA C -10.804 -6.231 -2.285 1.00 . A A . 54 GLU CA 1 1 6 6004 1 1 19 GLU CB C -10.773 -5.425 -3.581 1.00 . A A . 54 GLU CB 1 1 6 6005 1 1 19 GLU CD C -10.808 -5.613 -6.099 1.00 . A A . 54 GLU CD 1 1 6 6006 1 1 19 GLU CG C -11.162 -6.256 -4.786 1.00 . A A . 54 GLU CG 1 1 6 6007 1 1 19 GLU H H -12.873 -6.112 -2.018 1.00 . A A . 54 GLU H 1 1 6 6008 1 1 19 GLU HA H -10.147 -7.078 -2.409 1.00 . A A . 54 GLU HA 1 1 6 6009 1 1 19 GLU HB2 H -11.484 -4.618 -3.486 1.00 . A A . 54 GLU HB2 1 1 6 6010 1 1 19 GLU HB3 H -9.795 -5.003 -3.744 1.00 . A A . 54 GLU HB3 1 1 6 6011 1 1 19 GLU HG2 H -10.691 -7.221 -4.700 1.00 . A A . 54 GLU HG2 1 1 6 6012 1 1 19 GLU HG3 H -12.232 -6.402 -4.749 1.00 . A A . 54 GLU HG3 1 1 6 6013 1 1 19 GLU N N -12.136 -6.756 -2.066 1.00 . A A . 54 GLU N 1 1 6 6014 1 1 19 GLU O O -9.093 -5.074 -1.071 1.00 . A A . 54 GLU O 1 1 6 6015 1 1 19 GLU OE1 O -9.616 -5.526 -6.423 1.00 . A A . 54 GLU OE1 1 1 6 6016 1 1 19 GLU OE2 O -11.719 -5.200 -6.845 1.00 . A A . 54 GLU OE2 1 1 6 6017 1 1 20 ARG C C -9.839 -4.898 1.939 1.00 . A A . 55 ARG C 1 1 6 6018 1 1 20 ARG CA C -10.802 -4.224 0.971 1.00 . A A . 55 ARG CA 1 1 6 6019 1 1 20 ARG CB C -12.048 -3.666 1.672 1.00 . A A . 55 ARG CB 1 1 6 6020 1 1 20 ARG CD C -13.154 -3.106 3.832 1.00 . A A . 55 ARG CD 1 1 6 6021 1 1 20 ARG CG C -11.833 -3.181 3.091 1.00 . A A . 55 ARG CG 1 1 6 6022 1 1 20 ARG CZ C -13.892 -2.940 6.201 1.00 . A A . 55 ARG CZ 1 1 6 6023 1 1 20 ARG H H -12.080 -5.380 -0.261 1.00 . A A . 55 ARG H 1 1 6 6024 1 1 20 ARG HA H -10.261 -3.391 0.553 1.00 . A A . 55 ARG HA 1 1 6 6025 1 1 20 ARG HB2 H -12.358 -2.785 1.120 1.00 . A A . 55 ARG HB2 1 1 6 6026 1 1 20 ARG HB3 H -12.833 -4.393 1.635 1.00 . A A . 55 ARG HB3 1 1 6 6027 1 1 20 ARG HD2 H -13.798 -2.394 3.337 1.00 . A A . 55 ARG HD2 1 1 6 6028 1 1 20 ARG HD3 H -13.616 -4.082 3.798 1.00 . A A . 55 ARG HD3 1 1 6 6029 1 1 20 ARG HE H -12.165 -2.215 5.442 1.00 . A A . 55 ARG HE 1 1 6 6030 1 1 20 ARG HG2 H -11.149 -3.857 3.583 1.00 . A A . 55 ARG HG2 1 1 6 6031 1 1 20 ARG HG3 H -11.388 -2.197 3.058 1.00 . A A . 55 ARG HG3 1 1 6 6032 1 1 20 ARG HH11 H -15.062 -4.212 5.095 1.00 . A A . 55 ARG HH11 1 1 6 6033 1 1 20 ARG HH12 H -15.621 -3.933 6.667 1.00 . A A . 55 ARG HH12 1 1 6 6034 1 1 20 ARG HH21 H -12.915 -1.862 7.628 1.00 . A A . 55 ARG HH21 1 1 6 6035 1 1 20 ARG HH22 H -14.383 -2.551 8.150 1.00 . A A . 55 ARG HH22 1 1 6 6036 1 1 20 ARG N N -11.157 -5.061 -0.176 1.00 . A A . 55 ARG N 1 1 6 6037 1 1 20 ARG NE N -12.993 -2.710 5.235 1.00 . A A . 55 ARG NE 1 1 6 6038 1 1 20 ARG NH1 N -14.921 -3.745 5.972 1.00 . A A . 55 ARG NH1 1 1 6 6039 1 1 20 ARG NH2 N -13.718 -2.425 7.410 1.00 . A A . 55 ARG NH2 1 1 6 6040 1 1 20 ARG O O -10.190 -5.793 2.712 1.00 . A A . 55 ARG O 1 1 6 6041 1 1 21 LEU C C -7.087 -3.619 3.451 1.00 . A A . 56 LEU C 1 1 6 6042 1 1 21 LEU CA C -7.552 -4.850 2.669 1.00 . A A . 56 LEU CA 1 1 6 6043 1 1 21 LEU CB C -6.442 -5.420 1.738 1.00 . A A . 56 LEU CB 1 1 6 6044 1 1 21 LEU CD1 C -4.357 -6.711 1.435 1.00 . A A . 56 LEU CD1 1 1 6 6045 1 1 21 LEU CD2 C -4.194 -4.455 2.333 1.00 . A A . 56 LEU CD2 1 1 6 6046 1 1 21 LEU CG C -5.046 -5.716 2.317 1.00 . A A . 56 LEU CG 1 1 6 6047 1 1 21 LEU H H -8.464 -3.817 1.129 1.00 . A A . 56 LEU H 1 1 6 6048 1 1 21 LEU HA H -7.880 -5.623 3.346 1.00 . A A . 56 LEU HA 1 1 6 6049 1 1 21 LEU HB2 H -6.811 -6.342 1.315 1.00 . A A . 56 LEU HB2 1 1 6 6050 1 1 21 LEU HB3 H -6.322 -4.720 0.924 1.00 . A A . 56 LEU HB3 1 1 6 6051 1 1 21 LEU HD11 H -4.922 -7.630 1.394 1.00 . A A . 56 LEU HD11 1 1 6 6052 1 1 21 LEU HD12 H -3.368 -6.890 1.825 1.00 . A A . 56 LEU HD12 1 1 6 6053 1 1 21 LEU HD13 H -4.275 -6.282 0.447 1.00 . A A . 56 LEU HD13 1 1 6 6054 1 1 21 LEU HD21 H -3.238 -4.654 2.792 1.00 . A A . 56 LEU HD21 1 1 6 6055 1 1 21 LEU HD22 H -4.710 -3.691 2.895 1.00 . A A . 56 LEU HD22 1 1 6 6056 1 1 21 LEU HD23 H -4.046 -4.117 1.318 1.00 . A A . 56 LEU HD23 1 1 6 6057 1 1 21 LEU HG H -5.117 -6.101 3.323 1.00 . A A . 56 LEU HG 1 1 6 6058 1 1 21 LEU N N -8.649 -4.463 1.845 1.00 . A A . 56 LEU N 1 1 6 6059 1 1 21 LEU O O -7.389 -2.491 3.071 1.00 . A A . 56 LEU O 1 1 6 6060 1 1 22 VAL C C -4.357 -2.985 5.569 1.00 . A A . 57 VAL C 1 1 6 6061 1 1 22 VAL CA C -5.841 -2.734 5.285 1.00 . A A . 57 VAL CA 1 1 6 6062 1 1 22 VAL CB C -6.637 -2.430 6.608 1.00 . A A . 57 VAL CB 1 1 6 6063 1 1 22 VAL CG1 C -6.806 -3.669 7.478 1.00 . A A . 57 VAL CG1 1 1 6 6064 1 1 22 VAL CG2 C -5.971 -1.311 7.404 1.00 . A A . 57 VAL CG2 1 1 6 6065 1 1 22 VAL H H -6.255 -4.740 4.864 1.00 . A A . 57 VAL H 1 1 6 6066 1 1 22 VAL HA H -5.903 -1.868 4.641 1.00 . A A . 57 VAL HA 1 1 6 6067 1 1 22 VAL HB H -7.625 -2.097 6.324 1.00 . A A . 57 VAL HB 1 1 6 6068 1 1 22 VAL HG11 H -5.835 -4.073 7.724 1.00 . A A . 57 VAL HG11 1 1 6 6069 1 1 22 VAL HG12 H -7.387 -4.403 6.940 1.00 . A A . 57 VAL HG12 1 1 6 6070 1 1 22 VAL HG13 H -7.325 -3.397 8.385 1.00 . A A . 57 VAL HG13 1 1 6 6071 1 1 22 VAL HG21 H -4.969 -1.609 7.673 1.00 . A A . 57 VAL HG21 1 1 6 6072 1 1 22 VAL HG22 H -6.540 -1.099 8.298 1.00 . A A . 57 VAL HG22 1 1 6 6073 1 1 22 VAL HG23 H -5.924 -0.424 6.790 1.00 . A A . 57 VAL HG23 1 1 6 6074 1 1 22 VAL N N -6.404 -3.826 4.539 1.00 . A A . 57 VAL N 1 1 6 6075 1 1 22 VAL O O -3.987 -4.027 6.119 1.00 . A A . 57 VAL O 1 1 6 6076 1 1 23 ALA C C -1.852 -1.037 6.459 1.00 . A A . 58 ALA C 1 1 6 6077 1 1 23 ALA CA C -2.094 -2.163 5.469 1.00 . A A . 58 ALA CA 1 1 6 6078 1 1 23 ALA CB C -1.214 -2.013 4.204 1.00 . A A . 58 ALA CB 1 1 6 6079 1 1 23 ALA H H -3.862 -1.316 4.612 1.00 . A A . 58 ALA H 1 1 6 6080 1 1 23 ALA HA H -1.922 -3.117 5.946 1.00 . A A . 58 ALA HA 1 1 6 6081 1 1 23 ALA HB1 H -1.415 -2.803 3.491 1.00 . A A . 58 ALA HB1 1 1 6 6082 1 1 23 ALA HB2 H -0.163 -2.052 4.451 1.00 . A A . 58 ALA HB2 1 1 6 6083 1 1 23 ALA HB3 H -1.425 -1.065 3.729 1.00 . A A . 58 ALA HB3 1 1 6 6084 1 1 23 ALA N N -3.508 -2.078 5.128 1.00 . A A . 58 ALA N 1 1 6 6085 1 1 23 ALA O O -2.246 0.072 6.179 1.00 . A A . 58 ALA O 1 1 6 6086 1 1 24 ASP C C -2.315 0.024 9.283 1.00 . A A . 59 ASP C 1 1 6 6087 1 1 24 ASP CA C -0.986 -0.462 8.766 1.00 . A A . 59 ASP CA 1 1 6 6088 1 1 24 ASP CB C 0.102 0.670 8.772 1.00 . A A . 59 ASP CB 1 1 6 6089 1 1 24 ASP CG C 0.342 1.462 7.519 1.00 . A A . 59 ASP CG 1 1 6 6090 1 1 24 ASP H H -0.642 -2.162 7.557 1.00 . A A . 59 ASP H 1 1 6 6091 1 1 24 ASP HA H -0.720 -1.198 9.511 1.00 . A A . 59 ASP HA 1 1 6 6092 1 1 24 ASP HB2 H -0.319 1.398 9.453 1.00 . A A . 59 ASP HB2 1 1 6 6093 1 1 24 ASP HB3 H 1.019 0.353 9.240 1.00 . A A . 59 ASP HB3 1 1 6 6094 1 1 24 ASP N N -1.121 -1.317 7.543 1.00 . A A . 59 ASP N 1 1 6 6095 1 1 24 ASP O O -2.810 -0.460 10.305 1.00 . A A . 59 ASP O 1 1 6 6096 1 1 24 ASP OD1 O -0.442 2.408 7.238 1.00 . A A . 59 ASP OD1 1 1 6 6097 1 1 24 ASP OD2 O 1.387 1.196 6.831 1.00 . A A . 59 ASP OD2 1 1 6 6098 1 1 25 LYS C C -4.726 2.268 7.664 1.00 . A A . 60 LYS C 1 1 6 6099 1 1 25 LYS CA C -4.191 1.463 8.862 1.00 . A A . 60 LYS CA 1 1 6 6100 1 1 25 LYS CB C -4.202 2.268 10.143 1.00 . A A . 60 LYS CB 1 1 6 6101 1 1 25 LYS CD C -5.514 3.172 12.066 1.00 . A A . 60 LYS CD 1 1 6 6102 1 1 25 LYS CE C -4.991 4.599 11.934 1.00 . A A . 60 LYS CE 1 1 6 6103 1 1 25 LYS CG C -5.585 2.463 10.733 1.00 . A A . 60 LYS CG 1 1 6 6104 1 1 25 LYS H H -2.381 1.181 7.776 1.00 . A A . 60 LYS H 1 1 6 6105 1 1 25 LYS HA H -4.814 0.597 8.982 1.00 . A A . 60 LYS HA 1 1 6 6106 1 1 25 LYS HB2 H -3.573 1.780 10.872 1.00 . A A . 60 LYS HB2 1 1 6 6107 1 1 25 LYS HB3 H -3.798 3.235 9.901 1.00 . A A . 60 LYS HB3 1 1 6 6108 1 1 25 LYS HD2 H -6.486 3.181 12.537 1.00 . A A . 60 LYS HD2 1 1 6 6109 1 1 25 LYS HD3 H -4.814 2.605 12.662 1.00 . A A . 60 LYS HD3 1 1 6 6110 1 1 25 LYS HE2 H -4.982 5.042 12.919 1.00 . A A . 60 LYS HE2 1 1 6 6111 1 1 25 LYS HE3 H -3.983 4.573 11.546 1.00 . A A . 60 LYS HE3 1 1 6 6112 1 1 25 LYS HG2 H -6.172 3.052 10.044 1.00 . A A . 60 LYS HG2 1 1 6 6113 1 1 25 LYS HG3 H -6.036 1.489 10.855 1.00 . A A . 60 LYS HG3 1 1 6 6114 1 1 25 LYS HZ1 H -5.470 6.406 11.022 1.00 . A A . 60 LYS HZ1 1 1 6 6115 1 1 25 LYS HZ2 H -6.814 5.475 11.411 1.00 . A A . 60 LYS HZ2 1 1 6 6116 1 1 25 LYS HZ3 H -5.867 5.070 10.078 1.00 . A A . 60 LYS HZ3 1 1 6 6117 1 1 25 LYS N N -2.891 0.931 8.572 1.00 . A A . 60 LYS N 1 1 6 6118 1 1 25 LYS NZ N -5.839 5.435 11.052 1.00 . A A . 60 LYS NZ 1 1 6 6119 1 1 25 LYS O O -5.516 3.197 7.803 1.00 . A A . 60 LYS O 1 1 6 6120 1 1 26 LEU C C -5.580 1.441 4.573 1.00 . A A . 61 LEU C 1 1 6 6121 1 1 26 LEU CA C -4.715 2.479 5.264 1.00 . A A . 61 LEU CA 1 1 6 6122 1 1 26 LEU CB C -3.525 2.822 4.393 1.00 . A A . 61 LEU CB 1 1 6 6123 1 1 26 LEU CD1 C -1.307 3.928 4.054 1.00 . A A . 61 LEU CD1 1 1 6 6124 1 1 26 LEU CD2 C -3.110 5.141 5.257 1.00 . A A . 61 LEU CD2 1 1 6 6125 1 1 26 LEU CG C -2.489 3.782 4.989 1.00 . A A . 61 LEU CG 1 1 6 6126 1 1 26 LEU H H -3.578 1.205 6.447 1.00 . A A . 61 LEU H 1 1 6 6127 1 1 26 LEU HA H -5.291 3.366 5.459 1.00 . A A . 61 LEU HA 1 1 6 6128 1 1 26 LEU HB2 H -3.049 1.884 4.170 1.00 . A A . 61 LEU HB2 1 1 6 6129 1 1 26 LEU HB3 H -3.902 3.247 3.474 1.00 . A A . 61 LEU HB3 1 1 6 6130 1 1 26 LEU HD11 H -0.575 4.589 4.494 1.00 . A A . 61 LEU HD11 1 1 6 6131 1 1 26 LEU HD12 H -1.644 4.340 3.114 1.00 . A A . 61 LEU HD12 1 1 6 6132 1 1 26 LEU HD13 H -0.864 2.958 3.882 1.00 . A A . 61 LEU HD13 1 1 6 6133 1 1 26 LEU HD21 H -3.921 5.029 5.961 1.00 . A A . 61 LEU HD21 1 1 6 6134 1 1 26 LEU HD22 H -3.485 5.554 4.332 1.00 . A A . 61 LEU HD22 1 1 6 6135 1 1 26 LEU HD23 H -2.362 5.801 5.669 1.00 . A A . 61 LEU HD23 1 1 6 6136 1 1 26 LEU HG H -2.130 3.381 5.926 1.00 . A A . 61 LEU HG 1 1 6 6137 1 1 26 LEU N N -4.264 1.908 6.504 1.00 . A A . 61 LEU N 1 1 6 6138 1 1 26 LEU O O -5.151 0.286 4.404 1.00 . A A . 61 LEU O 1 1 6 6139 1 1 27 ILE C C -7.634 0.916 2.110 1.00 . A A . 62 ILE C 1 1 6 6140 1 1 27 ILE CA C -7.704 0.867 3.629 1.00 . A A . 62 ILE CA 1 1 6 6141 1 1 27 ILE CB C -9.162 1.182 4.051 1.00 . A A . 62 ILE CB 1 1 6 6142 1 1 27 ILE CD1 C -8.884 0.479 6.510 1.00 . A A . 62 ILE CD1 1 1 6 6143 1 1 27 ILE CG1 C -9.271 1.566 5.535 1.00 . A A . 62 ILE CG1 1 1 6 6144 1 1 27 ILE CG2 C -10.019 -0.020 3.793 1.00 . A A . 62 ILE CG2 1 1 6 6145 1 1 27 ILE H H -7.038 2.762 4.215 1.00 . A A . 62 ILE H 1 1 6 6146 1 1 27 ILE HA H -7.426 -0.114 3.987 1.00 . A A . 62 ILE HA 1 1 6 6147 1 1 27 ILE HB H -9.526 1.999 3.445 1.00 . A A . 62 ILE HB 1 1 6 6148 1 1 27 ILE HD11 H -8.965 0.846 7.522 1.00 . A A . 62 ILE HD11 1 1 6 6149 1 1 27 ILE HD12 H -7.869 0.174 6.305 1.00 . A A . 62 ILE HD12 1 1 6 6150 1 1 27 ILE HD13 H -9.543 -0.364 6.373 1.00 . A A . 62 ILE HD13 1 1 6 6151 1 1 27 ILE HG12 H -8.615 2.402 5.706 1.00 . A A . 62 ILE HG12 1 1 6 6152 1 1 27 ILE HG13 H -10.288 1.863 5.745 1.00 . A A . 62 ILE HG13 1 1 6 6153 1 1 27 ILE HG21 H -9.991 -0.268 2.743 1.00 . A A . 62 ILE HG21 1 1 6 6154 1 1 27 ILE HG22 H -11.022 0.206 4.122 1.00 . A A . 62 ILE HG22 1 1 6 6155 1 1 27 ILE HG23 H -9.607 -0.824 4.385 1.00 . A A . 62 ILE HG23 1 1 6 6156 1 1 27 ILE N N -6.766 1.820 4.175 1.00 . A A . 62 ILE N 1 1 6 6157 1 1 27 ILE O O -7.835 1.981 1.501 1.00 . A A . 62 ILE O 1 1 6 6158 1 1 28 PHE C C -7.238 -1.679 -0.523 1.00 . A A . 63 PHE C 1 1 6 6159 1 1 28 PHE CA C -7.156 -0.300 0.083 1.00 . A A . 63 PHE CA 1 1 6 6160 1 1 28 PHE CB C -5.984 0.497 -0.444 1.00 . A A . 63 PHE CB 1 1 6 6161 1 1 28 PHE CD1 C -4.171 -0.909 0.637 1.00 . A A . 63 PHE CD1 1 1 6 6162 1 1 28 PHE CD2 C -4.049 1.448 0.683 1.00 . A A . 63 PHE CD2 1 1 6 6163 1 1 28 PHE CE1 C -2.993 -0.968 1.339 1.00 . A A . 63 PHE CE1 1 1 6 6164 1 1 28 PHE CE2 C -2.900 1.384 1.365 1.00 . A A . 63 PHE CE2 1 1 6 6165 1 1 28 PHE CG C -4.708 0.327 0.301 1.00 . A A . 63 PHE CG 1 1 6 6166 1 1 28 PHE CZ C -2.357 0.191 1.699 1.00 . A A . 63 PHE CZ 1 1 6 6167 1 1 28 PHE H H -7.178 -1.011 2.059 1.00 . A A . 63 PHE H 1 1 6 6168 1 1 28 PHE HA H -8.038 0.200 -0.285 1.00 . A A . 63 PHE HA 1 1 6 6169 1 1 28 PHE HB2 H -5.824 0.403 -1.506 1.00 . A A . 63 PHE HB2 1 1 6 6170 1 1 28 PHE HB3 H -6.257 1.520 -0.223 1.00 . A A . 63 PHE HB3 1 1 6 6171 1 1 28 PHE HD1 H -4.655 -1.836 0.364 1.00 . A A . 63 PHE HD1 1 1 6 6172 1 1 28 PHE HD2 H -4.460 2.413 0.426 1.00 . A A . 63 PHE HD2 1 1 6 6173 1 1 28 PHE HE1 H -2.565 -1.924 1.601 1.00 . A A . 63 PHE HE1 1 1 6 6174 1 1 28 PHE HE2 H -2.407 2.302 1.637 1.00 . A A . 63 PHE HE2 1 1 6 6175 1 1 28 PHE HZ H -1.422 0.193 2.240 1.00 . A A . 63 PHE HZ 1 1 6 6176 1 1 28 PHE N N -7.302 -0.201 1.511 1.00 . A A . 63 PHE N 1 1 6 6177 1 1 28 PHE O O -7.338 -2.674 0.160 1.00 . A A . 63 PHE O 1 1 6 6178 1 1 29 HIS C C -5.881 -3.530 -2.512 1.00 . A A . 64 HIS C 1 1 6 6179 1 1 29 HIS CA C -7.238 -2.860 -2.661 1.00 . A A . 64 HIS CA 1 1 6 6180 1 1 29 HIS CB C -7.386 -2.432 -4.144 1.00 . A A . 64 HIS CB 1 1 6 6181 1 1 29 HIS CD2 C -9.765 -1.840 -4.902 1.00 . A A . 64 HIS CD2 1 1 6 6182 1 1 29 HIS CE1 C -9.655 0.327 -4.648 1.00 . A A . 64 HIS CE1 1 1 6 6183 1 1 29 HIS CG C -8.537 -1.522 -4.452 1.00 . A A . 64 HIS CG 1 1 6 6184 1 1 29 HIS H H -7.292 -0.818 -2.285 1.00 . A A . 64 HIS H 1 1 6 6185 1 1 29 HIS HA H -8.047 -3.522 -2.396 1.00 . A A . 64 HIS HA 1 1 6 6186 1 1 29 HIS HB2 H -6.506 -1.895 -4.456 1.00 . A A . 64 HIS HB2 1 1 6 6187 1 1 29 HIS HB3 H -7.493 -3.319 -4.752 1.00 . A A . 64 HIS HB3 1 1 6 6188 1 1 29 HIS HD2 H -10.118 -2.836 -5.108 1.00 . A A . 64 HIS HD2 1 1 6 6189 1 1 29 HIS HE1 H -9.936 1.370 -4.630 1.00 . A A . 64 HIS HE1 1 1 6 6190 1 1 29 HIS HE2 H -11.408 -0.579 -5.312 1.00 . A A . 64 HIS HE2 1 1 6 6191 1 1 29 HIS N N -7.248 -1.677 -1.830 1.00 . A A . 64 HIS N 1 1 6 6192 1 1 29 HIS ND1 N -8.470 -0.132 -4.287 1.00 . A A . 64 HIS ND1 1 1 6 6193 1 1 29 HIS NE2 N -10.470 -0.666 -5.025 1.00 . A A . 64 HIS NE2 1 1 6 6194 1 1 29 HIS O O -4.834 -2.870 -2.550 1.00 . A A . 64 HIS O 1 1 6 6195 1 1 30 ASN C C -3.836 -5.528 -3.491 1.00 . A A . 65 ASN C 1 1 6 6196 1 1 30 ASN CA C -4.684 -5.630 -2.225 1.00 . A A . 65 ASN CA 1 1 6 6197 1 1 30 ASN CB C -5.019 -7.111 -1.921 1.00 . A A . 65 ASN CB 1 1 6 6198 1 1 30 ASN CG C -5.816 -7.809 -3.020 1.00 . A A . 65 ASN CG 1 1 6 6199 1 1 30 ASN H H -6.777 -5.274 -2.272 1.00 . A A . 65 ASN H 1 1 6 6200 1 1 30 ASN HA H -4.115 -5.228 -1.401 1.00 . A A . 65 ASN HA 1 1 6 6201 1 1 30 ASN HB2 H -4.103 -7.658 -1.760 1.00 . A A . 65 ASN HB2 1 1 6 6202 1 1 30 ASN HB3 H -5.600 -7.144 -1.011 1.00 . A A . 65 ASN HB3 1 1 6 6203 1 1 30 ASN HD21 H -4.159 -8.501 -3.872 1.00 . A A . 65 ASN HD21 1 1 6 6204 1 1 30 ASN HD22 H -5.642 -8.932 -4.639 1.00 . A A . 65 ASN HD22 1 1 6 6205 1 1 30 ASN N N -5.904 -4.830 -2.344 1.00 . A A . 65 ASN N 1 1 6 6206 1 1 30 ASN ND2 N -5.139 -8.474 -3.929 1.00 . A A . 65 ASN ND2 1 1 6 6207 1 1 30 ASN O O -2.617 -5.601 -3.451 1.00 . A A . 65 ASN O 1 1 6 6208 1 1 30 ASN OD1 O -7.044 -7.762 -3.026 1.00 . A A . 65 ASN OD1 1 1 6 6209 1 1 31 SER C C -3.245 -3.936 -6.217 1.00 . A A . 66 SER C 1 1 6 6210 1 1 31 SER CA C -3.878 -5.306 -5.877 1.00 . A A . 66 SER CA 1 1 6 6211 1 1 31 SER CB C -4.895 -5.710 -6.918 1.00 . A A . 66 SER CB 1 1 6 6212 1 1 31 SER H H -5.478 -5.369 -4.596 1.00 . A A . 66 SER H 1 1 6 6213 1 1 31 SER HA H -3.093 -6.043 -5.930 1.00 . A A . 66 SER HA 1 1 6 6214 1 1 31 SER HB2 H -4.498 -5.428 -7.878 1.00 . A A . 66 SER HB2 1 1 6 6215 1 1 31 SER HB3 H -5.043 -6.779 -6.888 1.00 . A A . 66 SER HB3 1 1 6 6216 1 1 31 SER HG H -6.244 -4.314 -7.287 1.00 . A A . 66 SER HG 1 1 6 6217 1 1 31 SER N N -4.496 -5.399 -4.600 1.00 . A A . 66 SER N 1 1 6 6218 1 1 31 SER O O -2.526 -3.837 -7.212 1.00 . A A . 66 SER O 1 1 6 6219 1 1 31 SER OG O -6.135 -5.055 -6.676 1.00 . A A . 66 SER OG 1 1 6 6220 1 1 32 CYS C C -1.731 -1.020 -5.411 1.00 . A A . 67 CYS C 1 1 6 6221 1 1 32 CYS CA C -3.038 -1.584 -5.936 1.00 . A A . 67 CYS CA 1 1 6 6222 1 1 32 CYS CB C -4.159 -0.545 -5.875 1.00 . A A . 67 CYS CB 1 1 6 6223 1 1 32 CYS H H -3.818 -2.986 -4.511 1.00 . A A . 67 CYS H 1 1 6 6224 1 1 32 CYS HA H -2.857 -1.769 -6.985 1.00 . A A . 67 CYS HA 1 1 6 6225 1 1 32 CYS HB2 H -3.718 0.416 -6.082 1.00 . A A . 67 CYS HB2 1 1 6 6226 1 1 32 CYS HB3 H -4.931 -0.769 -6.594 1.00 . A A . 67 CYS HB3 1 1 6 6227 1 1 32 CYS N N -3.447 -2.889 -5.419 1.00 . A A . 67 CYS N 1 1 6 6228 1 1 32 CYS O O -0.996 -0.377 -6.177 1.00 . A A . 67 CYS O 1 1 6 6229 1 1 32 CYS SG S -4.924 -0.316 -4.286 1.00 . A A . 67 CYS SG 1 1 6 6230 1 1 33 PHE C C 1.065 -1.247 -4.070 1.00 . A A . 68 PHE C 1 1 6 6231 1 1 33 PHE CA C -0.232 -0.613 -3.614 1.00 . A A . 68 PHE CA 1 1 6 6232 1 1 33 PHE CB C -0.279 -0.420 -2.086 1.00 . A A . 68 PHE CB 1 1 6 6233 1 1 33 PHE CD1 C -1.583 -2.434 -1.259 1.00 . A A . 68 PHE CD1 1 1 6 6234 1 1 33 PHE CD2 C 0.524 -1.923 -0.277 1.00 . A A . 68 PHE CD2 1 1 6 6235 1 1 33 PHE CE1 C -1.716 -3.515 -0.400 1.00 . A A . 68 PHE CE1 1 1 6 6236 1 1 33 PHE CE2 C 0.397 -2.986 0.579 1.00 . A A . 68 PHE CE2 1 1 6 6237 1 1 33 PHE CG C -0.455 -1.627 -1.204 1.00 . A A . 68 PHE CG 1 1 6 6238 1 1 33 PHE CZ C -0.718 -3.784 0.522 1.00 . A A . 68 PHE CZ 1 1 6 6239 1 1 33 PHE H H -1.909 -1.893 -3.614 1.00 . A A . 68 PHE H 1 1 6 6240 1 1 33 PHE HA H -0.243 0.366 -4.072 1.00 . A A . 68 PHE HA 1 1 6 6241 1 1 33 PHE HB2 H 0.748 -0.190 -1.843 1.00 . A A . 68 PHE HB2 1 1 6 6242 1 1 33 PHE HB3 H -0.942 0.374 -1.778 1.00 . A A . 68 PHE HB3 1 1 6 6243 1 1 33 PHE HD1 H -2.357 -2.218 -1.980 1.00 . A A . 68 PHE HD1 1 1 6 6244 1 1 33 PHE HD2 H 1.403 -1.297 -0.237 1.00 . A A . 68 PHE HD2 1 1 6 6245 1 1 33 PHE HE1 H -2.599 -4.137 -0.436 1.00 . A A . 68 PHE HE1 1 1 6 6246 1 1 33 PHE HE2 H 1.173 -3.193 1.301 1.00 . A A . 68 PHE HE2 1 1 6 6247 1 1 33 PHE HZ H -0.792 -4.615 1.206 1.00 . A A . 68 PHE HZ 1 1 6 6248 1 1 33 PHE N N -1.391 -1.272 -4.162 1.00 . A A . 68 PHE N 1 1 6 6249 1 1 33 PHE O O 1.434 -2.353 -3.659 1.00 . A A . 68 PHE O 1 1 6 6250 1 1 34 CYS C C 3.866 0.245 -5.236 1.00 . A A . 69 CYS C 1 1 6 6251 1 1 34 CYS CA C 2.957 -0.927 -5.498 1.00 . A A . 69 CYS CA 1 1 6 6252 1 1 34 CYS CB C 2.817 -1.143 -7.003 1.00 . A A . 69 CYS CB 1 1 6 6253 1 1 34 CYS H H 1.321 0.272 -5.293 1.00 . A A . 69 CYS H 1 1 6 6254 1 1 34 CYS HA H 3.318 -1.826 -5.024 1.00 . A A . 69 CYS HA 1 1 6 6255 1 1 34 CYS HB2 H 2.680 -0.199 -7.509 1.00 . A A . 69 CYS HB2 1 1 6 6256 1 1 34 CYS HB3 H 3.740 -1.577 -7.348 1.00 . A A . 69 CYS HB3 1 1 6 6257 1 1 34 CYS HG H 0.417 -1.789 -6.817 1.00 . A A . 69 CYS HG 1 1 6 6258 1 1 34 CYS N N 1.701 -0.566 -4.960 1.00 . A A . 69 CYS N 1 1 6 6259 1 1 34 CYS O O 3.386 1.302 -4.815 1.00 . A A . 69 CYS O 1 1 6 6260 1 1 34 CYS SG S 1.474 -2.267 -7.461 1.00 . A A . 69 CYS SG 1 1 6 6261 1 1 35 CYS C C 5.794 2.198 -6.334 1.00 . A A . 70 CYS C 1 1 6 6262 1 1 35 CYS CA C 6.066 1.164 -5.285 1.00 . A A . 70 CYS CA 1 1 6 6263 1 1 35 CYS CB C 7.501 0.668 -5.325 1.00 . A A . 70 CYS CB 1 1 6 6264 1 1 35 CYS H H 5.471 -0.802 -5.741 1.00 . A A . 70 CYS H 1 1 6 6265 1 1 35 CYS HA H 5.870 1.603 -4.319 1.00 . A A . 70 CYS HA 1 1 6 6266 1 1 35 CYS HB2 H 7.651 0.137 -4.401 1.00 . A A . 70 CYS HB2 1 1 6 6267 1 1 35 CYS HB3 H 7.626 0.008 -6.168 1.00 . A A . 70 CYS HB3 1 1 6 6268 1 1 35 CYS N N 5.147 0.075 -5.449 1.00 . A A . 70 CYS N 1 1 6 6269 1 1 35 CYS O O 5.506 1.892 -7.487 1.00 . A A . 70 CYS O 1 1 6 6270 1 1 35 CYS SG S 8.817 1.913 -5.355 1.00 . A A . 70 CYS SG 1 1 6 6271 1 1 36 LYS C C 6.690 4.861 -7.661 1.00 . A A . 71 LYS C 1 1 6 6272 1 1 36 LYS CA C 5.509 4.504 -6.773 1.00 . A A . 71 LYS CA 1 1 6 6273 1 1 36 LYS CB C 5.045 5.705 -5.958 1.00 . A A . 71 LYS CB 1 1 6 6274 1 1 36 LYS CD C 2.792 6.404 -7.060 1.00 . A A . 71 LYS CD 1 1 6 6275 1 1 36 LYS CE C 2.691 5.548 -8.295 1.00 . A A . 71 LYS CE 1 1 6 6276 1 1 36 LYS CG C 4.248 6.790 -6.722 1.00 . A A . 71 LYS CG 1 1 6 6277 1 1 36 LYS H H 6.056 3.526 -4.963 1.00 . A A . 71 LYS H 1 1 6 6278 1 1 36 LYS HA H 4.706 4.181 -7.404 1.00 . A A . 71 LYS HA 1 1 6 6279 1 1 36 LYS HB2 H 4.480 5.381 -5.098 1.00 . A A . 71 LYS HB2 1 1 6 6280 1 1 36 LYS HB3 H 5.950 6.162 -5.596 1.00 . A A . 71 LYS HB3 1 1 6 6281 1 1 36 LYS HD2 H 2.373 5.851 -6.231 1.00 . A A . 71 LYS HD2 1 1 6 6282 1 1 36 LYS HD3 H 2.219 7.307 -7.210 1.00 . A A . 71 LYS HD3 1 1 6 6283 1 1 36 LYS HE2 H 3.260 6.077 -9.040 1.00 . A A . 71 LYS HE2 1 1 6 6284 1 1 36 LYS HE3 H 3.137 4.582 -8.121 1.00 . A A . 71 LYS HE3 1 1 6 6285 1 1 36 LYS HG2 H 4.217 7.710 -6.169 1.00 . A A . 71 LYS HG2 1 1 6 6286 1 1 36 LYS HG3 H 4.767 6.975 -7.651 1.00 . A A . 71 LYS HG3 1 1 6 6287 1 1 36 LYS HZ1 H 0.806 6.243 -8.919 1.00 . A A . 71 LYS HZ1 1 1 6 6288 1 1 36 LYS HZ2 H 0.731 4.835 -8.017 1.00 . A A . 71 LYS HZ2 1 1 6 6289 1 1 36 LYS HZ3 H 1.254 4.789 -9.609 1.00 . A A . 71 LYS HZ3 1 1 6 6290 1 1 36 LYS N N 5.836 3.409 -5.914 1.00 . A A . 71 LYS N 1 1 6 6291 1 1 36 LYS NZ N 1.290 5.344 -8.729 1.00 . A A . 71 LYS NZ 1 1 6 6292 1 1 36 LYS O O 6.525 5.481 -8.703 1.00 . A A . 71 LYS O 1 1 6 6293 1 1 37 HIS C C 9.332 3.608 -9.032 1.00 . A A . 72 HIS C 1 1 6 6294 1 1 37 HIS CA C 9.050 4.746 -8.045 1.00 . A A . 72 HIS CA 1 1 6 6295 1 1 37 HIS CB C 10.246 5.050 -7.138 1.00 . A A . 72 HIS CB 1 1 6 6296 1 1 37 HIS CD2 C 12.441 5.275 -8.506 1.00 . A A . 72 HIS CD2 1 1 6 6297 1 1 37 HIS CE1 C 12.652 7.437 -8.369 1.00 . A A . 72 HIS CE1 1 1 6 6298 1 1 37 HIS CG C 11.391 5.770 -7.817 1.00 . A A . 72 HIS CG 1 1 6 6299 1 1 37 HIS H H 7.939 3.928 -6.431 1.00 . A A . 72 HIS H 1 1 6 6300 1 1 37 HIS HA H 8.811 5.625 -8.622 1.00 . A A . 72 HIS HA 1 1 6 6301 1 1 37 HIS HB2 H 9.899 5.686 -6.339 1.00 . A A . 72 HIS HB2 1 1 6 6302 1 1 37 HIS HB3 H 10.621 4.125 -6.726 1.00 . A A . 72 HIS HB3 1 1 6 6303 1 1 37 HIS HD2 H 12.622 4.237 -8.740 1.00 . A A . 72 HIS HD2 1 1 6 6304 1 1 37 HIS HE1 H 13.066 8.432 -8.438 1.00 . A A . 72 HIS HE1 1 1 6 6305 1 1 37 HIS HE2 H 13.824 6.334 -9.638 1.00 . A A . 72 HIS HE2 1 1 6 6306 1 1 37 HIS N N 7.875 4.442 -7.263 1.00 . A A . 72 HIS N 1 1 6 6307 1 1 37 HIS ND1 N 11.518 7.141 -7.735 1.00 . A A . 72 HIS ND1 1 1 6 6308 1 1 37 HIS NE2 N 13.235 6.339 -8.852 1.00 . A A . 72 HIS NE2 1 1 6 6309 1 1 37 HIS O O 9.911 3.825 -10.096 1.00 . A A . 72 HIS O 1 1 6 6310 1 1 38 CYS C C 7.763 0.429 -9.292 1.00 . A A . 73 CYS C 1 1 6 6311 1 1 38 CYS CA C 8.990 1.288 -9.564 1.00 . A A . 73 CYS CA 1 1 6 6312 1 1 38 CYS CB C 10.279 0.514 -9.299 1.00 . A A . 73 CYS CB 1 1 6 6313 1 1 38 CYS H H 8.455 2.226 -7.835 1.00 . A A . 73 CYS H 1 1 6 6314 1 1 38 CYS HA H 9.017 1.705 -10.558 1.00 . A A . 73 CYS HA 1 1 6 6315 1 1 38 CYS HB2 H 10.524 -0.101 -10.141 1.00 . A A . 73 CYS HB2 1 1 6 6316 1 1 38 CYS HB3 H 11.027 1.281 -9.261 1.00 . A A . 73 CYS HB3 1 1 6 6317 1 1 38 CYS N N 8.900 2.401 -8.685 1.00 . A A . 73 CYS N 1 1 6 6318 1 1 38 CYS O O 7.494 0.146 -8.147 1.00 . A A . 73 CYS O 1 1 6 6319 1 1 38 CYS SG S 10.376 -0.487 -7.777 1.00 . A A . 73 CYS SG 1 1 6 6320 1 1 39 HIS C C 5.928 -2.201 -9.648 1.00 . A A . 74 HIS C 1 1 6 6321 1 1 39 HIS CA C 5.774 -0.721 -10.007 1.00 . A A . 74 HIS CA 1 1 6 6322 1 1 39 HIS CB C 4.691 -0.475 -11.081 1.00 . A A . 74 HIS CB 1 1 6 6323 1 1 39 HIS CD2 C 5.242 -1.994 -13.121 1.00 . A A . 74 HIS CD2 1 1 6 6324 1 1 39 HIS CE1 C 5.503 -0.438 -14.617 1.00 . A A . 74 HIS CE1 1 1 6 6325 1 1 39 HIS CG C 5.061 -0.810 -12.503 1.00 . A A . 74 HIS CG 1 1 6 6326 1 1 39 HIS H H 7.367 0.089 -11.207 1.00 . A A . 74 HIS H 1 1 6 6327 1 1 39 HIS HA H 5.423 -0.271 -9.086 1.00 . A A . 74 HIS HA 1 1 6 6328 1 1 39 HIS HB2 H 3.842 -1.085 -10.816 1.00 . A A . 74 HIS HB2 1 1 6 6329 1 1 39 HIS HB3 H 4.406 0.565 -11.032 1.00 . A A . 74 HIS HB3 1 1 6 6330 1 1 39 HIS HD1 H 5.182 1.117 -13.338 1.00 . A A . 74 HIS HD1 1 1 6 6331 1 1 39 HIS HD2 H 5.177 -2.971 -12.663 1.00 . A A . 74 HIS HD2 1 1 6 6332 1 1 39 HIS HE1 H 5.690 0.062 -15.556 1.00 . A A . 74 HIS HE1 1 1 6 6333 1 1 39 HIS HE2 H 5.534 -2.408 -15.140 1.00 . A A . 74 HIS HE2 1 1 6 6334 1 1 39 HIS N N 7.046 -0.023 -10.284 1.00 . A A . 74 HIS N 1 1 6 6335 1 1 39 HIS ND1 N 5.234 0.145 -13.475 1.00 . A A . 74 HIS ND1 1 1 6 6336 1 1 39 HIS NE2 N 5.514 -1.732 -14.426 1.00 . A A . 74 HIS NE2 1 1 6 6337 1 1 39 HIS O O 5.304 -3.079 -10.244 1.00 . A A . 74 HIS O 1 1 6 6338 1 1 40 THR C C 5.756 -4.144 -7.259 1.00 . A A . 75 THR C 1 1 6 6339 1 1 40 THR CA C 6.948 -3.777 -8.137 1.00 . A A . 75 THR CA 1 1 6 6340 1 1 40 THR CB C 8.298 -3.908 -7.346 1.00 . A A . 75 THR CB 1 1 6 6341 1 1 40 THR CG2 C 8.334 -3.006 -6.125 1.00 . A A . 75 THR CG2 1 1 6 6342 1 1 40 THR H H 7.195 -1.677 -8.261 1.00 . A A . 75 THR H 1 1 6 6343 1 1 40 THR HA H 6.960 -4.451 -8.982 1.00 . A A . 75 THR HA 1 1 6 6344 1 1 40 THR HB H 9.097 -3.624 -8.010 1.00 . A A . 75 THR HB 1 1 6 6345 1 1 40 THR HG1 H 8.893 -5.734 -7.696 1.00 . A A . 75 THR HG1 1 1 6 6346 1 1 40 THR HG21 H 9.267 -3.148 -5.600 1.00 . A A . 75 THR HG21 1 1 6 6347 1 1 40 THR HG22 H 7.508 -3.255 -5.476 1.00 . A A . 75 THR HG22 1 1 6 6348 1 1 40 THR HG23 H 8.249 -1.977 -6.440 1.00 . A A . 75 THR HG23 1 1 6 6349 1 1 40 THR N N 6.737 -2.451 -8.658 1.00 . A A . 75 THR N 1 1 6 6350 1 1 40 THR O O 5.260 -3.300 -6.474 1.00 . A A . 75 THR O 1 1 6 6351 1 1 40 THR OG1 O 8.526 -5.263 -6.935 1.00 . A A . 75 THR OG1 1 1 6 6352 1 1 41 LYS C C 4.533 -6.159 -5.303 1.00 . A A . 76 LYS C 1 1 6 6353 1 1 41 LYS CA C 4.095 -5.788 -6.709 1.00 . A A . 76 LYS CA 1 1 6 6354 1 1 41 LYS CB C 3.447 -6.965 -7.396 1.00 . A A . 76 LYS CB 1 1 6 6355 1 1 41 LYS CD C 1.104 -6.112 -7.200 1.00 . A A . 76 LYS CD 1 1 6 6356 1 1 41 LYS CE C -0.335 -6.501 -6.945 1.00 . A A . 76 LYS CE 1 1 6 6357 1 1 41 LYS CG C 2.051 -7.265 -6.905 1.00 . A A . 76 LYS CG 1 1 6 6358 1 1 41 LYS H H 5.662 -5.949 -8.083 1.00 . A A . 76 LYS H 1 1 6 6359 1 1 41 LYS HA H 3.395 -4.968 -6.653 1.00 . A A . 76 LYS HA 1 1 6 6360 1 1 41 LYS HB2 H 3.407 -6.786 -8.460 1.00 . A A . 76 LYS HB2 1 1 6 6361 1 1 41 LYS HB3 H 4.060 -7.833 -7.204 1.00 . A A . 76 LYS HB3 1 1 6 6362 1 1 41 LYS HD2 H 1.350 -5.278 -6.560 1.00 . A A . 76 LYS HD2 1 1 6 6363 1 1 41 LYS HD3 H 1.212 -5.819 -8.234 1.00 . A A . 76 LYS HD3 1 1 6 6364 1 1 41 LYS HE2 H -0.965 -5.647 -7.145 1.00 . A A . 76 LYS HE2 1 1 6 6365 1 1 41 LYS HE3 H -0.584 -7.300 -7.626 1.00 . A A . 76 LYS HE3 1 1 6 6366 1 1 41 LYS HG2 H 1.697 -8.158 -7.388 1.00 . A A . 76 LYS HG2 1 1 6 6367 1 1 41 LYS HG3 H 2.087 -7.424 -5.838 1.00 . A A . 76 LYS HG3 1 1 6 6368 1 1 41 LYS HZ1 H 0.042 -7.764 -5.332 1.00 . A A . 76 LYS HZ1 1 1 6 6369 1 1 41 LYS HZ2 H -1.547 -7.259 -5.416 1.00 . A A . 76 LYS HZ2 1 1 6 6370 1 1 41 LYS HZ3 H -0.345 -6.178 -4.893 1.00 . A A . 76 LYS HZ3 1 1 6 6371 1 1 41 LYS N N 5.236 -5.335 -7.447 1.00 . A A . 76 LYS N 1 1 6 6372 1 1 41 LYS NZ N -0.563 -6.949 -5.558 1.00 . A A . 76 LYS NZ 1 1 6 6373 1 1 41 LYS O O 4.849 -7.298 -4.993 1.00 . A A . 76 LYS O 1 1 6 6374 1 1 42 LEU C C 3.903 -5.387 -2.167 1.00 . A A . 77 LEU C 1 1 6 6375 1 1 42 LEU CA C 5.025 -5.267 -3.138 1.00 . A A . 77 LEU CA 1 1 6 6376 1 1 42 LEU CB C 5.944 -4.087 -2.850 1.00 . A A . 77 LEU CB 1 1 6 6377 1 1 42 LEU CD1 C 4.338 -2.210 -2.047 1.00 . A A . 77 LEU CD1 1 1 6 6378 1 1 42 LEU CD2 C 6.493 -1.703 -3.060 1.00 . A A . 77 LEU CD2 1 1 6 6379 1 1 42 LEU CG C 5.373 -2.655 -3.073 1.00 . A A . 77 LEU CG 1 1 6 6380 1 1 42 LEU H H 4.284 -4.318 -4.878 1.00 . A A . 77 LEU H 1 1 6 6381 1 1 42 LEU HA H 5.616 -6.166 -3.056 1.00 . A A . 77 LEU HA 1 1 6 6382 1 1 42 LEU HB2 H 6.435 -4.149 -1.893 1.00 . A A . 77 LEU HB2 1 1 6 6383 1 1 42 LEU HB3 H 6.684 -4.171 -3.635 1.00 . A A . 77 LEU HB3 1 1 6 6384 1 1 42 LEU HD11 H 3.555 -2.944 -1.922 1.00 . A A . 77 LEU HD11 1 1 6 6385 1 1 42 LEU HD12 H 3.916 -1.254 -2.338 1.00 . A A . 77 LEU HD12 1 1 6 6386 1 1 42 LEU HD13 H 4.876 -2.080 -1.123 1.00 . A A . 77 LEU HD13 1 1 6 6387 1 1 42 LEU HD21 H 7.240 -1.978 -3.791 1.00 . A A . 77 LEU HD21 1 1 6 6388 1 1 42 LEU HD22 H 6.929 -1.700 -2.073 1.00 . A A . 77 LEU HD22 1 1 6 6389 1 1 42 LEU HD23 H 6.117 -0.716 -3.283 1.00 . A A . 77 LEU HD23 1 1 6 6390 1 1 42 LEU HG H 4.927 -2.604 -4.054 1.00 . A A . 77 LEU HG 1 1 6 6391 1 1 42 LEU N N 4.570 -5.176 -4.500 1.00 . A A . 77 LEU N 1 1 6 6392 1 1 42 LEU O O 4.124 -5.509 -0.953 1.00 . A A . 77 LEU O 1 1 6 6393 1 1 43 SER C C 1.533 -6.658 -1.047 1.00 . A A . 78 SER C 1 1 6 6394 1 1 43 SER CA C 1.535 -5.416 -1.906 1.00 . A A . 78 SER CA 1 1 6 6395 1 1 43 SER CB C 0.370 -5.511 -2.829 1.00 . A A . 78 SER CB 1 1 6 6396 1 1 43 SER H H 2.624 -5.334 -3.669 1.00 . A A . 78 SER H 1 1 6 6397 1 1 43 SER HA H 1.418 -4.525 -1.317 1.00 . A A . 78 SER HA 1 1 6 6398 1 1 43 SER HB2 H 0.211 -6.555 -3.015 1.00 . A A . 78 SER HB2 1 1 6 6399 1 1 43 SER HB3 H -0.503 -5.091 -2.355 1.00 . A A . 78 SER HB3 1 1 6 6400 1 1 43 SER HG H 0.881 -3.918 -3.832 1.00 . A A . 78 SER HG 1 1 6 6401 1 1 43 SER N N 2.707 -5.375 -2.696 1.00 . A A . 78 SER N 1 1 6 6402 1 1 43 SER O O 1.874 -7.748 -1.512 1.00 . A A . 78 SER O 1 1 6 6403 1 1 43 SER OG O 0.617 -4.826 -4.057 1.00 . A A . 78 SER OG 1 1 6 6404 1 1 44 LEU C C 1.948 -8.633 1.156 1.00 . A A . 79 LEU C 1 1 6 6405 1 1 44 LEU CA C 0.949 -7.464 1.213 1.00 . A A . 79 LEU CA 1 1 6 6406 1 1 44 LEU CB C -0.497 -7.911 1.205 1.00 . A A . 79 LEU CB 1 1 6 6407 1 1 44 LEU CD1 C -0.559 -8.939 3.512 1.00 . A A . 79 LEU CD1 1 1 6 6408 1 1 44 LEU CD2 C -1.147 -6.530 3.216 1.00 . A A . 79 LEU CD2 1 1 6 6409 1 1 44 LEU CG C -1.191 -7.923 2.583 1.00 . A A . 79 LEU CG 1 1 6 6410 1 1 44 LEU H H 0.967 -5.528 0.447 1.00 . A A . 79 LEU H 1 1 6 6411 1 1 44 LEU HA H 1.133 -6.978 2.156 1.00 . A A . 79 LEU HA 1 1 6 6412 1 1 44 LEU HB2 H -1.026 -7.253 0.524 1.00 . A A . 79 LEU HB2 1 1 6 6413 1 1 44 LEU HB3 H -0.517 -8.913 0.804 1.00 . A A . 79 LEU HB3 1 1 6 6414 1 1 44 LEU HD11 H 0.478 -8.683 3.674 1.00 . A A . 79 LEU HD11 1 1 6 6415 1 1 44 LEU HD12 H -0.633 -9.917 3.063 1.00 . A A . 79 LEU HD12 1 1 6 6416 1 1 44 LEU HD13 H -1.090 -8.930 4.451 1.00 . A A . 79 LEU HD13 1 1 6 6417 1 1 44 LEU HD21 H -1.633 -6.547 4.179 1.00 . A A . 79 LEU HD21 1 1 6 6418 1 1 44 LEU HD22 H -1.655 -5.830 2.573 1.00 . A A . 79 LEU HD22 1 1 6 6419 1 1 44 LEU HD23 H -0.124 -6.202 3.336 1.00 . A A . 79 LEU HD23 1 1 6 6420 1 1 44 LEU HG H -2.224 -8.203 2.453 1.00 . A A . 79 LEU HG 1 1 6 6421 1 1 44 LEU N N 1.140 -6.455 0.192 1.00 . A A . 79 LEU N 1 1 6 6422 1 1 44 LEU O O 1.566 -9.796 1.128 1.00 . A A . 79 LEU O 1 1 6 6423 1 1 45 GLY C C 5.480 -8.696 1.688 1.00 . A A . 80 GLY C 1 1 6 6424 1 1 45 GLY CA C 4.240 -9.293 1.125 1.00 . A A . 80 GLY CA 1 1 6 6425 1 1 45 GLY H H 3.438 -7.352 1.082 1.00 . A A . 80 GLY H 1 1 6 6426 1 1 45 GLY HA2 H 3.931 -10.132 1.732 1.00 . A A . 80 GLY HA2 1 1 6 6427 1 1 45 GLY HA3 H 4.433 -9.621 0.114 1.00 . A A . 80 GLY HA3 1 1 6 6428 1 1 45 GLY N N 3.203 -8.301 1.122 1.00 . A A . 80 GLY N 1 1 6 6429 1 1 45 GLY O O 5.855 -8.968 2.822 1.00 . A A . 80 GLY O 1 1 6 6430 1 1 46 SER C C 7.104 -5.694 0.843 1.00 . A A . 81 SER C 1 1 6 6431 1 1 46 SER CA C 7.240 -7.109 1.343 1.00 . A A . 81 SER CA 1 1 6 6432 1 1 46 SER CB C 8.490 -7.788 0.769 1.00 . A A . 81 SER CB 1 1 6 6433 1 1 46 SER H H 5.716 -7.651 0.025 1.00 . A A . 81 SER H 1 1 6 6434 1 1 46 SER HA H 7.282 -7.121 2.421 1.00 . A A . 81 SER HA 1 1 6 6435 1 1 46 SER HB2 H 9.342 -7.143 0.920 1.00 . A A . 81 SER HB2 1 1 6 6436 1 1 46 SER HB3 H 8.655 -8.727 1.271 1.00 . A A . 81 SER HB3 1 1 6 6437 1 1 46 SER HG H 8.260 -7.160 -1.049 1.00 . A A . 81 SER HG 1 1 6 6438 1 1 46 SER N N 6.074 -7.831 0.922 1.00 . A A . 81 SER N 1 1 6 6439 1 1 46 SER O O 7.275 -5.437 -0.353 1.00 . A A . 81 SER O 1 1 6 6440 1 1 46 SER OG O 8.338 -8.034 -0.639 1.00 . A A . 81 SER OG 1 1 6 6441 1 1 47 TYR C C 7.015 -2.428 2.304 1.00 . A A . 82 TYR C 1 1 6 6442 1 1 47 TYR CA C 6.509 -3.446 1.319 1.00 . A A . 82 TYR CA 1 1 6 6443 1 1 47 TYR CB C 4.966 -3.280 1.119 1.00 . A A . 82 TYR CB 1 1 6 6444 1 1 47 TYR CD1 C 4.136 -2.503 3.398 1.00 . A A . 82 TYR CD1 1 1 6 6445 1 1 47 TYR CD2 C 3.108 -4.449 2.483 1.00 . A A . 82 TYR CD2 1 1 6 6446 1 1 47 TYR CE1 C 3.321 -2.575 4.492 1.00 . A A . 82 TYR CE1 1 1 6 6447 1 1 47 TYR CE2 C 2.288 -4.525 3.593 1.00 . A A . 82 TYR CE2 1 1 6 6448 1 1 47 TYR CG C 4.064 -3.426 2.367 1.00 . A A . 82 TYR CG 1 1 6 6449 1 1 47 TYR CZ C 2.402 -3.584 4.593 1.00 . A A . 82 TYR CZ 1 1 6 6450 1 1 47 TYR H H 6.812 -4.963 2.694 1.00 . A A . 82 TYR H 1 1 6 6451 1 1 47 TYR HA H 6.987 -3.264 0.367 1.00 . A A . 82 TYR HA 1 1 6 6452 1 1 47 TYR HB2 H 4.758 -2.306 0.710 1.00 . A A . 82 TYR HB2 1 1 6 6453 1 1 47 TYR HB3 H 4.646 -4.015 0.397 1.00 . A A . 82 TYR HB3 1 1 6 6454 1 1 47 TYR HD1 H 4.874 -1.718 3.318 1.00 . A A . 82 TYR HD1 1 1 6 6455 1 1 47 TYR HD2 H 2.982 -5.204 1.721 1.00 . A A . 82 TYR HD2 1 1 6 6456 1 1 47 TYR HE1 H 3.411 -1.834 5.272 1.00 . A A . 82 TYR HE1 1 1 6 6457 1 1 47 TYR HE2 H 1.563 -5.320 3.671 1.00 . A A . 82 TYR HE2 1 1 6 6458 1 1 47 TYR HH H 1.452 -4.560 5.957 1.00 . A A . 82 TYR HH 1 1 6 6459 1 1 47 TYR N N 6.820 -4.779 1.730 1.00 . A A . 82 TYR N 1 1 6 6460 1 1 47 TYR O O 7.446 -2.769 3.401 1.00 . A A . 82 TYR O 1 1 6 6461 1 1 47 TYR OH O 1.574 -3.639 5.692 1.00 . A A . 82 TYR OH 1 1 6 6462 1 1 48 ALA C C 6.125 0.906 2.367 1.00 . A A . 83 ALA C 1 1 6 6463 1 1 48 ALA CA C 7.221 -0.074 2.715 1.00 . A A . 83 ALA CA 1 1 6 6464 1 1 48 ALA CB C 8.577 0.540 2.421 1.00 . A A . 83 ALA CB 1 1 6 6465 1 1 48 ALA H H 6.828 -1.020 0.925 1.00 . A A . 83 ALA H 1 1 6 6466 1 1 48 ALA HA H 7.161 -0.366 3.753 1.00 . A A . 83 ALA HA 1 1 6 6467 1 1 48 ALA HB1 H 8.678 0.676 1.355 1.00 . A A . 83 ALA HB1 1 1 6 6468 1 1 48 ALA HB2 H 9.360 -0.105 2.790 1.00 . A A . 83 ALA HB2 1 1 6 6469 1 1 48 ALA HB3 H 8.633 1.508 2.900 1.00 . A A . 83 ALA HB3 1 1 6 6470 1 1 48 ALA N N 7.002 -1.206 1.875 1.00 . A A . 83 ALA N 1 1 6 6471 1 1 48 ALA O O 6.014 1.317 1.240 1.00 . A A . 83 ALA O 1 1 6 6472 1 1 49 ALA C C 4.372 3.415 3.756 1.00 . A A . 84 ALA C 1 1 6 6473 1 1 49 ALA CA C 4.244 2.177 2.951 1.00 . A A . 84 ALA CA 1 1 6 6474 1 1 49 ALA CB C 2.878 1.552 3.129 1.00 . A A . 84 ALA CB 1 1 6 6475 1 1 49 ALA H H 5.371 0.906 4.198 1.00 . A A . 84 ALA H 1 1 6 6476 1 1 49 ALA HA H 4.363 2.438 1.909 1.00 . A A . 84 ALA HA 1 1 6 6477 1 1 49 ALA HB1 H 2.828 0.630 2.569 1.00 . A A . 84 ALA HB1 1 1 6 6478 1 1 49 ALA HB2 H 2.149 2.243 2.730 1.00 . A A . 84 ALA HB2 1 1 6 6479 1 1 49 ALA HB3 H 2.676 1.369 4.173 1.00 . A A . 84 ALA HB3 1 1 6 6480 1 1 49 ALA N N 5.299 1.253 3.284 1.00 . A A . 84 ALA N 1 1 6 6481 1 1 49 ALA O O 4.534 3.346 4.985 1.00 . A A . 84 ALA O 1 1 6 6482 1 1 50 LEU C C 3.229 6.581 3.358 1.00 . A A . 85 LEU C 1 1 6 6483 1 1 50 LEU CA C 4.425 5.785 3.744 1.00 . A A . 85 LEU CA 1 1 6 6484 1 1 50 LEU CB C 5.670 6.540 3.266 1.00 . A A . 85 LEU CB 1 1 6 6485 1 1 50 LEU CD1 C 6.560 7.562 5.340 1.00 . A A . 85 LEU CD1 1 1 6 6486 1 1 50 LEU CD2 C 6.860 8.762 3.214 1.00 . A A . 85 LEU CD2 1 1 6 6487 1 1 50 LEU CG C 5.972 7.836 3.999 1.00 . A A . 85 LEU CG 1 1 6 6488 1 1 50 LEU H H 4.179 4.581 2.121 1.00 . A A . 85 LEU H 1 1 6 6489 1 1 50 LEU HA H 4.482 5.647 4.811 1.00 . A A . 85 LEU HA 1 1 6 6490 1 1 50 LEU HB2 H 6.514 5.894 3.423 1.00 . A A . 85 LEU HB2 1 1 6 6491 1 1 50 LEU HB3 H 5.575 6.754 2.215 1.00 . A A . 85 LEU HB3 1 1 6 6492 1 1 50 LEU HD11 H 7.514 7.079 5.186 1.00 . A A . 85 LEU HD11 1 1 6 6493 1 1 50 LEU HD12 H 5.884 6.933 5.898 1.00 . A A . 85 LEU HD12 1 1 6 6494 1 1 50 LEU HD13 H 6.689 8.518 5.826 1.00 . A A . 85 LEU HD13 1 1 6 6495 1 1 50 LEU HD21 H 6.384 9.038 2.286 1.00 . A A . 85 LEU HD21 1 1 6 6496 1 1 50 LEU HD22 H 7.804 8.275 3.015 1.00 . A A . 85 LEU HD22 1 1 6 6497 1 1 50 LEU HD23 H 7.023 9.647 3.813 1.00 . A A . 85 LEU HD23 1 1 6 6498 1 1 50 LEU HG H 5.029 8.331 4.162 1.00 . A A . 85 LEU HG 1 1 6 6499 1 1 50 LEU N N 4.322 4.537 3.097 1.00 . A A . 85 LEU N 1 1 6 6500 1 1 50 LEU O O 2.620 6.330 2.314 1.00 . A A . 85 LEU O 1 1 6 6501 1 1 51 HIS C C 2.170 9.127 2.573 1.00 . A A . 86 HIS C 1 1 6 6502 1 1 51 HIS CA C 1.858 8.473 3.917 1.00 . A A . 86 HIS CA 1 1 6 6503 1 1 51 HIS CB C 1.796 9.528 5.053 1.00 . A A . 86 HIS CB 1 1 6 6504 1 1 51 HIS CD2 C 4.149 10.706 5.072 1.00 . A A . 86 HIS CD2 1 1 6 6505 1 1 51 HIS CE1 C 4.796 10.096 7.054 1.00 . A A . 86 HIS CE1 1 1 6 6506 1 1 51 HIS CG C 3.149 9.967 5.606 1.00 . A A . 86 HIS CG 1 1 6 6507 1 1 51 HIS H H 3.271 7.448 5.107 1.00 . A A . 86 HIS H 1 1 6 6508 1 1 51 HIS HA H 0.907 7.967 3.855 1.00 . A A . 86 HIS HA 1 1 6 6509 1 1 51 HIS HB2 H 1.309 10.410 4.666 1.00 . A A . 86 HIS HB2 1 1 6 6510 1 1 51 HIS HB3 H 1.209 9.130 5.867 1.00 . A A . 86 HIS HB3 1 1 6 6511 1 1 51 HIS HD1 H 3.090 9.058 7.500 1.00 . A A . 86 HIS HD1 1 1 6 6512 1 1 51 HIS HD2 H 4.192 11.113 4.075 1.00 . A A . 86 HIS HD2 1 1 6 6513 1 1 51 HIS HE1 H 5.417 9.946 7.922 1.00 . A A . 86 HIS HE1 1 1 6 6514 1 1 51 HIS HE2 H 5.996 11.261 5.893 1.00 . A A . 86 HIS HE2 1 1 6 6515 1 1 51 HIS N N 2.862 7.486 4.216 1.00 . A A . 86 HIS N 1 1 6 6516 1 1 51 HIS ND1 N 3.594 9.603 6.853 1.00 . A A . 86 HIS ND1 1 1 6 6517 1 1 51 HIS NE2 N 5.149 10.769 5.993 1.00 . A A . 86 HIS NE2 1 1 6 6518 1 1 51 HIS O O 3.246 9.710 2.380 1.00 . A A . 86 HIS O 1 1 6 6519 1 1 52 GLY C C 1.893 8.500 -0.679 1.00 . A A . 87 GLY C 1 1 6 6520 1 1 52 GLY CA C 1.460 9.528 0.352 1.00 . A A . 87 GLY CA 1 1 6 6521 1 1 52 GLY H H 0.460 8.464 1.857 1.00 . A A . 87 GLY H 1 1 6 6522 1 1 52 GLY HA2 H 0.528 9.963 0.024 1.00 . A A . 87 GLY HA2 1 1 6 6523 1 1 52 GLY HA3 H 2.210 10.304 0.407 1.00 . A A . 87 GLY HA3 1 1 6 6524 1 1 52 GLY N N 1.271 8.978 1.653 1.00 . A A . 87 GLY N 1 1 6 6525 1 1 52 GLY O O 1.263 8.391 -1.731 1.00 . A A . 87 GLY O 1 1 6 6526 1 1 53 GLU C C 3.856 5.462 -0.800 1.00 . A A . 88 GLU C 1 1 6 6527 1 1 53 GLU CA C 3.491 6.801 -1.385 1.00 . A A . 88 GLU CA 1 1 6 6528 1 1 53 GLU CB C 4.712 7.380 -2.112 1.00 . A A . 88 GLU CB 1 1 6 6529 1 1 53 GLU CD C 5.645 9.279 -3.490 1.00 . A A . 88 GLU CD 1 1 6 6530 1 1 53 GLU CG C 4.445 8.704 -2.777 1.00 . A A . 88 GLU CG 1 1 6 6531 1 1 53 GLU H H 3.315 7.665 0.518 1.00 . A A . 88 GLU H 1 1 6 6532 1 1 53 GLU HA H 2.708 6.670 -2.116 1.00 . A A . 88 GLU HA 1 1 6 6533 1 1 53 GLU HB2 H 5.573 7.451 -1.466 1.00 . A A . 88 GLU HB2 1 1 6 6534 1 1 53 GLU HB3 H 4.931 6.692 -2.917 1.00 . A A . 88 GLU HB3 1 1 6 6535 1 1 53 GLU HG2 H 3.635 8.559 -3.474 1.00 . A A . 88 GLU HG2 1 1 6 6536 1 1 53 GLU HG3 H 4.112 9.385 -2.009 1.00 . A A . 88 GLU HG3 1 1 6 6537 1 1 53 GLU N N 2.943 7.719 -0.390 1.00 . A A . 88 GLU N 1 1 6 6538 1 1 53 GLU O O 4.362 5.362 0.318 1.00 . A A . 88 GLU O 1 1 6 6539 1 1 53 GLU OE1 O 5.861 8.975 -4.693 1.00 . A A . 88 GLU OE1 1 1 6 6540 1 1 53 GLU OE2 O 6.371 10.069 -2.885 1.00 . A A . 88 GLU OE2 1 1 6 6541 1 1 54 PHE C C 5.210 2.858 -1.966 1.00 . A A . 89 PHE C 1 1 6 6542 1 1 54 PHE CA C 3.949 3.119 -1.216 1.00 . A A . 89 PHE CA 1 1 6 6543 1 1 54 PHE CB C 2.795 2.183 -1.612 1.00 . A A . 89 PHE CB 1 1 6 6544 1 1 54 PHE CD1 C 0.765 3.685 -1.442 1.00 . A A . 89 PHE CD1 1 1 6 6545 1 1 54 PHE CD2 C 1.134 2.071 0.269 1.00 . A A . 89 PHE CD2 1 1 6 6546 1 1 54 PHE CE1 C -0.343 4.150 -0.779 1.00 . A A . 89 PHE CE1 1 1 6 6547 1 1 54 PHE CE2 C 0.036 2.543 0.936 1.00 . A A . 89 PHE CE2 1 1 6 6548 1 1 54 PHE CG C 1.522 2.629 -0.925 1.00 . A A . 89 PHE CG 1 1 6 6549 1 1 54 PHE CZ C -0.704 3.586 0.408 1.00 . A A . 89 PHE CZ 1 1 6 6550 1 1 54 PHE H H 3.201 4.579 -2.440 1.00 . A A . 89 PHE H 1 1 6 6551 1 1 54 PHE HA H 4.133 3.071 -0.152 1.00 . A A . 89 PHE HA 1 1 6 6552 1 1 54 PHE HB2 H 2.648 2.193 -2.682 1.00 . A A . 89 PHE HB2 1 1 6 6553 1 1 54 PHE HB3 H 3.023 1.176 -1.306 1.00 . A A . 89 PHE HB3 1 1 6 6554 1 1 54 PHE HD1 H 1.052 4.131 -2.383 1.00 . A A . 89 PHE HD1 1 1 6 6555 1 1 54 PHE HD2 H 1.689 1.250 0.698 1.00 . A A . 89 PHE HD2 1 1 6 6556 1 1 54 PHE HE1 H -0.929 4.966 -1.176 1.00 . A A . 89 PHE HE1 1 1 6 6557 1 1 54 PHE HE2 H -0.258 2.089 1.873 1.00 . A A . 89 PHE HE2 1 1 6 6558 1 1 54 PHE HZ H -1.569 3.963 0.932 1.00 . A A . 89 PHE HZ 1 1 6 6559 1 1 54 PHE N N 3.616 4.450 -1.566 1.00 . A A . 89 PHE N 1 1 6 6560 1 1 54 PHE O O 5.328 3.231 -3.142 1.00 . A A . 89 PHE O 1 1 6 6561 1 1 55 TYR C C 8.050 0.937 -1.595 1.00 . A A . 90 TYR C 1 1 6 6562 1 1 55 TYR CA C 7.463 2.285 -1.863 1.00 . A A . 90 TYR CA 1 1 6 6563 1 1 55 TYR CB C 8.244 3.358 -1.116 1.00 . A A . 90 TYR CB 1 1 6 6564 1 1 55 TYR CD1 C 7.678 5.322 -2.537 1.00 . A A . 90 TYR CD1 1 1 6 6565 1 1 55 TYR CD2 C 9.960 4.929 -2.042 1.00 . A A . 90 TYR CD2 1 1 6 6566 1 1 55 TYR CE1 C 7.999 6.436 -3.248 1.00 . A A . 90 TYR CE1 1 1 6 6567 1 1 55 TYR CE2 C 10.298 6.052 -2.760 1.00 . A A . 90 TYR CE2 1 1 6 6568 1 1 55 TYR CG C 8.648 4.545 -1.921 1.00 . A A . 90 TYR CG 1 1 6 6569 1 1 55 TYR CZ C 9.310 6.808 -3.361 1.00 . A A . 90 TYR CZ 1 1 6 6570 1 1 55 TYR H H 6.010 1.882 -0.447 1.00 . A A . 90 TYR H 1 1 6 6571 1 1 55 TYR HA H 7.456 2.528 -2.915 1.00 . A A . 90 TYR HA 1 1 6 6572 1 1 55 TYR HB2 H 7.432 3.843 -0.586 1.00 . A A . 90 TYR HB2 1 1 6 6573 1 1 55 TYR HB3 H 8.999 3.028 -0.421 1.00 . A A . 90 TYR HB3 1 1 6 6574 1 1 55 TYR HD1 H 6.640 5.038 -2.451 1.00 . A A . 90 TYR HD1 1 1 6 6575 1 1 55 TYR HD2 H 10.735 4.338 -1.576 1.00 . A A . 90 TYR HD2 1 1 6 6576 1 1 55 TYR HE1 H 7.205 7.005 -3.711 1.00 . A A . 90 TYR HE1 1 1 6 6577 1 1 55 TYR HE2 H 11.335 6.338 -2.838 1.00 . A A . 90 TYR HE2 1 1 6 6578 1 1 55 TYR HH H 9.126 8.674 -3.717 1.00 . A A . 90 TYR HH 1 1 6 6579 1 1 55 TYR N N 6.160 2.310 -1.323 1.00 . A A . 90 TYR N 1 1 6 6580 1 1 55 TYR O O 7.620 0.236 -0.687 1.00 . A A . 90 TYR O 1 1 6 6581 1 1 55 TYR OH O 9.642 7.940 -4.080 1.00 . A A . 90 TYR OH 1 1 6 6582 1 1 56 CYS C C 10.658 -0.548 -1.112 1.00 . A A . 91 CYS C 1 1 6 6583 1 1 56 CYS CA C 9.594 -0.727 -2.160 1.00 . A A . 91 CYS CA 1 1 6 6584 1 1 56 CYS CB C 10.181 -1.327 -3.450 1.00 . A A . 91 CYS CB 1 1 6 6585 1 1 56 CYS H H 9.262 1.104 -3.139 1.00 . A A . 91 CYS H 1 1 6 6586 1 1 56 CYS HA H 8.821 -1.381 -1.778 1.00 . A A . 91 CYS HA 1 1 6 6587 1 1 56 CYS HB2 H 10.551 -2.318 -3.236 1.00 . A A . 91 CYS HB2 1 1 6 6588 1 1 56 CYS HB3 H 9.400 -1.425 -4.184 1.00 . A A . 91 CYS HB3 1 1 6 6589 1 1 56 CYS N N 8.983 0.535 -2.395 1.00 . A A . 91 CYS N 1 1 6 6590 1 1 56 CYS O O 11.133 0.585 -0.941 1.00 . A A . 91 CYS O 1 1 6 6591 1 1 56 CYS SG S 11.523 -0.370 -4.205 1.00 . A A . 91 CYS SG 1 1 6 6592 1 1 57 LYS C C 13.375 -0.838 0.030 1.00 . A A . 92 LYS C 1 1 6 6593 1 1 57 LYS CA C 12.076 -1.493 0.588 1.00 . A A . 92 LYS CA 1 1 6 6594 1 1 57 LYS CB C 12.386 -2.861 1.209 1.00 . A A . 92 LYS CB 1 1 6 6595 1 1 57 LYS CD C 11.638 -4.852 2.496 1.00 . A A . 92 LYS CD 1 1 6 6596 1 1 57 LYS CE C 10.566 -5.475 3.359 1.00 . A A . 92 LYS CE 1 1 6 6597 1 1 57 LYS CG C 11.236 -3.487 1.980 1.00 . A A . 92 LYS CG 1 1 6 6598 1 1 57 LYS H H 10.554 -2.443 -0.546 1.00 . A A . 92 LYS H 1 1 6 6599 1 1 57 LYS HA H 11.693 -0.844 1.361 1.00 . A A . 92 LYS HA 1 1 6 6600 1 1 57 LYS HB2 H 12.669 -3.547 0.427 1.00 . A A . 92 LYS HB2 1 1 6 6601 1 1 57 LYS HB3 H 13.221 -2.748 1.885 1.00 . A A . 92 LYS HB3 1 1 6 6602 1 1 57 LYS HD2 H 11.825 -5.503 1.656 1.00 . A A . 92 LYS HD2 1 1 6 6603 1 1 57 LYS HD3 H 12.542 -4.753 3.077 1.00 . A A . 92 LYS HD3 1 1 6 6604 1 1 57 LYS HE2 H 10.369 -4.825 4.200 1.00 . A A . 92 LYS HE2 1 1 6 6605 1 1 57 LYS HE3 H 9.665 -5.592 2.775 1.00 . A A . 92 LYS HE3 1 1 6 6606 1 1 57 LYS HG2 H 10.982 -2.852 2.816 1.00 . A A . 92 LYS HG2 1 1 6 6607 1 1 57 LYS HG3 H 10.384 -3.593 1.324 1.00 . A A . 92 LYS HG3 1 1 6 6608 1 1 57 LYS HZ1 H 11.057 -7.495 3.098 1.00 . A A . 92 LYS HZ1 1 1 6 6609 1 1 57 LYS HZ2 H 10.373 -7.166 4.612 1.00 . A A . 92 LYS HZ2 1 1 6 6610 1 1 57 LYS HZ3 H 11.944 -6.711 4.262 1.00 . A A . 92 LYS HZ3 1 1 6 6611 1 1 57 LYS N N 11.030 -1.594 -0.420 1.00 . A A . 92 LYS N 1 1 6 6612 1 1 57 LYS NZ N 10.991 -6.789 3.859 1.00 . A A . 92 LYS NZ 1 1 6 6613 1 1 57 LYS O O 13.887 0.091 0.667 1.00 . A A . 92 LYS O 1 1 6 6614 1 1 58 PRO C C 14.907 0.897 -1.978 1.00 . A A . 93 PRO C 1 1 6 6615 1 1 58 PRO CA C 15.117 -0.606 -1.724 1.00 . A A . 93 PRO CA 1 1 6 6616 1 1 58 PRO CB C 15.347 -1.330 -3.053 1.00 . A A . 93 PRO CB 1 1 6 6617 1 1 58 PRO CD C 13.465 -2.375 -2.042 1.00 . A A . 93 PRO CD 1 1 6 6618 1 1 58 PRO CG C 14.643 -2.630 -2.914 1.00 . A A . 93 PRO CG 1 1 6 6619 1 1 58 PRO HA H 15.974 -0.737 -1.080 1.00 . A A . 93 PRO HA 1 1 6 6620 1 1 58 PRO HB2 H 14.932 -0.734 -3.850 1.00 . A A . 93 PRO HB2 1 1 6 6621 1 1 58 PRO HB3 H 16.406 -1.466 -3.213 1.00 . A A . 93 PRO HB3 1 1 6 6622 1 1 58 PRO HD2 H 12.621 -2.093 -2.653 1.00 . A A . 93 PRO HD2 1 1 6 6623 1 1 58 PRO HD3 H 13.233 -3.253 -1.460 1.00 . A A . 93 PRO HD3 1 1 6 6624 1 1 58 PRO HG2 H 14.322 -2.993 -3.879 1.00 . A A . 93 PRO HG2 1 1 6 6625 1 1 58 PRO HG3 H 15.284 -3.355 -2.442 1.00 . A A . 93 PRO HG3 1 1 6 6626 1 1 58 PRO N N 13.920 -1.252 -1.170 1.00 . A A . 93 PRO N 1 1 6 6627 1 1 58 PRO O O 15.687 1.720 -1.505 1.00 . A A . 93 PRO O 1 1 6 6628 1 1 59 HIS C C 13.267 3.495 -1.763 1.00 . A A . 94 HIS C 1 1 6 6629 1 1 59 HIS CA C 13.560 2.667 -2.969 1.00 . A A . 94 HIS CA 1 1 6 6630 1 1 59 HIS CB C 12.490 2.890 -4.045 1.00 . A A . 94 HIS CB 1 1 6 6631 1 1 59 HIS CD2 C 14.190 2.817 -5.953 1.00 . A A . 94 HIS CD2 1 1 6 6632 1 1 59 HIS CE1 C 12.850 2.107 -7.517 1.00 . A A . 94 HIS CE1 1 1 6 6633 1 1 59 HIS CG C 12.963 2.643 -5.438 1.00 . A A . 94 HIS CG 1 1 6 6634 1 1 59 HIS H H 13.176 0.561 -2.923 1.00 . A A . 94 HIS H 1 1 6 6635 1 1 59 HIS HA H 14.499 3.037 -3.355 1.00 . A A . 94 HIS HA 1 1 6 6636 1 1 59 HIS HB2 H 11.653 2.234 -3.858 1.00 . A A . 94 HIS HB2 1 1 6 6637 1 1 59 HIS HB3 H 12.159 3.914 -3.983 1.00 . A A . 94 HIS HB3 1 1 6 6638 1 1 59 HIS HD2 H 15.046 3.167 -5.397 1.00 . A A . 94 HIS HD2 1 1 6 6639 1 1 59 HIS HE1 H 12.468 1.776 -8.475 1.00 . A A . 94 HIS HE1 1 1 6 6640 1 1 59 HIS HE2 H 14.896 2.359 -7.873 1.00 . A A . 94 HIS HE2 1 1 6 6641 1 1 59 HIS N N 13.813 1.257 -2.650 1.00 . A A . 94 HIS N 1 1 6 6642 1 1 59 HIS ND1 N 12.115 2.204 -6.416 1.00 . A A . 94 HIS ND1 1 1 6 6643 1 1 59 HIS NE2 N 14.121 2.476 -7.278 1.00 . A A . 94 HIS NE2 1 1 6 6644 1 1 59 HIS O O 13.629 4.660 -1.728 1.00 . A A . 94 HIS O 1 1 6 6645 1 1 60 PHE C C 13.613 4.054 1.082 1.00 . A A . 95 PHE C 1 1 6 6646 1 1 60 PHE CA C 12.313 3.622 0.441 1.00 . A A . 95 PHE CA 1 1 6 6647 1 1 60 PHE CB C 11.553 2.728 1.409 1.00 . A A . 95 PHE CB 1 1 6 6648 1 1 60 PHE CD1 C 9.705 4.050 2.377 1.00 . A A . 95 PHE CD1 1 1 6 6649 1 1 60 PHE CD2 C 11.579 3.609 3.727 1.00 . A A . 95 PHE CD2 1 1 6 6650 1 1 60 PHE CE1 C 9.124 4.746 3.396 1.00 . A A . 95 PHE CE1 1 1 6 6651 1 1 60 PHE CE2 C 11.010 4.310 4.769 1.00 . A A . 95 PHE CE2 1 1 6 6652 1 1 60 PHE CG C 10.934 3.476 2.532 1.00 . A A . 95 PHE CG 1 1 6 6653 1 1 60 PHE CZ C 9.773 4.882 4.603 1.00 . A A . 95 PHE CZ 1 1 6 6654 1 1 60 PHE H H 12.323 1.977 -0.870 1.00 . A A . 95 PHE H 1 1 6 6655 1 1 60 PHE HA H 11.716 4.498 0.223 1.00 . A A . 95 PHE HA 1 1 6 6656 1 1 60 PHE HB2 H 10.772 2.188 0.902 1.00 . A A . 95 PHE HB2 1 1 6 6657 1 1 60 PHE HB3 H 12.249 2.020 1.832 1.00 . A A . 95 PHE HB3 1 1 6 6658 1 1 60 PHE HD1 H 9.192 3.953 1.432 1.00 . A A . 95 PHE HD1 1 1 6 6659 1 1 60 PHE HD2 H 12.547 3.145 3.824 1.00 . A A . 95 PHE HD2 1 1 6 6660 1 1 60 PHE HE1 H 8.155 5.177 3.222 1.00 . A A . 95 PHE HE1 1 1 6 6661 1 1 60 PHE HE2 H 11.535 4.403 5.708 1.00 . A A . 95 PHE HE2 1 1 6 6662 1 1 60 PHE HZ H 9.313 5.434 5.409 1.00 . A A . 95 PHE HZ 1 1 6 6663 1 1 60 PHE N N 12.616 2.912 -0.780 1.00 . A A . 95 PHE N 1 1 6 6664 1 1 60 PHE O O 13.786 5.207 1.411 1.00 . A A . 95 PHE O 1 1 6 6665 1 1 61 GLN C C 16.640 4.420 1.019 1.00 . A A . 96 GLN C 1 1 6 6666 1 1 61 GLN CA C 15.840 3.355 1.771 1.00 . A A . 96 GLN CA 1 1 6 6667 1 1 61 GLN CB C 16.626 2.044 1.846 1.00 . A A . 96 GLN CB 1 1 6 6668 1 1 61 GLN CD C 16.705 -0.336 2.702 1.00 . A A . 96 GLN CD 1 1 6 6669 1 1 61 GLN CG C 16.020 1.012 2.790 1.00 . A A . 96 GLN CG 1 1 6 6670 1 1 61 GLN H H 14.353 2.236 0.788 1.00 . A A . 96 GLN H 1 1 6 6671 1 1 61 GLN HA H 15.670 3.705 2.778 1.00 . A A . 96 GLN HA 1 1 6 6672 1 1 61 GLN HB2 H 16.659 1.613 0.856 1.00 . A A . 96 GLN HB2 1 1 6 6673 1 1 61 GLN HB3 H 17.634 2.257 2.171 1.00 . A A . 96 GLN HB3 1 1 6 6674 1 1 61 GLN HE21 H 15.429 -0.873 1.320 1.00 . A A . 96 GLN HE21 1 1 6 6675 1 1 61 GLN HE22 H 16.611 -2.069 1.738 1.00 . A A . 96 GLN HE22 1 1 6 6676 1 1 61 GLN HG2 H 16.121 1.383 3.799 1.00 . A A . 96 GLN HG2 1 1 6 6677 1 1 61 GLN HG3 H 14.968 0.888 2.570 1.00 . A A . 96 GLN HG3 1 1 6 6678 1 1 61 GLN N N 14.543 3.123 1.162 1.00 . A A . 96 GLN N 1 1 6 6679 1 1 61 GLN NE2 N 16.206 -1.182 1.838 1.00 . A A . 96 GLN NE2 1 1 6 6680 1 1 61 GLN O O 17.287 5.266 1.632 1.00 . A A . 96 GLN O 1 1 6 6681 1 1 61 GLN OE1 O 17.672 -0.615 3.413 1.00 . A A . 96 GLN OE1 1 1 6 6682 1 1 62 GLN C C 16.702 6.714 -1.119 1.00 . A A . 97 GLN C 1 1 6 6683 1 1 62 GLN CA C 17.339 5.315 -1.111 1.00 . A A . 97 GLN CA 1 1 6 6684 1 1 62 GLN CB C 17.295 4.819 -2.545 1.00 . A A . 97 GLN CB 1 1 6 6685 1 1 62 GLN CD C 17.556 2.932 -4.193 1.00 . A A . 97 GLN CD 1 1 6 6686 1 1 62 GLN CG C 17.884 3.454 -2.796 1.00 . A A . 97 GLN CG 1 1 6 6687 1 1 62 GLN H H 16.067 3.697 -0.766 1.00 . A A . 97 GLN H 1 1 6 6688 1 1 62 GLN HA H 18.374 5.349 -0.808 1.00 . A A . 97 GLN HA 1 1 6 6689 1 1 62 GLN HB2 H 16.265 4.794 -2.867 1.00 . A A . 97 GLN HB2 1 1 6 6690 1 1 62 GLN HB3 H 17.823 5.534 -3.148 1.00 . A A . 97 GLN HB3 1 1 6 6691 1 1 62 GLN HE21 H 17.482 4.771 -4.940 1.00 . A A . 97 GLN HE21 1 1 6 6692 1 1 62 GLN HE22 H 17.187 3.502 -6.052 1.00 . A A . 97 GLN HE22 1 1 6 6693 1 1 62 GLN HG2 H 18.957 3.514 -2.693 1.00 . A A . 97 GLN HG2 1 1 6 6694 1 1 62 GLN HG3 H 17.486 2.763 -2.068 1.00 . A A . 97 GLN HG3 1 1 6 6695 1 1 62 GLN N N 16.595 4.381 -0.302 1.00 . A A . 97 GLN N 1 1 6 6696 1 1 62 GLN NE2 N 17.392 3.817 -5.146 1.00 . A A . 97 GLN NE2 1 1 6 6697 1 1 62 GLN O O 17.357 7.718 -0.847 1.00 . A A . 97 GLN O 1 1 6 6698 1 1 62 GLN OE1 O 17.439 1.725 -4.402 1.00 . A A . 97 GLN OE1 1 1 6 6699 1 1 63 LEU C C 14.186 8.639 -0.381 1.00 . A A . 98 LEU C 1 1 6 6700 1 1 63 LEU CA C 14.702 7.985 -1.652 1.00 . A A . 98 LEU CA 1 1 6 6701 1 1 63 LEU CB C 13.580 7.722 -2.615 1.00 . A A . 98 LEU CB 1 1 6 6702 1 1 63 LEU CD1 C 12.928 6.694 -4.760 1.00 . A A . 98 LEU CD1 1 1 6 6703 1 1 63 LEU CD2 C 14.408 8.636 -4.793 1.00 . A A . 98 LEU CD2 1 1 6 6704 1 1 63 LEU CG C 14.024 7.381 -4.038 1.00 . A A . 98 LEU CG 1 1 6 6705 1 1 63 LEU H H 14.957 5.904 -1.588 1.00 . A A . 98 LEU H 1 1 6 6706 1 1 63 LEU HA H 15.372 8.669 -2.146 1.00 . A A . 98 LEU HA 1 1 6 6707 1 1 63 LEU HB2 H 13.034 6.883 -2.213 1.00 . A A . 98 LEU HB2 1 1 6 6708 1 1 63 LEU HB3 H 12.931 8.584 -2.649 1.00 . A A . 98 LEU HB3 1 1 6 6709 1 1 63 LEU HD11 H 13.235 6.486 -5.773 1.00 . A A . 98 LEU HD11 1 1 6 6710 1 1 63 LEU HD12 H 12.054 7.327 -4.755 1.00 . A A . 98 LEU HD12 1 1 6 6711 1 1 63 LEU HD13 H 12.717 5.769 -4.249 1.00 . A A . 98 LEU HD13 1 1 6 6712 1 1 63 LEU HD21 H 14.599 8.386 -5.827 1.00 . A A . 98 LEU HD21 1 1 6 6713 1 1 63 LEU HD22 H 15.295 9.069 -4.355 1.00 . A A . 98 LEU HD22 1 1 6 6714 1 1 63 LEU HD23 H 13.594 9.345 -4.742 1.00 . A A . 98 LEU HD23 1 1 6 6715 1 1 63 LEU HG H 14.886 6.730 -4.010 1.00 . A A . 98 LEU HG 1 1 6 6716 1 1 63 LEU N N 15.441 6.751 -1.460 1.00 . A A . 98 LEU N 1 1 6 6717 1 1 63 LEU O O 14.285 9.859 -0.218 1.00 . A A . 98 LEU O 1 1 6 6718 1 1 64 PHE C C 13.926 8.268 2.908 1.00 . A A . 99 PHE C 1 1 6 6719 1 1 64 PHE CA C 13.022 8.398 1.708 1.00 . A A . 99 PHE CA 1 1 6 6720 1 1 64 PHE CB C 11.672 7.723 2.011 1.00 . A A . 99 PHE CB 1 1 6 6721 1 1 64 PHE CD1 C 10.573 9.186 0.249 1.00 . A A . 99 PHE CD1 1 1 6 6722 1 1 64 PHE CD2 C 9.345 7.347 1.143 1.00 . A A . 99 PHE CD2 1 1 6 6723 1 1 64 PHE CE1 C 9.500 9.509 -0.555 1.00 . A A . 99 PHE CE1 1 1 6 6724 1 1 64 PHE CE2 C 8.273 7.674 0.335 1.00 . A A . 99 PHE CE2 1 1 6 6725 1 1 64 PHE CG C 10.512 8.096 1.113 1.00 . A A . 99 PHE CG 1 1 6 6726 1 1 64 PHE CZ C 8.357 8.756 -0.514 1.00 . A A . 99 PHE CZ 1 1 6 6727 1 1 64 PHE H H 13.617 6.876 0.380 1.00 . A A . 99 PHE H 1 1 6 6728 1 1 64 PHE HA H 12.842 9.445 1.542 1.00 . A A . 99 PHE HA 1 1 6 6729 1 1 64 PHE HB2 H 11.821 6.683 1.764 1.00 . A A . 99 PHE HB2 1 1 6 6730 1 1 64 PHE HB3 H 11.393 7.818 3.047 1.00 . A A . 99 PHE HB3 1 1 6 6731 1 1 64 PHE HD1 H 11.467 9.788 0.197 1.00 . A A . 99 PHE HD1 1 1 6 6732 1 1 64 PHE HD2 H 9.266 6.500 1.814 1.00 . A A . 99 PHE HD2 1 1 6 6733 1 1 64 PHE HE1 H 9.541 10.353 -1.226 1.00 . A A . 99 PHE HE1 1 1 6 6734 1 1 64 PHE HE2 H 7.372 7.078 0.368 1.00 . A A . 99 PHE HE2 1 1 6 6735 1 1 64 PHE HZ H 7.531 9.028 -1.153 1.00 . A A . 99 PHE HZ 1 1 6 6736 1 1 64 PHE N N 13.637 7.849 0.511 1.00 . A A . 99 PHE N 1 1 6 6737 1 1 64 PHE O O 13.797 9.039 3.869 1.00 . A A . 99 PHE O 1 1 6 6738 1 1 65 LYS C C 15.057 6.007 4.889 1.00 . A A . 100 LYS C 1 1 6 6739 1 1 65 LYS CA C 15.782 6.897 3.866 1.00 . A A . 100 LYS CA 1 1 6 6740 1 1 65 LYS CB C 16.449 8.126 4.512 1.00 . A A . 100 LYS CB 1 1 6 6741 1 1 65 LYS CD C 17.984 9.086 6.234 1.00 . A A . 100 LYS CD 1 1 6 6742 1 1 65 LYS CE C 16.880 9.845 6.961 1.00 . A A . 100 LYS CE 1 1 6 6743 1 1 65 LYS CG C 17.468 7.818 5.579 1.00 . A A . 100 LYS CG 1 1 6 6744 1 1 65 LYS H H 14.851 6.732 2.014 1.00 . A A . 100 LYS H 1 1 6 6745 1 1 65 LYS HA H 16.531 6.284 3.382 1.00 . A A . 100 LYS HA 1 1 6 6746 1 1 65 LYS HB2 H 16.937 8.703 3.740 1.00 . A A . 100 LYS HB2 1 1 6 6747 1 1 65 LYS HB3 H 15.663 8.725 4.946 1.00 . A A . 100 LYS HB3 1 1 6 6748 1 1 65 LYS HD2 H 18.744 8.819 6.951 1.00 . A A . 100 LYS HD2 1 1 6 6749 1 1 65 LYS HD3 H 18.409 9.724 5.474 1.00 . A A . 100 LYS HD3 1 1 6 6750 1 1 65 LYS HE2 H 16.111 10.117 6.254 1.00 . A A . 100 LYS HE2 1 1 6 6751 1 1 65 LYS HE3 H 16.457 9.209 7.724 1.00 . A A . 100 LYS HE3 1 1 6 6752 1 1 65 LYS HG2 H 16.987 7.189 6.312 1.00 . A A . 100 LYS HG2 1 1 6 6753 1 1 65 LYS HG3 H 18.290 7.281 5.130 1.00 . A A . 100 LYS HG3 1 1 6 6754 1 1 65 LYS HZ1 H 16.601 11.556 8.087 1.00 . A A . 100 LYS HZ1 1 1 6 6755 1 1 65 LYS HZ2 H 17.743 11.723 6.855 1.00 . A A . 100 LYS HZ2 1 1 6 6756 1 1 65 LYS HZ3 H 18.140 10.876 8.268 1.00 . A A . 100 LYS HZ3 1 1 6 6757 1 1 65 LYS N N 14.841 7.282 2.823 1.00 . A A . 100 LYS N 1 1 6 6758 1 1 65 LYS NZ N 17.380 11.080 7.587 1.00 . A A . 100 LYS NZ 1 1 6 6759 1 1 65 LYS O O 13.823 6.073 4.988 1.00 . A A . 100 LYS O 1 1 6 6760 1 1 66 SER C C 14.603 3.030 5.929 1.00 . A A . 101 SER C 1 1 6 6761 1 1 66 SER CA C 15.299 4.227 6.615 1.00 . A A . 101 SER CA 1 1 6 6762 1 1 66 SER CB C 14.343 4.944 7.593 1.00 . A A . 101 SER CB 1 1 6 6763 1 1 66 SER H H 16.784 5.139 5.441 1.00 . A A . 101 SER H 1 1 6 6764 1 1 66 SER HA H 16.151 3.848 7.159 1.00 . A A . 101 SER HA 1 1 6 6765 1 1 66 SER HB2 H 13.430 5.195 7.074 1.00 . A A . 101 SER HB2 1 1 6 6766 1 1 66 SER HB3 H 14.119 4.284 8.417 1.00 . A A . 101 SER HB3 1 1 6 6767 1 1 66 SER HG H 14.323 6.850 7.846 1.00 . A A . 101 SER HG 1 1 6 6768 1 1 66 SER N N 15.817 5.163 5.605 1.00 . A A . 101 SER N 1 1 6 6769 1 1 66 SER O O 14.412 3.019 4.715 1.00 . A A . 101 SER O 1 1 6 6770 1 1 66 SER OG O 14.930 6.147 8.106 1.00 . A A . 101 SER OG 1 1 6 6771 1 1 67 LYS C C 12.159 0.904 6.543 1.00 . A A . 102 LYS C 1 1 6 6772 1 1 67 LYS CA C 13.629 0.837 6.172 1.00 . A A . 102 LYS CA 1 1 6 6773 1 1 67 LYS CB C 14.308 -0.406 6.754 1.00 . A A . 102 LYS CB 1 1 6 6774 1 1 67 LYS CD C 16.506 -1.594 7.152 1.00 . A A . 102 LYS CD 1 1 6 6775 1 1 67 LYS CE C 18.005 -1.550 6.905 1.00 . A A . 102 LYS CE 1 1 6 6776 1 1 67 LYS CG C 15.804 -0.452 6.449 1.00 . A A . 102 LYS CG 1 1 6 6777 1 1 67 LYS H H 14.454 2.055 7.662 1.00 . A A . 102 LYS H 1 1 6 6778 1 1 67 LYS HA H 13.729 0.841 5.096 1.00 . A A . 102 LYS HA 1 1 6 6779 1 1 67 LYS HB2 H 14.173 -0.405 7.826 1.00 . A A . 102 LYS HB2 1 1 6 6780 1 1 67 LYS HB3 H 13.849 -1.290 6.337 1.00 . A A . 102 LYS HB3 1 1 6 6781 1 1 67 LYS HD2 H 16.319 -1.521 8.213 1.00 . A A . 102 LYS HD2 1 1 6 6782 1 1 67 LYS HD3 H 16.117 -2.531 6.781 1.00 . A A . 102 LYS HD3 1 1 6 6783 1 1 67 LYS HE2 H 18.187 -1.718 5.854 1.00 . A A . 102 LYS HE2 1 1 6 6784 1 1 67 LYS HE3 H 18.369 -0.570 7.178 1.00 . A A . 102 LYS HE3 1 1 6 6785 1 1 67 LYS HG2 H 15.935 -0.570 5.383 1.00 . A A . 102 LYS HG2 1 1 6 6786 1 1 67 LYS HG3 H 16.247 0.483 6.761 1.00 . A A . 102 LYS HG3 1 1 6 6787 1 1 67 LYS HZ1 H 18.559 -2.502 8.708 1.00 . A A . 102 LYS HZ1 1 1 6 6788 1 1 67 LYS HZ2 H 19.763 -2.412 7.566 1.00 . A A . 102 LYS HZ2 1 1 6 6789 1 1 67 LYS HZ3 H 18.566 -3.553 7.375 1.00 . A A . 102 LYS HZ3 1 1 6 6790 1 1 67 LYS N N 14.275 2.017 6.697 1.00 . A A . 102 LYS N 1 1 6 6791 1 1 67 LYS NZ N 18.743 -2.576 7.687 1.00 . A A . 102 LYS NZ 1 1 6 6792 1 1 67 LYS O O 11.812 1.004 7.722 1.00 . A A . 102 LYS O 1 1 6 6793 1 1 68 GLY C C 9.145 0.121 6.534 1.00 . A A . 103 GLY C 1 1 6 6794 1 1 68 GLY CA C 9.868 1.122 5.677 1.00 . A A . 103 GLY CA 1 1 6 6795 1 1 68 GLY H H 11.669 0.706 4.613 1.00 . A A . 103 GLY H 1 1 6 6796 1 1 68 GLY HA2 H 9.735 2.098 6.119 1.00 . A A . 103 GLY HA2 1 1 6 6797 1 1 68 GLY HA3 H 9.414 1.134 4.698 1.00 . A A . 103 GLY HA3 1 1 6 6798 1 1 68 GLY N N 11.306 0.880 5.511 1.00 . A A . 103 GLY N 1 1 6 6799 1 1 68 GLY O O 8.311 0.489 7.347 1.00 . A A . 103 GLY O 1 1 6 6800 1 1 69 ASN C C 9.824 -3.293 7.150 1.00 . A A . 104 ASN C 1 1 6 6801 1 1 69 ASN CA C 8.838 -2.175 7.114 1.00 . A A . 104 ASN CA 1 1 6 6802 1 1 69 ASN CB C 7.483 -2.639 6.550 1.00 . A A . 104 ASN CB 1 1 6 6803 1 1 69 ASN CG C 6.786 -3.652 7.450 1.00 . A A . 104 ASN CG 1 1 6 6804 1 1 69 ASN H H 10.055 -1.369 5.620 1.00 . A A . 104 ASN H 1 1 6 6805 1 1 69 ASN HA H 8.710 -1.798 8.119 1.00 . A A . 104 ASN HA 1 1 6 6806 1 1 69 ASN HB2 H 6.833 -1.784 6.436 1.00 . A A . 104 ASN HB2 1 1 6 6807 1 1 69 ASN HB3 H 7.644 -3.093 5.583 1.00 . A A . 104 ASN HB3 1 1 6 6808 1 1 69 ASN HD21 H 7.572 -5.153 6.443 1.00 . A A . 104 ASN HD21 1 1 6 6809 1 1 69 ASN HD22 H 6.551 -5.589 7.761 1.00 . A A . 104 ASN HD22 1 1 6 6810 1 1 69 ASN N N 9.421 -1.122 6.323 1.00 . A A . 104 ASN N 1 1 6 6811 1 1 69 ASN ND2 N 6.987 -4.916 7.196 1.00 . A A . 104 ASN ND2 1 1 6 6812 1 1 69 ASN O O 9.842 -4.173 6.279 1.00 . A A . 104 ASN O 1 1 6 6813 1 1 69 ASN OD1 O 6.041 -3.281 8.356 1.00 . A A . 104 ASN OD1 1 1 6 6814 1 1 70 TYR C C 11.252 -5.299 9.097 1.00 . A A . 105 TYR C 1 1 6 6815 1 1 70 TYR CA C 11.748 -4.151 8.242 1.00 . A A . 105 TYR CA 1 1 6 6816 1 1 70 TYR CB C 12.945 -3.432 8.873 1.00 . A A . 105 TYR CB 1 1 6 6817 1 1 70 TYR CD1 C 14.629 -4.599 7.431 1.00 . A A . 105 TYR CD1 1 1 6 6818 1 1 70 TYR CD2 C 15.191 -4.209 9.702 1.00 . A A . 105 TYR CD2 1 1 6 6819 1 1 70 TYR CE1 C 15.847 -5.185 7.220 1.00 . A A . 105 TYR CE1 1 1 6 6820 1 1 70 TYR CE2 C 16.426 -4.789 9.495 1.00 . A A . 105 TYR CE2 1 1 6 6821 1 1 70 TYR CG C 14.275 -4.102 8.671 1.00 . A A . 105 TYR CG 1 1 6 6822 1 1 70 TYR CZ C 16.745 -5.276 8.250 1.00 . A A . 105 TYR CZ 1 1 6 6823 1 1 70 TYR H H 10.607 -2.498 8.766 1.00 . A A . 105 TYR H 1 1 6 6824 1 1 70 TYR HA H 12.020 -4.517 7.264 1.00 . A A . 105 TYR HA 1 1 6 6825 1 1 70 TYR HB2 H 13.014 -2.439 8.453 1.00 . A A . 105 TYR HB2 1 1 6 6826 1 1 70 TYR HB3 H 12.769 -3.347 9.935 1.00 . A A . 105 TYR HB3 1 1 6 6827 1 1 70 TYR HD1 H 13.925 -4.528 6.616 1.00 . A A . 105 TYR HD1 1 1 6 6828 1 1 70 TYR HD2 H 14.931 -3.824 10.677 1.00 . A A . 105 TYR HD2 1 1 6 6829 1 1 70 TYR HE1 H 16.092 -5.564 6.240 1.00 . A A . 105 TYR HE1 1 1 6 6830 1 1 70 TYR HE2 H 17.132 -4.868 10.308 1.00 . A A . 105 TYR HE2 1 1 6 6831 1 1 70 TYR HH H 18.208 -6.388 8.783 1.00 . A A . 105 TYR HH 1 1 6 6832 1 1 70 TYR N N 10.689 -3.217 8.101 1.00 . A A . 105 TYR N 1 1 6 6833 1 1 70 TYR O O 11.377 -5.276 10.325 1.00 . A A . 105 TYR O 1 1 6 6834 1 1 70 TYR OH O 17.979 -5.834 8.025 1.00 . A A . 105 TYR OH 1 1 6 6835 1 1 71 ASP C C 11.106 -8.323 9.684 1.00 . A A . 106 ASP C 1 1 6 6836 1 1 71 ASP CA C 10.043 -7.420 9.094 1.00 . A A . 106 ASP CA 1 1 6 6837 1 1 71 ASP CB C 9.062 -8.198 8.165 1.00 . A A . 106 ASP CB 1 1 6 6838 1 1 71 ASP CG C 9.646 -8.637 6.825 1.00 . A A . 106 ASP CG 1 1 6 6839 1 1 71 ASP H H 10.544 -6.178 7.465 1.00 . A A . 106 ASP H 1 1 6 6840 1 1 71 ASP HA H 9.477 -7.023 9.924 1.00 . A A . 106 ASP HA 1 1 6 6841 1 1 71 ASP HB2 H 8.725 -9.085 8.680 1.00 . A A . 106 ASP HB2 1 1 6 6842 1 1 71 ASP HB3 H 8.204 -7.571 7.974 1.00 . A A . 106 ASP HB3 1 1 6 6843 1 1 71 ASP N N 10.622 -6.258 8.439 1.00 . A A . 106 ASP N 1 1 6 6844 1 1 71 ASP O O 11.669 -9.176 9.014 1.00 . A A . 106 ASP O 1 1 6 6845 1 1 71 ASP OD1 O 9.664 -7.816 5.876 1.00 . A A . 106 ASP OD1 1 1 6 6846 1 1 71 ASP OD2 O 10.069 -9.810 6.674 1.00 . A A . 106 ASP OD2 1 1 6 6847 1 1 72 GLU C C 11.621 -9.410 12.866 1.00 . A A . 107 GLU C 1 1 6 6848 1 1 72 GLU CA C 12.355 -8.830 11.678 1.00 . A A . 107 GLU CA 1 1 6 6849 1 1 72 GLU CB C 13.505 -7.933 12.164 1.00 . A A . 107 GLU CB 1 1 6 6850 1 1 72 GLU CD C 15.163 -8.357 10.312 1.00 . A A . 107 GLU CD 1 1 6 6851 1 1 72 GLU CG C 14.366 -7.328 11.065 1.00 . A A . 107 GLU CG 1 1 6 6852 1 1 72 GLU H H 10.964 -7.318 11.362 1.00 . A A . 107 GLU H 1 1 6 6853 1 1 72 GLU HA H 12.746 -9.626 11.063 1.00 . A A . 107 GLU HA 1 1 6 6854 1 1 72 GLU HB2 H 13.093 -7.127 12.750 1.00 . A A . 107 GLU HB2 1 1 6 6855 1 1 72 GLU HB3 H 14.146 -8.523 12.800 1.00 . A A . 107 GLU HB3 1 1 6 6856 1 1 72 GLU HG2 H 13.721 -6.820 10.363 1.00 . A A . 107 GLU HG2 1 1 6 6857 1 1 72 GLU HG3 H 15.046 -6.613 11.505 1.00 . A A . 107 GLU HG3 1 1 6 6858 1 1 72 GLU N N 11.410 -8.070 10.919 1.00 . A A . 107 GLU N 1 1 6 6859 1 1 72 GLU O O 11.506 -8.712 13.896 1.00 . A A . 107 GLU O 1 1 6 6860 1 1 72 GLU OXT O 11.108 -10.539 12.767 1.00 . A A . 107 GLU OXT 1 1 6 6861 1 1 72 GLU OE1 O 16.110 -8.934 10.888 1.00 . A A . 107 GLU OE1 1 1 6 6862 1 1 72 GLU OE2 O 14.872 -8.612 9.134 1.00 . A A . 107 GLU OE2 1 1 6 6863 2 2 1 ZN ZN ZN -6.797 0.964 -4.540 1.00 . B A . 201 ZN ZN 1 1 6 6864 3 2 1 ZN ZN ZN 10.762 0.855 -5.983 1.00 . C A . 202 ZN ZN 1 1 7 6865 1 1 1 ARG C C -23.498 -4.065 7.822 1.00 . A A . 36 ARG C 1 1 7 6866 1 1 1 ARG CA C -24.669 -4.087 8.783 1.00 . A A . 36 ARG CA 1 1 7 6867 1 1 1 ARG CB C -25.776 -4.999 8.180 1.00 . A A . 36 ARG CB 1 1 7 6868 1 1 1 ARG CD C -27.996 -3.812 8.349 1.00 . A A . 36 ARG CD 1 1 7 6869 1 1 1 ARG CG C -27.140 -4.959 8.867 1.00 . A A . 36 ARG CG 1 1 7 6870 1 1 1 ARG CZ C -28.588 -2.991 6.064 1.00 . A A . 36 ARG CZ 1 1 7 6871 1 1 1 ARG H1 H -25.910 -2.644 9.656 1.00 . A A . 36 ARG H1 1 1 7 6872 1 1 1 ARG H2 H -25.384 -2.267 8.084 1.00 . A A . 36 ARG H2 1 1 7 6873 1 1 1 ARG H3 H -24.332 -2.160 9.371 1.00 . A A . 36 ARG H3 1 1 7 6874 1 1 1 ARG HA H -24.342 -4.486 9.732 1.00 . A A . 36 ARG HA 1 1 7 6875 1 1 1 ARG HB2 H -25.930 -4.705 7.152 1.00 . A A . 36 ARG HB2 1 1 7 6876 1 1 1 ARG HB3 H -25.422 -6.019 8.190 1.00 . A A . 36 ARG HB3 1 1 7 6877 1 1 1 ARG HD2 H -28.907 -3.754 8.925 1.00 . A A . 36 ARG HD2 1 1 7 6878 1 1 1 ARG HD3 H -27.440 -2.893 8.456 1.00 . A A . 36 ARG HD3 1 1 7 6879 1 1 1 ARG HE H -28.417 -4.925 6.648 1.00 . A A . 36 ARG HE 1 1 7 6880 1 1 1 ARG HG2 H -27.662 -5.887 8.688 1.00 . A A . 36 ARG HG2 1 1 7 6881 1 1 1 ARG HG3 H -26.992 -4.828 9.928 1.00 . A A . 36 ARG HG3 1 1 7 6882 1 1 1 ARG HH11 H -28.052 -1.434 7.303 1.00 . A A . 36 ARG HH11 1 1 7 6883 1 1 1 ARG HH12 H -28.556 -0.972 5.758 1.00 . A A . 36 ARG HH12 1 1 7 6884 1 1 1 ARG HH21 H -29.129 -4.216 4.533 1.00 . A A . 36 ARG HH21 1 1 7 6885 1 1 1 ARG HH22 H -29.188 -2.559 4.168 1.00 . A A . 36 ARG HH22 1 1 7 6886 1 1 1 ARG N N -25.121 -2.715 8.983 1.00 . A A . 36 ARG N 1 1 7 6887 1 1 1 ARG NE N -28.340 -3.984 6.935 1.00 . A A . 36 ARG NE 1 1 7 6888 1 1 1 ARG NH1 N -28.390 -1.724 6.405 1.00 . A A . 36 ARG NH1 1 1 7 6889 1 1 1 ARG NH2 N -28.994 -3.274 4.845 1.00 . A A . 36 ARG NH2 1 1 7 6890 1 1 1 ARG O O -23.699 -3.829 6.635 1.00 . A A . 36 ARG O 1 1 7 6891 1 1 2 ALA C C -20.632 -2.959 6.946 1.00 . A A . 37 ALA C 1 1 7 6892 1 1 2 ALA CA C -21.016 -4.305 7.591 1.00 . A A . 37 ALA CA 1 1 7 6893 1 1 2 ALA CB C -21.048 -5.425 6.545 1.00 . A A . 37 ALA CB 1 1 7 6894 1 1 2 ALA H H -22.219 -4.341 9.336 1.00 . A A . 37 ALA H 1 1 7 6895 1 1 2 ALA HA H -20.241 -4.546 8.305 1.00 . A A . 37 ALA HA 1 1 7 6896 1 1 2 ALA HB1 H -20.078 -5.509 6.078 1.00 . A A . 37 ALA HB1 1 1 7 6897 1 1 2 ALA HB2 H -21.790 -5.194 5.795 1.00 . A A . 37 ALA HB2 1 1 7 6898 1 1 2 ALA HB3 H -21.299 -6.359 7.025 1.00 . A A . 37 ALA HB3 1 1 7 6899 1 1 2 ALA N N -22.281 -4.248 8.361 1.00 . A A . 37 ALA N 1 1 7 6900 1 1 2 ALA O O -21.479 -2.221 6.426 1.00 . A A . 37 ALA O 1 1 7 6901 1 1 3 GLN C C -18.535 -1.747 4.926 1.00 . A A . 38 GLN C 1 1 7 6902 1 1 3 GLN CA C -18.888 -1.412 6.352 1.00 . A A . 38 GLN CA 1 1 7 6903 1 1 3 GLN CB C -17.698 -0.794 7.083 1.00 . A A . 38 GLN CB 1 1 7 6904 1 1 3 GLN CD C -16.877 0.368 9.183 1.00 . A A . 38 GLN CD 1 1 7 6905 1 1 3 GLN CG C -18.048 -0.264 8.457 1.00 . A A . 38 GLN CG 1 1 7 6906 1 1 3 GLN H H -18.732 -3.181 7.498 1.00 . A A . 38 GLN H 1 1 7 6907 1 1 3 GLN HA H -19.710 -0.711 6.337 1.00 . A A . 38 GLN HA 1 1 7 6908 1 1 3 GLN HB2 H -16.929 -1.545 7.193 1.00 . A A . 38 GLN HB2 1 1 7 6909 1 1 3 GLN HB3 H -17.310 0.020 6.489 1.00 . A A . 38 GLN HB3 1 1 7 6910 1 1 3 GLN HE21 H -16.026 1.019 7.479 1.00 . A A . 38 GLN HE21 1 1 7 6911 1 1 3 GLN HE22 H -15.205 1.374 8.942 1.00 . A A . 38 GLN HE22 1 1 7 6912 1 1 3 GLN HG2 H -18.825 0.478 8.354 1.00 . A A . 38 GLN HG2 1 1 7 6913 1 1 3 GLN HG3 H -18.421 -1.083 9.054 1.00 . A A . 38 GLN HG3 1 1 7 6914 1 1 3 GLN N N -19.368 -2.615 7.010 1.00 . A A . 38 GLN N 1 1 7 6915 1 1 3 GLN NE2 N -15.960 0.971 8.464 1.00 . A A . 38 GLN NE2 1 1 7 6916 1 1 3 GLN O O -17.435 -2.210 4.632 1.00 . A A . 38 GLN O 1 1 7 6917 1 1 3 GLN OE1 O -16.815 0.327 10.410 1.00 . A A . 38 GLN OE1 1 1 7 6918 1 1 4 VAL C C -18.954 -0.715 1.802 1.00 . A A . 39 VAL C 1 1 7 6919 1 1 4 VAL CA C -19.317 -1.916 2.660 1.00 . A A . 39 VAL CA 1 1 7 6920 1 1 4 VAL CB C -20.579 -2.618 2.067 1.00 . A A . 39 VAL CB 1 1 7 6921 1 1 4 VAL CG1 C -20.926 -3.873 2.855 1.00 . A A . 39 VAL CG1 1 1 7 6922 1 1 4 VAL CG2 C -21.776 -1.672 2.013 1.00 . A A . 39 VAL CG2 1 1 7 6923 1 1 4 VAL H H -20.341 -1.178 4.358 1.00 . A A . 39 VAL H 1 1 7 6924 1 1 4 VAL HA H -18.499 -2.618 2.622 1.00 . A A . 39 VAL HA 1 1 7 6925 1 1 4 VAL HB H -20.337 -2.922 1.059 1.00 . A A . 39 VAL HB 1 1 7 6926 1 1 4 VAL HG11 H -20.102 -4.569 2.809 1.00 . A A . 39 VAL HG11 1 1 7 6927 1 1 4 VAL HG12 H -21.810 -4.330 2.437 1.00 . A A . 39 VAL HG12 1 1 7 6928 1 1 4 VAL HG13 H -21.114 -3.606 3.885 1.00 . A A . 39 VAL HG13 1 1 7 6929 1 1 4 VAL HG21 H -21.537 -0.829 1.381 1.00 . A A . 39 VAL HG21 1 1 7 6930 1 1 4 VAL HG22 H -21.998 -1.321 3.008 1.00 . A A . 39 VAL HG22 1 1 7 6931 1 1 4 VAL HG23 H -22.631 -2.196 1.611 1.00 . A A . 39 VAL HG23 1 1 7 6932 1 1 4 VAL N N -19.491 -1.559 4.051 1.00 . A A . 39 VAL N 1 1 7 6933 1 1 4 VAL O O -18.642 -0.863 0.629 1.00 . A A . 39 VAL O 1 1 7 6934 1 1 5 LYS C C -17.420 2.294 2.057 1.00 . A A . 40 LYS C 1 1 7 6935 1 1 5 LYS CA C -18.713 1.643 1.582 1.00 . A A . 40 LYS CA 1 1 7 6936 1 1 5 LYS CB C -19.889 2.634 1.636 1.00 . A A . 40 LYS CB 1 1 7 6937 1 1 5 LYS CD C -20.242 2.894 -0.831 1.00 . A A . 40 LYS CD 1 1 7 6938 1 1 5 LYS CE C -20.109 3.792 -2.048 1.00 . A A . 40 LYS CE 1 1 7 6939 1 1 5 LYS CG C -19.910 3.616 0.472 1.00 . A A . 40 LYS CG 1 1 7 6940 1 1 5 LYS H H -19.183 0.549 3.330 1.00 . A A . 40 LYS H 1 1 7 6941 1 1 5 LYS HA H -18.570 1.313 0.564 1.00 . A A . 40 LYS HA 1 1 7 6942 1 1 5 LYS HB2 H -20.815 2.077 1.626 1.00 . A A . 40 LYS HB2 1 1 7 6943 1 1 5 LYS HB3 H -19.830 3.198 2.555 1.00 . A A . 40 LYS HB3 1 1 7 6944 1 1 5 LYS HD2 H -19.572 2.057 -0.957 1.00 . A A . 40 LYS HD2 1 1 7 6945 1 1 5 LYS HD3 H -21.257 2.531 -0.775 1.00 . A A . 40 LYS HD3 1 1 7 6946 1 1 5 LYS HE2 H -19.076 4.090 -2.149 1.00 . A A . 40 LYS HE2 1 1 7 6947 1 1 5 LYS HE3 H -20.395 3.211 -2.912 1.00 . A A . 40 LYS HE3 1 1 7 6948 1 1 5 LYS HG2 H -20.660 4.370 0.658 1.00 . A A . 40 LYS HG2 1 1 7 6949 1 1 5 LYS HG3 H -18.937 4.078 0.382 1.00 . A A . 40 LYS HG3 1 1 7 6950 1 1 5 LYS HZ1 H -20.630 5.644 -1.221 1.00 . A A . 40 LYS HZ1 1 1 7 6951 1 1 5 LYS HZ2 H -21.945 4.769 -1.806 1.00 . A A . 40 LYS HZ2 1 1 7 6952 1 1 5 LYS HZ3 H -20.899 5.517 -2.882 1.00 . A A . 40 LYS HZ3 1 1 7 6953 1 1 5 LYS N N -18.988 0.468 2.371 1.00 . A A . 40 LYS N 1 1 7 6954 1 1 5 LYS NZ N -20.948 5.006 -1.978 1.00 . A A . 40 LYS NZ 1 1 7 6955 1 1 5 LYS O O -17.392 3.462 2.471 1.00 . A A . 40 LYS O 1 1 7 6956 1 1 6 GLU C C -14.354 2.582 1.245 1.00 . A A . 41 GLU C 1 1 7 6957 1 1 6 GLU CA C -15.057 1.982 2.434 1.00 . A A . 41 GLU CA 1 1 7 6958 1 1 6 GLU CB C -14.265 0.779 2.896 1.00 . A A . 41 GLU CB 1 1 7 6959 1 1 6 GLU CD C -14.732 0.788 5.362 1.00 . A A . 41 GLU CD 1 1 7 6960 1 1 6 GLU CG C -14.875 0.049 4.060 1.00 . A A . 41 GLU CG 1 1 7 6961 1 1 6 GLU H H -16.461 0.624 1.663 1.00 . A A . 41 GLU H 1 1 7 6962 1 1 6 GLU HA H -15.147 2.689 3.244 1.00 . A A . 41 GLU HA 1 1 7 6963 1 1 6 GLU HB2 H -14.176 0.088 2.070 1.00 . A A . 41 GLU HB2 1 1 7 6964 1 1 6 GLU HB3 H -13.276 1.106 3.181 1.00 . A A . 41 GLU HB3 1 1 7 6965 1 1 6 GLU HG2 H -15.926 -0.102 3.864 1.00 . A A . 41 GLU HG2 1 1 7 6966 1 1 6 GLU HG3 H -14.384 -0.908 4.142 1.00 . A A . 41 GLU HG3 1 1 7 6967 1 1 6 GLU N N -16.371 1.536 2.015 1.00 . A A . 41 GLU N 1 1 7 6968 1 1 6 GLU O O -14.600 2.172 0.134 1.00 . A A . 41 GLU O 1 1 7 6969 1 1 6 GLU OE1 O -13.727 0.569 6.063 1.00 . A A . 41 GLU OE1 1 1 7 6970 1 1 6 GLU OE2 O -15.609 1.579 5.721 1.00 . A A . 41 GLU OE2 1 1 7 6971 1 1 7 THR C C -11.286 3.818 0.480 1.00 . A A . 42 THR C 1 1 7 6972 1 1 7 THR CA C -12.791 4.045 0.297 1.00 . A A . 42 THR CA 1 1 7 6973 1 1 7 THR CB C -13.087 5.526 0.058 1.00 . A A . 42 THR CB 1 1 7 6974 1 1 7 THR CG2 C -13.309 5.750 -1.434 1.00 . A A . 42 THR CG2 1 1 7 6975 1 1 7 THR H H -13.276 3.828 2.350 1.00 . A A . 42 THR H 1 1 7 6976 1 1 7 THR HA H -13.162 3.464 -0.539 1.00 . A A . 42 THR HA 1 1 7 6977 1 1 7 THR HB H -12.226 6.097 0.368 1.00 . A A . 42 THR HB 1 1 7 6978 1 1 7 THR HG1 H -14.307 5.413 1.583 1.00 . A A . 42 THR HG1 1 1 7 6979 1 1 7 THR HG21 H -13.533 6.791 -1.616 1.00 . A A . 42 THR HG21 1 1 7 6980 1 1 7 THR HG22 H -14.141 5.137 -1.757 1.00 . A A . 42 THR HG22 1 1 7 6981 1 1 7 THR HG23 H -12.423 5.465 -1.981 1.00 . A A . 42 THR HG23 1 1 7 6982 1 1 7 THR N N -13.487 3.521 1.441 1.00 . A A . 42 THR N 1 1 7 6983 1 1 7 THR O O -10.764 3.923 1.591 1.00 . A A . 42 THR O 1 1 7 6984 1 1 7 THR OG1 O -14.310 5.880 0.739 1.00 . A A . 42 THR OG1 1 1 7 6985 1 1 8 CYS C C -8.295 4.300 -0.716 1.00 . A A . 43 CYS C 1 1 7 6986 1 1 8 CYS CA C -9.236 3.115 -0.596 1.00 . A A . 43 CYS CA 1 1 7 6987 1 1 8 CYS CB C -9.050 2.121 -1.735 1.00 . A A . 43 CYS CB 1 1 7 6988 1 1 8 CYS H H -11.079 3.568 -1.467 1.00 . A A . 43 CYS H 1 1 7 6989 1 1 8 CYS HA H -9.053 2.587 0.329 1.00 . A A . 43 CYS HA 1 1 7 6990 1 1 8 CYS HB2 H -9.251 1.141 -1.325 1.00 . A A . 43 CYS HB2 1 1 7 6991 1 1 8 CYS HB3 H -9.786 2.306 -2.501 1.00 . A A . 43 CYS HB3 1 1 7 6992 1 1 8 CYS N N -10.622 3.508 -0.599 1.00 . A A . 43 CYS N 1 1 7 6993 1 1 8 CYS O O -8.643 5.326 -1.284 1.00 . A A . 43 CYS O 1 1 7 6994 1 1 8 CYS SG S -7.424 1.996 -2.481 1.00 . A A . 43 CYS SG 1 1 7 6995 1 1 9 ALA C C -5.041 4.928 -1.278 1.00 . A A . 44 ALA C 1 1 7 6996 1 1 9 ALA CA C -6.077 5.167 -0.190 1.00 . A A . 44 ALA CA 1 1 7 6997 1 1 9 ALA CB C -5.372 5.244 1.136 1.00 . A A . 44 ALA CB 1 1 7 6998 1 1 9 ALA H H -6.940 3.301 0.330 1.00 . A A . 44 ALA H 1 1 7 6999 1 1 9 ALA HA H -6.552 6.121 -0.353 1.00 . A A . 44 ALA HA 1 1 7 7000 1 1 9 ALA HB1 H -4.784 4.349 1.288 1.00 . A A . 44 ALA HB1 1 1 7 7001 1 1 9 ALA HB2 H -6.111 5.352 1.914 1.00 . A A . 44 ALA HB2 1 1 7 7002 1 1 9 ALA HB3 H -4.727 6.108 1.106 1.00 . A A . 44 ALA HB3 1 1 7 7003 1 1 9 ALA N N -7.102 4.138 -0.156 1.00 . A A . 44 ALA N 1 1 7 7004 1 1 9 ALA O O -4.463 5.868 -1.804 1.00 . A A . 44 ALA O 1 1 7 7005 1 1 10 ALA C C -4.183 3.503 -4.008 1.00 . A A . 45 ALA C 1 1 7 7006 1 1 10 ALA CA C -3.751 3.352 -2.564 1.00 . A A . 45 ALA CA 1 1 7 7007 1 1 10 ALA CB C -3.215 1.964 -2.295 1.00 . A A . 45 ALA CB 1 1 7 7008 1 1 10 ALA H H -5.387 2.944 -1.310 1.00 . A A . 45 ALA H 1 1 7 7009 1 1 10 ALA HA H -2.954 4.056 -2.378 1.00 . A A . 45 ALA HA 1 1 7 7010 1 1 10 ALA HB1 H -2.317 1.808 -2.874 1.00 . A A . 45 ALA HB1 1 1 7 7011 1 1 10 ALA HB2 H -3.956 1.229 -2.575 1.00 . A A . 45 ALA HB2 1 1 7 7012 1 1 10 ALA HB3 H -2.986 1.874 -1.241 1.00 . A A . 45 ALA HB3 1 1 7 7013 1 1 10 ALA N N -4.820 3.671 -1.641 1.00 . A A . 45 ALA N 1 1 7 7014 1 1 10 ALA O O -3.366 3.722 -4.881 1.00 . A A . 45 ALA O 1 1 7 7015 1 1 11 CYS C C -7.302 4.326 -5.612 1.00 . A A . 46 CYS C 1 1 7 7016 1 1 11 CYS CA C -5.989 3.523 -5.586 1.00 . A A . 46 CYS CA 1 1 7 7017 1 1 11 CYS CB C -6.061 2.144 -6.307 1.00 . A A . 46 CYS CB 1 1 7 7018 1 1 11 CYS H H -6.067 3.191 -3.497 1.00 . A A . 46 CYS H 1 1 7 7019 1 1 11 CYS HA H -5.259 4.132 -6.101 1.00 . A A . 46 CYS HA 1 1 7 7020 1 1 11 CYS HB2 H -5.521 1.993 -7.226 1.00 . A A . 46 CYS HB2 1 1 7 7021 1 1 11 CYS HB3 H -5.317 1.661 -5.684 1.00 . A A . 46 CYS HB3 1 1 7 7022 1 1 11 CYS N N -5.465 3.380 -4.248 1.00 . A A . 46 CYS N 1 1 7 7023 1 1 11 CYS O O -7.919 4.492 -6.651 1.00 . A A . 46 CYS O 1 1 7 7024 1 1 11 CYS SG S -7.530 1.096 -6.037 1.00 . A A . 46 CYS SG 1 1 7 7025 1 1 12 GLN C C -10.175 5.173 -4.872 1.00 . A A . 47 GLN C 1 1 7 7026 1 1 12 GLN CA C -8.894 5.681 -4.201 1.00 . A A . 47 GLN CA 1 1 7 7027 1 1 12 GLN CB C -8.635 7.138 -4.507 1.00 . A A . 47 GLN CB 1 1 7 7028 1 1 12 GLN CD C -7.169 9.143 -3.993 1.00 . A A . 47 GLN CD 1 1 7 7029 1 1 12 GLN CG C -7.576 7.735 -3.606 1.00 . A A . 47 GLN CG 1 1 7 7030 1 1 12 GLN H H -7.101 4.705 -3.649 1.00 . A A . 47 GLN H 1 1 7 7031 1 1 12 GLN HA H -9.040 5.602 -3.134 1.00 . A A . 47 GLN HA 1 1 7 7032 1 1 12 GLN HB2 H -8.352 7.256 -5.541 1.00 . A A . 47 GLN HB2 1 1 7 7033 1 1 12 GLN HB3 H -9.570 7.642 -4.309 1.00 . A A . 47 GLN HB3 1 1 7 7034 1 1 12 GLN HE21 H -6.711 9.544 -2.121 1.00 . A A . 47 GLN HE21 1 1 7 7035 1 1 12 GLN HE22 H -6.504 10.840 -3.236 1.00 . A A . 47 GLN HE22 1 1 7 7036 1 1 12 GLN HG2 H -7.977 7.761 -2.602 1.00 . A A . 47 GLN HG2 1 1 7 7037 1 1 12 GLN HG3 H -6.724 7.074 -3.628 1.00 . A A . 47 GLN HG3 1 1 7 7038 1 1 12 GLN N N -7.685 4.845 -4.423 1.00 . A A . 47 GLN N 1 1 7 7039 1 1 12 GLN NE2 N -6.748 9.911 -3.031 1.00 . A A . 47 GLN NE2 1 1 7 7040 1 1 12 GLN O O -10.934 5.930 -5.467 1.00 . A A . 47 GLN O 1 1 7 7041 1 1 12 GLN OE1 O -7.215 9.533 -5.167 1.00 . A A . 47 GLN OE1 1 1 7 7042 1 1 13 LYS C C -12.318 2.700 -4.093 1.00 . A A . 48 LYS C 1 1 7 7043 1 1 13 LYS CA C -11.562 3.226 -5.280 1.00 . A A . 48 LYS CA 1 1 7 7044 1 1 13 LYS CB C -11.129 2.058 -6.178 1.00 . A A . 48 LYS CB 1 1 7 7045 1 1 13 LYS CD C -10.939 3.356 -8.338 1.00 . A A . 48 LYS CD 1 1 7 7046 1 1 13 LYS CE C -12.069 2.641 -9.073 1.00 . A A . 48 LYS CE 1 1 7 7047 1 1 13 LYS CG C -10.245 2.447 -7.353 1.00 . A A . 48 LYS CG 1 1 7 7048 1 1 13 LYS H H -9.762 3.380 -4.227 1.00 . A A . 48 LYS H 1 1 7 7049 1 1 13 LYS HA H -12.163 3.926 -5.840 1.00 . A A . 48 LYS HA 1 1 7 7050 1 1 13 LYS HB2 H -10.575 1.345 -5.587 1.00 . A A . 48 LYS HB2 1 1 7 7051 1 1 13 LYS HB3 H -12.012 1.574 -6.566 1.00 . A A . 48 LYS HB3 1 1 7 7052 1 1 13 LYS HD2 H -11.337 4.179 -7.762 1.00 . A A . 48 LYS HD2 1 1 7 7053 1 1 13 LYS HD3 H -10.216 3.728 -9.049 1.00 . A A . 48 LYS HD3 1 1 7 7054 1 1 13 LYS HE2 H -12.809 2.315 -8.358 1.00 . A A . 48 LYS HE2 1 1 7 7055 1 1 13 LYS HE3 H -12.520 3.342 -9.760 1.00 . A A . 48 LYS HE3 1 1 7 7056 1 1 13 LYS HG2 H -9.372 2.955 -6.973 1.00 . A A . 48 LYS HG2 1 1 7 7057 1 1 13 LYS HG3 H -9.941 1.541 -7.851 1.00 . A A . 48 LYS HG3 1 1 7 7058 1 1 13 LYS HZ1 H -10.857 1.753 -10.517 1.00 . A A . 48 LYS HZ1 1 1 7 7059 1 1 13 LYS HZ2 H -12.356 1.056 -10.414 1.00 . A A . 48 LYS HZ2 1 1 7 7060 1 1 13 LYS HZ3 H -11.194 0.716 -9.232 1.00 . A A . 48 LYS HZ3 1 1 7 7061 1 1 13 LYS N N -10.400 3.902 -4.744 1.00 . A A . 48 LYS N 1 1 7 7062 1 1 13 LYS NZ N -11.589 1.462 -9.840 1.00 . A A . 48 LYS NZ 1 1 7 7063 1 1 13 LYS O O -11.710 2.486 -3.047 1.00 . A A . 48 LYS O 1 1 7 7064 1 1 14 THR C C -14.066 0.579 -2.868 1.00 . A A . 49 THR C 1 1 7 7065 1 1 14 THR CA C -14.383 2.062 -3.104 1.00 . A A . 49 THR CA 1 1 7 7066 1 1 14 THR CB C -15.862 2.238 -3.376 1.00 . A A . 49 THR CB 1 1 7 7067 1 1 14 THR CG2 C -16.635 2.166 -2.082 1.00 . A A . 49 THR CG2 1 1 7 7068 1 1 14 THR H H -14.082 2.795 -5.025 1.00 . A A . 49 THR H 1 1 7 7069 1 1 14 THR HA H -14.127 2.616 -2.220 1.00 . A A . 49 THR HA 1 1 7 7070 1 1 14 THR HB H -16.156 1.426 -4.013 1.00 . A A . 49 THR HB 1 1 7 7071 1 1 14 THR HG1 H -16.257 3.398 -4.911 1.00 . A A . 49 THR HG1 1 1 7 7072 1 1 14 THR HG21 H -16.579 1.166 -1.676 1.00 . A A . 49 THR HG21 1 1 7 7073 1 1 14 THR HG22 H -17.663 2.458 -2.232 1.00 . A A . 49 THR HG22 1 1 7 7074 1 1 14 THR HG23 H -16.135 2.845 -1.399 1.00 . A A . 49 THR HG23 1 1 7 7075 1 1 14 THR N N -13.605 2.561 -4.201 1.00 . A A . 49 THR N 1 1 7 7076 1 1 14 THR O O -14.090 -0.231 -3.808 1.00 . A A . 49 THR O 1 1 7 7077 1 1 14 THR OG1 O -16.087 3.533 -3.971 1.00 . A A . 49 THR OG1 1 1 7 7078 1 1 15 VAL C C -14.568 -1.768 -0.699 1.00 . A A . 50 VAL C 1 1 7 7079 1 1 15 VAL CA C -13.372 -1.103 -1.294 1.00 . A A . 50 VAL CA 1 1 7 7080 1 1 15 VAL CB C -12.244 -1.162 -0.227 1.00 . A A . 50 VAL CB 1 1 7 7081 1 1 15 VAL CG1 C -11.307 -2.289 -0.552 1.00 . A A . 50 VAL CG1 1 1 7 7082 1 1 15 VAL CG2 C -11.508 0.149 -0.124 1.00 . A A . 50 VAL CG2 1 1 7 7083 1 1 15 VAL H H -13.834 0.920 -0.935 1.00 . A A . 50 VAL H 1 1 7 7084 1 1 15 VAL HA H -13.021 -1.593 -2.193 1.00 . A A . 50 VAL HA 1 1 7 7085 1 1 15 VAL HB H -12.660 -1.432 0.738 1.00 . A A . 50 VAL HB 1 1 7 7086 1 1 15 VAL HG11 H -10.935 -2.164 -1.558 1.00 . A A . 50 VAL HG11 1 1 7 7087 1 1 15 VAL HG12 H -11.817 -3.237 -0.462 1.00 . A A . 50 VAL HG12 1 1 7 7088 1 1 15 VAL HG13 H -10.472 -2.255 0.131 1.00 . A A . 50 VAL HG13 1 1 7 7089 1 1 15 VAL HG21 H -12.191 0.915 0.209 1.00 . A A . 50 VAL HG21 1 1 7 7090 1 1 15 VAL HG22 H -11.170 0.404 -1.119 1.00 . A A . 50 VAL HG22 1 1 7 7091 1 1 15 VAL HG23 H -10.668 0.073 0.551 1.00 . A A . 50 VAL HG23 1 1 7 7092 1 1 15 VAL N N -13.748 0.241 -1.642 1.00 . A A . 50 VAL N 1 1 7 7093 1 1 15 VAL O O -15.261 -1.176 0.135 1.00 . A A . 50 VAL O 1 1 7 7094 1 1 16 TYR C C -15.308 -4.810 0.249 1.00 . A A . 51 TYR C 1 1 7 7095 1 1 16 TYR CA C -15.920 -3.698 -0.585 1.00 . A A . 51 TYR CA 1 1 7 7096 1 1 16 TYR CB C -16.773 -4.223 -1.745 1.00 . A A . 51 TYR CB 1 1 7 7097 1 1 16 TYR CD1 C -17.998 -2.113 -2.268 1.00 . A A . 51 TYR CD1 1 1 7 7098 1 1 16 TYR CD2 C -16.791 -3.133 -4.024 1.00 . A A . 51 TYR CD2 1 1 7 7099 1 1 16 TYR CE1 C -18.400 -1.103 -3.113 1.00 . A A . 51 TYR CE1 1 1 7 7100 1 1 16 TYR CE2 C -17.183 -2.129 -4.887 1.00 . A A . 51 TYR CE2 1 1 7 7101 1 1 16 TYR CG C -17.197 -3.134 -2.701 1.00 . A A . 51 TYR CG 1 1 7 7102 1 1 16 TYR CZ C -17.990 -1.115 -4.423 1.00 . A A . 51 TYR CZ 1 1 7 7103 1 1 16 TYR H H -14.265 -3.368 -1.797 1.00 . A A . 51 TYR H 1 1 7 7104 1 1 16 TYR HA H -16.503 -3.046 0.049 1.00 . A A . 51 TYR HA 1 1 7 7105 1 1 16 TYR HB2 H -16.210 -4.943 -2.311 1.00 . A A . 51 TYR HB2 1 1 7 7106 1 1 16 TYR HB3 H -17.668 -4.683 -1.353 1.00 . A A . 51 TYR HB3 1 1 7 7107 1 1 16 TYR HD1 H -18.285 -2.138 -1.230 1.00 . A A . 51 TYR HD1 1 1 7 7108 1 1 16 TYR HD2 H -16.157 -3.932 -4.376 1.00 . A A . 51 TYR HD2 1 1 7 7109 1 1 16 TYR HE1 H -19.032 -0.307 -2.747 1.00 . A A . 51 TYR HE1 1 1 7 7110 1 1 16 TYR HE2 H -16.856 -2.142 -5.916 1.00 . A A . 51 TYR HE2 1 1 7 7111 1 1 16 TYR HH H -18.353 0.725 -4.785 1.00 . A A . 51 TYR HH 1 1 7 7112 1 1 16 TYR N N -14.828 -2.951 -1.113 1.00 . A A . 51 TYR N 1 1 7 7113 1 1 16 TYR O O -14.154 -5.132 0.006 1.00 . A A . 51 TYR O 1 1 7 7114 1 1 16 TYR OH O -18.388 -0.104 -5.273 1.00 . A A . 51 TYR OH 1 1 7 7115 1 1 17 PRO C C -14.584 -7.486 1.558 1.00 . A A . 52 PRO C 1 1 7 7116 1 1 17 PRO CA C -15.458 -6.396 2.194 1.00 . A A . 52 PRO CA 1 1 7 7117 1 1 17 PRO CB C -16.688 -7.018 2.819 1.00 . A A . 52 PRO CB 1 1 7 7118 1 1 17 PRO CD C -17.460 -5.168 1.509 1.00 . A A . 52 PRO CD 1 1 7 7119 1 1 17 PRO CG C -17.711 -5.938 2.778 1.00 . A A . 52 PRO CG 1 1 7 7120 1 1 17 PRO HA H -14.890 -5.907 2.966 1.00 . A A . 52 PRO HA 1 1 7 7121 1 1 17 PRO HB2 H -16.950 -7.866 2.212 1.00 . A A . 52 PRO HB2 1 1 7 7122 1 1 17 PRO HB3 H -16.471 -7.336 3.828 1.00 . A A . 52 PRO HB3 1 1 7 7123 1 1 17 PRO HD2 H -18.079 -5.538 0.707 1.00 . A A . 52 PRO HD2 1 1 7 7124 1 1 17 PRO HD3 H -17.640 -4.115 1.658 1.00 . A A . 52 PRO HD3 1 1 7 7125 1 1 17 PRO HG2 H -18.700 -6.374 2.762 1.00 . A A . 52 PRO HG2 1 1 7 7126 1 1 17 PRO HG3 H -17.600 -5.292 3.637 1.00 . A A . 52 PRO HG3 1 1 7 7127 1 1 17 PRO N N -16.031 -5.411 1.230 1.00 . A A . 52 PRO N 1 1 7 7128 1 1 17 PRO O O -13.553 -7.865 2.118 1.00 . A A . 52 PRO O 1 1 7 7129 1 1 18 MET C C -12.794 -8.490 -0.711 1.00 . A A . 53 MET C 1 1 7 7130 1 1 18 MET CA C -14.234 -8.936 -0.376 1.00 . A A . 53 MET CA 1 1 7 7131 1 1 18 MET CB C -14.997 -9.223 -1.662 1.00 . A A . 53 MET CB 1 1 7 7132 1 1 18 MET CE C -15.092 -8.842 -4.824 1.00 . A A . 53 MET CE 1 1 7 7133 1 1 18 MET CG C -14.386 -10.287 -2.539 1.00 . A A . 53 MET CG 1 1 7 7134 1 1 18 MET H H -15.781 -7.542 -0.014 1.00 . A A . 53 MET H 1 1 7 7135 1 1 18 MET HA H -14.189 -9.850 0.194 1.00 . A A . 53 MET HA 1 1 7 7136 1 1 18 MET HB2 H -15.985 -9.554 -1.381 1.00 . A A . 53 MET HB2 1 1 7 7137 1 1 18 MET HB3 H -15.076 -8.306 -2.225 1.00 . A A . 53 MET HB3 1 1 7 7138 1 1 18 MET HE1 H -15.569 -8.108 -4.192 1.00 . A A . 53 MET HE1 1 1 7 7139 1 1 18 MET HE2 H -15.554 -8.826 -5.800 1.00 . A A . 53 MET HE2 1 1 7 7140 1 1 18 MET HE3 H -14.042 -8.607 -4.921 1.00 . A A . 53 MET HE3 1 1 7 7141 1 1 18 MET HG2 H -13.354 -10.022 -2.709 1.00 . A A . 53 MET HG2 1 1 7 7142 1 1 18 MET HG3 H -14.419 -11.222 -2.000 1.00 . A A . 53 MET HG3 1 1 7 7143 1 1 18 MET N N -14.960 -7.920 0.374 1.00 . A A . 53 MET N 1 1 7 7144 1 1 18 MET O O -11.877 -9.306 -0.773 1.00 . A A . 53 MET O 1 1 7 7145 1 1 18 MET SD S -15.270 -10.484 -4.109 1.00 . A A . 53 MET SD 1 1 7 7146 1 1 19 GLU C C -10.706 -5.845 -0.181 1.00 . A A . 54 GLU C 1 1 7 7147 1 1 19 GLU CA C -11.317 -6.661 -1.308 1.00 . A A . 54 GLU CA 1 1 7 7148 1 1 19 GLU CB C -11.528 -5.745 -2.496 1.00 . A A . 54 GLU CB 1 1 7 7149 1 1 19 GLU CD C -12.501 -5.451 -4.780 1.00 . A A . 54 GLU CD 1 1 7 7150 1 1 19 GLU CG C -12.290 -6.386 -3.627 1.00 . A A . 54 GLU CG 1 1 7 7151 1 1 19 GLU H H -13.347 -6.572 -0.782 1.00 . A A . 54 GLU H 1 1 7 7152 1 1 19 GLU HA H -10.656 -7.463 -1.602 1.00 . A A . 54 GLU HA 1 1 7 7153 1 1 19 GLU HB2 H -12.076 -4.878 -2.161 1.00 . A A . 54 GLU HB2 1 1 7 7154 1 1 19 GLU HB3 H -10.571 -5.414 -2.868 1.00 . A A . 54 GLU HB3 1 1 7 7155 1 1 19 GLU HG2 H -11.744 -7.257 -3.954 1.00 . A A . 54 GLU HG2 1 1 7 7156 1 1 19 GLU HG3 H -13.254 -6.698 -3.252 1.00 . A A . 54 GLU HG3 1 1 7 7157 1 1 19 GLU N N -12.606 -7.203 -0.909 1.00 . A A . 54 GLU N 1 1 7 7158 1 1 19 GLU O O -9.513 -5.554 -0.190 1.00 . A A . 54 GLU O 1 1 7 7159 1 1 19 GLU OE1 O -13.423 -4.617 -4.713 1.00 . A A . 54 GLU OE1 1 1 7 7160 1 1 19 GLU OE2 O -11.753 -5.542 -5.783 1.00 . A A . 54 GLU OE2 1 1 7 7161 1 1 20 ARG C C -10.217 -5.217 2.830 1.00 . A A . 55 ARG C 1 1 7 7162 1 1 20 ARG CA C -11.185 -4.598 1.860 1.00 . A A . 55 ARG CA 1 1 7 7163 1 1 20 ARG CB C -12.430 -4.061 2.551 1.00 . A A . 55 ARG CB 1 1 7 7164 1 1 20 ARG CD C -13.506 -3.198 4.604 1.00 . A A . 55 ARG CD 1 1 7 7165 1 1 20 ARG CG C -12.206 -3.322 3.847 1.00 . A A . 55 ARG CG 1 1 7 7166 1 1 20 ARG CZ C -13.669 -2.526 7.001 1.00 . A A . 55 ARG CZ 1 1 7 7167 1 1 20 ARG H H -12.464 -5.811 0.724 1.00 . A A . 55 ARG H 1 1 7 7168 1 1 20 ARG HA H -10.681 -3.757 1.413 1.00 . A A . 55 ARG HA 1 1 7 7169 1 1 20 ARG HB2 H -12.863 -3.331 1.880 1.00 . A A . 55 ARG HB2 1 1 7 7170 1 1 20 ARG HB3 H -13.148 -4.843 2.682 1.00 . A A . 55 ARG HB3 1 1 7 7171 1 1 20 ARG HD2 H -14.274 -2.874 3.917 1.00 . A A . 55 ARG HD2 1 1 7 7172 1 1 20 ARG HD3 H -13.779 -4.171 4.980 1.00 . A A . 55 ARG HD3 1 1 7 7173 1 1 20 ARG HE H -13.249 -1.314 5.479 1.00 . A A . 55 ARG HE 1 1 7 7174 1 1 20 ARG HG2 H -11.486 -3.856 4.451 1.00 . A A . 55 ARG HG2 1 1 7 7175 1 1 20 ARG HG3 H -11.833 -2.332 3.630 1.00 . A A . 55 ARG HG3 1 1 7 7176 1 1 20 ARG HH11 H -13.669 -4.569 6.819 1.00 . A A . 55 ARG HH11 1 1 7 7177 1 1 20 ARG HH12 H -13.959 -3.988 8.397 1.00 . A A . 55 ARG HH12 1 1 7 7178 1 1 20 ARG HH21 H -13.677 -0.575 7.515 1.00 . A A . 55 ARG HH21 1 1 7 7179 1 1 20 ARG HH22 H -13.988 -1.653 8.824 1.00 . A A . 55 ARG HH22 1 1 7 7180 1 1 20 ARG N N -11.545 -5.474 0.768 1.00 . A A . 55 ARG N 1 1 7 7181 1 1 20 ARG NE N -13.420 -2.256 5.723 1.00 . A A . 55 ARG NE 1 1 7 7182 1 1 20 ARG NH1 N -13.775 -3.781 7.431 1.00 . A A . 55 ARG NH1 1 1 7 7183 1 1 20 ARG NH2 N -13.781 -1.521 7.850 1.00 . A A . 55 ARG NH2 1 1 7 7184 1 1 20 ARG O O -10.538 -6.140 3.585 1.00 . A A . 55 ARG O 1 1 7 7185 1 1 21 LEU C C -7.567 -3.777 4.333 1.00 . A A . 56 LEU C 1 1 7 7186 1 1 21 LEU CA C -7.974 -5.052 3.612 1.00 . A A . 56 LEU CA 1 1 7 7187 1 1 21 LEU CB C -6.836 -5.638 2.735 1.00 . A A . 56 LEU CB 1 1 7 7188 1 1 21 LEU CD1 C -4.777 -6.971 2.536 1.00 . A A . 56 LEU CD1 1 1 7 7189 1 1 21 LEU CD2 C -4.606 -4.734 3.449 1.00 . A A . 56 LEU CD2 1 1 7 7190 1 1 21 LEU CG C -5.486 -5.967 3.382 1.00 . A A . 56 LEU CG 1 1 7 7191 1 1 21 LEU H H -8.852 -4.070 2.049 1.00 . A A . 56 LEU H 1 1 7 7192 1 1 21 LEU HA H -8.305 -5.795 4.320 1.00 . A A . 56 LEU HA 1 1 7 7193 1 1 21 LEU HB2 H -7.203 -6.548 2.285 1.00 . A A . 56 LEU HB2 1 1 7 7194 1 1 21 LEU HB3 H -6.658 -4.934 1.935 1.00 . A A . 56 LEU HB3 1 1 7 7195 1 1 21 LEU HD11 H -5.406 -7.833 2.376 1.00 . A A . 56 LEU HD11 1 1 7 7196 1 1 21 LEU HD12 H -3.878 -7.259 3.054 1.00 . A A . 56 LEU HD12 1 1 7 7197 1 1 21 LEU HD13 H -4.522 -6.507 1.594 1.00 . A A . 56 LEU HD13 1 1 7 7198 1 1 21 LEU HD21 H -3.675 -4.989 3.932 1.00 . A A . 56 LEU HD21 1 1 7 7199 1 1 21 LEU HD22 H -5.111 -3.966 4.016 1.00 . A A . 56 LEU HD22 1 1 7 7200 1 1 21 LEU HD23 H -4.408 -4.376 2.450 1.00 . A A . 56 LEU HD23 1 1 7 7201 1 1 21 LEU HG H -5.613 -6.354 4.381 1.00 . A A . 56 LEU HG 1 1 7 7202 1 1 21 LEU N N -9.048 -4.722 2.759 1.00 . A A . 56 LEU N 1 1 7 7203 1 1 21 LEU O O -7.845 -2.677 3.855 1.00 . A A . 56 LEU O 1 1 7 7204 1 1 22 VAL C C -5.012 -2.869 6.510 1.00 . A A . 57 VAL C 1 1 7 7205 1 1 22 VAL CA C -6.500 -2.750 6.177 1.00 . A A . 57 VAL CA 1 1 7 7206 1 1 22 VAL CB C -7.379 -2.396 7.426 1.00 . A A . 57 VAL CB 1 1 7 7207 1 1 22 VAL CG1 C -7.580 -3.583 8.354 1.00 . A A . 57 VAL CG1 1 1 7 7208 1 1 22 VAL CG2 C -6.809 -1.194 8.180 1.00 . A A . 57 VAL CG2 1 1 7 7209 1 1 22 VAL H H -6.822 -4.795 5.857 1.00 . A A . 57 VAL H 1 1 7 7210 1 1 22 VAL HA H -6.581 -1.937 5.467 1.00 . A A . 57 VAL HA 1 1 7 7211 1 1 22 VAL HB H -8.357 -2.122 7.059 1.00 . A A . 57 VAL HB 1 1 7 7212 1 1 22 VAL HG11 H -8.179 -3.274 9.198 1.00 . A A . 57 VAL HG11 1 1 7 7213 1 1 22 VAL HG12 H -6.623 -3.948 8.693 1.00 . A A . 57 VAL HG12 1 1 7 7214 1 1 22 VAL HG13 H -8.103 -4.357 7.810 1.00 . A A . 57 VAL HG13 1 1 7 7215 1 1 22 VAL HG21 H -5.796 -1.408 8.488 1.00 . A A . 57 VAL HG21 1 1 7 7216 1 1 22 VAL HG22 H -7.408 -0.952 9.047 1.00 . A A . 57 VAL HG22 1 1 7 7217 1 1 22 VAL HG23 H -6.799 -0.338 7.519 1.00 . A A . 57 VAL HG23 1 1 7 7218 1 1 22 VAL N N -6.969 -3.904 5.474 1.00 . A A . 57 VAL N 1 1 7 7219 1 1 22 VAL O O -4.606 -3.632 7.396 1.00 . A A . 57 VAL O 1 1 7 7220 1 1 23 ALA C C -2.421 -0.783 6.522 1.00 . A A . 58 ALA C 1 1 7 7221 1 1 23 ALA CA C -2.766 -2.137 6.007 1.00 . A A . 58 ALA CA 1 1 7 7222 1 1 23 ALA CB C -1.978 -2.407 4.705 1.00 . A A . 58 ALA CB 1 1 7 7223 1 1 23 ALA H H -4.591 -1.546 5.093 1.00 . A A . 58 ALA H 1 1 7 7224 1 1 23 ALA HA H -2.528 -2.890 6.742 1.00 . A A . 58 ALA HA 1 1 7 7225 1 1 23 ALA HB1 H -2.319 -3.301 4.203 1.00 . A A . 58 ALA HB1 1 1 7 7226 1 1 23 ALA HB2 H -0.927 -2.533 4.924 1.00 . A A . 58 ALA HB2 1 1 7 7227 1 1 23 ALA HB3 H -2.059 -1.562 4.034 1.00 . A A . 58 ALA HB3 1 1 7 7228 1 1 23 ALA N N -4.201 -2.144 5.772 1.00 . A A . 58 ALA N 1 1 7 7229 1 1 23 ALA O O -2.929 0.202 5.986 1.00 . A A . 58 ALA O 1 1 7 7230 1 1 24 ASP C C -2.352 1.467 8.500 1.00 . A A . 59 ASP C 1 1 7 7231 1 1 24 ASP CA C -1.168 0.599 8.131 1.00 . A A . 59 ASP CA 1 1 7 7232 1 1 24 ASP CB C -0.209 1.365 7.233 1.00 . A A . 59 ASP CB 1 1 7 7233 1 1 24 ASP CG C 0.885 0.522 6.570 1.00 . A A . 59 ASP CG 1 1 7 7234 1 1 24 ASP H H -1.189 -1.531 7.919 1.00 . A A . 59 ASP H 1 1 7 7235 1 1 24 ASP HA H -0.654 0.358 9.050 1.00 . A A . 59 ASP HA 1 1 7 7236 1 1 24 ASP HB2 H -0.636 2.195 6.698 1.00 . A A . 59 ASP HB2 1 1 7 7237 1 1 24 ASP HB3 H 0.373 1.833 8.020 1.00 . A A . 59 ASP HB3 1 1 7 7238 1 1 24 ASP N N -1.567 -0.705 7.553 1.00 . A A . 59 ASP N 1 1 7 7239 1 1 24 ASP O O -2.315 2.712 8.379 1.00 . A A . 59 ASP O 1 1 7 7240 1 1 24 ASP OD1 O 0.600 -0.327 5.711 1.00 . A A . 59 ASP OD1 1 1 7 7241 1 1 24 ASP OD2 O 2.073 0.723 6.935 1.00 . A A . 59 ASP OD2 1 1 7 7242 1 1 25 LYS C C -5.457 2.012 8.101 1.00 . A A . 60 LYS C 1 1 7 7243 1 1 25 LYS CA C -4.684 1.395 9.300 1.00 . A A . 60 LYS CA 1 1 7 7244 1 1 25 LYS CB C -4.478 2.388 10.443 1.00 . A A . 60 LYS CB 1 1 7 7245 1 1 25 LYS CD C -5.463 3.853 12.228 1.00 . A A . 60 LYS CD 1 1 7 7246 1 1 25 LYS CE C -4.757 5.122 11.750 1.00 . A A . 60 LYS CE 1 1 7 7247 1 1 25 LYS CG C -5.754 2.904 11.076 1.00 . A A . 60 LYS CG 1 1 7 7248 1 1 25 LYS H H -3.331 -0.180 8.895 1.00 . A A . 60 LYS H 1 1 7 7249 1 1 25 LYS HA H -5.290 0.582 9.663 1.00 . A A . 60 LYS HA 1 1 7 7250 1 1 25 LYS HB2 H -3.869 1.931 11.209 1.00 . A A . 60 LYS HB2 1 1 7 7251 1 1 25 LYS HB3 H -3.947 3.218 10.011 1.00 . A A . 60 LYS HB3 1 1 7 7252 1 1 25 LYS HD2 H -6.398 4.130 12.691 1.00 . A A . 60 LYS HD2 1 1 7 7253 1 1 25 LYS HD3 H -4.837 3.347 12.949 1.00 . A A . 60 LYS HD3 1 1 7 7254 1 1 25 LYS HE2 H -3.854 4.848 11.224 1.00 . A A . 60 LYS HE2 1 1 7 7255 1 1 25 LYS HE3 H -5.414 5.655 11.079 1.00 . A A . 60 LYS HE3 1 1 7 7256 1 1 25 LYS HG2 H -6.312 3.433 10.316 1.00 . A A . 60 LYS HG2 1 1 7 7257 1 1 25 LYS HG3 H -6.324 2.050 11.410 1.00 . A A . 60 LYS HG3 1 1 7 7258 1 1 25 LYS HZ1 H -5.218 6.247 13.446 1.00 . A A . 60 LYS HZ1 1 1 7 7259 1 1 25 LYS HZ2 H -3.990 6.901 12.514 1.00 . A A . 60 LYS HZ2 1 1 7 7260 1 1 25 LYS HZ3 H -3.675 5.552 13.472 1.00 . A A . 60 LYS HZ3 1 1 7 7261 1 1 25 LYS N N -3.422 0.795 8.893 1.00 . A A . 60 LYS N 1 1 7 7262 1 1 25 LYS NZ N -4.387 6.007 12.868 1.00 . A A . 60 LYS NZ 1 1 7 7263 1 1 25 LYS O O -6.587 2.504 8.248 1.00 . A A . 60 LYS O 1 1 7 7264 1 1 26 LEU C C -6.370 1.323 5.156 1.00 . A A . 61 LEU C 1 1 7 7265 1 1 26 LEU CA C -5.526 2.429 5.726 1.00 . A A . 61 LEU CA 1 1 7 7266 1 1 26 LEU CB C -4.518 2.859 4.700 1.00 . A A . 61 LEU CB 1 1 7 7267 1 1 26 LEU CD1 C -2.567 4.192 4.008 1.00 . A A . 61 LEU CD1 1 1 7 7268 1 1 26 LEU CD2 C -4.420 5.302 5.203 1.00 . A A . 61 LEU CD2 1 1 7 7269 1 1 26 LEU CG C -3.614 4.021 5.071 1.00 . A A . 61 LEU CG 1 1 7 7270 1 1 26 LEU H H -3.957 1.593 6.841 1.00 . A A . 61 LEU H 1 1 7 7271 1 1 26 LEU HA H -6.157 3.263 5.973 1.00 . A A . 61 LEU HA 1 1 7 7272 1 1 26 LEU HB2 H -3.908 1.994 4.504 1.00 . A A . 61 LEU HB2 1 1 7 7273 1 1 26 LEU HB3 H -5.063 3.116 3.805 1.00 . A A . 61 LEU HB3 1 1 7 7274 1 1 26 LEU HD11 H -1.898 4.994 4.278 1.00 . A A . 61 LEU HD11 1 1 7 7275 1 1 26 LEU HD12 H -3.057 4.431 3.076 1.00 . A A . 61 LEU HD12 1 1 7 7276 1 1 26 LEU HD13 H -2.014 3.268 3.901 1.00 . A A . 61 LEU HD13 1 1 7 7277 1 1 26 LEU HD21 H -4.896 5.522 4.258 1.00 . A A . 61 LEU HD21 1 1 7 7278 1 1 26 LEU HD22 H -3.760 6.114 5.468 1.00 . A A . 61 LEU HD22 1 1 7 7279 1 1 26 LEU HD23 H -5.172 5.182 5.967 1.00 . A A . 61 LEU HD23 1 1 7 7280 1 1 26 LEU HG H -3.127 3.822 6.014 1.00 . A A . 61 LEU HG 1 1 7 7281 1 1 26 LEU N N -4.869 1.964 6.928 1.00 . A A . 61 LEU N 1 1 7 7282 1 1 26 LEU O O -5.951 0.162 5.135 1.00 . A A . 61 LEU O 1 1 7 7283 1 1 27 ILE C C -8.296 0.631 2.665 1.00 . A A . 62 ILE C 1 1 7 7284 1 1 27 ILE CA C -8.429 0.666 4.177 1.00 . A A . 62 ILE CA 1 1 7 7285 1 1 27 ILE CB C -9.902 0.989 4.520 1.00 . A A . 62 ILE CB 1 1 7 7286 1 1 27 ILE CD1 C -9.812 0.261 6.983 1.00 . A A . 62 ILE CD1 1 1 7 7287 1 1 27 ILE CG1 C -10.085 1.373 5.994 1.00 . A A . 62 ILE CG1 1 1 7 7288 1 1 27 ILE CG2 C -10.742 -0.213 4.228 1.00 . A A . 62 ILE CG2 1 1 7 7289 1 1 27 ILE H H -7.810 2.599 4.664 1.00 . A A . 62 ILE H 1 1 7 7290 1 1 27 ILE HA H -8.158 -0.291 4.601 1.00 . A A . 62 ILE HA 1 1 7 7291 1 1 27 ILE HB H -10.236 1.803 3.895 1.00 . A A . 62 ILE HB 1 1 7 7292 1 1 27 ILE HD11 H -9.981 0.618 7.988 1.00 . A A . 62 ILE HD11 1 1 7 7293 1 1 27 ILE HD12 H -8.786 -0.053 6.876 1.00 . A A . 62 ILE HD12 1 1 7 7294 1 1 27 ILE HD13 H -10.466 -0.573 6.776 1.00 . A A . 62 ILE HD13 1 1 7 7295 1 1 27 ILE HG12 H -9.405 2.178 6.213 1.00 . A A . 62 ILE HG12 1 1 7 7296 1 1 27 ILE HG13 H -11.100 1.714 6.134 1.00 . A A . 62 ILE HG13 1 1 7 7297 1 1 27 ILE HG21 H -11.771 0.010 4.467 1.00 . A A . 62 ILE HG21 1 1 7 7298 1 1 27 ILE HG22 H -10.372 -0.990 4.883 1.00 . A A . 62 ILE HG22 1 1 7 7299 1 1 27 ILE HG23 H -10.629 -0.498 3.194 1.00 . A A . 62 ILE HG23 1 1 7 7300 1 1 27 ILE N N -7.535 1.659 4.691 1.00 . A A . 62 ILE N 1 1 7 7301 1 1 27 ILE O O -8.523 1.643 1.996 1.00 . A A . 62 ILE O 1 1 7 7302 1 1 28 PHE C C -7.757 -2.076 0.217 1.00 . A A . 63 PHE C 1 1 7 7303 1 1 28 PHE CA C -7.740 -0.663 0.723 1.00 . A A . 63 PHE CA 1 1 7 7304 1 1 28 PHE CB C -6.614 0.166 0.118 1.00 . A A . 63 PHE CB 1 1 7 7305 1 1 28 PHE CD1 C -4.727 -1.073 1.273 1.00 . A A . 63 PHE CD1 1 1 7 7306 1 1 28 PHE CD2 C -4.631 1.275 1.017 1.00 . A A . 63 PHE CD2 1 1 7 7307 1 1 28 PHE CE1 C -3.508 -1.040 1.920 1.00 . A A . 63 PHE CE1 1 1 7 7308 1 1 28 PHE CE2 C -3.439 1.306 1.645 1.00 . A A . 63 PHE CE2 1 1 7 7309 1 1 28 PHE CG C -5.296 0.106 0.814 1.00 . A A . 63 PHE CG 1 1 7 7310 1 1 28 PHE CZ C -2.860 0.165 2.103 1.00 . A A . 63 PHE CZ 1 1 7 7311 1 1 28 PHE H H -7.717 -1.265 2.729 1.00 . A A . 63 PHE H 1 1 7 7312 1 1 28 PHE HA H -8.656 -0.236 0.342 1.00 . A A . 63 PHE HA 1 1 7 7313 1 1 28 PHE HB2 H -6.475 0.002 -0.938 1.00 . A A . 63 PHE HB2 1 1 7 7314 1 1 28 PHE HB3 H -6.935 1.187 0.276 1.00 . A A . 63 PHE HB3 1 1 7 7315 1 1 28 PHE HD1 H -5.225 -2.022 1.128 1.00 . A A . 63 PHE HD1 1 1 7 7316 1 1 28 PHE HD2 H -5.069 2.195 0.660 1.00 . A A . 63 PHE HD2 1 1 7 7317 1 1 28 PHE HE1 H -3.063 -1.958 2.273 1.00 . A A . 63 PHE HE1 1 1 7 7318 1 1 28 PHE HE2 H -2.947 2.253 1.778 1.00 . A A . 63 PHE HE2 1 1 7 7319 1 1 28 PHE HZ H -1.894 0.251 2.588 1.00 . A A . 63 PHE HZ 1 1 7 7320 1 1 28 PHE N N -7.896 -0.493 2.139 1.00 . A A . 63 PHE N 1 1 7 7321 1 1 28 PHE O O -7.704 -3.020 0.976 1.00 . A A . 63 PHE O 1 1 7 7322 1 1 29 HIS C C -6.514 -4.047 -1.639 1.00 . A A . 64 HIS C 1 1 7 7323 1 1 29 HIS CA C -7.884 -3.413 -1.827 1.00 . A A . 64 HIS CA 1 1 7 7324 1 1 29 HIS CB C -8.079 -3.084 -3.324 1.00 . A A . 64 HIS CB 1 1 7 7325 1 1 29 HIS CD2 C -10.491 -2.516 -3.977 1.00 . A A . 64 HIS CD2 1 1 7 7326 1 1 29 HIS CE1 C -10.347 -0.353 -3.798 1.00 . A A . 64 HIS CE1 1 1 7 7327 1 1 29 HIS CG C -9.237 -2.194 -3.624 1.00 . A A . 64 HIS CG 1 1 7 7328 1 1 29 HIS H H -8.112 -1.370 -1.593 1.00 . A A . 64 HIS H 1 1 7 7329 1 1 29 HIS HA H -8.672 -4.073 -1.497 1.00 . A A . 64 HIS HA 1 1 7 7330 1 1 29 HIS HB2 H -7.219 -2.544 -3.682 1.00 . A A . 64 HIS HB2 1 1 7 7331 1 1 29 HIS HB3 H -8.189 -3.994 -3.892 1.00 . A A . 64 HIS HB3 1 1 7 7332 1 1 29 HIS HD2 H -10.878 -3.511 -4.109 1.00 . A A . 64 HIS HD2 1 1 7 7333 1 1 29 HIS HE1 H -10.617 0.691 -3.774 1.00 . A A . 64 HIS HE1 1 1 7 7334 1 1 29 HIS HE2 H -12.147 -1.256 -4.314 1.00 . A A . 64 HIS HE2 1 1 7 7335 1 1 29 HIS N N -7.914 -2.175 -1.078 1.00 . A A . 64 HIS N 1 1 7 7336 1 1 29 HIS ND1 N -9.148 -0.813 -3.510 1.00 . A A . 64 HIS ND1 1 1 7 7337 1 1 29 HIS NE2 N -11.193 -1.341 -4.087 1.00 . A A . 64 HIS NE2 1 1 7 7338 1 1 29 HIS O O -5.475 -3.393 -1.766 1.00 . A A . 64 HIS O 1 1 7 7339 1 1 30 ASN C C -4.313 -6.061 -2.172 1.00 . A A . 65 ASN C 1 1 7 7340 1 1 30 ASN CA C -5.339 -6.094 -1.041 1.00 . A A . 65 ASN CA 1 1 7 7341 1 1 30 ASN CB C -5.716 -7.555 -0.683 1.00 . A A . 65 ASN CB 1 1 7 7342 1 1 30 ASN CG C -6.364 -8.341 -1.821 1.00 . A A . 65 ASN CG 1 1 7 7343 1 1 30 ASN H H -7.417 -5.744 -1.284 1.00 . A A . 65 ASN H 1 1 7 7344 1 1 30 ASN HA H -4.886 -5.645 -0.172 1.00 . A A . 65 ASN HA 1 1 7 7345 1 1 30 ASN HB2 H -4.824 -8.084 -0.380 1.00 . A A . 65 ASN HB2 1 1 7 7346 1 1 30 ASN HB3 H -6.403 -7.536 0.151 1.00 . A A . 65 ASN HB3 1 1 7 7347 1 1 30 ASN HD21 H -4.621 -9.111 -2.340 1.00 . A A . 65 ASN HD21 1 1 7 7348 1 1 30 ASN HD22 H -5.962 -9.622 -3.283 1.00 . A A . 65 ASN HD22 1 1 7 7349 1 1 30 ASN N N -6.536 -5.314 -1.338 1.00 . A A . 65 ASN N 1 1 7 7350 1 1 30 ASN ND2 N -5.580 -9.090 -2.554 1.00 . A A . 65 ASN ND2 1 1 7 7351 1 1 30 ASN O O -3.113 -6.073 -1.926 1.00 . A A . 65 ASN O 1 1 7 7352 1 1 30 ASN OD1 O -7.583 -8.290 -2.016 1.00 . A A . 65 ASN OD1 1 1 7 7353 1 1 31 SER C C -3.440 -4.717 -5.015 1.00 . A A . 66 SER C 1 1 7 7354 1 1 31 SER CA C -3.982 -6.105 -4.560 1.00 . A A . 66 SER CA 1 1 7 7355 1 1 31 SER CB C -4.770 -6.775 -5.651 1.00 . A A . 66 SER CB 1 1 7 7356 1 1 31 SER H H -5.758 -6.175 -3.523 1.00 . A A . 66 SER H 1 1 7 7357 1 1 31 SER HA H -3.124 -6.734 -4.389 1.00 . A A . 66 SER HA 1 1 7 7358 1 1 31 SER HB2 H -4.275 -6.557 -6.583 1.00 . A A . 66 SER HB2 1 1 7 7359 1 1 31 SER HB3 H -4.772 -7.842 -5.486 1.00 . A A . 66 SER HB3 1 1 7 7360 1 1 31 SER HG H -6.678 -7.032 -5.928 1.00 . A A . 66 SER HG 1 1 7 7361 1 1 31 SER N N -4.789 -6.120 -3.376 1.00 . A A . 66 SER N 1 1 7 7362 1 1 31 SER O O -2.530 -4.663 -5.847 1.00 . A A . 66 SER O 1 1 7 7363 1 1 31 SER OG O -6.117 -6.295 -5.653 1.00 . A A . 66 SER OG 1 1 7 7364 1 1 32 CYS C C -2.475 -1.548 -4.672 1.00 . A A . 67 CYS C 1 1 7 7365 1 1 32 CYS CA C -3.685 -2.326 -5.139 1.00 . A A . 67 CYS CA 1 1 7 7366 1 1 32 CYS CB C -4.916 -1.422 -5.170 1.00 . A A . 67 CYS CB 1 1 7 7367 1 1 32 CYS H H -4.426 -3.644 -3.609 1.00 . A A . 67 CYS H 1 1 7 7368 1 1 32 CYS HA H -3.480 -2.594 -6.164 1.00 . A A . 67 CYS HA 1 1 7 7369 1 1 32 CYS HB2 H -4.603 -0.466 -5.561 1.00 . A A . 67 CYS HB2 1 1 7 7370 1 1 32 CYS HB3 H -5.697 -1.852 -5.779 1.00 . A A . 67 CYS HB3 1 1 7 7371 1 1 32 CYS N N -3.943 -3.608 -4.465 1.00 . A A . 67 CYS N 1 1 7 7372 1 1 32 CYS O O -1.962 -0.712 -5.421 1.00 . A A . 67 CYS O 1 1 7 7373 1 1 32 CYS SG S -5.605 -0.991 -3.582 1.00 . A A . 67 CYS SG 1 1 7 7374 1 1 33 PHE C C 0.420 -1.501 -3.470 1.00 . A A . 68 PHE C 1 1 7 7375 1 1 33 PHE CA C -0.914 -0.962 -3.009 1.00 . A A . 68 PHE CA 1 1 7 7376 1 1 33 PHE CB C -0.945 -0.681 -1.502 1.00 . A A . 68 PHE CB 1 1 7 7377 1 1 33 PHE CD1 C -2.169 -2.665 -0.535 1.00 . A A . 68 PHE CD1 1 1 7 7378 1 1 33 PHE CD2 C -0.017 -2.099 0.307 1.00 . A A . 68 PHE CD2 1 1 7 7379 1 1 33 PHE CE1 C -2.245 -3.709 0.366 1.00 . A A . 68 PHE CE1 1 1 7 7380 1 1 33 PHE CE2 C -0.091 -3.128 1.202 1.00 . A A . 68 PHE CE2 1 1 7 7381 1 1 33 PHE CG C -1.047 -1.848 -0.569 1.00 . A A . 68 PHE CG 1 1 7 7382 1 1 33 PHE CZ C -1.198 -3.931 1.233 1.00 . A A . 68 PHE CZ 1 1 7 7383 1 1 33 PHE H H -2.402 -2.472 -2.915 1.00 . A A . 68 PHE H 1 1 7 7384 1 1 33 PHE HA H -1.036 -0.021 -3.528 1.00 . A A . 68 PHE HA 1 1 7 7385 1 1 33 PHE HB2 H 0.055 -0.341 -1.283 1.00 . A A . 68 PHE HB2 1 1 7 7386 1 1 33 PHE HB3 H -1.681 0.066 -1.242 1.00 . A A . 68 PHE HB3 1 1 7 7387 1 1 33 PHE HD1 H -2.978 -2.472 -1.224 1.00 . A A . 68 PHE HD1 1 1 7 7388 1 1 33 PHE HD2 H 0.856 -1.464 0.278 1.00 . A A . 68 PHE HD2 1 1 7 7389 1 1 33 PHE HE1 H -3.121 -4.342 0.411 1.00 . A A . 68 PHE HE1 1 1 7 7390 1 1 33 PHE HE2 H 0.718 -3.312 1.893 1.00 . A A . 68 PHE HE2 1 1 7 7391 1 1 33 PHE HZ H -1.228 -4.738 1.946 1.00 . A A . 68 PHE HZ 1 1 7 7392 1 1 33 PHE N N -2.014 -1.768 -3.475 1.00 . A A . 68 PHE N 1 1 7 7393 1 1 33 PHE O O 0.995 -2.407 -2.871 1.00 . A A . 68 PHE O 1 1 7 7394 1 1 34 CYS C C 3.110 -0.212 -4.839 1.00 . A A . 69 CYS C 1 1 7 7395 1 1 34 CYS CA C 2.126 -1.318 -5.123 1.00 . A A . 69 CYS CA 1 1 7 7396 1 1 34 CYS CB C 1.965 -1.494 -6.636 1.00 . A A . 69 CYS CB 1 1 7 7397 1 1 34 CYS H H 0.347 -0.261 -4.976 1.00 . A A . 69 CYS H 1 1 7 7398 1 1 34 CYS HA H 2.479 -2.242 -4.691 1.00 . A A . 69 CYS HA 1 1 7 7399 1 1 34 CYS HB2 H 1.776 -0.548 -7.121 1.00 . A A . 69 CYS HB2 1 1 7 7400 1 1 34 CYS HB3 H 2.901 -1.874 -7.015 1.00 . A A . 69 CYS HB3 1 1 7 7401 1 1 34 CYS HG H -0.471 -2.170 -6.672 1.00 . A A . 69 CYS HG 1 1 7 7402 1 1 34 CYS N N 0.879 -0.958 -4.544 1.00 . A A . 69 CYS N 1 1 7 7403 1 1 34 CYS O O 2.708 0.855 -4.351 1.00 . A A . 69 CYS O 1 1 7 7404 1 1 34 CYS SG S 0.678 -2.671 -7.108 1.00 . A A . 69 CYS SG 1 1 7 7405 1 1 35 CYS C C 5.072 1.766 -5.756 1.00 . A A . 70 CYS C 1 1 7 7406 1 1 35 CYS CA C 5.393 0.549 -4.923 1.00 . A A . 70 CYS CA 1 1 7 7407 1 1 35 CYS CB C 6.790 -0.010 -5.221 1.00 . A A . 70 CYS CB 1 1 7 7408 1 1 35 CYS H H 4.619 -1.351 -5.438 1.00 . A A . 70 CYS H 1 1 7 7409 1 1 35 CYS HA H 5.359 0.850 -3.887 1.00 . A A . 70 CYS HA 1 1 7 7410 1 1 35 CYS HB2 H 7.002 -0.653 -4.382 1.00 . A A . 70 CYS HB2 1 1 7 7411 1 1 35 CYS HB3 H 6.794 -0.619 -6.111 1.00 . A A . 70 CYS HB3 1 1 7 7412 1 1 35 CYS N N 4.380 -0.460 -5.105 1.00 . A A . 70 CYS N 1 1 7 7413 1 1 35 CYS O O 4.610 1.685 -6.891 1.00 . A A . 70 CYS O 1 1 7 7414 1 1 35 CYS SG S 8.156 1.202 -5.268 1.00 . A A . 70 CYS SG 1 1 7 7415 1 1 36 LYS C C 5.930 4.503 -6.776 1.00 . A A . 71 LYS C 1 1 7 7416 1 1 36 LYS CA C 4.929 4.143 -5.705 1.00 . A A . 71 LYS CA 1 1 7 7417 1 1 36 LYS CB C 4.906 5.208 -4.616 1.00 . A A . 71 LYS CB 1 1 7 7418 1 1 36 LYS CD C 2.809 6.599 -5.211 1.00 . A A . 71 LYS CD 1 1 7 7419 1 1 36 LYS CE C 2.415 6.119 -6.579 1.00 . A A . 71 LYS CE 1 1 7 7420 1 1 36 LYS CG C 4.331 6.579 -5.006 1.00 . A A . 71 LYS CG 1 1 7 7421 1 1 36 LYS H H 5.545 2.814 -4.199 1.00 . A A . 71 LYS H 1 1 7 7422 1 1 36 LYS HA H 3.953 4.086 -6.142 1.00 . A A . 71 LYS HA 1 1 7 7423 1 1 36 LYS HB2 H 4.387 4.846 -3.742 1.00 . A A . 71 LYS HB2 1 1 7 7424 1 1 36 LYS HB3 H 5.939 5.351 -4.350 1.00 . A A . 71 LYS HB3 1 1 7 7425 1 1 36 LYS HD2 H 2.349 5.956 -4.475 1.00 . A A . 71 LYS HD2 1 1 7 7426 1 1 36 LYS HD3 H 2.449 7.607 -5.071 1.00 . A A . 71 LYS HD3 1 1 7 7427 1 1 36 LYS HE2 H 3.077 6.619 -7.265 1.00 . A A . 71 LYS HE2 1 1 7 7428 1 1 36 LYS HE3 H 2.563 5.056 -6.660 1.00 . A A . 71 LYS HE3 1 1 7 7429 1 1 36 LYS HG2 H 4.576 7.332 -4.279 1.00 . A A . 71 LYS HG2 1 1 7 7430 1 1 36 LYS HG3 H 4.794 6.851 -5.942 1.00 . A A . 71 LYS HG3 1 1 7 7431 1 1 36 LYS HZ1 H 0.826 7.434 -6.808 1.00 . A A . 71 LYS HZ1 1 1 7 7432 1 1 36 LYS HZ2 H 0.357 5.930 -6.233 1.00 . A A . 71 LYS HZ2 1 1 7 7433 1 1 36 LYS HZ3 H 0.781 6.122 -7.856 1.00 . A A . 71 LYS HZ3 1 1 7 7434 1 1 36 LYS N N 5.238 2.878 -5.131 1.00 . A A . 71 LYS N 1 1 7 7435 1 1 36 LYS NZ N 1.007 6.413 -6.884 1.00 . A A . 71 LYS NZ 1 1 7 7436 1 1 36 LYS O O 5.604 5.195 -7.717 1.00 . A A . 71 LYS O 1 1 7 7437 1 1 37 HIS C C 8.285 3.315 -8.734 1.00 . A A . 72 HIS C 1 1 7 7438 1 1 37 HIS CA C 8.169 4.340 -7.582 1.00 . A A . 72 HIS CA 1 1 7 7439 1 1 37 HIS CB C 9.478 4.509 -6.822 1.00 . A A . 72 HIS CB 1 1 7 7440 1 1 37 HIS CD2 C 11.385 5.064 -8.470 1.00 . A A . 72 HIS CD2 1 1 7 7441 1 1 37 HIS CE1 C 11.651 7.150 -7.903 1.00 . A A . 72 HIS CE1 1 1 7 7442 1 1 37 HIS CG C 10.495 5.371 -7.509 1.00 . A A . 72 HIS CG 1 1 7 7443 1 1 37 HIS H H 7.296 3.330 -5.945 1.00 . A A . 72 HIS H 1 1 7 7444 1 1 37 HIS HA H 7.890 5.296 -7.999 1.00 . A A . 72 HIS HA 1 1 7 7445 1 1 37 HIS HB2 H 9.245 4.979 -5.879 1.00 . A A . 72 HIS HB2 1 1 7 7446 1 1 37 HIS HB3 H 9.915 3.538 -6.642 1.00 . A A . 72 HIS HB3 1 1 7 7447 1 1 37 HIS HD2 H 11.504 4.107 -8.956 1.00 . A A . 72 HIS HD2 1 1 7 7448 1 1 37 HIS HE1 H 12.057 8.150 -7.840 1.00 . A A . 72 HIS HE1 1 1 7 7449 1 1 37 HIS HE2 H 12.654 6.354 -9.518 1.00 . A A . 72 HIS HE2 1 1 7 7450 1 1 37 HIS N N 7.125 3.976 -6.662 1.00 . A A . 72 HIS N 1 1 7 7451 1 1 37 HIS ND1 N 10.657 6.692 -7.151 1.00 . A A . 72 HIS ND1 1 1 7 7452 1 1 37 HIS NE2 N 12.113 6.199 -8.714 1.00 . A A . 72 HIS NE2 1 1 7 7453 1 1 37 HIS O O 8.765 3.638 -9.815 1.00 . A A . 72 HIS O 1 1 7 7454 1 1 38 CYS C C 6.574 0.260 -9.276 1.00 . A A . 73 CYS C 1 1 7 7455 1 1 38 CYS CA C 7.813 1.079 -9.517 1.00 . A A . 73 CYS CA 1 1 7 7456 1 1 38 CYS CB C 9.058 0.202 -9.433 1.00 . A A . 73 CYS CB 1 1 7 7457 1 1 38 CYS H H 7.465 1.816 -7.640 1.00 . A A . 73 CYS H 1 1 7 7458 1 1 38 CYS HA H 7.781 1.583 -10.471 1.00 . A A . 73 CYS HA 1 1 7 7459 1 1 38 CYS HB2 H 9.227 -0.330 -10.346 1.00 . A A . 73 CYS HB2 1 1 7 7460 1 1 38 CYS HB3 H 9.849 0.919 -9.349 1.00 . A A . 73 CYS HB3 1 1 7 7461 1 1 38 CYS N N 7.838 2.088 -8.499 1.00 . A A . 73 CYS N 1 1 7 7462 1 1 38 CYS O O 6.267 -0.015 -8.132 1.00 . A A . 73 CYS O 1 1 7 7463 1 1 38 CYS SG S 9.176 -0.943 -8.025 1.00 . A A . 73 CYS SG 1 1 7 7464 1 1 39 HIS C C 4.810 -2.352 -9.715 1.00 . A A . 74 HIS C 1 1 7 7465 1 1 39 HIS CA C 4.601 -0.863 -10.120 1.00 . A A . 74 HIS CA 1 1 7 7466 1 1 39 HIS CB C 3.737 -0.719 -11.364 1.00 . A A . 74 HIS CB 1 1 7 7467 1 1 39 HIS CD2 C 1.363 -0.624 -10.371 1.00 . A A . 74 HIS CD2 1 1 7 7468 1 1 39 HIS CE1 C 0.504 -2.318 -11.430 1.00 . A A . 74 HIS CE1 1 1 7 7469 1 1 39 HIS CG C 2.323 -1.140 -11.162 1.00 . A A . 74 HIS CG 1 1 7 7470 1 1 39 HIS H H 6.203 0.002 -11.216 1.00 . A A . 74 HIS H 1 1 7 7471 1 1 39 HIS HA H 4.093 -0.394 -9.286 1.00 . A A . 74 HIS HA 1 1 7 7472 1 1 39 HIS HB2 H 3.741 0.317 -11.670 1.00 . A A . 74 HIS HB2 1 1 7 7473 1 1 39 HIS HB3 H 4.171 -1.327 -12.142 1.00 . A A . 74 HIS HB3 1 1 7 7474 1 1 39 HIS HD1 H 2.207 -2.764 -12.478 1.00 . A A . 74 HIS HD1 1 1 7 7475 1 1 39 HIS HD2 H 1.466 0.226 -9.711 1.00 . A A . 74 HIS HD2 1 1 7 7476 1 1 39 HIS HE1 H -0.194 -3.067 -11.772 1.00 . A A . 74 HIS HE1 1 1 7 7477 1 1 39 HIS HE2 H -0.643 -1.164 -10.192 1.00 . A A . 74 HIS HE2 1 1 7 7478 1 1 39 HIS N N 5.876 -0.157 -10.303 1.00 . A A . 74 HIS N 1 1 7 7479 1 1 39 HIS ND1 N 1.752 -2.199 -11.813 1.00 . A A . 74 HIS ND1 1 1 7 7480 1 1 39 HIS NE2 N 0.249 -1.373 -10.555 1.00 . A A . 74 HIS NE2 1 1 7 7481 1 1 39 HIS O O 4.338 -3.292 -10.357 1.00 . A A . 74 HIS O 1 1 7 7482 1 1 40 THR C C 4.729 -4.044 -6.963 1.00 . A A . 75 THR C 1 1 7 7483 1 1 40 THR CA C 5.818 -3.728 -7.997 1.00 . A A . 75 THR CA 1 1 7 7484 1 1 40 THR CB C 7.215 -3.566 -7.326 1.00 . A A . 75 THR CB 1 1 7 7485 1 1 40 THR CG2 C 7.422 -4.399 -6.078 1.00 . A A . 75 THR CG2 1 1 7 7486 1 1 40 THR H H 5.865 -1.660 -8.272 1.00 . A A . 75 THR H 1 1 7 7487 1 1 40 THR HA H 5.881 -4.514 -8.733 1.00 . A A . 75 THR HA 1 1 7 7488 1 1 40 THR HB H 7.269 -2.520 -7.054 1.00 . A A . 75 THR HB 1 1 7 7489 1 1 40 THR HG1 H 8.756 -2.909 -8.322 1.00 . A A . 75 THR HG1 1 1 7 7490 1 1 40 THR HG21 H 6.775 -3.953 -5.336 1.00 . A A . 75 THR HG21 1 1 7 7491 1 1 40 THR HG22 H 8.450 -4.313 -5.760 1.00 . A A . 75 THR HG22 1 1 7 7492 1 1 40 THR HG23 H 7.143 -5.428 -6.245 1.00 . A A . 75 THR HG23 1 1 7 7493 1 1 40 THR N N 5.512 -2.497 -8.650 1.00 . A A . 75 THR N 1 1 7 7494 1 1 40 THR O O 4.476 -3.231 -6.050 1.00 . A A . 75 THR O 1 1 7 7495 1 1 40 THR OG1 O 8.271 -3.746 -8.264 1.00 . A A . 75 THR OG1 1 1 7 7496 1 1 41 LYS C C 3.687 -6.178 -4.965 1.00 . A A . 76 LYS C 1 1 7 7497 1 1 41 LYS CA C 3.023 -5.613 -6.216 1.00 . A A . 76 LYS CA 1 1 7 7498 1 1 41 LYS CB C 2.094 -6.644 -6.908 1.00 . A A . 76 LYS CB 1 1 7 7499 1 1 41 LYS CD C 0.797 -7.668 -4.904 1.00 . A A . 76 LYS CD 1 1 7 7500 1 1 41 LYS CE C 1.337 -9.076 -5.093 1.00 . A A . 76 LYS CE 1 1 7 7501 1 1 41 LYS CG C 0.715 -6.906 -6.234 1.00 . A A . 76 LYS CG 1 1 7 7502 1 1 41 LYS H H 4.316 -5.793 -7.861 1.00 . A A . 76 LYS H 1 1 7 7503 1 1 41 LYS HA H 2.459 -4.734 -5.942 1.00 . A A . 76 LYS HA 1 1 7 7504 1 1 41 LYS HB2 H 1.907 -6.305 -7.915 1.00 . A A . 76 LYS HB2 1 1 7 7505 1 1 41 LYS HB3 H 2.633 -7.578 -6.951 1.00 . A A . 76 LYS HB3 1 1 7 7506 1 1 41 LYS HD2 H 1.454 -7.133 -4.234 1.00 . A A . 76 LYS HD2 1 1 7 7507 1 1 41 LYS HD3 H -0.191 -7.722 -4.469 1.00 . A A . 76 LYS HD3 1 1 7 7508 1 1 41 LYS HE2 H 0.670 -9.625 -5.740 1.00 . A A . 76 LYS HE2 1 1 7 7509 1 1 41 LYS HE3 H 2.308 -9.010 -5.559 1.00 . A A . 76 LYS HE3 1 1 7 7510 1 1 41 LYS HG2 H 0.243 -5.954 -6.043 1.00 . A A . 76 LYS HG2 1 1 7 7511 1 1 41 LYS HG3 H 0.102 -7.465 -6.923 1.00 . A A . 76 LYS HG3 1 1 7 7512 1 1 41 LYS HZ1 H 0.557 -9.901 -3.328 1.00 . A A . 76 LYS HZ1 1 1 7 7513 1 1 41 LYS HZ2 H 2.146 -9.334 -3.175 1.00 . A A . 76 LYS HZ2 1 1 7 7514 1 1 41 LYS HZ3 H 1.845 -10.754 -3.991 1.00 . A A . 76 LYS HZ3 1 1 7 7515 1 1 41 LYS N N 4.074 -5.192 -7.122 1.00 . A A . 76 LYS N 1 1 7 7516 1 1 41 LYS NZ N 1.470 -9.801 -3.813 1.00 . A A . 76 LYS NZ 1 1 7 7517 1 1 41 LYS O O 4.060 -7.348 -4.890 1.00 . A A . 76 LYS O 1 1 7 7518 1 1 42 LEU C C 3.517 -5.797 -1.653 1.00 . A A . 77 LEU C 1 1 7 7519 1 1 42 LEU CA C 4.506 -5.576 -2.769 1.00 . A A . 77 LEU CA 1 1 7 7520 1 1 42 LEU CB C 5.445 -4.413 -2.495 1.00 . A A . 77 LEU CB 1 1 7 7521 1 1 42 LEU CD1 C 3.840 -2.654 -1.476 1.00 . A A . 77 LEU CD1 1 1 7 7522 1 1 42 LEU CD2 C 5.887 -1.991 -2.535 1.00 . A A . 77 LEU CD2 1 1 7 7523 1 1 42 LEU CG C 4.818 -2.979 -2.565 1.00 . A A . 77 LEU CG 1 1 7 7524 1 1 42 LEU H H 3.576 -4.398 -4.230 1.00 . A A . 77 LEU H 1 1 7 7525 1 1 42 LEU HA H 5.111 -6.462 -2.872 1.00 . A A . 77 LEU HA 1 1 7 7526 1 1 42 LEU HB2 H 6.080 -4.535 -1.632 1.00 . A A . 77 LEU HB2 1 1 7 7527 1 1 42 LEU HB3 H 6.061 -4.418 -3.384 1.00 . A A . 77 LEU HB3 1 1 7 7528 1 1 42 LEU HD11 H 4.435 -2.666 -0.581 1.00 . A A . 77 LEU HD11 1 1 7 7529 1 1 42 LEU HD12 H 3.055 -3.394 -1.410 1.00 . A A . 77 LEU HD12 1 1 7 7530 1 1 42 LEU HD13 H 3.435 -1.661 -1.615 1.00 . A A . 77 LEU HD13 1 1 7 7531 1 1 42 LEU HD21 H 6.612 -2.231 -3.298 1.00 . A A . 77 LEU HD21 1 1 7 7532 1 1 42 LEU HD22 H 6.346 -1.998 -1.557 1.00 . A A . 77 LEU HD22 1 1 7 7533 1 1 42 LEU HD23 H 5.467 -1.018 -2.736 1.00 . A A . 77 LEU HD23 1 1 7 7534 1 1 42 LEU HG H 4.313 -2.860 -3.512 1.00 . A A . 77 LEU HG 1 1 7 7535 1 1 42 LEU N N 3.871 -5.313 -4.040 1.00 . A A . 77 LEU N 1 1 7 7536 1 1 42 LEU O O 3.897 -6.124 -0.509 1.00 . A A . 77 LEU O 1 1 7 7537 1 1 43 SER C C 1.181 -6.948 -0.281 1.00 . A A . 78 SER C 1 1 7 7538 1 1 43 SER CA C 1.191 -5.651 -1.072 1.00 . A A . 78 SER CA 1 1 7 7539 1 1 43 SER CB C -0.048 -5.591 -1.900 1.00 . A A . 78 SER CB 1 1 7 7540 1 1 43 SER H H 2.038 -5.389 -2.913 1.00 . A A . 78 SER H 1 1 7 7541 1 1 43 SER HA H 1.179 -4.797 -0.419 1.00 . A A . 78 SER HA 1 1 7 7542 1 1 43 SER HB2 H -0.331 -6.607 -2.108 1.00 . A A . 78 SER HB2 1 1 7 7543 1 1 43 SER HB3 H -0.836 -5.099 -1.349 1.00 . A A . 78 SER HB3 1 1 7 7544 1 1 43 SER HG H 0.332 -3.936 -2.906 1.00 . A A . 78 SER HG 1 1 7 7545 1 1 43 SER N N 2.270 -5.603 -1.987 1.00 . A A . 78 SER N 1 1 7 7546 1 1 43 SER O O 1.358 -8.037 -0.843 1.00 . A A . 78 SER O 1 1 7 7547 1 1 43 SER OG O 0.210 -4.877 -3.106 1.00 . A A . 78 SER OG 1 1 7 7548 1 1 44 LEU C C 1.769 -9.035 1.866 1.00 . A A . 79 LEU C 1 1 7 7549 1 1 44 LEU CA C 0.786 -7.870 1.992 1.00 . A A . 79 LEU CA 1 1 7 7550 1 1 44 LEU CB C -0.646 -8.324 2.065 1.00 . A A . 79 LEU CB 1 1 7 7551 1 1 44 LEU CD1 C -0.725 -8.721 4.557 1.00 . A A . 79 LEU CD1 1 1 7 7552 1 1 44 LEU CD2 C -1.372 -6.503 3.651 1.00 . A A . 79 LEU CD2 1 1 7 7553 1 1 44 LEU CG C -1.364 -7.998 3.389 1.00 . A A . 79 LEU CG 1 1 7 7554 1 1 44 LEU H H 0.831 -5.878 1.344 1.00 . A A . 79 LEU H 1 1 7 7555 1 1 44 LEU HA H 1.015 -7.403 2.939 1.00 . A A . 79 LEU HA 1 1 7 7556 1 1 44 LEU HB2 H -1.127 -7.808 1.243 1.00 . A A . 79 LEU HB2 1 1 7 7557 1 1 44 LEU HB3 H -0.683 -9.389 1.888 1.00 . A A . 79 LEU HB3 1 1 7 7558 1 1 44 LEU HD11 H -1.267 -8.489 5.462 1.00 . A A . 79 LEU HD11 1 1 7 7559 1 1 44 LEU HD12 H 0.295 -8.382 4.663 1.00 . A A . 79 LEU HD12 1 1 7 7560 1 1 44 LEU HD13 H -0.745 -9.786 4.381 1.00 . A A . 79 LEU HD13 1 1 7 7561 1 1 44 LEU HD21 H -0.383 -6.088 3.505 1.00 . A A . 79 LEU HD21 1 1 7 7562 1 1 44 LEU HD22 H -1.674 -6.328 4.674 1.00 . A A . 79 LEU HD22 1 1 7 7563 1 1 44 LEU HD23 H -2.078 -6.037 2.984 1.00 . A A . 79 LEU HD23 1 1 7 7564 1 1 44 LEU HG H -2.384 -8.335 3.308 1.00 . A A . 79 LEU HG 1 1 7 7565 1 1 44 LEU N N 0.929 -6.794 1.014 1.00 . A A . 79 LEU N 1 1 7 7566 1 1 44 LEU O O 1.416 -10.201 2.087 1.00 . A A . 79 LEU O 1 1 7 7567 1 1 45 GLY C C 5.168 -9.135 2.217 1.00 . A A . 80 GLY C 1 1 7 7568 1 1 45 GLY CA C 4.011 -9.683 1.480 1.00 . A A . 80 GLY CA 1 1 7 7569 1 1 45 GLY H H 3.156 -7.788 1.254 1.00 . A A . 80 GLY H 1 1 7 7570 1 1 45 GLY HA2 H 3.668 -10.595 1.947 1.00 . A A . 80 GLY HA2 1 1 7 7571 1 1 45 GLY HA3 H 4.302 -9.875 0.458 1.00 . A A . 80 GLY HA3 1 1 7 7572 1 1 45 GLY N N 2.971 -8.714 1.516 1.00 . A A . 80 GLY N 1 1 7 7573 1 1 45 GLY O O 5.511 -9.583 3.302 1.00 . A A . 80 GLY O 1 1 7 7574 1 1 46 SER C C 6.852 -6.036 1.690 1.00 . A A . 81 SER C 1 1 7 7575 1 1 46 SER CA C 6.827 -7.433 2.257 1.00 . A A . 81 SER CA 1 1 7 7576 1 1 46 SER CB C 8.155 -8.164 2.068 1.00 . A A . 81 SER CB 1 1 7 7577 1 1 46 SER H H 5.462 -7.870 0.746 1.00 . A A . 81 SER H 1 1 7 7578 1 1 46 SER HA H 6.599 -7.367 3.311 1.00 . A A . 81 SER HA 1 1 7 7579 1 1 46 SER HB2 H 8.956 -7.581 2.493 1.00 . A A . 81 SER HB2 1 1 7 7580 1 1 46 SER HB3 H 8.084 -9.108 2.587 1.00 . A A . 81 SER HB3 1 1 7 7581 1 1 46 SER HG H 8.084 -9.306 0.502 1.00 . A A . 81 SER HG 1 1 7 7582 1 1 46 SER N N 5.762 -8.152 1.638 1.00 . A A . 81 SER N 1 1 7 7583 1 1 46 SER O O 7.200 -5.836 0.525 1.00 . A A . 81 SER O 1 1 7 7584 1 1 46 SER OG O 8.424 -8.422 0.701 1.00 . A A . 81 SER OG 1 1 7 7585 1 1 47 TYR C C 6.934 -2.814 2.950 1.00 . A A . 82 TYR C 1 1 7 7586 1 1 47 TYR CA C 6.395 -3.775 1.948 1.00 . A A . 82 TYR CA 1 1 7 7587 1 1 47 TYR CB C 4.942 -3.436 1.571 1.00 . A A . 82 TYR CB 1 1 7 7588 1 1 47 TYR CD1 C 3.913 -2.297 3.548 1.00 . A A . 82 TYR CD1 1 1 7 7589 1 1 47 TYR CD2 C 2.926 -4.356 2.881 1.00 . A A . 82 TYR CD2 1 1 7 7590 1 1 47 TYR CE1 C 2.984 -2.159 4.540 1.00 . A A . 82 TYR CE1 1 1 7 7591 1 1 47 TYR CE2 C 1.990 -4.230 3.893 1.00 . A A . 82 TYR CE2 1 1 7 7592 1 1 47 TYR CG C 3.918 -3.376 2.702 1.00 . A A . 82 TYR CG 1 1 7 7593 1 1 47 TYR CZ C 2.031 -3.120 4.720 1.00 . A A . 82 TYR CZ 1 1 7 7594 1 1 47 TYR H H 6.212 -5.171 3.400 1.00 . A A . 82 TYR H 1 1 7 7595 1 1 47 TYR HA H 6.997 -3.715 1.052 1.00 . A A . 82 TYR HA 1 1 7 7596 1 1 47 TYR HB2 H 4.928 -2.457 1.119 1.00 . A A . 82 TYR HB2 1 1 7 7597 1 1 47 TYR HB3 H 4.606 -4.161 0.847 1.00 . A A . 82 TYR HB3 1 1 7 7598 1 1 47 TYR HD1 H 4.701 -1.573 3.400 1.00 . A A . 82 TYR HD1 1 1 7 7599 1 1 47 TYR HD2 H 2.868 -5.231 2.249 1.00 . A A . 82 TYR HD2 1 1 7 7600 1 1 47 TYR HE1 H 3.011 -1.293 5.186 1.00 . A A . 82 TYR HE1 1 1 7 7601 1 1 47 TYR HE2 H 1.243 -5.000 4.030 1.00 . A A . 82 TYR HE2 1 1 7 7602 1 1 47 TYR HH H 0.878 -2.000 5.683 1.00 . A A . 82 TYR HH 1 1 7 7603 1 1 47 TYR N N 6.461 -5.074 2.457 1.00 . A A . 82 TYR N 1 1 7 7604 1 1 47 TYR O O 7.095 -3.157 4.132 1.00 . A A . 82 TYR O 1 1 7 7605 1 1 47 TYR OH O 1.098 -2.954 5.707 1.00 . A A . 82 TYR OH 1 1 7 7606 1 1 48 ALA C C 6.687 0.547 3.086 1.00 . A A . 83 ALA C 1 1 7 7607 1 1 48 ALA CA C 7.607 -0.592 3.349 1.00 . A A . 83 ALA CA 1 1 7 7608 1 1 48 ALA CB C 9.048 -0.203 3.067 1.00 . A A . 83 ALA CB 1 1 7 7609 1 1 48 ALA H H 7.090 -1.436 1.546 1.00 . A A . 83 ALA H 1 1 7 7610 1 1 48 ALA HA H 7.513 -0.925 4.370 1.00 . A A . 83 ALA HA 1 1 7 7611 1 1 48 ALA HB1 H 9.674 -1.075 3.172 1.00 . A A . 83 ALA HB1 1 1 7 7612 1 1 48 ALA HB2 H 9.370 0.550 3.772 1.00 . A A . 83 ALA HB2 1 1 7 7613 1 1 48 ALA HB3 H 9.143 0.191 2.066 1.00 . A A . 83 ALA HB3 1 1 7 7614 1 1 48 ALA N N 7.194 -1.642 2.502 1.00 . A A . 83 ALA N 1 1 7 7615 1 1 48 ALA O O 6.597 1.036 1.967 1.00 . A A . 83 ALA O 1 1 7 7616 1 1 49 ALA C C 5.501 3.210 4.598 1.00 . A A . 84 ALA C 1 1 7 7617 1 1 49 ALA CA C 5.050 1.989 3.877 1.00 . A A . 84 ALA CA 1 1 7 7618 1 1 49 ALA CB C 3.676 1.561 4.346 1.00 . A A . 84 ALA CB 1 1 7 7619 1 1 49 ALA H H 6.117 0.580 4.966 1.00 . A A . 84 ALA H 1 1 7 7620 1 1 49 ALA HA H 4.991 2.177 2.814 1.00 . A A . 84 ALA HA 1 1 7 7621 1 1 49 ALA HB1 H 2.968 2.354 4.160 1.00 . A A . 84 ALA HB1 1 1 7 7622 1 1 49 ALA HB2 H 3.705 1.345 5.404 1.00 . A A . 84 ALA HB2 1 1 7 7623 1 1 49 ALA HB3 H 3.372 0.675 3.808 1.00 . A A . 84 ALA HB3 1 1 7 7624 1 1 49 ALA N N 5.988 0.953 4.067 1.00 . A A . 84 ALA N 1 1 7 7625 1 1 49 ALA O O 5.871 3.156 5.780 1.00 . A A . 84 ALA O 1 1 7 7626 1 1 50 LEU C C 4.559 6.321 4.396 1.00 . A A . 85 LEU C 1 1 7 7627 1 1 50 LEU CA C 5.814 5.533 4.479 1.00 . A A . 85 LEU CA 1 1 7 7628 1 1 50 LEU CB C 6.932 6.247 3.693 1.00 . A A . 85 LEU CB 1 1 7 7629 1 1 50 LEU CD1 C 8.222 7.434 5.473 1.00 . A A . 85 LEU CD1 1 1 7 7630 1 1 50 LEU CD2 C 8.077 8.456 3.246 1.00 . A A . 85 LEU CD2 1 1 7 7631 1 1 50 LEU CG C 7.371 7.600 4.257 1.00 . A A . 85 LEU CG 1 1 7 7632 1 1 50 LEU H H 5.231 4.285 2.962 1.00 . A A . 85 LEU H 1 1 7 7633 1 1 50 LEU HA H 6.116 5.396 5.504 1.00 . A A . 85 LEU HA 1 1 7 7634 1 1 50 LEU HB2 H 7.797 5.610 3.731 1.00 . A A . 85 LEU HB2 1 1 7 7635 1 1 50 LEU HB3 H 6.642 6.373 2.665 1.00 . A A . 85 LEU HB3 1 1 7 7636 1 1 50 LEU HD11 H 7.718 6.817 6.198 1.00 . A A . 85 LEU HD11 1 1 7 7637 1 1 50 LEU HD12 H 8.363 8.428 5.874 1.00 . A A . 85 LEU HD12 1 1 7 7638 1 1 50 LEU HD13 H 9.162 6.996 5.168 1.00 . A A . 85 LEU HD13 1 1 7 7639 1 1 50 LEU HD21 H 7.430 8.642 2.402 1.00 . A A . 85 LEU HD21 1 1 7 7640 1 1 50 LEU HD22 H 8.980 7.959 2.917 1.00 . A A . 85 LEU HD22 1 1 7 7641 1 1 50 LEU HD23 H 8.329 9.391 3.725 1.00 . A A . 85 LEU HD23 1 1 7 7642 1 1 50 LEU HG H 6.475 8.113 4.564 1.00 . A A . 85 LEU HG 1 1 7 7643 1 1 50 LEU N N 5.504 4.287 3.909 1.00 . A A . 85 LEU N 1 1 7 7644 1 1 50 LEU O O 3.697 6.010 3.574 1.00 . A A . 85 LEU O 1 1 7 7645 1 1 51 HIS C C 3.165 8.747 3.769 1.00 . A A . 86 HIS C 1 1 7 7646 1 1 51 HIS CA C 3.304 8.201 5.197 1.00 . A A . 86 HIS CA 1 1 7 7647 1 1 51 HIS CB C 3.478 9.341 6.236 1.00 . A A . 86 HIS CB 1 1 7 7648 1 1 51 HIS CD2 C 5.660 10.539 5.413 1.00 . A A . 86 HIS CD2 1 1 7 7649 1 1 51 HIS CE1 C 6.810 10.421 7.248 1.00 . A A . 86 HIS CE1 1 1 7 7650 1 1 51 HIS CG C 4.881 9.922 6.327 1.00 . A A . 86 HIS CG 1 1 7 7651 1 1 51 HIS H H 5.054 7.324 6.005 1.00 . A A . 86 HIS H 1 1 7 7652 1 1 51 HIS HA H 2.406 7.649 5.431 1.00 . A A . 86 HIS HA 1 1 7 7653 1 1 51 HIS HB2 H 2.806 10.147 5.980 1.00 . A A . 86 HIS HB2 1 1 7 7654 1 1 51 HIS HB3 H 3.209 8.965 7.211 1.00 . A A . 86 HIS HB3 1 1 7 7655 1 1 51 HIS HD1 H 5.354 9.439 8.313 1.00 . A A . 86 HIS HD1 1 1 7 7656 1 1 51 HIS HD2 H 5.431 10.699 4.372 1.00 . A A . 86 HIS HD2 1 1 7 7657 1 1 51 HIS HE1 H 7.635 10.500 7.938 1.00 . A A . 86 HIS HE1 1 1 7 7658 1 1 51 HIS HE2 H 7.595 11.282 5.572 1.00 . A A . 86 HIS HE2 1 1 7 7659 1 1 51 HIS N N 4.409 7.273 5.268 1.00 . A A . 86 HIS N 1 1 7 7660 1 1 51 HIS ND1 N 5.640 9.864 7.471 1.00 . A A . 86 HIS ND1 1 1 7 7661 1 1 51 HIS NE2 N 6.838 10.836 6.012 1.00 . A A . 86 HIS NE2 1 1 7 7662 1 1 51 HIS O O 4.113 9.299 3.193 1.00 . A A . 86 HIS O 1 1 7 7663 1 1 52 GLY C C 2.015 7.893 0.788 1.00 . A A . 87 GLY C 1 1 7 7664 1 1 52 GLY CA C 1.757 8.939 1.863 1.00 . A A . 87 GLY CA 1 1 7 7665 1 1 52 GLY H H 1.367 7.951 3.664 1.00 . A A . 87 GLY H 1 1 7 7666 1 1 52 GLY HA2 H 0.719 9.230 1.807 1.00 . A A . 87 GLY HA2 1 1 7 7667 1 1 52 GLY HA3 H 2.369 9.803 1.655 1.00 . A A . 87 GLY HA3 1 1 7 7668 1 1 52 GLY N N 2.035 8.488 3.187 1.00 . A A . 87 GLY N 1 1 7 7669 1 1 52 GLY O O 1.143 7.661 -0.062 1.00 . A A . 87 GLY O 1 1 7 7670 1 1 53 GLU C C 3.959 4.950 0.182 1.00 . A A . 88 GLU C 1 1 7 7671 1 1 53 GLU CA C 3.560 6.350 -0.278 1.00 . A A . 88 GLU CA 1 1 7 7672 1 1 53 GLU CB C 4.726 6.996 -1.050 1.00 . A A . 88 GLU CB 1 1 7 7673 1 1 53 GLU CD C 5.605 9.148 -2.087 1.00 . A A . 88 GLU CD 1 1 7 7674 1 1 53 GLU CG C 4.434 8.433 -1.468 1.00 . A A . 88 GLU CG 1 1 7 7675 1 1 53 GLU H H 3.722 7.220 1.645 1.00 . A A . 88 GLU H 1 1 7 7676 1 1 53 GLU HA H 2.715 6.288 -0.948 1.00 . A A . 88 GLU HA 1 1 7 7677 1 1 53 GLU HB2 H 5.644 6.939 -0.484 1.00 . A A . 88 GLU HB2 1 1 7 7678 1 1 53 GLU HB3 H 4.867 6.422 -1.954 1.00 . A A . 88 GLU HB3 1 1 7 7679 1 1 53 GLU HG2 H 3.631 8.418 -2.188 1.00 . A A . 88 GLU HG2 1 1 7 7680 1 1 53 GLU HG3 H 4.107 8.970 -0.591 1.00 . A A . 88 GLU HG3 1 1 7 7681 1 1 53 GLU N N 3.165 7.210 0.836 1.00 . A A . 88 GLU N 1 1 7 7682 1 1 53 GLU O O 4.618 4.777 1.208 1.00 . A A . 88 GLU O 1 1 7 7683 1 1 53 GLU OE1 O 6.417 9.745 -1.345 1.00 . A A . 88 GLU OE1 1 1 7 7684 1 1 53 GLU OE2 O 5.712 9.167 -3.330 1.00 . A A . 88 GLU OE2 1 1 7 7685 1 1 54 PHE C C 5.096 2.304 -1.221 1.00 . A A . 89 PHE C 1 1 7 7686 1 1 54 PHE CA C 3.912 2.593 -0.344 1.00 . A A . 89 PHE CA 1 1 7 7687 1 1 54 PHE CB C 2.695 1.712 -0.709 1.00 . A A . 89 PHE CB 1 1 7 7688 1 1 54 PHE CD1 C 1.097 1.646 1.265 1.00 . A A . 89 PHE CD1 1 1 7 7689 1 1 54 PHE CD2 C 0.638 3.152 -0.541 1.00 . A A . 89 PHE CD2 1 1 7 7690 1 1 54 PHE CE1 C -0.002 2.126 1.930 1.00 . A A . 89 PHE CE1 1 1 7 7691 1 1 54 PHE CE2 C -0.466 3.618 0.120 1.00 . A A . 89 PHE CE2 1 1 7 7692 1 1 54 PHE CG C 1.442 2.157 0.015 1.00 . A A . 89 PHE CG 1 1 7 7693 1 1 54 PHE CZ C -0.780 3.116 1.348 1.00 . A A . 89 PHE CZ 1 1 7 7694 1 1 54 PHE H H 3.082 4.148 -1.421 1.00 . A A . 89 PHE H 1 1 7 7695 1 1 54 PHE HA H 4.180 2.465 0.695 1.00 . A A . 89 PHE HA 1 1 7 7696 1 1 54 PHE HB2 H 2.506 1.813 -1.768 1.00 . A A . 89 PHE HB2 1 1 7 7697 1 1 54 PHE HB3 H 2.896 0.679 -0.478 1.00 . A A . 89 PHE HB3 1 1 7 7698 1 1 54 PHE HD1 H 1.678 0.872 1.742 1.00 . A A . 89 PHE HD1 1 1 7 7699 1 1 54 PHE HD2 H 0.879 3.550 -1.515 1.00 . A A . 89 PHE HD2 1 1 7 7700 1 1 54 PHE HE1 H -0.268 1.714 2.896 1.00 . A A . 89 PHE HE1 1 1 7 7701 1 1 54 PHE HE2 H -1.092 4.387 -0.309 1.00 . A A . 89 PHE HE2 1 1 7 7702 1 1 54 PHE HZ H -1.641 3.517 1.858 1.00 . A A . 89 PHE HZ 1 1 7 7703 1 1 54 PHE N N 3.591 3.969 -0.605 1.00 . A A . 89 PHE N 1 1 7 7704 1 1 54 PHE O O 5.044 2.525 -2.430 1.00 . A A . 89 PHE O 1 1 7 7705 1 1 55 TYR C C 7.927 0.394 -1.258 1.00 . A A . 90 TYR C 1 1 7 7706 1 1 55 TYR CA C 7.387 1.804 -1.373 1.00 . A A . 90 TYR CA 1 1 7 7707 1 1 55 TYR CB C 8.330 2.813 -0.715 1.00 . A A . 90 TYR CB 1 1 7 7708 1 1 55 TYR CD1 C 7.776 4.848 -2.074 1.00 . A A . 90 TYR CD1 1 1 7 7709 1 1 55 TYR CD2 C 10.068 4.233 -1.874 1.00 . A A . 90 TYR CD2 1 1 7 7710 1 1 55 TYR CE1 C 8.118 5.927 -2.845 1.00 . A A . 90 TYR CE1 1 1 7 7711 1 1 55 TYR CE2 C 10.429 5.318 -2.643 1.00 . A A . 90 TYR CE2 1 1 7 7712 1 1 55 TYR CG C 8.742 3.976 -1.576 1.00 . A A . 90 TYR CG 1 1 7 7713 1 1 55 TYR CZ C 9.443 6.169 -3.132 1.00 . A A . 90 TYR CZ 1 1 7 7714 1 1 55 TYR H H 6.155 1.565 0.287 1.00 . A A . 90 TYR H 1 1 7 7715 1 1 55 TYR HA H 7.229 2.082 -2.405 1.00 . A A . 90 TYR HA 1 1 7 7716 1 1 55 TYR HB2 H 7.647 3.341 -0.061 1.00 . A A . 90 TYR HB2 1 1 7 7717 1 1 55 TYR HB3 H 9.145 2.398 -0.145 1.00 . A A . 90 TYR HB3 1 1 7 7718 1 1 55 TYR HD1 H 6.731 4.684 -1.854 1.00 . A A . 90 TYR HD1 1 1 7 7719 1 1 55 TYR HD2 H 10.835 3.572 -1.502 1.00 . A A . 90 TYR HD2 1 1 7 7720 1 1 55 TYR HE1 H 7.331 6.572 -3.208 1.00 . A A . 90 TYR HE1 1 1 7 7721 1 1 55 TYR HE2 H 11.480 5.489 -2.836 1.00 . A A . 90 TYR HE2 1 1 7 7722 1 1 55 TYR HH H 10.424 7.006 -4.589 1.00 . A A . 90 TYR HH 1 1 7 7723 1 1 55 TYR N N 6.161 1.873 -0.650 1.00 . A A . 90 TYR N 1 1 7 7724 1 1 55 TYR O O 7.705 -0.280 -0.246 1.00 . A A . 90 TYR O 1 1 7 7725 1 1 55 TYR OH O 9.778 7.256 -3.919 1.00 . A A . 90 TYR OH 1 1 7 7726 1 1 56 CYS C C 10.330 -1.408 -1.365 1.00 . A A . 91 CYS C 1 1 7 7727 1 1 56 CYS CA C 9.109 -1.435 -2.236 1.00 . A A . 91 CYS CA 1 1 7 7728 1 1 56 CYS CB C 9.457 -2.025 -3.635 1.00 . A A . 91 CYS CB 1 1 7 7729 1 1 56 CYS H H 8.707 0.464 -3.097 1.00 . A A . 91 CYS H 1 1 7 7730 1 1 56 CYS HA H 8.335 -2.036 -1.771 1.00 . A A . 91 CYS HA 1 1 7 7731 1 1 56 CYS HB2 H 9.754 -3.054 -3.497 1.00 . A A . 91 CYS HB2 1 1 7 7732 1 1 56 CYS HB3 H 8.590 -2.025 -4.274 1.00 . A A . 91 CYS HB3 1 1 7 7733 1 1 56 CYS N N 8.579 -0.093 -2.304 1.00 . A A . 91 CYS N 1 1 7 7734 1 1 56 CYS O O 10.930 -0.339 -1.235 1.00 . A A . 91 CYS O 1 1 7 7735 1 1 56 CYS SG S 10.805 -1.203 -4.538 1.00 . A A . 91 CYS SG 1 1 7 7736 1 1 57 LYS C C 13.137 -1.968 -0.631 1.00 . A A . 92 LYS C 1 1 7 7737 1 1 57 LYS CA C 11.886 -2.567 0.073 1.00 . A A . 92 LYS CA 1 1 7 7738 1 1 57 LYS CB C 12.189 -3.993 0.558 1.00 . A A . 92 LYS CB 1 1 7 7739 1 1 57 LYS CD C 11.419 -6.104 1.701 1.00 . A A . 92 LYS CD 1 1 7 7740 1 1 57 LYS CE C 11.764 -7.009 0.504 1.00 . A A . 92 LYS CE 1 1 7 7741 1 1 57 LYS CG C 11.044 -4.681 1.285 1.00 . A A . 92 LYS CG 1 1 7 7742 1 1 57 LYS H H 10.165 -3.333 -0.925 1.00 . A A . 92 LYS H 1 1 7 7743 1 1 57 LYS HA H 11.649 -1.951 0.927 1.00 . A A . 92 LYS HA 1 1 7 7744 1 1 57 LYS HB2 H 12.454 -4.596 -0.294 1.00 . A A . 92 LYS HB2 1 1 7 7745 1 1 57 LYS HB3 H 13.038 -3.952 1.225 1.00 . A A . 92 LYS HB3 1 1 7 7746 1 1 57 LYS HD2 H 12.284 -6.048 2.345 1.00 . A A . 92 LYS HD2 1 1 7 7747 1 1 57 LYS HD3 H 10.598 -6.537 2.251 1.00 . A A . 92 LYS HD3 1 1 7 7748 1 1 57 LYS HE2 H 12.551 -6.537 -0.059 1.00 . A A . 92 LYS HE2 1 1 7 7749 1 1 57 LYS HE3 H 12.133 -7.954 0.870 1.00 . A A . 92 LYS HE3 1 1 7 7750 1 1 57 LYS HG2 H 10.792 -4.111 2.167 1.00 . A A . 92 LYS HG2 1 1 7 7751 1 1 57 LYS HG3 H 10.191 -4.713 0.629 1.00 . A A . 92 LYS HG3 1 1 7 7752 1 1 57 LYS HZ1 H 10.929 -7.863 -1.199 1.00 . A A . 92 LYS HZ1 1 1 7 7753 1 1 57 LYS HZ2 H 10.237 -6.377 -0.823 1.00 . A A . 92 LYS HZ2 1 1 7 7754 1 1 57 LYS HZ3 H 9.836 -7.753 0.070 1.00 . A A . 92 LYS HZ3 1 1 7 7755 1 1 57 LYS N N 10.710 -2.528 -0.793 1.00 . A A . 92 LYS N 1 1 7 7756 1 1 57 LYS NZ N 10.616 -7.254 -0.415 1.00 . A A . 92 LYS NZ 1 1 7 7757 1 1 57 LYS O O 13.774 -1.090 -0.051 1.00 . A A . 92 LYS O 1 1 7 7758 1 1 58 PRO C C 14.547 -0.283 -2.778 1.00 . A A . 93 PRO C 1 1 7 7759 1 1 58 PRO CA C 14.649 -1.807 -2.609 1.00 . A A . 93 PRO CA 1 1 7 7760 1 1 58 PRO CB C 14.625 -2.486 -3.981 1.00 . A A . 93 PRO CB 1 1 7 7761 1 1 58 PRO CD C 12.814 -3.407 -2.760 1.00 . A A . 93 PRO CD 1 1 7 7762 1 1 58 PRO CG C 13.841 -3.730 -3.784 1.00 . A A . 93 PRO CG 1 1 7 7763 1 1 58 PRO HA H 15.568 -2.050 -2.096 1.00 . A A . 93 PRO HA 1 1 7 7764 1 1 58 PRO HB2 H 14.138 -1.827 -4.685 1.00 . A A . 93 PRO HB2 1 1 7 7765 1 1 58 PRO HB3 H 15.632 -2.694 -4.310 1.00 . A A . 93 PRO HB3 1 1 7 7766 1 1 58 PRO HD2 H 11.935 -3.018 -3.253 1.00 . A A . 93 PRO HD2 1 1 7 7767 1 1 58 PRO HD3 H 12.567 -4.290 -2.193 1.00 . A A . 93 PRO HD3 1 1 7 7768 1 1 58 PRO HG2 H 13.368 -4.027 -4.709 1.00 . A A . 93 PRO HG2 1 1 7 7769 1 1 58 PRO HG3 H 14.472 -4.524 -3.422 1.00 . A A . 93 PRO HG3 1 1 7 7770 1 1 58 PRO N N 13.483 -2.375 -1.914 1.00 . A A . 93 PRO N 1 1 7 7771 1 1 58 PRO O O 15.465 0.446 -2.411 1.00 . A A . 93 PRO O 1 1 7 7772 1 1 59 HIS C C 13.214 2.417 -2.217 1.00 . A A . 94 HIS C 1 1 7 7773 1 1 59 HIS CA C 13.242 1.642 -3.485 1.00 . A A . 94 HIS CA 1 1 7 7774 1 1 59 HIS CB C 12.036 2.010 -4.346 1.00 . A A . 94 HIS CB 1 1 7 7775 1 1 59 HIS CD2 C 13.431 2.217 -6.475 1.00 . A A . 94 HIS CD2 1 1 7 7776 1 1 59 HIS CE1 C 11.877 1.663 -7.896 1.00 . A A . 94 HIS CE1 1 1 7 7777 1 1 59 HIS CG C 12.296 1.932 -5.804 1.00 . A A . 94 HIS CG 1 1 7 7778 1 1 59 HIS H H 12.682 -0.427 -3.479 1.00 . A A . 94 HIS H 1 1 7 7779 1 1 59 HIS HA H 14.130 1.955 -4.013 1.00 . A A . 94 HIS HA 1 1 7 7780 1 1 59 HIS HB2 H 11.218 1.342 -4.120 1.00 . A A . 94 HIS HB2 1 1 7 7781 1 1 59 HIS HB3 H 11.740 3.021 -4.114 1.00 . A A . 94 HIS HB3 1 1 7 7782 1 1 59 HIS HD2 H 14.364 2.515 -6.019 1.00 . A A . 94 HIS HD2 1 1 7 7783 1 1 59 HIS HE1 H 11.386 1.440 -8.832 1.00 . A A . 94 HIS HE1 1 1 7 7784 1 1 59 HIS HE2 H 13.629 2.559 -8.515 1.00 . A A . 94 HIS HE2 1 1 7 7785 1 1 59 HIS N N 13.408 0.201 -3.270 1.00 . A A . 94 HIS N 1 1 7 7786 1 1 59 HIS ND1 N 11.317 1.588 -6.686 1.00 . A A . 94 HIS ND1 1 1 7 7787 1 1 59 HIS NE2 N 13.164 2.050 -7.812 1.00 . A A . 94 HIS NE2 1 1 7 7788 1 1 59 HIS O O 13.701 3.542 -2.181 1.00 . A A . 94 HIS O 1 1 7 7789 1 1 60 PHE C C 14.007 2.724 0.566 1.00 . A A . 95 PHE C 1 1 7 7790 1 1 60 PHE CA C 12.594 2.479 0.101 1.00 . A A . 95 PHE CA 1 1 7 7791 1 1 60 PHE CB C 11.837 1.606 1.109 1.00 . A A . 95 PHE CB 1 1 7 7792 1 1 60 PHE CD1 C 10.507 3.332 2.324 1.00 . A A . 95 PHE CD1 1 1 7 7793 1 1 60 PHE CD2 C 12.046 2.025 3.577 1.00 . A A . 95 PHE CD2 1 1 7 7794 1 1 60 PHE CE1 C 10.146 4.018 3.455 1.00 . A A . 95 PHE CE1 1 1 7 7795 1 1 60 PHE CE2 C 11.693 2.710 4.724 1.00 . A A . 95 PHE CE2 1 1 7 7796 1 1 60 PHE CG C 11.456 2.331 2.366 1.00 . A A . 95 PHE CG 1 1 7 7797 1 1 60 PHE CZ C 10.739 3.711 4.663 1.00 . A A . 95 PHE CZ 1 1 7 7798 1 1 60 PHE H H 12.271 0.933 -1.277 1.00 . A A . 95 PHE H 1 1 7 7799 1 1 60 PHE HA H 12.097 3.431 0.000 1.00 . A A . 95 PHE HA 1 1 7 7800 1 1 60 PHE HB2 H 10.947 1.193 0.660 1.00 . A A . 95 PHE HB2 1 1 7 7801 1 1 60 PHE HB3 H 12.488 0.793 1.385 1.00 . A A . 95 PHE HB3 1 1 7 7802 1 1 60 PHE HD1 H 10.038 3.571 1.382 1.00 . A A . 95 PHE HD1 1 1 7 7803 1 1 60 PHE HD2 H 12.783 1.239 3.621 1.00 . A A . 95 PHE HD2 1 1 7 7804 1 1 60 PHE HE1 H 9.400 4.796 3.373 1.00 . A A . 95 PHE HE1 1 1 7 7805 1 1 60 PHE HE2 H 12.161 2.461 5.665 1.00 . A A . 95 PHE HE2 1 1 7 7806 1 1 60 PHE HZ H 10.460 4.250 5.556 1.00 . A A . 95 PHE HZ 1 1 7 7807 1 1 60 PHE N N 12.656 1.833 -1.182 1.00 . A A . 95 PHE N 1 1 7 7808 1 1 60 PHE O O 14.368 3.838 0.883 1.00 . A A . 95 PHE O 1 1 7 7809 1 1 61 GLN C C 17.039 2.703 0.086 1.00 . A A . 96 GLN C 1 1 7 7810 1 1 61 GLN CA C 16.203 1.726 0.893 1.00 . A A . 96 GLN CA 1 1 7 7811 1 1 61 GLN CB C 16.811 0.340 0.812 1.00 . A A . 96 GLN CB 1 1 7 7812 1 1 61 GLN CD C 16.697 -2.051 1.627 1.00 . A A . 96 GLN CD 1 1 7 7813 1 1 61 GLN CG C 16.208 -0.632 1.793 1.00 . A A . 96 GLN CG 1 1 7 7814 1 1 61 GLN H H 14.466 0.864 0.064 1.00 . A A . 96 GLN H 1 1 7 7815 1 1 61 GLN HA H 16.220 2.037 1.926 1.00 . A A . 96 GLN HA 1 1 7 7816 1 1 61 GLN HB2 H 16.659 -0.041 -0.186 1.00 . A A . 96 GLN HB2 1 1 7 7817 1 1 61 GLN HB3 H 17.870 0.415 1.004 1.00 . A A . 96 GLN HB3 1 1 7 7818 1 1 61 GLN HE21 H 18.468 -1.418 1.042 1.00 . A A . 96 GLN HE21 1 1 7 7819 1 1 61 GLN HE22 H 18.268 -3.124 1.084 1.00 . A A . 96 GLN HE22 1 1 7 7820 1 1 61 GLN HG2 H 16.522 -0.291 2.766 1.00 . A A . 96 GLN HG2 1 1 7 7821 1 1 61 GLN HG3 H 15.131 -0.603 1.715 1.00 . A A . 96 GLN HG3 1 1 7 7822 1 1 61 GLN N N 14.818 1.690 0.466 1.00 . A A . 96 GLN N 1 1 7 7823 1 1 61 GLN NE2 N 17.922 -2.216 1.219 1.00 . A A . 96 GLN NE2 1 1 7 7824 1 1 61 GLN O O 17.892 3.392 0.632 1.00 . A A . 96 GLN O 1 1 7 7825 1 1 61 GLN OE1 O 15.965 -3.002 1.895 1.00 . A A . 96 GLN OE1 1 1 7 7826 1 1 62 GLN C C 17.150 5.080 -1.893 1.00 . A A . 97 GLN C 1 1 7 7827 1 1 62 GLN CA C 17.592 3.617 -2.038 1.00 . A A . 97 GLN CA 1 1 7 7828 1 1 62 GLN CB C 17.415 3.179 -3.482 1.00 . A A . 97 GLN CB 1 1 7 7829 1 1 62 GLN CD C 17.639 1.353 -5.205 1.00 . A A . 97 GLN CD 1 1 7 7830 1 1 62 GLN CG C 17.906 1.776 -3.776 1.00 . A A . 97 GLN CG 1 1 7 7831 1 1 62 GLN H H 16.177 2.155 -1.639 1.00 . A A . 97 GLN H 1 1 7 7832 1 1 62 GLN HA H 18.637 3.516 -1.789 1.00 . A A . 97 GLN HA 1 1 7 7833 1 1 62 GLN HB2 H 16.363 3.227 -3.726 1.00 . A A . 97 GLN HB2 1 1 7 7834 1 1 62 GLN HB3 H 17.951 3.871 -4.105 1.00 . A A . 97 GLN HB3 1 1 7 7835 1 1 62 GLN HE21 H 19.400 2.032 -5.742 1.00 . A A . 97 GLN HE21 1 1 7 7836 1 1 62 GLN HE22 H 18.439 1.339 -7.004 1.00 . A A . 97 GLN HE22 1 1 7 7837 1 1 62 GLN HG2 H 18.971 1.740 -3.598 1.00 . A A . 97 GLN HG2 1 1 7 7838 1 1 62 GLN HG3 H 17.404 1.092 -3.108 1.00 . A A . 97 GLN HG3 1 1 7 7839 1 1 62 GLN N N 16.833 2.743 -1.205 1.00 . A A . 97 GLN N 1 1 7 7840 1 1 62 GLN NE2 N 18.583 1.598 -6.070 1.00 . A A . 97 GLN NE2 1 1 7 7841 1 1 62 GLN O O 17.967 5.969 -1.623 1.00 . A A . 97 GLN O 1 1 7 7842 1 1 62 GLN OE1 O 16.586 0.792 -5.523 1.00 . A A . 97 GLN OE1 1 1 7 7843 1 1 63 LEU C C 15.104 7.292 -0.706 1.00 . A A . 98 LEU C 1 1 7 7844 1 1 63 LEU CA C 15.313 6.655 -2.079 1.00 . A A . 98 LEU CA 1 1 7 7845 1 1 63 LEU CB C 14.027 6.613 -2.865 1.00 . A A . 98 LEU CB 1 1 7 7846 1 1 63 LEU CD1 C 12.944 5.709 -4.892 1.00 . A A . 98 LEU CD1 1 1 7 7847 1 1 63 LEU CD2 C 14.580 7.505 -5.131 1.00 . A A . 98 LEU CD2 1 1 7 7848 1 1 63 LEU CG C 14.205 6.271 -4.344 1.00 . A A . 98 LEU CG 1 1 7 7849 1 1 63 LEU H H 15.248 4.553 -2.143 1.00 . A A . 98 LEU H 1 1 7 7850 1 1 63 LEU HA H 16.001 7.266 -2.641 1.00 . A A . 98 LEU HA 1 1 7 7851 1 1 63 LEU HB2 H 13.405 5.859 -2.406 1.00 . A A . 98 LEU HB2 1 1 7 7852 1 1 63 LEU HB3 H 13.531 7.568 -2.783 1.00 . A A . 98 LEU HB3 1 1 7 7853 1 1 63 LEU HD11 H 13.074 5.488 -5.941 1.00 . A A . 98 LEU HD11 1 1 7 7854 1 1 63 LEU HD12 H 12.150 6.427 -4.757 1.00 . A A . 98 LEU HD12 1 1 7 7855 1 1 63 LEU HD13 H 12.715 4.800 -4.357 1.00 . A A . 98 LEU HD13 1 1 7 7856 1 1 63 LEU HD21 H 13.786 8.229 -5.020 1.00 . A A . 98 LEU HD21 1 1 7 7857 1 1 63 LEU HD22 H 14.678 7.250 -6.177 1.00 . A A . 98 LEU HD22 1 1 7 7858 1 1 63 LEU HD23 H 15.505 7.916 -4.756 1.00 . A A . 98 LEU HD23 1 1 7 7859 1 1 63 LEU HG H 14.994 5.543 -4.462 1.00 . A A . 98 LEU HG 1 1 7 7860 1 1 63 LEU N N 15.869 5.312 -2.052 1.00 . A A . 98 LEU N 1 1 7 7861 1 1 63 LEU O O 15.488 8.441 -0.488 1.00 . A A . 98 LEU O 1 1 7 7862 1 1 64 PHE C C 15.220 6.600 2.600 1.00 . A A . 99 PHE C 1 1 7 7863 1 1 64 PHE CA C 14.243 7.106 1.548 1.00 . A A . 99 PHE CA 1 1 7 7864 1 1 64 PHE CB C 12.810 6.743 1.970 1.00 . A A . 99 PHE CB 1 1 7 7865 1 1 64 PHE CD1 C 11.899 8.620 0.536 1.00 . A A . 99 PHE CD1 1 1 7 7866 1 1 64 PHE CD2 C 10.456 6.818 1.135 1.00 . A A . 99 PHE CD2 1 1 7 7867 1 1 64 PHE CE1 C 10.872 9.201 -0.178 1.00 . A A . 99 PHE CE1 1 1 7 7868 1 1 64 PHE CE2 C 9.432 7.405 0.423 1.00 . A A . 99 PHE CE2 1 1 7 7869 1 1 64 PHE CG C 11.703 7.413 1.204 1.00 . A A . 99 PHE CG 1 1 7 7870 1 1 64 PHE CZ C 9.647 8.594 -0.234 1.00 . A A . 99 PHE CZ 1 1 7 7871 1 1 64 PHE H H 14.296 5.611 0.048 1.00 . A A . 99 PHE H 1 1 7 7872 1 1 64 PHE HA H 14.326 8.178 1.491 1.00 . A A . 99 PHE HA 1 1 7 7873 1 1 64 PHE HB2 H 12.687 5.727 1.626 1.00 . A A . 99 PHE HB2 1 1 7 7874 1 1 64 PHE HB3 H 12.645 6.793 3.033 1.00 . A A . 99 PHE HB3 1 1 7 7875 1 1 64 PHE HD1 H 12.860 9.110 0.568 1.00 . A A . 99 PHE HD1 1 1 7 7876 1 1 64 PHE HD2 H 10.276 5.890 1.662 1.00 . A A . 99 PHE HD2 1 1 7 7877 1 1 64 PHE HE1 H 11.013 10.135 -0.699 1.00 . A A . 99 PHE HE1 1 1 7 7878 1 1 64 PHE HE2 H 8.464 6.929 0.381 1.00 . A A . 99 PHE HE2 1 1 7 7879 1 1 64 PHE HZ H 8.857 9.065 -0.795 1.00 . A A . 99 PHE HZ 1 1 7 7880 1 1 64 PHE N N 14.552 6.544 0.229 1.00 . A A . 99 PHE N 1 1 7 7881 1 1 64 PHE O O 15.136 6.988 3.779 1.00 . A A . 99 PHE O 1 1 7 7882 1 1 65 LYS C C 16.406 4.154 3.989 1.00 . A A . 100 LYS C 1 1 7 7883 1 1 65 LYS CA C 17.131 5.104 3.000 1.00 . A A . 100 LYS CA 1 1 7 7884 1 1 65 LYS CB C 18.003 6.195 3.660 1.00 . A A . 100 LYS CB 1 1 7 7885 1 1 65 LYS CD C 20.166 6.855 4.696 1.00 . A A . 100 LYS CD 1 1 7 7886 1 1 65 LYS CE C 21.386 6.355 5.433 1.00 . A A . 100 LYS CE 1 1 7 7887 1 1 65 LYS CG C 19.334 5.710 4.177 1.00 . A A . 100 LYS CG 1 1 7 7888 1 1 65 LYS H H 16.073 5.403 1.242 1.00 . A A . 100 LYS H 1 1 7 7889 1 1 65 LYS HA H 17.729 4.486 2.345 1.00 . A A . 100 LYS HA 1 1 7 7890 1 1 65 LYS HB2 H 18.189 6.976 2.940 1.00 . A A . 100 LYS HB2 1 1 7 7891 1 1 65 LYS HB3 H 17.451 6.615 4.488 1.00 . A A . 100 LYS HB3 1 1 7 7892 1 1 65 LYS HD2 H 20.484 7.467 3.865 1.00 . A A . 100 LYS HD2 1 1 7 7893 1 1 65 LYS HD3 H 19.565 7.447 5.371 1.00 . A A . 100 LYS HD3 1 1 7 7894 1 1 65 LYS HE2 H 21.933 5.689 4.782 1.00 . A A . 100 LYS HE2 1 1 7 7895 1 1 65 LYS HE3 H 22.010 7.196 5.694 1.00 . A A . 100 LYS HE3 1 1 7 7896 1 1 65 LYS HG2 H 19.168 4.994 4.962 1.00 . A A . 100 LYS HG2 1 1 7 7897 1 1 65 LYS HG3 H 19.866 5.228 3.369 1.00 . A A . 100 LYS HG3 1 1 7 7898 1 1 65 LYS HZ1 H 20.492 4.746 6.464 1.00 . A A . 100 LYS HZ1 1 1 7 7899 1 1 65 LYS HZ2 H 20.392 6.218 7.248 1.00 . A A . 100 LYS HZ2 1 1 7 7900 1 1 65 LYS HZ3 H 21.843 5.395 7.237 1.00 . A A . 100 LYS HZ3 1 1 7 7901 1 1 65 LYS N N 16.122 5.714 2.165 1.00 . A A . 100 LYS N 1 1 7 7902 1 1 65 LYS NZ N 21.010 5.624 6.658 1.00 . A A . 100 LYS NZ 1 1 7 7903 1 1 65 LYS O O 15.296 3.717 3.671 1.00 . A A . 100 LYS O 1 1 7 7904 1 1 66 SER C C 16.242 1.489 5.403 1.00 . A A . 101 SER C 1 1 7 7905 1 1 66 SER CA C 16.408 2.867 6.089 1.00 . A A . 101 SER CA 1 1 7 7906 1 1 66 SER CB C 15.078 3.461 6.580 1.00 . A A . 101 SER CB 1 1 7 7907 1 1 66 SER H H 17.892 4.163 5.373 1.00 . A A . 101 SER H 1 1 7 7908 1 1 66 SER HA H 17.090 2.754 6.919 1.00 . A A . 101 SER HA 1 1 7 7909 1 1 66 SER HB2 H 14.397 3.552 5.746 1.00 . A A . 101 SER HB2 1 1 7 7910 1 1 66 SER HB3 H 14.646 2.823 7.335 1.00 . A A . 101 SER HB3 1 1 7 7911 1 1 66 SER HG H 16.217 4.987 6.906 1.00 . A A . 101 SER HG 1 1 7 7912 1 1 66 SER N N 17.016 3.802 5.142 1.00 . A A . 101 SER N 1 1 7 7913 1 1 66 SER O O 16.984 1.179 4.452 1.00 . A A . 101 SER O 1 1 7 7914 1 1 66 SER OG O 15.309 4.753 7.138 1.00 . A A . 101 SER OG 1 1 7 7915 1 1 67 LYS C C 13.680 -0.969 5.278 1.00 . A A . 102 LYS C 1 1 7 7916 1 1 67 LYS CA C 15.148 -0.641 5.277 1.00 . A A . 102 LYS CA 1 1 7 7917 1 1 67 LYS CB C 15.971 -1.764 5.976 1.00 . A A . 102 LYS CB 1 1 7 7918 1 1 67 LYS CD C 15.654 -1.189 8.452 1.00 . A A . 102 LYS CD 1 1 7 7919 1 1 67 LYS CE C 15.058 -1.706 9.743 1.00 . A A . 102 LYS CE 1 1 7 7920 1 1 67 LYS CG C 15.485 -2.230 7.356 1.00 . A A . 102 LYS CG 1 1 7 7921 1 1 67 LYS H H 14.780 0.904 6.643 1.00 . A A . 102 LYS H 1 1 7 7922 1 1 67 LYS HA H 15.456 -0.568 4.247 1.00 . A A . 102 LYS HA 1 1 7 7923 1 1 67 LYS HB2 H 15.985 -2.627 5.328 1.00 . A A . 102 LYS HB2 1 1 7 7924 1 1 67 LYS HB3 H 16.986 -1.408 6.080 1.00 . A A . 102 LYS HB3 1 1 7 7925 1 1 67 LYS HD2 H 16.706 -0.991 8.597 1.00 . A A . 102 LYS HD2 1 1 7 7926 1 1 67 LYS HD3 H 15.145 -0.283 8.160 1.00 . A A . 102 LYS HD3 1 1 7 7927 1 1 67 LYS HE2 H 14.008 -1.886 9.570 1.00 . A A . 102 LYS HE2 1 1 7 7928 1 1 67 LYS HE3 H 15.545 -2.635 10.001 1.00 . A A . 102 LYS HE3 1 1 7 7929 1 1 67 LYS HG2 H 14.436 -2.476 7.285 1.00 . A A . 102 LYS HG2 1 1 7 7930 1 1 67 LYS HG3 H 16.034 -3.120 7.628 1.00 . A A . 102 LYS HG3 1 1 7 7931 1 1 67 LYS HZ1 H 14.686 0.132 10.671 1.00 . A A . 102 LYS HZ1 1 1 7 7932 1 1 67 LYS HZ2 H 16.166 -0.559 11.109 1.00 . A A . 102 LYS HZ2 1 1 7 7933 1 1 67 LYS HZ3 H 14.723 -1.190 11.712 1.00 . A A . 102 LYS HZ3 1 1 7 7934 1 1 67 LYS N N 15.350 0.654 5.886 1.00 . A A . 102 LYS N 1 1 7 7935 1 1 67 LYS NZ N 15.176 -0.764 10.871 1.00 . A A . 102 LYS NZ 1 1 7 7936 1 1 67 LYS O O 12.927 -0.427 6.097 1.00 . A A . 102 LYS O 1 1 7 7937 1 1 68 GLY C C 11.497 -3.158 5.347 1.00 . A A . 103 GLY C 1 1 7 7938 1 1 68 GLY CA C 11.892 -2.229 4.234 1.00 . A A . 103 GLY CA 1 1 7 7939 1 1 68 GLY H H 13.933 -2.214 3.733 1.00 . A A . 103 GLY H 1 1 7 7940 1 1 68 GLY HA2 H 11.285 -1.339 4.297 1.00 . A A . 103 GLY HA2 1 1 7 7941 1 1 68 GLY HA3 H 11.733 -2.714 3.283 1.00 . A A . 103 GLY HA3 1 1 7 7942 1 1 68 GLY N N 13.275 -1.828 4.349 1.00 . A A . 103 GLY N 1 1 7 7943 1 1 68 GLY O O 11.529 -4.390 5.198 1.00 . A A . 103 GLY O 1 1 7 7944 1 1 69 ASN C C 9.485 -3.982 7.602 1.00 . A A . 104 ASN C 1 1 7 7945 1 1 69 ASN CA C 10.811 -3.234 7.683 1.00 . A A . 104 ASN CA 1 1 7 7946 1 1 69 ASN CB C 10.841 -2.227 8.878 1.00 . A A . 104 ASN CB 1 1 7 7947 1 1 69 ASN CG C 9.856 -1.053 8.749 1.00 . A A . 104 ASN CG 1 1 7 7948 1 1 69 ASN H H 11.148 -1.573 6.453 1.00 . A A . 104 ASN H 1 1 7 7949 1 1 69 ASN HA H 11.586 -3.965 7.859 1.00 . A A . 104 ASN HA 1 1 7 7950 1 1 69 ASN HB2 H 10.599 -2.754 9.789 1.00 . A A . 104 ASN HB2 1 1 7 7951 1 1 69 ASN HB3 H 11.839 -1.824 8.965 1.00 . A A . 104 ASN HB3 1 1 7 7952 1 1 69 ASN HD21 H 8.579 -1.925 9.970 1.00 . A A . 104 ASN HD21 1 1 7 7953 1 1 69 ASN HD22 H 8.094 -0.385 9.357 1.00 . A A . 104 ASN HD22 1 1 7 7954 1 1 69 ASN N N 11.152 -2.556 6.456 1.00 . A A . 104 ASN N 1 1 7 7955 1 1 69 ASN ND2 N 8.735 -1.124 9.421 1.00 . A A . 104 ASN ND2 1 1 7 7956 1 1 69 ASN O O 8.411 -3.424 7.779 1.00 . A A . 104 ASN O 1 1 7 7957 1 1 69 ASN OD1 O 10.143 -0.062 8.085 1.00 . A A . 104 ASN OD1 1 1 7 7958 1 1 70 TYR C C 8.330 -6.705 8.711 1.00 . A A . 105 TYR C 1 1 7 7959 1 1 70 TYR CA C 8.387 -6.058 7.343 1.00 . A A . 105 TYR CA 1 1 7 7960 1 1 70 TYR CB C 8.356 -7.116 6.219 1.00 . A A . 105 TYR CB 1 1 7 7961 1 1 70 TYR CD1 C 5.895 -7.700 6.156 1.00 . A A . 105 TYR CD1 1 1 7 7962 1 1 70 TYR CD2 C 7.442 -9.403 6.775 1.00 . A A . 105 TYR CD2 1 1 7 7963 1 1 70 TYR CE1 C 4.851 -8.585 6.337 1.00 . A A . 105 TYR CE1 1 1 7 7964 1 1 70 TYR CE2 C 6.408 -10.291 6.949 1.00 . A A . 105 TYR CE2 1 1 7 7965 1 1 70 TYR CG C 7.208 -8.094 6.373 1.00 . A A . 105 TYR CG 1 1 7 7966 1 1 70 TYR CZ C 5.116 -9.880 6.734 1.00 . A A . 105 TYR CZ 1 1 7 7967 1 1 70 TYR H H 10.423 -5.617 7.018 1.00 . A A . 105 TYR H 1 1 7 7968 1 1 70 TYR HA H 7.534 -5.402 7.246 1.00 . A A . 105 TYR HA 1 1 7 7969 1 1 70 TYR HB2 H 8.248 -6.620 5.267 1.00 . A A . 105 TYR HB2 1 1 7 7970 1 1 70 TYR HB3 H 9.278 -7.678 6.230 1.00 . A A . 105 TYR HB3 1 1 7 7971 1 1 70 TYR HD1 H 5.693 -6.686 5.843 1.00 . A A . 105 TYR HD1 1 1 7 7972 1 1 70 TYR HD2 H 8.458 -9.727 6.944 1.00 . A A . 105 TYR HD2 1 1 7 7973 1 1 70 TYR HE1 H 3.834 -8.264 6.165 1.00 . A A . 105 TYR HE1 1 1 7 7974 1 1 70 TYR HE2 H 6.614 -11.304 7.261 1.00 . A A . 105 TYR HE2 1 1 7 7975 1 1 70 TYR HH H 4.259 -11.208 7.767 1.00 . A A . 105 TYR HH 1 1 7 7976 1 1 70 TYR N N 9.557 -5.236 7.289 1.00 . A A . 105 TYR N 1 1 7 7977 1 1 70 TYR O O 7.434 -6.440 9.507 1.00 . A A . 105 TYR O 1 1 7 7978 1 1 70 TYR OH O 4.082 -10.764 6.927 1.00 . A A . 105 TYR OH 1 1 7 7979 1 1 71 ASP C C 10.625 -7.662 10.981 1.00 . A A . 106 ASP C 1 1 7 7980 1 1 71 ASP CA C 9.405 -8.179 10.267 1.00 . A A . 106 ASP CA 1 1 7 7981 1 1 71 ASP CB C 9.458 -9.705 10.077 1.00 . A A . 106 ASP CB 1 1 7 7982 1 1 71 ASP CG C 9.628 -10.463 11.377 1.00 . A A . 106 ASP CG 1 1 7 7983 1 1 71 ASP H H 10.028 -7.633 8.342 1.00 . A A . 106 ASP H 1 1 7 7984 1 1 71 ASP HA H 8.531 -7.915 10.845 1.00 . A A . 106 ASP HA 1 1 7 7985 1 1 71 ASP HB2 H 8.540 -10.035 9.613 1.00 . A A . 106 ASP HB2 1 1 7 7986 1 1 71 ASP HB3 H 10.287 -9.945 9.428 1.00 . A A . 106 ASP HB3 1 1 7 7987 1 1 71 ASP N N 9.308 -7.504 8.997 1.00 . A A . 106 ASP N 1 1 7 7988 1 1 71 ASP O O 11.698 -8.269 10.954 1.00 . A A . 106 ASP O 1 1 7 7989 1 1 71 ASP OD1 O 8.842 -10.235 12.322 1.00 . A A . 106 ASP OD1 1 1 7 7990 1 1 71 ASP OD2 O 10.558 -11.288 11.477 1.00 . A A . 106 ASP OD2 1 1 7 7991 1 1 72 GLU C C 11.174 -5.630 13.650 1.00 . A A . 107 GLU C 1 1 7 7992 1 1 72 GLU CA C 11.583 -5.882 12.220 1.00 . A A . 107 GLU CA 1 1 7 7993 1 1 72 GLU CB C 11.904 -4.592 11.454 1.00 . A A . 107 GLU CB 1 1 7 7994 1 1 72 GLU CD C 13.865 -3.538 12.742 1.00 . A A . 107 GLU CD 1 1 7 7995 1 1 72 GLU CG C 13.369 -4.170 11.462 1.00 . A A . 107 GLU CG 1 1 7 7996 1 1 72 GLU H H 9.600 -6.096 11.640 1.00 . A A . 107 GLU H 1 1 7 7997 1 1 72 GLU HA H 12.434 -6.546 12.194 1.00 . A A . 107 GLU HA 1 1 7 7998 1 1 72 GLU HB2 H 11.603 -4.720 10.425 1.00 . A A . 107 GLU HB2 1 1 7 7999 1 1 72 GLU HB3 H 11.322 -3.790 11.884 1.00 . A A . 107 GLU HB3 1 1 7 8000 1 1 72 GLU HG2 H 13.964 -5.052 11.284 1.00 . A A . 107 GLU HG2 1 1 7 8001 1 1 72 GLU HG3 H 13.521 -3.480 10.646 1.00 . A A . 107 GLU HG3 1 1 7 8002 1 1 72 GLU N N 10.481 -6.522 11.581 1.00 . A A . 107 GLU N 1 1 7 8003 1 1 72 GLU O O 10.847 -4.488 14.018 1.00 . A A . 107 GLU O 1 1 7 8004 1 1 72 GLU OXT O 11.057 -6.630 14.396 1.00 . A A . 107 GLU OXT 1 1 7 8005 1 1 72 GLU OE1 O 14.241 -4.263 13.672 1.00 . A A . 107 GLU OE1 1 1 7 8006 1 1 72 GLU OE2 O 13.938 -2.277 12.803 1.00 . A A . 107 GLU OE2 1 1 7 8007 2 2 1 ZN ZN ZN -7.482 0.239 -3.934 1.00 . B A . 201 ZN ZN 1 1 7 8008 3 2 1 ZN ZN ZN 9.981 0.171 -6.202 1.00 . C A . 202 ZN ZN 1 1 8 8009 1 1 1 ARG C C -17.885 -4.000 5.810 1.00 . A A . 36 ARG C 1 1 8 8010 1 1 1 ARG CA C -17.495 -3.215 7.042 1.00 . A A . 36 ARG CA 1 1 8 8011 1 1 1 ARG CB C -16.144 -2.520 6.813 1.00 . A A . 36 ARG CB 1 1 8 8012 1 1 1 ARG CD C -16.636 -0.350 7.986 1.00 . A A . 36 ARG CD 1 1 8 8013 1 1 1 ARG CG C -15.719 -1.559 7.916 1.00 . A A . 36 ARG CG 1 1 8 8014 1 1 1 ARG CZ C -17.570 1.296 6.378 1.00 . A A . 36 ARG CZ 1 1 8 8015 1 1 1 ARG H1 H -18.348 -4.590 8.294 1.00 . A A . 36 ARG H1 1 1 8 8016 1 1 1 ARG H2 H -17.223 -3.625 9.082 1.00 . A A . 36 ARG H2 1 1 8 8017 1 1 1 ARG H3 H -16.721 -4.853 8.025 1.00 . A A . 36 ARG H3 1 1 8 8018 1 1 1 ARG HA H -18.252 -2.471 7.238 1.00 . A A . 36 ARG HA 1 1 8 8019 1 1 1 ARG HB2 H -15.377 -3.272 6.707 1.00 . A A . 36 ARG HB2 1 1 8 8020 1 1 1 ARG HB3 H -16.199 -1.964 5.888 1.00 . A A . 36 ARG HB3 1 1 8 8021 1 1 1 ARG HD2 H -17.644 -0.683 8.175 1.00 . A A . 36 ARG HD2 1 1 8 8022 1 1 1 ARG HD3 H -16.312 0.292 8.791 1.00 . A A . 36 ARG HD3 1 1 8 8023 1 1 1 ARG HE H -15.854 0.276 6.146 1.00 . A A . 36 ARG HE 1 1 8 8024 1 1 1 ARG HG2 H -15.752 -2.078 8.862 1.00 . A A . 36 ARG HG2 1 1 8 8025 1 1 1 ARG HG3 H -14.710 -1.227 7.725 1.00 . A A . 36 ARG HG3 1 1 8 8026 1 1 1 ARG HH11 H -18.791 0.996 7.982 1.00 . A A . 36 ARG HH11 1 1 8 8027 1 1 1 ARG HH12 H -19.369 2.126 6.852 1.00 . A A . 36 ARG HH12 1 1 8 8028 1 1 1 ARG HH21 H -16.613 1.782 4.688 1.00 . A A . 36 ARG HH21 1 1 8 8029 1 1 1 ARG HH22 H -18.070 2.678 4.978 1.00 . A A . 36 ARG HH22 1 1 8 8030 1 1 1 ARG N N -17.433 -4.112 8.190 1.00 . A A . 36 ARG N 1 1 8 8031 1 1 1 ARG NE N -16.631 0.415 6.740 1.00 . A A . 36 ARG NE 1 1 8 8032 1 1 1 ARG NH1 N -18.642 1.489 7.124 1.00 . A A . 36 ARG NH1 1 1 8 8033 1 1 1 ARG NH2 N -17.429 1.961 5.263 1.00 . A A . 36 ARG NH2 1 1 8 8034 1 1 1 ARG O O -17.051 -4.299 4.952 1.00 . A A . 36 ARG O 1 1 8 8035 1 1 2 ALA C C -20.310 -4.180 3.606 1.00 . A A . 37 ALA C 1 1 8 8036 1 1 2 ALA CA C -19.655 -5.104 4.611 1.00 . A A . 37 ALA CA 1 1 8 8037 1 1 2 ALA CB C -20.634 -6.151 5.083 1.00 . A A . 37 ALA CB 1 1 8 8038 1 1 2 ALA H H -19.771 -4.091 6.448 1.00 . A A . 37 ALA H 1 1 8 8039 1 1 2 ALA HA H -18.820 -5.601 4.139 1.00 . A A . 37 ALA HA 1 1 8 8040 1 1 2 ALA HB1 H -20.139 -6.826 5.766 1.00 . A A . 37 ALA HB1 1 1 8 8041 1 1 2 ALA HB2 H -21.008 -6.699 4.231 1.00 . A A . 37 ALA HB2 1 1 8 8042 1 1 2 ALA HB3 H -21.455 -5.665 5.589 1.00 . A A . 37 ALA HB3 1 1 8 8043 1 1 2 ALA N N -19.147 -4.348 5.731 1.00 . A A . 37 ALA N 1 1 8 8044 1 1 2 ALA O O -20.561 -4.561 2.453 1.00 . A A . 37 ALA O 1 1 8 8045 1 1 3 GLN C C -20.032 -1.385 2.383 1.00 . A A . 38 GLN C 1 1 8 8046 1 1 3 GLN CA C -21.174 -2.003 3.151 1.00 . A A . 38 GLN CA 1 1 8 8047 1 1 3 GLN CB C -21.989 -0.972 3.923 1.00 . A A . 38 GLN CB 1 1 8 8048 1 1 3 GLN CD C -23.747 0.812 3.838 1.00 . A A . 38 GLN CD 1 1 8 8049 1 1 3 GLN CG C -22.756 -0.004 3.045 1.00 . A A . 38 GLN CG 1 1 8 8050 1 1 3 GLN H H -20.441 -2.743 4.973 1.00 . A A . 38 GLN H 1 1 8 8051 1 1 3 GLN HA H -21.807 -2.526 2.449 1.00 . A A . 38 GLN HA 1 1 8 8052 1 1 3 GLN HB2 H -22.705 -1.498 4.536 1.00 . A A . 38 GLN HB2 1 1 8 8053 1 1 3 GLN HB3 H -21.327 -0.404 4.559 1.00 . A A . 38 GLN HB3 1 1 8 8054 1 1 3 GLN HE21 H -25.116 -0.575 3.552 1.00 . A A . 38 GLN HE21 1 1 8 8055 1 1 3 GLN HE22 H -25.621 0.781 4.480 1.00 . A A . 38 GLN HE22 1 1 8 8056 1 1 3 GLN HG2 H -22.058 0.666 2.567 1.00 . A A . 38 GLN HG2 1 1 8 8057 1 1 3 GLN HG3 H -23.289 -0.562 2.290 1.00 . A A . 38 GLN HG3 1 1 8 8058 1 1 3 GLN N N -20.614 -2.979 4.035 1.00 . A A . 38 GLN N 1 1 8 8059 1 1 3 GLN NE2 N -24.940 0.296 3.971 1.00 . A A . 38 GLN NE2 1 1 8 8060 1 1 3 GLN O O -19.139 -0.749 2.964 1.00 . A A . 38 GLN O 1 1 8 8061 1 1 3 GLN OE1 O -23.440 1.907 4.336 1.00 . A A . 38 GLN OE1 1 1 8 8062 1 1 4 VAL C C -18.906 0.263 -0.041 1.00 . A A . 39 VAL C 1 1 8 8063 1 1 4 VAL CA C -18.940 -1.235 0.246 1.00 . A A . 39 VAL CA 1 1 8 8064 1 1 4 VAL CB C -18.934 -2.061 -1.072 1.00 . A A . 39 VAL CB 1 1 8 8065 1 1 4 VAL CG1 C -17.721 -1.734 -1.934 1.00 . A A . 39 VAL CG1 1 1 8 8066 1 1 4 VAL CG2 C -18.970 -3.548 -0.760 1.00 . A A . 39 VAL CG2 1 1 8 8067 1 1 4 VAL H H -20.822 -2.031 0.682 1.00 . A A . 39 VAL H 1 1 8 8068 1 1 4 VAL HA H -18.038 -1.478 0.788 1.00 . A A . 39 VAL HA 1 1 8 8069 1 1 4 VAL HB H -19.823 -1.813 -1.632 1.00 . A A . 39 VAL HB 1 1 8 8070 1 1 4 VAL HG11 H -17.769 -2.309 -2.846 1.00 . A A . 39 VAL HG11 1 1 8 8071 1 1 4 VAL HG12 H -16.817 -1.982 -1.398 1.00 . A A . 39 VAL HG12 1 1 8 8072 1 1 4 VAL HG13 H -17.721 -0.680 -2.172 1.00 . A A . 39 VAL HG13 1 1 8 8073 1 1 4 VAL HG21 H -19.884 -3.787 -0.236 1.00 . A A . 39 VAL HG21 1 1 8 8074 1 1 4 VAL HG22 H -18.129 -3.798 -0.131 1.00 . A A . 39 VAL HG22 1 1 8 8075 1 1 4 VAL HG23 H -18.914 -4.120 -1.675 1.00 . A A . 39 VAL HG23 1 1 8 8076 1 1 4 VAL N N -20.038 -1.607 1.096 1.00 . A A . 39 VAL N 1 1 8 8077 1 1 4 VAL O O -19.389 0.744 -1.076 1.00 . A A . 39 VAL O 1 1 8 8078 1 1 5 LYS C C -16.672 2.606 1.076 1.00 . A A . 40 LYS C 1 1 8 8079 1 1 5 LYS CA C -18.116 2.395 0.747 1.00 . A A . 40 LYS CA 1 1 8 8080 1 1 5 LYS CB C -18.993 3.302 1.614 1.00 . A A . 40 LYS CB 1 1 8 8081 1 1 5 LYS CD C -21.222 4.392 2.014 1.00 . A A . 40 LYS CD 1 1 8 8082 1 1 5 LYS CE C -21.104 4.298 3.528 1.00 . A A . 40 LYS CE 1 1 8 8083 1 1 5 LYS CG C -20.482 3.264 1.298 1.00 . A A . 40 LYS CG 1 1 8 8084 1 1 5 LYS H H -18.230 0.554 1.775 1.00 . A A . 40 LYS H 1 1 8 8085 1 1 5 LYS HA H -18.253 2.625 -0.298 1.00 . A A . 40 LYS HA 1 1 8 8086 1 1 5 LYS HB2 H -18.863 2.998 2.642 1.00 . A A . 40 LYS HB2 1 1 8 8087 1 1 5 LYS HB3 H -18.646 4.319 1.509 1.00 . A A . 40 LYS HB3 1 1 8 8088 1 1 5 LYS HD2 H -20.813 5.339 1.695 1.00 . A A . 40 LYS HD2 1 1 8 8089 1 1 5 LYS HD3 H -22.266 4.344 1.738 1.00 . A A . 40 LYS HD3 1 1 8 8090 1 1 5 LYS HE2 H -21.636 3.419 3.856 1.00 . A A . 40 LYS HE2 1 1 8 8091 1 1 5 LYS HE3 H -20.063 4.213 3.799 1.00 . A A . 40 LYS HE3 1 1 8 8092 1 1 5 LYS HG2 H -20.618 3.372 0.232 1.00 . A A . 40 LYS HG2 1 1 8 8093 1 1 5 LYS HG3 H -20.885 2.316 1.622 1.00 . A A . 40 LYS HG3 1 1 8 8094 1 1 5 LYS HZ1 H -21.181 6.338 3.901 1.00 . A A . 40 LYS HZ1 1 1 8 8095 1 1 5 LYS HZ2 H -21.612 5.412 5.232 1.00 . A A . 40 LYS HZ2 1 1 8 8096 1 1 5 LYS HZ3 H -22.686 5.603 3.946 1.00 . A A . 40 LYS HZ3 1 1 8 8097 1 1 5 LYS N N -18.401 0.991 0.909 1.00 . A A . 40 LYS N 1 1 8 8098 1 1 5 LYS NZ N -21.686 5.479 4.197 1.00 . A A . 40 LYS NZ 1 1 8 8099 1 1 5 LYS O O -16.239 3.704 1.432 1.00 . A A . 40 LYS O 1 1 8 8100 1 1 6 GLU C C -13.825 2.009 0.020 1.00 . A A . 41 GLU C 1 1 8 8101 1 1 6 GLU CA C -14.536 1.554 1.224 1.00 . A A . 41 GLU CA 1 1 8 8102 1 1 6 GLU CB C -14.039 0.145 1.530 1.00 . A A . 41 GLU CB 1 1 8 8103 1 1 6 GLU CD C -14.647 0.095 3.981 1.00 . A A . 41 GLU CD 1 1 8 8104 1 1 6 GLU CG C -14.762 -0.576 2.632 1.00 . A A . 41 GLU CG 1 1 8 8105 1 1 6 GLU H H -16.360 0.760 0.535 1.00 . A A . 41 GLU H 1 1 8 8106 1 1 6 GLU HA H -14.338 2.195 2.069 1.00 . A A . 41 GLU HA 1 1 8 8107 1 1 6 GLU HB2 H -14.130 -0.450 0.633 1.00 . A A . 41 GLU HB2 1 1 8 8108 1 1 6 GLU HB3 H -12.993 0.206 1.793 1.00 . A A . 41 GLU HB3 1 1 8 8109 1 1 6 GLU HG2 H -15.803 -0.702 2.373 1.00 . A A . 41 GLU HG2 1 1 8 8110 1 1 6 GLU HG3 H -14.260 -1.531 2.671 1.00 . A A . 41 GLU HG3 1 1 8 8111 1 1 6 GLU N N -15.932 1.553 0.914 1.00 . A A . 41 GLU N 1 1 8 8112 1 1 6 GLU O O -14.037 1.479 -1.065 1.00 . A A . 41 GLU O 1 1 8 8113 1 1 6 GLU OE1 O -15.216 1.171 4.165 1.00 . A A . 41 GLU OE1 1 1 8 8114 1 1 6 GLU OE2 O -14.031 -0.484 4.894 1.00 . A A . 41 GLU OE2 1 1 8 8115 1 1 7 THR C C -10.801 3.203 -0.649 1.00 . A A . 42 THR C 1 1 8 8116 1 1 7 THR CA C -12.267 3.400 -0.947 1.00 . A A . 42 THR CA 1 1 8 8117 1 1 7 THR CB C -12.545 4.867 -1.262 1.00 . A A . 42 THR CB 1 1 8 8118 1 1 7 THR CG2 C -12.818 5.014 -2.754 1.00 . A A . 42 THR CG2 1 1 8 8119 1 1 7 THR H H -12.812 3.288 1.075 1.00 . A A . 42 THR H 1 1 8 8120 1 1 7 THR HA H -12.603 2.782 -1.772 1.00 . A A . 42 THR HA 1 1 8 8121 1 1 7 THR HB H -11.674 5.454 -1.011 1.00 . A A . 42 THR HB 1 1 8 8122 1 1 7 THR HG1 H -14.139 4.514 -0.179 1.00 . A A . 42 THR HG1 1 1 8 8123 1 1 7 THR HG21 H -11.944 4.710 -3.312 1.00 . A A . 42 THR HG21 1 1 8 8124 1 1 7 THR HG22 H -13.060 6.041 -2.984 1.00 . A A . 42 THR HG22 1 1 8 8125 1 1 7 THR HG23 H -13.651 4.377 -3.018 1.00 . A A . 42 THR HG23 1 1 8 8126 1 1 7 THR N N -12.992 2.943 0.173 1.00 . A A . 42 THR N 1 1 8 8127 1 1 7 THR O O -10.368 3.322 0.491 1.00 . A A . 42 THR O 1 1 8 8128 1 1 7 THR OG1 O -13.719 5.301 -0.544 1.00 . A A . 42 THR OG1 1 1 8 8129 1 1 8 CYS C C -7.837 3.822 -1.540 1.00 . A A . 43 CYS C 1 1 8 8130 1 1 8 CYS CA C -8.692 2.568 -1.533 1.00 . A A . 43 CYS CA 1 1 8 8131 1 1 8 CYS CB C -8.386 1.627 -2.676 1.00 . A A . 43 CYS CB 1 1 8 8132 1 1 8 CYS H H -10.476 2.860 -2.541 1.00 . A A . 43 CYS H 1 1 8 8133 1 1 8 CYS HA H -8.538 2.031 -0.608 1.00 . A A . 43 CYS HA 1 1 8 8134 1 1 8 CYS HB2 H -8.570 0.628 -2.312 1.00 . A A . 43 CYS HB2 1 1 8 8135 1 1 8 CYS HB3 H -9.085 1.786 -3.482 1.00 . A A . 43 CYS HB3 1 1 8 8136 1 1 8 CYS N N -10.072 2.882 -1.645 1.00 . A A . 43 CYS N 1 1 8 8137 1 1 8 CYS O O -8.250 4.853 -2.040 1.00 . A A . 43 CYS O 1 1 8 8138 1 1 8 CYS SG S -6.731 1.582 -3.309 1.00 . A A . 43 CYS SG 1 1 8 8139 1 1 9 ALA C C -4.587 4.684 -1.832 1.00 . A A . 44 ALA C 1 1 8 8140 1 1 9 ALA CA C -5.755 4.856 -0.871 1.00 . A A . 44 ALA CA 1 1 8 8141 1 1 9 ALA CB C -5.235 5.032 0.529 1.00 . A A . 44 ALA CB 1 1 8 8142 1 1 9 ALA H H -6.460 2.910 -0.448 1.00 . A A . 44 ALA H 1 1 8 8143 1 1 9 ALA HA H -6.297 5.754 -1.127 1.00 . A A . 44 ALA HA 1 1 8 8144 1 1 9 ALA HB1 H -4.658 5.944 0.544 1.00 . A A . 44 ALA HB1 1 1 8 8145 1 1 9 ALA HB2 H -4.608 4.193 0.793 1.00 . A A . 44 ALA HB2 1 1 8 8146 1 1 9 ALA HB3 H -6.073 5.120 1.202 1.00 . A A . 44 ALA HB3 1 1 8 8147 1 1 9 ALA N N -6.677 3.740 -0.923 1.00 . A A . 44 ALA N 1 1 8 8148 1 1 9 ALA O O -3.927 5.643 -2.177 1.00 . A A . 44 ALA O 1 1 8 8149 1 1 10 ALA C C -3.520 3.326 -4.601 1.00 . A A . 45 ALA C 1 1 8 8150 1 1 10 ALA CA C -3.199 3.180 -3.122 1.00 . A A . 45 ALA CA 1 1 8 8151 1 1 10 ALA CB C -2.680 1.795 -2.818 1.00 . A A . 45 ALA CB 1 1 8 8152 1 1 10 ALA H H -4.979 2.730 -2.089 1.00 . A A . 45 ALA H 1 1 8 8153 1 1 10 ALA HA H -2.430 3.892 -2.861 1.00 . A A . 45 ALA HA 1 1 8 8154 1 1 10 ALA HB1 H -2.520 1.712 -1.750 1.00 . A A . 45 ALA HB1 1 1 8 8155 1 1 10 ALA HB2 H -1.745 1.645 -3.338 1.00 . A A . 45 ALA HB2 1 1 8 8156 1 1 10 ALA HB3 H -3.398 1.054 -3.139 1.00 . A A . 45 ALA HB3 1 1 8 8157 1 1 10 ALA N N -4.359 3.460 -2.292 1.00 . A A . 45 ALA N 1 1 8 8158 1 1 10 ALA O O -2.650 3.613 -5.413 1.00 . A A . 45 ALA O 1 1 8 8159 1 1 11 CYS C C -6.576 3.972 -6.358 1.00 . A A . 46 CYS C 1 1 8 8160 1 1 11 CYS CA C -5.227 3.232 -6.303 1.00 . A A . 46 CYS CA 1 1 8 8161 1 1 11 CYS CB C -5.209 1.849 -7.034 1.00 . A A . 46 CYS CB 1 1 8 8162 1 1 11 CYS H H -5.401 2.835 -4.242 1.00 . A A . 46 CYS H 1 1 8 8163 1 1 11 CYS HA H -4.506 3.882 -6.778 1.00 . A A . 46 CYS HA 1 1 8 8164 1 1 11 CYS HB2 H -4.615 1.726 -7.924 1.00 . A A . 46 CYS HB2 1 1 8 8165 1 1 11 CYS HB3 H -4.482 1.398 -6.370 1.00 . A A . 46 CYS HB3 1 1 8 8166 1 1 11 CYS N N -4.767 3.099 -4.939 1.00 . A A . 46 CYS N 1 1 8 8167 1 1 11 CYS O O -7.167 4.135 -7.409 1.00 . A A . 46 CYS O 1 1 8 8168 1 1 11 CYS SG S -6.644 0.736 -6.856 1.00 . A A . 46 CYS SG 1 1 8 8169 1 1 12 GLN C C -9.523 4.668 -5.698 1.00 . A A . 47 GLN C 1 1 8 8170 1 1 12 GLN CA C -8.280 5.202 -4.966 1.00 . A A . 47 GLN CA 1 1 8 8171 1 1 12 GLN CB C -8.074 6.701 -5.129 1.00 . A A . 47 GLN CB 1 1 8 8172 1 1 12 GLN CD C -6.828 8.730 -4.189 1.00 . A A . 47 GLN CD 1 1 8 8173 1 1 12 GLN CG C -7.149 7.255 -4.051 1.00 . A A . 47 GLN CG 1 1 8 8174 1 1 12 GLN H H -6.465 4.298 -4.376 1.00 . A A . 47 GLN H 1 1 8 8175 1 1 12 GLN HA H -8.470 5.027 -3.917 1.00 . A A . 47 GLN HA 1 1 8 8176 1 1 12 GLN HB2 H -7.670 6.918 -6.107 1.00 . A A . 47 GLN HB2 1 1 8 8177 1 1 12 GLN HB3 H -9.042 7.165 -5.011 1.00 . A A . 47 GLN HB3 1 1 8 8178 1 1 12 GLN HE21 H -5.080 8.433 -3.338 1.00 . A A . 47 GLN HE21 1 1 8 8179 1 1 12 GLN HE22 H -5.416 10.060 -3.805 1.00 . A A . 47 GLN HE22 1 1 8 8180 1 1 12 GLN HG2 H -7.636 7.110 -3.097 1.00 . A A . 47 GLN HG2 1 1 8 8181 1 1 12 GLN HG3 H -6.242 6.672 -4.071 1.00 . A A . 47 GLN HG3 1 1 8 8182 1 1 12 GLN N N -7.026 4.434 -5.166 1.00 . A A . 47 GLN N 1 1 8 8183 1 1 12 GLN NE2 N -5.662 9.115 -3.735 1.00 . A A . 47 GLN NE2 1 1 8 8184 1 1 12 GLN O O -10.377 5.421 -6.161 1.00 . A A . 47 GLN O 1 1 8 8185 1 1 12 GLN OE1 O -7.629 9.521 -4.692 1.00 . A A . 47 GLN OE1 1 1 8 8186 1 1 13 LYS C C -11.490 2.079 -5.214 1.00 . A A . 48 LYS C 1 1 8 8187 1 1 13 LYS CA C -10.703 2.647 -6.352 1.00 . A A . 48 LYS CA 1 1 8 8188 1 1 13 LYS CB C -10.168 1.504 -7.228 1.00 . A A . 48 LYS CB 1 1 8 8189 1 1 13 LYS CD C -10.311 2.685 -9.429 1.00 . A A . 48 LYS CD 1 1 8 8190 1 1 13 LYS CE C -11.387 1.756 -9.986 1.00 . A A . 48 LYS CE 1 1 8 8191 1 1 13 LYS CG C -9.412 1.951 -8.470 1.00 . A A . 48 LYS CG 1 1 8 8192 1 1 13 LYS H H -8.856 2.852 -5.415 1.00 . A A . 48 LYS H 1 1 8 8193 1 1 13 LYS HA H -11.327 3.302 -6.937 1.00 . A A . 48 LYS HA 1 1 8 8194 1 1 13 LYS HB2 H -9.473 0.928 -6.635 1.00 . A A . 48 LYS HB2 1 1 8 8195 1 1 13 LYS HB3 H -10.985 0.866 -7.525 1.00 . A A . 48 LYS HB3 1 1 8 8196 1 1 13 LYS HD2 H -10.761 3.480 -8.855 1.00 . A A . 48 LYS HD2 1 1 8 8197 1 1 13 LYS HD3 H -9.718 3.096 -10.231 1.00 . A A . 48 LYS HD3 1 1 8 8198 1 1 13 LYS HE2 H -10.906 0.936 -10.497 1.00 . A A . 48 LYS HE2 1 1 8 8199 1 1 13 LYS HE3 H -11.975 1.366 -9.169 1.00 . A A . 48 LYS HE3 1 1 8 8200 1 1 13 LYS HG2 H -8.607 2.607 -8.175 1.00 . A A . 48 LYS HG2 1 1 8 8201 1 1 13 LYS HG3 H -9.007 1.078 -8.961 1.00 . A A . 48 LYS HG3 1 1 8 8202 1 1 13 LYS HZ1 H -12.980 1.742 -11.289 1.00 . A A . 48 LYS HZ1 1 1 8 8203 1 1 13 LYS HZ2 H -11.748 2.821 -11.736 1.00 . A A . 48 LYS HZ2 1 1 8 8204 1 1 13 LYS HZ3 H -12.794 3.202 -10.468 1.00 . A A . 48 LYS HZ3 1 1 8 8205 1 1 13 LYS N N -9.596 3.371 -5.775 1.00 . A A . 48 LYS N 1 1 8 8206 1 1 13 LYS NZ N -12.281 2.428 -10.935 1.00 . A A . 48 LYS NZ 1 1 8 8207 1 1 13 LYS O O -10.932 1.871 -4.139 1.00 . A A . 48 LYS O 1 1 8 8208 1 1 14 THR C C -13.133 -0.130 -4.111 1.00 . A A . 49 THR C 1 1 8 8209 1 1 14 THR CA C -13.574 1.315 -4.376 1.00 . A A . 49 THR CA 1 1 8 8210 1 1 14 THR CB C -15.018 1.341 -4.791 1.00 . A A . 49 THR CB 1 1 8 8211 1 1 14 THR CG2 C -15.883 1.229 -3.562 1.00 . A A . 49 THR CG2 1 1 8 8212 1 1 14 THR H H -13.212 2.196 -6.213 1.00 . A A . 49 THR H 1 1 8 8213 1 1 14 THR HA H -13.466 1.883 -3.470 1.00 . A A . 49 THR HA 1 1 8 8214 1 1 14 THR HB H -15.187 0.489 -5.424 1.00 . A A . 49 THR HB 1 1 8 8215 1 1 14 THR HG1 H -16.140 2.485 -5.908 1.00 . A A . 49 THR HG1 1 1 8 8216 1 1 14 THR HG21 H -15.476 1.929 -2.840 1.00 . A A . 49 THR HG21 1 1 8 8217 1 1 14 THR HG22 H -15.842 0.212 -3.195 1.00 . A A . 49 THR HG22 1 1 8 8218 1 1 14 THR HG23 H -16.902 1.494 -3.797 1.00 . A A . 49 THR HG23 1 1 8 8219 1 1 14 THR N N -12.759 1.901 -5.394 1.00 . A A . 49 THR N 1 1 8 8220 1 1 14 THR O O -12.921 -0.915 -5.055 1.00 . A A . 49 THR O 1 1 8 8221 1 1 14 THR OG1 O -15.296 2.588 -5.457 1.00 . A A . 49 THR OG1 1 1 8 8222 1 1 15 VAL C C -13.621 -2.681 -2.200 1.00 . A A . 50 VAL C 1 1 8 8223 1 1 15 VAL CA C -12.467 -1.782 -2.506 1.00 . A A . 50 VAL CA 1 1 8 8224 1 1 15 VAL CB C -11.513 -1.782 -1.295 1.00 . A A . 50 VAL CB 1 1 8 8225 1 1 15 VAL CG1 C -10.451 -2.818 -1.522 1.00 . A A . 50 VAL CG1 1 1 8 8226 1 1 15 VAL CG2 C -10.907 -0.417 -1.070 1.00 . A A . 50 VAL CG2 1 1 8 8227 1 1 15 VAL H H -13.209 0.174 -2.154 1.00 . A A . 50 VAL H 1 1 8 8228 1 1 15 VAL HA H -11.925 -2.146 -3.368 1.00 . A A . 50 VAL HA 1 1 8 8229 1 1 15 VAL HB H -12.033 -2.111 -0.401 1.00 . A A . 50 VAL HB 1 1 8 8230 1 1 15 VAL HG11 H -9.981 -2.645 -2.480 1.00 . A A . 50 VAL HG11 1 1 8 8231 1 1 15 VAL HG12 H -10.873 -3.812 -1.501 1.00 . A A . 50 VAL HG12 1 1 8 8232 1 1 15 VAL HG13 H -9.697 -2.719 -0.756 1.00 . A A . 50 VAL HG13 1 1 8 8233 1 1 15 VAL HG21 H -11.694 0.284 -0.834 1.00 . A A . 50 VAL HG21 1 1 8 8234 1 1 15 VAL HG22 H -10.431 -0.093 -1.989 1.00 . A A . 50 VAL HG22 1 1 8 8235 1 1 15 VAL HG23 H -10.190 -0.451 -0.264 1.00 . A A . 50 VAL HG23 1 1 8 8236 1 1 15 VAL N N -12.958 -0.471 -2.853 1.00 . A A . 50 VAL N 1 1 8 8237 1 1 15 VAL O O -14.547 -2.291 -1.491 1.00 . A A . 50 VAL O 1 1 8 8238 1 1 16 TYR C C -14.199 -5.807 -1.494 1.00 . A A . 51 TYR C 1 1 8 8239 1 1 16 TYR CA C -14.649 -4.796 -2.540 1.00 . A A . 51 TYR CA 1 1 8 8240 1 1 16 TYR CB C -14.964 -5.455 -3.883 1.00 . A A . 51 TYR CB 1 1 8 8241 1 1 16 TYR CD1 C -15.882 -3.412 -5.016 1.00 . A A . 51 TYR CD1 1 1 8 8242 1 1 16 TYR CD2 C -14.174 -4.624 -6.116 1.00 . A A . 51 TYR CD2 1 1 8 8243 1 1 16 TYR CE1 C -15.924 -2.508 -6.056 1.00 . A A . 51 TYR CE1 1 1 8 8244 1 1 16 TYR CE2 C -14.201 -3.735 -7.162 1.00 . A A . 51 TYR CE2 1 1 8 8245 1 1 16 TYR CG C -15.013 -4.477 -5.030 1.00 . A A . 51 TYR CG 1 1 8 8246 1 1 16 TYR CZ C -15.075 -2.678 -7.130 1.00 . A A . 51 TYR CZ 1 1 8 8247 1 1 16 TYR H H -12.770 -4.162 -3.198 1.00 . A A . 51 TYR H 1 1 8 8248 1 1 16 TYR HA H -15.509 -4.254 -2.177 1.00 . A A . 51 TYR HA 1 1 8 8249 1 1 16 TYR HB2 H -14.192 -6.163 -4.115 1.00 . A A . 51 TYR HB2 1 1 8 8250 1 1 16 TYR HB3 H -15.920 -5.955 -3.829 1.00 . A A . 51 TYR HB3 1 1 8 8251 1 1 16 TYR HD1 H -16.518 -3.314 -4.152 1.00 . A A . 51 TYR HD1 1 1 8 8252 1 1 16 TYR HD2 H -13.488 -5.457 -6.136 1.00 . A A . 51 TYR HD2 1 1 8 8253 1 1 16 TYR HE1 H -16.615 -1.677 -6.023 1.00 . A A . 51 TYR HE1 1 1 8 8254 1 1 16 TYR HE2 H -13.537 -3.868 -8.003 1.00 . A A . 51 TYR HE2 1 1 8 8255 1 1 16 TYR HH H -15.058 -2.322 -8.984 1.00 . A A . 51 TYR HH 1 1 8 8256 1 1 16 TYR N N -13.571 -3.868 -2.712 1.00 . A A . 51 TYR N 1 1 8 8257 1 1 16 TYR O O -12.997 -6.000 -1.348 1.00 . A A . 51 TYR O 1 1 8 8258 1 1 16 TYR OH O -15.098 -1.792 -8.175 1.00 . A A . 51 TYR OH 1 1 8 8259 1 1 17 PRO C C -13.620 -8.289 0.258 1.00 . A A . 52 PRO C 1 1 8 8260 1 1 17 PRO CA C -14.814 -7.324 0.393 1.00 . A A . 52 PRO CA 1 1 8 8261 1 1 17 PRO CB C -16.084 -8.106 0.618 1.00 . A A . 52 PRO CB 1 1 8 8262 1 1 17 PRO CD C -16.585 -6.487 -1.064 1.00 . A A . 52 PRO CD 1 1 8 8263 1 1 17 PRO CG C -17.166 -7.227 0.105 1.00 . A A . 52 PRO CG 1 1 8 8264 1 1 17 PRO HA H -14.644 -6.711 1.262 1.00 . A A . 52 PRO HA 1 1 8 8265 1 1 17 PRO HB2 H -15.987 -9.017 0.055 1.00 . A A . 52 PRO HB2 1 1 8 8266 1 1 17 PRO HB3 H -16.204 -8.330 1.668 1.00 . A A . 52 PRO HB3 1 1 8 8267 1 1 17 PRO HD2 H -16.801 -7.004 -1.986 1.00 . A A . 52 PRO HD2 1 1 8 8268 1 1 17 PRO HD3 H -16.968 -5.478 -1.102 1.00 . A A . 52 PRO HD3 1 1 8 8269 1 1 17 PRO HG2 H -18.007 -7.826 -0.212 1.00 . A A . 52 PRO HG2 1 1 8 8270 1 1 17 PRO HG3 H -17.470 -6.535 0.877 1.00 . A A . 52 PRO HG3 1 1 8 8271 1 1 17 PRO N N -15.129 -6.488 -0.788 1.00 . A A . 52 PRO N 1 1 8 8272 1 1 17 PRO O O -12.825 -8.413 1.197 1.00 . A A . 52 PRO O 1 1 8 8273 1 1 18 MET C C -11.011 -9.202 -1.107 1.00 . A A . 53 MET C 1 1 8 8274 1 1 18 MET CA C -12.371 -9.897 -1.031 1.00 . A A . 53 MET CA 1 1 8 8275 1 1 18 MET CB C -12.581 -10.804 -2.231 1.00 . A A . 53 MET CB 1 1 8 8276 1 1 18 MET CE C -10.313 -13.976 -3.666 1.00 . A A . 53 MET CE 1 1 8 8277 1 1 18 MET CG C -11.522 -11.877 -2.364 1.00 . A A . 53 MET CG 1 1 8 8278 1 1 18 MET H H -14.065 -8.779 -1.643 1.00 . A A . 53 MET H 1 1 8 8279 1 1 18 MET HA H -12.359 -10.511 -0.144 1.00 . A A . 53 MET HA 1 1 8 8280 1 1 18 MET HB2 H -13.539 -11.286 -2.105 1.00 . A A . 53 MET HB2 1 1 8 8281 1 1 18 MET HB3 H -12.586 -10.208 -3.132 1.00 . A A . 53 MET HB3 1 1 8 8282 1 1 18 MET HE1 H -10.365 -14.520 -2.735 1.00 . A A . 53 MET HE1 1 1 8 8283 1 1 18 MET HE2 H -9.419 -13.372 -3.681 1.00 . A A . 53 MET HE2 1 1 8 8284 1 1 18 MET HE3 H -10.288 -14.673 -4.490 1.00 . A A . 53 MET HE3 1 1 8 8285 1 1 18 MET HG2 H -10.558 -11.394 -2.398 1.00 . A A . 53 MET HG2 1 1 8 8286 1 1 18 MET HG3 H -11.566 -12.500 -1.483 1.00 . A A . 53 MET HG3 1 1 8 8287 1 1 18 MET N N -13.462 -8.942 -0.884 1.00 . A A . 53 MET N 1 1 8 8288 1 1 18 MET O O -10.032 -9.661 -0.521 1.00 . A A . 53 MET O 1 1 8 8289 1 1 18 MET SD S -11.748 -12.914 -3.816 1.00 . A A . 53 MET SD 1 1 8 8290 1 1 19 GLU C C -9.508 -6.317 -0.898 1.00 . A A . 54 GLU C 1 1 8 8291 1 1 19 GLU CA C -9.725 -7.367 -1.938 1.00 . A A . 54 GLU CA 1 1 8 8292 1 1 19 GLU CB C -9.644 -6.789 -3.319 1.00 . A A . 54 GLU CB 1 1 8 8293 1 1 19 GLU CD C -9.273 -7.322 -5.723 1.00 . A A . 54 GLU CD 1 1 8 8294 1 1 19 GLU CG C -9.528 -7.862 -4.356 1.00 . A A . 54 GLU CG 1 1 8 8295 1 1 19 GLU H H -11.762 -7.689 -2.172 1.00 . A A . 54 GLU H 1 1 8 8296 1 1 19 GLU HA H -8.934 -8.096 -1.842 1.00 . A A . 54 GLU HA 1 1 8 8297 1 1 19 GLU HB2 H -10.565 -6.251 -3.493 1.00 . A A . 54 GLU HB2 1 1 8 8298 1 1 19 GLU HB3 H -8.827 -6.091 -3.409 1.00 . A A . 54 GLU HB3 1 1 8 8299 1 1 19 GLU HG2 H -8.739 -8.526 -4.045 1.00 . A A . 54 GLU HG2 1 1 8 8300 1 1 19 GLU HG3 H -10.454 -8.418 -4.353 1.00 . A A . 54 GLU HG3 1 1 8 8301 1 1 19 GLU N N -10.960 -8.076 -1.766 1.00 . A A . 54 GLU N 1 1 8 8302 1 1 19 GLU O O -8.409 -5.805 -0.773 1.00 . A A . 54 GLU O 1 1 8 8303 1 1 19 GLU OE1 O -10.227 -6.893 -6.369 1.00 . A A . 54 GLU OE1 1 1 8 8304 1 1 19 GLU OE2 O -8.095 -7.313 -6.175 1.00 . A A . 54 GLU OE2 1 1 8 8305 1 1 20 ARG C C -9.575 -5.519 2.012 1.00 . A A . 55 ARG C 1 1 8 8306 1 1 20 ARG CA C -10.478 -5.025 0.909 1.00 . A A . 55 ARG CA 1 1 8 8307 1 1 20 ARG CB C -11.855 -4.642 1.436 1.00 . A A . 55 ARG CB 1 1 8 8308 1 1 20 ARG CD C -13.142 -3.885 3.420 1.00 . A A . 55 ARG CD 1 1 8 8309 1 1 20 ARG CG C -11.825 -3.833 2.694 1.00 . A A . 55 ARG CG 1 1 8 8310 1 1 20 ARG CZ C -12.671 -3.224 5.776 1.00 . A A . 55 ARG CZ 1 1 8 8311 1 1 20 ARG H H -11.422 -6.409 -0.370 1.00 . A A . 55 ARG H 1 1 8 8312 1 1 20 ARG HA H -10.012 -4.146 0.499 1.00 . A A . 55 ARG HA 1 1 8 8313 1 1 20 ARG HB2 H -12.339 -4.002 0.707 1.00 . A A . 55 ARG HB2 1 1 8 8314 1 1 20 ARG HB3 H -12.447 -5.520 1.572 1.00 . A A . 55 ARG HB3 1 1 8 8315 1 1 20 ARG HD2 H -13.933 -3.610 2.737 1.00 . A A . 55 ARG HD2 1 1 8 8316 1 1 20 ARG HD3 H -13.302 -4.892 3.773 1.00 . A A . 55 ARG HD3 1 1 8 8317 1 1 20 ARG HE H -13.487 -2.065 4.387 1.00 . A A . 55 ARG HE 1 1 8 8318 1 1 20 ARG HG2 H -11.049 -4.221 3.337 1.00 . A A . 55 ARG HG2 1 1 8 8319 1 1 20 ARG HG3 H -11.601 -2.807 2.442 1.00 . A A . 55 ARG HG3 1 1 8 8320 1 1 20 ARG HH11 H -12.223 -5.197 5.468 1.00 . A A . 55 ARG HH11 1 1 8 8321 1 1 20 ARG HH12 H -11.873 -4.641 7.032 1.00 . A A . 55 ARG HH12 1 1 8 8322 1 1 20 ARG HH21 H -13.027 -1.347 6.343 1.00 . A A . 55 ARG HH21 1 1 8 8323 1 1 20 ARG HH22 H -12.352 -2.306 7.598 1.00 . A A . 55 ARG HH22 1 1 8 8324 1 1 20 ARG N N -10.557 -5.992 -0.161 1.00 . A A . 55 ARG N 1 1 8 8325 1 1 20 ARG NE N -13.131 -2.975 4.555 1.00 . A A . 55 ARG NE 1 1 8 8326 1 1 20 ARG NH1 N -12.227 -4.432 6.116 1.00 . A A . 55 ARG NH1 1 1 8 8327 1 1 20 ARG NH2 N -12.674 -2.241 6.650 1.00 . A A . 55 ARG NH2 1 1 8 8328 1 1 20 ARG O O -9.942 -6.362 2.832 1.00 . A A . 55 ARG O 1 1 8 8329 1 1 21 LEU C C -7.086 -4.060 3.640 1.00 . A A . 56 LEU C 1 1 8 8330 1 1 21 LEU CA C -7.379 -5.338 2.890 1.00 . A A . 56 LEU CA 1 1 8 8331 1 1 21 LEU CB C -6.145 -5.879 2.115 1.00 . A A . 56 LEU CB 1 1 8 8332 1 1 21 LEU CD1 C -3.989 -7.089 2.136 1.00 . A A . 56 LEU CD1 1 1 8 8333 1 1 21 LEU CD2 C -4.028 -4.799 2.925 1.00 . A A . 56 LEU CD2 1 1 8 8334 1 1 21 LEU CG C -4.824 -6.089 2.872 1.00 . A A . 56 LEU CG 1 1 8 8335 1 1 21 LEU H H -8.165 -4.481 1.195 1.00 . A A . 56 LEU H 1 1 8 8336 1 1 21 LEU HA H -7.732 -6.097 3.570 1.00 . A A . 56 LEU HA 1 1 8 8337 1 1 21 LEU HB2 H -6.423 -6.829 1.684 1.00 . A A . 56 LEU HB2 1 1 8 8338 1 1 21 LEU HB3 H -5.953 -5.199 1.298 1.00 . A A . 56 LEU HB3 1 1 8 8339 1 1 21 LEU HD11 H -4.538 -8.008 1.997 1.00 . A A . 56 LEU HD11 1 1 8 8340 1 1 21 LEU HD12 H -3.106 -7.275 2.727 1.00 . A A . 56 LEU HD12 1 1 8 8341 1 1 21 LEU HD13 H -3.707 -6.665 1.183 1.00 . A A . 56 LEU HD13 1 1 8 8342 1 1 21 LEU HD21 H -3.785 -4.482 1.921 1.00 . A A . 56 LEU HD21 1 1 8 8343 1 1 21 LEU HD22 H -3.123 -4.960 3.490 1.00 . A A . 56 LEU HD22 1 1 8 8344 1 1 21 LEU HD23 H -4.623 -4.037 3.407 1.00 . A A . 56 LEU HD23 1 1 8 8345 1 1 21 LEU HG H -5.005 -6.422 3.883 1.00 . A A . 56 LEU HG 1 1 8 8346 1 1 21 LEU N N -8.402 -5.063 1.953 1.00 . A A . 56 LEU N 1 1 8 8347 1 1 21 LEU O O -7.362 -2.969 3.146 1.00 . A A . 56 LEU O 1 1 8 8348 1 1 22 VAL C C -4.732 -3.064 5.916 1.00 . A A . 57 VAL C 1 1 8 8349 1 1 22 VAL CA C -6.217 -3.019 5.555 1.00 . A A . 57 VAL CA 1 1 8 8350 1 1 22 VAL CB C -7.141 -2.760 6.793 1.00 . A A . 57 VAL CB 1 1 8 8351 1 1 22 VAL CG1 C -7.198 -3.940 7.751 1.00 . A A . 57 VAL CG1 1 1 8 8352 1 1 22 VAL CG2 C -6.741 -1.480 7.510 1.00 . A A . 57 VAL CG2 1 1 8 8353 1 1 22 VAL H H -6.469 -5.062 5.227 1.00 . A A . 57 VAL H 1 1 8 8354 1 1 22 VAL HA H -6.335 -2.195 4.866 1.00 . A A . 57 VAL HA 1 1 8 8355 1 1 22 VAL HB H -8.142 -2.622 6.411 1.00 . A A . 57 VAL HB 1 1 8 8356 1 1 22 VAL HG11 H -7.837 -3.687 8.584 1.00 . A A . 57 VAL HG11 1 1 8 8357 1 1 22 VAL HG12 H -6.205 -4.169 8.105 1.00 . A A . 57 VAL HG12 1 1 8 8358 1 1 22 VAL HG13 H -7.611 -4.790 7.229 1.00 . A A . 57 VAL HG13 1 1 8 8359 1 1 22 VAL HG21 H -5.707 -1.544 7.815 1.00 . A A . 57 VAL HG21 1 1 8 8360 1 1 22 VAL HG22 H -7.370 -1.316 8.373 1.00 . A A . 57 VAL HG22 1 1 8 8361 1 1 22 VAL HG23 H -6.859 -0.651 6.824 1.00 . A A . 57 VAL HG23 1 1 8 8362 1 1 22 VAL N N -6.593 -4.176 4.824 1.00 . A A . 57 VAL N 1 1 8 8363 1 1 22 VAL O O -4.283 -3.902 6.723 1.00 . A A . 57 VAL O 1 1 8 8364 1 1 23 ALA C C -2.348 -0.761 6.136 1.00 . A A . 58 ALA C 1 1 8 8365 1 1 23 ALA CA C -2.550 -2.121 5.579 1.00 . A A . 58 ALA CA 1 1 8 8366 1 1 23 ALA CB C -1.646 -2.312 4.330 1.00 . A A . 58 ALA CB 1 1 8 8367 1 1 23 ALA H H -4.355 -1.627 4.589 1.00 . A A . 58 ALA H 1 1 8 8368 1 1 23 ALA HA H -2.311 -2.865 6.324 1.00 . A A . 58 ALA HA 1 1 8 8369 1 1 23 ALA HB1 H -1.777 -1.475 3.656 1.00 . A A . 58 ALA HB1 1 1 8 8370 1 1 23 ALA HB2 H -1.899 -3.211 3.787 1.00 . A A . 58 ALA HB2 1 1 8 8371 1 1 23 ALA HB3 H -0.600 -2.362 4.601 1.00 . A A . 58 ALA HB3 1 1 8 8372 1 1 23 ALA N N -3.956 -2.229 5.258 1.00 . A A . 58 ALA N 1 1 8 8373 1 1 23 ALA O O -2.854 0.197 5.568 1.00 . A A . 58 ALA O 1 1 8 8374 1 1 24 ASP C C -2.543 1.448 8.140 1.00 . A A . 59 ASP C 1 1 8 8375 1 1 24 ASP CA C -1.284 0.612 7.887 1.00 . A A . 59 ASP CA 1 1 8 8376 1 1 24 ASP CB C -0.265 1.437 7.109 1.00 . A A . 59 ASP CB 1 1 8 8377 1 1 24 ASP CG C 0.680 0.638 6.213 1.00 . A A . 59 ASP CG 1 1 8 8378 1 1 24 ASP H H -1.197 -1.482 7.580 1.00 . A A . 59 ASP H 1 1 8 8379 1 1 24 ASP HA H -0.863 0.359 8.849 1.00 . A A . 59 ASP HA 1 1 8 8380 1 1 24 ASP HB2 H -0.788 2.247 6.629 1.00 . A A . 59 ASP HB2 1 1 8 8381 1 1 24 ASP HB3 H 0.347 1.899 7.872 1.00 . A A . 59 ASP HB3 1 1 8 8382 1 1 24 ASP N N -1.591 -0.665 7.213 1.00 . A A . 59 ASP N 1 1 8 8383 1 1 24 ASP O O -2.538 2.684 7.985 1.00 . A A . 59 ASP O 1 1 8 8384 1 1 24 ASP OD1 O 1.177 -0.443 6.644 1.00 . A A . 59 ASP OD1 1 1 8 8385 1 1 24 ASP OD2 O 0.923 1.078 5.080 1.00 . A A . 59 ASP OD2 1 1 8 8386 1 1 25 LYS C C -5.614 1.875 7.494 1.00 . A A . 60 LYS C 1 1 8 8387 1 1 25 LYS CA C -4.940 1.272 8.756 1.00 . A A . 60 LYS CA 1 1 8 8388 1 1 25 LYS CB C -4.950 2.218 9.942 1.00 . A A . 60 LYS CB 1 1 8 8389 1 1 25 LYS CD C -6.245 3.405 11.682 1.00 . A A . 60 LYS CD 1 1 8 8390 1 1 25 LYS CE C -7.624 3.821 12.162 1.00 . A A . 60 LYS CE 1 1 8 8391 1 1 25 LYS CG C -6.329 2.537 10.466 1.00 . A A . 60 LYS CG 1 1 8 8392 1 1 25 LYS H H -3.485 -0.212 8.623 1.00 . A A . 60 LYS H 1 1 8 8393 1 1 25 LYS HA H -5.533 0.410 9.015 1.00 . A A . 60 LYS HA 1 1 8 8394 1 1 25 LYS HB2 H -4.365 1.796 10.745 1.00 . A A . 60 LYS HB2 1 1 8 8395 1 1 25 LYS HB3 H -4.492 3.133 9.607 1.00 . A A . 60 LYS HB3 1 1 8 8396 1 1 25 LYS HD2 H -5.743 2.846 12.459 1.00 . A A . 60 LYS HD2 1 1 8 8397 1 1 25 LYS HD3 H -5.654 4.261 11.401 1.00 . A A . 60 LYS HD3 1 1 8 8398 1 1 25 LYS HE2 H -8.125 4.358 11.371 1.00 . A A . 60 LYS HE2 1 1 8 8399 1 1 25 LYS HE3 H -8.191 2.933 12.399 1.00 . A A . 60 LYS HE3 1 1 8 8400 1 1 25 LYS HG2 H -6.874 3.057 9.692 1.00 . A A . 60 LYS HG2 1 1 8 8401 1 1 25 LYS HG3 H -6.829 1.607 10.702 1.00 . A A . 60 LYS HG3 1 1 8 8402 1 1 25 LYS HZ1 H -8.522 4.906 13.687 1.00 . A A . 60 LYS HZ1 1 1 8 8403 1 1 25 LYS HZ2 H -7.068 5.580 13.167 1.00 . A A . 60 LYS HZ2 1 1 8 8404 1 1 25 LYS HZ3 H -7.063 4.213 14.140 1.00 . A A . 60 LYS HZ3 1 1 8 8405 1 1 25 LYS N N -3.610 0.750 8.499 1.00 . A A . 60 LYS N 1 1 8 8406 1 1 25 LYS NZ N -7.562 4.683 13.358 1.00 . A A . 60 LYS NZ 1 1 8 8407 1 1 25 LYS O O -6.739 2.381 7.547 1.00 . A A . 60 LYS O 1 1 8 8408 1 1 26 LEU C C -6.285 1.092 4.505 1.00 . A A . 61 LEU C 1 1 8 8409 1 1 26 LEU CA C -5.538 2.241 5.131 1.00 . A A . 61 LEU CA 1 1 8 8410 1 1 26 LEU CB C -4.470 2.729 4.192 1.00 . A A . 61 LEU CB 1 1 8 8411 1 1 26 LEU CD1 C -2.498 4.148 3.705 1.00 . A A . 61 LEU CD1 1 1 8 8412 1 1 26 LEU CD2 C -4.421 5.122 4.945 1.00 . A A . 61 LEU CD2 1 1 8 8413 1 1 26 LEU CG C -3.594 3.866 4.700 1.00 . A A . 61 LEU CG 1 1 8 8414 1 1 26 LEU H H -4.042 1.423 6.355 1.00 . A A . 61 LEU H 1 1 8 8415 1 1 26 LEU HA H -6.229 3.040 5.333 1.00 . A A . 61 LEU HA 1 1 8 8416 1 1 26 LEU HB2 H -3.847 1.877 3.985 1.00 . A A . 61 LEU HB2 1 1 8 8417 1 1 26 LEU HB3 H -4.948 3.041 3.275 1.00 . A A . 61 LEU HB3 1 1 8 8418 1 1 26 LEU HD11 H -1.843 4.914 4.091 1.00 . A A . 61 LEU HD11 1 1 8 8419 1 1 26 LEU HD12 H -2.942 4.484 2.780 1.00 . A A . 61 LEU HD12 1 1 8 8420 1 1 26 LEU HD13 H -1.940 3.238 3.530 1.00 . A A . 61 LEU HD13 1 1 8 8421 1 1 26 LEU HD21 H -5.174 4.922 5.693 1.00 . A A . 61 LEU HD21 1 1 8 8422 1 1 26 LEU HD22 H -4.899 5.423 4.025 1.00 . A A . 61 LEU HD22 1 1 8 8423 1 1 26 LEU HD23 H -3.775 5.915 5.290 1.00 . A A . 61 LEU HD23 1 1 8 8424 1 1 26 LEU HG H -3.138 3.570 5.632 1.00 . A A . 61 LEU HG 1 1 8 8425 1 1 26 LEU N N -4.957 1.797 6.373 1.00 . A A . 61 LEU N 1 1 8 8426 1 1 26 LEU O O -5.795 -0.043 4.491 1.00 . A A . 61 LEU O 1 1 8 8427 1 1 27 ILE C C -8.040 0.298 1.930 1.00 . A A . 62 ILE C 1 1 8 8428 1 1 27 ILE CA C -8.252 0.319 3.434 1.00 . A A . 62 ILE CA 1 1 8 8429 1 1 27 ILE CB C -9.764 0.547 3.716 1.00 . A A . 62 ILE CB 1 1 8 8430 1 1 27 ILE CD1 C -9.763 -0.260 6.159 1.00 . A A . 62 ILE CD1 1 1 8 8431 1 1 27 ILE CG1 C -10.038 0.874 5.192 1.00 . A A . 62 ILE CG1 1 1 8 8432 1 1 27 ILE CG2 C -10.514 -0.696 3.356 1.00 . A A . 62 ILE CG2 1 1 8 8433 1 1 27 ILE H H -7.777 2.283 3.945 1.00 . A A . 62 ILE H 1 1 8 8434 1 1 27 ILE HA H -7.941 -0.621 3.866 1.00 . A A . 62 ILE HA 1 1 8 8435 1 1 27 ILE HB H -10.118 1.359 3.098 1.00 . A A . 62 ILE HB 1 1 8 8436 1 1 27 ILE HD11 H -9.967 0.060 7.170 1.00 . A A . 62 ILE HD11 1 1 8 8437 1 1 27 ILE HD12 H -8.729 -0.555 6.071 1.00 . A A . 62 ILE HD12 1 1 8 8438 1 1 27 ILE HD13 H -10.395 -1.101 5.914 1.00 . A A . 62 ILE HD13 1 1 8 8439 1 1 27 ILE HG12 H -9.398 1.694 5.469 1.00 . A A . 62 ILE HG12 1 1 8 8440 1 1 27 ILE HG13 H -11.070 1.174 5.304 1.00 . A A . 62 ILE HG13 1 1 8 8441 1 1 27 ILE HG21 H -10.365 -0.933 2.314 1.00 . A A . 62 ILE HG21 1 1 8 8442 1 1 27 ILE HG22 H -11.558 -0.552 3.590 1.00 . A A . 62 ILE HG22 1 1 8 8443 1 1 27 ILE HG23 H -10.097 -1.473 3.982 1.00 . A A . 62 ILE HG23 1 1 8 8444 1 1 27 ILE N N -7.444 1.361 3.989 1.00 . A A . 62 ILE N 1 1 8 8445 1 1 27 ILE O O -8.323 1.288 1.245 1.00 . A A . 62 ILE O 1 1 8 8446 1 1 28 PHE C C -7.121 -2.346 -0.470 1.00 . A A . 63 PHE C 1 1 8 8447 1 1 28 PHE CA C -7.255 -0.938 0.022 1.00 . A A . 63 PHE CA 1 1 8 8448 1 1 28 PHE CB C -6.157 -0.030 -0.509 1.00 . A A . 63 PHE CB 1 1 8 8449 1 1 28 PHE CD1 C -4.261 -1.173 0.736 1.00 . A A . 63 PHE CD1 1 1 8 8450 1 1 28 PHE CD2 C -4.265 1.173 0.455 1.00 . A A . 63 PHE CD2 1 1 8 8451 1 1 28 PHE CE1 C -3.070 -1.076 1.426 1.00 . A A . 63 PHE CE1 1 1 8 8452 1 1 28 PHE CE2 C -3.101 1.265 1.123 1.00 . A A . 63 PHE CE2 1 1 8 8453 1 1 28 PHE CG C -4.867 -0.025 0.242 1.00 . A A . 63 PHE CG 1 1 8 8454 1 1 28 PHE CZ C -2.487 0.158 1.617 1.00 . A A . 63 PHE CZ 1 1 8 8455 1 1 28 PHE H H -7.274 -1.534 2.029 1.00 . A A . 63 PHE H 1 1 8 8456 1 1 28 PHE HA H -8.173 -0.591 -0.427 1.00 . A A . 63 PHE HA 1 1 8 8457 1 1 28 PHE HB2 H -5.956 -0.182 -1.558 1.00 . A A . 63 PHE HB2 1 1 8 8458 1 1 28 PHE HB3 H -6.544 0.970 -0.369 1.00 . A A . 63 PHE HB3 1 1 8 8459 1 1 28 PHE HD1 H -4.708 -2.146 0.586 1.00 . A A . 63 PHE HD1 1 1 8 8460 1 1 28 PHE HD2 H -4.730 2.071 0.076 1.00 . A A . 63 PHE HD2 1 1 8 8461 1 1 28 PHE HE1 H -2.599 -1.970 1.808 1.00 . A A . 63 PHE HE1 1 1 8 8462 1 1 28 PHE HE2 H -2.659 2.234 1.258 1.00 . A A . 63 PHE HE2 1 1 8 8463 1 1 28 PHE HZ H -1.545 0.295 2.136 1.00 . A A . 63 PHE HZ 1 1 8 8464 1 1 28 PHE N N -7.503 -0.787 1.428 1.00 . A A . 63 PHE N 1 1 8 8465 1 1 28 PHE O O -7.044 -3.278 0.299 1.00 . A A . 63 PHE O 1 1 8 8466 1 1 29 HIS C C -5.635 -4.271 -2.188 1.00 . A A . 64 HIS C 1 1 8 8467 1 1 29 HIS CA C -7.008 -3.716 -2.480 1.00 . A A . 64 HIS CA 1 1 8 8468 1 1 29 HIS CB C -7.104 -3.471 -4.002 1.00 . A A . 64 HIS CB 1 1 8 8469 1 1 29 HIS CD2 C -9.471 -3.118 -4.930 1.00 . A A . 64 HIS CD2 1 1 8 8470 1 1 29 HIS CE1 C -9.489 -0.939 -4.854 1.00 . A A . 64 HIS CE1 1 1 8 8471 1 1 29 HIS CG C -8.286 -2.683 -4.455 1.00 . A A . 64 HIS CG 1 1 8 8472 1 1 29 HIS H H -7.343 -1.675 -2.316 1.00 . A A . 64 HIS H 1 1 8 8473 1 1 29 HIS HA H -7.782 -4.407 -2.184 1.00 . A A . 64 HIS HA 1 1 8 8474 1 1 29 HIS HB2 H -6.250 -2.899 -4.324 1.00 . A A . 64 HIS HB2 1 1 8 8475 1 1 29 HIS HB3 H -7.113 -4.420 -4.518 1.00 . A A . 64 HIS HB3 1 1 8 8476 1 1 29 HIS HD2 H -9.752 -4.150 -5.064 1.00 . A A . 64 HIS HD2 1 1 8 8477 1 1 29 HIS HE1 H -9.831 0.082 -4.918 1.00 . A A . 64 HIS HE1 1 1 8 8478 1 1 29 HIS HE2 H -11.207 -1.972 -5.337 1.00 . A A . 64 HIS HE2 1 1 8 8479 1 1 29 HIS N N -7.162 -2.466 -1.774 1.00 . A A . 64 HIS N 1 1 8 8480 1 1 29 HIS ND1 N -8.302 -1.294 -4.408 1.00 . A A . 64 HIS ND1 1 1 8 8481 1 1 29 HIS NE2 N -10.234 -2.002 -5.181 1.00 . A A . 64 HIS NE2 1 1 8 8482 1 1 29 HIS O O -4.624 -3.562 -2.268 1.00 . A A . 64 HIS O 1 1 8 8483 1 1 30 ASN C C -3.477 -6.255 -2.814 1.00 . A A . 65 ASN C 1 1 8 8484 1 1 30 ASN CA C -4.387 -6.266 -1.590 1.00 . A A . 65 ASN CA 1 1 8 8485 1 1 30 ASN CB C -4.683 -7.726 -1.132 1.00 . A A . 65 ASN CB 1 1 8 8486 1 1 30 ASN CG C -5.658 -8.524 -2.017 1.00 . A A . 65 ASN CG 1 1 8 8487 1 1 30 ASN H H -6.479 -5.971 -1.685 1.00 . A A . 65 ASN H 1 1 8 8488 1 1 30 ASN HA H -3.869 -5.759 -0.791 1.00 . A A . 65 ASN HA 1 1 8 8489 1 1 30 ASN HB2 H -3.754 -8.275 -1.102 1.00 . A A . 65 ASN HB2 1 1 8 8490 1 1 30 ASN HB3 H -5.087 -7.692 -0.132 1.00 . A A . 65 ASN HB3 1 1 8 8491 1 1 30 ASN HD21 H -6.226 -9.586 -0.450 1.00 . A A . 65 ASN HD21 1 1 8 8492 1 1 30 ASN HD22 H -6.967 -9.998 -1.956 1.00 . A A . 65 ASN HD22 1 1 8 8493 1 1 30 ASN N N -5.617 -5.526 -1.828 1.00 . A A . 65 ASN N 1 1 8 8494 1 1 30 ASN ND2 N -6.356 -9.452 -1.417 1.00 . A A . 65 ASN ND2 1 1 8 8495 1 1 30 ASN O O -2.271 -6.279 -2.697 1.00 . A A . 65 ASN O 1 1 8 8496 1 1 30 ASN OD1 O -5.785 -8.307 -3.218 1.00 . A A . 65 ASN OD1 1 1 8 8497 1 1 31 SER C C -2.805 -4.934 -5.697 1.00 . A A . 66 SER C 1 1 8 8498 1 1 31 SER CA C -3.444 -6.270 -5.224 1.00 . A A . 66 SER CA 1 1 8 8499 1 1 31 SER CB C -4.500 -6.718 -6.206 1.00 . A A . 66 SER CB 1 1 8 8500 1 1 31 SER H H -5.062 -6.225 -3.969 1.00 . A A . 66 SER H 1 1 8 8501 1 1 31 SER HA H -2.688 -7.039 -5.237 1.00 . A A . 66 SER HA 1 1 8 8502 1 1 31 SER HB2 H -4.111 -6.538 -7.195 1.00 . A A . 66 SER HB2 1 1 8 8503 1 1 31 SER HB3 H -4.693 -7.772 -6.076 1.00 . A A . 66 SER HB3 1 1 8 8504 1 1 31 SER HG H -6.480 -6.573 -6.076 1.00 . A A . 66 SER HG 1 1 8 8505 1 1 31 SER N N -4.082 -6.242 -3.950 1.00 . A A . 66 SER N 1 1 8 8506 1 1 31 SER O O -1.988 -4.943 -6.627 1.00 . A A . 66 SER O 1 1 8 8507 1 1 31 SER OG O -5.716 -5.976 -5.998 1.00 . A A . 66 SER OG 1 1 8 8508 1 1 32 CYS C C -1.609 -1.759 -5.213 1.00 . A A . 67 CYS C 1 1 8 8509 1 1 32 CYS CA C -2.791 -2.544 -5.739 1.00 . A A . 67 CYS CA 1 1 8 8510 1 1 32 CYS CB C -3.985 -1.642 -5.846 1.00 . A A . 67 CYS CB 1 1 8 8511 1 1 32 CYS H H -3.561 -3.817 -4.194 1.00 . A A . 67 CYS H 1 1 8 8512 1 1 32 CYS HA H -2.541 -2.815 -6.754 1.00 . A A . 67 CYS HA 1 1 8 8513 1 1 32 CYS HB2 H -3.650 -0.676 -6.191 1.00 . A A . 67 CYS HB2 1 1 8 8514 1 1 32 CYS HB3 H -4.727 -2.062 -6.507 1.00 . A A . 67 CYS HB3 1 1 8 8515 1 1 32 CYS N N -3.133 -3.805 -5.081 1.00 . A A . 67 CYS N 1 1 8 8516 1 1 32 CYS O O -1.002 -1.014 -5.990 1.00 . A A . 67 CYS O 1 1 8 8517 1 1 32 CYS SG S -4.770 -1.281 -4.306 1.00 . A A . 67 CYS SG 1 1 8 8518 1 1 33 PHE C C 1.134 -1.345 -3.855 1.00 . A A . 68 PHE C 1 1 8 8519 1 1 33 PHE CA C -0.255 -0.983 -3.413 1.00 . A A . 68 PHE CA 1 1 8 8520 1 1 33 PHE CB C -0.357 -0.697 -1.903 1.00 . A A . 68 PHE CB 1 1 8 8521 1 1 33 PHE CD1 C -1.525 -2.698 -0.907 1.00 . A A . 68 PHE CD1 1 1 8 8522 1 1 33 PHE CD2 C 0.583 -2.033 -0.033 1.00 . A A . 68 PHE CD2 1 1 8 8523 1 1 33 PHE CE1 C -1.590 -3.718 0.030 1.00 . A A . 68 PHE CE1 1 1 8 8524 1 1 33 PHE CE2 C 0.522 -3.036 0.902 1.00 . A A . 68 PHE CE2 1 1 8 8525 1 1 33 PHE CG C -0.432 -1.849 -0.945 1.00 . A A . 68 PHE CG 1 1 8 8526 1 1 33 PHE CZ C -0.561 -3.876 0.936 1.00 . A A . 68 PHE CZ 1 1 8 8527 1 1 33 PHE H H -1.682 -2.546 -3.363 1.00 . A A . 68 PHE H 1 1 8 8528 1 1 33 PHE HA H -0.458 -0.057 -3.934 1.00 . A A . 68 PHE HA 1 1 8 8529 1 1 33 PHE HB2 H 0.607 -0.286 -1.647 1.00 . A A . 68 PHE HB2 1 1 8 8530 1 1 33 PHE HB3 H -1.145 0.005 -1.681 1.00 . A A . 68 PHE HB3 1 1 8 8531 1 1 33 PHE HD1 H -2.321 -2.560 -1.625 1.00 . A A . 68 PHE HD1 1 1 8 8532 1 1 33 PHE HD2 H 1.433 -1.367 -0.070 1.00 . A A . 68 PHE HD2 1 1 8 8533 1 1 33 PHE HE1 H -2.446 -4.377 0.079 1.00 . A A . 68 PHE HE1 1 1 8 8534 1 1 33 PHE HE2 H 1.320 -3.167 1.617 1.00 . A A . 68 PHE HE2 1 1 8 8535 1 1 33 PHE HZ H -0.592 -4.658 1.677 1.00 . A A . 68 PHE HZ 1 1 8 8536 1 1 33 PHE N N -1.271 -1.870 -3.938 1.00 . A A . 68 PHE N 1 1 8 8537 1 1 33 PHE O O 1.793 -2.219 -3.299 1.00 . A A . 68 PHE O 1 1 8 8538 1 1 34 CYS C C 3.671 0.320 -5.153 1.00 . A A . 69 CYS C 1 1 8 8539 1 1 34 CYS CA C 2.791 -0.852 -5.508 1.00 . A A . 69 CYS CA 1 1 8 8540 1 1 34 CYS CB C 2.589 -0.905 -7.025 1.00 . A A . 69 CYS CB 1 1 8 8541 1 1 34 CYS H H 0.924 -0.005 -5.245 1.00 . A A . 69 CYS H 1 1 8 8542 1 1 34 CYS HA H 3.235 -1.779 -5.180 1.00 . A A . 69 CYS HA 1 1 8 8543 1 1 34 CYS HB2 H 2.233 0.051 -7.378 1.00 . A A . 69 CYS HB2 1 1 8 8544 1 1 34 CYS HB3 H 3.539 -1.117 -7.492 1.00 . A A . 69 CYS HB3 1 1 8 8545 1 1 34 CYS HG H 0.259 -1.820 -7.020 1.00 . A A . 69 CYS HG 1 1 8 8546 1 1 34 CYS N N 1.534 -0.677 -4.879 1.00 . A A . 69 CYS N 1 1 8 8547 1 1 34 CYS O O 3.208 1.306 -4.573 1.00 . A A . 69 CYS O 1 1 8 8548 1 1 34 CYS SG S 1.419 -2.172 -7.565 1.00 . A A . 69 CYS SG 1 1 8 8549 1 1 35 CYS C C 5.617 2.423 -6.117 1.00 . A A . 70 CYS C 1 1 8 8550 1 1 35 CYS CA C 5.869 1.238 -5.218 1.00 . A A . 70 CYS CA 1 1 8 8551 1 1 35 CYS CB C 7.281 0.700 -5.377 1.00 . A A . 70 CYS CB 1 1 8 8552 1 1 35 CYS H H 5.220 -0.620 -5.915 1.00 . A A . 70 CYS H 1 1 8 8553 1 1 35 CYS HA H 5.735 1.540 -4.190 1.00 . A A . 70 CYS HA 1 1 8 8554 1 1 35 CYS HB2 H 7.446 0.053 -4.531 1.00 . A A . 70 CYS HB2 1 1 8 8555 1 1 35 CYS HB3 H 7.337 0.135 -6.297 1.00 . A A . 70 CYS HB3 1 1 8 8556 1 1 35 CYS N N 4.926 0.202 -5.473 1.00 . A A . 70 CYS N 1 1 8 8557 1 1 35 CYS O O 5.326 2.312 -7.305 1.00 . A A . 70 CYS O 1 1 8 8558 1 1 35 CYS SG S 8.649 1.888 -5.324 1.00 . A A . 70 CYS SG 1 1 8 8559 1 1 36 LYS C C 6.535 5.075 -7.178 1.00 . A A . 71 LYS C 1 1 8 8560 1 1 36 LYS CA C 5.521 4.831 -6.073 1.00 . A A . 71 LYS CA 1 1 8 8561 1 1 36 LYS CB C 5.703 5.860 -4.983 1.00 . A A . 71 LYS CB 1 1 8 8562 1 1 36 LYS CD C 3.939 7.424 -5.708 1.00 . A A . 71 LYS CD 1 1 8 8563 1 1 36 LYS CE C 3.755 8.339 -6.862 1.00 . A A . 71 LYS CE 1 1 8 8564 1 1 36 LYS CG C 5.410 7.244 -5.440 1.00 . A A . 71 LYS CG 1 1 8 8565 1 1 36 LYS H H 5.828 3.444 -4.520 1.00 . A A . 71 LYS H 1 1 8 8566 1 1 36 LYS HA H 4.548 4.990 -6.511 1.00 . A A . 71 LYS HA 1 1 8 8567 1 1 36 LYS HB2 H 5.064 5.616 -4.148 1.00 . A A . 71 LYS HB2 1 1 8 8568 1 1 36 LYS HB3 H 6.734 5.809 -4.678 1.00 . A A . 71 LYS HB3 1 1 8 8569 1 1 36 LYS HD2 H 3.464 6.477 -5.913 1.00 . A A . 71 LYS HD2 1 1 8 8570 1 1 36 LYS HD3 H 3.482 7.871 -4.837 1.00 . A A . 71 LYS HD3 1 1 8 8571 1 1 36 LYS HE2 H 4.205 7.764 -7.658 1.00 . A A . 71 LYS HE2 1 1 8 8572 1 1 36 LYS HE3 H 2.703 8.493 -7.051 1.00 . A A . 71 LYS HE3 1 1 8 8573 1 1 36 LYS HG2 H 5.717 7.957 -4.690 1.00 . A A . 71 LYS HG2 1 1 8 8574 1 1 36 LYS HG3 H 5.953 7.427 -6.355 1.00 . A A . 71 LYS HG3 1 1 8 8575 1 1 36 LYS HZ1 H 5.501 9.517 -6.738 1.00 . A A . 71 LYS HZ1 1 1 8 8576 1 1 36 LYS HZ2 H 4.286 9.983 -5.702 1.00 . A A . 71 LYS HZ2 1 1 8 8577 1 1 36 LYS HZ3 H 4.160 10.355 -7.348 1.00 . A A . 71 LYS HZ3 1 1 8 8578 1 1 36 LYS N N 5.688 3.535 -5.490 1.00 . A A . 71 LYS N 1 1 8 8579 1 1 36 LYS NZ N 4.470 9.632 -6.668 1.00 . A A . 71 LYS NZ 1 1 8 8580 1 1 36 LYS O O 6.221 5.706 -8.185 1.00 . A A . 71 LYS O 1 1 8 8581 1 1 37 HIS C C 8.818 3.656 -9.027 1.00 . A A . 72 HIS C 1 1 8 8582 1 1 37 HIS CA C 8.770 4.788 -7.987 1.00 . A A . 72 HIS CA 1 1 8 8583 1 1 37 HIS CB C 10.117 4.989 -7.299 1.00 . A A . 72 HIS CB 1 1 8 8584 1 1 37 HIS CD2 C 12.010 5.071 -9.075 1.00 . A A . 72 HIS CD2 1 1 8 8585 1 1 37 HIS CE1 C 12.447 7.194 -8.898 1.00 . A A . 72 HIS CE1 1 1 8 8586 1 1 37 HIS CG C 11.172 5.626 -8.167 1.00 . A A . 72 HIS CG 1 1 8 8587 1 1 37 HIS H H 7.904 3.998 -6.221 1.00 . A A . 72 HIS H 1 1 8 8588 1 1 37 HIS HA H 8.504 5.700 -8.500 1.00 . A A . 72 HIS HA 1 1 8 8589 1 1 37 HIS HB2 H 9.964 5.634 -6.446 1.00 . A A . 72 HIS HB2 1 1 8 8590 1 1 37 HIS HB3 H 10.488 4.032 -6.960 1.00 . A A . 72 HIS HB3 1 1 8 8591 1 1 37 HIS HD2 H 12.039 4.036 -9.384 1.00 . A A . 72 HIS HD2 1 1 8 8592 1 1 37 HIS HE1 H 12.925 8.154 -9.018 1.00 . A A . 72 HIS HE1 1 1 8 8593 1 1 37 HIS HE2 H 13.666 5.960 -10.008 1.00 . A A . 72 HIS HE2 1 1 8 8594 1 1 37 HIS N N 7.731 4.551 -7.013 1.00 . A A . 72 HIS N 1 1 8 8595 1 1 37 HIS ND1 N 11.446 6.966 -8.065 1.00 . A A . 72 HIS ND1 1 1 8 8596 1 1 37 HIS NE2 N 12.816 6.079 -9.532 1.00 . A A . 72 HIS NE2 1 1 8 8597 1 1 37 HIS O O 9.106 3.900 -10.196 1.00 . A A . 72 HIS O 1 1 8 8598 1 1 38 CYS C C 7.176 0.575 -9.316 1.00 . A A . 73 CYS C 1 1 8 8599 1 1 38 CYS CA C 8.468 1.341 -9.546 1.00 . A A . 73 CYS CA 1 1 8 8600 1 1 38 CYS CB C 9.696 0.438 -9.366 1.00 . A A . 73 CYS CB 1 1 8 8601 1 1 38 CYS H H 8.260 2.237 -7.692 1.00 . A A . 73 CYS H 1 1 8 8602 1 1 38 CYS HA H 8.498 1.785 -10.529 1.00 . A A . 73 CYS HA 1 1 8 8603 1 1 38 CYS HB2 H 9.846 -0.203 -10.211 1.00 . A A . 73 CYS HB2 1 1 8 8604 1 1 38 CYS HB3 H 10.511 1.136 -9.376 1.00 . A A . 73 CYS HB3 1 1 8 8605 1 1 38 CYS N N 8.511 2.430 -8.615 1.00 . A A . 73 CYS N 1 1 8 8606 1 1 38 CYS O O 6.860 0.246 -8.188 1.00 . A A . 73 CYS O 1 1 8 8607 1 1 38 CYS SG S 9.803 -0.545 -7.834 1.00 . A A . 73 CYS SG 1 1 8 8608 1 1 39 HIS C C 5.269 -1.892 -9.920 1.00 . A A . 74 HIS C 1 1 8 8609 1 1 39 HIS CA C 5.148 -0.394 -10.175 1.00 . A A . 74 HIS CA 1 1 8 8610 1 1 39 HIS CB C 4.166 -0.063 -11.319 1.00 . A A . 74 HIS CB 1 1 8 8611 1 1 39 HIS CD2 C 4.679 -1.494 -13.430 1.00 . A A . 74 HIS CD2 1 1 8 8612 1 1 39 HIS CE1 C 5.479 0.082 -14.694 1.00 . A A . 74 HIS CE1 1 1 8 8613 1 1 39 HIS CG C 4.658 -0.352 -12.713 1.00 . A A . 74 HIS CG 1 1 8 8614 1 1 39 HIS H H 6.803 0.463 -11.238 1.00 . A A . 74 HIS H 1 1 8 8615 1 1 39 HIS HA H 4.747 0.020 -9.259 1.00 . A A . 74 HIS HA 1 1 8 8616 1 1 39 HIS HB2 H 3.270 -0.646 -11.166 1.00 . A A . 74 HIS HB2 1 1 8 8617 1 1 39 HIS HB3 H 3.916 0.985 -11.257 1.00 . A A . 74 HIS HB3 1 1 8 8618 1 1 39 HIS HD1 H 5.307 1.559 -13.298 1.00 . A A . 74 HIS HD1 1 1 8 8619 1 1 39 HIS HD2 H 4.354 -2.466 -13.087 1.00 . A A . 74 HIS HD2 1 1 8 8620 1 1 39 HIS HE1 H 5.894 0.606 -15.539 1.00 . A A . 74 HIS HE1 1 1 8 8621 1 1 39 HIS HE2 H 5.067 -1.747 -15.462 1.00 . A A . 74 HIS HE2 1 1 8 8622 1 1 39 HIS N N 6.451 0.262 -10.342 1.00 . A A . 74 HIS N 1 1 8 8623 1 1 39 HIS ND1 N 5.170 0.614 -13.538 1.00 . A A . 74 HIS ND1 1 1 8 8624 1 1 39 HIS NE2 N 5.193 -1.198 -14.656 1.00 . A A . 74 HIS NE2 1 1 8 8625 1 1 39 HIS O O 4.817 -2.722 -10.700 1.00 . A A . 74 HIS O 1 1 8 8626 1 1 40 THR C C 5.071 -3.944 -7.334 1.00 . A A . 75 THR C 1 1 8 8627 1 1 40 THR CA C 6.069 -3.573 -8.451 1.00 . A A . 75 THR CA 1 1 8 8628 1 1 40 THR CB C 7.559 -3.822 -8.038 1.00 . A A . 75 THR CB 1 1 8 8629 1 1 40 THR CG2 C 7.881 -3.278 -6.646 1.00 . A A . 75 THR CG2 1 1 8 8630 1 1 40 THR H H 6.211 -1.483 -8.253 1.00 . A A . 75 THR H 1 1 8 8631 1 1 40 THR HA H 5.839 -4.173 -9.319 1.00 . A A . 75 THR HA 1 1 8 8632 1 1 40 THR HB H 8.175 -3.311 -8.764 1.00 . A A . 75 THR HB 1 1 8 8633 1 1 40 THR HG1 H 8.026 -5.411 -9.008 1.00 . A A . 75 THR HG1 1 1 8 8634 1 1 40 THR HG21 H 7.714 -2.211 -6.627 1.00 . A A . 75 THR HG21 1 1 8 8635 1 1 40 THR HG22 H 8.912 -3.488 -6.403 1.00 . A A . 75 THR HG22 1 1 8 8636 1 1 40 THR HG23 H 7.236 -3.756 -5.924 1.00 . A A . 75 THR HG23 1 1 8 8637 1 1 40 THR N N 5.872 -2.214 -8.821 1.00 . A A . 75 THR N 1 1 8 8638 1 1 40 THR O O 4.840 -3.139 -6.404 1.00 . A A . 75 THR O 1 1 8 8639 1 1 40 THR OG1 O 7.859 -5.216 -8.076 1.00 . A A . 75 THR OG1 1 1 8 8640 1 1 41 LYS C C 4.143 -6.019 -5.220 1.00 . A A . 76 LYS C 1 1 8 8641 1 1 41 LYS CA C 3.419 -5.575 -6.502 1.00 . A A . 76 LYS CA 1 1 8 8642 1 1 41 LYS CB C 2.573 -6.733 -7.104 1.00 . A A . 76 LYS CB 1 1 8 8643 1 1 41 LYS CD C 1.225 -7.583 -5.008 1.00 . A A . 76 LYS CD 1 1 8 8644 1 1 41 LYS CE C 1.536 -9.095 -4.938 1.00 . A A . 76 LYS CE 1 1 8 8645 1 1 41 LYS CG C 1.190 -6.995 -6.438 1.00 . A A . 76 LYS CG 1 1 8 8646 1 1 41 LYS H H 4.580 -5.635 -8.283 1.00 . A A . 76 LYS H 1 1 8 8647 1 1 41 LYS HA H 2.771 -4.744 -6.267 1.00 . A A . 76 LYS HA 1 1 8 8648 1 1 41 LYS HB2 H 2.389 -6.495 -8.140 1.00 . A A . 76 LYS HB2 1 1 8 8649 1 1 41 LYS HB3 H 3.161 -7.636 -7.048 1.00 . A A . 76 LYS HB3 1 1 8 8650 1 1 41 LYS HD2 H 1.984 -7.063 -4.443 1.00 . A A . 76 LYS HD2 1 1 8 8651 1 1 41 LYS HD3 H 0.265 -7.402 -4.545 1.00 . A A . 76 LYS HD3 1 1 8 8652 1 1 41 LYS HE2 H 1.410 -9.424 -3.918 1.00 . A A . 76 LYS HE2 1 1 8 8653 1 1 41 LYS HE3 H 0.822 -9.617 -5.558 1.00 . A A . 76 LYS HE3 1 1 8 8654 1 1 41 LYS HG2 H 0.664 -6.053 -6.386 1.00 . A A . 76 LYS HG2 1 1 8 8655 1 1 41 LYS HG3 H 0.627 -7.660 -7.076 1.00 . A A . 76 LYS HG3 1 1 8 8656 1 1 41 LYS HZ1 H 3.083 -10.462 -5.177 1.00 . A A . 76 LYS HZ1 1 1 8 8657 1 1 41 LYS HZ2 H 3.625 -8.899 -4.854 1.00 . A A . 76 LYS HZ2 1 1 8 8658 1 1 41 LYS HZ3 H 3.047 -9.303 -6.381 1.00 . A A . 76 LYS HZ3 1 1 8 8659 1 1 41 LYS N N 4.405 -5.096 -7.482 1.00 . A A . 76 LYS N 1 1 8 8660 1 1 41 LYS NZ N 2.906 -9.455 -5.364 1.00 . A A . 76 LYS NZ 1 1 8 8661 1 1 41 LYS O O 4.402 -7.198 -4.999 1.00 . A A . 76 LYS O 1 1 8 8662 1 1 42 LEU C C 4.200 -5.459 -2.015 1.00 . A A . 77 LEU C 1 1 8 8663 1 1 42 LEU CA C 5.158 -5.231 -3.154 1.00 . A A . 77 LEU CA 1 1 8 8664 1 1 42 LEU CB C 6.067 -4.020 -2.912 1.00 . A A . 77 LEU CB 1 1 8 8665 1 1 42 LEU CD1 C 4.492 -2.333 -1.717 1.00 . A A . 77 LEU CD1 1 1 8 8666 1 1 42 LEU CD2 C 6.435 -1.574 -2.963 1.00 . A A . 77 LEU CD2 1 1 8 8667 1 1 42 LEU CG C 5.391 -2.605 -2.907 1.00 . A A . 77 LEU CG 1 1 8 8668 1 1 42 LEU H H 4.279 -4.143 -4.733 1.00 . A A . 77 LEU H 1 1 8 8669 1 1 42 LEU HA H 5.786 -6.103 -3.234 1.00 . A A . 77 LEU HA 1 1 8 8670 1 1 42 LEU HB2 H 6.708 -4.135 -2.053 1.00 . A A . 77 LEU HB2 1 1 8 8671 1 1 42 LEU HB3 H 6.678 -3.990 -3.804 1.00 . A A . 77 LEU HB3 1 1 8 8672 1 1 42 LEU HD11 H 3.699 -3.064 -1.648 1.00 . A A . 77 LEU HD11 1 1 8 8673 1 1 42 LEU HD12 H 4.069 -1.339 -1.794 1.00 . A A . 77 LEU HD12 1 1 8 8674 1 1 42 LEU HD13 H 5.112 -2.393 -0.839 1.00 . A A . 77 LEU HD13 1 1 8 8675 1 1 42 LEU HD21 H 7.069 -1.756 -3.817 1.00 . A A . 77 LEU HD21 1 1 8 8676 1 1 42 LEU HD22 H 7.012 -1.620 -2.053 1.00 . A A . 77 LEU HD22 1 1 8 8677 1 1 42 LEU HD23 H 5.977 -0.601 -3.052 1.00 . A A . 77 LEU HD23 1 1 8 8678 1 1 42 LEU HG H 4.796 -2.501 -3.802 1.00 . A A . 77 LEU HG 1 1 8 8679 1 1 42 LEU N N 4.476 -5.053 -4.424 1.00 . A A . 77 LEU N 1 1 8 8680 1 1 42 LEU O O 4.612 -5.751 -0.885 1.00 . A A . 77 LEU O 1 1 8 8681 1 1 43 SER C C 1.925 -6.677 -0.561 1.00 . A A . 78 SER C 1 1 8 8682 1 1 43 SER CA C 1.869 -5.401 -1.406 1.00 . A A . 78 SER CA 1 1 8 8683 1 1 43 SER CB C 0.632 -5.432 -2.232 1.00 . A A . 78 SER CB 1 1 8 8684 1 1 43 SER H H 2.710 -5.097 -3.249 1.00 . A A . 78 SER H 1 1 8 8685 1 1 43 SER HA H 1.810 -4.527 -0.782 1.00 . A A . 78 SER HA 1 1 8 8686 1 1 43 SER HB2 H 0.487 -6.459 -2.505 1.00 . A A . 78 SER HB2 1 1 8 8687 1 1 43 SER HB3 H -0.211 -5.080 -1.655 1.00 . A A . 78 SER HB3 1 1 8 8688 1 1 43 SER HG H 1.057 -3.728 -3.151 1.00 . A A . 78 SER HG 1 1 8 8689 1 1 43 SER N N 2.946 -5.310 -2.325 1.00 . A A . 78 SER N 1 1 8 8690 1 1 43 SER O O 2.231 -7.765 -1.077 1.00 . A A . 78 SER O 1 1 8 8691 1 1 43 SER OG O 0.790 -4.625 -3.397 1.00 . A A . 78 SER OG 1 1 8 8692 1 1 44 LEU C C 2.561 -8.667 1.617 1.00 . A A . 79 LEU C 1 1 8 8693 1 1 44 LEU CA C 1.515 -7.553 1.729 1.00 . A A . 79 LEU CA 1 1 8 8694 1 1 44 LEU CB C 0.093 -8.095 1.781 1.00 . A A . 79 LEU CB 1 1 8 8695 1 1 44 LEU CD1 C 0.132 -8.711 4.229 1.00 . A A . 79 LEU CD1 1 1 8 8696 1 1 44 LEU CD2 C -0.721 -6.482 3.525 1.00 . A A . 79 LEU CD2 1 1 8 8697 1 1 44 LEU CG C -0.604 -7.947 3.141 1.00 . A A . 79 LEU CG 1 1 8 8698 1 1 44 LEU H H 1.475 -5.581 1.027 1.00 . A A . 79 LEU H 1 1 8 8699 1 1 44 LEU HA H 1.706 -7.064 2.672 1.00 . A A . 79 LEU HA 1 1 8 8700 1 1 44 LEU HB2 H -0.484 -7.568 1.028 1.00 . A A . 79 LEU HB2 1 1 8 8701 1 1 44 LEU HB3 H 0.125 -9.144 1.528 1.00 . A A . 79 LEU HB3 1 1 8 8702 1 1 44 LEU HD11 H -0.408 -8.601 5.157 1.00 . A A . 79 LEU HD11 1 1 8 8703 1 1 44 LEU HD12 H 1.122 -8.290 4.340 1.00 . A A . 79 LEU HD12 1 1 8 8704 1 1 44 LEU HD13 H 0.198 -9.755 3.963 1.00 . A A . 79 LEU HD13 1 1 8 8705 1 1 44 LEU HD21 H -1.123 -6.401 4.523 1.00 . A A . 79 LEU HD21 1 1 8 8706 1 1 44 LEU HD22 H -1.400 -6.000 2.838 1.00 . A A . 79 LEU HD22 1 1 8 8707 1 1 44 LEU HD23 H 0.244 -5.999 3.474 1.00 . A A . 79 LEU HD23 1 1 8 8708 1 1 44 LEU HG H -1.598 -8.359 3.067 1.00 . A A . 79 LEU HG 1 1 8 8709 1 1 44 LEU N N 1.626 -6.500 0.724 1.00 . A A . 79 LEU N 1 1 8 8710 1 1 44 LEU O O 2.316 -9.728 1.011 1.00 . A A . 79 LEU O 1 1 8 8711 1 1 45 GLY C C 6.035 -8.682 2.594 1.00 . A A . 80 GLY C 1 1 8 8712 1 1 45 GLY CA C 4.771 -9.368 2.191 1.00 . A A . 80 GLY CA 1 1 8 8713 1 1 45 GLY H H 3.789 -7.621 2.761 1.00 . A A . 80 GLY H 1 1 8 8714 1 1 45 GLY HA2 H 4.565 -10.179 2.873 1.00 . A A . 80 GLY HA2 1 1 8 8715 1 1 45 GLY HA3 H 4.887 -9.754 1.190 1.00 . A A . 80 GLY HA3 1 1 8 8716 1 1 45 GLY N N 3.685 -8.438 2.224 1.00 . A A . 80 GLY N 1 1 8 8717 1 1 45 GLY O O 6.659 -9.022 3.607 1.00 . A A . 80 GLY O 1 1 8 8718 1 1 46 SER C C 7.345 -5.530 1.467 1.00 . A A . 81 SER C 1 1 8 8719 1 1 46 SER CA C 7.543 -6.905 2.093 1.00 . A A . 81 SER CA 1 1 8 8720 1 1 46 SER CB C 8.811 -7.607 1.574 1.00 . A A . 81 SER CB 1 1 8 8721 1 1 46 SER H H 5.904 -7.547 0.989 1.00 . A A . 81 SER H 1 1 8 8722 1 1 46 SER HA H 7.616 -6.800 3.166 1.00 . A A . 81 SER HA 1 1 8 8723 1 1 46 SER HB2 H 9.660 -6.943 1.642 1.00 . A A . 81 SER HB2 1 1 8 8724 1 1 46 SER HB3 H 8.977 -8.478 2.189 1.00 . A A . 81 SER HB3 1 1 8 8725 1 1 46 SER HG H 7.729 -8.147 0.018 1.00 . A A . 81 SER HG 1 1 8 8726 1 1 46 SER N N 6.412 -7.717 1.812 1.00 . A A . 81 SER N 1 1 8 8727 1 1 46 SER O O 7.452 -5.369 0.249 1.00 . A A . 81 SER O 1 1 8 8728 1 1 46 SER OG O 8.672 -8.037 0.211 1.00 . A A . 81 SER OG 1 1 8 8729 1 1 47 TYR C C 7.405 -2.180 2.694 1.00 . A A . 82 TYR C 1 1 8 8730 1 1 47 TYR CA C 6.832 -3.230 1.767 1.00 . A A . 82 TYR CA 1 1 8 8731 1 1 47 TYR CB C 5.317 -3.001 1.491 1.00 . A A . 82 TYR CB 1 1 8 8732 1 1 47 TYR CD1 C 4.390 -2.006 3.619 1.00 . A A . 82 TYR CD1 1 1 8 8733 1 1 47 TYR CD2 C 3.399 -4.024 2.840 1.00 . A A . 82 TYR CD2 1 1 8 8734 1 1 47 TYR CE1 C 3.507 -1.965 4.668 1.00 . A A . 82 TYR CE1 1 1 8 8735 1 1 47 TYR CE2 C 2.513 -3.995 3.902 1.00 . A A . 82 TYR CE2 1 1 8 8736 1 1 47 TYR CG C 4.364 -3.023 2.686 1.00 . A A . 82 TYR CG 1 1 8 8737 1 1 47 TYR CZ C 2.576 -2.959 4.812 1.00 . A A . 82 TYR CZ 1 1 8 8738 1 1 47 TYR H H 6.982 -4.641 3.254 1.00 . A A . 82 TYR H 1 1 8 8739 1 1 47 TYR HA H 7.360 -3.159 0.827 1.00 . A A . 82 TYR HA 1 1 8 8740 1 1 47 TYR HB2 H 5.165 -2.059 0.989 1.00 . A A . 82 TYR HB2 1 1 8 8741 1 1 47 TYR HB3 H 5.004 -3.776 0.810 1.00 . A A . 82 TYR HB3 1 1 8 8742 1 1 47 TYR HD1 H 5.146 -1.245 3.496 1.00 . A A . 82 TYR HD1 1 1 8 8743 1 1 47 TYR HD2 H 3.330 -4.843 2.139 1.00 . A A . 82 TYR HD2 1 1 8 8744 1 1 47 TYR HE1 H 3.552 -1.155 5.380 1.00 . A A . 82 TYR HE1 1 1 8 8745 1 1 47 TYR HE2 H 1.785 -4.787 4.009 1.00 . A A . 82 TYR HE2 1 1 8 8746 1 1 47 TYR HH H 1.490 -1.952 5.989 1.00 . A A . 82 TYR HH 1 1 8 8747 1 1 47 TYR N N 7.068 -4.537 2.279 1.00 . A A . 82 TYR N 1 1 8 8748 1 1 47 TYR O O 7.870 -2.500 3.802 1.00 . A A . 82 TYR O 1 1 8 8749 1 1 47 TYR OH O 1.686 -2.900 5.851 1.00 . A A . 82 TYR OH 1 1 8 8750 1 1 48 ALA C C 6.833 1.212 2.760 1.00 . A A . 83 ALA C 1 1 8 8751 1 1 48 ALA CA C 7.851 0.144 3.013 1.00 . A A . 83 ALA CA 1 1 8 8752 1 1 48 ALA CB C 9.231 0.639 2.635 1.00 . A A . 83 ALA CB 1 1 8 8753 1 1 48 ALA H H 7.263 -0.808 1.269 1.00 . A A . 83 ALA H 1 1 8 8754 1 1 48 ALA HA H 7.843 -0.145 4.054 1.00 . A A . 83 ALA HA 1 1 8 8755 1 1 48 ALA HB1 H 9.240 0.924 1.594 1.00 . A A . 83 ALA HB1 1 1 8 8756 1 1 48 ALA HB2 H 9.946 -0.153 2.799 1.00 . A A . 83 ALA HB2 1 1 8 8757 1 1 48 ALA HB3 H 9.499 1.491 3.246 1.00 . A A . 83 ALA HB3 1 1 8 8758 1 1 48 ALA N N 7.481 -0.982 2.212 1.00 . A A . 83 ALA N 1 1 8 8759 1 1 48 ALA O O 6.669 1.655 1.644 1.00 . A A . 83 ALA O 1 1 8 8760 1 1 49 ALA C C 5.510 3.885 4.180 1.00 . A A . 84 ALA C 1 1 8 8761 1 1 49 ALA CA C 5.141 2.597 3.518 1.00 . A A . 84 ALA CA 1 1 8 8762 1 1 49 ALA CB C 3.797 2.108 3.995 1.00 . A A . 84 ALA CB 1 1 8 8763 1 1 49 ALA H H 6.282 1.288 4.655 1.00 . A A . 84 ALA H 1 1 8 8764 1 1 49 ALA HA H 5.077 2.735 2.448 1.00 . A A . 84 ALA HA 1 1 8 8765 1 1 49 ALA HB1 H 3.055 2.845 3.727 1.00 . A A . 84 ALA HB1 1 1 8 8766 1 1 49 ALA HB2 H 3.813 1.967 5.066 1.00 . A A . 84 ALA HB2 1 1 8 8767 1 1 49 ALA HB3 H 3.566 1.176 3.501 1.00 . A A . 84 ALA HB3 1 1 8 8768 1 1 49 ALA N N 6.141 1.618 3.745 1.00 . A A . 84 ALA N 1 1 8 8769 1 1 49 ALA O O 6.044 3.888 5.307 1.00 . A A . 84 ALA O 1 1 8 8770 1 1 50 LEU C C 4.144 6.924 3.858 1.00 . A A . 85 LEU C 1 1 8 8771 1 1 50 LEU CA C 5.468 6.249 4.030 1.00 . A A . 85 LEU CA 1 1 8 8772 1 1 50 LEU CB C 6.579 7.044 3.304 1.00 . A A . 85 LEU CB 1 1 8 8773 1 1 50 LEU CD1 C 7.665 8.186 5.235 1.00 . A A . 85 LEU CD1 1 1 8 8774 1 1 50 LEU CD2 C 7.728 9.280 3.048 1.00 . A A . 85 LEU CD2 1 1 8 8775 1 1 50 LEU CG C 6.932 8.385 3.948 1.00 . A A . 85 LEU CG 1 1 8 8776 1 1 50 LEU H H 4.937 4.918 2.571 1.00 . A A . 85 LEU H 1 1 8 8777 1 1 50 LEU HA H 5.701 6.157 5.077 1.00 . A A . 85 LEU HA 1 1 8 8778 1 1 50 LEU HB2 H 7.473 6.446 3.319 1.00 . A A . 85 LEU HB2 1 1 8 8779 1 1 50 LEU HB3 H 6.318 7.213 2.274 1.00 . A A . 85 LEU HB3 1 1 8 8780 1 1 50 LEU HD11 H 8.608 7.715 4.995 1.00 . A A . 85 LEU HD11 1 1 8 8781 1 1 50 LEU HD12 H 7.074 7.571 5.896 1.00 . A A . 85 LEU HD12 1 1 8 8782 1 1 50 LEU HD13 H 7.833 9.160 5.668 1.00 . A A . 85 LEU HD13 1 1 8 8783 1 1 50 LEU HD21 H 8.682 8.822 2.819 1.00 . A A . 85 LEU HD21 1 1 8 8784 1 1 50 LEU HD22 H 7.878 10.220 3.564 1.00 . A A . 85 LEU HD22 1 1 8 8785 1 1 50 LEU HD23 H 7.174 9.448 2.138 1.00 . A A . 85 LEU HD23 1 1 8 8786 1 1 50 LEU HG H 5.999 8.872 4.173 1.00 . A A . 85 LEU HG 1 1 8 8787 1 1 50 LEU N N 5.290 4.957 3.490 1.00 . A A . 85 LEU N 1 1 8 8788 1 1 50 LEU O O 3.353 6.493 3.015 1.00 . A A . 85 LEU O 1 1 8 8789 1 1 51 HIS C C 2.377 9.116 3.095 1.00 . A A . 86 HIS C 1 1 8 8790 1 1 51 HIS CA C 2.628 8.668 4.551 1.00 . A A . 86 HIS CA 1 1 8 8791 1 1 51 HIS CB C 2.622 9.885 5.525 1.00 . A A . 86 HIS CB 1 1 8 8792 1 1 51 HIS CD2 C 4.770 11.028 4.635 1.00 . A A . 86 HIS CD2 1 1 8 8793 1 1 51 HIS CE1 C 5.584 11.757 6.487 1.00 . A A . 86 HIS CE1 1 1 8 8794 1 1 51 HIS CG C 3.915 10.668 5.592 1.00 . A A . 86 HIS CG 1 1 8 8795 1 1 51 HIS H H 4.477 8.083 5.417 1.00 . A A . 86 HIS H 1 1 8 8796 1 1 51 HIS HA H 1.827 8.003 4.835 1.00 . A A . 86 HIS HA 1 1 8 8797 1 1 51 HIS HB2 H 1.888 10.583 5.154 1.00 . A A . 86 HIS HB2 1 1 8 8798 1 1 51 HIS HB3 H 2.359 9.563 6.521 1.00 . A A . 86 HIS HB3 1 1 8 8799 1 1 51 HIS HD1 H 4.066 11.046 7.654 1.00 . A A . 86 HIS HD1 1 1 8 8800 1 1 51 HIS HD2 H 4.683 10.761 3.594 1.00 . A A . 86 HIS HD2 1 1 8 8801 1 1 51 HIS HE1 H 6.274 12.210 7.178 1.00 . A A . 86 HIS HE1 1 1 8 8802 1 1 51 HIS HE2 H 6.396 12.298 4.725 1.00 . A A . 86 HIS HE2 1 1 8 8803 1 1 51 HIS N N 3.858 7.899 4.678 1.00 . A A . 86 HIS N 1 1 8 8804 1 1 51 HIS ND1 N 4.454 11.145 6.757 1.00 . A A . 86 HIS ND1 1 1 8 8805 1 1 51 HIS NE2 N 5.786 11.699 5.211 1.00 . A A . 86 HIS NE2 1 1 8 8806 1 1 51 HIS O O 3.200 9.805 2.483 1.00 . A A . 86 HIS O 1 1 8 8807 1 1 52 GLY C C 1.366 8.099 0.114 1.00 . A A . 87 GLY C 1 1 8 8808 1 1 52 GLY CA C 0.892 9.044 1.216 1.00 . A A . 87 GLY CA 1 1 8 8809 1 1 52 GLY H H 0.720 8.034 3.049 1.00 . A A . 87 GLY H 1 1 8 8810 1 1 52 GLY HA2 H -0.186 9.095 1.176 1.00 . A A . 87 GLY HA2 1 1 8 8811 1 1 52 GLY HA3 H 1.286 10.030 1.016 1.00 . A A . 87 GLY HA3 1 1 8 8812 1 1 52 GLY N N 1.280 8.664 2.547 1.00 . A A . 87 GLY N 1 1 8 8813 1 1 52 GLY O O 0.639 7.888 -0.860 1.00 . A A . 87 GLY O 1 1 8 8814 1 1 53 GLU C C 3.743 5.423 -0.350 1.00 . A A . 88 GLU C 1 1 8 8815 1 1 53 GLU CA C 3.126 6.717 -0.849 1.00 . A A . 88 GLU CA 1 1 8 8816 1 1 53 GLU CB C 4.172 7.535 -1.626 1.00 . A A . 88 GLU CB 1 1 8 8817 1 1 53 GLU CD C 4.619 9.738 -2.806 1.00 . A A . 88 GLU CD 1 1 8 8818 1 1 53 GLU CG C 3.630 8.879 -2.084 1.00 . A A . 88 GLU CG 1 1 8 8819 1 1 53 GLU H H 3.055 7.551 1.099 1.00 . A A . 88 GLU H 1 1 8 8820 1 1 53 GLU HA H 2.308 6.499 -1.516 1.00 . A A . 88 GLU HA 1 1 8 8821 1 1 53 GLU HB2 H 5.073 7.664 -1.042 1.00 . A A . 88 GLU HB2 1 1 8 8822 1 1 53 GLU HB3 H 4.425 6.975 -2.515 1.00 . A A . 88 GLU HB3 1 1 8 8823 1 1 53 GLU HG2 H 2.799 8.689 -2.747 1.00 . A A . 88 GLU HG2 1 1 8 8824 1 1 53 GLU HG3 H 3.262 9.393 -1.211 1.00 . A A . 88 GLU HG3 1 1 8 8825 1 1 53 GLU N N 2.564 7.510 0.250 1.00 . A A . 88 GLU N 1 1 8 8826 1 1 53 GLU O O 4.387 5.385 0.706 1.00 . A A . 88 GLU O 1 1 8 8827 1 1 53 GLU OE1 O 5.635 10.132 -2.211 1.00 . A A . 88 GLU OE1 1 1 8 8828 1 1 53 GLU OE2 O 4.384 10.070 -3.992 1.00 . A A . 88 GLU OE2 1 1 8 8829 1 1 54 PHE C C 5.302 2.884 -1.583 1.00 . A A . 89 PHE C 1 1 8 8830 1 1 54 PHE CA C 4.066 3.092 -0.757 1.00 . A A . 89 PHE CA 1 1 8 8831 1 1 54 PHE CB C 2.972 2.035 -1.030 1.00 . A A . 89 PHE CB 1 1 8 8832 1 1 54 PHE CD1 C 0.821 3.325 -0.839 1.00 . A A . 89 PHE CD1 1 1 8 8833 1 1 54 PHE CD2 C 1.391 1.856 0.961 1.00 . A A . 89 PHE CD2 1 1 8 8834 1 1 54 PHE CE1 C -0.300 3.722 -0.175 1.00 . A A . 89 PHE CE1 1 1 8 8835 1 1 54 PHE CE2 C 0.267 2.268 1.637 1.00 . A A . 89 PHE CE2 1 1 8 8836 1 1 54 PHE CG C 1.691 2.385 -0.294 1.00 . A A . 89 PHE CG 1 1 8 8837 1 1 54 PHE CZ C -0.575 3.208 1.059 1.00 . A A . 89 PHE CZ 1 1 8 8838 1 1 54 PHE H H 3.112 4.445 -1.976 1.00 . A A . 89 PHE H 1 1 8 8839 1 1 54 PHE HA H 4.319 3.099 0.296 1.00 . A A . 89 PHE HA 1 1 8 8840 1 1 54 PHE HB2 H 2.754 2.015 -2.088 1.00 . A A . 89 PHE HB2 1 1 8 8841 1 1 54 PHE HB3 H 3.310 1.060 -0.722 1.00 . A A . 89 PHE HB3 1 1 8 8842 1 1 54 PHE HD1 H 1.034 3.734 -1.816 1.00 . A A . 89 PHE HD1 1 1 8 8843 1 1 54 PHE HD2 H 2.024 1.122 1.435 1.00 . A A . 89 PHE HD2 1 1 8 8844 1 1 54 PHE HE1 H -0.961 4.453 -0.615 1.00 . A A . 89 PHE HE1 1 1 8 8845 1 1 54 PHE HE2 H 0.034 1.842 2.605 1.00 . A A . 89 PHE HE2 1 1 8 8846 1 1 54 PHE HZ H -1.458 3.558 1.572 1.00 . A A . 89 PHE HZ 1 1 8 8847 1 1 54 PHE N N 3.575 4.381 -1.113 1.00 . A A . 89 PHE N 1 1 8 8848 1 1 54 PHE O O 5.297 3.099 -2.793 1.00 . A A . 89 PHE O 1 1 8 8849 1 1 55 TYR C C 8.208 1.126 -1.420 1.00 . A A . 90 TYR C 1 1 8 8850 1 1 55 TYR CA C 7.614 2.511 -1.610 1.00 . A A . 90 TYR CA 1 1 8 8851 1 1 55 TYR CB C 8.463 3.572 -0.894 1.00 . A A . 90 TYR CB 1 1 8 8852 1 1 55 TYR CD1 C 7.874 5.726 -2.059 1.00 . A A . 90 TYR CD1 1 1 8 8853 1 1 55 TYR CD2 C 10.157 5.048 -2.065 1.00 . A A . 90 TYR CD2 1 1 8 8854 1 1 55 TYR CE1 C 8.200 6.858 -2.762 1.00 . A A . 90 TYR CE1 1 1 8 8855 1 1 55 TYR CE2 C 10.486 6.187 -2.772 1.00 . A A . 90 TYR CE2 1 1 8 8856 1 1 55 TYR CG C 8.846 4.792 -1.697 1.00 . A A . 90 TYR CG 1 1 8 8857 1 1 55 TYR CZ C 9.500 7.089 -3.117 1.00 . A A . 90 TYR CZ 1 1 8 8858 1 1 55 TYR H H 6.308 2.226 -0.023 1.00 . A A . 90 TYR H 1 1 8 8859 1 1 55 TYR HA H 7.518 2.772 -2.653 1.00 . A A . 90 TYR HA 1 1 8 8860 1 1 55 TYR HB2 H 7.703 4.051 -0.288 1.00 . A A . 90 TYR HB2 1 1 8 8861 1 1 55 TYR HB3 H 9.263 3.210 -0.270 1.00 . A A . 90 TYR HB3 1 1 8 8862 1 1 55 TYR HD1 H 6.839 5.571 -1.790 1.00 . A A . 90 TYR HD1 1 1 8 8863 1 1 55 TYR HD2 H 10.939 4.349 -1.807 1.00 . A A . 90 TYR HD2 1 1 8 8864 1 1 55 TYR HE1 H 7.425 7.562 -3.027 1.00 . A A . 90 TYR HE1 1 1 8 8865 1 1 55 TYR HE2 H 11.515 6.373 -3.046 1.00 . A A . 90 TYR HE2 1 1 8 8866 1 1 55 TYR HH H 9.297 8.961 -3.469 1.00 . A A . 90 TYR HH 1 1 8 8867 1 1 55 TYR N N 6.351 2.524 -0.962 1.00 . A A . 90 TYR N 1 1 8 8868 1 1 55 TYR O O 7.938 0.466 -0.418 1.00 . A A . 90 TYR O 1 1 8 8869 1 1 55 TYR OH O 9.820 8.228 -3.820 1.00 . A A . 90 TYR OH 1 1 8 8870 1 1 56 CYS C C 10.748 -0.410 -1.251 1.00 . A A . 91 CYS C 1 1 8 8871 1 1 56 CYS CA C 9.584 -0.636 -2.170 1.00 . A A . 91 CYS CA 1 1 8 8872 1 1 56 CYS CB C 10.044 -1.302 -3.480 1.00 . A A . 91 CYS CB 1 1 8 8873 1 1 56 CYS H H 9.050 1.132 -3.219 1.00 . A A . 91 CYS H 1 1 8 8874 1 1 56 CYS HA H 8.877 -1.274 -1.660 1.00 . A A . 91 CYS HA 1 1 8 8875 1 1 56 CYS HB2 H 10.405 -2.293 -3.253 1.00 . A A . 91 CYS HB2 1 1 8 8876 1 1 56 CYS HB3 H 9.210 -1.405 -4.154 1.00 . A A . 91 CYS HB3 1 1 8 8877 1 1 56 CYS N N 8.946 0.636 -2.382 1.00 . A A . 91 CYS N 1 1 8 8878 1 1 56 CYS O O 11.274 0.713 -1.235 1.00 . A A . 91 CYS O 1 1 8 8879 1 1 56 CYS SG S 11.353 -0.427 -4.356 1.00 . A A . 91 CYS SG 1 1 8 8880 1 1 57 LYS C C 13.520 -0.670 -0.296 1.00 . A A . 92 LYS C 1 1 8 8881 1 1 57 LYS CA C 12.257 -1.229 0.430 1.00 . A A . 92 LYS CA 1 1 8 8882 1 1 57 LYS CB C 12.561 -2.527 1.197 1.00 . A A . 92 LYS CB 1 1 8 8883 1 1 57 LYS CD C 11.744 -4.367 2.697 1.00 . A A . 92 LYS CD 1 1 8 8884 1 1 57 LYS CE C 10.569 -4.982 3.456 1.00 . A A . 92 LYS CE 1 1 8 8885 1 1 57 LYS CG C 11.379 -3.066 2.007 1.00 . A A . 92 LYS CG 1 1 8 8886 1 1 57 LYS H H 10.699 -2.275 -0.538 1.00 . A A . 92 LYS H 1 1 8 8887 1 1 57 LYS HA H 11.940 -0.473 1.133 1.00 . A A . 92 LYS HA 1 1 8 8888 1 1 57 LYS HB2 H 12.861 -3.292 0.497 1.00 . A A . 92 LYS HB2 1 1 8 8889 1 1 57 LYS HB3 H 13.377 -2.339 1.880 1.00 . A A . 92 LYS HB3 1 1 8 8890 1 1 57 LYS HD2 H 12.078 -5.072 1.950 1.00 . A A . 92 LYS HD2 1 1 8 8891 1 1 57 LYS HD3 H 12.549 -4.175 3.392 1.00 . A A . 92 LYS HD3 1 1 8 8892 1 1 57 LYS HE2 H 9.758 -5.146 2.763 1.00 . A A . 92 LYS HE2 1 1 8 8893 1 1 57 LYS HE3 H 10.879 -5.929 3.870 1.00 . A A . 92 LYS HE3 1 1 8 8894 1 1 57 LYS HG2 H 11.102 -2.340 2.757 1.00 . A A . 92 LYS HG2 1 1 8 8895 1 1 57 LYS HG3 H 10.543 -3.238 1.347 1.00 . A A . 92 LYS HG3 1 1 8 8896 1 1 57 LYS HZ1 H 9.422 -4.664 5.153 1.00 . A A . 92 LYS HZ1 1 1 8 8897 1 1 57 LYS HZ2 H 9.525 -3.312 4.174 1.00 . A A . 92 LYS HZ2 1 1 8 8898 1 1 57 LYS HZ3 H 10.856 -3.770 5.130 1.00 . A A . 92 LYS HZ3 1 1 8 8899 1 1 57 LYS N N 11.149 -1.405 -0.492 1.00 . A A . 92 LYS N 1 1 8 8900 1 1 57 LYS NZ N 10.067 -4.121 4.545 1.00 . A A . 92 LYS NZ 1 1 8 8901 1 1 57 LYS O O 14.086 0.316 0.182 1.00 . A A . 92 LYS O 1 1 8 8902 1 1 58 PRO C C 14.937 0.813 -2.586 1.00 . A A . 93 PRO C 1 1 8 8903 1 1 58 PRO CA C 15.078 -0.687 -2.256 1.00 . A A . 93 PRO CA 1 1 8 8904 1 1 58 PRO CB C 15.078 -1.505 -3.552 1.00 . A A . 93 PRO CB 1 1 8 8905 1 1 58 PRO CD C 13.366 -2.423 -2.194 1.00 . A A . 93 PRO CD 1 1 8 8906 1 1 58 PRO CG C 14.407 -2.778 -3.193 1.00 . A A . 93 PRO CG 1 1 8 8907 1 1 58 PRO HA H 16.007 -0.841 -1.729 1.00 . A A . 93 PRO HA 1 1 8 8908 1 1 58 PRO HB2 H 14.530 -0.970 -4.313 1.00 . A A . 93 PRO HB2 1 1 8 8909 1 1 58 PRO HB3 H 16.092 -1.672 -3.882 1.00 . A A . 93 PRO HB3 1 1 8 8910 1 1 58 PRO HD2 H 12.450 -2.185 -2.714 1.00 . A A . 93 PRO HD2 1 1 8 8911 1 1 58 PRO HD3 H 13.208 -3.238 -1.505 1.00 . A A . 93 PRO HD3 1 1 8 8912 1 1 58 PRO HG2 H 13.951 -3.227 -4.063 1.00 . A A . 93 PRO HG2 1 1 8 8913 1 1 58 PRO HG3 H 15.110 -3.462 -2.748 1.00 . A A . 93 PRO HG3 1 1 8 8914 1 1 58 PRO N N 13.934 -1.225 -1.501 1.00 . A A . 93 PRO N 1 1 8 8915 1 1 58 PRO O O 15.889 1.584 -2.427 1.00 . A A . 93 PRO O 1 1 8 8916 1 1 59 HIS C C 13.421 3.520 -2.175 1.00 . A A . 94 HIS C 1 1 8 8917 1 1 59 HIS CA C 13.560 2.638 -3.382 1.00 . A A . 94 HIS CA 1 1 8 8918 1 1 59 HIS CB C 12.413 2.874 -4.382 1.00 . A A . 94 HIS CB 1 1 8 8919 1 1 59 HIS CD2 C 13.965 2.683 -6.414 1.00 . A A . 94 HIS CD2 1 1 8 8920 1 1 59 HIS CE1 C 12.502 1.938 -7.844 1.00 . A A . 94 HIS CE1 1 1 8 8921 1 1 59 HIS CG C 12.772 2.557 -5.801 1.00 . A A . 94 HIS CG 1 1 8 8922 1 1 59 HIS H H 13.033 0.581 -3.120 1.00 . A A . 94 HIS H 1 1 8 8923 1 1 59 HIS HA H 14.483 2.942 -3.858 1.00 . A A . 94 HIS HA 1 1 8 8924 1 1 59 HIS HB2 H 11.566 2.261 -4.110 1.00 . A A . 94 HIS HB2 1 1 8 8925 1 1 59 HIS HB3 H 12.126 3.913 -4.338 1.00 . A A . 94 HIS HB3 1 1 8 8926 1 1 59 HIS HD2 H 14.871 3.040 -5.950 1.00 . A A . 94 HIS HD2 1 1 8 8927 1 1 59 HIS HE1 H 12.059 1.567 -8.759 1.00 . A A . 94 HIS HE1 1 1 8 8928 1 1 59 HIS HE2 H 14.347 2.657 -8.443 1.00 . A A . 94 HIS HE2 1 1 8 8929 1 1 59 HIS N N 13.765 1.231 -3.035 1.00 . A A . 94 HIS N 1 1 8 8930 1 1 59 HIS ND1 N 11.846 2.093 -6.699 1.00 . A A . 94 HIS ND1 1 1 8 8931 1 1 59 HIS NE2 N 13.795 2.290 -7.715 1.00 . A A . 94 HIS NE2 1 1 8 8932 1 1 59 HIS O O 13.860 4.649 -2.190 1.00 . A A . 94 HIS O 1 1 8 8933 1 1 60 PHE C C 14.043 4.047 0.691 1.00 . A A . 95 PHE C 1 1 8 8934 1 1 60 PHE CA C 12.663 3.755 0.105 1.00 . A A . 95 PHE CA 1 1 8 8935 1 1 60 PHE CB C 11.826 2.924 1.074 1.00 . A A . 95 PHE CB 1 1 8 8936 1 1 60 PHE CD1 C 10.425 4.707 2.118 1.00 . A A . 95 PHE CD1 1 1 8 8937 1 1 60 PHE CD2 C 11.682 3.297 3.536 1.00 . A A . 95 PHE CD2 1 1 8 8938 1 1 60 PHE CE1 C 9.935 5.374 3.212 1.00 . A A . 95 PHE CE1 1 1 8 8939 1 1 60 PHE CE2 C 11.192 3.951 4.637 1.00 . A A . 95 PHE CE2 1 1 8 8940 1 1 60 PHE CG C 11.307 3.664 2.269 1.00 . A A . 95 PHE CG 1 1 8 8941 1 1 60 PHE CZ C 10.316 4.998 4.478 1.00 . A A . 95 PHE CZ 1 1 8 8942 1 1 60 PHE H H 12.501 2.079 -1.177 1.00 . A A . 95 PHE H 1 1 8 8943 1 1 60 PHE HA H 12.160 4.692 -0.097 1.00 . A A . 95 PHE HA 1 1 8 8944 1 1 60 PHE HB2 H 10.984 2.494 0.554 1.00 . A A . 95 PHE HB2 1 1 8 8945 1 1 60 PHE HB3 H 12.453 2.122 1.433 1.00 . A A . 95 PHE HB3 1 1 8 8946 1 1 60 PHE HD1 H 10.122 5.006 1.126 1.00 . A A . 95 PHE HD1 1 1 8 8947 1 1 60 PHE HD2 H 12.381 2.485 3.662 1.00 . A A . 95 PHE HD2 1 1 8 8948 1 1 60 PHE HE1 H 9.253 6.196 3.067 1.00 . A A . 95 PHE HE1 1 1 8 8949 1 1 60 PHE HE2 H 11.500 3.637 5.622 1.00 . A A . 95 PHE HE2 1 1 8 8950 1 1 60 PHE HZ H 9.925 5.516 5.341 1.00 . A A . 95 PHE HZ 1 1 8 8951 1 1 60 PHE N N 12.835 3.003 -1.130 1.00 . A A . 95 PHE N 1 1 8 8952 1 1 60 PHE O O 14.319 5.155 1.157 1.00 . A A . 95 PHE O 1 1 8 8953 1 1 61 GLN C C 17.096 4.161 0.264 1.00 . A A . 96 GLN C 1 1 8 8954 1 1 61 GLN CA C 16.283 3.162 1.079 1.00 . A A . 96 GLN CA 1 1 8 8955 1 1 61 GLN CB C 16.967 1.797 1.102 1.00 . A A . 96 GLN CB 1 1 8 8956 1 1 61 GLN CD C 17.059 -0.524 2.100 1.00 . A A . 96 GLN CD 1 1 8 8957 1 1 61 GLN CG C 16.399 0.837 2.133 1.00 . A A . 96 GLN CG 1 1 8 8958 1 1 61 GLN H H 14.602 2.191 0.257 1.00 . A A . 96 GLN H 1 1 8 8959 1 1 61 GLN HA H 16.253 3.545 2.088 1.00 . A A . 96 GLN HA 1 1 8 8960 1 1 61 GLN HB2 H 16.854 1.349 0.127 1.00 . A A . 96 GLN HB2 1 1 8 8961 1 1 61 GLN HB3 H 18.019 1.932 1.302 1.00 . A A . 96 GLN HB3 1 1 8 8962 1 1 61 GLN HE21 H 18.415 0.096 3.380 1.00 . A A . 96 GLN HE21 1 1 8 8963 1 1 61 GLN HE22 H 18.577 -1.536 2.845 1.00 . A A . 96 GLN HE22 1 1 8 8964 1 1 61 GLN HG2 H 16.544 1.265 3.112 1.00 . A A . 96 GLN HG2 1 1 8 8965 1 1 61 GLN HG3 H 15.341 0.716 1.948 1.00 . A A . 96 GLN HG3 1 1 8 8966 1 1 61 GLN N N 14.909 3.052 0.620 1.00 . A A . 96 GLN N 1 1 8 8967 1 1 61 GLN NE2 N 18.112 -0.671 2.847 1.00 . A A . 96 GLN NE2 1 1 8 8968 1 1 61 GLN O O 17.835 4.948 0.815 1.00 . A A . 96 GLN O 1 1 8 8969 1 1 61 GLN OE1 O 16.613 -1.444 1.393 1.00 . A A . 96 GLN OE1 1 1 8 8970 1 1 62 GLN C C 17.168 6.411 -1.938 1.00 . A A . 97 GLN C 1 1 8 8971 1 1 62 GLN CA C 17.737 4.983 -1.893 1.00 . A A . 97 GLN CA 1 1 8 8972 1 1 62 GLN CB C 17.792 4.382 -3.275 1.00 . A A . 97 GLN CB 1 1 8 8973 1 1 62 GLN CD C 18.503 2.420 -4.675 1.00 . A A . 97 GLN CD 1 1 8 8974 1 1 62 GLN CG C 18.600 3.100 -3.338 1.00 . A A . 97 GLN CG 1 1 8 8975 1 1 62 GLN H H 16.423 3.430 -1.473 1.00 . A A . 97 GLN H 1 1 8 8976 1 1 62 GLN HA H 18.747 5.030 -1.517 1.00 . A A . 97 GLN HA 1 1 8 8977 1 1 62 GLN HB2 H 16.780 4.161 -3.585 1.00 . A A . 97 GLN HB2 1 1 8 8978 1 1 62 GLN HB3 H 18.219 5.101 -3.950 1.00 . A A . 97 GLN HB3 1 1 8 8979 1 1 62 GLN HE21 H 16.944 1.442 -4.034 1.00 . A A . 97 GLN HE21 1 1 8 8980 1 1 62 GLN HE22 H 17.432 1.091 -5.659 1.00 . A A . 97 GLN HE22 1 1 8 8981 1 1 62 GLN HG2 H 19.638 3.333 -3.148 1.00 . A A . 97 GLN HG2 1 1 8 8982 1 1 62 GLN HG3 H 18.241 2.424 -2.575 1.00 . A A . 97 GLN HG3 1 1 8 8983 1 1 62 GLN N N 16.993 4.096 -1.038 1.00 . A A . 97 GLN N 1 1 8 8984 1 1 62 GLN NE2 N 17.534 1.572 -4.809 1.00 . A A . 97 GLN NE2 1 1 8 8985 1 1 62 GLN O O 17.887 7.377 -1.710 1.00 . A A . 97 GLN O 1 1 8 8986 1 1 62 GLN OE1 O 19.301 2.660 -5.579 1.00 . A A . 97 GLN OE1 1 1 8 8987 1 1 63 LEU C C 14.951 8.540 -1.078 1.00 . A A . 98 LEU C 1 1 8 8988 1 1 63 LEU CA C 15.240 7.815 -2.380 1.00 . A A . 98 LEU CA 1 1 8 8989 1 1 63 LEU CB C 13.965 7.626 -3.167 1.00 . A A . 98 LEU CB 1 1 8 8990 1 1 63 LEU CD1 C 12.878 6.633 -5.142 1.00 . A A . 98 LEU CD1 1 1 8 8991 1 1 63 LEU CD2 C 14.543 8.382 -5.476 1.00 . A A . 98 LEU CD2 1 1 8 8992 1 1 63 LEU CG C 14.149 7.198 -4.622 1.00 . A A . 98 LEU CG 1 1 8 8993 1 1 63 LEU H H 15.323 5.722 -2.272 1.00 . A A . 98 LEU H 1 1 8 8994 1 1 63 LEU HA H 15.898 8.423 -2.981 1.00 . A A . 98 LEU HA 1 1 8 8995 1 1 63 LEU HB2 H 13.392 6.866 -2.658 1.00 . A A . 98 LEU HB2 1 1 8 8996 1 1 63 LEU HB3 H 13.410 8.551 -3.149 1.00 . A A . 98 LEU HB3 1 1 8 8997 1 1 63 LEU HD11 H 13.000 6.354 -6.178 1.00 . A A . 98 LEU HD11 1 1 8 8998 1 1 63 LEU HD12 H 12.097 7.370 -5.039 1.00 . A A . 98 LEU HD12 1 1 8 8999 1 1 63 LEU HD13 H 12.639 5.758 -4.560 1.00 . A A . 98 LEU HD13 1 1 8 9000 1 1 63 LEU HD21 H 14.591 8.076 -6.512 1.00 . A A . 98 LEU HD21 1 1 8 9001 1 1 63 LEU HD22 H 15.500 8.762 -5.154 1.00 . A A . 98 LEU HD22 1 1 8 9002 1 1 63 LEU HD23 H 13.782 9.140 -5.363 1.00 . A A . 98 LEU HD23 1 1 8 9003 1 1 63 LEU HG H 14.926 6.452 -4.696 1.00 . A A . 98 LEU HG 1 1 8 9004 1 1 63 LEU N N 15.886 6.525 -2.198 1.00 . A A . 98 LEU N 1 1 8 9005 1 1 63 LEU O O 15.212 9.734 -0.966 1.00 . A A . 98 LEU O 1 1 8 9006 1 1 64 PHE C C 15.199 8.247 2.226 1.00 . A A . 99 PHE C 1 1 8 9007 1 1 64 PHE CA C 14.121 8.489 1.175 1.00 . A A . 99 PHE CA 1 1 8 9008 1 1 64 PHE CB C 12.718 8.083 1.686 1.00 . A A . 99 PHE CB 1 1 8 9009 1 1 64 PHE CD1 C 11.696 9.824 0.147 1.00 . A A . 99 PHE CD1 1 1 8 9010 1 1 64 PHE CD2 C 10.307 8.036 0.924 1.00 . A A . 99 PHE CD2 1 1 8 9011 1 1 64 PHE CE1 C 10.638 10.334 -0.572 1.00 . A A . 99 PHE CE1 1 1 8 9012 1 1 64 PHE CE2 C 9.254 8.560 0.201 1.00 . A A . 99 PHE CE2 1 1 8 9013 1 1 64 PHE CG C 11.553 8.661 0.907 1.00 . A A . 99 PHE CG 1 1 8 9014 1 1 64 PHE CZ C 9.426 9.707 -0.546 1.00 . A A . 99 PHE CZ 1 1 8 9015 1 1 64 PHE H H 14.253 6.876 -0.179 1.00 . A A . 99 PHE H 1 1 8 9016 1 1 64 PHE HA H 14.124 9.549 0.984 1.00 . A A . 99 PHE HA 1 1 8 9017 1 1 64 PHE HB2 H 12.626 7.033 1.453 1.00 . A A . 99 PHE HB2 1 1 8 9018 1 1 64 PHE HB3 H 12.595 8.235 2.745 1.00 . A A . 99 PHE HB3 1 1 8 9019 1 1 64 PHE HD1 H 12.642 10.340 0.104 1.00 . A A . 99 PHE HD1 1 1 8 9020 1 1 64 PHE HD2 H 10.131 7.141 1.510 1.00 . A A . 99 PHE HD2 1 1 8 9021 1 1 64 PHE HE1 H 10.748 11.233 -1.159 1.00 . A A . 99 PHE HE1 1 1 8 9022 1 1 64 PHE HE2 H 8.294 8.066 0.224 1.00 . A A . 99 PHE HE2 1 1 8 9023 1 1 64 PHE HZ H 8.615 10.128 -1.119 1.00 . A A . 99 PHE HZ 1 1 8 9024 1 1 64 PHE N N 14.447 7.832 -0.080 1.00 . A A . 99 PHE N 1 1 8 9025 1 1 64 PHE O O 15.172 8.838 3.310 1.00 . A A . 99 PHE O 1 1 8 9026 1 1 65 LYS C C 16.921 6.438 4.036 1.00 . A A . 100 LYS C 1 1 8 9027 1 1 65 LYS CA C 17.306 7.047 2.704 1.00 . A A . 100 LYS CA 1 1 8 9028 1 1 65 LYS CB C 18.243 8.249 2.862 1.00 . A A . 100 LYS CB 1 1 8 9029 1 1 65 LYS CD C 19.862 9.880 1.707 1.00 . A A . 100 LYS CD 1 1 8 9030 1 1 65 LYS CE C 19.306 11.245 2.157 1.00 . A A . 100 LYS CE 1 1 8 9031 1 1 65 LYS CG C 18.804 8.771 1.538 1.00 . A A . 100 LYS CG 1 1 8 9032 1 1 65 LYS H H 16.069 6.868 1.047 1.00 . A A . 100 LYS H 1 1 8 9033 1 1 65 LYS HA H 17.835 6.277 2.161 1.00 . A A . 100 LYS HA 1 1 8 9034 1 1 65 LYS HB2 H 17.712 9.044 3.362 1.00 . A A . 100 LYS HB2 1 1 8 9035 1 1 65 LYS HB3 H 19.067 7.922 3.475 1.00 . A A . 100 LYS HB3 1 1 8 9036 1 1 65 LYS HD2 H 20.578 9.555 2.445 1.00 . A A . 100 LYS HD2 1 1 8 9037 1 1 65 LYS HD3 H 20.372 10.005 0.762 1.00 . A A . 100 LYS HD3 1 1 8 9038 1 1 65 LYS HE2 H 20.094 11.979 2.093 1.00 . A A . 100 LYS HE2 1 1 8 9039 1 1 65 LYS HE3 H 18.522 11.514 1.466 1.00 . A A . 100 LYS HE3 1 1 8 9040 1 1 65 LYS HG2 H 19.256 7.947 1.006 1.00 . A A . 100 LYS HG2 1 1 8 9041 1 1 65 LYS HG3 H 17.981 9.157 0.954 1.00 . A A . 100 LYS HG3 1 1 8 9042 1 1 65 LYS HZ1 H 18.529 12.255 3.788 1.00 . A A . 100 LYS HZ1 1 1 8 9043 1 1 65 LYS HZ2 H 19.441 10.920 4.241 1.00 . A A . 100 LYS HZ2 1 1 8 9044 1 1 65 LYS HZ3 H 17.880 10.730 3.614 1.00 . A A . 100 LYS HZ3 1 1 8 9045 1 1 65 LYS N N 16.147 7.364 1.887 1.00 . A A . 100 LYS N 1 1 8 9046 1 1 65 LYS NZ N 18.762 11.273 3.536 1.00 . A A . 100 LYS NZ 1 1 8 9047 1 1 65 LYS O O 17.588 6.636 5.051 1.00 . A A . 100 LYS O 1 1 8 9048 1 1 66 SER C C 15.179 3.571 4.949 1.00 . A A . 101 SER C 1 1 8 9049 1 1 66 SER CA C 15.366 5.059 5.218 1.00 . A A . 101 SER CA 1 1 8 9050 1 1 66 SER CB C 14.031 5.703 5.585 1.00 . A A . 101 SER CB 1 1 8 9051 1 1 66 SER H H 15.381 5.526 3.186 1.00 . A A . 101 SER H 1 1 8 9052 1 1 66 SER HA H 16.068 5.211 6.024 1.00 . A A . 101 SER HA 1 1 8 9053 1 1 66 SER HB2 H 13.294 5.454 4.835 1.00 . A A . 101 SER HB2 1 1 8 9054 1 1 66 SER HB3 H 13.703 5.337 6.547 1.00 . A A . 101 SER HB3 1 1 8 9055 1 1 66 SER HG H 15.061 7.322 5.371 1.00 . A A . 101 SER HG 1 1 8 9056 1 1 66 SER N N 15.860 5.690 4.028 1.00 . A A . 101 SER N 1 1 8 9057 1 1 66 SER O O 14.807 3.186 3.845 1.00 . A A . 101 SER O 1 1 8 9058 1 1 66 SER OG O 14.163 7.119 5.654 1.00 . A A . 101 SER OG 1 1 8 9059 1 1 67 LYS C C 13.822 1.043 5.682 1.00 . A A . 102 LYS C 1 1 8 9060 1 1 67 LYS CA C 15.300 1.317 5.866 1.00 . A A . 102 LYS CA 1 1 8 9061 1 1 67 LYS CB C 15.780 0.684 7.186 1.00 . A A . 102 LYS CB 1 1 8 9062 1 1 67 LYS CD C 16.359 -1.670 6.405 1.00 . A A . 102 LYS CD 1 1 8 9063 1 1 67 LYS CE C 16.082 -3.148 6.646 1.00 . A A . 102 LYS CE 1 1 8 9064 1 1 67 LYS CG C 15.523 -0.818 7.348 1.00 . A A . 102 LYS CG 1 1 8 9065 1 1 67 LYS H H 15.874 3.133 6.757 1.00 . A A . 102 LYS H 1 1 8 9066 1 1 67 LYS HA H 15.867 0.907 5.045 1.00 . A A . 102 LYS HA 1 1 8 9067 1 1 67 LYS HB2 H 16.846 0.841 7.264 1.00 . A A . 102 LYS HB2 1 1 8 9068 1 1 67 LYS HB3 H 15.299 1.201 8.003 1.00 . A A . 102 LYS HB3 1 1 8 9069 1 1 67 LYS HD2 H 16.106 -1.423 5.384 1.00 . A A . 102 LYS HD2 1 1 8 9070 1 1 67 LYS HD3 H 17.406 -1.474 6.578 1.00 . A A . 102 LYS HD3 1 1 8 9071 1 1 67 LYS HE2 H 16.255 -3.366 7.689 1.00 . A A . 102 LYS HE2 1 1 8 9072 1 1 67 LYS HE3 H 15.049 -3.349 6.407 1.00 . A A . 102 LYS HE3 1 1 8 9073 1 1 67 LYS HG2 H 15.756 -1.102 8.363 1.00 . A A . 102 LYS HG2 1 1 8 9074 1 1 67 LYS HG3 H 14.476 -1.006 7.159 1.00 . A A . 102 LYS HG3 1 1 8 9075 1 1 67 LYS HZ1 H 16.707 -5.020 5.998 1.00 . A A . 102 LYS HZ1 1 1 8 9076 1 1 67 LYS HZ2 H 17.944 -3.894 6.101 1.00 . A A . 102 LYS HZ2 1 1 8 9077 1 1 67 LYS HZ3 H 16.878 -3.829 4.817 1.00 . A A . 102 LYS HZ3 1 1 8 9078 1 1 67 LYS N N 15.497 2.755 5.934 1.00 . A A . 102 LYS N 1 1 8 9079 1 1 67 LYS NZ N 16.947 -4.022 5.835 1.00 . A A . 102 LYS NZ 1 1 8 9080 1 1 67 LYS O O 13.023 1.492 6.491 1.00 . A A . 102 LYS O 1 1 8 9081 1 1 68 GLY C C 11.476 -0.828 5.421 1.00 . A A . 103 GLY C 1 1 8 9082 1 1 68 GLY CA C 12.083 0.017 4.339 1.00 . A A . 103 GLY CA 1 1 8 9083 1 1 68 GLY H H 14.143 0.080 3.948 1.00 . A A . 103 GLY H 1 1 8 9084 1 1 68 GLY HA2 H 11.493 0.917 4.259 1.00 . A A . 103 GLY HA2 1 1 8 9085 1 1 68 GLY HA3 H 12.029 -0.526 3.408 1.00 . A A . 103 GLY HA3 1 1 8 9086 1 1 68 GLY N N 13.466 0.351 4.601 1.00 . A A . 103 GLY N 1 1 8 9087 1 1 68 GLY O O 11.586 -2.049 5.393 1.00 . A A . 103 GLY O 1 1 8 9088 1 1 69 ASN C C 8.806 -0.574 7.625 1.00 . A A . 104 ASN C 1 1 8 9089 1 1 69 ASN CA C 10.272 -0.875 7.485 1.00 . A A . 104 ASN CA 1 1 8 9090 1 1 69 ASN CB C 11.002 -0.498 8.797 1.00 . A A . 104 ASN CB 1 1 8 9091 1 1 69 ASN CG C 10.767 0.950 9.262 1.00 . A A . 104 ASN CG 1 1 8 9092 1 1 69 ASN H H 10.743 0.786 6.310 1.00 . A A . 104 ASN H 1 1 8 9093 1 1 69 ASN HA H 10.401 -1.935 7.325 1.00 . A A . 104 ASN HA 1 1 8 9094 1 1 69 ASN HB2 H 10.668 -1.158 9.584 1.00 . A A . 104 ASN HB2 1 1 8 9095 1 1 69 ASN HB3 H 12.063 -0.639 8.652 1.00 . A A . 104 ASN HB3 1 1 8 9096 1 1 69 ASN HD21 H 12.313 1.595 8.195 1.00 . A A . 104 ASN HD21 1 1 8 9097 1 1 69 ASN HD22 H 11.509 2.802 9.079 1.00 . A A . 104 ASN HD22 1 1 8 9098 1 1 69 ASN N N 10.833 -0.191 6.360 1.00 . A A . 104 ASN N 1 1 8 9099 1 1 69 ASN ND2 N 11.591 1.861 8.810 1.00 . A A . 104 ASN ND2 1 1 8 9100 1 1 69 ASN O O 8.350 0.545 7.332 1.00 . A A . 104 ASN O 1 1 8 9101 1 1 69 ASN OD1 O 9.832 1.236 10.023 1.00 . A A . 104 ASN OD1 1 1 8 9102 1 1 70 TYR C C 6.318 -2.954 8.785 1.00 . A A . 105 TYR C 1 1 8 9103 1 1 70 TYR CA C 6.688 -1.549 8.364 1.00 . A A . 105 TYR CA 1 1 8 9104 1 1 70 TYR CB C 5.766 -1.032 7.248 1.00 . A A . 105 TYR CB 1 1 8 9105 1 1 70 TYR CD1 C 3.771 -0.457 8.671 1.00 . A A . 105 TYR CD1 1 1 8 9106 1 1 70 TYR CD2 C 4.844 1.307 7.502 1.00 . A A . 105 TYR CD2 1 1 8 9107 1 1 70 TYR CE1 C 2.884 0.438 9.223 1.00 . A A . 105 TYR CE1 1 1 8 9108 1 1 70 TYR CE2 C 3.966 2.215 8.062 1.00 . A A . 105 TYR CE2 1 1 8 9109 1 1 70 TYR CG C 4.760 -0.045 7.800 1.00 . A A . 105 TYR CG 1 1 8 9110 1 1 70 TYR CZ C 2.986 1.772 8.919 1.00 . A A . 105 TYR CZ 1 1 8 9111 1 1 70 TYR H H 8.503 -2.485 8.024 1.00 . A A . 105 TYR H 1 1 8 9112 1 1 70 TYR HA H 6.623 -0.918 9.239 1.00 . A A . 105 TYR HA 1 1 8 9113 1 1 70 TYR HB2 H 6.357 -0.542 6.489 1.00 . A A . 105 TYR HB2 1 1 8 9114 1 1 70 TYR HB3 H 5.225 -1.859 6.813 1.00 . A A . 105 TYR HB3 1 1 8 9115 1 1 70 TYR HD1 H 3.696 -1.507 8.907 1.00 . A A . 105 TYR HD1 1 1 8 9116 1 1 70 TYR HD2 H 5.610 1.651 6.823 1.00 . A A . 105 TYR HD2 1 1 8 9117 1 1 70 TYR HE1 H 2.115 0.089 9.895 1.00 . A A . 105 TYR HE1 1 1 8 9118 1 1 70 TYR HE2 H 4.042 3.263 7.821 1.00 . A A . 105 TYR HE2 1 1 8 9119 1 1 70 TYR HH H 2.136 2.440 10.444 1.00 . A A . 105 TYR HH 1 1 8 9120 1 1 70 TYR N N 8.083 -1.600 7.993 1.00 . A A . 105 TYR N 1 1 8 9121 1 1 70 TYR O O 5.258 -3.486 8.480 1.00 . A A . 105 TYR O 1 1 8 9122 1 1 70 TYR OH O 2.120 2.675 9.509 1.00 . A A . 105 TYR OH 1 1 8 9123 1 1 71 ASP C C 6.318 -5.032 11.203 1.00 . A A . 106 ASP C 1 1 8 9124 1 1 71 ASP CA C 7.205 -4.913 9.982 1.00 . A A . 106 ASP CA 1 1 8 9125 1 1 71 ASP CB C 8.636 -5.341 10.353 1.00 . A A . 106 ASP CB 1 1 8 9126 1 1 71 ASP CG C 9.229 -4.530 11.519 1.00 . A A . 106 ASP CG 1 1 8 9127 1 1 71 ASP H H 8.000 -2.987 9.837 1.00 . A A . 106 ASP H 1 1 8 9128 1 1 71 ASP HA H 6.848 -5.551 9.189 1.00 . A A . 106 ASP HA 1 1 8 9129 1 1 71 ASP HB2 H 8.630 -6.384 10.634 1.00 . A A . 106 ASP HB2 1 1 8 9130 1 1 71 ASP HB3 H 9.273 -5.211 9.491 1.00 . A A . 106 ASP HB3 1 1 8 9131 1 1 71 ASP N N 7.242 -3.528 9.520 1.00 . A A . 106 ASP N 1 1 8 9132 1 1 71 ASP O O 5.836 -6.113 11.547 1.00 . A A . 106 ASP O 1 1 8 9133 1 1 71 ASP OD1 O 9.181 -3.266 11.486 1.00 . A A . 106 ASP OD1 1 1 8 9134 1 1 71 ASP OD2 O 9.749 -5.136 12.480 1.00 . A A . 106 ASP OD2 1 1 8 9135 1 1 72 GLU C C 4.562 -2.508 12.889 1.00 . A A . 107 GLU C 1 1 8 9136 1 1 72 GLU CA C 5.343 -3.793 13.010 1.00 . A A . 107 GLU CA 1 1 8 9137 1 1 72 GLU CB C 6.311 -3.731 14.196 1.00 . A A . 107 GLU CB 1 1 8 9138 1 1 72 GLU CD C 6.690 -3.444 16.643 1.00 . A A . 107 GLU CD 1 1 8 9139 1 1 72 GLU CG C 5.663 -3.626 15.562 1.00 . A A . 107 GLU CG 1 1 8 9140 1 1 72 GLU H H 6.452 -3.096 11.412 1.00 . A A . 107 GLU H 1 1 8 9141 1 1 72 GLU HA H 4.677 -4.636 13.117 1.00 . A A . 107 GLU HA 1 1 8 9142 1 1 72 GLU HB2 H 6.924 -4.619 14.187 1.00 . A A . 107 GLU HB2 1 1 8 9143 1 1 72 GLU HB3 H 6.954 -2.874 14.060 1.00 . A A . 107 GLU HB3 1 1 8 9144 1 1 72 GLU HG2 H 4.993 -2.778 15.566 1.00 . A A . 107 GLU HG2 1 1 8 9145 1 1 72 GLU HG3 H 5.107 -4.531 15.757 1.00 . A A . 107 GLU HG3 1 1 8 9146 1 1 72 GLU N N 6.095 -3.916 11.811 1.00 . A A . 107 GLU N 1 1 8 9147 1 1 72 GLU O O 5.172 -1.429 13.027 1.00 . A A . 107 GLU O 1 1 8 9148 1 1 72 GLU OXT O 3.364 -2.555 12.585 1.00 . A A . 107 GLU OXT 1 1 8 9149 1 1 72 GLU OE1 O 7.162 -2.300 16.840 1.00 . A A . 107 GLU OE1 1 1 8 9150 1 1 72 GLU OE2 O 7.062 -4.434 17.310 1.00 . A A . 107 GLU OE2 1 1 8 9151 2 2 1 ZN ZN ZN -6.668 -0.160 -4.767 1.00 . B A . 201 ZN ZN 1 1 8 9152 3 2 1 ZN ZN ZN 10.498 0.774 -6.111 1.00 . C A . 202 ZN ZN 1 1 9 9153 1 1 1 ARG C C -24.110 -1.859 -3.559 1.00 . A A . 36 ARG C 1 1 9 9154 1 1 1 ARG CA C -25.318 -2.760 -3.733 1.00 . A A . 36 ARG CA 1 1 9 9155 1 1 1 ARG CB C -26.493 -1.979 -4.350 1.00 . A A . 36 ARG CB 1 1 9 9156 1 1 1 ARG CD C -28.703 -2.027 -5.530 1.00 . A A . 36 ARG CD 1 1 9 9157 1 1 1 ARG CG C -27.602 -2.855 -4.895 1.00 . A A . 36 ARG CG 1 1 9 9158 1 1 1 ARG CZ C -30.840 -2.416 -6.748 1.00 . A A . 36 ARG CZ 1 1 9 9159 1 1 1 ARG H1 H -24.896 -4.059 -2.198 1.00 . A A . 36 ARG H1 1 1 9 9160 1 1 1 ARG H2 H -26.535 -4.006 -2.556 1.00 . A A . 36 ARG H2 1 1 9 9161 1 1 1 ARG H3 H -25.787 -2.738 -1.716 1.00 . A A . 36 ARG H3 1 1 9 9162 1 1 1 ARG HA H -25.024 -3.541 -4.419 1.00 . A A . 36 ARG HA 1 1 9 9163 1 1 1 ARG HB2 H -26.915 -1.319 -3.607 1.00 . A A . 36 ARG HB2 1 1 9 9164 1 1 1 ARG HB3 H -26.109 -1.379 -5.161 1.00 . A A . 36 ARG HB3 1 1 9 9165 1 1 1 ARG HD2 H -29.187 -1.440 -4.764 1.00 . A A . 36 ARG HD2 1 1 9 9166 1 1 1 ARG HD3 H -28.263 -1.370 -6.266 1.00 . A A . 36 ARG HD3 1 1 9 9167 1 1 1 ARG HE H -29.481 -3.827 -6.224 1.00 . A A . 36 ARG HE 1 1 9 9168 1 1 1 ARG HG2 H -27.188 -3.519 -5.639 1.00 . A A . 36 ARG HG2 1 1 9 9169 1 1 1 ARG HG3 H -28.021 -3.437 -4.088 1.00 . A A . 36 ARG HG3 1 1 9 9170 1 1 1 ARG HH11 H -30.574 -0.456 -6.214 1.00 . A A . 36 ARG HH11 1 1 9 9171 1 1 1 ARG HH12 H -31.999 -0.763 -7.085 1.00 . A A . 36 ARG HH12 1 1 9 9172 1 1 1 ARG HH21 H -31.443 -4.236 -7.451 1.00 . A A . 36 ARG HH21 1 1 9 9173 1 1 1 ARG HH22 H -32.505 -2.962 -7.806 1.00 . A A . 36 ARG HH22 1 1 9 9174 1 1 1 ARG N N -25.676 -3.431 -2.481 1.00 . A A . 36 ARG N 1 1 9 9175 1 1 1 ARG NE N -29.709 -2.868 -6.188 1.00 . A A . 36 ARG NE 1 1 9 9176 1 1 1 ARG NH1 N -31.158 -1.127 -6.676 1.00 . A A . 36 ARG NH1 1 1 9 9177 1 1 1 ARG NH2 N -31.649 -3.256 -7.375 1.00 . A A . 36 ARG NH2 1 1 9 9178 1 1 1 ARG O O -23.015 -2.196 -4.021 1.00 . A A . 36 ARG O 1 1 9 9179 1 1 2 ALA C C -23.286 0.965 -1.400 1.00 . A A . 37 ALA C 1 1 9 9180 1 1 2 ALA CA C -23.185 0.211 -2.719 1.00 . A A . 37 ALA CA 1 1 9 9181 1 1 2 ALA CB C -23.134 1.182 -3.896 1.00 . A A . 37 ALA CB 1 1 9 9182 1 1 2 ALA H H -25.146 -0.492 -2.475 1.00 . A A . 37 ALA H 1 1 9 9183 1 1 2 ALA HA H -22.269 -0.361 -2.718 1.00 . A A . 37 ALA HA 1 1 9 9184 1 1 2 ALA HB1 H -22.263 1.813 -3.802 1.00 . A A . 37 ALA HB1 1 1 9 9185 1 1 2 ALA HB2 H -24.023 1.794 -3.895 1.00 . A A . 37 ALA HB2 1 1 9 9186 1 1 2 ALA HB3 H -23.078 0.627 -4.820 1.00 . A A . 37 ALA HB3 1 1 9 9187 1 1 2 ALA N N -24.281 -0.726 -2.883 1.00 . A A . 37 ALA N 1 1 9 9188 1 1 2 ALA O O -22.936 2.144 -1.313 1.00 . A A . 37 ALA O 1 1 9 9189 1 1 3 GLN C C -22.541 0.715 1.699 1.00 . A A . 38 GLN C 1 1 9 9190 1 1 3 GLN CA C -23.863 0.924 0.947 1.00 . A A . 38 GLN CA 1 1 9 9191 1 1 3 GLN CB C -25.051 0.347 1.736 1.00 . A A . 38 GLN CB 1 1 9 9192 1 1 3 GLN CD C -25.099 2.154 3.573 1.00 . A A . 38 GLN CD 1 1 9 9193 1 1 3 GLN CG C -25.878 1.386 2.517 1.00 . A A . 38 GLN CG 1 1 9 9194 1 1 3 GLN H H -24.015 -0.652 -0.477 1.00 . A A . 38 GLN H 1 1 9 9195 1 1 3 GLN HA H -24.002 1.984 0.783 1.00 . A A . 38 GLN HA 1 1 9 9196 1 1 3 GLN HB2 H -25.709 -0.163 1.048 1.00 . A A . 38 GLN HB2 1 1 9 9197 1 1 3 GLN HB3 H -24.665 -0.371 2.446 1.00 . A A . 38 GLN HB3 1 1 9 9198 1 1 3 GLN HE21 H -25.542 0.789 4.931 1.00 . A A . 38 GLN HE21 1 1 9 9199 1 1 3 GLN HE22 H -24.603 2.117 5.488 1.00 . A A . 38 GLN HE22 1 1 9 9200 1 1 3 GLN HG2 H -26.277 2.102 1.813 1.00 . A A . 38 GLN HG2 1 1 9 9201 1 1 3 GLN HG3 H -26.700 0.876 2.997 1.00 . A A . 38 GLN HG3 1 1 9 9202 1 1 3 GLN N N -23.747 0.286 -0.363 1.00 . A A . 38 GLN N 1 1 9 9203 1 1 3 GLN NE2 N -25.070 1.638 4.773 1.00 . A A . 38 GLN NE2 1 1 9 9204 1 1 3 GLN O O -22.329 1.212 2.804 1.00 . A A . 38 GLN O 1 1 9 9205 1 1 3 GLN OE1 O -24.519 3.216 3.300 1.00 . A A . 38 GLN OE1 1 1 9 9206 1 1 4 VAL C C -19.447 0.937 1.252 1.00 . A A . 39 VAL C 1 1 9 9207 1 1 4 VAL CA C -20.335 -0.265 1.598 1.00 . A A . 39 VAL CA 1 1 9 9208 1 1 4 VAL CB C -19.729 -1.613 1.090 1.00 . A A . 39 VAL CB 1 1 9 9209 1 1 4 VAL CG1 C -20.446 -2.775 1.754 1.00 . A A . 39 VAL CG1 1 1 9 9210 1 1 4 VAL CG2 C -19.857 -1.746 -0.433 1.00 . A A . 39 VAL CG2 1 1 9 9211 1 1 4 VAL H H -21.931 -0.464 0.244 1.00 . A A . 39 VAL H 1 1 9 9212 1 1 4 VAL HA H -20.420 -0.298 2.675 1.00 . A A . 39 VAL HA 1 1 9 9213 1 1 4 VAL HB H -18.684 -1.648 1.360 1.00 . A A . 39 VAL HB 1 1 9 9214 1 1 4 VAL HG11 H -20.039 -3.709 1.397 1.00 . A A . 39 VAL HG11 1 1 9 9215 1 1 4 VAL HG12 H -21.499 -2.729 1.520 1.00 . A A . 39 VAL HG12 1 1 9 9216 1 1 4 VAL HG13 H -20.319 -2.716 2.824 1.00 . A A . 39 VAL HG13 1 1 9 9217 1 1 4 VAL HG21 H -20.901 -1.722 -0.710 1.00 . A A . 39 VAL HG21 1 1 9 9218 1 1 4 VAL HG22 H -19.419 -2.677 -0.758 1.00 . A A . 39 VAL HG22 1 1 9 9219 1 1 4 VAL HG23 H -19.343 -0.920 -0.903 1.00 . A A . 39 VAL HG23 1 1 9 9220 1 1 4 VAL N N -21.666 -0.043 1.087 1.00 . A A . 39 VAL N 1 1 9 9221 1 1 4 VAL O O -18.709 0.950 0.272 1.00 . A A . 39 VAL O 1 1 9 9222 1 1 5 LYS C C -17.426 3.176 2.353 1.00 . A A . 40 LYS C 1 1 9 9223 1 1 5 LYS CA C -18.857 3.208 1.820 1.00 . A A . 40 LYS CA 1 1 9 9224 1 1 5 LYS CB C -19.643 4.381 2.419 1.00 . A A . 40 LYS CB 1 1 9 9225 1 1 5 LYS CD C -21.071 4.773 0.369 1.00 . A A . 40 LYS CD 1 1 9 9226 1 1 5 LYS CE C -22.483 5.000 -0.143 1.00 . A A . 40 LYS CE 1 1 9 9227 1 1 5 LYS CG C -21.061 4.536 1.871 1.00 . A A . 40 LYS CG 1 1 9 9228 1 1 5 LYS H H -20.123 1.859 2.851 1.00 . A A . 40 LYS H 1 1 9 9229 1 1 5 LYS HA H -18.807 3.343 0.750 1.00 . A A . 40 LYS HA 1 1 9 9230 1 1 5 LYS HB2 H -19.709 4.244 3.488 1.00 . A A . 40 LYS HB2 1 1 9 9231 1 1 5 LYS HB3 H -19.101 5.293 2.216 1.00 . A A . 40 LYS HB3 1 1 9 9232 1 1 5 LYS HD2 H -20.477 5.648 0.151 1.00 . A A . 40 LYS HD2 1 1 9 9233 1 1 5 LYS HD3 H -20.650 3.914 -0.132 1.00 . A A . 40 LYS HD3 1 1 9 9234 1 1 5 LYS HE2 H -23.095 4.153 0.130 1.00 . A A . 40 LYS HE2 1 1 9 9235 1 1 5 LYS HE3 H -22.882 5.891 0.319 1.00 . A A . 40 LYS HE3 1 1 9 9236 1 1 5 LYS HG2 H -21.618 3.635 2.079 1.00 . A A . 40 LYS HG2 1 1 9 9237 1 1 5 LYS HG3 H -21.534 5.370 2.364 1.00 . A A . 40 LYS HG3 1 1 9 9238 1 1 5 LYS HZ1 H -22.190 4.310 -2.110 1.00 . A A . 40 LYS HZ1 1 1 9 9239 1 1 5 LYS HZ2 H -21.940 5.971 -1.910 1.00 . A A . 40 LYS HZ2 1 1 9 9240 1 1 5 LYS HZ3 H -23.485 5.372 -1.926 1.00 . A A . 40 LYS HZ3 1 1 9 9241 1 1 5 LYS N N -19.551 1.958 2.060 1.00 . A A . 40 LYS N 1 1 9 9242 1 1 5 LYS NZ N -22.518 5.161 -1.610 1.00 . A A . 40 LYS NZ 1 1 9 9243 1 1 5 LYS O O -17.041 3.977 3.211 1.00 . A A . 40 LYS O 1 1 9 9244 1 1 6 GLU C C -14.469 2.688 1.105 1.00 . A A . 41 GLU C 1 1 9 9245 1 1 6 GLU CA C -15.274 2.123 2.217 1.00 . A A . 41 GLU CA 1 1 9 9246 1 1 6 GLU CB C -14.887 0.675 2.379 1.00 . A A . 41 GLU CB 1 1 9 9247 1 1 6 GLU CD C -15.289 0.436 4.846 1.00 . A A . 41 GLU CD 1 1 9 9248 1 1 6 GLU CG C -15.614 -0.055 3.461 1.00 . A A . 41 GLU CG 1 1 9 9249 1 1 6 GLU H H -17.046 1.619 1.207 1.00 . A A . 41 GLU H 1 1 9 9250 1 1 6 GLU HA H -15.086 2.654 3.136 1.00 . A A . 41 GLU HA 1 1 9 9251 1 1 6 GLU HB2 H -15.075 0.163 1.446 1.00 . A A . 41 GLU HB2 1 1 9 9252 1 1 6 GLU HB3 H -13.829 0.628 2.591 1.00 . A A . 41 GLU HB3 1 1 9 9253 1 1 6 GLU HG2 H -16.680 0.003 3.299 1.00 . A A . 41 GLU HG2 1 1 9 9254 1 1 6 GLU HG3 H -15.270 -1.070 3.373 1.00 . A A . 41 GLU HG3 1 1 9 9255 1 1 6 GLU N N -16.662 2.244 1.862 1.00 . A A . 41 GLU N 1 1 9 9256 1 1 6 GLU O O -14.663 2.323 -0.031 1.00 . A A . 41 GLU O 1 1 9 9257 1 1 6 GLU OE1 O -15.953 1.378 5.344 1.00 . A A . 41 GLU OE1 1 1 9 9258 1 1 6 GLU OE2 O -14.402 -0.143 5.481 1.00 . A A . 41 GLU OE2 1 1 9 9259 1 1 7 THR C C -11.350 3.674 0.434 1.00 . A A . 42 THR C 1 1 9 9260 1 1 7 THR CA C -12.808 4.092 0.325 1.00 . A A . 42 THR CA 1 1 9 9261 1 1 7 THR CB C -12.928 5.617 0.243 1.00 . A A . 42 THR CB 1 1 9 9262 1 1 7 THR CG2 C -13.358 6.000 -1.168 1.00 . A A . 42 THR CG2 1 1 9 9263 1 1 7 THR H H -13.399 3.743 2.332 1.00 . A A . 42 THR H 1 1 9 9264 1 1 7 THR HA H -13.256 3.664 -0.565 1.00 . A A . 42 THR HA 1 1 9 9265 1 1 7 THR HB H -11.955 6.045 0.431 1.00 . A A . 42 THR HB 1 1 9 9266 1 1 7 THR HG1 H -13.751 5.733 2.050 1.00 . A A . 42 THR HG1 1 1 9 9267 1 1 7 THR HG21 H -14.293 5.503 -1.392 1.00 . A A . 42 THR HG21 1 1 9 9268 1 1 7 THR HG22 H -12.605 5.677 -1.872 1.00 . A A . 42 THR HG22 1 1 9 9269 1 1 7 THR HG23 H -13.490 7.070 -1.233 1.00 . A A . 42 THR HG23 1 1 9 9270 1 1 7 THR N N -13.574 3.531 1.391 1.00 . A A . 42 THR N 1 1 9 9271 1 1 7 THR O O -10.768 3.666 1.524 1.00 . A A . 42 THR O 1 1 9 9272 1 1 7 THR OG1 O -13.931 6.088 1.169 1.00 . A A . 42 THR OG1 1 1 9 9273 1 1 8 CYS C C -8.450 3.967 -0.806 1.00 . A A . 43 CYS C 1 1 9 9274 1 1 8 CYS CA C -9.443 2.832 -0.776 1.00 . A A . 43 CYS CA 1 1 9 9275 1 1 8 CYS CB C -9.354 1.961 -2.011 1.00 . A A . 43 CYS CB 1 1 9 9276 1 1 8 CYS H H -11.288 3.434 -1.528 1.00 . A A . 43 CYS H 1 1 9 9277 1 1 8 CYS HA H -9.283 2.200 0.079 1.00 . A A . 43 CYS HA 1 1 9 9278 1 1 8 CYS HB2 H -9.650 0.964 -1.722 1.00 . A A . 43 CYS HB2 1 1 9 9279 1 1 8 CYS HB3 H -10.083 2.324 -2.708 1.00 . A A . 43 CYS HB3 1 1 9 9280 1 1 8 CYS N N -10.785 3.326 -0.690 1.00 . A A . 43 CYS N 1 1 9 9281 1 1 8 CYS O O -8.732 5.008 -1.339 1.00 . A A . 43 CYS O 1 1 9 9282 1 1 8 CYS SG S -7.752 1.784 -2.798 1.00 . A A . 43 CYS SG 1 1 9 9283 1 1 9 ALA C C -5.201 4.557 -1.239 1.00 . A A . 44 ALA C 1 1 9 9284 1 1 9 ALA CA C -6.274 4.796 -0.189 1.00 . A A . 44 ALA CA 1 1 9 9285 1 1 9 ALA CB C -5.637 4.875 1.161 1.00 . A A . 44 ALA CB 1 1 9 9286 1 1 9 ALA H H -7.168 2.930 0.286 1.00 . A A . 44 ALA H 1 1 9 9287 1 1 9 ALA HA H -6.747 5.748 -0.378 1.00 . A A . 44 ALA HA 1 1 9 9288 1 1 9 ALA HB1 H -5.103 3.957 1.356 1.00 . A A . 44 ALA HB1 1 1 9 9289 1 1 9 ALA HB2 H -6.413 5.041 1.892 1.00 . A A . 44 ALA HB2 1 1 9 9290 1 1 9 ALA HB3 H -4.951 5.707 1.139 1.00 . A A . 44 ALA HB3 1 1 9 9291 1 1 9 ALA N N -7.301 3.771 -0.201 1.00 . A A . 44 ALA N 1 1 9 9292 1 1 9 ALA O O -4.457 5.469 -1.593 1.00 . A A . 44 ALA O 1 1 9 9293 1 1 10 ALA C C -4.456 3.302 -4.122 1.00 . A A . 45 ALA C 1 1 9 9294 1 1 10 ALA CA C -4.076 2.987 -2.677 1.00 . A A . 45 ALA CA 1 1 9 9295 1 1 10 ALA CB C -3.699 1.530 -2.495 1.00 . A A . 45 ALA CB 1 1 9 9296 1 1 10 ALA H H -5.813 2.680 -1.512 1.00 . A A . 45 ALA H 1 1 9 9297 1 1 10 ALA HA H -3.217 3.588 -2.421 1.00 . A A . 45 ALA HA 1 1 9 9298 1 1 10 ALA HB1 H -3.472 1.368 -1.447 1.00 . A A . 45 ALA HB1 1 1 9 9299 1 1 10 ALA HB2 H -2.827 1.307 -3.091 1.00 . A A . 45 ALA HB2 1 1 9 9300 1 1 10 ALA HB3 H -4.522 0.895 -2.789 1.00 . A A . 45 ALA HB3 1 1 9 9301 1 1 10 ALA N N -5.134 3.345 -1.753 1.00 . A A . 45 ALA N 1 1 9 9302 1 1 10 ALA O O -3.604 3.572 -4.952 1.00 . A A . 45 ALA O 1 1 9 9303 1 1 11 CYS C C -7.453 4.537 -5.664 1.00 . A A . 46 CYS C 1 1 9 9304 1 1 11 CYS CA C -6.233 3.603 -5.733 1.00 . A A . 46 CYS CA 1 1 9 9305 1 1 11 CYS CB C -6.470 2.339 -6.585 1.00 . A A . 46 CYS CB 1 1 9 9306 1 1 11 CYS H H -6.365 2.995 -3.705 1.00 . A A . 46 CYS H 1 1 9 9307 1 1 11 CYS HA H -5.439 4.179 -6.186 1.00 . A A . 46 CYS HA 1 1 9 9308 1 1 11 CYS HB2 H -5.951 2.207 -7.519 1.00 . A A . 46 CYS HB2 1 1 9 9309 1 1 11 CYS HB3 H -5.792 1.713 -6.018 1.00 . A A . 46 CYS HB3 1 1 9 9310 1 1 11 CYS N N -5.739 3.266 -4.408 1.00 . A A . 46 CYS N 1 1 9 9311 1 1 11 CYS O O -7.931 5.035 -6.670 1.00 . A A . 46 CYS O 1 1 9 9312 1 1 11 CYS SG S -8.046 1.482 -6.375 1.00 . A A . 46 CYS SG 1 1 9 9313 1 1 12 GLN C C -10.313 5.452 -4.819 1.00 . A A . 47 GLN C 1 1 9 9314 1 1 12 GLN CA C -8.996 5.709 -4.097 1.00 . A A . 47 GLN CA 1 1 9 9315 1 1 12 GLN CB C -8.538 7.141 -4.104 1.00 . A A . 47 GLN CB 1 1 9 9316 1 1 12 GLN CD C -6.735 8.661 -3.160 1.00 . A A . 47 GLN CD 1 1 9 9317 1 1 12 GLN CG C -7.410 7.330 -3.106 1.00 . A A . 47 GLN CG 1 1 9 9318 1 1 12 GLN H H -7.442 4.405 -3.643 1.00 . A A . 47 GLN H 1 1 9 9319 1 1 12 GLN HA H -9.200 5.455 -3.066 1.00 . A A . 47 GLN HA 1 1 9 9320 1 1 12 GLN HB2 H -8.236 7.447 -5.095 1.00 . A A . 47 GLN HB2 1 1 9 9321 1 1 12 GLN HB3 H -9.383 7.715 -3.757 1.00 . A A . 47 GLN HB3 1 1 9 9322 1 1 12 GLN HE21 H -5.052 7.823 -2.580 1.00 . A A . 47 GLN HE21 1 1 9 9323 1 1 12 GLN HE22 H -4.973 9.516 -2.874 1.00 . A A . 47 GLN HE22 1 1 9 9324 1 1 12 GLN HG2 H -7.823 7.209 -2.116 1.00 . A A . 47 GLN HG2 1 1 9 9325 1 1 12 GLN HG3 H -6.689 6.545 -3.277 1.00 . A A . 47 GLN HG3 1 1 9 9326 1 1 12 GLN N N -7.894 4.798 -4.418 1.00 . A A . 47 GLN N 1 1 9 9327 1 1 12 GLN NE2 N -5.473 8.672 -2.836 1.00 . A A . 47 GLN NE2 1 1 9 9328 1 1 12 GLN O O -10.973 6.359 -5.325 1.00 . A A . 47 GLN O 1 1 9 9329 1 1 12 GLN OE1 O -7.336 9.676 -3.487 1.00 . A A . 47 GLN OE1 1 1 9 9330 1 1 13 LYS C C -12.634 3.090 -4.196 1.00 . A A . 48 LYS C 1 1 9 9331 1 1 13 LYS CA C -11.905 3.701 -5.361 1.00 . A A . 48 LYS CA 1 1 9 9332 1 1 13 LYS CB C -11.632 2.637 -6.422 1.00 . A A . 48 LYS CB 1 1 9 9333 1 1 13 LYS CD C -11.697 4.229 -8.370 1.00 . A A . 48 LYS CD 1 1 9 9334 1 1 13 LYS CE C -13.045 3.702 -8.875 1.00 . A A . 48 LYS CE 1 1 9 9335 1 1 13 LYS CG C -10.900 3.154 -7.649 1.00 . A A . 48 LYS CG 1 1 9 9336 1 1 13 LYS H H -10.034 3.549 -4.485 1.00 . A A . 48 LYS H 1 1 9 9337 1 1 13 LYS HA H -12.490 4.506 -5.775 1.00 . A A . 48 LYS HA 1 1 9 9338 1 1 13 LYS HB2 H -11.014 1.868 -5.986 1.00 . A A . 48 LYS HB2 1 1 9 9339 1 1 13 LYS HB3 H -12.566 2.197 -6.737 1.00 . A A . 48 LYS HB3 1 1 9 9340 1 1 13 LYS HD2 H -11.863 5.021 -7.655 1.00 . A A . 48 LYS HD2 1 1 9 9341 1 1 13 LYS HD3 H -11.119 4.603 -9.202 1.00 . A A . 48 LYS HD3 1 1 9 9342 1 1 13 LYS HE2 H -13.639 3.380 -8.033 1.00 . A A . 48 LYS HE2 1 1 9 9343 1 1 13 LYS HE3 H -13.560 4.507 -9.376 1.00 . A A . 48 LYS HE3 1 1 9 9344 1 1 13 LYS HG2 H -9.958 3.577 -7.331 1.00 . A A . 48 LYS HG2 1 1 9 9345 1 1 13 LYS HG3 H -10.716 2.329 -8.317 1.00 . A A . 48 LYS HG3 1 1 9 9346 1 1 13 LYS HZ1 H -12.424 1.755 -9.364 1.00 . A A . 48 LYS HZ1 1 1 9 9347 1 1 13 LYS HZ2 H -12.306 2.855 -10.631 1.00 . A A . 48 LYS HZ2 1 1 9 9348 1 1 13 LYS HZ3 H -13.806 2.260 -10.183 1.00 . A A . 48 LYS HZ3 1 1 9 9349 1 1 13 LYS N N -10.661 4.202 -4.843 1.00 . A A . 48 LYS N 1 1 9 9350 1 1 13 LYS NZ N -12.884 2.569 -9.815 1.00 . A A . 48 LYS NZ 1 1 9 9351 1 1 13 LYS O O -11.996 2.699 -3.220 1.00 . A A . 48 LYS O 1 1 9 9352 1 1 14 THR C C -14.515 0.978 -3.151 1.00 . A A . 49 THR C 1 1 9 9353 1 1 14 THR CA C -14.697 2.510 -3.168 1.00 . A A . 49 THR CA 1 1 9 9354 1 1 14 THR CB C -16.155 2.888 -3.315 1.00 . A A . 49 THR CB 1 1 9 9355 1 1 14 THR CG2 C -16.878 2.681 -2.013 1.00 . A A . 49 THR CG2 1 1 9 9356 1 1 14 THR H H -14.416 3.430 -5.014 1.00 . A A . 49 THR H 1 1 9 9357 1 1 14 THR HA H -14.324 2.915 -2.243 1.00 . A A . 49 THR HA 1 1 9 9358 1 1 14 THR HB H -16.568 2.244 -4.069 1.00 . A A . 49 THR HB 1 1 9 9359 1 1 14 THR HG1 H -15.516 4.741 -3.210 1.00 . A A . 49 THR HG1 1 1 9 9360 1 1 14 THR HG21 H -17.888 3.058 -2.080 1.00 . A A . 49 THR HG21 1 1 9 9361 1 1 14 THR HG22 H -16.307 3.209 -1.258 1.00 . A A . 49 THR HG22 1 1 9 9362 1 1 14 THR HG23 H -16.888 1.625 -1.779 1.00 . A A . 49 THR HG23 1 1 9 9363 1 1 14 THR N N -13.933 3.074 -4.237 1.00 . A A . 49 THR N 1 1 9 9364 1 1 14 THR O O -14.656 0.313 -4.188 1.00 . A A . 49 THR O 1 1 9 9365 1 1 14 THR OG1 O -16.236 4.289 -3.662 1.00 . A A . 49 THR OG1 1 1 9 9366 1 1 15 VAL C C -15.046 -1.738 -1.439 1.00 . A A . 50 VAL C 1 1 9 9367 1 1 15 VAL CA C -13.835 -0.947 -1.844 1.00 . A A . 50 VAL CA 1 1 9 9368 1 1 15 VAL CB C -12.762 -1.164 -0.744 1.00 . A A . 50 VAL CB 1 1 9 9369 1 1 15 VAL CG1 C -11.881 -2.314 -1.118 1.00 . A A . 50 VAL CG1 1 1 9 9370 1 1 15 VAL CG2 C -11.956 0.083 -0.491 1.00 . A A . 50 VAL CG2 1 1 9 9371 1 1 15 VAL H H -14.229 1.033 -1.206 1.00 . A A . 50 VAL H 1 1 9 9372 1 1 15 VAL HA H -13.429 -1.298 -2.782 1.00 . A A . 50 VAL HA 1 1 9 9373 1 1 15 VAL HB H -13.242 -1.484 0.175 1.00 . A A . 50 VAL HB 1 1 9 9374 1 1 15 VAL HG11 H -11.472 -2.142 -2.102 1.00 . A A . 50 VAL HG11 1 1 9 9375 1 1 15 VAL HG12 H -12.441 -3.237 -1.109 1.00 . A A . 50 VAL HG12 1 1 9 9376 1 1 15 VAL HG13 H -11.064 -2.370 -0.414 1.00 . A A . 50 VAL HG13 1 1 9 9377 1 1 15 VAL HG21 H -12.601 0.852 -0.093 1.00 . A A . 50 VAL HG21 1 1 9 9378 1 1 15 VAL HG22 H -11.565 0.427 -1.440 1.00 . A A . 50 VAL HG22 1 1 9 9379 1 1 15 VAL HG23 H -11.148 -0.119 0.196 1.00 . A A . 50 VAL HG23 1 1 9 9380 1 1 15 VAL N N -14.187 0.450 -1.997 1.00 . A A . 50 VAL N 1 1 9 9381 1 1 15 VAL O O -15.825 -1.303 -0.582 1.00 . A A . 50 VAL O 1 1 9 9382 1 1 16 TYR C C -15.765 -4.821 -0.761 1.00 . A A . 51 TYR C 1 1 9 9383 1 1 16 TYR CA C -16.305 -3.743 -1.692 1.00 . A A . 51 TYR CA 1 1 9 9384 1 1 16 TYR CB C -16.923 -4.348 -2.961 1.00 . A A . 51 TYR CB 1 1 9 9385 1 1 16 TYR CD1 C -17.862 -2.074 -3.558 1.00 . A A . 51 TYR CD1 1 1 9 9386 1 1 16 TYR CD2 C -17.483 -3.630 -5.313 1.00 . A A . 51 TYR CD2 1 1 9 9387 1 1 16 TYR CE1 C -18.321 -1.150 -4.460 1.00 . A A . 51 TYR CE1 1 1 9 9388 1 1 16 TYR CE2 C -17.946 -2.709 -6.227 1.00 . A A . 51 TYR CE2 1 1 9 9389 1 1 16 TYR CG C -17.429 -3.329 -3.964 1.00 . A A . 51 TYR CG 1 1 9 9390 1 1 16 TYR CZ C -18.361 -1.472 -5.793 1.00 . A A . 51 TYR CZ 1 1 9 9391 1 1 16 TYR H H -14.573 -3.170 -2.715 1.00 . A A . 51 TYR H 1 1 9 9392 1 1 16 TYR HA H -17.043 -3.162 -1.160 1.00 . A A . 51 TYR HA 1 1 9 9393 1 1 16 TYR HB2 H -16.164 -4.923 -3.465 1.00 . A A . 51 TYR HB2 1 1 9 9394 1 1 16 TYR HB3 H -17.747 -4.990 -2.689 1.00 . A A . 51 TYR HB3 1 1 9 9395 1 1 16 TYR HD1 H -17.815 -1.834 -2.508 1.00 . A A . 51 TYR HD1 1 1 9 9396 1 1 16 TYR HD2 H -17.157 -4.604 -5.647 1.00 . A A . 51 TYR HD2 1 1 9 9397 1 1 16 TYR HE1 H -18.651 -0.179 -4.120 1.00 . A A . 51 TYR HE1 1 1 9 9398 1 1 16 TYR HE2 H -17.980 -2.957 -7.277 1.00 . A A . 51 TYR HE2 1 1 9 9399 1 1 16 TYR HH H -18.288 0.248 -6.555 1.00 . A A . 51 TYR HH 1 1 9 9400 1 1 16 TYR N N -15.213 -2.880 -2.032 1.00 . A A . 51 TYR N 1 1 9 9401 1 1 16 TYR O O -14.580 -5.104 -0.828 1.00 . A A . 51 TYR O 1 1 9 9402 1 1 16 TYR OH O -18.813 -0.550 -6.698 1.00 . A A . 51 TYR OH 1 1 9 9403 1 1 17 PRO C C -15.126 -7.441 0.750 1.00 . A A . 52 PRO C 1 1 9 9404 1 1 17 PRO CA C -16.146 -6.372 1.176 1.00 . A A . 52 PRO CA 1 1 9 9405 1 1 17 PRO CB C -17.427 -7.028 1.634 1.00 . A A . 52 PRO CB 1 1 9 9406 1 1 17 PRO CD C -18.074 -5.292 0.130 1.00 . A A . 52 PRO CD 1 1 9 9407 1 1 17 PRO CG C -18.478 -6.011 1.384 1.00 . A A . 52 PRO CG 1 1 9 9408 1 1 17 PRO HA H -15.733 -5.824 2.005 1.00 . A A . 52 PRO HA 1 1 9 9409 1 1 17 PRO HB2 H -17.554 -7.916 1.040 1.00 . A A . 52 PRO HB2 1 1 9 9410 1 1 17 PRO HB3 H -17.351 -7.288 2.679 1.00 . A A . 52 PRO HB3 1 1 9 9411 1 1 17 PRO HD2 H -18.535 -5.753 -0.731 1.00 . A A . 52 PRO HD2 1 1 9 9412 1 1 17 PRO HD3 H -18.349 -4.249 0.194 1.00 . A A . 52 PRO HD3 1 1 9 9413 1 1 17 PRO HG2 H -19.433 -6.498 1.249 1.00 . A A . 52 PRO HG2 1 1 9 9414 1 1 17 PRO HG3 H -18.521 -5.321 2.214 1.00 . A A . 52 PRO HG3 1 1 9 9415 1 1 17 PRO N N -16.602 -5.445 0.103 1.00 . A A . 52 PRO N 1 1 9 9416 1 1 17 PRO O O -14.204 -7.764 1.514 1.00 . A A . 52 PRO O 1 1 9 9417 1 1 18 MET C C -12.956 -8.405 -1.216 1.00 . A A . 53 MET C 1 1 9 9418 1 1 18 MET CA C -14.356 -8.968 -0.982 1.00 . A A . 53 MET CA 1 1 9 9419 1 1 18 MET CB C -14.890 -9.528 -2.289 1.00 . A A . 53 MET CB 1 1 9 9420 1 1 18 MET CE C -14.461 -9.552 -5.458 1.00 . A A . 53 MET CE 1 1 9 9421 1 1 18 MET CG C -13.991 -10.575 -2.911 1.00 . A A . 53 MET CG 1 1 9 9422 1 1 18 MET H H -16.011 -7.631 -1.011 1.00 . A A . 53 MET H 1 1 9 9423 1 1 18 MET HA H -14.287 -9.780 -0.275 1.00 . A A . 53 MET HA 1 1 9 9424 1 1 18 MET HB2 H -15.847 -9.984 -2.087 1.00 . A A . 53 MET HB2 1 1 9 9425 1 1 18 MET HB3 H -15.017 -8.714 -2.987 1.00 . A A . 53 MET HB3 1 1 9 9426 1 1 18 MET HE1 H -14.735 -9.729 -6.487 1.00 . A A . 53 MET HE1 1 1 9 9427 1 1 18 MET HE2 H -13.457 -9.157 -5.414 1.00 . A A . 53 MET HE2 1 1 9 9428 1 1 18 MET HE3 H -15.150 -8.841 -5.026 1.00 . A A . 53 MET HE3 1 1 9 9429 1 1 18 MET HG2 H -12.994 -10.166 -2.968 1.00 . A A . 53 MET HG2 1 1 9 9430 1 1 18 MET HG3 H -13.975 -11.430 -2.253 1.00 . A A . 53 MET HG3 1 1 9 9431 1 1 18 MET N N -15.265 -7.953 -0.458 1.00 . A A . 53 MET N 1 1 9 9432 1 1 18 MET O O -11.955 -9.051 -0.915 1.00 . A A . 53 MET O 1 1 9 9433 1 1 18 MET SD S -14.546 -11.099 -4.547 1.00 . A A . 53 MET SD 1 1 9 9434 1 1 19 GLU C C -11.105 -5.775 -0.842 1.00 . A A . 54 GLU C 1 1 9 9435 1 1 19 GLU CA C -11.622 -6.577 -2.017 1.00 . A A . 54 GLU CA 1 1 9 9436 1 1 19 GLU CB C -11.795 -5.654 -3.226 1.00 . A A . 54 GLU CB 1 1 9 9437 1 1 19 GLU CD C -12.496 -5.394 -5.640 1.00 . A A . 54 GLU CD 1 1 9 9438 1 1 19 GLU CG C -12.386 -6.329 -4.456 1.00 . A A . 54 GLU CG 1 1 9 9439 1 1 19 GLU H H -13.697 -6.630 -1.760 1.00 . A A . 54 GLU H 1 1 9 9440 1 1 19 GLU HA H -10.917 -7.355 -2.265 1.00 . A A . 54 GLU HA 1 1 9 9441 1 1 19 GLU HB2 H -12.451 -4.843 -2.944 1.00 . A A . 54 GLU HB2 1 1 9 9442 1 1 19 GLU HB3 H -10.835 -5.241 -3.492 1.00 . A A . 54 GLU HB3 1 1 9 9443 1 1 19 GLU HG2 H -11.759 -7.165 -4.727 1.00 . A A . 54 GLU HG2 1 1 9 9444 1 1 19 GLU HG3 H -13.372 -6.692 -4.207 1.00 . A A . 54 GLU HG3 1 1 9 9445 1 1 19 GLU N N -12.889 -7.178 -1.674 1.00 . A A . 54 GLU N 1 1 9 9446 1 1 19 GLU O O -9.924 -5.483 -0.755 1.00 . A A . 54 GLU O 1 1 9 9447 1 1 19 GLU OE1 O -13.462 -4.605 -5.708 1.00 . A A . 54 GLU OE1 1 1 9 9448 1 1 19 GLU OE2 O -11.615 -5.438 -6.536 1.00 . A A . 54 GLU OE2 1 1 9 9449 1 1 20 ARG C C -10.840 -5.391 2.218 1.00 . A A . 55 ARG C 1 1 9 9450 1 1 20 ARG CA C -11.731 -4.672 1.245 1.00 . A A . 55 ARG CA 1 1 9 9451 1 1 20 ARG CB C -13.026 -4.146 1.866 1.00 . A A . 55 ARG CB 1 1 9 9452 1 1 20 ARG CD C -14.361 -3.528 3.846 1.00 . A A . 55 ARG CD 1 1 9 9453 1 1 20 ARG CG C -12.950 -3.596 3.273 1.00 . A A . 55 ARG CG 1 1 9 9454 1 1 20 ARG CZ C -14.956 -3.579 6.272 1.00 . A A . 55 ARG CZ 1 1 9 9455 1 1 20 ARG H H -12.931 -5.766 -0.086 1.00 . A A . 55 ARG H 1 1 9 9456 1 1 20 ARG HA H -11.170 -3.824 0.891 1.00 . A A . 55 ARG HA 1 1 9 9457 1 1 20 ARG HB2 H -13.317 -3.306 1.251 1.00 . A A . 55 ARG HB2 1 1 9 9458 1 1 20 ARG HB3 H -13.816 -4.861 1.773 1.00 . A A . 55 ARG HB3 1 1 9 9459 1 1 20 ARG HD2 H -14.979 -2.961 3.168 1.00 . A A . 55 ARG HD2 1 1 9 9460 1 1 20 ARG HD3 H -14.754 -4.532 3.882 1.00 . A A . 55 ARG HD3 1 1 9 9461 1 1 20 ARG HE H -14.192 -1.982 5.261 1.00 . A A . 55 ARG HE 1 1 9 9462 1 1 20 ARG HG2 H -12.300 -4.233 3.855 1.00 . A A . 55 ARG HG2 1 1 9 9463 1 1 20 ARG HG3 H -12.533 -2.600 3.236 1.00 . A A . 55 ARG HG3 1 1 9 9464 1 1 20 ARG HH11 H -15.027 -5.442 5.404 1.00 . A A . 55 ARG HH11 1 1 9 9465 1 1 20 ARG HH12 H -15.565 -5.396 7.003 1.00 . A A . 55 ARG HH12 1 1 9 9466 1 1 20 ARG HH21 H -14.977 -1.940 7.487 1.00 . A A . 55 ARG HH21 1 1 9 9467 1 1 20 ARG HH22 H -15.556 -3.351 8.223 1.00 . A A . 55 ARG HH22 1 1 9 9468 1 1 20 ARG N N -12.012 -5.459 0.068 1.00 . A A . 55 ARG N 1 1 9 9469 1 1 20 ARG NE N -14.451 -2.936 5.193 1.00 . A A . 55 ARG NE 1 1 9 9470 1 1 20 ARG NH1 N -15.202 -4.882 6.219 1.00 . A A . 55 ARG NH1 1 1 9 9471 1 1 20 ARG NH2 N -15.178 -2.920 7.401 1.00 . A A . 55 ARG NH2 1 1 9 9472 1 1 20 ARG O O -11.219 -6.360 2.894 1.00 . A A . 55 ARG O 1 1 9 9473 1 1 21 LEU C C -8.110 -4.157 3.780 1.00 . A A . 56 LEU C 1 1 9 9474 1 1 21 LEU CA C -8.595 -5.370 3.016 1.00 . A A . 56 LEU CA 1 1 9 9475 1 1 21 LEU CB C -7.505 -5.956 2.080 1.00 . A A . 56 LEU CB 1 1 9 9476 1 1 21 LEU CD1 C -5.498 -7.334 1.753 1.00 . A A . 56 LEU CD1 1 1 9 9477 1 1 21 LEU CD2 C -5.214 -5.139 2.732 1.00 . A A . 56 LEU CD2 1 1 9 9478 1 1 21 LEU CG C -6.138 -6.345 2.663 1.00 . A A . 56 LEU CG 1 1 9 9479 1 1 21 LEU H H -9.462 -4.231 1.558 1.00 . A A . 56 LEU H 1 1 9 9480 1 1 21 LEU HA H -8.937 -6.137 3.693 1.00 . A A . 56 LEU HA 1 1 9 9481 1 1 21 LEU HB2 H -7.913 -6.839 1.614 1.00 . A A . 56 LEU HB2 1 1 9 9482 1 1 21 LEU HB3 H -7.335 -5.230 1.298 1.00 . A A . 56 LEU HB3 1 1 9 9483 1 1 21 LEU HD11 H -6.131 -8.201 1.639 1.00 . A A . 56 LEU HD11 1 1 9 9484 1 1 21 LEU HD12 H -4.545 -7.605 2.177 1.00 . A A . 56 LEU HD12 1 1 9 9485 1 1 21 LEU HD13 H -5.340 -6.854 0.797 1.00 . A A . 56 LEU HD13 1 1 9 9486 1 1 21 LEU HD21 H -4.270 -5.427 3.168 1.00 . A A . 56 LEU HD21 1 1 9 9487 1 1 21 LEU HD22 H -5.673 -4.373 3.341 1.00 . A A . 56 LEU HD22 1 1 9 9488 1 1 21 LEU HD23 H -5.051 -4.759 1.735 1.00 . A A . 56 LEU HD23 1 1 9 9489 1 1 21 LEU HG H -6.236 -6.765 3.652 1.00 . A A . 56 LEU HG 1 1 9 9490 1 1 21 LEU N N -9.663 -4.943 2.205 1.00 . A A . 56 LEU N 1 1 9 9491 1 1 21 LEU O O -8.365 -3.024 3.377 1.00 . A A . 56 LEU O 1 1 9 9492 1 1 22 VAL C C -5.454 -3.526 5.947 1.00 . A A . 57 VAL C 1 1 9 9493 1 1 22 VAL CA C -6.932 -3.300 5.619 1.00 . A A . 57 VAL CA 1 1 9 9494 1 1 22 VAL CB C -7.803 -2.995 6.880 1.00 . A A . 57 VAL CB 1 1 9 9495 1 1 22 VAL CG1 C -8.137 -4.247 7.662 1.00 . A A . 57 VAL CG1 1 1 9 9496 1 1 22 VAL CG2 C -7.133 -1.974 7.774 1.00 . A A . 57 VAL CG2 1 1 9 9497 1 1 22 VAL H H -7.309 -5.290 5.172 1.00 . A A . 57 VAL H 1 1 9 9498 1 1 22 VAL HA H -6.972 -2.438 4.969 1.00 . A A . 57 VAL HA 1 1 9 9499 1 1 22 VAL HB H -8.737 -2.576 6.535 1.00 . A A . 57 VAL HB 1 1 9 9500 1 1 22 VAL HG11 H -8.700 -3.980 8.544 1.00 . A A . 57 VAL HG11 1 1 9 9501 1 1 22 VAL HG12 H -7.223 -4.749 7.938 1.00 . A A . 57 VAL HG12 1 1 9 9502 1 1 22 VAL HG13 H -8.735 -4.894 7.037 1.00 . A A . 57 VAL HG13 1 1 9 9503 1 1 22 VAL HG21 H -7.011 -1.051 7.225 1.00 . A A . 57 VAL HG21 1 1 9 9504 1 1 22 VAL HG22 H -6.160 -2.342 8.061 1.00 . A A . 57 VAL HG22 1 1 9 9505 1 1 22 VAL HG23 H -7.737 -1.796 8.651 1.00 . A A . 57 VAL HG23 1 1 9 9506 1 1 22 VAL N N -7.460 -4.372 4.859 1.00 . A A . 57 VAL N 1 1 9 9507 1 1 22 VAL O O -5.095 -4.426 6.725 1.00 . A A . 57 VAL O 1 1 9 9508 1 1 23 ALA C C -2.817 -1.530 6.281 1.00 . A A . 58 ALA C 1 1 9 9509 1 1 23 ALA CA C -3.174 -2.806 5.573 1.00 . A A . 58 ALA CA 1 1 9 9510 1 1 23 ALA CB C -2.362 -2.930 4.255 1.00 . A A . 58 ALA CB 1 1 9 9511 1 1 23 ALA H H -4.961 -2.059 4.696 1.00 . A A . 58 ALA H 1 1 9 9512 1 1 23 ALA HA H -2.983 -3.659 6.207 1.00 . A A . 58 ALA HA 1 1 9 9513 1 1 23 ALA HB1 H -2.685 -3.780 3.670 1.00 . A A . 58 ALA HB1 1 1 9 9514 1 1 23 ALA HB2 H -1.308 -3.052 4.460 1.00 . A A . 58 ALA HB2 1 1 9 9515 1 1 23 ALA HB3 H -2.472 -2.033 3.660 1.00 . A A . 58 ALA HB3 1 1 9 9516 1 1 23 ALA N N -4.600 -2.740 5.308 1.00 . A A . 58 ALA N 1 1 9 9517 1 1 23 ALA O O -3.223 -0.464 5.829 1.00 . A A . 58 ALA O 1 1 9 9518 1 1 24 ASP C C -2.855 0.462 8.509 1.00 . A A . 59 ASP C 1 1 9 9519 1 1 24 ASP CA C -1.681 -0.450 8.206 1.00 . A A . 59 ASP CA 1 1 9 9520 1 1 24 ASP CB C -0.503 0.375 7.745 1.00 . A A . 59 ASP CB 1 1 9 9521 1 1 24 ASP CG C 0.673 -0.398 7.156 1.00 . A A . 59 ASP CG 1 1 9 9522 1 1 24 ASP H H -1.640 -2.510 7.534 1.00 . A A . 59 ASP H 1 1 9 9523 1 1 24 ASP HA H -1.426 -0.898 9.156 1.00 . A A . 59 ASP HA 1 1 9 9524 1 1 24 ASP HB2 H -0.833 1.298 7.299 1.00 . A A . 59 ASP HB2 1 1 9 9525 1 1 24 ASP HB3 H -0.112 0.655 8.718 1.00 . A A . 59 ASP HB3 1 1 9 9526 1 1 24 ASP N N -2.020 -1.625 7.339 1.00 . A A . 59 ASP N 1 1 9 9527 1 1 24 ASP O O -2.742 1.701 8.463 1.00 . A A . 59 ASP O 1 1 9 9528 1 1 24 ASP OD1 O 0.996 -1.499 7.682 1.00 . A A . 59 ASP OD1 1 1 9 9529 1 1 24 ASP OD2 O 1.372 0.132 6.269 1.00 . A A . 59 ASP OD2 1 1 9 9530 1 1 25 LYS C C -5.837 1.290 7.928 1.00 . A A . 60 LYS C 1 1 9 9531 1 1 25 LYS CA C -5.233 0.489 9.117 1.00 . A A . 60 LYS CA 1 1 9 9532 1 1 25 LYS CB C -5.099 1.287 10.414 1.00 . A A . 60 LYS CB 1 1 9 9533 1 1 25 LYS CD C -6.116 2.350 12.403 1.00 . A A . 60 LYS CD 1 1 9 9534 1 1 25 LYS CE C -7.320 3.039 13.026 1.00 . A A . 60 LYS CE 1 1 9 9535 1 1 25 LYS CG C -6.387 1.817 11.014 1.00 . A A . 60 LYS CG 1 1 9 9536 1 1 25 LYS H H -3.950 -1.135 8.778 1.00 . A A . 60 LYS H 1 1 9 9537 1 1 25 LYS HA H -5.921 -0.321 9.297 1.00 . A A . 60 LYS HA 1 1 9 9538 1 1 25 LYS HB2 H -4.611 0.670 11.155 1.00 . A A . 60 LYS HB2 1 1 9 9539 1 1 25 LYS HB3 H -4.461 2.120 10.176 1.00 . A A . 60 LYS HB3 1 1 9 9540 1 1 25 LYS HD2 H -5.839 1.515 13.030 1.00 . A A . 60 LYS HD2 1 1 9 9541 1 1 25 LYS HD3 H -5.282 3.031 12.341 1.00 . A A . 60 LYS HD3 1 1 9 9542 1 1 25 LYS HE2 H -8.146 2.344 13.042 1.00 . A A . 60 LYS HE2 1 1 9 9543 1 1 25 LYS HE3 H -7.067 3.313 14.039 1.00 . A A . 60 LYS HE3 1 1 9 9544 1 1 25 LYS HG2 H -6.774 2.609 10.389 1.00 . A A . 60 LYS HG2 1 1 9 9545 1 1 25 LYS HG3 H -7.102 1.010 11.071 1.00 . A A . 60 LYS HG3 1 1 9 9546 1 1 25 LYS HZ1 H -8.092 4.047 11.336 1.00 . A A . 60 LYS HZ1 1 1 9 9547 1 1 25 LYS HZ2 H -6.949 4.929 12.204 1.00 . A A . 60 LYS HZ2 1 1 9 9548 1 1 25 LYS HZ3 H -8.496 4.729 12.822 1.00 . A A . 60 LYS HZ3 1 1 9 9549 1 1 25 LYS N N -3.977 -0.157 8.786 1.00 . A A . 60 LYS N 1 1 9 9550 1 1 25 LYS NZ N -7.737 4.255 12.290 1.00 . A A . 60 LYS NZ 1 1 9 9551 1 1 25 LYS O O -6.893 1.917 8.047 1.00 . A A . 60 LYS O 1 1 9 9552 1 1 26 LEU C C -6.648 0.807 4.922 1.00 . A A . 61 LEU C 1 1 9 9553 1 1 26 LEU CA C -5.747 1.838 5.582 1.00 . A A . 61 LEU CA 1 1 9 9554 1 1 26 LEU CB C -4.670 2.234 4.605 1.00 . A A . 61 LEU CB 1 1 9 9555 1 1 26 LEU CD1 C -2.615 3.454 3.986 1.00 . A A . 61 LEU CD1 1 1 9 9556 1 1 26 LEU CD2 C -4.244 4.529 5.520 1.00 . A A . 61 LEU CD2 1 1 9 9557 1 1 26 LEU CG C -3.613 3.215 5.089 1.00 . A A . 61 LEU CG 1 1 9 9558 1 1 26 LEU H H -4.276 0.856 6.749 1.00 . A A . 61 LEU H 1 1 9 9559 1 1 26 LEU HA H -6.330 2.702 5.847 1.00 . A A . 61 LEU HA 1 1 9 9560 1 1 26 LEU HB2 H -4.183 1.317 4.322 1.00 . A A . 61 LEU HB2 1 1 9 9561 1 1 26 LEU HB3 H -5.157 2.647 3.734 1.00 . A A . 61 LEU HB3 1 1 9 9562 1 1 26 LEU HD11 H -3.122 3.887 3.137 1.00 . A A . 61 LEU HD11 1 1 9 9563 1 1 26 LEU HD12 H -2.175 2.510 3.693 1.00 . A A . 61 LEU HD12 1 1 9 9564 1 1 26 LEU HD13 H -1.849 4.129 4.334 1.00 . A A . 61 LEU HD13 1 1 9 9565 1 1 26 LEU HD21 H -4.784 4.959 4.690 1.00 . A A . 61 LEU HD21 1 1 9 9566 1 1 26 LEU HD22 H -3.467 5.211 5.834 1.00 . A A . 61 LEU HD22 1 1 9 9567 1 1 26 LEU HD23 H -4.922 4.352 6.341 1.00 . A A . 61 LEU HD23 1 1 9 9568 1 1 26 LEU HG H -3.091 2.789 5.933 1.00 . A A . 61 LEU HG 1 1 9 9569 1 1 26 LEU N N -5.179 1.261 6.789 1.00 . A A . 61 LEU N 1 1 9 9570 1 1 26 LEU O O -6.261 -0.357 4.780 1.00 . A A . 61 LEU O 1 1 9 9571 1 1 27 ILE C C -8.645 0.368 2.422 1.00 . A A . 62 ILE C 1 1 9 9572 1 1 27 ILE CA C -8.752 0.280 3.930 1.00 . A A . 62 ILE CA 1 1 9 9573 1 1 27 ILE CB C -10.220 0.597 4.320 1.00 . A A . 62 ILE CB 1 1 9 9574 1 1 27 ILE CD1 C -9.970 -0.202 6.744 1.00 . A A . 62 ILE CD1 1 1 9 9575 1 1 27 ILE CG1 C -10.364 0.913 5.809 1.00 . A A . 62 ILE CG1 1 1 9 9576 1 1 27 ILE CG2 C -11.090 -0.578 3.980 1.00 . A A . 62 ILE CG2 1 1 9 9577 1 1 27 ILE H H -8.087 2.154 4.551 1.00 . A A . 62 ILE H 1 1 9 9578 1 1 27 ILE HA H -8.490 -0.711 4.270 1.00 . A A . 62 ILE HA 1 1 9 9579 1 1 27 ILE HB H -10.553 1.447 3.742 1.00 . A A . 62 ILE HB 1 1 9 9580 1 1 27 ILE HD11 H -10.123 0.103 7.768 1.00 . A A . 62 ILE HD11 1 1 9 9581 1 1 27 ILE HD12 H -8.927 -0.431 6.591 1.00 . A A . 62 ILE HD12 1 1 9 9582 1 1 27 ILE HD13 H -10.566 -1.076 6.529 1.00 . A A . 62 ILE HD13 1 1 9 9583 1 1 27 ILE HG12 H -9.719 1.747 6.017 1.00 . A A . 62 ILE HG12 1 1 9 9584 1 1 27 ILE HG13 H -11.387 1.191 6.019 1.00 . A A . 62 ILE HG13 1 1 9 9585 1 1 27 ILE HG21 H -11.002 -0.802 2.928 1.00 . A A . 62 ILE HG21 1 1 9 9586 1 1 27 ILE HG22 H -12.107 -0.341 4.253 1.00 . A A . 62 ILE HG22 1 1 9 9587 1 1 27 ILE HG23 H -10.732 -1.408 4.572 1.00 . A A . 62 ILE HG23 1 1 9 9588 1 1 27 ILE N N -7.821 1.213 4.508 1.00 . A A . 62 ILE N 1 1 9 9589 1 1 27 ILE O O -8.786 1.454 1.849 1.00 . A A . 62 ILE O 1 1 9 9590 1 1 28 PHE C C -8.322 -2.178 -0.213 1.00 . A A . 63 PHE C 1 1 9 9591 1 1 28 PHE CA C -8.208 -0.811 0.374 1.00 . A A . 63 PHE CA 1 1 9 9592 1 1 28 PHE CB C -7.031 -0.032 -0.177 1.00 . A A . 63 PHE CB 1 1 9 9593 1 1 28 PHE CD1 C -5.230 -1.486 0.869 1.00 . A A . 63 PHE CD1 1 1 9 9594 1 1 28 PHE CD2 C -4.991 0.863 0.806 1.00 . A A . 63 PHE CD2 1 1 9 9595 1 1 28 PHE CE1 C -4.014 -1.577 1.512 1.00 . A A . 63 PHE CE1 1 1 9 9596 1 1 28 PHE CE2 C -3.807 0.769 1.428 1.00 . A A . 63 PHE CE2 1 1 9 9597 1 1 28 PHE CG C -5.724 -0.238 0.508 1.00 . A A . 63 PHE CG 1 1 9 9598 1 1 28 PHE CZ C -3.301 -0.433 1.791 1.00 . A A . 63 PHE CZ 1 1 9 9599 1 1 28 PHE H H -8.210 -1.561 2.322 1.00 . A A . 63 PHE H 1 1 9 9600 1 1 28 PHE HA H -9.095 -0.304 0.025 1.00 . A A . 63 PHE HA 1 1 9 9601 1 1 28 PHE HB2 H -6.907 -0.121 -1.244 1.00 . A A . 63 PHE HB2 1 1 9 9602 1 1 28 PHE HB3 H -7.274 0.995 0.063 1.00 . A A . 63 PHE HB3 1 1 9 9603 1 1 28 PHE HD1 H -5.776 -2.394 0.653 1.00 . A A . 63 PHE HD1 1 1 9 9604 1 1 28 PHE HD2 H -5.370 1.835 0.527 1.00 . A A . 63 PHE HD2 1 1 9 9605 1 1 28 PHE HE1 H -3.623 -2.544 1.792 1.00 . A A . 63 PHE HE1 1 1 9 9606 1 1 28 PHE HE2 H -3.259 1.669 1.634 1.00 . A A . 63 PHE HE2 1 1 9 9607 1 1 28 PHE HZ H -2.334 -0.444 2.279 1.00 . A A . 63 PHE HZ 1 1 9 9608 1 1 28 PHE N N -8.335 -0.734 1.799 1.00 . A A . 63 PHE N 1 1 9 9609 1 1 28 PHE O O -8.408 -3.158 0.489 1.00 . A A . 63 PHE O 1 1 9 9610 1 1 29 HIS C C -7.050 -4.066 -2.169 1.00 . A A . 64 HIS C 1 1 9 9611 1 1 29 HIS CA C -8.415 -3.412 -2.294 1.00 . A A . 64 HIS CA 1 1 9 9612 1 1 29 HIS CB C -8.643 -3.062 -3.772 1.00 . A A . 64 HIS CB 1 1 9 9613 1 1 29 HIS CD2 C -11.049 -2.456 -4.434 1.00 . A A . 64 HIS CD2 1 1 9 9614 1 1 29 HIS CE1 C -10.856 -0.291 -4.350 1.00 . A A . 64 HIS CE1 1 1 9 9615 1 1 29 HIS CG C -9.798 -2.148 -4.062 1.00 . A A . 64 HIS CG 1 1 9 9616 1 1 29 HIS H H -8.450 -1.357 -1.997 1.00 . A A . 64 HIS H 1 1 9 9617 1 1 29 HIS HA H -9.198 -4.070 -1.948 1.00 . A A . 64 HIS HA 1 1 9 9618 1 1 29 HIS HB2 H -7.776 -2.542 -4.144 1.00 . A A . 64 HIS HB2 1 1 9 9619 1 1 29 HIS HB3 H -8.785 -3.972 -4.336 1.00 . A A . 64 HIS HB3 1 1 9 9620 1 1 29 HIS HD2 H -11.439 -3.453 -4.549 1.00 . A A . 64 HIS HD2 1 1 9 9621 1 1 29 HIS HE1 H -11.097 0.760 -4.383 1.00 . A A . 64 HIS HE1 1 1 9 9622 1 1 29 HIS HE2 H -12.569 -1.186 -5.112 1.00 . A A . 64 HIS HE2 1 1 9 9623 1 1 29 HIS N N -8.388 -2.201 -1.513 1.00 . A A . 64 HIS N 1 1 9 9624 1 1 29 HIS ND1 N -9.678 -0.766 -4.006 1.00 . A A . 64 HIS ND1 1 1 9 9625 1 1 29 HIS NE2 N -11.722 -1.275 -4.618 1.00 . A A . 64 HIS NE2 1 1 9 9626 1 1 29 HIS O O -6.011 -3.394 -2.209 1.00 . A A . 64 HIS O 1 1 9 9627 1 1 30 ASN C C -4.976 -6.068 -3.083 1.00 . A A . 65 ASN C 1 1 9 9628 1 1 30 ASN CA C -5.860 -6.154 -1.841 1.00 . A A . 65 ASN CA 1 1 9 9629 1 1 30 ASN CB C -6.228 -7.629 -1.548 1.00 . A A . 65 ASN CB 1 1 9 9630 1 1 30 ASN CG C -6.645 -8.450 -2.772 1.00 . A A . 65 ASN CG 1 1 9 9631 1 1 30 ASN H H -7.915 -5.840 -1.907 1.00 . A A . 65 ASN H 1 1 9 9632 1 1 30 ASN HA H -5.318 -5.767 -0.992 1.00 . A A . 65 ASN HA 1 1 9 9633 1 1 30 ASN HB2 H -5.379 -8.103 -1.090 1.00 . A A . 65 ASN HB2 1 1 9 9634 1 1 30 ASN HB3 H -7.041 -7.636 -0.837 1.00 . A A . 65 ASN HB3 1 1 9 9635 1 1 30 ASN HD21 H -4.827 -9.222 -2.918 1.00 . A A . 65 ASN HD21 1 1 9 9636 1 1 30 ASN HD22 H -5.958 -9.760 -4.098 1.00 . A A . 65 ASN HD22 1 1 9 9637 1 1 30 ASN N N -7.061 -5.367 -1.992 1.00 . A A . 65 ASN N 1 1 9 9638 1 1 30 ASN ND2 N -5.726 -9.214 -3.318 1.00 . A A . 65 ASN ND2 1 1 9 9639 1 1 30 ASN O O -3.778 -6.138 -2.992 1.00 . A A . 65 ASN O 1 1 9 9640 1 1 30 ASN OD1 O -7.802 -8.433 -3.187 1.00 . A A . 65 ASN OD1 1 1 9 9641 1 1 31 SER C C -4.233 -4.606 -5.870 1.00 . A A . 66 SER C 1 1 9 9642 1 1 31 SER CA C -4.929 -5.936 -5.490 1.00 . A A . 66 SER CA 1 1 9 9643 1 1 31 SER CB C -5.931 -6.328 -6.548 1.00 . A A . 66 SER CB 1 1 9 9644 1 1 31 SER H H -6.574 -5.874 -4.249 1.00 . A A . 66 SER H 1 1 9 9645 1 1 31 SER HA H -4.180 -6.711 -5.487 1.00 . A A . 66 SER HA 1 1 9 9646 1 1 31 SER HB2 H -5.456 -6.208 -7.508 1.00 . A A . 66 SER HB2 1 1 9 9647 1 1 31 SER HB3 H -6.214 -7.361 -6.409 1.00 . A A . 66 SER HB3 1 1 9 9648 1 1 31 SER HG H -7.100 -4.992 -7.286 1.00 . A A . 66 SER HG 1 1 9 9649 1 1 31 SER N N -5.599 -5.954 -4.224 1.00 . A A . 66 SER N 1 1 9 9650 1 1 31 SER O O -3.429 -4.584 -6.802 1.00 . A A . 66 SER O 1 1 9 9651 1 1 31 SER OG O -7.096 -5.505 -6.469 1.00 . A A . 66 SER OG 1 1 9 9652 1 1 32 CYS C C -2.812 -1.626 -5.162 1.00 . A A . 67 CYS C 1 1 9 9653 1 1 32 CYS CA C -4.072 -2.239 -5.740 1.00 . A A . 67 CYS CA 1 1 9 9654 1 1 32 CYS CB C -5.212 -1.238 -5.776 1.00 . A A . 67 CYS CB 1 1 9 9655 1 1 32 CYS H H -4.963 -3.560 -4.312 1.00 . A A . 67 CYS H 1 1 9 9656 1 1 32 CYS HA H -3.837 -2.460 -6.770 1.00 . A A . 67 CYS HA 1 1 9 9657 1 1 32 CYS HB2 H -4.798 -0.265 -5.991 1.00 . A A . 67 CYS HB2 1 1 9 9658 1 1 32 CYS HB3 H -5.911 -1.524 -6.545 1.00 . A A . 67 CYS HB3 1 1 9 9659 1 1 32 CYS N N -4.505 -3.517 -5.182 1.00 . A A . 67 CYS N 1 1 9 9660 1 1 32 CYS O O -2.209 -0.757 -5.809 1.00 . A A . 67 CYS O 1 1 9 9661 1 1 32 CYS SG S -6.086 -1.087 -4.230 1.00 . A A . 67 CYS SG 1 1 9 9662 1 1 33 PHE C C 0.082 -1.950 -3.969 1.00 . A A . 68 PHE C 1 1 9 9663 1 1 33 PHE CA C -1.221 -1.366 -3.461 1.00 . A A . 68 PHE CA 1 1 9 9664 1 1 33 PHE CB C -1.241 -1.157 -1.936 1.00 . A A . 68 PHE CB 1 1 9 9665 1 1 33 PHE CD1 C -2.612 -3.073 -1.022 1.00 . A A . 68 PHE CD1 1 1 9 9666 1 1 33 PHE CD2 C -0.423 -2.696 -0.165 1.00 . A A . 68 PHE CD2 1 1 9 9667 1 1 33 PHE CE1 C -2.768 -4.139 -0.141 1.00 . A A . 68 PHE CE1 1 1 9 9668 1 1 33 PHE CE2 C -0.574 -3.741 0.709 1.00 . A A . 68 PHE CE2 1 1 9 9669 1 1 33 PHE CG C -1.433 -2.344 -1.038 1.00 . A A . 68 PHE CG 1 1 9 9670 1 1 33 PHE CZ C -1.739 -4.464 0.726 1.00 . A A . 68 PHE CZ 1 1 9 9671 1 1 33 PHE H H -2.800 -2.766 -3.509 1.00 . A A . 68 PHE H 1 1 9 9672 1 1 33 PHE HA H -1.271 -0.390 -3.926 1.00 . A A . 68 PHE HA 1 1 9 9673 1 1 33 PHE HB2 H -0.214 -0.924 -1.707 1.00 . A A . 68 PHE HB2 1 1 9 9674 1 1 33 PHE HB3 H -1.901 -0.356 -1.639 1.00 . A A . 68 PHE HB3 1 1 9 9675 1 1 33 PHE HD1 H -3.400 -2.802 -1.710 1.00 . A A . 68 PHE HD1 1 1 9 9676 1 1 33 PHE HD2 H 0.495 -2.128 -0.181 1.00 . A A . 68 PHE HD2 1 1 9 9677 1 1 33 PHE HE1 H -3.689 -4.705 -0.113 1.00 . A A . 68 PHE HE1 1 1 9 9678 1 1 33 PHE HE2 H 0.226 -3.997 1.388 1.00 . A A . 68 PHE HE2 1 1 9 9679 1 1 33 PHE HZ H -1.828 -5.283 1.423 1.00 . A A . 68 PHE HZ 1 1 9 9680 1 1 33 PHE N N -2.374 -2.031 -3.995 1.00 . A A . 68 PHE N 1 1 9 9681 1 1 33 PHE O O 0.576 -2.961 -3.489 1.00 . A A . 68 PHE O 1 1 9 9682 1 1 34 CYS C C 2.818 -0.568 -5.244 1.00 . A A . 69 CYS C 1 1 9 9683 1 1 34 CYS CA C 1.827 -1.656 -5.592 1.00 . A A . 69 CYS CA 1 1 9 9684 1 1 34 CYS CB C 1.652 -1.736 -7.112 1.00 . A A . 69 CYS CB 1 1 9 9685 1 1 34 CYS H H 0.091 -0.556 -5.335 1.00 . A A . 69 CYS H 1 1 9 9686 1 1 34 CYS HA H 2.164 -2.610 -5.217 1.00 . A A . 69 CYS HA 1 1 9 9687 1 1 34 CYS HB2 H 1.521 -0.756 -7.547 1.00 . A A . 69 CYS HB2 1 1 9 9688 1 1 34 CYS HB3 H 2.571 -2.138 -7.507 1.00 . A A . 69 CYS HB3 1 1 9 9689 1 1 34 CYS HG H -0.529 -2.924 -6.618 1.00 . A A . 69 CYS HG 1 1 9 9690 1 1 34 CYS N N 0.585 -1.320 -4.980 1.00 . A A . 69 CYS N 1 1 9 9691 1 1 34 CYS O O 2.429 0.460 -4.680 1.00 . A A . 69 CYS O 1 1 9 9692 1 1 34 CYS SG S 0.312 -2.839 -7.641 1.00 . A A . 69 CYS SG 1 1 9 9693 1 1 35 CYS C C 4.870 1.365 -6.246 1.00 . A A . 70 CYS C 1 1 9 9694 1 1 35 CYS CA C 5.086 0.206 -5.296 1.00 . A A . 70 CYS CA 1 1 9 9695 1 1 35 CYS CB C 6.484 -0.406 -5.424 1.00 . A A . 70 CYS CB 1 1 9 9696 1 1 35 CYS H H 4.326 -1.658 -5.928 1.00 . A A . 70 CYS H 1 1 9 9697 1 1 35 CYS HA H 4.950 0.565 -4.287 1.00 . A A . 70 CYS HA 1 1 9 9698 1 1 35 CYS HB2 H 6.586 -1.073 -4.586 1.00 . A A . 70 CYS HB2 1 1 9 9699 1 1 35 CYS HB3 H 6.536 -0.958 -6.350 1.00 . A A . 70 CYS HB3 1 1 9 9700 1 1 35 CYS N N 4.079 -0.796 -5.531 1.00 . A A . 70 CYS N 1 1 9 9701 1 1 35 CYS O O 4.475 1.205 -7.404 1.00 . A A . 70 CYS O 1 1 9 9702 1 1 35 CYS SG S 7.935 0.694 -5.306 1.00 . A A . 70 CYS SG 1 1 9 9703 1 1 36 LYS C C 6.014 4.022 -7.375 1.00 . A A . 71 LYS C 1 1 9 9704 1 1 36 LYS CA C 4.863 3.746 -6.420 1.00 . A A . 71 LYS CA 1 1 9 9705 1 1 36 LYS CB C 4.717 4.888 -5.426 1.00 . A A . 71 LYS CB 1 1 9 9706 1 1 36 LYS CD C 2.734 5.982 -6.466 1.00 . A A . 71 LYS CD 1 1 9 9707 1 1 36 LYS CE C 2.485 6.694 -7.760 1.00 . A A . 71 LYS CE 1 1 9 9708 1 1 36 LYS CG C 4.182 6.142 -6.059 1.00 . A A . 71 LYS CG 1 1 9 9709 1 1 36 LYS H H 5.330 2.491 -4.767 1.00 . A A . 71 LYS H 1 1 9 9710 1 1 36 LYS HA H 3.967 3.708 -7.018 1.00 . A A . 71 LYS HA 1 1 9 9711 1 1 36 LYS HB2 H 4.080 4.591 -4.608 1.00 . A A . 71 LYS HB2 1 1 9 9712 1 1 36 LYS HB3 H 5.706 5.094 -5.055 1.00 . A A . 71 LYS HB3 1 1 9 9713 1 1 36 LYS HD2 H 2.492 4.936 -6.573 1.00 . A A . 71 LYS HD2 1 1 9 9714 1 1 36 LYS HD3 H 2.104 6.416 -5.704 1.00 . A A . 71 LYS HD3 1 1 9 9715 1 1 36 LYS HE2 H 3.158 6.193 -8.438 1.00 . A A . 71 LYS HE2 1 1 9 9716 1 1 36 LYS HE3 H 1.460 6.556 -8.069 1.00 . A A . 71 LYS HE3 1 1 9 9717 1 1 36 LYS HG2 H 4.257 6.969 -5.371 1.00 . A A . 71 LYS HG2 1 1 9 9718 1 1 36 LYS HG3 H 4.767 6.354 -6.941 1.00 . A A . 71 LYS HG3 1 1 9 9719 1 1 36 LYS HZ1 H 3.848 8.258 -7.506 1.00 . A A . 71 LYS HZ1 1 1 9 9720 1 1 36 LYS HZ2 H 2.305 8.615 -6.939 1.00 . A A . 71 LYS HZ2 1 1 9 9721 1 1 36 LYS HZ3 H 2.610 8.610 -8.589 1.00 . A A . 71 LYS HZ3 1 1 9 9722 1 1 36 LYS N N 5.069 2.513 -5.714 1.00 . A A . 71 LYS N 1 1 9 9723 1 1 36 LYS NZ N 2.832 8.132 -7.693 1.00 . A A . 71 LYS NZ 1 1 9 9724 1 1 36 LYS O O 5.834 4.667 -8.405 1.00 . A A . 71 LYS O 1 1 9 9725 1 1 37 HIS C C 8.396 2.646 -8.975 1.00 . A A . 72 HIS C 1 1 9 9726 1 1 37 HIS CA C 8.342 3.735 -7.898 1.00 . A A . 72 HIS CA 1 1 9 9727 1 1 37 HIS CB C 9.625 3.783 -7.067 1.00 . A A . 72 HIS CB 1 1 9 9728 1 1 37 HIS CD2 C 11.754 3.616 -8.539 1.00 . A A . 72 HIS CD2 1 1 9 9729 1 1 37 HIS CE1 C 12.375 5.686 -8.392 1.00 . A A . 72 HIS CE1 1 1 9 9730 1 1 37 HIS CG C 10.844 4.289 -7.804 1.00 . A A . 72 HIS CG 1 1 9 9731 1 1 37 HIS H H 7.263 2.988 -6.228 1.00 . A A . 72 HIS H 1 1 9 9732 1 1 37 HIS HA H 8.193 4.686 -8.387 1.00 . A A . 72 HIS HA 1 1 9 9733 1 1 37 HIS HB2 H 9.459 4.442 -6.229 1.00 . A A . 72 HIS HB2 1 1 9 9734 1 1 37 HIS HB3 H 9.841 2.792 -6.697 1.00 . A A . 72 HIS HB3 1 1 9 9735 1 1 37 HIS HD2 H 11.729 2.567 -8.795 1.00 . A A . 72 HIS HD2 1 1 9 9736 1 1 37 HIS HE1 H 12.963 6.586 -8.497 1.00 . A A . 72 HIS HE1 1 1 9 9737 1 1 37 HIS HE2 H 13.649 4.275 -9.122 1.00 . A A . 72 HIS HE2 1 1 9 9738 1 1 37 HIS N N 7.187 3.515 -7.049 1.00 . A A . 72 HIS N 1 1 9 9739 1 1 37 HIS ND1 N 11.232 5.606 -7.721 1.00 . A A . 72 HIS ND1 1 1 9 9740 1 1 37 HIS NE2 N 12.720 4.514 -8.901 1.00 . A A . 72 HIS NE2 1 1 9 9741 1 1 37 HIS O O 8.643 2.930 -10.142 1.00 . A A . 72 HIS O 1 1 9 9742 1 1 38 CYS C C 6.671 -0.268 -9.370 1.00 . A A . 73 CYS C 1 1 9 9743 1 1 38 CYS CA C 8.040 0.345 -9.544 1.00 . A A . 73 CYS CA 1 1 9 9744 1 1 38 CYS CB C 9.174 -0.684 -9.333 1.00 . A A . 73 CYS CB 1 1 9 9745 1 1 38 CYS H H 7.921 1.201 -7.657 1.00 . A A . 73 CYS H 1 1 9 9746 1 1 38 CYS HA H 8.139 0.807 -10.515 1.00 . A A . 73 CYS HA 1 1 9 9747 1 1 38 CYS HB2 H 9.298 -1.314 -10.192 1.00 . A A . 73 CYS HB2 1 1 9 9748 1 1 38 CYS HB3 H 10.055 -0.074 -9.302 1.00 . A A . 73 CYS HB3 1 1 9 9749 1 1 38 CYS N N 8.126 1.404 -8.588 1.00 . A A . 73 CYS N 1 1 9 9750 1 1 38 CYS O O 6.312 -0.600 -8.270 1.00 . A A . 73 CYS O 1 1 9 9751 1 1 38 CYS SG S 9.138 -1.734 -7.829 1.00 . A A . 73 CYS SG 1 1 9 9752 1 1 39 HIS C C 4.410 -2.412 -10.114 1.00 . A A . 74 HIS C 1 1 9 9753 1 1 39 HIS CA C 4.530 -0.893 -10.289 1.00 . A A . 74 HIS CA 1 1 9 9754 1 1 39 HIS CB C 3.745 -0.380 -11.500 1.00 . A A . 74 HIS CB 1 1 9 9755 1 1 39 HIS CD2 C 1.396 0.235 -10.566 1.00 . A A . 74 HIS CD2 1 1 9 9756 1 1 39 HIS CE1 C 0.208 -1.064 -11.849 1.00 . A A . 74 HIS CE1 1 1 9 9757 1 1 39 HIS CG C 2.248 -0.445 -11.369 1.00 . A A . 74 HIS CG 1 1 9 9758 1 1 39 HIS H H 6.333 -0.419 -11.318 1.00 . A A . 74 HIS H 1 1 9 9759 1 1 39 HIS HA H 4.120 -0.456 -9.387 1.00 . A A . 74 HIS HA 1 1 9 9760 1 1 39 HIS HB2 H 4.021 0.649 -11.673 1.00 . A A . 74 HIS HB2 1 1 9 9761 1 1 39 HIS HB3 H 4.039 -0.978 -12.348 1.00 . A A . 74 HIS HB3 1 1 9 9762 1 1 39 HIS HD1 H 1.793 -1.853 -12.854 1.00 . A A . 74 HIS HD1 1 1 9 9763 1 1 39 HIS HD2 H 1.664 0.961 -9.811 1.00 . A A . 74 HIS HD2 1 1 9 9764 1 1 39 HIS HE1 H -0.629 -1.563 -12.314 1.00 . A A . 74 HIS HE1 1 1 9 9765 1 1 39 HIS HE2 H -0.678 0.356 -10.702 1.00 . A A . 74 HIS HE2 1 1 9 9766 1 1 39 HIS N N 5.941 -0.489 -10.420 1.00 . A A . 74 HIS N 1 1 9 9767 1 1 39 HIS ND1 N 1.466 -1.246 -12.154 1.00 . A A . 74 HIS ND1 1 1 9 9768 1 1 39 HIS NE2 N 0.133 -0.170 -10.887 1.00 . A A . 74 HIS NE2 1 1 9 9769 1 1 39 HIS O O 3.674 -3.099 -10.820 1.00 . A A . 74 HIS O 1 1 9 9770 1 1 40 THR C C 4.142 -4.572 -7.730 1.00 . A A . 75 THR C 1 1 9 9771 1 1 40 THR CA C 5.159 -4.288 -8.836 1.00 . A A . 75 THR CA 1 1 9 9772 1 1 40 THR CB C 6.603 -4.757 -8.434 1.00 . A A . 75 THR CB 1 1 9 9773 1 1 40 THR CG2 C 7.009 -4.273 -7.039 1.00 . A A . 75 THR CG2 1 1 9 9774 1 1 40 THR H H 5.635 -2.243 -8.614 1.00 . A A . 75 THR H 1 1 9 9775 1 1 40 THR HA H 4.850 -4.818 -9.726 1.00 . A A . 75 THR HA 1 1 9 9776 1 1 40 THR HB H 7.286 -4.341 -9.160 1.00 . A A . 75 THR HB 1 1 9 9777 1 1 40 THR HG1 H 7.500 -6.363 -8.978 1.00 . A A . 75 THR HG1 1 1 9 9778 1 1 40 THR HG21 H 6.992 -3.194 -7.014 1.00 . A A . 75 THR HG21 1 1 9 9779 1 1 40 THR HG22 H 8.005 -4.625 -6.810 1.00 . A A . 75 THR HG22 1 1 9 9780 1 1 40 THR HG23 H 6.314 -4.662 -6.311 1.00 . A A . 75 THR HG23 1 1 9 9781 1 1 40 THR N N 5.122 -2.897 -9.145 1.00 . A A . 75 THR N 1 1 9 9782 1 1 40 THR O O 4.022 -3.787 -6.752 1.00 . A A . 75 THR O 1 1 9 9783 1 1 40 THR OG1 O 6.698 -6.186 -8.469 1.00 . A A . 75 THR OG1 1 1 9 9784 1 1 41 LYS C C 2.962 -6.619 -5.731 1.00 . A A . 76 LYS C 1 1 9 9785 1 1 41 LYS CA C 2.357 -5.986 -6.960 1.00 . A A . 76 LYS CA 1 1 9 9786 1 1 41 LYS CB C 1.178 -6.799 -7.532 1.00 . A A . 76 LYS CB 1 1 9 9787 1 1 41 LYS CD C 1.544 -6.819 -10.048 1.00 . A A . 76 LYS CD 1 1 9 9788 1 1 41 LYS CE C 0.230 -6.104 -10.399 1.00 . A A . 76 LYS CE 1 1 9 9789 1 1 41 LYS CG C 1.445 -7.665 -8.766 1.00 . A A . 76 LYS CG 1 1 9 9790 1 1 41 LYS H H 3.489 -6.178 -8.705 1.00 . A A . 76 LYS H 1 1 9 9791 1 1 41 LYS HA H 1.969 -5.029 -6.650 1.00 . A A . 76 LYS HA 1 1 9 9792 1 1 41 LYS HB2 H 0.869 -7.443 -6.728 1.00 . A A . 76 LYS HB2 1 1 9 9793 1 1 41 LYS HB3 H 0.371 -6.114 -7.740 1.00 . A A . 76 LYS HB3 1 1 9 9794 1 1 41 LYS HD2 H 2.262 -6.042 -9.826 1.00 . A A . 76 LYS HD2 1 1 9 9795 1 1 41 LYS HD3 H 1.875 -7.424 -10.879 1.00 . A A . 76 LYS HD3 1 1 9 9796 1 1 41 LYS HE2 H -0.017 -5.405 -9.614 1.00 . A A . 76 LYS HE2 1 1 9 9797 1 1 41 LYS HE3 H 0.377 -5.551 -11.316 1.00 . A A . 76 LYS HE3 1 1 9 9798 1 1 41 LYS HG2 H 2.378 -8.189 -8.623 1.00 . A A . 76 LYS HG2 1 1 9 9799 1 1 41 LYS HG3 H 0.646 -8.382 -8.876 1.00 . A A . 76 LYS HG3 1 1 9 9800 1 1 41 LYS HZ1 H -1.072 -7.583 -9.712 1.00 . A A . 76 LYS HZ1 1 1 9 9801 1 1 41 LYS HZ2 H -0.783 -7.689 -11.380 1.00 . A A . 76 LYS HZ2 1 1 9 9802 1 1 41 LYS HZ3 H -1.773 -6.492 -10.747 1.00 . A A . 76 LYS HZ3 1 1 9 9803 1 1 41 LYS N N 3.354 -5.614 -7.917 1.00 . A A . 76 LYS N 1 1 9 9804 1 1 41 LYS NZ N -0.903 -7.037 -10.582 1.00 . A A . 76 LYS NZ 1 1 9 9805 1 1 41 LYS O O 3.274 -7.807 -5.685 1.00 . A A . 76 LYS O 1 1 9 9806 1 1 42 LEU C C 2.725 -6.268 -2.433 1.00 . A A . 77 LEU C 1 1 9 9807 1 1 42 LEU CA C 3.762 -6.099 -3.504 1.00 . A A . 77 LEU CA 1 1 9 9808 1 1 42 LEU CB C 4.790 -5.020 -3.171 1.00 . A A . 77 LEU CB 1 1 9 9809 1 1 42 LEU CD1 C 3.347 -3.186 -2.021 1.00 . A A . 77 LEU CD1 1 1 9 9810 1 1 42 LEU CD2 C 5.461 -2.656 -3.080 1.00 . A A . 77 LEU CD2 1 1 9 9811 1 1 42 LEU CG C 4.295 -3.537 -3.151 1.00 . A A . 77 LEU CG 1 1 9 9812 1 1 42 LEU H H 2.942 -4.843 -4.956 1.00 . A A . 77 LEU H 1 1 9 9813 1 1 42 LEU HA H 4.289 -7.035 -3.602 1.00 . A A . 77 LEU HA 1 1 9 9814 1 1 42 LEU HB2 H 5.377 -5.238 -2.293 1.00 . A A . 77 LEU HB2 1 1 9 9815 1 1 42 LEU HB3 H 5.435 -5.035 -4.041 1.00 . A A . 77 LEU HB3 1 1 9 9816 1 1 42 LEU HD11 H 3.900 -3.289 -1.101 1.00 . A A . 77 LEU HD11 1 1 9 9817 1 1 42 LEU HD12 H 2.503 -3.862 -2.001 1.00 . A A . 77 LEU HD12 1 1 9 9818 1 1 42 LEU HD13 H 3.007 -2.162 -2.115 1.00 . A A . 77 LEU HD13 1 1 9 9819 1 1 42 LEU HD21 H 5.957 -2.818 -2.136 1.00 . A A . 77 LEU HD21 1 1 9 9820 1 1 42 LEU HD22 H 5.146 -1.626 -3.161 1.00 . A A . 77 LEU HD22 1 1 9 9821 1 1 42 LEU HD23 H 6.145 -2.902 -3.878 1.00 . A A . 77 LEU HD23 1 1 9 9822 1 1 42 LEU HG H 3.799 -3.323 -4.086 1.00 . A A . 77 LEU HG 1 1 9 9823 1 1 42 LEU N N 3.180 -5.778 -4.781 1.00 . A A . 77 LEU N 1 1 9 9824 1 1 42 LEU O O 3.033 -6.637 -1.282 1.00 . A A . 77 LEU O 1 1 9 9825 1 1 43 SER C C 0.244 -7.379 -1.256 1.00 . A A . 78 SER C 1 1 9 9826 1 1 43 SER CA C 0.420 -6.025 -1.933 1.00 . A A . 78 SER CA 1 1 9 9827 1 1 43 SER CB C -0.794 -5.639 -2.752 1.00 . A A . 78 SER CB 1 1 9 9828 1 1 43 SER H H 1.307 -5.798 -3.744 1.00 . A A . 78 SER H 1 1 9 9829 1 1 43 SER HA H 0.560 -5.259 -1.186 1.00 . A A . 78 SER HA 1 1 9 9830 1 1 43 SER HB2 H -1.689 -5.975 -2.248 1.00 . A A . 78 SER HB2 1 1 9 9831 1 1 43 SER HB3 H -0.826 -4.566 -2.869 1.00 . A A . 78 SER HB3 1 1 9 9832 1 1 43 SER HG H -1.429 -6.910 -4.069 1.00 . A A . 78 SER HG 1 1 9 9833 1 1 43 SER N N 1.510 -6.008 -2.811 1.00 . A A . 78 SER N 1 1 9 9834 1 1 43 SER O O 0.326 -8.441 -1.900 1.00 . A A . 78 SER O 1 1 9 9835 1 1 43 SER OG O -0.732 -6.242 -4.042 1.00 . A A . 78 SER OG 1 1 9 9836 1 1 44 LEU C C 0.664 -9.598 0.693 1.00 . A A . 79 LEU C 1 1 9 9837 1 1 44 LEU CA C -0.248 -8.400 0.948 1.00 . A A . 79 LEU CA 1 1 9 9838 1 1 44 LEU CB C -1.714 -8.759 1.018 1.00 . A A . 79 LEU CB 1 1 9 9839 1 1 44 LEU CD1 C -1.697 -9.938 3.210 1.00 . A A . 79 LEU CD1 1 1 9 9840 1 1 44 LEU CD2 C -2.150 -7.480 3.172 1.00 . A A . 79 LEU CD2 1 1 9 9841 1 1 44 LEU CG C -2.319 -8.822 2.431 1.00 . A A . 79 LEU CG 1 1 9 9842 1 1 44 LEU H H -0.087 -6.388 0.414 1.00 . A A . 79 LEU H 1 1 9 9843 1 1 44 LEU HA H 0.046 -8.033 1.918 1.00 . A A . 79 LEU HA 1 1 9 9844 1 1 44 LEU HB2 H -2.230 -8.012 0.439 1.00 . A A . 79 LEU HB2 1 1 9 9845 1 1 44 LEU HB3 H -1.835 -9.721 0.545 1.00 . A A . 79 LEU HB3 1 1 9 9846 1 1 44 LEU HD11 H -0.634 -9.763 3.230 1.00 . A A . 79 LEU HD11 1 1 9 9847 1 1 44 LEU HD12 H -1.911 -10.859 2.690 1.00 . A A . 79 LEU HD12 1 1 9 9848 1 1 44 LEU HD13 H -2.095 -9.958 4.213 1.00 . A A . 79 LEU HD13 1 1 9 9849 1 1 44 LEU HD21 H -1.106 -7.212 3.235 1.00 . A A . 79 LEU HD21 1 1 9 9850 1 1 44 LEU HD22 H -2.543 -7.541 4.176 1.00 . A A . 79 LEU HD22 1 1 9 9851 1 1 44 LEU HD23 H -2.674 -6.694 2.648 1.00 . A A . 79 LEU HD23 1 1 9 9852 1 1 44 LEU HG H -3.372 -9.042 2.358 1.00 . A A . 79 LEU HG 1 1 9 9853 1 1 44 LEU N N -0.031 -7.290 0.040 1.00 . A A . 79 LEU N 1 1 9 9854 1 1 44 LEU O O 0.224 -10.681 0.299 1.00 . A A . 79 LEU O 1 1 9 9855 1 1 45 GLY C C 4.211 -9.798 1.286 1.00 . A A . 80 GLY C 1 1 9 9856 1 1 45 GLY CA C 2.934 -10.359 0.767 1.00 . A A . 80 GLY CA 1 1 9 9857 1 1 45 GLY H H 2.193 -8.464 1.187 1.00 . A A . 80 GLY H 1 1 9 9858 1 1 45 GLY HA2 H 2.651 -11.231 1.337 1.00 . A A . 80 GLY HA2 1 1 9 9859 1 1 45 GLY HA3 H 3.054 -10.622 -0.272 1.00 . A A . 80 GLY HA3 1 1 9 9860 1 1 45 GLY N N 1.922 -9.362 0.907 1.00 . A A . 80 GLY N 1 1 9 9861 1 1 45 GLY O O 4.734 -10.237 2.313 1.00 . A A . 80 GLY O 1 1 9 9862 1 1 46 SER C C 5.729 -6.607 0.644 1.00 . A A . 81 SER C 1 1 9 9863 1 1 46 SER CA C 5.854 -8.067 1.044 1.00 . A A . 81 SER CA 1 1 9 9864 1 1 46 SER CB C 7.112 -8.720 0.424 1.00 . A A . 81 SER CB 1 1 9 9865 1 1 46 SER H H 4.190 -8.454 -0.174 1.00 . A A . 81 SER H 1 1 9 9866 1 1 46 SER HA H 5.912 -8.139 2.119 1.00 . A A . 81 SER HA 1 1 9 9867 1 1 46 SER HB2 H 7.987 -8.137 0.669 1.00 . A A . 81 SER HB2 1 1 9 9868 1 1 46 SER HB3 H 7.215 -9.711 0.836 1.00 . A A . 81 SER HB3 1 1 9 9869 1 1 46 SER HG H 6.127 -9.147 -1.184 1.00 . A A . 81 SER HG 1 1 9 9870 1 1 46 SER N N 4.675 -8.768 0.622 1.00 . A A . 81 SER N 1 1 9 9871 1 1 46 SER O O 5.884 -6.264 -0.522 1.00 . A A . 81 SER O 1 1 9 9872 1 1 46 SER OG O 7.020 -8.834 -0.997 1.00 . A A . 81 SER OG 1 1 9 9873 1 1 47 TYR C C 5.844 -3.485 2.331 1.00 . A A . 82 TYR C 1 1 9 9874 1 1 47 TYR CA C 5.261 -4.379 1.276 1.00 . A A . 82 TYR CA 1 1 9 9875 1 1 47 TYR CB C 3.750 -4.115 1.102 1.00 . A A . 82 TYR CB 1 1 9 9876 1 1 47 TYR CD1 C 2.874 -3.412 3.344 1.00 . A A . 82 TYR CD1 1 1 9 9877 1 1 47 TYR CD2 C 2.034 -5.441 2.449 1.00 . A A . 82 TYR CD2 1 1 9 9878 1 1 47 TYR CE1 C 2.081 -3.552 4.449 1.00 . A A . 82 TYR CE1 1 1 9 9879 1 1 47 TYR CE2 C 1.237 -5.594 3.558 1.00 . A A . 82 TYR CE2 1 1 9 9880 1 1 47 TYR CG C 2.879 -4.338 2.330 1.00 . A A . 82 TYR CG 1 1 9 9881 1 1 47 TYR CZ C 1.263 -4.647 4.555 1.00 . A A . 82 TYR CZ 1 1 9 9882 1 1 47 TYR H H 5.391 -5.974 2.547 1.00 . A A . 82 TYR H 1 1 9 9883 1 1 47 TYR HA H 5.749 -4.168 0.336 1.00 . A A . 82 TYR HA 1 1 9 9884 1 1 47 TYR HB2 H 3.581 -3.102 0.771 1.00 . A A . 82 TYR HB2 1 1 9 9885 1 1 47 TYR HB3 H 3.396 -4.775 0.326 1.00 . A A . 82 TYR HB3 1 1 9 9886 1 1 47 TYR HD1 H 3.554 -2.583 3.233 1.00 . A A . 82 TYR HD1 1 1 9 9887 1 1 47 TYR HD2 H 1.985 -6.200 1.682 1.00 . A A . 82 TYR HD2 1 1 9 9888 1 1 47 TYR HE1 H 2.105 -2.792 5.216 1.00 . A A . 82 TYR HE1 1 1 9 9889 1 1 47 TYR HE2 H 0.594 -6.456 3.643 1.00 . A A . 82 TYR HE2 1 1 9 9890 1 1 47 TYR HH H 0.598 -5.709 5.967 1.00 . A A . 82 TYR HH 1 1 9 9891 1 1 47 TYR N N 5.476 -5.741 1.596 1.00 . A A . 82 TYR N 1 1 9 9892 1 1 47 TYR O O 6.222 -3.946 3.409 1.00 . A A . 82 TYR O 1 1 9 9893 1 1 47 TYR OH O 0.471 -4.804 5.659 1.00 . A A . 82 TYR OH 1 1 9 9894 1 1 48 ALA C C 5.578 0.005 2.610 1.00 . A A . 83 ALA C 1 1 9 9895 1 1 48 ALA CA C 6.368 -1.239 2.932 1.00 . A A . 83 ALA CA 1 1 9 9896 1 1 48 ALA CB C 7.852 -0.989 2.801 1.00 . A A . 83 ALA CB 1 1 9 9897 1 1 48 ALA H H 5.759 -1.954 1.089 1.00 . A A . 83 ALA H 1 1 9 9898 1 1 48 ALA HA H 6.141 -1.571 3.934 1.00 . A A . 83 ALA HA 1 1 9 9899 1 1 48 ALA HB1 H 8.390 -1.893 3.042 1.00 . A A . 83 ALA HB1 1 1 9 9900 1 1 48 ALA HB2 H 8.133 -0.207 3.490 1.00 . A A . 83 ALA HB2 1 1 9 9901 1 1 48 ALA HB3 H 8.084 -0.684 1.792 1.00 . A A . 83 ALA HB3 1 1 9 9902 1 1 48 ALA N N 5.956 -2.246 2.007 1.00 . A A . 83 ALA N 1 1 9 9903 1 1 48 ALA O O 5.640 0.513 1.508 1.00 . A A . 83 ALA O 1 1 9 9904 1 1 49 ALA C C 4.456 2.854 3.905 1.00 . A A . 84 ALA C 1 1 9 9905 1 1 49 ALA CA C 3.983 1.594 3.213 1.00 . A A . 84 ALA CA 1 1 9 9906 1 1 49 ALA CB C 2.547 1.271 3.563 1.00 . A A . 84 ALA CB 1 1 9 9907 1 1 49 ALA H H 4.801 0.096 4.424 1.00 . A A . 84 ALA H 1 1 9 9908 1 1 49 ALA HA H 4.032 1.736 2.144 1.00 . A A . 84 ALA HA 1 1 9 9909 1 1 49 ALA HB1 H 1.898 2.075 3.249 1.00 . A A . 84 ALA HB1 1 1 9 9910 1 1 49 ALA HB2 H 2.464 1.122 4.629 1.00 . A A . 84 ALA HB2 1 1 9 9911 1 1 49 ALA HB3 H 2.254 0.356 3.069 1.00 . A A . 84 ALA HB3 1 1 9 9912 1 1 49 ALA N N 4.818 0.479 3.520 1.00 . A A . 84 ALA N 1 1 9 9913 1 1 49 ALA O O 4.742 2.842 5.119 1.00 . A A . 84 ALA O 1 1 9 9914 1 1 50 LEU C C 3.694 6.082 3.471 1.00 . A A . 85 LEU C 1 1 9 9915 1 1 50 LEU CA C 4.899 5.208 3.673 1.00 . A A . 85 LEU CA 1 1 9 9916 1 1 50 LEU CB C 6.119 5.862 2.958 1.00 . A A . 85 LEU CB 1 1 9 9917 1 1 50 LEU CD1 C 7.323 7.098 4.786 1.00 . A A . 85 LEU CD1 1 1 9 9918 1 1 50 LEU CD2 C 7.191 8.126 2.543 1.00 . A A . 85 LEU CD2 1 1 9 9919 1 1 50 LEU CG C 6.515 7.227 3.533 1.00 . A A . 85 LEU CG 1 1 9 9920 1 1 50 LEU H H 4.344 3.905 2.182 1.00 . A A . 85 LEU H 1 1 9 9921 1 1 50 LEU HA H 5.107 5.106 4.724 1.00 . A A . 85 LEU HA 1 1 9 9922 1 1 50 LEU HB2 H 6.973 5.214 3.081 1.00 . A A . 85 LEU HB2 1 1 9 9923 1 1 50 LEU HB3 H 5.967 5.978 1.901 1.00 . A A . 85 LEU HB3 1 1 9 9924 1 1 50 LEU HD11 H 8.264 6.633 4.532 1.00 . A A . 85 LEU HD11 1 1 9 9925 1 1 50 LEU HD12 H 6.781 6.494 5.497 1.00 . A A . 85 LEU HD12 1 1 9 9926 1 1 50 LEU HD13 H 7.489 8.093 5.174 1.00 . A A . 85 LEU HD13 1 1 9 9927 1 1 50 LEU HD21 H 6.535 8.303 1.703 1.00 . A A . 85 LEU HD21 1 1 9 9928 1 1 50 LEU HD22 H 8.115 7.676 2.211 1.00 . A A . 85 LEU HD22 1 1 9 9929 1 1 50 LEU HD23 H 7.394 9.064 3.042 1.00 . A A . 85 LEU HD23 1 1 9 9930 1 1 50 LEU HG H 5.589 7.696 3.829 1.00 . A A . 85 LEU HG 1 1 9 9931 1 1 50 LEU N N 4.559 3.925 3.145 1.00 . A A . 85 LEU N 1 1 9 9932 1 1 50 LEU O O 2.834 5.763 2.643 1.00 . A A . 85 LEU O 1 1 9 9933 1 1 51 HIS C C 2.552 8.604 2.610 1.00 . A A . 86 HIS C 1 1 9 9934 1 1 51 HIS CA C 2.547 8.108 4.064 1.00 . A A . 86 HIS CA 1 1 9 9935 1 1 51 HIS CB C 2.703 9.286 5.067 1.00 . A A . 86 HIS CB 1 1 9 9936 1 1 51 HIS CD2 C 4.994 10.356 4.368 1.00 . A A . 86 HIS CD2 1 1 9 9937 1 1 51 HIS CE1 C 5.916 10.439 6.330 1.00 . A A . 86 HIS CE1 1 1 9 9938 1 1 51 HIS CG C 4.105 9.839 5.248 1.00 . A A . 86 HIS CG 1 1 9 9939 1 1 51 HIS H H 4.167 7.153 5.043 1.00 . A A . 86 HIS H 1 1 9 9940 1 1 51 HIS HA H 1.598 7.626 4.244 1.00 . A A . 86 HIS HA 1 1 9 9941 1 1 51 HIS HB2 H 2.085 10.105 4.731 1.00 . A A . 86 HIS HB2 1 1 9 9942 1 1 51 HIS HB3 H 2.346 8.959 6.031 1.00 . A A . 86 HIS HB3 1 1 9 9943 1 1 51 HIS HD1 H 4.352 9.604 7.332 1.00 . A A . 86 HIS HD1 1 1 9 9944 1 1 51 HIS HD2 H 4.881 10.413 3.296 1.00 . A A . 86 HIS HD2 1 1 9 9945 1 1 51 HIS HE1 H 6.649 10.591 7.105 1.00 . A A . 86 HIS HE1 1 1 9 9946 1 1 51 HIS HE2 H 6.936 11.052 4.672 1.00 . A A . 86 HIS HE2 1 1 9 9947 1 1 51 HIS N N 3.568 7.101 4.267 1.00 . A A . 86 HIS N 1 1 9 9948 1 1 51 HIS ND1 N 4.724 9.908 6.472 1.00 . A A . 86 HIS ND1 1 1 9 9949 1 1 51 HIS NE2 N 6.099 10.720 5.068 1.00 . A A . 86 HIS NE2 1 1 9 9950 1 1 51 HIS O O 3.579 9.060 2.087 1.00 . A A . 86 HIS O 1 1 9 9951 1 1 52 GLY C C 1.637 7.826 -0.453 1.00 . A A . 87 GLY C 1 1 9 9952 1 1 52 GLY CA C 1.310 8.872 0.606 1.00 . A A . 87 GLY CA 1 1 9 9953 1 1 52 GLY H H 0.699 7.962 2.391 1.00 . A A . 87 GLY H 1 1 9 9954 1 1 52 GLY HA2 H 0.294 9.204 0.458 1.00 . A A . 87 GLY HA2 1 1 9 9955 1 1 52 GLY HA3 H 1.969 9.717 0.470 1.00 . A A . 87 GLY HA3 1 1 9 9956 1 1 52 GLY N N 1.447 8.418 1.951 1.00 . A A . 87 GLY N 1 1 9 9957 1 1 52 GLY O O 1.012 7.828 -1.526 1.00 . A A . 87 GLY O 1 1 9 9958 1 1 53 GLU C C 3.340 4.626 -0.638 1.00 . A A . 88 GLU C 1 1 9 9959 1 1 53 GLU CA C 3.070 6.004 -1.220 1.00 . A A . 88 GLU CA 1 1 9 9960 1 1 53 GLU CB C 4.347 6.525 -1.887 1.00 . A A . 88 GLU CB 1 1 9 9961 1 1 53 GLU CD C 5.486 8.492 -2.961 1.00 . A A . 88 GLU CD 1 1 9 9962 1 1 53 GLU CG C 4.202 7.918 -2.455 1.00 . A A . 88 GLU CG 1 1 9 9963 1 1 53 GLU H H 3.036 6.889 0.688 1.00 . A A . 88 GLU H 1 1 9 9964 1 1 53 GLU HA H 2.302 5.942 -1.976 1.00 . A A . 88 GLU HA 1 1 9 9965 1 1 53 GLU HB2 H 5.186 6.493 -1.209 1.00 . A A . 88 GLU HB2 1 1 9 9966 1 1 53 GLU HB3 H 4.545 5.877 -2.729 1.00 . A A . 88 GLU HB3 1 1 9 9967 1 1 53 GLU HG2 H 3.481 7.884 -3.257 1.00 . A A . 88 GLU HG2 1 1 9 9968 1 1 53 GLU HG3 H 3.811 8.555 -1.676 1.00 . A A . 88 GLU HG3 1 1 9 9969 1 1 53 GLU N N 2.619 6.954 -0.200 1.00 . A A . 88 GLU N 1 1 9 9970 1 1 53 GLU O O 3.888 4.498 0.452 1.00 . A A . 88 GLU O 1 1 9 9971 1 1 53 GLU OE1 O 5.903 8.167 -4.093 1.00 . A A . 88 GLU OE1 1 1 9 9972 1 1 53 GLU OE2 O 6.075 9.321 -2.261 1.00 . A A . 88 GLU OE2 1 1 9 9973 1 1 54 PHE C C 4.523 1.913 -1.770 1.00 . A A . 89 PHE C 1 1 9 9974 1 1 54 PHE CA C 3.297 2.261 -0.998 1.00 . A A . 89 PHE CA 1 1 9 9975 1 1 54 PHE CB C 2.110 1.329 -1.315 1.00 . A A . 89 PHE CB 1 1 9 9976 1 1 54 PHE CD1 C 0.087 2.813 -1.115 1.00 . A A . 89 PHE CD1 1 1 9 9977 1 1 54 PHE CD2 C 0.483 1.219 0.623 1.00 . A A . 89 PHE CD2 1 1 9 9978 1 1 54 PHE CE1 C -1.015 3.275 -0.447 1.00 . A A . 89 PHE CE1 1 1 9 9979 1 1 54 PHE CE2 C -0.612 1.694 1.298 1.00 . A A . 89 PHE CE2 1 1 9 9980 1 1 54 PHE CG C 0.856 1.777 -0.597 1.00 . A A . 89 PHE CG 1 1 9 9981 1 1 54 PHE CZ C -1.361 2.729 0.752 1.00 . A A . 89 PHE CZ 1 1 9 9982 1 1 54 PHE H H 2.554 3.718 -2.241 1.00 . A A . 89 PHE H 1 1 9 9983 1 1 54 PHE HA H 3.526 2.249 0.057 1.00 . A A . 89 PHE HA 1 1 9 9984 1 1 54 PHE HB2 H 1.917 1.301 -2.377 1.00 . A A . 89 PHE HB2 1 1 9 9985 1 1 54 PHE HB3 H 2.357 0.338 -0.977 1.00 . A A . 89 PHE HB3 1 1 9 9986 1 1 54 PHE HD1 H 0.357 3.247 -2.066 1.00 . A A . 89 PHE HD1 1 1 9 9987 1 1 54 PHE HD2 H 1.040 0.408 1.068 1.00 . A A . 89 PHE HD2 1 1 9 9988 1 1 54 PHE HE1 H -1.617 4.076 -0.848 1.00 . A A . 89 PHE HE1 1 1 9 9989 1 1 54 PHE HE2 H -0.894 1.240 2.241 1.00 . A A . 89 PHE HE2 1 1 9 9990 1 1 54 PHE HZ H -2.221 3.132 1.265 1.00 . A A . 89 PHE HZ 1 1 9 9991 1 1 54 PHE N N 3.005 3.606 -1.381 1.00 . A A . 89 PHE N 1 1 9 9992 1 1 54 PHE O O 4.621 2.215 -2.962 1.00 . A A . 89 PHE O 1 1 9 9993 1 1 55 TYR C C 7.241 -0.159 -1.475 1.00 . A A . 90 TYR C 1 1 9 9994 1 1 55 TYR CA C 6.754 1.243 -1.712 1.00 . A A . 90 TYR CA 1 1 9 9995 1 1 55 TYR CB C 7.650 2.249 -0.991 1.00 . A A . 90 TYR CB 1 1 9 9996 1 1 55 TYR CD1 C 7.300 4.276 -2.417 1.00 . A A . 90 TYR CD1 1 1 9 9997 1 1 55 TYR CD2 C 9.528 3.580 -2.001 1.00 . A A . 90 TYR CD2 1 1 9 9998 1 1 55 TYR CE1 C 7.752 5.337 -3.152 1.00 . A A . 90 TYR CE1 1 1 9 9999 1 1 55 TYR CE2 C 9.992 4.642 -2.739 1.00 . A A . 90 TYR CE2 1 1 9 10000 1 1 55 TYR CG C 8.178 3.375 -1.829 1.00 . A A . 90 TYR CG 1 1 9 10001 1 1 55 TYR CZ C 9.097 5.522 -3.312 1.00 . A A . 90 TYR CZ 1 1 9 10002 1 1 55 TYR H H 5.354 1.016 -0.209 1.00 . A A . 90 TYR H 1 1 9 10003 1 1 55 TYR HA H 6.725 1.489 -2.761 1.00 . A A . 90 TYR HA 1 1 9 10004 1 1 55 TYR HB2 H 6.916 2.816 -0.429 1.00 . A A . 90 TYR HB2 1 1 9 10005 1 1 55 TYR HB3 H 8.390 1.837 -0.325 1.00 . A A . 90 TYR HB3 1 1 9 10006 1 1 55 TYR HD1 H 6.237 4.137 -2.294 1.00 . A A . 90 TYR HD1 1 1 9 10007 1 1 55 TYR HD2 H 10.235 2.892 -1.564 1.00 . A A . 90 TYR HD2 1 1 9 10008 1 1 55 TYR HE1 H 7.039 6.015 -3.594 1.00 . A A . 90 TYR HE1 1 1 9 10009 1 1 55 TYR HE2 H 11.057 4.787 -2.852 1.00 . A A . 90 TYR HE2 1 1 9 10010 1 1 55 TYR HH H 9.136 7.383 -3.713 1.00 . A A . 90 TYR HH 1 1 9 10011 1 1 55 TYR N N 5.475 1.369 -1.121 1.00 . A A . 90 TYR N 1 1 9 10012 1 1 55 TYR O O 6.821 -0.814 -0.524 1.00 . A A . 90 TYR O 1 1 9 10013 1 1 55 TYR OH O 9.556 6.582 -4.052 1.00 . A A . 90 TYR OH 1 1 9 10014 1 1 56 CYS C C 9.698 -1.816 -1.100 1.00 . A A . 91 CYS C 1 1 9 10015 1 1 56 CYS CA C 8.598 -1.962 -2.110 1.00 . A A . 91 CYS CA 1 1 9 10016 1 1 56 CYS CB C 9.094 -2.663 -3.405 1.00 . A A . 91 CYS CB 1 1 9 10017 1 1 56 CYS H H 8.290 -0.151 -3.153 1.00 . A A . 91 CYS H 1 1 9 10018 1 1 56 CYS HA H 7.811 -2.550 -1.659 1.00 . A A . 91 CYS HA 1 1 9 10019 1 1 56 CYS HB2 H 9.408 -3.663 -3.147 1.00 . A A . 91 CYS HB2 1 1 9 10020 1 1 56 CYS HB3 H 8.285 -2.760 -4.108 1.00 . A A . 91 CYS HB3 1 1 9 10021 1 1 56 CYS N N 8.059 -0.664 -2.354 1.00 . A A . 91 CYS N 1 1 9 10022 1 1 56 CYS O O 10.324 -0.756 -1.082 1.00 . A A . 91 CYS O 1 1 9 10023 1 1 56 CYS SG S 10.475 -1.863 -4.262 1.00 . A A . 91 CYS SG 1 1 9 10024 1 1 57 LYS C C 12.343 -2.271 0.175 1.00 . A A . 92 LYS C 1 1 9 10025 1 1 57 LYS CA C 10.959 -2.715 0.754 1.00 . A A . 92 LYS CA 1 1 9 10026 1 1 57 LYS CB C 11.067 -4.054 1.507 1.00 . A A . 92 LYS CB 1 1 9 10027 1 1 57 LYS CD C 9.910 -5.872 2.800 1.00 . A A . 92 LYS CD 1 1 9 10028 1 1 57 LYS CE C 8.598 -6.362 3.408 1.00 . A A . 92 LYS CE 1 1 9 10029 1 1 57 LYS CG C 9.770 -4.494 2.179 1.00 . A A . 92 LYS CG 1 1 9 10030 1 1 57 LYS H H 9.388 -3.616 -0.307 1.00 . A A . 92 LYS H 1 1 9 10031 1 1 57 LYS HA H 10.633 -1.956 1.450 1.00 . A A . 92 LYS HA 1 1 9 10032 1 1 57 LYS HB2 H 11.358 -4.827 0.812 1.00 . A A . 92 LYS HB2 1 1 9 10033 1 1 57 LYS HB3 H 11.827 -3.973 2.269 1.00 . A A . 92 LYS HB3 1 1 9 10034 1 1 57 LYS HD2 H 10.228 -6.573 2.042 1.00 . A A . 92 LYS HD2 1 1 9 10035 1 1 57 LYS HD3 H 10.660 -5.820 3.576 1.00 . A A . 92 LYS HD3 1 1 9 10036 1 1 57 LYS HE2 H 7.840 -6.363 2.638 1.00 . A A . 92 LYS HE2 1 1 9 10037 1 1 57 LYS HE3 H 8.738 -7.371 3.766 1.00 . A A . 92 LYS HE3 1 1 9 10038 1 1 57 LYS HG2 H 9.525 -3.788 2.959 1.00 . A A . 92 LYS HG2 1 1 9 10039 1 1 57 LYS HG3 H 8.975 -4.511 1.449 1.00 . A A . 92 LYS HG3 1 1 9 10040 1 1 57 LYS HZ1 H 8.845 -5.434 5.279 1.00 . A A . 92 LYS HZ1 1 1 9 10041 1 1 57 LYS HZ2 H 7.255 -5.895 4.944 1.00 . A A . 92 LYS HZ2 1 1 9 10042 1 1 57 LYS HZ3 H 7.874 -4.549 4.217 1.00 . A A . 92 LYS HZ3 1 1 9 10043 1 1 57 LYS N N 9.934 -2.804 -0.275 1.00 . A A . 92 LYS N 1 1 9 10044 1 1 57 LYS NZ N 8.129 -5.510 4.528 1.00 . A A . 92 LYS NZ 1 1 9 10045 1 1 57 LYS O O 12.961 -1.355 0.751 1.00 . A A . 92 LYS O 1 1 9 10046 1 1 58 PRO C C 14.055 -0.881 -1.966 1.00 . A A . 93 PRO C 1 1 9 10047 1 1 58 PRO CA C 14.092 -2.377 -1.598 1.00 . A A . 93 PRO CA 1 1 9 10048 1 1 58 PRO CB C 14.218 -3.222 -2.868 1.00 . A A . 93 PRO CB 1 1 9 10049 1 1 58 PRO CD C 12.231 -3.942 -1.795 1.00 . A A . 93 PRO CD 1 1 9 10050 1 1 58 PRO CG C 13.358 -4.408 -2.634 1.00 . A A . 93 PRO CG 1 1 9 10051 1 1 58 PRO HA H 14.929 -2.565 -0.942 1.00 . A A . 93 PRO HA 1 1 9 10052 1 1 58 PRO HB2 H 13.864 -2.646 -3.710 1.00 . A A . 93 PRO HB2 1 1 9 10053 1 1 58 PRO HB3 H 15.250 -3.501 -3.023 1.00 . A A . 93 PRO HB3 1 1 9 10054 1 1 58 PRO HD2 H 11.426 -3.600 -2.432 1.00 . A A . 93 PRO HD2 1 1 9 10055 1 1 58 PRO HD3 H 11.890 -4.738 -1.151 1.00 . A A . 93 PRO HD3 1 1 9 10056 1 1 58 PRO HG2 H 12.988 -4.796 -3.571 1.00 . A A . 93 PRO HG2 1 1 9 10057 1 1 58 PRO HG3 H 13.905 -5.169 -2.104 1.00 . A A . 93 PRO HG3 1 1 9 10058 1 1 58 PRO N N 12.827 -2.829 -1.003 1.00 . A A . 93 PRO N 1 1 9 10059 1 1 58 PRO O O 14.939 -0.120 -1.570 1.00 . A A . 93 PRO O 1 1 9 10060 1 1 59 HIS C C 12.693 1.848 -1.870 1.00 . A A . 94 HIS C 1 1 9 10061 1 1 59 HIS CA C 12.877 0.974 -3.050 1.00 . A A . 94 HIS CA 1 1 9 10062 1 1 59 HIS CB C 11.779 1.275 -4.083 1.00 . A A . 94 HIS CB 1 1 9 10063 1 1 59 HIS CD2 C 13.402 1.030 -6.025 1.00 . A A . 94 HIS CD2 1 1 9 10064 1 1 59 HIS CE1 C 11.956 0.507 -7.562 1.00 . A A . 94 HIS CE1 1 1 9 10065 1 1 59 HIS CG C 12.175 1.000 -5.485 1.00 . A A . 94 HIS CG 1 1 9 10066 1 1 59 HIS H H 12.295 -1.091 -2.908 1.00 . A A . 94 HIS H 1 1 9 10067 1 1 59 HIS HA H 13.829 1.239 -3.483 1.00 . A A . 94 HIS HA 1 1 9 10068 1 1 59 HIS HB2 H 10.901 0.688 -3.861 1.00 . A A . 94 HIS HB2 1 1 9 10069 1 1 59 HIS HB3 H 11.538 2.324 -4.008 1.00 . A A . 94 HIS HB3 1 1 9 10070 1 1 59 HIS HD2 H 14.304 1.272 -5.483 1.00 . A A . 94 HIS HD2 1 1 9 10071 1 1 59 HIS HE1 H 11.536 0.223 -8.518 1.00 . A A . 94 HIS HE1 1 1 9 10072 1 1 59 HIS HE2 H 13.992 0.414 -7.939 1.00 . A A . 94 HIS HE2 1 1 9 10073 1 1 59 HIS N N 12.995 -0.446 -2.667 1.00 . A A . 94 HIS N 1 1 9 10074 1 1 59 HIS ND1 N 11.252 0.679 -6.450 1.00 . A A . 94 HIS ND1 1 1 9 10075 1 1 59 HIS NE2 N 13.264 0.716 -7.348 1.00 . A A . 94 HIS NE2 1 1 9 10076 1 1 59 HIS O O 13.157 2.973 -1.863 1.00 . A A . 94 HIS O 1 1 9 10077 1 1 60 PHE C C 13.117 2.363 0.970 1.00 . A A . 95 PHE C 1 1 9 10078 1 1 60 PHE CA C 11.784 2.099 0.306 1.00 . A A . 95 PHE CA 1 1 9 10079 1 1 60 PHE CB C 10.813 1.364 1.228 1.00 . A A . 95 PHE CB 1 1 9 10080 1 1 60 PHE CD1 C 9.848 3.556 2.015 1.00 . A A . 95 PHE CD1 1 1 9 10081 1 1 60 PHE CD2 C 9.750 1.698 3.462 1.00 . A A . 95 PHE CD2 1 1 9 10082 1 1 60 PHE CE1 C 9.205 4.324 2.956 1.00 . A A . 95 PHE CE1 1 1 9 10083 1 1 60 PHE CE2 C 9.097 2.467 4.400 1.00 . A A . 95 PHE CE2 1 1 9 10084 1 1 60 PHE CG C 10.133 2.227 2.261 1.00 . A A . 95 PHE CG 1 1 9 10085 1 1 60 PHE CZ C 8.829 3.777 4.149 1.00 . A A . 95 PHE CZ 1 1 9 10086 1 1 60 PHE H H 11.652 0.436 -0.948 1.00 . A A . 95 PHE H 1 1 9 10087 1 1 60 PHE HA H 11.365 3.054 0.025 1.00 . A A . 95 PHE HA 1 1 9 10088 1 1 60 PHE HB2 H 10.046 0.890 0.635 1.00 . A A . 95 PHE HB2 1 1 9 10089 1 1 60 PHE HB3 H 11.369 0.599 1.750 1.00 . A A . 95 PHE HB3 1 1 9 10090 1 1 60 PHE HD1 H 10.134 4.009 1.080 1.00 . A A . 95 PHE HD1 1 1 9 10091 1 1 60 PHE HD2 H 9.964 0.662 3.675 1.00 . A A . 95 PHE HD2 1 1 9 10092 1 1 60 PHE HE1 H 8.991 5.363 2.757 1.00 . A A . 95 PHE HE1 1 1 9 10093 1 1 60 PHE HE2 H 8.798 2.033 5.342 1.00 . A A . 95 PHE HE2 1 1 9 10094 1 1 60 PHE HZ H 8.316 4.376 4.887 1.00 . A A . 95 PHE HZ 1 1 9 10095 1 1 60 PHE N N 12.016 1.348 -0.878 1.00 . A A . 95 PHE N 1 1 9 10096 1 1 60 PHE O O 13.384 3.470 1.330 1.00 . A A . 95 PHE O 1 1 9 10097 1 1 61 GLN C C 16.219 2.410 0.797 1.00 . A A . 96 GLN C 1 1 9 10098 1 1 61 GLN CA C 15.321 1.493 1.612 1.00 . A A . 96 GLN CA 1 1 9 10099 1 1 61 GLN CB C 16.011 0.161 1.791 1.00 . A A . 96 GLN CB 1 1 9 10100 1 1 61 GLN CD C 16.150 -1.971 3.089 1.00 . A A . 96 GLN CD 1 1 9 10101 1 1 61 GLN CG C 15.426 -0.662 2.889 1.00 . A A . 96 GLN CG 1 1 9 10102 1 1 61 GLN H H 13.694 0.460 0.723 1.00 . A A . 96 GLN H 1 1 9 10103 1 1 61 GLN HA H 15.184 1.928 2.590 1.00 . A A . 96 GLN HA 1 1 9 10104 1 1 61 GLN HB2 H 15.934 -0.395 0.868 1.00 . A A . 96 GLN HB2 1 1 9 10105 1 1 61 GLN HB3 H 17.055 0.335 2.010 1.00 . A A . 96 GLN HB3 1 1 9 10106 1 1 61 GLN HE21 H 15.791 -1.897 5.021 1.00 . A A . 96 GLN HE21 1 1 9 10107 1 1 61 GLN HE22 H 16.692 -3.263 4.468 1.00 . A A . 96 GLN HE22 1 1 9 10108 1 1 61 GLN HG2 H 15.442 -0.093 3.807 1.00 . A A . 96 GLN HG2 1 1 9 10109 1 1 61 GLN HG3 H 14.404 -0.865 2.604 1.00 . A A . 96 GLN HG3 1 1 9 10110 1 1 61 GLN N N 13.973 1.346 1.051 1.00 . A A . 96 GLN N 1 1 9 10111 1 1 61 GLN NE2 N 16.212 -2.422 4.305 1.00 . A A . 96 GLN NE2 1 1 9 10112 1 1 61 GLN O O 17.025 3.159 1.348 1.00 . A A . 96 GLN O 1 1 9 10113 1 1 61 GLN OE1 O 16.669 -2.559 2.152 1.00 . A A . 96 GLN OE1 1 1 9 10114 1 1 62 GLN C C 16.498 4.579 -1.379 1.00 . A A . 97 GLN C 1 1 9 10115 1 1 62 GLN CA C 16.951 3.117 -1.344 1.00 . A A . 97 GLN CA 1 1 9 10116 1 1 62 GLN CB C 16.920 2.532 -2.747 1.00 . A A . 97 GLN CB 1 1 9 10117 1 1 62 GLN CD C 17.426 0.591 -4.265 1.00 . A A . 97 GLN CD 1 1 9 10118 1 1 62 GLN CG C 17.505 1.137 -2.858 1.00 . A A . 97 GLN CG 1 1 9 10119 1 1 62 GLN H H 15.517 1.684 -0.927 1.00 . A A . 97 GLN H 1 1 9 10120 1 1 62 GLN HA H 17.967 3.058 -0.985 1.00 . A A . 97 GLN HA 1 1 9 10121 1 1 62 GLN HB2 H 15.896 2.492 -3.092 1.00 . A A . 97 GLN HB2 1 1 9 10122 1 1 62 GLN HB3 H 17.478 3.188 -3.389 1.00 . A A . 97 GLN HB3 1 1 9 10123 1 1 62 GLN HE21 H 19.157 1.418 -4.676 1.00 . A A . 97 GLN HE21 1 1 9 10124 1 1 62 GLN HE22 H 18.435 0.548 -5.972 1.00 . A A . 97 GLN HE22 1 1 9 10125 1 1 62 GLN HG2 H 18.542 1.164 -2.555 1.00 . A A . 97 GLN HG2 1 1 9 10126 1 1 62 GLN HG3 H 16.956 0.482 -2.198 1.00 . A A . 97 GLN HG3 1 1 9 10127 1 1 62 GLN N N 16.127 2.322 -0.499 1.00 . A A . 97 GLN N 1 1 9 10128 1 1 62 GLN NE2 N 18.426 0.875 -5.046 1.00 . A A . 97 GLN NE2 1 1 9 10129 1 1 62 GLN O O 17.291 5.492 -1.161 1.00 . A A . 97 GLN O 1 1 9 10130 1 1 62 GLN OE1 O 16.452 -0.070 -4.650 1.00 . A A . 97 GLN OE1 1 1 9 10131 1 1 63 LEU C C 14.353 6.838 -0.520 1.00 . A A . 98 LEU C 1 1 9 10132 1 1 63 LEU CA C 14.683 6.109 -1.814 1.00 . A A . 98 LEU CA 1 1 9 10133 1 1 63 LEU CB C 13.480 6.012 -2.705 1.00 . A A . 98 LEU CB 1 1 9 10134 1 1 63 LEU CD1 C 12.606 5.077 -4.817 1.00 . A A . 98 LEU CD1 1 1 9 10135 1 1 63 LEU CD2 C 14.268 6.864 -4.893 1.00 . A A . 98 LEU CD2 1 1 9 10136 1 1 63 LEU CG C 13.806 5.642 -4.143 1.00 . A A . 98 LEU CG 1 1 9 10137 1 1 63 LEU H H 14.638 4.012 -1.757 1.00 . A A . 98 LEU H 1 1 9 10138 1 1 63 LEU HA H 15.416 6.689 -2.351 1.00 . A A . 98 LEU HA 1 1 9 10139 1 1 63 LEU HB2 H 12.839 5.253 -2.285 1.00 . A A . 98 LEU HB2 1 1 9 10140 1 1 63 LEU HB3 H 12.962 6.959 -2.701 1.00 . A A . 98 LEU HB3 1 1 9 10141 1 1 63 LEU HD11 H 11.801 5.795 -4.772 1.00 . A A . 98 LEU HD11 1 1 9 10142 1 1 63 LEU HD12 H 12.321 4.164 -4.318 1.00 . A A . 98 LEU HD12 1 1 9 10143 1 1 63 LEU HD13 H 12.843 4.864 -5.848 1.00 . A A . 98 LEU HD13 1 1 9 10144 1 1 63 LEU HD21 H 14.464 6.603 -5.923 1.00 . A A . 98 LEU HD21 1 1 9 10145 1 1 63 LEU HD22 H 15.160 7.260 -4.434 1.00 . A A . 98 LEU HD22 1 1 9 10146 1 1 63 LEU HD23 H 13.478 7.599 -4.852 1.00 . A A . 98 LEU HD23 1 1 9 10147 1 1 63 LEU HG H 14.602 4.913 -4.171 1.00 . A A . 98 LEU HG 1 1 9 10148 1 1 63 LEU N N 15.241 4.782 -1.654 1.00 . A A . 98 LEU N 1 1 9 10149 1 1 63 LEU O O 14.664 8.007 -0.381 1.00 . A A . 98 LEU O 1 1 9 10150 1 1 64 PHE C C 14.206 6.391 2.834 1.00 . A A . 99 PHE C 1 1 9 10151 1 1 64 PHE CA C 13.344 6.839 1.655 1.00 . A A . 99 PHE CA 1 1 9 10152 1 1 64 PHE CB C 11.846 6.615 1.932 1.00 . A A . 99 PHE CB 1 1 9 10153 1 1 64 PHE CD1 C 11.226 8.635 0.526 1.00 . A A . 99 PHE CD1 1 1 9 10154 1 1 64 PHE CD2 C 9.694 6.795 0.576 1.00 . A A . 99 PHE CD2 1 1 9 10155 1 1 64 PHE CE1 C 10.383 9.308 -0.336 1.00 . A A . 99 PHE CE1 1 1 9 10156 1 1 64 PHE CE2 C 8.857 7.481 -0.284 1.00 . A A . 99 PHE CE2 1 1 9 10157 1 1 64 PHE CG C 10.903 7.365 0.997 1.00 . A A . 99 PHE CG 1 1 9 10158 1 1 64 PHE CZ C 9.209 8.733 -0.739 1.00 . A A . 99 PHE CZ 1 1 9 10159 1 1 64 PHE H H 13.501 5.220 0.293 1.00 . A A . 99 PHE H 1 1 9 10160 1 1 64 PHE HA H 13.516 7.892 1.508 1.00 . A A . 99 PHE HA 1 1 9 10161 1 1 64 PHE HB2 H 11.690 5.588 1.633 1.00 . A A . 99 PHE HB2 1 1 9 10162 1 1 64 PHE HB3 H 11.579 6.750 2.965 1.00 . A A . 99 PHE HB3 1 1 9 10163 1 1 64 PHE HD1 H 12.148 9.105 0.831 1.00 . A A . 99 PHE HD1 1 1 9 10164 1 1 64 PHE HD2 H 9.369 5.822 0.927 1.00 . A A . 99 PHE HD2 1 1 9 10165 1 1 64 PHE HE1 H 10.630 10.292 -0.702 1.00 . A A . 99 PHE HE1 1 1 9 10166 1 1 64 PHE HE2 H 7.928 7.032 -0.605 1.00 . A A . 99 PHE HE2 1 1 9 10167 1 1 64 PHE HZ H 8.567 9.281 -1.411 1.00 . A A . 99 PHE HZ 1 1 9 10168 1 1 64 PHE N N 13.738 6.163 0.426 1.00 . A A . 99 PHE N 1 1 9 10169 1 1 64 PHE O O 14.350 7.106 3.822 1.00 . A A . 99 PHE O 1 1 9 10170 1 1 65 LYS C C 15.017 4.001 4.911 1.00 . A A . 100 LYS C 1 1 9 10171 1 1 65 LYS CA C 15.652 4.523 3.617 1.00 . A A . 100 LYS CA 1 1 9 10172 1 1 65 LYS CB C 16.903 5.362 3.878 1.00 . A A . 100 LYS CB 1 1 9 10173 1 1 65 LYS CD C 19.226 5.435 4.748 1.00 . A A . 100 LYS CD 1 1 9 10174 1 1 65 LYS CE C 20.316 4.657 5.451 1.00 . A A . 100 LYS CE 1 1 9 10175 1 1 65 LYS CG C 17.972 4.612 4.620 1.00 . A A . 100 LYS CG 1 1 9 10176 1 1 65 LYS H H 14.443 4.650 1.943 1.00 . A A . 100 LYS H 1 1 9 10177 1 1 65 LYS HA H 15.965 3.644 3.073 1.00 . A A . 100 LYS HA 1 1 9 10178 1 1 65 LYS HB2 H 17.307 5.692 2.933 1.00 . A A . 100 LYS HB2 1 1 9 10179 1 1 65 LYS HB3 H 16.624 6.226 4.462 1.00 . A A . 100 LYS HB3 1 1 9 10180 1 1 65 LYS HD2 H 19.563 5.714 3.761 1.00 . A A . 100 LYS HD2 1 1 9 10181 1 1 65 LYS HD3 H 18.999 6.324 5.315 1.00 . A A . 100 LYS HD3 1 1 9 10182 1 1 65 LYS HE2 H 19.999 4.455 6.463 1.00 . A A . 100 LYS HE2 1 1 9 10183 1 1 65 LYS HE3 H 20.469 3.722 4.934 1.00 . A A . 100 LYS HE3 1 1 9 10184 1 1 65 LYS HG2 H 17.582 4.365 5.595 1.00 . A A . 100 LYS HG2 1 1 9 10185 1 1 65 LYS HG3 H 18.194 3.698 4.087 1.00 . A A . 100 LYS HG3 1 1 9 10186 1 1 65 LYS HZ1 H 21.480 6.297 6.012 1.00 . A A . 100 LYS HZ1 1 1 9 10187 1 1 65 LYS HZ2 H 21.936 5.597 4.530 1.00 . A A . 100 LYS HZ2 1 1 9 10188 1 1 65 LYS HZ3 H 22.301 4.821 5.973 1.00 . A A . 100 LYS HZ3 1 1 9 10189 1 1 65 LYS N N 14.724 5.187 2.714 1.00 . A A . 100 LYS N 1 1 9 10190 1 1 65 LYS NZ N 21.587 5.404 5.491 1.00 . A A . 100 LYS NZ 1 1 9 10191 1 1 65 LYS O O 15.352 2.902 5.379 1.00 . A A . 100 LYS O 1 1 9 10192 1 1 66 SER C C 12.450 3.297 6.703 1.00 . A A . 101 SER C 1 1 9 10193 1 1 66 SER CA C 13.489 4.458 6.721 1.00 . A A . 101 SER CA 1 1 9 10194 1 1 66 SER CB C 12.848 5.738 7.233 1.00 . A A . 101 SER CB 1 1 9 10195 1 1 66 SER H H 13.822 5.559 4.970 1.00 . A A . 101 SER H 1 1 9 10196 1 1 66 SER HA H 14.281 4.201 7.405 1.00 . A A . 101 SER HA 1 1 9 10197 1 1 66 SER HB2 H 12.006 5.986 6.604 1.00 . A A . 101 SER HB2 1 1 9 10198 1 1 66 SER HB3 H 12.503 5.595 8.246 1.00 . A A . 101 SER HB3 1 1 9 10199 1 1 66 SER HG H 13.263 7.616 7.391 1.00 . A A . 101 SER HG 1 1 9 10200 1 1 66 SER N N 14.096 4.744 5.442 1.00 . A A . 101 SER N 1 1 9 10201 1 1 66 SER O O 11.248 3.565 6.679 1.00 . A A . 101 SER O 1 1 9 10202 1 1 66 SER OG O 13.776 6.821 7.208 1.00 . A A . 101 SER OG 1 1 9 10203 1 1 67 LYS C C 12.972 -0.381 6.003 1.00 . A A . 102 LYS C 1 1 9 10204 1 1 67 LYS CA C 12.274 0.701 6.827 1.00 . A A . 102 LYS CA 1 1 9 10205 1 1 67 LYS CB C 10.740 0.625 6.564 1.00 . A A . 102 LYS CB 1 1 9 10206 1 1 67 LYS CD C 9.972 0.580 8.982 1.00 . A A . 102 LYS CD 1 1 9 10207 1 1 67 LYS CE C 8.988 1.167 9.980 1.00 . A A . 102 LYS CE 1 1 9 10208 1 1 67 LYS CG C 9.811 1.229 7.626 1.00 . A A . 102 LYS CG 1 1 9 10209 1 1 67 LYS H H 13.935 1.994 6.461 1.00 . A A . 102 LYS H 1 1 9 10210 1 1 67 LYS HA H 12.483 0.433 7.854 1.00 . A A . 102 LYS HA 1 1 9 10211 1 1 67 LYS HB2 H 10.550 1.140 5.636 1.00 . A A . 102 LYS HB2 1 1 9 10212 1 1 67 LYS HB3 H 10.476 -0.415 6.436 1.00 . A A . 102 LYS HB3 1 1 9 10213 1 1 67 LYS HD2 H 9.794 -0.481 8.886 1.00 . A A . 102 LYS HD2 1 1 9 10214 1 1 67 LYS HD3 H 10.977 0.747 9.340 1.00 . A A . 102 LYS HD3 1 1 9 10215 1 1 67 LYS HE2 H 9.211 0.788 10.965 1.00 . A A . 102 LYS HE2 1 1 9 10216 1 1 67 LYS HE3 H 9.108 2.240 9.977 1.00 . A A . 102 LYS HE3 1 1 9 10217 1 1 67 LYS HG2 H 10.026 2.282 7.723 1.00 . A A . 102 LYS HG2 1 1 9 10218 1 1 67 LYS HG3 H 8.789 1.106 7.299 1.00 . A A . 102 LYS HG3 1 1 9 10219 1 1 67 LYS HZ1 H 7.303 1.146 8.688 1.00 . A A . 102 LYS HZ1 1 1 9 10220 1 1 67 LYS HZ2 H 6.936 1.315 10.319 1.00 . A A . 102 LYS HZ2 1 1 9 10221 1 1 67 LYS HZ3 H 7.397 -0.175 9.733 1.00 . A A . 102 LYS HZ3 1 1 9 10222 1 1 67 LYS N N 12.969 2.037 6.649 1.00 . A A . 102 LYS N 1 1 9 10223 1 1 67 LYS NZ N 7.576 0.846 9.646 1.00 . A A . 102 LYS NZ 1 1 9 10224 1 1 67 LYS O O 14.173 -0.585 6.145 1.00 . A A . 102 LYS O 1 1 9 10225 1 1 68 GLY C C 12.897 -3.401 5.172 1.00 . A A . 103 GLY C 1 1 9 10226 1 1 68 GLY CA C 12.795 -2.142 4.356 1.00 . A A . 103 GLY CA 1 1 9 10227 1 1 68 GLY H H 11.291 -0.839 4.893 1.00 . A A . 103 GLY H 1 1 9 10228 1 1 68 GLY HA2 H 12.205 -2.330 3.472 1.00 . A A . 103 GLY HA2 1 1 9 10229 1 1 68 GLY HA3 H 13.795 -1.857 4.067 1.00 . A A . 103 GLY HA3 1 1 9 10230 1 1 68 GLY N N 12.225 -1.061 5.103 1.00 . A A . 103 GLY N 1 1 9 10231 1 1 68 GLY O O 13.530 -4.358 4.756 1.00 . A A . 103 GLY O 1 1 9 10232 1 1 69 ASN C C 11.630 -5.679 6.516 1.00 . A A . 104 ASN C 1 1 9 10233 1 1 69 ASN CA C 12.290 -4.536 7.236 1.00 . A A . 104 ASN CA 1 1 9 10234 1 1 69 ASN CB C 11.552 -4.246 8.555 1.00 . A A . 104 ASN CB 1 1 9 10235 1 1 69 ASN CG C 12.157 -3.116 9.379 1.00 . A A . 104 ASN CG 1 1 9 10236 1 1 69 ASN H H 11.843 -2.557 6.617 1.00 . A A . 104 ASN H 1 1 9 10237 1 1 69 ASN HA H 13.316 -4.799 7.444 1.00 . A A . 104 ASN HA 1 1 9 10238 1 1 69 ASN HB2 H 10.525 -3.992 8.343 1.00 . A A . 104 ASN HB2 1 1 9 10239 1 1 69 ASN HB3 H 11.575 -5.144 9.152 1.00 . A A . 104 ASN HB3 1 1 9 10240 1 1 69 ASN HD21 H 10.399 -2.750 10.201 1.00 . A A . 104 ASN HD21 1 1 9 10241 1 1 69 ASN HD22 H 11.699 -1.744 10.727 1.00 . A A . 104 ASN HD22 1 1 9 10242 1 1 69 ASN N N 12.290 -3.384 6.351 1.00 . A A . 104 ASN N 1 1 9 10243 1 1 69 ASN ND2 N 11.343 -2.471 10.173 1.00 . A A . 104 ASN ND2 1 1 9 10244 1 1 69 ASN O O 10.470 -5.552 6.061 1.00 . A A . 104 ASN O 1 1 9 10245 1 1 69 ASN OD1 O 13.360 -2.847 9.323 1.00 . A A . 104 ASN OD1 1 1 9 10246 1 1 70 TYR C C 10.810 -8.558 6.426 1.00 . A A . 105 TYR C 1 1 9 10247 1 1 70 TYR CA C 11.885 -7.883 5.610 1.00 . A A . 105 TYR CA 1 1 9 10248 1 1 70 TYR CB C 13.035 -8.837 5.271 1.00 . A A . 105 TYR CB 1 1 9 10249 1 1 70 TYR CD1 C 13.194 -9.147 2.785 1.00 . A A . 105 TYR CD1 1 1 9 10250 1 1 70 TYR CD2 C 12.170 -10.884 4.054 1.00 . A A . 105 TYR CD2 1 1 9 10251 1 1 70 TYR CE1 C 12.981 -9.853 1.626 1.00 . A A . 105 TYR CE1 1 1 9 10252 1 1 70 TYR CE2 C 11.955 -11.601 2.893 1.00 . A A . 105 TYR CE2 1 1 9 10253 1 1 70 TYR CG C 12.795 -9.646 4.018 1.00 . A A . 105 TYR CG 1 1 9 10254 1 1 70 TYR CZ C 12.363 -11.076 1.681 1.00 . A A . 105 TYR CZ 1 1 9 10255 1 1 70 TYR H H 13.235 -6.833 6.788 1.00 . A A . 105 TYR H 1 1 9 10256 1 1 70 TYR HA H 11.443 -7.508 4.698 1.00 . A A . 105 TYR HA 1 1 9 10257 1 1 70 TYR HB2 H 13.941 -8.267 5.128 1.00 . A A . 105 TYR HB2 1 1 9 10258 1 1 70 TYR HB3 H 13.179 -9.525 6.088 1.00 . A A . 105 TYR HB3 1 1 9 10259 1 1 70 TYR HD1 H 13.681 -8.184 2.743 1.00 . A A . 105 TYR HD1 1 1 9 10260 1 1 70 TYR HD2 H 11.852 -11.288 5.004 1.00 . A A . 105 TYR HD2 1 1 9 10261 1 1 70 TYR HE1 H 13.300 -9.446 0.678 1.00 . A A . 105 TYR HE1 1 1 9 10262 1 1 70 TYR HE2 H 11.469 -12.564 2.934 1.00 . A A . 105 TYR HE2 1 1 9 10263 1 1 70 TYR HH H 11.201 -12.030 0.529 1.00 . A A . 105 TYR HH 1 1 9 10264 1 1 70 TYR N N 12.359 -6.764 6.359 1.00 . A A . 105 TYR N 1 1 9 10265 1 1 70 TYR O O 10.963 -8.737 7.633 1.00 . A A . 105 TYR O 1 1 9 10266 1 1 70 TYR OH O 12.142 -11.779 0.518 1.00 . A A . 105 TYR OH 1 1 9 10267 1 1 71 ASP C C 7.655 -10.087 5.505 1.00 . A A . 106 ASP C 1 1 9 10268 1 1 71 ASP CA C 8.566 -9.383 6.482 1.00 . A A . 106 ASP CA 1 1 9 10269 1 1 71 ASP CB C 7.842 -8.196 7.164 1.00 . A A . 106 ASP CB 1 1 9 10270 1 1 71 ASP CG C 6.506 -8.520 7.826 1.00 . A A . 106 ASP CG 1 1 9 10271 1 1 71 ASP H H 9.694 -8.842 4.812 1.00 . A A . 106 ASP H 1 1 9 10272 1 1 71 ASP HA H 8.919 -10.059 7.245 1.00 . A A . 106 ASP HA 1 1 9 10273 1 1 71 ASP HB2 H 8.490 -7.792 7.926 1.00 . A A . 106 ASP HB2 1 1 9 10274 1 1 71 ASP HB3 H 7.680 -7.437 6.412 1.00 . A A . 106 ASP HB3 1 1 9 10275 1 1 71 ASP N N 9.728 -8.887 5.788 1.00 . A A . 106 ASP N 1 1 9 10276 1 1 71 ASP O O 6.900 -9.441 4.772 1.00 . A A . 106 ASP O 1 1 9 10277 1 1 71 ASP OD1 O 6.479 -9.229 8.857 1.00 . A A . 106 ASP OD1 1 1 9 10278 1 1 71 ASP OD2 O 5.462 -7.975 7.363 1.00 . A A . 106 ASP OD2 1 1 9 10279 1 1 72 GLU C C 6.398 -13.298 5.479 1.00 . A A . 107 GLU C 1 1 9 10280 1 1 72 GLU CA C 6.955 -12.210 4.610 1.00 . A A . 107 GLU CA 1 1 9 10281 1 1 72 GLU CB C 7.650 -12.796 3.362 1.00 . A A . 107 GLU CB 1 1 9 10282 1 1 72 GLU CD C 8.418 -12.405 0.986 1.00 . A A . 107 GLU CD 1 1 9 10283 1 1 72 GLU CG C 7.994 -11.770 2.295 1.00 . A A . 107 GLU CG 1 1 9 10284 1 1 72 GLU H H 8.507 -11.826 5.940 1.00 . A A . 107 GLU H 1 1 9 10285 1 1 72 GLU HA H 6.132 -11.583 4.303 1.00 . A A . 107 GLU HA 1 1 9 10286 1 1 72 GLU HB2 H 8.564 -13.285 3.661 1.00 . A A . 107 GLU HB2 1 1 9 10287 1 1 72 GLU HB3 H 6.997 -13.533 2.919 1.00 . A A . 107 GLU HB3 1 1 9 10288 1 1 72 GLU HG2 H 7.109 -11.178 2.124 1.00 . A A . 107 GLU HG2 1 1 9 10289 1 1 72 GLU HG3 H 8.792 -11.139 2.659 1.00 . A A . 107 GLU HG3 1 1 9 10290 1 1 72 GLU N N 7.807 -11.377 5.419 1.00 . A A . 107 GLU N 1 1 9 10291 1 1 72 GLU O O 5.201 -13.258 5.794 1.00 . A A . 107 GLU O 1 1 9 10292 1 1 72 GLU OXT O 7.187 -14.139 5.970 1.00 . A A . 107 GLU OXT 1 1 9 10293 1 1 72 GLU OE1 O 7.538 -12.860 0.222 1.00 . A A . 107 GLU OE1 1 1 9 10294 1 1 72 GLU OE2 O 9.623 -12.479 0.698 1.00 . A A . 107 GLU OE2 1 1 9 10295 2 2 1 ZN ZN ZN -7.963 0.220 -4.463 1.00 . B A . 201 ZN ZN 1 1 9 10296 3 2 1 ZN ZN ZN 9.761 -0.531 -6.002 1.00 . C A . 202 ZN ZN 1 1 10 10297 1 1 1 ARG C C -22.053 1.520 11.285 1.00 . A A . 36 ARG C 1 1 10 10298 1 1 1 ARG CA C -21.161 1.956 12.443 1.00 . A A . 36 ARG CA 1 1 10 10299 1 1 1 ARG CB C -21.887 3.019 13.299 1.00 . A A . 36 ARG CB 1 1 10 10300 1 1 1 ARG CD C -22.908 5.306 13.529 1.00 . A A . 36 ARG CD 1 1 10 10301 1 1 1 ARG CG C -22.074 4.386 12.641 1.00 . A A . 36 ARG CG 1 1 10 10302 1 1 1 ARG CZ C -23.705 7.689 13.554 1.00 . A A . 36 ARG CZ 1 1 10 10303 1 1 1 ARG H1 H -19.346 1.622 11.536 1.00 . A A . 36 ARG H1 1 1 10 10304 1 1 1 ARG H2 H -19.260 2.747 12.789 1.00 . A A . 36 ARG H2 1 1 10 10305 1 1 1 ARG H3 H -19.927 3.174 11.294 1.00 . A A . 36 ARG H3 1 1 10 10306 1 1 1 ARG HA H -20.995 1.083 13.057 1.00 . A A . 36 ARG HA 1 1 10 10307 1 1 1 ARG HB2 H -22.869 2.639 13.540 1.00 . A A . 36 ARG HB2 1 1 10 10308 1 1 1 ARG HB3 H -21.340 3.157 14.220 1.00 . A A . 36 ARG HB3 1 1 10 10309 1 1 1 ARG HD2 H -23.906 4.898 13.581 1.00 . A A . 36 ARG HD2 1 1 10 10310 1 1 1 ARG HD3 H -22.483 5.328 14.521 1.00 . A A . 36 ARG HD3 1 1 10 10311 1 1 1 ARG HE H -22.446 6.866 12.206 1.00 . A A . 36 ARG HE 1 1 10 10312 1 1 1 ARG HG2 H -21.106 4.836 12.481 1.00 . A A . 36 ARG HG2 1 1 10 10313 1 1 1 ARG HG3 H -22.578 4.257 11.693 1.00 . A A . 36 ARG HG3 1 1 10 10314 1 1 1 ARG HH11 H -24.609 6.573 15.021 1.00 . A A . 36 ARG HH11 1 1 10 10315 1 1 1 ARG HH12 H -25.035 8.227 15.003 1.00 . A A . 36 ARG HH12 1 1 10 10316 1 1 1 ARG HH21 H -23.058 9.087 12.233 1.00 . A A . 36 ARG HH21 1 1 10 10317 1 1 1 ARG HH22 H -24.146 9.675 13.407 1.00 . A A . 36 ARG HH22 1 1 10 10318 1 1 1 ARG N N -19.842 2.413 11.995 1.00 . A A . 36 ARG N 1 1 10 10319 1 1 1 ARG NE N -22.989 6.682 13.007 1.00 . A A . 36 ARG NE 1 1 10 10320 1 1 1 ARG NH1 N -24.500 7.478 14.600 1.00 . A A . 36 ARG NH1 1 1 10 10321 1 1 1 ARG NH2 N -23.634 8.898 13.032 1.00 . A A . 36 ARG NH2 1 1 10 10322 1 1 1 ARG O O -23.257 1.344 11.473 1.00 . A A . 36 ARG O 1 1 10 10323 1 1 2 ALA C C -21.529 0.017 8.051 1.00 . A A . 37 ALA C 1 1 10 10324 1 1 2 ALA CA C -22.299 0.936 8.971 1.00 . A A . 37 ALA CA 1 1 10 10325 1 1 2 ALA CB C -22.741 2.185 8.214 1.00 . A A . 37 ALA CB 1 1 10 10326 1 1 2 ALA H H -20.525 1.359 9.949 1.00 . A A . 37 ALA H 1 1 10 10327 1 1 2 ALA HA H -23.180 0.430 9.334 1.00 . A A . 37 ALA HA 1 1 10 10328 1 1 2 ALA HB1 H -23.364 1.901 7.379 1.00 . A A . 37 ALA HB1 1 1 10 10329 1 1 2 ALA HB2 H -21.872 2.714 7.851 1.00 . A A . 37 ALA HB2 1 1 10 10330 1 1 2 ALA HB3 H -23.302 2.826 8.879 1.00 . A A . 37 ALA HB3 1 1 10 10331 1 1 2 ALA N N -21.493 1.307 10.108 1.00 . A A . 37 ALA N 1 1 10 10332 1 1 2 ALA O O -20.296 0.100 7.961 1.00 . A A . 37 ALA O 1 1 10 10333 1 1 3 GLN C C -21.532 -0.957 5.075 1.00 . A A . 38 GLN C 1 1 10 10334 1 1 3 GLN CA C -21.625 -1.730 6.395 1.00 . A A . 38 GLN CA 1 1 10 10335 1 1 3 GLN CB C -22.349 -3.120 6.257 1.00 . A A . 38 GLN CB 1 1 10 10336 1 1 3 GLN CD C -24.809 -2.470 6.743 1.00 . A A . 38 GLN CD 1 1 10 10337 1 1 3 GLN CG C -23.822 -3.114 5.784 1.00 . A A . 38 GLN CG 1 1 10 10338 1 1 3 GLN H H -23.199 -0.922 7.558 1.00 . A A . 38 GLN H 1 1 10 10339 1 1 3 GLN HA H -20.607 -1.876 6.733 1.00 . A A . 38 GLN HA 1 1 10 10340 1 1 3 GLN HB2 H -21.792 -3.717 5.550 1.00 . A A . 38 GLN HB2 1 1 10 10341 1 1 3 GLN HB3 H -22.304 -3.615 7.216 1.00 . A A . 38 GLN HB3 1 1 10 10342 1 1 3 GLN HE21 H -23.802 -3.107 8.336 1.00 . A A . 38 GLN HE21 1 1 10 10343 1 1 3 GLN HE22 H -25.225 -2.173 8.644 1.00 . A A . 38 GLN HE22 1 1 10 10344 1 1 3 GLN HG2 H -23.874 -2.569 4.853 1.00 . A A . 38 GLN HG2 1 1 10 10345 1 1 3 GLN HG3 H -24.126 -4.135 5.605 1.00 . A A . 38 GLN HG3 1 1 10 10346 1 1 3 GLN N N -22.235 -0.863 7.382 1.00 . A A . 38 GLN N 1 1 10 10347 1 1 3 GLN NE2 N -24.585 -2.597 8.031 1.00 . A A . 38 GLN NE2 1 1 10 10348 1 1 3 GLN O O -22.245 -1.213 4.089 1.00 . A A . 38 GLN O 1 1 10 10349 1 1 3 GLN OE1 O -25.796 -1.891 6.314 1.00 . A A . 38 GLN OE1 1 1 10 10350 1 1 4 VAL C C -19.221 0.651 3.258 1.00 . A A . 39 VAL C 1 1 10 10351 1 1 4 VAL CA C -20.514 0.942 4.015 1.00 . A A . 39 VAL CA 1 1 10 10352 1 1 4 VAL CB C -20.516 2.411 4.552 1.00 . A A . 39 VAL CB 1 1 10 10353 1 1 4 VAL CG1 C -19.341 2.678 5.487 1.00 . A A . 39 VAL CG1 1 1 10 10354 1 1 4 VAL CG2 C -20.562 3.431 3.419 1.00 . A A . 39 VAL CG2 1 1 10 10355 1 1 4 VAL H H -20.117 0.138 5.893 1.00 . A A . 39 VAL H 1 1 10 10356 1 1 4 VAL HA H -21.358 0.827 3.352 1.00 . A A . 39 VAL HA 1 1 10 10357 1 1 4 VAL HB H -21.413 2.523 5.144 1.00 . A A . 39 VAL HB 1 1 10 10358 1 1 4 VAL HG11 H -19.374 3.704 5.823 1.00 . A A . 39 VAL HG11 1 1 10 10359 1 1 4 VAL HG12 H -18.416 2.500 4.958 1.00 . A A . 39 VAL HG12 1 1 10 10360 1 1 4 VAL HG13 H -19.402 2.016 6.338 1.00 . A A . 39 VAL HG13 1 1 10 10361 1 1 4 VAL HG21 H -21.465 3.290 2.843 1.00 . A A . 39 VAL HG21 1 1 10 10362 1 1 4 VAL HG22 H -19.707 3.288 2.775 1.00 . A A . 39 VAL HG22 1 1 10 10363 1 1 4 VAL HG23 H -20.544 4.431 3.826 1.00 . A A . 39 VAL HG23 1 1 10 10364 1 1 4 VAL N N -20.681 0.026 5.097 1.00 . A A . 39 VAL N 1 1 10 10365 1 1 4 VAL O O -18.241 0.151 3.822 1.00 . A A . 39 VAL O 1 1 10 10366 1 1 5 LYS C C -17.094 1.863 1.443 1.00 . A A . 40 LYS C 1 1 10 10367 1 1 5 LYS CA C -18.153 0.793 1.106 1.00 . A A . 40 LYS CA 1 1 10 10368 1 1 5 LYS CB C -18.655 0.898 -0.354 1.00 . A A . 40 LYS CB 1 1 10 10369 1 1 5 LYS CD C -19.988 2.232 -2.087 1.00 . A A . 40 LYS CD 1 1 10 10370 1 1 5 LYS CE C -21.094 1.206 -2.278 1.00 . A A . 40 LYS CE 1 1 10 10371 1 1 5 LYS CG C -19.400 2.207 -0.676 1.00 . A A . 40 LYS CG 1 1 10 10372 1 1 5 LYS H H -20.120 1.224 1.617 1.00 . A A . 40 LYS H 1 1 10 10373 1 1 5 LYS HA H -17.718 -0.184 1.255 1.00 . A A . 40 LYS HA 1 1 10 10374 1 1 5 LYS HB2 H -17.812 0.811 -1.021 1.00 . A A . 40 LYS HB2 1 1 10 10375 1 1 5 LYS HB3 H -19.328 0.074 -0.540 1.00 . A A . 40 LYS HB3 1 1 10 10376 1 1 5 LYS HD2 H -20.402 3.212 -2.268 1.00 . A A . 40 LYS HD2 1 1 10 10377 1 1 5 LYS HD3 H -19.203 2.035 -2.802 1.00 . A A . 40 LYS HD3 1 1 10 10378 1 1 5 LYS HE2 H -20.686 0.216 -2.145 1.00 . A A . 40 LYS HE2 1 1 10 10379 1 1 5 LYS HE3 H -21.862 1.388 -1.543 1.00 . A A . 40 LYS HE3 1 1 10 10380 1 1 5 LYS HG2 H -20.201 2.344 0.034 1.00 . A A . 40 LYS HG2 1 1 10 10381 1 1 5 LYS HG3 H -18.702 3.025 -0.574 1.00 . A A . 40 LYS HG3 1 1 10 10382 1 1 5 LYS HZ1 H -22.082 2.244 -3.786 1.00 . A A . 40 LYS HZ1 1 1 10 10383 1 1 5 LYS HZ2 H -22.465 0.608 -3.733 1.00 . A A . 40 LYS HZ2 1 1 10 10384 1 1 5 LYS HZ3 H -20.982 1.105 -4.361 1.00 . A A . 40 LYS HZ3 1 1 10 10385 1 1 5 LYS N N -19.266 0.920 1.986 1.00 . A A . 40 LYS N 1 1 10 10386 1 1 5 LYS NZ N -21.691 1.295 -3.625 1.00 . A A . 40 LYS NZ 1 1 10 10387 1 1 5 LYS O O -17.382 3.080 1.477 1.00 . A A . 40 LYS O 1 1 10 10388 1 1 6 GLU C C -14.069 2.703 0.854 1.00 . A A . 41 GLU C 1 1 10 10389 1 1 6 GLU CA C -14.792 2.264 2.098 1.00 . A A . 41 GLU CA 1 1 10 10390 1 1 6 GLU CB C -13.826 1.511 3.015 1.00 . A A . 41 GLU CB 1 1 10 10391 1 1 6 GLU CD C -13.617 0.833 5.467 1.00 . A A . 41 GLU CD 1 1 10 10392 1 1 6 GLU CG C -14.503 0.888 4.228 1.00 . A A . 41 GLU CG 1 1 10 10393 1 1 6 GLU H H -15.745 0.445 1.646 1.00 . A A . 41 GLU H 1 1 10 10394 1 1 6 GLU HA H -15.177 3.129 2.616 1.00 . A A . 41 GLU HA 1 1 10 10395 1 1 6 GLU HB2 H -13.389 0.713 2.431 1.00 . A A . 41 GLU HB2 1 1 10 10396 1 1 6 GLU HB3 H -13.032 2.167 3.335 1.00 . A A . 41 GLU HB3 1 1 10 10397 1 1 6 GLU HG2 H -15.402 1.442 4.454 1.00 . A A . 41 GLU HG2 1 1 10 10398 1 1 6 GLU HG3 H -14.756 -0.121 3.925 1.00 . A A . 41 GLU HG3 1 1 10 10399 1 1 6 GLU N N -15.903 1.408 1.720 1.00 . A A . 41 GLU N 1 1 10 10400 1 1 6 GLU O O -14.203 2.074 -0.165 1.00 . A A . 41 GLU O 1 1 10 10401 1 1 6 GLU OE1 O -13.558 1.844 6.215 1.00 . A A . 41 GLU OE1 1 1 10 10402 1 1 6 GLU OE2 O -13.008 -0.216 5.753 1.00 . A A . 41 GLU OE2 1 1 10 10403 1 1 7 THR C C -11.136 3.928 -0.040 1.00 . A A . 42 THR C 1 1 10 10404 1 1 7 THR CA C -12.625 4.185 -0.271 1.00 . A A . 42 THR CA 1 1 10 10405 1 1 7 THR CB C -12.893 5.643 -0.650 1.00 . A A . 42 THR CB 1 1 10 10406 1 1 7 THR CG2 C -12.818 5.794 -2.163 1.00 . A A . 42 THR CG2 1 1 10 10407 1 1 7 THR H H -13.253 4.302 1.731 1.00 . A A . 42 THR H 1 1 10 10408 1 1 7 THR HA H -12.954 3.532 -1.068 1.00 . A A . 42 THR HA 1 1 10 10409 1 1 7 THR HB H -12.138 6.265 -0.196 1.00 . A A . 42 THR HB 1 1 10 10410 1 1 7 THR HG1 H -14.255 5.877 0.696 1.00 . A A . 42 THR HG1 1 1 10 10411 1 1 7 THR HG21 H -13.583 5.165 -2.598 1.00 . A A . 42 THR HG21 1 1 10 10412 1 1 7 THR HG22 H -11.847 5.481 -2.514 1.00 . A A . 42 THR HG22 1 1 10 10413 1 1 7 THR HG23 H -12.997 6.822 -2.441 1.00 . A A . 42 THR HG23 1 1 10 10414 1 1 7 THR N N -13.349 3.784 0.903 1.00 . A A . 42 THR N 1 1 10 10415 1 1 7 THR O O -10.645 3.990 1.091 1.00 . A A . 42 THR O 1 1 10 10416 1 1 7 THR OG1 O -14.245 5.967 -0.264 1.00 . A A . 42 THR OG1 1 1 10 10417 1 1 8 CYS C C -8.102 4.276 -1.147 1.00 . A A . 43 CYS C 1 1 10 10418 1 1 8 CYS CA C -9.110 3.154 -1.068 1.00 . A A . 43 CYS CA 1 1 10 10419 1 1 8 CYS CB C -8.967 2.179 -2.204 1.00 . A A . 43 CYS CB 1 1 10 10420 1 1 8 CYS H H -10.869 3.753 -1.982 1.00 . A A . 43 CYS H 1 1 10 10421 1 1 8 CYS HA H -8.987 2.591 -0.160 1.00 . A A . 43 CYS HA 1 1 10 10422 1 1 8 CYS HB2 H -9.268 1.204 -1.852 1.00 . A A . 43 CYS HB2 1 1 10 10423 1 1 8 CYS HB3 H -9.671 2.469 -2.962 1.00 . A A . 43 CYS HB3 1 1 10 10424 1 1 8 CYS N N -10.454 3.620 -1.102 1.00 . A A . 43 CYS N 1 1 10 10425 1 1 8 CYS O O -8.327 5.270 -1.803 1.00 . A A . 43 CYS O 1 1 10 10426 1 1 8 CYS SG S -7.354 1.970 -2.914 1.00 . A A . 43 CYS SG 1 1 10 10427 1 1 9 ALA C C -4.856 4.772 -1.487 1.00 . A A . 44 ALA C 1 1 10 10428 1 1 9 ALA CA C -5.939 5.102 -0.467 1.00 . A A . 44 ALA CA 1 1 10 10429 1 1 9 ALA CB C -5.320 5.210 0.894 1.00 . A A . 44 ALA CB 1 1 10 10430 1 1 9 ALA H H -6.928 3.333 0.139 1.00 . A A . 44 ALA H 1 1 10 10431 1 1 9 ALA HA H -6.371 6.063 -0.701 1.00 . A A . 44 ALA HA 1 1 10 10432 1 1 9 ALA HB1 H -6.102 5.412 1.608 1.00 . A A . 44 ALA HB1 1 1 10 10433 1 1 9 ALA HB2 H -4.625 6.033 0.854 1.00 . A A . 44 ALA HB2 1 1 10 10434 1 1 9 ALA HB3 H -4.803 4.291 1.127 1.00 . A A . 44 ALA HB3 1 1 10 10435 1 1 9 ALA N N -7.001 4.117 -0.449 1.00 . A A . 44 ALA N 1 1 10 10436 1 1 9 ALA O O -4.099 5.639 -1.890 1.00 . A A . 44 ALA O 1 1 10 10437 1 1 10 ALA C C -4.077 3.299 -4.280 1.00 . A A . 45 ALA C 1 1 10 10438 1 1 10 ALA CA C -3.729 3.102 -2.809 1.00 . A A . 45 ALA CA 1 1 10 10439 1 1 10 ALA CB C -3.367 1.665 -2.515 1.00 . A A . 45 ALA CB 1 1 10 10440 1 1 10 ALA H H -5.505 2.880 -1.706 1.00 . A A . 45 ALA H 1 1 10 10441 1 1 10 ALA HA H -2.870 3.716 -2.581 1.00 . A A . 45 ALA HA 1 1 10 10442 1 1 10 ALA HB1 H -4.191 1.020 -2.781 1.00 . A A . 45 ALA HB1 1 1 10 10443 1 1 10 ALA HB2 H -3.165 1.576 -1.454 1.00 . A A . 45 ALA HB2 1 1 10 10444 1 1 10 ALA HB3 H -2.489 1.394 -3.083 1.00 . A A . 45 ALA HB3 1 1 10 10445 1 1 10 ALA N N -4.806 3.527 -1.936 1.00 . A A . 45 ALA N 1 1 10 10446 1 1 10 ALA O O -3.205 3.375 -5.128 1.00 . A A . 45 ALA O 1 1 10 10447 1 1 11 CYS C C -7.046 4.484 -5.990 1.00 . A A . 46 CYS C 1 1 10 10448 1 1 11 CYS CA C -5.806 3.577 -5.929 1.00 . A A . 46 CYS CA 1 1 10 10449 1 1 11 CYS CB C -5.967 2.228 -6.691 1.00 . A A . 46 CYS CB 1 1 10 10450 1 1 11 CYS H H -6.000 3.256 -3.844 1.00 . A A . 46 CYS H 1 1 10 10451 1 1 11 CYS HA H -5.013 4.139 -6.402 1.00 . A A . 46 CYS HA 1 1 10 10452 1 1 11 CYS HB2 H -5.407 2.045 -7.592 1.00 . A A . 46 CYS HB2 1 1 10 10453 1 1 11 CYS HB3 H -5.284 1.678 -6.053 1.00 . A A . 46 CYS HB3 1 1 10 10454 1 1 11 CYS N N -5.353 3.362 -4.572 1.00 . A A . 46 CYS N 1 1 10 10455 1 1 11 CYS O O -7.566 4.758 -7.063 1.00 . A A . 46 CYS O 1 1 10 10456 1 1 11 CYS SG S -7.514 1.299 -6.482 1.00 . A A . 46 CYS SG 1 1 10 10457 1 1 12 GLN C C -9.907 5.465 -5.319 1.00 . A A . 47 GLN C 1 1 10 10458 1 1 12 GLN CA C -8.615 5.893 -4.630 1.00 . A A . 47 GLN CA 1 1 10 10459 1 1 12 GLN CB C -8.255 7.302 -4.975 1.00 . A A . 47 GLN CB 1 1 10 10460 1 1 12 GLN CD C -6.649 9.215 -4.531 1.00 . A A . 47 GLN CD 1 1 10 10461 1 1 12 GLN CG C -7.171 7.864 -4.082 1.00 . A A . 47 GLN CG 1 1 10 10462 1 1 12 GLN H H -6.980 4.779 -3.976 1.00 . A A . 47 GLN H 1 1 10 10463 1 1 12 GLN HA H -8.789 5.864 -3.565 1.00 . A A . 47 GLN HA 1 1 10 10464 1 1 12 GLN HB2 H -7.982 7.385 -6.017 1.00 . A A . 47 GLN HB2 1 1 10 10465 1 1 12 GLN HB3 H -9.169 7.836 -4.768 1.00 . A A . 47 GLN HB3 1 1 10 10466 1 1 12 GLN HE21 H -6.926 8.765 -6.442 1.00 . A A . 47 GLN HE21 1 1 10 10467 1 1 12 GLN HE22 H -6.277 10.324 -6.122 1.00 . A A . 47 GLN HE22 1 1 10 10468 1 1 12 GLN HG2 H -7.583 7.970 -3.089 1.00 . A A . 47 GLN HG2 1 1 10 10469 1 1 12 GLN HG3 H -6.370 7.143 -4.053 1.00 . A A . 47 GLN HG3 1 1 10 10470 1 1 12 GLN N N -7.469 4.978 -4.801 1.00 . A A . 47 GLN N 1 1 10 10471 1 1 12 GLN NE2 N -6.617 9.455 -5.817 1.00 . A A . 47 GLN NE2 1 1 10 10472 1 1 12 GLN O O -10.627 6.273 -5.890 1.00 . A A . 47 GLN O 1 1 10 10473 1 1 12 GLN OE1 O -6.242 10.038 -3.711 1.00 . A A . 47 GLN OE1 1 1 10 10474 1 1 13 LYS C C -12.129 3.045 -4.651 1.00 . A A . 48 LYS C 1 1 10 10475 1 1 13 LYS CA C -11.385 3.640 -5.799 1.00 . A A . 48 LYS CA 1 1 10 10476 1 1 13 LYS CB C -11.031 2.556 -6.817 1.00 . A A . 48 LYS CB 1 1 10 10477 1 1 13 LYS CD C -10.842 4.149 -8.794 1.00 . A A . 48 LYS CD 1 1 10 10478 1 1 13 LYS CE C -12.156 3.694 -9.407 1.00 . A A . 48 LYS CE 1 1 10 10479 1 1 13 LYS CG C -10.174 3.040 -7.984 1.00 . A A . 48 LYS CG 1 1 10 10480 1 1 13 LYS H H -9.577 3.615 -4.774 1.00 . A A . 48 LYS H 1 1 10 10481 1 1 13 LYS HA H -11.969 4.416 -6.270 1.00 . A A . 48 LYS HA 1 1 10 10482 1 1 13 LYS HB2 H -10.478 1.778 -6.313 1.00 . A A . 48 LYS HB2 1 1 10 10483 1 1 13 LYS HB3 H -11.942 2.135 -7.213 1.00 . A A . 48 LYS HB3 1 1 10 10484 1 1 13 LYS HD2 H -11.026 4.986 -8.136 1.00 . A A . 48 LYS HD2 1 1 10 10485 1 1 13 LYS HD3 H -10.169 4.452 -9.582 1.00 . A A . 48 LYS HD3 1 1 10 10486 1 1 13 LYS HE2 H -11.968 2.848 -10.051 1.00 . A A . 48 LYS HE2 1 1 10 10487 1 1 13 LYS HE3 H -12.825 3.396 -8.614 1.00 . A A . 48 LYS HE3 1 1 10 10488 1 1 13 LYS HG2 H -9.248 3.425 -7.582 1.00 . A A . 48 LYS HG2 1 1 10 10489 1 1 13 LYS HG3 H -9.959 2.197 -8.618 1.00 . A A . 48 LYS HG3 1 1 10 10490 1 1 13 LYS HZ1 H -13.732 4.442 -10.525 1.00 . A A . 48 LYS HZ1 1 1 10 10491 1 1 13 LYS HZ2 H -12.226 4.994 -11.034 1.00 . A A . 48 LYS HZ2 1 1 10 10492 1 1 13 LYS HZ3 H -12.927 5.625 -9.634 1.00 . A A . 48 LYS HZ3 1 1 10 10493 1 1 13 LYS N N -10.187 4.208 -5.247 1.00 . A A . 48 LYS N 1 1 10 10494 1 1 13 LYS NZ N -12.798 4.764 -10.198 1.00 . A A . 48 LYS NZ 1 1 10 10495 1 1 13 LYS O O -11.509 2.692 -3.649 1.00 . A A . 48 LYS O 1 1 10 10496 1 1 14 THR C C -13.955 0.934 -3.533 1.00 . A A . 49 THR C 1 1 10 10497 1 1 14 THR CA C -14.195 2.438 -3.668 1.00 . A A . 49 THR CA 1 1 10 10498 1 1 14 THR CB C -15.657 2.702 -3.884 1.00 . A A . 49 THR CB 1 1 10 10499 1 1 14 THR CG2 C -16.385 2.585 -2.582 1.00 . A A . 49 THR CG2 1 1 10 10500 1 1 14 THR H H -13.884 3.357 -5.515 1.00 . A A . 49 THR H 1 1 10 10501 1 1 14 THR HA H -13.900 2.915 -2.750 1.00 . A A . 49 THR HA 1 1 10 10502 1 1 14 THR HB H -16.020 1.955 -4.564 1.00 . A A . 49 THR HB 1 1 10 10503 1 1 14 THR HG1 H -16.059 4.615 -3.642 1.00 . A A . 49 THR HG1 1 1 10 10504 1 1 14 THR HG21 H -15.890 3.235 -1.874 1.00 . A A . 49 THR HG21 1 1 10 10505 1 1 14 THR HG22 H -16.365 1.557 -2.247 1.00 . A A . 49 THR HG22 1 1 10 10506 1 1 14 THR HG23 H -17.405 2.912 -2.714 1.00 . A A . 49 THR HG23 1 1 10 10507 1 1 14 THR N N -13.417 2.992 -4.732 1.00 . A A . 49 THR N 1 1 10 10508 1 1 14 THR O O -14.055 0.176 -4.520 1.00 . A A . 49 THR O 1 1 10 10509 1 1 14 THR OG1 O -15.825 4.041 -4.383 1.00 . A A . 49 THR OG1 1 1 10 10510 1 1 15 VAL C C -14.598 -1.472 -1.565 1.00 . A A . 50 VAL C 1 1 10 10511 1 1 15 VAL CA C -13.333 -0.829 -2.027 1.00 . A A . 50 VAL CA 1 1 10 10512 1 1 15 VAL CB C -12.310 -0.964 -0.866 1.00 . A A . 50 VAL CB 1 1 10 10513 1 1 15 VAL CG1 C -11.432 -2.151 -1.099 1.00 . A A . 50 VAL CG1 1 1 10 10514 1 1 15 VAL CG2 C -11.497 0.289 -0.668 1.00 . A A . 50 VAL CG2 1 1 10 10515 1 1 15 VAL H H -13.655 1.168 -1.589 1.00 . A A . 50 VAL H 1 1 10 10516 1 1 15 VAL HA H -12.921 -1.295 -2.910 1.00 . A A . 50 VAL HA 1 1 10 10517 1 1 15 VAL HB H -12.846 -1.192 0.049 1.00 . A A . 50 VAL HB 1 1 10 10518 1 1 15 VAL HG11 H -10.986 -2.077 -2.081 1.00 . A A . 50 VAL HG11 1 1 10 10519 1 1 15 VAL HG12 H -12.010 -3.060 -1.026 1.00 . A A . 50 VAL HG12 1 1 10 10520 1 1 15 VAL HG13 H -10.640 -2.155 -0.364 1.00 . A A . 50 VAL HG13 1 1 10 10521 1 1 15 VAL HG21 H -12.135 1.072 -0.283 1.00 . A A . 50 VAL HG21 1 1 10 10522 1 1 15 VAL HG22 H -11.135 0.593 -1.641 1.00 . A A . 50 VAL HG22 1 1 10 10523 1 1 15 VAL HG23 H -10.673 0.112 0.008 1.00 . A A . 50 VAL HG23 1 1 10 10524 1 1 15 VAL N N -13.634 0.526 -2.333 1.00 . A A . 50 VAL N 1 1 10 10525 1 1 15 VAL O O -15.345 -0.886 -0.767 1.00 . A A . 50 VAL O 1 1 10 10526 1 1 16 TYR C C -15.611 -4.254 -0.501 1.00 . A A . 51 TYR C 1 1 10 10527 1 1 16 TYR CA C -16.033 -3.315 -1.618 1.00 . A A . 51 TYR CA 1 1 10 10528 1 1 16 TYR CB C -16.703 -3.990 -2.817 1.00 . A A . 51 TYR CB 1 1 10 10529 1 1 16 TYR CD1 C -17.751 -1.854 -3.595 1.00 . A A . 51 TYR CD1 1 1 10 10530 1 1 16 TYR CD2 C -16.574 -3.140 -5.202 1.00 . A A . 51 TYR CD2 1 1 10 10531 1 1 16 TYR CE1 C -18.032 -0.902 -4.543 1.00 . A A . 51 TYR CE1 1 1 10 10532 1 1 16 TYR CE2 C -16.854 -2.194 -6.169 1.00 . A A . 51 TYR CE2 1 1 10 10533 1 1 16 TYR CG C -17.023 -2.981 -3.899 1.00 . A A . 51 TYR CG 1 1 10 10534 1 1 16 TYR CZ C -17.582 -1.074 -5.830 1.00 . A A . 51 TYR CZ 1 1 10 10535 1 1 16 TYR H H -14.276 -3.046 -2.702 1.00 . A A . 51 TYR H 1 1 10 10536 1 1 16 TYR HA H -16.692 -2.572 -1.193 1.00 . A A . 51 TYR HA 1 1 10 10537 1 1 16 TYR HB2 H -16.030 -4.714 -3.239 1.00 . A A . 51 TYR HB2 1 1 10 10538 1 1 16 TYR HB3 H -17.627 -4.459 -2.514 1.00 . A A . 51 TYR HB3 1 1 10 10539 1 1 16 TYR HD1 H -18.078 -1.747 -2.574 1.00 . A A . 51 TYR HD1 1 1 10 10540 1 1 16 TYR HD2 H -16.004 -4.019 -5.457 1.00 . A A . 51 TYR HD2 1 1 10 10541 1 1 16 TYR HE1 H -18.605 -0.027 -4.273 1.00 . A A . 51 TYR HE1 1 1 10 10542 1 1 16 TYR HE2 H -16.500 -2.331 -7.180 1.00 . A A . 51 TYR HE2 1 1 10 10543 1 1 16 TYR HH H -18.027 -0.558 -7.613 1.00 . A A . 51 TYR HH 1 1 10 10544 1 1 16 TYR N N -14.872 -2.624 -2.047 1.00 . A A . 51 TYR N 1 1 10 10545 1 1 16 TYR O O -14.432 -4.605 -0.438 1.00 . A A . 51 TYR O 1 1 10 10546 1 1 16 TYR OH O -17.844 -0.113 -6.775 1.00 . A A . 51 TYR OH 1 1 10 10547 1 1 17 PRO C C -15.237 -6.600 1.447 1.00 . A A . 52 PRO C 1 1 10 10548 1 1 17 PRO CA C -16.215 -5.421 1.625 1.00 . A A . 52 PRO CA 1 1 10 10549 1 1 17 PRO CB C -17.570 -5.920 2.085 1.00 . A A . 52 PRO CB 1 1 10 10550 1 1 17 PRO CD C -17.998 -4.389 0.304 1.00 . A A . 52 PRO CD 1 1 10 10551 1 1 17 PRO CG C -18.535 -4.895 1.611 1.00 . A A . 52 PRO CG 1 1 10 10552 1 1 17 PRO HA H -15.819 -4.772 2.388 1.00 . A A . 52 PRO HA 1 1 10 10553 1 1 17 PRO HB2 H -17.726 -6.881 1.632 1.00 . A A . 52 PRO HB2 1 1 10 10554 1 1 17 PRO HB3 H -17.579 -6.010 3.160 1.00 . A A . 52 PRO HB3 1 1 10 10555 1 1 17 PRO HD2 H -18.448 -4.924 -0.519 1.00 . A A . 52 PRO HD2 1 1 10 10556 1 1 17 PRO HD3 H -18.183 -3.329 0.207 1.00 . A A . 52 PRO HD3 1 1 10 10557 1 1 17 PRO HG2 H -19.506 -5.343 1.465 1.00 . A A . 52 PRO HG2 1 1 10 10558 1 1 17 PRO HG3 H -18.598 -4.091 2.330 1.00 . A A . 52 PRO HG3 1 1 10 10559 1 1 17 PRO N N -16.540 -4.665 0.392 1.00 . A A . 52 PRO N 1 1 10 10560 1 1 17 PRO O O -14.368 -6.814 2.290 1.00 . A A . 52 PRO O 1 1 10 10561 1 1 18 MET C C -13.019 -8.014 -0.207 1.00 . A A . 53 MET C 1 1 10 10562 1 1 18 MET CA C -14.469 -8.449 0.081 1.00 . A A . 53 MET CA 1 1 10 10563 1 1 18 MET CB C -15.013 -9.272 -1.080 1.00 . A A . 53 MET CB 1 1 10 10564 1 1 18 MET CE C -13.706 -12.829 -2.841 1.00 . A A . 53 MET CE 1 1 10 10565 1 1 18 MET CG C -14.219 -10.531 -1.365 1.00 . A A . 53 MET CG 1 1 10 10566 1 1 18 MET H H -16.035 -7.061 -0.303 1.00 . A A . 53 MET H 1 1 10 10567 1 1 18 MET HA H -14.460 -9.077 0.959 1.00 . A A . 53 MET HA 1 1 10 10568 1 1 18 MET HB2 H -16.017 -9.567 -0.816 1.00 . A A . 53 MET HB2 1 1 10 10569 1 1 18 MET HB3 H -15.036 -8.664 -1.972 1.00 . A A . 53 MET HB3 1 1 10 10570 1 1 18 MET HE1 H -12.696 -12.465 -2.959 1.00 . A A . 53 MET HE1 1 1 10 10571 1 1 18 MET HE2 H -13.956 -13.471 -3.673 1.00 . A A . 53 MET HE2 1 1 10 10572 1 1 18 MET HE3 H -13.784 -13.388 -1.921 1.00 . A A . 53 MET HE3 1 1 10 10573 1 1 18 MET HG2 H -13.190 -10.245 -1.516 1.00 . A A . 53 MET HG2 1 1 10 10574 1 1 18 MET HG3 H -14.277 -11.170 -0.496 1.00 . A A . 53 MET HG3 1 1 10 10575 1 1 18 MET N N -15.339 -7.309 0.343 1.00 . A A . 53 MET N 1 1 10 10576 1 1 18 MET O O -12.066 -8.661 0.240 1.00 . A A . 53 MET O 1 1 10 10577 1 1 18 MET SD S -14.843 -11.439 -2.803 1.00 . A A . 53 MET SD 1 1 10 10578 1 1 19 GLU C C -10.961 -5.512 -0.238 1.00 . A A . 54 GLU C 1 1 10 10579 1 1 19 GLU CA C -11.532 -6.428 -1.295 1.00 . A A . 54 GLU CA 1 1 10 10580 1 1 19 GLU CB C -11.648 -5.633 -2.587 1.00 . A A . 54 GLU CB 1 1 10 10581 1 1 19 GLU CD C -12.509 -5.478 -4.907 1.00 . A A . 54 GLU CD 1 1 10 10582 1 1 19 GLU CG C -12.335 -6.360 -3.709 1.00 . A A . 54 GLU CG 1 1 10 10583 1 1 19 GLU H H -13.632 -6.326 -1.090 1.00 . A A . 54 GLU H 1 1 10 10584 1 1 19 GLU HA H -10.886 -7.276 -1.459 1.00 . A A . 54 GLU HA 1 1 10 10585 1 1 19 GLU HB2 H -12.193 -4.720 -2.399 1.00 . A A . 54 GLU HB2 1 1 10 10586 1 1 19 GLU HB3 H -10.653 -5.374 -2.917 1.00 . A A . 54 GLU HB3 1 1 10 10587 1 1 19 GLU HG2 H -11.743 -7.219 -3.991 1.00 . A A . 54 GLU HG2 1 1 10 10588 1 1 19 GLU HG3 H -13.309 -6.683 -3.372 1.00 . A A . 54 GLU HG3 1 1 10 10589 1 1 19 GLU N N -12.857 -6.892 -0.885 1.00 . A A . 54 GLU N 1 1 10 10590 1 1 19 GLU O O -9.756 -5.268 -0.195 1.00 . A A . 54 GLU O 1 1 10 10591 1 1 19 GLU OE1 O -13.481 -4.685 -4.934 1.00 . A A . 54 GLU OE1 1 1 10 10592 1 1 19 GLU OE2 O -11.700 -5.563 -5.841 1.00 . A A . 54 GLU OE2 1 1 10 10593 1 1 20 ARG C C -10.595 -4.706 2.700 1.00 . A A . 55 ARG C 1 1 10 10594 1 1 20 ARG CA C -11.527 -4.092 1.668 1.00 . A A . 55 ARG CA 1 1 10 10595 1 1 20 ARG CB C -12.815 -3.493 2.257 1.00 . A A . 55 ARG CB 1 1 10 10596 1 1 20 ARG CD C -14.129 -3.054 4.280 1.00 . A A . 55 ARG CD 1 1 10 10597 1 1 20 ARG CG C -12.740 -2.987 3.658 1.00 . A A . 55 ARG CG 1 1 10 10598 1 1 20 ARG CZ C -14.818 -3.102 6.669 1.00 . A A . 55 ARG CZ 1 1 10 10599 1 1 20 ARG H H -12.783 -5.288 0.478 1.00 . A A . 55 ARG H 1 1 10 10600 1 1 20 ARG HA H -10.971 -3.298 1.196 1.00 . A A . 55 ARG HA 1 1 10 10601 1 1 20 ARG HB2 H -13.078 -2.607 1.689 1.00 . A A . 55 ARG HB2 1 1 10 10602 1 1 20 ARG HB3 H -13.617 -4.194 2.151 1.00 . A A . 55 ARG HB3 1 1 10 10603 1 1 20 ARG HD2 H -14.806 -2.470 3.675 1.00 . A A . 55 ARG HD2 1 1 10 10604 1 1 20 ARG HD3 H -14.457 -4.082 4.279 1.00 . A A . 55 ARG HD3 1 1 10 10605 1 1 20 ARG HE H -13.666 -1.689 5.742 1.00 . A A . 55 ARG HE 1 1 10 10606 1 1 20 ARG HG2 H -12.013 -3.589 4.184 1.00 . A A . 55 ARG HG2 1 1 10 10607 1 1 20 ARG HG3 H -12.401 -1.961 3.640 1.00 . A A . 55 ARG HG3 1 1 10 10608 1 1 20 ARG HH11 H -15.485 -4.767 5.655 1.00 . A A . 55 ARG HH11 1 1 10 10609 1 1 20 ARG HH12 H -15.941 -4.701 7.292 1.00 . A A . 55 ARG HH12 1 1 10 10610 1 1 20 ARG HH21 H -14.330 -1.628 7.987 1.00 . A A . 55 ARG HH21 1 1 10 10611 1 1 20 ARG HH22 H -15.289 -2.857 8.657 1.00 . A A . 55 ARG HH22 1 1 10 10612 1 1 20 ARG N N -11.850 -5.016 0.606 1.00 . A A . 55 ARG N 1 1 10 10613 1 1 20 ARG NE N -14.163 -2.545 5.636 1.00 . A A . 55 ARG NE 1 1 10 10614 1 1 20 ARG NH1 N -15.461 -4.266 6.523 1.00 . A A . 55 ARG NH1 1 1 10 10615 1 1 20 ARG NH2 N -14.815 -2.496 7.850 1.00 . A A . 55 ARG NH2 1 1 10 10616 1 1 20 ARG O O -10.973 -5.541 3.552 1.00 . A A . 55 ARG O 1 1 10 10617 1 1 21 LEU C C -7.757 -3.432 4.008 1.00 . A A . 56 LEU C 1 1 10 10618 1 1 21 LEU CA C -8.288 -4.691 3.352 1.00 . A A . 56 LEU CA 1 1 10 10619 1 1 21 LEU CB C -7.228 -5.363 2.426 1.00 . A A . 56 LEU CB 1 1 10 10620 1 1 21 LEU CD1 C -5.232 -6.802 2.154 1.00 . A A . 56 LEU CD1 1 1 10 10621 1 1 21 LEU CD2 C -4.899 -4.542 2.957 1.00 . A A . 56 LEU CD2 1 1 10 10622 1 1 21 LEU CG C -5.842 -5.734 3.003 1.00 . A A . 56 LEU CG 1 1 10 10623 1 1 21 LEU H H -9.222 -3.726 1.791 1.00 . A A . 56 LEU H 1 1 10 10624 1 1 21 LEU HA H -8.605 -5.401 4.100 1.00 . A A . 56 LEU HA 1 1 10 10625 1 1 21 LEU HB2 H -7.666 -6.269 2.037 1.00 . A A . 56 LEU HB2 1 1 10 10626 1 1 21 LEU HB3 H -7.072 -4.695 1.591 1.00 . A A . 56 LEU HB3 1 1 10 10627 1 1 21 LEU HD11 H -4.321 -7.145 2.618 1.00 . A A . 56 LEU HD11 1 1 10 10628 1 1 21 LEU HD12 H -4.988 -6.351 1.201 1.00 . A A . 56 LEU HD12 1 1 10 10629 1 1 21 LEU HD13 H -5.927 -7.618 2.026 1.00 . A A . 56 LEU HD13 1 1 10 10630 1 1 21 LEU HD21 H -4.771 -4.225 1.933 1.00 . A A . 56 LEU HD21 1 1 10 10631 1 1 21 LEU HD22 H -3.943 -4.823 3.375 1.00 . A A . 56 LEU HD22 1 1 10 10632 1 1 21 LEU HD23 H -5.321 -3.732 3.534 1.00 . A A . 56 LEU HD23 1 1 10 10633 1 1 21 LEU HG H -5.923 -6.073 4.024 1.00 . A A . 56 LEU HG 1 1 10 10634 1 1 21 LEU N N -9.395 -4.324 2.549 1.00 . A A . 56 LEU N 1 1 10 10635 1 1 21 LEU O O -7.987 -2.327 3.521 1.00 . A A . 56 LEU O 1 1 10 10636 1 1 22 VAL C C -5.019 -2.755 6.048 1.00 . A A . 57 VAL C 1 1 10 10637 1 1 22 VAL CA C -6.497 -2.481 5.761 1.00 . A A . 57 VAL CA 1 1 10 10638 1 1 22 VAL CB C -7.290 -2.076 7.044 1.00 . A A . 57 VAL CB 1 1 10 10639 1 1 22 VAL CG1 C -7.556 -3.265 7.958 1.00 . A A . 57 VAL CG1 1 1 10 10640 1 1 22 VAL CG2 C -6.571 -0.977 7.795 1.00 . A A . 57 VAL CG2 1 1 10 10641 1 1 22 VAL H H -6.977 -4.478 5.491 1.00 . A A . 57 VAL H 1 1 10 10642 1 1 22 VAL HA H -6.539 -1.657 5.063 1.00 . A A . 57 VAL HA 1 1 10 10643 1 1 22 VAL HB H -8.250 -1.695 6.729 1.00 . A A . 57 VAL HB 1 1 10 10644 1 1 22 VAL HG11 H -6.617 -3.696 8.270 1.00 . A A . 57 VAL HG11 1 1 10 10645 1 1 22 VAL HG12 H -8.133 -3.999 7.416 1.00 . A A . 57 VAL HG12 1 1 10 10646 1 1 22 VAL HG13 H -8.113 -2.934 8.822 1.00 . A A . 57 VAL HG13 1 1 10 10647 1 1 22 VAL HG21 H -5.591 -1.329 8.084 1.00 . A A . 57 VAL HG21 1 1 10 10648 1 1 22 VAL HG22 H -7.137 -0.688 8.668 1.00 . A A . 57 VAL HG22 1 1 10 10649 1 1 22 VAL HG23 H -6.458 -0.121 7.146 1.00 . A A . 57 VAL HG23 1 1 10 10650 1 1 22 VAL N N -7.093 -3.587 5.100 1.00 . A A . 57 VAL N 1 1 10 10651 1 1 22 VAL O O -4.672 -3.616 6.870 1.00 . A A . 57 VAL O 1 1 10 10652 1 1 23 ALA C C -2.286 -0.920 6.186 1.00 . A A . 58 ALA C 1 1 10 10653 1 1 23 ALA CA C -2.737 -2.215 5.585 1.00 . A A . 58 ALA CA 1 1 10 10654 1 1 23 ALA CB C -1.972 -2.480 4.264 1.00 . A A . 58 ALA CB 1 1 10 10655 1 1 23 ALA H H -4.466 -1.427 4.667 1.00 . A A . 58 ALA H 1 1 10 10656 1 1 23 ALA HA H -2.577 -3.031 6.273 1.00 . A A . 58 ALA HA 1 1 10 10657 1 1 23 ALA HB1 H -2.047 -1.613 3.619 1.00 . A A . 58 ALA HB1 1 1 10 10658 1 1 23 ALA HB2 H -2.393 -3.316 3.726 1.00 . A A . 58 ALA HB2 1 1 10 10659 1 1 23 ALA HB3 H -0.924 -2.680 4.436 1.00 . A A . 58 ALA HB3 1 1 10 10660 1 1 23 ALA N N -4.150 -2.077 5.334 1.00 . A A . 58 ALA N 1 1 10 10661 1 1 23 ALA O O -2.637 0.132 5.663 1.00 . A A . 58 ALA O 1 1 10 10662 1 1 24 ASP C C -2.103 1.236 8.261 1.00 . A A . 59 ASP C 1 1 10 10663 1 1 24 ASP CA C -0.985 0.246 7.934 1.00 . A A . 59 ASP CA 1 1 10 10664 1 1 24 ASP CB C 0.127 0.946 7.148 1.00 . A A . 59 ASP CB 1 1 10 10665 1 1 24 ASP CG C 1.127 0.010 6.448 1.00 . A A . 59 ASP CG 1 1 10 10666 1 1 24 ASP H H -1.242 -1.866 7.596 1.00 . A A . 59 ASP H 1 1 10 10667 1 1 24 ASP HA H -0.580 -0.088 8.878 1.00 . A A . 59 ASP HA 1 1 10 10668 1 1 24 ASP HB2 H -0.210 1.837 6.645 1.00 . A A . 59 ASP HB2 1 1 10 10669 1 1 24 ASP HB3 H 0.722 1.311 7.979 1.00 . A A . 59 ASP HB3 1 1 10 10670 1 1 24 ASP N N -1.483 -0.979 7.255 1.00 . A A . 59 ASP N 1 1 10 10671 1 1 24 ASP O O -1.921 2.457 8.169 1.00 . A A . 59 ASP O 1 1 10 10672 1 1 24 ASP OD1 O 0.772 -0.685 5.484 1.00 . A A . 59 ASP OD1 1 1 10 10673 1 1 24 ASP OD2 O 2.303 -0.073 6.909 1.00 . A A . 59 ASP OD2 1 1 10 10674 1 1 25 LYS C C -5.076 2.182 7.696 1.00 . A A . 60 LYS C 1 1 10 10675 1 1 25 LYS CA C -4.477 1.432 8.932 1.00 . A A . 60 LYS CA 1 1 10 10676 1 1 25 LYS CB C -4.281 2.316 10.167 1.00 . A A . 60 LYS CB 1 1 10 10677 1 1 25 LYS CD C -5.287 3.701 11.970 1.00 . A A . 60 LYS CD 1 1 10 10678 1 1 25 LYS CE C -6.431 4.637 12.341 1.00 . A A . 60 LYS CE 1 1 10 10679 1 1 25 LYS CG C -5.519 3.041 10.639 1.00 . A A . 60 LYS CG 1 1 10 10680 1 1 25 LYS H H -3.274 -0.283 8.679 1.00 . A A . 60 LYS H 1 1 10 10681 1 1 25 LYS HA H -5.197 0.669 9.178 1.00 . A A . 60 LYS HA 1 1 10 10682 1 1 25 LYS HB2 H -3.905 1.712 10.980 1.00 . A A . 60 LYS HB2 1 1 10 10683 1 1 25 LYS HB3 H -3.535 3.043 9.897 1.00 . A A . 60 LYS HB3 1 1 10 10684 1 1 25 LYS HD2 H -5.196 2.930 12.721 1.00 . A A . 60 LYS HD2 1 1 10 10685 1 1 25 LYS HD3 H -4.361 4.247 11.889 1.00 . A A . 60 LYS HD3 1 1 10 10686 1 1 25 LYS HE2 H -6.234 5.058 13.316 1.00 . A A . 60 LYS HE2 1 1 10 10687 1 1 25 LYS HE3 H -6.471 5.434 11.613 1.00 . A A . 60 LYS HE3 1 1 10 10688 1 1 25 LYS HG2 H -5.776 3.794 9.909 1.00 . A A . 60 LYS HG2 1 1 10 10689 1 1 25 LYS HG3 H -6.324 2.325 10.720 1.00 . A A . 60 LYS HG3 1 1 10 10690 1 1 25 LYS HZ1 H -7.782 3.204 13.102 1.00 . A A . 60 LYS HZ1 1 1 10 10691 1 1 25 LYS HZ2 H -7.967 3.518 11.467 1.00 . A A . 60 LYS HZ2 1 1 10 10692 1 1 25 LYS HZ3 H -8.495 4.640 12.595 1.00 . A A . 60 LYS HZ3 1 1 10 10693 1 1 25 LYS N N -3.257 0.691 8.615 1.00 . A A . 60 LYS N 1 1 10 10694 1 1 25 LYS NZ N -7.742 3.955 12.383 1.00 . A A . 60 LYS NZ 1 1 10 10695 1 1 25 LYS O O -6.108 2.852 7.777 1.00 . A A . 60 LYS O 1 1 10 10696 1 1 26 LEU C C -5.933 1.576 4.705 1.00 . A A . 61 LEU C 1 1 10 10697 1 1 26 LEU CA C -4.973 2.599 5.332 1.00 . A A . 61 LEU CA 1 1 10 10698 1 1 26 LEU CB C -3.823 2.884 4.391 1.00 . A A . 61 LEU CB 1 1 10 10699 1 1 26 LEU CD1 C -1.531 3.804 3.988 1.00 . A A . 61 LEU CD1 1 1 10 10700 1 1 26 LEU CD2 C -3.139 5.113 5.357 1.00 . A A . 61 LEU CD2 1 1 10 10701 1 1 26 LEU CG C -2.671 3.719 4.973 1.00 . A A . 61 LEU CG 1 1 10 10702 1 1 26 LEU H H -3.599 1.541 6.519 1.00 . A A . 61 LEU H 1 1 10 10703 1 1 26 LEU HA H -5.503 3.509 5.552 1.00 . A A . 61 LEU HA 1 1 10 10704 1 1 26 LEU HB2 H -3.435 1.919 4.120 1.00 . A A . 61 LEU HB2 1 1 10 10705 1 1 26 LEU HB3 H -4.205 3.381 3.511 1.00 . A A . 61 LEU HB3 1 1 10 10706 1 1 26 LEU HD11 H -1.866 4.320 3.101 1.00 . A A . 61 LEU HD11 1 1 10 10707 1 1 26 LEU HD12 H -1.226 2.802 3.723 1.00 . A A . 61 LEU HD12 1 1 10 10708 1 1 26 LEU HD13 H -0.700 4.334 4.429 1.00 . A A . 61 LEU HD13 1 1 10 10709 1 1 26 LEU HD21 H -2.305 5.674 5.750 1.00 . A A . 61 LEU HD21 1 1 10 10710 1 1 26 LEU HD22 H -3.906 5.037 6.113 1.00 . A A . 61 LEU HD22 1 1 10 10711 1 1 26 LEU HD23 H -3.534 5.612 4.484 1.00 . A A . 61 LEU HD23 1 1 10 10712 1 1 26 LEU HG H -2.303 3.226 5.861 1.00 . A A . 61 LEU HG 1 1 10 10713 1 1 26 LEU N N -4.453 2.035 6.558 1.00 . A A . 61 LEU N 1 1 10 10714 1 1 26 LEU O O -5.593 0.391 4.599 1.00 . A A . 61 LEU O 1 1 10 10715 1 1 27 ILE C C -8.030 1.017 2.279 1.00 . A A . 62 ILE C 1 1 10 10716 1 1 27 ILE CA C -8.096 1.064 3.790 1.00 . A A . 62 ILE CA 1 1 10 10717 1 1 27 ILE CB C -9.544 1.457 4.164 1.00 . A A . 62 ILE CB 1 1 10 10718 1 1 27 ILE CD1 C -9.378 0.854 6.661 1.00 . A A . 62 ILE CD1 1 1 10 10719 1 1 27 ILE CG1 C -9.676 1.910 5.624 1.00 . A A . 62 ILE CG1 1 1 10 10720 1 1 27 ILE CG2 C -10.433 0.273 3.933 1.00 . A A . 62 ILE CG2 1 1 10 10721 1 1 27 ILE H H -7.339 2.958 4.291 1.00 . A A . 62 ILE H 1 1 10 10722 1 1 27 ILE HA H -7.878 0.088 4.197 1.00 . A A . 62 ILE HA 1 1 10 10723 1 1 27 ILE HB H -9.868 2.252 3.509 1.00 . A A . 62 ILE HB 1 1 10 10724 1 1 27 ILE HD11 H -10.059 0.025 6.532 1.00 . A A . 62 ILE HD11 1 1 10 10725 1 1 27 ILE HD12 H -9.494 1.273 7.650 1.00 . A A . 62 ILE HD12 1 1 10 10726 1 1 27 ILE HD13 H -8.364 0.507 6.528 1.00 . A A . 62 ILE HD13 1 1 10 10727 1 1 27 ILE HG12 H -8.981 2.716 5.781 1.00 . A A . 62 ILE HG12 1 1 10 10728 1 1 27 ILE HG13 H -10.680 2.274 5.786 1.00 . A A . 62 ILE HG13 1 1 10 10729 1 1 27 ILE HG21 H -11.445 0.544 4.190 1.00 . A A . 62 ILE HG21 1 1 10 10730 1 1 27 ILE HG22 H -10.078 -0.499 4.601 1.00 . A A . 62 ILE HG22 1 1 10 10731 1 1 27 ILE HG23 H -10.360 -0.046 2.905 1.00 . A A . 62 ILE HG23 1 1 10 10732 1 1 27 ILE N N -7.109 2.005 4.289 1.00 . A A . 62 ILE N 1 1 10 10733 1 1 27 ILE O O -8.119 2.064 1.608 1.00 . A A . 62 ILE O 1 1 10 10734 1 1 28 PHE C C -7.930 -1.804 -0.138 1.00 . A A . 63 PHE C 1 1 10 10735 1 1 28 PHE CA C -7.728 -0.390 0.335 1.00 . A A . 63 PHE CA 1 1 10 10736 1 1 28 PHE CB C -6.531 0.279 -0.302 1.00 . A A . 63 PHE CB 1 1 10 10737 1 1 28 PHE CD1 C -4.722 -1.133 0.759 1.00 . A A . 63 PHE CD1 1 1 10 10738 1 1 28 PHE CD2 C -4.553 1.218 0.750 1.00 . A A . 63 PHE CD2 1 1 10 10739 1 1 28 PHE CE1 C -3.521 -1.200 1.430 1.00 . A A . 63 PHE CE1 1 1 10 10740 1 1 28 PHE CE2 C -3.385 1.148 1.396 1.00 . A A . 63 PHE CE2 1 1 10 10741 1 1 28 PHE CG C -5.243 0.101 0.413 1.00 . A A . 63 PHE CG 1 1 10 10742 1 1 28 PHE CZ C -2.850 -0.044 1.744 1.00 . A A . 63 PHE CZ 1 1 10 10743 1 1 28 PHE H H -7.718 -0.946 2.347 1.00 . A A . 63 PHE H 1 1 10 10744 1 1 28 PHE HA H -8.594 0.136 -0.040 1.00 . A A . 63 PHE HA 1 1 10 10745 1 1 28 PHE HB2 H -6.415 0.096 -1.357 1.00 . A A . 63 PHE HB2 1 1 10 10746 1 1 28 PHE HB3 H -6.737 1.330 -0.154 1.00 . A A . 63 PHE HB3 1 1 10 10747 1 1 28 PHE HD1 H -5.239 -2.050 0.514 1.00 . A A . 63 PHE HD1 1 1 10 10748 1 1 28 PHE HD2 H -4.952 2.185 0.484 1.00 . A A . 63 PHE HD2 1 1 10 10749 1 1 28 PHE HE1 H -3.107 -2.160 1.699 1.00 . A A . 63 PHE HE1 1 1 10 10750 1 1 28 PHE HE2 H -2.876 2.065 1.630 1.00 . A A . 63 PHE HE2 1 1 10 10751 1 1 28 PHE HZ H -1.895 -0.036 2.253 1.00 . A A . 63 PHE HZ 1 1 10 10752 1 1 28 PHE N N -7.808 -0.166 1.750 1.00 . A A . 63 PHE N 1 1 10 10753 1 1 28 PHE O O -8.091 -2.719 0.645 1.00 . A A . 63 PHE O 1 1 10 10754 1 1 29 HIS C C -6.705 -3.883 -1.941 1.00 . A A . 64 HIS C 1 1 10 10755 1 1 29 HIS CA C -8.037 -3.201 -2.138 1.00 . A A . 64 HIS CA 1 1 10 10756 1 1 29 HIS CB C -8.195 -2.968 -3.656 1.00 . A A . 64 HIS CB 1 1 10 10757 1 1 29 HIS CD2 C -10.538 -2.425 -4.520 1.00 . A A . 64 HIS CD2 1 1 10 10758 1 1 29 HIS CE1 C -10.381 -0.250 -4.486 1.00 . A A . 64 HIS CE1 1 1 10 10759 1 1 29 HIS CG C -9.317 -2.082 -4.078 1.00 . A A . 64 HIS CG 1 1 10 10760 1 1 29 HIS H H -8.011 -1.126 -1.990 1.00 . A A . 64 HIS H 1 1 10 10761 1 1 29 HIS HA H -8.858 -3.801 -1.776 1.00 . A A . 64 HIS HA 1 1 10 10762 1 1 29 HIS HB2 H -7.296 -2.513 -4.041 1.00 . A A . 64 HIS HB2 1 1 10 10763 1 1 29 HIS HB3 H -8.328 -3.927 -4.136 1.00 . A A . 64 HIS HB3 1 1 10 10764 1 1 29 HIS HD2 H -10.907 -3.432 -4.628 1.00 . A A . 64 HIS HD2 1 1 10 10765 1 1 29 HIS HE1 H -10.631 0.798 -4.561 1.00 . A A . 64 HIS HE1 1 1 10 10766 1 1 29 HIS HE2 H -12.042 -1.207 -5.306 1.00 . A A . 64 HIS HE2 1 1 10 10767 1 1 29 HIS N N -7.981 -1.932 -1.445 1.00 . A A . 64 HIS N 1 1 10 10768 1 1 29 HIS ND1 N -9.220 -0.693 -4.056 1.00 . A A . 64 HIS ND1 1 1 10 10769 1 1 29 HIS NE2 N -11.213 -1.262 -4.780 1.00 . A A . 64 HIS NE2 1 1 10 10770 1 1 29 HIS O O -5.643 -3.252 -2.000 1.00 . A A . 64 HIS O 1 1 10 10771 1 1 30 ASN C C -4.738 -6.025 -2.774 1.00 . A A . 65 ASN C 1 1 10 10772 1 1 30 ASN CA C -5.615 -5.974 -1.516 1.00 . A A . 65 ASN CA 1 1 10 10773 1 1 30 ASN CB C -6.038 -7.387 -1.074 1.00 . A A . 65 ASN CB 1 1 10 10774 1 1 30 ASN CG C -6.917 -8.162 -2.063 1.00 . A A . 65 ASN CG 1 1 10 10775 1 1 30 ASN H H -7.639 -5.584 -1.581 1.00 . A A . 65 ASN H 1 1 10 10776 1 1 30 ASN HA H -5.033 -5.539 -0.719 1.00 . A A . 65 ASN HA 1 1 10 10777 1 1 30 ASN HB2 H -5.142 -7.957 -0.918 1.00 . A A . 65 ASN HB2 1 1 10 10778 1 1 30 ASN HB3 H -6.565 -7.310 -0.135 1.00 . A A . 65 ASN HB3 1 1 10 10779 1 1 30 ASN HD21 H -6.192 -9.870 -1.383 1.00 . A A . 65 ASN HD21 1 1 10 10780 1 1 30 ASN HD22 H -7.398 -10.007 -2.613 1.00 . A A . 65 ASN HD22 1 1 10 10781 1 1 30 ASN N N -6.769 -5.148 -1.689 1.00 . A A . 65 ASN N 1 1 10 10782 1 1 30 ASN ND2 N -6.820 -9.471 -2.025 1.00 . A A . 65 ASN ND2 1 1 10 10783 1 1 30 ASN O O -3.535 -6.081 -2.681 1.00 . A A . 65 ASN O 1 1 10 10784 1 1 30 ASN OD1 O -7.685 -7.590 -2.839 1.00 . A A . 65 ASN OD1 1 1 10 10785 1 1 31 SER C C -4.049 -4.780 -5.725 1.00 . A A . 66 SER C 1 1 10 10786 1 1 31 SER CA C -4.699 -6.098 -5.204 1.00 . A A . 66 SER CA 1 1 10 10787 1 1 31 SER CB C -5.651 -6.684 -6.222 1.00 . A A . 66 SER CB 1 1 10 10788 1 1 31 SER H H -6.346 -6.022 -3.937 1.00 . A A . 66 SER H 1 1 10 10789 1 1 31 SER HA H -3.894 -6.808 -5.111 1.00 . A A . 66 SER HA 1 1 10 10790 1 1 31 SER HB2 H -5.208 -6.519 -7.190 1.00 . A A . 66 SER HB2 1 1 10 10791 1 1 31 SER HB3 H -5.749 -7.747 -6.054 1.00 . A A . 66 SER HB3 1 1 10 10792 1 1 31 SER HG H -6.882 -5.150 -6.429 1.00 . A A . 66 SER HG 1 1 10 10793 1 1 31 SER N N -5.366 -6.036 -3.921 1.00 . A A . 66 SER N 1 1 10 10794 1 1 31 SER O O -3.372 -4.800 -6.766 1.00 . A A . 66 SER O 1 1 10 10795 1 1 31 SER OG O -6.944 -6.070 -6.138 1.00 . A A . 66 SER OG 1 1 10 10796 1 1 32 CYS C C -2.541 -1.767 -5.299 1.00 . A A . 67 CYS C 1 1 10 10797 1 1 32 CYS CA C -3.857 -2.399 -5.724 1.00 . A A . 67 CYS CA 1 1 10 10798 1 1 32 CYS CB C -4.978 -1.369 -5.719 1.00 . A A . 67 CYS CB 1 1 10 10799 1 1 32 CYS H H -4.617 -3.650 -4.157 1.00 . A A . 67 CYS H 1 1 10 10800 1 1 32 CYS HA H -3.712 -2.675 -6.757 1.00 . A A . 67 CYS HA 1 1 10 10801 1 1 32 CYS HB2 H -4.560 -0.419 -6.013 1.00 . A A . 67 CYS HB2 1 1 10 10802 1 1 32 CYS HB3 H -5.780 -1.662 -6.380 1.00 . A A . 67 CYS HB3 1 1 10 10803 1 1 32 CYS N N -4.250 -3.648 -5.068 1.00 . A A . 67 CYS N 1 1 10 10804 1 1 32 CYS O O -1.892 -1.117 -6.126 1.00 . A A . 67 CYS O 1 1 10 10805 1 1 32 CYS SG S -5.681 -1.016 -4.130 1.00 . A A . 67 CYS SG 1 1 10 10806 1 1 33 PHE C C 0.354 -1.753 -4.136 1.00 . A A . 68 PHE C 1 1 10 10807 1 1 33 PHE CA C -0.960 -1.197 -3.615 1.00 . A A . 68 PHE CA 1 1 10 10808 1 1 33 PHE CB C -0.928 -0.910 -2.105 1.00 . A A . 68 PHE CB 1 1 10 10809 1 1 33 PHE CD1 C -2.241 -2.826 -1.085 1.00 . A A . 68 PHE CD1 1 1 10 10810 1 1 33 PHE CD2 C -0.061 -2.334 -0.263 1.00 . A A . 68 PHE CD2 1 1 10 10811 1 1 33 PHE CE1 C -2.363 -3.849 -0.149 1.00 . A A . 68 PHE CE1 1 1 10 10812 1 1 33 PHE CE2 C -0.180 -3.336 0.665 1.00 . A A . 68 PHE CE2 1 1 10 10813 1 1 33 PHE CG C -1.080 -2.060 -1.147 1.00 . A A . 68 PHE CG 1 1 10 10814 1 1 33 PHE CZ C -1.325 -4.090 0.724 1.00 . A A . 68 PHE CZ 1 1 10 10815 1 1 33 PHE H H -2.582 -2.552 -3.456 1.00 . A A . 68 PHE H 1 1 10 10816 1 1 33 PHE HA H -1.065 -0.248 -4.122 1.00 . A A . 68 PHE HA 1 1 10 10817 1 1 33 PHE HB2 H 0.098 -0.636 -1.918 1.00 . A A . 68 PHE HB2 1 1 10 10818 1 1 33 PHE HB3 H -1.602 -0.114 -1.827 1.00 . A A . 68 PHE HB3 1 1 10 10819 1 1 33 PHE HD1 H -3.039 -2.619 -1.782 1.00 . A A . 68 PHE HD1 1 1 10 10820 1 1 33 PHE HD2 H 0.840 -1.740 -0.314 1.00 . A A . 68 PHE HD2 1 1 10 10821 1 1 33 PHE HE1 H -3.263 -4.444 -0.076 1.00 . A A . 68 PHE HE1 1 1 10 10822 1 1 33 PHE HE2 H 0.622 -3.536 1.358 1.00 . A A . 68 PHE HE2 1 1 10 10823 1 1 33 PHE HZ H -1.396 -4.874 1.460 1.00 . A A . 68 PHE HZ 1 1 10 10824 1 1 33 PHE N N -2.124 -1.932 -4.060 1.00 . A A . 68 PHE N 1 1 10 10825 1 1 33 PHE O O 0.912 -2.715 -3.612 1.00 . A A . 68 PHE O 1 1 10 10826 1 1 34 CYS C C 3.014 -0.352 -5.534 1.00 . A A . 69 CYS C 1 1 10 10827 1 1 34 CYS CA C 2.031 -1.471 -5.840 1.00 . A A . 69 CYS CA 1 1 10 10828 1 1 34 CYS CB C 1.812 -1.560 -7.355 1.00 . A A . 69 CYS CB 1 1 10 10829 1 1 34 CYS H H 0.234 -0.452 -5.577 1.00 . A A . 69 CYS H 1 1 10 10830 1 1 34 CYS HA H 2.402 -2.414 -5.473 1.00 . A A . 69 CYS HA 1 1 10 10831 1 1 34 CYS HB2 H 1.674 -0.581 -7.788 1.00 . A A . 69 CYS HB2 1 1 10 10832 1 1 34 CYS HB3 H 2.712 -1.980 -7.778 1.00 . A A . 69 CYS HB3 1 1 10 10833 1 1 34 CYS HG H -0.644 -2.137 -7.264 1.00 . A A . 69 CYS HG 1 1 10 10834 1 1 34 CYS N N 0.796 -1.157 -5.197 1.00 . A A . 69 CYS N 1 1 10 10835 1 1 34 CYS O O 2.621 0.686 -4.982 1.00 . A A . 69 CYS O 1 1 10 10836 1 1 34 CYS SG S 0.441 -2.635 -7.844 1.00 . A A . 69 CYS SG 1 1 10 10837 1 1 35 CYS C C 5.005 1.632 -6.606 1.00 . A A . 70 CYS C 1 1 10 10838 1 1 35 CYS CA C 5.273 0.472 -5.666 1.00 . A A . 70 CYS CA 1 1 10 10839 1 1 35 CYS CB C 6.678 -0.108 -5.835 1.00 . A A . 70 CYS CB 1 1 10 10840 1 1 35 CYS H H 4.515 -1.426 -6.251 1.00 . A A . 70 CYS H 1 1 10 10841 1 1 35 CYS HA H 5.160 0.834 -4.655 1.00 . A A . 70 CYS HA 1 1 10 10842 1 1 35 CYS HB2 H 6.821 -0.742 -4.977 1.00 . A A . 70 CYS HB2 1 1 10 10843 1 1 35 CYS HB3 H 6.714 -0.691 -6.742 1.00 . A A . 70 CYS HB3 1 1 10 10844 1 1 35 CYS N N 4.272 -0.559 -5.858 1.00 . A A . 70 CYS N 1 1 10 10845 1 1 35 CYS O O 4.637 1.462 -7.774 1.00 . A A . 70 CYS O 1 1 10 10846 1 1 35 CYS SG S 8.100 1.028 -5.797 1.00 . A A . 70 CYS SG 1 1 10 10847 1 1 36 LYS C C 5.977 4.344 -7.800 1.00 . A A . 71 LYS C 1 1 10 10848 1 1 36 LYS CA C 4.872 4.018 -6.792 1.00 . A A . 71 LYS CA 1 1 10 10849 1 1 36 LYS CB C 4.677 5.172 -5.809 1.00 . A A . 71 LYS CB 1 1 10 10850 1 1 36 LYS CD C 2.664 6.451 -6.821 1.00 . A A . 71 LYS CD 1 1 10 10851 1 1 36 LYS CE C 2.511 5.966 -8.237 1.00 . A A . 71 LYS CE 1 1 10 10852 1 1 36 LYS CG C 4.131 6.497 -6.394 1.00 . A A . 71 LYS CG 1 1 10 10853 1 1 36 LYS H H 5.454 2.791 -5.138 1.00 . A A . 71 LYS H 1 1 10 10854 1 1 36 LYS HA H 3.944 3.844 -7.302 1.00 . A A . 71 LYS HA 1 1 10 10855 1 1 36 LYS HB2 H 4.051 4.868 -4.985 1.00 . A A . 71 LYS HB2 1 1 10 10856 1 1 36 LYS HB3 H 5.659 5.367 -5.417 1.00 . A A . 71 LYS HB3 1 1 10 10857 1 1 36 LYS HD2 H 2.127 5.782 -6.164 1.00 . A A . 71 LYS HD2 1 1 10 10858 1 1 36 LYS HD3 H 2.247 7.444 -6.741 1.00 . A A . 71 LYS HD3 1 1 10 10859 1 1 36 LYS HE2 H 3.258 5.194 -8.266 1.00 . A A . 71 LYS HE2 1 1 10 10860 1 1 36 LYS HE3 H 1.519 5.595 -8.440 1.00 . A A . 71 LYS HE3 1 1 10 10861 1 1 36 LYS HG2 H 4.244 7.310 -5.706 1.00 . A A . 71 LYS HG2 1 1 10 10862 1 1 36 LYS HG3 H 4.721 6.680 -7.278 1.00 . A A . 71 LYS HG3 1 1 10 10863 1 1 36 LYS HZ1 H 2.495 7.871 -9.131 1.00 . A A . 71 LYS HZ1 1 1 10 10864 1 1 36 LYS HZ2 H 2.728 6.607 -10.205 1.00 . A A . 71 LYS HZ2 1 1 10 10865 1 1 36 LYS HZ3 H 3.991 7.082 -9.227 1.00 . A A . 71 LYS HZ3 1 1 10 10866 1 1 36 LYS N N 5.162 2.796 -6.077 1.00 . A A . 71 LYS N 1 1 10 10867 1 1 36 LYS NZ N 2.960 6.951 -9.250 1.00 . A A . 71 LYS NZ 1 1 10 10868 1 1 36 LYS O O 5.816 5.209 -8.667 1.00 . A A . 71 LYS O 1 1 10 10869 1 1 37 HIS C C 8.315 2.729 -9.579 1.00 . A A . 72 HIS C 1 1 10 10870 1 1 37 HIS CA C 8.196 3.895 -8.585 1.00 . A A . 72 HIS CA 1 1 10 10871 1 1 37 HIS CB C 9.490 4.118 -7.800 1.00 . A A . 72 HIS CB 1 1 10 10872 1 1 37 HIS CD2 C 11.544 4.087 -9.379 1.00 . A A . 72 HIS CD2 1 1 10 10873 1 1 37 HIS CE1 C 12.039 6.194 -9.249 1.00 . A A . 72 HIS CE1 1 1 10 10874 1 1 37 HIS CG C 10.631 4.701 -8.597 1.00 . A A . 72 HIS CG 1 1 10 10875 1 1 37 HIS H H 7.169 2.998 -6.962 1.00 . A A . 72 HIS H 1 1 10 10876 1 1 37 HIS HA H 7.960 4.793 -9.139 1.00 . A A . 72 HIS HA 1 1 10 10877 1 1 37 HIS HB2 H 9.276 4.802 -6.992 1.00 . A A . 72 HIS HB2 1 1 10 10878 1 1 37 HIS HB3 H 9.815 3.173 -7.387 1.00 . A A . 72 HIS HB3 1 1 10 10879 1 1 37 HIS HD2 H 11.569 3.039 -9.637 1.00 . A A . 72 HIS HD2 1 1 10 10880 1 1 37 HIS HE1 H 12.556 7.135 -9.364 1.00 . A A . 72 HIS HE1 1 1 10 10881 1 1 37 HIS HE2 H 13.387 4.816 -9.896 1.00 . A A . 72 HIS HE2 1 1 10 10882 1 1 37 HIS N N 7.096 3.663 -7.679 1.00 . A A . 72 HIS N 1 1 10 10883 1 1 37 HIS ND1 N 10.938 6.038 -8.521 1.00 . A A . 72 HIS ND1 1 1 10 10884 1 1 37 HIS NE2 N 12.436 5.039 -9.784 1.00 . A A . 72 HIS NE2 1 1 10 10885 1 1 37 HIS O O 8.776 2.907 -10.700 1.00 . A A . 72 HIS O 1 1 10 10886 1 1 38 CYS C C 6.572 -0.324 -9.820 1.00 . A A . 73 CYS C 1 1 10 10887 1 1 38 CYS CA C 7.870 0.422 -10.055 1.00 . A A . 73 CYS CA 1 1 10 10888 1 1 38 CYS CB C 9.078 -0.473 -9.810 1.00 . A A . 73 CYS CB 1 1 10 10889 1 1 38 CYS H H 7.539 1.377 -8.274 1.00 . A A . 73 CYS H 1 1 10 10890 1 1 38 CYS HA H 7.926 0.834 -11.051 1.00 . A A . 73 CYS HA 1 1 10 10891 1 1 38 CYS HB2 H 9.275 -1.111 -10.647 1.00 . A A . 73 CYS HB2 1 1 10 10892 1 1 38 CYS HB3 H 9.889 0.226 -9.760 1.00 . A A . 73 CYS HB3 1 1 10 10893 1 1 38 CYS N N 7.888 1.538 -9.171 1.00 . A A . 73 CYS N 1 1 10 10894 1 1 38 CYS O O 6.214 -0.564 -8.680 1.00 . A A . 73 CYS O 1 1 10 10895 1 1 38 CYS SG S 9.085 -1.446 -8.287 1.00 . A A . 73 CYS SG 1 1 10 10896 1 1 39 HIS C C 4.646 -2.802 -10.271 1.00 . A A . 74 HIS C 1 1 10 10897 1 1 39 HIS CA C 4.555 -1.335 -10.671 1.00 . A A . 74 HIS CA 1 1 10 10898 1 1 39 HIS CB C 3.610 -1.119 -11.876 1.00 . A A . 74 HIS CB 1 1 10 10899 1 1 39 HIS CD2 C 4.164 -2.820 -13.789 1.00 . A A . 74 HIS CD2 1 1 10 10900 1 1 39 HIS CE1 C 4.909 -1.409 -15.260 1.00 . A A . 74 HIS CE1 1 1 10 10901 1 1 39 HIS CG C 4.114 -1.588 -13.228 1.00 . A A . 74 HIS CG 1 1 10 10902 1 1 39 HIS H H 6.233 -0.541 -11.748 1.00 . A A . 74 HIS H 1 1 10 10903 1 1 39 HIS HA H 4.112 -0.843 -9.814 1.00 . A A . 74 HIS HA 1 1 10 10904 1 1 39 HIS HB2 H 2.706 -1.666 -11.660 1.00 . A A . 74 HIS HB2 1 1 10 10905 1 1 39 HIS HB3 H 3.379 -0.066 -11.935 1.00 . A A . 74 HIS HB3 1 1 10 10906 1 1 39 HIS HD1 H 4.705 0.241 -14.100 1.00 . A A . 74 HIS HD1 1 1 10 10907 1 1 39 HIS HD2 H 3.868 -3.746 -13.319 1.00 . A A . 74 HIS HD2 1 1 10 10908 1 1 39 HIS HE1 H 5.298 -0.986 -16.172 1.00 . A A . 74 HIS HE1 1 1 10 10909 1 1 39 HIS HE2 H 4.537 -3.317 -15.781 1.00 . A A . 74 HIS HE2 1 1 10 10910 1 1 39 HIS N N 5.868 -0.699 -10.852 1.00 . A A . 74 HIS N 1 1 10 10911 1 1 39 HIS ND1 N 4.592 -0.734 -14.183 1.00 . A A . 74 HIS ND1 1 1 10 10912 1 1 39 HIS NE2 N 4.663 -2.671 -15.050 1.00 . A A . 74 HIS NE2 1 1 10 10913 1 1 39 HIS O O 4.101 -3.684 -10.927 1.00 . A A . 74 HIS O 1 1 10 10914 1 1 40 THR C C 4.327 -4.557 -7.658 1.00 . A A . 75 THR C 1 1 10 10915 1 1 40 THR CA C 5.426 -4.363 -8.697 1.00 . A A . 75 THR CA 1 1 10 10916 1 1 40 THR CB C 6.841 -4.671 -8.113 1.00 . A A . 75 THR CB 1 1 10 10917 1 1 40 THR CG2 C 7.118 -3.905 -6.822 1.00 . A A . 75 THR CG2 1 1 10 10918 1 1 40 THR H H 5.757 -2.291 -8.747 1.00 . A A . 75 THR H 1 1 10 10919 1 1 40 THR HA H 5.226 -5.031 -9.521 1.00 . A A . 75 THR HA 1 1 10 10920 1 1 40 THR HB H 7.557 -4.368 -8.863 1.00 . A A . 75 THR HB 1 1 10 10921 1 1 40 THR HG1 H 7.549 -6.407 -8.556 1.00 . A A . 75 THR HG1 1 1 10 10922 1 1 40 THR HG21 H 8.099 -4.163 -6.452 1.00 . A A . 75 THR HG21 1 1 10 10923 1 1 40 THR HG22 H 6.374 -4.167 -6.084 1.00 . A A . 75 THR HG22 1 1 10 10924 1 1 40 THR HG23 H 7.074 -2.844 -7.018 1.00 . A A . 75 THR HG23 1 1 10 10925 1 1 40 THR N N 5.324 -3.050 -9.203 1.00 . A A . 75 THR N 1 1 10 10926 1 1 40 THR O O 4.093 -3.669 -6.795 1.00 . A A . 75 THR O 1 1 10 10927 1 1 40 THR OG1 O 6.972 -6.074 -7.855 1.00 . A A . 75 THR OG1 1 1 10 10928 1 1 41 LYS C C 3.142 -6.522 -5.591 1.00 . A A . 76 LYS C 1 1 10 10929 1 1 41 LYS CA C 2.534 -5.972 -6.882 1.00 . A A . 76 LYS CA 1 1 10 10930 1 1 41 LYS CB C 1.568 -6.965 -7.577 1.00 . A A . 76 LYS CB 1 1 10 10931 1 1 41 LYS CD C 0.223 -8.023 -5.651 1.00 . A A . 76 LYS CD 1 1 10 10932 1 1 41 LYS CE C 0.611 -9.462 -5.972 1.00 . A A . 76 LYS CE 1 1 10 10933 1 1 41 LYS CG C 0.190 -7.160 -6.909 1.00 . A A . 76 LYS CG 1 1 10 10934 1 1 41 LYS H H 3.838 -6.277 -8.503 1.00 . A A . 76 LYS H 1 1 10 10935 1 1 41 LYS HA H 2.013 -5.053 -6.657 1.00 . A A . 76 LYS HA 1 1 10 10936 1 1 41 LYS HB2 H 1.398 -6.623 -8.587 1.00 . A A . 76 LYS HB2 1 1 10 10937 1 1 41 LYS HB3 H 2.065 -7.922 -7.616 1.00 . A A . 76 LYS HB3 1 1 10 10938 1 1 41 LYS HD2 H 0.946 -7.608 -4.963 1.00 . A A . 76 LYS HD2 1 1 10 10939 1 1 41 LYS HD3 H -0.757 -8.010 -5.197 1.00 . A A . 76 LYS HD3 1 1 10 10940 1 1 41 LYS HE2 H -0.082 -9.860 -6.697 1.00 . A A . 76 LYS HE2 1 1 10 10941 1 1 41 LYS HE3 H 1.607 -9.476 -6.388 1.00 . A A . 76 LYS HE3 1 1 10 10942 1 1 41 LYS HG2 H -0.202 -6.191 -6.639 1.00 . A A . 76 LYS HG2 1 1 10 10943 1 1 41 LYS HG3 H -0.473 -7.617 -7.630 1.00 . A A . 76 LYS HG3 1 1 10 10944 1 1 41 LYS HZ1 H 1.229 -9.950 -4.047 1.00 . A A . 76 LYS HZ1 1 1 10 10945 1 1 41 LYS HZ2 H 0.889 -11.282 -5.019 1.00 . A A . 76 LYS HZ2 1 1 10 10946 1 1 41 LYS HZ3 H -0.379 -10.367 -4.390 1.00 . A A . 76 LYS HZ3 1 1 10 10947 1 1 41 LYS N N 3.615 -5.653 -7.778 1.00 . A A . 76 LYS N 1 1 10 10948 1 1 41 LYS NZ N 0.586 -10.319 -4.773 1.00 . A A . 76 LYS NZ 1 1 10 10949 1 1 41 LYS O O 3.423 -7.709 -5.459 1.00 . A A . 76 LYS O 1 1 10 10950 1 1 42 LEU C C 3.063 -5.973 -2.285 1.00 . A A . 77 LEU C 1 1 10 10951 1 1 42 LEU CA C 4.044 -5.869 -3.420 1.00 . A A . 77 LEU CA 1 1 10 10952 1 1 42 LEU CB C 5.088 -4.775 -3.199 1.00 . A A . 77 LEU CB 1 1 10 10953 1 1 42 LEU CD1 C 3.718 -2.847 -2.111 1.00 . A A . 77 LEU CD1 1 1 10 10954 1 1 42 LEU CD2 C 5.754 -2.395 -3.385 1.00 . A A . 77 LEU CD2 1 1 10 10955 1 1 42 LEU CG C 4.588 -3.292 -3.272 1.00 . A A . 77 LEU CG 1 1 10 10956 1 1 42 LEU H H 3.176 -4.694 -4.934 1.00 . A A . 77 LEU H 1 1 10 10957 1 1 42 LEU HA H 4.571 -6.807 -3.490 1.00 . A A . 77 LEU HA 1 1 10 10958 1 1 42 LEU HB2 H 5.713 -4.933 -2.336 1.00 . A A . 77 LEU HB2 1 1 10 10959 1 1 42 LEU HB3 H 5.691 -4.857 -4.094 1.00 . A A . 77 LEU HB3 1 1 10 10960 1 1 42 LEU HD11 H 3.319 -1.855 -2.294 1.00 . A A . 77 LEU HD11 1 1 10 10961 1 1 42 LEU HD12 H 4.371 -2.793 -1.256 1.00 . A A . 77 LEU HD12 1 1 10 10962 1 1 42 LEU HD13 H 2.923 -3.554 -1.917 1.00 . A A . 77 LEU HD13 1 1 10 10963 1 1 42 LEU HD21 H 6.340 -2.663 -4.252 1.00 . A A . 77 LEU HD21 1 1 10 10964 1 1 42 LEU HD22 H 6.353 -2.499 -2.494 1.00 . A A . 77 LEU HD22 1 1 10 10965 1 1 42 LEU HD23 H 5.417 -1.373 -3.475 1.00 . A A . 77 LEU HD23 1 1 10 10966 1 1 42 LEU HG H 4.010 -3.170 -4.175 1.00 . A A . 77 LEU HG 1 1 10 10967 1 1 42 LEU N N 3.405 -5.618 -4.704 1.00 . A A . 77 LEU N 1 1 10 10968 1 1 42 LEU O O 3.445 -6.176 -1.129 1.00 . A A . 77 LEU O 1 1 10 10969 1 1 43 SER C C 0.733 -7.096 -0.841 1.00 . A A . 78 SER C 1 1 10 10970 1 1 43 SER CA C 0.748 -5.826 -1.698 1.00 . A A . 78 SER CA 1 1 10 10971 1 1 43 SER CB C -0.489 -5.800 -2.531 1.00 . A A . 78 SER CB 1 1 10 10972 1 1 43 SER H H 1.590 -5.710 -3.568 1.00 . A A . 78 SER H 1 1 10 10973 1 1 43 SER HA H 0.745 -4.939 -1.091 1.00 . A A . 78 SER HA 1 1 10 10974 1 1 43 SER HB2 H -0.729 -6.823 -2.749 1.00 . A A . 78 SER HB2 1 1 10 10975 1 1 43 SER HB3 H -1.296 -5.345 -1.977 1.00 . A A . 78 SER HB3 1 1 10 10976 1 1 43 SER HG H 0.073 -4.181 -3.506 1.00 . A A . 78 SER HG 1 1 10 10977 1 1 43 SER N N 1.820 -5.836 -2.626 1.00 . A A . 78 SER N 1 1 10 10978 1 1 43 SER O O 0.881 -8.208 -1.374 1.00 . A A . 78 SER O 1 1 10 10979 1 1 43 SER OG O -0.256 -5.064 -3.732 1.00 . A A . 78 SER OG 1 1 10 10980 1 1 44 LEU C C 1.360 -9.109 1.319 1.00 . A A . 79 LEU C 1 1 10 10981 1 1 44 LEU CA C 0.355 -7.960 1.465 1.00 . A A . 79 LEU CA 1 1 10 10982 1 1 44 LEU CB C -1.088 -8.445 1.519 1.00 . A A . 79 LEU CB 1 1 10 10983 1 1 44 LEU CD1 C -1.234 -9.067 3.914 1.00 . A A . 79 LEU CD1 1 1 10 10984 1 1 44 LEU CD2 C -1.781 -6.739 3.236 1.00 . A A . 79 LEU CD2 1 1 10 10985 1 1 44 LEU CG C -1.826 -8.214 2.834 1.00 . A A . 79 LEU CG 1 1 10 10986 1 1 44 LEU H H 0.409 -5.977 0.769 1.00 . A A . 79 LEU H 1 1 10 10987 1 1 44 LEU HA H 0.581 -7.497 2.413 1.00 . A A . 79 LEU HA 1 1 10 10988 1 1 44 LEU HB2 H -1.620 -7.921 0.742 1.00 . A A . 79 LEU HB2 1 1 10 10989 1 1 44 LEU HB3 H -1.101 -9.502 1.300 1.00 . A A . 79 LEU HB3 1 1 10 10990 1 1 44 LEU HD11 H -1.754 -8.891 4.843 1.00 . A A . 79 LEU HD11 1 1 10 10991 1 1 44 LEU HD12 H -0.191 -8.804 3.999 1.00 . A A . 79 LEU HD12 1 1 10 10992 1 1 44 LEU HD13 H -1.328 -10.099 3.614 1.00 . A A . 79 LEU HD13 1 1 10 10993 1 1 44 LEU HD21 H -2.365 -6.169 2.529 1.00 . A A . 79 LEU HD21 1 1 10 10994 1 1 44 LEU HD22 H -0.763 -6.375 3.216 1.00 . A A . 79 LEU HD22 1 1 10 10995 1 1 44 LEU HD23 H -2.190 -6.605 4.227 1.00 . A A . 79 LEU HD23 1 1 10 10996 1 1 44 LEU HG H -2.859 -8.497 2.701 1.00 . A A . 79 LEU HG 1 1 10 10997 1 1 44 LEU N N 0.491 -6.902 0.459 1.00 . A A . 79 LEU N 1 1 10 10998 1 1 44 LEU O O 1.108 -10.103 0.620 1.00 . A A . 79 LEU O 1 1 10 10999 1 1 45 GLY C C 4.815 -9.335 2.314 1.00 . A A . 80 GLY C 1 1 10 11000 1 1 45 GLY CA C 3.512 -9.959 1.937 1.00 . A A . 80 GLY CA 1 1 10 11001 1 1 45 GLY H H 2.560 -8.224 2.623 1.00 . A A . 80 GLY H 1 1 10 11002 1 1 45 GLY HA2 H 3.296 -10.776 2.608 1.00 . A A . 80 GLY HA2 1 1 10 11003 1 1 45 GLY HA3 H 3.583 -10.332 0.925 1.00 . A A . 80 GLY HA3 1 1 10 11004 1 1 45 GLY N N 2.456 -8.985 2.010 1.00 . A A . 80 GLY N 1 1 10 11005 1 1 45 GLY O O 5.374 -9.619 3.377 1.00 . A A . 80 GLY O 1 1 10 11006 1 1 46 SER C C 6.399 -6.379 1.071 1.00 . A A . 81 SER C 1 1 10 11007 1 1 46 SER CA C 6.493 -7.735 1.741 1.00 . A A . 81 SER CA 1 1 10 11008 1 1 46 SER CB C 7.707 -8.539 1.232 1.00 . A A . 81 SER CB 1 1 10 11009 1 1 46 SER H H 4.801 -8.305 0.631 1.00 . A A . 81 SER H 1 1 10 11010 1 1 46 SER HA H 6.576 -7.603 2.810 1.00 . A A . 81 SER HA 1 1 10 11011 1 1 46 SER HB2 H 8.606 -7.952 1.348 1.00 . A A . 81 SER HB2 1 1 10 11012 1 1 46 SER HB3 H 7.793 -9.446 1.811 1.00 . A A . 81 SER HB3 1 1 10 11013 1 1 46 SER HG H 6.883 -8.314 -0.518 1.00 . A A . 81 SER HG 1 1 10 11014 1 1 46 SER N N 5.286 -8.466 1.471 1.00 . A A . 81 SER N 1 1 10 11015 1 1 46 SER O O 6.524 -6.269 -0.153 1.00 . A A . 81 SER O 1 1 10 11016 1 1 46 SER OG O 7.563 -8.888 -0.142 1.00 . A A . 81 SER OG 1 1 10 11017 1 1 47 TYR C C 6.580 -2.997 2.204 1.00 . A A . 82 TYR C 1 1 10 11018 1 1 47 TYR CA C 5.992 -4.058 1.302 1.00 . A A . 82 TYR CA 1 1 10 11019 1 1 47 TYR CB C 4.477 -3.806 1.051 1.00 . A A . 82 TYR CB 1 1 10 11020 1 1 47 TYR CD1 C 3.628 -2.762 3.184 1.00 . A A . 82 TYR CD1 1 1 10 11021 1 1 47 TYR CD2 C 2.562 -4.764 2.476 1.00 . A A . 82 TYR CD2 1 1 10 11022 1 1 47 TYR CE1 C 2.785 -2.684 4.254 1.00 . A A . 82 TYR CE1 1 1 10 11023 1 1 47 TYR CE2 C 1.714 -4.686 3.568 1.00 . A A . 82 TYR CE2 1 1 10 11024 1 1 47 TYR CG C 3.552 -3.790 2.273 1.00 . A A . 82 TYR CG 1 1 10 11025 1 1 47 TYR CZ C 1.836 -3.634 4.449 1.00 . A A . 82 TYR CZ 1 1 10 11026 1 1 47 TYR H H 6.141 -5.439 2.824 1.00 . A A . 82 TYR H 1 1 10 11027 1 1 47 TYR HA H 6.501 -4.012 0.350 1.00 . A A . 82 TYR HA 1 1 10 11028 1 1 47 TYR HB2 H 4.347 -2.848 0.573 1.00 . A A . 82 TYR HB2 1 1 10 11029 1 1 47 TYR HB3 H 4.123 -4.566 0.373 1.00 . A A . 82 TYR HB3 1 1 10 11030 1 1 47 TYR HD1 H 4.395 -2.018 3.032 1.00 . A A . 82 TYR HD1 1 1 10 11031 1 1 47 TYR HD2 H 2.443 -5.598 1.799 1.00 . A A . 82 TYR HD2 1 1 10 11032 1 1 47 TYR HE1 H 2.861 -1.867 4.953 1.00 . A A . 82 TYR HE1 1 1 10 11033 1 1 47 TYR HE2 H 0.962 -5.446 3.723 1.00 . A A . 82 TYR HE2 1 1 10 11034 1 1 47 TYR HH H 0.720 -2.574 5.504 1.00 . A A . 82 TYR HH 1 1 10 11035 1 1 47 TYR N N 6.191 -5.355 1.846 1.00 . A A . 82 TYR N 1 1 10 11036 1 1 47 TYR O O 6.950 -3.268 3.351 1.00 . A A . 82 TYR O 1 1 10 11037 1 1 47 TYR OH O 0.984 -3.511 5.534 1.00 . A A . 82 TYR OH 1 1 10 11038 1 1 48 ALA C C 6.014 0.363 2.171 1.00 . A A . 83 ALA C 1 1 10 11039 1 1 48 ALA CA C 7.072 -0.666 2.432 1.00 . A A . 83 ALA CA 1 1 10 11040 1 1 48 ALA CB C 8.438 -0.139 2.005 1.00 . A A . 83 ALA CB 1 1 10 11041 1 1 48 ALA H H 6.485 -1.678 0.729 1.00 . A A . 83 ALA H 1 1 10 11042 1 1 48 ALA HA H 7.090 -0.928 3.479 1.00 . A A . 83 ALA HA 1 1 10 11043 1 1 48 ALA HB1 H 8.637 0.795 2.512 1.00 . A A . 83 ALA HB1 1 1 10 11044 1 1 48 ALA HB2 H 8.454 0.028 0.938 1.00 . A A . 83 ALA HB2 1 1 10 11045 1 1 48 ALA HB3 H 9.201 -0.854 2.271 1.00 . A A . 83 ALA HB3 1 1 10 11046 1 1 48 ALA N N 6.691 -1.821 1.680 1.00 . A A . 83 ALA N 1 1 10 11047 1 1 48 ALA O O 5.619 0.567 1.034 1.00 . A A . 83 ALA O 1 1 10 11048 1 1 49 ALA C C 4.847 3.179 3.702 1.00 . A A . 84 ALA C 1 1 10 11049 1 1 49 ALA CA C 4.489 1.937 2.974 1.00 . A A . 84 ALA CA 1 1 10 11050 1 1 49 ALA CB C 3.129 1.420 3.413 1.00 . A A . 84 ALA CB 1 1 10 11051 1 1 49 ALA H H 5.832 0.791 4.090 1.00 . A A . 84 ALA H 1 1 10 11052 1 1 49 ALA HA H 4.448 2.144 1.915 1.00 . A A . 84 ALA HA 1 1 10 11053 1 1 49 ALA HB1 H 3.131 1.243 4.479 1.00 . A A . 84 ALA HB1 1 1 10 11054 1 1 49 ALA HB2 H 2.922 0.495 2.895 1.00 . A A . 84 ALA HB2 1 1 10 11055 1 1 49 ALA HB3 H 2.367 2.142 3.162 1.00 . A A . 84 ALA HB3 1 1 10 11056 1 1 49 ALA N N 5.504 0.962 3.182 1.00 . A A . 84 ALA N 1 1 10 11057 1 1 49 ALA O O 5.172 3.142 4.901 1.00 . A A . 84 ALA O 1 1 10 11058 1 1 50 LEU C C 3.847 6.331 3.394 1.00 . A A . 85 LEU C 1 1 10 11059 1 1 50 LEU CA C 5.078 5.521 3.559 1.00 . A A . 85 LEU CA 1 1 10 11060 1 1 50 LEU CB C 6.242 6.203 2.823 1.00 . A A . 85 LEU CB 1 1 10 11061 1 1 50 LEU CD1 C 7.487 7.402 4.614 1.00 . A A . 85 LEU CD1 1 1 10 11062 1 1 50 LEU CD2 C 7.364 8.409 2.371 1.00 . A A . 85 LEU CD2 1 1 10 11063 1 1 50 LEU CG C 6.658 7.558 3.381 1.00 . A A . 85 LEU CG 1 1 10 11064 1 1 50 LEU H H 4.523 4.246 2.062 1.00 . A A . 85 LEU H 1 1 10 11065 1 1 50 LEU HA H 5.326 5.419 4.602 1.00 . A A . 85 LEU HA 1 1 10 11066 1 1 50 LEU HB2 H 7.089 5.553 2.947 1.00 . A A . 85 LEU HB2 1 1 10 11067 1 1 50 LEU HB3 H 6.038 6.308 1.772 1.00 . A A . 85 LEU HB3 1 1 10 11068 1 1 50 LEU HD11 H 6.944 6.830 5.352 1.00 . A A . 85 LEU HD11 1 1 10 11069 1 1 50 LEU HD12 H 7.683 8.399 4.980 1.00 . A A . 85 LEU HD12 1 1 10 11070 1 1 50 LEU HD13 H 8.401 6.902 4.324 1.00 . A A . 85 LEU HD13 1 1 10 11071 1 1 50 LEU HD21 H 8.243 7.888 2.019 1.00 . A A . 85 LEU HD21 1 1 10 11072 1 1 50 LEU HD22 H 7.655 9.331 2.855 1.00 . A A . 85 LEU HD22 1 1 10 11073 1 1 50 LEU HD23 H 6.702 8.621 1.546 1.00 . A A . 85 LEU HD23 1 1 10 11074 1 1 50 LEU HG H 5.751 8.064 3.674 1.00 . A A . 85 LEU HG 1 1 10 11075 1 1 50 LEU N N 4.799 4.258 3.009 1.00 . A A . 85 LEU N 1 1 10 11076 1 1 50 LEU O O 3.008 6.010 2.551 1.00 . A A . 85 LEU O 1 1 10 11077 1 1 51 HIS C C 2.554 8.786 2.665 1.00 . A A . 86 HIS C 1 1 10 11078 1 1 51 HIS CA C 2.618 8.269 4.105 1.00 . A A . 86 HIS CA 1 1 10 11079 1 1 51 HIS CB C 2.813 9.437 5.122 1.00 . A A . 86 HIS CB 1 1 10 11080 1 1 51 HIS CD2 C 5.073 10.555 4.352 1.00 . A A . 86 HIS CD2 1 1 10 11081 1 1 51 HIS CE1 C 6.135 10.494 6.247 1.00 . A A . 86 HIS CE1 1 1 10 11082 1 1 51 HIS CG C 4.241 9.979 5.251 1.00 . A A . 86 HIS CG 1 1 10 11083 1 1 51 HIS H H 4.309 7.375 4.997 1.00 . A A . 86 HIS H 1 1 10 11084 1 1 51 HIS HA H 1.694 7.760 4.334 1.00 . A A . 86 HIS HA 1 1 10 11085 1 1 51 HIS HB2 H 2.183 10.262 4.826 1.00 . A A . 86 HIS HB2 1 1 10 11086 1 1 51 HIS HB3 H 2.499 9.093 6.095 1.00 . A A . 86 HIS HB3 1 1 10 11087 1 1 51 HIS HD1 H 4.633 9.578 7.283 1.00 . A A . 86 HIS HD1 1 1 10 11088 1 1 51 HIS HD2 H 4.891 10.687 3.297 1.00 . A A . 86 HIS HD2 1 1 10 11089 1 1 51 HIS HE1 H 6.914 10.594 6.988 1.00 . A A . 86 HIS HE1 1 1 10 11090 1 1 51 HIS HE2 H 6.801 11.608 4.688 1.00 . A A . 86 HIS HE2 1 1 10 11091 1 1 51 HIS N N 3.690 7.314 4.237 1.00 . A A . 86 HIS N 1 1 10 11092 1 1 51 HIS ND1 N 4.947 9.954 6.430 1.00 . A A . 86 HIS ND1 1 1 10 11093 1 1 51 HIS NE2 N 6.233 10.866 4.996 1.00 . A A . 86 HIS NE2 1 1 10 11094 1 1 51 HIS O O 3.510 9.356 2.155 1.00 . A A . 86 HIS O 1 1 10 11095 1 1 52 GLY C C 1.606 7.909 -0.388 1.00 . A A . 87 GLY C 1 1 10 11096 1 1 52 GLY CA C 1.279 8.969 0.665 1.00 . A A . 87 GLY CA 1 1 10 11097 1 1 52 GLY H H 0.740 8.026 2.454 1.00 . A A . 87 GLY H 1 1 10 11098 1 1 52 GLY HA2 H 0.252 9.277 0.531 1.00 . A A . 87 GLY HA2 1 1 10 11099 1 1 52 GLY HA3 H 1.919 9.823 0.502 1.00 . A A . 87 GLY HA3 1 1 10 11100 1 1 52 GLY N N 1.452 8.535 2.017 1.00 . A A . 87 GLY N 1 1 10 11101 1 1 52 GLY O O 0.824 7.721 -1.316 1.00 . A A . 87 GLY O 1 1 10 11102 1 1 53 GLU C C 3.581 4.911 -0.798 1.00 . A A . 88 GLU C 1 1 10 11103 1 1 53 GLU CA C 3.180 6.283 -1.329 1.00 . A A . 88 GLU CA 1 1 10 11104 1 1 53 GLU CB C 4.374 6.902 -2.085 1.00 . A A . 88 GLU CB 1 1 10 11105 1 1 53 GLU CD C 5.294 9.027 -3.139 1.00 . A A . 88 GLU CD 1 1 10 11106 1 1 53 GLU CG C 4.094 8.313 -2.579 1.00 . A A . 88 GLU CG 1 1 10 11107 1 1 53 GLU H H 3.246 7.206 0.586 1.00 . A A . 88 GLU H 1 1 10 11108 1 1 53 GLU HA H 2.361 6.177 -2.024 1.00 . A A . 88 GLU HA 1 1 10 11109 1 1 53 GLU HB2 H 5.289 6.849 -1.514 1.00 . A A . 88 GLU HB2 1 1 10 11110 1 1 53 GLU HB3 H 4.531 6.289 -2.961 1.00 . A A . 88 GLU HB3 1 1 10 11111 1 1 53 GLU HG2 H 3.342 8.256 -3.350 1.00 . A A . 88 GLU HG2 1 1 10 11112 1 1 53 GLU HG3 H 3.699 8.880 -1.750 1.00 . A A . 88 GLU HG3 1 1 10 11113 1 1 53 GLU N N 2.733 7.187 -0.250 1.00 . A A . 88 GLU N 1 1 10 11114 1 1 53 GLU O O 4.187 4.791 0.269 1.00 . A A . 88 GLU O 1 1 10 11115 1 1 53 GLU OE1 O 5.719 8.714 -4.268 1.00 . A A . 88 GLU OE1 1 1 10 11116 1 1 53 GLU OE2 O 5.794 9.978 -2.486 1.00 . A A . 88 GLU OE2 1 1 10 11117 1 1 54 PHE C C 4.795 2.235 -2.077 1.00 . A A . 89 PHE C 1 1 10 11118 1 1 54 PHE CA C 3.601 2.539 -1.230 1.00 . A A . 89 PHE CA 1 1 10 11119 1 1 54 PHE CB C 2.415 1.609 -1.543 1.00 . A A . 89 PHE CB 1 1 10 11120 1 1 54 PHE CD1 C 0.397 3.084 -1.315 1.00 . A A . 89 PHE CD1 1 1 10 11121 1 1 54 PHE CD2 C 0.871 1.544 0.449 1.00 . A A . 89 PHE CD2 1 1 10 11122 1 1 54 PHE CE1 C -0.674 3.568 -0.621 1.00 . A A . 89 PHE CE1 1 1 10 11123 1 1 54 PHE CE2 C -0.191 2.038 1.153 1.00 . A A . 89 PHE CE2 1 1 10 11124 1 1 54 PHE CG C 1.188 2.061 -0.797 1.00 . A A . 89 PHE CG 1 1 10 11125 1 1 54 PHE CZ C -0.966 3.059 0.609 1.00 . A A . 89 PHE CZ 1 1 10 11126 1 1 54 PHE H H 2.773 4.020 -2.393 1.00 . A A . 89 PHE H 1 1 10 11127 1 1 54 PHE HA H 3.863 2.483 -0.182 1.00 . A A . 89 PHE HA 1 1 10 11128 1 1 54 PHE HB2 H 2.201 1.622 -2.602 1.00 . A A . 89 PHE HB2 1 1 10 11129 1 1 54 PHE HB3 H 2.656 0.601 -1.253 1.00 . A A . 89 PHE HB3 1 1 10 11130 1 1 54 PHE HD1 H 0.631 3.484 -2.290 1.00 . A A . 89 PHE HD1 1 1 10 11131 1 1 54 PHE HD2 H 1.447 0.747 0.894 1.00 . A A . 89 PHE HD2 1 1 10 11132 1 1 54 PHE HE1 H -1.284 4.361 -1.028 1.00 . A A . 89 PHE HE1 1 1 10 11133 1 1 54 PHE HE2 H -0.422 1.610 2.121 1.00 . A A . 89 PHE HE2 1 1 10 11134 1 1 54 PHE HZ H -1.804 3.474 1.146 1.00 . A A . 89 PHE HZ 1 1 10 11135 1 1 54 PHE N N 3.259 3.891 -1.556 1.00 . A A . 89 PHE N 1 1 10 11136 1 1 54 PHE O O 4.819 2.562 -3.275 1.00 . A A . 89 PHE O 1 1 10 11137 1 1 55 TYR C C 7.584 0.207 -1.937 1.00 . A A . 90 TYR C 1 1 10 11138 1 1 55 TYR CA C 7.030 1.588 -2.159 1.00 . A A . 90 TYR CA 1 1 10 11139 1 1 55 TYR CB C 7.920 2.631 -1.492 1.00 . A A . 90 TYR CB 1 1 10 11140 1 1 55 TYR CD1 C 7.445 4.616 -2.943 1.00 . A A . 90 TYR CD1 1 1 10 11141 1 1 55 TYR CD2 C 9.711 3.938 -2.658 1.00 . A A . 90 TYR CD2 1 1 10 11142 1 1 55 TYR CE1 C 7.837 5.646 -3.751 1.00 . A A . 90 TYR CE1 1 1 10 11143 1 1 55 TYR CE2 C 10.114 4.973 -3.462 1.00 . A A . 90 TYR CE2 1 1 10 11144 1 1 55 TYR CG C 8.377 3.737 -2.383 1.00 . A A . 90 TYR CG 1 1 10 11145 1 1 55 TYR CZ C 9.173 5.830 -4.010 1.00 . A A . 90 TYR CZ 1 1 10 11146 1 1 55 TYR H H 5.689 1.275 -0.604 1.00 . A A . 90 TYR H 1 1 10 11147 1 1 55 TYR HA H 6.937 1.826 -3.207 1.00 . A A . 90 TYR HA 1 1 10 11148 1 1 55 TYR HB2 H 7.203 3.179 -0.893 1.00 . A A . 90 TYR HB2 1 1 10 11149 1 1 55 TYR HB3 H 8.706 2.241 -0.867 1.00 . A A . 90 TYR HB3 1 1 10 11150 1 1 55 TYR HD1 H 6.391 4.495 -2.736 1.00 . A A . 90 TYR HD1 1 1 10 11151 1 1 55 TYR HD2 H 10.451 3.275 -2.237 1.00 . A A . 90 TYR HD2 1 1 10 11152 1 1 55 TYR HE1 H 7.083 6.303 -4.161 1.00 . A A . 90 TYR HE1 1 1 10 11153 1 1 55 TYR HE2 H 11.170 5.109 -3.644 1.00 . A A . 90 TYR HE2 1 1 10 11154 1 1 55 TYR HH H 10.143 6.517 -5.520 1.00 . A A . 90 TYR HH 1 1 10 11155 1 1 55 TYR N N 5.783 1.674 -1.501 1.00 . A A . 90 TYR N 1 1 10 11156 1 1 55 TYR O O 7.266 -0.436 -0.948 1.00 . A A . 90 TYR O 1 1 10 11157 1 1 55 TYR OH O 9.571 6.865 -4.827 1.00 . A A . 90 TYR OH 1 1 10 11158 1 1 56 CYS C C 10.121 -1.371 -1.717 1.00 . A A . 91 CYS C 1 1 10 11159 1 1 56 CYS CA C 8.952 -1.565 -2.636 1.00 . A A . 91 CYS CA 1 1 10 11160 1 1 56 CYS CB C 9.393 -2.248 -3.936 1.00 . A A . 91 CYS CB 1 1 10 11161 1 1 56 CYS H H 8.509 0.206 -3.691 1.00 . A A . 91 CYS H 1 1 10 11162 1 1 56 CYS HA H 8.226 -2.184 -2.128 1.00 . A A . 91 CYS HA 1 1 10 11163 1 1 56 CYS HB2 H 9.722 -3.250 -3.706 1.00 . A A . 91 CYS HB2 1 1 10 11164 1 1 56 CYS HB3 H 8.562 -2.328 -4.614 1.00 . A A . 91 CYS HB3 1 1 10 11165 1 1 56 CYS N N 8.352 -0.289 -2.862 1.00 . A A . 91 CYS N 1 1 10 11166 1 1 56 CYS O O 10.722 -0.286 -1.752 1.00 . A A . 91 CYS O 1 1 10 11167 1 1 56 CYS SG S 10.721 -1.400 -4.794 1.00 . A A . 91 CYS SG 1 1 10 11168 1 1 57 LYS C C 12.904 -1.743 -0.658 1.00 . A A . 92 LYS C 1 1 10 11169 1 1 57 LYS CA C 11.550 -2.163 0.021 1.00 . A A . 92 LYS CA 1 1 10 11170 1 1 57 LYS CB C 11.655 -3.333 1.011 1.00 . A A . 92 LYS CB 1 1 10 11171 1 1 57 LYS CD C 10.474 -4.482 3.026 1.00 . A A . 92 LYS CD 1 1 10 11172 1 1 57 LYS CE C 10.215 -5.902 2.496 1.00 . A A . 92 LYS CE 1 1 10 11173 1 1 57 LYS CG C 10.440 -3.377 1.956 1.00 . A A . 92 LYS CG 1 1 10 11174 1 1 57 LYS H H 9.927 -3.168 -0.884 1.00 . A A . 92 LYS H 1 1 10 11175 1 1 57 LYS HA H 11.263 -1.284 0.583 1.00 . A A . 92 LYS HA 1 1 10 11176 1 1 57 LYS HB2 H 11.710 -4.261 0.461 1.00 . A A . 92 LYS HB2 1 1 10 11177 1 1 57 LYS HB3 H 12.546 -3.217 1.611 1.00 . A A . 92 LYS HB3 1 1 10 11178 1 1 57 LYS HD2 H 11.450 -4.476 3.488 1.00 . A A . 92 LYS HD2 1 1 10 11179 1 1 57 LYS HD3 H 9.732 -4.247 3.775 1.00 . A A . 92 LYS HD3 1 1 10 11180 1 1 57 LYS HE2 H 10.106 -6.561 3.344 1.00 . A A . 92 LYS HE2 1 1 10 11181 1 1 57 LYS HE3 H 9.289 -5.889 1.940 1.00 . A A . 92 LYS HE3 1 1 10 11182 1 1 57 LYS HG2 H 10.400 -2.434 2.479 1.00 . A A . 92 LYS HG2 1 1 10 11183 1 1 57 LYS HG3 H 9.544 -3.485 1.361 1.00 . A A . 92 LYS HG3 1 1 10 11184 1 1 57 LYS HZ1 H 12.218 -6.299 2.096 1.00 . A A . 92 LYS HZ1 1 1 10 11185 1 1 57 LYS HZ2 H 11.294 -6.031 0.675 1.00 . A A . 92 LYS HZ2 1 1 10 11186 1 1 57 LYS HZ3 H 11.163 -7.453 1.520 1.00 . A A . 92 LYS HZ3 1 1 10 11187 1 1 57 LYS N N 10.443 -2.332 -0.897 1.00 . A A . 92 LYS N 1 1 10 11188 1 1 57 LYS NZ N 11.293 -6.427 1.634 1.00 . A A . 92 LYS NZ 1 1 10 11189 1 1 57 LYS O O 13.590 -0.853 -0.116 1.00 . A A . 92 LYS O 1 1 10 11190 1 1 58 PRO C C 14.432 -0.339 -2.947 1.00 . A A . 93 PRO C 1 1 10 11191 1 1 58 PRO CA C 14.495 -1.839 -2.588 1.00 . A A . 93 PRO CA 1 1 10 11192 1 1 58 PRO CB C 14.489 -2.668 -3.867 1.00 . A A . 93 PRO CB 1 1 10 11193 1 1 58 PRO CD C 12.662 -3.459 -2.569 1.00 . A A . 93 PRO CD 1 1 10 11194 1 1 58 PRO CG C 13.713 -3.891 -3.534 1.00 . A A . 93 PRO CG 1 1 10 11195 1 1 58 PRO HA H 15.398 -2.028 -2.027 1.00 . A A . 93 PRO HA 1 1 10 11196 1 1 58 PRO HB2 H 14.015 -2.093 -4.650 1.00 . A A . 93 PRO HB2 1 1 10 11197 1 1 58 PRO HB3 H 15.509 -2.888 -4.143 1.00 . A A . 93 PRO HB3 1 1 10 11198 1 1 58 PRO HD2 H 11.777 -3.163 -3.115 1.00 . A A . 93 PRO HD2 1 1 10 11199 1 1 58 PRO HD3 H 12.432 -4.257 -1.879 1.00 . A A . 93 PRO HD3 1 1 10 11200 1 1 58 PRO HG2 H 13.254 -4.305 -4.419 1.00 . A A . 93 PRO HG2 1 1 10 11201 1 1 58 PRO HG3 H 14.347 -4.624 -3.066 1.00 . A A . 93 PRO HG3 1 1 10 11202 1 1 58 PRO N N 13.290 -2.304 -1.863 1.00 . A A . 93 PRO N 1 1 10 11203 1 1 58 PRO O O 15.386 0.412 -2.697 1.00 . A A . 93 PRO O 1 1 10 11204 1 1 59 HIS C C 13.052 2.378 -2.654 1.00 . A A . 94 HIS C 1 1 10 11205 1 1 59 HIS CA C 13.140 1.516 -3.871 1.00 . A A . 94 HIS CA 1 1 10 11206 1 1 59 HIS CB C 11.962 1.803 -4.831 1.00 . A A . 94 HIS CB 1 1 10 11207 1 1 59 HIS CD2 C 13.450 1.686 -6.914 1.00 . A A . 94 HIS CD2 1 1 10 11208 1 1 59 HIS CE1 C 11.934 1.004 -8.331 1.00 . A A . 94 HIS CE1 1 1 10 11209 1 1 59 HIS CG C 12.271 1.545 -6.270 1.00 . A A . 94 HIS CG 1 1 10 11210 1 1 59 HIS H H 12.589 -0.543 -3.700 1.00 . A A . 94 HIS H 1 1 10 11211 1 1 59 HIS HA H 14.059 1.798 -4.366 1.00 . A A . 94 HIS HA 1 1 10 11212 1 1 59 HIS HB2 H 11.120 1.184 -4.559 1.00 . A A . 94 HIS HB2 1 1 10 11213 1 1 59 HIS HB3 H 11.684 2.840 -4.733 1.00 . A A . 94 HIS HB3 1 1 10 11214 1 1 59 HIS HD2 H 14.369 2.032 -6.460 1.00 . A A . 94 HIS HD2 1 1 10 11215 1 1 59 HIS HE1 H 11.474 0.674 -9.253 1.00 . A A . 94 HIS HE1 1 1 10 11216 1 1 59 HIS HE2 H 13.932 1.100 -8.873 1.00 . A A . 94 HIS HE2 1 1 10 11217 1 1 59 HIS N N 13.310 0.101 -3.520 1.00 . A A . 94 HIS N 1 1 10 11218 1 1 59 HIS ND1 N 11.308 1.125 -7.160 1.00 . A A . 94 HIS ND1 1 1 10 11219 1 1 59 HIS NE2 N 13.234 1.340 -8.223 1.00 . A A . 94 HIS NE2 1 1 10 11220 1 1 59 HIS O O 13.486 3.511 -2.671 1.00 . A A . 94 HIS O 1 1 10 11221 1 1 60 PHE C C 13.769 2.875 0.171 1.00 . A A . 95 PHE C 1 1 10 11222 1 1 60 PHE CA C 12.364 2.552 -0.348 1.00 . A A . 95 PHE CA 1 1 10 11223 1 1 60 PHE CB C 11.599 1.699 0.664 1.00 . A A . 95 PHE CB 1 1 10 11224 1 1 60 PHE CD1 C 9.968 3.260 1.702 1.00 . A A . 95 PHE CD1 1 1 10 11225 1 1 60 PHE CD2 C 11.704 2.400 3.054 1.00 . A A . 95 PHE CD2 1 1 10 11226 1 1 60 PHE CE1 C 9.482 3.975 2.757 1.00 . A A . 95 PHE CE1 1 1 10 11227 1 1 60 PHE CE2 C 11.225 3.118 4.131 1.00 . A A . 95 PHE CE2 1 1 10 11228 1 1 60 PHE CG C 11.082 2.466 1.836 1.00 . A A . 95 PHE CG 1 1 10 11229 1 1 60 PHE CZ C 10.110 3.910 3.982 1.00 . A A . 95 PHE CZ 1 1 10 11230 1 1 60 PHE H H 12.133 0.927 -1.675 1.00 . A A . 95 PHE H 1 1 10 11231 1 1 60 PHE HA H 11.828 3.478 -0.514 1.00 . A A . 95 PHE HA 1 1 10 11232 1 1 60 PHE HB2 H 10.763 1.221 0.181 1.00 . A A . 95 PHE HB2 1 1 10 11233 1 1 60 PHE HB3 H 12.264 0.935 1.034 1.00 . A A . 95 PHE HB3 1 1 10 11234 1 1 60 PHE HD1 H 9.463 3.314 0.750 1.00 . A A . 95 PHE HD1 1 1 10 11235 1 1 60 PHE HD2 H 12.576 1.772 3.150 1.00 . A A . 95 PHE HD2 1 1 10 11236 1 1 60 PHE HE1 H 8.608 4.587 2.604 1.00 . A A . 95 PHE HE1 1 1 10 11237 1 1 60 PHE HE2 H 11.726 3.053 5.085 1.00 . A A . 95 PHE HE2 1 1 10 11238 1 1 60 PHE HZ H 9.726 4.474 4.819 1.00 . A A . 95 PHE HZ 1 1 10 11239 1 1 60 PHE N N 12.484 1.843 -1.601 1.00 . A A . 95 PHE N 1 1 10 11240 1 1 60 PHE O O 14.008 3.962 0.688 1.00 . A A . 95 PHE O 1 1 10 11241 1 1 61 GLN C C 16.745 3.220 -0.450 1.00 . A A . 96 GLN C 1 1 10 11242 1 1 61 GLN CA C 16.106 2.117 0.346 1.00 . A A . 96 GLN CA 1 1 10 11243 1 1 61 GLN CB C 16.941 0.851 0.142 1.00 . A A . 96 GLN CB 1 1 10 11244 1 1 61 GLN CD C 17.661 -1.446 0.821 1.00 . A A . 96 GLN CD 1 1 10 11245 1 1 61 GLN CG C 16.684 -0.306 1.086 1.00 . A A . 96 GLN CG 1 1 10 11246 1 1 61 GLN H H 14.413 1.065 -0.394 1.00 . A A . 96 GLN H 1 1 10 11247 1 1 61 GLN HA H 16.189 2.420 1.373 1.00 . A A . 96 GLN HA 1 1 10 11248 1 1 61 GLN HB2 H 16.742 0.488 -0.855 1.00 . A A . 96 GLN HB2 1 1 10 11249 1 1 61 GLN HB3 H 17.985 1.118 0.203 1.00 . A A . 96 GLN HB3 1 1 10 11250 1 1 61 GLN HE21 H 17.703 -1.935 2.740 1.00 . A A . 96 GLN HE21 1 1 10 11251 1 1 61 GLN HE22 H 18.697 -2.878 1.697 1.00 . A A . 96 GLN HE22 1 1 10 11252 1 1 61 GLN HG2 H 16.799 0.039 2.103 1.00 . A A . 96 GLN HG2 1 1 10 11253 1 1 61 GLN HG3 H 15.677 -0.667 0.935 1.00 . A A . 96 GLN HG3 1 1 10 11254 1 1 61 GLN N N 14.697 1.926 -0.014 1.00 . A A . 96 GLN N 1 1 10 11255 1 1 61 GLN NE2 N 18.049 -2.156 1.850 1.00 . A A . 96 GLN NE2 1 1 10 11256 1 1 61 GLN O O 17.431 4.071 0.103 1.00 . A A . 96 GLN O 1 1 10 11257 1 1 61 GLN OE1 O 18.100 -1.654 -0.316 1.00 . A A . 96 GLN OE1 1 1 10 11258 1 1 62 GLN C C 16.557 5.553 -2.456 1.00 . A A . 97 GLN C 1 1 10 11259 1 1 62 GLN CA C 17.201 4.160 -2.560 1.00 . A A . 97 GLN CA 1 1 10 11260 1 1 62 GLN CB C 17.113 3.656 -3.993 1.00 . A A . 97 GLN CB 1 1 10 11261 1 1 62 GLN CD C 17.711 1.882 -5.668 1.00 . A A . 97 GLN CD 1 1 10 11262 1 1 62 GLN CG C 17.886 2.376 -4.254 1.00 . A A . 97 GLN CG 1 1 10 11263 1 1 62 GLN H H 16.004 2.511 -2.158 1.00 . A A . 97 GLN H 1 1 10 11264 1 1 62 GLN HA H 18.245 4.214 -2.298 1.00 . A A . 97 GLN HA 1 1 10 11265 1 1 62 GLN HB2 H 16.076 3.446 -4.221 1.00 . A A . 97 GLN HB2 1 1 10 11266 1 1 62 GLN HB3 H 17.476 4.419 -4.657 1.00 . A A . 97 GLN HB3 1 1 10 11267 1 1 62 GLN HE21 H 19.508 1.070 -5.640 1.00 . A A . 97 GLN HE21 1 1 10 11268 1 1 62 GLN HE22 H 18.609 0.888 -7.111 1.00 . A A . 97 GLN HE22 1 1 10 11269 1 1 62 GLN HG2 H 18.936 2.559 -4.077 1.00 . A A . 97 GLN HG2 1 1 10 11270 1 1 62 GLN HG3 H 17.537 1.614 -3.572 1.00 . A A . 97 GLN HG3 1 1 10 11271 1 1 62 GLN N N 16.560 3.199 -1.731 1.00 . A A . 97 GLN N 1 1 10 11272 1 1 62 GLN NE2 N 18.707 1.214 -6.190 1.00 . A A . 97 GLN NE2 1 1 10 11273 1 1 62 GLN O O 17.226 6.542 -2.189 1.00 . A A . 97 GLN O 1 1 10 11274 1 1 62 GLN OE1 O 16.669 2.094 -6.289 1.00 . A A . 97 GLN OE1 1 1 10 11275 1 1 63 LEU C C 14.106 7.483 -1.444 1.00 . A A . 98 LEU C 1 1 10 11276 1 1 63 LEU CA C 14.525 6.805 -2.753 1.00 . A A . 98 LEU CA 1 1 10 11277 1 1 63 LEU CB C 13.362 6.540 -3.642 1.00 . A A . 98 LEU CB 1 1 10 11278 1 1 63 LEU CD1 C 12.642 5.505 -5.761 1.00 . A A . 98 LEU CD1 1 1 10 11279 1 1 63 LEU CD2 C 14.074 7.485 -5.837 1.00 . A A . 98 LEU CD2 1 1 10 11280 1 1 63 LEU CG C 13.750 6.216 -5.083 1.00 . A A . 98 LEU CG 1 1 10 11281 1 1 63 LEU H H 14.800 4.738 -2.746 1.00 . A A . 98 LEU H 1 1 10 11282 1 1 63 LEU HA H 15.149 7.500 -3.296 1.00 . A A . 98 LEU HA 1 1 10 11283 1 1 63 LEU HB2 H 12.872 5.681 -3.210 1.00 . A A . 98 LEU HB2 1 1 10 11284 1 1 63 LEU HB3 H 12.689 7.385 -3.635 1.00 . A A . 98 LEU HB3 1 1 10 11285 1 1 63 LEU HD11 H 11.770 6.140 -5.756 1.00 . A A . 98 LEU HD11 1 1 10 11286 1 1 63 LEU HD12 H 12.446 4.593 -5.220 1.00 . A A . 98 LEU HD12 1 1 10 11287 1 1 63 LEU HD13 H 12.924 5.278 -6.778 1.00 . A A . 98 LEU HD13 1 1 10 11288 1 1 63 LEU HD21 H 13.221 8.144 -5.776 1.00 . A A . 98 LEU HD21 1 1 10 11289 1 1 63 LEU HD22 H 14.249 7.239 -6.875 1.00 . A A . 98 LEU HD22 1 1 10 11290 1 1 63 LEU HD23 H 14.944 7.965 -5.412 1.00 . A A . 98 LEU HD23 1 1 10 11291 1 1 63 LEU HG H 14.628 5.586 -5.095 1.00 . A A . 98 LEU HG 1 1 10 11292 1 1 63 LEU N N 15.287 5.589 -2.659 1.00 . A A . 98 LEU N 1 1 10 11293 1 1 63 LEU O O 14.209 8.705 -1.327 1.00 . A A . 98 LEU O 1 1 10 11294 1 1 64 PHE C C 13.917 7.294 1.987 1.00 . A A . 99 PHE C 1 1 10 11295 1 1 64 PHE CA C 13.079 7.405 0.730 1.00 . A A . 99 PHE CA 1 1 10 11296 1 1 64 PHE CB C 11.696 6.857 1.080 1.00 . A A . 99 PHE CB 1 1 10 11297 1 1 64 PHE CD1 C 10.579 8.494 -0.490 1.00 . A A . 99 PHE CD1 1 1 10 11298 1 1 64 PHE CD2 C 9.377 6.557 0.207 1.00 . A A . 99 PHE CD2 1 1 10 11299 1 1 64 PHE CE1 C 9.491 8.901 -1.227 1.00 . A A . 99 PHE CE1 1 1 10 11300 1 1 64 PHE CE2 C 8.293 6.966 -0.534 1.00 . A A . 99 PHE CE2 1 1 10 11301 1 1 64 PHE CG C 10.538 7.313 0.239 1.00 . A A . 99 PHE CG 1 1 10 11302 1 1 64 PHE CZ C 8.356 8.139 -1.252 1.00 . A A . 99 PHE CZ 1 1 10 11303 1 1 64 PHE H H 13.605 5.749 -0.522 1.00 . A A . 99 PHE H 1 1 10 11304 1 1 64 PHE HA H 12.947 8.448 0.500 1.00 . A A . 99 PHE HA 1 1 10 11305 1 1 64 PHE HB2 H 11.744 5.795 0.891 1.00 . A A . 99 PHE HB2 1 1 10 11306 1 1 64 PHE HB3 H 11.479 7.035 2.120 1.00 . A A . 99 PHE HB3 1 1 10 11307 1 1 64 PHE HD1 H 11.466 9.107 -0.490 1.00 . A A . 99 PHE HD1 1 1 10 11308 1 1 64 PHE HD2 H 9.323 5.641 0.781 1.00 . A A . 99 PHE HD2 1 1 10 11309 1 1 64 PHE HE1 H 9.511 9.819 -1.796 1.00 . A A . 99 PHE HE1 1 1 10 11310 1 1 64 PHE HE2 H 7.397 6.363 -0.553 1.00 . A A . 99 PHE HE2 1 1 10 11311 1 1 64 PHE HZ H 7.517 8.479 -1.839 1.00 . A A . 99 PHE HZ 1 1 10 11312 1 1 64 PHE N N 13.623 6.727 -0.454 1.00 . A A . 99 PHE N 1 1 10 11313 1 1 64 PHE O O 14.074 8.291 2.697 1.00 . A A . 99 PHE O 1 1 10 11314 1 1 65 LYS C C 15.949 4.622 3.459 1.00 . A A . 100 LYS C 1 1 10 11315 1 1 65 LYS CA C 15.182 5.937 3.497 1.00 . A A . 100 LYS CA 1 1 10 11316 1 1 65 LYS CB C 14.121 5.941 4.645 1.00 . A A . 100 LYS CB 1 1 10 11317 1 1 65 LYS CD C 13.450 5.709 7.037 1.00 . A A . 100 LYS CD 1 1 10 11318 1 1 65 LYS CE C 13.858 5.349 8.461 1.00 . A A . 100 LYS CE 1 1 10 11319 1 1 65 LYS CG C 14.622 5.689 6.055 1.00 . A A . 100 LYS CG 1 1 10 11320 1 1 65 LYS H H 14.502 5.422 1.580 1.00 . A A . 100 LYS H 1 1 10 11321 1 1 65 LYS HA H 15.871 6.752 3.663 1.00 . A A . 100 LYS HA 1 1 10 11322 1 1 65 LYS HB2 H 13.639 6.906 4.647 1.00 . A A . 100 LYS HB2 1 1 10 11323 1 1 65 LYS HB3 H 13.373 5.198 4.410 1.00 . A A . 100 LYS HB3 1 1 10 11324 1 1 65 LYS HD2 H 13.028 6.703 7.047 1.00 . A A . 100 LYS HD2 1 1 10 11325 1 1 65 LYS HD3 H 12.699 5.010 6.699 1.00 . A A . 100 LYS HD3 1 1 10 11326 1 1 65 LYS HE2 H 14.313 4.370 8.456 1.00 . A A . 100 LYS HE2 1 1 10 11327 1 1 65 LYS HE3 H 14.574 6.077 8.813 1.00 . A A . 100 LYS HE3 1 1 10 11328 1 1 65 LYS HG2 H 15.118 4.729 6.084 1.00 . A A . 100 LYS HG2 1 1 10 11329 1 1 65 LYS HG3 H 15.319 6.480 6.282 1.00 . A A . 100 LYS HG3 1 1 10 11330 1 1 65 LYS HZ1 H 12.959 5.087 10.348 1.00 . A A . 100 LYS HZ1 1 1 10 11331 1 1 65 LYS HZ2 H 11.977 4.632 9.074 1.00 . A A . 100 LYS HZ2 1 1 10 11332 1 1 65 LYS HZ3 H 12.220 6.266 9.399 1.00 . A A . 100 LYS HZ3 1 1 10 11333 1 1 65 LYS N N 14.511 6.157 2.234 1.00 . A A . 100 LYS N 1 1 10 11334 1 1 65 LYS NZ N 12.684 5.335 9.376 1.00 . A A . 100 LYS NZ 1 1 10 11335 1 1 65 LYS O O 17.099 4.594 3.038 1.00 . A A . 100 LYS O 1 1 10 11336 1 1 66 SER C C 14.794 1.438 4.772 1.00 . A A . 101 SER C 1 1 10 11337 1 1 66 SER CA C 15.735 2.190 3.878 1.00 . A A . 101 SER CA 1 1 10 11338 1 1 66 SER CB C 17.186 2.050 4.407 1.00 . A A . 101 SER CB 1 1 10 11339 1 1 66 SER H H 14.351 3.665 4.197 1.00 . A A . 101 SER H 1 1 10 11340 1 1 66 SER HA H 15.639 1.728 2.910 1.00 . A A . 101 SER HA 1 1 10 11341 1 1 66 SER HB2 H 17.827 2.752 3.894 1.00 . A A . 101 SER HB2 1 1 10 11342 1 1 66 SER HB3 H 17.203 2.257 5.467 1.00 . A A . 101 SER HB3 1 1 10 11343 1 1 66 SER HG H 18.377 0.545 4.822 1.00 . A A . 101 SER HG 1 1 10 11344 1 1 66 SER N N 15.262 3.552 3.855 1.00 . A A . 101 SER N 1 1 10 11345 1 1 66 SER O O 13.929 2.055 5.412 1.00 . A A . 101 SER O 1 1 10 11346 1 1 66 SER OG O 17.677 0.730 4.185 1.00 . A A . 101 SER OG 1 1 10 11347 1 1 67 LYS C C 14.701 -2.139 5.169 1.00 . A A . 102 LYS C 1 1 10 11348 1 1 67 LYS CA C 14.200 -0.782 5.588 1.00 . A A . 102 LYS CA 1 1 10 11349 1 1 67 LYS CB C 12.659 -0.653 5.360 1.00 . A A . 102 LYS CB 1 1 10 11350 1 1 67 LYS CD C 11.844 -2.745 6.582 1.00 . A A . 102 LYS CD 1 1 10 11351 1 1 67 LYS CE C 11.012 -3.281 7.742 1.00 . A A . 102 LYS CE 1 1 10 11352 1 1 67 LYS CG C 11.768 -1.233 6.477 1.00 . A A . 102 LYS CG 1 1 10 11353 1 1 67 LYS H H 15.680 -0.206 4.229 1.00 . A A . 102 LYS H 1 1 10 11354 1 1 67 LYS HA H 14.454 -0.617 6.624 1.00 . A A . 102 LYS HA 1 1 10 11355 1 1 67 LYS HB2 H 12.420 0.396 5.262 1.00 . A A . 102 LYS HB2 1 1 10 11356 1 1 67 LYS HB3 H 12.410 -1.148 4.433 1.00 . A A . 102 LYS HB3 1 1 10 11357 1 1 67 LYS HD2 H 11.478 -3.178 5.662 1.00 . A A . 102 LYS HD2 1 1 10 11358 1 1 67 LYS HD3 H 12.876 -3.028 6.725 1.00 . A A . 102 LYS HD3 1 1 10 11359 1 1 67 LYS HE2 H 9.998 -2.925 7.638 1.00 . A A . 102 LYS HE2 1 1 10 11360 1 1 67 LYS HE3 H 11.018 -4.360 7.705 1.00 . A A . 102 LYS HE3 1 1 10 11361 1 1 67 LYS HG2 H 12.085 -0.815 7.422 1.00 . A A . 102 LYS HG2 1 1 10 11362 1 1 67 LYS HG3 H 10.746 -0.941 6.286 1.00 . A A . 102 LYS HG3 1 1 10 11363 1 1 67 LYS HZ1 H 12.511 -3.141 9.197 1.00 . A A . 102 LYS HZ1 1 1 10 11364 1 1 67 LYS HZ2 H 10.965 -3.266 9.822 1.00 . A A . 102 LYS HZ2 1 1 10 11365 1 1 67 LYS HZ3 H 11.482 -1.809 9.171 1.00 . A A . 102 LYS HZ3 1 1 10 11366 1 1 67 LYS N N 14.951 0.147 4.783 1.00 . A A . 102 LYS N 1 1 10 11367 1 1 67 LYS NZ N 11.524 -2.842 9.056 1.00 . A A . 102 LYS NZ 1 1 10 11368 1 1 67 LYS O O 15.207 -2.911 5.972 1.00 . A A . 102 LYS O 1 1 10 11369 1 1 68 GLY C C 14.328 -4.799 3.604 1.00 . A A . 103 GLY C 1 1 10 11370 1 1 68 GLY CA C 15.131 -3.585 3.255 1.00 . A A . 103 GLY CA 1 1 10 11371 1 1 68 GLY H H 14.145 -1.732 3.285 1.00 . A A . 103 GLY H 1 1 10 11372 1 1 68 GLY HA2 H 15.136 -3.465 2.182 1.00 . A A . 103 GLY HA2 1 1 10 11373 1 1 68 GLY HA3 H 16.146 -3.728 3.593 1.00 . A A . 103 GLY HA3 1 1 10 11374 1 1 68 GLY N N 14.608 -2.380 3.857 1.00 . A A . 103 GLY N 1 1 10 11375 1 1 68 GLY O O 13.482 -5.228 2.819 1.00 . A A . 103 GLY O 1 1 10 11376 1 1 69 ASN C C 13.841 -7.614 4.367 1.00 . A A . 104 ASN C 1 1 10 11377 1 1 69 ASN CA C 13.958 -6.494 5.373 1.00 . A A . 104 ASN CA 1 1 10 11378 1 1 69 ASN CB C 12.605 -6.139 5.996 1.00 . A A . 104 ASN CB 1 1 10 11379 1 1 69 ASN CG C 12.042 -7.235 6.887 1.00 . A A . 104 ASN CG 1 1 10 11380 1 1 69 ASN H H 15.291 -4.871 5.320 1.00 . A A . 104 ASN H 1 1 10 11381 1 1 69 ASN HA H 14.616 -6.841 6.156 1.00 . A A . 104 ASN HA 1 1 10 11382 1 1 69 ASN HB2 H 12.717 -5.246 6.592 1.00 . A A . 104 ASN HB2 1 1 10 11383 1 1 69 ASN HB3 H 11.896 -5.947 5.204 1.00 . A A . 104 ASN HB3 1 1 10 11384 1 1 69 ASN HD21 H 12.972 -6.472 8.464 1.00 . A A . 104 ASN HD21 1 1 10 11385 1 1 69 ASN HD22 H 12.036 -7.885 8.753 1.00 . A A . 104 ASN HD22 1 1 10 11386 1 1 69 ASN N N 14.599 -5.323 4.788 1.00 . A A . 104 ASN N 1 1 10 11387 1 1 69 ASN ND2 N 12.382 -7.192 8.152 1.00 . A A . 104 ASN ND2 1 1 10 11388 1 1 69 ASN O O 12.756 -7.948 3.889 1.00 . A A . 104 ASN O 1 1 10 11389 1 1 69 ASN OD1 O 11.290 -8.101 6.444 1.00 . A A . 104 ASN OD1 1 1 10 11390 1 1 70 TYR C C 15.117 -10.442 3.963 1.00 . A A . 105 TYR C 1 1 10 11391 1 1 70 TYR CA C 15.011 -9.231 3.086 1.00 . A A . 105 TYR CA 1 1 10 11392 1 1 70 TYR CB C 16.196 -9.102 2.117 1.00 . A A . 105 TYR CB 1 1 10 11393 1 1 70 TYR CD1 C 15.191 -7.547 0.398 1.00 . A A . 105 TYR CD1 1 1 10 11394 1 1 70 TYR CD2 C 17.084 -6.784 1.624 1.00 . A A . 105 TYR CD2 1 1 10 11395 1 1 70 TYR CE1 C 15.131 -6.344 -0.271 1.00 . A A . 105 TYR CE1 1 1 10 11396 1 1 70 TYR CE2 C 17.024 -5.572 0.965 1.00 . A A . 105 TYR CE2 1 1 10 11397 1 1 70 TYR CG C 16.168 -7.792 1.353 1.00 . A A . 105 TYR CG 1 1 10 11398 1 1 70 TYR CZ C 16.047 -5.359 0.019 1.00 . A A . 105 TYR CZ 1 1 10 11399 1 1 70 TYR H H 15.801 -7.736 4.321 1.00 . A A . 105 TYR H 1 1 10 11400 1 1 70 TYR HA H 14.079 -9.266 2.541 1.00 . A A . 105 TYR HA 1 1 10 11401 1 1 70 TYR HB2 H 17.119 -9.147 2.677 1.00 . A A . 105 TYR HB2 1 1 10 11402 1 1 70 TYR HB3 H 16.168 -9.912 1.402 1.00 . A A . 105 TYR HB3 1 1 10 11403 1 1 70 TYR HD1 H 14.476 -8.324 0.175 1.00 . A A . 105 TYR HD1 1 1 10 11404 1 1 70 TYR HD2 H 17.853 -6.952 2.364 1.00 . A A . 105 TYR HD2 1 1 10 11405 1 1 70 TYR HE1 H 14.367 -6.176 -1.016 1.00 . A A . 105 TYR HE1 1 1 10 11406 1 1 70 TYR HE2 H 17.743 -4.798 1.186 1.00 . A A . 105 TYR HE2 1 1 10 11407 1 1 70 TYR HH H 16.836 -3.912 -0.966 1.00 . A A . 105 TYR HH 1 1 10 11408 1 1 70 TYR N N 14.965 -8.117 3.975 1.00 . A A . 105 TYR N 1 1 10 11409 1 1 70 TYR O O 16.217 -10.809 4.399 1.00 . A A . 105 TYR O 1 1 10 11410 1 1 70 TYR OH O 15.970 -4.151 -0.620 1.00 . A A . 105 TYR OH 1 1 10 11411 1 1 71 ASP C C 14.763 -13.227 4.950 1.00 . A A . 106 ASP C 1 1 10 11412 1 1 71 ASP CA C 13.828 -12.083 5.253 1.00 . A A . 106 ASP CA 1 1 10 11413 1 1 71 ASP CB C 12.381 -12.572 5.349 1.00 . A A . 106 ASP CB 1 1 10 11414 1 1 71 ASP CG C 12.219 -13.683 6.361 1.00 . A A . 106 ASP CG 1 1 10 11415 1 1 71 ASP H H 13.147 -10.661 3.852 1.00 . A A . 106 ASP H 1 1 10 11416 1 1 71 ASP HA H 14.111 -11.682 6.215 1.00 . A A . 106 ASP HA 1 1 10 11417 1 1 71 ASP HB2 H 11.741 -11.752 5.638 1.00 . A A . 106 ASP HB2 1 1 10 11418 1 1 71 ASP HB3 H 12.071 -12.942 4.383 1.00 . A A . 106 ASP HB3 1 1 10 11419 1 1 71 ASP N N 13.959 -10.993 4.291 1.00 . A A . 106 ASP N 1 1 10 11420 1 1 71 ASP O O 14.769 -13.776 3.847 1.00 . A A . 106 ASP O 1 1 10 11421 1 1 71 ASP OD1 O 12.220 -13.403 7.569 1.00 . A A . 106 ASP OD1 1 1 10 11422 1 1 71 ASP OD2 O 12.080 -14.856 5.967 1.00 . A A . 106 ASP OD2 1 1 10 11423 1 1 72 GLU C C 16.155 -15.652 6.749 1.00 . A A . 107 GLU C 1 1 10 11424 1 1 72 GLU CA C 16.544 -14.557 5.788 1.00 . A A . 107 GLU CA 1 1 10 11425 1 1 72 GLU CB C 17.935 -14.004 6.116 1.00 . A A . 107 GLU CB 1 1 10 11426 1 1 72 GLU CD C 19.092 -15.205 4.262 1.00 . A A . 107 GLU CD 1 1 10 11427 1 1 72 GLU CG C 19.067 -14.937 5.744 1.00 . A A . 107 GLU CG 1 1 10 11428 1 1 72 GLU H H 15.518 -13.061 6.762 1.00 . A A . 107 GLU H 1 1 10 11429 1 1 72 GLU HA H 16.533 -14.936 4.777 1.00 . A A . 107 GLU HA 1 1 10 11430 1 1 72 GLU HB2 H 18.071 -13.077 5.579 1.00 . A A . 107 GLU HB2 1 1 10 11431 1 1 72 GLU HB3 H 17.990 -13.805 7.175 1.00 . A A . 107 GLU HB3 1 1 10 11432 1 1 72 GLU HG2 H 20.006 -14.488 6.036 1.00 . A A . 107 GLU HG2 1 1 10 11433 1 1 72 GLU HG3 H 18.932 -15.874 6.264 1.00 . A A . 107 GLU HG3 1 1 10 11434 1 1 72 GLU N N 15.578 -13.533 5.906 1.00 . A A . 107 GLU N 1 1 10 11435 1 1 72 GLU O O 15.713 -16.732 6.298 1.00 . A A . 107 GLU O 1 1 10 11436 1 1 72 GLU OXT O 16.179 -15.402 7.974 1.00 . A A . 107 GLU OXT 1 1 10 11437 1 1 72 GLU OE1 O 19.657 -14.393 3.517 1.00 . A A . 107 GLU OE1 1 1 10 11438 1 1 72 GLU OE2 O 18.528 -16.209 3.817 1.00 . A A . 107 GLU OE2 1 1 10 11439 2 2 1 ZN ZN ZN -7.510 0.296 -4.444 1.00 . B A . 201 ZN ZN 1 1 10 11440 3 2 1 ZN ZN ZN 9.915 -0.178 -6.578 1.00 . C A . 202 ZN ZN 1 1 stop_ save_
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