NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | in_dress | stage | program | type | subtype | item_count |
373665 | 1dx7 | 4303 | cing | recoord | dress | 4-filtered-FRED | STAR | entry | full | 456 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1dx7 # This FRED archive file contains, for PDB entry <1dx7>: # # - Coordinates and sequence information from the PDB mmCIF file # - NMR restraints from the PDB MR file # # In this file, the coordinates and NMR restraints share the same atom names, # and in this way can differ from the data deposited at the wwPDB. To achieve # this aim, the NMR restraints were parsed from their original format files, and # the coordinates and NMR restraints information were subsequently harmonized. # # Due to the complexity of this harmonization process and the filtering process # used in creating these files, the NMR restraints information in these files # may differ significantly from that in the originally deposited file. Other # modifications could have occurred to the NMR restraints information, or data # could have been lost because of parsing or conversion errors. The PDB file # remains the authoritative reference for the atomic coordinates and the # originally deposited restraints files remain the primary reference for these # data. # # This file is generated at the BioMagResBank (BMRB) in collaboration with the # PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and # the CMBI/IMM group at the Radboud University of Nijmegen. # # Several software packages were used to produce this file: # # - Wattos (BMRB and CMBI/IMM). # - FormatConverter and NMRStarExport (PDBe). # - CCPN framework (http://www.ccpn.ac.uk/). # # More information about this process can be found in the references below. # Please cite the original reference for this PDB entry. # # JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL # Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED # containing converted and filtered sets of experimental NMR restraints and # coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12. # # WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL # Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy: # development of a software pipeline. Proteins 59, 687-696. # # JF Doreleijers, W Vranken, C Penkett, J Lin, CF Schulte, G Vuister, G Vriend, # JL Markley, EL Ulrich. BioMagResBank database `NMR Restraints Grid` with # curated sets of experimental NMR restraints for over 4,000 protein and nucleic # acid PDB entries. (in preparation) save_Conversion_project_for_entry_Name_1 _Study_list.Sf_category study_list _Study_list.Entry_ID 1 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project for entry 1" NMR . 1 1 stop_ save_ save_originalConstraints_1 _Entry.Sf_category entry_information _Entry.ID 1 _Entry.Title "Data for entry 1" _Entry.NMR_STAR_version 3.1.0.8 _Entry.Experimental_method NMR _Entry.Details . save_ save_assembly_1dx7 _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 1dx7 _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 5453.10 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 $LIGHT_HARVESTING_PROTEIN_B_875_BETA_CHAIN A . 1 1 stop_ save_ save_LIGHT_HARVESTING_PROTEIN_B_875_BETA_CHAIN _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "LIGHT HARVESTING PROTEIN B 875 BETA CHAIN" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code ADKSDLGYTGLTDEQAQELHSVYMSGLWLFSAVAIVAHLAVYIWRPWF _Entity.Number_of_monomers 48 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 ALA . 1 1 2 ASP . 1 1 3 LYS . 1 1 4 SER . 1 1 5 ASP . 1 1 6 LEU . 1 1 7 GLY . 1 1 8 TYR . 1 1 9 THR . 1 1 10 GLY . 1 1 11 LEU . 1 1 12 THR . 1 1 13 ASP . 1 1 14 GLU . 1 1 15 GLN . 1 1 16 ALA . 1 1 17 GLN . 1 1 18 GLU . 1 1 19 LEU . 1 1 20 HIS . 1 1 21 SER . 1 1 22 VAL . 1 1 23 TYR . 1 1 24 MET . 1 1 25 SER . 1 1 26 GLY . 1 1 27 LEU . 1 1 28 TRP . 1 1 29 LEU . 1 1 30 PHE . 1 1 31 SER . 1 1 32 ALA . 1 1 33 VAL . 1 1 34 ALA . 1 1 35 ILE . 1 1 36 VAL . 1 1 37 ALA . 1 1 38 HIS . 1 1 39 LEU . 1 1 40 ALA . 1 1 41 VAL . 1 1 42 TYR . 1 1 43 ILE . 1 1 44 TRP . 1 1 45 ARG . 1 1 46 PRO . 1 1 47 TRP . 1 1 48 PHE . 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 ALA 1 1 1 1 ASP 2 2 1 1 LYS 3 3 1 1 SER 4 4 1 1 ASP 5 5 1 1 LEU 6 6 1 1 GLY 7 7 1 1 TYR 8 8 1 1 THR 9 9 1 1 GLY 10 10 1 1 LEU 11 11 1 1 THR 12 12 1 1 ASP 13 13 1 1 GLU 14 14 1 1 GLN 15 15 1 1 ALA 16 16 1 1 GLN 17 17 1 1 GLU 18 18 1 1 LEU 19 19 1 1 HIS 20 20 1 1 SER 21 21 1 1 VAL 22 22 1 1 TYR 23 23 1 1 MET 24 24 1 1 SER 25 25 1 1 GLY 26 26 1 1 LEU 27 27 1 1 TRP 28 28 1 1 LEU 29 29 1 1 PHE 30 30 1 1 SER 31 31 1 1 ALA 32 32 1 1 VAL 33 33 1 1 ALA 34 34 1 1 ILE 35 35 1 1 VAL 36 36 1 1 ALA 37 37 1 1 HIS 38 38 1 1 LEU 39 39 1 1 ALA 40 40 1 1 VAL 41 41 1 1 TYR 42 42 1 1 ILE 43 43 1 1 TRP 44 44 1 1 ARG 45 45 1 1 PRO 46 46 1 1 TRP 47 47 1 1 PHE 48 48 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 121 1 . . . 1 1 122 1 . . . 1 1 123 1 . . . 1 1 124 1 . . . 1 1 125 1 . . . 1 1 126 1 . . . 1 1 127 1 . . . 1 1 128 1 . . . 1 1 129 1 . . . 1 1 130 1 . . . 1 1 131 1 . . . 1 1 132 1 . . . 1 1 133 1 . . . 1 1 134 1 . . . 1 1 135 1 . . . 1 1 136 1 . . . 1 1 137 1 . . . 1 1 138 1 . . . 1 1 139 1 . . . 1 1 140 1 . . . 1 1 141 1 . . . 1 1 142 1 . . . 1 1 143 1 . . . 1 1 144 1 . . . 1 1 145 1 . . . 1 1 146 1 . . . 1 1 147 1 . . . 1 1 148 1 . . . 1 1 149 1 . . . 1 1 150 1 . . . 1 1 151 1 . . . 1 1 152 1 . . . 1 1 153 1 . . . 1 1 154 1 . . . 1 1 155 1 . . . 1 1 156 1 . . . 1 1 157 1 . . . 1 1 158 1 . . . 1 1 159 1 . . . 1 1 160 1 . . . 1 1 161 1 . . . 1 1 162 1 . . . 1 1 163 1 . . . 1 1 164 1 . . . 1 1 165 1 . . . 1 1 166 1 . . . 1 1 167 1 . . . 1 1 168 1 . . . 1 1 169 1 . . . 1 1 170 1 . . . 1 1 171 1 . . . 1 1 172 1 . . . 1 1 173 1 . . . 1 1 174 1 . . . 1 1 175 1 . . . 1 1 176 1 . . . 1 1 177 1 . . . 1 1 178 1 . . . 1 1 179 1 . . . 1 1 180 1 . . . 1 1 181 1 . . . 1 1 182 1 . . . 1 1 183 1 . . . 1 1 184 1 . . . 1 1 185 1 . . . 1 1 186 1 . . . 1 1 187 1 . . . 1 1 188 1 . . . 1 1 189 1 . . . 1 1 190 1 . . . 1 1 191 1 . . . 1 1 192 1 . . . 1 1 193 1 . . . 1 1 194 1 . . . 1 1 195 1 . . . 1 1 196 1 . . . 1 1 197 1 . . . 1 1 198 1 . . . 1 1 199 1 . . . 1 1 200 1 . . . 1 1 201 1 . . . 1 1 202 1 . . . 1 1 203 1 . . . 1 1 204 1 . . . 1 1 205 1 . . . 1 1 206 1 . . . 1 1 207 1 . . . 1 1 208 1 . . . 1 1 209 1 . . . 1 1 210 1 . . . 1 1 211 1 . . . 1 1 212 1 . . . 1 1 213 1 . . . 1 1 214 1 . . . 1 1 215 1 . . . 1 1 216 1 . . . 1 1 217 1 . . . 1 1 218 1 . . . 1 1 219 1 . . . 1 1 220 1 . . . 1 1 221 1 . . . 1 1 222 1 . . . 1 1 223 1 . . . 1 1 224 1 . . . 1 1 225 1 . . . 1 1 226 1 . . . 1 1 227 1 . . . 1 1 228 1 . . . 1 1 229 1 . . . 1 1 230 1 . . . 1 1 231 1 . . . 1 1 232 1 . . . 1 1 233 1 . . . 1 1 234 1 . . . 1 1 235 1 . . . 1 1 236 1 . . . 1 1 237 1 . . . 1 1 238 1 . . . 1 1 239 1 . . . 1 1 240 1 . . . 1 1 241 1 . . . 1 1 242 1 . . . 1 1 243 1 . . . 1 1 244 1 . . . 1 1 245 1 . . . 1 1 246 1 . . . 1 1 247 1 . . . 1 1 248 1 . . . 1 1 249 1 . . . 1 1 250 1 . . . 1 1 251 1 . . . 1 1 252 1 . . . 1 1 253 1 . . . 1 1 254 1 . . . 1 1 255 1 . . . 1 1 256 1 . . . 1 1 257 1 . . . 1 1 258 1 . . . 1 1 259 1 . . . 1 1 260 1 . . . 1 1 261 1 . . . 1 1 262 1 . . . 1 1 263 1 . . . 1 1 264 1 . . . 1 1 265 1 . . . 1 1 266 1 . . . 1 1 267 1 . . . 1 1 268 1 . . . 1 1 269 1 . . . 1 1 270 1 . . . 1 1 271 1 . . . 1 1 272 1 . . . 1 1 273 1 . . . 1 1 274 1 . . . 1 1 275 1 . . . 1 1 276 1 . . . 1 1 277 1 . . . 1 1 278 1 . . . 1 1 279 1 . . . 1 1 280 1 . . . 1 1 281 1 . . . 1 1 282 1 . . . 1 1 283 1 . . . 1 1 284 1 . . . 1 1 285 1 . . . 1 1 286 1 . . . 1 1 287 1 . . . 1 1 288 1 . . . 1 1 289 1 . . . 1 1 290 1 . . . 1 1 291 1 . . . 1 1 292 1 . . . 1 1 293 1 . . . 1 1 294 1 . . . 1 1 295 1 . . . 1 1 296 1 . . . 1 1 297 1 . . . 1 1 298 1 . . . 1 1 299 1 . . . 1 1 300 1 . . . 1 1 301 1 . . . 1 1 302 1 . . . 1 1 303 1 . . . 1 1 304 1 . . . 1 1 305 1 . . . 1 1 306 1 . . . 1 1 307 1 . . . 1 1 308 1 . . . 1 1 309 1 . . . 1 1 310 1 . . . 1 1 311 1 . . . 1 1 312 1 . . . 1 1 313 1 . . . 1 1 314 1 . . . 1 1 315 1 . . . 1 1 316 1 . . . 1 1 317 1 . . . 1 1 318 1 . . . 1 1 319 1 . . . 1 1 320 1 . . . 1 1 321 1 . . . 1 1 322 1 . . . 1 1 323 1 . . . 1 1 324 1 . . . 1 1 325 1 . . . 1 1 326 1 . . . 1 1 327 1 . . . 1 1 328 1 . . . 1 1 329 1 . . . 1 1 330 1 . . . 1 1 331 1 . . . 1 1 332 1 . . . 1 1 333 1 . . . 1 1 334 1 . . . 1 1 335 1 . . . 1 1 336 1 . . . 1 1 337 1 . . . 1 1 338 1 . . . 1 1 339 1 . . . 1 1 340 1 . . . 1 1 341 1 . . . 1 1 342 1 . . . 1 1 343 1 . . . 1 1 344 1 . . . 1 1 345 1 . . . 1 1 346 1 . . . 1 1 347 1 . . . 1 1 348 1 . . . 1 1 349 1 . . . 1 1 350 1 . . . 1 1 351 1 . . . 1 1 352 1 . . . 1 1 353 1 . . . 1 1 354 1 . . . 1 1 355 1 . . . 1 1 356 1 . . . 1 1 357 1 . . . 1 1 358 1 . . . 1 1 359 1 . . . 1 1 360 1 . . . 1 1 361 1 . . . 1 1 362 1 . . . 1 1 363 1 . . . 1 1 364 1 . . . 1 1 365 1 . . . 1 1 366 1 . . . 1 1 367 1 . . . 1 1 368 1 . . . 1 1 369 1 . . . 1 1 370 1 . . . 1 1 371 1 . . . 1 1 372 1 . . . 1 1 373 1 . . . 1 1 374 1 . . . 1 1 375 1 . . . 1 1 376 1 . . . 1 1 377 1 . . . 1 1 378 1 . . . 1 1 379 1 . . . 1 1 380 1 . . . 1 1 381 1 . . . 1 1 382 1 . . . 1 1 383 1 . . . 1 1 384 1 . . . 1 1 385 1 . . . 1 1 386 1 . . . 1 1 387 1 . . . 1 1 388 1 . . . 1 1 389 1 . . . 1 1 390 1 . . . 1 1 391 1 . . . 1 1 392 1 . . . 1 1 393 1 . . . 1 1 394 1 . . . 1 1 395 1 . . . 1 1 396 1 . . . 1 1 397 1 . . . 1 1 398 1 . . . 1 1 399 1 . . . 1 1 400 1 . . . 1 1 401 1 . . . 1 1 402 1 . . . 1 1 403 1 . . . 1 1 404 1 . . . 1 1 405 1 . . . 1 1 406 1 . . . 1 1 407 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 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 3 LYS H . 3 . HN 1 1 1 1 2 1 1 4 SER H . 4 . HN 1 1 2 1 1 1 1 4 SER H . 4 . HN 1 1 2 1 2 1 1 5 ASP H . 5 . HN 1 1 3 1 1 1 1 5 ASP H . 5 . HN 1 1 3 1 2 1 1 6 LEU H . 6 . HN 1 1 4 1 1 1 1 6 LEU H . 6 . HN 1 1 4 1 2 1 1 7 GLY H . 7 . HN 1 1 5 1 1 1 1 8 TYR H . 8 . HN 1 1 5 1 2 1 1 9 THR H . 9 . HN 1 1 6 1 1 1 1 11 LEU H . 11 . HN 1 1 6 1 2 1 1 12 THR H . 12 . HN 1 1 7 1 1 1 1 12 THR H . 12 . HN 1 1 7 1 2 1 1 13 ASP H . 13 . HN 1 1 8 1 1 1 1 15 GLN H . 15 . HN 1 1 8 1 2 1 1 16 ALA H . 16 . HN 1 1 9 1 1 1 1 16 ALA H . 16 . HN 1 1 9 1 2 1 1 17 GLN H . 17 . HN 1 1 10 1 1 1 1 17 GLN H . 17 . HN 1 1 10 1 2 1 1 18 GLU H . 18 . HN 1 1 11 1 1 1 1 21 SER H . 21 . HN 1 1 11 1 2 1 1 22 VAL H . 22 . HN 1 1 12 1 1 1 1 24 MET H . 24 . HN 1 1 12 1 2 1 1 25 SER H . 25 . HN 1 1 13 1 1 1 1 26 GLY H . 26 . HN 1 1 13 1 2 1 1 27 LEU H . 27 . HN 1 1 14 1 1 1 1 27 LEU H . 27 . HN 1 1 14 1 2 1 1 28 TRP H . 28 . HN 1 1 15 1 1 1 1 29 LEU H . 29 . HN 1 1 15 1 2 1 1 30 PHE H . 30 . HN 1 1 16 1 1 1 1 30 PHE H . 30 . HN 1 1 16 1 2 1 1 31 SER H . 31 . HN 1 1 17 1 1 1 1 34 ALA H . 34 . HN 1 1 17 1 2 1 1 35 ILE H . 35 . HN 1 1 18 1 1 1 1 35 ILE H . 35 . HN 1 1 18 1 2 1 1 36 VAL H . 36 . HN 1 1 19 1 1 1 1 36 VAL H . 36 . HN 1 1 19 1 2 1 1 37 ALA H . 37 . HN 1 1 20 1 1 1 1 37 ALA H . 37 . HN 1 1 20 1 2 1 1 38 HIS H . 38 . HN 1 1 21 1 1 1 1 38 HIS H . 38 . HN 1 1 21 1 2 1 1 39 LEU H . 39 . HN 1 1 22 1 1 1 1 39 LEU H . 39 . HN 1 1 22 1 2 1 1 40 ALA H . 40 . HN 1 1 23 1 1 1 1 40 ALA H . 40 . HN 1 1 23 1 2 1 1 41 VAL H . 41 . HN 1 1 24 1 1 1 1 41 VAL H . 41 . HN 1 1 24 1 2 1 1 42 TYR H . 42 . HN 1 1 25 1 1 1 1 42 TYR H . 42 . HN 1 1 25 1 2 1 1 43 ILE H . 43 . HN 1 1 26 1 1 1 1 43 ILE H . 43 . HN 1 1 26 1 2 1 1 44 TRP H . 44 . HN 1 1 27 1 1 1 1 44 TRP H . 44 . HN 1 1 27 1 2 1 1 45 ARG H . 45 . HN 1 1 28 1 1 1 1 47 TRP H . 47 . HN 1 1 28 1 2 1 1 48 PHE H . 48 . HN 1 1 29 1 1 1 1 2 ASP HA . 2 . HA 1 1 29 1 2 1 1 3 LYS H . 3 . HN 1 1 30 1 1 1 1 3 LYS HA . 3 . HA 1 1 30 1 2 1 1 4 SER H . 4 . HN 1 1 31 1 1 1 1 4 SER HA . 4 . HA 1 1 31 1 2 1 1 5 ASP H . 5 . HN 1 1 32 1 1 1 1 5 ASP HA . 5 . HA 1 1 32 1 2 1 1 6 LEU H . 6 . HN 1 1 33 1 1 1 1 7 GLY QA . 7 . HA+ 1 1 33 1 2 1 1 8 TYR H . 8 . HN 1 1 34 1 1 1 1 8 TYR HA . 8 . HA 1 1 34 1 2 1 1 9 THR H . 9 . HN 1 1 35 1 1 1 1 10 GLY QA . 10 . HA+ 1 1 35 1 2 1 1 11 LEU H . 11 . HN 1 1 36 1 1 1 1 11 LEU HA . 11 . HA 1 1 36 1 2 1 1 12 THR H . 12 . HN 1 1 37 1 1 1 1 12 THR HA . 12 . HA 1 1 37 1 2 1 1 13 ASP H . 13 . HN 1 1 38 1 1 1 1 13 ASP HA . 13 . HA 1 1 38 1 2 1 1 14 GLU H . 14 . HN 1 1 39 1 1 1 1 14 GLU HA . 14 . HA 1 1 39 1 2 1 1 15 GLN H . 15 . HN 1 1 40 1 1 1 1 15 GLN HA . 15 . HA 1 1 40 1 2 1 1 16 ALA H . 16 . HN 1 1 41 1 1 1 1 16 ALA HA . 16 . HA 1 1 41 1 2 1 1 17 GLN H . 17 . HN 1 1 42 1 1 1 1 17 GLN HA . 17 . HA 1 1 42 1 2 1 1 18 GLU H . 18 . HN 1 1 43 1 1 1 1 18 GLU HA . 18 . HA 1 1 43 1 2 1 1 19 LEU H . 19 . HN 1 1 44 1 1 1 1 19 LEU HA . 19 . HA 1 1 44 1 2 1 1 20 HIS H . 20 . HN 1 1 45 1 1 1 1 20 HIS HA . 20 . HA 1 1 45 1 2 1 1 21 SER H . 21 . HN 1 1 46 1 1 1 1 21 SER HA . 21 . HA 1 1 46 1 2 1 1 22 VAL H . 22 . HN 1 1 47 1 1 1 1 22 VAL HA . 22 . HA 1 1 47 1 2 1 1 23 TYR H . 23 . HN 1 1 48 1 1 1 1 23 TYR HA . 23 . HA 1 1 48 1 2 1 1 24 MET H . 24 . HN 1 1 49 1 1 1 1 24 MET HA . 24 . HA 1 1 49 1 2 1 1 25 SER H . 25 . HN 1 1 50 1 1 1 1 26 GLY QA . 26 . HA+ 1 1 50 1 2 1 1 27 LEU H . 27 . HN 1 1 51 1 1 1 1 27 LEU HA . 27 . HA 1 1 51 1 2 1 1 28 TRP H . 28 . HN 1 1 52 1 1 1 1 28 TRP HA . 28 . HA 1 1 52 1 2 1 1 29 LEU H . 29 . HN 1 1 53 1 1 1 1 29 LEU HA . 29 . HA 1 1 53 1 2 1 1 30 PHE H . 30 . HN 1 1 54 1 1 1 1 30 PHE HA . 30 . HA 1 1 54 1 2 1 1 31 SER H . 31 . HN 1 1 55 1 1 1 1 31 SER HA . 31 . HA 1 1 55 1 2 1 1 32 ALA H . 32 . HN 1 1 56 1 1 1 1 32 ALA HA . 32 . HA 1 1 56 1 2 1 1 33 VAL H . 33 . HN 1 1 57 1 1 1 1 33 VAL HA . 33 . HA 1 1 57 1 2 1 1 34 ALA H . 34 . HN 1 1 58 1 1 1 1 34 ALA HA . 34 . HA 1 1 58 1 2 1 1 35 ILE H . 35 . HN 1 1 59 1 1 1 1 35 ILE HA . 35 . HA 1 1 59 1 2 1 1 36 VAL H . 36 . HN 1 1 60 1 1 1 1 36 VAL HA . 36 . HA 1 1 60 1 2 1 1 37 ALA H . 37 . HN 1 1 61 1 1 1 1 39 LEU HA . 39 . HA 1 1 61 1 2 1 1 40 ALA H . 40 . HN 1 1 62 1 1 1 1 40 ALA HA . 40 . HA 1 1 62 1 2 1 1 41 VAL H . 41 . HN 1 1 63 1 1 1 1 41 VAL HA . 41 . HA 1 1 63 1 2 1 1 42 TYR H . 42 . HN 1 1 64 1 1 1 1 42 TYR HA . 42 . HA 1 1 64 1 2 1 1 43 ILE H . 43 . HN 1 1 65 1 1 1 1 44 TRP HA . 44 . HA 1 1 65 1 2 1 1 45 ARG H . 45 . HN 1 1 66 1 1 1 1 47 TRP H . 47 . HN 1 1 66 1 2 1 1 48 PHE HA . 48 . HA 1 1 67 1 1 1 1 2 ASP QB . 2 . HB+ 1 1 67 1 2 1 1 3 LYS H . 3 . HN 1 1 68 1 1 1 1 3 LYS HB3 . 3 . HB1 1 1 68 1 2 1 1 4 SER H . 4 . HN 1 1 69 1 1 1 1 3 LYS HB2 . 3 . HB2 1 1 69 1 2 1 1 4 SER H . 4 . HN 1 1 70 1 1 1 1 4 SER QB . 4 . HB+ 1 1 70 1 2 1 1 5 ASP H . 5 . HN 1 1 71 1 1 1 1 5 ASP QB . 5 . HB+ 1 1 71 1 2 1 1 6 LEU H . 6 . HN 1 1 72 1 1 1 1 6 LEU HB3 . 6 . HB1 1 1 72 1 2 1 1 7 GLY H . 7 . HN 1 1 73 1 1 1 1 6 LEU HB2 . 6 . HB2 1 1 73 1 2 1 1 7 GLY H . 7 . HN 1 1 74 1 1 1 1 6 LEU HG . 6 . HG 1 1 74 1 2 1 1 7 GLY H . 7 . HN 1 1 75 1 1 1 1 6 LEU QD . 6 . HD++ 1 1 75 1 2 1 1 7 GLY H . 7 . HN 1 1 76 1 1 1 1 8 TYR QB . 8 . HB+ 1 1 76 1 2 1 1 9 THR H . 9 . HN 1 1 77 1 1 1 1 8 TYR QD . 8 . HD+ 1 1 77 1 2 1 1 9 THR H . 9 . HN 1 1 78 1 1 1 1 8 TYR QD . 8 . HD+ 1 1 78 1 2 1 1 9 THR HG1 . 9 . HG+ 1 1 78 1 2 1 1 9 THR MG . 9 . HG+ 1 1 79 1 1 1 1 9 THR HB . 9 . HB 1 1 79 1 2 1 1 10 GLY H . 10 . HN 1 1 80 1 1 1 1 9 THR HG1 . 9 . HG+ 1 1 80 1 1 1 1 9 THR MG . 9 . HG+ 1 1 80 1 2 1 1 10 GLY H . 10 . HN 1 1 81 1 1 1 1 11 LEU QB . 11 . HB+ 1 1 81 1 2 1 1 12 THR H . 12 . HN 1 1 82 1 1 1 1 11 LEU HG . 11 . HG 1 1 82 1 2 1 1 12 THR H . 12 . HN 1 1 83 1 1 1 1 11 LEU QD . 11 . HD++ 1 1 83 1 2 1 1 12 THR H . 12 . HN 1 1 84 1 1 1 1 12 THR HB . 12 . HB 1 1 84 1 2 1 1 13 ASP H . 13 . HN 1 1 85 1 1 1 1 12 THR HG1 . 12 . HG+ 1 1 85 1 1 1 1 12 THR MG . 12 . HG+ 1 1 85 1 2 1 1 13 ASP H . 13 . HN 1 1 86 1 1 1 1 13 ASP HA . 13 . HA 1 1 86 1 2 1 1 14 GLU HA . 14 . HA 1 1 87 1 1 1 1 13 ASP HB3 . 13 . HB1 1 1 87 1 2 1 1 14 GLU H . 14 . HN 1 1 88 1 1 1 1 13 ASP HB2 . 13 . HB2 1 1 88 1 2 1 1 14 GLU H . 14 . HN 1 1 89 1 1 1 1 14 GLU HB3 . 14 . HB1 1 1 89 1 2 1 1 15 GLN H . 15 . HN 1 1 90 1 1 1 1 14 GLU HB2 . 14 . HB2 1 1 90 1 2 1 1 15 GLN H . 15 . HN 1 1 91 1 1 1 1 14 GLU QG . 14 . HG+ 1 1 91 1 2 1 1 15 GLN H . 15 . HN 1 1 92 1 1 1 1 15 GLN H . 15 . HN 1 1 92 1 2 1 1 16 ALA MB . 16 . HB+ 1 1 93 1 1 1 1 15 GLN QB . 15 . HB+ 1 1 93 1 2 1 1 16 ALA H . 16 . HN 1 1 94 1 1 1 1 16 ALA MB . 16 . HB+ 1 1 94 1 2 1 1 17 GLN H . 17 . HN 1 1 95 1 1 1 1 15 GLN QB . 15 . HB+ 1 1 95 1 2 1 1 16 ALA MB . 16 . HB+ 1 1 96 1 1 1 1 15 GLN QG . 15 . HG+ 1 1 96 1 2 1 1 16 ALA MB . 16 . HB+ 1 1 97 1 1 1 1 17 GLN QB . 17 . HB+ 1 1 97 1 2 1 1 18 GLU H . 18 . HN 1 1 98 1 1 1 1 17 GLN QG . 17 . HG+ 1 1 98 1 2 1 1 18 GLU H . 18 . HN 1 1 99 1 1 1 1 18 GLU HB3 . 18 . HB1 1 1 99 1 2 1 1 19 LEU H . 19 . HN 1 1 100 1 1 1 1 18 GLU HB2 . 18 . HB2 1 1 100 1 2 1 1 19 LEU H . 19 . HN 1 1 101 1 1 1 1 19 LEU HB3 . 19 . HB1 1 1 101 1 2 1 1 20 HIS H . 20 . HN 1 1 102 1 1 1 1 19 LEU HB2 . 19 . HB2 1 1 102 1 2 1 1 20 HIS H . 20 . HN 1 1 103 1 1 1 1 19 LEU QD . 19 . HD++ 1 1 103 1 2 1 1 20 HIS H . 20 . HN 1 1 104 1 1 1 1 19 LEU QD . 19 . HD++ 1 1 104 1 2 1 1 20 HIS HD1 . 20 . HD1 1 1 105 1 1 1 1 20 HIS HB3 . 20 . HB1 1 1 105 1 2 1 1 21 SER H . 21 . HN 1 1 106 1 1 1 1 20 HIS HB2 . 20 . HB2 1 1 106 1 2 1 1 21 SER H . 21 . HN 1 1 107 1 1 1 1 21 SER QB . 21 . HB+ 1 1 107 1 2 1 1 22 VAL H . 22 . HN 1 1 108 1 1 1 1 22 VAL HB . 22 . HB 1 1 108 1 2 1 1 23 TYR H . 23 . HN 1 1 109 1 1 1 1 22 VAL MG1 . 22 . HG1+ 1 1 109 1 2 1 1 23 TYR H . 23 . HN 1 1 110 1 1 1 1 22 VAL MG2 . 22 . HG2+ 1 1 110 1 2 1 1 23 TYR H . 23 . HN 1 1 111 1 1 1 1 21 SER HA . 21 . HA 1 1 111 1 2 1 1 22 VAL QG . 22 . HG++ 1 1 112 1 1 1 1 21 SER QB . 21 . HB+ 1 1 112 1 2 1 1 22 VAL QG . 22 . HG++ 1 1 113 1 1 1 1 21 SER HB3 . 21 . HB1 1 1 113 1 2 1 1 22 VAL HA . 22 . HA 1 1 114 1 1 1 1 21 SER HB2 . 21 . HB2 1 1 114 1 2 1 1 22 VAL HA . 22 . HA 1 1 115 1 1 1 1 22 VAL QG . 22 . HG++ 1 1 115 1 2 1 1 23 TYR HA . 23 . HA 1 1 116 1 1 1 1 23 TYR QB . 23 . HB+ 1 1 116 1 2 1 1 24 MET H . 24 . HN 1 1 117 1 1 1 1 23 TYR QD . 23 . HD+ 1 1 117 1 2 1 1 24 MET H . 24 . HN 1 1 118 1 1 1 1 23 TYR QD . 23 . HD+ 1 1 118 1 2 1 1 24 MET HA . 24 . HA 1 1 119 1 1 1 1 22 VAL QG . 22 . HG++ 1 1 119 1 2 1 1 23 TYR QD . 23 . HD+ 1 1 120 1 1 1 1 24 MET QB . 24 . HB+ 1 1 120 1 2 1 1 25 SER H . 25 . HN 1 1 121 1 1 1 1 25 SER QB . 25 . HB+ 1 1 121 1 2 1 1 26 GLY H . 26 . HN 1 1 122 1 1 1 1 26 GLY H . 26 . HN 1 1 122 1 2 1 1 27 LEU QB . 27 . HB+ 1 1 123 1 1 1 1 27 LEU HB3 . 27 . HB1 1 1 123 1 2 1 1 28 TRP H . 28 . HN 1 1 124 1 1 1 1 27 LEU HB2 . 27 . HB2 1 1 124 1 2 1 1 28 TRP H . 28 . HN 1 1 125 1 1 1 1 27 LEU QD . 27 . HD++ 1 1 125 1 2 1 1 28 TRP H . 28 . HN 1 1 126 1 1 1 1 26 GLY QA . 26 . HA+ 1 1 126 1 2 1 1 27 LEU QB . 27 . HB+ 1 1 127 1 1 1 1 28 TRP QB . 28 . HB+ 1 1 127 1 2 1 1 29 LEU H . 29 . HN 1 1 128 1 1 1 1 29 LEU HG . 29 . HG 1 1 128 1 2 1 1 30 PHE H . 30 . HN 1 1 129 1 1 1 1 29 LEU QD . 29 . HD++ 1 1 129 1 2 1 1 30 PHE H . 30 . HN 1 1 130 1 1 1 1 29 LEU H . 29 . HN 1 1 130 1 2 1 1 30 PHE QB . 30 . HB+ 1 1 131 1 1 1 1 30 PHE QB . 30 . HB+ 1 1 131 1 2 1 1 31 SER H . 31 . HN 1 1 132 1 1 1 1 31 SER QB . 31 . HB+ 1 1 132 1 2 1 1 32 ALA H . 32 . HN 1 1 133 1 1 1 1 32 ALA MB . 32 . HB+ 1 1 133 1 2 1 1 33 VAL H . 33 . HN 1 1 134 1 1 1 1 33 VAL HB . 33 . HB 1 1 134 1 2 1 1 34 ALA H . 34 . HN 1 1 135 1 1 1 1 34 ALA MB . 34 . HB+ 1 1 135 1 2 1 1 35 ILE H . 35 . HN 1 1 136 1 1 1 1 34 ALA MB . 34 . HB+ 1 1 136 1 2 1 1 35 ILE HB . 35 . HB 1 1 137 1 1 1 1 34 ALA MB . 34 . HB+ 1 1 137 1 2 1 1 35 ILE MD . 35 . HD1+ 1 1 138 1 1 1 1 35 ILE HB . 35 . HB 1 1 138 1 2 1 1 36 VAL H . 36 . HN 1 1 139 1 1 1 1 33 VAL QG . 33 . HG++ 1 1 139 1 1 1 1 35 ILE MG . 35 . HG2+ 1 1 139 1 2 1 1 36 VAL H . 36 . HN 1 1 140 1 1 1 1 35 ILE HB . 35 . HB 1 1 140 1 2 1 1 36 VAL QG . 36 . HG++ 1 1 141 1 1 1 1 35 ILE QG . 35 . HG1+ 1 1 141 1 2 1 1 36 VAL QG . 36 . HG++ 1 1 142 1 1 1 1 36 VAL HB . 36 . HB 1 1 142 1 2 1 1 37 ALA H . 37 . HN 1 1 143 1 1 1 1 36 VAL QG . 36 . HG++ 1 1 143 1 2 1 1 37 ALA H . 37 . HN 1 1 144 1 1 1 1 37 ALA MB . 37 . HB+ 1 1 144 1 2 1 1 38 HIS H . 38 . HN 1 1 145 1 1 1 1 38 HIS HB3 . 38 . HB1 1 1 145 1 2 1 1 39 LEU H . 39 . HN 1 1 146 1 1 1 1 38 HIS HB2 . 38 . HB2 1 1 146 1 2 1 1 39 LEU H . 39 . HN 1 1 147 1 1 1 1 36 VAL HA . 36 . HA 1 1 147 1 2 1 1 39 LEU QD . 39 . HD++ 1 1 148 1 1 1 1 39 LEU QB . 39 . HB+ 1 1 148 1 2 1 1 40 ALA H . 40 . HN 1 1 149 1 1 1 1 39 LEU HG . 39 . HG 1 1 149 1 2 1 1 40 ALA H . 40 . HN 1 1 150 1 1 1 1 39 LEU QD . 39 . HD++ 1 1 150 1 2 1 1 40 ALA H . 40 . HN 1 1 151 1 1 1 1 40 ALA MB . 40 . HB+ 1 1 151 1 2 1 1 41 VAL H . 41 . HN 1 1 152 1 1 1 1 41 VAL HB . 41 . HB 1 1 152 1 2 1 1 42 TYR H . 42 . HN 1 1 153 1 1 1 1 41 VAL MG1 . 41 . HG1+ 1 1 153 1 2 1 1 42 TYR H . 42 . HN 1 1 154 1 1 1 1 41 VAL MG2 . 41 . HG2+ 1 1 154 1 2 1 1 42 TYR H . 42 . HN 1 1 155 1 1 1 1 40 ALA MB . 40 . HB+ 1 1 155 1 2 1 1 41 VAL HA . 41 . HA 1 1 156 1 1 1 1 40 ALA MB . 40 . HB+ 1 1 156 1 2 1 1 41 VAL QG . 41 . HG++ 1 1 157 1 1 1 1 36 VAL QG . 36 . HG++ 1 1 157 1 1 1 1 41 VAL QG . 41 . HG++ 1 1 157 1 2 1 1 40 ALA HA . 40 . HA 1 1 158 1 1 1 1 42 TYR QD . 42 . HD+ 1 1 158 1 2 1 1 43 ILE H . 43 . HN 1 1 159 1 1 1 1 43 ILE HB . 43 . HB 1 1 159 1 2 1 1 44 TRP HD1 . 44 . HD+ 1 1 160 1 1 1 1 43 ILE MG . 43 . HG2+ 1 1 160 1 2 1 1 44 TRP HD1 . 44 . HD+ 1 1 161 1 1 1 1 43 ILE MG . 43 . HG2+ 1 1 161 1 2 1 1 44 TRP HA . 44 . HA 1 1 162 1 1 1 1 42 TYR HA . 42 . HA 1 1 162 1 2 1 1 45 ARG QB . 45 . HB+ 1 1 163 1 1 1 1 45 ARG HA . 45 . HA 1 1 163 1 2 1 1 46 PRO QD . 46 . HD+ 1 1 164 1 1 1 1 47 TRP H . 47 . HN 1 1 164 1 2 1 1 48 PHE QB . 48 . HB+ 1 1 165 1 1 1 1 3 LYS HA . 3 . HA 1 1 165 1 2 1 1 6 LEU H . 6 . HN 1 1 166 1 1 1 1 4 SER HA . 4 . HA 1 1 166 1 2 1 1 7 GLY H . 7 . HN 1 1 167 1 1 1 1 5 ASP HA . 5 . HA 1 1 167 1 2 1 1 8 TYR H . 8 . HN 1 1 168 1 1 1 1 5 ASP HA . 5 . HA 1 1 168 1 2 1 1 8 TYR QD . 8 . HD+ 1 1 169 1 1 1 1 5 ASP HA . 5 . HA 1 1 169 1 2 1 1 8 TYR QB . 8 . HB+ 1 1 170 1 1 1 1 8 TYR HA . 8 . HA 1 1 170 1 2 1 1 11 LEU QB . 11 . HB+ 1 1 171 1 1 1 1 8 TYR HA . 8 . HA 1 1 171 1 2 1 1 11 LEU HG . 11 . HG 1 1 172 1 1 1 1 8 TYR HA . 8 . HA 1 1 172 1 2 1 1 11 LEU QD . 11 . HD++ 1 1 173 1 1 1 1 10 GLY QA . 10 . HA+ 1 1 173 1 2 1 1 13 ASP QB . 13 . HB+ 1 1 174 1 1 1 1 8 TYR QD . 8 . HD+ 1 1 174 1 2 1 1 11 LEU QD . 11 . HD++ 1 1 175 1 1 1 1 8 TYR QD . 8 . HD+ 1 1 175 1 2 1 1 11 LEU QB . 11 . HB+ 1 1 176 1 1 1 1 8 TYR QD . 8 . HD+ 1 1 176 1 2 1 1 11 LEU HG . 11 . HG 1 1 177 1 1 1 1 12 THR HA . 12 . HA 1 1 177 1 2 1 1 15 GLN QG . 15 . HG+ 1 1 178 1 1 1 1 8 TYR QD . 8 . HD+ 1 1 178 1 2 1 1 12 THR HG1 . 12 . HG+ 1 1 178 1 2 1 1 12 THR MG . 12 . HG+ 1 1 179 1 1 1 1 8 TYR QE . 8 . HE+ 1 1 179 1 2 1 1 12 THR HG1 . 12 . HG+ 1 1 179 1 2 1 1 12 THR MG . 12 . HG+ 1 1 180 1 1 1 1 13 ASP HA . 13 . HA 1 1 180 1 2 1 1 16 ALA MB . 16 . HB+ 1 1 181 1 1 1 1 11 LEU HG . 11 . HG 1 1 181 1 2 1 1 14 GLU H . 14 . HN 1 1 182 1 1 1 1 14 GLU HA . 14 . HA 1 1 182 1 2 1 1 17 GLN QG . 17 . HG+ 1 1 183 1 1 1 1 12 THR HG1 . 12 . HG+ 1 1 183 1 1 1 1 12 THR MG . 12 . HG+ 1 1 183 1 2 1 1 15 GLN QB . 15 . HB+ 1 1 184 1 1 1 1 13 ASP HA . 13 . HA 1 1 184 1 2 1 1 16 ALA H . 16 . HN 1 1 185 1 1 1 1 14 GLU QB . 14 . HB+ 1 1 185 1 2 1 1 17 GLN H . 17 . HN 1 1 186 1 1 1 1 14 GLU QG . 14 . HG+ 1 1 186 1 2 1 1 17 GLN H . 17 . HN 1 1 187 1 1 1 1 17 GLN H . 17 . HN 1 1 187 1 2 1 1 20 HIS QB . 20 . HB+ 1 1 188 1 1 1 1 17 GLN HA . 17 . HA 1 1 188 1 2 1 1 20 HIS QB . 20 . HB+ 1 1 189 1 1 1 1 15 GLN HA . 15 . HA 1 1 189 1 2 1 1 18 GLU H . 18 . HN 1 1 190 1 1 1 1 15 GLN QB . 15 . HB+ 1 1 190 1 2 1 1 18 GLU H . 18 . HN 1 1 191 1 1 1 1 19 LEU HA . 19 . HA 1 1 191 1 2 1 1 22 VAL QG . 22 . HG++ 1 1 192 1 1 1 1 20 HIS HA . 20 . HA 1 1 192 1 2 1 1 23 TYR QB . 23 . HB+ 1 1 193 1 1 1 1 16 ALA MB . 16 . HB+ 1 1 193 1 2 1 1 20 HIS HD1 . 20 . HD+ 1 1 193 1 2 1 1 20 HIS HD2 . 20 . HD+ 1 1 194 1 1 1 1 17 GLN HA . 17 . HA 1 1 194 1 2 1 1 20 HIS H . 20 . HN 1 1 195 1 1 1 1 17 GLN QB . 17 . HB+ 1 1 195 1 2 1 1 20 HIS H . 20 . HN 1 1 196 1 1 1 1 17 GLN QG . 17 . HG+ 1 1 196 1 2 1 1 20 HIS H . 20 . HN 1 1 197 1 1 1 1 20 HIS HA . 20 . HA 1 1 197 1 2 1 1 23 TYR H . 23 . HN 1 1 198 1 1 1 1 20 HIS HA . 20 . HA 1 1 198 1 2 1 1 23 TYR QD . 23 . HD+ 1 1 199 1 1 1 1 23 TYR QD . 23 . HD+ 1 1 199 1 2 1 1 27 LEU QB . 27 . HB+ 1 1 200 1 1 1 1 23 TYR QD . 23 . HD+ 1 1 200 1 2 1 1 27 LEU QD . 27 . HD++ 1 1 201 1 1 1 1 23 TYR QE . 23 . HE+ 1 1 201 1 2 1 1 27 LEU QD . 27 . HD++ 1 1 202 1 1 1 1 26 GLY QA . 26 . HA+ 1 1 202 1 2 1 1 29 LEU QB . 29 . HB+ 1 1 203 1 1 1 1 26 GLY QA . 26 . HA+ 1 1 203 1 2 1 1 29 LEU HG . 29 . HG 1 1 204 1 1 1 1 26 GLY QA . 26 . HA+ 1 1 204 1 2 1 1 29 LEU QD . 29 . HD++ 1 1 205 1 1 1 1 24 MET HA . 24 . HA 1 1 205 1 2 1 1 27 LEU H . 27 . HN 1 1 206 1 1 1 1 28 TRP HA . 28 . HA 1 1 206 1 2 1 1 31 SER QB . 31 . HB+ 1 1 207 1 1 1 1 29 LEU HA . 29 . HA 1 1 207 1 2 1 1 32 ALA MB . 32 . HB+ 1 1 208 1 1 1 1 30 PHE HA . 30 . HA 1 1 208 1 2 1 1 33 VAL HB . 33 . HB 1 1 209 1 1 1 1 30 PHE HA . 30 . HA 1 1 209 1 2 1 1 33 VAL QG . 33 . HG++ 1 1 210 1 1 1 1 28 TRP HA . 28 . HA 1 1 210 1 2 1 1 31 SER H . 31 . HN 1 1 211 1 1 1 1 31 SER HA . 31 . HA 1 1 211 1 2 1 1 34 ALA MB . 34 . HB+ 1 1 212 1 1 1 1 31 SER QB . 31 . HB+ 1 1 212 1 2 1 1 34 ALA MB . 34 . HB+ 1 1 213 1 1 1 1 29 LEU HA . 29 . HA 1 1 213 1 2 1 1 32 ALA H . 32 . HN 1 1 214 1 1 1 1 29 LEU QD . 29 . HD++ 1 1 214 1 2 1 1 32 ALA H . 32 . HN 1 1 215 1 1 1 1 32 ALA HA . 32 . HA 1 1 215 1 2 1 1 35 ILE HB . 35 . HB 1 1 216 1 1 1 1 32 ALA HA . 32 . HA 1 1 216 1 2 1 1 35 ILE MG . 35 . HG2+ 1 1 217 1 1 1 1 33 VAL HA . 33 . HA 1 1 217 1 2 1 1 36 VAL HB . 36 . HB 1 1 218 1 1 1 1 33 VAL HA . 33 . HA 1 1 218 1 2 1 1 36 VAL QG . 36 . HG++ 1 1 219 1 1 1 1 33 VAL HA . 33 . HA 1 1 219 1 2 1 1 37 ALA H . 37 . HN 1 1 220 1 1 1 1 33 VAL QG . 33 . HG++ 1 1 220 1 2 1 1 37 ALA MB . 37 . HB+ 1 1 221 1 1 1 1 34 ALA HA . 34 . HA 1 1 221 1 2 1 1 37 ALA MB . 37 . HB+ 1 1 222 1 1 1 1 32 ALA HA . 32 . HA 1 1 222 1 2 1 1 35 ILE H . 35 . HN 1 1 223 1 1 1 1 35 ILE HA . 35 . HA 1 1 223 1 2 1 1 38 HIS QB . 38 . HB+ 1 1 224 1 1 1 1 33 VAL HA . 33 . HA 1 1 224 1 2 1 1 36 VAL H . 36 . HN 1 1 225 1 1 1 1 33 VAL HB . 33 . HB 1 1 225 1 2 1 1 36 VAL H . 36 . HN 1 1 226 1 1 1 1 36 VAL HA . 36 . HA 1 1 226 1 2 1 1 39 LEU QB . 39 . HB+ 1 1 227 1 1 1 1 36 VAL HA . 36 . HA 1 1 227 1 2 1 1 39 LEU HG . 39 . HG 1 1 228 1 1 1 1 34 ALA HA . 34 . HA 1 1 228 1 2 1 1 37 ALA H . 37 . HN 1 1 229 1 1 1 1 35 ILE HA . 35 . HA 1 1 229 1 2 1 1 38 HIS H . 38 . HN 1 1 230 1 1 1 1 35 ILE MG . 35 . HG2+ 1 1 230 1 2 1 1 38 HIS H . 38 . HN 1 1 231 1 1 1 1 38 HIS HA . 38 . HA 1 1 231 1 2 1 1 41 VAL QG . 41 . HG++ 1 1 232 1 1 1 1 38 HIS HA . 38 . HA 1 1 232 1 2 1 1 41 VAL HB . 41 . HB 1 1 233 1 1 1 1 35 ILE MG . 35 . HG2+ 1 1 233 1 2 1 1 38 HIS HD1 . 38 . HD+ 1 1 233 1 2 1 1 38 HIS HD2 . 38 . HD+ 1 1 234 1 1 1 1 39 LEU HA . 39 . HA 1 1 234 1 2 1 1 42 TYR QB . 42 . HB+ 1 1 235 1 1 1 1 40 ALA HA . 40 . HA 1 1 235 1 2 1 1 43 ILE HB . 43 . HB 1 1 236 1 1 1 1 40 ALA HA . 40 . HA 1 1 236 1 2 1 1 43 ILE QG . 43 . HG1+ 1 1 237 1 1 1 1 40 ALA HA . 40 . HA 1 1 237 1 2 1 1 43 ILE MD . 43 . HD1+ 1 1 238 1 1 1 1 38 HIS HA . 38 . HA 1 1 238 1 2 1 1 41 VAL H . 41 . HN 1 1 239 1 1 1 1 39 LEU HA . 39 . HA 1 1 239 1 2 1 1 42 TYR QD . 42 . HD+ 1 1 240 1 1 1 1 39 LEU QD . 39 . HD++ 1 1 240 1 2 1 1 42 TYR QD . 42 . HD+ 1 1 241 1 1 1 1 40 ALA HA . 40 . HA 1 1 241 1 2 1 1 43 ILE H . 43 . HN 1 1 242 1 1 1 1 40 ALA MB . 40 . HB+ 1 1 242 1 2 1 1 43 ILE MG . 43 . HG2+ 1 1 243 1 1 1 1 40 ALA MB . 40 . HB+ 1 1 243 1 2 1 1 43 ILE MD . 43 . HD1+ 1 1 244 1 1 1 1 41 VAL HA . 41 . HA 1 1 244 1 2 1 1 44 TRP H . 44 . HN 1 1 245 1 1 1 1 41 VAL HA . 41 . HA 1 1 245 1 2 1 1 44 TRP QB . 44 . HB+ 1 1 246 1 1 1 1 41 VAL HA . 41 . HA 1 1 246 1 2 1 1 44 TRP HD1 . 44 . HD+ 1 1 247 1 1 1 1 44 TRP HA . 44 . HA 1 1 247 1 2 1 1 47 TRP HD1 . 47 . HD+ 1 1 248 1 1 1 1 8 TYR QD . 8 . HD+ 1 1 248 1 2 1 1 15 GLN QG . 15 . HG+ 1 1 249 1 1 1 1 8 TYR QD . 8 . HD+ 1 1 249 1 2 1 1 15 GLN QB . 15 . HB+ 1 1 250 1 1 1 1 5 ASP HA . 5 . HA 1 1 250 1 2 1 1 9 THR H . 9 . HN 1 1 251 1 1 1 1 6 LEU HA . 6 . HA 1 1 251 1 2 1 1 9 THR HB . 9 . HB 1 1 252 1 1 1 1 6 LEU HA . 6 . HA 1 1 252 1 2 1 1 9 THR HG1 . 9 . HG+ 1 1 252 1 2 1 1 9 THR MG . 9 . HG+ 1 1 253 1 1 1 1 8 TYR QB . 8 . HB+ 1 1 253 1 2 1 1 12 THR H . 12 . HN 1 1 254 1 1 1 1 15 GLN QB . 15 . HB+ 1 1 254 1 2 1 1 19 LEU QD . 19 . HD++ 1 1 255 1 1 1 1 11 LEU QD . 11 . HD++ 1 1 255 1 2 1 1 15 GLN QB . 15 . HB+ 1 1 256 1 1 1 1 11 LEU HA . 11 . HA 1 1 256 1 2 1 1 15 GLN H . 15 . HN 1 1 257 1 1 1 1 12 THR HA . 12 . HA 1 1 257 1 2 1 1 16 ALA H . 16 . HN 1 1 258 1 1 1 1 12 THR HG1 . 12 . HG+ 1 1 258 1 1 1 1 12 THR MG . 12 . HG+ 1 1 258 1 2 1 1 16 ALA H . 16 . HN 1 1 259 1 1 1 1 18 GLU H . 18 . HN 1 1 259 1 2 1 1 22 VAL QG . 22 . HG++ 1 1 260 1 1 1 1 18 GLU QB . 18 . HB+ 1 1 260 1 2 1 1 22 VAL QG . 22 . HG++ 1 1 261 1 1 1 1 18 GLU QG . 18 . HG+ 1 1 261 1 2 1 1 22 VAL QG . 22 . HG++ 1 1 262 1 1 1 1 20 HIS HD1 . 20 . HD1 1 1 262 1 2 1 1 24 MET QB . 24 . HB+ 1 1 263 1 1 1 1 19 LEU QD . 19 . HD++ 1 1 263 1 2 1 1 23 TYR QD . 23 . HD+ 1 1 264 1 1 1 1 19 LEU QD . 19 . HD++ 1 1 264 1 2 1 1 23 TYR QE . 23 . HE+ 1 1 265 1 1 1 1 23 TYR H . 23 . HN 1 1 265 1 2 1 1 27 LEU QD . 27 . HD++ 1 1 266 1 1 1 1 23 TYR HA . 23 . HA 1 1 266 1 2 1 1 27 LEU QD . 27 . HD++ 1 1 267 1 1 1 1 19 LEU HA . 19 . HA 1 1 267 1 2 1 1 23 TYR H . 23 . HN 1 1 268 1 1 1 1 20 HIS QB . 20 . HB+ 1 1 268 1 2 1 1 24 MET H . 24 . HN 1 1 269 1 1 1 1 28 TRP HD1 . 28 . HD+ 1 1 269 1 2 1 1 32 ALA MB . 32 . HB+ 1 1 270 1 1 1 1 30 PHE HA . 30 . HA 1 1 270 1 2 1 1 34 ALA MB . 34 . HB+ 1 1 271 1 1 1 1 29 LEU HG . 29 . HG 1 1 271 1 2 1 1 33 VAL H . 33 . HN 1 1 272 1 1 1 1 29 LEU QB . 29 . HB+ 1 1 272 1 2 1 1 33 VAL QG . 33 . HG++ 1 1 273 1 1 1 1 29 LEU HG . 29 . HG 1 1 273 1 2 1 1 33 VAL QG . 33 . HG++ 1 1 274 1 1 1 1 29 LEU HA . 29 . HA 1 1 274 1 2 1 1 33 VAL QG . 33 . HG++ 1 1 275 1 1 1 1 30 PHE QB . 30 . HB+ 1 1 275 1 2 1 1 34 ALA H . 34 . HN 1 1 276 1 1 1 1 32 ALA HA . 32 . HA 1 1 276 1 2 1 1 36 VAL H . 36 . HN 1 1 277 1 1 1 1 34 ALA MB . 34 . HB+ 1 1 277 1 2 1 1 37 ALA H . 37 . HN 1 1 278 1 1 1 1 33 VAL QG . 33 . HG++ 1 1 278 1 2 1 1 37 ALA H . 37 . HN 1 1 279 1 1 1 1 34 ALA MB . 34 . HB+ 1 1 279 1 2 1 1 38 HIS H . 38 . HN 1 1 280 1 1 1 1 34 ALA MB . 34 . HB+ 1 1 280 1 2 1 1 38 HIS HE1 . 38 . HE1 1 1 281 1 1 1 1 36 VAL QG . 36 . HG++ 1 1 281 1 2 1 1 38 HIS H . 38 . HN 1 1 282 1 1 1 1 36 VAL HA . 36 . HA 1 1 282 1 2 1 1 38 HIS H . 38 . HN 1 1 283 1 1 1 1 35 ILE HA . 35 . HA 1 1 283 1 2 1 1 39 LEU H . 39 . HN 1 1 284 1 1 1 1 36 VAL HA . 36 . HA 1 1 284 1 2 1 1 40 ALA H . 40 . HN 1 1 285 1 1 1 1 36 VAL QG . 36 . HG++ 1 1 285 1 2 1 1 40 ALA H . 40 . HN 1 1 286 1 1 1 1 37 ALA MB . 37 . HB+ 1 1 286 1 2 1 1 41 VAL QG . 41 . HG++ 1 1 287 1 1 1 1 38 HIS HA . 38 . HA 1 1 287 1 2 1 1 42 TYR QD . 42 . HD+ 1 1 288 1 1 1 1 39 LEU HA . 39 . HA 1 1 288 1 2 1 1 43 ILE H . 43 . HN 1 1 289 1 1 1 1 40 ALA HA . 40 . HA 1 1 289 1 2 1 1 44 TRP H . 44 . HN 1 1 290 1 1 1 1 40 ALA HA . 40 . HA 1 1 290 1 2 1 1 44 TRP HD1 . 44 . HD+ 1 1 291 1 1 1 1 40 ALA MB . 40 . HB+ 1 1 291 1 2 1 1 44 TRP HD1 . 44 . HD+ 1 1 292 1 1 1 1 41 VAL QG . 41 . HG++ 1 1 292 1 2 1 1 45 ARG QD . 45 . HD+ 1 1 293 1 1 1 1 5 ASP H . 5 . HN 1 1 293 1 2 1 1 5 ASP HA . 5 . HA 1 1 294 1 1 1 1 6 LEU H . 6 . HN 1 1 294 1 2 1 1 6 LEU HA . 6 . HA 1 1 295 1 1 1 1 8 TYR H . 8 . HN 1 1 295 1 2 1 1 8 TYR HA . 8 . HA 1 1 296 1 1 1 1 9 THR H . 9 . HN 1 1 296 1 2 1 1 9 THR HA . 9 . HA 1 1 297 1 1 1 1 11 LEU H . 11 . HN 1 1 297 1 2 1 1 11 LEU HA . 11 . HA 1 1 298 1 1 1 1 12 THR H . 12 . HN 1 1 298 1 2 1 1 12 THR HA . 12 . HA 1 1 299 1 1 1 1 13 ASP H . 13 . HN 1 1 299 1 2 1 1 13 ASP HA . 13 . HA 1 1 300 1 1 1 1 14 GLU H . 14 . HN 1 1 300 1 2 1 1 14 GLU HA . 14 . HA 1 1 301 1 1 1 1 15 GLN H . 15 . HN 1 1 301 1 2 1 1 15 GLN HA . 15 . HA 1 1 302 1 1 1 1 17 GLN H . 17 . HN 1 1 302 1 2 1 1 17 GLN HA . 17 . HA 1 1 303 1 1 1 1 18 GLU H . 18 . HN 1 1 303 1 2 1 1 18 GLU HA . 18 . HA 1 1 304 1 1 1 1 20 HIS H . 20 . HN 1 1 304 1 2 1 1 20 HIS HA . 20 . HA 1 1 305 1 1 1 1 21 SER H . 21 . HN 1 1 305 1 2 1 1 21 SER HA . 21 . HA 1 1 306 1 1 1 1 22 VAL H . 22 . HN 1 1 306 1 2 1 1 22 VAL HA . 22 . HA 1 1 307 1 1 1 1 23 TYR H . 23 . HN 1 1 307 1 2 1 1 23 TYR HA . 23 . HA 1 1 308 1 1 1 1 25 SER H . 25 . HN 1 1 308 1 2 1 1 25 SER HA . 25 . HA 1 1 309 1 1 1 1 26 GLY H . 26 . HN 1 1 309 1 2 1 1 26 GLY QA . 26 . HA+ 1 1 310 1 1 1 1 27 LEU H . 27 . HN 1 1 310 1 2 1 1 27 LEU HA . 27 . HA 1 1 311 1 1 1 1 28 TRP H . 28 . HN 1 1 311 1 2 1 1 28 TRP HA . 28 . HA 1 1 312 1 1 1 1 29 LEU H . 29 . HN 1 1 312 1 2 1 1 29 LEU HA . 29 . HA 1 1 313 1 1 1 1 30 PHE H . 30 . HN 1 1 313 1 2 1 1 30 PHE HA . 30 . HA 1 1 314 1 1 1 1 31 SER H . 31 . HN 1 1 314 1 2 1 1 31 SER HA . 31 . HA 1 1 315 1 1 1 1 33 VAL H . 33 . HN 1 1 315 1 2 1 1 33 VAL HA . 33 . HA 1 1 316 1 1 1 1 34 ALA H . 34 . HN 1 1 316 1 2 1 1 34 ALA HA . 34 . HA 1 1 317 1 1 1 1 36 VAL H . 36 . HN 1 1 317 1 2 1 1 36 VAL HA . 36 . HA 1 1 318 1 1 1 1 37 ALA H . 37 . HN 1 1 318 1 2 1 1 37 ALA HA . 37 . HA 1 1 319 1 1 1 1 38 HIS H . 38 . HN 1 1 319 1 2 1 1 38 HIS HA . 38 . HA 1 1 320 1 1 1 1 39 LEU H . 39 . HN 1 1 320 1 2 1 1 39 LEU HA . 39 . HA 1 1 321 1 1 1 1 40 ALA H . 40 . HN 1 1 321 1 2 1 1 40 ALA HA . 40 . HA 1 1 322 1 1 1 1 41 VAL H . 41 . HN 1 1 322 1 2 1 1 41 VAL HA . 41 . HA 1 1 323 1 1 1 1 42 TYR H . 42 . HN 1 1 323 1 2 1 1 42 TYR HA . 42 . HA 1 1 324 1 1 1 1 43 ILE H . 43 . HN 1 1 324 1 2 1 1 43 ILE HA . 43 . HA 1 1 325 1 1 1 1 44 TRP H . 44 . HN 1 1 325 1 2 1 1 44 TRP HA . 44 . HA 1 1 326 1 1 1 1 47 TRP H . 47 . HN 1 1 326 1 2 1 1 47 TRP HA . 47 . HA 1 1 327 1 1 1 1 5 ASP H . 5 . HN 1 1 327 1 2 1 1 5 ASP QB . 5 . HB+ 1 1 328 1 1 1 1 6 LEU H . 6 . HN 1 1 328 1 2 1 1 6 LEU QB . 6 . HB+ 1 1 329 1 1 1 1 6 LEU H . 6 . HN 1 1 329 1 2 1 1 6 LEU HG . 6 . HG 1 1 330 1 1 1 1 6 LEU H . 6 . HN 1 1 330 1 2 1 1 6 LEU QD . 6 . HD++ 1 1 331 1 1 1 1 8 TYR H . 8 . HN 1 1 331 1 2 1 1 8 TYR QB . 8 . HB+ 1 1 332 1 1 1 1 9 THR H . 9 . HN 1 1 332 1 2 1 1 9 THR HB . 9 . HB 1 1 333 1 1 1 1 11 LEU H . 11 . HN 1 1 333 1 2 1 1 11 LEU QB . 11 . HB+ 1 1 334 1 1 1 1 11 LEU H . 11 . HN 1 1 334 1 2 1 1 11 LEU QD . 11 . HD++ 1 1 335 1 1 1 1 11 LEU H . 11 . HN 1 1 335 1 2 1 1 11 LEU HG . 11 . HG 1 1 336 1 1 1 1 12 THR H . 12 . HN 1 1 336 1 2 1 1 12 THR HB . 12 . HB 1 1 337 1 1 1 1 12 THR H . 12 . HN 1 1 337 1 2 1 1 12 THR HG1 . 12 . HG+ 1 1 337 1 2 1 1 12 THR MG . 12 . HG+ 1 1 338 1 1 1 1 13 ASP H . 13 . HN 1 1 338 1 2 1 1 13 ASP QB . 13 . HB+ 1 1 339 1 1 1 1 14 GLU H . 14 . HN 1 1 339 1 2 1 1 14 GLU QB . 14 . HB+ 1 1 340 1 1 1 1 14 GLU H . 14 . HN 1 1 340 1 2 1 1 14 GLU QG . 14 . HG+ 1 1 341 1 1 1 1 15 GLN H . 15 . HN 1 1 341 1 2 1 1 15 GLN QB . 15 . HB+ 1 1 342 1 1 1 1 15 GLN H . 15 . HN 1 1 342 1 2 1 1 15 GLN QG . 15 . HG+ 1 1 343 1 1 1 1 16 ALA H . 16 . HN 1 1 343 1 2 1 1 16 ALA MB . 16 . HB+ 1 1 344 1 1 1 1 17 GLN H . 17 . HN 1 1 344 1 2 1 1 17 GLN QB . 17 . HB+ 1 1 345 1 1 1 1 17 GLN H . 17 . HN 1 1 345 1 2 1 1 17 GLN QG . 17 . HG+ 1 1 346 1 1 1 1 18 GLU H . 18 . HN 1 1 346 1 2 1 1 18 GLU QB . 18 . HB+ 1 1 347 1 1 1 1 18 GLU H . 18 . HN 1 1 347 1 2 1 1 18 GLU QG . 18 . HG+ 1 1 348 1 1 1 1 19 LEU H . 19 . HN 1 1 348 1 2 1 1 19 LEU QB . 19 . HB+ 1 1 349 1 1 1 1 19 LEU H . 19 . HN 1 1 349 1 2 1 1 19 LEU HG . 19 . HG 1 1 350 1 1 1 1 19 LEU H . 19 . HN 1 1 350 1 2 1 1 19 LEU QD . 19 . HD++ 1 1 351 1 1 1 1 20 HIS H . 20 . HN 1 1 351 1 2 1 1 20 HIS HB3 . 20 . HB1 1 1 352 1 1 1 1 20 HIS H . 20 . HN 1 1 352 1 2 1 1 20 HIS HB2 . 20 . HB2 1 1 353 1 1 1 1 21 SER H . 21 . HN 1 1 353 1 2 1 1 21 SER QB . 21 . HB+ 1 1 354 1 1 1 1 22 VAL H . 22 . HN 1 1 354 1 2 1 1 22 VAL HB . 22 . HB 1 1 355 1 1 1 1 22 VAL H . 22 . HN 1 1 355 1 2 1 1 22 VAL QG . 22 . HG++ 1 1 356 1 1 1 1 23 TYR H . 23 . HN 1 1 356 1 2 1 1 23 TYR QB . 23 . HB+ 1 1 357 1 1 1 1 24 MET H . 24 . HN 1 1 357 1 2 1 1 24 MET QB . 24 . HB+ 1 1 358 1 1 1 1 24 MET H . 24 . HN 1 1 358 1 2 1 1 24 MET QG . 24 . HG+ 1 1 359 1 1 1 1 25 SER H . 25 . HN 1 1 359 1 2 1 1 25 SER QB . 25 . HB+ 1 1 360 1 1 1 1 27 LEU H . 27 . HN 1 1 360 1 2 1 1 27 LEU QB . 27 . HB+ 1 1 361 1 1 1 1 27 LEU H . 27 . HN 1 1 361 1 2 1 1 27 LEU QD . 27 . HD++ 1 1 362 1 1 1 1 28 TRP H . 28 . HN 1 1 362 1 2 1 1 28 TRP QB . 28 . HB+ 1 1 363 1 1 1 1 29 LEU H . 29 . HN 1 1 363 1 2 1 1 29 LEU HG . 29 . HG 1 1 364 1 1 1 1 29 LEU H . 29 . HN 1 1 364 1 2 1 1 29 LEU QD . 29 . HD++ 1 1 365 1 1 1 1 30 PHE H . 30 . HN 1 1 365 1 2 1 1 30 PHE QB . 30 . HB+ 1 1 366 1 1 1 1 31 SER H . 31 . HN 1 1 366 1 2 1 1 31 SER QB . 31 . HB+ 1 1 367 1 1 1 1 33 VAL H . 33 . HN 1 1 367 1 2 1 1 33 VAL HB . 33 . HB 1 1 368 1 1 1 1 33 VAL H . 33 . HN 1 1 368 1 2 1 1 33 VAL QG . 33 . HG++ 1 1 369 1 1 1 1 34 ALA H . 34 . HN 1 1 369 1 2 1 1 34 ALA MB . 34 . HB+ 1 1 370 1 1 1 1 35 ILE H . 35 . HN 1 1 370 1 2 1 1 35 ILE HB . 35 . HB 1 1 371 1 1 1 1 35 ILE H . 35 . HN 1 1 371 1 2 1 1 35 ILE MG . 35 . HG2+ 1 1 372 1 1 1 1 35 ILE H . 35 . HN 1 1 372 1 2 1 1 35 ILE QG . 35 . HG1+ 1 1 373 1 1 1 1 35 ILE H . 35 . HN 1 1 373 1 2 1 1 35 ILE QG . 35 . HG++ 1 1 373 1 2 1 1 35 ILE MG . 35 . HG++ 1 1 374 1 1 1 1 35 ILE H . 35 . HN 1 1 374 1 2 1 1 35 ILE MD . 35 . HD1+ 1 1 375 1 1 1 1 36 VAL H . 36 . HN 1 1 375 1 2 1 1 36 VAL HB . 36 . HB 1 1 376 1 1 1 1 37 ALA H . 37 . HN 1 1 376 1 2 1 1 37 ALA MB . 37 . HB+ 1 1 377 1 1 1 1 38 HIS H . 38 . HN 1 1 377 1 2 1 1 38 HIS QB . 38 . HB+ 1 1 378 1 1 1 1 39 LEU H . 39 . HN 1 1 378 1 2 1 1 39 LEU QB . 39 . HB+ 1 1 379 1 1 1 1 39 LEU H . 39 . HN 1 1 379 1 2 1 1 39 LEU HG . 39 . HG 1 1 380 1 1 1 1 39 LEU H . 39 . HN 1 1 380 1 2 1 1 39 LEU QD . 39 . HD++ 1 1 381 1 1 1 1 40 ALA H . 40 . HN 1 1 381 1 2 1 1 40 ALA MB . 40 . HB+ 1 1 382 1 1 1 1 41 VAL H . 41 . HN 1 1 382 1 2 1 1 41 VAL HB . 41 . HB 1 1 383 1 1 1 1 41 VAL H . 41 . HN 1 1 383 1 2 1 1 41 VAL QG . 41 . HG++ 1 1 384 1 1 1 1 42 TYR H . 42 . HN 1 1 384 1 2 1 1 42 TYR QB . 42 . HB+ 1 1 385 1 1 1 1 43 ILE H . 43 . HN 1 1 385 1 2 1 1 43 ILE HB . 43 . HB 1 1 386 1 1 1 1 44 TRP H . 44 . HN 1 1 386 1 2 1 1 44 TRP QB . 44 . HB+ 1 1 387 1 1 1 1 45 ARG H . 45 . HN 1 1 387 1 2 1 1 45 ARG QG . 45 . HG+ 1 1 388 1 1 1 1 45 ARG H . 45 . HN 1 1 388 1 2 1 1 45 ARG QB . 45 . HB+ 1 1 389 1 1 1 1 45 ARG HA . 45 . HA 1 1 389 1 2 1 1 45 ARG QD . 45 . HD+ 1 1 390 1 1 1 1 45 ARG QB . 45 . HB+ 1 1 390 1 2 1 1 45 ARG QD . 45 . HD+ 1 1 391 1 1 1 1 45 ARG H . 45 . HN 1 1 391 1 2 1 1 45 ARG QD . 45 . HD+ 1 1 392 1 1 1 1 45 ARG QB . 45 . HB+ 1 1 392 1 2 1 1 45 ARG HE . 45 . HE 1 1 393 1 1 1 1 47 TRP H . 47 . HN 1 1 393 1 2 1 1 47 TRP QB . 47 . HB+ 1 1 394 1 1 1 1 6 LEU HA . 6 . HA 1 1 394 1 2 1 1 6 LEU QD . 6 . HD++ 1 1 395 1 1 1 1 6 LEU HA . 6 . HA 1 1 395 1 2 1 1 6 LEU HG . 6 . HG 1 1 396 1 1 1 1 27 LEU HA . 27 . HA 1 1 396 1 2 1 1 27 LEU QD . 27 . HD++ 1 1 397 1 1 1 1 35 ILE HA . 35 . HA 1 1 397 1 2 1 1 35 ILE QG . 35 . HG++ 1 1 397 1 2 1 1 35 ILE MG . 35 . HG++ 1 1 398 1 1 1 1 8 TYR QB . 8 . HB+ 1 1 398 1 2 1 1 8 TYR QD . 8 . HD+ 1 1 399 1 1 1 1 8 TYR HA . 8 . HA 1 1 399 1 2 1 1 8 TYR QD . 8 . HD+ 1 1 400 1 1 1 1 8 TYR H . 8 . HN 1 1 400 1 2 1 1 8 TYR QD . 8 . HD+ 1 1 401 1 1 1 1 20 HIS HA . 20 . HA 1 1 401 1 2 1 1 20 HIS HD2 . 20 . HD2 1 1 402 1 1 1 1 20 HIS H . 20 . HN 1 1 402 1 2 1 1 20 HIS HD2 . 20 . HD2 1 1 403 1 1 1 1 23 TYR QB . 23 . HB+ 1 1 403 1 2 1 1 23 TYR QD . 23 . HD+ 1 1 404 1 1 1 1 23 TYR HA . 23 . HA 1 1 404 1 2 1 1 23 TYR QD . 23 . HD+ 1 1 405 1 1 1 1 23 TYR QB . 23 . HB+ 1 1 405 1 2 1 1 23 TYR QE . 23 . HE+ 1 1 406 1 1 1 1 28 TRP QB . 28 . HB+ 1 1 406 1 2 1 1 28 TRP HD1 . 28 . HD+ 1 1 407 1 1 1 1 28 TRP H . 28 . HN 1 1 407 1 2 1 1 28 TRP HD1 . 28 . HD+ 1 1 408 1 1 1 1 28 TRP HA . 28 . HA 1 1 408 1 2 1 1 28 TRP HD1 . 28 . HD+ 1 1 409 1 1 1 1 30 PHE HA . 30 . HA 1 1 409 1 2 1 1 30 PHE QD . 30 . HD+ 1 1 410 1 1 1 1 38 HIS QB . 38 . HB+ 1 1 410 1 2 1 1 38 HIS HD2 . 38 . HD2 1 1 411 1 1 1 1 38 HIS HA . 38 . HA 1 1 411 1 2 1 1 38 HIS HD2 . 38 . HD2 1 1 412 1 1 1 1 38 HIS H . 38 . HN 1 1 412 1 2 1 1 38 HIS HD2 . 38 . HD2 1 1 413 1 1 1 1 42 TYR HB3 . 42 . HB1 1 1 413 1 2 1 1 42 TYR QD . 42 . HD+ 1 1 414 1 1 1 1 42 TYR HB2 . 42 . HB2 1 1 414 1 2 1 1 42 TYR QD . 42 . HD+ 1 1 415 1 1 1 1 42 TYR H . 42 . HN 1 1 415 1 2 1 1 42 TYR QD . 42 . HD+ 1 1 416 1 1 1 1 42 TYR HA . 42 . HA 1 1 416 1 2 1 1 42 TYR QD . 42 . HD+ 1 1 417 1 1 1 1 44 TRP QB . 44 . HB+ 1 1 417 1 2 1 1 44 TRP HD1 . 44 . HD+ 1 1 418 1 1 1 1 44 TRP H . 44 . HN 1 1 418 1 2 1 1 44 TRP HD1 . 44 . HD+ 1 1 419 1 1 1 1 44 TRP HA . 44 . HA 1 1 419 1 2 1 1 44 TRP HD1 . 44 . HD+ 1 1 420 1 1 1 1 47 TRP H . 47 . HN 1 1 420 1 2 1 1 47 TRP HD1 . 47 . HD+ 1 1 421 1 1 1 1 4 SER O . 4 . O 1 1 421 1 2 1 1 8 TYR H . 8 . HN 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 3.4 1.8 3.4 1 1 2 1 . . . . . 3.4 1.8 3.4 1 1 3 1 . . . . . 3.8 1.8 3.8 1 1 4 1 . . . . . 3.4 1.8 3.4 1 1 5 1 . . . . . 3.8 1.8 3.8 1 1 6 1 . . . . . 3.4 1.8 3.4 1 1 7 1 . . . . . 3.1 1.8 3.1 1 1 8 1 . . . . . 3.1 1.8 3.1 1 1 9 1 . . . . . 3.4 1.8 3.4 1 1 10 1 . . . . . 3.4 1.8 3.4 1 1 11 1 . . . . . 4.2 1.8 4.2 1 1 12 1 . . . . . 3.8 1.8 3.8 1 1 13 1 . . . . . 3.4 1.8 3.4 1 1 14 1 . . . . . 4.2 1.8 4.2 1 1 15 1 . . . . . 3.1 1.8 3.1 1 1 16 1 . . . . . 3.1 1.8 3.1 1 1 17 1 . . . . . 3.1 1.8 3.1 1 1 18 1 . . . . . 3.8 1.8 3.8 1 1 19 1 . . . . . 3.1 1.8 3.1 1 1 20 1 . . . . . 3.8 1.8 3.8 1 1 21 1 . . . . . 3.4 1.8 3.4 1 1 22 1 . . . . . 3.4 1.8 3.4 1 1 23 1 . . . . . 3.4 1.8 3.4 1 1 24 1 . . . . . 3.1 1.8 3.1 1 1 25 1 . . . . . 3.4 1.8 3.4 1 1 26 1 . . . . . 3.4 1.8 3.4 1 1 27 1 . . . . . 3.1 1.8 3.1 1 1 28 1 . . . . . 4.6 1.8 4.6 1 1 29 1 . . . . . 3.4 1.8 3.4 1 1 30 1 . . . . . 3.4 1.8 3.4 1 1 31 1 . . . . . 4.2 1.8 4.2 1 1 32 1 . . . . . 3.8 1.8 3.8 1 1 33 1 . . . . . 3.8 1.8 3.8 1 1 34 1 . . . . . 3.4 1.8 3.4 1 1 35 1 . . . . . 3.8 1.8 3.8 1 1 36 1 . . . . . 4.2 1.8 4.2 1 1 37 1 . . . . . 3.1 1.8 3.1 1 1 38 1 . . . . . 4.2 1.8 4.2 1 1 39 1 . . . . . 3.8 1.8 3.8 1 1 40 1 . . . . . 3.1 1.8 3.1 1 1 41 1 . . . . . 3.4 1.8 3.4 1 1 42 1 . . . . . 3.4 1.8 3.4 1 1 43 1 . . . . . 4.2 1.8 4.2 1 1 44 1 . . . . . 3.4 1.8 3.4 1 1 45 1 . . . . . 4.6 1.8 4.6 1 1 46 1 . . . . . 3.4 1.8 3.4 1 1 47 1 . . . . . 4.2 1.8 4.2 1 1 48 1 . . . . . 3.8 1.8 3.8 1 1 49 1 . . . . . 4.2 1.8 4.2 1 1 50 1 . . . . . 3.1 1.8 3.1 1 1 51 1 . . . . . 3.8 1.8 3.8 1 1 52 1 . . . . . 3.1 1.8 3.1 1 1 53 1 . . . . . 4.2 1.8 4.2 1 1 54 1 . . . . . 3.1 1.8 3.1 1 1 55 1 . . . . . 4.6 1.8 4.6 1 1 56 1 . . . . . 4.6 1.8 4.6 1 1 57 1 . . . . . 4.2 1.8 4.2 1 1 58 1 . . . . . 4.6 1.8 4.6 1 1 59 1 . . . . . 3.8 1.8 3.8 1 1 60 1 . . . . . 4.2 1.8 4.2 1 1 61 1 . . . . . 4.2 1.8 4.2 1 1 62 1 . . . . . 3.8 1.8 3.8 1 1 63 1 . . . . . 4.2 1.8 4.2 1 1 64 1 . . . . . 4.2 1.8 4.2 1 1 65 1 . . . . . 3.1 1.8 3.1 1 1 66 1 . . . . . 4.2 1.8 4.2 1 1 67 1 . . . . . 3.8 1.8 3.8 1 1 68 1 . . . . . 3.8 1.8 3.8 1 1 69 1 . . . . . 3.8 1.8 3.8 1 1 70 1 . . . . . 3.8 1.8 3.8 1 1 71 1 . . . . . 3.8 1.8 3.8 1 1 72 1 . . . . . 3.8 1.8 3.8 1 1 73 1 . . . . . 3.8 1.8 3.8 1 1 74 1 . . . . . 3.8 1.8 3.8 1 1 75 1 . . . . . 3.8 1.8 3.8 1 1 76 1 . . . . . 3.1 1.8 3.1 1 1 77 1 . . . . . 4.6 1.8 4.6 1 1 78 1 . . . . . 4.2 1.8 4.2 1 1 79 1 . . . . . 3.4 1.8 3.4 1 1 80 1 . . . . . 3.4 1.8 3.4 1 1 81 1 . . . . . 4.6 1.8 4.6 1 1 82 1 . . . . . 3.8 1.8 3.8 1 1 83 1 . . . . . 4.2 1.8 4.2 1 1 84 1 . . . . . 3.4 1.8 3.4 1 1 85 1 . . . . . 3.8 1.8 3.8 1 1 86 1 . . . . . 4.2 1.8 4.2 1 1 87 1 . . . . . 3.8 1.8 3.8 1 1 88 1 . . . . . 3.8 1.8 3.8 1 1 89 1 . . . . . 4.2 1.8 4.2 1 1 90 1 . . . . . 4.2 1.8 4.2 1 1 91 1 . . . . . 4.6 1.8 4.6 1 1 92 1 . . . . . 3.8 1.8 3.8 1 1 93 1 . . . . . 2.8 1.8 2.8 1 1 94 1 . . . . . 3.1 1.8 3.1 1 1 95 1 . . . . . 4.6 1.8 4.6 1 1 96 1 . . . . . 4.6 1.8 4.6 1 1 97 1 . . . . . 3.1 1.8 3.1 1 1 98 1 . . . . . 4.2 1.8 4.2 1 1 99 1 . . . . . 3.8 1.8 3.8 1 1 100 1 . . . . . 3.8 1.8 3.8 1 1 101 1 . . . . . 3.8 1.8 3.8 1 1 102 1 . . . . . 3.8 1.8 3.8 1 1 103 1 . . . . . 4.2 1.8 4.2 1 1 104 1 . . . . . 4.6 1.8 4.6 1 1 105 1 . . . . . 4.2 1.8 4.2 1 1 106 1 . . . . . 4.2 1.8 4.2 1 1 107 1 . . . . . 3.8 1.8 3.8 1 1 108 1 . . . . . 3.8 1.8 3.8 1 1 109 1 . . . . . 3.8 1.8 3.8 1 1 110 1 . . . . . 3.8 1.8 3.8 1 1 111 1 . . . . . 3.8 1.8 3.8 1 1 112 1 . . . . . 3.1 1.8 3.1 1 1 113 1 . . . . . 3.8 1.8 3.8 1 1 114 1 . . . . . 3.8 1.8 3.8 1 1 115 1 . . . . . 3.8 1.8 3.8 1 1 116 1 . . . . . 3.1 1.8 3.1 1 1 117 1 . . . . . 4.6 1.8 4.6 1 1 118 1 . . . . . 3.8 1.8 3.8 1 1 119 1 . . . . . 4.6 1.8 4.6 1 1 120 1 . . . . . 4.6 1.8 4.6 1 1 121 1 . . . . . 4.6 1.8 4.6 1 1 122 1 . . . . . 4.2 1.8 4.2 1 1 123 1 . . . . . 3.8 1.8 3.8 1 1 124 1 . . . . . 3.8 1.8 3.8 1 1 125 1 . . . . . 4.6 1.8 4.6 1 1 126 1 . . . . . 4.2 1.8 4.2 1 1 127 1 . . . . . 3.4 1.8 3.4 1 1 128 1 . . . . . 3.1 1.8 3.1 1 1 129 1 . . . . . 3.8 1.8 3.8 1 1 130 1 . . . . . 4.2 1.8 4.2 1 1 131 1 . . . . . 3.4 1.8 3.4 1 1 132 1 . . . . . 4.2 1.8 4.2 1 1 133 1 . . . . . 3.1 1.8 3.1 1 1 134 1 . . . . . 4.2 1.8 4.2 1 1 135 1 . . . . . 3.1 1.8 3.1 1 1 136 1 . . . . . 4.6 1.8 4.6 1 1 137 1 . . . . . 4.6 1.8 4.6 1 1 138 1 . . . . . 3.1 1.8 3.1 1 1 139 1 . . . . . 3.1 1.8 3.1 1 1 140 1 . . . . . 4.6 1.8 4.6 1 1 141 1 . . . . . 3.1 1.8 3.1 1 1 142 1 . . . . . 3.1 1.8 3.1 1 1 143 1 . . . . . 3.1 1.8 3.1 1 1 144 1 . . . . . 3.1 1.8 3.1 1 1 145 1 . . . . . 4.2 1.8 4.2 1 1 146 1 . . . . . 4.2 1.8 4.2 1 1 147 1 . . . . . 3.1 1.8 3.1 1 1 148 1 . . . . . 4.2 1.8 4.2 1 1 149 1 . . . . . 4.2 1.8 4.2 1 1 150 1 . . . . . 4.6 1.8 4.6 1 1 151 1 . . . . . 3.1 1.8 3.1 1 1 152 1 . . . . . 3.8 1.8 3.8 1 1 153 1 . . . . . 3.8 1.8 3.8 1 1 154 1 . . . . . 4.2 1.8 4.2 1 1 155 1 . . . . . 4.2 1.8 4.2 1 1 156 1 . . . . . 3.1 1.8 3.1 1 1 157 1 . . . . . 3.1 1.8 3.1 1 1 158 1 . . . . . 4.6 1.8 4.6 1 1 159 1 . . . . . 4.6 1.8 4.6 1 1 160 1 . . . . . 4.2 1.8 4.2 1 1 161 1 . . . . . 4.6 1.8 4.6 1 1 162 1 . . . . . 3.8 1.8 3.8 1 1 163 1 . . . . . 3.1 1.8 3.1 1 1 164 1 . . . . . 3.4 1.8 3.4 1 1 165 1 . . . . . 3.8 1.8 3.8 1 1 166 1 . . . . . 3.8 1.8 3.8 1 1 167 1 . . . . . 3.8 1.8 3.8 1 1 168 1 . . . . . 4.2 1.8 4.2 1 1 169 1 . . . . . 3.1 1.8 3.1 1 1 170 1 . . . . . 3.8 1.8 3.8 1 1 171 1 . . . . . 3.8 1.8 3.8 1 1 172 1 . . . . . 3.8 1.8 3.8 1 1 173 1 . . . . . 3.1 1.8 3.1 1 1 174 1 . . . . . 3.1 1.8 3.1 1 1 175 1 . . . . . 4.6 1.8 4.6 1 1 176 1 . . . . . 4.6 1.8 4.6 1 1 177 1 . . . . . 4.6 1.8 4.6 1 1 178 1 . . . . . 4.2 1.8 4.2 1 1 179 1 . . . . . 4.2 1.8 4.2 1 1 180 1 . . . . . 3.1 1.8 3.1 1 1 181 1 . . . . . 4.6 1.8 4.6 1 1 182 1 . . . . . 3.1 1.8 3.1 1 1 183 1 . . . . . 4.6 1.8 4.6 1 1 184 1 . . . . . 3.8 1.8 3.8 1 1 185 1 . . . . . 4.2 1.8 4.2 1 1 186 1 . . . . . 4.6 1.8 4.6 1 1 187 1 . . . . . 4.2 1.8 4.2 1 1 188 1 . . . . . 3.1 1.8 3.1 1 1 189 1 . . . . . 4.2 1.8 4.2 1 1 190 1 . . . . . 3.8 1.8 3.8 1 1 191 1 . . . . . 2.8 1.8 2.8 1 1 192 1 . . . . . 3.1 1.8 3.1 1 1 193 1 . . . . . 4.6 1.8 4.6 1 1 194 1 . . . . . 4.2 1.8 4.2 1 1 195 1 . . . . . 3.8 1.8 3.8 1 1 196 1 . . . . . 4.2 1.8 4.2 1 1 197 1 . . . . . 4.2 1.8 4.2 1 1 198 1 . . . . . 4.6 1.8 4.6 1 1 199 1 . . . . . 3.8 1.8 3.8 1 1 200 1 . . . . . 3.8 1.8 3.8 1 1 201 1 . . . . . 3.1 1.8 3.1 1 1 202 1 . . . . . 3.1 1.8 3.1 1 1 203 1 . . . . . 4.6 1.8 4.6 1 1 204 1 . . . . . 3.8 1.8 3.8 1 1 205 1 . . . . . 4.2 1.8 4.2 1 1 206 1 . . . . . 3.8 1.8 3.8 1 1 207 1 . . . . . 3.1 1.8 3.1 1 1 208 1 . . . . . 3.1 1.8 3.1 1 1 209 1 . . . . . 3.1 1.8 3.1 1 1 210 1 . . . . . 3.8 1.8 3.8 1 1 211 1 . . . . . 2.8 1.8 2.8 1 1 212 1 . . . . . 4.6 1.8 4.6 1 1 213 1 . . . . . 4.2 1.8 4.2 1 1 214 1 . . . . . 4.6 1.8 4.6 1 1 215 1 . . . . . 3.1 1.8 3.1 1 1 216 1 . . . . . 4.2 1.8 4.2 1 1 217 1 . . . . . 3.4 1.8 3.4 1 1 218 1 . . . . . 3.1 1.8 3.1 1 1 219 1 . . . . . 4.2 1.8 4.2 1 1 220 1 . . . . . 3.4 1.8 3.4 1 1 221 1 . . . . . 2.8 1.8 2.8 1 1 222 1 . . . . . 3.4 1.8 3.4 1 1 223 1 . . . . . 4.2 1.8 4.2 1 1 224 1 . . . . . 3.8 1.8 3.8 1 1 225 1 . . . . . 4.6 1.8 4.6 1 1 226 1 . . . . . 3.8 1.8 3.8 1 1 227 1 . . . . . 3.4 1.8 3.4 1 1 228 1 . . . . . 4.2 1.8 4.2 1 1 229 1 . . . . . 4.2 1.8 4.2 1 1 230 1 . . . . . 4.2 1.8 4.2 1 1 231 1 . . . . . 3.8 1.8 3.8 1 1 232 1 . . . . . 3.8 1.8 3.8 1 1 233 1 . . . . . 4.2 1.8 4.2 1 1 234 1 . . . . . 3.8 1.8 3.8 1 1 235 1 . . . . . 3.4 1.8 3.4 1 1 236 1 . . . . . 4.2 1.8 4.2 1 1 237 1 . . . . . 3.8 1.8 3.8 1 1 238 1 . . . . . 4.2 1.8 4.2 1 1 239 1 . . . . . 4.2 1.8 4.2 1 1 240 1 . . . . . 4.2 1.8 4.2 1 1 241 1 . . . . . 4.6 1.8 4.6 1 1 242 1 . . . . . 4.2 1.8 4.2 1 1 243 1 . . . . . 4.2 1.8 4.2 1 1 244 1 . . . . . 4.6 1.8 4.6 1 1 245 1 . . . . . 4.6 1.8 4.6 1 1 246 1 . . . . . 4.6 1.8 4.6 1 1 247 1 . . . . . 3.8 1.8 3.8 1 1 248 1 . . . . . 3.8 1.8 3.8 1 1 249 1 . . . . . 4.6 1.8 4.6 1 1 250 1 . . . . . 4.2 1.8 4.2 1 1 251 1 . . . . . 3.8 1.8 3.8 1 1 252 1 . . . . . 3.4 1.8 3.4 1 1 253 1 . . . . . 4.6 1.8 4.6 1 1 254 1 . . . . . 4.2 1.8 4.2 1 1 255 1 . . . . . 4.2 1.8 4.2 1 1 256 1 . . . . . 3.8 1.8 3.8 1 1 257 1 . . . . . 3.8 1.8 3.8 1 1 258 1 . . . . . 4.6 1.8 4.6 1 1 259 1 . . . . . 3.8 1.8 3.8 1 1 260 1 . . . . . 4.6 1.8 4.6 1 1 261 1 . . . . . 4.6 1.8 4.6 1 1 262 1 . . . . . 4.2 1.8 4.2 1 1 263 1 . . . . . 3.8 1.8 3.8 1 1 264 1 . . . . . 3.8 1.8 3.8 1 1 265 1 . . . . . 4.6 1.8 4.6 1 1 266 1 . . . . . 3.8 1.8 3.8 1 1 267 1 . . . . . 4.2 1.8 4.2 1 1 268 1 . . . . . 4.6 1.8 4.6 1 1 269 1 . . . . . 4.2 1.8 4.2 1 1 270 1 . . . . . 3.8 1.8 3.8 1 1 271 1 . . . . . 4.6 1.8 4.6 1 1 272 1 . . . . . 4.2 1.8 4.2 1 1 273 1 . . . . . 4.6 1.8 4.6 1 1 274 1 . . . . . 4.2 1.8 4.2 1 1 275 1 . . . . . 4.6 1.8 4.6 1 1 276 1 . . . . . 4.6 1.8 4.6 1 1 277 1 . . . . . 4.2 1.8 4.2 1 1 278 1 . . . . . 4.2 1.8 4.2 1 1 279 1 . . . . . 4.2 1.8 4.2 1 1 280 1 . . . . . 4.2 1.8 4.2 1 1 281 1 . . . . . 4.2 1.8 4.2 1 1 282 1 . . . . . 4.6 1.8 4.6 1 1 283 1 . . . . . 4.6 1.8 4.6 1 1 284 1 . . . . . 4.6 1.8 4.6 1 1 285 1 . . . . . 3.8 1.8 3.8 1 1 286 1 . . . . . 3.8 1.8 3.8 1 1 287 1 . . . . . 4.2 1.8 4.2 1 1 288 1 . . . . . 4.2 1.8 4.2 1 1 289 1 . . . . . 4.6 1.8 4.6 1 1 290 1 . . . . . 3.8 1.8 3.8 1 1 291 1 . . . . . 3.4 1.8 3.4 1 1 292 1 . . . . . 3.8 1.8 3.8 1 1 293 1 . . . . . 3.1 1.8 3.1 1 1 294 1 . . . . . 3.1 1.8 3.1 1 1 295 1 . . . . . 2.5 1.8 2.5 1 1 296 1 . . . . . 2.8 1.8 2.8 1 1 297 1 . . . . . 2.5 1.8 2.5 1 1 298 1 . . . . . 2.5 1.8 2.5 1 1 299 1 . . . . . 2.5 1.8 2.5 1 1 300 1 . . . . . 3.1 1.8 3.1 1 1 301 1 . . . . . 3.1 1.8 3.1 1 1 302 1 . . . . . 3.1 1.8 3.1 1 1 303 1 . . . . . 3.1 1.8 3.1 1 1 304 1 . . . . . 2.8 1.8 2.8 1 1 305 1 . . . . . 2.5 1.8 2.5 1 1 306 1 . . . . . 3.1 1.8 3.1 1 1 307 1 . . . . . 2.8 1.8 2.8 1 1 308 1 . . . . . 3.1 1.8 3.1 1 1 309 1 . . . . . 2.8 1.8 2.8 1 1 310 1 . . . . . 2.8 1.8 2.8 1 1 311 1 . . . . . 2.8 1.8 2.8 1 1 312 1 . . . . . 3.1 1.8 3.1 1 1 313 1 . . . . . 2.5 1.8 2.5 1 1 314 1 . . . . . 3.1 1.8 3.1 1 1 315 1 . . . . . 2.8 1.8 2.8 1 1 316 1 . . . . . 2.8 1.8 2.8 1 1 317 1 . . . . . 2.8 1.8 2.8 1 1 318 1 . . . . . 2.5 1.8 2.5 1 1 319 1 . . . . . 2.8 1.8 2.8 1 1 320 1 . . . . . 2.8 1.8 2.8 1 1 321 1 . . . . . 3.1 1.8 3.1 1 1 322 1 . . . . . 2.8 1.8 2.8 1 1 323 1 . . . . . 2.8 1.8 2.8 1 1 324 1 . . . . . 3.1 1.8 3.1 1 1 325 1 . . . . . 3.1 1.8 3.1 1 1 326 1 . . . . . 3.1 1.8 3.1 1 1 327 1 . . . . . 3.4 1.8 3.4 1 1 328 1 . . . . . 2.8 1.8 2.8 1 1 329 1 . . . . . 3.8 1.8 3.8 1 1 330 1 . . . . . 4.2 1.8 4.2 1 1 331 1 . . . . . 2.8 1.8 2.8 1 1 332 1 . . . . . 3.4 1.8 3.4 1 1 333 1 . . . . . 2.8 1.8 2.8 1 1 334 1 . . . . . 3.4 1.8 3.4 1 1 335 1 . . . . . 3.4 1.8 3.4 1 1 336 1 . . . . . 3.1 1.8 3.1 1 1 337 1 . . . . . 3.1 1.8 3.1 1 1 338 1 . . . . . 2.5 1.8 2.5 1 1 339 1 . . . . . 2.8 1.8 2.8 1 1 340 1 . . . . . 4.2 1.8 4.2 1 1 341 1 . . . . . 2.5 1.8 2.5 1 1 342 1 . . . . . 3.8 1.8 3.8 1 1 343 1 . . . . . 2.3 1.8 2.3 1 1 344 1 . . . . . 2.5 1.8 2.5 1 1 345 1 . . . . . 3.4 1.8 3.4 1 1 346 1 . . . . . 2.5 1.8 2.5 1 1 347 1 . . . . . 4.2 1.8 4.2 1 1 348 1 . . . . . 2.8 1.8 2.8 1 1 349 1 . . . . . 3.8 1.8 3.8 1 1 350 1 . . . . . 3.1 1.8 3.1 1 1 351 1 . . . . . 3.1 1.8 3.1 1 1 352 1 . . . . . 3.1 1.8 3.1 1 1 353 1 . . . . . 3.8 1.8 3.8 1 1 354 1 . . . . . 3.1 1.8 3.1 1 1 355 1 . . . . . 2.8 1.8 2.8 1 1 356 1 . . . . . 2.8 1.8 2.8 1 1 357 1 . . . . . 3.8 1.8 3.8 1 1 358 1 . . . . . 3.4 1.8 3.4 1 1 359 1 . . . . . 2.8 1.8 2.8 1 1 360 1 . . . . . 2.5 1.8 2.5 1 1 361 1 . . . . . 3.8 1.8 3.8 1 1 362 1 . . . . . 2.8 1.8 2.8 1 1 363 1 . . . . . 3.8 1.8 3.8 1 1 364 1 . . . . . 3.4 1.8 3.4 1 1 365 1 . . . . . 2.8 1.8 2.8 1 1 366 1 . . . . . 3.8 1.8 3.8 1 1 367 1 . . . . . 2.5 1.8 2.5 1 1 368 1 . . . . . 2.3 1.8 2.3 1 1 369 1 . . . . . 2.3 1.8 2.3 1 1 370 1 . . . . . 3.1 1.8 3.1 1 1 371 1 . . . . . 3.1 1.8 3.1 1 1 372 1 . . . . . 3.1 1.8 3.1 1 1 373 1 . . . . . 2.5 1.8 2.5 1 1 374 1 . . . . . 3.8 1.8 3.8 1 1 375 1 . . . . . 3.1 1.8 3.1 1 1 376 1 . . . . . 2.3 1.8 2.3 1 1 377 1 . . . . . 2.8 1.8 2.8 1 1 378 1 . . . . . 3.4 1.8 3.4 1 1 379 1 . . . . . 2.8 1.8 2.8 1 1 380 1 . . . . . 3.4 1.8 3.4 1 1 381 1 . . . . . 2.3 1.8 2.3 1 1 382 1 . . . . . 2.8 1.8 2.8 1 1 383 1 . . . . . 2.5 1.8 2.5 1 1 384 1 . . . . . 2.5 1.8 2.5 1 1 385 1 . . . . . 2.8 1.8 2.8 1 1 386 1 . . . . . 2.5 1.8 2.5 1 1 387 1 . . . . . 3.8 1.8 3.8 1 1 388 1 . . . . . 3.1 1.8 3.1 1 1 389 1 . . . . . 4.2 1.8 4.2 1 1 390 1 . . . . . 3.4 1.8 3.4 1 1 391 1 . . . . . 3.8 1.8 3.8 1 1 392 1 . . . . . 4.6 1.8 4.6 1 1 393 1 . . . . . 3.8 1.8 3.8 1 1 394 1 . . . . . 2.3 1.8 2.3 1 1 395 1 . . . . . 2.5 1.8 2.5 1 1 396 1 . . . . . 3.4 1.8 3.4 1 1 397 1 . . . . . 2.5 1.8 2.5 1 1 398 1 . . . . . 2.3 1.8 2.3 1 1 399 1 . . . . . 2.8 1.8 2.8 1 1 400 1 . . . . . 3.8 1.8 3.8 1 1 401 1 . . . . . 3.4 1.8 3.4 1 1 402 1 . . . . . 3.8 1.8 3.8 1 1 403 1 . . . . . 2.3 1.8 2.3 1 1 404 1 . . . . . 3.4 1.8 3.4 1 1 405 1 . . . . . 4.2 1.8 4.2 1 1 406 1 . . . . . 2.8 1.8 2.8 1 1 407 1 . . . . . 4.2 1.8 4.2 1 1 408 1 . . . . . 3.4 1.8 3.4 1 1 409 1 . . . . . 3.8 1.8 3.8 1 1 410 1 . . . . . 3.4 1.8 3.4 1 1 411 1 . . . . . 3.4 1.8 3.4 1 1 412 1 . . . . . 3.8 1.8 3.8 1 1 413 1 . . . . . 3.4 1.8 3.4 1 1 414 1 . . . . . 3.4 1.8 3.4 1 1 415 1 . . . . . 4.2 1.8 4.2 1 1 416 1 . . . . . 3.1 1.8 3.1 1 1 417 1 . . . . . 3.1 1.8 3.1 1 1 418 1 . . . . . 3.8 1.8 3.8 1 1 419 1 . . . . . 3.4 1.8 3.4 1 1 420 1 . . . . . 3.8 1.8 3.8 1 1 421 1 . . . . . 2.5 2.0 2.7 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_3_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 2 _Distance_constraint_list.Constraint_type "hydrogen bond" _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 2 2 1 . . . 1 2 3 1 . . . 1 2 4 1 . . . 1 2 5 1 . . . 1 2 6 1 . . . 1 2 7 1 . . . 1 2 8 1 . . . 1 2 9 1 . . . 1 2 10 1 . . . 1 2 11 1 . . . 1 2 12 1 . . . 1 2 13 1 . . . 1 2 14 1 . . . 1 2 15 1 . . . 1 2 16 1 . . . 1 2 17 1 . . . 1 2 18 1 . . . 1 2 19 1 . . . 1 2 20 1 . . . 1 2 21 1 . . . 1 2 22 1 . . . 1 2 23 1 . . . 1 2 24 1 . . . 1 2 25 1 . . . 1 2 26 1 . . . 1 2 27 1 . . . 1 2 28 1 . . . 1 2 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 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 4 SER O . 4 . O 1 2 1 1 2 1 1 8 TYR N . 8 . N 1 2 2 1 1 1 1 8 TYR O . 8 . O 1 2 2 1 2 1 1 12 THR H . 12 . HN 1 2 3 1 1 1 1 8 TYR O . 8 . O 1 2 3 1 2 1 1 12 THR N . 12 . N 1 2 4 1 1 1 1 9 THR O . 9 . O 1 2 4 1 2 1 1 13 ASP H . 13 . HN 1 2 5 1 1 1 1 9 THR O . 9 . O 1 2 5 1 2 1 1 13 ASP N . 13 . N 1 2 6 1 1 1 1 10 GLY O . 10 . O 1 2 6 1 2 1 1 14 GLU H . 14 . HN 1 2 7 1 1 1 1 10 GLY O . 10 . O 1 2 7 1 2 1 1 14 GLU N . 14 . N 1 2 8 1 1 1 1 11 LEU O . 11 . O 1 2 8 1 2 1 1 15 GLN H . 15 . HN 1 2 9 1 1 1 1 11 LEU O . 11 . O 1 2 9 1 2 1 1 15 GLN N . 15 . N 1 2 10 1 1 1 1 13 ASP O . 13 . O 1 2 10 1 2 1 1 17 GLN H . 17 . HN 1 2 11 1 1 1 1 13 ASP O . 13 . O 1 2 11 1 2 1 1 17 GLN N . 17 . N 1 2 12 1 1 1 1 14 GLU O . 14 . O 1 2 12 1 2 1 1 18 GLU H . 18 . HN 1 2 13 1 1 1 1 14 GLU O . 14 . O 1 2 13 1 2 1 1 18 GLU N . 18 . N 1 2 14 1 1 1 1 16 ALA O . 16 . O 1 2 14 1 2 1 1 20 HIS H . 20 . HN 1 2 15 1 1 1 1 16 ALA O . 16 . O 1 2 15 1 2 1 1 20 HIS N . 20 . N 1 2 16 1 1 1 1 17 GLN O . 17 . O 1 2 16 1 2 1 1 21 SER H . 21 . HN 1 2 17 1 1 1 1 17 GLN O . 17 . O 1 2 17 1 2 1 1 21 SER N . 21 . N 1 2 18 1 1 1 1 22 VAL O . 22 . O 1 2 18 1 2 1 1 26 GLY H . 26 . HN 1 2 19 1 1 1 1 22 VAL O . 22 . O 1 2 19 1 2 1 1 26 GLY N . 26 . N 1 2 20 1 1 1 1 23 TYR O . 23 . O 1 2 20 1 2 1 1 27 LEU H . 27 . HN 1 2 21 1 1 1 1 23 TYR O . 23 . O 1 2 21 1 2 1 1 27 LEU N . 27 . N 1 2 22 1 1 1 1 24 MET O . 24 . O 1 2 22 1 2 1 1 28 TRP H . 28 . HN 1 2 23 1 1 1 1 24 MET O . 24 . O 1 2 23 1 2 1 1 28 TRP N . 28 . N 1 2 24 1 1 1 1 25 SER O . 25 . O 1 2 24 1 2 1 1 29 LEU H . 29 . HN 1 2 25 1 1 1 1 25 SER O . 25 . O 1 2 25 1 2 1 1 29 LEU N . 29 . N 1 2 26 1 1 1 1 26 GLY O . 26 . O 1 2 26 1 2 1 1 30 PHE H . 30 . HN 1 2 27 1 1 1 1 26 GLY O . 26 . O 1 2 27 1 2 1 1 30 PHE N . 30 . N 1 2 28 1 1 1 1 27 LEU O . 27 . O 1 2 28 1 2 1 1 31 SER H . 31 . HN 1 2 29 1 1 1 1 27 LEU O . 27 . O 1 2 29 1 2 1 1 31 SER N . 31 . N 1 2 30 1 1 1 1 29 LEU O . 29 . O 1 2 30 1 2 1 1 33 VAL H . 33 . HN 1 2 31 1 1 1 1 29 LEU O . 29 . O 1 2 31 1 2 1 1 33 VAL N . 33 . N 1 2 32 1 1 1 1 32 ALA O . 32 . O 1 2 32 1 2 1 1 36 VAL H . 36 . HN 1 2 33 1 1 1 1 32 ALA O . 32 . O 1 2 33 1 2 1 1 36 VAL N . 36 . N 1 2 34 1 1 1 1 33 VAL O . 33 . O 1 2 34 1 2 1 1 37 ALA H . 37 . HN 1 2 35 1 1 1 1 33 VAL O . 33 . O 1 2 35 1 2 1 1 37 ALA N . 37 . N 1 2 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 3.5 2.7 3.7 1 2 2 1 . . . . . 2.5 2.0 2.7 1 2 3 1 . . . . . 3.5 2.7 3.7 1 2 4 1 . . . . . 2.5 2.0 2.7 1 2 5 1 . . . . . 3.5 2.7 3.7 1 2 6 1 . . . . . 2.5 2.0 2.7 1 2 7 1 . . . . . 3.5 2.7 3.7 1 2 8 1 . . . . . 2.5 2.0 2.7 1 2 9 1 . . . . . 3.5 2.7 3.7 1 2 10 1 . . . . . 2.5 2.0 2.7 1 2 11 1 . . . . . 3.5 2.7 3.7 1 2 12 1 . . . . . 2.5 2.0 2.7 1 2 13 1 . . . . . 3.5 2.7 3.7 1 2 14 1 . . . . . 2.5 2.0 2.7 1 2 15 1 . . . . . 3.5 2.7 3.7 1 2 16 1 . . . . . 2.5 2.0 2.7 1 2 17 1 . . . . . 3.5 2.7 3.7 1 2 18 1 . . . . . 2.5 2.0 2.7 1 2 19 1 . . . . . 3.5 2.7 3.7 1 2 20 1 . . . . . 2.5 2.0 2.7 1 2 21 1 . . . . . 3.5 2.7 3.7 1 2 22 1 . . . . . 2.5 2.0 2.7 1 2 23 1 . . . . . 3.5 2.7 3.7 1 2 24 1 . . . . . 2.5 2.0 2.7 1 2 25 1 . . . . . 3.5 2.7 3.7 1 2 26 1 . . . . . 2.5 2.0 2.7 1 2 27 1 . . . . . 3.5 2.7 3.7 1 2 28 1 . . . . . 2.5 2.0 2.7 1 2 29 1 . . . . . 3.5 2.7 3.7 1 2 30 1 . . . . . 2.5 2.0 2.7 1 2 31 1 . . . . . 3.5 2.7 3.7 1 2 32 1 . . . . . 2.5 2.0 2.7 1 2 33 1 . . . . . 3.5 2.7 3.7 1 2 34 1 . . . . . 2.5 2.0 2.7 1 2 35 1 . . . . . 3.5 2.7 3.7 1 2 stop_ save_ save_conformer_family_coord_set_1 _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Entry_ID 1 _Conformer_family_coord_set.ID 1 loop_ _Atom_site.Model_ID _Atom_site.ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Occupancy _Atom_site.Uncertainty _Atom_site.PDBX_label_asym_ID _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID 1 1 1 1 1 ALA C C -2.894 -10.438 30.215 1.00 . A A . 1 ALA C 1 1 1 2 1 1 1 ALA CA C -2.797 -11.591 31.216 1.00 . A A . 1 ALA CA 1 1 1 3 1 1 1 ALA CB C -2.959 -11.049 32.637 1.00 . A A . 1 ALA CB 1 1 1 4 1 1 1 ALA H1 H -1.121 -12.144 30.111 1.00 . A A . 1 ALA H1 1 1 1 5 1 1 1 ALA H2 H -0.793 -11.809 31.741 1.00 . A A . 1 ALA H2 1 1 1 6 1 1 1 ALA H3 H -1.559 -13.263 31.311 1.00 . A A . 1 ALA H3 1 1 1 7 1 1 1 ALA HA H -3.577 -12.310 31.014 1.00 . A A . 1 ALA HA 1 1 1 8 1 1 1 ALA HB1 H -2.339 -11.620 33.313 1.00 . A A . 1 ALA HB1 1 1 1 9 1 1 1 ALA HB2 H -2.659 -10.012 32.663 1.00 . A A . 1 ALA HB2 1 1 1 10 1 1 1 ALA HB3 H -3.992 -11.132 32.938 1.00 . A A . 1 ALA HB3 1 1 1 11 1 1 1 ALA N N -1.467 -12.251 31.085 1.00 . A A . 1 ALA N 1 1 1 12 1 1 1 ALA O O -2.108 -9.512 30.241 1.00 . A A . 1 ALA O 1 1 1 13 1 1 2 ASP C C -5.397 -9.452 27.709 1.00 . A A . 2 ASP C 1 1 1 14 1 1 2 ASP CA C -4.001 -9.391 28.332 1.00 . A A . 2 ASP CA 1 1 1 15 1 1 2 ASP CB C -2.946 -9.557 27.236 1.00 . A A . 2 ASP CB 1 1 1 16 1 1 2 ASP CG C -3.051 -10.959 26.634 1.00 . A A . 2 ASP CG 1 1 1 17 1 1 2 ASP H H -4.479 -11.241 29.327 1.00 . A A . 2 ASP H 1 1 1 18 1 1 2 ASP HA H -3.866 -8.437 28.819 1.00 . A A . 2 ASP HA 1 1 1 19 1 1 2 ASP HB2 H -3.110 -8.819 26.464 1.00 . A A . 2 ASP HB2 1 1 1 20 1 1 2 ASP HB3 H -1.962 -9.422 27.659 1.00 . A A . 2 ASP HB3 1 1 1 21 1 1 2 ASP N N -3.854 -10.485 29.332 1.00 . A A . 2 ASP N 1 1 1 22 1 1 2 ASP O O -6.192 -10.314 28.025 1.00 . A A . 2 ASP O 1 1 1 23 1 1 2 ASP OD1 O -3.924 -11.163 25.806 1.00 . A A . 2 ASP OD1 1 1 1 24 1 1 2 ASP OD2 O -2.257 -11.805 27.010 1.00 . A A . 2 ASP OD2 1 1 1 25 1 1 3 LYS C C -7.066 -9.529 25.039 1.00 . A A . 3 LYS C 1 1 1 26 1 1 3 LYS CA C -7.046 -8.546 26.181 1.00 . A A . 3 LYS CA 1 1 1 27 1 1 3 LYS CB C -7.385 -7.145 25.671 1.00 . A A . 3 LYS CB 1 1 1 28 1 1 3 LYS CD C -7.305 -5.977 27.879 1.00 . A A . 3 LYS CD 1 1 1 29 1 1 3 LYS CE C -7.792 -4.642 28.446 1.00 . A A . 3 LYS CE 1 1 1 30 1 1 3 LYS CG C -8.212 -6.403 26.723 1.00 . A A . 3 LYS CG 1 1 1 31 1 1 3 LYS H H -5.046 -7.855 26.583 1.00 . A A . 3 LYS H 1 1 1 32 1 1 3 LYS HA H -7.793 -8.867 26.887 1.00 . A A . 3 LYS HA 1 1 1 33 1 1 3 LYS HB2 H -6.471 -6.600 25.481 1.00 . A A . 3 LYS HB2 1 1 1 34 1 1 3 LYS HB3 H -7.955 -7.222 24.757 1.00 . A A . 3 LYS HB3 1 1 1 35 1 1 3 LYS HD2 H -7.332 -6.730 28.654 1.00 . A A . 3 LYS HD2 1 1 1 36 1 1 3 LYS HD3 H -6.293 -5.866 27.520 1.00 . A A . 3 LYS HD3 1 1 1 37 1 1 3 LYS HE2 H -7.105 -4.303 29.207 1.00 . A A . 3 LYS HE2 1 1 1 38 1 1 3 LYS HE3 H -7.841 -3.911 27.653 1.00 . A A . 3 LYS HE3 1 1 1 39 1 1 3 LYS HG2 H -8.662 -5.529 26.276 1.00 . A A . 3 LYS HG2 1 1 1 40 1 1 3 LYS HG3 H -8.987 -7.056 27.097 1.00 . A A . 3 LYS HG3 1 1 1 41 1 1 3 LYS HZ1 H -9.760 -5.319 28.368 1.00 . A A . 3 LYS HZ1 1 1 1 42 1 1 3 LYS HZ2 H -9.068 -5.376 29.918 1.00 . A A . 3 LYS HZ2 1 1 1 43 1 1 3 LYS HZ3 H -9.556 -3.889 29.256 1.00 . A A . 3 LYS HZ3 1 1 1 44 1 1 3 LYS N N -5.701 -8.542 26.825 1.00 . A A . 3 LYS N 1 1 1 45 1 1 3 LYS NZ N -9.146 -4.820 29.042 1.00 . A A . 3 LYS NZ 1 1 1 46 1 1 3 LYS O O -7.292 -10.704 25.245 1.00 . A A . 3 LYS O 1 1 1 47 1 1 4 SER C C -8.318 -10.741 22.887 1.00 . A A . 4 SER C 1 1 1 48 1 1 4 SER CA C -6.966 -10.096 22.746 1.00 . A A . 4 SER CA 1 1 1 49 1 1 4 SER CB C -5.857 -11.120 22.958 1.00 . A A . 4 SER CB 1 1 1 50 1 1 4 SER H H -6.737 -8.146 23.642 1.00 . A A . 4 SER H 1 1 1 51 1 1 4 SER HA H -6.892 -9.666 21.773 1.00 . A A . 4 SER HA 1 1 1 52 1 1 4 SER HB2 H -5.524 -11.494 22.008 1.00 . A A . 4 SER HB2 1 1 1 53 1 1 4 SER HB3 H -5.031 -10.641 23.463 1.00 . A A . 4 SER HB3 1 1 1 54 1 1 4 SER HG H -5.660 -12.862 23.802 1.00 . A A . 4 SER HG 1 1 1 55 1 1 4 SER N N -6.884 -9.095 23.827 1.00 . A A . 4 SER N 1 1 1 56 1 1 4 SER O O -8.502 -11.830 22.482 1.00 . A A . 4 SER O 1 1 1 57 1 1 4 SER OG O -6.348 -12.196 23.748 1.00 . A A . 4 SER OG 1 1 1 58 1 1 5 ASP C C -10.639 -12.097 23.563 1.00 . A A . 5 ASP C 1 1 1 59 1 1 5 ASP CA C -10.619 -10.602 23.766 1.00 . A A . 5 ASP CA 1 1 1 60 1 1 5 ASP CB C -11.688 -9.929 22.905 1.00 . A A . 5 ASP CB 1 1 1 61 1 1 5 ASP CG C -12.988 -9.812 23.703 1.00 . A A . 5 ASP CG 1 1 1 62 1 1 5 ASP H H -9.027 -9.158 23.848 1.00 . A A . 5 ASP H 1 1 1 63 1 1 5 ASP HA H -10.831 -10.421 24.755 1.00 . A A . 5 ASP HA 1 1 1 64 1 1 5 ASP HB2 H -11.351 -8.945 22.619 1.00 . A A . 5 ASP HB2 1 1 1 65 1 1 5 ASP HB3 H -11.863 -10.523 22.023 1.00 . A A . 5 ASP HB3 1 1 1 66 1 1 5 ASP N N -9.248 -10.048 23.510 1.00 . A A . 5 ASP N 1 1 1 67 1 1 5 ASP O O -11.535 -12.629 22.941 1.00 . A A . 5 ASP O 1 1 1 68 1 1 5 ASP OD1 O -13.000 -9.073 24.674 1.00 . A A . 5 ASP OD1 1 1 1 69 1 1 5 ASP OD2 O -13.950 -10.464 23.330 1.00 . A A . 5 ASP OD2 1 1 1 70 1 1 6 LEU C C -10.320 -14.720 22.780 1.00 . A A . 6 LEU C 1 1 1 71 1 1 6 LEU CA C -9.450 -14.238 23.900 1.00 . A A . 6 LEU CA 1 1 1 72 1 1 6 LEU CB C -9.787 -14.950 25.151 1.00 . A A . 6 LEU CB 1 1 1 73 1 1 6 LEU CD1 C -7.648 -14.688 26.352 1.00 . A A . 6 LEU CD1 1 1 1 74 1 1 6 LEU CD2 C -8.874 -16.877 26.441 1.00 . A A . 6 LEU CD2 1 1 1 75 1 1 6 LEU CG C -8.529 -15.663 25.578 1.00 . A A . 6 LEU CG 1 1 1 76 1 1 6 LEU H H -8.912 -12.235 24.557 1.00 . A A . 6 LEU H 1 1 1 77 1 1 6 LEU HA H -8.414 -14.440 23.627 1.00 . A A . 6 LEU HA 1 1 1 78 1 1 6 LEU HB2 H -10.094 -14.231 25.881 1.00 . A A . 6 LEU HB2 1 1 1 79 1 1 6 LEU HB3 H -10.570 -15.656 24.956 1.00 . A A . 6 LEU HB3 1 1 1 80 1 1 6 LEU HD11 H -7.525 -13.785 25.767 1.00 . A A . 6 LEU HD11 1 1 1 81 1 1 6 LEU HD12 H -8.116 -14.447 27.294 1.00 . A A . 6 LEU HD12 1 1 1 82 1 1 6 LEU HD13 H -6.682 -15.136 26.530 1.00 . A A . 6 LEU HD13 1 1 1 83 1 1 6 LEU HD21 H -9.751 -17.364 26.042 1.00 . A A . 6 LEU HD21 1 1 1 84 1 1 6 LEU HD22 H -8.044 -17.568 26.437 1.00 . A A . 6 LEU HD22 1 1 1 85 1 1 6 LEU HD23 H -9.070 -16.555 27.453 1.00 . A A . 6 LEU HD23 1 1 1 86 1 1 6 LEU HG H -8.009 -15.975 24.680 1.00 . A A . 6 LEU HG 1 1 1 87 1 1 6 LEU N N -9.612 -12.753 24.073 1.00 . A A . 6 LEU N 1 1 1 88 1 1 6 LEU O O -11.131 -15.619 22.878 1.00 . A A . 6 LEU O 1 1 1 89 1 1 7 GLY C C -10.588 -13.071 19.611 1.00 . A A . 7 GLY C 1 1 1 90 1 1 7 GLY CA C -10.880 -14.276 20.480 1.00 . A A . 7 GLY CA 1 1 1 91 1 1 7 GLY H H -9.459 -13.328 21.807 1.00 . A A . 7 GLY H 1 1 1 92 1 1 7 GLY HA2 H -11.938 -14.335 20.679 1.00 . A A . 7 GLY HA2 1 1 1 93 1 1 7 GLY HA3 H -10.535 -15.182 19.999 1.00 . A A . 7 GLY HA3 1 1 1 94 1 1 7 GLY N N -10.128 -14.048 21.740 1.00 . A A . 7 GLY N 1 1 1 95 1 1 7 GLY O O -10.209 -13.185 18.462 1.00 . A A . 7 GLY O 1 1 1 96 1 1 8 TYR C C -8.871 -10.869 19.114 1.00 . A A . 8 TYR C 1 1 1 97 1 1 8 TYR CA C -10.333 -10.696 19.461 1.00 . A A . 8 TYR CA 1 1 1 98 1 1 8 TYR CB C -10.548 -9.504 20.374 1.00 . A A . 8 TYR CB 1 1 1 99 1 1 8 TYR CD1 C -10.012 -7.525 18.885 1.00 . A A . 8 TYR CD1 1 1 1 100 1 1 8 TYR CD2 C -8.569 -8.084 20.747 1.00 . A A . 8 TYR CD2 1 1 1 101 1 1 8 TYR CE1 C -9.187 -6.436 18.571 1.00 . A A . 8 TYR CE1 1 1 1 102 1 1 8 TYR CE2 C -7.742 -6.997 20.442 1.00 . A A . 8 TYR CE2 1 1 1 103 1 1 8 TYR CG C -9.689 -8.344 19.978 1.00 . A A . 8 TYR CG 1 1 1 104 1 1 8 TYR CZ C -8.052 -6.170 19.352 1.00 . A A . 8 TYR CZ 1 1 1 105 1 1 8 TYR H H -10.926 -11.841 21.128 1.00 . A A . 8 TYR H 1 1 1 106 1 1 8 TYR HA H -10.929 -10.617 18.585 1.00 . A A . 8 TYR HA 1 1 1 107 1 1 8 TYR HB2 H -11.581 -9.211 20.349 1.00 . A A . 8 TYR HB2 1 1 1 108 1 1 8 TYR HB3 H -10.276 -9.799 21.375 1.00 . A A . 8 TYR HB3 1 1 1 109 1 1 8 TYR HD1 H -10.883 -7.737 18.279 1.00 . A A . 8 TYR HD1 1 1 1 110 1 1 8 TYR HD2 H -8.347 -8.736 21.584 1.00 . A A . 8 TYR HD2 1 1 1 111 1 1 8 TYR HE1 H -9.426 -5.800 17.731 1.00 . A A . 8 TYR HE1 1 1 1 112 1 1 8 TYR HE2 H -6.868 -6.795 21.044 1.00 . A A . 8 TYR HE2 1 1 1 113 1 1 8 TYR HH H -6.422 -5.439 18.679 1.00 . A A . 8 TYR HH 1 1 1 114 1 1 8 TYR N N -10.685 -11.907 20.192 1.00 . A A . 8 TYR N 1 1 1 115 1 1 8 TYR O O -8.375 -10.346 18.161 1.00 . A A . 8 TYR O 1 1 1 116 1 1 8 TYR OH O -7.240 -5.097 19.047 1.00 . A A . 8 TYR OH 1 1 1 117 1 1 9 THR C C -6.572 -12.179 18.113 1.00 . A A . 9 THR C 1 1 1 118 1 1 9 THR CA C -6.743 -11.915 19.616 1.00 . A A . 9 THR CA 1 1 1 119 1 1 9 THR CB C -6.289 -13.170 20.380 1.00 . A A . 9 THR CB 1 1 1 120 1 1 9 THR CG2 C -4.763 -13.258 20.379 1.00 . A A . 9 THR CG2 1 1 1 121 1 1 9 THR H H -8.636 -12.058 20.682 1.00 . A A . 9 THR H 1 1 1 122 1 1 9 THR HA H -6.143 -11.067 19.912 1.00 . A A . 9 THR HA 1 1 1 123 1 1 9 THR HB H -6.699 -14.049 19.915 1.00 . A A . 9 THR HB 1 1 1 124 1 1 9 THR HG1 H -7.700 -13.261 21.654 1.00 . A A . 9 THR HG1 1 1 1 125 1 1 9 THR HG21 H -4.349 -12.334 20.002 1.00 . A A . 9 THR HG21 1 1 1 126 1 1 9 THR HG22 H -4.411 -13.425 21.386 1.00 . A A . 9 THR HG22 1 1 1 127 1 1 9 THR HG23 H -4.450 -14.076 19.747 1.00 . A A . 9 THR HG23 1 1 1 128 1 1 9 THR N N -8.187 -11.644 19.902 1.00 . A A . 9 THR N 1 1 1 129 1 1 9 THR O O -5.771 -11.557 17.441 1.00 . A A . 9 THR O 1 1 1 130 1 1 9 THR OG1 O -6.763 -13.115 21.696 1.00 . A A . 9 THR OG1 1 1 1 131 1 1 10 GLY C C -7.778 -12.339 15.265 1.00 . A A . 10 GLY C 1 1 1 132 1 1 10 GLY CA C -7.201 -13.462 16.135 1.00 . A A . 10 GLY CA 1 1 1 133 1 1 10 GLY H H -7.941 -13.615 18.164 1.00 . A A . 10 GLY H 1 1 1 134 1 1 10 GLY HA2 H -7.743 -14.375 15.939 1.00 . A A . 10 GLY HA2 1 1 1 135 1 1 10 GLY HA3 H -6.159 -13.604 15.883 1.00 . A A . 10 GLY HA3 1 1 1 136 1 1 10 GLY N N -7.315 -13.120 17.590 1.00 . A A . 10 GLY N 1 1 1 137 1 1 10 GLY O O -7.042 -11.589 14.648 1.00 . A A . 10 GLY O 1 1 1 138 1 1 11 LEU C C -8.879 -9.897 14.460 1.00 . A A . 11 LEU C 1 1 1 139 1 1 11 LEU CA C -9.705 -11.164 14.355 1.00 . A A . 11 LEU CA 1 1 1 140 1 1 11 LEU CB C -11.165 -10.932 14.790 1.00 . A A . 11 LEU CB 1 1 1 141 1 1 11 LEU CD1 C -11.696 -8.501 14.980 1.00 . A A . 11 LEU CD1 1 1 1 142 1 1 11 LEU CD2 C -12.317 -10.052 16.824 1.00 . A A . 11 LEU CD2 1 1 1 143 1 1 11 LEU CG C -11.270 -9.746 15.752 1.00 . A A . 11 LEU CG 1 1 1 144 1 1 11 LEU H H -9.657 -12.848 15.676 1.00 . A A . 11 LEU H 1 1 1 145 1 1 11 LEU HA H -9.691 -11.475 13.330 1.00 . A A . 11 LEU HA 1 1 1 146 1 1 11 LEU HB2 H -11.768 -10.733 13.916 1.00 . A A . 11 LEU HB2 1 1 1 147 1 1 11 LEU HB3 H -11.535 -11.820 15.280 1.00 . A A . 11 LEU HB3 1 1 1 148 1 1 11 LEU HD11 H -11.390 -8.594 13.948 1.00 . A A . 11 LEU HD11 1 1 1 149 1 1 11 LEU HD12 H -12.770 -8.396 15.029 1.00 . A A . 11 LEU HD12 1 1 1 150 1 1 11 LEU HD13 H -11.230 -7.633 15.419 1.00 . A A . 11 LEU HD13 1 1 1 151 1 1 11 LEU HD21 H -12.207 -11.075 17.153 1.00 . A A . 11 LEU HD21 1 1 1 152 1 1 11 LEU HD22 H -12.180 -9.385 17.662 1.00 . A A . 11 LEU HD22 1 1 1 153 1 1 11 LEU HD23 H -13.305 -9.912 16.411 1.00 . A A . 11 LEU HD23 1 1 1 154 1 1 11 LEU HG H -10.308 -9.572 16.213 1.00 . A A . 11 LEU HG 1 1 1 155 1 1 11 LEU N N -9.086 -12.227 15.192 1.00 . A A . 11 LEU N 1 1 1 156 1 1 11 LEU O O -8.817 -9.140 13.540 1.00 . A A . 11 LEU O 1 1 1 157 1 1 12 THR C C -6.485 -8.442 14.491 1.00 . A A . 12 THR C 1 1 1 158 1 1 12 THR CA C -7.368 -8.485 15.689 1.00 . A A . 12 THR CA 1 1 1 159 1 1 12 THR CB C -6.486 -8.572 16.938 1.00 . A A . 12 THR CB 1 1 1 160 1 1 12 THR CG2 C -5.373 -7.523 16.870 1.00 . A A . 12 THR CG2 1 1 1 161 1 1 12 THR H H -8.273 -10.315 16.284 1.00 . A A . 12 THR H 1 1 1 162 1 1 12 THR HA H -7.973 -7.623 15.729 1.00 . A A . 12 THR HA 1 1 1 163 1 1 12 THR HB H -6.050 -9.553 17.007 1.00 . A A . 12 THR HB 1 1 1 164 1 1 12 THR HG1 H -8.185 -8.311 17.748 1.00 . A A . 12 THR HG1 1 1 1 165 1 1 12 THR HG21 H -4.807 -7.657 15.960 1.00 . A A . 12 THR HG21 1 1 1 166 1 1 12 THR HG22 H -5.809 -6.535 16.880 1.00 . A A . 12 THR HG22 1 1 1 167 1 1 12 THR HG23 H -4.719 -7.636 17.721 1.00 . A A . 12 THR HG23 1 1 1 168 1 1 12 THR N N -8.221 -9.684 15.563 1.00 . A A . 12 THR N 1 1 1 169 1 1 12 THR O O -6.622 -7.624 13.627 1.00 . A A . 12 THR O 1 1 1 170 1 1 12 THR OG1 O -7.288 -8.329 18.062 1.00 . A A . 12 THR OG1 1 1 1 171 1 1 13 ASP C C -5.305 -8.961 12.046 1.00 . A A . 13 ASP C 1 1 1 172 1 1 13 ASP CA C -4.632 -9.438 13.316 1.00 . A A . 13 ASP CA 1 1 1 173 1 1 13 ASP CB C -4.143 -10.879 13.152 1.00 . A A . 13 ASP CB 1 1 1 174 1 1 13 ASP CG C -2.629 -10.932 13.369 1.00 . A A . 13 ASP CG 1 1 1 175 1 1 13 ASP H H -5.531 -9.978 15.194 1.00 . A A . 13 ASP H 1 1 1 176 1 1 13 ASP HA H -3.812 -8.792 13.510 1.00 . A A . 13 ASP HA 1 1 1 177 1 1 13 ASP HB2 H -4.635 -11.512 13.880 1.00 . A A . 13 ASP HB2 1 1 1 178 1 1 13 ASP HB3 H -4.374 -11.227 12.157 1.00 . A A . 13 ASP HB3 1 1 1 179 1 1 13 ASP N N -5.581 -9.349 14.454 1.00 . A A . 13 ASP N 1 1 1 180 1 1 13 ASP O O -4.685 -8.354 11.196 1.00 . A A . 13 ASP O 1 1 1 181 1 1 13 ASP OD1 O -1.928 -10.197 12.694 1.00 . A A . 13 ASP OD1 1 1 1 182 1 1 13 ASP OD2 O -2.197 -11.706 14.207 1.00 . A A . 13 ASP OD2 1 1 1 183 1 1 14 GLU C C -7.599 -7.189 10.917 1.00 . A A . 14 GLU C 1 1 1 184 1 1 14 GLU CA C -7.245 -8.666 10.714 1.00 . A A . 14 GLU CA 1 1 1 185 1 1 14 GLU CB C -8.516 -9.441 10.443 1.00 . A A . 14 GLU CB 1 1 1 186 1 1 14 GLU CD C -8.627 -11.034 8.521 1.00 . A A . 14 GLU CD 1 1 1 187 1 1 14 GLU CG C -8.721 -9.564 8.933 1.00 . A A . 14 GLU CG 1 1 1 188 1 1 14 GLU H H -7.087 -9.640 12.630 1.00 . A A . 14 GLU H 1 1 1 189 1 1 14 GLU HA H -6.564 -8.763 9.887 1.00 . A A . 14 GLU HA 1 1 1 190 1 1 14 GLU HB2 H -8.441 -10.421 10.886 1.00 . A A . 14 GLU HB2 1 1 1 191 1 1 14 GLU HB3 H -9.345 -8.906 10.875 1.00 . A A . 14 GLU HB3 1 1 1 192 1 1 14 GLU HG2 H -9.693 -9.175 8.670 1.00 . A A . 14 GLU HG2 1 1 1 193 1 1 14 GLU HG3 H -7.955 -8.998 8.422 1.00 . A A . 14 GLU HG3 1 1 1 194 1 1 14 GLU N N -6.577 -9.176 11.921 1.00 . A A . 14 GLU N 1 1 1 195 1 1 14 GLU O O -7.278 -6.359 10.098 1.00 . A A . 14 GLU O 1 1 1 196 1 1 14 GLU OE1 O -7.516 -11.516 8.368 1.00 . A A . 14 GLU OE1 1 1 1 197 1 1 14 GLU OE2 O -9.666 -11.653 8.365 1.00 . A A . 14 GLU OE2 1 1 1 198 1 1 15 GLN C C -7.311 -4.673 12.456 1.00 . A A . 15 GLN C 1 1 1 199 1 1 15 GLN CA C -8.596 -5.427 12.266 1.00 . A A . 15 GLN CA 1 1 1 200 1 1 15 GLN CB C -9.412 -5.313 13.537 1.00 . A A . 15 GLN CB 1 1 1 201 1 1 15 GLN CD C -11.181 -6.494 12.219 1.00 . A A . 15 GLN CD 1 1 1 202 1 1 15 GLN CG C -10.484 -6.398 13.579 1.00 . A A . 15 GLN CG 1 1 1 203 1 1 15 GLN H H -8.484 -7.533 12.664 1.00 . A A . 15 GLN H 1 1 1 204 1 1 15 GLN HA H -9.132 -5.026 11.442 1.00 . A A . 15 GLN HA 1 1 1 205 1 1 15 GLN HB2 H -8.752 -5.432 14.380 1.00 . A A . 15 GLN HB2 1 1 1 206 1 1 15 GLN HB3 H -9.873 -4.342 13.570 1.00 . A A . 15 GLN HB3 1 1 1 207 1 1 15 GLN HE21 H -11.994 -4.687 12.348 1.00 . A A . 15 GLN HE21 1 1 1 208 1 1 15 GLN HE22 H -12.352 -5.544 10.927 1.00 . A A . 15 GLN HE22 1 1 1 209 1 1 15 GLN HG2 H -10.021 -7.345 13.818 1.00 . A A . 15 GLN HG2 1 1 1 210 1 1 15 GLN HG3 H -11.211 -6.153 14.339 1.00 . A A . 15 GLN HG3 1 1 1 211 1 1 15 GLN N N -8.246 -6.853 12.009 1.00 . A A . 15 GLN N 1 1 1 212 1 1 15 GLN NE2 N -11.902 -5.492 11.797 1.00 . A A . 15 GLN NE2 1 1 1 213 1 1 15 GLN O O -7.052 -3.653 11.852 1.00 . A A . 15 GLN O 1 1 1 214 1 1 15 GLN OE1 O -11.068 -7.492 11.535 1.00 . A A . 15 GLN OE1 1 1 1 215 1 1 16 ALA C C -4.581 -4.313 12.134 1.00 . A A . 16 ALA C 1 1 1 216 1 1 16 ALA CA C -5.173 -4.595 13.511 1.00 . A A . 16 ALA CA 1 1 1 217 1 1 16 ALA CB C -4.305 -5.593 14.269 1.00 . A A . 16 ALA CB 1 1 1 218 1 1 16 ALA H H -6.734 -6.023 13.739 1.00 . A A . 16 ALA H 1 1 1 219 1 1 16 ALA HA H -5.276 -3.681 14.069 1.00 . A A . 16 ALA HA 1 1 1 220 1 1 16 ALA HB1 H -4.090 -5.209 15.255 1.00 . A A . 16 ALA HB1 1 1 1 221 1 1 16 ALA HB2 H -4.841 -6.532 14.354 1.00 . A A . 16 ALA HB2 1 1 1 222 1 1 16 ALA HB3 H -3.382 -5.752 13.732 1.00 . A A . 16 ALA HB3 1 1 1 223 1 1 16 ALA N N -6.488 -5.204 13.284 1.00 . A A . 16 ALA N 1 1 1 224 1 1 16 ALA O O -3.785 -3.415 11.959 1.00 . A A . 16 ALA O 1 1 1 225 1 1 17 GLN C C -5.355 -3.781 9.094 1.00 . A A . 17 GLN C 1 1 1 226 1 1 17 GLN CA C -4.486 -4.837 9.766 1.00 . A A . 17 GLN CA 1 1 1 227 1 1 17 GLN CB C -4.502 -6.155 8.987 1.00 . A A . 17 GLN CB 1 1 1 228 1 1 17 GLN CD C -5.208 -7.303 6.876 1.00 . A A . 17 GLN CD 1 1 1 229 1 1 17 GLN CG C -5.482 -6.116 7.801 1.00 . A A . 17 GLN CG 1 1 1 230 1 1 17 GLN H H -5.663 -5.792 11.309 1.00 . A A . 17 GLN H 1 1 1 231 1 1 17 GLN HA H -3.476 -4.470 9.826 1.00 . A A . 17 GLN HA 1 1 1 232 1 1 17 GLN HB2 H -3.510 -6.344 8.620 1.00 . A A . 17 GLN HB2 1 1 1 233 1 1 17 GLN HB3 H -4.793 -6.942 9.658 1.00 . A A . 17 GLN HB3 1 1 1 234 1 1 17 GLN HE21 H -5.825 -6.354 5.244 1.00 . A A . 17 GLN HE21 1 1 1 235 1 1 17 GLN HE22 H -5.290 -7.946 4.999 1.00 . A A . 17 GLN HE22 1 1 1 236 1 1 17 GLN HG2 H -6.495 -6.173 8.169 1.00 . A A . 17 GLN HG2 1 1 1 237 1 1 17 GLN HG3 H -5.350 -5.197 7.253 1.00 . A A . 17 GLN HG3 1 1 1 238 1 1 17 GLN N N -4.998 -5.072 11.144 1.00 . A A . 17 GLN N 1 1 1 239 1 1 17 GLN NE2 N -5.462 -7.192 5.600 1.00 . A A . 17 GLN NE2 1 1 1 240 1 1 17 GLN O O -4.885 -2.986 8.304 1.00 . A A . 17 GLN O 1 1 1 241 1 1 17 GLN OE1 O -4.758 -8.342 7.317 1.00 . A A . 17 GLN OE1 1 1 1 242 1 1 18 GLU C C -6.791 -1.386 8.903 1.00 . A A . 18 GLU C 1 1 1 243 1 1 18 GLU CA C -7.519 -2.723 8.843 1.00 . A A . 18 GLU CA 1 1 1 244 1 1 18 GLU CB C -8.814 -2.645 9.654 1.00 . A A . 18 GLU CB 1 1 1 245 1 1 18 GLU CD C -9.861 -4.490 8.335 1.00 . A A . 18 GLU CD 1 1 1 246 1 1 18 GLU CG C -9.998 -3.028 8.764 1.00 . A A . 18 GLU CG 1 1 1 247 1 1 18 GLU H H -6.959 -4.386 10.080 1.00 . A A . 18 GLU H 1 1 1 248 1 1 18 GLU HA H -7.741 -2.973 7.816 1.00 . A A . 18 GLU HA 1 1 1 249 1 1 18 GLU HB2 H -8.755 -3.327 10.491 1.00 . A A . 18 GLU HB2 1 1 1 250 1 1 18 GLU HB3 H -8.951 -1.638 10.019 1.00 . A A . 18 GLU HB3 1 1 1 251 1 1 18 GLU HG2 H -10.918 -2.898 9.315 1.00 . A A . 18 GLU HG2 1 1 1 252 1 1 18 GLU HG3 H -10.009 -2.398 7.888 1.00 . A A . 18 GLU HG3 1 1 1 253 1 1 18 GLU N N -6.617 -3.749 9.429 1.00 . A A . 18 GLU N 1 1 1 254 1 1 18 GLU O O -7.058 -0.479 8.141 1.00 . A A . 18 GLU O 1 1 1 255 1 1 18 GLU OE1 O -9.114 -5.209 8.979 1.00 . A A . 18 GLU OE1 1 1 1 256 1 1 18 GLU OE2 O -10.506 -4.867 7.370 1.00 . A A . 18 GLU OE2 1 1 1 257 1 1 19 LEU C C -3.629 -0.299 9.504 1.00 . A A . 19 LEU C 1 1 1 258 1 1 19 LEU CA C -5.071 -0.027 9.927 1.00 . A A . 19 LEU CA 1 1 1 259 1 1 19 LEU CB C -5.090 0.445 11.377 1.00 . A A . 19 LEU CB 1 1 1 260 1 1 19 LEU CD1 C -2.846 0.334 12.458 1.00 . A A . 19 LEU CD1 1 1 1 261 1 1 19 LEU CD2 C -4.826 -0.716 13.572 1.00 . A A . 19 LEU CD2 1 1 1 262 1 1 19 LEU CG C -4.159 -0.419 12.226 1.00 . A A . 19 LEU CG 1 1 1 263 1 1 19 LEU H H -5.660 -2.021 10.406 1.00 . A A . 19 LEU H 1 1 1 264 1 1 19 LEU HA H -5.496 0.729 9.291 1.00 . A A . 19 LEU HA 1 1 1 265 1 1 19 LEU HB2 H -4.755 1.462 11.414 1.00 . A A . 19 LEU HB2 1 1 1 266 1 1 19 LEU HB3 H -6.093 0.376 11.763 1.00 . A A . 19 LEU HB3 1 1 1 267 1 1 19 LEU HD11 H -2.902 1.309 11.993 1.00 . A A . 19 LEU HD11 1 1 1 268 1 1 19 LEU HD12 H -2.680 0.450 13.519 1.00 . A A . 19 LEU HD12 1 1 1 269 1 1 19 LEU HD13 H -2.030 -0.224 12.025 1.00 . A A . 19 LEU HD13 1 1 1 270 1 1 19 LEU HD21 H -5.262 0.190 13.966 1.00 . A A . 19 LEU HD21 1 1 1 271 1 1 19 LEU HD22 H -5.601 -1.458 13.434 1.00 . A A . 19 LEU HD22 1 1 1 272 1 1 19 LEU HD23 H -4.088 -1.092 14.265 1.00 . A A . 19 LEU HD23 1 1 1 273 1 1 19 LEU HG H -3.956 -1.345 11.710 1.00 . A A . 19 LEU HG 1 1 1 274 1 1 19 LEU N N -5.854 -1.274 9.807 1.00 . A A . 19 LEU N 1 1 1 275 1 1 19 LEU O O -2.935 0.581 9.050 1.00 . A A . 19 LEU O 1 1 1 276 1 1 20 HIS C C -1.673 -2.268 7.845 1.00 . A A . 20 HIS C 1 1 1 277 1 1 20 HIS CA C -1.770 -1.839 9.307 1.00 . A A . 20 HIS CA 1 1 1 278 1 1 20 HIS CB C -1.277 -2.982 10.174 1.00 . A A . 20 HIS CB 1 1 1 279 1 1 20 HIS CD2 C -0.207 -1.876 12.289 1.00 . A A . 20 HIS CD2 1 1 1 280 1 1 20 HIS CE1 C 1.878 -2.066 11.732 1.00 . A A . 20 HIS CE1 1 1 1 281 1 1 20 HIS CG C -0.178 -2.490 11.066 1.00 . A A . 20 HIS CG 1 1 1 282 1 1 20 HIS H H -3.740 -2.197 10.063 1.00 . A A . 20 HIS H 1 1 1 283 1 1 20 HIS HA H -1.150 -0.977 9.474 1.00 . A A . 20 HIS HA 1 1 1 284 1 1 20 HIS HB2 H -2.091 -3.357 10.772 1.00 . A A . 20 HIS HB2 1 1 1 285 1 1 20 HIS HB3 H -0.908 -3.764 9.538 1.00 . A A . 20 HIS HB3 1 1 1 286 1 1 20 HIS HD1 H 1.520 -2.992 9.901 1.00 . A A . 20 HIS HD1 1 1 1 287 1 1 20 HIS HD2 H -1.106 -1.630 12.835 1.00 . A A . 20 HIS HD2 1 1 1 288 1 1 20 HIS HE1 H 2.957 -2.013 11.746 1.00 . A A . 20 HIS HE1 1 1 1 289 1 1 20 HIS N N -3.170 -1.510 9.674 1.00 . A A . 20 HIS N 1 1 1 290 1 1 20 HIS ND1 N 1.161 -2.602 10.727 1.00 . A A . 20 HIS ND1 1 1 1 291 1 1 20 HIS NE2 N 1.092 -1.608 12.711 1.00 . A A . 20 HIS NE2 1 1 1 292 1 1 20 HIS O O -1.226 -1.512 7.007 1.00 . A A . 20 HIS O 1 1 1 293 1 1 21 SER C C -2.266 -2.865 5.191 1.00 . A A . 21 SER C 1 1 1 294 1 1 21 SER CA C -1.969 -3.987 6.136 1.00 . A A . 21 SER CA 1 1 1 295 1 1 21 SER CB C -3.005 -5.071 5.872 1.00 . A A . 21 SER CB 1 1 1 296 1 1 21 SER H H -2.389 -4.085 8.236 1.00 . A A . 21 SER H 1 1 1 297 1 1 21 SER HA H -0.997 -4.362 5.958 1.00 . A A . 21 SER HA 1 1 1 298 1 1 21 SER HB2 H -3.982 -4.698 6.125 1.00 . A A . 21 SER HB2 1 1 1 299 1 1 21 SER HB3 H -2.992 -5.315 4.816 1.00 . A A . 21 SER HB3 1 1 1 300 1 1 21 SER HG H -2.158 -5.950 7.388 1.00 . A A . 21 SER HG 1 1 1 301 1 1 21 SER N N -2.060 -3.491 7.539 1.00 . A A . 21 SER N 1 1 1 302 1 1 21 SER O O -1.409 -2.351 4.505 1.00 . A A . 21 SER O 1 1 1 303 1 1 21 SER OG O -2.711 -6.222 6.652 1.00 . A A . 21 SER OG 1 1 1 304 1 1 22 VAL C C -2.863 -0.308 4.289 1.00 . A A . 22 VAL C 1 1 1 305 1 1 22 VAL CA C -3.954 -1.389 4.329 1.00 . A A . 22 VAL CA 1 1 1 306 1 1 22 VAL CB C -5.245 -0.833 4.947 1.00 . A A . 22 VAL CB 1 1 1 307 1 1 22 VAL CG1 C -5.193 -1.005 6.476 1.00 . A A . 22 VAL CG1 1 1 1 308 1 1 22 VAL CG2 C -5.407 0.653 4.607 1.00 . A A . 22 VAL CG2 1 1 1 309 1 1 22 VAL H H -4.134 -2.939 5.767 1.00 . A A . 22 VAL H 1 1 1 310 1 1 22 VAL HA H -4.147 -1.779 3.347 1.00 . A A . 22 VAL HA 1 1 1 311 1 1 22 VAL HB H -6.085 -1.384 4.560 1.00 . A A . 22 VAL HB 1 1 1 312 1 1 22 VAL HG11 H -4.207 -1.346 6.775 1.00 . A A . 22 VAL HG11 1 1 1 313 1 1 22 VAL HG12 H -5.406 -0.061 6.952 1.00 . A A . 22 VAL HG12 1 1 1 314 1 1 22 VAL HG13 H -5.928 -1.740 6.782 1.00 . A A . 22 VAL HG13 1 1 1 315 1 1 22 VAL HG21 H -4.539 1.197 4.948 1.00 . A A . 22 VAL HG21 1 1 1 316 1 1 22 VAL HG22 H -5.506 0.769 3.538 1.00 . A A . 22 VAL HG22 1 1 1 317 1 1 22 VAL HG23 H -6.289 1.040 5.095 1.00 . A A . 22 VAL HG23 1 1 1 318 1 1 22 VAL N N -3.495 -2.490 5.181 1.00 . A A . 22 VAL N 1 1 1 319 1 1 22 VAL O O -2.449 0.150 3.243 1.00 . A A . 22 VAL O 1 1 1 320 1 1 23 TYR C C -0.166 0.737 4.620 1.00 . A A . 23 TYR C 1 1 1 321 1 1 23 TYR CA C -1.325 1.109 5.539 1.00 . A A . 23 TYR CA 1 1 1 322 1 1 23 TYR CB C -0.803 1.147 6.975 1.00 . A A . 23 TYR CB 1 1 1 323 1 1 23 TYR CD1 C 0.128 3.461 6.655 1.00 . A A . 23 TYR CD1 1 1 1 324 1 1 23 TYR CD2 C -1.236 3.011 8.608 1.00 . A A . 23 TYR CD2 1 1 1 325 1 1 23 TYR CE1 C 0.287 4.788 7.074 1.00 . A A . 23 TYR CE1 1 1 1 326 1 1 23 TYR CE2 C -1.078 4.334 9.029 1.00 . A A . 23 TYR CE2 1 1 1 327 1 1 23 TYR CG C -0.634 2.575 7.423 1.00 . A A . 23 TYR CG 1 1 1 328 1 1 23 TYR CZ C -0.317 5.225 8.261 1.00 . A A . 23 TYR CZ 1 1 1 329 1 1 23 TYR H H -2.755 -0.319 6.262 1.00 . A A . 23 TYR H 1 1 1 330 1 1 23 TYR HA H -1.717 2.077 5.267 1.00 . A A . 23 TYR HA 1 1 1 331 1 1 23 TYR HB2 H -1.500 0.647 7.621 1.00 . A A . 23 TYR HB2 1 1 1 332 1 1 23 TYR HB3 H 0.152 0.644 7.021 1.00 . A A . 23 TYR HB3 1 1 1 333 1 1 23 TYR HD1 H 0.594 3.118 5.741 1.00 . A A . 23 TYR HD1 1 1 1 334 1 1 23 TYR HD2 H -1.822 2.326 9.199 1.00 . A A . 23 TYR HD2 1 1 1 335 1 1 23 TYR HE1 H 0.874 5.474 6.482 1.00 . A A . 23 TYR HE1 1 1 1 336 1 1 23 TYR HE2 H -1.544 4.666 9.946 1.00 . A A . 23 TYR HE2 1 1 1 337 1 1 23 TYR HH H 0.714 6.618 9.062 1.00 . A A . 23 TYR HH 1 1 1 338 1 1 23 TYR N N -2.397 0.079 5.444 1.00 . A A . 23 TYR N 1 1 1 339 1 1 23 TYR O O 0.105 1.401 3.640 1.00 . A A . 23 TYR O 1 1 1 340 1 1 23 TYR OH O -0.160 6.532 8.675 1.00 . A A . 23 TYR OH 1 1 1 341 1 1 24 MET C C 1.240 -1.056 2.680 1.00 . A A . 24 MET C 1 1 1 342 1 1 24 MET CA C 1.696 -0.725 4.108 1.00 . A A . 24 MET CA 1 1 1 343 1 1 24 MET CB C 2.360 -1.954 4.733 1.00 . A A . 24 MET CB 1 1 1 344 1 1 24 MET CE C 6.037 -3.183 4.812 1.00 . A A . 24 MET CE 1 1 1 345 1 1 24 MET CG C 3.820 -1.635 5.055 1.00 . A A . 24 MET CG 1 1 1 346 1 1 24 MET H H 0.306 -0.830 5.753 1.00 . A A . 24 MET H 1 1 1 347 1 1 24 MET HA H 2.408 0.088 4.076 1.00 . A A . 24 MET HA 1 1 1 348 1 1 24 MET HB2 H 1.840 -2.221 5.643 1.00 . A A . 24 MET HB2 1 1 1 349 1 1 24 MET HB3 H 2.318 -2.779 4.038 1.00 . A A . 24 MET HB3 1 1 1 350 1 1 24 MET HE1 H 6.234 -2.222 4.357 1.00 . A A . 24 MET HE1 1 1 1 351 1 1 24 MET HE2 H 6.890 -3.482 5.399 1.00 . A A . 24 MET HE2 1 1 1 352 1 1 24 MET HE3 H 5.855 -3.922 4.043 1.00 . A A . 24 MET HE3 1 1 1 353 1 1 24 MET HG2 H 4.353 -1.422 4.140 1.00 . A A . 24 MET HG2 1 1 1 354 1 1 24 MET HG3 H 3.865 -0.775 5.706 1.00 . A A . 24 MET HG3 1 1 1 355 1 1 24 MET N N 0.535 -0.315 4.945 1.00 . A A . 24 MET N 1 1 1 356 1 1 24 MET O O 2.049 -1.245 1.794 1.00 . A A . 24 MET O 1 1 1 357 1 1 24 MET SD S 4.581 -3.056 5.879 1.00 . A A . 24 MET SD 1 1 1 358 1 1 25 SER C C -0.524 -0.167 0.228 1.00 . A A . 25 SER C 1 1 1 359 1 1 25 SER CA C -0.533 -1.442 1.074 1.00 . A A . 25 SER CA 1 1 1 360 1 1 25 SER CB C -1.957 -1.991 1.155 1.00 . A A . 25 SER CB 1 1 1 361 1 1 25 SER H H -0.681 -0.970 3.166 1.00 . A A . 25 SER H 1 1 1 362 1 1 25 SER HA H 0.113 -2.180 0.620 1.00 . A A . 25 SER HA 1 1 1 363 1 1 25 SER HB2 H -2.128 -2.413 2.131 1.00 . A A . 25 SER HB2 1 1 1 364 1 1 25 SER HB3 H -2.662 -1.187 0.984 1.00 . A A . 25 SER HB3 1 1 1 365 1 1 25 SER HG H -3.062 -3.213 0.120 1.00 . A A . 25 SER HG 1 1 1 366 1 1 25 SER N N -0.042 -1.126 2.445 1.00 . A A . 25 SER N 1 1 1 367 1 1 25 SER O O 0.286 -0.006 -0.663 1.00 . A A . 25 SER O 1 1 1 368 1 1 25 SER OG O -2.127 -3.004 0.172 1.00 . A A . 25 SER OG 1 1 1 369 1 1 26 GLY C C -0.079 2.673 -0.192 1.00 . A A . 26 GLY C 1 1 1 370 1 1 26 GLY CA C -1.448 2.013 -0.275 1.00 . A A . 26 GLY CA 1 1 1 371 1 1 26 GLY H H -2.053 0.602 1.234 1.00 . A A . 26 GLY H 1 1 1 372 1 1 26 GLY HA2 H -2.187 2.676 0.144 1.00 . A A . 26 GLY HA2 1 1 1 373 1 1 26 GLY HA3 H -1.689 1.799 -1.304 1.00 . A A . 26 GLY HA3 1 1 1 374 1 1 26 GLY N N -1.414 0.746 0.506 1.00 . A A . 26 GLY N 1 1 1 375 1 1 26 GLY O O 0.337 3.403 -1.070 1.00 . A A . 26 GLY O 1 1 1 376 1 1 27 LEU C C 2.847 2.660 -0.157 1.00 . A A . 27 LEU C 1 1 1 377 1 1 27 LEU CA C 1.971 2.994 1.054 1.00 . A A . 27 LEU CA 1 1 1 378 1 1 27 LEU CB C 2.575 2.382 2.312 1.00 . A A . 27 LEU CB 1 1 1 379 1 1 27 LEU CD1 C 1.296 4.167 3.514 1.00 . A A . 27 LEU CD1 1 1 1 380 1 1 27 LEU CD2 C 2.918 2.733 4.760 1.00 . A A . 27 LEU CD2 1 1 1 381 1 1 27 LEU CG C 2.635 3.430 3.426 1.00 . A A . 27 LEU CG 1 1 1 382 1 1 27 LEU H H 0.253 1.815 1.555 1.00 . A A . 27 LEU H 1 1 1 383 1 1 27 LEU HA H 1.896 4.063 1.169 1.00 . A A . 27 LEU HA 1 1 1 384 1 1 27 LEU HB2 H 1.953 1.555 2.629 1.00 . A A . 27 LEU HB2 1 1 1 385 1 1 27 LEU HB3 H 3.570 2.025 2.098 1.00 . A A . 27 LEU HB3 1 1 1 386 1 1 27 LEU HD11 H 0.487 3.454 3.457 1.00 . A A . 27 LEU HD11 1 1 1 387 1 1 27 LEU HD12 H 1.240 4.700 4.452 1.00 . A A . 27 LEU HD12 1 1 1 388 1 1 27 LEU HD13 H 1.216 4.868 2.697 1.00 . A A . 27 LEU HD13 1 1 1 389 1 1 27 LEU HD21 H 2.180 1.961 4.927 1.00 . A A . 27 LEU HD21 1 1 1 390 1 1 27 LEU HD22 H 3.902 2.290 4.733 1.00 . A A . 27 LEU HD22 1 1 1 391 1 1 27 LEU HD23 H 2.870 3.455 5.561 1.00 . A A . 27 LEU HD23 1 1 1 392 1 1 27 LEU HG H 3.423 4.138 3.213 1.00 . A A . 27 LEU HG 1 1 1 393 1 1 27 LEU N N 0.621 2.410 0.869 1.00 . A A . 27 LEU N 1 1 1 394 1 1 27 LEU O O 3.320 3.536 -0.854 1.00 . A A . 27 LEU O 1 1 1 395 1 1 28 TRP C C 3.154 1.170 -2.873 1.00 . A A . 28 TRP C 1 1 1 396 1 1 28 TRP CA C 3.918 1.001 -1.562 1.00 . A A . 28 TRP CA 1 1 1 397 1 1 28 TRP CB C 4.335 -0.459 -1.407 1.00 . A A . 28 TRP CB 1 1 1 398 1 1 28 TRP CD1 C 6.639 0.213 -2.086 1.00 . A A . 28 TRP CD1 1 1 1 399 1 1 28 TRP CD2 C 6.064 -1.783 -2.937 1.00 . A A . 28 TRP CD2 1 1 1 400 1 1 28 TRP CE2 C 7.379 -1.515 -3.388 1.00 . A A . 28 TRP CE2 1 1 1 401 1 1 28 TRP CE3 C 5.459 -2.988 -3.334 1.00 . A A . 28 TRP CE3 1 1 1 402 1 1 28 TRP CG C 5.626 -0.665 -2.112 1.00 . A A . 28 TRP CG 1 1 1 403 1 1 28 TRP CH2 C 7.453 -3.606 -4.590 1.00 . A A . 28 TRP CH2 1 1 1 404 1 1 28 TRP CZ2 C 8.069 -2.412 -4.205 1.00 . A A . 28 TRP CZ2 1 1 1 405 1 1 28 TRP CZ3 C 6.150 -3.894 -4.156 1.00 . A A . 28 TRP CZ3 1 1 1 406 1 1 28 TRP H H 2.692 0.711 0.166 1.00 . A A . 28 TRP H 1 1 1 407 1 1 28 TRP HA H 4.790 1.622 -1.582 1.00 . A A . 28 TRP HA 1 1 1 408 1 1 28 TRP HB2 H 4.461 -0.684 -0.361 1.00 . A A . 28 TRP HB2 1 1 1 409 1 1 28 TRP HB3 H 3.580 -1.100 -1.833 1.00 . A A . 28 TRP HB3 1 1 1 410 1 1 28 TRP HD1 H 6.625 1.150 -1.556 1.00 . A A . 28 TRP HD1 1 1 1 411 1 1 28 TRP HE1 H 8.545 0.165 -2.983 1.00 . A A . 28 TRP HE1 1 1 1 412 1 1 28 TRP HE3 H 4.456 -3.220 -3.005 1.00 . A A . 28 TRP HE3 1 1 1 413 1 1 28 TRP HH2 H 7.979 -4.306 -5.222 1.00 . A A . 28 TRP HH2 1 1 1 414 1 1 28 TRP HZ2 H 9.071 -2.185 -4.536 1.00 . A A . 28 TRP HZ2 1 1 1 415 1 1 28 TRP HZ3 H 5.677 -4.817 -4.455 1.00 . A A . 28 TRP HZ3 1 1 1 416 1 1 28 TRP N N 3.071 1.398 -0.409 1.00 . A A . 28 TRP N 1 1 1 417 1 1 28 TRP NE1 N 7.686 -0.284 -2.841 1.00 . A A . 28 TRP NE1 1 1 1 418 1 1 28 TRP O O 3.642 0.828 -3.932 1.00 . A A . 28 TRP O 1 1 1 419 1 1 29 LEU C C 1.528 3.279 -4.609 1.00 . A A . 29 LEU C 1 1 1 420 1 1 29 LEU CA C 1.192 1.894 -4.056 1.00 . A A . 29 LEU CA 1 1 1 421 1 1 29 LEU CB C -0.298 1.762 -3.705 1.00 . A A . 29 LEU CB 1 1 1 422 1 1 29 LEU CD1 C -1.436 2.076 -5.905 1.00 . A A . 29 LEU CD1 1 1 1 423 1 1 29 LEU CD2 C -2.479 2.937 -3.804 1.00 . A A . 29 LEU CD2 1 1 1 424 1 1 29 LEU CG C -1.162 2.706 -4.541 1.00 . A A . 29 LEU CG 1 1 1 425 1 1 29 LEU H H 1.594 1.976 -1.964 1.00 . A A . 29 LEU H 1 1 1 426 1 1 29 LEU HA H 1.466 1.140 -4.780 1.00 . A A . 29 LEU HA 1 1 1 427 1 1 29 LEU HB2 H -0.614 0.746 -3.884 1.00 . A A . 29 LEU HB2 1 1 1 428 1 1 29 LEU HB3 H -0.433 1.994 -2.659 1.00 . A A . 29 LEU HB3 1 1 1 429 1 1 29 LEU HD11 H -0.531 1.616 -6.275 1.00 . A A . 29 LEU HD11 1 1 1 430 1 1 29 LEU HD12 H -2.207 1.325 -5.807 1.00 . A A . 29 LEU HD12 1 1 1 431 1 1 29 LEU HD13 H -1.762 2.839 -6.596 1.00 . A A . 29 LEU HD13 1 1 1 432 1 1 29 LEU HD21 H -2.306 2.854 -2.739 1.00 . A A . 29 LEU HD21 1 1 1 433 1 1 29 LEU HD22 H -2.853 3.923 -4.033 1.00 . A A . 29 LEU HD22 1 1 1 434 1 1 29 LEU HD23 H -3.200 2.195 -4.112 1.00 . A A . 29 LEU HD23 1 1 1 435 1 1 29 LEU HG H -0.656 3.647 -4.672 1.00 . A A . 29 LEU HG 1 1 1 436 1 1 29 LEU N N 1.971 1.698 -2.818 1.00 . A A . 29 LEU N 1 1 1 437 1 1 29 LEU O O 2.022 3.414 -5.703 1.00 . A A . 29 LEU O 1 1 1 438 1 1 30 PHE C C 3.078 5.898 -4.313 1.00 . A A . 30 PHE C 1 1 1 439 1 1 30 PHE CA C 1.569 5.669 -4.343 1.00 . A A . 30 PHE CA 1 1 1 440 1 1 30 PHE CB C 0.874 6.697 -3.455 1.00 . A A . 30 PHE CB 1 1 1 441 1 1 30 PHE CD1 C -1.060 6.465 -5.056 1.00 . A A . 30 PHE CD1 1 1 1 442 1 1 30 PHE CD2 C -0.689 8.604 -3.976 1.00 . A A . 30 PHE CD2 1 1 1 443 1 1 30 PHE CE1 C -2.167 6.996 -5.728 1.00 . A A . 30 PHE CE1 1 1 1 444 1 1 30 PHE CE2 C -1.796 9.135 -4.648 1.00 . A A . 30 PHE CE2 1 1 1 445 1 1 30 PHE CG C -0.321 7.269 -4.180 1.00 . A A . 30 PHE CG 1 1 1 446 1 1 30 PHE CZ C -2.535 8.331 -5.523 1.00 . A A . 30 PHE CZ 1 1 1 447 1 1 30 PHE H H 0.863 4.193 -2.989 1.00 . A A . 30 PHE H 1 1 1 448 1 1 30 PHE HA H 1.217 5.754 -5.340 1.00 . A A . 30 PHE HA 1 1 1 449 1 1 30 PHE HB2 H 0.548 6.217 -2.542 1.00 . A A . 30 PHE HB2 1 1 1 450 1 1 30 PHE HB3 H 1.565 7.491 -3.218 1.00 . A A . 30 PHE HB3 1 1 1 451 1 1 30 PHE HD1 H -0.776 5.435 -5.213 1.00 . A A . 30 PHE HD1 1 1 1 452 1 1 30 PHE HD2 H -0.118 9.224 -3.300 1.00 . A A . 30 PHE HD2 1 1 1 453 1 1 30 PHE HE1 H -2.738 6.376 -6.403 1.00 . A A . 30 PHE HE1 1 1 1 454 1 1 30 PHE HE2 H -2.080 10.165 -4.490 1.00 . A A . 30 PHE HE2 1 1 1 455 1 1 30 PHE HZ H -3.390 8.741 -6.042 1.00 . A A . 30 PHE HZ 1 1 1 456 1 1 30 PHE N N 1.263 4.311 -3.859 1.00 . A A . 30 PHE N 1 1 1 457 1 1 30 PHE O O 3.575 6.914 -4.757 1.00 . A A . 30 PHE O 1 1 1 458 1 1 31 SER C C 5.898 4.381 -4.949 1.00 . A A . 31 SER C 1 1 1 459 1 1 31 SER CA C 5.289 5.098 -3.746 1.00 . A A . 31 SER CA 1 1 1 460 1 1 31 SER CB C 5.822 4.482 -2.452 1.00 . A A . 31 SER CB 1 1 1 461 1 1 31 SER H H 3.381 4.145 -3.462 1.00 . A A . 31 SER H 1 1 1 462 1 1 31 SER HA H 5.549 6.147 -3.787 1.00 . A A . 31 SER HA 1 1 1 463 1 1 31 SER HB2 H 5.855 5.233 -1.681 1.00 . A A . 31 SER HB2 1 1 1 464 1 1 31 SER HB3 H 5.168 3.678 -2.141 1.00 . A A . 31 SER HB3 1 1 1 465 1 1 31 SER HG H 7.690 4.718 -2.944 1.00 . A A . 31 SER HG 1 1 1 466 1 1 31 SER N N 3.808 4.954 -3.801 1.00 . A A . 31 SER N 1 1 1 467 1 1 31 SER O O 7.060 4.537 -5.251 1.00 . A A . 31 SER O 1 1 1 468 1 1 31 SER OG O 7.134 3.983 -2.676 1.00 . A A . 31 SER OG 1 1 1 469 1 1 32 ALA C C 4.974 3.561 -8.067 1.00 . A A . 32 ALA C 1 1 1 470 1 1 32 ALA CA C 5.605 2.896 -6.851 1.00 . A A . 32 ALA CA 1 1 1 471 1 1 32 ALA CB C 5.195 1.423 -6.778 1.00 . A A . 32 ALA CB 1 1 1 472 1 1 32 ALA H H 4.167 3.516 -5.383 1.00 . A A . 32 ALA H 1 1 1 473 1 1 32 ALA HA H 6.684 2.980 -6.919 1.00 . A A . 32 ALA HA 1 1 1 474 1 1 32 ALA HB1 H 4.126 1.354 -6.630 1.00 . A A . 32 ALA HB1 1 1 1 475 1 1 32 ALA HB2 H 5.464 0.927 -7.699 1.00 . A A . 32 ALA HB2 1 1 1 476 1 1 32 ALA HB3 H 5.704 0.948 -5.951 1.00 . A A . 32 ALA HB3 1 1 1 477 1 1 32 ALA N N 5.106 3.611 -5.645 1.00 . A A . 32 ALA N 1 1 1 478 1 1 32 ALA O O 5.656 4.019 -8.958 1.00 . A A . 32 ALA O 1 1 1 479 1 1 33 VAL C C 3.648 5.689 -9.408 1.00 . A A . 33 VAL C 1 1 1 480 1 1 33 VAL CA C 3.012 4.334 -9.227 1.00 . A A . 33 VAL CA 1 1 1 481 1 1 33 VAL CB C 1.565 4.577 -8.907 1.00 . A A . 33 VAL CB 1 1 1 482 1 1 33 VAL CG1 C 0.912 5.279 -10.097 1.00 . A A . 33 VAL CG1 1 1 1 483 1 1 33 VAL CG2 C 0.858 3.257 -8.608 1.00 . A A . 33 VAL CG2 1 1 1 484 1 1 33 VAL H H 3.140 3.312 -7.354 1.00 . A A . 33 VAL H 1 1 1 485 1 1 33 VAL HA H 3.105 3.752 -10.129 1.00 . A A . 33 VAL HA 1 1 1 486 1 1 33 VAL HB H 1.528 5.218 -8.048 1.00 . A A . 33 VAL HB 1 1 1 487 1 1 33 VAL HG11 H 1.671 5.824 -10.649 1.00 . A A . 33 VAL HG11 1 1 1 488 1 1 33 VAL HG12 H 0.455 4.544 -10.743 1.00 . A A . 33 VAL HG12 1 1 1 489 1 1 33 VAL HG13 H 0.161 5.968 -9.743 1.00 . A A . 33 VAL HG13 1 1 1 490 1 1 33 VAL HG21 H 1.524 2.435 -8.826 1.00 . A A . 33 VAL HG21 1 1 1 491 1 1 33 VAL HG22 H 0.580 3.229 -7.564 1.00 . A A . 33 VAL HG22 1 1 1 492 1 1 33 VAL HG23 H -0.028 3.175 -9.219 1.00 . A A . 33 VAL HG23 1 1 1 493 1 1 33 VAL N N 3.675 3.657 -8.092 1.00 . A A . 33 VAL N 1 1 1 494 1 1 33 VAL O O 3.954 6.083 -10.499 1.00 . A A . 33 VAL O 1 1 1 495 1 1 34 ALA C C 5.731 7.570 -9.261 1.00 . A A . 34 ALA C 1 1 1 496 1 1 34 ALA CA C 4.467 7.749 -8.463 1.00 . A A . 34 ALA CA 1 1 1 497 1 1 34 ALA CB C 4.861 8.278 -7.099 1.00 . A A . 34 ALA CB 1 1 1 498 1 1 34 ALA H H 3.570 6.075 -7.455 1.00 . A A . 34 ALA H 1 1 1 499 1 1 34 ALA HA H 3.800 8.438 -8.958 1.00 . A A . 34 ALA HA 1 1 1 500 1 1 34 ALA HB1 H 5.059 7.446 -6.435 1.00 . A A . 34 ALA HB1 1 1 1 501 1 1 34 ALA HB2 H 5.757 8.874 -7.210 1.00 . A A . 34 ALA HB2 1 1 1 502 1 1 34 ALA HB3 H 4.065 8.885 -6.700 1.00 . A A . 34 ALA HB3 1 1 1 503 1 1 34 ALA N N 3.838 6.413 -8.336 1.00 . A A . 34 ALA N 1 1 1 504 1 1 34 ALA O O 5.911 8.148 -10.309 1.00 . A A . 34 ALA O 1 1 1 505 1 1 35 ILE C C 7.577 6.336 -10.927 1.00 . A A . 35 ILE C 1 1 1 506 1 1 35 ILE CA C 7.870 6.478 -9.458 1.00 . A A . 35 ILE CA 1 1 1 507 1 1 35 ILE CB C 8.465 5.172 -8.975 1.00 . A A . 35 ILE CB 1 1 1 508 1 1 35 ILE CD1 C 8.952 3.783 -6.961 1.00 . A A . 35 ILE CD1 1 1 1 509 1 1 35 ILE CG1 C 8.075 4.898 -7.536 1.00 . A A . 35 ILE CG1 1 1 1 510 1 1 35 ILE CG2 C 9.957 5.300 -9.088 1.00 . A A . 35 ILE CG2 1 1 1 511 1 1 35 ILE H H 6.420 6.301 -7.915 1.00 . A A . 35 ILE H 1 1 1 512 1 1 35 ILE HA H 8.567 7.285 -9.293 1.00 . A A . 35 ILE HA 1 1 1 513 1 1 35 ILE HB H 8.111 4.364 -9.594 1.00 . A A . 35 ILE HB 1 1 1 514 1 1 35 ILE HD11 H 9.245 3.111 -7.754 1.00 . A A . 35 ILE HD11 1 1 1 515 1 1 35 ILE HD12 H 9.833 4.215 -6.510 1.00 . A A . 35 ILE HD12 1 1 1 516 1 1 35 ILE HD13 H 8.397 3.236 -6.213 1.00 . A A . 35 ILE HD13 1 1 1 517 1 1 35 ILE HG12 H 8.194 5.796 -6.950 1.00 . A A . 35 ILE HG12 1 1 1 518 1 1 35 ILE HG13 H 7.042 4.586 -7.523 1.00 . A A . 35 ILE HG13 1 1 1 519 1 1 35 ILE HG21 H 10.175 6.051 -9.834 1.00 . A A . 35 ILE HG21 1 1 1 520 1 1 35 ILE HG22 H 10.353 5.610 -8.137 1.00 . A A . 35 ILE HG22 1 1 1 521 1 1 35 ILE HG23 H 10.381 4.355 -9.379 1.00 . A A . 35 ILE HG23 1 1 1 522 1 1 35 ILE N N 6.606 6.748 -8.757 1.00 . A A . 35 ILE N 1 1 1 523 1 1 35 ILE O O 8.359 6.710 -11.772 1.00 . A A . 35 ILE O 1 1 1 524 1 1 36 VAL C C 5.781 7.023 -13.208 1.00 . A A . 36 VAL C 1 1 1 525 1 1 36 VAL CA C 6.081 5.637 -12.651 1.00 . A A . 36 VAL CA 1 1 1 526 1 1 36 VAL CB C 4.864 4.729 -12.757 1.00 . A A . 36 VAL CB 1 1 1 527 1 1 36 VAL CG1 C 4.695 4.282 -14.210 1.00 . A A . 36 VAL CG1 1 1 1 528 1 1 36 VAL CG2 C 5.081 3.504 -11.854 1.00 . A A . 36 VAL CG2 1 1 1 529 1 1 36 VAL H H 5.817 5.509 -10.522 1.00 . A A . 36 VAL H 1 1 1 530 1 1 36 VAL HA H 6.911 5.202 -13.183 1.00 . A A . 36 VAL HA 1 1 1 531 1 1 36 VAL HB H 3.982 5.265 -12.437 1.00 . A A . 36 VAL HB 1 1 1 532 1 1 36 VAL HG11 H 5.452 4.754 -14.822 1.00 . A A . 36 VAL HG11 1 1 1 533 1 1 36 VAL HG12 H 4.798 3.210 -14.272 1.00 . A A . 36 VAL HG12 1 1 1 534 1 1 36 VAL HG13 H 3.716 4.572 -14.562 1.00 . A A . 36 VAL HG13 1 1 1 535 1 1 36 VAL HG21 H 5.667 3.787 -10.983 1.00 . A A . 36 VAL HG21 1 1 1 536 1 1 36 VAL HG22 H 4.126 3.120 -11.534 1.00 . A A . 36 VAL HG22 1 1 1 537 1 1 36 VAL HG23 H 5.609 2.741 -12.406 1.00 . A A . 36 VAL HG23 1 1 1 538 1 1 36 VAL N N 6.440 5.798 -11.234 1.00 . A A . 36 VAL N 1 1 1 539 1 1 36 VAL O O 6.313 7.431 -14.218 1.00 . A A . 36 VAL O 1 1 1 540 1 1 37 ALA C C 5.980 9.812 -13.335 1.00 . A A . 37 ALA C 1 1 1 541 1 1 37 ALA CA C 4.658 9.129 -12.986 1.00 . A A . 37 ALA CA 1 1 1 542 1 1 37 ALA CB C 3.947 9.893 -11.867 1.00 . A A . 37 ALA CB 1 1 1 543 1 1 37 ALA H H 4.562 7.441 -11.719 1.00 . A A . 37 ALA H 1 1 1 544 1 1 37 ALA HA H 4.027 9.078 -13.850 1.00 . A A . 37 ALA HA 1 1 1 545 1 1 37 ALA HB1 H 4.678 10.281 -11.174 1.00 . A A . 37 ALA HB1 1 1 1 546 1 1 37 ALA HB2 H 3.383 10.711 -12.291 1.00 . A A . 37 ALA HB2 1 1 1 547 1 1 37 ALA HB3 H 3.274 9.223 -11.346 1.00 . A A . 37 ALA HB3 1 1 1 548 1 1 37 ALA N N 4.959 7.768 -12.531 1.00 . A A . 37 ALA N 1 1 1 549 1 1 37 ALA O O 6.048 10.632 -14.228 1.00 . A A . 37 ALA O 1 1 1 550 1 1 38 HIS C C 8.950 9.423 -14.204 1.00 . A A . 38 HIS C 1 1 1 551 1 1 38 HIS CA C 8.351 10.096 -12.966 1.00 . A A . 38 HIS CA 1 1 1 552 1 1 38 HIS CB C 9.304 9.940 -11.779 1.00 . A A . 38 HIS CB 1 1 1 553 1 1 38 HIS CD2 C 7.687 11.550 -10.476 1.00 . A A . 38 HIS CD2 1 1 1 554 1 1 38 HIS CE1 C 8.742 11.594 -8.584 1.00 . A A . 38 HIS CE1 1 1 1 555 1 1 38 HIS CG C 8.793 10.748 -10.618 1.00 . A A . 38 HIS CG 1 1 1 556 1 1 38 HIS H H 6.984 8.796 -11.922 1.00 . A A . 38 HIS H 1 1 1 557 1 1 38 HIS HA H 8.195 11.138 -13.171 1.00 . A A . 38 HIS HA 1 1 1 558 1 1 38 HIS HB2 H 9.360 8.899 -11.496 1.00 . A A . 38 HIS HB2 1 1 1 559 1 1 38 HIS HB3 H 10.287 10.292 -12.056 1.00 . A A . 38 HIS HB3 1 1 1 560 1 1 38 HIS HD1 H 10.281 10.322 -9.172 1.00 . A A . 38 HIS HD1 1 1 1 561 1 1 38 HIS HD2 H 6.953 11.738 -11.245 1.00 . A A . 38 HIS HD2 1 1 1 562 1 1 38 HIS HE1 H 9.017 11.817 -7.564 1.00 . A A . 38 HIS HE1 1 1 1 563 1 1 38 HIS N N 7.044 9.468 -12.645 1.00 . A A . 38 HIS N 1 1 1 564 1 1 38 HIS ND1 N 9.451 10.791 -9.399 1.00 . A A . 38 HIS ND1 1 1 1 565 1 1 38 HIS NE2 N 7.657 12.083 -9.191 1.00 . A A . 38 HIS NE2 1 1 1 566 1 1 38 HIS O O 9.490 10.074 -15.076 1.00 . A A . 38 HIS O 1 1 1 567 1 1 39 LEU C C 8.317 7.356 -16.550 1.00 . A A . 39 LEU C 1 1 1 568 1 1 39 LEU CA C 9.394 7.411 -15.474 1.00 . A A . 39 LEU CA 1 1 1 569 1 1 39 LEU CB C 9.799 5.990 -15.079 1.00 . A A . 39 LEU CB 1 1 1 570 1 1 39 LEU CD1 C 10.547 4.609 -13.139 1.00 . A A . 39 LEU CD1 1 1 1 571 1 1 39 LEU CD2 C 11.957 6.511 -13.936 1.00 . A A . 39 LEU CD2 1 1 1 572 1 1 39 LEU CG C 10.522 6.018 -13.733 1.00 . A A . 39 LEU CG 1 1 1 573 1 1 39 LEU H H 8.404 7.624 -13.592 1.00 . A A . 39 LEU H 1 1 1 574 1 1 39 LEU HA H 10.249 7.943 -15.849 1.00 . A A . 39 LEU HA 1 1 1 575 1 1 39 LEU HB2 H 8.916 5.373 -15.001 1.00 . A A . 39 LEU HB2 1 1 1 576 1 1 39 LEU HB3 H 10.458 5.581 -15.830 1.00 . A A . 39 LEU HB3 1 1 1 577 1 1 39 LEU HD11 H 10.494 3.881 -13.935 1.00 . A A . 39 LEU HD11 1 1 1 578 1 1 39 LEU HD12 H 11.463 4.468 -12.583 1.00 . A A . 39 LEU HD12 1 1 1 579 1 1 39 LEU HD13 H 9.702 4.482 -12.478 1.00 . A A . 39 LEU HD13 1 1 1 580 1 1 39 LEU HD21 H 11.942 7.457 -14.456 1.00 . A A . 39 LEU HD21 1 1 1 581 1 1 39 LEU HD22 H 12.435 6.635 -12.976 1.00 . A A . 39 LEU HD22 1 1 1 582 1 1 39 LEU HD23 H 12.507 5.787 -14.520 1.00 . A A . 39 LEU HD23 1 1 1 583 1 1 39 LEU HG H 10.002 6.683 -13.060 1.00 . A A . 39 LEU HG 1 1 1 584 1 1 39 LEU N N 8.848 8.125 -14.294 1.00 . A A . 39 LEU N 1 1 1 585 1 1 39 LEU O O 8.436 7.982 -17.580 1.00 . A A . 39 LEU O 1 1 1 586 1 1 40 ALA C C 5.987 7.832 -18.047 1.00 . A A . 40 ALA C 1 1 1 587 1 1 40 ALA CA C 6.159 6.504 -17.304 1.00 . A A . 40 ALA CA 1 1 1 588 1 1 40 ALA CB C 4.855 6.169 -16.581 1.00 . A A . 40 ALA CB 1 1 1 589 1 1 40 ALA H H 7.209 6.115 -15.467 1.00 . A A . 40 ALA H 1 1 1 590 1 1 40 ALA HA H 6.384 5.720 -18.008 1.00 . A A . 40 ALA HA 1 1 1 591 1 1 40 ALA HB1 H 4.744 5.097 -16.518 1.00 . A A . 40 ALA HB1 1 1 1 592 1 1 40 ALA HB2 H 4.023 6.586 -17.130 1.00 . A A . 40 ALA HB2 1 1 1 593 1 1 40 ALA HB3 H 4.877 6.590 -15.586 1.00 . A A . 40 ALA HB3 1 1 1 594 1 1 40 ALA N N 7.267 6.610 -16.309 1.00 . A A . 40 ALA N 1 1 1 595 1 1 40 ALA O O 5.659 7.860 -19.216 1.00 . A A . 40 ALA O 1 1 1 596 1 1 41 VAL C C 7.256 10.481 -18.981 1.00 . A A . 41 VAL C 1 1 1 597 1 1 41 VAL CA C 6.057 10.250 -18.060 1.00 . A A . 41 VAL CA 1 1 1 598 1 1 41 VAL CB C 5.981 11.361 -17.014 1.00 . A A . 41 VAL CB 1 1 1 599 1 1 41 VAL CG1 C 6.085 12.722 -17.704 1.00 . A A . 41 VAL CG1 1 1 1 600 1 1 41 VAL CG2 C 4.643 11.263 -16.278 1.00 . A A . 41 VAL CG2 1 1 1 601 1 1 41 VAL H H 6.474 8.904 -16.438 1.00 . A A . 41 VAL H 1 1 1 602 1 1 41 VAL HA H 5.153 10.243 -18.643 1.00 . A A . 41 VAL HA 1 1 1 603 1 1 41 VAL HB H 6.792 11.250 -16.309 1.00 . A A . 41 VAL HB 1 1 1 604 1 1 41 VAL HG11 H 6.138 12.581 -18.773 1.00 . A A . 41 VAL HG11 1 1 1 605 1 1 41 VAL HG12 H 5.216 13.316 -17.462 1.00 . A A . 41 VAL HG12 1 1 1 606 1 1 41 VAL HG13 H 6.975 13.231 -17.364 1.00 . A A . 41 VAL HG13 1 1 1 607 1 1 41 VAL HG21 H 4.417 10.225 -16.079 1.00 . A A . 41 VAL HG21 1 1 1 608 1 1 41 VAL HG22 H 4.704 11.804 -15.345 1.00 . A A . 41 VAL HG22 1 1 1 609 1 1 41 VAL HG23 H 3.863 11.690 -16.890 1.00 . A A . 41 VAL HG23 1 1 1 610 1 1 41 VAL N N 6.208 8.937 -17.381 1.00 . A A . 41 VAL N 1 1 1 611 1 1 41 VAL O O 7.106 10.783 -20.148 1.00 . A A . 41 VAL O 1 1 1 612 1 1 42 TYR C C 9.975 9.218 -20.038 1.00 . A A . 42 TYR C 1 1 1 613 1 1 42 TYR CA C 9.653 10.526 -19.311 1.00 . A A . 42 TYR CA 1 1 1 614 1 1 42 TYR CB C 10.835 10.924 -18.425 1.00 . A A . 42 TYR CB 1 1 1 615 1 1 42 TYR CD1 C 9.675 13.145 -18.142 1.00 . A A . 42 TYR CD1 1 1 1 616 1 1 42 TYR CD2 C 10.884 12.210 -16.259 1.00 . A A . 42 TYR CD2 1 1 1 617 1 1 42 TYR CE1 C 9.324 14.255 -17.365 1.00 . A A . 42 TYR CE1 1 1 1 618 1 1 42 TYR CE2 C 10.533 13.321 -15.482 1.00 . A A . 42 TYR CE2 1 1 1 619 1 1 42 TYR CG C 10.455 12.122 -17.588 1.00 . A A . 42 TYR CG 1 1 1 620 1 1 42 TYR CZ C 9.753 14.344 -16.036 1.00 . A A . 42 TYR CZ 1 1 1 621 1 1 42 TYR H H 8.547 10.081 -17.531 1.00 . A A . 42 TYR H 1 1 1 622 1 1 42 TYR HA H 9.461 11.303 -20.029 1.00 . A A . 42 TYR HA 1 1 1 623 1 1 42 TYR HB2 H 11.092 10.099 -17.778 1.00 . A A . 42 TYR HB2 1 1 1 624 1 1 42 TYR HB3 H 11.682 11.174 -19.046 1.00 . A A . 42 TYR HB3 1 1 1 625 1 1 42 TYR HD1 H 9.345 13.076 -19.168 1.00 . A A . 42 TYR HD1 1 1 1 626 1 1 42 TYR HD2 H 11.486 11.421 -15.832 1.00 . A A . 42 TYR HD2 1 1 1 627 1 1 42 TYR HE1 H 8.723 15.044 -17.792 1.00 . A A . 42 TYR HE1 1 1 1 628 1 1 42 TYR HE2 H 10.864 13.389 -14.457 1.00 . A A . 42 TYR HE2 1 1 1 629 1 1 42 TYR HH H 9.710 15.280 -14.373 1.00 . A A . 42 TYR HH 1 1 1 630 1 1 42 TYR N N 8.447 10.330 -18.468 1.00 . A A . 42 TYR N 1 1 1 631 1 1 42 TYR O O 11.039 9.052 -20.601 1.00 . A A . 42 TYR O 1 1 1 632 1 1 42 TYR OH O 9.408 15.438 -15.270 1.00 . A A . 42 TYR OH 1 1 1 633 1 1 43 ILE C C 8.462 6.922 -21.984 1.00 . A A . 43 ILE C 1 1 1 634 1 1 43 ILE CA C 9.299 6.984 -20.704 1.00 . A A . 43 ILE CA 1 1 1 635 1 1 43 ILE CB C 8.891 5.845 -19.763 1.00 . A A . 43 ILE CB 1 1 1 636 1 1 43 ILE CD1 C 9.576 4.502 -17.773 1.00 . A A . 43 ILE CD1 1 1 1 637 1 1 43 ILE CG1 C 9.969 5.659 -18.693 1.00 . A A . 43 ILE CG1 1 1 1 638 1 1 43 ILE CG2 C 8.733 4.543 -20.553 1.00 . A A . 43 ILE CG2 1 1 1 639 1 1 43 ILE H H 8.214 8.443 -19.562 1.00 . A A . 43 ILE H 1 1 1 640 1 1 43 ILE HA H 10.346 6.891 -20.952 1.00 . A A . 43 ILE HA 1 1 1 641 1 1 43 ILE HB H 7.952 6.092 -19.289 1.00 . A A . 43 ILE HB 1 1 1 642 1 1 43 ILE HD11 H 9.009 3.773 -18.333 1.00 . A A . 43 ILE HD11 1 1 1 643 1 1 43 ILE HD12 H 10.467 4.038 -17.377 1.00 . A A . 43 ILE HD12 1 1 1 644 1 1 43 ILE HD13 H 8.974 4.878 -16.959 1.00 . A A . 43 ILE HD13 1 1 1 645 1 1 43 ILE HG12 H 10.914 5.438 -19.169 1.00 . A A . 43 ILE HG12 1 1 1 646 1 1 43 ILE HG13 H 10.060 6.564 -18.112 1.00 . A A . 43 ILE HG13 1 1 1 647 1 1 43 ILE HG21 H 8.046 4.700 -21.371 1.00 . A A . 43 ILE HG21 1 1 1 648 1 1 43 ILE HG22 H 9.694 4.239 -20.942 1.00 . A A . 43 ILE HG22 1 1 1 649 1 1 43 ILE HG23 H 8.348 3.773 -19.901 1.00 . A A . 43 ILE HG23 1 1 1 650 1 1 43 ILE N N 9.060 8.286 -20.024 1.00 . A A . 43 ILE N 1 1 1 651 1 1 43 ILE O O 8.788 6.214 -22.917 1.00 . A A . 43 ILE O 1 1 1 652 1 1 44 TRP C C 7.086 8.620 -24.286 1.00 . A A . 44 TRP C 1 1 1 653 1 1 44 TRP CA C 6.532 7.634 -23.258 1.00 . A A . 44 TRP CA 1 1 1 654 1 1 44 TRP CB C 5.098 8.024 -22.892 1.00 . A A . 44 TRP CB 1 1 1 655 1 1 44 TRP CD1 C 4.385 6.049 -21.484 1.00 . A A . 44 TRP CD1 1 1 1 656 1 1 44 TRP CD2 C 3.305 6.139 -23.456 1.00 . A A . 44 TRP CD2 1 1 1 657 1 1 44 TRP CE2 C 2.816 4.999 -22.777 1.00 . A A . 44 TRP CE2 1 1 1 658 1 1 44 TRP CE3 C 2.785 6.426 -24.731 1.00 . A A . 44 TRP CE3 1 1 1 659 1 1 44 TRP CG C 4.301 6.789 -22.613 1.00 . A A . 44 TRP CG 1 1 1 660 1 1 44 TRP CH2 C 1.338 4.471 -24.609 1.00 . A A . 44 TRP CH2 1 1 1 661 1 1 44 TRP CZ2 C 1.844 4.172 -23.342 1.00 . A A . 44 TRP CZ2 1 1 1 662 1 1 44 TRP CZ3 C 1.807 5.595 -25.303 1.00 . A A . 44 TRP CZ3 1 1 1 663 1 1 44 TRP H H 7.136 8.220 -21.275 1.00 . A A . 44 TRP H 1 1 1 664 1 1 44 TRP HA H 6.541 6.644 -23.678 1.00 . A A . 44 TRP HA 1 1 1 665 1 1 44 TRP HB2 H 5.109 8.650 -22.012 1.00 . A A . 44 TRP HB2 1 1 1 666 1 1 44 TRP HB3 H 4.650 8.563 -23.713 1.00 . A A . 44 TRP HB3 1 1 1 667 1 1 44 TRP HD1 H 5.033 6.254 -20.644 1.00 . A A . 44 TRP HD1 1 1 1 668 1 1 44 TRP HE1 H 3.371 4.300 -20.894 1.00 . A A . 44 TRP HE1 1 1 1 669 1 1 44 TRP HE3 H 3.139 7.290 -25.274 1.00 . A A . 44 TRP HE3 1 1 1 670 1 1 44 TRP HH2 H 0.586 3.836 -25.054 1.00 . A A . 44 TRP HH2 1 1 1 671 1 1 44 TRP HZ2 H 1.487 3.307 -22.803 1.00 . A A . 44 TRP HZ2 1 1 1 672 1 1 44 TRP HZ3 H 1.414 5.825 -26.282 1.00 . A A . 44 TRP HZ3 1 1 1 673 1 1 44 TRP N N 7.384 7.656 -22.037 1.00 . A A . 44 TRP N 1 1 1 674 1 1 44 TRP NE1 N 3.504 4.987 -21.580 1.00 . A A . 44 TRP NE1 1 1 1 675 1 1 44 TRP O O 6.489 8.861 -25.317 1.00 . A A . 44 TRP O 1 1 1 676 1 1 45 ARG C C 9.616 9.425 -26.052 1.00 . A A . 45 ARG C 1 1 1 677 1 1 45 ARG CA C 8.818 10.166 -24.970 1.00 . A A . 45 ARG CA 1 1 1 678 1 1 45 ARG CB C 9.739 11.131 -24.220 1.00 . A A . 45 ARG CB 1 1 1 679 1 1 45 ARG CD C 8.568 12.881 -22.875 1.00 . A A . 45 ARG CD 1 1 1 680 1 1 45 ARG CG C 9.139 12.538 -24.252 1.00 . A A . 45 ARG CG 1 1 1 681 1 1 45 ARG CZ C 6.367 13.365 -21.990 1.00 . A A . 45 ARG CZ 1 1 1 682 1 1 45 ARG H H 8.680 8.985 -23.174 1.00 . A A . 45 ARG H 1 1 1 683 1 1 45 ARG HA H 8.031 10.721 -25.435 1.00 . A A . 45 ARG HA 1 1 1 684 1 1 45 ARG HB2 H 9.844 10.806 -23.195 1.00 . A A . 45 ARG HB2 1 1 1 685 1 1 45 ARG HB3 H 10.709 11.145 -24.695 1.00 . A A . 45 ARG HB3 1 1 1 686 1 1 45 ARG HD2 H 8.589 12.002 -22.248 1.00 . A A . 45 ARG HD2 1 1 1 687 1 1 45 ARG HD3 H 9.163 13.660 -22.422 1.00 . A A . 45 ARG HD3 1 1 1 688 1 1 45 ARG HE H 6.836 13.651 -23.898 1.00 . A A . 45 ARG HE 1 1 1 689 1 1 45 ARG HG2 H 9.908 13.251 -24.512 1.00 . A A . 45 ARG HG2 1 1 1 690 1 1 45 ARG HG3 H 8.349 12.576 -24.987 1.00 . A A . 45 ARG HG3 1 1 1 691 1 1 45 ARG HH11 H 5.261 11.823 -22.629 1.00 . A A . 45 ARG HH11 1 1 1 692 1 1 45 ARG HH12 H 4.785 12.508 -21.111 1.00 . A A . 45 ARG HH12 1 1 1 693 1 1 45 ARG HH21 H 7.286 14.910 -21.109 1.00 . A A . 45 ARG HH21 1 1 1 694 1 1 45 ARG HH22 H 5.932 14.256 -20.250 1.00 . A A . 45 ARG HH22 1 1 1 695 1 1 45 ARG N N 8.222 9.193 -24.012 1.00 . A A . 45 ARG N 1 1 1 696 1 1 45 ARG NE N 7.163 13.352 -23.024 1.00 . A A . 45 ARG NE 1 1 1 697 1 1 45 ARG NH1 N 5.395 12.498 -21.903 1.00 . A A . 45 ARG NH1 1 1 1 698 1 1 45 ARG NH2 N 6.542 14.246 -21.043 1.00 . A A . 45 ARG NH2 1 1 1 699 1 1 45 ARG O O 9.414 9.649 -27.228 1.00 . A A . 45 ARG O 1 1 1 700 1 1 46 PRO C C 10.592 6.564 -27.051 1.00 . A A . 46 PRO C 1 1 1 701 1 1 46 PRO CA C 11.358 7.779 -26.518 1.00 . A A . 46 PRO CA 1 1 1 702 1 1 46 PRO CB C 12.514 7.342 -25.615 1.00 . A A . 46 PRO CB 1 1 1 703 1 1 46 PRO CD C 10.734 8.310 -24.188 1.00 . A A . 46 PRO CD 1 1 1 704 1 1 46 PRO CG C 11.984 7.409 -24.162 1.00 . A A . 46 PRO CG 1 1 1 705 1 1 46 PRO HB2 H 12.813 6.332 -25.860 1.00 . A A . 46 PRO HB2 1 1 1 706 1 1 46 PRO HB3 H 13.349 8.016 -25.729 1.00 . A A . 46 PRO HB3 1 1 1 707 1 1 46 PRO HD2 H 9.890 7.792 -23.759 1.00 . A A . 46 PRO HD2 1 1 1 708 1 1 46 PRO HD3 H 10.916 9.235 -23.668 1.00 . A A . 46 PRO HD3 1 1 1 709 1 1 46 PRO HG2 H 11.722 6.417 -23.819 1.00 . A A . 46 PRO HG2 1 1 1 710 1 1 46 PRO HG3 H 12.731 7.841 -23.514 1.00 . A A . 46 PRO HG3 1 1 1 711 1 1 46 PRO N N 10.502 8.569 -25.617 1.00 . A A . 46 PRO N 1 1 1 712 1 1 46 PRO O O 9.800 5.964 -26.352 1.00 . A A . 46 PRO O 1 1 1 713 1 1 47 TRP C C 10.987 4.374 -29.927 1.00 . A A . 47 TRP C 1 1 1 714 1 1 47 TRP CA C 10.111 5.022 -28.855 1.00 . A A . 47 TRP CA 1 1 1 715 1 1 47 TRP CB C 8.793 5.481 -29.482 1.00 . A A . 47 TRP CB 1 1 1 716 1 1 47 TRP CD1 C 7.468 6.111 -27.424 1.00 . A A . 47 TRP CD1 1 1 1 717 1 1 47 TRP CD2 C 6.637 4.299 -28.466 1.00 . A A . 47 TRP CD2 1 1 1 718 1 1 47 TRP CE2 C 5.809 4.538 -27.344 1.00 . A A . 47 TRP CE2 1 1 1 719 1 1 47 TRP CE3 C 6.329 3.206 -29.296 1.00 . A A . 47 TRP CE3 1 1 1 720 1 1 47 TRP CG C 7.684 5.312 -28.494 1.00 . A A . 47 TRP CG 1 1 1 721 1 1 47 TRP CH2 C 4.422 2.641 -27.891 1.00 . A A . 47 TRP CH2 1 1 1 722 1 1 47 TRP CZ2 C 4.714 3.722 -27.056 1.00 . A A . 47 TRP CZ2 1 1 1 723 1 1 47 TRP CZ3 C 5.228 2.383 -29.009 1.00 . A A . 47 TRP CZ3 1 1 1 724 1 1 47 TRP H H 11.469 6.693 -28.828 1.00 . A A . 47 TRP H 1 1 1 725 1 1 47 TRP HA H 9.908 4.305 -28.073 1.00 . A A . 47 TRP HA 1 1 1 726 1 1 47 TRP HB2 H 8.870 6.521 -29.762 1.00 . A A . 47 TRP HB2 1 1 1 727 1 1 47 TRP HB3 H 8.586 4.886 -30.360 1.00 . A A . 47 TRP HB3 1 1 1 728 1 1 47 TRP HD1 H 8.066 6.967 -27.148 1.00 . A A . 47 TRP HD1 1 1 1 729 1 1 47 TRP HE1 H 5.987 6.056 -25.927 1.00 . A A . 47 TRP HE1 1 1 1 730 1 1 47 TRP HE3 H 6.944 2.999 -30.160 1.00 . A A . 47 TRP HE3 1 1 1 731 1 1 47 TRP HH2 H 3.577 2.004 -27.676 1.00 . A A . 47 TRP HH2 1 1 1 732 1 1 47 TRP HZ2 H 4.097 3.925 -26.193 1.00 . A A . 47 TRP HZ2 1 1 1 733 1 1 47 TRP HZ3 H 5.001 1.547 -29.654 1.00 . A A . 47 TRP HZ3 1 1 1 734 1 1 47 TRP N N 10.824 6.197 -28.281 1.00 . A A . 47 TRP N 1 1 1 735 1 1 47 TRP NE1 N 6.356 5.653 -26.740 1.00 . A A . 47 TRP NE1 1 1 1 736 1 1 47 TRP O O 11.211 3.180 -29.923 1.00 . A A . 47 TRP O 1 1 1 737 1 1 48 PHE C C 11.644 3.400 -32.568 1.00 . A A . 48 PHE C 1 1 1 738 1 1 48 PHE CA C 12.354 4.586 -31.914 1.00 . A A . 48 PHE CA 1 1 1 739 1 1 48 PHE CB C 13.674 4.117 -31.299 1.00 . A A . 48 PHE CB 1 1 1 740 1 1 48 PHE CD1 C 14.944 4.144 -33.477 1.00 . A A . 48 PHE CD1 1 1 1 741 1 1 48 PHE CD2 C 15.773 5.473 -31.626 1.00 . A A . 48 PHE CD2 1 1 1 742 1 1 48 PHE CE1 C 16.011 4.582 -34.270 1.00 . A A . 48 PHE CE1 1 1 1 743 1 1 48 PHE CE2 C 16.840 5.912 -32.419 1.00 . A A . 48 PHE CE2 1 1 1 744 1 1 48 PHE CG C 14.825 4.589 -32.155 1.00 . A A . 48 PHE CG 1 1 1 745 1 1 48 PHE CZ C 16.959 5.467 -33.741 1.00 . A A . 48 PHE CZ 1 1 1 746 1 1 48 PHE H H 11.298 6.116 -30.828 1.00 . A A . 48 PHE H 1 1 1 747 1 1 48 PHE HA H 12.552 5.343 -32.658 1.00 . A A . 48 PHE HA 1 1 1 748 1 1 48 PHE HB2 H 13.772 4.527 -30.304 1.00 . A A . 48 PHE HB2 1 1 1 749 1 1 48 PHE HB3 H 13.684 3.038 -31.247 1.00 . A A . 48 PHE HB3 1 1 1 750 1 1 48 PHE HD1 H 14.213 3.461 -33.884 1.00 . A A . 48 PHE HD1 1 1 1 751 1 1 48 PHE HD2 H 15.681 5.817 -30.606 1.00 . A A . 48 PHE HD2 1 1 1 752 1 1 48 PHE HE1 H 16.103 4.239 -35.289 1.00 . A A . 48 PHE HE1 1 1 1 753 1 1 48 PHE HE2 H 17.571 6.594 -32.011 1.00 . A A . 48 PHE HE2 1 1 1 754 1 1 48 PHE HZ H 17.782 5.805 -34.353 1.00 . A A . 48 PHE HZ 1 1 1 755 1 1 48 PHE N N 11.489 5.155 -30.844 1.00 . A A . 48 PHE N 1 1 1 756 1 1 48 PHE O O 10.536 3.098 -32.157 1.00 . A A . 48 PHE O 1 1 1 757 1 1 48 PHE OXT O 12.220 2.813 -33.470 1.00 . A A . 48 PHE OXT 1 1 2 758 1 1 1 ALA C C -25.865 15.799 14.853 1.00 . A A . 1 ALA C 1 1 2 759 1 1 1 ALA CA C -25.630 17.280 14.548 1.00 . A A . 1 ALA CA 1 1 2 760 1 1 1 ALA CB C -24.134 17.528 14.345 1.00 . A A . 1 ALA CB 1 1 2 761 1 1 1 ALA H1 H -26.327 17.491 16.499 1.00 . A A . 1 ALA H1 1 1 2 762 1 1 1 ALA H2 H -25.391 18.799 15.951 1.00 . A A . 1 ALA H2 1 1 2 763 1 1 1 ALA H3 H -26.988 18.606 15.405 1.00 . A A . 1 ALA H3 1 1 2 764 1 1 1 ALA HA H -26.166 17.551 13.650 1.00 . A A . 1 ALA HA 1 1 2 765 1 1 1 ALA HB1 H -23.620 17.418 15.288 1.00 . A A . 1 ALA HB1 1 1 2 766 1 1 1 ALA HB2 H -23.984 18.528 13.966 1.00 . A A . 1 ALA HB2 1 1 2 767 1 1 1 ALA HB3 H -23.744 16.812 13.637 1.00 . A A . 1 ALA HB3 1 1 2 768 1 1 1 ALA N N -26.122 18.106 15.686 1.00 . A A . 1 ALA N 1 1 2 769 1 1 1 ALA O O -24.936 15.028 14.988 1.00 . A A . 1 ALA O 1 1 2 770 1 1 2 ASP C C -28.496 13.465 14.322 1.00 . A A . 2 ASP C 1 1 2 771 1 1 2 ASP CA C -27.395 13.964 15.259 1.00 . A A . 2 ASP CA 1 1 2 772 1 1 2 ASP CB C -27.860 13.829 16.710 1.00 . A A . 2 ASP CB 1 1 2 773 1 1 2 ASP CG C -26.821 13.038 17.508 1.00 . A A . 2 ASP CG 1 1 2 774 1 1 2 ASP H H -27.837 16.033 14.850 1.00 . A A . 2 ASP H 1 1 2 775 1 1 2 ASP HA H -26.502 13.375 15.111 1.00 . A A . 2 ASP HA 1 1 2 776 1 1 2 ASP HB2 H -27.977 14.812 17.144 1.00 . A A . 2 ASP HB2 1 1 2 777 1 1 2 ASP HB3 H -28.806 13.309 16.739 1.00 . A A . 2 ASP HB3 1 1 2 778 1 1 2 ASP N N -27.101 15.395 14.963 1.00 . A A . 2 ASP N 1 1 2 779 1 1 2 ASP O O -28.996 12.366 14.465 1.00 . A A . 2 ASP O 1 1 2 780 1 1 2 ASP OD1 O -26.061 12.310 16.894 1.00 . A A . 2 ASP OD1 1 1 2 781 1 1 2 ASP OD2 O -26.805 13.175 18.721 1.00 . A A . 2 ASP OD2 1 1 2 782 1 1 3 LYS C C -29.364 13.697 11.013 1.00 . A A . 3 LYS C 1 1 2 783 1 1 3 LYS CA C -29.950 13.831 12.419 1.00 . A A . 3 LYS CA 1 1 2 784 1 1 3 LYS CB C -31.071 14.873 12.407 1.00 . A A . 3 LYS CB 1 1 2 785 1 1 3 LYS CD C -33.441 15.327 13.053 1.00 . A A . 3 LYS CD 1 1 2 786 1 1 3 LYS CE C -33.191 16.277 14.226 1.00 . A A . 3 LYS CE 1 1 2 787 1 1 3 LYS CG C -32.339 14.266 13.011 1.00 . A A . 3 LYS CG 1 1 2 788 1 1 3 LYS H H -28.468 15.145 13.264 1.00 . A A . 3 LYS H 1 1 2 789 1 1 3 LYS HA H -30.346 12.878 12.736 1.00 . A A . 3 LYS HA 1 1 2 790 1 1 3 LYS HB2 H -30.769 15.732 12.989 1.00 . A A . 3 LYS HB2 1 1 2 791 1 1 3 LYS HB3 H -31.268 15.177 11.390 1.00 . A A . 3 LYS HB3 1 1 2 792 1 1 3 LYS HD2 H -33.438 15.886 12.129 1.00 . A A . 3 LYS HD2 1 1 2 793 1 1 3 LYS HD3 H -34.399 14.846 13.181 1.00 . A A . 3 LYS HD3 1 1 2 794 1 1 3 LYS HE2 H -32.353 15.920 14.807 1.00 . A A . 3 LYS HE2 1 1 2 795 1 1 3 LYS HE3 H -32.972 17.264 13.848 1.00 . A A . 3 LYS HE3 1 1 2 796 1 1 3 LYS HG2 H -32.664 13.433 12.404 1.00 . A A . 3 LYS HG2 1 1 2 797 1 1 3 LYS HG3 H -32.133 13.924 14.013 1.00 . A A . 3 LYS HG3 1 1 2 798 1 1 3 LYS HZ1 H -35.228 15.995 14.550 1.00 . A A . 3 LYS HZ1 1 1 2 799 1 1 3 LYS HZ2 H -34.264 15.728 15.924 1.00 . A A . 3 LYS HZ2 1 1 2 800 1 1 3 LYS HZ3 H -34.571 17.313 15.392 1.00 . A A . 3 LYS HZ3 1 1 2 801 1 1 3 LYS N N -28.882 14.263 13.363 1.00 . A A . 3 LYS N 1 1 2 802 1 1 3 LYS NZ N -34.406 16.333 15.088 1.00 . A A . 3 LYS NZ 1 1 2 803 1 1 3 LYS O O -29.957 13.101 10.137 1.00 . A A . 3 LYS O 1 1 2 804 1 1 4 SER C C -26.705 12.899 9.375 1.00 . A A . 4 SER C 1 1 2 805 1 1 4 SER CA C -27.579 14.152 9.444 1.00 . A A . 4 SER CA 1 1 2 806 1 1 4 SER CB C -26.715 15.389 9.193 1.00 . A A . 4 SER CB 1 1 2 807 1 1 4 SER H H -27.742 14.724 11.513 1.00 . A A . 4 SER H 1 1 2 808 1 1 4 SER HA H -28.352 14.094 8.692 1.00 . A A . 4 SER HA 1 1 2 809 1 1 4 SER HB2 H -25.788 15.299 9.734 1.00 . A A . 4 SER HB2 1 1 2 810 1 1 4 SER HB3 H -26.506 15.471 8.134 1.00 . A A . 4 SER HB3 1 1 2 811 1 1 4 SER HG H -27.462 17.164 8.910 1.00 . A A . 4 SER HG 1 1 2 812 1 1 4 SER N N -28.203 14.248 10.792 1.00 . A A . 4 SER N 1 1 2 813 1 1 4 SER O O -26.446 12.370 8.313 1.00 . A A . 4 SER O 1 1 2 814 1 1 4 SER OG O -27.410 16.545 9.642 1.00 . A A . 4 SER OG 1 1 2 815 1 1 5 ASP C C -26.211 10.001 10.008 1.00 . A A . 5 ASP C 1 1 2 816 1 1 5 ASP CA C -25.394 11.200 10.496 1.00 . A A . 5 ASP CA 1 1 2 817 1 1 5 ASP CB C -24.886 10.927 11.913 1.00 . A A . 5 ASP CB 1 1 2 818 1 1 5 ASP CG C -26.068 10.594 12.824 1.00 . A A . 5 ASP CG 1 1 2 819 1 1 5 ASP H H -26.471 12.860 11.346 1.00 . A A . 5 ASP H 1 1 2 820 1 1 5 ASP HA H -24.553 11.353 9.835 1.00 . A A . 5 ASP HA 1 1 2 821 1 1 5 ASP HB2 H -24.199 10.093 11.894 1.00 . A A . 5 ASP HB2 1 1 2 822 1 1 5 ASP HB3 H -24.379 11.803 12.289 1.00 . A A . 5 ASP HB3 1 1 2 823 1 1 5 ASP N N -26.250 12.418 10.499 1.00 . A A . 5 ASP N 1 1 2 824 1 1 5 ASP O O -25.688 9.093 9.394 1.00 . A A . 5 ASP O 1 1 2 825 1 1 5 ASP OD1 O -26.991 11.391 12.878 1.00 . A A . 5 ASP OD1 1 1 2 826 1 1 5 ASP OD2 O -26.030 9.551 13.454 1.00 . A A . 5 ASP OD2 1 1 2 827 1 1 6 LEU C C -28.455 8.882 8.311 1.00 . A A . 6 LEU C 1 1 2 828 1 1 6 LEU CA C -28.340 8.850 9.828 1.00 . A A . 6 LEU CA 1 1 2 829 1 1 6 LEU CB C -29.728 8.984 10.441 1.00 . A A . 6 LEU CB 1 1 2 830 1 1 6 LEU CD1 C -30.648 10.125 12.458 1.00 . A A . 6 LEU CD1 1 1 2 831 1 1 6 LEU CD2 C -29.650 7.836 12.643 1.00 . A A . 6 LEU CD2 1 1 2 832 1 1 6 LEU CG C -29.559 9.187 11.933 1.00 . A A . 6 LEU CG 1 1 2 833 1 1 6 LEU H H -27.890 10.735 10.773 1.00 . A A . 6 LEU H 1 1 2 834 1 1 6 LEU HA H -27.894 7.923 10.151 1.00 . A A . 6 LEU HA 1 1 2 835 1 1 6 LEU HB2 H -30.239 9.833 10.009 1.00 . A A . 6 LEU HB2 1 1 2 836 1 1 6 LEU HB3 H -30.295 8.083 10.261 1.00 . A A . 6 LEU HB3 1 1 2 837 1 1 6 LEU HD11 H -30.856 10.884 11.717 1.00 . A A . 6 LEU HD11 1 1 2 838 1 1 6 LEU HD12 H -31.545 9.559 12.656 1.00 . A A . 6 LEU HD12 1 1 2 839 1 1 6 LEU HD13 H -30.309 10.596 13.369 1.00 . A A . 6 LEU HD13 1 1 2 840 1 1 6 LEU HD21 H -29.053 7.111 12.110 1.00 . A A . 6 LEU HD21 1 1 2 841 1 1 6 LEU HD22 H -29.282 7.934 13.653 1.00 . A A . 6 LEU HD22 1 1 2 842 1 1 6 LEU HD23 H -30.680 7.509 12.665 1.00 . A A . 6 LEU HD23 1 1 2 843 1 1 6 LEU HG H -28.587 9.620 12.106 1.00 . A A . 6 LEU HG 1 1 2 844 1 1 6 LEU N N -27.489 9.991 10.276 1.00 . A A . 6 LEU N 1 1 2 845 1 1 6 LEU O O -28.398 7.868 7.643 1.00 . A A . 6 LEU O 1 1 2 846 1 1 7 GLY C C -27.529 9.516 5.626 1.00 . A A . 7 GLY C 1 1 2 847 1 1 7 GLY CA C -28.740 10.175 6.288 1.00 . A A . 7 GLY CA 1 1 2 848 1 1 7 GLY H H -28.662 10.847 8.339 1.00 . A A . 7 GLY H 1 1 2 849 1 1 7 GLY HA2 H -28.771 11.219 6.015 1.00 . A A . 7 GLY HA2 1 1 2 850 1 1 7 GLY HA3 H -29.646 9.687 5.957 1.00 . A A . 7 GLY HA3 1 1 2 851 1 1 7 GLY N N -28.620 10.050 7.767 1.00 . A A . 7 GLY N 1 1 2 852 1 1 7 GLY O O -27.610 9.009 4.524 1.00 . A A . 7 GLY O 1 1 2 853 1 1 8 TYR C C -25.038 7.506 6.271 1.00 . A A . 8 TYR C 1 1 2 854 1 1 8 TYR CA C -25.197 8.907 5.716 1.00 . A A . 8 TYR CA 1 1 2 855 1 1 8 TYR CB C -23.968 9.723 6.079 1.00 . A A . 8 TYR CB 1 1 2 856 1 1 8 TYR CD1 C -25.135 11.900 5.746 1.00 . A A . 8 TYR CD1 1 1 2 857 1 1 8 TYR CD2 C -23.108 11.465 4.503 1.00 . A A . 8 TYR CD2 1 1 2 858 1 1 8 TYR CE1 C -25.241 13.159 5.143 1.00 . A A . 8 TYR CE1 1 1 2 859 1 1 8 TYR CE2 C -23.205 12.719 3.894 1.00 . A A . 8 TYR CE2 1 1 2 860 1 1 8 TYR CG C -24.072 11.063 5.424 1.00 . A A . 8 TYR CG 1 1 2 861 1 1 8 TYR CZ C -24.272 13.570 4.215 1.00 . A A . 8 TYR CZ 1 1 2 862 1 1 8 TYR H H -26.360 9.929 7.160 1.00 . A A . 8 TYR H 1 1 2 863 1 1 8 TYR HA H -25.303 8.879 4.667 1.00 . A A . 8 TYR HA 1 1 2 864 1 1 8 TYR HB2 H -23.914 9.846 7.150 1.00 . A A . 8 TYR HB2 1 1 2 865 1 1 8 TYR HB3 H -23.087 9.216 5.724 1.00 . A A . 8 TYR HB3 1 1 2 866 1 1 8 TYR HD1 H -25.877 11.567 6.461 1.00 . A A . 8 TYR HD1 1 1 2 867 1 1 8 TYR HD2 H -22.292 10.803 4.256 1.00 . A A . 8 TYR HD2 1 1 2 868 1 1 8 TYR HE1 H -26.065 13.810 5.390 1.00 . A A . 8 TYR HE1 1 1 2 869 1 1 8 TYR HE2 H -22.456 13.031 3.183 1.00 . A A . 8 TYR HE2 1 1 2 870 1 1 8 TYR HH H -23.949 15.452 4.194 1.00 . A A . 8 TYR HH 1 1 2 871 1 1 8 TYR N N -26.406 9.520 6.290 1.00 . A A . 8 TYR N 1 1 2 872 1 1 8 TYR O O -25.403 6.538 5.647 1.00 . A A . 8 TYR O 1 1 2 873 1 1 8 TYR OH O -24.370 14.810 3.618 1.00 . A A . 8 TYR OH 1 1 2 874 1 1 9 THR C C -23.819 5.064 7.149 1.00 . A A . 9 THR C 1 1 2 875 1 1 9 THR CA C -24.354 6.111 8.138 1.00 . A A . 9 THR CA 1 1 2 876 1 1 9 THR CB C -25.713 5.717 8.704 1.00 . A A . 9 THR CB 1 1 2 877 1 1 9 THR CG2 C -25.529 4.799 9.913 1.00 . A A . 9 THR CG2 1 1 2 878 1 1 9 THR H H -24.280 8.228 7.935 1.00 . A A . 9 THR H 1 1 2 879 1 1 9 THR HA H -23.651 6.221 8.950 1.00 . A A . 9 THR HA 1 1 2 880 1 1 9 THR HB H -26.284 5.215 7.954 1.00 . A A . 9 THR HB 1 1 2 881 1 1 9 THR HG1 H -26.467 7.478 8.320 1.00 . A A . 9 THR HG1 1 1 2 882 1 1 9 THR HG21 H -24.568 4.992 10.368 1.00 . A A . 9 THR HG21 1 1 2 883 1 1 9 THR HG22 H -26.312 4.989 10.632 1.00 . A A . 9 THR HG22 1 1 2 884 1 1 9 THR HG23 H -25.575 3.768 9.594 1.00 . A A . 9 THR HG23 1 1 2 885 1 1 9 THR N N -24.525 7.418 7.465 1.00 . A A . 9 THR N 1 1 2 886 1 1 9 THR O O -22.629 4.833 7.074 1.00 . A A . 9 THR O 1 1 2 887 1 1 9 THR OG1 O -26.406 6.898 9.092 1.00 . A A . 9 THR OG1 1 1 2 888 1 1 10 GLY C C -23.438 4.144 4.271 1.00 . A A . 10 GLY C 1 1 2 889 1 1 10 GLY CA C -24.174 3.427 5.406 1.00 . A A . 10 GLY CA 1 1 2 890 1 1 10 GLY H H -25.625 4.635 6.438 1.00 . A A . 10 GLY H 1 1 2 891 1 1 10 GLY HA2 H -25.007 2.876 5.000 1.00 . A A . 10 GLY HA2 1 1 2 892 1 1 10 GLY HA3 H -23.496 2.746 5.904 1.00 . A A . 10 GLY HA3 1 1 2 893 1 1 10 GLY N N -24.669 4.435 6.383 1.00 . A A . 10 GLY N 1 1 2 894 1 1 10 GLY O O -22.322 3.805 3.931 1.00 . A A . 10 GLY O 1 1 2 895 1 1 11 LEU C C -22.089 6.454 3.071 1.00 . A A . 11 LEU C 1 1 2 896 1 1 11 LEU CA C -23.405 5.866 2.579 1.00 . A A . 11 LEU CA 1 1 2 897 1 1 11 LEU CB C -24.376 6.943 2.044 1.00 . A A . 11 LEU CB 1 1 2 898 1 1 11 LEU CD1 C -22.961 8.773 1.100 1.00 . A A . 11 LEU CD1 1 1 2 899 1 1 11 LEU CD2 C -25.014 9.333 2.402 1.00 . A A . 11 LEU CD2 1 1 2 900 1 1 11 LEU CG C -23.840 8.358 2.280 1.00 . A A . 11 LEU CG 1 1 2 901 1 1 11 LEU H H -24.944 5.391 3.958 1.00 . A A . 11 LEU H 1 1 2 902 1 1 11 LEU HA H -23.183 5.173 1.795 1.00 . A A . 11 LEU HA 1 1 2 903 1 1 11 LEU HB2 H -24.517 6.795 0.984 1.00 . A A . 11 LEU HB2 1 1 2 904 1 1 11 LEU HB3 H -25.327 6.840 2.544 1.00 . A A . 11 LEU HB3 1 1 2 905 1 1 11 LEU HD11 H -22.370 7.929 0.777 1.00 . A A . 11 LEU HD11 1 1 2 906 1 1 11 LEU HD12 H -23.585 9.110 0.286 1.00 . A A . 11 LEU HD12 1 1 2 907 1 1 11 LEU HD13 H -22.305 9.575 1.406 1.00 . A A . 11 LEU HD13 1 1 2 908 1 1 11 LEU HD21 H -25.905 8.790 2.676 1.00 . A A . 11 LEU HD21 1 1 2 909 1 1 11 LEU HD22 H -24.792 10.069 3.160 1.00 . A A . 11 LEU HD22 1 1 2 910 1 1 11 LEU HD23 H -25.170 9.828 1.455 1.00 . A A . 11 LEU HD23 1 1 2 911 1 1 11 LEU HG H -23.261 8.372 3.187 1.00 . A A . 11 LEU HG 1 1 2 912 1 1 11 LEU N N -24.055 5.133 3.680 1.00 . A A . 11 LEU N 1 1 2 913 1 1 11 LEU O O -21.110 6.400 2.379 1.00 . A A . 11 LEU O 1 1 2 914 1 1 12 THR C C -19.692 6.566 4.496 1.00 . A A . 12 THR C 1 1 2 915 1 1 12 THR CA C -20.771 7.582 4.726 1.00 . A A . 12 THR CA 1 1 2 916 1 1 12 THR CB C -20.882 7.944 6.223 1.00 . A A . 12 THR CB 1 1 2 917 1 1 12 THR CG2 C -19.582 7.644 6.986 1.00 . A A . 12 THR CG2 1 1 2 918 1 1 12 THR H H -22.833 7.075 4.812 1.00 . A A . 12 THR H 1 1 2 919 1 1 12 THR HA H -20.555 8.452 4.167 1.00 . A A . 12 THR HA 1 1 2 920 1 1 12 THR HB H -21.698 7.397 6.671 1.00 . A A . 12 THR HB 1 1 2 921 1 1 12 THR HG1 H -20.935 9.682 5.442 1.00 . A A . 12 THR HG1 1 1 2 922 1 1 12 THR HG21 H -18.744 7.691 6.305 1.00 . A A . 12 THR HG21 1 1 2 923 1 1 12 THR HG22 H -19.449 8.376 7.770 1.00 . A A . 12 THR HG22 1 1 2 924 1 1 12 THR HG23 H -19.637 6.658 7.421 1.00 . A A . 12 THR HG23 1 1 2 925 1 1 12 THR N N -22.044 7.018 4.251 1.00 . A A . 12 THR N 1 1 2 926 1 1 12 THR O O -18.915 6.661 3.588 1.00 . A A . 12 THR O 1 1 2 927 1 1 12 THR OG1 O -21.134 9.322 6.304 1.00 . A A . 12 THR OG1 1 1 2 928 1 1 13 ASP C C -18.271 4.248 3.804 1.00 . A A . 13 ASP C 1 1 2 929 1 1 13 ASP CA C -18.661 4.524 5.247 1.00 . A A . 13 ASP CA 1 1 2 930 1 1 13 ASP CB C -19.224 3.251 5.882 1.00 . A A . 13 ASP CB 1 1 2 931 1 1 13 ASP CG C -18.770 3.164 7.340 1.00 . A A . 13 ASP CG 1 1 2 932 1 1 13 ASP H H -20.326 5.621 6.044 1.00 . A A . 13 ASP H 1 1 2 933 1 1 13 ASP HA H -17.786 4.826 5.771 1.00 . A A . 13 ASP HA 1 1 2 934 1 1 13 ASP HB2 H -20.304 3.275 5.840 1.00 . A A . 13 ASP HB2 1 1 2 935 1 1 13 ASP HB3 H -18.861 2.390 5.342 1.00 . A A . 13 ASP HB3 1 1 2 936 1 1 13 ASP N N -19.668 5.611 5.333 1.00 . A A . 13 ASP N 1 1 2 937 1 1 13 ASP O O -17.154 3.860 3.529 1.00 . A A . 13 ASP O 1 1 2 938 1 1 13 ASP OD1 O -17.641 2.763 7.566 1.00 . A A . 13 ASP OD1 1 1 2 939 1 1 13 ASP OD2 O -19.560 3.500 8.207 1.00 . A A . 13 ASP OD2 1 1 2 940 1 1 14 GLU C C -18.007 5.380 0.887 1.00 . A A . 14 GLU C 1 1 2 941 1 1 14 GLU CA C -18.725 4.170 1.478 1.00 . A A . 14 GLU CA 1 1 2 942 1 1 14 GLU CB C -19.923 3.834 0.613 1.00 . A A . 14 GLU CB 1 1 2 943 1 1 14 GLU CD C -20.493 2.409 -1.358 1.00 . A A . 14 GLU CD 1 1 2 944 1 1 14 GLU CG C -19.696 2.478 -0.054 1.00 . A A . 14 GLU CG 1 1 2 945 1 1 14 GLU H H -20.053 4.774 3.071 1.00 . A A . 14 GLU H 1 1 2 946 1 1 14 GLU HA H -18.046 3.335 1.503 1.00 . A A . 14 GLU HA 1 1 2 947 1 1 14 GLU HB2 H -20.809 3.802 1.224 1.00 . A A . 14 GLU HB2 1 1 2 948 1 1 14 GLU HB3 H -20.025 4.594 -0.144 1.00 . A A . 14 GLU HB3 1 1 2 949 1 1 14 GLU HG2 H -18.642 2.356 -0.265 1.00 . A A . 14 GLU HG2 1 1 2 950 1 1 14 GLU HG3 H -20.024 1.691 0.610 1.00 . A A . 14 GLU HG3 1 1 2 951 1 1 14 GLU N N -19.145 4.446 2.866 1.00 . A A . 14 GLU N 1 1 2 952 1 1 14 GLU O O -16.971 5.242 0.276 1.00 . A A . 14 GLU O 1 1 2 953 1 1 14 GLU OE1 O -20.328 3.299 -2.177 1.00 . A A . 14 GLU OE1 1 1 2 954 1 1 14 GLU OE2 O -21.253 1.469 -1.515 1.00 . A A . 14 GLU OE2 1 1 2 955 1 1 15 GLN C C -16.544 7.896 1.246 1.00 . A A . 15 GLN C 1 1 2 956 1 1 15 GLN CA C -17.848 7.754 0.507 1.00 . A A . 15 GLN CA 1 1 2 957 1 1 15 GLN CB C -18.685 8.989 0.745 1.00 . A A . 15 GLN CB 1 1 2 958 1 1 15 GLN CD C -20.782 9.748 -0.377 1.00 . A A . 15 GLN CD 1 1 2 959 1 1 15 GLN CG C -20.158 8.667 0.507 1.00 . A A . 15 GLN CG 1 1 2 960 1 1 15 GLN H H -19.372 6.665 1.555 1.00 . A A . 15 GLN H 1 1 2 961 1 1 15 GLN HA H -17.663 7.621 -0.531 1.00 . A A . 15 GLN HA 1 1 2 962 1 1 15 GLN HB2 H -18.546 9.306 1.763 1.00 . A A . 15 GLN HB2 1 1 2 963 1 1 15 GLN HB3 H -18.366 9.765 0.071 1.00 . A A . 15 GLN HB3 1 1 2 964 1 1 15 GLN HE21 H -19.713 11.219 0.419 1.00 . A A . 15 GLN HE21 1 1 2 965 1 1 15 GLN HE22 H -20.791 11.687 -0.806 1.00 . A A . 15 GLN HE22 1 1 2 966 1 1 15 GLN HG2 H -20.243 7.706 0.022 1.00 . A A . 15 GLN HG2 1 1 2 967 1 1 15 GLN HG3 H -20.672 8.639 1.456 1.00 . A A . 15 GLN HG3 1 1 2 968 1 1 15 GLN N N -18.536 6.562 1.059 1.00 . A A . 15 GLN N 1 1 2 969 1 1 15 GLN NE2 N -20.397 10.987 -0.244 1.00 . A A . 15 GLN NE2 1 1 2 970 1 1 15 GLN O O -15.499 8.163 0.689 1.00 . A A . 15 GLN O 1 1 2 971 1 1 15 GLN OE1 O -21.629 9.461 -1.200 1.00 . A A . 15 GLN OE1 1 1 2 972 1 1 16 ALA C C -14.371 6.858 2.652 1.00 . A A . 16 ALA C 1 1 2 973 1 1 16 ALA CA C -15.403 7.738 3.341 1.00 . A A . 16 ALA CA 1 1 2 974 1 1 16 ALA CB C -15.732 7.188 4.726 1.00 . A A . 16 ALA CB 1 1 2 975 1 1 16 ALA H H -17.469 7.463 2.905 1.00 . A A . 16 ALA H 1 1 2 976 1 1 16 ALA HA H -15.044 8.750 3.410 1.00 . A A . 16 ALA HA 1 1 2 977 1 1 16 ALA HB1 H -15.619 7.971 5.461 1.00 . A A . 16 ALA HB1 1 1 2 978 1 1 16 ALA HB2 H -15.064 6.373 4.959 1.00 . A A . 16 ALA HB2 1 1 2 979 1 1 16 ALA HB3 H -16.755 6.832 4.731 1.00 . A A . 16 ALA HB3 1 1 2 980 1 1 16 ALA N N -16.614 7.684 2.511 1.00 . A A . 16 ALA N 1 1 2 981 1 1 16 ALA O O -13.183 7.095 2.722 1.00 . A A . 16 ALA O 1 1 2 982 1 1 17 GLN C C -13.607 5.557 -0.155 1.00 . A A . 17 GLN C 1 1 2 983 1 1 17 GLN CA C -13.886 4.964 1.222 1.00 . A A . 17 GLN CA 1 1 2 984 1 1 17 GLN CB C -14.478 3.574 1.055 1.00 . A A . 17 GLN CB 1 1 2 985 1 1 17 GLN CD C -14.617 1.345 2.172 1.00 . A A . 17 GLN CD 1 1 2 986 1 1 17 GLN CG C -14.450 2.849 2.398 1.00 . A A . 17 GLN CG 1 1 2 987 1 1 17 GLN H H -15.812 5.690 1.897 1.00 . A A . 17 GLN H 1 1 2 988 1 1 17 GLN HA H -12.964 4.901 1.773 1.00 . A A . 17 GLN HA 1 1 2 989 1 1 17 GLN HB2 H -15.496 3.657 0.705 1.00 . A A . 17 GLN HB2 1 1 2 990 1 1 17 GLN HB3 H -13.890 3.027 0.338 1.00 . A A . 17 GLN HB3 1 1 2 991 1 1 17 GLN HE21 H -13.825 0.850 3.923 1.00 . A A . 17 GLN HE21 1 1 2 992 1 1 17 GLN HE22 H -14.326 -0.454 2.960 1.00 . A A . 17 GLN HE22 1 1 2 993 1 1 17 GLN HG2 H -13.505 3.040 2.887 1.00 . A A . 17 GLN HG2 1 1 2 994 1 1 17 GLN HG3 H -15.255 3.209 3.016 1.00 . A A . 17 GLN HG3 1 1 2 995 1 1 17 GLN N N -14.835 5.850 1.953 1.00 . A A . 17 GLN N 1 1 2 996 1 1 17 GLN NE2 N -14.223 0.511 3.095 1.00 . A A . 17 GLN NE2 1 1 2 997 1 1 17 GLN O O -12.537 5.389 -0.708 1.00 . A A . 17 GLN O 1 1 2 998 1 1 17 GLN OE1 O -15.110 0.925 1.144 1.00 . A A . 17 GLN OE1 1 1 2 999 1 1 18 GLU C C -12.957 7.589 -1.978 1.00 . A A . 18 GLU C 1 1 2 1000 1 1 18 GLU CA C -14.317 6.909 -2.033 1.00 . A A . 18 GLU CA 1 1 2 1001 1 1 18 GLU CB C -15.405 7.947 -2.316 1.00 . A A . 18 GLU CB 1 1 2 1002 1 1 18 GLU CD C -17.609 7.366 -3.341 1.00 . A A . 18 GLU CD 1 1 2 1003 1 1 18 GLU CG C -16.122 7.592 -3.621 1.00 . A A . 18 GLU CG 1 1 2 1004 1 1 18 GLU H H -15.390 6.422 -0.240 1.00 . A A . 18 GLU H 1 1 2 1005 1 1 18 GLU HA H -14.318 6.152 -2.804 1.00 . A A . 18 GLU HA 1 1 2 1006 1 1 18 GLU HB2 H -16.115 7.954 -1.504 1.00 . A A . 18 GLU HB2 1 1 2 1007 1 1 18 GLU HB3 H -14.955 8.924 -2.410 1.00 . A A . 18 GLU HB3 1 1 2 1008 1 1 18 GLU HG2 H -16.006 8.402 -4.326 1.00 . A A . 18 GLU HG2 1 1 2 1009 1 1 18 GLU HG3 H -15.695 6.690 -4.033 1.00 . A A . 18 GLU HG3 1 1 2 1010 1 1 18 GLU N N -14.549 6.279 -0.706 1.00 . A A . 18 GLU N 1 1 2 1011 1 1 18 GLU O O -12.312 7.810 -2.983 1.00 . A A . 18 GLU O 1 1 2 1012 1 1 18 GLU OE1 O -18.195 8.191 -2.660 1.00 . A A . 18 GLU OE1 1 1 2 1013 1 1 18 GLU OE2 O -18.136 6.372 -3.813 1.00 . A A . 18 GLU OE2 1 1 2 1014 1 1 19 LEU C C -10.253 7.575 0.055 1.00 . A A . 19 LEU C 1 1 2 1015 1 1 19 LEU CA C -11.199 8.555 -0.630 1.00 . A A . 19 LEU CA 1 1 2 1016 1 1 19 LEU CB C -11.342 9.803 0.234 1.00 . A A . 19 LEU CB 1 1 2 1017 1 1 19 LEU CD1 C -10.169 9.573 2.423 1.00 . A A . 19 LEU CD1 1 1 2 1018 1 1 19 LEU CD2 C -12.556 10.318 2.355 1.00 . A A . 19 LEU CD2 1 1 2 1019 1 1 19 LEU CG C -11.510 9.411 1.703 1.00 . A A . 19 LEU CG 1 1 2 1020 1 1 19 LEU H H -13.060 7.721 -0.001 1.00 . A A . 19 LEU H 1 1 2 1021 1 1 19 LEU HA H -10.803 8.821 -1.595 1.00 . A A . 19 LEU HA 1 1 2 1022 1 1 19 LEU HB2 H -10.459 10.399 0.130 1.00 . A A . 19 LEU HB2 1 1 2 1023 1 1 19 LEU HB3 H -12.204 10.364 -0.087 1.00 . A A . 19 LEU HB3 1 1 2 1024 1 1 19 LEU HD11 H -9.412 9.884 1.714 1.00 . A A . 19 LEU HD11 1 1 2 1025 1 1 19 LEU HD12 H -10.263 10.320 3.197 1.00 . A A . 19 LEU HD12 1 1 2 1026 1 1 19 LEU HD13 H -9.880 8.630 2.864 1.00 . A A . 19 LEU HD13 1 1 2 1027 1 1 19 LEU HD21 H -12.317 11.351 2.145 1.00 . A A . 19 LEU HD21 1 1 2 1028 1 1 19 LEU HD22 H -13.534 10.087 1.956 1.00 . A A . 19 LEU HD22 1 1 2 1029 1 1 19 LEU HD23 H -12.556 10.159 3.423 1.00 . A A . 19 LEU HD23 1 1 2 1030 1 1 19 LEU HG H -11.831 8.382 1.767 1.00 . A A . 19 LEU HG 1 1 2 1031 1 1 19 LEU N N -12.518 7.912 -0.792 1.00 . A A . 19 LEU N 1 1 2 1032 1 1 19 LEU O O -9.060 7.642 -0.107 1.00 . A A . 19 LEU O 1 1 2 1033 1 1 20 HIS C C -9.699 4.456 0.728 1.00 . A A . 20 HIS C 1 1 2 1034 1 1 20 HIS CA C -9.934 5.710 1.567 1.00 . A A . 20 HIS CA 1 1 2 1035 1 1 20 HIS CB C -10.621 5.300 2.854 1.00 . A A . 20 HIS CB 1 1 2 1036 1 1 20 HIS CD2 C -9.785 6.958 4.690 1.00 . A A . 20 HIS CD2 1 1 2 1037 1 1 20 HIS CE1 C -8.293 5.689 5.617 1.00 . A A . 20 HIS CE1 1 1 2 1038 1 1 20 HIS CG C -9.801 5.768 4.016 1.00 . A A . 20 HIS CG 1 1 2 1039 1 1 20 HIS H H -11.752 6.672 0.977 1.00 . A A . 20 HIS H 1 1 2 1040 1 1 20 HIS HA H -8.993 6.173 1.800 1.00 . A A . 20 HIS HA 1 1 2 1041 1 1 20 HIS HB2 H -11.602 5.746 2.898 1.00 . A A . 20 HIS HB2 1 1 2 1042 1 1 20 HIS HB3 H -10.709 4.231 2.878 1.00 . A A . 20 HIS HB3 1 1 2 1043 1 1 20 HIS HD1 H -8.598 4.056 4.358 1.00 . A A . 20 HIS HD1 1 1 2 1044 1 1 20 HIS HD2 H -10.410 7.807 4.457 1.00 . A A . 20 HIS HD2 1 1 2 1045 1 1 20 HIS HE1 H -7.511 5.324 6.267 1.00 . A A . 20 HIS HE1 1 1 2 1046 1 1 20 HIS N N -10.788 6.684 0.843 1.00 . A A . 20 HIS N 1 1 2 1047 1 1 20 HIS ND1 N -8.842 4.971 4.619 1.00 . A A . 20 HIS ND1 1 1 2 1048 1 1 20 HIS NE2 N -8.831 6.910 5.704 1.00 . A A . 20 HIS NE2 1 1 2 1049 1 1 20 HIS O O -8.643 4.282 0.158 1.00 . A A . 20 HIS O 1 1 2 1050 1 1 21 SER C C -9.682 2.568 -1.322 1.00 . A A . 21 SER C 1 1 2 1051 1 1 21 SER CA C -10.501 2.300 -0.097 1.00 . A A . 21 SER CA 1 1 2 1052 1 1 21 SER CB C -11.848 1.771 -0.573 1.00 . A A . 21 SER CB 1 1 2 1053 1 1 21 SER H H -11.495 3.716 1.170 1.00 . A A . 21 SER H 1 1 2 1054 1 1 21 SER HA H -10.022 1.578 0.508 1.00 . A A . 21 SER HA 1 1 2 1055 1 1 21 SER HB2 H -12.366 2.547 -1.113 1.00 . A A . 21 SER HB2 1 1 2 1056 1 1 21 SER HB3 H -11.679 0.937 -1.243 1.00 . A A . 21 SER HB3 1 1 2 1057 1 1 21 SER HG H -12.683 0.402 0.528 1.00 . A A . 21 SER HG 1 1 2 1058 1 1 21 SER N N -10.668 3.563 0.679 1.00 . A A . 21 SER N 1 1 2 1059 1 1 21 SER O O -8.534 2.187 -1.434 1.00 . A A . 21 SER O 1 1 2 1060 1 1 21 SER OG O -12.627 1.360 0.542 1.00 . A A . 21 SER OG 1 1 2 1061 1 1 22 VAL C C -8.156 3.945 -3.184 1.00 . A A . 22 VAL C 1 1 2 1062 1 1 22 VAL CA C -9.627 3.615 -3.483 1.00 . A A . 22 VAL CA 1 1 2 1063 1 1 22 VAL CB C -10.356 4.848 -4.040 1.00 . A A . 22 VAL CB 1 1 2 1064 1 1 22 VAL CG1 C -10.894 5.694 -2.870 1.00 . A A . 22 VAL CG1 1 1 2 1065 1 1 22 VAL CG2 C -9.403 5.696 -4.888 1.00 . A A . 22 VAL CG2 1 1 2 1066 1 1 22 VAL H H -11.210 3.533 -2.073 1.00 . A A . 22 VAL H 1 1 2 1067 1 1 22 VAL HA H -9.711 2.792 -4.166 1.00 . A A . 22 VAL HA 1 1 2 1068 1 1 22 VAL HB H -11.184 4.520 -4.647 1.00 . A A . 22 VAL HB 1 1 2 1069 1 1 22 VAL HG11 H -10.542 5.288 -1.928 1.00 . A A . 22 VAL HG11 1 1 2 1070 1 1 22 VAL HG12 H -10.546 6.710 -2.973 1.00 . A A . 22 VAL HG12 1 1 2 1071 1 1 22 VAL HG13 H -11.977 5.680 -2.879 1.00 . A A . 22 VAL HG13 1 1 2 1072 1 1 22 VAL HG21 H -8.541 5.970 -4.296 1.00 . A A . 22 VAL HG21 1 1 2 1073 1 1 22 VAL HG22 H -9.082 5.128 -5.748 1.00 . A A . 22 VAL HG22 1 1 2 1074 1 1 22 VAL HG23 H -9.912 6.590 -5.216 1.00 . A A . 22 VAL HG23 1 1 2 1075 1 1 22 VAL N N -10.290 3.245 -2.229 1.00 . A A . 22 VAL N 1 1 2 1076 1 1 22 VAL O O -7.244 3.448 -3.814 1.00 . A A . 22 VAL O 1 1 2 1077 1 1 23 TYR C C -5.703 3.932 -1.573 1.00 . A A . 23 TYR C 1 1 2 1078 1 1 23 TYR CA C -6.564 5.170 -1.801 1.00 . A A . 23 TYR CA 1 1 2 1079 1 1 23 TYR CB C -6.633 5.938 -0.483 1.00 . A A . 23 TYR CB 1 1 2 1080 1 1 23 TYR CD1 C -4.340 6.915 -0.828 1.00 . A A . 23 TYR CD1 1 1 2 1081 1 1 23 TYR CD2 C -6.165 8.397 -0.233 1.00 . A A . 23 TYR CD2 1 1 2 1082 1 1 23 TYR CE1 C -3.464 8.008 -0.854 1.00 . A A . 23 TYR CE1 1 1 2 1083 1 1 23 TYR CE2 C -5.294 9.487 -0.259 1.00 . A A . 23 TYR CE2 1 1 2 1084 1 1 23 TYR CG C -5.690 7.112 -0.519 1.00 . A A . 23 TYR CG 1 1 2 1085 1 1 23 TYR CZ C -3.941 9.296 -0.570 1.00 . A A . 23 TYR CZ 1 1 2 1086 1 1 23 TYR H H -8.711 5.150 -1.720 1.00 . A A . 23 TYR H 1 1 2 1087 1 1 23 TYR HA H -6.121 5.793 -2.562 1.00 . A A . 23 TYR HA 1 1 2 1088 1 1 23 TYR HB2 H -7.636 6.284 -0.326 1.00 . A A . 23 TYR HB2 1 1 2 1089 1 1 23 TYR HB3 H -6.352 5.282 0.327 1.00 . A A . 23 TYR HB3 1 1 2 1090 1 1 23 TYR HD1 H -3.975 5.918 -1.043 1.00 . A A . 23 TYR HD1 1 1 2 1091 1 1 23 TYR HD2 H -7.206 8.546 0.005 1.00 . A A . 23 TYR HD2 1 1 2 1092 1 1 23 TYR HE1 H -2.422 7.859 -1.094 1.00 . A A . 23 TYR HE1 1 1 2 1093 1 1 23 TYR HE2 H -5.666 10.478 -0.035 1.00 . A A . 23 TYR HE2 1 1 2 1094 1 1 23 TYR HH H -3.348 10.951 -1.311 1.00 . A A . 23 TYR HH 1 1 2 1095 1 1 23 TYR N N -7.946 4.778 -2.203 1.00 . A A . 23 TYR N 1 1 2 1096 1 1 23 TYR O O -4.784 3.662 -2.317 1.00 . A A . 23 TYR O 1 1 2 1097 1 1 23 TYR OH O -3.079 10.373 -0.594 1.00 . A A . 23 TYR OH 1 1 2 1098 1 1 24 MET C C -4.645 1.313 -1.450 1.00 . A A . 24 MET C 1 1 2 1099 1 1 24 MET CA C -5.170 1.996 -0.179 1.00 . A A . 24 MET CA 1 1 2 1100 1 1 24 MET CB C -6.028 1.017 0.637 1.00 . A A . 24 MET CB 1 1 2 1101 1 1 24 MET CE C -9.048 -1.403 -0.778 1.00 . A A . 24 MET CE 1 1 2 1102 1 1 24 MET CG C -6.866 0.138 -0.297 1.00 . A A . 24 MET CG 1 1 2 1103 1 1 24 MET H H -6.718 3.474 0.078 1.00 . A A . 24 MET H 1 1 2 1104 1 1 24 MET HA H -4.326 2.307 0.420 1.00 . A A . 24 MET HA 1 1 2 1105 1 1 24 MET HB2 H -5.383 0.391 1.236 1.00 . A A . 24 MET HB2 1 1 2 1106 1 1 24 MET HB3 H -6.688 1.577 1.288 1.00 . A A . 24 MET HB3 1 1 2 1107 1 1 24 MET HE1 H -8.257 -2.039 -1.149 1.00 . A A . 24 MET HE1 1 1 2 1108 1 1 24 MET HE2 H -9.845 -2.016 -0.386 1.00 . A A . 24 MET HE2 1 1 2 1109 1 1 24 MET HE3 H -9.431 -0.789 -1.583 1.00 . A A . 24 MET HE3 1 1 2 1110 1 1 24 MET HG2 H -7.098 0.686 -1.197 1.00 . A A . 24 MET HG2 1 1 2 1111 1 1 24 MET HG3 H -6.305 -0.750 -0.554 1.00 . A A . 24 MET HG3 1 1 2 1112 1 1 24 MET N N -5.981 3.205 -0.516 1.00 . A A . 24 MET N 1 1 2 1113 1 1 24 MET O O -3.553 0.780 -1.468 1.00 . A A . 24 MET O 1 1 2 1114 1 1 24 MET SD S -8.401 -0.339 0.535 1.00 . A A . 24 MET SD 1 1 2 1115 1 1 25 SER C C -3.728 1.474 -4.309 1.00 . A A . 25 SER C 1 1 2 1116 1 1 25 SER CA C -4.923 0.685 -3.767 1.00 . A A . 25 SER CA 1 1 2 1117 1 1 25 SER CB C -6.049 0.685 -4.804 1.00 . A A . 25 SER CB 1 1 2 1118 1 1 25 SER H H -6.278 1.766 -2.486 1.00 . A A . 25 SER H 1 1 2 1119 1 1 25 SER HA H -4.621 -0.332 -3.561 1.00 . A A . 25 SER HA 1 1 2 1120 1 1 25 SER HB2 H -6.925 0.222 -4.385 1.00 . A A . 25 SER HB2 1 1 2 1121 1 1 25 SER HB3 H -6.280 1.705 -5.081 1.00 . A A . 25 SER HB3 1 1 2 1122 1 1 25 SER HG H -5.104 -0.791 -5.648 1.00 . A A . 25 SER HG 1 1 2 1123 1 1 25 SER N N -5.402 1.327 -2.511 1.00 . A A . 25 SER N 1 1 2 1124 1 1 25 SER O O -2.602 1.013 -4.293 1.00 . A A . 25 SER O 1 1 2 1125 1 1 25 SER OG O -5.632 -0.048 -5.948 1.00 . A A . 25 SER OG 1 1 2 1126 1 1 26 GLY C C -2.030 4.103 -4.165 1.00 . A A . 26 GLY C 1 1 2 1127 1 1 26 GLY CA C -2.845 3.503 -5.311 1.00 . A A . 26 GLY CA 1 1 2 1128 1 1 26 GLY H H -4.875 3.028 -4.766 1.00 . A A . 26 GLY H 1 1 2 1129 1 1 26 GLY HA2 H -3.252 4.301 -5.909 1.00 . A A . 26 GLY HA2 1 1 2 1130 1 1 26 GLY HA3 H -2.202 2.888 -5.922 1.00 . A A . 26 GLY HA3 1 1 2 1131 1 1 26 GLY N N -3.962 2.672 -4.774 1.00 . A A . 26 GLY N 1 1 2 1132 1 1 26 GLY O O -1.244 5.005 -4.362 1.00 . A A . 26 GLY O 1 1 2 1133 1 1 27 LEU C C -0.123 3.412 -1.700 1.00 . A A . 27 LEU C 1 1 2 1134 1 1 27 LEU CA C -1.454 4.156 -1.820 1.00 . A A . 27 LEU CA 1 1 2 1135 1 1 27 LEU CB C -2.280 3.940 -0.556 1.00 . A A . 27 LEU CB 1 1 2 1136 1 1 27 LEU CD1 C -3.450 5.233 1.233 1.00 . A A . 27 LEU CD1 1 1 2 1137 1 1 27 LEU CD2 C -0.954 5.141 1.187 1.00 . A A . 27 LEU CD2 1 1 2 1138 1 1 27 LEU CG C -2.218 5.188 0.325 1.00 . A A . 27 LEU CG 1 1 2 1139 1 1 27 LEU H H -2.848 2.901 -2.827 1.00 . A A . 27 LEU H 1 1 2 1140 1 1 27 LEU HA H -1.277 5.206 -1.965 1.00 . A A . 27 LEU HA 1 1 2 1141 1 1 27 LEU HB2 H -3.305 3.746 -0.836 1.00 . A A . 27 LEU HB2 1 1 2 1142 1 1 27 LEU HB3 H -1.890 3.095 -0.011 1.00 . A A . 27 LEU HB3 1 1 2 1143 1 1 27 LEU HD11 H -4.339 5.070 0.641 1.00 . A A . 27 LEU HD11 1 1 2 1144 1 1 27 LEU HD12 H -3.371 4.462 1.984 1.00 . A A . 27 LEU HD12 1 1 2 1145 1 1 27 LEU HD13 H -3.508 6.198 1.712 1.00 . A A . 27 LEU HD13 1 1 2 1146 1 1 27 LEU HD21 H -0.176 4.613 0.656 1.00 . A A . 27 LEU HD21 1 1 2 1147 1 1 27 LEU HD22 H -0.625 6.147 1.400 1.00 . A A . 27 LEU HD22 1 1 2 1148 1 1 27 LEU HD23 H -1.169 4.628 2.113 1.00 . A A . 27 LEU HD23 1 1 2 1149 1 1 27 LEU HG H -2.198 6.071 -0.299 1.00 . A A . 27 LEU HG 1 1 2 1150 1 1 27 LEU N N -2.211 3.617 -2.972 1.00 . A A . 27 LEU N 1 1 2 1151 1 1 27 LEU O O 0.942 3.999 -1.785 1.00 . A A . 27 LEU O 1 1 2 1152 1 1 28 TRP C C 1.788 1.429 -2.741 1.00 . A A . 28 TRP C 1 1 2 1153 1 1 28 TRP CA C 1.075 1.344 -1.414 1.00 . A A . 28 TRP CA 1 1 2 1154 1 1 28 TRP CB C 0.737 -0.101 -1.021 1.00 . A A . 28 TRP CB 1 1 2 1155 1 1 28 TRP CD1 C 2.612 -1.150 -2.291 1.00 . A A . 28 TRP CD1 1 1 2 1156 1 1 28 TRP CD2 C 2.629 -1.750 -0.132 1.00 . A A . 28 TRP CD2 1 1 2 1157 1 1 28 TRP CE2 C 3.728 -2.402 -0.739 1.00 . A A . 28 TRP CE2 1 1 2 1158 1 1 28 TRP CE3 C 2.407 -1.961 1.240 1.00 . A A . 28 TRP CE3 1 1 2 1159 1 1 28 TRP CG C 1.945 -0.961 -1.147 1.00 . A A . 28 TRP CG 1 1 2 1160 1 1 28 TRP CH2 C 4.343 -3.434 1.353 1.00 . A A . 28 TRP CH2 1 1 2 1161 1 1 28 TRP CZ2 C 4.578 -3.235 -0.010 1.00 . A A . 28 TRP CZ2 1 1 2 1162 1 1 28 TRP CZ3 C 3.260 -2.798 1.977 1.00 . A A . 28 TRP CZ3 1 1 2 1163 1 1 28 TRP H H -1.026 1.655 -1.480 1.00 . A A . 28 TRP H 1 1 2 1164 1 1 28 TRP HA H 1.700 1.785 -0.683 1.00 . A A . 28 TRP HA 1 1 2 1165 1 1 28 TRP HB2 H 0.389 -0.122 0.000 1.00 . A A . 28 TRP HB2 1 1 2 1166 1 1 28 TRP HB3 H -0.040 -0.475 -1.672 1.00 . A A . 28 TRP HB3 1 1 2 1167 1 1 28 TRP HD1 H 2.351 -0.695 -3.230 1.00 . A A . 28 TRP HD1 1 1 2 1168 1 1 28 TRP HE1 H 4.324 -2.297 -2.735 1.00 . A A . 28 TRP HE1 1 1 2 1169 1 1 28 TRP HE3 H 1.575 -1.476 1.731 1.00 . A A . 28 TRP HE3 1 1 2 1170 1 1 28 TRP HH2 H 4.995 -4.077 1.925 1.00 . A A . 28 TRP HH2 1 1 2 1171 1 1 28 TRP HZ2 H 5.410 -3.721 -0.496 1.00 . A A . 28 TRP HZ2 1 1 2 1172 1 1 28 TRP HZ3 H 3.081 -2.954 3.031 1.00 . A A . 28 TRP HZ3 1 1 2 1173 1 1 28 TRP N N -0.172 2.118 -1.523 1.00 . A A . 28 TRP N 1 1 2 1174 1 1 28 TRP NE1 N 3.677 -2.001 -2.061 1.00 . A A . 28 TRP NE1 1 1 2 1175 1 1 28 TRP O O 3.000 1.418 -2.813 1.00 . A A . 28 TRP O 1 1 2 1176 1 1 29 LEU C C 2.002 3.212 -5.267 1.00 . A A . 29 LEU C 1 1 2 1177 1 1 29 LEU CA C 1.719 1.732 -5.104 1.00 . A A . 29 LEU CA 1 1 2 1178 1 1 29 LEU CB C 0.862 1.235 -6.275 1.00 . A A . 29 LEU CB 1 1 2 1179 1 1 29 LEU CD1 C -1.437 0.631 -6.997 1.00 . A A . 29 LEU CD1 1 1 2 1180 1 1 29 LEU CD2 C -0.489 -0.300 -4.875 1.00 . A A . 29 LEU CD2 1 1 2 1181 1 1 29 LEU CG C -0.535 0.920 -5.797 1.00 . A A . 29 LEU CG 1 1 2 1182 1 1 29 LEU H H 0.081 1.631 -3.694 1.00 . A A . 29 LEU H 1 1 2 1183 1 1 29 LEU HA H 2.658 1.194 -5.090 1.00 . A A . 29 LEU HA 1 1 2 1184 1 1 29 LEU HB2 H 0.811 2.005 -7.029 1.00 . A A . 29 LEU HB2 1 1 2 1185 1 1 29 LEU HB3 H 1.306 0.347 -6.696 1.00 . A A . 29 LEU HB3 1 1 2 1186 1 1 29 LEU HD11 H -0.851 0.193 -7.790 1.00 . A A . 29 LEU HD11 1 1 2 1187 1 1 29 LEU HD12 H -2.217 -0.056 -6.703 1.00 . A A . 29 LEU HD12 1 1 2 1188 1 1 29 LEU HD13 H -1.881 1.552 -7.344 1.00 . A A . 29 LEU HD13 1 1 2 1189 1 1 29 LEU HD21 H 0.525 -0.672 -4.824 1.00 . A A . 29 LEU HD21 1 1 2 1190 1 1 29 LEU HD22 H -0.818 -0.017 -3.886 1.00 . A A . 29 LEU HD22 1 1 2 1191 1 1 29 LEU HD23 H -1.137 -1.072 -5.264 1.00 . A A . 29 LEU HD23 1 1 2 1192 1 1 29 LEU HG H -0.905 1.773 -5.261 1.00 . A A . 29 LEU HG 1 1 2 1193 1 1 29 LEU N N 1.053 1.575 -3.788 1.00 . A A . 29 LEU N 1 1 2 1194 1 1 29 LEU O O 2.920 3.592 -5.938 1.00 . A A . 29 LEU O 1 1 2 1195 1 1 30 PHE C C 3.008 5.708 -4.710 1.00 . A A . 30 PHE C 1 1 2 1196 1 1 30 PHE CA C 1.504 5.523 -4.732 1.00 . A A . 30 PHE CA 1 1 2 1197 1 1 30 PHE CB C 0.875 6.277 -3.562 1.00 . A A . 30 PHE CB 1 1 2 1198 1 1 30 PHE CD1 C -0.662 7.335 -5.265 1.00 . A A . 30 PHE CD1 1 1 2 1199 1 1 30 PHE CD2 C 0.074 8.660 -3.372 1.00 . A A . 30 PHE CD2 1 1 2 1200 1 1 30 PHE CE1 C -1.399 8.425 -5.740 1.00 . A A . 30 PHE CE1 1 1 2 1201 1 1 30 PHE CE2 C -0.664 9.749 -3.847 1.00 . A A . 30 PHE CE2 1 1 2 1202 1 1 30 PHE CG C 0.076 7.451 -4.080 1.00 . A A . 30 PHE CG 1 1 2 1203 1 1 30 PHE CZ C -1.401 9.632 -5.032 1.00 . A A . 30 PHE CZ 1 1 2 1204 1 1 30 PHE H H 0.505 3.750 -4.063 1.00 . A A . 30 PHE H 1 1 2 1205 1 1 30 PHE HA H 1.115 5.873 -5.653 1.00 . A A . 30 PHE HA 1 1 2 1206 1 1 30 PHE HB2 H 0.227 5.611 -3.012 1.00 . A A . 30 PHE HB2 1 1 2 1207 1 1 30 PHE HB3 H 1.657 6.637 -2.911 1.00 . A A . 30 PHE HB3 1 1 2 1208 1 1 30 PHE HD1 H -0.662 6.405 -5.812 1.00 . A A . 30 PHE HD1 1 1 2 1209 1 1 30 PHE HD2 H 0.642 8.750 -2.458 1.00 . A A . 30 PHE HD2 1 1 2 1210 1 1 30 PHE HE1 H -1.967 8.335 -6.655 1.00 . A A . 30 PHE HE1 1 1 2 1211 1 1 30 PHE HE2 H -0.665 10.681 -3.301 1.00 . A A . 30 PHE HE2 1 1 2 1212 1 1 30 PHE HZ H -1.970 10.474 -5.399 1.00 . A A . 30 PHE HZ 1 1 2 1213 1 1 30 PHE N N 1.234 4.066 -4.622 1.00 . A A . 30 PHE N 1 1 2 1214 1 1 30 PHE O O 3.571 6.558 -5.372 1.00 . A A . 30 PHE O 1 1 2 1215 1 1 31 SER C C 5.636 4.417 -5.315 1.00 . A A . 31 SER C 1 1 2 1216 1 1 31 SER CA C 5.133 4.874 -3.942 1.00 . A A . 31 SER CA 1 1 2 1217 1 1 31 SER CB C 5.635 3.921 -2.857 1.00 . A A . 31 SER CB 1 1 2 1218 1 1 31 SER H H 3.146 4.155 -3.505 1.00 . A A . 31 SER H 1 1 2 1219 1 1 31 SER HA H 5.477 5.880 -3.744 1.00 . A A . 31 SER HA 1 1 2 1220 1 1 31 SER HB2 H 4.799 3.529 -2.302 1.00 . A A . 31 SER HB2 1 1 2 1221 1 1 31 SER HB3 H 6.174 3.104 -3.320 1.00 . A A . 31 SER HB3 1 1 2 1222 1 1 31 SER HG H 6.462 4.195 -1.117 1.00 . A A . 31 SER HG 1 1 2 1223 1 1 31 SER N N 3.652 4.849 -3.987 1.00 . A A . 31 SER N 1 1 2 1224 1 1 31 SER O O 6.327 5.140 -5.995 1.00 . A A . 31 SER O 1 1 2 1225 1 1 31 SER OG O 6.494 4.629 -1.972 1.00 . A A . 31 SER OG 1 1 2 1226 1 1 32 ALA C C 5.001 3.575 -8.167 1.00 . A A . 32 ALA C 1 1 2 1227 1 1 32 ALA CA C 5.665 2.719 -7.086 1.00 . A A . 32 ALA CA 1 1 2 1228 1 1 32 ALA CB C 5.218 1.265 -7.241 1.00 . A A . 32 ALA CB 1 1 2 1229 1 1 32 ALA H H 4.664 2.681 -5.173 1.00 . A A . 32 ALA H 1 1 2 1230 1 1 32 ALA HA H 6.742 2.782 -7.194 1.00 . A A . 32 ALA HA 1 1 2 1231 1 1 32 ALA HB1 H 4.336 1.223 -7.863 1.00 . A A . 32 ALA HB1 1 1 2 1232 1 1 32 ALA HB2 H 4.992 0.852 -6.269 1.00 . A A . 32 ALA HB2 1 1 2 1233 1 1 32 ALA HB3 H 6.010 0.692 -7.701 1.00 . A A . 32 ALA HB3 1 1 2 1234 1 1 32 ALA N N 5.252 3.228 -5.737 1.00 . A A . 32 ALA N 1 1 2 1235 1 1 32 ALA O O 5.665 4.329 -8.846 1.00 . A A . 32 ALA O 1 1 2 1236 1 1 33 VAL C C 3.669 5.690 -9.413 1.00 . A A . 33 VAL C 1 1 2 1237 1 1 33 VAL CA C 3.013 4.322 -9.355 1.00 . A A . 33 VAL CA 1 1 2 1238 1 1 33 VAL CB C 1.575 4.531 -8.955 1.00 . A A . 33 VAL CB 1 1 2 1239 1 1 33 VAL CG1 C 0.942 5.587 -9.865 1.00 . A A . 33 VAL CG1 1 1 2 1240 1 1 33 VAL CG2 C 0.804 3.218 -9.068 1.00 . A A . 33 VAL CG2 1 1 2 1241 1 1 33 VAL H H 3.161 2.871 -7.766 1.00 . A A . 33 VAL H 1 1 2 1242 1 1 33 VAL HA H 3.062 3.847 -10.321 1.00 . A A . 33 VAL HA 1 1 2 1243 1 1 33 VAL HB H 1.568 4.878 -7.942 1.00 . A A . 33 VAL HB 1 1 2 1244 1 1 33 VAL HG11 H 1.684 5.944 -10.570 1.00 . A A . 33 VAL HG11 1 1 2 1245 1 1 33 VAL HG12 H 0.113 5.151 -10.401 1.00 . A A . 33 VAL HG12 1 1 2 1246 1 1 33 VAL HG13 H 0.592 6.413 -9.262 1.00 . A A . 33 VAL HG13 1 1 2 1247 1 1 33 VAL HG21 H 1.474 2.391 -8.885 1.00 . A A . 33 VAL HG21 1 1 2 1248 1 1 33 VAL HG22 H 0.007 3.207 -8.339 1.00 . A A . 33 VAL HG22 1 1 2 1249 1 1 33 VAL HG23 H 0.387 3.130 -10.059 1.00 . A A . 33 VAL HG23 1 1 2 1250 1 1 33 VAL N N 3.696 3.484 -8.329 1.00 . A A . 33 VAL N 1 1 2 1251 1 1 33 VAL O O 3.922 6.197 -10.469 1.00 . A A . 33 VAL O 1 1 2 1252 1 1 34 ALA C C 5.837 7.494 -9.155 1.00 . A A . 34 ALA C 1 1 2 1253 1 1 34 ALA CA C 4.586 7.632 -8.327 1.00 . A A . 34 ALA CA 1 1 2 1254 1 1 34 ALA CB C 5.015 8.068 -6.942 1.00 . A A . 34 ALA CB 1 1 2 1255 1 1 34 ALA H H 3.713 5.878 -7.425 1.00 . A A . 34 ALA H 1 1 2 1256 1 1 34 ALA HA H 3.922 8.362 -8.763 1.00 . A A . 34 ALA HA 1 1 2 1257 1 1 34 ALA HB1 H 5.862 8.734 -7.043 1.00 . A A . 34 ALA HB1 1 1 2 1258 1 1 34 ALA HB2 H 4.202 8.577 -6.452 1.00 . A A . 34 ALA HB2 1 1 2 1259 1 1 34 ALA HB3 H 5.308 7.199 -6.369 1.00 . A A . 34 ALA HB3 1 1 2 1260 1 1 34 ALA N N 3.936 6.298 -8.285 1.00 . A A . 34 ALA N 1 1 2 1261 1 1 34 ALA O O 6.006 8.135 -10.169 1.00 . A A . 34 ALA O 1 1 2 1262 1 1 35 ILE C C 7.620 6.309 -10.925 1.00 . A A . 35 ILE C 1 1 2 1263 1 1 35 ILE CA C 7.964 6.423 -9.463 1.00 . A A . 35 ILE CA 1 1 2 1264 1 1 35 ILE CB C 8.628 5.127 -9.035 1.00 . A A . 35 ILE CB 1 1 2 1265 1 1 35 ILE CD1 C 9.235 3.725 -7.054 1.00 . A A . 35 ILE CD1 1 1 2 1266 1 1 35 ILE CG1 C 8.262 4.772 -7.604 1.00 . A A . 35 ILE CG1 1 1 2 1267 1 1 35 ILE CG2 C 10.112 5.336 -9.149 1.00 . A A . 35 ILE CG2 1 1 2 1268 1 1 35 ILE H H 6.553 6.141 -7.901 1.00 . A A . 35 ILE H 1 1 2 1269 1 1 35 ILE HA H 8.639 7.250 -9.306 1.00 . A A . 35 ILE HA 1 1 2 1270 1 1 35 ILE HB H 8.310 4.329 -9.687 1.00 . A A . 35 ILE HB 1 1 2 1271 1 1 35 ILE HD11 H 9.847 3.343 -7.860 1.00 . A A . 35 ILE HD11 1 1 2 1272 1 1 35 ILE HD12 H 9.868 4.179 -6.306 1.00 . A A . 35 ILE HD12 1 1 2 1273 1 1 35 ILE HD13 H 8.678 2.913 -6.610 1.00 . A A . 35 ILE HD13 1 1 2 1274 1 1 35 ILE HG12 H 8.292 5.658 -6.990 1.00 . A A . 35 ILE HG12 1 1 2 1275 1 1 35 ILE HG13 H 7.266 4.365 -7.609 1.00 . A A . 35 ILE HG13 1 1 2 1276 1 1 35 ILE HG21 H 10.291 6.101 -9.891 1.00 . A A . 35 ILE HG21 1 1 2 1277 1 1 35 ILE HG22 H 10.491 5.660 -8.195 1.00 . A A . 35 ILE HG22 1 1 2 1278 1 1 35 ILE HG23 H 10.588 4.417 -9.444 1.00 . A A . 35 ILE HG23 1 1 2 1279 1 1 35 ILE N N 6.720 6.641 -8.717 1.00 . A A . 35 ILE N 1 1 2 1280 1 1 35 ILE O O 8.403 6.637 -11.786 1.00 . A A . 35 ILE O 1 1 2 1281 1 1 36 VAL C C 5.770 7.135 -13.147 1.00 . A A . 36 VAL C 1 1 2 1282 1 1 36 VAL CA C 6.054 5.731 -12.626 1.00 . A A . 36 VAL CA 1 1 2 1283 1 1 36 VAL CB C 4.824 4.840 -12.728 1.00 . A A . 36 VAL CB 1 1 2 1284 1 1 36 VAL CG1 C 4.639 4.402 -14.181 1.00 . A A . 36 VAL CG1 1 1 2 1285 1 1 36 VAL CG2 C 5.036 3.610 -11.833 1.00 . A A . 36 VAL CG2 1 1 2 1286 1 1 36 VAL H H 5.809 5.596 -10.495 1.00 . A A . 36 VAL H 1 1 2 1287 1 1 36 VAL HA H 6.870 5.296 -13.180 1.00 . A A . 36 VAL HA 1 1 2 1288 1 1 36 VAL HB H 3.952 5.385 -12.399 1.00 . A A . 36 VAL HB 1 1 2 1289 1 1 36 VAL HG11 H 5.402 4.862 -14.796 1.00 . A A . 36 VAL HG11 1 1 2 1290 1 1 36 VAL HG12 H 4.721 3.328 -14.248 1.00 . A A . 36 VAL HG12 1 1 2 1291 1 1 36 VAL HG13 H 3.665 4.712 -14.528 1.00 . A A . 36 VAL HG13 1 1 2 1292 1 1 36 VAL HG21 H 5.451 3.915 -10.875 1.00 . A A . 36 VAL HG21 1 1 2 1293 1 1 36 VAL HG22 H 4.091 3.114 -11.674 1.00 . A A . 36 VAL HG22 1 1 2 1294 1 1 36 VAL HG23 H 5.721 2.930 -12.316 1.00 . A A . 36 VAL HG23 1 1 2 1295 1 1 36 VAL N N 6.443 5.851 -11.213 1.00 . A A . 36 VAL N 1 1 2 1296 1 1 36 VAL O O 6.271 7.545 -14.172 1.00 . A A . 36 VAL O 1 1 2 1297 1 1 37 ALA C C 6.072 9.915 -13.202 1.00 . A A . 37 ALA C 1 1 2 1298 1 1 37 ALA CA C 4.733 9.272 -12.852 1.00 . A A . 37 ALA CA 1 1 2 1299 1 1 37 ALA CB C 4.059 10.038 -11.712 1.00 . A A . 37 ALA CB 1 1 2 1300 1 1 37 ALA H H 4.633 7.572 -11.602 1.00 . A A . 37 ALA H 1 1 2 1301 1 1 37 ALA HA H 4.092 9.253 -13.710 1.00 . A A . 37 ALA HA 1 1 2 1302 1 1 37 ALA HB1 H 4.813 10.403 -11.030 1.00 . A A . 37 ALA HB1 1 1 2 1303 1 1 37 ALA HB2 H 3.505 10.870 -12.116 1.00 . A A . 37 ALA HB2 1 1 2 1304 1 1 37 ALA HB3 H 3.385 9.377 -11.184 1.00 . A A . 37 ALA HB3 1 1 2 1305 1 1 37 ALA N N 5.004 7.895 -12.426 1.00 . A A . 37 ALA N 1 1 2 1306 1 1 37 ALA O O 6.161 10.746 -14.082 1.00 . A A . 37 ALA O 1 1 2 1307 1 1 38 HIS C C 9.054 9.428 -14.063 1.00 . A A . 38 HIS C 1 1 2 1308 1 1 38 HIS CA C 8.452 10.121 -12.836 1.00 . A A . 38 HIS CA 1 1 2 1309 1 1 38 HIS CB C 9.390 9.957 -11.638 1.00 . A A . 38 HIS CB 1 1 2 1310 1 1 38 HIS CD2 C 7.502 11.090 -10.203 1.00 . A A . 38 HIS CD2 1 1 2 1311 1 1 38 HIS CE1 C 8.526 11.106 -8.295 1.00 . A A . 38 HIS CE1 1 1 2 1312 1 1 38 HIS CG C 8.735 10.522 -10.407 1.00 . A A . 38 HIS CG 1 1 2 1313 1 1 38 HIS H H 7.045 8.850 -11.805 1.00 . A A . 38 HIS H 1 1 2 1314 1 1 38 HIS HA H 8.320 11.163 -13.053 1.00 . A A . 38 HIS HA 1 1 2 1315 1 1 38 HIS HB2 H 9.598 8.908 -11.486 1.00 . A A . 38 HIS HB2 1 1 2 1316 1 1 38 HIS HB3 H 10.312 10.484 -11.829 1.00 . A A . 38 HIS HB3 1 1 2 1317 1 1 38 HIS HD1 H 10.272 10.208 -8.984 1.00 . A A . 38 HIS HD1 1 1 2 1318 1 1 38 HIS HD2 H 6.748 11.230 -10.964 1.00 . A A . 38 HIS HD2 1 1 2 1319 1 1 38 HIS HE1 H 8.753 11.257 -7.249 1.00 . A A . 38 HIS HE1 1 1 2 1320 1 1 38 HIS N N 7.127 9.529 -12.520 1.00 . A A . 38 HIS N 1 1 2 1321 1 1 38 HIS ND1 N 9.370 10.543 -9.176 1.00 . A A . 38 HIS ND1 1 1 2 1322 1 1 38 HIS NE2 N 7.372 11.458 -8.868 1.00 . A A . 38 HIS NE2 1 1 2 1323 1 1 38 HIS O O 9.707 10.049 -14.876 1.00 . A A . 38 HIS O 1 1 2 1324 1 1 39 LEU C C 8.323 7.413 -16.481 1.00 . A A . 39 LEU C 1 1 2 1325 1 1 39 LEU CA C 9.382 7.432 -15.388 1.00 . A A . 39 LEU CA 1 1 2 1326 1 1 39 LEU CB C 9.745 5.998 -14.998 1.00 . A A . 39 LEU CB 1 1 2 1327 1 1 39 LEU CD1 C 10.844 4.583 -13.260 1.00 . A A . 39 LEU CD1 1 1 2 1328 1 1 39 LEU CD2 C 11.941 6.691 -14.034 1.00 . A A . 39 LEU CD2 1 1 2 1329 1 1 39 LEU CG C 10.600 6.017 -13.733 1.00 . A A . 39 LEU CG 1 1 2 1330 1 1 39 LEU H H 8.301 7.671 -13.556 1.00 . A A . 39 LEU H 1 1 2 1331 1 1 39 LEU HA H 10.256 7.946 -15.742 1.00 . A A . 39 LEU HA 1 1 2 1332 1 1 39 LEU HB2 H 8.842 5.436 -14.816 1.00 . A A . 39 LEU HB2 1 1 2 1333 1 1 39 LEU HB3 H 10.302 5.538 -15.799 1.00 . A A . 39 LEU HB3 1 1 2 1334 1 1 39 LEU HD11 H 11.219 3.991 -14.083 1.00 . A A . 39 LEU HD11 1 1 2 1335 1 1 39 LEU HD12 H 11.568 4.586 -12.459 1.00 . A A . 39 LEU HD12 1 1 2 1336 1 1 39 LEU HD13 H 9.915 4.159 -12.905 1.00 . A A . 39 LEU HD13 1 1 2 1337 1 1 39 LEU HD21 H 11.768 7.700 -14.379 1.00 . A A . 39 LEU HD21 1 1 2 1338 1 1 39 LEU HD22 H 12.542 6.715 -13.137 1.00 . A A . 39 LEU HD22 1 1 2 1339 1 1 39 LEU HD23 H 12.461 6.133 -14.801 1.00 . A A . 39 LEU HD23 1 1 2 1340 1 1 39 LEU HG H 10.084 6.566 -12.962 1.00 . A A . 39 LEU HG 1 1 2 1341 1 1 39 LEU N N 8.832 8.152 -14.210 1.00 . A A . 39 LEU N 1 1 2 1342 1 1 39 LEU O O 8.483 8.023 -17.515 1.00 . A A . 39 LEU O 1 1 2 1343 1 1 40 ALA C C 6.026 7.963 -18.014 1.00 . A A . 40 ALA C 1 1 2 1344 1 1 40 ALA CA C 6.142 6.639 -17.252 1.00 . A A . 40 ALA CA 1 1 2 1345 1 1 40 ALA CB C 4.821 6.371 -16.531 1.00 . A A . 40 ALA CB 1 1 2 1346 1 1 40 ALA H H 7.156 6.229 -15.402 1.00 . A A . 40 ALA H 1 1 2 1347 1 1 40 ALA HA H 6.340 5.836 -17.943 1.00 . A A . 40 ALA HA 1 1 2 1348 1 1 40 ALA HB1 H 4.518 5.349 -16.705 1.00 . A A . 40 ALA HB1 1 1 2 1349 1 1 40 ALA HB2 H 4.064 7.043 -16.911 1.00 . A A . 40 ALA HB2 1 1 2 1350 1 1 40 ALA HB3 H 4.949 6.537 -15.471 1.00 . A A . 40 ALA HB3 1 1 2 1351 1 1 40 ALA N N 7.243 6.713 -16.247 1.00 . A A . 40 ALA N 1 1 2 1352 1 1 40 ALA O O 5.672 7.987 -19.176 1.00 . A A . 40 ALA O 1 1 2 1353 1 1 41 VAL C C 7.337 10.514 -19.095 1.00 . A A . 41 VAL C 1 1 2 1354 1 1 41 VAL CA C 6.202 10.373 -18.077 1.00 . A A . 41 VAL CA 1 1 2 1355 1 1 41 VAL CB C 6.273 11.507 -17.057 1.00 . A A . 41 VAL CB 1 1 2 1356 1 1 41 VAL CG1 C 6.414 12.844 -17.788 1.00 . A A . 41 VAL CG1 1 1 2 1357 1 1 41 VAL CG2 C 4.989 11.513 -16.226 1.00 . A A . 41 VAL CG2 1 1 2 1358 1 1 41 VAL H H 6.591 9.042 -16.432 1.00 . A A . 41 VAL H 1 1 2 1359 1 1 41 VAL HA H 5.256 10.415 -18.589 1.00 . A A . 41 VAL HA 1 1 2 1360 1 1 41 VAL HB H 7.124 11.358 -16.409 1.00 . A A . 41 VAL HB 1 1 2 1361 1 1 41 VAL HG11 H 5.701 12.889 -18.597 1.00 . A A . 41 VAL HG11 1 1 2 1362 1 1 41 VAL HG12 H 6.226 13.653 -17.098 1.00 . A A . 41 VAL HG12 1 1 2 1363 1 1 41 VAL HG13 H 7.415 12.934 -18.185 1.00 . A A . 41 VAL HG13 1 1 2 1364 1 1 41 VAL HG21 H 4.729 10.497 -15.958 1.00 . A A . 41 VAL HG21 1 1 2 1365 1 1 41 VAL HG22 H 5.142 12.094 -15.329 1.00 . A A . 41 VAL HG22 1 1 2 1366 1 1 41 VAL HG23 H 4.187 11.947 -16.805 1.00 . A A . 41 VAL HG23 1 1 2 1367 1 1 41 VAL N N 6.311 9.068 -17.373 1.00 . A A . 41 VAL N 1 1 2 1368 1 1 41 VAL O O 7.104 10.640 -20.279 1.00 . A A . 41 VAL O 1 1 2 1369 1 1 42 TYR C C 10.006 9.276 -20.243 1.00 . A A . 42 TYR C 1 1 2 1370 1 1 42 TYR CA C 9.704 10.630 -19.595 1.00 . A A . 42 TYR CA 1 1 2 1371 1 1 42 TYR CB C 10.940 11.119 -18.841 1.00 . A A . 42 TYR CB 1 1 2 1372 1 1 42 TYR CD1 C 10.666 13.624 -18.890 1.00 . A A . 42 TYR CD1 1 1 2 1373 1 1 42 TYR CD2 C 10.299 12.449 -16.802 1.00 . A A . 42 TYR CD2 1 1 2 1374 1 1 42 TYR CE1 C 10.375 14.839 -18.258 1.00 . A A . 42 TYR CE1 1 1 2 1375 1 1 42 TYR CE2 C 10.007 13.663 -16.169 1.00 . A A . 42 TYR CE2 1 1 2 1376 1 1 42 TYR CG C 10.628 12.429 -18.162 1.00 . A A . 42 TYR CG 1 1 2 1377 1 1 42 TYR CZ C 10.046 14.858 -16.898 1.00 . A A . 42 TYR CZ 1 1 2 1378 1 1 42 TYR H H 8.735 10.395 -17.693 1.00 . A A . 42 TYR H 1 1 2 1379 1 1 42 TYR HA H 9.444 11.343 -20.358 1.00 . A A . 42 TYR HA 1 1 2 1380 1 1 42 TYR HB2 H 11.223 10.387 -18.100 1.00 . A A . 42 TYR HB2 1 1 2 1381 1 1 42 TYR HB3 H 11.754 11.261 -19.537 1.00 . A A . 42 TYR HB3 1 1 2 1382 1 1 42 TYR HD1 H 10.920 13.608 -19.940 1.00 . A A . 42 TYR HD1 1 1 2 1383 1 1 42 TYR HD2 H 10.270 11.527 -16.242 1.00 . A A . 42 TYR HD2 1 1 2 1384 1 1 42 TYR HE1 H 10.405 15.761 -18.821 1.00 . A A . 42 TYR HE1 1 1 2 1385 1 1 42 TYR HE2 H 9.753 13.679 -15.120 1.00 . A A . 42 TYR HE2 1 1 2 1386 1 1 42 TYR HH H 9.466 16.677 -16.947 1.00 . A A . 42 TYR HH 1 1 2 1387 1 1 42 TYR N N 8.564 10.494 -18.649 1.00 . A A . 42 TYR N 1 1 2 1388 1 1 42 TYR O O 11.009 9.106 -20.908 1.00 . A A . 42 TYR O 1 1 2 1389 1 1 42 TYR OH O 9.758 16.056 -16.275 1.00 . A A . 42 TYR OH 1 1 2 1390 1 1 43 ILE C C 8.455 6.766 -21.849 1.00 . A A . 43 ILE C 1 1 2 1391 1 1 43 ILE CA C 9.392 6.968 -20.654 1.00 . A A . 43 ILE CA 1 1 2 1392 1 1 43 ILE CB C 9.134 5.886 -19.593 1.00 . A A . 43 ILE CB 1 1 2 1393 1 1 43 ILE CD1 C 10.280 4.467 -17.876 1.00 . A A . 43 ILE CD1 1 1 2 1394 1 1 43 ILE CG1 C 10.372 5.754 -18.699 1.00 . A A . 43 ILE CG1 1 1 2 1395 1 1 43 ILE CG2 C 8.847 4.541 -20.269 1.00 . A A . 43 ILE CG2 1 1 2 1396 1 1 43 ILE H H 8.352 8.466 -19.512 1.00 . A A . 43 ILE H 1 1 2 1397 1 1 43 ILE HA H 10.418 6.905 -20.986 1.00 . A A . 43 ILE HA 1 1 2 1398 1 1 43 ILE HB H 8.284 6.173 -18.990 1.00 . A A . 43 ILE HB 1 1 2 1399 1 1 43 ILE HD11 H 9.316 4.419 -17.391 1.00 . A A . 43 ILE HD11 1 1 2 1400 1 1 43 ILE HD12 H 10.397 3.613 -18.528 1.00 . A A . 43 ILE HD12 1 1 2 1401 1 1 43 ILE HD13 H 11.059 4.460 -17.130 1.00 . A A . 43 ILE HD13 1 1 2 1402 1 1 43 ILE HG12 H 11.259 5.724 -19.316 1.00 . A A . 43 ILE HG12 1 1 2 1403 1 1 43 ILE HG13 H 10.426 6.601 -18.032 1.00 . A A . 43 ILE HG13 1 1 2 1404 1 1 43 ILE HG21 H 9.679 4.270 -20.901 1.00 . A A . 43 ILE HG21 1 1 2 1405 1 1 43 ILE HG22 H 8.706 3.782 -19.513 1.00 . A A . 43 ILE HG22 1 1 2 1406 1 1 43 ILE HG23 H 7.952 4.623 -20.868 1.00 . A A . 43 ILE HG23 1 1 2 1407 1 1 43 ILE N N 9.151 8.310 -20.052 1.00 . A A . 43 ILE N 1 1 2 1408 1 1 43 ILE O O 8.719 5.965 -22.724 1.00 . A A . 43 ILE O 1 1 2 1409 1 1 44 TRP C C 6.691 8.371 -24.099 1.00 . A A . 44 TRP C 1 1 2 1410 1 1 44 TRP CA C 6.420 7.307 -23.036 1.00 . A A . 44 TRP CA 1 1 2 1411 1 1 44 TRP CB C 4.980 7.434 -22.533 1.00 . A A . 44 TRP CB 1 1 2 1412 1 1 44 TRP CD1 C 5.204 5.716 -20.691 1.00 . A A . 44 TRP CD1 1 1 2 1413 1 1 44 TRP CD2 C 3.531 5.240 -22.118 1.00 . A A . 44 TRP CD2 1 1 2 1414 1 1 44 TRP CE2 C 3.544 4.209 -21.149 1.00 . A A . 44 TRP CE2 1 1 2 1415 1 1 44 TRP CE3 C 2.565 5.178 -23.139 1.00 . A A . 44 TRP CE3 1 1 2 1416 1 1 44 TRP CG C 4.595 6.185 -21.805 1.00 . A A . 44 TRP CG 1 1 2 1417 1 1 44 TRP CH2 C 1.679 3.107 -22.212 1.00 . A A . 44 TRP CH2 1 1 2 1418 1 1 44 TRP CZ2 C 2.632 3.155 -21.191 1.00 . A A . 44 TRP CZ2 1 1 2 1419 1 1 44 TRP CZ3 C 1.646 4.117 -23.184 1.00 . A A . 44 TRP CZ3 1 1 2 1420 1 1 44 TRP H H 7.160 8.115 -21.179 1.00 . A A . 44 TRP H 1 1 2 1421 1 1 44 TRP HA H 6.563 6.332 -23.469 1.00 . A A . 44 TRP HA 1 1 2 1422 1 1 44 TRP HB2 H 4.905 8.278 -21.864 1.00 . A A . 44 TRP HB2 1 1 2 1423 1 1 44 TRP HB3 H 4.317 7.579 -23.372 1.00 . A A . 44 TRP HB3 1 1 2 1424 1 1 44 TRP HD1 H 6.039 6.182 -20.188 1.00 . A A . 44 TRP HD1 1 1 2 1425 1 1 44 TRP HE1 H 4.830 4.004 -19.522 1.00 . A A . 44 TRP HE1 1 1 2 1426 1 1 44 TRP HE3 H 2.531 5.950 -23.893 1.00 . A A . 44 TRP HE3 1 1 2 1427 1 1 44 TRP HH2 H 0.970 2.295 -22.252 1.00 . A A . 44 TRP HH2 1 1 2 1428 1 1 44 TRP HZ2 H 2.662 2.379 -20.440 1.00 . A A . 44 TRP HZ2 1 1 2 1429 1 1 44 TRP HZ3 H 0.909 4.080 -23.973 1.00 . A A . 44 TRP HZ3 1 1 2 1430 1 1 44 TRP N N 7.362 7.477 -21.894 1.00 . A A . 44 TRP N 1 1 2 1431 1 1 44 TRP NE1 N 4.581 4.544 -20.301 1.00 . A A . 44 TRP NE1 1 1 2 1432 1 1 44 TRP O O 5.965 8.500 -25.063 1.00 . A A . 44 TRP O 1 1 2 1433 1 1 45 ARG C C 8.925 9.625 -26.063 1.00 . A A . 45 ARG C 1 1 2 1434 1 1 45 ARG CA C 8.056 10.193 -24.928 1.00 . A A . 45 ARG CA 1 1 2 1435 1 1 45 ARG CB C 8.792 11.353 -24.248 1.00 . A A . 45 ARG CB 1 1 2 1436 1 1 45 ARG CD C 6.841 11.458 -22.693 1.00 . A A . 45 ARG CD 1 1 2 1437 1 1 45 ARG CG C 8.369 11.442 -22.781 1.00 . A A . 45 ARG CG 1 1 2 1438 1 1 45 ARG CZ C 5.192 12.992 -21.801 1.00 . A A . 45 ARG CZ 1 1 2 1439 1 1 45 ARG H H 8.299 9.010 -23.140 1.00 . A A . 45 ARG H 1 1 2 1440 1 1 45 ARG HA H 7.142 10.558 -25.345 1.00 . A A . 45 ARG HA 1 1 2 1441 1 1 45 ARG HB2 H 9.858 11.194 -24.310 1.00 . A A . 45 ARG HB2 1 1 2 1442 1 1 45 ARG HB3 H 8.539 12.276 -24.747 1.00 . A A . 45 ARG HB3 1 1 2 1443 1 1 45 ARG HD2 H 6.427 11.655 -23.670 1.00 . A A . 45 ARG HD2 1 1 2 1444 1 1 45 ARG HD3 H 6.491 10.501 -22.339 1.00 . A A . 45 ARG HD3 1 1 2 1445 1 1 45 ARG HE H 7.040 12.878 -21.083 1.00 . A A . 45 ARG HE 1 1 2 1446 1 1 45 ARG HG2 H 8.753 10.587 -22.242 1.00 . A A . 45 ARG HG2 1 1 2 1447 1 1 45 ARG HG3 H 8.762 12.348 -22.346 1.00 . A A . 45 ARG HG3 1 1 2 1448 1 1 45 ARG HH11 H 4.501 11.781 -20.363 1.00 . A A . 45 ARG HH11 1 1 2 1449 1 1 45 ARG HH12 H 3.339 12.867 -21.051 1.00 . A A . 45 ARG HH12 1 1 2 1450 1 1 45 ARG HH21 H 5.598 14.310 -23.251 1.00 . A A . 45 ARG HH21 1 1 2 1451 1 1 45 ARG HH22 H 3.961 14.299 -22.686 1.00 . A A . 45 ARG HH22 1 1 2 1452 1 1 45 ARG N N 7.733 9.133 -23.927 1.00 . A A . 45 ARG N 1 1 2 1453 1 1 45 ARG NE N 6.409 12.525 -21.746 1.00 . A A . 45 ARG NE 1 1 2 1454 1 1 45 ARG NH1 N 4.272 12.509 -21.009 1.00 . A A . 45 ARG NH1 1 1 2 1455 1 1 45 ARG NH2 N 4.894 13.941 -22.645 1.00 . A A . 45 ARG NH2 1 1 2 1456 1 1 45 ARG O O 8.652 9.866 -27.222 1.00 . A A . 45 ARG O 1 1 2 1457 1 1 46 PRO C C 10.333 6.980 -27.220 1.00 . A A . 46 PRO C 1 1 2 1458 1 1 46 PRO CA C 10.888 8.297 -26.663 1.00 . A A . 46 PRO CA 1 1 2 1459 1 1 46 PRO CB C 12.143 8.042 -25.823 1.00 . A A . 46 PRO CB 1 1 2 1460 1 1 46 PRO CD C 10.278 8.618 -24.292 1.00 . A A . 46 PRO CD 1 1 2 1461 1 1 46 PRO CG C 11.675 7.970 -24.348 1.00 . A A . 46 PRO CG 1 1 2 1462 1 1 46 PRO HB2 H 12.600 7.106 -26.118 1.00 . A A . 46 PRO HB2 1 1 2 1463 1 1 46 PRO HB3 H 12.843 8.853 -25.942 1.00 . A A . 46 PRO HB3 1 1 2 1464 1 1 46 PRO HD2 H 9.561 7.928 -23.875 1.00 . A A . 46 PRO HD2 1 1 2 1465 1 1 46 PRO HD3 H 10.298 9.533 -23.725 1.00 . A A . 46 PRO HD3 1 1 2 1466 1 1 46 PRO HG2 H 11.619 6.938 -24.029 1.00 . A A . 46 PRO HG2 1 1 2 1467 1 1 46 PRO HG3 H 12.356 8.518 -23.716 1.00 . A A . 46 PRO HG3 1 1 2 1468 1 1 46 PRO N N 9.951 8.900 -25.698 1.00 . A A . 46 PRO N 1 1 2 1469 1 1 46 PRO O O 11.073 6.127 -27.666 1.00 . A A . 46 PRO O 1 1 2 1470 1 1 47 TRP C C 6.984 5.779 -28.091 1.00 . A A . 47 TRP C 1 1 2 1471 1 1 47 TRP CA C 8.451 5.543 -27.728 1.00 . A A . 47 TRP CA 1 1 2 1472 1 1 47 TRP CB C 8.546 4.449 -26.662 1.00 . A A . 47 TRP CB 1 1 2 1473 1 1 47 TRP CD1 C 10.474 5.074 -25.152 1.00 . A A . 47 TRP CD1 1 1 2 1474 1 1 47 TRP CD2 C 11.033 3.502 -26.661 1.00 . A A . 47 TRP CD2 1 1 2 1475 1 1 47 TRP CE2 C 12.192 3.755 -25.890 1.00 . A A . 47 TRP CE2 1 1 2 1476 1 1 47 TRP CE3 C 11.117 2.546 -27.689 1.00 . A A . 47 TRP CE3 1 1 2 1477 1 1 47 TRP CG C 9.955 4.352 -26.173 1.00 . A A . 47 TRP CG 1 1 2 1478 1 1 47 TRP CH2 C 13.457 2.136 -27.154 1.00 . A A . 47 TRP CH2 1 1 2 1479 1 1 47 TRP CZ2 C 13.391 3.083 -26.129 1.00 . A A . 47 TRP CZ2 1 1 2 1480 1 1 47 TRP CZ3 C 12.323 1.867 -27.933 1.00 . A A . 47 TRP CZ3 1 1 2 1481 1 1 47 TRP H H 8.455 7.501 -26.835 1.00 . A A . 47 TRP H 1 1 2 1482 1 1 47 TRP HA H 8.995 5.235 -28.610 1.00 . A A . 47 TRP HA 1 1 2 1483 1 1 47 TRP HB2 H 7.894 4.694 -25.837 1.00 . A A . 47 TRP HB2 1 1 2 1484 1 1 47 TRP HB3 H 8.249 3.504 -27.089 1.00 . A A . 47 TRP HB3 1 1 2 1485 1 1 47 TRP HD1 H 9.939 5.805 -24.564 1.00 . A A . 47 TRP HD1 1 1 2 1486 1 1 47 TRP HE1 H 12.404 5.096 -24.309 1.00 . A A . 47 TRP HE1 1 1 2 1487 1 1 47 TRP HE3 H 10.249 2.331 -28.295 1.00 . A A . 47 TRP HE3 1 1 2 1488 1 1 47 TRP HH2 H 14.382 1.611 -27.346 1.00 . A A . 47 TRP HH2 1 1 2 1489 1 1 47 TRP HZ2 H 14.262 3.294 -25.525 1.00 . A A . 47 TRP HZ2 1 1 2 1490 1 1 47 TRP HZ3 H 12.377 1.134 -28.724 1.00 . A A . 47 TRP HZ3 1 1 2 1491 1 1 47 TRP N N 9.039 6.805 -27.198 1.00 . A A . 47 TRP N 1 1 2 1492 1 1 47 TRP NE1 N 11.801 4.720 -24.983 1.00 . A A . 47 TRP NE1 1 1 2 1493 1 1 47 TRP O O 6.549 5.477 -29.185 1.00 . A A . 47 TRP O 1 1 2 1494 1 1 48 PHE C C 4.104 5.270 -27.902 1.00 . A A . 48 PHE C 1 1 2 1495 1 1 48 PHE CA C 4.781 6.576 -27.479 1.00 . A A . 48 PHE CA 1 1 2 1496 1 1 48 PHE CB C 4.669 7.598 -28.612 1.00 . A A . 48 PHE CB 1 1 2 1497 1 1 48 PHE CD1 C 2.162 7.844 -28.498 1.00 . A A . 48 PHE CD1 1 1 2 1498 1 1 48 PHE CD2 C 3.544 9.806 -28.153 1.00 . A A . 48 PHE CD2 1 1 2 1499 1 1 48 PHE CE1 C 1.012 8.621 -28.316 1.00 . A A . 48 PHE CE1 1 1 2 1500 1 1 48 PHE CE2 C 2.393 10.585 -27.971 1.00 . A A . 48 PHE CE2 1 1 2 1501 1 1 48 PHE CG C 3.428 8.436 -28.416 1.00 . A A . 48 PHE CG 1 1 2 1502 1 1 48 PHE CZ C 1.128 9.992 -28.053 1.00 . A A . 48 PHE CZ 1 1 2 1503 1 1 48 PHE H H 6.588 6.557 -26.309 1.00 . A A . 48 PHE H 1 1 2 1504 1 1 48 PHE HA H 4.295 6.964 -26.596 1.00 . A A . 48 PHE HA 1 1 2 1505 1 1 48 PHE HB2 H 5.540 8.237 -28.607 1.00 . A A . 48 PHE HB2 1 1 2 1506 1 1 48 PHE HB3 H 4.607 7.081 -29.559 1.00 . A A . 48 PHE HB3 1 1 2 1507 1 1 48 PHE HD1 H 2.072 6.787 -28.700 1.00 . A A . 48 PHE HD1 1 1 2 1508 1 1 48 PHE HD2 H 4.520 10.264 -28.090 1.00 . A A . 48 PHE HD2 1 1 2 1509 1 1 48 PHE HE1 H 0.035 8.165 -28.379 1.00 . A A . 48 PHE HE1 1 1 2 1510 1 1 48 PHE HE2 H 2.483 11.641 -27.768 1.00 . A A . 48 PHE HE2 1 1 2 1511 1 1 48 PHE HZ H 0.241 10.591 -27.913 1.00 . A A . 48 PHE HZ 1 1 2 1512 1 1 48 PHE N N 6.218 6.319 -27.184 1.00 . A A . 48 PHE N 1 1 2 1513 1 1 48 PHE O O 4.164 4.321 -27.138 1.00 . A A . 48 PHE O 1 1 2 1514 1 1 48 PHE OXT O 3.537 5.242 -28.981 1.00 . A A . 48 PHE OXT 1 1 3 1515 1 1 1 ALA C C 28.179 12.901 30.394 1.00 . A A . 1 ALA C 1 1 3 1516 1 1 1 ALA CA C 29.327 12.694 31.384 1.00 . A A . 1 ALA CA 1 1 3 1517 1 1 1 ALA CB C 30.645 13.116 30.733 1.00 . A A . 1 ALA CB 1 1 3 1518 1 1 1 ALA H1 H 28.442 10.894 31.944 1.00 . A A . 1 ALA H1 1 1 3 1519 1 1 1 ALA H2 H 29.834 10.713 30.994 1.00 . A A . 1 ALA H2 1 1 3 1520 1 1 1 ALA H3 H 29.975 11.156 32.628 1.00 . A A . 1 ALA H3 1 1 3 1521 1 1 1 ALA HA H 29.153 13.293 32.267 1.00 . A A . 1 ALA HA 1 1 3 1522 1 1 1 ALA HB1 H 30.936 14.088 31.106 1.00 . A A . 1 ALA HB1 1 1 3 1523 1 1 1 ALA HB2 H 31.412 12.395 30.972 1.00 . A A . 1 ALA HB2 1 1 3 1524 1 1 1 ALA HB3 H 30.518 13.165 29.662 1.00 . A A . 1 ALA HB3 1 1 3 1525 1 1 1 ALA N N 29.400 11.256 31.766 1.00 . A A . 1 ALA N 1 1 3 1526 1 1 1 ALA O O 27.600 13.966 30.314 1.00 . A A . 1 ALA O 1 1 3 1527 1 1 2 ASP C C 25.609 11.063 29.011 1.00 . A A . 2 ASP C 1 1 3 1528 1 1 2 ASP CA C 26.738 12.031 28.652 1.00 . A A . 2 ASP CA 1 1 3 1529 1 1 2 ASP CB C 27.259 11.717 27.249 1.00 . A A . 2 ASP CB 1 1 3 1530 1 1 2 ASP CG C 27.634 13.019 26.539 1.00 . A A . 2 ASP CG 1 1 3 1531 1 1 2 ASP H H 28.327 11.040 29.717 1.00 . A A . 2 ASP H 1 1 3 1532 1 1 2 ASP HA H 26.361 13.039 28.676 1.00 . A A . 2 ASP HA 1 1 3 1533 1 1 2 ASP HB2 H 28.131 11.083 27.322 1.00 . A A . 2 ASP HB2 1 1 3 1534 1 1 2 ASP HB3 H 26.492 11.210 26.683 1.00 . A A . 2 ASP HB3 1 1 3 1535 1 1 2 ASP N N 27.846 11.890 29.637 1.00 . A A . 2 ASP N 1 1 3 1536 1 1 2 ASP O O 24.740 11.374 29.801 1.00 . A A . 2 ASP O 1 1 3 1537 1 1 2 ASP OD1 O 27.065 14.042 26.882 1.00 . A A . 2 ASP OD1 1 1 3 1538 1 1 2 ASP OD2 O 28.483 12.971 25.665 1.00 . A A . 2 ASP OD2 1 1 3 1539 1 1 3 LYS C C 23.257 9.283 28.001 1.00 . A A . 3 LYS C 1 1 3 1540 1 1 3 LYS CA C 24.544 8.899 28.736 1.00 . A A . 3 LYS CA 1 1 3 1541 1 1 3 LYS CB C 24.280 8.879 30.242 1.00 . A A . 3 LYS CB 1 1 3 1542 1 1 3 LYS CD C 24.842 7.497 32.247 1.00 . A A . 3 LYS CD 1 1 3 1543 1 1 3 LYS CE C 23.597 7.315 33.118 1.00 . A A . 3 LYS CE 1 1 3 1544 1 1 3 LYS CG C 24.443 7.452 30.771 1.00 . A A . 3 LYS CG 1 1 3 1545 1 1 3 LYS H H 26.324 9.669 27.799 1.00 . A A . 3 LYS H 1 1 3 1546 1 1 3 LYS HA H 24.863 7.919 28.415 1.00 . A A . 3 LYS HA 1 1 3 1547 1 1 3 LYS HB2 H 24.985 9.530 30.738 1.00 . A A . 3 LYS HB2 1 1 3 1548 1 1 3 LYS HB3 H 23.275 9.221 30.438 1.00 . A A . 3 LYS HB3 1 1 3 1549 1 1 3 LYS HD2 H 25.546 6.704 32.454 1.00 . A A . 3 LYS HD2 1 1 3 1550 1 1 3 LYS HD3 H 25.297 8.451 32.469 1.00 . A A . 3 LYS HD3 1 1 3 1551 1 1 3 LYS HE2 H 22.919 6.627 32.637 1.00 . A A . 3 LYS HE2 1 1 3 1552 1 1 3 LYS HE3 H 23.887 6.922 34.082 1.00 . A A . 3 LYS HE3 1 1 3 1553 1 1 3 LYS HG2 H 23.508 6.921 30.665 1.00 . A A . 3 LYS HG2 1 1 3 1554 1 1 3 LYS HG3 H 25.212 6.945 30.208 1.00 . A A . 3 LYS HG3 1 1 3 1555 1 1 3 LYS HZ1 H 23.573 9.395 33.024 1.00 . A A . 3 LYS HZ1 1 1 3 1556 1 1 3 LYS HZ2 H 22.069 8.670 32.709 1.00 . A A . 3 LYS HZ2 1 1 3 1557 1 1 3 LYS HZ3 H 22.654 8.748 34.299 1.00 . A A . 3 LYS HZ3 1 1 3 1558 1 1 3 LYS N N 25.615 9.893 28.434 1.00 . A A . 3 LYS N 1 1 3 1559 1 1 3 LYS NZ N 22.922 8.631 33.302 1.00 . A A . 3 LYS NZ 1 1 3 1560 1 1 3 LYS O O 22.269 8.579 28.052 1.00 . A A . 3 LYS O 1 1 3 1561 1 1 4 SER C C 21.852 9.936 25.344 1.00 . A A . 4 SER C 1 1 3 1562 1 1 4 SER CA C 22.038 10.818 26.579 1.00 . A A . 4 SER CA 1 1 3 1563 1 1 4 SER CB C 22.185 12.278 26.145 1.00 . A A . 4 SER CB 1 1 3 1564 1 1 4 SER H H 24.067 10.948 27.286 1.00 . A A . 4 SER H 1 1 3 1565 1 1 4 SER HA H 21.177 10.720 27.223 1.00 . A A . 4 SER HA 1 1 3 1566 1 1 4 SER HB2 H 23.065 12.703 26.599 1.00 . A A . 4 SER HB2 1 1 3 1567 1 1 4 SER HB3 H 22.280 12.324 25.069 1.00 . A A . 4 SER HB3 1 1 3 1568 1 1 4 SER HG H 20.482 13.152 25.798 1.00 . A A . 4 SER HG 1 1 3 1569 1 1 4 SER N N 23.261 10.394 27.315 1.00 . A A . 4 SER N 1 1 3 1570 1 1 4 SER O O 20.757 9.770 24.846 1.00 . A A . 4 SER O 1 1 3 1571 1 1 4 SER OG O 21.041 13.010 26.565 1.00 . A A . 4 SER OG 1 1 3 1572 1 1 5 ASP C C 21.954 7.270 23.978 1.00 . A A . 5 ASP C 1 1 3 1573 1 1 5 ASP CA C 22.799 8.497 23.640 1.00 . A A . 5 ASP CA 1 1 3 1574 1 1 5 ASP CB C 24.193 8.051 23.195 1.00 . A A . 5 ASP CB 1 1 3 1575 1 1 5 ASP CG C 24.391 8.390 21.715 1.00 . A A . 5 ASP CG 1 1 3 1576 1 1 5 ASP H H 23.791 9.515 25.259 1.00 . A A . 5 ASP H 1 1 3 1577 1 1 5 ASP HA H 22.325 9.049 22.841 1.00 . A A . 5 ASP HA 1 1 3 1578 1 1 5 ASP HB2 H 24.940 8.562 23.784 1.00 . A A . 5 ASP HB2 1 1 3 1579 1 1 5 ASP HB3 H 24.291 6.984 23.333 1.00 . A A . 5 ASP HB3 1 1 3 1580 1 1 5 ASP N N 22.916 9.368 24.843 1.00 . A A . 5 ASP N 1 1 3 1581 1 1 5 ASP O O 21.247 6.743 23.143 1.00 . A A . 5 ASP O 1 1 3 1582 1 1 5 ASP OD1 O 24.166 9.533 21.356 1.00 . A A . 5 ASP OD1 1 1 3 1583 1 1 5 ASP OD2 O 24.764 7.501 20.969 1.00 . A A . 5 ASP OD2 1 1 3 1584 1 1 6 LEU C C 19.732 5.958 25.423 1.00 . A A . 6 LEU C 1 1 3 1585 1 1 6 LEU CA C 21.206 5.621 25.580 1.00 . A A . 6 LEU CA 1 1 3 1586 1 1 6 LEU CB C 21.484 5.254 27.033 1.00 . A A . 6 LEU CB 1 1 3 1587 1 1 6 LEU CD1 C 23.397 5.604 28.593 1.00 . A A . 6 LEU CD1 1 1 3 1588 1 1 6 LEU CD2 C 23.387 3.658 27.018 1.00 . A A . 6 LEU CD2 1 1 3 1589 1 1 6 LEU CG C 22.983 5.121 27.201 1.00 . A A . 6 LEU CG 1 1 3 1590 1 1 6 LEU H H 22.587 7.252 25.861 1.00 . A A . 6 LEU H 1 1 3 1591 1 1 6 LEU HA H 21.469 4.786 24.943 1.00 . A A . 6 LEU HA 1 1 3 1592 1 1 6 LEU HB2 H 21.110 6.033 27.683 1.00 . A A . 6 LEU HB2 1 1 3 1593 1 1 6 LEU HB3 H 21.008 4.317 27.272 1.00 . A A . 6 LEU HB3 1 1 3 1594 1 1 6 LEU HD11 H 22.764 5.143 29.337 1.00 . A A . 6 LEU HD11 1 1 3 1595 1 1 6 LEU HD12 H 24.426 5.331 28.776 1.00 . A A . 6 LEU HD12 1 1 3 1596 1 1 6 LEU HD13 H 23.293 6.676 28.647 1.00 . A A . 6 LEU HD13 1 1 3 1597 1 1 6 LEU HD21 H 22.883 3.254 26.151 1.00 . A A . 6 LEU HD21 1 1 3 1598 1 1 6 LEU HD22 H 24.455 3.593 26.875 1.00 . A A . 6 LEU HD22 1 1 3 1599 1 1 6 LEU HD23 H 23.104 3.093 27.894 1.00 . A A . 6 LEU HD23 1 1 3 1600 1 1 6 LEU HG H 23.460 5.724 26.448 1.00 . A A . 6 LEU HG 1 1 3 1601 1 1 6 LEU N N 22.014 6.811 25.198 1.00 . A A . 6 LEU N 1 1 3 1602 1 1 6 LEU O O 19.072 5.455 24.541 1.00 . A A . 6 LEU O 1 1 3 1603 1 1 7 GLY C C 17.282 7.084 24.771 1.00 . A A . 7 GLY C 1 1 3 1604 1 1 7 GLY CA C 17.780 7.232 26.207 1.00 . A A . 7 GLY CA 1 1 3 1605 1 1 7 GLY H H 19.812 7.203 26.968 1.00 . A A . 7 GLY H 1 1 3 1606 1 1 7 GLY HA2 H 17.683 8.262 26.514 1.00 . A A . 7 GLY HA2 1 1 3 1607 1 1 7 GLY HA3 H 17.195 6.602 26.860 1.00 . A A . 7 GLY HA3 1 1 3 1608 1 1 7 GLY N N 19.227 6.820 26.277 1.00 . A A . 7 GLY N 1 1 3 1609 1 1 7 GLY O O 16.277 6.456 24.505 1.00 . A A . 7 GLY O 1 1 3 1610 1 1 8 TYR C C 17.628 6.003 22.106 1.00 . A A . 8 TYR C 1 1 3 1611 1 1 8 TYR CA C 17.672 7.493 22.427 1.00 . A A . 8 TYR CA 1 1 3 1612 1 1 8 TYR CB C 18.780 8.197 21.657 1.00 . A A . 8 TYR CB 1 1 3 1613 1 1 8 TYR CD1 C 17.904 8.556 19.338 1.00 . A A . 8 TYR CD1 1 1 3 1614 1 1 8 TYR CD2 C 19.653 6.913 19.690 1.00 . A A . 8 TYR CD2 1 1 3 1615 1 1 8 TYR CE1 C 17.933 8.296 17.962 1.00 . A A . 8 TYR CE1 1 1 3 1616 1 1 8 TYR CE2 C 19.695 6.660 18.313 1.00 . A A . 8 TYR CE2 1 1 3 1617 1 1 8 TYR CG C 18.759 7.862 20.195 1.00 . A A . 8 TYR CG 1 1 3 1618 1 1 8 TYR CZ C 18.835 7.354 17.447 1.00 . A A . 8 TYR CZ 1 1 3 1619 1 1 8 TYR H H 18.835 8.084 24.077 1.00 . A A . 8 TYR H 1 1 3 1620 1 1 8 TYR HA H 16.734 7.956 22.238 1.00 . A A . 8 TYR HA 1 1 3 1621 1 1 8 TYR HB2 H 18.663 9.263 21.771 1.00 . A A . 8 TYR HB2 1 1 3 1622 1 1 8 TYR HB3 H 19.734 7.903 22.072 1.00 . A A . 8 TYR HB3 1 1 3 1623 1 1 8 TYR HD1 H 17.198 9.271 19.744 1.00 . A A . 8 TYR HD1 1 1 3 1624 1 1 8 TYR HD2 H 20.307 6.373 20.369 1.00 . A A . 8 TYR HD2 1 1 3 1625 1 1 8 TYR HE1 H 17.270 8.831 17.298 1.00 . A A . 8 TYR HE1 1 1 3 1626 1 1 8 TYR HE2 H 20.385 5.928 17.918 1.00 . A A . 8 TYR HE2 1 1 3 1627 1 1 8 TYR HH H 18.399 7.814 15.646 1.00 . A A . 8 TYR HH 1 1 3 1628 1 1 8 TYR N N 18.020 7.620 23.843 1.00 . A A . 8 TYR N 1 1 3 1629 1 1 8 TYR O O 16.588 5.390 22.106 1.00 . A A . 8 TYR O 1 1 3 1630 1 1 8 TYR OH O 18.879 7.111 16.090 1.00 . A A . 8 TYR OH 1 1 3 1631 1 1 9 THR C C 17.562 3.312 21.237 1.00 . A A . 9 THR C 1 1 3 1632 1 1 9 THR CA C 18.908 3.960 21.659 1.00 . A A . 9 THR CA 1 1 3 1633 1 1 9 THR CB C 19.471 3.354 22.958 1.00 . A A . 9 THR CB 1 1 3 1634 1 1 9 THR CG2 C 18.363 3.054 23.982 1.00 . A A . 9 THR CG2 1 1 3 1635 1 1 9 THR H H 19.587 5.972 21.983 1.00 . A A . 9 THR H 1 1 3 1636 1 1 9 THR HA H 19.628 3.807 20.868 1.00 . A A . 9 THR HA 1 1 3 1637 1 1 9 THR HB H 20.152 4.066 23.395 1.00 . A A . 9 THR HB 1 1 3 1638 1 1 9 THR HG1 H 21.049 2.475 22.308 1.00 . A A . 9 THR HG1 1 1 3 1639 1 1 9 THR HG21 H 17.423 3.445 23.622 1.00 . A A . 9 THR HG21 1 1 3 1640 1 1 9 THR HG22 H 18.279 1.986 24.121 1.00 . A A . 9 THR HG22 1 1 3 1641 1 1 9 THR HG23 H 18.607 3.517 24.926 1.00 . A A . 9 THR HG23 1 1 3 1642 1 1 9 THR N N 18.777 5.430 21.912 1.00 . A A . 9 THR N 1 1 3 1643 1 1 9 THR O O 16.856 3.828 20.394 1.00 . A A . 9 THR O 1 1 3 1644 1 1 9 THR OG1 O 20.196 2.187 22.649 1.00 . A A . 9 THR OG1 1 1 3 1645 1 1 10 GLY C C 14.806 2.524 21.186 1.00 . A A . 10 GLY C 1 1 3 1646 1 1 10 GLY CA C 15.939 1.500 21.389 1.00 . A A . 10 GLY CA 1 1 3 1647 1 1 10 GLY H H 17.809 1.734 22.410 1.00 . A A . 10 GLY H 1 1 3 1648 1 1 10 GLY HA2 H 15.654 0.810 22.168 1.00 . A A . 10 GLY HA2 1 1 3 1649 1 1 10 GLY HA3 H 16.090 0.953 20.470 1.00 . A A . 10 GLY HA3 1 1 3 1650 1 1 10 GLY N N 17.218 2.170 21.774 1.00 . A A . 10 GLY N 1 1 3 1651 1 1 10 GLY O O 13.980 2.361 20.304 1.00 . A A . 10 GLY O 1 1 3 1652 1 1 11 LEU C C 13.680 4.903 20.287 1.00 . A A . 11 LEU C 1 1 3 1653 1 1 11 LEU CA C 13.665 4.567 21.755 1.00 . A A . 11 LEU CA 1 1 3 1654 1 1 11 LEU CB C 13.906 5.797 22.652 1.00 . A A . 11 LEU CB 1 1 3 1655 1 1 11 LEU CD1 C 12.419 7.392 21.455 1.00 . A A . 11 LEU CD1 1 1 3 1656 1 1 11 LEU CD2 C 14.450 8.219 22.657 1.00 . A A . 11 LEU CD2 1 1 3 1657 1 1 11 LEU CG C 13.864 7.075 21.833 1.00 . A A . 11 LEU CG 1 1 3 1658 1 1 11 LEU H H 15.391 3.751 22.657 1.00 . A A . 11 LEU H 1 1 3 1659 1 1 11 LEU HA H 12.724 4.120 21.991 1.00 . A A . 11 LEU HA 1 1 3 1660 1 1 11 LEU HB2 H 13.144 5.840 23.413 1.00 . A A . 11 LEU HB2 1 1 3 1661 1 1 11 LEU HB3 H 14.874 5.715 23.122 1.00 . A A . 11 LEU HB3 1 1 3 1662 1 1 11 LEU HD11 H 11.935 6.492 21.104 1.00 . A A . 11 LEU HD11 1 1 3 1663 1 1 11 LEU HD12 H 11.894 7.769 22.320 1.00 . A A . 11 LEU HD12 1 1 3 1664 1 1 11 LEU HD13 H 12.406 8.137 20.674 1.00 . A A . 11 LEU HD13 1 1 3 1665 1 1 11 LEU HD21 H 15.138 7.814 23.385 1.00 . A A . 11 LEU HD21 1 1 3 1666 1 1 11 LEU HD22 H 14.975 8.900 22.005 1.00 . A A . 11 LEU HD22 1 1 3 1667 1 1 11 LEU HD23 H 13.654 8.743 23.163 1.00 . A A . 11 LEU HD23 1 1 3 1668 1 1 11 LEU HG H 14.449 6.927 20.944 1.00 . A A . 11 LEU HG 1 1 3 1669 1 1 11 LEU N N 14.741 3.588 21.965 1.00 . A A . 11 LEU N 1 1 3 1670 1 1 11 LEU O O 12.681 4.836 19.641 1.00 . A A . 11 LEU O 1 1 3 1671 1 1 12 THR C C 14.103 4.606 17.552 1.00 . A A . 12 THR C 1 1 3 1672 1 1 12 THR CA C 14.951 5.551 18.341 1.00 . A A . 12 THR CA 1 1 3 1673 1 1 12 THR CB C 16.400 5.358 17.922 1.00 . A A . 12 THR CB 1 1 3 1674 1 1 12 THR CG2 C 16.608 5.918 16.514 1.00 . A A . 12 THR CG2 1 1 3 1675 1 1 12 THR H H 15.607 5.281 20.330 1.00 . A A . 12 THR H 1 1 3 1676 1 1 12 THR HA H 14.653 6.547 18.162 1.00 . A A . 12 THR HA 1 1 3 1677 1 1 12 THR HB H 16.640 4.306 17.925 1.00 . A A . 12 THR HB 1 1 3 1678 1 1 12 THR HG1 H 16.660 6.574 19.392 1.00 . A A . 12 THR HG1 1 1 3 1679 1 1 12 THR HG21 H 15.785 5.615 15.884 1.00 . A A . 12 THR HG21 1 1 3 1680 1 1 12 THR HG22 H 16.651 6.994 16.554 1.00 . A A . 12 THR HG22 1 1 3 1681 1 1 12 THR HG23 H 17.531 5.533 16.106 1.00 . A A . 12 THR HG23 1 1 3 1682 1 1 12 THR N N 14.824 5.240 19.771 1.00 . A A . 12 THR N 1 1 3 1683 1 1 12 THR O O 13.160 4.976 16.927 1.00 . A A . 12 THR O 1 1 3 1684 1 1 12 THR OG1 O 17.227 6.026 18.850 1.00 . A A . 12 THR OG1 1 1 3 1685 1 1 13 ASP C C 12.242 2.808 16.637 1.00 . A A . 13 ASP C 1 1 3 1686 1 1 13 ASP CA C 13.685 2.363 16.812 1.00 . A A . 13 ASP CA 1 1 3 1687 1 1 13 ASP CB C 13.743 1.006 17.516 1.00 . A A . 13 ASP CB 1 1 3 1688 1 1 13 ASP CG C 14.752 0.104 16.803 1.00 . A A . 13 ASP CG 1 1 3 1689 1 1 13 ASP H H 15.240 3.131 18.106 1.00 . A A . 13 ASP H 1 1 3 1690 1 1 13 ASP HA H 14.116 2.291 15.845 1.00 . A A . 13 ASP HA 1 1 3 1691 1 1 13 ASP HB2 H 14.048 1.146 18.543 1.00 . A A . 13 ASP HB2 1 1 3 1692 1 1 13 ASP HB3 H 12.768 0.544 17.489 1.00 . A A . 13 ASP HB3 1 1 3 1693 1 1 13 ASP N N 14.454 3.380 17.583 1.00 . A A . 13 ASP N 1 1 3 1694 1 1 13 ASP O O 11.686 2.735 15.562 1.00 . A A . 13 ASP O 1 1 3 1695 1 1 13 ASP OD1 O 15.853 0.564 16.548 1.00 . A A . 13 ASP OD1 1 1 3 1696 1 1 13 ASP OD2 O 14.406 -1.032 16.522 1.00 . A A . 13 ASP OD2 1 1 3 1697 1 1 14 GLU C C 10.263 5.275 17.040 1.00 . A A . 14 GLU C 1 1 3 1698 1 1 14 GLU CA C 10.257 3.803 17.465 1.00 . A A . 14 GLU CA 1 1 3 1699 1 1 14 GLU CB C 9.460 3.653 18.747 1.00 . A A . 14 GLU CB 1 1 3 1700 1 1 14 GLU CD C 8.418 1.429 19.202 1.00 . A A . 14 GLU CD 1 1 3 1701 1 1 14 GLU CG C 8.244 2.768 18.483 1.00 . A A . 14 GLU CG 1 1 3 1702 1 1 14 GLU H H 12.105 3.428 18.517 1.00 . A A . 14 GLU H 1 1 3 1703 1 1 14 GLU HA H 9.809 3.210 16.682 1.00 . A A . 14 GLU HA 1 1 3 1704 1 1 14 GLU HB2 H 10.083 3.206 19.506 1.00 . A A . 14 GLU HB2 1 1 3 1705 1 1 14 GLU HB3 H 9.133 4.627 19.070 1.00 . A A . 14 GLU HB3 1 1 3 1706 1 1 14 GLU HG2 H 7.354 3.261 18.845 1.00 . A A . 14 GLU HG2 1 1 3 1707 1 1 14 GLU HG3 H 8.153 2.595 17.420 1.00 . A A . 14 GLU HG3 1 1 3 1708 1 1 14 GLU N N 11.641 3.327 17.655 1.00 . A A . 14 GLU N 1 1 3 1709 1 1 14 GLU O O 9.494 5.674 16.198 1.00 . A A . 14 GLU O 1 1 3 1710 1 1 14 GLU OE1 O 9.447 0.803 19.006 1.00 . A A . 14 GLU OE1 1 1 3 1711 1 1 14 GLU OE2 O 7.520 1.052 19.937 1.00 . A A . 14 GLU OE2 1 1 3 1712 1 1 15 GLN C C 11.709 7.585 15.799 1.00 . A A . 15 GLN C 1 1 3 1713 1 1 15 GLN CA C 11.180 7.524 17.211 1.00 . A A . 15 GLN CA 1 1 3 1714 1 1 15 GLN CB C 12.079 8.276 18.187 1.00 . A A . 15 GLN CB 1 1 3 1715 1 1 15 GLN CD C 12.394 10.755 18.303 1.00 . A A . 15 GLN CD 1 1 3 1716 1 1 15 GLN CG C 12.766 9.486 17.533 1.00 . A A . 15 GLN CG 1 1 3 1717 1 1 15 GLN H H 11.745 5.740 18.280 1.00 . A A . 15 GLN H 1 1 3 1718 1 1 15 GLN HA H 10.197 7.931 17.231 1.00 . A A . 15 GLN HA 1 1 3 1719 1 1 15 GLN HB2 H 11.472 8.616 19.004 1.00 . A A . 15 GLN HB2 1 1 3 1720 1 1 15 GLN HB3 H 12.826 7.598 18.555 1.00 . A A . 15 GLN HB3 1 1 3 1721 1 1 15 GLN HE21 H 11.006 11.310 16.997 1.00 . A A . 15 GLN HE21 1 1 3 1722 1 1 15 GLN HE22 H 11.214 12.352 18.322 1.00 . A A . 15 GLN HE22 1 1 3 1723 1 1 15 GLN HG2 H 13.841 9.350 17.569 1.00 . A A . 15 GLN HG2 1 1 3 1724 1 1 15 GLN HG3 H 12.449 9.587 16.509 1.00 . A A . 15 GLN HG3 1 1 3 1725 1 1 15 GLN N N 11.126 6.083 17.607 1.00 . A A . 15 GLN N 1 1 3 1726 1 1 15 GLN NE2 N 11.460 11.537 17.835 1.00 . A A . 15 GLN NE2 1 1 3 1727 1 1 15 GLN O O 11.191 8.272 14.943 1.00 . A A . 15 GLN O 1 1 3 1728 1 1 15 GLN OE1 O 12.958 11.036 19.343 1.00 . A A . 15 GLN OE1 1 1 3 1729 1 1 16 ALA C C 12.030 6.421 13.301 1.00 . A A . 16 ALA C 1 1 3 1730 1 1 16 ALA CA C 13.231 6.750 14.177 1.00 . A A . 16 ALA CA 1 1 3 1731 1 1 16 ALA CB C 14.266 5.631 14.102 1.00 . A A . 16 ALA CB 1 1 3 1732 1 1 16 ALA H H 13.073 6.267 16.239 1.00 . A A . 16 ALA H 1 1 3 1733 1 1 16 ALA HA H 13.662 7.692 13.888 1.00 . A A . 16 ALA HA 1 1 3 1734 1 1 16 ALA HB1 H 14.223 5.049 15.015 1.00 . A A . 16 ALA HB1 1 1 3 1735 1 1 16 ALA HB2 H 14.050 4.994 13.258 1.00 . A A . 16 ALA HB2 1 1 3 1736 1 1 16 ALA HB3 H 15.252 6.058 13.993 1.00 . A A . 16 ALA HB3 1 1 3 1737 1 1 16 ALA N N 12.704 6.823 15.541 1.00 . A A . 16 ALA N 1 1 3 1738 1 1 16 ALA O O 11.961 6.787 12.145 1.00 . A A . 16 ALA O 1 1 3 1739 1 1 17 GLN C C 8.860 6.589 13.174 1.00 . A A . 17 GLN C 1 1 3 1740 1 1 17 GLN CA C 9.833 5.419 13.098 1.00 . A A . 17 GLN CA 1 1 3 1741 1 1 17 GLN CB C 9.167 4.171 13.654 1.00 . A A . 17 GLN CB 1 1 3 1742 1 1 17 GLN CD C 9.297 1.680 13.745 1.00 . A A . 17 GLN CD 1 1 3 1743 1 1 17 GLN CG C 9.978 2.952 13.238 1.00 . A A . 17 GLN CG 1 1 3 1744 1 1 17 GLN H H 11.126 5.471 14.829 1.00 . A A . 17 GLN H 1 1 3 1745 1 1 17 GLN HA H 10.108 5.255 12.074 1.00 . A A . 17 GLN HA 1 1 3 1746 1 1 17 GLN HB2 H 9.122 4.231 14.731 1.00 . A A . 17 GLN HB2 1 1 3 1747 1 1 17 GLN HB3 H 8.169 4.092 13.253 1.00 . A A . 17 GLN HB3 1 1 3 1748 1 1 17 GLN HE21 H 10.032 0.539 12.295 1.00 . A A . 17 GLN HE21 1 1 3 1749 1 1 17 GLN HE22 H 9.038 -0.261 13.415 1.00 . A A . 17 GLN HE22 1 1 3 1750 1 1 17 GLN HG2 H 10.049 2.925 12.161 1.00 . A A . 17 GLN HG2 1 1 3 1751 1 1 17 GLN HG3 H 10.966 3.026 13.662 1.00 . A A . 17 GLN HG3 1 1 3 1752 1 1 17 GLN N N 11.054 5.746 13.877 1.00 . A A . 17 GLN N 1 1 3 1753 1 1 17 GLN NE2 N 9.470 0.560 13.098 1.00 . A A . 17 GLN NE2 1 1 3 1754 1 1 17 GLN O O 8.059 6.794 12.287 1.00 . A A . 17 GLN O 1 1 3 1755 1 1 17 GLN OE1 O 8.601 1.705 14.740 1.00 . A A . 17 GLN OE1 1 1 3 1756 1 1 18 GLU C C 8.104 9.299 12.975 1.00 . A A . 18 GLU C 1 1 3 1757 1 1 18 GLU CA C 8.001 8.535 14.295 1.00 . A A . 18 GLU CA 1 1 3 1758 1 1 18 GLU CB C 8.416 9.445 15.454 1.00 . A A . 18 GLU CB 1 1 3 1759 1 1 18 GLU CD C 7.831 9.199 17.870 1.00 . A A . 18 GLU CD 1 1 3 1760 1 1 18 GLU CG C 7.282 9.515 16.478 1.00 . A A . 18 GLU CG 1 1 3 1761 1 1 18 GLU H H 9.576 7.208 14.925 1.00 . A A . 18 GLU H 1 1 3 1762 1 1 18 GLU HA H 6.989 8.190 14.441 1.00 . A A . 18 GLU HA 1 1 3 1763 1 1 18 GLU HB2 H 9.303 9.047 15.924 1.00 . A A . 18 GLU HB2 1 1 3 1764 1 1 18 GLU HB3 H 8.621 10.436 15.077 1.00 . A A . 18 GLU HB3 1 1 3 1765 1 1 18 GLU HG2 H 6.855 10.508 16.474 1.00 . A A . 18 GLU HG2 1 1 3 1766 1 1 18 GLU HG3 H 6.519 8.795 16.222 1.00 . A A . 18 GLU HG3 1 1 3 1767 1 1 18 GLU N N 8.923 7.374 14.214 1.00 . A A . 18 GLU N 1 1 3 1768 1 1 18 GLU O O 7.201 10.005 12.576 1.00 . A A . 18 GLU O 1 1 3 1769 1 1 18 GLU OE1 O 8.213 8.061 18.090 1.00 . A A . 18 GLU OE1 1 1 3 1770 1 1 18 GLU OE2 O 7.859 10.099 18.693 1.00 . A A . 18 GLU OE2 1 1 3 1771 1 1 19 LEU C C 9.470 8.848 9.871 1.00 . A A . 19 LEU C 1 1 3 1772 1 1 19 LEU CA C 9.406 9.855 10.999 1.00 . A A . 19 LEU CA 1 1 3 1773 1 1 19 LEU CB C 10.731 10.587 11.006 1.00 . A A . 19 LEU CB 1 1 3 1774 1 1 19 LEU CD1 C 9.617 12.004 12.740 1.00 . A A . 19 LEU CD1 1 1 3 1775 1 1 19 LEU CD2 C 11.351 10.291 13.383 1.00 . A A . 19 LEU CD2 1 1 3 1776 1 1 19 LEU CG C 10.925 11.315 12.327 1.00 . A A . 19 LEU CG 1 1 3 1777 1 1 19 LEU H H 9.929 8.585 12.645 1.00 . A A . 19 LEU H 1 1 3 1778 1 1 19 LEU HA H 8.597 10.550 10.831 1.00 . A A . 19 LEU HA 1 1 3 1779 1 1 19 LEU HB2 H 11.531 9.874 10.871 1.00 . A A . 19 LEU HB2 1 1 3 1780 1 1 19 LEU HB3 H 10.741 11.283 10.200 1.00 . A A . 19 LEU HB3 1 1 3 1781 1 1 19 LEU HD11 H 9.009 12.187 11.859 1.00 . A A . 19 LEU HD11 1 1 3 1782 1 1 19 LEU HD12 H 9.077 11.371 13.426 1.00 . A A . 19 LEU HD12 1 1 3 1783 1 1 19 LEU HD13 H 9.842 12.944 13.220 1.00 . A A . 19 LEU HD13 1 1 3 1784 1 1 19 LEU HD21 H 11.764 9.415 12.888 1.00 . A A . 19 LEU HD21 1 1 3 1785 1 1 19 LEU HD22 H 12.100 10.727 14.026 1.00 . A A . 19 LEU HD22 1 1 3 1786 1 1 19 LEU HD23 H 10.493 10.001 13.970 1.00 . A A . 19 LEU HD23 1 1 3 1787 1 1 19 LEU HG H 11.699 12.053 12.214 1.00 . A A . 19 LEU HG 1 1 3 1788 1 1 19 LEU N N 9.215 9.154 12.297 1.00 . A A . 19 LEU N 1 1 3 1789 1 1 19 LEU O O 9.507 9.203 8.715 1.00 . A A . 19 LEU O 1 1 3 1790 1 1 20 HIS C C 8.458 5.690 9.123 1.00 . A A . 20 HIS C 1 1 3 1791 1 1 20 HIS CA C 9.689 6.598 9.152 1.00 . A A . 20 HIS CA 1 1 3 1792 1 1 20 HIS CB C 10.931 5.812 9.447 1.00 . A A . 20 HIS CB 1 1 3 1793 1 1 20 HIS CD2 C 12.141 7.668 8.065 1.00 . A A . 20 HIS CD2 1 1 3 1794 1 1 20 HIS CE1 C 14.177 7.158 8.583 1.00 . A A . 20 HIS CE1 1 1 3 1795 1 1 20 HIS CG C 12.084 6.584 8.899 1.00 . A A . 20 HIS CG 1 1 3 1796 1 1 20 HIS H H 9.624 7.346 11.109 1.00 . A A . 20 HIS H 1 1 3 1797 1 1 20 HIS HA H 9.794 7.093 8.206 1.00 . A A . 20 HIS HA 1 1 3 1798 1 1 20 HIS HB2 H 11.043 5.696 10.516 1.00 . A A . 20 HIS HB2 1 1 3 1799 1 1 20 HIS HB3 H 10.870 4.859 8.985 1.00 . A A . 20 HIS HB3 1 1 3 1800 1 1 20 HIS HD1 H 13.656 5.571 9.814 1.00 . A A . 20 HIS HD1 1 1 3 1801 1 1 20 HIS HD2 H 11.282 8.177 7.655 1.00 . A A . 20 HIS HD2 1 1 3 1802 1 1 20 HIS HE1 H 15.255 7.157 8.648 1.00 . A A . 20 HIS HE1 1 1 3 1803 1 1 20 HIS N N 9.568 7.608 10.192 1.00 . A A . 20 HIS N 1 1 3 1804 1 1 20 HIS ND1 N 13.379 6.279 9.217 1.00 . A A . 20 HIS ND1 1 1 3 1805 1 1 20 HIS NE2 N 13.469 8.032 7.862 1.00 . A A . 20 HIS NE2 1 1 3 1806 1 1 20 HIS O O 7.664 5.775 8.218 1.00 . A A . 20 HIS O 1 1 3 1807 1 1 21 SER C C 5.906 4.761 9.584 1.00 . A A . 21 SER C 1 1 3 1808 1 1 21 SER CA C 7.074 3.939 10.045 1.00 . A A . 21 SER CA 1 1 3 1809 1 1 21 SER CB C 6.730 3.402 11.428 1.00 . A A . 21 SER CB 1 1 3 1810 1 1 21 SER H H 8.916 4.732 10.808 1.00 . A A . 21 SER H 1 1 3 1811 1 1 21 SER HA H 7.244 3.144 9.374 1.00 . A A . 21 SER HA 1 1 3 1812 1 1 21 SER HB2 H 6.631 4.222 12.117 1.00 . A A . 21 SER HB2 1 1 3 1813 1 1 21 SER HB3 H 5.781 2.881 11.373 1.00 . A A . 21 SER HB3 1 1 3 1814 1 1 21 SER HG H 7.451 1.621 11.733 1.00 . A A . 21 SER HG 1 1 3 1815 1 1 21 SER N N 8.277 4.815 10.084 1.00 . A A . 21 SER N 1 1 3 1816 1 1 21 SER O O 5.465 4.699 8.458 1.00 . A A . 21 SER O 1 1 3 1817 1 1 21 SER OG O 7.753 2.522 11.871 1.00 . A A . 21 SER OG 1 1 3 1818 1 1 22 VAL C C 4.583 7.097 8.764 1.00 . A A . 22 VAL C 1 1 3 1819 1 1 22 VAL CA C 4.331 6.444 10.141 1.00 . A A . 22 VAL CA 1 1 3 1820 1 1 22 VAL CB C 4.279 7.523 11.230 1.00 . A A . 22 VAL CB 1 1 3 1821 1 1 22 VAL CG1 C 5.717 7.921 11.624 1.00 . A A . 22 VAL CG1 1 1 3 1822 1 1 22 VAL CG2 C 3.534 8.756 10.711 1.00 . A A . 22 VAL CG2 1 1 3 1823 1 1 22 VAL H H 5.841 5.593 11.347 1.00 . A A . 22 VAL H 1 1 3 1824 1 1 22 VAL HA H 3.428 5.868 10.144 1.00 . A A . 22 VAL HA 1 1 3 1825 1 1 22 VAL HB H 3.768 7.130 12.098 1.00 . A A . 22 VAL HB 1 1 3 1826 1 1 22 VAL HG11 H 6.430 7.276 11.122 1.00 . A A . 22 VAL HG11 1 1 3 1827 1 1 22 VAL HG12 H 5.902 8.946 11.336 1.00 . A A . 22 VAL HG12 1 1 3 1828 1 1 22 VAL HG13 H 5.844 7.820 12.693 1.00 . A A . 22 VAL HG13 1 1 3 1829 1 1 22 VAL HG21 H 3.018 8.505 9.796 1.00 . A A . 22 VAL HG21 1 1 3 1830 1 1 22 VAL HG22 H 2.818 9.082 11.450 1.00 . A A . 22 VAL HG22 1 1 3 1831 1 1 22 VAL HG23 H 4.242 9.549 10.520 1.00 . A A . 22 VAL HG23 1 1 3 1832 1 1 22 VAL N N 5.439 5.558 10.460 1.00 . A A . 22 VAL N 1 1 3 1833 1 1 22 VAL O O 3.760 7.055 7.866 1.00 . A A . 22 VAL O 1 1 3 1834 1 1 23 TYR C C 6.579 7.492 6.284 1.00 . A A . 23 TYR C 1 1 3 1835 1 1 23 TYR CA C 6.097 8.447 7.382 1.00 . A A . 23 TYR CA 1 1 3 1836 1 1 23 TYR CB C 7.247 9.382 7.734 1.00 . A A . 23 TYR CB 1 1 3 1837 1 1 23 TYR CD1 C 6.804 11.167 6.058 1.00 . A A . 23 TYR CD1 1 1 3 1838 1 1 23 TYR CD2 C 6.770 11.731 8.411 1.00 . A A . 23 TYR CD2 1 1 3 1839 1 1 23 TYR CE1 C 6.522 12.500 5.733 1.00 . A A . 23 TYR CE1 1 1 3 1840 1 1 23 TYR CE2 C 6.490 13.061 8.101 1.00 . A A . 23 TYR CE2 1 1 3 1841 1 1 23 TYR CG C 6.924 10.795 7.392 1.00 . A A . 23 TYR CG 1 1 3 1842 1 1 23 TYR CZ C 6.365 13.450 6.758 1.00 . A A . 23 TYR CZ 1 1 3 1843 1 1 23 TYR H H 6.337 7.756 9.378 1.00 . A A . 23 TYR H 1 1 3 1844 1 1 23 TYR HA H 5.262 9.026 7.029 1.00 . A A . 23 TYR HA 1 1 3 1845 1 1 23 TYR HB2 H 7.446 9.314 8.791 1.00 . A A . 23 TYR HB2 1 1 3 1846 1 1 23 TYR HB3 H 8.127 9.090 7.187 1.00 . A A . 23 TYR HB3 1 1 3 1847 1 1 23 TYR HD1 H 6.936 10.419 5.278 1.00 . A A . 23 TYR HD1 1 1 3 1848 1 1 23 TYR HD2 H 6.870 11.423 9.442 1.00 . A A . 23 TYR HD2 1 1 3 1849 1 1 23 TYR HE1 H 6.427 12.798 4.700 1.00 . A A . 23 TYR HE1 1 1 3 1850 1 1 23 TYR HE2 H 6.378 13.784 8.896 1.00 . A A . 23 TYR HE2 1 1 3 1851 1 1 23 TYR HH H 6.362 14.918 5.537 1.00 . A A . 23 TYR HH 1 1 3 1852 1 1 23 TYR N N 5.721 7.729 8.631 1.00 . A A . 23 TYR N 1 1 3 1853 1 1 23 TYR O O 5.851 7.158 5.375 1.00 . A A . 23 TYR O 1 1 3 1854 1 1 23 TYR OH O 6.088 14.764 6.445 1.00 . A A . 23 TYR OH 1 1 3 1855 1 1 24 MET C C 7.378 5.135 4.880 1.00 . A A . 24 MET C 1 1 3 1856 1 1 24 MET CA C 8.394 6.201 5.312 1.00 . A A . 24 MET CA 1 1 3 1857 1 1 24 MET CB C 9.676 5.528 5.846 1.00 . A A . 24 MET CB 1 1 3 1858 1 1 24 MET CE C 13.307 5.733 5.826 1.00 . A A . 24 MET CE 1 1 3 1859 1 1 24 MET CG C 10.789 5.677 4.811 1.00 . A A . 24 MET CG 1 1 3 1860 1 1 24 MET H H 8.393 7.387 7.082 1.00 . A A . 24 MET H 1 1 3 1861 1 1 24 MET HA H 8.647 6.816 4.456 1.00 . A A . 24 MET HA 1 1 3 1862 1 1 24 MET HB2 H 9.988 5.995 6.776 1.00 . A A . 24 MET HB2 1 1 3 1863 1 1 24 MET HB3 H 9.490 4.479 6.021 1.00 . A A . 24 MET HB3 1 1 3 1864 1 1 24 MET HE1 H 12.952 6.728 5.612 1.00 . A A . 24 MET HE1 1 1 3 1865 1 1 24 MET HE2 H 13.406 5.610 6.896 1.00 . A A . 24 MET HE2 1 1 3 1866 1 1 24 MET HE3 H 14.267 5.585 5.351 1.00 . A A . 24 MET HE3 1 1 3 1867 1 1 24 MET HG2 H 10.396 5.466 3.828 1.00 . A A . 24 MET HG2 1 1 3 1868 1 1 24 MET HG3 H 11.169 6.687 4.839 1.00 . A A . 24 MET HG3 1 1 3 1869 1 1 24 MET N N 7.823 7.088 6.351 1.00 . A A . 24 MET N 1 1 3 1870 1 1 24 MET O O 7.444 4.627 3.778 1.00 . A A . 24 MET O 1 1 3 1871 1 1 24 MET SD S 12.127 4.517 5.190 1.00 . A A . 24 MET SD 1 1 3 1872 1 1 25 SER C C 4.530 4.320 4.229 1.00 . A A . 25 SER C 1 1 3 1873 1 1 25 SER CA C 5.442 3.747 5.315 1.00 . A A . 25 SER CA 1 1 3 1874 1 1 25 SER CB C 4.596 3.334 6.518 1.00 . A A . 25 SER CB 1 1 3 1875 1 1 25 SER H H 6.392 5.195 6.608 1.00 . A A . 25 SER H 1 1 3 1876 1 1 25 SER HA H 5.961 2.883 4.926 1.00 . A A . 25 SER HA 1 1 3 1877 1 1 25 SER HB2 H 5.235 2.958 7.298 1.00 . A A . 25 SER HB2 1 1 3 1878 1 1 25 SER HB3 H 4.050 4.193 6.885 1.00 . A A . 25 SER HB3 1 1 3 1879 1 1 25 SER HG H 4.118 1.465 6.263 1.00 . A A . 25 SER HG 1 1 3 1880 1 1 25 SER N N 6.441 4.782 5.721 1.00 . A A . 25 SER N 1 1 3 1881 1 1 25 SER O O 4.492 3.829 3.117 1.00 . A A . 25 SER O 1 1 3 1882 1 1 25 SER OG O 3.689 2.312 6.124 1.00 . A A . 25 SER OG 1 1 3 1883 1 1 26 GLY C C 3.744 6.603 2.412 1.00 . A A . 26 GLY C 1 1 3 1884 1 1 26 GLY CA C 2.899 5.958 3.505 1.00 . A A . 26 GLY CA 1 1 3 1885 1 1 26 GLY H H 3.845 5.747 5.436 1.00 . A A . 26 GLY H 1 1 3 1886 1 1 26 GLY HA2 H 2.283 6.712 3.965 1.00 . A A . 26 GLY HA2 1 1 3 1887 1 1 26 GLY HA3 H 2.277 5.188 3.074 1.00 . A A . 26 GLY HA3 1 1 3 1888 1 1 26 GLY N N 3.798 5.358 4.534 1.00 . A A . 26 GLY N 1 1 3 1889 1 1 26 GLY O O 3.255 6.976 1.363 1.00 . A A . 26 GLY O 1 1 3 1890 1 1 27 LEU C C 6.607 6.272 0.856 1.00 . A A . 27 LEU C 1 1 3 1891 1 1 27 LEU CA C 5.906 7.365 1.661 1.00 . A A . 27 LEU CA 1 1 3 1892 1 1 27 LEU CB C 6.933 8.208 2.404 1.00 . A A . 27 LEU CB 1 1 3 1893 1 1 27 LEU CD1 C 5.378 9.794 3.544 1.00 . A A . 27 LEU CD1 1 1 3 1894 1 1 27 LEU CD2 C 7.636 10.569 2.803 1.00 . A A . 27 LEU CD2 1 1 3 1895 1 1 27 LEU CG C 6.455 9.658 2.464 1.00 . A A . 27 LEU CG 1 1 3 1896 1 1 27 LEU H H 5.378 6.440 3.503 1.00 . A A . 27 LEU H 1 1 3 1897 1 1 27 LEU HA H 5.329 7.990 1.006 1.00 . A A . 27 LEU HA 1 1 3 1898 1 1 27 LEU HB2 H 7.038 7.824 3.410 1.00 . A A . 27 LEU HB2 1 1 3 1899 1 1 27 LEU HB3 H 7.882 8.159 1.894 1.00 . A A . 27 LEU HB3 1 1 3 1900 1 1 27 LEU HD11 H 5.611 9.138 4.372 1.00 . A A . 27 LEU HD11 1 1 3 1901 1 1 27 LEU HD12 H 5.343 10.816 3.892 1.00 . A A . 27 LEU HD12 1 1 3 1902 1 1 27 LEU HD13 H 4.418 9.522 3.131 1.00 . A A . 27 LEU HD13 1 1 3 1903 1 1 27 LEU HD21 H 8.302 10.059 3.483 1.00 . A A . 27 LEU HD21 1 1 3 1904 1 1 27 LEU HD22 H 8.170 10.819 1.898 1.00 . A A . 27 LEU HD22 1 1 3 1905 1 1 27 LEU HD23 H 7.273 11.475 3.267 1.00 . A A . 27 LEU HD23 1 1 3 1906 1 1 27 LEU HG H 6.042 9.941 1.506 1.00 . A A . 27 LEU HG 1 1 3 1907 1 1 27 LEU N N 5.012 6.743 2.657 1.00 . A A . 27 LEU N 1 1 3 1908 1 1 27 LEU O O 7.210 6.527 -0.167 1.00 . A A . 27 LEU O 1 1 3 1909 1 1 28 TRP C C 6.199 3.500 -0.526 1.00 . A A . 28 TRP C 1 1 3 1910 1 1 28 TRP CA C 7.151 3.937 0.575 1.00 . A A . 28 TRP CA 1 1 3 1911 1 1 28 TRP CB C 7.438 2.802 1.568 1.00 . A A . 28 TRP CB 1 1 3 1912 1 1 28 TRP CD1 C 7.178 0.942 -0.080 1.00 . A A . 28 TRP CD1 1 1 3 1913 1 1 28 TRP CD2 C 9.167 0.872 0.954 1.00 . A A . 28 TRP CD2 1 1 3 1914 1 1 28 TRP CE2 C 9.141 -0.221 0.056 1.00 . A A . 28 TRP CE2 1 1 3 1915 1 1 28 TRP CE3 C 10.319 1.059 1.739 1.00 . A A . 28 TRP CE3 1 1 3 1916 1 1 28 TRP CG C 7.904 1.590 0.838 1.00 . A A . 28 TRP CG 1 1 3 1917 1 1 28 TRP CH2 C 11.357 -0.898 0.729 1.00 . A A . 28 TRP CH2 1 1 3 1918 1 1 28 TRP CZ2 C 10.220 -1.099 -0.060 1.00 . A A . 28 TRP CZ2 1 1 3 1919 1 1 28 TRP CZ3 C 11.407 0.178 1.626 1.00 . A A . 28 TRP CZ3 1 1 3 1920 1 1 28 TRP H H 6.017 4.860 2.115 1.00 . A A . 28 TRP H 1 1 3 1921 1 1 28 TRP HA H 8.052 4.270 0.136 1.00 . A A . 28 TRP HA 1 1 3 1922 1 1 28 TRP HB2 H 8.204 3.118 2.261 1.00 . A A . 28 TRP HB2 1 1 3 1923 1 1 28 TRP HB3 H 6.537 2.567 2.115 1.00 . A A . 28 TRP HB3 1 1 3 1924 1 1 28 TRP HD1 H 6.190 1.231 -0.394 1.00 . A A . 28 TRP HD1 1 1 3 1925 1 1 28 TRP HE1 H 7.599 -0.769 -1.237 1.00 . A A . 28 TRP HE1 1 1 3 1926 1 1 28 TRP HE3 H 10.366 1.886 2.433 1.00 . A A . 28 TRP HE3 1 1 3 1927 1 1 28 TRP HH2 H 12.197 -1.572 0.646 1.00 . A A . 28 TRP HH2 1 1 3 1928 1 1 28 TRP HZ2 H 10.177 -1.926 -0.752 1.00 . A A . 28 TRP HZ2 1 1 3 1929 1 1 28 TRP HZ3 H 12.286 0.331 2.234 1.00 . A A . 28 TRP HZ3 1 1 3 1930 1 1 28 TRP N N 6.516 5.049 1.304 1.00 . A A . 28 TRP N 1 1 3 1931 1 1 28 TRP NE1 N 7.905 -0.135 -0.555 1.00 . A A . 28 TRP NE1 1 1 3 1932 1 1 28 TRP O O 6.592 2.947 -1.534 1.00 . A A . 28 TRP O 1 1 3 1933 1 1 29 LEU C C 3.950 4.511 -2.444 1.00 . A A . 29 LEU C 1 1 3 1934 1 1 29 LEU CA C 3.941 3.420 -1.369 1.00 . A A . 29 LEU CA 1 1 3 1935 1 1 29 LEU CB C 2.566 3.299 -0.678 1.00 . A A . 29 LEU CB 1 1 3 1936 1 1 29 LEU CD1 C 0.992 3.286 -2.623 1.00 . A A . 29 LEU CD1 1 1 3 1937 1 1 29 LEU CD2 C 0.312 4.332 -0.459 1.00 . A A . 29 LEU CD2 1 1 3 1938 1 1 29 LEU CG C 1.477 4.089 -1.416 1.00 . A A . 29 LEU CG 1 1 3 1939 1 1 29 LEU H H 4.677 4.245 0.467 1.00 . A A . 29 LEU H 1 1 3 1940 1 1 29 LEU HA H 4.205 2.473 -1.817 1.00 . A A . 29 LEU HA 1 1 3 1941 1 1 29 LEU HB2 H 2.281 2.258 -0.646 1.00 . A A . 29 LEU HB2 1 1 3 1942 1 1 29 LEU HB3 H 2.647 3.671 0.332 1.00 . A A . 29 LEU HB3 1 1 3 1943 1 1 29 LEU HD11 H 1.783 2.632 -2.959 1.00 . A A . 29 LEU HD11 1 1 3 1944 1 1 29 LEU HD12 H 0.132 2.697 -2.342 1.00 . A A . 29 LEU HD12 1 1 3 1945 1 1 29 LEU HD13 H 0.721 3.962 -3.420 1.00 . A A . 29 LEU HD13 1 1 3 1946 1 1 29 LEU HD21 H 0.700 4.510 0.534 1.00 . A A . 29 LEU HD21 1 1 3 1947 1 1 29 LEU HD22 H -0.251 5.193 -0.788 1.00 . A A . 29 LEU HD22 1 1 3 1948 1 1 29 LEU HD23 H -0.330 3.463 -0.445 1.00 . A A . 29 LEU HD23 1 1 3 1949 1 1 29 LEU HG H 1.872 5.037 -1.748 1.00 . A A . 29 LEU HG 1 1 3 1950 1 1 29 LEU N N 4.949 3.778 -0.344 1.00 . A A . 29 LEU N 1 1 3 1951 1 1 29 LEU O O 3.979 4.232 -3.625 1.00 . A A . 29 LEU O 1 1 3 1952 1 1 30 PHE C C 5.303 6.921 -3.696 1.00 . A A . 30 PHE C 1 1 3 1953 1 1 30 PHE CA C 3.938 6.856 -3.021 1.00 . A A . 30 PHE CA 1 1 3 1954 1 1 30 PHE CB C 3.641 8.182 -2.320 1.00 . A A . 30 PHE CB 1 1 3 1955 1 1 30 PHE CD1 C 1.184 7.733 -1.982 1.00 . A A . 30 PHE CD1 1 1 3 1956 1 1 30 PHE CD2 C 1.848 9.694 -3.245 1.00 . A A . 30 PHE CD2 1 1 3 1957 1 1 30 PHE CE1 C -0.162 8.069 -2.167 1.00 . A A . 30 PHE CE1 1 1 3 1958 1 1 30 PHE CE2 C 0.502 10.029 -3.431 1.00 . A A . 30 PHE CE2 1 1 3 1959 1 1 30 PHE CG C 2.189 8.545 -2.520 1.00 . A A . 30 PHE CG 1 1 3 1960 1 1 30 PHE CZ C -0.504 9.217 -2.892 1.00 . A A . 30 PHE CZ 1 1 3 1961 1 1 30 PHE H H 3.895 5.960 -1.093 1.00 . A A . 30 PHE H 1 1 3 1962 1 1 30 PHE HA H 3.193 6.659 -3.748 1.00 . A A . 30 PHE HA 1 1 3 1963 1 1 30 PHE HB2 H 3.845 8.085 -1.263 1.00 . A A . 30 PHE HB2 1 1 3 1964 1 1 30 PHE HB3 H 4.266 8.958 -2.737 1.00 . A A . 30 PHE HB3 1 1 3 1965 1 1 30 PHE HD1 H 1.447 6.847 -1.422 1.00 . A A . 30 PHE HD1 1 1 3 1966 1 1 30 PHE HD2 H 2.623 10.320 -3.661 1.00 . A A . 30 PHE HD2 1 1 3 1967 1 1 30 PHE HE1 H -0.937 7.442 -1.752 1.00 . A A . 30 PHE HE1 1 1 3 1968 1 1 30 PHE HE2 H 0.238 10.914 -3.991 1.00 . A A . 30 PHE HE2 1 1 3 1969 1 1 30 PHE HZ H -1.542 9.476 -3.036 1.00 . A A . 30 PHE HZ 1 1 3 1970 1 1 30 PHE N N 3.925 5.755 -2.038 1.00 . A A . 30 PHE N 1 1 3 1971 1 1 30 PHE O O 5.501 7.628 -4.665 1.00 . A A . 30 PHE O 1 1 3 1972 1 1 31 SER C C 7.631 5.115 -4.920 1.00 . A A . 31 SER C 1 1 3 1973 1 1 31 SER CA C 7.599 6.165 -3.809 1.00 . A A . 31 SER CA 1 1 3 1974 1 1 31 SER CB C 8.641 5.822 -2.745 1.00 . A A . 31 SER CB 1 1 3 1975 1 1 31 SER H H 6.044 5.607 -2.428 1.00 . A A . 31 SER H 1 1 3 1976 1 1 31 SER HA H 7.810 7.139 -4.228 1.00 . A A . 31 SER HA 1 1 3 1977 1 1 31 SER HB2 H 8.551 6.504 -1.916 1.00 . A A . 31 SER HB2 1 1 3 1978 1 1 31 SER HB3 H 8.478 4.810 -2.395 1.00 . A A . 31 SER HB3 1 1 3 1979 1 1 31 SER HG H 10.450 6.538 -2.754 1.00 . A A . 31 SER HG 1 1 3 1980 1 1 31 SER N N 6.240 6.174 -3.198 1.00 . A A . 31 SER N 1 1 3 1981 1 1 31 SER O O 8.643 4.892 -5.552 1.00 . A A . 31 SER O 1 1 3 1982 1 1 31 SER OG O 9.941 5.940 -3.306 1.00 . A A . 31 SER OG 1 1 3 1983 1 1 32 ALA C C 5.392 3.917 -7.245 1.00 . A A . 32 ALA C 1 1 3 1984 1 1 32 ALA CA C 6.444 3.461 -6.245 1.00 . A A . 32 ALA CA 1 1 3 1985 1 1 32 ALA CB C 6.055 2.104 -5.655 1.00 . A A . 32 ALA CB 1 1 3 1986 1 1 32 ALA H H 5.714 4.692 -4.652 1.00 . A A . 32 ALA H 1 1 3 1987 1 1 32 ALA HA H 7.401 3.389 -6.751 1.00 . A A . 32 ALA HA 1 1 3 1988 1 1 32 ALA HB1 H 5.348 1.616 -6.310 1.00 . A A . 32 ALA HB1 1 1 3 1989 1 1 32 ALA HB2 H 5.605 2.249 -4.684 1.00 . A A . 32 ALA HB2 1 1 3 1990 1 1 32 ALA HB3 H 6.938 1.490 -5.555 1.00 . A A . 32 ALA HB3 1 1 3 1991 1 1 32 ALA N N 6.515 4.483 -5.169 1.00 . A A . 32 ALA N 1 1 3 1992 1 1 32 ALA O O 5.621 3.917 -8.433 1.00 . A A . 32 ALA O 1 1 3 1993 1 1 33 VAL C C 3.698 6.126 -8.332 1.00 . A A . 33 VAL C 1 1 3 1994 1 1 33 VAL CA C 3.219 4.824 -7.722 1.00 . A A . 33 VAL CA 1 1 3 1995 1 1 33 VAL CB C 1.930 5.097 -6.994 1.00 . A A . 33 VAL CB 1 1 3 1996 1 1 33 VAL CG1 C 0.857 5.448 -8.021 1.00 . A A . 33 VAL CG1 1 1 3 1997 1 1 33 VAL CG2 C 1.513 3.865 -6.191 1.00 . A A . 33 VAL CG2 1 1 3 1998 1 1 33 VAL H H 4.078 4.363 -5.814 1.00 . A A . 33 VAL H 1 1 3 1999 1 1 33 VAL HA H 3.058 4.094 -8.495 1.00 . A A . 33 VAL HA 1 1 3 2000 1 1 33 VAL HB H 2.090 5.930 -6.336 1.00 . A A . 33 VAL HB 1 1 3 2001 1 1 33 VAL HG11 H 1.334 5.669 -8.969 1.00 . A A . 33 VAL HG11 1 1 3 2002 1 1 33 VAL HG12 H 0.184 4.612 -8.141 1.00 . A A . 33 VAL HG12 1 1 3 2003 1 1 33 VAL HG13 H 0.304 6.313 -7.685 1.00 . A A . 33 VAL HG13 1 1 3 2004 1 1 33 VAL HG21 H 2.081 3.009 -6.525 1.00 . A A . 33 VAL HG21 1 1 3 2005 1 1 33 VAL HG22 H 1.707 4.039 -5.142 1.00 . A A . 33 VAL HG22 1 1 3 2006 1 1 33 VAL HG23 H 0.460 3.678 -6.337 1.00 . A A . 33 VAL HG23 1 1 3 2007 1 1 33 VAL N N 4.249 4.340 -6.779 1.00 . A A . 33 VAL N 1 1 3 2008 1 1 33 VAL O O 3.489 6.385 -9.492 1.00 . A A . 33 VAL O 1 1 3 2009 1 1 34 ALA C C 5.750 7.873 -9.264 1.00 . A A . 34 ALA C 1 1 3 2010 1 1 34 ALA CA C 4.861 8.226 -8.104 1.00 . A A . 34 ALA CA 1 1 3 2011 1 1 34 ALA CB C 5.729 8.921 -7.077 1.00 . A A . 34 ALA CB 1 1 3 2012 1 1 34 ALA H H 4.508 6.717 -6.616 1.00 . A A . 34 ALA H 1 1 3 2013 1 1 34 ALA HA H 4.051 8.864 -8.416 1.00 . A A . 34 ALA HA 1 1 3 2014 1 1 34 ALA HB1 H 6.341 9.654 -7.584 1.00 . A A . 34 ALA HB1 1 1 3 2015 1 1 34 ALA HB2 H 5.109 9.404 -6.339 1.00 . A A . 34 ALA HB2 1 1 3 2016 1 1 34 ALA HB3 H 6.369 8.188 -6.601 1.00 . A A . 34 ALA HB3 1 1 3 2017 1 1 34 ALA N N 4.348 6.949 -7.553 1.00 . A A . 34 ALA N 1 1 3 2018 1 1 34 ALA O O 5.727 8.486 -10.309 1.00 . A A . 34 ALA O 1 1 3 2019 1 1 35 ILE C C 6.639 5.964 -11.282 1.00 . A A . 35 ILE C 1 1 3 2020 1 1 35 ILE CA C 7.460 6.410 -10.097 1.00 . A A . 35 ILE CA 1 1 3 2021 1 1 35 ILE CB C 8.273 5.227 -9.583 1.00 . A A . 35 ILE CB 1 1 3 2022 1 1 35 ILE CD1 C 8.760 6.646 -7.587 1.00 . A A . 35 ILE CD1 1 1 3 2023 1 1 35 ILE CG1 C 8.376 5.245 -8.067 1.00 . A A . 35 ILE CG1 1 1 3 2024 1 1 35 ILE CG2 C 9.657 5.327 -10.170 1.00 . A A . 35 ILE CG2 1 1 3 2025 1 1 35 ILE H H 6.524 6.417 -8.200 1.00 . A A . 35 ILE H 1 1 3 2026 1 1 35 ILE HA H 8.119 7.210 -10.391 1.00 . A A . 35 ILE HA 1 1 3 2027 1 1 35 ILE HB H 7.803 4.310 -9.890 1.00 . A A . 35 ILE HB 1 1 3 2028 1 1 35 ILE HD11 H 8.946 7.280 -8.441 1.00 . A A . 35 ILE HD11 1 1 3 2029 1 1 35 ILE HD12 H 7.951 7.059 -7.000 1.00 . A A . 35 ILE HD12 1 1 3 2030 1 1 35 ILE HD13 H 9.651 6.588 -6.980 1.00 . A A . 35 ILE HD13 1 1 3 2031 1 1 35 ILE HG12 H 7.419 4.965 -7.659 1.00 . A A . 35 ILE HG12 1 1 3 2032 1 1 35 ILE HG13 H 9.123 4.536 -7.749 1.00 . A A . 35 ILE HG13 1 1 3 2033 1 1 35 ILE HG21 H 9.587 5.763 -11.152 1.00 . A A . 35 ILE HG21 1 1 3 2034 1 1 35 ILE HG22 H 10.253 5.959 -9.533 1.00 . A A . 35 ILE HG22 1 1 3 2035 1 1 35 ILE HG23 H 10.094 4.346 -10.233 1.00 . A A . 35 ILE HG23 1 1 3 2036 1 1 35 ILE N N 6.542 6.871 -9.056 1.00 . A A . 35 ILE N 1 1 3 2037 1 1 35 ILE O O 7.046 6.104 -12.418 1.00 . A A . 35 ILE O 1 1 3 2038 1 1 36 VAL C C 3.999 6.256 -12.759 1.00 . A A . 36 VAL C 1 1 3 2039 1 1 36 VAL CA C 4.658 5.015 -12.190 1.00 . A A . 36 VAL CA 1 1 3 2040 1 1 36 VAL CB C 3.625 3.992 -11.777 1.00 . A A . 36 VAL CB 1 1 3 2041 1 1 36 VAL CG1 C 3.245 3.180 -13.019 1.00 . A A . 36 VAL CG1 1 1 3 2042 1 1 36 VAL CG2 C 4.233 3.075 -10.711 1.00 . A A . 36 VAL CG2 1 1 3 2043 1 1 36 VAL H H 5.134 5.335 -10.118 1.00 . A A . 36 VAL H 1 1 3 2044 1 1 36 VAL HA H 5.314 4.584 -12.927 1.00 . A A . 36 VAL HA 1 1 3 2045 1 1 36 VAL HB H 2.753 4.494 -11.383 1.00 . A A . 36 VAL HB 1 1 3 2046 1 1 36 VAL HG11 H 3.998 3.323 -13.791 1.00 . A A . 36 VAL HG11 1 1 3 2047 1 1 36 VAL HG12 H 3.188 2.133 -12.764 1.00 . A A . 36 VAL HG12 1 1 3 2048 1 1 36 VAL HG13 H 2.289 3.516 -13.389 1.00 . A A . 36 VAL HG13 1 1 3 2049 1 1 36 VAL HG21 H 5.172 3.491 -10.364 1.00 . A A . 36 VAL HG21 1 1 3 2050 1 1 36 VAL HG22 H 3.552 2.990 -9.881 1.00 . A A . 36 VAL HG22 1 1 3 2051 1 1 36 VAL HG23 H 4.410 2.098 -11.135 1.00 . A A . 36 VAL HG23 1 1 3 2052 1 1 36 VAL N N 5.473 5.436 -11.043 1.00 . A A . 36 VAL N 1 1 3 2053 1 1 36 VAL O O 3.599 6.318 -13.895 1.00 . A A . 36 VAL O 1 1 3 2054 1 1 37 ALA C C 4.493 9.127 -13.359 1.00 . A A . 37 ALA C 1 1 3 2055 1 1 37 ALA CA C 3.388 8.527 -12.499 1.00 . A A . 37 ALA CA 1 1 3 2056 1 1 37 ALA CB C 3.038 9.474 -11.355 1.00 . A A . 37 ALA CB 1 1 3 2057 1 1 37 ALA H H 4.284 7.230 -11.095 1.00 . A A . 37 ALA H 1 1 3 2058 1 1 37 ALA HA H 2.524 8.315 -13.088 1.00 . A A . 37 ALA HA 1 1 3 2059 1 1 37 ALA HB1 H 3.937 9.730 -10.815 1.00 . A A . 37 ALA HB1 1 1 3 2060 1 1 37 ALA HB2 H 2.593 10.371 -11.760 1.00 . A A . 37 ALA HB2 1 1 3 2061 1 1 37 ALA HB3 H 2.339 8.991 -10.688 1.00 . A A . 37 ALA HB3 1 1 3 2062 1 1 37 ALA N N 3.935 7.277 -11.985 1.00 . A A . 37 ALA N 1 1 3 2063 1 1 37 ALA O O 4.255 9.889 -14.276 1.00 . A A . 37 ALA O 1 1 3 2064 1 1 38 HIS C C 7.484 8.169 -14.686 1.00 . A A . 38 HIS C 1 1 3 2065 1 1 38 HIS CA C 6.878 9.281 -13.818 1.00 . A A . 38 HIS CA 1 1 3 2066 1 1 38 HIS CB C 7.944 9.754 -12.839 1.00 . A A . 38 HIS CB 1 1 3 2067 1 1 38 HIS CD2 C 6.292 11.615 -11.988 1.00 . A A . 38 HIS CD2 1 1 3 2068 1 1 38 HIS CE1 C 7.149 11.915 -10.021 1.00 . A A . 38 HIS CE1 1 1 3 2069 1 1 38 HIS CG C 7.360 10.758 -11.885 1.00 . A A . 38 HIS CG 1 1 3 2070 1 1 38 HIS H H 5.877 8.155 -12.301 1.00 . A A . 38 HIS H 1 1 3 2071 1 1 38 HIS HA H 6.562 10.096 -14.434 1.00 . A A . 38 HIS HA 1 1 3 2072 1 1 38 HIS HB2 H 8.316 8.906 -12.282 1.00 . A A . 38 HIS HB2 1 1 3 2073 1 1 38 HIS HB3 H 8.749 10.198 -13.388 1.00 . A A . 38 HIS HB3 1 1 3 2074 1 1 38 HIS HD1 H 8.665 10.504 -10.236 1.00 . A A . 38 HIS HD1 1 1 3 2075 1 1 38 HIS HD2 H 5.650 11.708 -12.852 1.00 . A A . 38 HIS HD2 1 1 3 2076 1 1 38 HIS HE1 H 7.331 12.284 -9.022 1.00 . A A . 38 HIS HE1 1 1 3 2077 1 1 38 HIS N N 5.720 8.767 -13.052 1.00 . A A . 38 HIS N 1 1 3 2078 1 1 38 HIS ND1 N 7.891 10.967 -10.621 1.00 . A A . 38 HIS ND1 1 1 3 2079 1 1 38 HIS NE2 N 6.161 12.345 -10.810 1.00 . A A . 38 HIS NE2 1 1 3 2080 1 1 38 HIS O O 8.601 8.279 -15.152 1.00 . A A . 38 HIS O 1 1 3 2081 1 1 39 LEU C C 7.277 6.283 -17.194 1.00 . A A . 39 LEU C 1 1 3 2082 1 1 39 LEU CA C 7.330 5.977 -15.695 1.00 . A A . 39 LEU CA 1 1 3 2083 1 1 39 LEU CB C 6.556 4.678 -15.393 1.00 . A A . 39 LEU CB 1 1 3 2084 1 1 39 LEU CD1 C 4.530 6.088 -16.275 1.00 . A A . 39 LEU CD1 1 1 3 2085 1 1 39 LEU CD2 C 4.448 3.591 -16.217 1.00 . A A . 39 LEU CD2 1 1 3 2086 1 1 39 LEU CG C 5.002 4.827 -15.502 1.00 . A A . 39 LEU CG 1 1 3 2087 1 1 39 LEU H H 5.899 7.015 -14.492 1.00 . A A . 39 LEU H 1 1 3 2088 1 1 39 LEU HA H 8.360 5.847 -15.416 1.00 . A A . 39 LEU HA 1 1 3 2089 1 1 39 LEU HB2 H 6.876 3.917 -16.087 1.00 . A A . 39 LEU HB2 1 1 3 2090 1 1 39 LEU HB3 H 6.803 4.356 -14.391 1.00 . A A . 39 LEU HB3 1 1 3 2091 1 1 39 LEU HD11 H 5.262 6.866 -16.217 1.00 . A A . 39 LEU HD11 1 1 3 2092 1 1 39 LEU HD12 H 4.366 5.832 -17.310 1.00 . A A . 39 LEU HD12 1 1 3 2093 1 1 39 LEU HD13 H 3.599 6.439 -15.860 1.00 . A A . 39 LEU HD13 1 1 3 2094 1 1 39 LEU HD21 H 5.242 2.873 -16.363 1.00 . A A . 39 LEU HD21 1 1 3 2095 1 1 39 LEU HD22 H 3.667 3.147 -15.617 1.00 . A A . 39 LEU HD22 1 1 3 2096 1 1 39 LEU HD23 H 4.043 3.879 -17.176 1.00 . A A . 39 LEU HD23 1 1 3 2097 1 1 39 LEU HG H 4.593 4.852 -14.520 1.00 . A A . 39 LEU HG 1 1 3 2098 1 1 39 LEU N N 6.779 7.095 -14.885 1.00 . A A . 39 LEU N 1 1 3 2099 1 1 39 LEU O O 7.979 7.141 -17.686 1.00 . A A . 39 LEU O 1 1 3 2100 1 1 40 ALA C C 6.187 7.269 -19.754 1.00 . A A . 40 ALA C 1 1 3 2101 1 1 40 ALA CA C 6.343 5.796 -19.401 1.00 . A A . 40 ALA CA 1 1 3 2102 1 1 40 ALA CB C 5.147 5.017 -19.942 1.00 . A A . 40 ALA CB 1 1 3 2103 1 1 40 ALA H H 5.920 4.876 -17.503 1.00 . A A . 40 ALA H 1 1 3 2104 1 1 40 ALA HA H 7.217 5.450 -19.856 1.00 . A A . 40 ALA HA 1 1 3 2105 1 1 40 ALA HB1 H 5.081 4.063 -19.439 1.00 . A A . 40 ALA HB1 1 1 3 2106 1 1 40 ALA HB2 H 4.243 5.580 -19.764 1.00 . A A . 40 ALA HB2 1 1 3 2107 1 1 40 ALA HB3 H 5.271 4.857 -21.003 1.00 . A A . 40 ALA HB3 1 1 3 2108 1 1 40 ALA N N 6.457 5.574 -17.926 1.00 . A A . 40 ALA N 1 1 3 2109 1 1 40 ALA O O 6.198 7.648 -20.908 1.00 . A A . 40 ALA O 1 1 3 2110 1 1 41 VAL C C 7.243 10.161 -19.183 1.00 . A A . 41 VAL C 1 1 3 2111 1 1 41 VAL CA C 5.860 9.528 -19.032 1.00 . A A . 41 VAL CA 1 1 3 2112 1 1 41 VAL CB C 5.111 10.113 -17.837 1.00 . A A . 41 VAL CB 1 1 3 2113 1 1 41 VAL CG1 C 4.243 11.275 -18.304 1.00 . A A . 41 VAL CG1 1 1 3 2114 1 1 41 VAL CG2 C 4.221 9.016 -17.218 1.00 . A A . 41 VAL CG2 1 1 3 2115 1 1 41 VAL H H 6.009 7.767 -17.878 1.00 . A A . 41 VAL H 1 1 3 2116 1 1 41 VAL HA H 5.288 9.675 -19.932 1.00 . A A . 41 VAL HA 1 1 3 2117 1 1 41 VAL HB H 5.821 10.462 -17.102 1.00 . A A . 41 VAL HB 1 1 3 2118 1 1 41 VAL HG11 H 3.701 10.982 -19.190 1.00 . A A . 41 VAL HG11 1 1 3 2119 1 1 41 VAL HG12 H 3.546 11.540 -17.523 1.00 . A A . 41 VAL HG12 1 1 3 2120 1 1 41 VAL HG13 H 4.874 12.122 -18.530 1.00 . A A . 41 VAL HG13 1 1 3 2121 1 1 41 VAL HG21 H 4.225 8.132 -17.864 1.00 . A A . 41 VAL HG21 1 1 3 2122 1 1 41 VAL HG22 H 4.610 8.743 -16.247 1.00 . A A . 41 VAL HG22 1 1 3 2123 1 1 41 VAL HG23 H 3.213 9.381 -17.113 1.00 . A A . 41 VAL HG23 1 1 3 2124 1 1 41 VAL N N 6.032 8.091 -18.785 1.00 . A A . 41 VAL N 1 1 3 2125 1 1 41 VAL O O 7.501 10.916 -20.100 1.00 . A A . 41 VAL O 1 1 3 2126 1 1 42 TYR C C 10.285 9.626 -19.473 1.00 . A A . 42 TYR C 1 1 3 2127 1 1 42 TYR CA C 9.519 10.378 -18.383 1.00 . A A . 42 TYR CA 1 1 3 2128 1 1 42 TYR CB C 10.222 10.186 -17.040 1.00 . A A . 42 TYR CB 1 1 3 2129 1 1 42 TYR CD1 C 8.416 11.045 -15.526 1.00 . A A . 42 TYR CD1 1 1 3 2130 1 1 42 TYR CD2 C 10.475 12.310 -15.712 1.00 . A A . 42 TYR CD2 1 1 3 2131 1 1 42 TYR CE1 C 7.915 11.997 -14.628 1.00 . A A . 42 TYR CE1 1 1 3 2132 1 1 42 TYR CE2 C 9.975 13.262 -14.816 1.00 . A A . 42 TYR CE2 1 1 3 2133 1 1 42 TYR CG C 9.695 11.204 -16.066 1.00 . A A . 42 TYR CG 1 1 3 2134 1 1 42 TYR CZ C 8.694 13.106 -14.275 1.00 . A A . 42 TYR CZ 1 1 3 2135 1 1 42 TYR H H 7.910 9.216 -17.581 1.00 . A A . 42 TYR H 1 1 3 2136 1 1 42 TYR HA H 9.475 11.426 -18.623 1.00 . A A . 42 TYR HA 1 1 3 2137 1 1 42 TYR HB2 H 10.024 9.189 -16.667 1.00 . A A . 42 TYR HB2 1 1 3 2138 1 1 42 TYR HB3 H 11.287 10.322 -17.164 1.00 . A A . 42 TYR HB3 1 1 3 2139 1 1 42 TYR HD1 H 7.818 10.183 -15.799 1.00 . A A . 42 TYR HD1 1 1 3 2140 1 1 42 TYR HD2 H 11.464 12.430 -16.131 1.00 . A A . 42 TYR HD2 1 1 3 2141 1 1 42 TYR HE1 H 6.926 11.881 -14.212 1.00 . A A . 42 TYR HE1 1 1 3 2142 1 1 42 TYR HE2 H 10.576 14.116 -14.542 1.00 . A A . 42 TYR HE2 1 1 3 2143 1 1 42 TYR HH H 8.734 14.837 -13.471 1.00 . A A . 42 TYR HH 1 1 3 2144 1 1 42 TYR N N 8.141 9.833 -18.297 1.00 . A A . 42 TYR N 1 1 3 2145 1 1 42 TYR O O 11.057 10.197 -20.216 1.00 . A A . 42 TYR O 1 1 3 2146 1 1 42 TYR OH O 8.199 14.044 -13.392 1.00 . A A . 42 TYR OH 1 1 3 2147 1 1 43 ILE C C 10.273 7.931 -21.996 1.00 . A A . 43 ILE C 1 1 3 2148 1 1 43 ILE CA C 10.776 7.535 -20.604 1.00 . A A . 43 ILE CA 1 1 3 2149 1 1 43 ILE CB C 10.494 6.050 -20.358 1.00 . A A . 43 ILE CB 1 1 3 2150 1 1 43 ILE CD1 C 10.599 4.369 -18.512 1.00 . A A . 43 ILE CD1 1 1 3 2151 1 1 43 ILE CG1 C 11.295 5.576 -19.143 1.00 . A A . 43 ILE CG1 1 1 3 2152 1 1 43 ILE CG2 C 10.901 5.233 -21.586 1.00 . A A . 43 ILE CG2 1 1 3 2153 1 1 43 ILE H H 9.442 7.905 -18.956 1.00 . A A . 43 ILE H 1 1 3 2154 1 1 43 ILE HA H 11.839 7.715 -20.539 1.00 . A A . 43 ILE HA 1 1 3 2155 1 1 43 ILE HB H 9.439 5.912 -20.170 1.00 . A A . 43 ILE HB 1 1 3 2156 1 1 43 ILE HD11 H 9.598 4.645 -18.215 1.00 . A A . 43 ILE HD11 1 1 3 2157 1 1 43 ILE HD12 H 10.553 3.563 -19.229 1.00 . A A . 43 ILE HD12 1 1 3 2158 1 1 43 ILE HD13 H 11.155 4.046 -17.643 1.00 . A A . 43 ILE HD13 1 1 3 2159 1 1 43 ILE HG12 H 12.290 5.295 -19.457 1.00 . A A . 43 ILE HG12 1 1 3 2160 1 1 43 ILE HG13 H 11.357 6.373 -18.419 1.00 . A A . 43 ILE HG13 1 1 3 2161 1 1 43 ILE HG21 H 11.652 5.772 -22.145 1.00 . A A . 43 ILE HG21 1 1 3 2162 1 1 43 ILE HG22 H 11.302 4.282 -21.268 1.00 . A A . 43 ILE HG22 1 1 3 2163 1 1 43 ILE HG23 H 10.036 5.068 -22.210 1.00 . A A . 43 ILE HG23 1 1 3 2164 1 1 43 ILE N N 10.070 8.342 -19.569 1.00 . A A . 43 ILE N 1 1 3 2165 1 1 43 ILE O O 10.794 7.486 -23.000 1.00 . A A . 43 ILE O 1 1 3 2166 1 1 44 TRP C C 8.948 10.671 -23.599 1.00 . A A . 44 TRP C 1 1 3 2167 1 1 44 TRP CA C 8.740 9.170 -23.402 1.00 . A A . 44 TRP CA 1 1 3 2168 1 1 44 TRP CB C 7.247 8.847 -23.487 1.00 . A A . 44 TRP CB 1 1 3 2169 1 1 44 TRP CD1 C 7.376 6.363 -23.038 1.00 . A A . 44 TRP CD1 1 1 3 2170 1 1 44 TRP CD2 C 6.535 6.832 -25.071 1.00 . A A . 44 TRP CD2 1 1 3 2171 1 1 44 TRP CE2 C 6.551 5.422 -24.954 1.00 . A A . 44 TRP CE2 1 1 3 2172 1 1 44 TRP CE3 C 6.047 7.392 -26.266 1.00 . A A . 44 TRP CE3 1 1 3 2173 1 1 44 TRP CG C 7.065 7.406 -23.842 1.00 . A A . 44 TRP CG 1 1 3 2174 1 1 44 TRP CH2 C 5.618 5.169 -27.164 1.00 . A A . 44 TRP CH2 1 1 3 2175 1 1 44 TRP CZ2 C 6.099 4.597 -25.985 1.00 . A A . 44 TRP CZ2 1 1 3 2176 1 1 44 TRP CZ3 C 5.591 6.564 -27.305 1.00 . A A . 44 TRP CZ3 1 1 3 2177 1 1 44 TRP H H 8.856 9.106 -21.250 1.00 . A A . 44 TRP H 1 1 3 2178 1 1 44 TRP HA H 9.270 8.636 -24.175 1.00 . A A . 44 TRP HA 1 1 3 2179 1 1 44 TRP HB2 H 6.782 9.043 -22.533 1.00 . A A . 44 TRP HB2 1 1 3 2180 1 1 44 TRP HB3 H 6.788 9.464 -24.245 1.00 . A A . 44 TRP HB3 1 1 3 2181 1 1 44 TRP HD1 H 7.795 6.438 -22.045 1.00 . A A . 44 TRP HD1 1 1 3 2182 1 1 44 TRP HE1 H 7.204 4.285 -23.334 1.00 . A A . 44 TRP HE1 1 1 3 2183 1 1 44 TRP HE3 H 6.022 8.465 -26.384 1.00 . A A . 44 TRP HE3 1 1 3 2184 1 1 44 TRP HH2 H 5.265 4.539 -27.967 1.00 . A A . 44 TRP HH2 1 1 3 2185 1 1 44 TRP HZ2 H 6.122 3.523 -25.871 1.00 . A A . 44 TRP HZ2 1 1 3 2186 1 1 44 TRP HZ3 H 5.218 7.006 -28.218 1.00 . A A . 44 TRP HZ3 1 1 3 2187 1 1 44 TRP N N 9.266 8.758 -22.068 1.00 . A A . 44 TRP N 1 1 3 2188 1 1 44 TRP NE1 N 7.073 5.185 -23.698 1.00 . A A . 44 TRP NE1 1 1 3 2189 1 1 44 TRP O O 8.394 11.270 -24.499 1.00 . A A . 44 TRP O 1 1 3 2190 1 1 45 ARG C C 10.457 13.011 -24.360 1.00 . A A . 45 ARG C 1 1 3 2191 1 1 45 ARG CA C 9.999 12.738 -22.924 1.00 . A A . 45 ARG CA 1 1 3 2192 1 1 45 ARG CB C 11.091 13.165 -21.941 1.00 . A A . 45 ARG CB 1 1 3 2193 1 1 45 ARG CD C 9.510 13.449 -20.028 1.00 . A A . 45 ARG CD 1 1 3 2194 1 1 45 ARG CG C 10.513 14.163 -20.936 1.00 . A A . 45 ARG CG 1 1 3 2195 1 1 45 ARG CZ C 9.566 14.858 -18.056 1.00 . A A . 45 ARG CZ 1 1 3 2196 1 1 45 ARG H H 10.192 10.775 -22.060 1.00 . A A . 45 ARG H 1 1 3 2197 1 1 45 ARG HA H 9.091 13.287 -22.721 1.00 . A A . 45 ARG HA 1 1 3 2198 1 1 45 ARG HB2 H 11.459 12.296 -21.416 1.00 . A A . 45 ARG HB2 1 1 3 2199 1 1 45 ARG HB3 H 11.903 13.629 -22.482 1.00 . A A . 45 ARG HB3 1 1 3 2200 1 1 45 ARG HD2 H 8.516 13.819 -20.230 1.00 . A A . 45 ARG HD2 1 1 3 2201 1 1 45 ARG HD3 H 9.545 12.387 -20.220 1.00 . A A . 45 ARG HD3 1 1 3 2202 1 1 45 ARG HE H 10.306 13.015 -18.073 1.00 . A A . 45 ARG HE 1 1 3 2203 1 1 45 ARG HG2 H 11.313 14.574 -20.337 1.00 . A A . 45 ARG HG2 1 1 3 2204 1 1 45 ARG HG3 H 10.013 14.959 -21.465 1.00 . A A . 45 ARG HG3 1 1 3 2205 1 1 45 ARG HH11 H 7.816 15.045 -19.011 1.00 . A A . 45 ARG HH11 1 1 3 2206 1 1 45 ARG HH12 H 8.228 16.343 -17.942 1.00 . A A . 45 ARG HH12 1 1 3 2207 1 1 45 ARG HH21 H 11.244 14.941 -16.969 1.00 . A A . 45 ARG HH21 1 1 3 2208 1 1 45 ARG HH22 H 10.166 16.285 -16.787 1.00 . A A . 45 ARG HH22 1 1 3 2209 1 1 45 ARG N N 9.749 11.279 -22.773 1.00 . A A . 45 ARG N 1 1 3 2210 1 1 45 ARG NE N 9.858 13.709 -18.601 1.00 . A A . 45 ARG NE 1 1 3 2211 1 1 45 ARG NH1 N 8.449 15.462 -18.360 1.00 . A A . 45 ARG NH1 1 1 3 2212 1 1 45 ARG NH2 N 10.390 15.403 -17.204 1.00 . A A . 45 ARG NH2 1 1 3 2213 1 1 45 ARG O O 10.603 12.093 -25.142 1.00 . A A . 45 ARG O 1 1 3 2214 1 1 46 PRO C C 12.611 14.357 -26.177 1.00 . A A . 46 PRO C 1 1 3 2215 1 1 46 PRO CA C 11.124 14.677 -26.005 1.00 . A A . 46 PRO CA 1 1 3 2216 1 1 46 PRO CB C 10.868 16.186 -26.023 1.00 . A A . 46 PRO CB 1 1 3 2217 1 1 46 PRO CD C 10.500 15.379 -23.712 1.00 . A A . 46 PRO CD 1 1 3 2218 1 1 46 PRO CG C 10.818 16.636 -24.544 1.00 . A A . 46 PRO CG 1 1 3 2219 1 1 46 PRO HB2 H 11.671 16.691 -26.543 1.00 . A A . 46 PRO HB2 1 1 3 2220 1 1 46 PRO HB3 H 9.924 16.397 -26.500 1.00 . A A . 46 PRO HB3 1 1 3 2221 1 1 46 PRO HD2 H 11.192 15.291 -22.888 1.00 . A A . 46 PRO HD2 1 1 3 2222 1 1 46 PRO HD3 H 9.482 15.407 -23.355 1.00 . A A . 46 PRO HD3 1 1 3 2223 1 1 46 PRO HG2 H 11.775 17.047 -24.251 1.00 . A A . 46 PRO HG2 1 1 3 2224 1 1 46 PRO HG3 H 10.040 17.371 -24.406 1.00 . A A . 46 PRO HG3 1 1 3 2225 1 1 46 PRO N N 10.675 14.263 -24.666 1.00 . A A . 46 PRO N 1 1 3 2226 1 1 46 PRO O O 13.470 15.067 -25.693 1.00 . A A . 46 PRO O 1 1 3 2227 1 1 47 TRP C C 14.498 12.202 -28.399 1.00 . A A . 47 TRP C 1 1 3 2228 1 1 47 TRP CA C 14.348 12.915 -27.056 1.00 . A A . 47 TRP CA 1 1 3 2229 1 1 47 TRP CB C 14.790 11.983 -25.924 1.00 . A A . 47 TRP CB 1 1 3 2230 1 1 47 TRP CD1 C 12.971 10.244 -25.623 1.00 . A A . 47 TRP CD1 1 1 3 2231 1 1 47 TRP CD2 C 14.714 9.480 -26.823 1.00 . A A . 47 TRP CD2 1 1 3 2232 1 1 47 TRP CE2 C 13.783 8.417 -26.736 1.00 . A A . 47 TRP CE2 1 1 3 2233 1 1 47 TRP CE3 C 15.908 9.257 -27.532 1.00 . A A . 47 TRP CE3 1 1 3 2234 1 1 47 TRP CG C 14.175 10.630 -26.109 1.00 . A A . 47 TRP CG 1 1 3 2235 1 1 47 TRP CH2 C 15.220 6.974 -28.029 1.00 . A A . 47 TRP CH2 1 1 3 2236 1 1 47 TRP CZ2 C 14.028 7.179 -27.329 1.00 . A A . 47 TRP CZ2 1 1 3 2237 1 1 47 TRP CZ3 C 16.158 8.012 -28.131 1.00 . A A . 47 TRP CZ3 1 1 3 2238 1 1 47 TRP H H 12.210 12.726 -27.240 1.00 . A A . 47 TRP H 1 1 3 2239 1 1 47 TRP HA H 14.958 13.806 -27.050 1.00 . A A . 47 TRP HA 1 1 3 2240 1 1 47 TRP HB2 H 15.866 11.892 -25.934 1.00 . A A . 47 TRP HB2 1 1 3 2241 1 1 47 TRP HB3 H 14.473 12.394 -24.976 1.00 . A A . 47 TRP HB3 1 1 3 2242 1 1 47 TRP HD1 H 12.299 10.858 -25.040 1.00 . A A . 47 TRP HD1 1 1 3 2243 1 1 47 TRP HE1 H 11.937 8.415 -25.770 1.00 . A A . 47 TRP HE1 1 1 3 2244 1 1 47 TRP HE3 H 16.637 10.049 -27.616 1.00 . A A . 47 TRP HE3 1 1 3 2245 1 1 47 TRP HH2 H 15.419 6.019 -28.492 1.00 . A A . 47 TRP HH2 1 1 3 2246 1 1 47 TRP HZ2 H 13.302 6.384 -27.248 1.00 . A A . 47 TRP HZ2 1 1 3 2247 1 1 47 TRP HZ3 H 17.079 7.851 -28.674 1.00 . A A . 47 TRP HZ3 1 1 3 2248 1 1 47 TRP N N 12.920 13.288 -26.860 1.00 . A A . 47 TRP N 1 1 3 2249 1 1 47 TRP NE1 N 12.739 8.931 -25.995 1.00 . A A . 47 TRP NE1 1 1 3 2250 1 1 47 TRP O O 15.478 11.531 -28.655 1.00 . A A . 47 TRP O 1 1 3 2251 1 1 48 PHE C C 14.687 12.330 -31.435 1.00 . A A . 48 PHE C 1 1 3 2252 1 1 48 PHE CA C 13.597 11.671 -30.582 1.00 . A A . 48 PHE CA 1 1 3 2253 1 1 48 PHE CB C 12.232 11.791 -31.270 1.00 . A A . 48 PHE CB 1 1 3 2254 1 1 48 PHE CD1 C 11.939 14.294 -31.143 1.00 . A A . 48 PHE CD1 1 1 3 2255 1 1 48 PHE CD2 C 12.128 13.252 -33.324 1.00 . A A . 48 PHE CD2 1 1 3 2256 1 1 48 PHE CE1 C 11.814 15.549 -31.754 1.00 . A A . 48 PHE CE1 1 1 3 2257 1 1 48 PHE CE2 C 12.003 14.505 -33.935 1.00 . A A . 48 PHE CE2 1 1 3 2258 1 1 48 PHE CG C 12.096 13.147 -31.929 1.00 . A A . 48 PHE CG 1 1 3 2259 1 1 48 PHE CZ C 11.846 15.654 -33.149 1.00 . A A . 48 PHE CZ 1 1 3 2260 1 1 48 PHE H H 12.745 12.885 -29.026 1.00 . A A . 48 PHE H 1 1 3 2261 1 1 48 PHE HA H 13.836 10.627 -30.442 1.00 . A A . 48 PHE HA 1 1 3 2262 1 1 48 PHE HB2 H 12.137 11.018 -32.017 1.00 . A A . 48 PHE HB2 1 1 3 2263 1 1 48 PHE HB3 H 11.453 11.674 -30.530 1.00 . A A . 48 PHE HB3 1 1 3 2264 1 1 48 PHE HD1 H 11.915 14.213 -30.067 1.00 . A A . 48 PHE HD1 1 1 3 2265 1 1 48 PHE HD2 H 12.250 12.366 -33.930 1.00 . A A . 48 PHE HD2 1 1 3 2266 1 1 48 PHE HE1 H 11.694 16.434 -31.148 1.00 . A A . 48 PHE HE1 1 1 3 2267 1 1 48 PHE HE2 H 12.027 14.587 -35.011 1.00 . A A . 48 PHE HE2 1 1 3 2268 1 1 48 PHE HZ H 11.750 16.621 -33.620 1.00 . A A . 48 PHE HZ 1 1 3 2269 1 1 48 PHE N N 13.527 12.340 -29.257 1.00 . A A . 48 PHE N 1 1 3 2270 1 1 48 PHE O O 14.815 13.542 -31.363 1.00 . A A . 48 PHE O 1 1 3 2271 1 1 48 PHE OXT O 15.372 11.612 -32.143 1.00 . A A . 48 PHE OXT 1 1 4 2272 1 1 1 ALA C C -22.553 5.454 30.331 1.00 . A A . 1 ALA C 1 1 4 2273 1 1 1 ALA CA C -23.484 5.376 31.543 1.00 . A A . 1 ALA CA 1 1 4 2274 1 1 1 ALA CB C -24.099 6.752 31.804 1.00 . A A . 1 ALA CB 1 1 4 2275 1 1 1 ALA H1 H -21.713 4.801 32.476 1.00 . A A . 1 ALA H1 1 1 4 2276 1 1 1 ALA H2 H -22.771 5.677 33.477 1.00 . A A . 1 ALA H2 1 1 4 2277 1 1 1 ALA H3 H -23.098 4.051 33.103 1.00 . A A . 1 ALA H3 1 1 4 2278 1 1 1 ALA HA H -24.271 4.662 31.348 1.00 . A A . 1 ALA HA 1 1 4 2279 1 1 1 ALA HB1 H -23.585 7.226 32.626 1.00 . A A . 1 ALA HB1 1 1 4 2280 1 1 1 ALA HB2 H -25.145 6.638 32.050 1.00 . A A . 1 ALA HB2 1 1 4 2281 1 1 1 ALA HB3 H -24.002 7.363 30.918 1.00 . A A . 1 ALA HB3 1 1 4 2282 1 1 1 ALA N N -22.708 4.944 32.739 1.00 . A A . 1 ALA N 1 1 4 2283 1 1 1 ALA O O -21.664 6.279 30.272 1.00 . A A . 1 ALA O 1 1 4 2284 1 1 2 ASP C C -22.532 3.817 27.037 1.00 . A A . 2 ASP C 1 1 4 2285 1 1 2 ASP CA C -21.877 4.625 28.158 1.00 . A A . 2 ASP CA 1 1 4 2286 1 1 2 ASP CB C -20.512 4.024 28.505 1.00 . A A . 2 ASP CB 1 1 4 2287 1 1 2 ASP CG C -19.726 3.762 27.219 1.00 . A A . 2 ASP CG 1 1 4 2288 1 1 2 ASP H H -23.473 3.941 29.432 1.00 . A A . 2 ASP H 1 1 4 2289 1 1 2 ASP HA H -21.746 5.643 27.833 1.00 . A A . 2 ASP HA 1 1 4 2290 1 1 2 ASP HB2 H -19.963 4.715 29.130 1.00 . A A . 2 ASP HB2 1 1 4 2291 1 1 2 ASP HB3 H -20.652 3.093 29.035 1.00 . A A . 2 ASP HB3 1 1 4 2292 1 1 2 ASP N N -22.750 4.599 29.365 1.00 . A A . 2 ASP N 1 1 4 2293 1 1 2 ASP O O -23.377 4.312 26.317 1.00 . A A . 2 ASP O 1 1 4 2294 1 1 2 ASP OD1 O -19.674 4.654 26.388 1.00 . A A . 2 ASP OD1 1 1 4 2295 1 1 2 ASP OD2 O -19.190 2.675 27.087 1.00 . A A . 2 ASP OD2 1 1 4 2296 1 1 3 LYS C C -22.200 2.163 24.440 1.00 . A A . 3 LYS C 1 1 4 2297 1 1 3 LYS CA C -22.753 1.739 25.803 1.00 . A A . 3 LYS CA 1 1 4 2298 1 1 3 LYS CB C -24.271 1.914 25.812 1.00 . A A . 3 LYS CB 1 1 4 2299 1 1 3 LYS CD C -26.444 0.768 26.269 1.00 . A A . 3 LYS CD 1 1 4 2300 1 1 3 LYS CE C -27.134 -0.592 26.382 1.00 . A A . 3 LYS CE 1 1 4 2301 1 1 3 LYS CG C -24.941 0.563 26.072 1.00 . A A . 3 LYS CG 1 1 4 2302 1 1 3 LYS H H -21.469 2.201 27.468 1.00 . A A . 3 LYS H 1 1 4 2303 1 1 3 LYS HA H -22.511 0.701 25.981 1.00 . A A . 3 LYS HA 1 1 4 2304 1 1 3 LYS HB2 H -24.546 2.609 26.590 1.00 . A A . 3 LYS HB2 1 1 4 2305 1 1 3 LYS HB3 H -24.596 2.296 24.856 1.00 . A A . 3 LYS HB3 1 1 4 2306 1 1 3 LYS HD2 H -26.615 1.334 27.173 1.00 . A A . 3 LYS HD2 1 1 4 2307 1 1 3 LYS HD3 H -26.848 1.305 25.425 1.00 . A A . 3 LYS HD3 1 1 4 2308 1 1 3 LYS HE2 H -26.393 -1.377 26.343 1.00 . A A . 3 LYS HE2 1 1 4 2309 1 1 3 LYS HE3 H -27.670 -0.649 27.319 1.00 . A A . 3 LYS HE3 1 1 4 2310 1 1 3 LYS HG2 H -24.773 -0.091 25.228 1.00 . A A . 3 LYS HG2 1 1 4 2311 1 1 3 LYS HG3 H -24.521 0.118 26.963 1.00 . A A . 3 LYS HG3 1 1 4 2312 1 1 3 LYS HZ1 H -27.652 -0.420 24.372 1.00 . A A . 3 LYS HZ1 1 1 4 2313 1 1 3 LYS HZ2 H -28.341 -1.763 25.152 1.00 . A A . 3 LYS HZ2 1 1 4 2314 1 1 3 LYS HZ3 H -28.953 -0.208 25.444 1.00 . A A . 3 LYS HZ3 1 1 4 2315 1 1 3 LYS N N -22.150 2.579 26.879 1.00 . A A . 3 LYS N 1 1 4 2316 1 1 3 LYS NZ N -28.093 -0.758 25.252 1.00 . A A . 3 LYS NZ 1 1 4 2317 1 1 3 LYS O O -22.542 1.600 23.419 1.00 . A A . 3 LYS O 1 1 4 2318 1 1 4 SER C C -19.305 3.204 23.035 1.00 . A A . 4 SER C 1 1 4 2319 1 1 4 SER CA C -20.779 3.606 23.113 1.00 . A A . 4 SER CA 1 1 4 2320 1 1 4 SER CB C -20.899 5.127 23.008 1.00 . A A . 4 SER CB 1 1 4 2321 1 1 4 SER H H -21.085 3.593 25.244 1.00 . A A . 4 SER H 1 1 4 2322 1 1 4 SER HA H -21.322 3.145 22.301 1.00 . A A . 4 SER HA 1 1 4 2323 1 1 4 SER HB2 H -21.921 5.396 22.800 1.00 . A A . 4 SER HB2 1 1 4 2324 1 1 4 SER HB3 H -20.594 5.576 23.944 1.00 . A A . 4 SER HB3 1 1 4 2325 1 1 4 SER HG H -20.574 5.548 21.136 1.00 . A A . 4 SER HG 1 1 4 2326 1 1 4 SER N N -21.349 3.150 24.412 1.00 . A A . 4 SER N 1 1 4 2327 1 1 4 SER O O -18.709 3.195 21.976 1.00 . A A . 4 SER O 1 1 4 2328 1 1 4 SER OG O -20.069 5.592 21.951 1.00 . A A . 4 SER OG 1 1 4 2329 1 1 5 ASP C C -17.173 0.945 24.054 1.00 . A A . 5 ASP C 1 1 4 2330 1 1 5 ASP CA C -17.276 2.470 24.137 1.00 . A A . 5 ASP CA 1 1 4 2331 1 1 5 ASP CB C -16.599 2.960 25.418 1.00 . A A . 5 ASP CB 1 1 4 2332 1 1 5 ASP CG C -16.922 4.440 25.632 1.00 . A A . 5 ASP CG 1 1 4 2333 1 1 5 ASP H H -19.210 2.885 24.992 1.00 . A A . 5 ASP H 1 1 4 2334 1 1 5 ASP HA H -16.787 2.910 23.280 1.00 . A A . 5 ASP HA 1 1 4 2335 1 1 5 ASP HB2 H -16.961 2.386 26.259 1.00 . A A . 5 ASP HB2 1 1 4 2336 1 1 5 ASP HB3 H -15.530 2.836 25.330 1.00 . A A . 5 ASP HB3 1 1 4 2337 1 1 5 ASP N N -18.711 2.871 24.149 1.00 . A A . 5 ASP N 1 1 4 2338 1 1 5 ASP O O -16.099 0.394 23.914 1.00 . A A . 5 ASP O 1 1 4 2339 1 1 5 ASP OD1 O -17.220 5.108 24.657 1.00 . A A . 5 ASP OD1 1 1 4 2340 1 1 5 ASP OD2 O -16.866 4.879 26.769 1.00 . A A . 5 ASP OD2 1 1 4 2341 1 1 6 LEU C C -18.415 -1.650 22.609 1.00 . A A . 6 LEU C 1 1 4 2342 1 1 6 LEU CA C -18.243 -1.229 24.060 1.00 . A A . 6 LEU CA 1 1 4 2343 1 1 6 LEU CB C -19.379 -1.808 24.894 1.00 . A A . 6 LEU CB 1 1 4 2344 1 1 6 LEU CD1 C -20.718 -0.987 26.830 1.00 . A A . 6 LEU CD1 1 1 4 2345 1 1 6 LEU CD2 C -18.502 -2.092 27.199 1.00 . A A . 6 LEU CD2 1 1 4 2346 1 1 6 LEU CG C -19.308 -1.181 26.272 1.00 . A A . 6 LEU CG 1 1 4 2347 1 1 6 LEU H H -19.136 0.721 24.250 1.00 . A A . 6 LEU H 1 1 4 2348 1 1 6 LEU HA H -17.301 -1.584 24.444 1.00 . A A . 6 LEU HA 1 1 4 2349 1 1 6 LEU HB2 H -20.328 -1.573 24.431 1.00 . A A . 6 LEU HB2 1 1 4 2350 1 1 6 LEU HB3 H -19.266 -2.878 24.975 1.00 . A A . 6 LEU HB3 1 1 4 2351 1 1 6 LEU HD11 H -21.431 -1.479 26.185 1.00 . A A . 6 LEU HD11 1 1 4 2352 1 1 6 LEU HD12 H -20.776 -1.414 27.821 1.00 . A A . 6 LEU HD12 1 1 4 2353 1 1 6 LEU HD13 H -20.944 0.067 26.878 1.00 . A A . 6 LEU HD13 1 1 4 2354 1 1 6 LEU HD21 H -17.587 -2.387 26.705 1.00 . A A . 6 LEU HD21 1 1 4 2355 1 1 6 LEU HD22 H -18.264 -1.560 28.109 1.00 . A A . 6 LEU HD22 1 1 4 2356 1 1 6 LEU HD23 H -19.083 -2.970 27.437 1.00 . A A . 6 LEU HD23 1 1 4 2357 1 1 6 LEU HG H -18.814 -0.229 26.184 1.00 . A A . 6 LEU HG 1 1 4 2358 1 1 6 LEU N N -18.280 0.258 24.138 1.00 . A A . 6 LEU N 1 1 4 2359 1 1 6 LEU O O -17.740 -2.530 22.111 1.00 . A A . 6 LEU O 1 1 4 2360 1 1 7 GLY C C -18.394 -0.838 19.654 1.00 . A A . 7 GLY C 1 1 4 2361 1 1 7 GLY CA C -19.559 -1.357 20.498 1.00 . A A . 7 GLY CA 1 1 4 2362 1 1 7 GLY H H -19.847 -0.310 22.364 1.00 . A A . 7 GLY H 1 1 4 2363 1 1 7 GLY HA2 H -20.476 -0.895 20.164 1.00 . A A . 7 GLY HA2 1 1 4 2364 1 1 7 GLY HA3 H -19.634 -2.430 20.391 1.00 . A A . 7 GLY HA3 1 1 4 2365 1 1 7 GLY N N -19.322 -1.017 21.928 1.00 . A A . 7 GLY N 1 1 4 2366 1 1 7 GLY O O -17.836 -1.551 18.844 1.00 . A A . 7 GLY O 1 1 4 2367 1 1 8 TYR C C -15.638 0.155 19.307 1.00 . A A . 8 TYR C 1 1 4 2368 1 1 8 TYR CA C -16.913 0.972 19.055 1.00 . A A . 8 TYR CA 1 1 4 2369 1 1 8 TYR CB C -16.714 2.427 19.482 1.00 . A A . 8 TYR CB 1 1 4 2370 1 1 8 TYR CD1 C -14.834 3.226 18.015 1.00 . A A . 8 TYR CD1 1 1 4 2371 1 1 8 TYR CD2 C -14.418 2.866 20.375 1.00 . A A . 8 TYR CD2 1 1 4 2372 1 1 8 TYR CE1 C -13.505 3.627 17.840 1.00 . A A . 8 TYR CE1 1 1 4 2373 1 1 8 TYR CE2 C -13.087 3.268 20.204 1.00 . A A . 8 TYR CE2 1 1 4 2374 1 1 8 TYR CG C -15.284 2.848 19.283 1.00 . A A . 8 TYR CG 1 1 4 2375 1 1 8 TYR CZ C -12.630 3.650 18.936 1.00 . A A . 8 TYR CZ 1 1 4 2376 1 1 8 TYR H H -18.481 0.960 20.480 1.00 . A A . 8 TYR H 1 1 4 2377 1 1 8 TYR HA H -17.174 0.945 18.016 1.00 . A A . 8 TYR HA 1 1 4 2378 1 1 8 TYR HB2 H -17.354 3.060 18.888 1.00 . A A . 8 TYR HB2 1 1 4 2379 1 1 8 TYR HB3 H -16.975 2.528 20.523 1.00 . A A . 8 TYR HB3 1 1 4 2380 1 1 8 TYR HD1 H -15.511 3.199 17.171 1.00 . A A . 8 TYR HD1 1 1 4 2381 1 1 8 TYR HD2 H -14.778 2.565 21.350 1.00 . A A . 8 TYR HD2 1 1 4 2382 1 1 8 TYR HE1 H -13.153 3.921 16.862 1.00 . A A . 8 TYR HE1 1 1 4 2383 1 1 8 TYR HE2 H -12.414 3.283 21.049 1.00 . A A . 8 TYR HE2 1 1 4 2384 1 1 8 TYR HH H -10.967 3.583 18.001 1.00 . A A . 8 TYR HH 1 1 4 2385 1 1 8 TYR N N -18.025 0.402 19.835 1.00 . A A . 8 TYR N 1 1 4 2386 1 1 8 TYR O O -14.706 0.190 18.535 1.00 . A A . 8 TYR O 1 1 4 2387 1 1 8 TYR OH O -11.320 4.047 18.764 1.00 . A A . 8 TYR OH 1 1 4 2388 1 1 9 THR C C -14.074 -2.264 19.451 1.00 . A A . 9 THR C 1 1 4 2389 1 1 9 THR CA C -14.368 -1.388 20.667 1.00 . A A . 9 THR CA 1 1 4 2390 1 1 9 THR CB C -14.596 -2.277 21.892 1.00 . A A . 9 THR CB 1 1 4 2391 1 1 9 THR CG2 C -13.254 -2.810 22.396 1.00 . A A . 9 THR CG2 1 1 4 2392 1 1 9 THR H H -16.348 -0.591 20.996 1.00 . A A . 9 THR H 1 1 4 2393 1 1 9 THR HA H -13.531 -0.730 20.847 1.00 . A A . 9 THR HA 1 1 4 2394 1 1 9 THR HB H -15.230 -3.107 21.626 1.00 . A A . 9 THR HB 1 1 4 2395 1 1 9 THR HG1 H -16.107 -1.316 22.622 1.00 . A A . 9 THR HG1 1 1 4 2396 1 1 9 THR HG21 H -12.453 -2.207 21.996 1.00 . A A . 9 THR HG21 1 1 4 2397 1 1 9 THR HG22 H -13.231 -2.768 23.476 1.00 . A A . 9 THR HG22 1 1 4 2398 1 1 9 THR HG23 H -13.130 -3.835 22.075 1.00 . A A . 9 THR HG23 1 1 4 2399 1 1 9 THR N N -15.588 -0.576 20.383 1.00 . A A . 9 THR N 1 1 4 2400 1 1 9 THR O O -13.152 -2.011 18.695 1.00 . A A . 9 THR O 1 1 4 2401 1 1 9 THR OG1 O -15.217 -1.516 22.913 1.00 . A A . 9 THR OG1 1 1 4 2402 1 1 10 GLY C C -14.419 -3.240 16.850 1.00 . A A . 10 GLY C 1 1 4 2403 1 1 10 GLY CA C -14.643 -4.154 18.053 1.00 . A A . 10 GLY CA 1 1 4 2404 1 1 10 GLY H H -15.616 -3.455 19.854 1.00 . A A . 10 GLY H 1 1 4 2405 1 1 10 GLY HA2 H -15.511 -4.770 17.879 1.00 . A A . 10 GLY HA2 1 1 4 2406 1 1 10 GLY HA3 H -13.773 -4.775 18.213 1.00 . A A . 10 GLY HA3 1 1 4 2407 1 1 10 GLY N N -14.867 -3.282 19.242 1.00 . A A . 10 GLY N 1 1 4 2408 1 1 10 GLY O O -13.559 -3.469 16.020 1.00 . A A . 10 GLY O 1 1 4 2409 1 1 11 LEU C C -13.598 -0.970 15.393 1.00 . A A . 11 LEU C 1 1 4 2410 1 1 11 LEU CA C -15.054 -1.232 15.680 1.00 . A A . 11 LEU CA 1 1 4 2411 1 1 11 LEU CB C -15.725 0.058 16.101 1.00 . A A . 11 LEU CB 1 1 4 2412 1 1 11 LEU CD1 C -18.168 0.013 15.695 1.00 . A A . 11 LEU CD1 1 1 4 2413 1 1 11 LEU CD2 C -16.752 1.814 14.678 1.00 . A A . 11 LEU CD2 1 1 4 2414 1 1 11 LEU CG C -16.799 0.345 15.101 1.00 . A A . 11 LEU CG 1 1 4 2415 1 1 11 LEU H H -15.866 -2.033 17.445 1.00 . A A . 11 LEU H 1 1 4 2416 1 1 11 LEU HA H -15.535 -1.622 14.806 1.00 . A A . 11 LEU HA 1 1 4 2417 1 1 11 LEU HB2 H -16.155 -0.075 17.072 1.00 . A A . 11 LEU HB2 1 1 4 2418 1 1 11 LEU HB3 H -15.012 0.867 16.114 1.00 . A A . 11 LEU HB3 1 1 4 2419 1 1 11 LEU HD11 H -18.094 -0.884 16.294 1.00 . A A . 11 LEU HD11 1 1 4 2420 1 1 11 LEU HD12 H -18.502 0.832 16.313 1.00 . A A . 11 LEU HD12 1 1 4 2421 1 1 11 LEU HD13 H -18.878 -0.148 14.897 1.00 . A A . 11 LEU HD13 1 1 4 2422 1 1 11 LEU HD21 H -15.869 2.279 15.089 1.00 . A A . 11 LEU HD21 1 1 4 2423 1 1 11 LEU HD22 H -16.725 1.878 13.601 1.00 . A A . 11 LEU HD22 1 1 4 2424 1 1 11 LEU HD23 H -17.632 2.322 15.046 1.00 . A A . 11 LEU HD23 1 1 4 2425 1 1 11 LEU HG H -16.602 -0.285 14.264 1.00 . A A . 11 LEU HG 1 1 4 2426 1 1 11 LEU N N -15.190 -2.193 16.772 1.00 . A A . 11 LEU N 1 1 4 2427 1 1 11 LEU O O -13.065 -1.500 14.466 1.00 . A A . 11 LEU O 1 1 4 2428 1 1 12 THR C C -10.795 -0.913 15.320 1.00 . A A . 12 THR C 1 1 4 2429 1 1 12 THR CA C -11.528 0.208 15.999 1.00 . A A . 12 THR CA 1 1 4 2430 1 1 12 THR CB C -10.890 0.485 17.354 1.00 . A A . 12 THR CB 1 1 4 2431 1 1 12 THR CG2 C -9.478 1.041 17.161 1.00 . A A . 12 THR CG2 1 1 4 2432 1 1 12 THR H H -13.484 0.279 16.905 1.00 . A A . 12 THR H 1 1 4 2433 1 1 12 THR HA H -11.464 1.078 15.396 1.00 . A A . 12 THR HA 1 1 4 2434 1 1 12 THR HB H -10.845 -0.427 17.931 1.00 . A A . 12 THR HB 1 1 4 2435 1 1 12 THR HG1 H -12.403 1.647 17.410 1.00 . A A . 12 THR HG1 1 1 4 2436 1 1 12 THR HG21 H -9.339 1.317 16.127 1.00 . A A . 12 THR HG21 1 1 4 2437 1 1 12 THR HG22 H -9.346 1.912 17.787 1.00 . A A . 12 THR HG22 1 1 4 2438 1 1 12 THR HG23 H -8.753 0.289 17.434 1.00 . A A . 12 THR HG23 1 1 4 2439 1 1 12 THR N N -12.979 -0.139 16.186 1.00 . A A . 12 THR N 1 1 4 2440 1 1 12 THR O O -9.889 -0.720 14.559 1.00 . A A . 12 THR O 1 1 4 2441 1 1 12 THR OG1 O -11.692 1.430 18.014 1.00 . A A . 12 THR OG1 1 1 4 2442 1 1 13 ASP C C -10.665 -3.025 13.403 1.00 . A A . 13 ASP C 1 1 4 2443 1 1 13 ASP CA C -10.525 -3.204 14.913 1.00 . A A . 13 ASP CA 1 1 4 2444 1 1 13 ASP CB C -11.142 -4.532 15.356 1.00 . A A . 13 ASP CB 1 1 4 2445 1 1 13 ASP CG C -10.236 -5.686 14.925 1.00 . A A . 13 ASP CG 1 1 4 2446 1 1 13 ASP H H -11.908 -2.218 16.205 1.00 . A A . 13 ASP H 1 1 4 2447 1 1 13 ASP HA H -9.497 -3.175 15.153 1.00 . A A . 13 ASP HA 1 1 4 2448 1 1 13 ASP HB2 H -11.249 -4.538 16.430 1.00 . A A . 13 ASP HB2 1 1 4 2449 1 1 13 ASP HB3 H -12.113 -4.649 14.897 1.00 . A A . 13 ASP HB3 1 1 4 2450 1 1 13 ASP N N -11.185 -2.083 15.582 1.00 . A A . 13 ASP N 1 1 4 2451 1 1 13 ASP O O -9.678 -2.908 12.697 1.00 . A A . 13 ASP O 1 1 4 2452 1 1 13 ASP OD1 O -10.200 -5.976 13.740 1.00 . A A . 13 ASP OD1 1 1 4 2453 1 1 13 ASP OD2 O -9.592 -6.260 15.787 1.00 . A A . 13 ASP OD2 1 1 4 2454 1 1 14 GLU C C -11.974 -1.352 11.018 1.00 . A A . 14 GLU C 1 1 4 2455 1 1 14 GLU CA C -11.948 -2.826 11.408 1.00 . A A . 14 GLU CA 1 1 4 2456 1 1 14 GLU CB C -13.193 -3.499 10.870 1.00 . A A . 14 GLU CB 1 1 4 2457 1 1 14 GLU CD C -15.273 -3.599 12.249 1.00 . A A . 14 GLU CD 1 1 4 2458 1 1 14 GLU CG C -14.424 -2.720 11.329 1.00 . A A . 14 GLU CG 1 1 4 2459 1 1 14 GLU H H -12.672 -3.082 13.429 1.00 . A A . 14 GLU H 1 1 4 2460 1 1 14 GLU HA H -11.077 -3.288 10.972 1.00 . A A . 14 GLU HA 1 1 4 2461 1 1 14 GLU HB2 H -13.145 -3.501 9.792 1.00 . A A . 14 GLU HB2 1 1 4 2462 1 1 14 GLU HB3 H -13.244 -4.510 11.237 1.00 . A A . 14 GLU HB3 1 1 4 2463 1 1 14 GLU HG2 H -14.107 -1.836 11.864 1.00 . A A . 14 GLU HG2 1 1 4 2464 1 1 14 GLU HG3 H -15.008 -2.431 10.469 1.00 . A A . 14 GLU HG3 1 1 4 2465 1 1 14 GLU N N -11.857 -2.993 12.876 1.00 . A A . 14 GLU N 1 1 4 2466 1 1 14 GLU O O -11.767 -1.016 9.873 1.00 . A A . 14 GLU O 1 1 4 2467 1 1 14 GLU OE1 O -15.010 -3.605 13.440 1.00 . A A . 14 GLU OE1 1 1 4 2468 1 1 14 GLU OE2 O -16.174 -4.253 11.747 1.00 . A A . 14 GLU OE2 1 1 4 2469 1 1 15 GLN C C -10.750 1.360 11.537 1.00 . A A . 15 GLN C 1 1 4 2470 1 1 15 GLN CA C -12.187 0.969 11.587 1.00 . A A . 15 GLN CA 1 1 4 2471 1 1 15 GLN CB C -12.882 1.797 12.644 1.00 . A A . 15 GLN CB 1 1 4 2472 1 1 15 GLN CD C -15.200 1.147 11.984 1.00 . A A . 15 GLN CD 1 1 4 2473 1 1 15 GLN CG C -14.154 1.091 13.098 1.00 . A A . 15 GLN CG 1 1 4 2474 1 1 15 GLN H H -12.335 -0.732 12.862 1.00 . A A . 15 GLN H 1 1 4 2475 1 1 15 GLN HA H -12.638 1.114 10.634 1.00 . A A . 15 GLN HA 1 1 4 2476 1 1 15 GLN HB2 H -12.216 1.917 13.481 1.00 . A A . 15 GLN HB2 1 1 4 2477 1 1 15 GLN HB3 H -13.124 2.764 12.228 1.00 . A A . 15 GLN HB3 1 1 4 2478 1 1 15 GLN HE21 H -15.755 -0.745 12.217 1.00 . A A . 15 GLN HE21 1 1 4 2479 1 1 15 GLN HE22 H -16.575 0.105 10.998 1.00 . A A . 15 GLN HE22 1 1 4 2480 1 1 15 GLN HG2 H -13.924 0.061 13.329 1.00 . A A . 15 GLN HG2 1 1 4 2481 1 1 15 GLN HG3 H -14.539 1.579 13.979 1.00 . A A . 15 GLN HG3 1 1 4 2482 1 1 15 GLN N N -12.198 -0.464 11.944 1.00 . A A . 15 GLN N 1 1 4 2483 1 1 15 GLN NE2 N -15.902 0.080 11.710 1.00 . A A . 15 GLN NE2 1 1 4 2484 1 1 15 GLN O O -10.304 2.066 10.665 1.00 . A A . 15 GLN O 1 1 4 2485 1 1 15 GLN OE1 O -15.382 2.171 11.355 1.00 . A A . 15 GLN OE1 1 1 4 2486 1 1 16 ALA C C -8.071 0.774 11.077 1.00 . A A . 16 ALA C 1 1 4 2487 1 1 16 ALA CA C -8.564 1.125 12.469 1.00 . A A . 16 ALA CA 1 1 4 2488 1 1 16 ALA CB C -7.868 0.253 13.508 1.00 . A A . 16 ALA CB 1 1 4 2489 1 1 16 ALA H H -10.427 0.263 13.131 1.00 . A A . 16 ALA H 1 1 4 2490 1 1 16 ALA HA H -8.386 2.168 12.671 1.00 . A A . 16 ALA HA 1 1 4 2491 1 1 16 ALA HB1 H -8.164 0.572 14.497 1.00 . A A . 16 ALA HB1 1 1 4 2492 1 1 16 ALA HB2 H -6.799 0.343 13.401 1.00 . A A . 16 ALA HB2 1 1 4 2493 1 1 16 ALA HB3 H -8.163 -0.776 13.362 1.00 . A A . 16 ALA HB3 1 1 4 2494 1 1 16 ALA N N -10.015 0.853 12.463 1.00 . A A . 16 ALA N 1 1 4 2495 1 1 16 ALA O O -7.177 1.394 10.542 1.00 . A A . 16 ALA O 1 1 4 2496 1 1 17 GLN C C -8.980 0.406 8.139 1.00 . A A . 17 GLN C 1 1 4 2497 1 1 17 GLN CA C -8.300 -0.571 9.089 1.00 . A A . 17 GLN CA 1 1 4 2498 1 1 17 GLN CB C -8.715 -2.020 8.812 1.00 . A A . 17 GLN CB 1 1 4 2499 1 1 17 GLN CD C -9.975 -3.555 7.287 1.00 . A A . 17 GLN CD 1 1 4 2500 1 1 17 GLN CG C -9.832 -2.108 7.761 1.00 . A A . 17 GLN CG 1 1 4 2501 1 1 17 GLN H H -9.436 -0.678 10.916 1.00 . A A . 17 GLN H 1 1 4 2502 1 1 17 GLN HA H -7.233 -0.475 8.988 1.00 . A A . 17 GLN HA 1 1 4 2503 1 1 17 GLN HB2 H -7.854 -2.560 8.460 1.00 . A A . 17 GLN HB2 1 1 4 2504 1 1 17 GLN HB3 H -9.061 -2.456 9.732 1.00 . A A . 17 GLN HB3 1 1 4 2505 1 1 17 GLN HE21 H -10.481 -3.048 5.435 1.00 . A A . 17 GLN HE21 1 1 4 2506 1 1 17 GLN HE22 H -10.411 -4.718 5.738 1.00 . A A . 17 GLN HE22 1 1 4 2507 1 1 17 GLN HG2 H -10.763 -1.779 8.198 1.00 . A A . 17 GLN HG2 1 1 4 2508 1 1 17 GLN HG3 H -9.587 -1.479 6.918 1.00 . A A . 17 GLN HG3 1 1 4 2509 1 1 17 GLN N N -8.692 -0.203 10.469 1.00 . A A . 17 GLN N 1 1 4 2510 1 1 17 GLN NE2 N -10.318 -3.794 6.051 1.00 . A A . 17 GLN NE2 1 1 4 2511 1 1 17 GLN O O -8.421 0.815 7.141 1.00 . A A . 17 GLN O 1 1 4 2512 1 1 17 GLN OE1 O -9.773 -4.479 8.051 1.00 . A A . 17 GLN OE1 1 1 4 2513 1 1 18 GLU C C -9.873 2.986 7.488 1.00 . A A . 18 GLU C 1 1 4 2514 1 1 18 GLU CA C -10.841 1.818 7.601 1.00 . A A . 18 GLU CA 1 1 4 2515 1 1 18 GLU CB C -12.149 2.281 8.248 1.00 . A A . 18 GLU CB 1 1 4 2516 1 1 18 GLU CD C -14.536 2.329 7.511 1.00 . A A . 18 GLU CD 1 1 4 2517 1 1 18 GLU CG C -13.113 2.768 7.164 1.00 . A A . 18 GLU CG 1 1 4 2518 1 1 18 GLU H H -10.587 0.519 9.301 1.00 . A A . 18 GLU H 1 1 4 2519 1 1 18 GLU HA H -11.033 1.393 6.626 1.00 . A A . 18 GLU HA 1 1 4 2520 1 1 18 GLU HB2 H -12.597 1.456 8.784 1.00 . A A . 18 GLU HB2 1 1 4 2521 1 1 18 GLU HB3 H -11.945 3.088 8.936 1.00 . A A . 18 GLU HB3 1 1 4 2522 1 1 18 GLU HG2 H -13.071 3.847 7.105 1.00 . A A . 18 GLU HG2 1 1 4 2523 1 1 18 GLU HG3 H -12.828 2.344 6.213 1.00 . A A . 18 GLU HG3 1 1 4 2524 1 1 18 GLU N N -10.169 0.824 8.468 1.00 . A A . 18 GLU N 1 1 4 2525 1 1 18 GLU O O -9.894 3.759 6.555 1.00 . A A . 18 GLU O 1 1 4 2526 1 1 18 GLU OE1 O -14.678 1.457 8.351 1.00 . A A . 18 GLU OE1 1 1 4 2527 1 1 18 GLU OE2 O -15.461 2.873 6.928 1.00 . A A . 18 GLU OE2 1 1 4 2528 1 1 19 LEU C C -6.699 3.648 8.002 1.00 . A A . 19 LEU C 1 1 4 2529 1 1 19 LEU CA C -8.025 4.154 8.528 1.00 . A A . 19 LEU CA 1 1 4 2530 1 1 19 LEU CB C -7.844 4.454 10.000 1.00 . A A . 19 LEU CB 1 1 4 2531 1 1 19 LEU CD1 C -6.626 6.573 9.708 1.00 . A A . 19 LEU CD1 1 1 4 2532 1 1 19 LEU CD2 C -9.148 6.506 9.564 1.00 . A A . 19 LEU CD2 1 1 4 2533 1 1 19 LEU CG C -7.908 5.927 10.247 1.00 . A A . 19 LEU CG 1 1 4 2534 1 1 19 LEU H H -9.049 2.476 9.209 1.00 . A A . 19 LEU H 1 1 4 2535 1 1 19 LEU HA H -8.346 5.022 7.991 1.00 . A A . 19 LEU HA 1 1 4 2536 1 1 19 LEU HB2 H -8.625 3.964 10.562 1.00 . A A . 19 LEU HB2 1 1 4 2537 1 1 19 LEU HB3 H -6.884 4.079 10.323 1.00 . A A . 19 LEU HB3 1 1 4 2538 1 1 19 LEU HD11 H -5.851 5.813 9.615 1.00 . A A . 19 LEU HD11 1 1 4 2539 1 1 19 LEU HD12 H -6.819 7.007 8.739 1.00 . A A . 19 LEU HD12 1 1 4 2540 1 1 19 LEU HD13 H -6.294 7.342 10.389 1.00 . A A . 19 LEU HD13 1 1 4 2541 1 1 19 LEU HD21 H -9.959 5.788 9.631 1.00 . A A . 19 LEU HD21 1 1 4 2542 1 1 19 LEU HD22 H -9.438 7.421 10.058 1.00 . A A . 19 LEU HD22 1 1 4 2543 1 1 19 LEU HD23 H -8.928 6.708 8.527 1.00 . A A . 19 LEU HD23 1 1 4 2544 1 1 19 LEU HG H -7.980 6.071 11.303 1.00 . A A . 19 LEU HG 1 1 4 2545 1 1 19 LEU N N -9.023 3.098 8.469 1.00 . A A . 19 LEU N 1 1 4 2546 1 1 19 LEU O O -5.861 4.411 7.568 1.00 . A A . 19 LEU O 1 1 4 2547 1 1 20 HIS C C -5.309 1.026 6.408 1.00 . A A . 20 HIS C 1 1 4 2548 1 1 20 HIS CA C -5.173 1.862 7.679 1.00 . A A . 20 HIS CA 1 1 4 2549 1 1 20 HIS CB C -4.647 1.055 8.835 1.00 . A A . 20 HIS CB 1 1 4 2550 1 1 20 HIS CD2 C -4.667 2.773 10.798 1.00 . A A . 20 HIS CD2 1 1 4 2551 1 1 20 HIS CE1 C -2.573 3.300 10.811 1.00 . A A . 20 HIS CE1 1 1 4 2552 1 1 20 HIS CG C -4.074 2.035 9.817 1.00 . A A . 20 HIS CG 1 1 4 2553 1 1 20 HIS H H -7.110 1.768 8.499 1.00 . A A . 20 HIS H 1 1 4 2554 1 1 20 HIS HA H -4.517 2.691 7.514 1.00 . A A . 20 HIS HA 1 1 4 2555 1 1 20 HIS HB2 H -5.463 0.501 9.295 1.00 . A A . 20 HIS HB2 1 1 4 2556 1 1 20 HIS HB3 H -3.898 0.384 8.497 1.00 . A A . 20 HIS HB3 1 1 4 2557 1 1 20 HIS HD1 H -2.059 2.087 9.214 1.00 . A A . 20 HIS HD1 1 1 4 2558 1 1 20 HIS HD2 H -5.719 2.782 10.999 1.00 . A A . 20 HIS HD2 1 1 4 2559 1 1 20 HIS HE1 H -1.625 3.756 11.061 1.00 . A A . 20 HIS HE1 1 1 4 2560 1 1 20 HIS N N -6.463 2.376 8.100 1.00 . A A . 20 HIS N 1 1 4 2561 1 1 20 HIS ND1 N -2.739 2.391 9.835 1.00 . A A . 20 HIS ND1 1 1 4 2562 1 1 20 HIS NE2 N -3.720 3.571 11.433 1.00 . A A . 20 HIS NE2 1 1 4 2563 1 1 20 HIS O O -4.789 1.386 5.372 1.00 . A A . 20 HIS O 1 1 4 2564 1 1 21 SER C C -6.371 -0.047 4.052 1.00 . A A . 21 SER C 1 1 4 2565 1 1 21 SER CA C -6.184 -0.919 5.260 1.00 . A A . 21 SER CA 1 1 4 2566 1 1 21 SER CB C -7.456 -1.735 5.372 1.00 . A A . 21 SER CB 1 1 4 2567 1 1 21 SER H H -6.417 -0.348 7.308 1.00 . A A . 21 SER H 1 1 4 2568 1 1 21 SER HA H -5.351 -1.557 5.135 1.00 . A A . 21 SER HA 1 1 4 2569 1 1 21 SER HB2 H -8.284 -1.070 5.564 1.00 . A A . 21 SER HB2 1 1 4 2570 1 1 21 SER HB3 H -7.629 -2.237 4.428 1.00 . A A . 21 SER HB3 1 1 4 2571 1 1 21 SER HG H -6.899 -3.460 6.079 1.00 . A A . 21 SER HG 1 1 4 2572 1 1 21 SER N N -6.006 -0.076 6.470 1.00 . A A . 21 SER N 1 1 4 2573 1 1 21 SER O O -5.797 -0.252 3.001 1.00 . A A . 21 SER O 1 1 4 2574 1 1 21 SER OG O -7.338 -2.680 6.426 1.00 . A A . 21 SER OG 1 1 4 2575 1 1 22 VAL C C -6.465 2.777 2.832 1.00 . A A . 22 VAL C 1 1 4 2576 1 1 22 VAL CA C -7.582 1.754 3.088 1.00 . A A . 22 VAL CA 1 1 4 2577 1 1 22 VAL CB C -8.890 2.451 3.453 1.00 . A A . 22 VAL CB 1 1 4 2578 1 1 22 VAL CG1 C -9.796 1.469 4.206 1.00 . A A . 22 VAL CG1 1 1 4 2579 1 1 22 VAL CG2 C -8.611 3.668 4.345 1.00 . A A . 22 VAL CG2 1 1 4 2580 1 1 22 VAL H H -7.717 0.982 5.036 1.00 . A A . 22 VAL H 1 1 4 2581 1 1 22 VAL HA H -7.737 1.136 2.224 1.00 . A A . 22 VAL HA 1 1 4 2582 1 1 22 VAL HB H -9.378 2.762 2.561 1.00 . A A . 22 VAL HB 1 1 4 2583 1 1 22 VAL HG11 H -9.365 0.475 4.162 1.00 . A A . 22 VAL HG11 1 1 4 2584 1 1 22 VAL HG12 H -9.877 1.777 5.238 1.00 . A A . 22 VAL HG12 1 1 4 2585 1 1 22 VAL HG13 H -10.775 1.459 3.753 1.00 . A A . 22 VAL HG13 1 1 4 2586 1 1 22 VAL HG21 H -7.930 4.336 3.841 1.00 . A A . 22 VAL HG21 1 1 4 2587 1 1 22 VAL HG22 H -9.537 4.185 4.547 1.00 . A A . 22 VAL HG22 1 1 4 2588 1 1 22 VAL HG23 H -8.171 3.341 5.278 1.00 . A A . 22 VAL HG23 1 1 4 2589 1 1 22 VAL N N -7.240 0.885 4.195 1.00 . A A . 22 VAL N 1 1 4 2590 1 1 22 VAL O O -6.068 3.010 1.707 1.00 . A A . 22 VAL O 1 1 4 2591 1 1 23 TYR C C -3.606 3.732 3.228 1.00 . A A . 23 TYR C 1 1 4 2592 1 1 23 TYR CA C -4.893 4.411 3.695 1.00 . A A . 23 TYR CA 1 1 4 2593 1 1 23 TYR CB C -4.645 5.107 5.032 1.00 . A A . 23 TYR CB 1 1 4 2594 1 1 23 TYR CD1 C -3.420 6.859 3.707 1.00 . A A . 23 TYR CD1 1 1 4 2595 1 1 23 TYR CD2 C -4.706 7.547 5.644 1.00 . A A . 23 TYR CD2 1 1 4 2596 1 1 23 TYR CE1 C -3.051 8.190 3.479 1.00 . A A . 23 TYR CE1 1 1 4 2597 1 1 23 TYR CE2 C -4.337 8.877 5.419 1.00 . A A . 23 TYR CE2 1 1 4 2598 1 1 23 TYR CG C -4.247 6.540 4.788 1.00 . A A . 23 TYR CG 1 1 4 2599 1 1 23 TYR CZ C -3.509 9.200 4.336 1.00 . A A . 23 TYR CZ 1 1 4 2600 1 1 23 TYR H H -6.305 3.204 4.763 1.00 . A A . 23 TYR H 1 1 4 2601 1 1 23 TYR HA H -5.203 5.138 2.964 1.00 . A A . 23 TYR HA 1 1 4 2602 1 1 23 TYR HB2 H -5.549 5.082 5.622 1.00 . A A . 23 TYR HB2 1 1 4 2603 1 1 23 TYR HB3 H -3.854 4.599 5.563 1.00 . A A . 23 TYR HB3 1 1 4 2604 1 1 23 TYR HD1 H -3.067 6.078 3.049 1.00 . A A . 23 TYR HD1 1 1 4 2605 1 1 23 TYR HD2 H -5.343 7.298 6.479 1.00 . A A . 23 TYR HD2 1 1 4 2606 1 1 23 TYR HE1 H -2.413 8.439 2.645 1.00 . A A . 23 TYR HE1 1 1 4 2607 1 1 23 TYR HE2 H -4.692 9.655 6.080 1.00 . A A . 23 TYR HE2 1 1 4 2608 1 1 23 TYR HH H -3.852 10.936 3.619 1.00 . A A . 23 TYR HH 1 1 4 2609 1 1 23 TYR N N -5.966 3.397 3.868 1.00 . A A . 23 TYR N 1 1 4 2610 1 1 23 TYR O O -3.167 3.919 2.110 1.00 . A A . 23 TYR O 1 1 4 2611 1 1 23 TYR OH O -3.145 10.513 4.112 1.00 . A A . 23 TYR OH 1 1 4 2612 1 1 24 MET C C -1.811 1.779 2.255 1.00 . A A . 24 MET C 1 1 4 2613 1 1 24 MET CA C -1.732 2.261 3.707 1.00 . A A . 24 MET CA 1 1 4 2614 1 1 24 MET CB C -1.517 1.060 4.630 1.00 . A A . 24 MET CB 1 1 4 2615 1 1 24 MET CE C -1.545 -1.869 6.016 1.00 . A A . 24 MET CE 1 1 4 2616 1 1 24 MET CG C -2.598 0.011 4.364 1.00 . A A . 24 MET CG 1 1 4 2617 1 1 24 MET H H -3.369 2.832 4.980 1.00 . A A . 24 MET H 1 1 4 2618 1 1 24 MET HA H -0.907 2.948 3.816 1.00 . A A . 24 MET HA 1 1 4 2619 1 1 24 MET HB2 H -0.543 0.632 4.441 1.00 . A A . 24 MET HB2 1 1 4 2620 1 1 24 MET HB3 H -1.576 1.381 5.659 1.00 . A A . 24 MET HB3 1 1 4 2621 1 1 24 MET HE1 H -0.864 -1.612 5.221 1.00 . A A . 24 MET HE1 1 1 4 2622 1 1 24 MET HE2 H -1.059 -1.709 6.969 1.00 . A A . 24 MET HE2 1 1 4 2623 1 1 24 MET HE3 H -1.831 -2.908 5.921 1.00 . A A . 24 MET HE3 1 1 4 2624 1 1 24 MET HG2 H -3.477 0.494 3.964 1.00 . A A . 24 MET HG2 1 1 4 2625 1 1 24 MET HG3 H -2.229 -0.712 3.651 1.00 . A A . 24 MET HG3 1 1 4 2626 1 1 24 MET N N -2.997 2.954 4.083 1.00 . A A . 24 MET N 1 1 4 2627 1 1 24 MET O O -0.811 1.673 1.572 1.00 . A A . 24 MET O 1 1 4 2628 1 1 24 MET SD S -3.020 -0.828 5.911 1.00 . A A . 24 MET SD 1 1 4 2629 1 1 25 SER C C -2.622 2.125 -0.574 1.00 . A A . 25 SER C 1 1 4 2630 1 1 25 SER CA C -3.123 1.027 0.365 1.00 . A A . 25 SER CA 1 1 4 2631 1 1 25 SER CB C -4.592 0.725 0.062 1.00 . A A . 25 SER CB 1 1 4 2632 1 1 25 SER H H -3.787 1.586 2.337 1.00 . A A . 25 SER H 1 1 4 2633 1 1 25 SER HA H -2.534 0.133 0.223 1.00 . A A . 25 SER HA 1 1 4 2634 1 1 25 SER HB2 H -5.009 0.126 0.854 1.00 . A A . 25 SER HB2 1 1 4 2635 1 1 25 SER HB3 H -5.141 1.655 -0.011 1.00 . A A . 25 SER HB3 1 1 4 2636 1 1 25 SER HG H -3.919 0.243 -1.698 1.00 . A A . 25 SER HG 1 1 4 2637 1 1 25 SER N N -2.991 1.492 1.774 1.00 . A A . 25 SER N 1 1 4 2638 1 1 25 SER O O -1.724 1.917 -1.367 1.00 . A A . 25 SER O 1 1 4 2639 1 1 25 SER OG O -4.681 0.010 -1.163 1.00 . A A . 25 SER OG 1 1 4 2640 1 1 26 GLY C C -1.326 4.821 -0.982 1.00 . A A . 26 GLY C 1 1 4 2641 1 1 26 GLY CA C -2.743 4.411 -1.367 1.00 . A A . 26 GLY CA 1 1 4 2642 1 1 26 GLY H H -3.908 3.444 0.165 1.00 . A A . 26 GLY H 1 1 4 2643 1 1 26 GLY HA2 H -3.400 5.255 -1.239 1.00 . A A . 26 GLY HA2 1 1 4 2644 1 1 26 GLY HA3 H -2.759 4.089 -2.395 1.00 . A A . 26 GLY HA3 1 1 4 2645 1 1 26 GLY N N -3.190 3.297 -0.486 1.00 . A A . 26 GLY N 1 1 4 2646 1 1 26 GLY O O -0.625 5.474 -1.727 1.00 . A A . 26 GLY O 1 1 4 2647 1 1 27 LEU C C 1.497 4.170 -0.294 1.00 . A A . 27 LEU C 1 1 4 2648 1 1 27 LEU CA C 0.459 4.789 0.646 1.00 . A A . 27 LEU CA 1 1 4 2649 1 1 27 LEU CB C 0.637 4.226 2.048 1.00 . A A . 27 LEU CB 1 1 4 2650 1 1 27 LEU CD1 C -0.825 5.603 3.532 1.00 . A A . 27 LEU CD1 1 1 4 2651 1 1 27 LEU CD2 C 1.474 4.976 4.278 1.00 . A A . 27 LEU CD2 1 1 4 2652 1 1 27 LEU CG C 0.614 5.361 3.073 1.00 . A A . 27 LEU CG 1 1 4 2653 1 1 27 LEU H H -1.494 3.916 0.766 1.00 . A A . 27 LEU H 1 1 4 2654 1 1 27 LEU HA H 0.572 5.861 0.667 1.00 . A A . 27 LEU HA 1 1 4 2655 1 1 27 LEU HB2 H -0.174 3.543 2.251 1.00 . A A . 27 LEU HB2 1 1 4 2656 1 1 27 LEU HB3 H 1.577 3.701 2.110 1.00 . A A . 27 LEU HB3 1 1 4 2657 1 1 27 LEU HD11 H -1.445 4.766 3.242 1.00 . A A . 27 LEU HD11 1 1 4 2658 1 1 27 LEU HD12 H -0.847 5.712 4.606 1.00 . A A . 27 LEU HD12 1 1 4 2659 1 1 27 LEU HD13 H -1.199 6.505 3.072 1.00 . A A . 27 LEU HD13 1 1 4 2660 1 1 27 LEU HD21 H 2.458 4.686 3.941 1.00 . A A . 27 LEU HD21 1 1 4 2661 1 1 27 LEU HD22 H 1.556 5.820 4.946 1.00 . A A . 27 LEU HD22 1 1 4 2662 1 1 27 LEU HD23 H 1.013 4.149 4.799 1.00 . A A . 27 LEU HD23 1 1 4 2663 1 1 27 LEU HG H 1.005 6.261 2.621 1.00 . A A . 27 LEU HG 1 1 4 2664 1 1 27 LEU N N -0.906 4.438 0.184 1.00 . A A . 27 LEU N 1 1 4 2665 1 1 27 LEU O O 2.174 4.861 -1.029 1.00 . A A . 27 LEU O 1 1 4 2666 1 1 28 TRP C C 2.132 2.168 -2.589 1.00 . A A . 28 TRP C 1 1 4 2667 1 1 28 TRP CA C 2.624 2.199 -1.144 1.00 . A A . 28 TRP CA 1 1 4 2668 1 1 28 TRP CB C 2.843 0.769 -0.654 1.00 . A A . 28 TRP CB 1 1 4 2669 1 1 28 TRP CD1 C 5.295 1.129 -0.940 1.00 . A A . 28 TRP CD1 1 1 4 2670 1 1 28 TRP CD2 C 4.681 -0.952 -1.515 1.00 . A A . 28 TRP CD2 1 1 4 2671 1 1 28 TRP CE2 C 6.079 -0.873 -1.719 1.00 . A A . 28 TRP CE2 1 1 4 2672 1 1 28 TRP CE3 C 4.035 -2.167 -1.804 1.00 . A A . 28 TRP CE3 1 1 4 2673 1 1 28 TRP CG C 4.217 0.337 -1.020 1.00 . A A . 28 TRP CG 1 1 4 2674 1 1 28 TRP CH2 C 6.153 -3.163 -2.475 1.00 . A A . 28 TRP CH2 1 1 4 2675 1 1 28 TRP CZ2 C 6.810 -1.962 -2.193 1.00 . A A . 28 TRP CZ2 1 1 4 2676 1 1 28 TRP CZ3 C 4.768 -3.266 -2.281 1.00 . A A . 28 TRP CZ3 1 1 4 2677 1 1 28 TRP H H 1.086 2.337 0.336 1.00 . A A . 28 TRP H 1 1 4 2678 1 1 28 TRP HA H 3.548 2.739 -1.098 1.00 . A A . 28 TRP HA 1 1 4 2679 1 1 28 TRP HB2 H 2.739 0.741 0.419 1.00 . A A . 28 TRP HB2 1 1 4 2680 1 1 28 TRP HB3 H 2.121 0.113 -1.111 1.00 . A A . 28 TRP HB3 1 1 4 2681 1 1 28 TRP HD1 H 5.284 2.153 -0.605 1.00 . A A . 28 TRP HD1 1 1 4 2682 1 1 28 TRP HE1 H 7.322 0.768 -1.391 1.00 . A A . 28 TRP HE1 1 1 4 2683 1 1 28 TRP HE3 H 2.968 -2.256 -1.658 1.00 . A A . 28 TRP HE3 1 1 4 2684 1 1 28 TRP HH2 H 6.712 -4.012 -2.841 1.00 . A A . 28 TRP HH2 1 1 4 2685 1 1 28 TRP HZ2 H 7.877 -1.878 -2.341 1.00 . A A . 28 TRP HZ2 1 1 4 2686 1 1 28 TRP HZ3 H 4.263 -4.195 -2.499 1.00 . A A . 28 TRP HZ3 1 1 4 2687 1 1 28 TRP N N 1.630 2.871 -0.268 1.00 . A A . 28 TRP N 1 1 4 2688 1 1 28 TRP NE1 N 6.408 0.418 -1.354 1.00 . A A . 28 TRP NE1 1 1 4 2689 1 1 28 TRP O O 2.769 1.606 -3.457 1.00 . A A . 28 TRP O 1 1 4 2690 1 1 29 LEU C C 0.917 4.078 -4.905 1.00 . A A . 29 LEU C 1 1 4 2691 1 1 29 LEU CA C 0.487 2.772 -4.230 1.00 . A A . 29 LEU CA 1 1 4 2692 1 1 29 LEU CB C -1.037 2.660 -4.144 1.00 . A A . 29 LEU CB 1 1 4 2693 1 1 29 LEU CD1 C -1.419 2.427 -6.586 1.00 . A A . 29 LEU CD1 1 1 4 2694 1 1 29 LEU CD2 C -3.192 3.396 -5.115 1.00 . A A . 29 LEU CD2 1 1 4 2695 1 1 29 LEU CG C -1.690 3.295 -5.361 1.00 . A A . 29 LEU CG 1 1 4 2696 1 1 29 LEU H H 0.512 3.212 -2.154 1.00 . A A . 29 LEU H 1 1 4 2697 1 1 29 LEU HA H 0.886 1.930 -4.778 1.00 . A A . 29 LEU HA 1 1 4 2698 1 1 29 LEU HB2 H -1.316 1.618 -4.094 1.00 . A A . 29 LEU HB2 1 1 4 2699 1 1 29 LEU HB3 H -1.380 3.164 -3.253 1.00 . A A . 29 LEU HB3 1 1 4 2700 1 1 29 LEU HD11 H -0.434 1.989 -6.500 1.00 . A A . 29 LEU HD11 1 1 4 2701 1 1 29 LEU HD12 H -2.159 1.643 -6.644 1.00 . A A . 29 LEU HD12 1 1 4 2702 1 1 29 LEU HD13 H -1.465 3.035 -7.478 1.00 . A A . 29 LEU HD13 1 1 4 2703 1 1 29 LEU HD21 H -3.371 3.457 -4.051 1.00 . A A . 29 LEU HD21 1 1 4 2704 1 1 29 LEU HD22 H -3.578 4.281 -5.598 1.00 . A A . 29 LEU HD22 1 1 4 2705 1 1 29 LEU HD23 H -3.684 2.522 -5.513 1.00 . A A . 29 LEU HD23 1 1 4 2706 1 1 29 LEU HG H -1.281 4.279 -5.514 1.00 . A A . 29 LEU HG 1 1 4 2707 1 1 29 LEU N N 1.013 2.763 -2.856 1.00 . A A . 29 LEU N 1 1 4 2708 1 1 29 LEU O O 1.723 4.083 -5.807 1.00 . A A . 29 LEU O 1 1 4 2709 1 1 30 PHE C C 2.275 6.664 -5.015 1.00 . A A . 30 PHE C 1 1 4 2710 1 1 30 PHE CA C 0.765 6.475 -5.097 1.00 . A A . 30 PHE CA 1 1 4 2711 1 1 30 PHE CB C 0.066 7.625 -4.376 1.00 . A A . 30 PHE CB 1 1 4 2712 1 1 30 PHE CD1 C -2.367 7.152 -4.837 1.00 . A A . 30 PHE CD1 1 1 4 2713 1 1 30 PHE CD2 C -1.312 9.028 -5.953 1.00 . A A . 30 PHE CD2 1 1 4 2714 1 1 30 PHE CE1 C -3.574 7.447 -5.482 1.00 . A A . 30 PHE CE1 1 1 4 2715 1 1 30 PHE CE2 C -2.519 9.324 -6.598 1.00 . A A . 30 PHE CE2 1 1 4 2716 1 1 30 PHE CG C -1.236 7.942 -5.072 1.00 . A A . 30 PHE CG 1 1 4 2717 1 1 30 PHE CZ C -3.650 8.533 -6.362 1.00 . A A . 30 PHE CZ 1 1 4 2718 1 1 30 PHE H H -0.264 5.175 -3.760 1.00 . A A . 30 PHE H 1 1 4 2719 1 1 30 PHE HA H 0.467 6.452 -6.113 1.00 . A A . 30 PHE HA 1 1 4 2720 1 1 30 PHE HB2 H -0.133 7.339 -3.353 1.00 . A A . 30 PHE HB2 1 1 4 2721 1 1 30 PHE HB3 H 0.703 8.496 -4.390 1.00 . A A . 30 PHE HB3 1 1 4 2722 1 1 30 PHE HD1 H -2.308 6.315 -4.158 1.00 . A A . 30 PHE HD1 1 1 4 2723 1 1 30 PHE HD2 H -0.439 9.638 -6.135 1.00 . A A . 30 PHE HD2 1 1 4 2724 1 1 30 PHE HE1 H -4.446 6.838 -5.299 1.00 . A A . 30 PHE HE1 1 1 4 2725 1 1 30 PHE HE2 H -2.577 10.162 -7.277 1.00 . A A . 30 PHE HE2 1 1 4 2726 1 1 30 PHE HZ H -4.582 8.761 -6.859 1.00 . A A . 30 PHE HZ 1 1 4 2727 1 1 30 PHE N N 0.386 5.189 -4.476 1.00 . A A . 30 PHE N 1 1 4 2728 1 1 30 PHE O O 2.856 7.465 -5.721 1.00 . A A . 30 PHE O 1 1 4 2729 1 1 31 SER C C 5.059 5.199 -5.097 1.00 . A A . 31 SER C 1 1 4 2730 1 1 31 SER CA C 4.386 6.044 -4.016 1.00 . A A . 31 SER CA 1 1 4 2731 1 1 31 SER CB C 4.807 5.538 -2.636 1.00 . A A . 31 SER CB 1 1 4 2732 1 1 31 SER H H 2.406 5.295 -3.616 1.00 . A A . 31 SER H 1 1 4 2733 1 1 31 SER HA H 4.680 7.076 -4.128 1.00 . A A . 31 SER HA 1 1 4 2734 1 1 31 SER HB2 H 4.744 6.342 -1.921 1.00 . A A . 31 SER HB2 1 1 4 2735 1 1 31 SER HB3 H 4.146 4.737 -2.330 1.00 . A A . 31 SER HB3 1 1 4 2736 1 1 31 SER HG H 6.731 5.823 -2.595 1.00 . A A . 31 SER HG 1 1 4 2737 1 1 31 SER N N 2.908 5.928 -4.161 1.00 . A A . 31 SER N 1 1 4 2738 1 1 31 SER O O 5.909 5.668 -5.828 1.00 . A A . 31 SER O 1 1 4 2739 1 1 31 SER OG O 6.146 5.068 -2.696 1.00 . A A . 31 SER OG 1 1 4 2740 1 1 32 ALA C C 4.810 3.545 -7.620 1.00 . A A . 32 ALA C 1 1 4 2741 1 1 32 ALA CA C 5.285 3.084 -6.251 1.00 . A A . 32 ALA CA 1 1 4 2742 1 1 32 ALA CB C 4.864 1.633 -6.011 1.00 . A A . 32 ALA CB 1 1 4 2743 1 1 32 ALA H H 3.983 3.601 -4.617 1.00 . A A . 32 ALA H 1 1 4 2744 1 1 32 ALA HA H 6.360 3.166 -6.215 1.00 . A A . 32 ALA HA 1 1 4 2745 1 1 32 ALA HB1 H 3.798 1.537 -6.162 1.00 . A A . 32 ALA HB1 1 1 4 2746 1 1 32 ALA HB2 H 5.386 0.987 -6.701 1.00 . A A . 32 ALA HB2 1 1 4 2747 1 1 32 ALA HB3 H 5.110 1.351 -4.996 1.00 . A A . 32 ALA HB3 1 1 4 2748 1 1 32 ALA N N 4.677 3.957 -5.211 1.00 . A A . 32 ALA N 1 1 4 2749 1 1 32 ALA O O 5.594 3.958 -8.439 1.00 . A A . 32 ALA O 1 1 4 2750 1 1 33 VAL C C 3.694 5.318 -9.483 1.00 . A A . 33 VAL C 1 1 4 2751 1 1 33 VAL CA C 3.048 3.983 -9.184 1.00 . A A . 33 VAL CA 1 1 4 2752 1 1 33 VAL CB C 1.567 4.203 -9.100 1.00 . A A . 33 VAL CB 1 1 4 2753 1 1 33 VAL CG1 C 0.979 4.349 -10.505 1.00 . A A . 33 VAL CG1 1 1 4 2754 1 1 33 VAL CG2 C 0.898 3.037 -8.371 1.00 . A A . 33 VAL CG2 1 1 4 2755 1 1 33 VAL H H 2.901 3.205 -7.202 1.00 . A A . 33 VAL H 1 1 4 2756 1 1 33 VAL HA H 3.283 3.274 -9.961 1.00 . A A . 33 VAL HA 1 1 4 2757 1 1 33 VAL HB H 1.424 5.105 -8.549 1.00 . A A . 33 VAL HB 1 1 4 2758 1 1 33 VAL HG11 H 1.402 3.597 -11.154 1.00 . A A . 33 VAL HG11 1 1 4 2759 1 1 33 VAL HG12 H -0.093 4.225 -10.461 1.00 . A A . 33 VAL HG12 1 1 4 2760 1 1 33 VAL HG13 H 1.211 5.330 -10.892 1.00 . A A . 33 VAL HG13 1 1 4 2761 1 1 33 VAL HG21 H 1.609 2.233 -8.248 1.00 . A A . 33 VAL HG21 1 1 4 2762 1 1 33 VAL HG22 H 0.558 3.369 -7.401 1.00 . A A . 33 VAL HG22 1 1 4 2763 1 1 33 VAL HG23 H 0.055 2.686 -8.949 1.00 . A A . 33 VAL HG23 1 1 4 2764 1 1 33 VAL N N 3.537 3.512 -7.874 1.00 . A A . 33 VAL N 1 1 4 2765 1 1 33 VAL O O 4.108 5.558 -10.583 1.00 . A A . 33 VAL O 1 1 4 2766 1 1 34 ALA C C 5.799 7.261 -9.310 1.00 . A A . 34 ALA C 1 1 4 2767 1 1 34 ALA CA C 4.413 7.514 -8.759 1.00 . A A . 34 ALA CA 1 1 4 2768 1 1 34 ALA CB C 4.549 8.303 -7.465 1.00 . A A . 34 ALA CB 1 1 4 2769 1 1 34 ALA H H 3.427 5.977 -7.617 1.00 . A A . 34 ALA H 1 1 4 2770 1 1 34 ALA HA H 3.829 8.072 -9.473 1.00 . A A . 34 ALA HA 1 1 4 2771 1 1 34 ALA HB1 H 4.870 7.643 -6.673 1.00 . A A . 34 ALA HB1 1 1 4 2772 1 1 34 ALA HB2 H 5.287 9.082 -7.608 1.00 . A A . 34 ALA HB2 1 1 4 2773 1 1 34 ALA HB3 H 3.599 8.747 -7.211 1.00 . A A . 34 ALA HB3 1 1 4 2774 1 1 34 ALA N N 3.777 6.193 -8.507 1.00 . A A . 34 ALA N 1 1 4 2775 1 1 34 ALA O O 6.206 7.853 -10.283 1.00 . A A . 34 ALA O 1 1 4 2776 1 1 35 ILE C C 7.854 5.978 -10.670 1.00 . A A . 35 ILE C 1 1 4 2777 1 1 35 ILE CA C 7.857 6.010 -9.160 1.00 . A A . 35 ILE CA 1 1 4 2778 1 1 35 ILE CB C 8.136 4.615 -8.611 1.00 . A A . 35 ILE CB 1 1 4 2779 1 1 35 ILE CD1 C 9.726 3.763 -6.928 1.00 . A A . 35 ILE CD1 1 1 4 2780 1 1 35 ILE CG1 C 9.572 4.544 -8.232 1.00 . A A . 35 ILE CG1 1 1 4 2781 1 1 35 ILE CG2 C 7.850 3.549 -9.660 1.00 . A A . 35 ILE CG2 1 1 4 2782 1 1 35 ILE H H 6.171 5.883 -7.929 1.00 . A A . 35 ILE H 1 1 4 2783 1 1 35 ILE HA H 8.587 6.710 -8.792 1.00 . A A . 35 ILE HA 1 1 4 2784 1 1 35 ILE HB H 7.517 4.442 -7.749 1.00 . A A . 35 ILE HB 1 1 4 2785 1 1 35 ILE HD11 H 8.962 4.078 -6.230 1.00 . A A . 35 ILE HD11 1 1 4 2786 1 1 35 ILE HD12 H 9.620 2.707 -7.126 1.00 . A A . 35 ILE HD12 1 1 4 2787 1 1 35 ILE HD13 H 10.701 3.956 -6.506 1.00 . A A . 35 ILE HD13 1 1 4 2788 1 1 35 ILE HG12 H 10.106 4.055 -9.033 1.00 . A A . 35 ILE HG12 1 1 4 2789 1 1 35 ILE HG13 H 9.927 5.548 -8.101 1.00 . A A . 35 ILE HG13 1 1 4 2790 1 1 35 ILE HG21 H 8.472 3.733 -10.525 1.00 . A A . 35 ILE HG21 1 1 4 2791 1 1 35 ILE HG22 H 8.065 2.573 -9.255 1.00 . A A . 35 ILE HG22 1 1 4 2792 1 1 35 ILE HG23 H 6.819 3.606 -9.948 1.00 . A A . 35 ILE HG23 1 1 4 2793 1 1 35 ILE N N 6.521 6.359 -8.696 1.00 . A A . 35 ILE N 1 1 4 2794 1 1 35 ILE O O 8.775 6.408 -11.335 1.00 . A A . 35 ILE O 1 1 4 2795 1 1 36 VAL C C 6.151 6.648 -13.209 1.00 . A A . 36 VAL C 1 1 4 2796 1 1 36 VAL CA C 6.706 5.342 -12.668 1.00 . A A . 36 VAL CA 1 1 4 2797 1 1 36 VAL CB C 5.814 4.163 -13.005 1.00 . A A . 36 VAL CB 1 1 4 2798 1 1 36 VAL CG1 C 5.982 3.796 -14.478 1.00 . A A . 36 VAL CG1 1 1 4 2799 1 1 36 VAL CG2 C 6.251 2.996 -12.119 1.00 . A A . 36 VAL CG2 1 1 4 2800 1 1 36 VAL H H 6.075 5.093 -10.613 1.00 . A A . 36 VAL H 1 1 4 2801 1 1 36 VAL HA H 7.689 5.175 -13.072 1.00 . A A . 36 VAL HA 1 1 4 2802 1 1 36 VAL HB H 4.783 4.412 -12.801 1.00 . A A . 36 VAL HB 1 1 4 2803 1 1 36 VAL HG11 H 6.790 4.374 -14.902 1.00 . A A . 36 VAL HG11 1 1 4 2804 1 1 36 VAL HG12 H 6.207 2.744 -14.564 1.00 . A A . 36 VAL HG12 1 1 4 2805 1 1 36 VAL HG13 H 5.067 4.014 -15.008 1.00 . A A . 36 VAL HG13 1 1 4 2806 1 1 36 VAL HG21 H 7.289 3.135 -11.825 1.00 . A A . 36 VAL HG21 1 1 4 2807 1 1 36 VAL HG22 H 5.633 2.968 -11.234 1.00 . A A . 36 VAL HG22 1 1 4 2808 1 1 36 VAL HG23 H 6.150 2.068 -12.661 1.00 . A A . 36 VAL HG23 1 1 4 2809 1 1 36 VAL N N 6.805 5.443 -11.200 1.00 . A A . 36 VAL N 1 1 4 2810 1 1 36 VAL O O 6.555 7.133 -14.245 1.00 . A A . 36 VAL O 1 1 4 2811 1 1 37 ALA C C 5.909 9.439 -13.244 1.00 . A A . 37 ALA C 1 1 4 2812 1 1 37 ALA CA C 4.718 8.541 -12.927 1.00 . A A . 37 ALA CA 1 1 4 2813 1 1 37 ALA CB C 3.879 9.163 -11.807 1.00 . A A . 37 ALA CB 1 1 4 2814 1 1 37 ALA H H 4.973 6.866 -11.658 1.00 . A A . 37 ALA H 1 1 4 2815 1 1 37 ALA HA H 4.117 8.394 -13.800 1.00 . A A . 37 ALA HA 1 1 4 2816 1 1 37 ALA HB1 H 4.531 9.511 -11.020 1.00 . A A . 37 ALA HB1 1 1 4 2817 1 1 37 ALA HB2 H 3.315 9.995 -12.201 1.00 . A A . 37 ALA HB2 1 1 4 2818 1 1 37 ALA HB3 H 3.200 8.420 -11.413 1.00 . A A . 37 ALA HB3 1 1 4 2819 1 1 37 ALA N N 5.259 7.249 -12.489 1.00 . A A . 37 ALA N 1 1 4 2820 1 1 37 ALA O O 5.822 10.354 -14.035 1.00 . A A . 37 ALA O 1 1 4 2821 1 1 38 HIS C C 8.960 9.419 -14.134 1.00 . A A . 38 HIS C 1 1 4 2822 1 1 38 HIS CA C 8.244 9.981 -12.905 1.00 . A A . 38 HIS CA 1 1 4 2823 1 1 38 HIS CB C 9.188 9.935 -11.701 1.00 . A A . 38 HIS CB 1 1 4 2824 1 1 38 HIS CD2 C 7.306 10.527 -9.965 1.00 . A A . 38 HIS CD2 1 1 4 2825 1 1 38 HIS CE1 C 7.794 9.048 -8.458 1.00 . A A . 38 HIS CE1 1 1 4 2826 1 1 38 HIS CG C 8.388 9.824 -10.433 1.00 . A A . 38 HIS CG 1 1 4 2827 1 1 38 HIS H H 7.084 8.408 -12.000 1.00 . A A . 38 HIS H 1 1 4 2828 1 1 38 HIS HA H 7.948 10.996 -13.095 1.00 . A A . 38 HIS HA 1 1 4 2829 1 1 38 HIS HB2 H 9.841 9.079 -11.789 1.00 . A A . 38 HIS HB2 1 1 4 2830 1 1 38 HIS HB3 H 9.779 10.838 -11.674 1.00 . A A . 38 HIS HB3 1 1 4 2831 1 1 38 HIS HD1 H 9.403 8.222 -9.488 1.00 . A A . 38 HIS HD1 1 1 4 2832 1 1 38 HIS HD2 H 6.819 11.338 -10.486 1.00 . A A . 38 HIS HD2 1 1 4 2833 1 1 38 HIS HE1 H 7.780 8.453 -7.557 1.00 . A A . 38 HIS HE1 1 1 4 2834 1 1 38 HIS N N 7.035 9.162 -12.633 1.00 . A A . 38 HIS N 1 1 4 2835 1 1 38 HIS ND1 N 8.681 8.885 -9.456 1.00 . A A . 38 HIS ND1 1 1 4 2836 1 1 38 HIS NE2 N 6.933 10.036 -8.717 1.00 . A A . 38 HIS NE2 1 1 4 2837 1 1 38 HIS O O 9.153 10.103 -15.118 1.00 . A A . 38 HIS O 1 1 4 2838 1 1 39 LEU C C 9.069 7.448 -16.420 1.00 . A A . 39 LEU C 1 1 4 2839 1 1 39 LEU CA C 10.048 7.566 -15.251 1.00 . A A . 39 LEU CA 1 1 4 2840 1 1 39 LEU CB C 10.557 6.172 -14.874 1.00 . A A . 39 LEU CB 1 1 4 2841 1 1 39 LEU CD1 C 11.683 4.829 -13.095 1.00 . A A . 39 LEU CD1 1 1 4 2842 1 1 39 LEU CD2 C 12.609 7.053 -13.755 1.00 . A A . 39 LEU CD2 1 1 4 2843 1 1 39 LEU CG C 11.326 6.244 -13.553 1.00 . A A . 39 LEU CG 1 1 4 2844 1 1 39 LEU H H 9.182 7.640 -13.284 1.00 . A A . 39 LEU H 1 1 4 2845 1 1 39 LEU HA H 10.878 8.188 -15.537 1.00 . A A . 39 LEU HA 1 1 4 2846 1 1 39 LEU HB2 H 9.718 5.500 -14.766 1.00 . A A . 39 LEU HB2 1 1 4 2847 1 1 39 LEU HB3 H 11.213 5.807 -15.650 1.00 . A A . 39 LEU HB3 1 1 4 2848 1 1 39 LEU HD11 H 11.963 4.232 -13.951 1.00 . A A . 39 LEU HD11 1 1 4 2849 1 1 39 LEU HD12 H 12.509 4.872 -12.401 1.00 . A A . 39 LEU HD12 1 1 4 2850 1 1 39 LEU HD13 H 10.828 4.381 -12.610 1.00 . A A . 39 LEU HD13 1 1 4 2851 1 1 39 LEU HD21 H 12.365 8.015 -14.181 1.00 . A A . 39 LEU HD21 1 1 4 2852 1 1 39 LEU HD22 H 13.099 7.195 -12.803 1.00 . A A . 39 LEU HD22 1 1 4 2853 1 1 39 LEU HD23 H 13.269 6.521 -14.424 1.00 . A A . 39 LEU HD23 1 1 4 2854 1 1 39 LEU HG H 10.712 6.719 -12.803 1.00 . A A . 39 LEU HG 1 1 4 2855 1 1 39 LEU N N 9.350 8.174 -14.085 1.00 . A A . 39 LEU N 1 1 4 2856 1 1 39 LEU O O 9.250 8.058 -17.452 1.00 . A A . 39 LEU O 1 1 4 2857 1 1 40 ALA C C 6.833 7.768 -18.134 1.00 . A A . 40 ALA C 1 1 4 2858 1 1 40 ALA CA C 7.030 6.471 -17.343 1.00 . A A . 40 ALA CA 1 1 4 2859 1 1 40 ALA CB C 5.694 6.068 -16.721 1.00 . A A . 40 ALA CB 1 1 4 2860 1 1 40 ALA H H 7.937 6.173 -15.413 1.00 . A A . 40 ALA H 1 1 4 2861 1 1 40 ALA HA H 7.361 5.690 -18.009 1.00 . A A . 40 ALA HA 1 1 4 2862 1 1 40 ALA HB1 H 5.847 5.784 -15.692 1.00 . A A . 40 ALA HB1 1 1 4 2863 1 1 40 ALA HB2 H 5.278 5.235 -17.269 1.00 . A A . 40 ALA HB2 1 1 4 2864 1 1 40 ALA HB3 H 5.011 6.905 -16.765 1.00 . A A . 40 ALA HB3 1 1 4 2865 1 1 40 ALA N N 8.042 6.657 -16.256 1.00 . A A . 40 ALA N 1 1 4 2866 1 1 40 ALA O O 6.841 7.768 -19.347 1.00 . A A . 40 ALA O 1 1 4 2867 1 1 41 VAL C C 7.507 10.343 -19.253 1.00 . A A . 41 VAL C 1 1 4 2868 1 1 41 VAL CA C 6.426 10.158 -18.186 1.00 . A A . 41 VAL CA 1 1 4 2869 1 1 41 VAL CB C 6.478 11.316 -17.191 1.00 . A A . 41 VAL CB 1 1 4 2870 1 1 41 VAL CG1 C 6.555 12.642 -17.950 1.00 . A A . 41 VAL CG1 1 1 4 2871 1 1 41 VAL CG2 C 5.211 11.295 -16.333 1.00 . A A . 41 VAL CG2 1 1 4 2872 1 1 41 VAL H H 6.625 8.851 -16.480 1.00 . A A . 41 VAL H 1 1 4 2873 1 1 41 VAL HA H 5.457 10.140 -18.662 1.00 . A A . 41 VAL HA 1 1 4 2874 1 1 41 VAL HB H 7.346 11.211 -16.558 1.00 . A A . 41 VAL HB 1 1 4 2875 1 1 41 VAL HG11 H 6.195 12.501 -18.959 1.00 . A A . 41 VAL HG11 1 1 4 2876 1 1 41 VAL HG12 H 5.945 13.380 -17.451 1.00 . A A . 41 VAL HG12 1 1 4 2877 1 1 41 VAL HG13 H 7.580 12.981 -17.978 1.00 . A A . 41 VAL HG13 1 1 4 2878 1 1 41 VAL HG21 H 4.968 10.273 -16.077 1.00 . A A . 41 VAL HG21 1 1 4 2879 1 1 41 VAL HG22 H 5.378 11.863 -15.430 1.00 . A A . 41 VAL HG22 1 1 4 2880 1 1 41 VAL HG23 H 4.394 11.732 -16.887 1.00 . A A . 41 VAL HG23 1 1 4 2881 1 1 41 VAL N N 6.640 8.871 -17.461 1.00 . A A . 41 VAL N 1 1 4 2882 1 1 41 VAL O O 7.215 10.570 -20.409 1.00 . A A . 41 VAL O 1 1 4 2883 1 1 42 TYR C C 9.743 9.305 -20.919 1.00 . A A . 42 TYR C 1 1 4 2884 1 1 42 TYR CA C 9.844 10.419 -19.876 1.00 . A A . 42 TYR CA 1 1 4 2885 1 1 42 TYR CB C 11.199 10.342 -19.168 1.00 . A A . 42 TYR CB 1 1 4 2886 1 1 42 TYR CD1 C 10.746 11.761 -17.130 1.00 . A A . 42 TYR CD1 1 1 4 2887 1 1 42 TYR CD2 C 12.279 12.593 -18.815 1.00 . A A . 42 TYR CD2 1 1 4 2888 1 1 42 TYR CE1 C 10.944 12.924 -16.375 1.00 . A A . 42 TYR CE1 1 1 4 2889 1 1 42 TYR CE2 C 12.477 13.755 -18.060 1.00 . A A . 42 TYR CE2 1 1 4 2890 1 1 42 TYR CG C 11.413 11.595 -18.351 1.00 . A A . 42 TYR CG 1 1 4 2891 1 1 42 TYR CZ C 11.809 13.921 -16.841 1.00 . A A . 42 TYR CZ 1 1 4 2892 1 1 42 TYR H H 8.970 10.070 -17.943 1.00 . A A . 42 TYR H 1 1 4 2893 1 1 42 TYR HA H 9.742 11.378 -20.361 1.00 . A A . 42 TYR HA 1 1 4 2894 1 1 42 TYR HB2 H 11.217 9.480 -18.517 1.00 . A A . 42 TYR HB2 1 1 4 2895 1 1 42 TYR HB3 H 11.985 10.255 -19.904 1.00 . A A . 42 TYR HB3 1 1 4 2896 1 1 42 TYR HD1 H 10.077 10.992 -16.769 1.00 . A A . 42 TYR HD1 1 1 4 2897 1 1 42 TYR HD2 H 12.794 12.466 -19.755 1.00 . A A . 42 TYR HD2 1 1 4 2898 1 1 42 TYR HE1 H 10.429 13.052 -15.435 1.00 . A A . 42 TYR HE1 1 1 4 2899 1 1 42 TYR HE2 H 13.146 14.524 -18.419 1.00 . A A . 42 TYR HE2 1 1 4 2900 1 1 42 TYR HH H 12.889 15.391 -16.278 1.00 . A A . 42 TYR HH 1 1 4 2901 1 1 42 TYR N N 8.753 10.251 -18.877 1.00 . A A . 42 TYR N 1 1 4 2902 1 1 42 TYR O O 9.832 9.541 -22.107 1.00 . A A . 42 TYR O 1 1 4 2903 1 1 42 TYR OH O 12.005 15.067 -16.097 1.00 . A A . 42 TYR OH 1 1 4 2904 1 1 43 ILE C C 8.095 7.080 -22.199 1.00 . A A . 43 ILE C 1 1 4 2905 1 1 43 ILE CA C 9.421 6.958 -21.438 1.00 . A A . 43 ILE CA 1 1 4 2906 1 1 43 ILE CB C 9.455 5.637 -20.661 1.00 . A A . 43 ILE CB 1 1 4 2907 1 1 43 ILE CD1 C 10.907 4.208 -19.214 1.00 . A A . 43 ILE CD1 1 1 4 2908 1 1 43 ILE CG1 C 10.900 5.317 -20.268 1.00 . A A . 43 ILE CG1 1 1 4 2909 1 1 43 ILE CG2 C 8.903 4.503 -21.528 1.00 . A A . 43 ILE CG2 1 1 4 2910 1 1 43 ILE H H 9.468 7.927 -19.517 1.00 . A A . 43 ILE H 1 1 4 2911 1 1 43 ILE HA H 10.244 6.986 -22.139 1.00 . A A . 43 ILE HA 1 1 4 2912 1 1 43 ILE HB H 8.852 5.732 -19.769 1.00 . A A . 43 ILE HB 1 1 4 2913 1 1 43 ILE HD11 H 10.014 4.276 -18.611 1.00 . A A . 43 ILE HD11 1 1 4 2914 1 1 43 ILE HD12 H 10.939 3.246 -19.703 1.00 . A A . 43 ILE HD12 1 1 4 2915 1 1 43 ILE HD13 H 11.776 4.319 -18.582 1.00 . A A . 43 ILE HD13 1 1 4 2916 1 1 43 ILE HG12 H 11.445 4.990 -21.140 1.00 . A A . 43 ILE HG12 1 1 4 2917 1 1 43 ILE HG13 H 11.366 6.201 -19.861 1.00 . A A . 43 ILE HG13 1 1 4 2918 1 1 43 ILE HG21 H 9.084 4.725 -22.569 1.00 . A A . 43 ILE HG21 1 1 4 2919 1 1 43 ILE HG22 H 9.394 3.578 -21.266 1.00 . A A . 43 ILE HG22 1 1 4 2920 1 1 43 ILE HG23 H 7.839 4.407 -21.360 1.00 . A A . 43 ILE HG23 1 1 4 2921 1 1 43 ILE N N 9.544 8.092 -20.479 1.00 . A A . 43 ILE N 1 1 4 2922 1 1 43 ILE O O 7.814 6.317 -23.101 1.00 . A A . 43 ILE O 1 1 4 2923 1 1 44 TRP C C 5.995 9.504 -23.340 1.00 . A A . 44 TRP C 1 1 4 2924 1 1 44 TRP CA C 5.973 8.206 -22.536 1.00 . A A . 44 TRP CA 1 1 4 2925 1 1 44 TRP CB C 4.848 8.269 -21.501 1.00 . A A . 44 TRP CB 1 1 4 2926 1 1 44 TRP CD1 C 4.602 5.862 -20.775 1.00 . A A . 44 TRP CD1 1 1 4 2927 1 1 44 TRP CD2 C 2.881 6.564 -22.042 1.00 . A A . 44 TRP CD2 1 1 4 2928 1 1 44 TRP CE2 C 2.616 5.214 -21.709 1.00 . A A . 44 TRP CE2 1 1 4 2929 1 1 44 TRP CE3 C 1.945 7.247 -22.840 1.00 . A A . 44 TRP CE3 1 1 4 2930 1 1 44 TRP CG C 4.148 6.951 -21.437 1.00 . A A . 44 TRP CG 1 1 4 2931 1 1 44 TRP CH2 C 0.542 5.259 -22.943 1.00 . A A . 44 TRP CH2 1 1 4 2932 1 1 44 TRP CZ2 C 1.462 4.565 -22.152 1.00 . A A . 44 TRP CZ2 1 1 4 2933 1 1 44 TRP CZ3 C 0.783 6.596 -23.287 1.00 . A A . 44 TRP CZ3 1 1 4 2934 1 1 44 TRP H H 7.523 8.636 -21.110 1.00 . A A . 44 TRP H 1 1 4 2935 1 1 44 TRP HA H 5.808 7.374 -23.203 1.00 . A A . 44 TRP HA 1 1 4 2936 1 1 44 TRP HB2 H 5.263 8.503 -20.533 1.00 . A A . 44 TRP HB2 1 1 4 2937 1 1 44 TRP HB3 H 4.143 9.037 -21.784 1.00 . A A . 44 TRP HB3 1 1 4 2938 1 1 44 TRP HD1 H 5.522 5.806 -20.213 1.00 . A A . 44 TRP HD1 1 1 4 2939 1 1 44 TRP HE1 H 3.785 3.932 -20.556 1.00 . A A . 44 TRP HE1 1 1 4 2940 1 1 44 TRP HE3 H 2.120 8.277 -23.111 1.00 . A A . 44 TRP HE3 1 1 4 2941 1 1 44 TRP HH2 H -0.353 4.764 -23.290 1.00 . A A . 44 TRP HH2 1 1 4 2942 1 1 44 TRP HZ2 H 1.282 3.535 -21.884 1.00 . A A . 44 TRP HZ2 1 1 4 2943 1 1 44 TRP HZ3 H 0.071 7.130 -23.900 1.00 . A A . 44 TRP HZ3 1 1 4 2944 1 1 44 TRP N N 7.278 8.033 -21.839 1.00 . A A . 44 TRP N 1 1 4 2945 1 1 44 TRP NE1 N 3.693 4.831 -20.936 1.00 . A A . 44 TRP NE1 1 1 4 2946 1 1 44 TRP O O 4.970 9.999 -23.767 1.00 . A A . 44 TRP O 1 1 4 2947 1 1 45 ARG C C 6.461 11.150 -25.640 1.00 . A A . 45 ARG C 1 1 4 2948 1 1 45 ARG CA C 7.246 11.321 -24.335 1.00 . A A . 45 ARG CA 1 1 4 2949 1 1 45 ARG CB C 8.717 11.616 -24.635 1.00 . A A . 45 ARG CB 1 1 4 2950 1 1 45 ARG CD C 9.622 12.701 -22.574 1.00 . A A . 45 ARG CD 1 1 4 2951 1 1 45 ARG CG C 9.112 12.948 -23.996 1.00 . A A . 45 ARG CG 1 1 4 2952 1 1 45 ARG CZ C 8.686 14.278 -20.991 1.00 . A A . 45 ARG CZ 1 1 4 2953 1 1 45 ARG H H 7.968 9.638 -23.201 1.00 . A A . 45 ARG H 1 1 4 2954 1 1 45 ARG HA H 6.822 12.131 -23.761 1.00 . A A . 45 ARG HA 1 1 4 2955 1 1 45 ARG HB2 H 9.332 10.826 -24.226 1.00 . A A . 45 ARG HB2 1 1 4 2956 1 1 45 ARG HB3 H 8.865 11.671 -25.703 1.00 . A A . 45 ARG HB3 1 1 4 2957 1 1 45 ARG HD2 H 8.965 12.006 -22.072 1.00 . A A . 45 ARG HD2 1 1 4 2958 1 1 45 ARG HD3 H 10.619 12.289 -22.616 1.00 . A A . 45 ARG HD3 1 1 4 2959 1 1 45 ARG HE H 10.386 14.619 -21.958 1.00 . A A . 45 ARG HE 1 1 4 2960 1 1 45 ARG HG2 H 9.891 13.413 -24.583 1.00 . A A . 45 ARG HG2 1 1 4 2961 1 1 45 ARG HG3 H 8.251 13.600 -23.959 1.00 . A A . 45 ARG HG3 1 1 4 2962 1 1 45 ARG HH11 H 7.269 13.362 -22.067 1.00 . A A . 45 ARG HH11 1 1 4 2963 1 1 45 ARG HH12 H 6.730 14.108 -20.599 1.00 . A A . 45 ARG HH12 1 1 4 2964 1 1 45 ARG HH21 H 9.878 15.261 -19.717 1.00 . A A . 45 ARG HH21 1 1 4 2965 1 1 45 ARG HH22 H 8.207 15.181 -19.268 1.00 . A A . 45 ARG HH22 1 1 4 2966 1 1 45 ARG N N 7.155 10.057 -23.553 1.00 . A A . 45 ARG N 1 1 4 2967 1 1 45 ARG NE N 9.648 13.989 -21.824 1.00 . A A . 45 ARG NE 1 1 4 2968 1 1 45 ARG NH1 N 7.466 13.885 -21.238 1.00 . A A . 45 ARG NH1 1 1 4 2969 1 1 45 ARG NH2 N 8.944 14.960 -19.907 1.00 . A A . 45 ARG NH2 1 1 4 2970 1 1 45 ARG O O 5.912 10.096 -25.893 1.00 . A A . 45 ARG O 1 1 4 2971 1 1 46 PRO C C 6.481 11.382 -28.763 1.00 . A A . 46 PRO C 1 1 4 2972 1 1 46 PRO CA C 5.697 12.174 -27.714 1.00 . A A . 46 PRO CA 1 1 4 2973 1 1 46 PRO CB C 5.593 13.654 -28.091 1.00 . A A . 46 PRO CB 1 1 4 2974 1 1 46 PRO CD C 7.095 13.472 -26.132 1.00 . A A . 46 PRO CD 1 1 4 2975 1 1 46 PRO CG C 6.718 14.381 -27.318 1.00 . A A . 46 PRO CG 1 1 4 2976 1 1 46 PRO HB2 H 5.731 13.775 -29.157 1.00 . A A . 46 PRO HB2 1 1 4 2977 1 1 46 PRO HB3 H 4.634 14.047 -27.792 1.00 . A A . 46 PRO HB3 1 1 4 2978 1 1 46 PRO HD2 H 8.166 13.341 -26.090 1.00 . A A . 46 PRO HD2 1 1 4 2979 1 1 46 PRO HD3 H 6.724 13.882 -25.207 1.00 . A A . 46 PRO HD3 1 1 4 2980 1 1 46 PRO HG2 H 7.573 14.527 -27.964 1.00 . A A . 46 PRO HG2 1 1 4 2981 1 1 46 PRO HG3 H 6.363 15.330 -26.951 1.00 . A A . 46 PRO HG3 1 1 4 2982 1 1 46 PRO N N 6.421 12.192 -26.432 1.00 . A A . 46 PRO N 1 1 4 2983 1 1 46 PRO O O 7.575 11.746 -29.144 1.00 . A A . 46 PRO O 1 1 4 2984 1 1 47 TRP C C 5.591 8.858 -31.188 1.00 . A A . 47 TRP C 1 1 4 2985 1 1 47 TRP CA C 6.626 9.469 -30.246 1.00 . A A . 47 TRP CA 1 1 4 2986 1 1 47 TRP CB C 7.404 8.352 -29.546 1.00 . A A . 47 TRP CB 1 1 4 2987 1 1 47 TRP CD1 C 8.002 8.689 -27.110 1.00 . A A . 47 TRP CD1 1 1 4 2988 1 1 47 TRP CD2 C 9.345 9.842 -28.501 1.00 . A A . 47 TRP CD2 1 1 4 2989 1 1 47 TRP CE2 C 9.788 10.120 -27.187 1.00 . A A . 47 TRP CE2 1 1 4 2990 1 1 47 TRP CE3 C 10.025 10.447 -29.573 1.00 . A A . 47 TRP CE3 1 1 4 2991 1 1 47 TRP CG C 8.209 8.931 -28.426 1.00 . A A . 47 TRP CG 1 1 4 2992 1 1 47 TRP CH2 C 11.534 11.562 -28.020 1.00 . A A . 47 TRP CH2 1 1 4 2993 1 1 47 TRP CZ2 C 10.868 10.969 -26.944 1.00 . A A . 47 TRP CZ2 1 1 4 2994 1 1 47 TRP CZ3 C 11.113 11.302 -29.332 1.00 . A A . 47 TRP CZ3 1 1 4 2995 1 1 47 TRP H H 5.040 10.021 -28.903 1.00 . A A . 47 TRP H 1 1 4 2996 1 1 47 TRP HA H 7.309 10.089 -30.809 1.00 . A A . 47 TRP HA 1 1 4 2997 1 1 47 TRP HB2 H 6.711 7.624 -29.152 1.00 . A A . 47 TRP HB2 1 1 4 2998 1 1 47 TRP HB3 H 8.064 7.874 -30.255 1.00 . A A . 47 TRP HB3 1 1 4 2999 1 1 47 TRP HD1 H 7.231 8.051 -26.700 1.00 . A A . 47 TRP HD1 1 1 4 3000 1 1 47 TRP HE1 H 9.006 9.393 -25.397 1.00 . A A . 47 TRP HE1 1 1 4 3001 1 1 47 TRP HE3 H 9.709 10.254 -30.588 1.00 . A A . 47 TRP HE3 1 1 4 3002 1 1 47 TRP HH2 H 12.370 12.220 -27.841 1.00 . A A . 47 TRP HH2 1 1 4 3003 1 1 47 TRP HZ2 H 11.188 11.165 -25.931 1.00 . A A . 47 TRP HZ2 1 1 4 3004 1 1 47 TRP HZ3 H 11.629 11.762 -30.162 1.00 . A A . 47 TRP HZ3 1 1 4 3005 1 1 47 TRP N N 5.925 10.296 -29.227 1.00 . A A . 47 TRP N 1 1 4 3006 1 1 47 TRP NE1 N 8.938 9.395 -26.375 1.00 . A A . 47 TRP NE1 1 1 4 3007 1 1 47 TRP O O 5.719 8.917 -32.394 1.00 . A A . 47 TRP O 1 1 4 3008 1 1 48 PHE C C 4.156 6.898 -32.649 1.00 . A A . 48 PHE C 1 1 4 3009 1 1 48 PHE CA C 3.505 7.661 -31.494 1.00 . A A . 48 PHE CA 1 1 4 3010 1 1 48 PHE CB C 2.601 8.761 -32.052 1.00 . A A . 48 PHE CB 1 1 4 3011 1 1 48 PHE CD1 C 0.729 8.676 -30.365 1.00 . A A . 48 PHE CD1 1 1 4 3012 1 1 48 PHE CD2 C 0.272 7.996 -32.647 1.00 . A A . 48 PHE CD2 1 1 4 3013 1 1 48 PHE CE1 C -0.600 8.407 -30.018 1.00 . A A . 48 PHE CE1 1 1 4 3014 1 1 48 PHE CE2 C -1.057 7.727 -32.301 1.00 . A A . 48 PHE CE2 1 1 4 3015 1 1 48 PHE CG C 1.166 8.471 -31.679 1.00 . A A . 48 PHE CG 1 1 4 3016 1 1 48 PHE CZ C -1.493 7.932 -30.987 1.00 . A A . 48 PHE CZ 1 1 4 3017 1 1 48 PHE H H 4.476 8.243 -29.665 1.00 . A A . 48 PHE H 1 1 4 3018 1 1 48 PHE HA H 2.915 6.979 -30.899 1.00 . A A . 48 PHE HA 1 1 4 3019 1 1 48 PHE HB2 H 2.896 9.713 -31.634 1.00 . A A . 48 PHE HB2 1 1 4 3020 1 1 48 PHE HB3 H 2.694 8.794 -33.127 1.00 . A A . 48 PHE HB3 1 1 4 3021 1 1 48 PHE HD1 H 1.419 9.042 -29.618 1.00 . A A . 48 PHE HD1 1 1 4 3022 1 1 48 PHE HD2 H 0.609 7.837 -33.661 1.00 . A A . 48 PHE HD2 1 1 4 3023 1 1 48 PHE HE1 H -0.937 8.565 -29.004 1.00 . A A . 48 PHE HE1 1 1 4 3024 1 1 48 PHE HE2 H -1.746 7.360 -33.048 1.00 . A A . 48 PHE HE2 1 1 4 3025 1 1 48 PHE HZ H -2.519 7.725 -30.719 1.00 . A A . 48 PHE HZ 1 1 4 3026 1 1 48 PHE N N 4.559 8.274 -30.641 1.00 . A A . 48 PHE N 1 1 4 3027 1 1 48 PHE O O 3.683 7.034 -33.765 1.00 . A A . 48 PHE O 1 1 4 3028 1 1 48 PHE OXT O 5.117 6.189 -32.398 1.00 . A A . 48 PHE OXT 1 1 5 3029 1 1 1 ALA C C -36.372 8.825 -5.293 1.00 . A A . 1 ALA C 1 1 5 3030 1 1 1 ALA CA C -37.532 9.017 -6.273 1.00 . A A . 1 ALA CA 1 1 5 3031 1 1 1 ALA CB C -37.316 8.127 -7.498 1.00 . A A . 1 ALA CB 1 1 5 3032 1 1 1 ALA H1 H -36.850 10.983 -6.206 1.00 . A A . 1 ALA H1 1 1 5 3033 1 1 1 ALA H2 H -37.440 10.505 -7.726 1.00 . A A . 1 ALA H2 1 1 5 3034 1 1 1 ALA H3 H -38.524 10.838 -6.464 1.00 . A A . 1 ALA H3 1 1 5 3035 1 1 1 ALA HA H -38.459 8.747 -5.790 1.00 . A A . 1 ALA HA 1 1 5 3036 1 1 1 ALA HB1 H -38.042 8.378 -8.258 1.00 . A A . 1 ALA HB1 1 1 5 3037 1 1 1 ALA HB2 H -37.435 7.091 -7.216 1.00 . A A . 1 ALA HB2 1 1 5 3038 1 1 1 ALA HB3 H -36.320 8.282 -7.885 1.00 . A A . 1 ALA HB3 1 1 5 3039 1 1 1 ALA N N -37.591 10.444 -6.700 1.00 . A A . 1 ALA N 1 1 5 3040 1 1 1 ALA O O -35.217 8.914 -5.659 1.00 . A A . 1 ALA O 1 1 5 3041 1 1 2 ASP C C -35.259 6.873 -2.940 1.00 . A A . 2 ASP C 1 1 5 3042 1 1 2 ASP CA C -35.584 8.364 -3.050 1.00 . A A . 2 ASP CA 1 1 5 3043 1 1 2 ASP CB C -36.042 8.886 -1.686 1.00 . A A . 2 ASP CB 1 1 5 3044 1 1 2 ASP CG C -36.311 10.389 -1.779 1.00 . A A . 2 ASP CG 1 1 5 3045 1 1 2 ASP H H -37.608 8.493 -3.775 1.00 . A A . 2 ASP H 1 1 5 3046 1 1 2 ASP HA H -34.701 8.903 -3.364 1.00 . A A . 2 ASP HA 1 1 5 3047 1 1 2 ASP HB2 H -36.946 8.374 -1.390 1.00 . A A . 2 ASP HB2 1 1 5 3048 1 1 2 ASP HB3 H -35.270 8.705 -0.954 1.00 . A A . 2 ASP HB3 1 1 5 3049 1 1 2 ASP N N -36.670 8.562 -4.049 1.00 . A A . 2 ASP N 1 1 5 3050 1 1 2 ASP O O -36.134 6.050 -2.760 1.00 . A A . 2 ASP O 1 1 5 3051 1 1 2 ASP OD1 O -35.351 11.141 -1.820 1.00 . A A . 2 ASP OD1 1 1 5 3052 1 1 2 ASP OD2 O -37.472 10.762 -1.806 1.00 . A A . 2 ASP OD2 1 1 5 3053 1 1 3 LYS C C -32.127 4.936 -3.150 1.00 . A A . 3 LYS C 1 1 5 3054 1 1 3 LYS CA C -33.632 5.082 -2.951 1.00 . A A . 3 LYS CA 1 1 5 3055 1 1 3 LYS CB C -34.364 4.291 -4.035 1.00 . A A . 3 LYS CB 1 1 5 3056 1 1 3 LYS CD C -32.591 3.942 -5.761 1.00 . A A . 3 LYS CD 1 1 5 3057 1 1 3 LYS CE C -32.881 2.990 -6.922 1.00 . A A . 3 LYS CE 1 1 5 3058 1 1 3 LYS CG C -33.858 4.724 -5.412 1.00 . A A . 3 LYS CG 1 1 5 3059 1 1 3 LYS H H -33.316 7.198 -3.194 1.00 . A A . 3 LYS H 1 1 5 3060 1 1 3 LYS HA H -33.904 4.704 -1.982 1.00 . A A . 3 LYS HA 1 1 5 3061 1 1 3 LYS HB2 H -34.180 3.236 -3.898 1.00 . A A . 3 LYS HB2 1 1 5 3062 1 1 3 LYS HB3 H -35.422 4.486 -3.968 1.00 . A A . 3 LYS HB3 1 1 5 3063 1 1 3 LYS HD2 H -31.810 4.632 -6.047 1.00 . A A . 3 LYS HD2 1 1 5 3064 1 1 3 LYS HD3 H -32.270 3.373 -4.902 1.00 . A A . 3 LYS HD3 1 1 5 3065 1 1 3 LYS HE2 H -32.114 2.230 -6.966 1.00 . A A . 3 LYS HE2 1 1 5 3066 1 1 3 LYS HE3 H -33.842 2.521 -6.770 1.00 . A A . 3 LYS HE3 1 1 5 3067 1 1 3 LYS HG2 H -34.619 4.526 -6.154 1.00 . A A . 3 LYS HG2 1 1 5 3068 1 1 3 LYS HG3 H -33.635 5.780 -5.399 1.00 . A A . 3 LYS HG3 1 1 5 3069 1 1 3 LYS HZ1 H -32.282 4.590 -8.113 1.00 . A A . 3 LYS HZ1 1 1 5 3070 1 1 3 LYS HZ2 H -32.553 3.149 -8.971 1.00 . A A . 3 LYS HZ2 1 1 5 3071 1 1 3 LYS HZ3 H -33.869 4.060 -8.410 1.00 . A A . 3 LYS HZ3 1 1 5 3072 1 1 3 LYS N N -34.008 6.519 -3.048 1.00 . A A . 3 LYS N 1 1 5 3073 1 1 3 LYS NZ N -32.898 3.755 -8.200 1.00 . A A . 3 LYS NZ 1 1 5 3074 1 1 3 LYS O O -31.481 4.107 -2.539 1.00 . A A . 3 LYS O 1 1 5 3075 1 1 4 SER C C -29.337 5.971 -2.971 1.00 . A A . 4 SER C 1 1 5 3076 1 1 4 SER CA C -30.104 5.663 -4.260 1.00 . A A . 4 SER CA 1 1 5 3077 1 1 4 SER CB C -29.721 6.680 -5.335 1.00 . A A . 4 SER CB 1 1 5 3078 1 1 4 SER H H -32.120 6.392 -4.479 1.00 . A A . 4 SER H 1 1 5 3079 1 1 4 SER HA H -29.850 4.669 -4.600 1.00 . A A . 4 SER HA 1 1 5 3080 1 1 4 SER HB2 H -30.576 7.287 -5.581 1.00 . A A . 4 SER HB2 1 1 5 3081 1 1 4 SER HB3 H -28.927 7.314 -4.964 1.00 . A A . 4 SER HB3 1 1 5 3082 1 1 4 SER HG H -29.473 6.546 -7.261 1.00 . A A . 4 SER HG 1 1 5 3083 1 1 4 SER N N -31.569 5.738 -4.004 1.00 . A A . 4 SER N 1 1 5 3084 1 1 4 SER O O -28.145 5.757 -2.884 1.00 . A A . 4 SER O 1 1 5 3085 1 1 4 SER OG O -29.288 5.990 -6.501 1.00 . A A . 4 SER OG 1 1 5 3086 1 1 5 ASP C C -29.032 5.495 0.075 1.00 . A A . 5 ASP C 1 1 5 3087 1 1 5 ASP CA C -29.311 6.789 -0.689 1.00 . A A . 5 ASP CA 1 1 5 3088 1 1 5 ASP CB C -30.194 7.705 0.160 1.00 . A A . 5 ASP CB 1 1 5 3089 1 1 5 ASP CG C -29.376 8.908 0.634 1.00 . A A . 5 ASP CG 1 1 5 3090 1 1 5 ASP H H -30.969 6.639 -2.058 1.00 . A A . 5 ASP H 1 1 5 3091 1 1 5 ASP HA H -28.376 7.285 -0.902 1.00 . A A . 5 ASP HA 1 1 5 3092 1 1 5 ASP HB2 H -31.030 8.049 -0.431 1.00 . A A . 5 ASP HB2 1 1 5 3093 1 1 5 ASP HB3 H -30.559 7.160 1.017 1.00 . A A . 5 ASP HB3 1 1 5 3094 1 1 5 ASP N N -30.008 6.471 -1.969 1.00 . A A . 5 ASP N 1 1 5 3095 1 1 5 ASP O O -27.972 5.321 0.642 1.00 . A A . 5 ASP O 1 1 5 3096 1 1 5 ASP OD1 O -29.315 9.883 -0.094 1.00 . A A . 5 ASP OD1 1 1 5 3097 1 1 5 ASP OD2 O -28.823 8.831 1.720 1.00 . A A . 5 ASP OD2 1 1 5 3098 1 1 6 LEU C C -28.439 2.690 0.300 1.00 . A A . 6 LEU C 1 1 5 3099 1 1 6 LEU CA C -29.733 3.298 0.811 1.00 . A A . 6 LEU CA 1 1 5 3100 1 1 6 LEU CB C -30.884 2.339 0.535 1.00 . A A . 6 LEU CB 1 1 5 3101 1 1 6 LEU CD1 C -33.283 2.620 -0.078 1.00 . A A . 6 LEU CD1 1 1 5 3102 1 1 6 LEU CD2 C -32.572 2.698 2.322 1.00 . A A . 6 LEU CD2 1 1 5 3103 1 1 6 LEU CG C -32.176 3.048 0.887 1.00 . A A . 6 LEU CG 1 1 5 3104 1 1 6 LEU H H -30.807 4.737 -0.386 1.00 . A A . 6 LEU H 1 1 5 3105 1 1 6 LEU HA H -29.666 3.487 1.870 1.00 . A A . 6 LEU HA 1 1 5 3106 1 1 6 LEU HB2 H -30.888 2.064 -0.510 1.00 . A A . 6 LEU HB2 1 1 5 3107 1 1 6 LEU HB3 H -30.777 1.455 1.146 1.00 . A A . 6 LEU HB3 1 1 5 3108 1 1 6 LEU HD11 H -33.090 1.616 -0.424 1.00 . A A . 6 LEU HD11 1 1 5 3109 1 1 6 LEU HD12 H -34.235 2.649 0.431 1.00 . A A . 6 LEU HD12 1 1 5 3110 1 1 6 LEU HD13 H -33.304 3.294 -0.922 1.00 . A A . 6 LEU HD13 1 1 5 3111 1 1 6 LEU HD21 H -31.710 2.797 2.965 1.00 . A A . 6 LEU HD21 1 1 5 3112 1 1 6 LEU HD22 H -33.349 3.369 2.655 1.00 . A A . 6 LEU HD22 1 1 5 3113 1 1 6 LEU HD23 H -32.934 1.681 2.357 1.00 . A A . 6 LEU HD23 1 1 5 3114 1 1 6 LEU HG H -32.010 4.109 0.807 1.00 . A A . 6 LEU HG 1 1 5 3115 1 1 6 LEU N N -29.964 4.582 0.087 1.00 . A A . 6 LEU N 1 1 5 3116 1 1 6 LEU O O -27.648 2.141 1.042 1.00 . A A . 6 LEU O 1 1 5 3117 1 1 7 GLY C C -25.802 3.136 -1.176 1.00 . A A . 7 GLY C 1 1 5 3118 1 1 7 GLY CA C -26.982 2.248 -1.574 1.00 . A A . 7 GLY CA 1 1 5 3119 1 1 7 GLY H H -28.890 3.256 -1.536 1.00 . A A . 7 GLY H 1 1 5 3120 1 1 7 GLY HA2 H -27.072 2.235 -2.649 1.00 . A A . 7 GLY HA2 1 1 5 3121 1 1 7 GLY HA3 H -26.820 1.243 -1.209 1.00 . A A . 7 GLY HA3 1 1 5 3122 1 1 7 GLY N N -28.225 2.800 -0.974 1.00 . A A . 7 GLY N 1 1 5 3123 1 1 7 GLY O O -24.764 2.659 -0.770 1.00 . A A . 7 GLY O 1 1 5 3124 1 1 8 TYR C C -24.455 5.097 0.522 1.00 . A A . 8 TYR C 1 1 5 3125 1 1 8 TYR CA C -24.863 5.346 -0.928 1.00 . A A . 8 TYR CA 1 1 5 3126 1 1 8 TYR CB C -25.353 6.777 -1.132 1.00 . A A . 8 TYR CB 1 1 5 3127 1 1 8 TYR CD1 C -23.328 8.121 -0.443 1.00 . A A . 8 TYR CD1 1 1 5 3128 1 1 8 TYR CD2 C -25.344 8.235 0.899 1.00 . A A . 8 TYR CD2 1 1 5 3129 1 1 8 TYR CE1 C -22.701 9.024 0.425 1.00 . A A . 8 TYR CE1 1 1 5 3130 1 1 8 TYR CE2 C -24.720 9.138 1.766 1.00 . A A . 8 TYR CE2 1 1 5 3131 1 1 8 TYR CG C -24.652 7.729 -0.200 1.00 . A A . 8 TYR CG 1 1 5 3132 1 1 8 TYR CZ C -23.398 9.534 1.528 1.00 . A A . 8 TYR CZ 1 1 5 3133 1 1 8 TYR H H -26.789 4.793 -1.617 1.00 . A A . 8 TYR H 1 1 5 3134 1 1 8 TYR HA H -24.034 5.160 -1.572 1.00 . A A . 8 TYR HA 1 1 5 3135 1 1 8 TYR HB2 H -25.161 7.073 -2.150 1.00 . A A . 8 TYR HB2 1 1 5 3136 1 1 8 TYR HB3 H -26.414 6.812 -0.944 1.00 . A A . 8 TYR HB3 1 1 5 3137 1 1 8 TYR HD1 H -22.787 7.717 -1.293 1.00 . A A . 8 TYR HD1 1 1 5 3138 1 1 8 TYR HD2 H -26.365 7.922 1.079 1.00 . A A . 8 TYR HD2 1 1 5 3139 1 1 8 TYR HE1 H -21.682 9.328 0.241 1.00 . A A . 8 TYR HE1 1 1 5 3140 1 1 8 TYR HE2 H -25.257 9.530 2.618 1.00 . A A . 8 TYR HE2 1 1 5 3141 1 1 8 TYR HH H -23.462 10.882 2.879 1.00 . A A . 8 TYR HH 1 1 5 3142 1 1 8 TYR N N -25.955 4.427 -1.291 1.00 . A A . 8 TYR N 1 1 5 3143 1 1 8 TYR O O -23.387 5.477 0.948 1.00 . A A . 8 TYR O 1 1 5 3144 1 1 8 TYR OH O -22.780 10.426 2.381 1.00 . A A . 8 TYR OH 1 1 5 3145 1 1 9 THR C C -23.776 3.154 2.674 1.00 . A A . 9 THR C 1 1 5 3146 1 1 9 THR CA C -24.930 4.156 2.689 1.00 . A A . 9 THR CA 1 1 5 3147 1 1 9 THR CB C -26.130 3.551 3.421 1.00 . A A . 9 THR CB 1 1 5 3148 1 1 9 THR CG2 C -25.948 3.716 4.930 1.00 . A A . 9 THR CG2 1 1 5 3149 1 1 9 THR H H -26.145 4.149 0.911 1.00 . A A . 9 THR H 1 1 5 3150 1 1 9 THR HA H -24.621 5.065 3.177 1.00 . A A . 9 THR HA 1 1 5 3151 1 1 9 THR HB H -26.208 2.502 3.184 1.00 . A A . 9 THR HB 1 1 5 3152 1 1 9 THR HG1 H -27.512 3.931 2.117 1.00 . A A . 9 THR HG1 1 1 5 3153 1 1 9 THR HG21 H -25.079 4.326 5.123 1.00 . A A . 9 THR HG21 1 1 5 3154 1 1 9 THR HG22 H -26.822 4.192 5.348 1.00 . A A . 9 THR HG22 1 1 5 3155 1 1 9 THR HG23 H -25.815 2.745 5.384 1.00 . A A . 9 THR HG23 1 1 5 3156 1 1 9 THR N N -25.291 4.450 1.276 1.00 . A A . 9 THR N 1 1 5 3157 1 1 9 THR O O -22.782 3.311 3.358 1.00 . A A . 9 THR O 1 1 5 3158 1 1 9 THR OG1 O -27.313 4.216 3.009 1.00 . A A . 9 THR OG1 1 1 5 3159 1 1 10 GLY C C -21.685 1.695 0.906 1.00 . A A . 10 GLY C 1 1 5 3160 1 1 10 GLY CA C -22.806 1.120 1.774 1.00 . A A . 10 GLY CA 1 1 5 3161 1 1 10 GLY H H -24.703 2.040 1.318 1.00 . A A . 10 GLY H 1 1 5 3162 1 1 10 GLY HA2 H -23.184 0.218 1.321 1.00 . A A . 10 GLY HA2 1 1 5 3163 1 1 10 GLY HA3 H -22.424 0.903 2.763 1.00 . A A . 10 GLY HA3 1 1 5 3164 1 1 10 GLY N N -23.897 2.132 1.870 1.00 . A A . 10 GLY N 1 1 5 3165 1 1 10 GLY O O -20.573 1.885 1.360 1.00 . A A . 10 GLY O 1 1 5 3166 1 1 11 LEU C C -20.252 3.679 -0.443 1.00 . A A . 11 LEU C 1 1 5 3167 1 1 11 LEU CA C -20.945 2.576 -1.216 1.00 . A A . 11 LEU CA 1 1 5 3168 1 1 11 LEU CB C -21.621 3.068 -2.514 1.00 . A A . 11 LEU CB 1 1 5 3169 1 1 11 LEU CD1 C -20.245 4.946 -3.384 1.00 . A A . 11 LEU CD1 1 1 5 3170 1 1 11 LEU CD2 C -22.729 5.090 -3.464 1.00 . A A . 11 LEU CD2 1 1 5 3171 1 1 11 LEU CG C -21.535 4.583 -2.653 1.00 . A A . 11 LEU CG 1 1 5 3172 1 1 11 LEU H H -22.861 1.854 -0.683 1.00 . A A . 11 LEU H 1 1 5 3173 1 1 11 LEU HA H -20.214 1.830 -1.451 1.00 . A A . 11 LEU HA 1 1 5 3174 1 1 11 LEU HB2 H -21.136 2.610 -3.362 1.00 . A A . 11 LEU HB2 1 1 5 3175 1 1 11 LEU HB3 H -22.660 2.776 -2.502 1.00 . A A . 11 LEU HB3 1 1 5 3176 1 1 11 LEU HD11 H -19.401 4.562 -2.834 1.00 . A A . 11 LEU HD11 1 1 5 3177 1 1 11 LEU HD12 H -20.258 4.508 -4.372 1.00 . A A . 11 LEU HD12 1 1 5 3178 1 1 11 LEU HD13 H -20.168 6.019 -3.466 1.00 . A A . 11 LEU HD13 1 1 5 3179 1 1 11 LEU HD21 H -23.544 4.386 -3.382 1.00 . A A . 11 LEU HD21 1 1 5 3180 1 1 11 LEU HD22 H -23.043 6.050 -3.082 1.00 . A A . 11 LEU HD22 1 1 5 3181 1 1 11 LEU HD23 H -22.443 5.191 -4.501 1.00 . A A . 11 LEU HD23 1 1 5 3182 1 1 11 LEU HG H -21.542 5.030 -1.670 1.00 . A A . 11 LEU HG 1 1 5 3183 1 1 11 LEU N N -21.972 1.994 -0.337 1.00 . A A . 11 LEU N 1 1 5 3184 1 1 11 LEU O O -19.083 3.894 -0.601 1.00 . A A . 11 LEU O 1 1 5 3185 1 1 12 THR C C -19.046 4.857 1.778 1.00 . A A . 12 THR C 1 1 5 3186 1 1 12 THR CA C -20.325 5.409 1.221 1.00 . A A . 12 THR CA 1 1 5 3187 1 1 12 THR CB C -21.276 5.825 2.360 1.00 . A A . 12 THR CB 1 1 5 3188 1 1 12 THR CG2 C -20.515 6.122 3.661 1.00 . A A . 12 THR CG2 1 1 5 3189 1 1 12 THR H H -21.900 4.168 0.541 1.00 . A A . 12 THR H 1 1 5 3190 1 1 12 THR HA H -20.115 6.240 0.606 1.00 . A A . 12 THR HA 1 1 5 3191 1 1 12 THR HB H -21.999 5.045 2.534 1.00 . A A . 12 THR HB 1 1 5 3192 1 1 12 THR HG1 H -21.388 7.358 1.260 1.00 . A A . 12 THR HG1 1 1 5 3193 1 1 12 THR HG21 H -19.516 6.456 3.425 1.00 . A A . 12 THR HG21 1 1 5 3194 1 1 12 THR HG22 H -21.032 6.893 4.213 1.00 . A A . 12 THR HG22 1 1 5 3195 1 1 12 THR HG23 H -20.462 5.225 4.260 1.00 . A A . 12 THR HG23 1 1 5 3196 1 1 12 THR N N -20.962 4.359 0.416 1.00 . A A . 12 THR N 1 1 5 3197 1 1 12 THR O O -17.978 5.177 1.348 1.00 . A A . 12 THR O 1 1 5 3198 1 1 12 THR OG1 O -21.930 6.989 1.949 1.00 . A A . 12 THR OG1 1 1 5 3199 1 1 13 ASP C C -16.878 3.213 2.415 1.00 . A A . 13 ASP C 1 1 5 3200 1 1 13 ASP CA C -18.019 3.401 3.404 1.00 . A A . 13 ASP CA 1 1 5 3201 1 1 13 ASP CB C -18.428 2.048 3.988 1.00 . A A . 13 ASP CB 1 1 5 3202 1 1 13 ASP CG C -18.323 2.096 5.513 1.00 . A A . 13 ASP CG 1 1 5 3203 1 1 13 ASP H H -20.093 3.845 3.045 1.00 . A A . 13 ASP H 1 1 5 3204 1 1 13 ASP HA H -17.676 4.038 4.184 1.00 . A A . 13 ASP HA 1 1 5 3205 1 1 13 ASP HB2 H -19.447 1.826 3.702 1.00 . A A . 13 ASP HB2 1 1 5 3206 1 1 13 ASP HB3 H -17.772 1.278 3.607 1.00 . A A . 13 ASP HB3 1 1 5 3207 1 1 13 ASP N N -19.190 4.035 2.743 1.00 . A A . 13 ASP N 1 1 5 3208 1 1 13 ASP O O -15.720 3.303 2.773 1.00 . A A . 13 ASP O 1 1 5 3209 1 1 13 ASP OD1 O -17.222 1.948 6.017 1.00 . A A . 13 ASP OD1 1 1 5 3210 1 1 13 ASP OD2 O -19.346 2.279 6.152 1.00 . A A . 13 ASP OD2 1 1 5 3211 1 1 14 GLU C C -15.574 4.176 -0.265 1.00 . A A . 14 GLU C 1 1 5 3212 1 1 14 GLU CA C -16.055 2.809 0.222 1.00 . A A . 14 GLU CA 1 1 5 3213 1 1 14 GLU CB C -16.483 1.976 -0.970 1.00 . A A . 14 GLU CB 1 1 5 3214 1 1 14 GLU CD C -16.313 -0.491 -0.609 1.00 . A A . 14 GLU CD 1 1 5 3215 1 1 14 GLU CG C -15.569 0.757 -1.089 1.00 . A A . 14 GLU CG 1 1 5 3216 1 1 14 GLU H H -18.107 2.918 0.875 1.00 . A A . 14 GLU H 1 1 5 3217 1 1 14 GLU HA H -15.251 2.318 0.743 1.00 . A A . 14 GLU HA 1 1 5 3218 1 1 14 GLU HB2 H -17.505 1.658 -0.838 1.00 . A A . 14 GLU HB2 1 1 5 3219 1 1 14 GLU HB3 H -16.399 2.576 -1.861 1.00 . A A . 14 GLU HB3 1 1 5 3220 1 1 14 GLU HG2 H -15.272 0.628 -2.119 1.00 . A A . 14 GLU HG2 1 1 5 3221 1 1 14 GLU HG3 H -14.692 0.909 -0.477 1.00 . A A . 14 GLU HG3 1 1 5 3222 1 1 14 GLU N N -17.170 2.975 1.174 1.00 . A A . 14 GLU N 1 1 5 3223 1 1 14 GLU O O -14.392 4.423 -0.331 1.00 . A A . 14 GLU O 1 1 5 3224 1 1 14 GLU OE1 O -17.533 -0.466 -0.607 1.00 . A A . 14 GLU OE1 1 1 5 3225 1 1 14 GLU OE2 O -15.650 -1.451 -0.251 1.00 . A A . 14 GLU OE2 1 1 5 3226 1 1 15 GLN C C -15.322 7.084 0.071 1.00 . A A . 15 GLN C 1 1 5 3227 1 1 15 GLN CA C -16.043 6.418 -1.071 1.00 . A A . 15 GLN CA 1 1 5 3228 1 1 15 GLN CB C -17.253 7.256 -1.425 1.00 . A A . 15 GLN CB 1 1 5 3229 1 1 15 GLN CD C -18.109 7.084 -3.758 1.00 . A A . 15 GLN CD 1 1 5 3230 1 1 15 GLN CG C -18.155 6.469 -2.358 1.00 . A A . 15 GLN CG 1 1 5 3231 1 1 15 GLN H H -17.424 4.845 -0.556 1.00 . A A . 15 GLN H 1 1 5 3232 1 1 15 GLN HA H -15.393 6.329 -1.907 1.00 . A A . 15 GLN HA 1 1 5 3233 1 1 15 GLN HB2 H -17.793 7.493 -0.521 1.00 . A A . 15 GLN HB2 1 1 5 3234 1 1 15 GLN HB3 H -16.928 8.161 -1.905 1.00 . A A . 15 GLN HB3 1 1 5 3235 1 1 15 GLN HE21 H -19.080 8.730 -3.222 1.00 . A A . 15 GLN HE21 1 1 5 3236 1 1 15 GLN HE22 H -18.624 8.656 -4.856 1.00 . A A . 15 GLN HE22 1 1 5 3237 1 1 15 GLN HG2 H -17.816 5.444 -2.398 1.00 . A A . 15 GLN HG2 1 1 5 3238 1 1 15 GLN HG3 H -19.166 6.500 -1.983 1.00 . A A . 15 GLN HG3 1 1 5 3239 1 1 15 GLN N N -16.474 5.064 -0.608 1.00 . A A . 15 GLN N 1 1 5 3240 1 1 15 GLN NE2 N -18.649 8.254 -3.962 1.00 . A A . 15 GLN NE2 1 1 5 3241 1 1 15 GLN O O -14.289 7.706 -0.074 1.00 . A A . 15 GLN O 1 1 5 3242 1 1 15 GLN OE1 O -17.573 6.494 -4.676 1.00 . A A . 15 GLN OE1 1 1 5 3243 1 1 16 ALA C C -13.824 6.995 2.435 1.00 . A A . 16 ALA C 1 1 5 3244 1 1 16 ALA CA C -15.265 7.481 2.424 1.00 . A A . 16 ALA CA 1 1 5 3245 1 1 16 ALA CB C -16.027 6.936 3.625 1.00 . A A . 16 ALA CB 1 1 5 3246 1 1 16 ALA H H -16.696 6.420 1.269 1.00 . A A . 16 ALA H 1 1 5 3247 1 1 16 ALA HA H -15.300 8.555 2.408 1.00 . A A . 16 ALA HA 1 1 5 3248 1 1 16 ALA HB1 H -16.473 7.752 4.172 1.00 . A A . 16 ALA HB1 1 1 5 3249 1 1 16 ALA HB2 H -15.350 6.393 4.268 1.00 . A A . 16 ALA HB2 1 1 5 3250 1 1 16 ALA HB3 H -16.805 6.268 3.270 1.00 . A A . 16 ALA HB3 1 1 5 3251 1 1 16 ALA N N -15.877 6.928 1.212 1.00 . A A . 16 ALA N 1 1 5 3252 1 1 16 ALA O O -12.927 7.655 2.921 1.00 . A A . 16 ALA O 1 1 5 3253 1 1 17 GLN C C -11.538 5.826 0.532 1.00 . A A . 17 GLN C 1 1 5 3254 1 1 17 GLN CA C -12.217 5.298 1.794 1.00 . A A . 17 GLN CA 1 1 5 3255 1 1 17 GLN CB C -12.251 3.779 1.748 1.00 . A A . 17 GLN CB 1 1 5 3256 1 1 17 GLN CD C -12.269 1.759 3.219 1.00 . A A . 17 GLN CD 1 1 5 3257 1 1 17 GLN CG C -12.631 3.243 3.126 1.00 . A A . 17 GLN CG 1 1 5 3258 1 1 17 GLN H H -14.350 5.334 1.462 1.00 . A A . 17 GLN H 1 1 5 3259 1 1 17 GLN HA H -11.663 5.622 2.658 1.00 . A A . 17 GLN HA 1 1 5 3260 1 1 17 GLN HB2 H -12.977 3.457 1.018 1.00 . A A . 17 GLN HB2 1 1 5 3261 1 1 17 GLN HB3 H -11.275 3.413 1.476 1.00 . A A . 17 GLN HB3 1 1 5 3262 1 1 17 GLN HE21 H -13.540 1.213 1.795 1.00 . A A . 17 GLN HE21 1 1 5 3263 1 1 17 GLN HE22 H -12.641 -0.049 2.488 1.00 . A A . 17 GLN HE22 1 1 5 3264 1 1 17 GLN HG2 H -12.095 3.795 3.884 1.00 . A A . 17 GLN HG2 1 1 5 3265 1 1 17 GLN HG3 H -13.692 3.363 3.276 1.00 . A A . 17 GLN HG3 1 1 5 3266 1 1 17 GLN N N -13.601 5.839 1.863 1.00 . A A . 17 GLN N 1 1 5 3267 1 1 17 GLN NE2 N -12.865 0.903 2.435 1.00 . A A . 17 GLN NE2 1 1 5 3268 1 1 17 GLN O O -10.331 5.959 0.476 1.00 . A A . 17 GLN O 1 1 5 3269 1 1 17 GLN OE1 O -11.433 1.374 4.013 1.00 . A A . 17 GLN OE1 1 1 5 3270 1 1 18 GLU C C -10.758 7.830 -1.300 1.00 . A A . 18 GLU C 1 1 5 3271 1 1 18 GLU CA C -11.706 6.716 -1.714 1.00 . A A . 18 GLU CA 1 1 5 3272 1 1 18 GLU CB C -12.805 7.281 -2.616 1.00 . A A . 18 GLU CB 1 1 5 3273 1 1 18 GLU CD C -12.402 5.888 -4.650 1.00 . A A . 18 GLU CD 1 1 5 3274 1 1 18 GLU CG C -12.317 7.298 -4.066 1.00 . A A . 18 GLU CG 1 1 5 3275 1 1 18 GLU H H -13.273 6.071 -0.398 1.00 . A A . 18 GLU H 1 1 5 3276 1 1 18 GLU HA H -11.160 5.943 -2.235 1.00 . A A . 18 GLU HA 1 1 5 3277 1 1 18 GLU HB2 H -13.685 6.662 -2.539 1.00 . A A . 18 GLU HB2 1 1 5 3278 1 1 18 GLU HB3 H -13.043 8.288 -2.307 1.00 . A A . 18 GLU HB3 1 1 5 3279 1 1 18 GLU HG2 H -12.935 7.968 -4.646 1.00 . A A . 18 GLU HG2 1 1 5 3280 1 1 18 GLU HG3 H -11.292 7.637 -4.096 1.00 . A A . 18 GLU HG3 1 1 5 3281 1 1 18 GLU N N -12.307 6.162 -0.473 1.00 . A A . 18 GLU N 1 1 5 3282 1 1 18 GLU O O -9.846 8.191 -2.015 1.00 . A A . 18 GLU O 1 1 5 3283 1 1 18 GLU OE1 O -12.695 4.973 -3.898 1.00 . A A . 18 GLU OE1 1 1 5 3284 1 1 18 GLU OE2 O -12.172 5.745 -5.840 1.00 . A A . 18 GLU OE2 1 1 5 3285 1 1 19 LEU C C -9.271 8.883 1.533 1.00 . A A . 19 LEU C 1 1 5 3286 1 1 19 LEU CA C -10.090 9.438 0.374 1.00 . A A . 19 LEU CA 1 1 5 3287 1 1 19 LEU CB C -10.940 10.600 0.870 1.00 . A A . 19 LEU CB 1 1 5 3288 1 1 19 LEU CD1 C -10.865 10.896 3.344 1.00 . A A . 19 LEU CD1 1 1 5 3289 1 1 19 LEU CD2 C -13.069 10.711 2.169 1.00 . A A . 19 LEU CD2 1 1 5 3290 1 1 19 LEU CG C -11.615 10.229 2.188 1.00 . A A . 19 LEU CG 1 1 5 3291 1 1 19 LEU H H -11.714 8.056 0.422 1.00 . A A . 19 LEU H 1 1 5 3292 1 1 19 LEU HA H -9.431 9.770 -0.410 1.00 . A A . 19 LEU HA 1 1 5 3293 1 1 19 LEU HB2 H -10.306 11.452 1.027 1.00 . A A . 19 LEU HB2 1 1 5 3294 1 1 19 LEU HB3 H -11.692 10.834 0.136 1.00 . A A . 19 LEU HB3 1 1 5 3295 1 1 19 LEU HD11 H -10.062 11.506 2.949 1.00 . A A . 19 LEU HD11 1 1 5 3296 1 1 19 LEU HD12 H -11.545 11.519 3.905 1.00 . A A . 19 LEU HD12 1 1 5 3297 1 1 19 LEU HD13 H -10.453 10.137 3.991 1.00 . A A . 19 LEU HD13 1 1 5 3298 1 1 19 LEU HD21 H -13.110 11.715 1.774 1.00 . A A . 19 LEU HD21 1 1 5 3299 1 1 19 LEU HD22 H -13.659 10.054 1.543 1.00 . A A . 19 LEU HD22 1 1 5 3300 1 1 19 LEU HD23 H -13.466 10.701 3.172 1.00 . A A . 19 LEU HD23 1 1 5 3301 1 1 19 LEU HG H -11.591 9.157 2.315 1.00 . A A . 19 LEU HG 1 1 5 3302 1 1 19 LEU N N -10.971 8.367 -0.132 1.00 . A A . 19 LEU N 1 1 5 3303 1 1 19 LEU O O -8.195 9.353 1.820 1.00 . A A . 19 LEU O 1 1 5 3304 1 1 20 HIS C C -8.206 6.133 2.938 1.00 . A A . 20 HIS C 1 1 5 3305 1 1 20 HIS CA C -9.083 7.307 3.368 1.00 . A A . 20 HIS CA 1 1 5 3306 1 1 20 HIS CB C -10.092 6.788 4.367 1.00 . A A . 20 HIS CB 1 1 5 3307 1 1 20 HIS CD2 C -10.563 8.735 6.034 1.00 . A A . 20 HIS CD2 1 1 5 3308 1 1 20 HIS CE1 C -9.244 8.116 7.639 1.00 . A A . 20 HIS CE1 1 1 5 3309 1 1 20 HIS CG C -9.967 7.575 5.632 1.00 . A A . 20 HIS CG 1 1 5 3310 1 1 20 HIS H H -10.677 7.565 1.970 1.00 . A A . 20 HIS H 1 1 5 3311 1 1 20 HIS HA H -8.479 8.063 3.834 1.00 . A A . 20 HIS HA 1 1 5 3312 1 1 20 HIS HB2 H -11.089 6.894 3.965 1.00 . A A . 20 HIS HB2 1 1 5 3313 1 1 20 HIS HB3 H -9.886 5.752 4.560 1.00 . A A . 20 HIS HB3 1 1 5 3314 1 1 20 HIS HD1 H -8.542 6.405 6.679 1.00 . A A . 20 HIS HD1 1 1 5 3315 1 1 20 HIS HD2 H -11.265 9.302 5.442 1.00 . A A . 20 HIS HD2 1 1 5 3316 1 1 20 HIS HE1 H -8.705 8.083 8.574 1.00 . A A . 20 HIS HE1 1 1 5 3317 1 1 20 HIS N N -9.797 7.899 2.210 1.00 . A A . 20 HIS N 1 1 5 3318 1 1 20 HIS ND1 N -9.127 7.194 6.666 1.00 . A A . 20 HIS ND1 1 1 5 3319 1 1 20 HIS NE2 N -10.109 9.080 7.304 1.00 . A A . 20 HIS NE2 1 1 5 3320 1 1 20 HIS O O -7.010 6.272 2.805 1.00 . A A . 20 HIS O 1 1 5 3321 1 1 21 SER C C -6.876 4.165 1.482 1.00 . A A . 21 SER C 1 1 5 3322 1 1 21 SER CA C -8.003 3.760 2.378 1.00 . A A . 21 SER CA 1 1 5 3323 1 1 21 SER CB C -8.856 2.771 1.595 1.00 . A A . 21 SER CB 1 1 5 3324 1 1 21 SER H H -9.754 4.878 2.911 1.00 . A A . 21 SER H 1 1 5 3325 1 1 21 SER HA H -7.622 3.299 3.249 1.00 . A A . 21 SER HA 1 1 5 3326 1 1 21 SER HB2 H -9.315 3.277 0.762 1.00 . A A . 21 SER HB2 1 1 5 3327 1 1 21 SER HB3 H -8.217 1.984 1.213 1.00 . A A . 21 SER HB3 1 1 5 3328 1 1 21 SER HG H -10.264 1.486 1.983 1.00 . A A . 21 SER HG 1 1 5 3329 1 1 21 SER N N -8.796 4.964 2.763 1.00 . A A . 21 SER N 1 1 5 3330 1 1 21 SER O O -5.722 4.179 1.858 1.00 . A A . 21 SER O 1 1 5 3331 1 1 21 SER OG O -9.859 2.226 2.441 1.00 . A A . 21 SER OG 1 1 5 3332 1 1 22 VAL C C -5.201 5.810 0.025 1.00 . A A . 22 VAL C 1 1 5 3333 1 1 22 VAL CA C -6.254 4.955 -0.694 1.00 . A A . 22 VAL CA 1 1 5 3334 1 1 22 VAL CB C -6.997 5.790 -1.742 1.00 . A A . 22 VAL CB 1 1 5 3335 1 1 22 VAL CG1 C -8.151 6.546 -1.062 1.00 . A A . 22 VAL CG1 1 1 5 3336 1 1 22 VAL CG2 C -6.043 6.793 -2.398 1.00 . A A . 22 VAL CG2 1 1 5 3337 1 1 22 VAL H H -8.182 4.488 0.056 1.00 . A A . 22 VAL H 1 1 5 3338 1 1 22 VAL HA H -5.813 4.089 -1.147 1.00 . A A . 22 VAL HA 1 1 5 3339 1 1 22 VAL HB H -7.402 5.132 -2.493 1.00 . A A . 22 VAL HB 1 1 5 3340 1 1 22 VAL HG11 H -8.154 6.340 0.003 1.00 . A A . 22 VAL HG11 1 1 5 3341 1 1 22 VAL HG12 H -8.025 7.606 -1.219 1.00 . A A . 22 VAL HG12 1 1 5 3342 1 1 22 VAL HG13 H -9.093 6.226 -1.487 1.00 . A A . 22 VAL HG13 1 1 5 3343 1 1 22 VAL HG21 H -5.598 7.417 -1.637 1.00 . A A . 22 VAL HG21 1 1 5 3344 1 1 22 VAL HG22 H -5.266 6.259 -2.925 1.00 . A A . 22 VAL HG22 1 1 5 3345 1 1 22 VAL HG23 H -6.592 7.410 -3.094 1.00 . A A . 22 VAL HG23 1 1 5 3346 1 1 22 VAL N N -7.235 4.509 0.296 1.00 . A A . 22 VAL N 1 1 5 3347 1 1 22 VAL O O -4.010 5.611 -0.097 1.00 . A A . 22 VAL O 1 1 5 3348 1 1 23 TYR C C -3.681 6.772 2.262 1.00 . A A . 23 TYR C 1 1 5 3349 1 1 23 TYR CA C -4.736 7.622 1.566 1.00 . A A . 23 TYR CA 1 1 5 3350 1 1 23 TYR CB C -5.521 8.361 2.643 1.00 . A A . 23 TYR CB 1 1 5 3351 1 1 23 TYR CD1 C -3.623 10.005 2.767 1.00 . A A . 23 TYR CD1 1 1 5 3352 1 1 23 TYR CD2 C -5.900 10.830 2.899 1.00 . A A . 23 TYR CD2 1 1 5 3353 1 1 23 TYR CE1 C -3.143 11.316 2.889 1.00 . A A . 23 TYR CE1 1 1 5 3354 1 1 23 TYR CE2 C -5.425 12.138 3.021 1.00 . A A . 23 TYR CE2 1 1 5 3355 1 1 23 TYR CG C -5.002 9.767 2.772 1.00 . A A . 23 TYR CG 1 1 5 3356 1 1 23 TYR CZ C -4.045 12.383 3.015 1.00 . A A . 23 TYR CZ 1 1 5 3357 1 1 23 TYR H H -6.628 6.875 0.878 1.00 . A A . 23 TYR H 1 1 5 3358 1 1 23 TYR HA H -4.262 8.333 0.908 1.00 . A A . 23 TYR HA 1 1 5 3359 1 1 23 TYR HB2 H -6.560 8.378 2.376 1.00 . A A . 23 TYR HB2 1 1 5 3360 1 1 23 TYR HB3 H -5.402 7.849 3.586 1.00 . A A . 23 TYR HB3 1 1 5 3361 1 1 23 TYR HD1 H -2.928 9.176 2.669 1.00 . A A . 23 TYR HD1 1 1 5 3362 1 1 23 TYR HD2 H -6.963 10.641 2.904 1.00 . A A . 23 TYR HD2 1 1 5 3363 1 1 23 TYR HE1 H -2.079 11.505 2.885 1.00 . A A . 23 TYR HE1 1 1 5 3364 1 1 23 TYR HE2 H -6.124 12.957 3.119 1.00 . A A . 23 TYR HE2 1 1 5 3365 1 1 23 TYR HH H -2.770 13.650 3.662 1.00 . A A . 23 TYR HH 1 1 5 3366 1 1 23 TYR N N -5.661 6.750 0.797 1.00 . A A . 23 TYR N 1 1 5 3367 1 1 23 TYR O O -2.501 6.940 2.050 1.00 . A A . 23 TYR O 1 1 5 3368 1 1 23 TYR OH O -3.573 13.674 3.136 1.00 . A A . 23 TYR OH 1 1 5 3369 1 1 24 MET C C -2.558 3.937 2.949 1.00 . A A . 24 MET C 1 1 5 3370 1 1 24 MET CA C -3.119 5.041 3.858 1.00 . A A . 24 MET CA 1 1 5 3371 1 1 24 MET CB C -3.812 4.412 5.069 1.00 . A A . 24 MET CB 1 1 5 3372 1 1 24 MET CE C -3.666 4.657 9.006 1.00 . A A . 24 MET CE 1 1 5 3373 1 1 24 MET CG C -3.183 4.957 6.352 1.00 . A A . 24 MET CG 1 1 5 3374 1 1 24 MET H H -5.065 5.783 3.296 1.00 . A A . 24 MET H 1 1 5 3375 1 1 24 MET HA H -2.308 5.668 4.198 1.00 . A A . 24 MET HA 1 1 5 3376 1 1 24 MET HB2 H -4.866 4.661 5.051 1.00 . A A . 24 MET HB2 1 1 5 3377 1 1 24 MET HB3 H -3.693 3.340 5.038 1.00 . A A . 24 MET HB3 1 1 5 3378 1 1 24 MET HE1 H -3.312 5.670 8.877 1.00 . A A . 24 MET HE1 1 1 5 3379 1 1 24 MET HE2 H -4.746 4.652 9.061 1.00 . A A . 24 MET HE2 1 1 5 3380 1 1 24 MET HE3 H -3.261 4.251 9.919 1.00 . A A . 24 MET HE3 1 1 5 3381 1 1 24 MET HG2 H -2.179 5.295 6.145 1.00 . A A . 24 MET HG2 1 1 5 3382 1 1 24 MET HG3 H -3.773 5.782 6.719 1.00 . A A . 24 MET HG3 1 1 5 3383 1 1 24 MET N N -4.100 5.882 3.119 1.00 . A A . 24 MET N 1 1 5 3384 1 1 24 MET O O -1.497 4.074 2.370 1.00 . A A . 24 MET O 1 1 5 3385 1 1 24 MET SD S -3.132 3.648 7.602 1.00 . A A . 24 MET SD 1 1 5 3386 1 1 25 SER C C -2.512 2.220 0.548 1.00 . A A . 25 SER C 1 1 5 3387 1 1 25 SER CA C -2.745 1.723 1.977 1.00 . A A . 25 SER CA 1 1 5 3388 1 1 25 SER CB C -3.771 0.590 1.959 1.00 . A A . 25 SER CB 1 1 5 3389 1 1 25 SER H H -4.097 2.738 3.316 1.00 . A A . 25 SER H 1 1 5 3390 1 1 25 SER HA H -1.815 1.356 2.383 1.00 . A A . 25 SER HA 1 1 5 3391 1 1 25 SER HB2 H -3.688 0.013 2.865 1.00 . A A . 25 SER HB2 1 1 5 3392 1 1 25 SER HB3 H -4.766 1.009 1.892 1.00 . A A . 25 SER HB3 1 1 5 3393 1 1 25 SER HG H -2.572 -0.284 0.701 1.00 . A A . 25 SER HG 1 1 5 3394 1 1 25 SER N N -3.250 2.838 2.833 1.00 . A A . 25 SER N 1 1 5 3395 1 1 25 SER O O -1.524 1.892 -0.083 1.00 . A A . 25 SER O 1 1 5 3396 1 1 25 SER OG O -3.520 -0.252 0.842 1.00 . A A . 25 SER OG 1 1 5 3397 1 1 26 GLY C C -1.910 4.271 -1.444 1.00 . A A . 26 GLY C 1 1 5 3398 1 1 26 GLY CA C -3.231 3.521 -1.357 1.00 . A A . 26 GLY CA 1 1 5 3399 1 1 26 GLY H H -4.195 3.269 0.552 1.00 . A A . 26 GLY H 1 1 5 3400 1 1 26 GLY HA2 H -4.035 4.190 -1.604 1.00 . A A . 26 GLY HA2 1 1 5 3401 1 1 26 GLY HA3 H -3.221 2.692 -2.049 1.00 . A A . 26 GLY HA3 1 1 5 3402 1 1 26 GLY N N -3.408 3.010 0.030 1.00 . A A . 26 GLY N 1 1 5 3403 1 1 26 GLY O O -1.283 4.327 -2.478 1.00 . A A . 26 GLY O 1 1 5 3404 1 1 27 LEU C C 0.927 4.667 -0.783 1.00 . A A . 27 LEU C 1 1 5 3405 1 1 27 LEU CA C -0.208 5.597 -0.354 1.00 . A A . 27 LEU CA 1 1 5 3406 1 1 27 LEU CB C 0.053 6.105 1.058 1.00 . A A . 27 LEU CB 1 1 5 3407 1 1 27 LEU CD1 C -0.901 8.358 0.546 1.00 . A A . 27 LEU CD1 1 1 5 3408 1 1 27 LEU CD2 C 0.722 8.085 2.424 1.00 . A A . 27 LEU CD2 1 1 5 3409 1 1 27 LEU CG C 0.344 7.607 1.021 1.00 . A A . 27 LEU CG 1 1 5 3410 1 1 27 LEU H H -2.017 4.787 0.464 1.00 . A A . 27 LEU H 1 1 5 3411 1 1 27 LEU HA H -0.273 6.432 -1.035 1.00 . A A . 27 LEU HA 1 1 5 3412 1 1 27 LEU HB2 H -0.821 5.919 1.664 1.00 . A A . 27 LEU HB2 1 1 5 3413 1 1 27 LEU HB3 H 0.899 5.584 1.477 1.00 . A A . 27 LEU HB3 1 1 5 3414 1 1 27 LEU HD11 H -1.492 7.712 -0.086 1.00 . A A . 27 LEU HD11 1 1 5 3415 1 1 27 LEU HD12 H -1.486 8.660 1.401 1.00 . A A . 27 LEU HD12 1 1 5 3416 1 1 27 LEU HD13 H -0.602 9.232 -0.013 1.00 . A A . 27 LEU HD13 1 1 5 3417 1 1 27 LEU HD21 H 0.155 7.532 3.158 1.00 . A A . 27 LEU HD21 1 1 5 3418 1 1 27 LEU HD22 H 1.777 7.924 2.588 1.00 . A A . 27 LEU HD22 1 1 5 3419 1 1 27 LEU HD23 H 0.501 9.139 2.517 1.00 . A A . 27 LEU HD23 1 1 5 3420 1 1 27 LEU HG H 1.162 7.797 0.340 1.00 . A A . 27 LEU HG 1 1 5 3421 1 1 27 LEU N N -1.488 4.848 -0.357 1.00 . A A . 27 LEU N 1 1 5 3422 1 1 27 LEU O O 1.688 4.972 -1.680 1.00 . A A . 27 LEU O 1 1 5 3423 1 1 28 TRP C C 2.024 2.236 -1.987 1.00 . A A . 28 TRP C 1 1 5 3424 1 1 28 TRP CA C 2.132 2.593 -0.512 1.00 . A A . 28 TRP CA 1 1 5 3425 1 1 28 TRP CB C 2.027 1.323 0.339 1.00 . A A . 28 TRP CB 1 1 5 3426 1 1 28 TRP CD1 C 4.427 1.120 -0.238 1.00 . A A . 28 TRP CD1 1 1 5 3427 1 1 28 TRP CD2 C 3.873 -0.248 1.448 1.00 . A A . 28 TRP CD2 1 1 5 3428 1 1 28 TRP CE2 C 5.253 -0.448 1.206 1.00 . A A . 28 TRP CE2 1 1 5 3429 1 1 28 TRP CE3 C 3.263 -0.995 2.471 1.00 . A A . 28 TRP CE3 1 1 5 3430 1 1 28 TRP CG C 3.387 0.754 0.510 1.00 . A A . 28 TRP CG 1 1 5 3431 1 1 28 TRP CH2 C 5.381 -2.092 2.967 1.00 . A A . 28 TRP CH2 1 1 5 3432 1 1 28 TRP CZ2 C 6.003 -1.357 1.953 1.00 . A A . 28 TRP CZ2 1 1 5 3433 1 1 28 TRP CZ3 C 4.014 -1.912 3.225 1.00 . A A . 28 TRP CZ3 1 1 5 3434 1 1 28 TRP H H 0.441 3.303 0.574 1.00 . A A . 28 TRP H 1 1 5 3435 1 1 28 TRP HA H 3.074 3.064 -0.340 1.00 . A A . 28 TRP HA 1 1 5 3436 1 1 28 TRP HB2 H 1.610 1.562 1.302 1.00 . A A . 28 TRP HB2 1 1 5 3437 1 1 28 TRP HB3 H 1.404 0.607 -0.165 1.00 . A A . 28 TRP HB3 1 1 5 3438 1 1 28 TRP HD1 H 4.374 1.853 -1.023 1.00 . A A . 28 TRP HD1 1 1 5 3439 1 1 28 TRP HE1 H 6.442 0.497 -0.227 1.00 . A A . 28 TRP HE1 1 1 5 3440 1 1 28 TRP HE3 H 2.211 -0.864 2.678 1.00 . A A . 28 TRP HE3 1 1 5 3441 1 1 28 TRP HH2 H 5.953 -2.798 3.550 1.00 . A A . 28 TRP HH2 1 1 5 3442 1 1 28 TRP HZ2 H 7.055 -1.492 1.750 1.00 . A A . 28 TRP HZ2 1 1 5 3443 1 1 28 TRP HZ3 H 3.536 -2.481 4.009 1.00 . A A . 28 TRP HZ3 1 1 5 3444 1 1 28 TRP N N 1.052 3.533 -0.145 1.00 . A A . 28 TRP N 1 1 5 3445 1 1 28 TRP NE1 N 5.547 0.413 0.164 1.00 . A A . 28 TRP NE1 1 1 5 3446 1 1 28 TRP O O 2.961 1.757 -2.597 1.00 . A A . 28 TRP O 1 1 5 3447 1 1 29 LEU C C 1.069 3.405 -4.825 1.00 . A A . 29 LEU C 1 1 5 3448 1 1 29 LEU CA C 0.705 2.163 -4.003 1.00 . A A . 29 LEU CA 1 1 5 3449 1 1 29 LEU CB C -0.761 1.725 -4.227 1.00 . A A . 29 LEU CB 1 1 5 3450 1 1 29 LEU CD1 C -1.142 1.985 -6.688 1.00 . A A . 29 LEU CD1 1 1 5 3451 1 1 29 LEU CD2 C -2.969 2.517 -5.073 1.00 . A A . 29 LEU CD2 1 1 5 3452 1 1 29 LEU CG C -1.460 2.563 -5.309 1.00 . A A . 29 LEU CG 1 1 5 3453 1 1 29 LEU H H 0.164 2.863 -2.040 1.00 . A A . 29 LEU H 1 1 5 3454 1 1 29 LEU HA H 1.367 1.352 -4.278 1.00 . A A . 29 LEU HA 1 1 5 3455 1 1 29 LEU HB2 H -0.774 0.688 -4.526 1.00 . A A . 29 LEU HB2 1 1 5 3456 1 1 29 LEU HB3 H -1.302 1.828 -3.297 1.00 . A A . 29 LEU HB3 1 1 5 3457 1 1 29 LEU HD11 H -0.119 1.640 -6.706 1.00 . A A . 29 LEU HD11 1 1 5 3458 1 1 29 LEU HD12 H -1.805 1.160 -6.895 1.00 . A A . 29 LEU HD12 1 1 5 3459 1 1 29 LEU HD13 H -1.276 2.750 -7.439 1.00 . A A . 29 LEU HD13 1 1 5 3460 1 1 29 LEU HD21 H -3.164 2.508 -4.009 1.00 . A A . 29 LEU HD21 1 1 5 3461 1 1 29 LEU HD22 H -3.430 3.386 -5.517 1.00 . A A . 29 LEU HD22 1 1 5 3462 1 1 29 LEU HD23 H -3.377 1.623 -5.522 1.00 . A A . 29 LEU HD23 1 1 5 3463 1 1 29 LEU HG H -1.121 3.587 -5.259 1.00 . A A . 29 LEU HG 1 1 5 3464 1 1 29 LEU N N 0.892 2.474 -2.561 1.00 . A A . 29 LEU N 1 1 5 3465 1 1 29 LEU O O 1.513 3.305 -5.948 1.00 . A A . 29 LEU O 1 1 5 3466 1 1 30 PHE C C 2.693 6.101 -4.871 1.00 . A A . 30 PHE C 1 1 5 3467 1 1 30 PHE CA C 1.206 5.806 -5.012 1.00 . A A . 30 PHE CA 1 1 5 3468 1 1 30 PHE CB C 0.387 6.976 -4.461 1.00 . A A . 30 PHE CB 1 1 5 3469 1 1 30 PHE CD1 C -0.534 7.591 -6.726 1.00 . A A . 30 PHE CD1 1 1 5 3470 1 1 30 PHE CD2 C 0.583 9.300 -5.418 1.00 . A A . 30 PHE CD2 1 1 5 3471 1 1 30 PHE CE1 C -0.765 8.521 -7.746 1.00 . A A . 30 PHE CE1 1 1 5 3472 1 1 30 PHE CE2 C 0.352 10.230 -6.438 1.00 . A A . 30 PHE CE2 1 1 5 3473 1 1 30 PHE CG C 0.140 7.980 -5.562 1.00 . A A . 30 PHE CG 1 1 5 3474 1 1 30 PHE CZ C -0.322 9.841 -7.602 1.00 . A A . 30 PHE CZ 1 1 5 3475 1 1 30 PHE H H 0.519 4.636 -3.385 1.00 . A A . 30 PHE H 1 1 5 3476 1 1 30 PHE HA H 0.971 5.651 -6.030 1.00 . A A . 30 PHE HA 1 1 5 3477 1 1 30 PHE HB2 H -0.557 6.610 -4.086 1.00 . A A . 30 PHE HB2 1 1 5 3478 1 1 30 PHE HB3 H 0.933 7.451 -3.659 1.00 . A A . 30 PHE HB3 1 1 5 3479 1 1 30 PHE HD1 H -0.876 6.572 -6.837 1.00 . A A . 30 PHE HD1 1 1 5 3480 1 1 30 PHE HD2 H 1.103 9.599 -4.521 1.00 . A A . 30 PHE HD2 1 1 5 3481 1 1 30 PHE HE1 H -1.284 8.222 -8.644 1.00 . A A . 30 PHE HE1 1 1 5 3482 1 1 30 PHE HE2 H 0.695 11.249 -6.326 1.00 . A A . 30 PHE HE2 1 1 5 3483 1 1 30 PHE HZ H -0.498 10.559 -8.389 1.00 . A A . 30 PHE HZ 1 1 5 3484 1 1 30 PHE N N 0.878 4.573 -4.274 1.00 . A A . 30 PHE N 1 1 5 3485 1 1 30 PHE O O 3.251 6.918 -5.575 1.00 . A A . 30 PHE O 1 1 5 3486 1 1 31 SER C C 5.546 4.819 -4.830 1.00 . A A . 31 SER C 1 1 5 3487 1 1 31 SER CA C 4.797 5.634 -3.779 1.00 . A A . 31 SER CA 1 1 5 3488 1 1 31 SER CB C 5.203 5.170 -2.380 1.00 . A A . 31 SER CB 1 1 5 3489 1 1 31 SER H H 2.859 4.765 -3.435 1.00 . A A . 31 SER H 1 1 5 3490 1 1 31 SER HA H 5.030 6.682 -3.900 1.00 . A A . 31 SER HA 1 1 5 3491 1 1 31 SER HB2 H 4.700 5.770 -1.640 1.00 . A A . 31 SER HB2 1 1 5 3492 1 1 31 SER HB3 H 4.925 4.133 -2.249 1.00 . A A . 31 SER HB3 1 1 5 3493 1 1 31 SER HG H 6.975 4.463 -1.999 1.00 . A A . 31 SER HG 1 1 5 3494 1 1 31 SER N N 3.337 5.424 -3.972 1.00 . A A . 31 SER N 1 1 5 3495 1 1 31 SER O O 6.726 4.996 -5.040 1.00 . A A . 31 SER O 1 1 5 3496 1 1 31 SER OG O 6.608 5.321 -2.227 1.00 . A A . 31 SER OG 1 1 5 3497 1 1 32 ALA C C 4.952 3.581 -7.904 1.00 . A A . 32 ALA C 1 1 5 3498 1 1 32 ALA CA C 5.490 3.110 -6.561 1.00 . A A . 32 ALA CA 1 1 5 3499 1 1 32 ALA CB C 5.139 1.637 -6.337 1.00 . A A . 32 ALA CB 1 1 5 3500 1 1 32 ALA H H 3.898 3.827 -5.313 1.00 . A A . 32 ALA H 1 1 5 3501 1 1 32 ALA HA H 6.567 3.245 -6.549 1.00 . A A . 32 ALA HA 1 1 5 3502 1 1 32 ALA HB1 H 4.337 1.564 -5.611 1.00 . A A . 32 ALA HB1 1 1 5 3503 1 1 32 ALA HB2 H 4.819 1.197 -7.271 1.00 . A A . 32 ALA HB2 1 1 5 3504 1 1 32 ALA HB3 H 6.006 1.112 -5.968 1.00 . A A . 32 ALA HB3 1 1 5 3505 1 1 32 ALA N N 4.853 3.938 -5.500 1.00 . A A . 32 ALA N 1 1 5 3506 1 1 32 ALA O O 5.703 3.875 -8.808 1.00 . A A . 32 ALA O 1 1 5 3507 1 1 33 VAL C C 3.628 5.575 -9.558 1.00 . A A . 33 VAL C 1 1 5 3508 1 1 33 VAL CA C 3.103 4.181 -9.318 1.00 . A A . 33 VAL CA 1 1 5 3509 1 1 33 VAL CB C 1.603 4.278 -9.243 1.00 . A A . 33 VAL CB 1 1 5 3510 1 1 33 VAL CG1 C 1.080 4.821 -10.574 1.00 . A A . 33 VAL CG1 1 1 5 3511 1 1 33 VAL CG2 C 0.999 2.904 -8.958 1.00 . A A . 33 VAL CG2 1 1 5 3512 1 1 33 VAL H H 3.064 3.476 -7.294 1.00 . A A . 33 VAL H 1 1 5 3513 1 1 33 VAL HA H 3.395 3.533 -10.126 1.00 . A A . 33 VAL HA 1 1 5 3514 1 1 33 VAL HB H 1.357 4.963 -8.457 1.00 . A A . 33 VAL HB 1 1 5 3515 1 1 33 VAL HG11 H 1.858 5.408 -11.053 1.00 . A A . 33 VAL HG11 1 1 5 3516 1 1 33 VAL HG12 H 0.805 3.998 -11.216 1.00 . A A . 33 VAL HG12 1 1 5 3517 1 1 33 VAL HG13 H 0.218 5.446 -10.395 1.00 . A A . 33 VAL HG13 1 1 5 3518 1 1 33 VAL HG21 H 1.761 2.147 -9.069 1.00 . A A . 33 VAL HG21 1 1 5 3519 1 1 33 VAL HG22 H 0.616 2.883 -7.949 1.00 . A A . 33 VAL HG22 1 1 5 3520 1 1 33 VAL HG23 H 0.196 2.712 -9.653 1.00 . A A . 33 VAL HG23 1 1 5 3521 1 1 33 VAL N N 3.659 3.691 -8.037 1.00 . A A . 33 VAL N 1 1 5 3522 1 1 33 VAL O O 3.935 5.930 -10.662 1.00 . A A . 33 VAL O 1 1 5 3523 1 1 34 ALA C C 5.591 7.587 -9.398 1.00 . A A . 34 ALA C 1 1 5 3524 1 1 34 ALA CA C 4.256 7.741 -8.725 1.00 . A A . 34 ALA CA 1 1 5 3525 1 1 34 ALA CB C 4.493 8.420 -7.390 1.00 . A A . 34 ALA CB 1 1 5 3526 1 1 34 ALA H H 3.468 6.065 -7.636 1.00 . A A . 34 ALA H 1 1 5 3527 1 1 34 ALA HA H 3.585 8.323 -9.337 1.00 . A A . 34 ALA HA 1 1 5 3528 1 1 34 ALA HB1 H 4.866 7.692 -6.682 1.00 . A A . 34 ALA HB1 1 1 5 3529 1 1 34 ALA HB2 H 5.229 9.200 -7.529 1.00 . A A . 34 ALA HB2 1 1 5 3530 1 1 34 ALA HB3 H 3.572 8.847 -7.029 1.00 . A A . 34 ALA HB3 1 1 5 3531 1 1 34 ALA N N 3.728 6.372 -8.528 1.00 . A A . 34 ALA N 1 1 5 3532 1 1 34 ALA O O 5.841 8.115 -10.456 1.00 . A A . 34 ALA O 1 1 5 3533 1 1 35 ILE C C 7.623 6.327 -10.814 1.00 . A A . 35 ILE C 1 1 5 3534 1 1 35 ILE CA C 7.777 6.583 -9.338 1.00 . A A . 35 ILE CA 1 1 5 3535 1 1 35 ILE CB C 8.387 5.347 -8.706 1.00 . A A . 35 ILE CB 1 1 5 3536 1 1 35 ILE CD1 C 8.763 4.140 -6.555 1.00 . A A . 35 ILE CD1 1 1 5 3537 1 1 35 ILE CG1 C 7.883 5.158 -7.288 1.00 . A A . 35 ILE CG1 1 1 5 3538 1 1 35 ILE CG2 C 9.876 5.546 -8.702 1.00 . A A . 35 ILE CG2 1 1 5 3539 1 1 35 ILE H H 6.200 6.420 -7.928 1.00 . A A . 35 ILE H 1 1 5 3540 1 1 35 ILE HA H 8.417 7.435 -9.172 1.00 . A A . 35 ILE HA 1 1 5 3541 1 1 35 ILE HB H 8.125 4.477 -9.287 1.00 . A A . 35 ILE HB 1 1 5 3542 1 1 35 ILE HD11 H 9.078 3.374 -7.247 1.00 . A A . 35 ILE HD11 1 1 5 3543 1 1 35 ILE HD12 H 9.630 4.640 -6.150 1.00 . A A . 35 ILE HD12 1 1 5 3544 1 1 35 ILE HD13 H 8.199 3.689 -5.752 1.00 . A A . 35 ILE HD13 1 1 5 3545 1 1 35 ILE HG12 H 7.903 6.103 -6.766 1.00 . A A . 35 ILE HG12 1 1 5 3546 1 1 35 ILE HG13 H 6.871 4.789 -7.340 1.00 . A A . 35 ILE HG13 1 1 5 3547 1 1 35 ILE HG21 H 10.122 6.258 -9.477 1.00 . A A . 35 ILE HG21 1 1 5 3548 1 1 35 ILE HG22 H 10.172 5.935 -7.743 1.00 . A A . 35 ILE HG22 1 1 5 3549 1 1 35 ILE HG23 H 10.369 4.609 -8.893 1.00 . A A . 35 ILE HG23 1 1 5 3550 1 1 35 ILE N N 6.446 6.833 -8.771 1.00 . A A . 35 ILE N 1 1 5 3551 1 1 35 ILE O O 8.471 6.664 -11.610 1.00 . A A . 35 ILE O 1 1 5 3552 1 1 36 VAL C C 5.977 6.801 -13.280 1.00 . A A . 36 VAL C 1 1 5 3553 1 1 36 VAL CA C 6.313 5.473 -12.617 1.00 . A A . 36 VAL CA 1 1 5 3554 1 1 36 VAL CB C 5.171 4.478 -12.776 1.00 . A A . 36 VAL CB 1 1 5 3555 1 1 36 VAL CG1 C 5.195 3.913 -14.198 1.00 . A A . 36 VAL CG1 1 1 5 3556 1 1 36 VAL CG2 C 5.358 3.342 -11.758 1.00 . A A . 36 VAL CG2 1 1 5 3557 1 1 36 VAL H H 5.846 5.483 -10.519 1.00 . A A . 36 VAL H 1 1 5 3558 1 1 36 VAL HA H 7.215 5.068 -13.046 1.00 . A A . 36 VAL HA 1 1 5 3559 1 1 36 VAL HB H 4.230 4.976 -12.599 1.00 . A A . 36 VAL HB 1 1 5 3560 1 1 36 VAL HG11 H 6.053 4.307 -14.726 1.00 . A A . 36 VAL HG11 1 1 5 3561 1 1 36 VAL HG12 H 5.260 2.836 -14.155 1.00 . A A . 36 VAL HG12 1 1 5 3562 1 1 36 VAL HG13 H 4.291 4.201 -14.713 1.00 . A A . 36 VAL HG13 1 1 5 3563 1 1 36 VAL HG21 H 5.779 3.736 -10.837 1.00 . A A . 36 VAL HG21 1 1 5 3564 1 1 36 VAL HG22 H 4.402 2.888 -11.548 1.00 . A A . 36 VAL HG22 1 1 5 3565 1 1 36 VAL HG23 H 6.027 2.601 -12.167 1.00 . A A . 36 VAL HG23 1 1 5 3566 1 1 36 VAL N N 6.531 5.739 -11.187 1.00 . A A . 36 VAL N 1 1 5 3567 1 1 36 VAL O O 6.555 7.184 -14.276 1.00 . A A . 36 VAL O 1 1 5 3568 1 1 37 ALA C C 6.019 9.593 -13.542 1.00 . A A . 37 ALA C 1 1 5 3569 1 1 37 ALA CA C 4.720 8.841 -13.258 1.00 . A A . 37 ALA CA 1 1 5 3570 1 1 37 ALA CB C 3.871 9.609 -12.243 1.00 . A A . 37 ALA CB 1 1 5 3571 1 1 37 ALA H H 4.637 7.222 -11.904 1.00 . A A . 37 ALA H 1 1 5 3572 1 1 37 ALA HA H 4.166 8.701 -14.165 1.00 . A A . 37 ALA HA 1 1 5 3573 1 1 37 ALA HB1 H 4.517 10.097 -11.530 1.00 . A A . 37 ALA HB1 1 1 5 3574 1 1 37 ALA HB2 H 3.275 10.348 -12.757 1.00 . A A . 37 ALA HB2 1 1 5 3575 1 1 37 ALA HB3 H 3.220 8.917 -11.724 1.00 . A A . 37 ALA HB3 1 1 5 3576 1 1 37 ALA N N 5.070 7.529 -12.706 1.00 . A A . 37 ALA N 1 1 5 3577 1 1 37 ALA O O 6.100 10.384 -14.459 1.00 . A A . 37 ALA O 1 1 5 3578 1 1 38 HIS C C 9.062 9.363 -14.178 1.00 . A A . 38 HIS C 1 1 5 3579 1 1 38 HIS CA C 8.332 10.050 -13.022 1.00 . A A . 38 HIS CA 1 1 5 3580 1 1 38 HIS CB C 9.202 10.015 -11.765 1.00 . A A . 38 HIS CB 1 1 5 3581 1 1 38 HIS CD2 C 7.065 10.655 -10.374 1.00 . A A . 38 HIS CD2 1 1 5 3582 1 1 38 HIS CE1 C 7.731 9.959 -8.433 1.00 . A A . 38 HIS CE1 1 1 5 3583 1 1 38 HIS CG C 8.327 10.142 -10.547 1.00 . A A . 38 HIS CG 1 1 5 3584 1 1 38 HIS H H 6.983 8.701 -12.023 1.00 . A A . 38 HIS H 1 1 5 3585 1 1 38 HIS HA H 8.123 11.068 -13.291 1.00 . A A . 38 HIS HA 1 1 5 3586 1 1 38 HIS HB2 H 9.740 9.079 -11.725 1.00 . A A . 38 HIS HB2 1 1 5 3587 1 1 38 HIS HB3 H 9.904 10.834 -11.789 1.00 . A A . 38 HIS HB3 1 1 5 3588 1 1 38 HIS HD1 H 9.591 9.284 -9.079 1.00 . A A . 38 HIS HD1 1 1 5 3589 1 1 38 HIS HD2 H 6.457 11.085 -11.156 1.00 . A A . 38 HIS HD2 1 1 5 3590 1 1 38 HIS HE1 H 7.765 9.725 -7.379 1.00 . A A . 38 HIS HE1 1 1 5 3591 1 1 38 HIS N N 7.050 9.348 -12.766 1.00 . A A . 38 HIS N 1 1 5 3592 1 1 38 HIS ND1 N 8.733 9.704 -9.296 1.00 . A A . 38 HIS ND1 1 1 5 3593 1 1 38 HIS NE2 N 6.691 10.539 -9.039 1.00 . A A . 38 HIS NE2 1 1 5 3594 1 1 38 HIS O O 9.565 10.006 -15.078 1.00 . A A . 38 HIS O 1 1 5 3595 1 1 39 LEU C C 8.799 7.117 -16.402 1.00 . A A . 39 LEU C 1 1 5 3596 1 1 39 LEU CA C 9.793 7.332 -15.266 1.00 . A A . 39 LEU CA 1 1 5 3597 1 1 39 LEU CB C 10.291 5.976 -14.761 1.00 . A A . 39 LEU CB 1 1 5 3598 1 1 39 LEU CD1 C 11.196 4.764 -12.772 1.00 . A A . 39 LEU CD1 1 1 5 3599 1 1 39 LEU CD2 C 12.219 6.926 -13.491 1.00 . A A . 39 LEU CD2 1 1 5 3600 1 1 39 LEU CG C 10.911 6.142 -13.374 1.00 . A A . 39 LEU CG 1 1 5 3601 1 1 39 LEU H H 8.697 7.562 -13.444 1.00 . A A . 39 LEU H 1 1 5 3602 1 1 39 LEU HA H 10.624 7.916 -15.620 1.00 . A A . 39 LEU HA 1 1 5 3603 1 1 39 LEU HB2 H 9.462 5.285 -14.705 1.00 . A A . 39 LEU HB2 1 1 5 3604 1 1 39 LEU HB3 H 11.036 5.589 -15.442 1.00 . A A . 39 LEU HB3 1 1 5 3605 1 1 39 LEU HD11 H 10.324 4.137 -12.881 1.00 . A A . 39 LEU HD11 1 1 5 3606 1 1 39 LEU HD12 H 12.030 4.313 -13.287 1.00 . A A . 39 LEU HD12 1 1 5 3607 1 1 39 LEU HD13 H 11.434 4.871 -11.725 1.00 . A A . 39 LEU HD13 1 1 5 3608 1 1 39 LEU HD21 H 12.563 6.903 -14.515 1.00 . A A . 39 LEU HD21 1 1 5 3609 1 1 39 LEU HD22 H 12.054 7.950 -13.191 1.00 . A A . 39 LEU HD22 1 1 5 3610 1 1 39 LEU HD23 H 12.966 6.478 -12.851 1.00 . A A . 39 LEU HD23 1 1 5 3611 1 1 39 LEU HG H 10.224 6.677 -12.736 1.00 . A A . 39 LEU HG 1 1 5 3612 1 1 39 LEU N N 9.113 8.060 -14.167 1.00 . A A . 39 LEU N 1 1 5 3613 1 1 39 LEU O O 8.940 7.677 -17.466 1.00 . A A . 39 LEU O 1 1 5 3614 1 1 40 ALA C C 6.501 7.317 -18.043 1.00 . A A . 40 ALA C 1 1 5 3615 1 1 40 ALA CA C 6.782 6.044 -17.240 1.00 . A A . 40 ALA CA 1 1 5 3616 1 1 40 ALA CB C 5.479 5.576 -16.597 1.00 . A A . 40 ALA CB 1 1 5 3617 1 1 40 ALA H H 7.719 5.864 -15.310 1.00 . A A . 40 ALA H 1 1 5 3618 1 1 40 ALA HA H 7.145 5.273 -17.898 1.00 . A A . 40 ALA HA 1 1 5 3619 1 1 40 ALA HB1 H 5.495 4.502 -16.491 1.00 . A A . 40 ALA HB1 1 1 5 3620 1 1 40 ALA HB2 H 4.648 5.864 -17.225 1.00 . A A . 40 ALA HB2 1 1 5 3621 1 1 40 ALA HB3 H 5.370 6.034 -15.624 1.00 . A A . 40 ALA HB3 1 1 5 3622 1 1 40 ALA N N 7.798 6.307 -16.180 1.00 . A A . 40 ALA N 1 1 5 3623 1 1 40 ALA O O 6.274 7.267 -19.235 1.00 . A A . 40 ALA O 1 1 5 3624 1 1 41 VAL C C 7.408 10.062 -19.046 1.00 . A A . 41 VAL C 1 1 5 3625 1 1 41 VAL CA C 6.217 9.716 -18.151 1.00 . A A . 41 VAL CA 1 1 5 3626 1 1 41 VAL CB C 5.956 10.850 -17.162 1.00 . A A . 41 VAL CB 1 1 5 3627 1 1 41 VAL CG1 C 5.958 12.188 -17.902 1.00 . A A . 41 VAL CG1 1 1 5 3628 1 1 41 VAL CG2 C 4.591 10.632 -16.507 1.00 . A A . 41 VAL CG2 1 1 5 3629 1 1 41 VAL H H 6.675 8.493 -16.440 1.00 . A A . 41 VAL H 1 1 5 3630 1 1 41 VAL HA H 5.343 9.569 -18.763 1.00 . A A . 41 VAL HA 1 1 5 3631 1 1 41 VAL HB H 6.727 10.854 -16.405 1.00 . A A . 41 VAL HB 1 1 5 3632 1 1 41 VAL HG11 H 5.868 12.012 -18.964 1.00 . A A . 41 VAL HG11 1 1 5 3633 1 1 41 VAL HG12 H 5.125 12.787 -17.565 1.00 . A A . 41 VAL HG12 1 1 5 3634 1 1 41 VAL HG13 H 6.882 12.710 -17.701 1.00 . A A . 41 VAL HG13 1 1 5 3635 1 1 41 VAL HG21 H 4.463 9.581 -16.283 1.00 . A A . 41 VAL HG21 1 1 5 3636 1 1 41 VAL HG22 H 4.534 11.204 -15.592 1.00 . A A . 41 VAL HG22 1 1 5 3637 1 1 41 VAL HG23 H 3.812 10.954 -17.182 1.00 . A A . 41 VAL HG23 1 1 5 3638 1 1 41 VAL N N 6.500 8.460 -17.406 1.00 . A A . 41 VAL N 1 1 5 3639 1 1 41 VAL O O 7.270 10.217 -20.242 1.00 . A A . 41 VAL O 1 1 5 3640 1 1 42 TYR C C 9.949 9.405 -20.373 1.00 . A A . 42 TYR C 1 1 5 3641 1 1 42 TYR CA C 9.773 10.492 -19.311 1.00 . A A . 42 TYR CA 1 1 5 3642 1 1 42 TYR CB C 11.014 10.545 -18.418 1.00 . A A . 42 TYR CB 1 1 5 3643 1 1 42 TYR CD1 C 10.532 12.988 -18.044 1.00 . A A . 42 TYR CD1 1 1 5 3644 1 1 42 TYR CD2 C 11.251 11.641 -16.161 1.00 . A A . 42 TYR CD2 1 1 5 3645 1 1 42 TYR CE1 C 10.454 14.111 -17.211 1.00 . A A . 42 TYR CE1 1 1 5 3646 1 1 42 TYR CE2 C 11.172 12.763 -15.327 1.00 . A A . 42 TYR CE2 1 1 5 3647 1 1 42 TYR CG C 10.931 11.754 -17.518 1.00 . A A . 42 TYR CG 1 1 5 3648 1 1 42 TYR CZ C 10.774 13.998 -15.852 1.00 . A A . 42 TYR CZ 1 1 5 3649 1 1 42 TYR H H 8.676 10.035 -17.518 1.00 . A A . 42 TYR H 1 1 5 3650 1 1 42 TYR HA H 9.631 11.449 -19.790 1.00 . A A . 42 TYR HA 1 1 5 3651 1 1 42 TYR HB2 H 11.065 9.649 -17.818 1.00 . A A . 42 TYR HB2 1 1 5 3652 1 1 42 TYR HB3 H 11.898 10.617 -19.034 1.00 . A A . 42 TYR HB3 1 1 5 3653 1 1 42 TYR HD1 H 10.286 13.074 -19.091 1.00 . A A . 42 TYR HD1 1 1 5 3654 1 1 42 TYR HD2 H 11.557 10.687 -15.756 1.00 . A A . 42 TYR HD2 1 1 5 3655 1 1 42 TYR HE1 H 10.148 15.063 -17.617 1.00 . A A . 42 TYR HE1 1 1 5 3656 1 1 42 TYR HE2 H 11.418 12.676 -14.279 1.00 . A A . 42 TYR HE2 1 1 5 3657 1 1 42 TYR HH H 9.896 15.586 -15.258 1.00 . A A . 42 TYR HH 1 1 5 3658 1 1 42 TYR N N 8.579 10.171 -18.481 1.00 . A A . 42 TYR N 1 1 5 3659 1 1 42 TYR O O 10.663 9.572 -21.342 1.00 . A A . 42 TYR O 1 1 5 3660 1 1 42 TYR OH O 10.695 15.104 -15.031 1.00 . A A . 42 TYR OH 1 1 5 3661 1 1 43 ILE C C 8.289 7.334 -22.221 1.00 . A A . 43 ILE C 1 1 5 3662 1 1 43 ILE CA C 9.399 7.181 -21.178 1.00 . A A . 43 ILE CA 1 1 5 3663 1 1 43 ILE CB C 9.248 5.845 -20.436 1.00 . A A . 43 ILE CB 1 1 5 3664 1 1 43 ILE CD1 C 10.350 4.995 -18.359 1.00 . A A . 43 ILE CD1 1 1 5 3665 1 1 43 ILE CG1 C 10.586 5.470 -19.795 1.00 . A A . 43 ILE CG1 1 1 5 3666 1 1 43 ILE CG2 C 8.826 4.738 -21.408 1.00 . A A . 43 ILE CG2 1 1 5 3667 1 1 43 ILE H H 8.724 8.187 -19.407 1.00 . A A . 43 ILE H 1 1 5 3668 1 1 43 ILE HA H 10.362 7.220 -21.665 1.00 . A A . 43 ILE HA 1 1 5 3669 1 1 43 ILE HB H 8.499 5.948 -19.664 1.00 . A A . 43 ILE HB 1 1 5 3670 1 1 43 ILE HD11 H 9.293 4.843 -18.200 1.00 . A A . 43 ILE HD11 1 1 5 3671 1 1 43 ILE HD12 H 10.877 4.067 -18.195 1.00 . A A . 43 ILE HD12 1 1 5 3672 1 1 43 ILE HD13 H 10.714 5.742 -17.669 1.00 . A A . 43 ILE HD13 1 1 5 3673 1 1 43 ILE HG12 H 11.048 4.676 -20.365 1.00 . A A . 43 ILE HG12 1 1 5 3674 1 1 43 ILE HG13 H 11.236 6.331 -19.785 1.00 . A A . 43 ILE HG13 1 1 5 3675 1 1 43 ILE HG21 H 8.914 5.095 -22.423 1.00 . A A . 43 ILE HG21 1 1 5 3676 1 1 43 ILE HG22 H 9.464 3.877 -21.272 1.00 . A A . 43 ILE HG22 1 1 5 3677 1 1 43 ILE HG23 H 7.801 4.460 -21.209 1.00 . A A . 43 ILE HG23 1 1 5 3678 1 1 43 ILE N N 9.293 8.293 -20.193 1.00 . A A . 43 ILE N 1 1 5 3679 1 1 43 ILE O O 8.434 6.936 -23.360 1.00 . A A . 43 ILE O 1 1 5 3680 1 1 44 TRP C C 6.085 9.515 -23.357 1.00 . A A . 44 TRP C 1 1 5 3681 1 1 44 TRP CA C 6.065 8.090 -22.813 1.00 . A A . 44 TRP CA 1 1 5 3682 1 1 44 TRP CB C 4.729 7.827 -22.118 1.00 . A A . 44 TRP CB 1 1 5 3683 1 1 44 TRP CD1 C 5.112 5.454 -21.347 1.00 . A A . 44 TRP CD1 1 1 5 3684 1 1 44 TRP CD2 C 3.456 5.613 -22.860 1.00 . A A . 44 TRP CD2 1 1 5 3685 1 1 44 TRP CE2 C 3.563 4.245 -22.518 1.00 . A A . 44 TRP CE2 1 1 5 3686 1 1 44 TRP CE3 C 2.480 5.988 -23.801 1.00 . A A . 44 TRP CE3 1 1 5 3687 1 1 44 TRP CG C 4.452 6.359 -22.102 1.00 . A A . 44 TRP CG 1 1 5 3688 1 1 44 TRP CH2 C 1.766 3.670 -24.023 1.00 . A A . 44 TRP CH2 1 1 5 3689 1 1 44 TRP CZ2 C 2.731 3.281 -23.088 1.00 . A A . 44 TRP CZ2 1 1 5 3690 1 1 44 TRP CZ3 C 1.641 5.021 -24.378 1.00 . A A . 44 TRP CZ3 1 1 5 3691 1 1 44 TRP H H 7.083 8.228 -20.919 1.00 . A A . 44 TRP H 1 1 5 3692 1 1 44 TRP HA H 6.193 7.398 -23.629 1.00 . A A . 44 TRP HA 1 1 5 3693 1 1 44 TRP HB2 H 4.773 8.195 -21.103 1.00 . A A . 44 TRP HB2 1 1 5 3694 1 1 44 TRP HB3 H 3.940 8.337 -22.651 1.00 . A A . 44 TRP HB3 1 1 5 3695 1 1 44 TRP HD1 H 5.919 5.676 -20.665 1.00 . A A . 44 TRP HD1 1 1 5 3696 1 1 44 TRP HE1 H 4.889 3.366 -21.171 1.00 . A A . 44 TRP HE1 1 1 5 3697 1 1 44 TRP HE3 H 2.376 7.025 -24.082 1.00 . A A . 44 TRP HE3 1 1 5 3698 1 1 44 TRP HH2 H 1.117 2.932 -24.469 1.00 . A A . 44 TRP HH2 1 1 5 3699 1 1 44 TRP HZ2 H 2.831 2.242 -22.811 1.00 . A A . 44 TRP HZ2 1 1 5 3700 1 1 44 TRP HZ3 H 0.895 5.319 -25.099 1.00 . A A . 44 TRP HZ3 1 1 5 3701 1 1 44 TRP N N 7.180 7.911 -21.841 1.00 . A A . 44 TRP N 1 1 5 3702 1 1 44 TRP NE1 N 4.587 4.198 -21.592 1.00 . A A . 44 TRP NE1 1 1 5 3703 1 1 44 TRP O O 5.188 9.936 -24.060 1.00 . A A . 44 TRP O 1 1 5 3704 1 1 45 ARG C C 6.840 11.650 -25.043 1.00 . A A . 45 ARG C 1 1 5 3705 1 1 45 ARG CA C 7.197 11.653 -23.555 1.00 . A A . 45 ARG CA 1 1 5 3706 1 1 45 ARG CB C 8.630 12.162 -23.357 1.00 . A A . 45 ARG CB 1 1 5 3707 1 1 45 ARG CD C 7.858 14.046 -21.894 1.00 . A A . 45 ARG CD 1 1 5 3708 1 1 45 ARG CG C 8.761 12.813 -21.975 1.00 . A A . 45 ARG CG 1 1 5 3709 1 1 45 ARG CZ C 7.901 16.039 -20.517 1.00 . A A . 45 ARG CZ 1 1 5 3710 1 1 45 ARG H H 7.822 9.894 -22.488 1.00 . A A . 45 ARG H 1 1 5 3711 1 1 45 ARG HA H 6.506 12.281 -23.016 1.00 . A A . 45 ARG HA 1 1 5 3712 1 1 45 ARG HB2 H 9.316 11.330 -23.426 1.00 . A A . 45 ARG HB2 1 1 5 3713 1 1 45 ARG HB3 H 8.869 12.884 -24.119 1.00 . A A . 45 ARG HB3 1 1 5 3714 1 1 45 ARG HD2 H 8.082 14.711 -22.714 1.00 . A A . 45 ARG HD2 1 1 5 3715 1 1 45 ARG HD3 H 6.825 13.741 -21.948 1.00 . A A . 45 ARG HD3 1 1 5 3716 1 1 45 ARG HE H 8.406 14.249 -19.820 1.00 . A A . 45 ARG HE 1 1 5 3717 1 1 45 ARG HG2 H 8.468 12.102 -21.215 1.00 . A A . 45 ARG HG2 1 1 5 3718 1 1 45 ARG HG3 H 9.786 13.109 -21.814 1.00 . A A . 45 ARG HG3 1 1 5 3719 1 1 45 ARG HH11 H 5.994 15.941 -21.121 1.00 . A A . 45 ARG HH11 1 1 5 3720 1 1 45 ARG HH12 H 6.584 17.528 -20.756 1.00 . A A . 45 ARG HH12 1 1 5 3721 1 1 45 ARG HH21 H 9.760 16.439 -19.891 1.00 . A A . 45 ARG HH21 1 1 5 3722 1 1 45 ARG HH22 H 8.715 17.809 -20.059 1.00 . A A . 45 ARG HH22 1 1 5 3723 1 1 45 ARG N N 7.108 10.258 -23.047 1.00 . A A . 45 ARG N 1 1 5 3724 1 1 45 ARG NE N 8.099 14.752 -20.604 1.00 . A A . 45 ARG NE 1 1 5 3725 1 1 45 ARG NH1 N 6.735 16.542 -20.822 1.00 . A A . 45 ARG NH1 1 1 5 3726 1 1 45 ARG NH2 N 8.867 16.824 -20.125 1.00 . A A . 45 ARG NH2 1 1 5 3727 1 1 45 ARG O O 6.755 10.601 -25.650 1.00 . A A . 45 ARG O 1 1 5 3728 1 1 46 PRO C C 7.518 12.674 -27.886 1.00 . A A . 46 PRO C 1 1 5 3729 1 1 46 PRO CA C 6.293 12.958 -27.016 1.00 . A A . 46 PRO CA 1 1 5 3730 1 1 46 PRO CB C 5.831 14.413 -27.136 1.00 . A A . 46 PRO CB 1 1 5 3731 1 1 46 PRO CD C 6.754 14.100 -24.865 1.00 . A A . 46 PRO CD 1 1 5 3732 1 1 46 PRO CG C 6.447 15.166 -25.933 1.00 . A A . 46 PRO CG 1 1 5 3733 1 1 46 PRO HB2 H 6.184 14.839 -28.066 1.00 . A A . 46 PRO HB2 1 1 5 3734 1 1 46 PRO HB3 H 4.755 14.468 -27.086 1.00 . A A . 46 PRO HB3 1 1 5 3735 1 1 46 PRO HD2 H 7.752 14.236 -24.479 1.00 . A A . 46 PRO HD2 1 1 5 3736 1 1 46 PRO HD3 H 6.028 14.140 -24.068 1.00 . A A . 46 PRO HD3 1 1 5 3737 1 1 46 PRO HG2 H 7.356 15.665 -26.237 1.00 . A A . 46 PRO HG2 1 1 5 3738 1 1 46 PRO HG3 H 5.741 15.881 -25.542 1.00 . A A . 46 PRO HG3 1 1 5 3739 1 1 46 PRO N N 6.641 12.818 -25.594 1.00 . A A . 46 PRO N 1 1 5 3740 1 1 46 PRO O O 8.498 13.392 -27.856 1.00 . A A . 46 PRO O 1 1 5 3741 1 1 47 TRP C C 8.090 10.949 -30.919 1.00 . A A . 47 TRP C 1 1 5 3742 1 1 47 TRP CA C 8.621 11.275 -29.528 1.00 . A A . 47 TRP CA 1 1 5 3743 1 1 47 TRP CB C 9.338 10.048 -28.958 1.00 . A A . 47 TRP CB 1 1 5 3744 1 1 47 TRP CD1 C 8.975 9.612 -26.488 1.00 . A A . 47 TRP CD1 1 1 5 3745 1 1 47 TRP CD2 C 10.578 11.144 -26.876 1.00 . A A . 47 TRP CD2 1 1 5 3746 1 1 47 TRP CE2 C 10.486 11.000 -25.472 1.00 . A A . 47 TRP CE2 1 1 5 3747 1 1 47 TRP CE3 C 11.519 12.057 -27.388 1.00 . A A . 47 TRP CE3 1 1 5 3748 1 1 47 TRP CG C 9.610 10.253 -27.501 1.00 . A A . 47 TRP CG 1 1 5 3749 1 1 47 TRP CH2 C 12.227 12.634 -25.132 1.00 . A A . 47 TRP CH2 1 1 5 3750 1 1 47 TRP CZ2 C 11.298 11.733 -24.606 1.00 . A A . 47 TRP CZ2 1 1 5 3751 1 1 47 TRP CZ3 C 12.338 12.796 -26.520 1.00 . A A . 47 TRP CZ3 1 1 5 3752 1 1 47 TRP H H 6.665 11.058 -28.667 1.00 . A A . 47 TRP H 1 1 5 3753 1 1 47 TRP HA H 9.305 12.109 -29.583 1.00 . A A . 47 TRP HA 1 1 5 3754 1 1 47 TRP HB2 H 8.715 9.175 -29.088 1.00 . A A . 47 TRP HB2 1 1 5 3755 1 1 47 TRP HB3 H 10.272 9.902 -29.481 1.00 . A A . 47 TRP HB3 1 1 5 3756 1 1 47 TRP HD1 H 8.193 8.874 -26.598 1.00 . A A . 47 TRP HD1 1 1 5 3757 1 1 47 TRP HE1 H 9.211 9.747 -24.400 1.00 . A A . 47 TRP HE1 1 1 5 3758 1 1 47 TRP HE3 H 11.613 12.188 -28.456 1.00 . A A . 47 TRP HE3 1 1 5 3759 1 1 47 TRP HH2 H 12.860 13.206 -24.469 1.00 . A A . 47 TRP HH2 1 1 5 3760 1 1 47 TRP HZ2 H 11.208 11.605 -23.537 1.00 . A A . 47 TRP HZ2 1 1 5 3761 1 1 47 TRP HZ3 H 13.058 13.493 -26.924 1.00 . A A . 47 TRP HZ3 1 1 5 3762 1 1 47 TRP N N 7.468 11.624 -28.659 1.00 . A A . 47 TRP N 1 1 5 3763 1 1 47 TRP NE1 N 9.497 10.054 -25.286 1.00 . A A . 47 TRP NE1 1 1 5 3764 1 1 47 TRP O O 8.558 11.463 -31.916 1.00 . A A . 47 TRP O 1 1 5 3765 1 1 48 PHE C C 7.633 9.524 -33.323 1.00 . A A . 48 PHE C 1 1 5 3766 1 1 48 PHE CA C 6.515 9.737 -32.299 1.00 . A A . 48 PHE CA 1 1 5 3767 1 1 48 PHE CB C 5.596 10.866 -32.765 1.00 . A A . 48 PHE CB 1 1 5 3768 1 1 48 PHE CD1 C 3.608 9.318 -32.837 1.00 . A A . 48 PHE CD1 1 1 5 3769 1 1 48 PHE CD2 C 4.083 10.699 -34.773 1.00 . A A . 48 PHE CD2 1 1 5 3770 1 1 48 PHE CE1 C 2.499 8.774 -33.497 1.00 . A A . 48 PHE CE1 1 1 5 3771 1 1 48 PHE CE2 C 2.974 10.156 -35.433 1.00 . A A . 48 PHE CE2 1 1 5 3772 1 1 48 PHE CG C 4.400 10.280 -33.476 1.00 . A A . 48 PHE CG 1 1 5 3773 1 1 48 PHE CZ C 2.182 9.194 -34.795 1.00 . A A . 48 PHE CZ 1 1 5 3774 1 1 48 PHE H H 6.739 9.712 -30.163 1.00 . A A . 48 PHE H 1 1 5 3775 1 1 48 PHE HA H 5.943 8.829 -32.193 1.00 . A A . 48 PHE HA 1 1 5 3776 1 1 48 PHE HB2 H 5.265 11.433 -31.906 1.00 . A A . 48 PHE HB2 1 1 5 3777 1 1 48 PHE HB3 H 6.135 11.513 -33.440 1.00 . A A . 48 PHE HB3 1 1 5 3778 1 1 48 PHE HD1 H 3.852 8.995 -31.837 1.00 . A A . 48 PHE HD1 1 1 5 3779 1 1 48 PHE HD2 H 4.694 11.441 -35.265 1.00 . A A . 48 PHE HD2 1 1 5 3780 1 1 48 PHE HE1 H 1.888 8.032 -33.005 1.00 . A A . 48 PHE HE1 1 1 5 3781 1 1 48 PHE HE2 H 2.729 10.479 -36.434 1.00 . A A . 48 PHE HE2 1 1 5 3782 1 1 48 PHE HZ H 1.327 8.774 -35.303 1.00 . A A . 48 PHE HZ 1 1 5 3783 1 1 48 PHE N N 7.102 10.102 -30.985 1.00 . A A . 48 PHE N 1 1 5 3784 1 1 48 PHE O O 8.591 8.845 -32.992 1.00 . A A . 48 PHE O 1 1 5 3785 1 1 48 PHE OXT O 7.512 10.044 -34.419 1.00 . A A . 48 PHE OXT 1 1 6 3786 1 1 1 ALA C C -30.852 -2.987 11.653 1.00 . A A . 1 ALA C 1 1 6 3787 1 1 1 ALA CA C -31.295 -4.160 10.778 1.00 . A A . 1 ALA CA 1 1 6 3788 1 1 1 ALA CB C -31.410 -5.421 11.638 1.00 . A A . 1 ALA CB 1 1 6 3789 1 1 1 ALA H1 H -30.058 -3.479 9.247 1.00 . A A . 1 ALA H1 1 1 6 3790 1 1 1 ALA H2 H -29.426 -4.797 10.114 1.00 . A A . 1 ALA H2 1 1 6 3791 1 1 1 ALA H3 H -30.680 -5.035 8.992 1.00 . A A . 1 ALA H3 1 1 6 3792 1 1 1 ALA HA H -32.253 -3.938 10.334 1.00 . A A . 1 ALA HA 1 1 6 3793 1 1 1 ALA HB1 H -32.449 -5.600 11.875 1.00 . A A . 1 ALA HB1 1 1 6 3794 1 1 1 ALA HB2 H -31.015 -6.266 11.093 1.00 . A A . 1 ALA HB2 1 1 6 3795 1 1 1 ALA HB3 H -30.850 -5.286 12.551 1.00 . A A . 1 ALA HB3 1 1 6 3796 1 1 1 ALA N N -30.289 -4.385 9.701 1.00 . A A . 1 ALA N 1 1 6 3797 1 1 1 ALA O O -31.617 -2.461 12.437 1.00 . A A . 1 ALA O 1 1 6 3798 1 1 2 ASP C C -27.656 -1.167 12.038 1.00 . A A . 2 ASP C 1 1 6 3799 1 1 2 ASP CA C -29.132 -1.432 12.355 1.00 . A A . 2 ASP CA 1 1 6 3800 1 1 2 ASP CB C -29.288 -1.780 13.838 1.00 . A A . 2 ASP CB 1 1 6 3801 1 1 2 ASP CG C -28.351 -2.936 14.192 1.00 . A A . 2 ASP CG 1 1 6 3802 1 1 2 ASP H H -29.017 -3.009 10.891 1.00 . A A . 2 ASP H 1 1 6 3803 1 1 2 ASP HA H -29.712 -0.549 12.130 1.00 . A A . 2 ASP HA 1 1 6 3804 1 1 2 ASP HB2 H -29.038 -0.917 14.438 1.00 . A A . 2 ASP HB2 1 1 6 3805 1 1 2 ASP HB3 H -30.308 -2.073 14.034 1.00 . A A . 2 ASP HB3 1 1 6 3806 1 1 2 ASP N N -29.620 -2.571 11.528 1.00 . A A . 2 ASP N 1 1 6 3807 1 1 2 ASP O O -27.218 -1.311 10.914 1.00 . A A . 2 ASP O 1 1 6 3808 1 1 2 ASP OD1 O -27.912 -3.618 13.281 1.00 . A A . 2 ASP OD1 1 1 6 3809 1 1 2 ASP OD2 O -28.089 -3.121 15.370 1.00 . A A . 2 ASP OD2 1 1 6 3810 1 1 3 LYS C C -24.775 -0.250 14.118 1.00 . A A . 3 LYS C 1 1 6 3811 1 1 3 LYS CA C -25.438 -0.522 12.789 1.00 . A A . 3 LYS CA 1 1 6 3812 1 1 3 LYS CB C -25.227 0.670 11.848 1.00 . A A . 3 LYS CB 1 1 6 3813 1 1 3 LYS CD C -26.304 2.773 11.029 1.00 . A A . 3 LYS CD 1 1 6 3814 1 1 3 LYS CE C -27.437 3.691 11.492 1.00 . A A . 3 LYS CE 1 1 6 3815 1 1 3 LYS CG C -26.562 1.350 11.530 1.00 . A A . 3 LYS CG 1 1 6 3816 1 1 3 LYS H H -27.247 -0.687 13.923 1.00 . A A . 3 LYS H 1 1 6 3817 1 1 3 LYS HA H -24.976 -1.410 12.367 1.00 . A A . 3 LYS HA 1 1 6 3818 1 1 3 LYS HB2 H -24.568 1.383 12.321 1.00 . A A . 3 LYS HB2 1 1 6 3819 1 1 3 LYS HB3 H -24.775 0.319 10.935 1.00 . A A . 3 LYS HB3 1 1 6 3820 1 1 3 LYS HD2 H -25.364 3.129 11.427 1.00 . A A . 3 LYS HD2 1 1 6 3821 1 1 3 LYS HD3 H -26.261 2.772 9.950 1.00 . A A . 3 LYS HD3 1 1 6 3822 1 1 3 LYS HE2 H -27.377 3.824 12.562 1.00 . A A . 3 LYS HE2 1 1 6 3823 1 1 3 LYS HE3 H -27.344 4.650 11.004 1.00 . A A . 3 LYS HE3 1 1 6 3824 1 1 3 LYS HG2 H -27.079 0.787 10.766 1.00 . A A . 3 LYS HG2 1 1 6 3825 1 1 3 LYS HG3 H -27.168 1.390 12.422 1.00 . A A . 3 LYS HG3 1 1 6 3826 1 1 3 LYS HZ1 H -28.791 2.109 11.515 1.00 . A A . 3 LYS HZ1 1 1 6 3827 1 1 3 LYS HZ2 H -29.517 3.641 11.551 1.00 . A A . 3 LYS HZ2 1 1 6 3828 1 1 3 LYS HZ3 H -28.851 3.052 10.104 1.00 . A A . 3 LYS HZ3 1 1 6 3829 1 1 3 LYS N N -26.882 -0.788 13.022 1.00 . A A . 3 LYS N 1 1 6 3830 1 1 3 LYS NZ N -28.748 3.077 11.139 1.00 . A A . 3 LYS NZ 1 1 6 3831 1 1 3 LYS O O -24.956 0.771 14.753 1.00 . A A . 3 LYS O 1 1 6 3832 1 1 4 SER C C -23.045 -2.589 16.163 1.00 . A A . 4 SER C 1 1 6 3833 1 1 4 SER CA C -23.290 -1.148 15.786 1.00 . A A . 4 SER CA 1 1 6 3834 1 1 4 SER CB C -24.117 -0.440 16.860 1.00 . A A . 4 SER CB 1 1 6 3835 1 1 4 SER H H -23.928 -1.984 13.965 1.00 . A A . 4 SER H 1 1 6 3836 1 1 4 SER HA H -22.354 -0.653 15.636 1.00 . A A . 4 SER HA 1 1 6 3837 1 1 4 SER HB2 H -23.707 -0.654 17.832 1.00 . A A . 4 SER HB2 1 1 6 3838 1 1 4 SER HB3 H -24.090 0.628 16.688 1.00 . A A . 4 SER HB3 1 1 6 3839 1 1 4 SER HG H -25.760 -1.052 17.704 1.00 . A A . 4 SER HG 1 1 6 3840 1 1 4 SER N N -24.017 -1.198 14.518 1.00 . A A . 4 SER N 1 1 6 3841 1 1 4 SER O O -23.950 -3.373 16.160 1.00 . A A . 4 SER O 1 1 6 3842 1 1 4 SER OG O -25.458 -0.908 16.804 1.00 . A A . 4 SER OG 1 1 6 3843 1 1 5 ASP C C -22.397 -5.388 16.171 1.00 . A A . 5 ASP C 1 1 6 3844 1 1 5 ASP CA C -21.424 -4.342 16.752 1.00 . A A . 5 ASP CA 1 1 6 3845 1 1 5 ASP CB C -21.362 -4.498 18.273 1.00 . A A . 5 ASP CB 1 1 6 3846 1 1 5 ASP CG C -20.499 -3.385 18.867 1.00 . A A . 5 ASP CG 1 1 6 3847 1 1 5 ASP H H -21.128 -2.254 16.345 1.00 . A A . 5 ASP H 1 1 6 3848 1 1 5 ASP HA H -20.445 -4.518 16.341 1.00 . A A . 5 ASP HA 1 1 6 3849 1 1 5 ASP HB2 H -22.362 -4.438 18.682 1.00 . A A . 5 ASP HB2 1 1 6 3850 1 1 5 ASP HB3 H -20.930 -5.457 18.520 1.00 . A A . 5 ASP HB3 1 1 6 3851 1 1 5 ASP N N -21.819 -2.934 16.413 1.00 . A A . 5 ASP N 1 1 6 3852 1 1 5 ASP O O -22.535 -6.473 16.700 1.00 . A A . 5 ASP O 1 1 6 3853 1 1 5 ASP OD1 O -19.480 -3.073 18.275 1.00 . A A . 5 ASP OD1 1 1 6 3854 1 1 5 ASP OD2 O -20.873 -2.862 19.904 1.00 . A A . 5 ASP OD2 1 1 6 3855 1 1 6 LEU C C -24.009 -5.563 12.999 1.00 . A A . 6 LEU C 1 1 6 3856 1 1 6 LEU CA C -23.989 -6.020 14.426 1.00 . A A . 6 LEU CA 1 1 6 3857 1 1 6 LEU CB C -25.401 -5.873 14.999 1.00 . A A . 6 LEU CB 1 1 6 3858 1 1 6 LEU CD1 C -26.567 -5.669 17.190 1.00 . A A . 6 LEU CD1 1 1 6 3859 1 1 6 LEU CD2 C -25.561 -7.853 16.499 1.00 . A A . 6 LEU CD2 1 1 6 3860 1 1 6 LEU CG C -25.408 -6.332 16.443 1.00 . A A . 6 LEU CG 1 1 6 3861 1 1 6 LEU H H -22.888 -4.209 14.658 1.00 . A A . 6 LEU H 1 1 6 3862 1 1 6 LEU HA H -23.638 -7.036 14.514 1.00 . A A . 6 LEU HA 1 1 6 3863 1 1 6 LEU HB2 H -25.702 -4.836 14.948 1.00 . A A . 6 LEU HB2 1 1 6 3864 1 1 6 LEU HB3 H -26.088 -6.477 14.426 1.00 . A A . 6 LEU HB3 1 1 6 3865 1 1 6 LEU HD11 H -26.865 -4.772 16.669 1.00 . A A . 6 LEU HD11 1 1 6 3866 1 1 6 LEU HD12 H -27.401 -6.354 17.238 1.00 . A A . 6 LEU HD12 1 1 6 3867 1 1 6 LEU HD13 H -26.252 -5.416 18.192 1.00 . A A . 6 LEU HD13 1 1 6 3868 1 1 6 LEU HD21 H -25.000 -8.302 15.694 1.00 . A A . 6 LEU HD21 1 1 6 3869 1 1 6 LEU HD22 H -25.187 -8.218 17.446 1.00 . A A . 6 LEU HD22 1 1 6 3870 1 1 6 LEU HD23 H -26.605 -8.114 16.401 1.00 . A A . 6 LEU HD23 1 1 6 3871 1 1 6 LEU HG H -24.480 -6.045 16.892 1.00 . A A . 6 LEU HG 1 1 6 3872 1 1 6 LEU N N -23.041 -5.080 15.080 1.00 . A A . 6 LEU N 1 1 6 3873 1 1 6 LEU O O -23.805 -6.307 12.059 1.00 . A A . 6 LEU O 1 1 6 3874 1 1 7 GLY C C -22.807 -2.927 11.473 1.00 . A A . 7 GLY C 1 1 6 3875 1 1 7 GLY CA C -24.144 -3.652 11.540 1.00 . A A . 7 GLY CA 1 1 6 3876 1 1 7 GLY H H -24.283 -3.722 13.675 1.00 . A A . 7 GLY H 1 1 6 3877 1 1 7 GLY HA2 H -24.951 -2.947 11.434 1.00 . A A . 7 GLY HA2 1 1 6 3878 1 1 7 GLY HA3 H -24.203 -4.408 10.768 1.00 . A A . 7 GLY HA3 1 1 6 3879 1 1 7 GLY N N -24.183 -4.285 12.866 1.00 . A A . 7 GLY N 1 1 6 3880 1 1 7 GLY O O -22.323 -2.584 10.412 1.00 . A A . 7 GLY O 1 1 6 3881 1 1 8 TYR C C -19.784 -3.097 12.582 1.00 . A A . 8 TYR C 1 1 6 3882 1 1 8 TYR CA C -20.879 -2.038 12.623 1.00 . A A . 8 TYR CA 1 1 6 3883 1 1 8 TYR CB C -20.756 -1.213 13.890 1.00 . A A . 8 TYR CB 1 1 6 3884 1 1 8 TYR CD1 C -18.620 0.099 13.548 1.00 . A A . 8 TYR CD1 1 1 6 3885 1 1 8 TYR CD2 C -18.667 -1.683 15.192 1.00 . A A . 8 TYR CD2 1 1 6 3886 1 1 8 TYR CE1 C -17.283 0.363 13.870 1.00 . A A . 8 TYR CE1 1 1 6 3887 1 1 8 TYR CE2 C -17.330 -1.419 15.517 1.00 . A A . 8 TYR CE2 1 1 6 3888 1 1 8 TYR CG C -19.309 -0.926 14.211 1.00 . A A . 8 TYR CG 1 1 6 3889 1 1 8 TYR CZ C -16.639 -0.395 14.856 1.00 . A A . 8 TYR CZ 1 1 6 3890 1 1 8 TYR H H -22.569 -2.996 13.463 1.00 . A A . 8 TYR H 1 1 6 3891 1 1 8 TYR HA H -20.813 -1.407 11.773 1.00 . A A . 8 TYR HA 1 1 6 3892 1 1 8 TYR HB2 H -21.287 -0.284 13.764 1.00 . A A . 8 TYR HB2 1 1 6 3893 1 1 8 TYR HB3 H -21.191 -1.773 14.695 1.00 . A A . 8 TYR HB3 1 1 6 3894 1 1 8 TYR HD1 H -19.115 0.680 12.782 1.00 . A A . 8 TYR HD1 1 1 6 3895 1 1 8 TYR HD2 H -19.205 -2.475 15.696 1.00 . A A . 8 TYR HD2 1 1 6 3896 1 1 8 TYR HE1 H -16.750 1.152 13.361 1.00 . A A . 8 TYR HE1 1 1 6 3897 1 1 8 TYR HE2 H -16.833 -2.005 16.276 1.00 . A A . 8 TYR HE2 1 1 6 3898 1 1 8 TYR HH H -14.769 -0.732 14.667 1.00 . A A . 8 TYR HH 1 1 6 3899 1 1 8 TYR N N -22.185 -2.709 12.618 1.00 . A A . 8 TYR N 1 1 6 3900 1 1 8 TYR O O -18.632 -2.801 12.389 1.00 . A A . 8 TYR O 1 1 6 3901 1 1 8 TYR OH O -15.321 -0.135 15.175 1.00 . A A . 8 TYR OH 1 1 6 3902 1 1 9 THR C C -18.664 -5.594 11.289 1.00 . A A . 9 THR C 1 1 6 3903 1 1 9 THR CA C -19.111 -5.406 12.736 1.00 . A A . 9 THR CA 1 1 6 3904 1 1 9 THR CB C -19.715 -6.710 13.264 1.00 . A A . 9 THR CB 1 1 6 3905 1 1 9 THR CG2 C -18.595 -7.691 13.611 1.00 . A A . 9 THR CG2 1 1 6 3906 1 1 9 THR H H -21.072 -4.552 12.935 1.00 . A A . 9 THR H 1 1 6 3907 1 1 9 THR HA H -18.270 -5.119 13.346 1.00 . A A . 9 THR HA 1 1 6 3908 1 1 9 THR HB H -20.352 -7.146 12.510 1.00 . A A . 9 THR HB 1 1 6 3909 1 1 9 THR HG1 H -21.234 -5.902 14.153 1.00 . A A . 9 THR HG1 1 1 6 3910 1 1 9 THR HG21 H -17.823 -7.639 12.857 1.00 . A A . 9 THR HG21 1 1 6 3911 1 1 9 THR HG22 H -18.176 -7.436 14.573 1.00 . A A . 9 THR HG22 1 1 6 3912 1 1 9 THR HG23 H -18.995 -8.694 13.648 1.00 . A A . 9 THR HG23 1 1 6 3913 1 1 9 THR N N -20.137 -4.332 12.771 1.00 . A A . 9 THR N 1 1 6 3914 1 1 9 THR O O -17.513 -5.400 10.945 1.00 . A A . 9 THR O 1 1 6 3915 1 1 9 THR OG1 O -20.482 -6.433 14.423 1.00 . A A . 9 THR OG1 1 1 6 3916 1 1 10 GLY C C -18.733 -4.827 8.414 1.00 . A A . 10 GLY C 1 1 6 3917 1 1 10 GLY CA C -19.223 -6.154 9.001 1.00 . A A . 10 GLY CA 1 1 6 3918 1 1 10 GLY H H -20.499 -6.101 10.740 1.00 . A A . 10 GLY H 1 1 6 3919 1 1 10 GLY HA2 H -20.093 -6.486 8.456 1.00 . A A . 10 GLY HA2 1 1 6 3920 1 1 10 GLY HA3 H -18.441 -6.897 8.919 1.00 . A A . 10 GLY HA3 1 1 6 3921 1 1 10 GLY N N -19.576 -5.961 10.435 1.00 . A A . 10 GLY N 1 1 6 3922 1 1 10 GLY O O -17.753 -4.776 7.693 1.00 . A A . 10 GLY O 1 1 6 3923 1 1 11 LEU C C -17.600 -2.118 8.721 1.00 . A A . 11 LEU C 1 1 6 3924 1 1 11 LEU CA C -18.981 -2.447 8.178 1.00 . A A . 11 LEU CA 1 1 6 3925 1 1 11 LEU CB C -20.032 -1.376 8.539 1.00 . A A . 11 LEU CB 1 1 6 3926 1 1 11 LEU CD1 C -18.819 0.805 8.505 1.00 . A A . 11 LEU CD1 1 1 6 3927 1 1 11 LEU CD2 C -20.521 0.352 10.273 1.00 . A A . 11 LEU CD2 1 1 6 3928 1 1 11 LEU CG C -19.427 -0.271 9.405 1.00 . A A . 11 LEU CG 1 1 6 3929 1 1 11 LEU H H -20.183 -3.792 9.284 1.00 . A A . 11 LEU H 1 1 6 3930 1 1 11 LEU HA H -18.908 -2.526 7.115 1.00 . A A . 11 LEU HA 1 1 6 3931 1 1 11 LEU HB2 H -20.419 -0.940 7.630 1.00 . A A . 11 LEU HB2 1 1 6 3932 1 1 11 LEU HB3 H -20.842 -1.845 9.078 1.00 . A A . 11 LEU HB3 1 1 6 3933 1 1 11 LEU HD11 H -18.236 0.337 7.727 1.00 . A A . 11 LEU HD11 1 1 6 3934 1 1 11 LEU HD12 H -19.610 1.390 8.060 1.00 . A A . 11 LEU HD12 1 1 6 3935 1 1 11 LEU HD13 H -18.184 1.450 9.094 1.00 . A A . 11 LEU HD13 1 1 6 3936 1 1 11 LEU HD21 H -21.428 -0.225 10.174 1.00 . A A . 11 LEU HD21 1 1 6 3937 1 1 11 LEU HD22 H -20.205 0.354 11.304 1.00 . A A . 11 LEU HD22 1 1 6 3938 1 1 11 LEU HD23 H -20.702 1.366 9.949 1.00 . A A . 11 LEU HD23 1 1 6 3939 1 1 11 LEU HG H -18.659 -0.696 10.034 1.00 . A A . 11 LEU HG 1 1 6 3940 1 1 11 LEU N N -19.405 -3.747 8.713 1.00 . A A . 11 LEU N 1 1 6 3941 1 1 11 LEU O O -16.800 -1.580 8.024 1.00 . A A . 11 LEU O 1 1 6 3942 1 1 12 THR C C -14.924 -2.791 9.637 1.00 . A A . 12 THR C 1 1 6 3943 1 1 12 THR CA C -15.960 -2.133 10.497 1.00 . A A . 12 THR CA 1 1 6 3944 1 1 12 THR CB C -15.839 -2.645 11.922 1.00 . A A . 12 THR CB 1 1 6 3945 1 1 12 THR CG2 C -14.382 -2.579 12.382 1.00 . A A . 12 THR CG2 1 1 6 3946 1 1 12 THR H H -17.971 -2.866 10.516 1.00 . A A . 12 THR H 1 1 6 3947 1 1 12 THR HA H -15.823 -1.082 10.480 1.00 . A A . 12 THR HA 1 1 6 3948 1 1 12 THR HB H -16.195 -3.662 11.981 1.00 . A A . 12 THR HB 1 1 6 3949 1 1 12 THR HG1 H -17.180 -1.309 12.115 1.00 . A A . 12 THR HG1 1 1 6 3950 1 1 12 THR HG21 H -14.020 -1.566 12.289 1.00 . A A . 12 THR HG21 1 1 6 3951 1 1 12 THR HG22 H -14.315 -2.891 13.413 1.00 . A A . 12 THR HG22 1 1 6 3952 1 1 12 THR HG23 H -13.780 -3.233 11.768 1.00 . A A . 12 THR HG23 1 1 6 3953 1 1 12 THR N N -17.312 -2.436 9.956 1.00 . A A . 12 THR N 1 1 6 3954 1 1 12 THR O O -13.766 -2.460 9.649 1.00 . A A . 12 THR O 1 1 6 3955 1 1 12 THR OG1 O -16.630 -1.814 12.721 1.00 . A A . 12 THR OG1 1 1 6 3956 1 1 13 ASP C C -14.083 -3.518 6.843 1.00 . A A . 13 ASP C 1 1 6 3957 1 1 13 ASP CA C -14.411 -4.428 8.010 1.00 . A A . 13 ASP CA 1 1 6 3958 1 1 13 ASP CB C -15.027 -5.736 7.508 1.00 . A A . 13 ASP CB 1 1 6 3959 1 1 13 ASP CG C -13.912 -6.729 7.175 1.00 . A A . 13 ASP CG 1 1 6 3960 1 1 13 ASP H H -16.272 -3.978 8.935 1.00 . A A . 13 ASP H 1 1 6 3961 1 1 13 ASP HA H -13.522 -4.624 8.546 1.00 . A A . 13 ASP HA 1 1 6 3962 1 1 13 ASP HB2 H -15.665 -6.151 8.275 1.00 . A A . 13 ASP HB2 1 1 6 3963 1 1 13 ASP HB3 H -15.611 -5.542 6.621 1.00 . A A . 13 ASP HB3 1 1 6 3964 1 1 13 ASP N N -15.345 -3.732 8.897 1.00 . A A . 13 ASP N 1 1 6 3965 1 1 13 ASP O O -12.943 -3.412 6.425 1.00 . A A . 13 ASP O 1 1 6 3966 1 1 13 ASP OD1 O -12.766 -6.314 7.142 1.00 . A A . 13 ASP OD1 1 1 6 3967 1 1 13 ASP OD2 O -14.224 -7.889 6.960 1.00 . A A . 13 ASP OD2 1 1 6 3968 1 1 14 GLU C C -14.525 -0.517 5.674 1.00 . A A . 14 GLU C 1 1 6 3969 1 1 14 GLU CA C -14.719 -1.941 5.181 1.00 . A A . 14 GLU CA 1 1 6 3970 1 1 14 GLU CB C -15.820 -1.962 4.145 1.00 . A A . 14 GLU CB 1 1 6 3971 1 1 14 GLU CD C -16.105 -2.242 1.680 1.00 . A A . 14 GLU CD 1 1 6 3972 1 1 14 GLU CG C -15.329 -2.715 2.911 1.00 . A A . 14 GLU CG 1 1 6 3973 1 1 14 GLU H H -15.973 -2.899 6.666 1.00 . A A . 14 GLU H 1 1 6 3974 1 1 14 GLU HA H -13.800 -2.293 4.740 1.00 . A A . 14 GLU HA 1 1 6 3975 1 1 14 GLU HB2 H -16.688 -2.451 4.556 1.00 . A A . 14 GLU HB2 1 1 6 3976 1 1 14 GLU HB3 H -16.061 -0.948 3.878 1.00 . A A . 14 GLU HB3 1 1 6 3977 1 1 14 GLU HG2 H -14.275 -2.518 2.773 1.00 . A A . 14 GLU HG2 1 1 6 3978 1 1 14 GLU HG3 H -15.484 -3.773 3.049 1.00 . A A . 14 GLU HG3 1 1 6 3979 1 1 14 GLU N N -15.049 -2.834 6.315 1.00 . A A . 14 GLU N 1 1 6 3980 1 1 14 GLU O O -14.089 0.345 4.942 1.00 . A A . 14 GLU O 1 1 6 3981 1 1 14 GLU OE1 O -17.291 -2.519 1.609 1.00 . A A . 14 GLU OE1 1 1 6 3982 1 1 14 GLU OE2 O -15.500 -1.611 0.829 1.00 . A A . 14 GLU OE2 1 1 6 3983 1 1 15 GLN C C -13.222 1.036 8.044 1.00 . A A . 15 GLN C 1 1 6 3984 1 1 15 GLN CA C -14.602 1.075 7.476 1.00 . A A . 15 GLN CA 1 1 6 3985 1 1 15 GLN CB C -15.657 1.376 8.546 1.00 . A A . 15 GLN CB 1 1 6 3986 1 1 15 GLN CD C -14.186 2.769 10.025 1.00 . A A . 15 GLN CD 1 1 6 3987 1 1 15 GLN CG C -15.052 1.509 9.954 1.00 . A A . 15 GLN CG 1 1 6 3988 1 1 15 GLN H H -15.132 -0.996 7.480 1.00 . A A . 15 GLN H 1 1 6 3989 1 1 15 GLN HA H -14.645 1.797 6.695 1.00 . A A . 15 GLN HA 1 1 6 3990 1 1 15 GLN HB2 H -16.143 2.298 8.288 1.00 . A A . 15 GLN HB2 1 1 6 3991 1 1 15 GLN HB3 H -16.375 0.578 8.547 1.00 . A A . 15 GLN HB3 1 1 6 3992 1 1 15 GLN HE21 H -15.600 3.955 9.292 1.00 . A A . 15 GLN HE21 1 1 6 3993 1 1 15 GLN HE22 H -14.134 4.722 9.672 1.00 . A A . 15 GLN HE22 1 1 6 3994 1 1 15 GLN HG2 H -15.852 1.580 10.680 1.00 . A A . 15 GLN HG2 1 1 6 3995 1 1 15 GLN HG3 H -14.448 0.644 10.172 1.00 . A A . 15 GLN HG3 1 1 6 3996 1 1 15 GLN N N -14.813 -0.276 6.912 1.00 . A A . 15 GLN N 1 1 6 3997 1 1 15 GLN NE2 N -14.682 3.910 9.630 1.00 . A A . 15 GLN NE2 1 1 6 3998 1 1 15 GLN O O -12.389 1.884 7.805 1.00 . A A . 15 GLN O 1 1 6 3999 1 1 15 GLN OE1 O -13.047 2.714 10.445 1.00 . A A . 15 GLN OE1 1 1 6 4000 1 1 16 ALA C C -10.689 -0.043 8.065 1.00 . A A . 16 ALA C 1 1 6 4001 1 1 16 ALA CA C -11.601 -0.185 9.269 1.00 . A A . 16 ALA CA 1 1 6 4002 1 1 16 ALA CB C -11.429 -1.569 9.897 1.00 . A A . 16 ALA CB 1 1 6 4003 1 1 16 ALA H H -13.658 -0.688 8.860 1.00 . A A . 16 ALA H 1 1 6 4004 1 1 16 ALA HA H -11.383 0.586 9.988 1.00 . A A . 16 ALA HA 1 1 6 4005 1 1 16 ALA HB1 H -12.052 -1.645 10.776 1.00 . A A . 16 ALA HB1 1 1 6 4006 1 1 16 ALA HB2 H -11.717 -2.327 9.185 1.00 . A A . 16 ALA HB2 1 1 6 4007 1 1 16 ALA HB3 H -10.394 -1.711 10.176 1.00 . A A . 16 ALA HB3 1 1 6 4008 1 1 16 ALA N N -12.963 -0.008 8.740 1.00 . A A . 16 ALA N 1 1 6 4009 1 1 16 ALA O O -9.561 0.380 8.178 1.00 . A A . 16 ALA O 1 1 6 4010 1 1 17 GLN C C -10.666 1.139 5.022 1.00 . A A . 17 GLN C 1 1 6 4011 1 1 17 GLN CA C -10.378 -0.214 5.665 1.00 . A A . 17 GLN CA 1 1 6 4012 1 1 17 GLN CB C -10.702 -1.323 4.677 1.00 . A A . 17 GLN CB 1 1 6 4013 1 1 17 GLN CD C -9.719 -3.533 4.060 1.00 . A A . 17 GLN CD 1 1 6 4014 1 1 17 GLN CG C -10.167 -2.643 5.222 1.00 . A A . 17 GLN CG 1 1 6 4015 1 1 17 GLN H H -12.144 -0.690 6.819 1.00 . A A . 17 GLN H 1 1 6 4016 1 1 17 GLN HA H -9.339 -0.265 5.929 1.00 . A A . 17 GLN HA 1 1 6 4017 1 1 17 GLN HB2 H -11.772 -1.388 4.545 1.00 . A A . 17 GLN HB2 1 1 6 4018 1 1 17 GLN HB3 H -10.230 -1.104 3.733 1.00 . A A . 17 GLN HB3 1 1 6 4019 1 1 17 GLN HE21 H -11.543 -3.694 3.293 1.00 . A A . 17 GLN HE21 1 1 6 4020 1 1 17 GLN HE22 H -10.324 -4.522 2.449 1.00 . A A . 17 GLN HE22 1 1 6 4021 1 1 17 GLN HG2 H -9.326 -2.442 5.872 1.00 . A A . 17 GLN HG2 1 1 6 4022 1 1 17 GLN HG3 H -10.943 -3.142 5.781 1.00 . A A . 17 GLN HG3 1 1 6 4023 1 1 17 GLN N N -11.202 -0.366 6.891 1.00 . A A . 17 GLN N 1 1 6 4024 1 1 17 GLN NE2 N -10.602 -3.951 3.196 1.00 . A A . 17 GLN NE2 1 1 6 4025 1 1 17 GLN O O -9.829 1.692 4.335 1.00 . A A . 17 GLN O 1 1 6 4026 1 1 17 GLN OE1 O -8.553 -3.852 3.940 1.00 . A A . 17 GLN OE1 1 1 6 4027 1 1 18 GLU C C -11.025 3.969 5.088 1.00 . A A . 18 GLU C 1 1 6 4028 1 1 18 GLU CA C -12.136 3.026 4.672 1.00 . A A . 18 GLU CA 1 1 6 4029 1 1 18 GLU CB C -13.472 3.538 5.211 1.00 . A A . 18 GLU CB 1 1 6 4030 1 1 18 GLU CD C -13.641 5.479 6.775 1.00 . A A . 18 GLU CD 1 1 6 4031 1 1 18 GLU CG C -13.333 3.985 6.671 1.00 . A A . 18 GLU CG 1 1 6 4032 1 1 18 GLU H H -12.484 1.247 5.833 1.00 . A A . 18 GLU H 1 1 6 4033 1 1 18 GLU HA H -12.175 2.955 3.595 1.00 . A A . 18 GLU HA 1 1 6 4034 1 1 18 GLU HB2 H -13.782 4.374 4.619 1.00 . A A . 18 GLU HB2 1 1 6 4035 1 1 18 GLU HB3 H -14.208 2.754 5.145 1.00 . A A . 18 GLU HB3 1 1 6 4036 1 1 18 GLU HG2 H -14.029 3.432 7.284 1.00 . A A . 18 GLU HG2 1 1 6 4037 1 1 18 GLU HG3 H -12.330 3.804 7.015 1.00 . A A . 18 GLU HG3 1 1 6 4038 1 1 18 GLU N N -11.829 1.694 5.256 1.00 . A A . 18 GLU N 1 1 6 4039 1 1 18 GLU O O -10.766 4.982 4.470 1.00 . A A . 18 GLU O 1 1 6 4040 1 1 18 GLU OE1 O -13.101 6.233 5.982 1.00 . A A . 18 GLU OE1 1 1 6 4041 1 1 18 GLU OE2 O -14.413 5.846 7.646 1.00 . A A . 18 GLU OE2 1 1 6 4042 1 1 19 LEU C C -7.958 3.720 6.470 1.00 . A A . 19 LEU C 1 1 6 4043 1 1 19 LEU CA C -9.275 4.446 6.680 1.00 . A A . 19 LEU CA 1 1 6 4044 1 1 19 LEU CB C -9.482 4.650 8.170 1.00 . A A . 19 LEU CB 1 1 6 4045 1 1 19 LEU CD1 C -7.829 3.489 9.636 1.00 . A A . 19 LEU CD1 1 1 6 4046 1 1 19 LEU CD2 C -10.293 3.077 9.934 1.00 . A A . 19 LEU CD2 1 1 6 4047 1 1 19 LEU CG C -9.178 3.351 8.917 1.00 . A A . 19 LEU CG 1 1 6 4048 1 1 19 LEU H H -10.646 2.813 6.624 1.00 . A A . 19 LEU H 1 1 6 4049 1 1 19 LEU HA H -9.252 5.398 6.177 1.00 . A A . 19 LEU HA 1 1 6 4050 1 1 19 LEU HB2 H -8.818 5.416 8.510 1.00 . A A . 19 LEU HB2 1 1 6 4051 1 1 19 LEU HB3 H -10.501 4.935 8.352 1.00 . A A . 19 LEU HB3 1 1 6 4052 1 1 19 LEU HD11 H -7.532 4.529 9.655 1.00 . A A . 19 LEU HD11 1 1 6 4053 1 1 19 LEU HD12 H -7.917 3.121 10.647 1.00 . A A . 19 LEU HD12 1 1 6 4054 1 1 19 LEU HD13 H -7.078 2.915 9.109 1.00 . A A . 19 LEU HD13 1 1 6 4055 1 1 19 LEU HD21 H -10.410 3.933 10.582 1.00 . A A . 19 LEU HD21 1 1 6 4056 1 1 19 LEU HD22 H -11.224 2.893 9.411 1.00 . A A . 19 LEU HD22 1 1 6 4057 1 1 19 LEU HD23 H -10.037 2.210 10.525 1.00 . A A . 19 LEU HD23 1 1 6 4058 1 1 19 LEU HG H -9.124 2.535 8.210 1.00 . A A . 19 LEU HG 1 1 6 4059 1 1 19 LEU N N -10.382 3.624 6.154 1.00 . A A . 19 LEU N 1 1 6 4060 1 1 19 LEU O O -6.910 4.313 6.514 1.00 . A A . 19 LEU O 1 1 6 4061 1 1 20 HIS C C -6.443 1.484 4.619 1.00 . A A . 20 HIS C 1 1 6 4062 1 1 20 HIS CA C -6.760 1.662 6.108 1.00 . A A . 20 HIS CA 1 1 6 4063 1 1 20 HIS CB C -6.925 0.291 6.746 1.00 . A A . 20 HIS CB 1 1 6 4064 1 1 20 HIS CD2 C -6.231 0.612 9.251 1.00 . A A . 20 HIS CD2 1 1 6 4065 1 1 20 HIS CE1 C -4.282 -0.330 9.167 1.00 . A A . 20 HIS CE1 1 1 6 4066 1 1 20 HIS CG C -6.049 0.190 7.959 1.00 . A A . 20 HIS CG 1 1 6 4067 1 1 20 HIS H H -8.866 1.979 6.304 1.00 . A A . 20 HIS H 1 1 6 4068 1 1 20 HIS HA H -5.952 2.181 6.589 1.00 . A A . 20 HIS HA 1 1 6 4069 1 1 20 HIS HB2 H -7.949 0.154 7.033 1.00 . A A . 20 HIS HB2 1 1 6 4070 1 1 20 HIS HB3 H -6.653 -0.464 6.035 1.00 . A A . 20 HIS HB3 1 1 6 4071 1 1 20 HIS HD1 H -4.370 -0.810 7.144 1.00 . A A . 20 HIS HD1 1 1 6 4072 1 1 20 HIS HD2 H -7.109 1.122 9.618 1.00 . A A . 20 HIS HD2 1 1 6 4073 1 1 20 HIS HE1 H -3.313 -0.716 9.444 1.00 . A A . 20 HIS HE1 1 1 6 4074 1 1 20 HIS N N -8.009 2.437 6.288 1.00 . A A . 20 HIS N 1 1 6 4075 1 1 20 HIS ND1 N -4.799 -0.406 7.927 1.00 . A A . 20 HIS ND1 1 1 6 4076 1 1 20 HIS NE2 N -5.115 0.282 10.014 1.00 . A A . 20 HIS NE2 1 1 6 4077 1 1 20 HIS O O -5.634 2.200 4.063 1.00 . A A . 20 HIS O 1 1 6 4078 1 1 21 SER C C -6.614 1.574 1.807 1.00 . A A . 21 SER C 1 1 6 4079 1 1 21 SER CA C -6.765 0.269 2.539 1.00 . A A . 21 SER CA 1 1 6 4080 1 1 21 SER CB C -7.905 -0.499 1.875 1.00 . A A . 21 SER CB 1 1 6 4081 1 1 21 SER H H -7.682 -0.061 4.447 1.00 . A A . 21 SER H 1 1 6 4082 1 1 21 SER HA H -5.870 -0.287 2.462 1.00 . A A . 21 SER HA 1 1 6 4083 1 1 21 SER HB2 H -8.830 0.033 2.017 1.00 . A A . 21 SER HB2 1 1 6 4084 1 1 21 SER HB3 H -7.706 -0.570 0.812 1.00 . A A . 21 SER HB3 1 1 6 4085 1 1 21 SER HG H -7.164 -2.240 2.325 1.00 . A A . 21 SER HG 1 1 6 4086 1 1 21 SER N N -7.054 0.515 3.978 1.00 . A A . 21 SER N 1 1 6 4087 1 1 21 SER O O -5.528 2.036 1.531 1.00 . A A . 21 SER O 1 1 6 4088 1 1 21 SER OG O -8.006 -1.797 2.446 1.00 . A A . 21 SER OG 1 1 6 4089 1 1 22 VAL C C -6.549 4.293 1.237 1.00 . A A . 22 VAL C 1 1 6 4090 1 1 22 VAL CA C -7.742 3.438 0.790 1.00 . A A . 22 VAL CA 1 1 6 4091 1 1 22 VAL CB C -9.046 4.132 1.178 1.00 . A A . 22 VAL CB 1 1 6 4092 1 1 22 VAL CG1 C -9.300 3.911 2.680 1.00 . A A . 22 VAL CG1 1 1 6 4093 1 1 22 VAL CG2 C -8.953 5.632 0.885 1.00 . A A . 22 VAL CG2 1 1 6 4094 1 1 22 VAL H H -8.564 1.742 1.749 1.00 . A A . 22 VAL H 1 1 6 4095 1 1 22 VAL HA H -7.719 3.248 -0.263 1.00 . A A . 22 VAL HA 1 1 6 4096 1 1 22 VAL HB H -9.857 3.700 0.616 1.00 . A A . 22 VAL HB 1 1 6 4097 1 1 22 VAL HG11 H -8.628 3.146 3.060 1.00 . A A . 22 VAL HG11 1 1 6 4098 1 1 22 VAL HG12 H -9.124 4.833 3.212 1.00 . A A . 22 VAL HG12 1 1 6 4099 1 1 22 VAL HG13 H -10.323 3.593 2.837 1.00 . A A . 22 VAL HG13 1 1 6 4100 1 1 22 VAL HG21 H -8.058 5.832 0.317 1.00 . A A . 22 VAL HG21 1 1 6 4101 1 1 22 VAL HG22 H -9.818 5.941 0.318 1.00 . A A . 22 VAL HG22 1 1 6 4102 1 1 22 VAL HG23 H -8.918 6.178 1.817 1.00 . A A . 22 VAL HG23 1 1 6 4103 1 1 22 VAL N N -7.719 2.156 1.499 1.00 . A A . 22 VAL N 1 1 6 4104 1 1 22 VAL O O -5.912 4.979 0.461 1.00 . A A . 22 VAL O 1 1 6 4105 1 1 23 TYR C C -3.815 4.340 2.883 1.00 . A A . 23 TYR C 1 1 6 4106 1 1 23 TYR CA C -5.170 5.030 3.111 1.00 . A A . 23 TYR CA 1 1 6 4107 1 1 23 TYR CB C -5.469 5.105 4.601 1.00 . A A . 23 TYR CB 1 1 6 4108 1 1 23 TYR CD1 C -3.262 6.330 4.779 1.00 . A A . 23 TYR CD1 1 1 6 4109 1 1 23 TYR CD2 C -4.270 5.402 6.777 1.00 . A A . 23 TYR CD2 1 1 6 4110 1 1 23 TYR CE1 C -2.191 6.808 5.548 1.00 . A A . 23 TYR CE1 1 1 6 4111 1 1 23 TYR CE2 C -3.211 5.876 7.545 1.00 . A A . 23 TYR CE2 1 1 6 4112 1 1 23 TYR CG C -4.299 5.626 5.396 1.00 . A A . 23 TYR CG 1 1 6 4113 1 1 23 TYR CZ C -2.166 6.581 6.933 1.00 . A A . 23 TYR CZ 1 1 6 4114 1 1 23 TYR H H -6.838 3.696 3.086 1.00 . A A . 23 TYR H 1 1 6 4115 1 1 23 TYR HA H -5.157 6.021 2.696 1.00 . A A . 23 TYR HA 1 1 6 4116 1 1 23 TYR HB2 H -6.320 5.749 4.761 1.00 . A A . 23 TYR HB2 1 1 6 4117 1 1 23 TYR HB3 H -5.710 4.111 4.945 1.00 . A A . 23 TYR HB3 1 1 6 4118 1 1 23 TYR HD1 H -3.284 6.504 3.714 1.00 . A A . 23 TYR HD1 1 1 6 4119 1 1 23 TYR HD2 H -5.071 4.858 7.250 1.00 . A A . 23 TYR HD2 1 1 6 4120 1 1 23 TYR HE1 H -1.387 7.352 5.075 1.00 . A A . 23 TYR HE1 1 1 6 4121 1 1 23 TYR HE2 H -3.203 5.696 8.612 1.00 . A A . 23 TYR HE2 1 1 6 4122 1 1 23 TYR HH H -1.280 7.977 7.888 1.00 . A A . 23 TYR HH 1 1 6 4123 1 1 23 TYR N N -6.279 4.248 2.506 1.00 . A A . 23 TYR N 1 1 6 4124 1 1 23 TYR O O -3.143 4.584 1.903 1.00 . A A . 23 TYR O 1 1 6 4125 1 1 23 TYR OH O -1.114 7.052 7.693 1.00 . A A . 23 TYR OH 1 1 6 4126 1 1 24 MET C C -1.941 2.147 2.287 1.00 . A A . 24 MET C 1 1 6 4127 1 1 24 MET CA C -2.072 2.825 3.657 1.00 . A A . 24 MET CA 1 1 6 4128 1 1 24 MET CB C -1.903 1.782 4.768 1.00 . A A . 24 MET CB 1 1 6 4129 1 1 24 MET CE C -1.373 -1.480 4.907 1.00 . A A . 24 MET CE 1 1 6 4130 1 1 24 MET CG C -2.975 0.697 4.642 1.00 . A A . 24 MET CG 1 1 6 4131 1 1 24 MET H H -3.947 3.336 4.594 1.00 . A A . 24 MET H 1 1 6 4132 1 1 24 MET HA H -1.291 3.566 3.754 1.00 . A A . 24 MET HA 1 1 6 4133 1 1 24 MET HB2 H -0.925 1.329 4.687 1.00 . A A . 24 MET HB2 1 1 6 4134 1 1 24 MET HB3 H -1.995 2.264 5.730 1.00 . A A . 24 MET HB3 1 1 6 4135 1 1 24 MET HE1 H -1.017 -0.742 5.614 1.00 . A A . 24 MET HE1 1 1 6 4136 1 1 24 MET HE2 H -1.988 -2.201 5.422 1.00 . A A . 24 MET HE2 1 1 6 4137 1 1 24 MET HE3 H -0.532 -1.986 4.453 1.00 . A A . 24 MET HE3 1 1 6 4138 1 1 24 MET HG2 H -3.224 0.323 5.623 1.00 . A A . 24 MET HG2 1 1 6 4139 1 1 24 MET HG3 H -3.857 1.115 4.184 1.00 . A A . 24 MET HG3 1 1 6 4140 1 1 24 MET N N -3.398 3.503 3.800 1.00 . A A . 24 MET N 1 1 6 4141 1 1 24 MET O O -0.918 2.241 1.643 1.00 . A A . 24 MET O 1 1 6 4142 1 1 24 MET SD S -2.347 -0.660 3.621 1.00 . A A . 24 MET SD 1 1 6 4143 1 1 25 SER C C -2.831 1.803 -0.613 1.00 . A A . 25 SER C 1 1 6 4144 1 1 25 SER CA C -2.849 0.769 0.517 1.00 . A A . 25 SER CA 1 1 6 4145 1 1 25 SER CB C -4.043 -0.167 0.329 1.00 . A A . 25 SER CB 1 1 6 4146 1 1 25 SER H H -3.766 1.374 2.372 1.00 . A A . 25 SER H 1 1 6 4147 1 1 25 SER HA H -1.936 0.192 0.485 1.00 . A A . 25 SER HA 1 1 6 4148 1 1 25 SER HB2 H -4.848 0.140 0.973 1.00 . A A . 25 SER HB2 1 1 6 4149 1 1 25 SER HB3 H -4.373 -0.125 -0.700 1.00 . A A . 25 SER HB3 1 1 6 4150 1 1 25 SER HG H -3.232 -1.881 -0.105 1.00 . A A . 25 SER HG 1 1 6 4151 1 1 25 SER N N -2.952 1.455 1.839 1.00 . A A . 25 SER N 1 1 6 4152 1 1 25 SER O O -2.195 1.612 -1.629 1.00 . A A . 25 SER O 1 1 6 4153 1 1 25 SER OG O -3.656 -1.494 0.663 1.00 . A A . 25 SER OG 1 1 6 4154 1 1 26 GLY C C -2.367 4.880 -1.350 1.00 . A A . 26 GLY C 1 1 6 4155 1 1 26 GLY CA C -3.549 3.928 -1.523 1.00 . A A . 26 GLY CA 1 1 6 4156 1 1 26 GLY H H -4.040 3.031 0.375 1.00 . A A . 26 GLY H 1 1 6 4157 1 1 26 GLY HA2 H -4.466 4.491 -1.456 1.00 . A A . 26 GLY HA2 1 1 6 4158 1 1 26 GLY HA3 H -3.486 3.449 -2.486 1.00 . A A . 26 GLY HA3 1 1 6 4159 1 1 26 GLY N N -3.528 2.893 -0.450 1.00 . A A . 26 GLY N 1 1 6 4160 1 1 26 GLY O O -2.135 5.754 -2.162 1.00 . A A . 26 GLY O 1 1 6 4161 1 1 27 LEU C C 0.821 4.932 -0.488 1.00 . A A . 27 LEU C 1 1 6 4162 1 1 27 LEU CA C -0.475 5.620 -0.047 1.00 . A A . 27 LEU CA 1 1 6 4163 1 1 27 LEU CB C -0.419 5.932 1.444 1.00 . A A . 27 LEU CB 1 1 6 4164 1 1 27 LEU CD1 C -0.146 8.334 0.814 1.00 . A A . 27 LEU CD1 1 1 6 4165 1 1 27 LEU CD2 C -2.415 7.430 1.347 1.00 . A A . 27 LEU CD2 1 1 6 4166 1 1 27 LEU CG C -0.924 7.354 1.692 1.00 . A A . 27 LEU CG 1 1 6 4167 1 1 27 LEU H H -1.838 4.025 0.350 1.00 . A A . 27 LEU H 1 1 6 4168 1 1 27 LEU HA H -0.609 6.529 -0.601 1.00 . A A . 27 LEU HA 1 1 6 4169 1 1 27 LEU HB2 H -1.048 5.229 1.973 1.00 . A A . 27 LEU HB2 1 1 6 4170 1 1 27 LEU HB3 H 0.598 5.843 1.795 1.00 . A A . 27 LEU HB3 1 1 6 4171 1 1 27 LEU HD11 H 0.701 7.831 0.373 1.00 . A A . 27 LEU HD11 1 1 6 4172 1 1 27 LEU HD12 H -0.792 8.706 0.031 1.00 . A A . 27 LEU HD12 1 1 6 4173 1 1 27 LEU HD13 H 0.200 9.161 1.418 1.00 . A A . 27 LEU HD13 1 1 6 4174 1 1 27 LEU HD21 H -2.952 6.670 1.893 1.00 . A A . 27 LEU HD21 1 1 6 4175 1 1 27 LEU HD22 H -2.796 8.404 1.617 1.00 . A A . 27 LEU HD22 1 1 6 4176 1 1 27 LEU HD23 H -2.547 7.274 0.287 1.00 . A A . 27 LEU HD23 1 1 6 4177 1 1 27 LEU HG H -0.779 7.609 2.732 1.00 . A A . 27 LEU HG 1 1 6 4178 1 1 27 LEU N N -1.628 4.725 -0.292 1.00 . A A . 27 LEU N 1 1 6 4179 1 1 27 LEU O O 1.713 5.553 -1.031 1.00 . A A . 27 LEU O 1 1 6 4180 1 1 28 TRP C C 2.065 2.675 -2.178 1.00 . A A . 28 TRP C 1 1 6 4181 1 1 28 TRP CA C 2.143 2.922 -0.679 1.00 . A A . 28 TRP CA 1 1 6 4182 1 1 28 TRP CB C 2.214 1.611 0.117 1.00 . A A . 28 TRP CB 1 1 6 4183 1 1 28 TRP CD1 C 3.357 0.277 -1.657 1.00 . A A . 28 TRP CD1 1 1 6 4184 1 1 28 TRP CD2 C 4.493 0.242 0.276 1.00 . A A . 28 TRP CD2 1 1 6 4185 1 1 28 TRP CE2 C 5.234 -0.540 -0.641 1.00 . A A . 28 TRP CE2 1 1 6 4186 1 1 28 TRP CE3 C 4.992 0.385 1.582 1.00 . A A . 28 TRP CE3 1 1 6 4187 1 1 28 TRP CG C 3.309 0.749 -0.407 1.00 . A A . 28 TRP CG 1 1 6 4188 1 1 28 TRP CH2 C 6.911 -1.011 1.028 1.00 . A A . 28 TRP CH2 1 1 6 4189 1 1 28 TRP CZ2 C 6.428 -1.161 -0.275 1.00 . A A . 28 TRP CZ2 1 1 6 4190 1 1 28 TRP CZ3 C 6.195 -0.239 1.955 1.00 . A A . 28 TRP CZ3 1 1 6 4191 1 1 28 TRP H H 0.202 3.160 0.150 1.00 . A A . 28 TRP H 1 1 6 4192 1 1 28 TRP HA H 2.996 3.513 -0.476 1.00 . A A . 28 TRP HA 1 1 6 4193 1 1 28 TRP HB2 H 2.402 1.833 1.156 1.00 . A A . 28 TRP HB2 1 1 6 4194 1 1 28 TRP HB3 H 1.274 1.088 0.028 1.00 . A A . 28 TRP HB3 1 1 6 4195 1 1 28 TRP HD1 H 2.620 0.482 -2.414 1.00 . A A . 28 TRP HD1 1 1 6 4196 1 1 28 TRP HE1 H 4.772 -0.941 -2.635 1.00 . A A . 28 TRP HE1 1 1 6 4197 1 1 28 TRP HE3 H 4.449 0.976 2.304 1.00 . A A . 28 TRP HE3 1 1 6 4198 1 1 28 TRP HH2 H 7.835 -1.487 1.321 1.00 . A A . 28 TRP HH2 1 1 6 4199 1 1 28 TRP HZ2 H 6.976 -1.753 -0.993 1.00 . A A . 28 TRP HZ2 1 1 6 4200 1 1 28 TRP HZ3 H 6.569 -0.124 2.962 1.00 . A A . 28 TRP HZ3 1 1 6 4201 1 1 28 TRP N N 0.927 3.649 -0.270 1.00 . A A . 28 TRP N 1 1 6 4202 1 1 28 TRP NE1 N 4.501 -0.485 -1.811 1.00 . A A . 28 TRP NE1 1 1 6 4203 1 1 28 TRP O O 3.060 2.490 -2.853 1.00 . A A . 28 TRP O 1 1 6 4204 1 1 29 LEU C C 1.101 3.797 -4.875 1.00 . A A . 29 LEU C 1 1 6 4205 1 1 29 LEU CA C 0.698 2.503 -4.158 1.00 . A A . 29 LEU CA 1 1 6 4206 1 1 29 LEU CB C -0.779 2.123 -4.400 1.00 . A A . 29 LEU CB 1 1 6 4207 1 1 29 LEU CD1 C -1.074 2.156 -6.883 1.00 . A A . 29 LEU CD1 1 1 6 4208 1 1 29 LEU CD2 C -2.914 2.930 -5.386 1.00 . A A . 29 LEU CD2 1 1 6 4209 1 1 29 LEU CG C -1.399 2.883 -5.581 1.00 . A A . 29 LEU CG 1 1 6 4210 1 1 29 LEU H H 0.114 2.885 -2.132 1.00 . A A . 29 LEU H 1 1 6 4211 1 1 29 LEU HA H 1.339 1.698 -4.494 1.00 . A A . 29 LEU HA 1 1 6 4212 1 1 29 LEU HB2 H -0.838 1.065 -4.600 1.00 . A A . 29 LEU HB2 1 1 6 4213 1 1 29 LEU HB3 H -1.345 2.341 -3.506 1.00 . A A . 29 LEU HB3 1 1 6 4214 1 1 29 LEU HD11 H -1.395 1.127 -6.811 1.00 . A A . 29 LEU HD11 1 1 6 4215 1 1 29 LEU HD12 H -1.589 2.637 -7.702 1.00 . A A . 29 LEU HD12 1 1 6 4216 1 1 29 LEU HD13 H -0.009 2.189 -7.057 1.00 . A A . 29 LEU HD13 1 1 6 4217 1 1 29 LEU HD21 H -3.135 2.949 -4.328 1.00 . A A . 29 LEU HD21 1 1 6 4218 1 1 29 LEU HD22 H -3.310 3.818 -5.853 1.00 . A A . 29 LEU HD22 1 1 6 4219 1 1 29 LEU HD23 H -3.362 2.055 -5.832 1.00 . A A . 29 LEU HD23 1 1 6 4220 1 1 29 LEU HG H -1.014 3.890 -5.620 1.00 . A A . 29 LEU HG 1 1 6 4221 1 1 29 LEU N N 0.885 2.706 -2.701 1.00 . A A . 29 LEU N 1 1 6 4222 1 1 29 LEU O O 1.916 3.790 -5.772 1.00 . A A . 29 LEU O 1 1 6 4223 1 1 30 PHE C C 2.419 6.362 -5.084 1.00 . A A . 30 PHE C 1 1 6 4224 1 1 30 PHE CA C 0.908 6.190 -5.126 1.00 . A A . 30 PHE CA 1 1 6 4225 1 1 30 PHE CB C 0.231 7.353 -4.398 1.00 . A A . 30 PHE CB 1 1 6 4226 1 1 30 PHE CD1 C -1.668 7.020 -6.023 1.00 . A A . 30 PHE CD1 1 1 6 4227 1 1 30 PHE CD2 C -1.169 9.266 -5.256 1.00 . A A . 30 PHE CD2 1 1 6 4228 1 1 30 PHE CE1 C -2.713 7.521 -6.808 1.00 . A A . 30 PHE CE1 1 1 6 4229 1 1 30 PHE CE2 C -2.214 9.766 -6.041 1.00 . A A . 30 PHE CE2 1 1 6 4230 1 1 30 PHE CG C -0.895 7.893 -5.246 1.00 . A A . 30 PHE CG 1 1 6 4231 1 1 30 PHE CZ C -2.986 8.893 -6.817 1.00 . A A . 30 PHE CZ 1 1 6 4232 1 1 30 PHE H H -0.104 4.907 -3.758 1.00 . A A . 30 PHE H 1 1 6 4233 1 1 30 PHE HA H 0.589 6.160 -6.136 1.00 . A A . 30 PHE HA 1 1 6 4234 1 1 30 PHE HB2 H -0.163 7.004 -3.454 1.00 . A A . 30 PHE HB2 1 1 6 4235 1 1 30 PHE HB3 H 0.953 8.135 -4.219 1.00 . A A . 30 PHE HB3 1 1 6 4236 1 1 30 PHE HD1 H -1.457 5.960 -6.015 1.00 . A A . 30 PHE HD1 1 1 6 4237 1 1 30 PHE HD2 H -0.573 9.938 -4.657 1.00 . A A . 30 PHE HD2 1 1 6 4238 1 1 30 PHE HE1 H -3.308 6.848 -7.407 1.00 . A A . 30 PHE HE1 1 1 6 4239 1 1 30 PHE HE2 H -2.425 10.825 -6.048 1.00 . A A . 30 PHE HE2 1 1 6 4240 1 1 30 PHE HZ H -3.792 9.279 -7.423 1.00 . A A . 30 PHE HZ 1 1 6 4241 1 1 30 PHE N N 0.544 4.911 -4.478 1.00 . A A . 30 PHE N 1 1 6 4242 1 1 30 PHE O O 3.001 7.098 -5.853 1.00 . A A . 30 PHE O 1 1 6 4243 1 1 31 SER C C 5.156 5.106 -5.314 1.00 . A A . 31 SER C 1 1 6 4244 1 1 31 SER CA C 4.532 5.764 -4.085 1.00 . A A . 31 SER CA 1 1 6 4245 1 1 31 SER CB C 5.004 5.046 -2.819 1.00 . A A . 31 SER CB 1 1 6 4246 1 1 31 SER H H 2.548 5.084 -3.598 1.00 . A A . 31 SER H 1 1 6 4247 1 1 31 SER HA H 4.826 6.803 -4.045 1.00 . A A . 31 SER HA 1 1 6 4248 1 1 31 SER HB2 H 4.674 4.021 -2.839 1.00 . A A . 31 SER HB2 1 1 6 4249 1 1 31 SER HB3 H 6.085 5.074 -2.773 1.00 . A A . 31 SER HB3 1 1 6 4250 1 1 31 SER HG H 5.032 6.419 -1.439 1.00 . A A . 31 SER HG 1 1 6 4251 1 1 31 SER N N 3.051 5.671 -4.192 1.00 . A A . 31 SER N 1 1 6 4252 1 1 31 SER O O 5.837 5.746 -6.082 1.00 . A A . 31 SER O 1 1 6 4253 1 1 31 SER OG O 4.451 5.692 -1.680 1.00 . A A . 31 SER OG 1 1 6 4254 1 1 32 ALA C C 4.909 3.751 -7.973 1.00 . A A . 32 ALA C 1 1 6 4255 1 1 32 ALA CA C 5.475 3.125 -6.700 1.00 . A A . 32 ALA CA 1 1 6 4256 1 1 32 ALA CB C 5.078 1.648 -6.640 1.00 . A A . 32 ALA CB 1 1 6 4257 1 1 32 ALA H H 4.345 3.346 -4.877 1.00 . A A . 32 ALA H 1 1 6 4258 1 1 32 ALA HA H 6.555 3.213 -6.711 1.00 . A A . 32 ALA HA 1 1 6 4259 1 1 32 ALA HB1 H 4.154 1.546 -6.088 1.00 . A A . 32 ALA HB1 1 1 6 4260 1 1 32 ALA HB2 H 4.943 1.270 -7.642 1.00 . A A . 32 ALA HB2 1 1 6 4261 1 1 32 ALA HB3 H 5.857 1.087 -6.146 1.00 . A A . 32 ALA HB3 1 1 6 4262 1 1 32 ALA N N 4.912 3.834 -5.510 1.00 . A A . 32 ALA N 1 1 6 4263 1 1 32 ALA O O 5.635 4.255 -8.803 1.00 . A A . 32 ALA O 1 1 6 4264 1 1 33 VAL C C 3.659 5.686 -9.598 1.00 . A A . 33 VAL C 1 1 6 4265 1 1 33 VAL CA C 3.026 4.338 -9.353 1.00 . A A . 33 VAL CA 1 1 6 4266 1 1 33 VAL CB C 1.554 4.575 -9.150 1.00 . A A . 33 VAL CB 1 1 6 4267 1 1 33 VAL CG1 C 0.995 5.323 -10.363 1.00 . A A . 33 VAL CG1 1 1 6 4268 1 1 33 VAL CG2 C 0.828 3.244 -8.970 1.00 . A A . 33 VAL CG2 1 1 6 4269 1 1 33 VAL H H 3.038 3.329 -7.459 1.00 . A A . 33 VAL H 1 1 6 4270 1 1 33 VAL HA H 3.181 3.697 -10.206 1.00 . A A . 33 VAL HA 1 1 6 4271 1 1 33 VAL HB H 1.442 5.180 -8.272 1.00 . A A . 33 VAL HB 1 1 6 4272 1 1 33 VAL HG11 H 1.816 5.691 -10.969 1.00 . A A . 33 VAL HG11 1 1 6 4273 1 1 33 VAL HG12 H 0.386 4.653 -10.951 1.00 . A A . 33 VAL HG12 1 1 6 4274 1 1 33 VAL HG13 H 0.397 6.156 -10.028 1.00 . A A . 33 VAL HG13 1 1 6 4275 1 1 33 VAL HG21 H 1.355 2.644 -8.243 1.00 . A A . 33 VAL HG21 1 1 6 4276 1 1 33 VAL HG22 H -0.178 3.429 -8.625 1.00 . A A . 33 VAL HG22 1 1 6 4277 1 1 33 VAL HG23 H 0.795 2.721 -9.915 1.00 . A A . 33 VAL HG23 1 1 6 4278 1 1 33 VAL N N 3.617 3.732 -8.135 1.00 . A A . 33 VAL N 1 1 6 4279 1 1 33 VAL O O 3.983 6.011 -10.706 1.00 . A A . 33 VAL O 1 1 6 4280 1 1 34 ALA C C 5.763 7.601 -9.449 1.00 . A A . 34 ALA C 1 1 6 4281 1 1 34 ALA CA C 4.430 7.817 -8.784 1.00 . A A . 34 ALA CA 1 1 6 4282 1 1 34 ALA CB C 4.685 8.492 -7.454 1.00 . A A . 34 ALA CB 1 1 6 4283 1 1 34 ALA H H 3.526 6.206 -7.684 1.00 . A A . 34 ALA H 1 1 6 4284 1 1 34 ALA HA H 3.794 8.432 -9.403 1.00 . A A . 34 ALA HA 1 1 6 4285 1 1 34 ALA HB1 H 5.273 7.833 -6.832 1.00 . A A . 34 ALA HB1 1 1 6 4286 1 1 34 ALA HB2 H 5.234 9.406 -7.631 1.00 . A A . 34 ALA HB2 1 1 6 4287 1 1 34 ALA HB3 H 3.745 8.711 -6.971 1.00 . A A . 34 ALA HB3 1 1 6 4288 1 1 34 ALA N N 3.815 6.483 -8.577 1.00 . A A . 34 ALA N 1 1 6 4289 1 1 34 ALA O O 6.041 8.119 -10.510 1.00 . A A . 34 ALA O 1 1 6 4290 1 1 35 ILE C C 7.713 6.227 -10.859 1.00 . A A . 35 ILE C 1 1 6 4291 1 1 35 ILE CA C 7.906 6.524 -9.397 1.00 . A A . 35 ILE CA 1 1 6 4292 1 1 35 ILE CB C 8.521 5.307 -8.737 1.00 . A A . 35 ILE CB 1 1 6 4293 1 1 35 ILE CD1 C 8.910 4.180 -6.540 1.00 . A A . 35 ILE CD1 1 1 6 4294 1 1 35 ILE CG1 C 8.007 5.140 -7.319 1.00 . A A . 35 ILE CG1 1 1 6 4295 1 1 35 ILE CG2 C 10.007 5.528 -8.725 1.00 . A A . 35 ILE CG2 1 1 6 4296 1 1 35 ILE H H 6.333 6.412 -7.979 1.00 . A A . 35 ILE H 1 1 6 4297 1 1 35 ILE HA H 8.558 7.377 -9.277 1.00 . A A . 35 ILE HA 1 1 6 4298 1 1 35 ILE HB H 8.277 4.425 -9.306 1.00 . A A . 35 ILE HB 1 1 6 4299 1 1 35 ILE HD11 H 9.927 4.544 -6.565 1.00 . A A . 35 ILE HD11 1 1 6 4300 1 1 35 ILE HD12 H 8.574 4.124 -5.514 1.00 . A A . 35 ILE HD12 1 1 6 4301 1 1 35 ILE HD13 H 8.866 3.200 -6.987 1.00 . A A . 35 ILE HD13 1 1 6 4302 1 1 35 ILE HG12 H 7.978 6.099 -6.825 1.00 . A A . 35 ILE HG12 1 1 6 4303 1 1 35 ILE HG13 H 7.015 4.729 -7.377 1.00 . A A . 35 ILE HG13 1 1 6 4304 1 1 35 ILE HG21 H 10.253 6.206 -9.531 1.00 . A A . 35 ILE HG21 1 1 6 4305 1 1 35 ILE HG22 H 10.284 5.972 -7.785 1.00 . A A . 35 ILE HG22 1 1 6 4306 1 1 35 ILE HG23 H 10.516 4.591 -8.860 1.00 . A A . 35 ILE HG23 1 1 6 4307 1 1 35 ILE N N 6.590 6.815 -8.822 1.00 . A A . 35 ILE N 1 1 6 4308 1 1 35 ILE O O 8.570 6.471 -11.676 1.00 . A A . 35 ILE O 1 1 6 4309 1 1 36 VAL C C 6.030 6.768 -13.293 1.00 . A A . 36 VAL C 1 1 6 4310 1 1 36 VAL CA C 6.316 5.433 -12.617 1.00 . A A . 36 VAL CA 1 1 6 4311 1 1 36 VAL CB C 5.128 4.492 -12.741 1.00 . A A . 36 VAL CB 1 1 6 4312 1 1 36 VAL CG1 C 5.098 3.909 -14.156 1.00 . A A . 36 VAL CG1 1 1 6 4313 1 1 36 VAL CG2 C 5.281 3.365 -11.709 1.00 . A A . 36 VAL CG2 1 1 6 4314 1 1 36 VAL H H 5.875 5.538 -10.518 1.00 . A A . 36 VAL H 1 1 6 4315 1 1 36 VAL HA H 7.192 4.981 -13.054 1.00 . A A . 36 VAL HA 1 1 6 4316 1 1 36 VAL HB H 4.213 5.036 -12.554 1.00 . A A . 36 VAL HB 1 1 6 4317 1 1 36 VAL HG11 H 5.873 4.375 -14.756 1.00 . A A . 36 VAL HG11 1 1 6 4318 1 1 36 VAL HG12 H 5.269 2.844 -14.111 1.00 . A A . 36 VAL HG12 1 1 6 4319 1 1 36 VAL HG13 H 4.135 4.103 -14.603 1.00 . A A . 36 VAL HG13 1 1 6 4320 1 1 36 VAL HG21 H 5.730 3.756 -10.798 1.00 . A A . 36 VAL HG21 1 1 6 4321 1 1 36 VAL HG22 H 4.311 2.952 -11.481 1.00 . A A . 36 VAL HG22 1 1 6 4322 1 1 36 VAL HG23 H 5.915 2.592 -12.114 1.00 . A A . 36 VAL HG23 1 1 6 4323 1 1 36 VAL N N 6.571 5.716 -11.199 1.00 . A A . 36 VAL N 1 1 6 4324 1 1 36 VAL O O 6.611 7.105 -14.301 1.00 . A A . 36 VAL O 1 1 6 4325 1 1 37 ALA C C 6.183 9.508 -13.701 1.00 . A A . 37 ALA C 1 1 6 4326 1 1 37 ALA CA C 4.865 8.881 -13.264 1.00 . A A . 37 ALA CA 1 1 6 4327 1 1 37 ALA CB C 4.194 9.742 -12.192 1.00 . A A . 37 ALA CB 1 1 6 4328 1 1 37 ALA H H 4.740 7.280 -11.895 1.00 . A A . 37 ALA H 1 1 6 4329 1 1 37 ALA HA H 4.209 8.770 -14.106 1.00 . A A . 37 ALA HA 1 1 6 4330 1 1 37 ALA HB1 H 4.944 10.125 -11.516 1.00 . A A . 37 ALA HB1 1 1 6 4331 1 1 37 ALA HB2 H 3.677 10.565 -12.662 1.00 . A A . 37 ALA HB2 1 1 6 4332 1 1 37 ALA HB3 H 3.485 9.139 -11.640 1.00 . A A . 37 ALA HB3 1 1 6 4333 1 1 37 ALA N N 5.166 7.554 -12.708 1.00 . A A . 37 ALA N 1 1 6 4334 1 1 37 ALA O O 6.255 10.187 -14.702 1.00 . A A . 37 ALA O 1 1 6 4335 1 1 38 HIS C C 9.128 8.915 -14.500 1.00 . A A . 38 HIS C 1 1 6 4336 1 1 38 HIS CA C 8.552 9.809 -13.399 1.00 . A A . 38 HIS CA 1 1 6 4337 1 1 38 HIS CB C 9.509 9.864 -12.206 1.00 . A A . 38 HIS CB 1 1 6 4338 1 1 38 HIS CD2 C 7.754 11.349 -10.935 1.00 . A A . 38 HIS CD2 1 1 6 4339 1 1 38 HIS CE1 C 8.306 10.826 -8.906 1.00 . A A . 38 HIS CE1 1 1 6 4340 1 1 38 HIS CG C 8.793 10.457 -11.024 1.00 . A A . 38 HIS CG 1 1 6 4341 1 1 38 HIS H H 7.184 8.677 -12.166 1.00 . A A . 38 HIS H 1 1 6 4342 1 1 38 HIS HA H 8.399 10.794 -13.795 1.00 . A A . 38 HIS HA 1 1 6 4343 1 1 38 HIS HB2 H 9.842 8.866 -11.964 1.00 . A A . 38 HIS HB2 1 1 6 4344 1 1 38 HIS HB3 H 10.361 10.479 -12.455 1.00 . A A . 38 HIS HB3 1 1 6 4345 1 1 38 HIS HD1 H 9.838 9.520 -9.436 1.00 . A A . 38 HIS HD1 1 1 6 4346 1 1 38 HIS HD2 H 7.251 11.803 -11.776 1.00 . A A . 38 HIS HD2 1 1 6 4347 1 1 38 HIS HE1 H 8.334 10.774 -7.828 1.00 . A A . 38 HIS HE1 1 1 6 4348 1 1 38 HIS N N 7.245 9.251 -12.975 1.00 . A A . 38 HIS N 1 1 6 4349 1 1 38 HIS ND1 N 9.129 10.136 -9.718 1.00 . A A . 38 HIS ND1 1 1 6 4350 1 1 38 HIS NE2 N 7.448 11.581 -9.597 1.00 . A A . 38 HIS NE2 1 1 6 4351 1 1 38 HIS O O 9.219 9.306 -15.646 1.00 . A A . 38 HIS O 1 1 6 4352 1 1 39 LEU C C 9.049 6.738 -16.368 1.00 . A A . 39 LEU C 1 1 6 4353 1 1 39 LEU CA C 10.033 6.787 -15.205 1.00 . A A . 39 LEU CA 1 1 6 4354 1 1 39 LEU CB C 10.185 5.379 -14.619 1.00 . A A . 39 LEU CB 1 1 6 4355 1 1 39 LEU CD1 C 11.108 4.028 -12.735 1.00 . A A . 39 LEU CD1 1 1 6 4356 1 1 39 LEU CD2 C 12.340 6.046 -13.544 1.00 . A A . 39 LEU CD2 1 1 6 4357 1 1 39 LEU CG C 10.956 5.440 -13.299 1.00 . A A . 39 LEU CG 1 1 6 4358 1 1 39 LEU H H 9.397 7.410 -13.250 1.00 . A A . 39 LEU H 1 1 6 4359 1 1 39 LEU HA H 10.985 7.141 -15.555 1.00 . A A . 39 LEU HA 1 1 6 4360 1 1 39 LEU HB2 H 9.207 4.956 -14.443 1.00 . A A . 39 LEU HB2 1 1 6 4361 1 1 39 LEU HB3 H 10.724 4.756 -15.318 1.00 . A A . 39 LEU HB3 1 1 6 4362 1 1 39 LEU HD11 H 11.623 3.407 -13.454 1.00 . A A . 39 LEU HD11 1 1 6 4363 1 1 39 LEU HD12 H 11.678 4.065 -11.819 1.00 . A A . 39 LEU HD12 1 1 6 4364 1 1 39 LEU HD13 H 10.131 3.614 -12.536 1.00 . A A . 39 LEU HD13 1 1 6 4365 1 1 39 LEU HD21 H 12.243 6.938 -14.144 1.00 . A A . 39 LEU HD21 1 1 6 4366 1 1 39 LEU HD22 H 12.796 6.297 -12.597 1.00 . A A . 39 LEU HD22 1 1 6 4367 1 1 39 LEU HD23 H 12.960 5.329 -14.061 1.00 . A A . 39 LEU HD23 1 1 6 4368 1 1 39 LEU HG H 10.413 6.049 -12.592 1.00 . A A . 39 LEU HG 1 1 6 4369 1 1 39 LEU N N 9.494 7.710 -14.170 1.00 . A A . 39 LEU N 1 1 6 4370 1 1 39 LEU O O 9.317 7.223 -17.447 1.00 . A A . 39 LEU O 1 1 6 4371 1 1 40 ALA C C 6.776 7.352 -18.013 1.00 . A A . 40 ALA C 1 1 6 4372 1 1 40 ALA CA C 6.900 6.043 -17.235 1.00 . A A . 40 ALA CA 1 1 6 4373 1 1 40 ALA CB C 5.532 5.693 -16.652 1.00 . A A . 40 ALA CB 1 1 6 4374 1 1 40 ALA H H 7.730 5.748 -15.276 1.00 . A A . 40 ALA H 1 1 6 4375 1 1 40 ALA HA H 7.189 5.265 -17.916 1.00 . A A . 40 ALA HA 1 1 6 4376 1 1 40 ALA HB1 H 5.380 4.625 -16.710 1.00 . A A . 40 ALA HB1 1 1 6 4377 1 1 40 ALA HB2 H 4.764 6.196 -17.221 1.00 . A A . 40 ALA HB2 1 1 6 4378 1 1 40 ALA HB3 H 5.483 6.007 -15.623 1.00 . A A . 40 ALA HB3 1 1 6 4379 1 1 40 ALA N N 7.912 6.144 -16.152 1.00 . A A . 40 ALA N 1 1 6 4380 1 1 40 ALA O O 7.111 7.402 -19.164 1.00 . A A . 40 ALA O 1 1 6 4381 1 1 41 VAL C C 7.368 10.050 -18.939 1.00 . A A . 41 VAL C 1 1 6 4382 1 1 41 VAL CA C 6.090 9.665 -18.199 1.00 . A A . 41 VAL CA 1 1 6 4383 1 1 41 VAL CB C 5.674 10.804 -17.268 1.00 . A A . 41 VAL CB 1 1 6 4384 1 1 41 VAL CG1 C 5.367 12.052 -18.098 1.00 . A A . 41 VAL CG1 1 1 6 4385 1 1 41 VAL CG2 C 4.423 10.394 -16.486 1.00 . A A . 41 VAL CG2 1 1 6 4386 1 1 41 VAL H H 5.991 8.358 -16.482 1.00 . A A . 41 VAL H 1 1 6 4387 1 1 41 VAL HA H 5.307 9.501 -18.935 1.00 . A A . 41 VAL HA 1 1 6 4388 1 1 41 VAL HB H 6.479 11.020 -16.582 1.00 . A A . 41 VAL HB 1 1 6 4389 1 1 41 VAL HG11 H 6.204 12.271 -18.743 1.00 . A A . 41 VAL HG11 1 1 6 4390 1 1 41 VAL HG12 H 4.486 11.877 -18.698 1.00 . A A . 41 VAL HG12 1 1 6 4391 1 1 41 VAL HG13 H 5.191 12.888 -17.437 1.00 . A A . 41 VAL HG13 1 1 6 4392 1 1 41 VAL HG21 H 4.406 9.321 -16.370 1.00 . A A . 41 VAL HG21 1 1 6 4393 1 1 41 VAL HG22 H 4.437 10.862 -15.513 1.00 . A A . 41 VAL HG22 1 1 6 4394 1 1 41 VAL HG23 H 3.543 10.712 -17.026 1.00 . A A . 41 VAL HG23 1 1 6 4395 1 1 41 VAL N N 6.273 8.402 -17.421 1.00 . A A . 41 VAL N 1 1 6 4396 1 1 41 VAL O O 7.385 10.086 -20.149 1.00 . A A . 41 VAL O 1 1 6 4397 1 1 42 TYR C C 9.871 9.777 -20.143 1.00 . A A . 42 TYR C 1 1 6 4398 1 1 42 TYR CA C 9.685 10.738 -18.963 1.00 . A A . 42 TYR CA 1 1 6 4399 1 1 42 TYR CB C 10.876 10.734 -17.982 1.00 . A A . 42 TYR CB 1 1 6 4400 1 1 42 TYR CD1 C 12.436 9.311 -19.355 1.00 . A A . 42 TYR CD1 1 1 6 4401 1 1 42 TYR CD2 C 11.887 8.616 -17.104 1.00 . A A . 42 TYR CD2 1 1 6 4402 1 1 42 TYR CE1 C 13.257 8.187 -19.506 1.00 . A A . 42 TYR CE1 1 1 6 4403 1 1 42 TYR CE2 C 12.709 7.490 -17.248 1.00 . A A . 42 TYR CE2 1 1 6 4404 1 1 42 TYR CG C 11.752 9.520 -18.155 1.00 . A A . 42 TYR CG 1 1 6 4405 1 1 42 TYR CZ C 13.394 7.276 -18.452 1.00 . A A . 42 TYR CZ 1 1 6 4406 1 1 42 TYR H H 8.403 10.326 -17.264 1.00 . A A . 42 TYR H 1 1 6 4407 1 1 42 TYR HA H 9.566 11.734 -19.361 1.00 . A A . 42 TYR HA 1 1 6 4408 1 1 42 TYR HB2 H 11.470 11.620 -18.149 1.00 . A A . 42 TYR HB2 1 1 6 4409 1 1 42 TYR HB3 H 10.495 10.753 -16.970 1.00 . A A . 42 TYR HB3 1 1 6 4410 1 1 42 TYR HD1 H 12.320 10.019 -20.165 1.00 . A A . 42 TYR HD1 1 1 6 4411 1 1 42 TYR HD2 H 11.355 8.789 -16.178 1.00 . A A . 42 TYR HD2 1 1 6 4412 1 1 42 TYR HE1 H 13.783 8.024 -20.435 1.00 . A A . 42 TYR HE1 1 1 6 4413 1 1 42 TYR HE2 H 12.814 6.789 -16.434 1.00 . A A . 42 TYR HE2 1 1 6 4414 1 1 42 TYR HH H 15.096 6.475 -18.779 1.00 . A A . 42 TYR HH 1 1 6 4415 1 1 42 TYR N N 8.431 10.350 -18.244 1.00 . A A . 42 TYR N 1 1 6 4416 1 1 42 TYR O O 10.402 10.132 -21.176 1.00 . A A . 42 TYR O 1 1 6 4417 1 1 42 TYR OH O 14.205 6.169 -18.597 1.00 . A A . 42 TYR OH 1 1 6 4418 1 1 43 ILE C C 8.311 7.865 -22.095 1.00 . A A . 43 ILE C 1 1 6 4419 1 1 43 ILE CA C 9.473 7.588 -21.118 1.00 . A A . 43 ILE CA 1 1 6 4420 1 1 43 ILE CB C 9.365 6.166 -20.544 1.00 . A A . 43 ILE CB 1 1 6 4421 1 1 43 ILE CD1 C 10.655 4.265 -19.563 1.00 . A A . 43 ILE CD1 1 1 6 4422 1 1 43 ILE CG1 C 10.753 5.690 -20.111 1.00 . A A . 43 ILE CG1 1 1 6 4423 1 1 43 ILE CG2 C 8.809 5.201 -21.597 1.00 . A A . 43 ILE CG2 1 1 6 4424 1 1 43 ILE H H 8.939 8.328 -19.166 1.00 . A A . 43 ILE H 1 1 6 4425 1 1 43 ILE HA H 10.415 7.705 -21.633 1.00 . A A . 43 ILE HA 1 1 6 4426 1 1 43 ILE HB H 8.708 6.174 -19.688 1.00 . A A . 43 ILE HB 1 1 6 4427 1 1 43 ILE HD11 H 9.724 4.148 -19.029 1.00 . A A . 43 ILE HD11 1 1 6 4428 1 1 43 ILE HD12 H 10.691 3.562 -20.381 1.00 . A A . 43 ILE HD12 1 1 6 4429 1 1 43 ILE HD13 H 11.482 4.079 -18.892 1.00 . A A . 43 ILE HD13 1 1 6 4430 1 1 43 ILE HG12 H 11.421 5.706 -20.960 1.00 . A A . 43 ILE HG12 1 1 6 4431 1 1 43 ILE HG13 H 11.134 6.344 -19.340 1.00 . A A . 43 ILE HG13 1 1 6 4432 1 1 43 ILE HG21 H 8.892 5.649 -22.576 1.00 . A A . 43 ILE HG21 1 1 6 4433 1 1 43 ILE HG22 H 9.371 4.279 -21.573 1.00 . A A . 43 ILE HG22 1 1 6 4434 1 1 43 ILE HG23 H 7.770 4.995 -21.381 1.00 . A A . 43 ILE HG23 1 1 6 4435 1 1 43 ILE N N 9.387 8.574 -20.002 1.00 . A A . 43 ILE N 1 1 6 4436 1 1 43 ILE O O 8.481 8.521 -23.103 1.00 . A A . 43 ILE O 1 1 6 4437 1 1 44 TRP C C 5.326 8.963 -22.388 1.00 . A A . 44 TRP C 1 1 6 4438 1 1 44 TRP CA C 5.957 7.599 -22.681 1.00 . A A . 44 TRP CA 1 1 6 4439 1 1 44 TRP CB C 4.921 6.495 -22.447 1.00 . A A . 44 TRP CB 1 1 6 4440 1 1 44 TRP CD1 C 4.742 7.453 -20.133 1.00 . A A . 44 TRP CD1 1 1 6 4441 1 1 44 TRP CD2 C 3.095 5.998 -20.578 1.00 . A A . 44 TRP CD2 1 1 6 4442 1 1 44 TRP CE2 C 2.879 6.459 -19.258 1.00 . A A . 44 TRP CE2 1 1 6 4443 1 1 44 TRP CE3 C 2.189 5.062 -21.110 1.00 . A A . 44 TRP CE3 1 1 6 4444 1 1 44 TRP CG C 4.285 6.651 -21.107 1.00 . A A . 44 TRP CG 1 1 6 4445 1 1 44 TRP CH2 C 0.914 5.077 -19.035 1.00 . A A . 44 TRP CH2 1 1 6 4446 1 1 44 TRP CZ2 C 1.803 6.008 -18.492 1.00 . A A . 44 TRP CZ2 1 1 6 4447 1 1 44 TRP CZ3 C 1.106 4.605 -20.342 1.00 . A A . 44 TRP CZ3 1 1 6 4448 1 1 44 TRP H H 7.025 6.848 -20.987 1.00 . A A . 44 TRP H 1 1 6 4449 1 1 44 TRP HA H 6.277 7.573 -23.702 1.00 . A A . 44 TRP HA 1 1 6 4450 1 1 44 TRP HB2 H 4.163 6.554 -23.204 1.00 . A A . 44 TRP HB2 1 1 6 4451 1 1 44 TRP HB3 H 5.410 5.538 -22.496 1.00 . A A . 44 TRP HB3 1 1 6 4452 1 1 44 TRP HD1 H 5.613 8.076 -20.209 1.00 . A A . 44 TRP HD1 1 1 6 4453 1 1 44 TRP HE1 H 4.024 7.832 -18.188 1.00 . A A . 44 TRP HE1 1 1 6 4454 1 1 44 TRP HE3 H 2.329 4.692 -22.115 1.00 . A A . 44 TRP HE3 1 1 6 4455 1 1 44 TRP HH2 H 0.078 4.722 -18.450 1.00 . A A . 44 TRP HH2 1 1 6 4456 1 1 44 TRP HZ2 H 1.660 6.375 -17.487 1.00 . A A . 44 TRP HZ2 1 1 6 4457 1 1 44 TRP HZ3 H 0.417 3.885 -20.760 1.00 . A A . 44 TRP HZ3 1 1 6 4458 1 1 44 TRP N N 7.134 7.371 -21.793 1.00 . A A . 44 TRP N 1 1 6 4459 1 1 44 TRP NE1 N 3.911 7.347 -19.032 1.00 . A A . 44 TRP NE1 1 1 6 4460 1 1 44 TRP O O 4.120 9.106 -22.351 1.00 . A A . 44 TRP O 1 1 6 4461 1 1 45 ARG C C 4.728 11.803 -23.063 1.00 . A A . 45 ARG C 1 1 6 4462 1 1 45 ARG CA C 5.593 11.315 -21.887 1.00 . A A . 45 ARG CA 1 1 6 4463 1 1 45 ARG CB C 6.786 12.255 -21.619 1.00 . A A . 45 ARG CB 1 1 6 4464 1 1 45 ARG CD C 8.013 14.264 -22.418 1.00 . A A . 45 ARG CD 1 1 6 4465 1 1 45 ARG CG C 6.639 13.607 -22.334 1.00 . A A . 45 ARG CG 1 1 6 4466 1 1 45 ARG CZ C 8.890 15.149 -24.495 1.00 . A A . 45 ARG CZ 1 1 6 4467 1 1 45 ARG H H 7.100 9.822 -22.213 1.00 . A A . 45 ARG H 1 1 6 4468 1 1 45 ARG HA H 4.986 11.263 -21.009 1.00 . A A . 45 ARG HA 1 1 6 4469 1 1 45 ARG HB2 H 6.862 12.430 -20.557 1.00 . A A . 45 ARG HB2 1 1 6 4470 1 1 45 ARG HB3 H 7.692 11.774 -21.960 1.00 . A A . 45 ARG HB3 1 1 6 4471 1 1 45 ARG HD2 H 8.232 14.760 -21.485 1.00 . A A . 45 ARG HD2 1 1 6 4472 1 1 45 ARG HD3 H 8.757 13.503 -22.607 1.00 . A A . 45 ARG HD3 1 1 6 4473 1 1 45 ARG HE H 7.376 15.996 -23.530 1.00 . A A . 45 ARG HE 1 1 6 4474 1 1 45 ARG HG2 H 6.255 13.458 -23.331 1.00 . A A . 45 ARG HG2 1 1 6 4475 1 1 45 ARG HG3 H 5.970 14.243 -21.776 1.00 . A A . 45 ARG HG3 1 1 6 4476 1 1 45 ARG HH11 H 10.469 15.019 -23.270 1.00 . A A . 45 ARG HH11 1 1 6 4477 1 1 45 ARG HH12 H 10.826 14.942 -24.963 1.00 . A A . 45 ARG HH12 1 1 6 4478 1 1 45 ARG HH21 H 7.516 15.252 -25.946 1.00 . A A . 45 ARG HH21 1 1 6 4479 1 1 45 ARG HH22 H 9.154 15.074 -26.478 1.00 . A A . 45 ARG HH22 1 1 6 4480 1 1 45 ARG N N 6.131 9.960 -22.179 1.00 . A A . 45 ARG N 1 1 6 4481 1 1 45 ARG NE N 8.023 15.258 -23.527 1.00 . A A . 45 ARG NE 1 1 6 4482 1 1 45 ARG NH1 N 10.161 15.028 -24.222 1.00 . A A . 45 ARG NH1 1 1 6 4483 1 1 45 ARG NH2 N 8.489 15.159 -25.736 1.00 . A A . 45 ARG NH2 1 1 6 4484 1 1 45 ARG O O 3.609 12.232 -22.868 1.00 . A A . 45 ARG O 1 1 6 4485 1 1 46 PRO C C 3.600 11.118 -25.952 1.00 . A A . 46 PRO C 1 1 6 4486 1 1 46 PRO CA C 4.604 12.171 -25.474 1.00 . A A . 46 PRO CA 1 1 6 4487 1 1 46 PRO CB C 5.752 12.336 -26.474 1.00 . A A . 46 PRO CB 1 1 6 4488 1 1 46 PRO CD C 6.644 11.210 -24.455 1.00 . A A . 46 PRO CD 1 1 6 4489 1 1 46 PRO CG C 6.918 11.462 -25.951 1.00 . A A . 46 PRO CG 1 1 6 4490 1 1 46 PRO HB2 H 5.440 11.998 -27.453 1.00 . A A . 46 PRO HB2 1 1 6 4491 1 1 46 PRO HB3 H 6.063 13.367 -26.517 1.00 . A A . 46 PRO HB3 1 1 6 4492 1 1 46 PRO HD2 H 6.679 10.152 -24.241 1.00 . A A . 46 PRO HD2 1 1 6 4493 1 1 46 PRO HD3 H 7.345 11.746 -23.837 1.00 . A A . 46 PRO HD3 1 1 6 4494 1 1 46 PRO HG2 H 6.945 10.524 -26.489 1.00 . A A . 46 PRO HG2 1 1 6 4495 1 1 46 PRO HG3 H 7.854 11.984 -26.066 1.00 . A A . 46 PRO HG3 1 1 6 4496 1 1 46 PRO N N 5.284 11.732 -24.243 1.00 . A A . 46 PRO N 1 1 6 4497 1 1 46 PRO O O 3.964 10.018 -26.320 1.00 . A A . 46 PRO O 1 1 6 4498 1 1 47 TRP C C 0.326 11.236 -27.337 1.00 . A A . 47 TRP C 1 1 6 4499 1 1 47 TRP CA C 1.300 10.498 -26.421 1.00 . A A . 47 TRP CA 1 1 6 4500 1 1 47 TRP CB C 0.539 9.945 -25.214 1.00 . A A . 47 TRP CB 1 1 6 4501 1 1 47 TRP CD1 C 2.205 8.081 -24.888 1.00 . A A . 47 TRP CD1 1 1 6 4502 1 1 47 TRP CD2 C 0.078 7.352 -24.842 1.00 . A A . 47 TRP CD2 1 1 6 4503 1 1 47 TRP CE2 C 0.900 6.217 -24.651 1.00 . A A . 47 TRP CE2 1 1 6 4504 1 1 47 TRP CE3 C -1.316 7.167 -24.855 1.00 . A A . 47 TRP CE3 1 1 6 4505 1 1 47 TRP CG C 0.933 8.522 -24.991 1.00 . A A . 47 TRP CG 1 1 6 4506 1 1 47 TRP CH2 C -1.029 4.776 -24.494 1.00 . A A . 47 TRP CH2 1 1 6 4507 1 1 47 TRP CZ2 C 0.357 4.942 -24.478 1.00 . A A . 47 TRP CZ2 1 1 6 4508 1 1 47 TRP CZ3 C -1.865 5.886 -24.682 1.00 . A A . 47 TRP CZ3 1 1 6 4509 1 1 47 TRP H H 2.074 12.353 -25.670 1.00 . A A . 47 TRP H 1 1 6 4510 1 1 47 TRP HA H 1.766 9.687 -26.962 1.00 . A A . 47 TRP HA 1 1 6 4511 1 1 47 TRP HB2 H 0.782 10.528 -24.337 1.00 . A A . 47 TRP HB2 1 1 6 4512 1 1 47 TRP HB3 H -0.522 10.000 -25.402 1.00 . A A . 47 TRP HB3 1 1 6 4513 1 1 47 TRP HD1 H 3.090 8.699 -24.953 1.00 . A A . 47 TRP HD1 1 1 6 4514 1 1 47 TRP HE1 H 2.981 6.146 -24.582 1.00 . A A . 47 TRP HE1 1 1 6 4515 1 1 47 TRP HE3 H -1.969 8.016 -25.000 1.00 . A A . 47 TRP HE3 1 1 6 4516 1 1 47 TRP HH2 H -1.457 3.793 -24.361 1.00 . A A . 47 TRP HH2 1 1 6 4517 1 1 47 TRP HZ2 H 1.006 4.091 -24.334 1.00 . A A . 47 TRP HZ2 1 1 6 4518 1 1 47 TRP HZ3 H -2.937 5.756 -24.693 1.00 . A A . 47 TRP HZ3 1 1 6 4519 1 1 47 TRP N N 2.340 11.457 -25.960 1.00 . A A . 47 TRP N 1 1 6 4520 1 1 47 TRP NE1 N 2.188 6.712 -24.688 1.00 . A A . 47 TRP NE1 1 1 6 4521 1 1 47 TRP O O -0.715 10.726 -27.697 1.00 . A A . 47 TRP O 1 1 6 4522 1 1 48 PHE C C -0.287 12.583 -29.979 1.00 . A A . 48 PHE C 1 1 6 4523 1 1 48 PHE CA C -0.242 13.226 -28.591 1.00 . A A . 48 PHE CA 1 1 6 4524 1 1 48 PHE CB C 0.287 14.655 -28.704 1.00 . A A . 48 PHE CB 1 1 6 4525 1 1 48 PHE CD1 C -2.066 15.471 -29.098 1.00 . A A . 48 PHE CD1 1 1 6 4526 1 1 48 PHE CD2 C -0.650 16.694 -27.556 1.00 . A A . 48 PHE CD2 1 1 6 4527 1 1 48 PHE CE1 C -3.108 16.375 -28.858 1.00 . A A . 48 PHE CE1 1 1 6 4528 1 1 48 PHE CE2 C -1.692 17.598 -27.316 1.00 . A A . 48 PHE CE2 1 1 6 4529 1 1 48 PHE CG C -0.837 15.631 -28.446 1.00 . A A . 48 PHE CG 1 1 6 4530 1 1 48 PHE CZ C -2.921 17.439 -27.967 1.00 . A A . 48 PHE CZ 1 1 6 4531 1 1 48 PHE H H 1.501 12.835 -27.402 1.00 . A A . 48 PHE H 1 1 6 4532 1 1 48 PHE HA H -1.233 13.241 -28.166 1.00 . A A . 48 PHE HA 1 1 6 4533 1 1 48 PHE HB2 H 1.070 14.806 -27.974 1.00 . A A . 48 PHE HB2 1 1 6 4534 1 1 48 PHE HB3 H 0.683 14.817 -29.695 1.00 . A A . 48 PHE HB3 1 1 6 4535 1 1 48 PHE HD1 H -2.210 14.650 -29.785 1.00 . A A . 48 PHE HD1 1 1 6 4536 1 1 48 PHE HD2 H 0.298 16.818 -27.053 1.00 . A A . 48 PHE HD2 1 1 6 4537 1 1 48 PHE HE1 H -4.056 16.252 -29.360 1.00 . A A . 48 PHE HE1 1 1 6 4538 1 1 48 PHE HE2 H -1.547 18.419 -26.629 1.00 . A A . 48 PHE HE2 1 1 6 4539 1 1 48 PHE HZ H -3.725 18.137 -27.783 1.00 . A A . 48 PHE HZ 1 1 6 4540 1 1 48 PHE N N 0.658 12.443 -27.708 1.00 . A A . 48 PHE N 1 1 6 4541 1 1 48 PHE O O -1.317 12.024 -30.318 1.00 . A A . 48 PHE O 1 1 6 4542 1 1 48 PHE OXT O 0.708 12.663 -30.680 1.00 . A A . 48 PHE OXT 1 1 stop_ save_
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