NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
395738 | 1rzs | 6185 | cing | 4-filtered-FRED | STAR | entry | full | 867 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1rzs # This FRED archive file contains, for PDB entry <1rzs>: # # - 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_1rzs _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 1rzs _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 6829.71 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 $Regulatory_protein_cro A . 1 1 stop_ save_ save_Regulatory_protein_cro _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Regulatory protein cro" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code MYKKDVIDHFGTQRAVAKALGISDAAVSQWKEVIPEKDAYRLEIVTAGALKYQENAYRQAA _Entity.Number_of_monomers 61 loop_ _Entity_comp_index.ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 MET . 1 1 2 TYR . 1 1 3 LYS . 1 1 4 LYS . 1 1 5 ASP . 1 1 6 VAL . 1 1 7 ILE . 1 1 8 ASP . 1 1 9 HIS . 1 1 10 PHE . 1 1 11 GLY . 1 1 12 THR . 1 1 13 GLN . 1 1 14 ARG . 1 1 15 ALA . 1 1 16 VAL . 1 1 17 ALA . 1 1 18 LYS . 1 1 19 ALA . 1 1 20 LEU . 1 1 21 GLY . 1 1 22 ILE . 1 1 23 SER . 1 1 24 ASP . 1 1 25 ALA . 1 1 26 ALA . 1 1 27 VAL . 1 1 28 SER . 1 1 29 GLN . 1 1 30 TRP . 1 1 31 LYS . 1 1 32 GLU . 1 1 33 VAL . 1 1 34 ILE . 1 1 35 PRO . 1 1 36 GLU . 1 1 37 LYS . 1 1 38 ASP . 1 1 39 ALA . 1 1 40 TYR . 1 1 41 ARG . 1 1 42 LEU . 1 1 43 GLU . 1 1 44 ILE . 1 1 45 VAL . 1 1 46 THR . 1 1 47 ALA . 1 1 48 GLY . 1 1 49 ALA . 1 1 50 LEU . 1 1 51 LYS . 1 1 52 TYR . 1 1 53 GLN . 1 1 54 GLU . 1 1 55 ASN . 1 1 56 ALA . 1 1 57 TYR . 1 1 58 ARG . 1 1 59 GLN . 1 1 60 ALA . 1 1 61 ALA . 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 MET 1 1 1 1 TYR 2 2 1 1 LYS 3 3 1 1 LYS 4 4 1 1 ASP 5 5 1 1 VAL 6 6 1 1 ILE 7 7 1 1 ASP 8 8 1 1 HIS 9 9 1 1 PHE 10 10 1 1 GLY 11 11 1 1 THR 12 12 1 1 GLN 13 13 1 1 ARG 14 14 1 1 ALA 15 15 1 1 VAL 16 16 1 1 ALA 17 17 1 1 LYS 18 18 1 1 ALA 19 19 1 1 LEU 20 20 1 1 GLY 21 21 1 1 ILE 22 22 1 1 SER 23 23 1 1 ASP 24 24 1 1 ALA 25 25 1 1 ALA 26 26 1 1 VAL 27 27 1 1 SER 28 28 1 1 GLN 29 29 1 1 TRP 30 30 1 1 LYS 31 31 1 1 GLU 32 32 1 1 VAL 33 33 1 1 ILE 34 34 1 1 PRO 35 35 1 1 GLU 36 36 1 1 LYS 37 37 1 1 ASP 38 38 1 1 ALA 39 39 1 1 TYR 40 40 1 1 ARG 41 41 1 1 LEU 42 42 1 1 GLU 43 43 1 1 ILE 44 44 1 1 VAL 45 45 1 1 THR 46 46 1 1 ALA 47 47 1 1 GLY 48 48 1 1 ALA 49 49 1 1 LEU 50 50 1 1 LYS 51 51 1 1 TYR 52 52 1 1 GLN 53 53 1 1 GLU 54 54 1 1 ASN 55 55 1 1 ALA 56 56 1 1 TYR 57 57 1 1 ARG 58 58 1 1 GLN 59 59 1 1 ALA 60 60 1 1 ALA 61 61 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 1 422 1 . . . 1 1 423 1 . . . 1 1 424 1 . . . 1 1 425 1 . . . 1 1 426 1 . . . 1 1 427 1 . . . 1 1 428 1 . . . 1 1 429 1 . . . 1 1 430 1 . . . 1 1 431 1 . . . 1 1 432 1 . . . 1 1 433 1 . . . 1 1 434 1 . . . 1 1 435 1 . . . 1 1 436 1 . . . 1 1 437 1 . . . 1 1 438 1 . . . 1 1 439 1 . . . 1 1 440 1 . . . 1 1 441 1 . . . 1 1 442 1 . . . 1 1 443 1 . . . 1 1 444 1 . . . 1 1 445 1 . . . 1 1 446 1 . . . 1 1 447 1 . . . 1 1 448 1 . . . 1 1 449 1 . . . 1 1 450 1 . . . 1 1 451 1 . . . 1 1 452 1 . . . 1 1 453 1 . . . 1 1 454 1 . . . 1 1 455 1 . . . 1 1 456 1 . . . 1 1 457 1 . . . 1 1 458 1 . . . 1 1 459 1 . . . 1 1 460 1 . . . 1 1 461 1 . . . 1 1 462 1 . . . 1 1 463 1 . . . 1 1 464 1 . . . 1 1 465 1 . . . 1 1 466 1 . . . 1 1 467 1 . . . 1 1 468 1 . . . 1 1 469 1 . . . 1 1 470 1 . . . 1 1 471 1 . . . 1 1 472 1 . . . 1 1 473 1 . . . 1 1 474 1 . . . 1 1 475 1 . . . 1 1 476 1 . . . 1 1 477 1 . . . 1 1 478 1 . . . 1 1 479 1 . . . 1 1 480 1 . . . 1 1 481 1 . . . 1 1 482 1 . . . 1 1 483 1 . . . 1 1 484 1 . . . 1 1 485 1 . . . 1 1 486 1 . . . 1 1 487 1 . . . 1 1 488 1 . . . 1 1 489 1 . . . 1 1 490 1 . . . 1 1 491 1 . . . 1 1 492 1 . . . 1 1 493 1 . . . 1 1 494 1 . . . 1 1 495 1 . . . 1 1 496 1 . . . 1 1 497 1 . . . 1 1 498 1 . . . 1 1 499 1 . . . 1 1 500 1 . . . 1 1 501 1 . . . 1 1 502 1 . . . 1 1 503 1 . . . 1 1 504 1 . . . 1 1 505 1 . . . 1 1 506 1 . . . 1 1 507 1 . . . 1 1 508 1 . . . 1 1 509 1 . . . 1 1 510 1 . . . 1 1 511 1 . . . 1 1 512 1 . . . 1 1 513 1 . . . 1 1 514 1 . . . 1 1 515 1 . . . 1 1 516 1 . . . 1 1 517 1 . . . 1 1 518 1 . . . 1 1 519 1 . . . 1 1 520 1 . . . 1 1 521 1 . . . 1 1 522 1 . . . 1 1 523 1 . . . 1 1 524 1 . . . 1 1 525 1 . . . 1 1 526 1 . . . 1 1 527 1 . . . 1 1 528 1 . . . 1 1 529 1 . . . 1 1 530 1 . . . 1 1 531 1 . . . 1 1 532 1 . . . 1 1 533 1 . . . 1 1 534 1 . . . 1 1 535 1 . . . 1 1 536 1 . . . 1 1 537 1 . . . 1 1 538 1 . . . 1 1 539 1 . . . 1 1 540 1 . . . 1 1 541 1 . . . 1 1 542 1 . . . 1 1 543 1 . . . 1 1 544 1 . . . 1 1 545 1 . . . 1 1 546 1 . . . 1 1 547 1 . . . 1 1 548 1 . . . 1 1 549 1 . . . 1 1 550 1 . . . 1 1 551 1 . . . 1 1 552 1 . . . 1 1 553 1 . . . 1 1 554 1 . . . 1 1 555 1 . . . 1 1 556 1 . . . 1 1 557 1 . . . 1 1 558 1 . . . 1 1 559 1 . . . 1 1 560 1 . . . 1 1 561 1 . . . 1 1 562 1 . . . 1 1 563 1 . . . 1 1 564 1 . . . 1 1 565 1 . . . 1 1 566 1 . . . 1 1 567 1 . . . 1 1 568 1 . . . 1 1 569 1 . . . 1 1 570 1 . . . 1 1 571 1 . . . 1 1 572 1 . . . 1 1 573 1 . . . 1 1 574 1 . . . 1 1 575 1 . . . 1 1 576 1 . . . 1 1 577 1 . . . 1 1 578 1 . . . 1 1 579 1 . . . 1 1 580 1 . . . 1 1 581 1 . . . 1 1 582 1 . . . 1 1 583 1 . . . 1 1 584 1 . . . 1 1 585 1 . . . 1 1 586 1 . . . 1 1 587 1 . . . 1 1 588 1 . . . 1 1 589 1 . . . 1 1 590 1 . . . 1 1 591 1 . . . 1 1 592 1 . . . 1 1 593 1 . . . 1 1 594 1 . . . 1 1 595 1 . . . 1 1 596 1 . . . 1 1 597 1 . . . 1 1 598 1 . . . 1 1 599 1 . . . 1 1 600 1 . . . 1 1 601 1 . . . 1 1 602 1 . . . 1 1 603 1 . . . 1 1 604 1 . . . 1 1 605 1 . . . 1 1 606 1 . . . 1 1 607 1 . . . 1 1 608 1 . . . 1 1 609 1 . . . 1 1 610 1 . . . 1 1 611 1 . . . 1 1 612 1 . . . 1 1 613 1 . . . 1 1 614 1 . . . 1 1 615 1 . . . 1 1 616 1 . . . 1 1 617 1 . . . 1 1 618 1 . . . 1 1 619 1 . . . 1 1 620 1 . . . 1 1 621 1 . . . 1 1 622 1 . . . 1 1 623 1 . . . 1 1 624 1 . . . 1 1 625 1 . . . 1 1 626 1 . . . 1 1 627 1 . . . 1 1 628 1 . . . 1 1 629 1 . . . 1 1 630 1 . . . 1 1 631 1 . . . 1 1 632 1 . . . 1 1 633 1 . . . 1 1 634 1 . . . 1 1 635 1 . . . 1 1 636 1 . . . 1 1 637 1 . . . 1 1 638 1 . . . 1 1 639 1 . . . 1 1 640 1 . . . 1 1 641 1 . . . 1 1 642 1 . . . 1 1 643 1 . . . 1 1 644 1 . . . 1 1 645 1 . . . 1 1 646 1 . . . 1 1 647 1 . . . 1 1 648 1 . . . 1 1 649 1 . . . 1 1 650 1 . . . 1 1 651 1 . . . 1 1 652 1 . . . 1 1 653 1 . . . 1 1 654 1 . . . 1 1 655 1 . . . 1 1 656 1 . . . 1 1 657 1 . . . 1 1 658 1 . . . 1 1 659 1 . . . 1 1 660 1 . . . 1 1 661 1 . . . 1 1 662 1 . . . 1 1 663 1 . . . 1 1 664 1 . . . 1 1 665 1 . . . 1 1 666 1 . . . 1 1 667 1 . . . 1 1 668 1 . . . 1 1 669 1 . . . 1 1 670 1 . . . 1 1 671 1 . . . 1 1 672 1 . . . 1 1 673 1 . . . 1 1 674 1 . . . 1 1 675 1 . . . 1 1 676 1 . . . 1 1 677 1 . . . 1 1 678 1 . . . 1 1 679 1 . . . 1 1 680 1 . . . 1 1 681 1 . . . 1 1 682 1 . . . 1 1 683 1 . . . 1 1 684 1 . . . 1 1 685 1 . . . 1 1 686 1 . . . 1 1 687 1 . . . 1 1 688 1 . . . 1 1 689 1 . . . 1 1 690 1 . . . 1 1 691 1 . . . 1 1 692 1 . . . 1 1 693 1 . . . 1 1 694 1 . . . 1 1 695 1 . . . 1 1 696 1 . . . 1 1 697 1 . . . 1 1 698 1 . . . 1 1 699 1 . . . 1 1 700 1 . . . 1 1 701 1 . . . 1 1 702 1 . . . 1 1 703 1 . . . 1 1 704 1 . . . 1 1 705 1 . . . 1 1 706 1 . . . 1 1 707 1 . . . 1 1 708 1 . . . 1 1 709 1 . . . 1 1 710 1 . . . 1 1 711 1 . . . 1 1 712 1 . . . 1 1 713 1 . . . 1 1 714 1 . . . 1 1 715 1 . . . 1 1 716 1 . . . 1 1 717 1 . . . 1 1 718 1 . . . 1 1 719 1 . . . 1 1 720 1 . . . 1 1 721 1 . . . 1 1 722 1 . . . 1 1 723 1 . . . 1 1 724 1 . . . 1 1 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 2 TYR HB2 . 2 . HB2 1 1 1 1 2 1 1 2 TYR QD . 2 . HD# 1 1 2 1 1 1 1 2 TYR HB3 . 2 . HB1 1 1 2 1 2 1 1 2 TYR QD . 2 . HD# 1 1 3 1 1 1 1 2 TYR HB3 . 2 . HB1 1 1 3 1 2 1 1 2 TYR QE . 2 . HE# 1 1 4 1 1 1 1 2 TYR HA . 2 . HA 1 1 4 1 2 1 1 2 TYR QD . 2 . HD# 1 1 5 1 1 1 1 2 TYR HA . 2 . HA 1 1 5 1 2 1 1 2 TYR QE . 2 . HE# 1 1 6 1 1 1 1 2 TYR H . 2 . HN 1 1 6 1 2 1 1 2 TYR QD . 2 . HD# 1 1 7 1 1 1 1 3 LYS H . 3 . HN 1 1 7 1 2 1 1 3 LYS QB . 3 . HB# 1 1 8 1 1 1 1 3 LYS H . 3 . HN 1 1 8 1 2 1 1 3 LYS QD . 3 . HD# 1 1 9 1 1 1 1 3 LYS HA . 3 . HA 1 1 9 1 2 1 1 3 LYS QG . 3 . HG# 1 1 10 1 1 1 1 4 LYS H . 4 . HN 1 1 10 1 2 1 1 4 LYS HB2 . 4 . HB2 1 1 11 1 1 1 1 4 LYS H . 4 . HN 1 1 11 1 2 1 1 4 LYS HB3 . 4 . HB1 1 1 12 1 1 1 1 4 LYS H . 4 . HN 1 1 12 1 2 1 1 4 LYS QG . 4 . HG# 1 1 13 1 1 1 1 5 ASP HA . 5 . HA 1 1 13 1 2 1 1 5 ASP QB . 5 . HB# 1 1 14 1 1 1 1 6 VAL H . 6 . HN 1 1 14 1 2 1 1 6 VAL HB . 6 . HB 1 1 15 1 1 1 1 6 VAL H . 6 . HN 1 1 15 1 2 1 1 6 VAL MG1 . 6 . HG1# 1 1 16 1 1 1 1 6 VAL H . 6 . HN 1 1 16 1 2 1 1 6 VAL MG2 . 6 . HG2# 1 1 17 1 1 1 1 6 VAL HA . 6 . HA 1 1 17 1 2 1 1 6 VAL MG2 . 6 . HG2# 1 1 18 1 1 1 1 7 ILE H . 7 . HN 1 1 18 1 2 1 1 7 ILE QG . 7 . HG1# 1 1 19 1 1 1 1 7 ILE H . 7 . HN 1 1 19 1 2 1 1 7 ILE MD . 7 . HD1# 1 1 20 1 1 1 1 7 ILE HA . 7 . HA 1 1 20 1 2 1 1 7 ILE MG . 7 . HG2# 1 1 21 1 1 1 1 7 ILE H . 7 . HN 1 1 21 1 2 1 1 7 ILE MG . 7 . HG2# 1 1 22 1 1 1 1 8 ASP H . 8 . HN 1 1 22 1 2 1 1 8 ASP HB3 . 8 . HB1 1 1 23 1 1 1 1 8 ASP H . 8 . HN 1 1 23 1 2 1 1 8 ASP HB2 . 8 . HB2 1 1 24 1 1 1 1 9 HIS H . 9 . HN 1 1 24 1 2 1 1 9 HIS QB . 9 . HB# 1 1 25 1 1 1 1 9 HIS H . 9 . HN 1 1 25 1 2 1 1 9 HIS HD2 . 9 . HD2 1 1 26 1 1 1 1 9 HIS HA . 9 . HA 1 1 26 1 2 1 1 9 HIS HD2 . 9 . HD2 1 1 27 1 1 1 1 10 PHE HA . 10 . HA 1 1 27 1 2 1 1 10 PHE QE . 10 . HE# 1 1 28 1 1 1 1 10 PHE H . 10 . HN 1 1 28 1 2 1 1 10 PHE HB2 . 10 . HB2 1 1 29 1 1 1 1 10 PHE HA . 10 . HA 1 1 29 1 2 1 1 10 PHE QD . 10 . HD# 1 1 30 1 1 1 1 10 PHE HB2 . 10 . HB2 1 1 30 1 2 1 1 10 PHE QD . 10 . HD# 1 1 31 1 1 1 1 10 PHE HB3 . 10 . HB1 1 1 31 1 2 1 1 10 PHE QD . 10 . HD# 1 1 32 1 1 1 1 10 PHE H . 10 . HN 1 1 32 1 2 1 1 10 PHE QD . 10 . HD# 1 1 33 1 1 1 1 12 THR HA . 12 . HA 1 1 33 1 2 1 1 12 THR HB . 12 . HB 1 1 34 1 1 1 1 13 GLN H . 13 . HN 1 1 34 1 2 1 1 13 GLN QG . 13 . HG# 1 1 35 1 1 1 1 14 ARG H . 14 . HN 1 1 35 1 2 1 1 14 ARG QD . 14 . HD# 1 1 36 1 1 1 1 14 ARG H . 14 . HN 1 1 36 1 2 1 1 14 ARG HB2 . 14 . HB2 1 1 37 1 1 1 1 14 ARG H . 14 . HN 1 1 37 1 2 1 1 14 ARG HB3 . 14 . HB1 1 1 38 1 1 1 1 16 VAL H . 16 . HN 1 1 38 1 2 1 1 16 VAL MG2 . 16 . HG2# 1 1 39 1 1 1 1 16 VAL H . 16 . HN 1 1 39 1 2 1 1 16 VAL MG1 . 16 . HG1# 1 1 40 1 1 1 1 16 VAL HA . 16 . HA 1 1 40 1 2 1 1 16 VAL MG1 . 16 . HG1# 1 1 41 1 1 1 1 18 LYS H . 18 . HN 1 1 41 1 2 1 1 18 LYS QB . 18 . HB# 1 1 42 1 1 1 1 18 LYS H . 18 . HN 1 1 42 1 2 1 1 18 LYS HG2 . 18 . HG2 1 1 43 1 1 1 1 18 LYS H . 18 . HN 1 1 43 1 2 1 1 18 LYS HG3 . 18 . HG1 1 1 44 1 1 1 1 18 LYS H . 18 . HN 1 1 44 1 2 1 1 18 LYS QD . 18 . HD# 1 1 45 1 1 1 1 19 ALA H . 19 . HN 1 1 45 1 2 1 1 19 ALA MB . 19 . HB# 1 1 46 1 1 1 1 20 LEU H . 20 . HN 1 1 46 1 2 1 1 20 LEU MD1 . 20 . HD1# 1 1 47 1 1 1 1 20 LEU H . 20 . HN 1 1 47 1 2 1 1 20 LEU MD2 . 20 . HD2# 1 1 48 1 1 1 1 20 LEU HA . 20 . HA 1 1 48 1 2 1 1 20 LEU MD1 . 20 . HD1# 1 1 49 1 1 1 1 22 ILE H . 22 . HN 1 1 49 1 2 1 1 22 ILE MG . 22 . HG2# 1 1 50 1 1 1 1 23 SER H . 23 . HN 1 1 50 1 2 1 1 23 SER QB . 23 . HB# 1 1 51 1 1 1 1 23 SER HA . 23 . HA 1 1 51 1 2 1 1 23 SER QB . 23 . HB# 1 1 52 1 1 1 1 24 ASP H . 24 . HN 1 1 52 1 2 1 1 24 ASP QB . 24 . HB# 1 1 53 1 1 1 1 25 ALA H . 25 . HN 1 1 53 1 2 1 1 25 ALA MB . 25 . HB# 1 1 54 1 1 1 1 26 ALA H . 26 . HN 1 1 54 1 2 1 1 26 ALA MB . 26 . HB# 1 1 55 1 1 1 1 27 VAL H . 27 . HN 1 1 55 1 2 1 1 27 VAL HB . 27 . HB 1 1 56 1 1 1 1 27 VAL H . 27 . HN 1 1 56 1 2 1 1 27 VAL MG1 . 27 . HG1# 1 1 57 1 1 1 1 27 VAL H . 27 . HN 1 1 57 1 2 1 1 27 VAL MG2 . 27 . HG2# 1 1 58 1 1 1 1 27 VAL MG1 . 27 . HG1# 1 1 58 1 2 1 1 27 VAL MG2 . 27 . HG2# 1 1 59 1 1 1 1 29 GLN H . 29 . HN 1 1 59 1 2 1 1 29 GLN HG2 . 29 . HG2 1 1 60 1 1 1 1 29 GLN H . 29 . HN 1 1 60 1 2 1 1 29 GLN QB . 29 . HB# 1 1 61 1 1 1 1 29 GLN H . 29 . HN 1 1 61 1 2 1 1 29 GLN HG3 . 29 . HG1 1 1 62 1 1 1 1 29 GLN HA . 29 . HA 1 1 62 1 2 1 1 29 GLN HG2 . 29 . HG2 1 1 63 1 1 1 1 29 GLN HA . 29 . HA 1 1 63 1 2 1 1 29 GLN HG3 . 29 . HG1 1 1 64 1 1 1 1 30 TRP H . 30 . HN 1 1 64 1 2 1 1 30 TRP QB . 30 . HB# 1 1 65 1 1 1 1 30 TRP HB2 . 30 . HB2 1 1 65 1 2 1 1 30 TRP HE3 . 30 . HE3 1 1 66 1 1 1 1 30 TRP HB3 . 30 . HB1 1 1 66 1 2 1 1 30 TRP HE3 . 30 . HE3 1 1 67 1 1 1 1 30 TRP H . 30 . HN 1 1 67 1 2 1 1 30 TRP HE1 . 30 . HE1 1 1 68 1 1 1 1 30 TRP H . 30 . HN 1 1 68 1 2 1 1 30 TRP HD1 . 30 . HD1 1 1 69 1 1 1 1 31 LYS H . 31 . HN 1 1 69 1 2 1 1 31 LYS QD . 31 . HD# 1 1 70 1 1 1 1 31 LYS H . 31 . HN 1 1 70 1 2 1 1 31 LYS QG . 31 . HG# 1 1 71 1 1 1 1 32 GLU H . 32 . HN 1 1 71 1 2 1 1 32 GLU QB . 32 . HB# 1 1 72 1 1 1 1 32 GLU H . 32 . HN 1 1 72 1 2 1 1 32 GLU QG . 32 . HG# 1 1 73 1 1 1 1 32 GLU HA . 32 . HA 1 1 73 1 2 1 1 32 GLU QB . 32 . HB# 1 1 74 1 1 1 1 33 VAL H . 33 . HN 1 1 74 1 2 1 1 33 VAL MG1 . 33 . HG1# 1 1 75 1 1 1 1 34 ILE H . 34 . HN 1 1 75 1 2 1 1 34 ILE MD . 34 . HD1# 1 1 76 1 1 1 1 34 ILE HA . 34 . HA 1 1 76 1 2 1 1 34 ILE MD . 34 . HD1# 1 1 77 1 1 1 1 36 GLU H . 36 . HN 1 1 77 1 2 1 1 36 GLU HB3 . 36 . HB1 1 1 78 1 1 1 1 36 GLU H . 36 . HN 1 1 78 1 2 1 1 36 GLU HB2 . 36 . HB2 1 1 79 1 1 1 1 37 LYS H . 37 . HN 1 1 79 1 2 1 1 37 LYS QG . 37 . HG# 1 1 80 1 1 1 1 38 ASP H . 38 . HN 1 1 80 1 2 1 1 38 ASP QB . 38 . HB# 1 1 81 1 1 1 1 40 TYR HA . 40 . HA 1 1 81 1 2 1 1 40 TYR QD . 40 . HD# 1 1 82 1 1 1 1 40 TYR H . 40 . HN 1 1 82 1 2 1 1 40 TYR HB2 . 40 . HB2 1 1 83 1 1 1 1 40 TYR H . 40 . HN 1 1 83 1 2 1 1 40 TYR HB3 . 40 . HB1 1 1 84 1 1 1 1 40 TYR H . 40 . HN 1 1 84 1 2 1 1 40 TYR QD . 40 . HD# 1 1 85 1 1 1 1 40 TYR HA . 40 . HA 1 1 85 1 2 1 1 40 TYR QE . 40 . HE# 1 1 86 1 1 1 1 42 LEU H . 42 . HN 1 1 86 1 2 1 1 42 LEU MD2 . 42 . HD2# 1 1 87 1 1 1 1 44 ILE H . 44 . HN 1 1 87 1 2 1 1 44 ILE HG12 . 44 . HG12 1 1 88 1 1 1 1 44 ILE HA . 44 . HA 1 1 88 1 2 1 1 44 ILE MD . 44 . HD1# 1 1 89 1 1 1 1 44 ILE HA . 44 . HA 1 1 89 1 2 1 1 44 ILE HG12 . 44 . HG12 1 1 90 1 1 1 1 44 ILE HA . 44 . HA 1 1 90 1 2 1 1 44 ILE HG13 . 44 . HG11 1 1 91 1 1 1 1 44 ILE HA . 44 . HA 1 1 91 1 2 1 1 44 ILE MG . 44 . HG2# 1 1 92 1 1 1 1 44 ILE QG . 44 . HG1# 1 1 92 1 2 1 1 44 ILE MG . 44 . HG2# 1 1 93 1 1 1 1 44 ILE H . 44 . HN 1 1 93 1 2 1 1 44 ILE HG13 . 44 . HG11 1 1 94 1 1 1 1 45 VAL H . 45 . HN 1 1 94 1 2 1 1 45 VAL HA . 45 . HA 1 1 95 1 1 1 1 45 VAL HA . 45 . HA 1 1 95 1 2 1 1 45 VAL HB . 45 . HB 1 1 96 1 1 1 1 46 THR H . 46 . HN 1 1 96 1 2 1 1 46 THR HB . 46 . HB 1 1 97 1 1 1 1 47 ALA H . 47 . HN 1 1 97 1 2 1 1 47 ALA HA . 47 . HA 1 1 98 1 1 1 1 47 ALA H . 47 . HN 1 1 98 1 2 1 1 47 ALA MB . 47 . HB# 1 1 99 1 1 1 1 48 GLY H . 48 . HN 1 1 99 1 2 1 1 48 GLY QA . 48 . HA# 1 1 100 1 1 1 1 51 LYS H . 51 . HN 1 1 100 1 2 1 1 51 LYS QB . 51 . HB# 1 1 101 1 1 1 1 51 LYS HA . 51 . HA 1 1 101 1 2 1 1 51 LYS QE . 51 . HE# 1 1 102 1 1 1 1 52 TYR H . 52 . HN 1 1 102 1 2 1 1 52 TYR HB3 . 52 . HB1 1 1 103 1 1 1 1 52 TYR H . 52 . HN 1 1 103 1 2 1 1 52 TYR HB2 . 52 . HB2 1 1 104 1 1 1 1 53 GLN HA . 53 . HA 1 1 104 1 2 1 1 53 GLN QG . 53 . HG# 1 1 105 1 1 1 1 54 GLU H . 54 . HN 1 1 105 1 2 1 1 54 GLU QG . 54 . HG# 1 1 106 1 1 1 1 54 GLU H . 54 . HN 1 1 106 1 2 1 1 54 GLU QB . 54 . HB# 1 1 107 1 1 1 1 55 ASN H . 55 . HN 1 1 107 1 2 1 1 55 ASN QD . 55 . HD2# 1 1 108 1 1 1 1 57 TYR HB2 . 57 . HB2 1 1 108 1 2 1 1 57 TYR QD . 57 . HD# 1 1 109 1 1 1 1 57 TYR HB3 . 57 . HB1 1 1 109 1 2 1 1 57 TYR QD . 57 . HD# 1 1 110 1 1 1 1 57 TYR HB3 . 57 . HB1 1 1 110 1 2 1 1 57 TYR QE . 57 . HE# 1 1 111 1 1 1 1 57 TYR H . 57 . HN 1 1 111 1 2 1 1 57 TYR QD . 57 . HD# 1 1 112 1 1 1 1 57 TYR HA . 57 . HA 1 1 112 1 2 1 1 57 TYR QD . 57 . HD# 1 1 113 1 1 1 1 1 MET HA . 1 . HA 1 1 113 1 2 1 1 2 TYR H . 2 . HN 1 1 114 1 1 1 1 1 MET QG . 1 . HG# 1 1 114 1 2 1 1 2 TYR H . 2 . HN 1 1 115 1 1 1 1 1 MET HA . 1 . HA 1 1 115 1 2 1 1 2 TYR QD . 2 . HD# 1 1 116 1 1 1 1 1 MET QG . 1 . HG# 1 1 116 1 2 1 1 34 ILE MD . 34 . HD1# 1 1 117 1 1 1 1 1 MET QG . 1 . HG# 1 1 117 1 2 1 1 34 ILE MG . 34 . HG2# 1 1 118 1 1 1 1 1 MET ME . 1 . HE# 1 1 118 1 2 1 1 34 ILE MD . 34 . HD1# 1 1 119 1 1 1 1 1 MET QG . 1 . HG# 1 1 119 1 2 1 1 39 ALA MB . 39 . HB# 1 1 120 1 1 1 1 1 MET ME . 1 . HE# 1 1 120 1 2 1 1 40 TYR HA . 40 . HA 1 1 121 1 1 1 1 1 MET ME . 1 . HE# 1 1 121 1 2 1 1 52 TYR HA . 52 . HA 1 1 122 1 1 1 1 1 MET ME . 1 . HE# 1 1 122 1 2 1 1 52 TYR H . 52 . HN 1 1 123 1 1 1 1 2 TYR HA . 2 . HA 1 1 123 1 2 1 1 3 LYS H . 3 . HN 1 1 124 1 1 1 1 2 TYR HB2 . 2 . HB2 1 1 124 1 2 1 1 3 LYS H . 3 . HN 1 1 125 1 1 1 1 2 TYR HB3 . 2 . HB1 1 1 125 1 2 1 1 3 LYS H . 3 . HN 1 1 126 1 1 1 1 2 TYR QD . 2 . HD# 1 1 126 1 2 1 1 3 LYS H . 3 . HN 1 1 127 1 1 1 1 2 TYR HA . 2 . HA 1 1 127 1 2 1 1 3 LYS QB . 3 . HB# 1 1 128 1 1 1 1 2 TYR HA . 2 . HA 1 1 128 1 2 1 1 4 LYS H . 4 . HN 1 1 129 1 1 1 1 2 TYR HB3 . 2 . HB1 1 1 129 1 2 1 1 4 LYS H . 4 . HN 1 1 130 1 1 1 1 2 TYR HB2 . 2 . HB2 1 1 130 1 2 1 1 4 LYS H . 4 . HN 1 1 131 1 1 1 1 2 TYR QD . 2 . HD# 1 1 131 1 2 1 1 4 LYS H . 4 . HN 1 1 132 1 1 1 1 2 TYR HA . 2 . HA 1 1 132 1 2 1 1 5 ASP H . 5 . HN 1 1 133 1 1 1 1 2 TYR HB3 . 2 . HB1 1 1 133 1 2 1 1 5 ASP H . 5 . HN 1 1 134 1 1 1 1 2 TYR H . 2 . HN 1 1 134 1 2 1 1 6 VAL MG2 . 6 . HG2# 1 1 135 1 1 1 1 2 TYR HB3 . 2 . HB1 1 1 135 1 2 1 1 32 GLU QG . 32 . HG# 1 1 136 1 1 1 1 2 TYR QD . 2 . HD# 1 1 136 1 2 1 1 32 GLU QG . 32 . HG# 1 1 137 1 1 1 1 2 TYR QD . 2 . HD# 1 1 137 1 2 1 1 32 GLU QB . 32 . HB# 1 1 138 1 1 1 1 2 TYR QE . 2 . HE# 1 1 138 1 2 1 1 32 GLU QG . 32 . HG# 1 1 139 1 1 1 1 2 TYR QE . 2 . HE# 1 1 139 1 2 1 1 32 GLU QB . 32 . HB# 1 1 140 1 1 1 1 2 TYR QD . 2 . HD# 1 1 140 1 2 1 1 33 VAL MG1 . 33 . HG1# 1 1 141 1 1 1 1 2 TYR QE . 2 . HE# 1 1 141 1 2 1 1 33 VAL MG2 . 33 . HG2# 1 1 142 1 1 1 1 2 TYR QE . 2 . HE# 1 1 142 1 2 1 1 33 VAL MG1 . 33 . HG1# 1 1 143 1 1 1 1 2 TYR HA . 2 . HA 1 1 143 1 2 1 1 33 VAL MG2 . 33 . HG2# 1 1 144 1 1 1 1 2 TYR HA . 2 . HA 1 1 144 1 2 1 1 33 VAL HA . 33 . HA 1 1 145 1 1 1 1 2 TYR QE . 2 . HE# 1 1 145 1 2 1 1 33 VAL HA . 33 . HA 1 1 146 1 1 1 1 2 TYR HA . 2 . HA 1 1 146 1 2 1 1 34 ILE H . 34 . HN 1 1 147 1 1 1 1 2 TYR QE . 2 . HE# 1 1 147 1 2 1 1 56 ALA MB . 56 . HB# 1 1 148 1 1 1 1 3 LYS HA . 3 . HA 1 1 148 1 2 1 1 4 LYS H . 4 . HN 1 1 149 1 1 1 1 3 LYS HB3 . 3 . HB1 1 1 149 1 2 1 1 4 LYS H . 4 . HN 1 1 150 1 1 1 1 3 LYS HB2 . 3 . HB2 1 1 150 1 2 1 1 4 LYS H . 4 . HN 1 1 151 1 1 1 1 3 LYS H . 3 . HN 1 1 151 1 2 1 1 4 LYS H . 4 . HN 1 1 152 1 1 1 1 3 LYS HA . 3 . HA 1 1 152 1 2 1 1 5 ASP H . 5 . HN 1 1 153 1 1 1 1 3 LYS HA . 3 . HA 1 1 153 1 2 1 1 6 VAL H . 6 . HN 1 1 154 1 1 1 1 3 LYS HA . 3 . HA 1 1 154 1 2 1 1 6 VAL MG2 . 6 . HG2# 1 1 155 1 1 1 1 3 LYS HA . 3 . HA 1 1 155 1 2 1 1 6 VAL HB . 6 . HB 1 1 156 1 1 1 1 3 LYS HA . 3 . HA 1 1 156 1 2 1 1 7 ILE H . 7 . HN 1 1 157 1 1 1 1 3 LYS QG . 3 . HG# 1 1 157 1 2 1 1 27 VAL MG1 . 27 . HG1# 1 1 158 1 1 1 1 3 LYS HE2 . 3 . HE2 1 1 158 1 2 1 1 27 VAL MG1 . 27 . HG1# 1 1 159 1 1 1 1 3 LYS HE3 . 3 . HE1 1 1 159 1 2 1 1 27 VAL MG1 . 27 . HG1# 1 1 160 1 1 1 1 3 LYS QE . 3 . HE# 1 1 160 1 2 1 1 7 ILE MD . 7 . HD1# 1 1 161 1 1 1 1 3 LYS QE . 3 . HE# 1 1 161 1 2 1 1 30 TRP H . 30 . HN 1 1 162 1 1 1 1 3 LYS HA . 3 . HA 1 1 162 1 2 1 1 30 TRP HE3 . 30 . HE3 1 1 163 1 1 1 1 3 LYS QE . 3 . HE# 1 1 163 1 2 1 1 30 TRP HE3 . 30 . HE3 1 1 164 1 1 1 1 3 LYS QD . 3 . HD# 1 1 164 1 2 1 1 30 TRP HB3 . 30 . HB1 1 1 165 1 1 1 1 3 LYS QD . 3 . HD# 1 1 165 1 2 1 1 30 TRP HB2 . 30 . HB2 1 1 166 1 1 1 1 3 LYS QG . 3 . HG# 1 1 166 1 2 1 1 30 TRP QB . 30 . HB# 1 1 167 1 1 1 1 3 LYS QE . 3 . HE# 1 1 167 1 2 1 1 30 TRP HB3 . 30 . HB1 1 1 168 1 1 1 1 3 LYS QE . 3 . HE# 1 1 168 1 2 1 1 30 TRP HB2 . 30 . HB2 1 1 169 1 1 1 1 3 LYS H . 3 . HN 1 1 169 1 2 1 1 32 GLU HA . 32 . HA 1 1 170 1 1 1 1 3 LYS H . 3 . HN 1 1 170 1 2 1 1 32 GLU QB . 32 . HB# 1 1 171 1 1 1 1 3 LYS H . 3 . HN 1 1 171 1 2 1 1 32 GLU QG . 32 . HG# 1 1 172 1 1 1 1 3 LYS H . 3 . HN 1 1 172 1 2 1 1 33 VAL HA . 33 . HA 1 1 173 1 1 1 1 3 LYS H . 3 . HN 1 1 173 1 2 1 1 33 VAL MG2 . 33 . HG2# 1 1 174 1 1 1 1 3 LYS H . 3 . HN 1 1 174 1 2 1 1 34 ILE MG . 34 . HG2# 1 1 175 1 1 1 1 3 LYS HA . 3 . HA 1 1 175 1 2 1 1 34 ILE H . 34 . HN 1 1 176 1 1 1 1 3 LYS HA . 3 . HA 1 1 176 1 2 1 1 34 ILE MD . 34 . HD1# 1 1 177 1 1 1 1 3 LYS HA . 3 . HA 1 1 177 1 2 1 1 34 ILE MG . 34 . HG2# 1 1 178 1 1 1 1 3 LYS H . 3 . HN 1 1 178 1 2 1 1 34 ILE H . 34 . HN 1 1 179 1 1 1 1 3 LYS QB . 3 . HB# 1 1 179 1 2 1 1 34 ILE MG . 34 . HG2# 1 1 180 1 1 1 1 3 LYS HA . 3 . HA 1 1 180 1 2 1 1 42 LEU MD1 . 42 . HD1# 1 1 181 1 1 1 1 4 LYS QG . 4 . HG# 1 1 181 1 2 1 1 5 ASP H . 5 . HN 1 1 182 1 1 1 1 4 LYS H . 4 . HN 1 1 182 1 2 1 1 5 ASP H . 5 . HN 1 1 183 1 1 1 1 4 LYS H . 4 . HN 1 1 183 1 2 1 1 6 VAL H . 6 . HN 1 1 184 1 1 1 1 4 LYS H . 4 . HN 1 1 184 1 2 1 1 7 ILE MD . 7 . HD1# 1 1 185 1 1 1 1 4 LYS HA . 4 . HA 1 1 185 1 2 1 1 7 ILE H . 7 . HN 1 1 186 1 1 1 1 4 LYS HA . 4 . HA 1 1 186 1 2 1 1 8 ASP H . 8 . HN 1 1 187 1 1 1 1 4 LYS H . 4 . HN 1 1 187 1 2 1 1 32 GLU QG . 32 . HG# 1 1 188 1 1 1 1 4 LYS H . 4 . HN 1 1 188 1 2 1 1 34 ILE MG . 34 . HG2# 1 1 189 1 1 1 1 5 ASP HA . 5 . HA 1 1 189 1 2 1 1 6 VAL H . 6 . HN 1 1 190 1 1 1 1 5 ASP H . 5 . HN 1 1 190 1 2 1 1 6 VAL MG2 . 6 . HG2# 1 1 191 1 1 1 1 5 ASP HB3 . 5 . HB1 1 1 191 1 2 1 1 6 VAL H . 6 . HN 1 1 192 1 1 1 1 5 ASP HB2 . 5 . HB2 1 1 192 1 2 1 1 6 VAL H . 6 . HN 1 1 193 1 1 1 1 5 ASP QB . 5 . HB# 1 1 193 1 2 1 1 6 VAL MG2 . 6 . HG2# 1 1 194 1 1 1 1 5 ASP H . 5 . HN 1 1 194 1 2 1 1 6 VAL H . 6 . HN 1 1 195 1 1 1 1 5 ASP QB . 5 . HB# 1 1 195 1 2 1 1 6 VAL HA . 6 . HA 1 1 196 1 1 1 1 5 ASP H . 5 . HN 1 1 196 1 2 1 1 7 ILE H . 7 . HN 1 1 197 1 1 1 1 5 ASP HA . 5 . HA 1 1 197 1 2 1 1 8 ASP H . 8 . HN 1 1 198 1 1 1 1 5 ASP H . 5 . HN 1 1 198 1 2 1 1 8 ASP H . 8 . HN 1 1 199 1 1 1 1 5 ASP HA . 5 . HA 1 1 199 1 2 1 1 8 ASP HB3 . 8 . HB1 1 1 200 1 1 1 1 5 ASP HA . 5 . HA 1 1 200 1 2 1 1 8 ASP HB2 . 8 . HB2 1 1 201 1 1 1 1 5 ASP HA . 5 . HA 1 1 201 1 2 1 1 9 HIS H . 9 . HN 1 1 202 1 1 1 1 5 ASP HB3 . 5 . HB1 1 1 202 1 2 1 1 50 LEU MD2 . 50 . HD2# 1 1 203 1 1 1 1 6 VAL HB . 6 . HB 1 1 203 1 2 1 1 7 ILE H . 7 . HN 1 1 204 1 1 1 1 6 VAL MG2 . 6 . HG2# 1 1 204 1 2 1 1 7 ILE H . 7 . HN 1 1 205 1 1 1 1 6 VAL H . 6 . HN 1 1 205 1 2 1 1 7 ILE HA . 7 . HA 1 1 206 1 1 1 1 6 VAL HA . 6 . HA 1 1 206 1 2 1 1 7 ILE H . 7 . HN 1 1 207 1 1 1 1 6 VAL H . 6 . HN 1 1 207 1 2 1 1 7 ILE HB . 7 . HB 1 1 208 1 1 1 1 6 VAL MG2 . 6 . HG2# 1 1 208 1 2 1 1 7 ILE HA . 7 . HA 1 1 209 1 1 1 1 6 VAL H . 6 . HN 1 1 209 1 2 1 1 7 ILE H . 7 . HN 1 1 210 1 1 1 1 6 VAL HB . 6 . HB 1 1 210 1 2 1 1 7 ILE HA . 7 . HA 1 1 211 1 1 1 1 6 VAL MG1 . 6 . HG1# 1 1 211 1 2 1 1 7 ILE HA . 7 . HA 1 1 212 1 1 1 1 6 VAL HB . 6 . HB 1 1 212 1 2 1 1 8 ASP H . 8 . HN 1 1 213 1 1 1 1 6 VAL HA . 6 . HA 1 1 213 1 2 1 1 8 ASP H . 8 . HN 1 1 214 1 1 1 1 6 VAL H . 6 . HN 1 1 214 1 2 1 1 8 ASP H . 8 . HN 1 1 215 1 1 1 1 6 VAL HA . 6 . HA 1 1 215 1 2 1 1 9 HIS H . 9 . HN 1 1 216 1 1 1 1 6 VAL HB . 6 . HB 1 1 216 1 2 1 1 9 HIS H . 9 . HN 1 1 217 1 1 1 1 6 VAL HA . 6 . HA 1 1 217 1 2 1 1 9 HIS HB3 . 9 . HB1 1 1 218 1 1 1 1 6 VAL HA . 6 . HA 1 1 218 1 2 1 1 9 HIS HB2 . 9 . HB2 1 1 219 1 1 1 1 6 VAL HA . 6 . HA 1 1 219 1 2 1 1 10 PHE QD . 10 . HD# 1 1 220 1 1 1 1 6 VAL HB . 6 . HB 1 1 220 1 2 1 1 10 PHE QD . 10 . HD# 1 1 221 1 1 1 1 6 VAL MG1 . 6 . HG1# 1 1 221 1 2 1 1 10 PHE HB2 . 10 . HB2 1 1 222 1 1 1 1 6 VAL MG1 . 6 . HG1# 1 1 222 1 2 1 1 13 GLN HA . 13 . HA 1 1 223 1 1 1 1 6 VAL MG1 . 6 . HG1# 1 1 223 1 2 1 1 27 VAL MG1 . 27 . HG1# 1 1 224 1 1 1 1 6 VAL H . 6 . HN 1 1 224 1 2 1 1 34 ILE MG . 34 . HG2# 1 1 225 1 1 1 1 6 VAL HB . 6 . HB 1 1 225 1 2 1 1 34 ILE MG . 34 . HG2# 1 1 226 1 1 1 1 6 VAL MG1 . 6 . HG1# 1 1 226 1 2 1 1 34 ILE MG . 34 . HG2# 1 1 227 1 1 1 1 6 VAL MG2 . 6 . HG2# 1 1 227 1 2 1 1 34 ILE MG . 34 . HG2# 1 1 228 1 1 1 1 6 VAL MG1 . 6 . HG1# 1 1 228 1 2 1 1 34 ILE MD . 34 . HD1# 1 1 229 1 1 1 1 6 VAL MG2 . 6 . HG2# 1 1 229 1 2 1 1 34 ILE MD . 34 . HD1# 1 1 230 1 1 1 1 6 VAL MG1 . 6 . HG1# 1 1 230 1 2 1 1 42 LEU H . 42 . HN 1 1 231 1 1 1 1 6 VAL HA . 6 . HA 1 1 231 1 2 1 1 50 LEU MD1 . 50 . HD1# 1 1 232 1 1 1 1 7 ILE HA . 7 . HA 1 1 232 1 2 1 1 8 ASP H . 8 . HN 1 1 233 1 1 1 1 7 ILE HB . 7 . HB 1 1 233 1 2 1 1 8 ASP H . 8 . HN 1 1 234 1 1 1 1 7 ILE MG . 7 . HG2# 1 1 234 1 2 1 1 8 ASP H . 8 . HN 1 1 235 1 1 1 1 7 ILE H . 7 . HN 1 1 235 1 2 1 1 8 ASP QB . 8 . HB# 1 1 236 1 1 1 1 7 ILE QG . 7 . HG1# 1 1 236 1 2 1 1 8 ASP H . 8 . HN 1 1 237 1 1 1 1 7 ILE H . 7 . HN 1 1 237 1 2 1 1 8 ASP H . 8 . HN 1 1 238 1 1 1 1 7 ILE MG . 7 . HG2# 1 1 238 1 2 1 1 8 ASP HA . 8 . HA 1 1 239 1 1 1 1 7 ILE HA . 7 . HA 1 1 239 1 2 1 1 8 ASP HA . 8 . HA 1 1 240 1 1 1 1 7 ILE HA . 7 . HA 1 1 240 1 2 1 1 9 HIS H . 9 . HN 1 1 241 1 1 1 1 7 ILE H . 7 . HN 1 1 241 1 2 1 1 9 HIS H . 9 . HN 1 1 242 1 1 1 1 7 ILE HB . 7 . HB 1 1 242 1 2 1 1 9 HIS H . 9 . HN 1 1 243 1 1 1 1 7 ILE HA . 7 . HA 1 1 243 1 2 1 1 10 PHE H . 10 . HN 1 1 244 1 1 1 1 7 ILE HA . 7 . HA 1 1 244 1 2 1 1 10 PHE QD . 10 . HD# 1 1 245 1 1 1 1 7 ILE HA . 7 . HA 1 1 245 1 2 1 1 10 PHE QE . 10 . HE# 1 1 246 1 1 1 1 7 ILE H . 7 . HN 1 1 246 1 2 1 1 10 PHE QD . 10 . HD# 1 1 247 1 1 1 1 7 ILE HA . 7 . HA 1 1 247 1 2 1 1 10 PHE HB2 . 10 . HB2 1 1 248 1 1 1 1 7 ILE HA . 7 . HA 1 1 248 1 2 1 1 10 PHE HB3 . 10 . HB1 1 1 249 1 1 1 1 7 ILE HA . 7 . HA 1 1 249 1 2 1 1 10 PHE HA . 10 . HA 1 1 250 1 1 1 1 7 ILE HA . 7 . HA 1 1 250 1 2 1 1 11 GLY H . 11 . HN 1 1 251 1 1 1 1 7 ILE MG . 7 . HG2# 1 1 251 1 2 1 1 11 GLY H . 11 . HN 1 1 252 1 1 1 1 7 ILE MG . 7 . HG2# 1 1 252 1 2 1 1 12 THR H . 12 . HN 1 1 253 1 1 1 1 7 ILE HA . 7 . HA 1 1 253 1 2 1 1 12 THR H . 12 . HN 1 1 254 1 1 1 1 7 ILE MD . 7 . HD1# 1 1 254 1 2 1 1 13 GLN HE21 . 13 . HE21 1 1 255 1 1 1 1 7 ILE MD . 7 . HD1# 1 1 255 1 2 1 1 13 GLN HE22 . 13 . HE22 1 1 256 1 1 1 1 7 ILE MD . 7 . HD1# 1 1 256 1 2 1 1 13 GLN QG . 13 . HG# 1 1 257 1 1 1 1 7 ILE HA . 7 . HA 1 1 257 1 2 1 1 13 GLN HA . 13 . HA 1 1 258 1 1 1 1 7 ILE HA . 7 . HA 1 1 258 1 2 1 1 16 VAL MG2 . 16 . HG2# 1 1 259 1 1 1 1 7 ILE MD . 7 . HD1# 1 1 259 1 2 1 1 27 VAL MG1 . 27 . HG1# 1 1 260 1 1 1 1 8 ASP H . 8 . HN 1 1 260 1 2 1 1 9 HIS HA . 9 . HA 1 1 261 1 1 1 1 8 ASP H . 8 . HN 1 1 261 1 2 1 1 9 HIS HB2 . 9 . HB2 1 1 262 1 1 1 1 8 ASP H . 8 . HN 1 1 262 1 2 1 1 9 HIS HB3 . 9 . HB1 1 1 263 1 1 1 1 8 ASP HB3 . 8 . HB1 1 1 263 1 2 1 1 9 HIS H . 9 . HN 1 1 264 1 1 1 1 8 ASP HB2 . 8 . HB2 1 1 264 1 2 1 1 9 HIS H . 9 . HN 1 1 265 1 1 1 1 8 ASP H . 8 . HN 1 1 265 1 2 1 1 9 HIS H . 9 . HN 1 1 266 1 1 1 1 8 ASP HA . 8 . HA 1 1 266 1 2 1 1 9 HIS QB . 9 . HB# 1 1 267 1 1 1 1 8 ASP H . 8 . HN 1 1 267 1 2 1 1 10 PHE H . 10 . HN 1 1 268 1 1 1 1 8 ASP HA . 8 . HA 1 1 268 1 2 1 1 11 GLY H . 11 . HN 1 1 269 1 1 1 1 8 ASP HA . 8 . HA 1 1 269 1 2 1 1 11 GLY QA . 11 . HA# 1 1 270 1 1 1 1 9 HIS HD2 . 9 . HD2 1 1 270 1 2 1 1 10 PHE H . 10 . HN 1 1 271 1 1 1 1 9 HIS HD2 . 9 . HD2 1 1 271 1 2 1 1 10 PHE QD . 10 . HD# 1 1 272 1 1 1 1 9 HIS QB . 9 . HB# 1 1 272 1 2 1 1 10 PHE QD . 10 . HD# 1 1 273 1 1 1 1 9 HIS HD2 . 9 . HD2 1 1 273 1 2 1 1 10 PHE QE . 10 . HE# 1 1 274 1 1 1 1 9 HIS HD2 . 9 . HD2 1 1 274 1 2 1 1 10 PHE HZ . 10 . HZ 1 1 275 1 1 1 1 9 HIS QB . 9 . HB# 1 1 275 1 2 1 1 10 PHE HA . 10 . HA 1 1 276 1 1 1 1 9 HIS H . 9 . HN 1 1 276 1 2 1 1 10 PHE H . 10 . HN 1 1 277 1 1 1 1 9 HIS HA . 9 . HA 1 1 277 1 2 1 1 10 PHE QD . 10 . HD# 1 1 278 1 1 1 1 9 HIS H . 9 . HN 1 1 278 1 2 1 1 10 PHE HA . 10 . HA 1 1 279 1 1 1 1 9 HIS HD2 . 9 . HD2 1 1 279 1 2 1 1 10 PHE HA . 10 . HA 1 1 280 1 1 1 1 9 HIS HA . 9 . HA 1 1 280 1 2 1 1 11 GLY H . 11 . HN 1 1 281 1 1 1 1 9 HIS H . 9 . HN 1 1 281 1 2 1 1 11 GLY H . 11 . HN 1 1 282 1 1 1 1 9 HIS HE1 . 9 . HE1 1 1 282 1 2 1 1 46 THR HA . 46 . HA 1 1 283 1 1 1 1 9 HIS HE1 . 9 . HE1 1 1 283 1 2 1 1 47 ALA MB . 47 . HB# 1 1 284 1 1 1 1 9 HIS HD2 . 9 . HD2 1 1 284 1 2 1 1 46 THR MG . 46 . HG2# 1 1 285 1 1 1 1 10 PHE HB2 . 10 . HB2 1 1 285 1 2 1 1 11 GLY H . 11 . HN 1 1 286 1 1 1 1 10 PHE HB3 . 10 . HB1 1 1 286 1 2 1 1 11 GLY H . 11 . HN 1 1 287 1 1 1 1 10 PHE HA . 10 . HA 1 1 287 1 2 1 1 11 GLY H . 11 . HN 1 1 288 1 1 1 1 10 PHE H . 10 . HN 1 1 288 1 2 1 1 11 GLY QA . 11 . HA# 1 1 289 1 1 1 1 10 PHE QD . 10 . HD# 1 1 289 1 2 1 1 11 GLY H . 11 . HN 1 1 290 1 1 1 1 10 PHE H . 10 . HN 1 1 290 1 2 1 1 11 GLY H . 11 . HN 1 1 291 1 1 1 1 10 PHE HA . 10 . HA 1 1 291 1 2 1 1 11 GLY QA . 11 . HA# 1 1 292 1 1 1 1 10 PHE HB3 . 10 . HB1 1 1 292 1 2 1 1 12 THR H . 12 . HN 1 1 293 1 1 1 1 10 PHE HB2 . 10 . HB2 1 1 293 1 2 1 1 12 THR H . 12 . HN 1 1 294 1 1 1 1 10 PHE QD . 10 . HD# 1 1 294 1 2 1 1 12 THR H . 12 . HN 1 1 295 1 1 1 1 10 PHE HB3 . 10 . HB1 1 1 295 1 2 1 1 15 ALA H . 15 . HN 1 1 296 1 1 1 1 10 PHE HA . 10 . HA 1 1 296 1 2 1 1 15 ALA MB . 15 . HB# 1 1 297 1 1 1 1 10 PHE HB2 . 10 . HB2 1 1 297 1 2 1 1 15 ALA MB . 15 . HB# 1 1 298 1 1 1 1 10 PHE HB3 . 10 . HB1 1 1 298 1 2 1 1 16 VAL H . 16 . HN 1 1 299 1 1 1 1 10 PHE HB2 . 10 . HB2 1 1 299 1 2 1 1 16 VAL H . 16 . HN 1 1 300 1 1 1 1 10 PHE HZ . 10 . HZ 1 1 300 1 2 1 1 16 VAL HA . 16 . HA 1 1 301 1 1 1 1 10 PHE HZ . 10 . HZ 1 1 301 1 2 1 1 16 VAL MG1 . 16 . HG1# 1 1 302 1 1 1 1 10 PHE HB3 . 10 . HB1 1 1 302 1 2 1 1 16 VAL HA . 16 . HA 1 1 303 1 1 1 1 10 PHE QD . 10 . HD# 1 1 303 1 2 1 1 16 VAL HA . 16 . HA 1 1 304 1 1 1 1 10 PHE HA . 10 . HA 1 1 304 1 2 1 1 16 VAL MG2 . 16 . HG2# 1 1 305 1 1 1 1 10 PHE HA . 10 . HA 1 1 305 1 2 1 1 16 VAL MG1 . 16 . HG1# 1 1 306 1 1 1 1 10 PHE HB2 . 10 . HB2 1 1 306 1 2 1 1 16 VAL MG2 . 16 . HG2# 1 1 307 1 1 1 1 10 PHE QD . 10 . HD# 1 1 307 1 2 1 1 16 VAL H . 16 . HN 1 1 308 1 1 1 1 10 PHE HZ . 10 . HZ 1 1 308 1 2 1 1 19 ALA HA . 19 . HA 1 1 309 1 1 1 1 10 PHE HZ . 10 . HZ 1 1 309 1 2 1 1 19 ALA MB . 19 . HB# 1 1 310 1 1 1 1 10 PHE HZ . 10 . HZ 1 1 310 1 2 1 1 20 LEU MD1 . 20 . HD1# 1 1 311 1 1 1 1 10 PHE HZ . 10 . HZ 1 1 311 1 2 1 1 42 LEU HA . 42 . HA 1 1 312 1 1 1 1 10 PHE HZ . 10 . HZ 1 1 312 1 2 1 1 45 VAL HB . 45 . HB 1 1 313 1 1 1 1 10 PHE HZ . 10 . HZ 1 1 313 1 2 1 1 45 VAL HA . 45 . HA 1 1 314 1 1 1 1 10 PHE QE . 10 . HE# 1 1 314 1 2 1 1 46 THR HA . 46 . HA 1 1 315 1 1 1 1 10 PHE HZ . 10 . HZ 1 1 315 1 2 1 1 46 THR MG . 46 . HG2# 1 1 316 1 1 1 1 10 PHE HZ . 10 . HZ 1 1 316 1 2 1 1 46 THR HA . 46 . HA 1 1 317 1 1 1 1 11 GLY HA3 . 11 . HA1 1 1 317 1 2 1 1 12 THR H . 12 . HN 1 1 318 1 1 1 1 11 GLY HA2 . 11 . HA2 1 1 318 1 2 1 1 12 THR H . 12 . HN 1 1 319 1 1 1 1 11 GLY QA . 11 . HA# 1 1 319 1 2 1 1 12 THR MG . 12 . HG2# 1 1 320 1 1 1 1 11 GLY H . 11 . HN 1 1 320 1 2 1 1 12 THR H . 12 . HN 1 1 321 1 1 1 1 11 GLY H . 11 . HN 1 1 321 1 2 1 1 15 ALA MB . 15 . HB# 1 1 322 1 1 1 1 11 GLY H . 11 . HN 1 1 322 1 2 1 1 16 VAL MG2 . 16 . HG2# 1 1 323 1 1 1 1 12 THR HA . 12 . HA 1 1 323 1 2 1 1 13 GLN H . 13 . HN 1 1 324 1 1 1 1 12 THR HB . 12 . HB 1 1 324 1 2 1 1 13 GLN H . 13 . HN 1 1 325 1 1 1 1 12 THR MG . 12 . HG2# 1 1 325 1 2 1 1 13 GLN H . 13 . HN 1 1 326 1 1 1 1 12 THR H . 12 . HN 1 1 326 1 2 1 1 13 GLN H . 13 . HN 1 1 327 1 1 1 1 12 THR HA . 12 . HA 1 1 327 1 2 1 1 14 ARG H . 14 . HN 1 1 328 1 1 1 1 12 THR HB . 12 . HB 1 1 328 1 2 1 1 14 ARG H . 14 . HN 1 1 329 1 1 1 1 12 THR HB . 12 . HB 1 1 329 1 2 1 1 14 ARG QB . 14 . HB# 1 1 330 1 1 1 1 13 GLN HA . 13 . HA 1 1 330 1 2 1 1 14 ARG H . 14 . HN 1 1 331 1 1 1 1 13 GLN QG . 13 . HG# 1 1 331 1 2 1 1 14 ARG H . 14 . HN 1 1 332 1 1 1 1 13 GLN QB . 13 . HB# 1 1 332 1 2 1 1 14 ARG H . 14 . HN 1 1 333 1 1 1 1 13 GLN H . 13 . HN 1 1 333 1 2 1 1 14 ARG H . 14 . HN 1 1 334 1 1 1 1 13 GLN HA . 13 . HA 1 1 334 1 2 1 1 15 ALA H . 15 . HN 1 1 335 1 1 1 1 13 GLN HA . 13 . HA 1 1 335 1 2 1 1 16 VAL H . 16 . HN 1 1 336 1 1 1 1 13 GLN HA . 13 . HA 1 1 336 1 2 1 1 16 VAL MG1 . 16 . HG1# 1 1 337 1 1 1 1 13 GLN HA . 13 . HA 1 1 337 1 2 1 1 16 VAL MG2 . 16 . HG2# 1 1 338 1 1 1 1 13 GLN HA . 13 . HA 1 1 338 1 2 1 1 16 VAL HA . 16 . HA 1 1 339 1 1 1 1 13 GLN HA . 13 . HA 1 1 339 1 2 1 1 17 ALA H . 17 . HN 1 1 340 1 1 1 1 13 GLN H . 13 . HN 1 1 340 1 2 1 1 27 VAL MG1 . 27 . HG1# 1 1 341 1 1 1 1 13 GLN HE21 . 13 . HE21 1 1 341 1 2 1 1 27 VAL MG1 . 27 . HG1# 1 1 342 1 1 1 1 13 GLN HE22 . 13 . HE22 1 1 342 1 2 1 1 27 VAL MG1 . 27 . HG1# 1 1 343 1 1 1 1 13 GLN HA . 13 . HA 1 1 343 1 2 1 1 27 VAL MG1 . 27 . HG1# 1 1 344 1 1 1 1 13 GLN HA . 13 . HA 1 1 344 1 2 1 1 27 VAL MG2 . 27 . HG2# 1 1 345 1 1 1 1 13 GLN HA . 13 . HA 1 1 345 1 2 1 1 27 VAL HB . 27 . HB 1 1 346 1 1 1 1 13 GLN QG . 13 . HG# 1 1 346 1 2 1 1 27 VAL MG1 . 27 . HG1# 1 1 347 1 1 1 1 13 GLN HB3 . 13 . HB1 1 1 347 1 2 1 1 27 VAL MG1 . 27 . HG1# 1 1 348 1 1 1 1 13 GLN QE . 13 . HE2# 1 1 348 1 2 1 1 27 VAL MG2 . 27 . HG2# 1 1 349 1 1 1 1 13 GLN HE22 . 13 . HE22 1 1 349 1 2 1 1 28 SER HA . 28 . HA 1 1 350 1 1 1 1 14 ARG H . 14 . HN 1 1 350 1 2 1 1 15 ALA HA . 15 . HA 1 1 351 1 1 1 1 14 ARG H . 14 . HN 1 1 351 1 2 1 1 16 VAL H . 16 . HN 1 1 352 1 1 1 1 14 ARG HA . 14 . HA 1 1 352 1 2 1 1 16 VAL H . 16 . HN 1 1 353 1 1 1 1 14 ARG H . 14 . HN 1 1 353 1 2 1 1 17 ALA H . 17 . HN 1 1 354 1 1 1 1 14 ARG H . 14 . HN 1 1 354 1 2 1 1 24 ASP HA . 24 . HA 1 1 355 1 1 1 1 14 ARG HA . 14 . HA 1 1 355 1 2 1 1 27 VAL MG1 . 27 . HG1# 1 1 356 1 1 1 1 15 ALA HA . 15 . HA 1 1 356 1 2 1 1 16 VAL H . 16 . HN 1 1 357 1 1 1 1 15 ALA H . 15 . HN 1 1 357 1 2 1 1 16 VAL H . 16 . HN 1 1 358 1 1 1 1 16 VAL H . 16 . HN 1 1 358 1 2 1 1 17 ALA HA . 17 . HA 1 1 359 1 1 1 1 16 VAL H . 16 . HN 1 1 359 1 2 1 1 17 ALA H . 17 . HN 1 1 360 1 1 1 1 16 VAL HA . 16 . HA 1 1 360 1 2 1 1 18 LYS H . 18 . HN 1 1 361 1 1 1 1 16 VAL HB . 16 . HB 1 1 361 1 2 1 1 18 LYS H . 18 . HN 1 1 362 1 1 1 1 16 VAL MG2 . 16 . HG2# 1 1 362 1 2 1 1 18 LYS H . 18 . HN 1 1 363 1 1 1 1 16 VAL H . 16 . HN 1 1 363 1 2 1 1 18 LYS H . 18 . HN 1 1 364 1 1 1 1 16 VAL MG1 . 16 . HG1# 1 1 364 1 2 1 1 27 VAL MG1 . 27 . HG1# 1 1 365 1 1 1 1 16 VAL H . 16 . HN 1 1 365 1 2 1 1 27 VAL MG1 . 27 . HG1# 1 1 366 1 1 1 1 16 VAL H . 16 . HN 1 1 366 1 2 1 1 27 VAL MG2 . 27 . HG2# 1 1 367 1 1 1 1 16 VAL HA . 16 . HA 1 1 367 1 2 1 1 27 VAL MG1 . 27 . HG1# 1 1 368 1 1 1 1 16 VAL MG2 . 16 . HG2# 1 1 368 1 2 1 1 27 VAL MG1 . 27 . HG1# 1 1 369 1 1 1 1 17 ALA HA . 17 . HA 1 1 369 1 2 1 1 18 LYS H . 18 . HN 1 1 370 1 1 1 1 17 ALA H . 17 . HN 1 1 370 1 2 1 1 18 LYS H . 18 . HN 1 1 371 1 1 1 1 17 ALA HA . 17 . HA 1 1 371 1 2 1 1 20 LEU MD1 . 20 . HD1# 1 1 372 1 1 1 1 17 ALA HA . 17 . HA 1 1 372 1 2 1 1 20 LEU H . 20 . HN 1 1 373 1 1 1 1 17 ALA HA . 17 . HA 1 1 373 1 2 1 1 21 GLY H . 21 . HN 1 1 374 1 1 1 1 17 ALA HA . 17 . HA 1 1 374 1 2 1 1 22 ILE H . 22 . HN 1 1 375 1 1 1 1 17 ALA HA . 17 . HA 1 1 375 1 2 1 1 22 ILE MD . 22 . HD1# 1 1 376 1 1 1 1 17 ALA HA . 17 . HA 1 1 376 1 2 1 1 22 ILE HB . 22 . HB 1 1 377 1 1 1 1 17 ALA HA . 17 . HA 1 1 377 1 2 1 1 22 ILE HG13 . 22 . HG11 1 1 378 1 1 1 1 17 ALA HA . 17 . HA 1 1 378 1 2 1 1 22 ILE MG . 22 . HG2# 1 1 379 1 1 1 1 17 ALA HA . 17 . HA 1 1 379 1 2 1 1 23 SER H . 23 . HN 1 1 380 1 1 1 1 17 ALA MB . 17 . HB# 1 1 380 1 2 1 1 24 ASP H . 24 . HN 1 1 381 1 1 1 1 17 ALA H . 17 . HN 1 1 381 1 2 1 1 24 ASP HA . 24 . HA 1 1 382 1 1 1 1 17 ALA HA . 17 . HA 1 1 382 1 2 1 1 26 ALA MB . 26 . HB# 1 1 383 1 1 1 1 17 ALA MB . 17 . HB# 1 1 383 1 2 1 1 27 VAL MG1 . 27 . HG1# 1 1 384 1 1 1 1 17 ALA H . 17 . HN 1 1 384 1 2 1 1 27 VAL MG1 . 27 . HG1# 1 1 385 1 1 1 1 17 ALA H . 17 . HN 1 1 385 1 2 1 1 27 VAL MG2 . 27 . HG2# 1 1 386 1 1 1 1 17 ALA HA . 17 . HA 1 1 386 1 2 1 1 27 VAL MG1 . 27 . HG1# 1 1 387 1 1 1 1 17 ALA HA . 17 . HA 1 1 387 1 2 1 1 27 VAL MG2 . 27 . HG2# 1 1 388 1 1 1 1 17 ALA MB . 17 . HB# 1 1 388 1 2 1 1 27 VAL MG2 . 27 . HG2# 1 1 389 1 1 1 1 18 LYS QG . 18 . HG# 1 1 389 1 2 1 1 19 ALA H . 19 . HN 1 1 390 1 1 1 1 18 LYS H . 18 . HN 1 1 390 1 2 1 1 19 ALA H . 19 . HN 1 1 391 1 1 1 1 18 LYS QB . 18 . HB# 1 1 391 1 2 1 1 20 LEU H . 20 . HN 1 1 392 1 1 1 1 18 LYS H . 18 . HN 1 1 392 1 2 1 1 20 LEU H . 20 . HN 1 1 393 1 1 1 1 18 LYS HA . 18 . HA 1 1 393 1 2 1 1 20 LEU H . 20 . HN 1 1 394 1 1 1 1 18 LYS H . 18 . HN 1 1 394 1 2 1 1 27 VAL MG2 . 27 . HG2# 1 1 395 1 1 1 1 19 ALA MB . 19 . HB# 1 1 395 1 2 1 1 20 LEU H . 20 . HN 1 1 396 1 1 1 1 19 ALA HA . 19 . HA 1 1 396 1 2 1 1 21 GLY H . 21 . HN 1 1 397 1 1 1 1 20 LEU MD1 . 20 . HD1# 1 1 397 1 2 1 1 21 GLY H . 21 . HN 1 1 398 1 1 1 1 20 LEU HA . 20 . HA 1 1 398 1 2 1 1 21 GLY H . 21 . HN 1 1 399 1 1 1 1 20 LEU H . 20 . HN 1 1 399 1 2 1 1 21 GLY H . 21 . HN 1 1 400 1 1 1 1 20 LEU H . 20 . HN 1 1 400 1 2 1 1 22 ILE MD . 22 . HD1# 1 1 401 1 1 1 1 20 LEU H . 20 . HN 1 1 401 1 2 1 1 22 ILE H . 22 . HN 1 1 402 1 1 1 1 20 LEU H . 20 . HN 1 1 402 1 2 1 1 22 ILE MG . 22 . HG2# 1 1 403 1 1 1 1 20 LEU MD1 . 20 . HD1# 1 1 403 1 2 1 1 22 ILE MG . 22 . HG2# 1 1 404 1 1 1 1 20 LEU MD1 . 20 . HD1# 1 1 404 1 2 1 1 34 ILE MG . 34 . HG2# 1 1 405 1 1 1 1 20 LEU MD1 . 20 . HD1# 1 1 405 1 2 1 1 27 VAL MG1 . 27 . HG1# 1 1 406 1 1 1 1 20 LEU MD1 . 20 . HD1# 1 1 406 1 2 1 1 30 TRP HE1 . 30 . HE1 1 1 407 1 1 1 1 20 LEU MD1 . 20 . HD1# 1 1 407 1 2 1 1 30 TRP HZ2 . 30 . HZ2 1 1 408 1 1 1 1 20 LEU MD1 . 20 . HD1# 1 1 408 1 2 1 1 38 ASP HA . 38 . HA 1 1 409 1 1 1 1 20 LEU MD1 . 20 . HD1# 1 1 409 1 2 1 1 38 ASP HB3 . 38 . HB1 1 1 410 1 1 1 1 20 LEU MD1 . 20 . HD1# 1 1 410 1 2 1 1 38 ASP HB2 . 38 . HB2 1 1 411 1 1 1 1 20 LEU MD1 . 20 . HD1# 1 1 411 1 2 1 1 42 LEU H . 42 . HN 1 1 412 1 1 1 1 20 LEU H . 20 . HN 1 1 412 1 2 1 1 42 LEU MD2 . 42 . HD2# 1 1 413 1 1 1 1 20 LEU MD1 . 20 . HD1# 1 1 413 1 2 1 1 42 LEU HA . 42 . HA 1 1 414 1 1 1 1 21 GLY H . 21 . HN 1 1 414 1 2 1 1 22 ILE MG . 22 . HG2# 1 1 415 1 1 1 1 21 GLY H . 21 . HN 1 1 415 1 2 1 1 22 ILE H . 22 . HN 1 1 416 1 1 1 1 22 ILE HB . 22 . HB 1 1 416 1 2 1 1 23 SER H . 23 . HN 1 1 417 1 1 1 1 22 ILE MG . 22 . HG2# 1 1 417 1 2 1 1 23 SER H . 23 . HN 1 1 418 1 1 1 1 22 ILE MD . 22 . HD1# 1 1 418 1 2 1 1 23 SER H . 23 . HN 1 1 419 1 1 1 1 22 ILE HA . 22 . HA 1 1 419 1 2 1 1 23 SER H . 23 . HN 1 1 420 1 1 1 1 22 ILE HB . 22 . HB 1 1 420 1 2 1 1 23 SER HA . 23 . HA 1 1 421 1 1 1 1 22 ILE H . 22 . HN 1 1 421 1 2 1 1 23 SER H . 23 . HN 1 1 422 1 1 1 1 22 ILE QG . 22 . HG1# 1 1 422 1 2 1 1 25 ALA H . 25 . HN 1 1 423 1 1 1 1 22 ILE MD . 22 . HD1# 1 1 423 1 2 1 1 26 ALA MB . 26 . HB# 1 1 424 1 1 1 1 22 ILE MG . 22 . HG2# 1 1 424 1 2 1 1 26 ALA MB . 26 . HB# 1 1 425 1 1 1 1 22 ILE QG . 22 . HG1# 1 1 425 1 2 1 1 27 VAL H . 27 . HN 1 1 426 1 1 1 1 22 ILE MD . 22 . HD1# 1 1 426 1 2 1 1 27 VAL H . 27 . HN 1 1 427 1 1 1 1 22 ILE MG . 22 . HG2# 1 1 427 1 2 1 1 27 VAL MG2 . 27 . HG2# 1 1 428 1 1 1 1 22 ILE QG . 22 . HG1# 1 1 428 1 2 1 1 27 VAL MG2 . 27 . HG2# 1 1 429 1 1 1 1 22 ILE MD . 22 . HD1# 1 1 429 1 2 1 1 27 VAL MG1 . 27 . HG1# 1 1 430 1 1 1 1 22 ILE MG . 22 . HG2# 1 1 430 1 2 1 1 30 TRP HE1 . 30 . HE1 1 1 431 1 1 1 1 22 ILE MG . 22 . HG2# 1 1 431 1 2 1 1 30 TRP HZ2 . 30 . HZ2 1 1 432 1 1 1 1 22 ILE MD . 22 . HD1# 1 1 432 1 2 1 1 30 TRP HE1 . 30 . HE1 1 1 433 1 1 1 1 23 SER HA . 23 . HA 1 1 433 1 2 1 1 24 ASP H . 24 . HN 1 1 434 1 1 1 1 23 SER QB . 23 . HB# 1 1 434 1 2 1 1 24 ASP H . 24 . HN 1 1 435 1 1 1 1 23 SER HA . 23 . HA 1 1 435 1 2 1 1 24 ASP QB . 24 . HB# 1 1 436 1 1 1 1 23 SER H . 23 . HN 1 1 436 1 2 1 1 24 ASP H . 24 . HN 1 1 437 1 1 1 1 23 SER HA . 23 . HA 1 1 437 1 2 1 1 25 ALA H . 25 . HN 1 1 438 1 1 1 1 23 SER QB . 23 . HB# 1 1 438 1 2 1 1 25 ALA H . 25 . HN 1 1 439 1 1 1 1 23 SER H . 23 . HN 1 1 439 1 2 1 1 26 ALA MB . 26 . HB# 1 1 440 1 1 1 1 23 SER QB . 23 . HB# 1 1 440 1 2 1 1 26 ALA H . 26 . HN 1 1 441 1 1 1 1 23 SER HA . 23 . HA 1 1 441 1 2 1 1 26 ALA MB . 26 . HB# 1 1 442 1 1 1 1 23 SER HB2 . 23 . HB2 1 1 442 1 2 1 1 26 ALA MB . 26 . HB# 1 1 443 1 1 1 1 23 SER H . 23 . HN 1 1 443 1 2 1 1 26 ALA H . 26 . HN 1 1 444 1 1 1 1 24 ASP QB . 24 . HB# 1 1 444 1 2 1 1 25 ALA H . 25 . HN 1 1 445 1 1 1 1 24 ASP H . 24 . HN 1 1 445 1 2 1 1 25 ALA H . 25 . HN 1 1 446 1 1 1 1 24 ASP H . 24 . HN 1 1 446 1 2 1 1 25 ALA MB . 25 . HB# 1 1 447 1 1 1 1 24 ASP H . 24 . HN 1 1 447 1 2 1 1 26 ALA H . 26 . HN 1 1 448 1 1 1 1 24 ASP H . 24 . HN 1 1 448 1 2 1 1 26 ALA MB . 26 . HB# 1 1 449 1 1 1 1 24 ASP HA . 24 . HA 1 1 449 1 2 1 1 27 VAL MG1 . 27 . HG1# 1 1 450 1 1 1 1 24 ASP HA . 24 . HA 1 1 450 1 2 1 1 27 VAL MG2 . 27 . HG2# 1 1 451 1 1 1 1 25 ALA H . 25 . HN 1 1 451 1 2 1 1 26 ALA MB . 26 . HB# 1 1 452 1 1 1 1 25 ALA H . 25 . HN 1 1 452 1 2 1 1 26 ALA H . 26 . HN 1 1 453 1 1 1 1 25 ALA H . 25 . HN 1 1 453 1 2 1 1 27 VAL H . 27 . HN 1 1 454 1 1 1 1 25 ALA H . 25 . HN 1 1 454 1 2 1 1 28 SER H . 28 . HN 1 1 455 1 1 1 1 25 ALA MB . 25 . HB# 1 1 455 1 2 1 1 29 GLN HE21 . 29 . HE21 1 1 456 1 1 1 1 25 ALA MB . 25 . HB# 1 1 456 1 2 1 1 29 GLN HE22 . 29 . HE22 1 1 457 1 1 1 1 25 ALA MB . 25 . HB# 1 1 457 1 2 1 1 29 GLN H . 29 . HN 1 1 458 1 1 1 1 26 ALA H . 26 . HN 1 1 458 1 2 1 1 27 VAL MG2 . 27 . HG2# 1 1 459 1 1 1 1 26 ALA MB . 26 . HB# 1 1 459 1 2 1 1 27 VAL H . 27 . HN 1 1 460 1 1 1 1 26 ALA H . 26 . HN 1 1 460 1 2 1 1 27 VAL H . 27 . HN 1 1 461 1 1 1 1 26 ALA MB . 26 . HB# 1 1 461 1 2 1 1 27 VAL MG2 . 27 . HG2# 1 1 462 1 1 1 1 26 ALA MB . 26 . HB# 1 1 462 1 2 1 1 27 VAL MG1 . 27 . HG1# 1 1 463 1 1 1 1 26 ALA HA . 26 . HA 1 1 463 1 2 1 1 29 GLN H . 29 . HN 1 1 464 1 1 1 1 26 ALA HA . 26 . HA 1 1 464 1 2 1 1 29 GLN QB . 29 . HB# 1 1 465 1 1 1 1 26 ALA MB . 26 . HB# 1 1 465 1 2 1 1 29 GLN H . 29 . HN 1 1 466 1 1 1 1 26 ALA HA . 26 . HA 1 1 466 1 2 1 1 29 GLN QE . 29 . HE2# 1 1 467 1 1 1 1 26 ALA HA . 26 . HA 1 1 467 1 2 1 1 30 TRP HE1 . 30 . HE1 1 1 468 1 1 1 1 26 ALA MB . 26 . HB# 1 1 468 1 2 1 1 30 TRP HE1 . 30 . HE1 1 1 469 1 1 1 1 26 ALA MB . 26 . HB# 1 1 469 1 2 1 1 30 TRP HZ2 . 30 . HZ2 1 1 470 1 1 1 1 26 ALA MB . 26 . HB# 1 1 470 1 2 1 1 30 TRP HD1 . 30 . HD1 1 1 471 1 1 1 1 26 ALA HA . 26 . HA 1 1 471 1 2 1 1 30 TRP H . 30 . HN 1 1 472 1 1 1 1 27 VAL MG1 . 27 . HG1# 1 1 472 1 2 1 1 28 SER H . 28 . HN 1 1 473 1 1 1 1 27 VAL MG2 . 27 . HG2# 1 1 473 1 2 1 1 28 SER H . 28 . HN 1 1 474 1 1 1 1 27 VAL MG1 . 27 . HG1# 1 1 474 1 2 1 1 28 SER HA . 28 . HA 1 1 475 1 1 1 1 27 VAL H . 27 . HN 1 1 475 1 2 1 1 28 SER H . 28 . HN 1 1 476 1 1 1 1 27 VAL H . 27 . HN 1 1 476 1 2 1 1 28 SER HA . 28 . HA 1 1 477 1 1 1 1 27 VAL MG2 . 27 . HG2# 1 1 477 1 2 1 1 29 GLN H . 29 . HN 1 1 478 1 1 1 1 27 VAL HA . 27 . HA 1 1 478 1 2 1 1 29 GLN H . 29 . HN 1 1 479 1 1 1 1 27 VAL HB . 27 . HB 1 1 479 1 2 1 1 29 GLN H . 29 . HN 1 1 480 1 1 1 1 27 VAL MG1 . 27 . HG1# 1 1 480 1 2 1 1 29 GLN H . 29 . HN 1 1 481 1 1 1 1 27 VAL H . 27 . HN 1 1 481 1 2 1 1 29 GLN H . 29 . HN 1 1 482 1 1 1 1 27 VAL HA . 27 . HA 1 1 482 1 2 1 1 30 TRP HE1 . 30 . HE1 1 1 483 1 1 1 1 27 VAL MG1 . 27 . HG1# 1 1 483 1 2 1 1 30 TRP HE1 . 30 . HE1 1 1 484 1 1 1 1 27 VAL MG2 . 27 . HG2# 1 1 484 1 2 1 1 30 TRP HE1 . 30 . HE1 1 1 485 1 1 1 1 27 VAL MG1 . 27 . HG1# 1 1 485 1 2 1 1 30 TRP H . 30 . HN 1 1 486 1 1 1 1 27 VAL MG1 . 27 . HG1# 1 1 486 1 2 1 1 30 TRP HE3 . 30 . HE3 1 1 487 1 1 1 1 27 VAL MG1 . 27 . HG1# 1 1 487 1 2 1 1 30 TRP HZ2 . 30 . HZ2 1 1 488 1 1 1 1 27 VAL MG1 . 27 . HG1# 1 1 488 1 2 1 1 30 TRP HD1 . 30 . HD1 1 1 489 1 1 1 1 27 VAL MG2 . 27 . HG2# 1 1 489 1 2 1 1 30 TRP HD1 . 30 . HD1 1 1 490 1 1 1 1 27 VAL MG1 . 27 . HG1# 1 1 490 1 2 1 1 34 ILE MG . 34 . HG2# 1 1 491 1 1 1 1 28 SER HA . 28 . HA 1 1 491 1 2 1 1 29 GLN H . 29 . HN 1 1 492 1 1 1 1 28 SER H . 28 . HN 1 1 492 1 2 1 1 29 GLN H . 29 . HN 1 1 493 1 1 1 1 29 GLN HA . 29 . HA 1 1 493 1 2 1 1 30 TRP H . 30 . HN 1 1 494 1 1 1 1 29 GLN H . 29 . HN 1 1 494 1 2 1 1 30 TRP QB . 30 . HB# 1 1 495 1 1 1 1 29 GLN H . 29 . HN 1 1 495 1 2 1 1 30 TRP H . 30 . HN 1 1 496 1 1 1 1 30 TRP H . 30 . HN 1 1 496 1 2 1 1 31 LYS H . 31 . HN 1 1 497 1 1 1 1 30 TRP HB2 . 30 . HB2 1 1 497 1 2 1 1 31 LYS H . 31 . HN 1 1 498 1 1 1 1 30 TRP HB3 . 30 . HB1 1 1 498 1 2 1 1 31 LYS H . 31 . HN 1 1 499 1 1 1 1 30 TRP HD1 . 30 . HD1 1 1 499 1 2 1 1 31 LYS H . 31 . HN 1 1 500 1 1 1 1 30 TRP HE1 . 30 . HE1 1 1 500 1 2 1 1 34 ILE HA . 34 . HA 1 1 501 1 1 1 1 30 TRP HE1 . 30 . HE1 1 1 501 1 2 1 1 34 ILE MG . 34 . HG2# 1 1 502 1 1 1 1 30 TRP H . 30 . HN 1 1 502 1 2 1 1 34 ILE MG . 34 . HG2# 1 1 503 1 1 1 1 30 TRP HE3 . 30 . HE3 1 1 503 1 2 1 1 34 ILE MG . 34 . HG2# 1 1 504 1 1 1 1 30 TRP HZ2 . 30 . HZ2 1 1 504 1 2 1 1 34 ILE MG . 34 . HG2# 1 1 505 1 1 1 1 30 TRP HD1 . 30 . HD1 1 1 505 1 2 1 1 34 ILE MG . 34 . HG2# 1 1 506 1 1 1 1 30 TRP HB3 . 30 . HB1 1 1 506 1 2 1 1 34 ILE MG . 34 . HG2# 1 1 507 1 1 1 1 30 TRP HB2 . 30 . HB2 1 1 507 1 2 1 1 34 ILE MG . 34 . HG2# 1 1 508 1 1 1 1 30 TRP HB2 . 30 . HB2 1 1 508 1 2 1 1 34 ILE HA . 34 . HA 1 1 509 1 1 1 1 30 TRP HB3 . 30 . HB1 1 1 509 1 2 1 1 34 ILE HA . 34 . HA 1 1 510 1 1 1 1 30 TRP HD1 . 30 . HD1 1 1 510 1 2 1 1 34 ILE HA . 34 . HA 1 1 511 1 1 1 1 30 TRP HE1 . 30 . HE1 1 1 511 1 2 1 1 35 PRO HA . 35 . HA 1 1 512 1 1 1 1 30 TRP QB . 30 . HB# 1 1 512 1 2 1 1 35 PRO QD . 35 . HD# 1 1 513 1 1 1 1 30 TRP HE1 . 30 . HE1 1 1 513 1 2 1 1 35 PRO HD2 . 35 . HD2 1 1 514 1 1 1 1 30 TRP HE1 . 30 . HE1 1 1 514 1 2 1 1 35 PRO HD3 . 35 . HD1 1 1 515 1 1 1 1 30 TRP HE1 . 30 . HE1 1 1 515 1 2 1 1 35 PRO HG3 . 35 . HG1 1 1 516 1 1 1 1 30 TRP HZ2 . 30 . HZ2 1 1 516 1 2 1 1 35 PRO QD . 35 . HD# 1 1 517 1 1 1 1 30 TRP HE1 . 30 . HE1 1 1 517 1 2 1 1 35 PRO HG2 . 35 . HG2 1 1 518 1 1 1 1 30 TRP HE1 . 30 . HE1 1 1 518 1 2 1 1 35 PRO QB . 35 . HB# 1 1 519 1 1 1 1 30 TRP HE1 . 30 . HE1 1 1 519 1 2 1 1 38 ASP QB . 38 . HB# 1 1 520 1 1 1 1 30 TRP HE1 . 30 . HE1 1 1 520 1 2 1 1 38 ASP H . 38 . HN 1 1 521 1 1 1 1 30 TRP HZ2 . 30 . HZ2 1 1 521 1 2 1 1 38 ASP HA . 38 . HA 1 1 522 1 1 1 1 31 LYS HA . 31 . HA 1 1 522 1 2 1 1 32 GLU H . 32 . HN 1 1 523 1 1 1 1 31 LYS H . 31 . HN 1 1 523 1 2 1 1 32 GLU H . 32 . HN 1 1 524 1 1 1 1 31 LYS H . 31 . HN 1 1 524 1 2 1 1 33 VAL H . 33 . HN 1 1 525 1 1 1 1 31 LYS QE . 31 . HE# 1 1 525 1 2 1 1 32 GLU H . 32 . HN 1 1 526 1 1 1 1 31 LYS QB . 31 . HB# 1 1 526 1 2 1 1 32 GLU H . 32 . HN 1 1 527 1 1 1 1 31 LYS HA . 31 . HA 1 1 527 1 2 1 1 33 VAL H . 33 . HN 1 1 528 1 1 1 1 31 LYS H . 31 . HN 1 1 528 1 2 1 1 34 ILE HA . 34 . HA 1 1 529 1 1 1 1 32 GLU H . 32 . HN 1 1 529 1 2 1 1 33 VAL H . 33 . HN 1 1 530 1 1 1 1 32 GLU QB . 32 . HB# 1 1 530 1 2 1 1 33 VAL MG1 . 33 . HG1# 1 1 531 1 1 1 1 33 VAL MG1 . 33 . HG1# 1 1 531 1 2 1 1 52 TYR QE . 52 . HE# 1 1 532 1 1 1 1 33 VAL MG2 . 33 . HG2# 1 1 532 1 2 1 1 57 TYR QD . 57 . HD# 1 1 533 1 1 1 1 33 VAL MG1 . 33 . HG1# 1 1 533 1 2 1 1 57 TYR QD . 57 . HD# 1 1 534 1 1 1 1 33 VAL MG1 . 33 . HG1# 1 1 534 1 2 1 1 56 ALA MB . 56 . HB# 1 1 535 1 1 1 1 33 VAL MG1 . 33 . HG1# 1 1 535 1 2 1 1 57 TYR QE . 57 . HE# 1 1 536 1 1 1 1 34 ILE H . 34 . HN 1 1 536 1 2 1 1 35 PRO QD . 35 . HD# 1 1 537 1 1 1 1 34 ILE MG . 34 . HG2# 1 1 537 1 2 1 1 35 PRO HD2 . 35 . HD2 1 1 538 1 1 1 1 34 ILE MD . 34 . HD1# 1 1 538 1 2 1 1 35 PRO HD2 . 35 . HD2 1 1 539 1 1 1 1 34 ILE MG . 34 . HG2# 1 1 539 1 2 1 1 35 PRO HD3 . 35 . HD1 1 1 540 1 1 1 1 34 ILE HA . 34 . HA 1 1 540 1 2 1 1 35 PRO QD . 35 . HD# 1 1 541 1 1 1 1 34 ILE HA . 34 . HA 1 1 541 1 2 1 1 35 PRO QG . 35 . HG# 1 1 542 1 1 1 1 34 ILE MD . 34 . HD1# 1 1 542 1 2 1 1 36 GLU HA . 36 . HA 1 1 543 1 1 1 1 34 ILE MD . 34 . HD1# 1 1 543 1 2 1 1 38 ASP HB2 . 38 . HB2 1 1 544 1 1 1 1 34 ILE MG . 34 . HG2# 1 1 544 1 2 1 1 38 ASP HB2 . 38 . HB2 1 1 545 1 1 1 1 34 ILE MD . 34 . HD1# 1 1 545 1 2 1 1 38 ASP H . 38 . HN 1 1 546 1 1 1 1 34 ILE MG . 34 . HG2# 1 1 546 1 2 1 1 38 ASP HB3 . 38 . HB1 1 1 547 1 1 1 1 34 ILE MD . 34 . HD1# 1 1 547 1 2 1 1 38 ASP HB3 . 38 . HB1 1 1 548 1 1 1 1 34 ILE MG . 34 . HG2# 1 1 548 1 2 1 1 39 ALA H . 39 . HN 1 1 549 1 1 1 1 34 ILE MD . 34 . HD1# 1 1 549 1 2 1 1 39 ALA H . 39 . HN 1 1 550 1 1 1 1 34 ILE MG . 34 . HG2# 1 1 550 1 2 1 1 39 ALA HA . 39 . HA 1 1 551 1 1 1 1 34 ILE MD . 34 . HD1# 1 1 551 1 2 1 1 39 ALA HA . 39 . HA 1 1 552 1 1 1 1 34 ILE MD . 34 . HD1# 1 1 552 1 2 1 1 39 ALA MB . 39 . HB# 1 1 553 1 1 1 1 34 ILE MD . 34 . HD1# 1 1 553 1 2 1 1 42 LEU H . 42 . HN 1 1 554 1 1 1 1 34 ILE MD . 34 . HD1# 1 1 554 1 2 1 1 42 LEU HG . 42 . HG 1 1 555 1 1 1 1 35 PRO HA . 35 . HA 1 1 555 1 2 1 1 36 GLU H . 36 . HN 1 1 556 1 1 1 1 35 PRO HA . 35 . HA 1 1 556 1 2 1 1 36 GLU HA . 36 . HA 1 1 557 1 1 1 1 35 PRO QB . 35 . HB# 1 1 557 1 2 1 1 36 GLU H . 36 . HN 1 1 558 1 1 1 1 35 PRO QG . 35 . HG# 1 1 558 1 2 1 1 36 GLU H . 36 . HN 1 1 559 1 1 1 1 35 PRO HA . 35 . HA 1 1 559 1 2 1 1 37 LYS H . 37 . HN 1 1 560 1 1 1 1 35 PRO HA . 35 . HA 1 1 560 1 2 1 1 38 ASP H . 38 . HN 1 1 561 1 1 1 1 35 PRO HA . 35 . HA 1 1 561 1 2 1 1 57 TYR QE . 57 . HE# 1 1 562 1 1 1 1 35 PRO HA . 35 . HA 1 1 562 1 2 1 1 57 TYR QD . 57 . HD# 1 1 563 1 1 1 1 36 GLU HA . 36 . HA 1 1 563 1 2 1 1 37 LYS H . 37 . HN 1 1 564 1 1 1 1 36 GLU QB . 36 . HB# 1 1 564 1 2 1 1 37 LYS H . 37 . HN 1 1 565 1 1 1 1 36 GLU H . 36 . HN 1 1 565 1 2 1 1 37 LYS H . 37 . HN 1 1 566 1 1 1 1 36 GLU H . 36 . HN 1 1 566 1 2 1 1 39 ALA H . 39 . HN 1 1 567 1 1 1 1 36 GLU HA . 36 . HA 1 1 567 1 2 1 1 52 TYR QE . 52 . HE# 1 1 568 1 1 1 1 36 GLU HG2 . 36 . HG2 1 1 568 1 2 1 1 52 TYR QE . 52 . HE# 1 1 569 1 1 1 1 36 GLU HG3 . 36 . HG1 1 1 569 1 2 1 1 52 TYR QE . 52 . HE# 1 1 570 1 1 1 1 36 GLU QB . 36 . HB# 1 1 570 1 2 1 1 52 TYR QE . 52 . HE# 1 1 571 1 1 1 1 36 GLU H . 36 . HN 1 1 571 1 2 1 1 52 TYR QE . 52 . HE# 1 1 572 1 1 1 1 36 GLU HA . 36 . HA 1 1 572 1 2 1 1 57 TYR QD . 57 . HD# 1 1 573 1 1 1 1 36 GLU QB . 36 . HB# 1 1 573 1 2 1 1 57 TYR QD . 57 . HD# 1 1 574 1 1 1 1 36 GLU H . 36 . HN 1 1 574 1 2 1 1 57 TYR HA . 57 . HA 1 1 575 1 1 1 1 36 GLU H . 36 . HN 1 1 575 1 2 1 1 57 TYR QD . 57 . HD# 1 1 576 1 1 1 1 36 GLU H . 36 . HN 1 1 576 1 2 1 1 57 TYR QE . 57 . HE# 1 1 577 1 1 1 1 37 LYS H . 37 . HN 1 1 577 1 2 1 1 38 ASP H . 38 . HN 1 1 578 1 1 1 1 37 LYS QG . 37 . HG# 1 1 578 1 2 1 1 38 ASP H . 38 . HN 1 1 579 1 1 1 1 37 LYS H . 37 . HN 1 1 579 1 2 1 1 39 ALA H . 39 . HN 1 1 580 1 1 1 1 37 LYS HA . 37 . HA 1 1 580 1 2 1 1 39 ALA H . 39 . HN 1 1 581 1 1 1 1 37 LYS HA . 37 . HA 1 1 581 1 2 1 1 40 TYR H . 40 . HN 1 1 582 1 1 1 1 38 ASP HA . 38 . HA 1 1 582 1 2 1 1 39 ALA H . 39 . HN 1 1 583 1 1 1 1 38 ASP QB . 38 . HB# 1 1 583 1 2 1 1 39 ALA H . 39 . HN 1 1 584 1 1 1 1 38 ASP H . 38 . HN 1 1 584 1 2 1 1 39 ALA H . 39 . HN 1 1 585 1 1 1 1 38 ASP HA . 38 . HA 1 1 585 1 2 1 1 40 TYR QD . 40 . HD# 1 1 586 1 1 1 1 38 ASP HA . 38 . HA 1 1 586 1 2 1 1 40 TYR H . 40 . HN 1 1 587 1 1 1 1 38 ASP HA . 38 . HA 1 1 587 1 2 1 1 41 ARG QD . 41 . HD# 1 1 588 1 1 1 1 38 ASP HA . 38 . HA 1 1 588 1 2 1 1 42 LEU H . 42 . HN 1 1 589 1 1 1 1 39 ALA MB . 39 . HB# 1 1 589 1 2 1 1 40 TYR HA . 40 . HA 1 1 590 1 1 1 1 39 ALA MB . 39 . HB# 1 1 590 1 2 1 1 42 LEU H . 42 . HN 1 1 591 1 1 1 1 39 ALA MB . 39 . HB# 1 1 591 1 2 1 1 52 TYR QD . 52 . HD# 1 1 592 1 1 1 1 39 ALA MB . 39 . HB# 1 1 592 1 2 1 1 52 TYR QE . 52 . HE# 1 1 593 1 1 1 1 39 ALA MB . 39 . HB# 1 1 593 1 2 1 1 57 TYR QD . 57 . HD# 1 1 594 1 1 1 1 40 TYR QB . 40 . HB# 1 1 594 1 2 1 1 42 LEU H . 42 . HN 1 1 595 1 1 1 1 40 TYR QE . 40 . HE# 1 1 595 1 2 1 1 41 ARG QD . 41 . HD# 1 1 596 1 1 1 1 40 TYR H . 40 . HN 1 1 596 1 2 1 1 42 LEU H . 42 . HN 1 1 597 1 1 1 1 40 TYR QD . 40 . HD# 1 1 597 1 2 1 1 42 LEU H . 42 . HN 1 1 598 1 1 1 1 40 TYR HA . 40 . HA 1 1 598 1 2 1 1 42 LEU H . 42 . HN 1 1 599 1 1 1 1 40 TYR QE . 40 . HE# 1 1 599 1 2 1 1 44 ILE QG . 44 . HG1# 1 1 600 1 1 1 1 40 TYR QE . 40 . HE# 1 1 600 1 2 1 1 44 ILE MD . 44 . HD1# 1 1 601 1 1 1 1 40 TYR QE . 40 . HE# 1 1 601 1 2 1 1 44 ILE MG . 44 . HG2# 1 1 602 1 1 1 1 40 TYR HA . 40 . HA 1 1 602 1 2 1 1 52 TYR H . 52 . HN 1 1 603 1 1 1 1 40 TYR QB . 40 . HB# 1 1 603 1 2 1 1 52 TYR QE . 52 . HE# 1 1 604 1 1 1 1 40 TYR QE . 40 . HE# 1 1 604 1 2 1 1 52 TYR QE . 52 . HE# 1 1 605 1 1 1 1 40 TYR QE . 40 . HE# 1 1 605 1 2 1 1 52 TYR QD . 52 . HD# 1 1 606 1 1 1 1 40 TYR HA . 40 . HA 1 1 606 1 2 1 1 52 TYR QB . 52 . HB# 1 1 607 1 1 1 1 40 TYR H . 40 . HN 1 1 607 1 2 1 1 52 TYR QD . 52 . HD# 1 1 608 1 1 1 1 40 TYR QB . 40 . HB# 1 1 608 1 2 1 1 52 TYR QD . 52 . HD# 1 1 609 1 1 1 1 40 TYR HA . 40 . HA 1 1 609 1 2 1 1 52 TYR QD . 52 . HD# 1 1 610 1 1 1 1 40 TYR HA . 40 . HA 1 1 610 1 2 1 1 52 TYR QE . 52 . HE# 1 1 611 1 1 1 1 40 TYR H . 40 . HN 1 1 611 1 2 1 1 52 TYR QE . 52 . HE# 1 1 612 1 1 1 1 40 TYR QE . 40 . HE# 1 1 612 1 2 1 1 52 TYR QB . 52 . HB# 1 1 613 1 1 1 1 41 ARG QB . 41 . HB# 1 1 613 1 2 1 1 42 LEU H . 42 . HN 1 1 614 1 1 1 1 41 ARG QD . 41 . HD# 1 1 614 1 2 1 1 45 VAL MG1 . 45 . HG1# 1 1 615 1 1 1 1 41 ARG HA . 41 . HA 1 1 615 1 2 1 1 45 VAL H . 45 . HN 1 1 616 1 1 1 1 42 LEU H . 42 . HN 1 1 616 1 2 1 1 43 GLU H . 43 . HN 1 1 617 1 1 1 1 42 LEU H . 42 . HN 1 1 617 1 2 1 1 44 ILE H . 44 . HN 1 1 618 1 1 1 1 42 LEU H . 42 . HN 1 1 618 1 2 1 1 45 VAL H . 45 . HN 1 1 619 1 1 1 1 42 LEU HA . 42 . HA 1 1 619 1 2 1 1 45 VAL H . 45 . HN 1 1 620 1 1 1 1 42 LEU MD2 . 42 . HD2# 1 1 620 1 2 1 1 45 VAL H . 45 . HN 1 1 621 1 1 1 1 42 LEU MD1 . 42 . HD1# 1 1 621 1 2 1 1 52 TYR QE . 52 . HE# 1 1 622 1 1 1 1 43 GLU H . 43 . HN 1 1 622 1 2 1 1 44 ILE H . 44 . HN 1 1 623 1 1 1 1 43 GLU HA . 43 . HA 1 1 623 1 2 1 1 44 ILE H . 44 . HN 1 1 624 1 1 1 1 43 GLU H . 43 . HN 1 1 624 1 2 1 1 45 VAL H . 45 . HN 1 1 625 1 1 1 1 43 GLU HA . 43 . HA 1 1 625 1 2 1 1 46 THR HA . 46 . HA 1 1 626 1 1 1 1 43 GLU HA . 43 . HA 1 1 626 1 2 1 1 46 THR H . 46 . HN 1 1 627 1 1 1 1 43 GLU HA . 43 . HA 1 1 627 1 2 1 1 47 ALA H . 47 . HN 1 1 628 1 1 1 1 43 GLU HA . 43 . HA 1 1 628 1 2 1 1 48 GLY H . 48 . HN 1 1 629 1 1 1 1 43 GLU QG . 43 . HG# 1 1 629 1 2 1 1 48 GLY QA . 48 . HA# 1 1 630 1 1 1 1 43 GLU HA . 43 . HA 1 1 630 1 2 1 1 48 GLY QA . 48 . HA# 1 1 631 1 1 1 1 43 GLU QG . 43 . HG# 1 1 631 1 2 1 1 48 GLY H . 48 . HN 1 1 632 1 1 1 1 43 GLU QG . 43 . HG# 1 1 632 1 2 1 1 51 LYS HA . 51 . HA 1 1 633 1 1 1 1 43 GLU H . 43 . HN 1 1 633 1 2 1 1 52 TYR H . 52 . HN 1 1 634 1 1 1 1 43 GLU QG . 43 . HG# 1 1 634 1 2 1 1 52 TYR H . 52 . HN 1 1 635 1 1 1 1 43 GLU QB . 43 . HB# 1 1 635 1 2 1 1 52 TYR QB . 52 . HB# 1 1 636 1 1 1 1 44 ILE HA . 44 . HA 1 1 636 1 2 1 1 45 VAL H . 45 . HN 1 1 637 1 1 1 1 44 ILE HB . 44 . HB 1 1 637 1 2 1 1 45 VAL H . 45 . HN 1 1 638 1 1 1 1 44 ILE HG13 . 44 . HG11 1 1 638 1 2 1 1 45 VAL H . 45 . HN 1 1 639 1 1 1 1 44 ILE MD . 44 . HD1# 1 1 639 1 2 1 1 45 VAL H . 45 . HN 1 1 640 1 1 1 1 44 ILE HG12 . 44 . HG12 1 1 640 1 2 1 1 45 VAL H . 45 . HN 1 1 641 1 1 1 1 44 ILE H . 44 . HN 1 1 641 1 2 1 1 45 VAL H . 45 . HN 1 1 642 1 1 1 1 44 ILE MG . 44 . HG2# 1 1 642 1 2 1 1 45 VAL H . 45 . HN 1 1 643 1 1 1 1 44 ILE H . 44 . HN 1 1 643 1 2 1 1 45 VAL HA . 45 . HA 1 1 644 1 1 1 1 44 ILE HA . 44 . HA 1 1 644 1 2 1 1 46 THR H . 46 . HN 1 1 645 1 1 1 1 44 ILE HA . 44 . HA 1 1 645 1 2 1 1 47 ALA H . 47 . HN 1 1 646 1 1 1 1 44 ILE HA . 44 . HA 1 1 646 1 2 1 1 48 GLY H . 48 . HN 1 1 647 1 1 1 1 45 VAL H . 45 . HN 1 1 647 1 2 1 1 46 THR MG . 46 . HG2# 1 1 648 1 1 1 1 45 VAL HB . 45 . HB 1 1 648 1 2 1 1 46 THR H . 46 . HN 1 1 649 1 1 1 1 45 VAL H . 45 . HN 1 1 649 1 2 1 1 46 THR H . 46 . HN 1 1 650 1 1 1 1 45 VAL HA . 45 . HA 1 1 650 1 2 1 1 47 ALA H . 47 . HN 1 1 651 1 1 1 1 45 VAL H . 45 . HN 1 1 651 1 2 1 1 47 ALA H . 47 . HN 1 1 652 1 1 1 1 45 VAL H . 45 . HN 1 1 652 1 2 1 1 48 GLY H . 48 . HN 1 1 653 1 1 1 1 46 THR HA . 46 . HA 1 1 653 1 2 1 1 47 ALA H . 47 . HN 1 1 654 1 1 1 1 46 THR HB . 46 . HB 1 1 654 1 2 1 1 47 ALA H . 47 . HN 1 1 655 1 1 1 1 46 THR HA . 46 . HA 1 1 655 1 2 1 1 47 ALA MB . 47 . HB# 1 1 656 1 1 1 1 46 THR H . 46 . HN 1 1 656 1 2 1 1 47 ALA H . 47 . HN 1 1 657 1 1 1 1 46 THR H . 46 . HN 1 1 657 1 2 1 1 48 GLY H . 48 . HN 1 1 658 1 1 1 1 46 THR MG . 46 . HG2# 1 1 658 1 2 1 1 48 GLY H . 48 . HN 1 1 659 1 1 1 1 46 THR HA . 46 . HA 1 1 659 1 2 1 1 48 GLY H . 48 . HN 1 1 660 1 1 1 1 46 THR HB . 46 . HB 1 1 660 1 2 1 1 48 GLY H . 48 . HN 1 1 661 1 1 1 1 46 THR HA . 46 . HA 1 1 661 1 2 1 1 49 ALA H . 49 . HN 1 1 662 1 1 1 1 46 THR HB . 46 . HB 1 1 662 1 2 1 1 49 ALA H . 49 . HN 1 1 663 1 1 1 1 46 THR MG . 46 . HG2# 1 1 663 1 2 1 1 49 ALA H . 49 . HN 1 1 664 1 1 1 1 46 THR HA . 46 . HA 1 1 664 1 2 1 1 50 LEU H . 50 . HN 1 1 665 1 1 1 1 46 THR HB . 46 . HB 1 1 665 1 2 1 1 50 LEU H . 50 . HN 1 1 666 1 1 1 1 47 ALA H . 47 . HN 1 1 666 1 2 1 1 48 GLY QA . 48 . HA# 1 1 667 1 1 1 1 47 ALA H . 47 . HN 1 1 667 1 2 1 1 48 GLY H . 48 . HN 1 1 668 1 1 1 1 47 ALA MB . 47 . HB# 1 1 668 1 2 1 1 48 GLY H . 48 . HN 1 1 669 1 1 1 1 47 ALA MB . 47 . HB# 1 1 669 1 2 1 1 49 ALA H . 49 . HN 1 1 670 1 1 1 1 47 ALA H . 47 . HN 1 1 670 1 2 1 1 49 ALA H . 49 . HN 1 1 671 1 1 1 1 48 GLY QA . 48 . HA# 1 1 671 1 2 1 1 49 ALA H . 49 . HN 1 1 672 1 1 1 1 48 GLY H . 48 . HN 1 1 672 1 2 1 1 49 ALA MB . 49 . HB# 1 1 673 1 1 1 1 48 GLY H . 48 . HN 1 1 673 1 2 1 1 49 ALA H . 49 . HN 1 1 674 1 1 1 1 48 GLY QA . 48 . HA# 1 1 674 1 2 1 1 50 LEU H . 50 . HN 1 1 675 1 1 1 1 48 GLY H . 48 . HN 1 1 675 1 2 1 1 50 LEU H . 50 . HN 1 1 676 1 1 1 1 49 ALA H . 49 . HN 1 1 676 1 2 1 1 50 LEU H . 50 . HN 1 1 677 1 1 1 1 50 LEU MD2 . 50 . HD2# 1 1 677 1 2 1 1 51 LYS H . 51 . HN 1 1 678 1 1 1 1 51 LYS QG . 51 . HG# 1 1 678 1 2 1 1 52 TYR H . 52 . HN 1 1 679 1 1 1 1 51 LYS HA . 51 . HA 1 1 679 1 2 1 1 52 TYR QB . 52 . HB# 1 1 680 1 1 1 1 51 LYS HA . 51 . HA 1 1 680 1 2 1 1 52 TYR H . 52 . HN 1 1 681 1 1 1 1 51 LYS H . 51 . HN 1 1 681 1 2 1 1 52 TYR H . 52 . HN 1 1 682 1 1 1 1 51 LYS QB . 51 . HB# 1 1 682 1 2 1 1 52 TYR H . 52 . HN 1 1 683 1 1 1 1 52 TYR HA . 52 . HA 1 1 683 1 2 1 1 53 GLN H . 53 . HN 1 1 684 1 1 1 1 52 TYR QB . 52 . HB# 1 1 684 1 2 1 1 53 GLN H . 53 . HN 1 1 685 1 1 1 1 52 TYR QE . 52 . HE# 1 1 685 1 2 1 1 53 GLN HA . 53 . HA 1 1 686 1 1 1 1 52 TYR QE . 52 . HE# 1 1 686 1 2 1 1 54 GLU QG . 54 . HG# 1 1 687 1 1 1 1 52 TYR QE . 52 . HE# 1 1 687 1 2 1 1 54 GLU QB . 54 . HB# 1 1 688 1 1 1 1 52 TYR QE . 52 . HE# 1 1 688 1 2 1 1 54 GLU H . 54 . HN 1 1 689 1 1 1 1 52 TYR QE . 52 . HE# 1 1 689 1 2 1 1 54 GLU HA . 54 . HA 1 1 690 1 1 1 1 52 TYR QE . 52 . HE# 1 1 690 1 2 1 1 57 TYR HB3 . 57 . HB1 1 1 691 1 1 1 1 52 TYR QD . 52 . HD# 1 1 691 1 2 1 1 57 TYR QD . 57 . HD# 1 1 692 1 1 1 1 52 TYR QE . 52 . HE# 1 1 692 1 2 1 1 57 TYR QD . 57 . HD# 1 1 693 1 1 1 1 53 GLN HA . 53 . HA 1 1 693 1 2 1 1 54 GLU H . 54 . HN 1 1 694 1 1 1 1 53 GLN HA . 53 . HA 1 1 694 1 2 1 1 55 ASN H . 55 . HN 1 1 695 1 1 1 1 53 GLN QG . 53 . HG# 1 1 695 1 2 1 1 54 GLU H . 54 . HN 1 1 696 1 1 1 1 54 GLU H . 54 . HN 1 1 696 1 2 1 1 55 ASN HA . 55 . HA 1 1 697 1 1 1 1 54 GLU QG . 54 . HG# 1 1 697 1 2 1 1 55 ASN H . 55 . HN 1 1 698 1 1 1 1 54 GLU QG . 54 . HG# 1 1 698 1 2 1 1 55 ASN HA . 55 . HA 1 1 699 1 1 1 1 54 GLU HA . 54 . HA 1 1 699 1 2 1 1 56 ALA H . 56 . HN 1 1 700 1 1 1 1 54 GLU QG . 54 . HG# 1 1 700 1 2 1 1 57 TYR QD . 57 . HD# 1 1 701 1 1 1 1 54 GLU HA . 54 . HA 1 1 701 1 2 1 1 57 TYR HB3 . 57 . HB1 1 1 702 1 1 1 1 54 GLU H . 54 . HN 1 1 702 1 2 1 1 57 TYR QD . 57 . HD# 1 1 703 1 1 1 1 54 GLU HA . 54 . HA 1 1 703 1 2 1 1 57 TYR QD . 57 . HD# 1 1 704 1 1 1 1 54 GLU QG . 54 . HG# 1 1 704 1 2 1 1 58 ARG H . 58 . HN 1 1 705 1 1 1 1 54 GLU QG . 54 . HG# 1 1 705 1 2 1 1 58 ARG QG . 58 . HG# 1 1 706 1 1 1 1 54 GLU HA . 54 . HA 1 1 706 1 2 1 1 58 ARG H . 58 . HN 1 1 707 1 1 1 1 55 ASN HA . 55 . HA 1 1 707 1 2 1 1 56 ALA MB . 56 . HB# 1 1 708 1 1 1 1 55 ASN H . 55 . HN 1 1 708 1 2 1 1 56 ALA H . 56 . HN 1 1 709 1 1 1 1 55 ASN H . 55 . HN 1 1 709 1 2 1 1 56 ALA MB . 56 . HB# 1 1 710 1 1 1 1 55 ASN HA . 55 . HA 1 1 710 1 2 1 1 56 ALA H . 56 . HN 1 1 711 1 1 1 1 55 ASN HA . 55 . HA 1 1 711 1 2 1 1 57 TYR H . 57 . HN 1 1 712 1 1 1 1 55 ASN HA . 55 . HA 1 1 712 1 2 1 1 57 TYR QD . 57 . HD# 1 1 713 1 1 1 1 55 ASN HA . 55 . HA 1 1 713 1 2 1 1 58 ARG HB3 . 58 . HB1 1 1 714 1 1 1 1 55 ASN HA . 55 . HA 1 1 714 1 2 1 1 58 ARG QG . 58 . HG# 1 1 715 1 1 1 1 55 ASN HA . 55 . HA 1 1 715 1 2 1 1 58 ARG QD . 58 . HD# 1 1 716 1 1 1 1 55 ASN HA . 55 . HA 1 1 716 1 2 1 1 58 ARG H . 58 . HN 1 1 717 1 1 1 1 55 ASN HA . 55 . HA 1 1 717 1 2 1 1 58 ARG HB2 . 58 . HB2 1 1 718 1 1 1 1 56 ALA MB . 56 . HB# 1 1 718 1 2 1 1 57 TYR H . 57 . HN 1 1 719 1 1 1 1 56 ALA MB . 56 . HB# 1 1 719 1 2 1 1 57 TYR QD . 57 . HD# 1 1 720 1 1 1 1 56 ALA HA . 56 . HA 1 1 720 1 2 1 1 57 TYR QD . 57 . HD# 1 1 721 1 1 1 1 56 ALA HA . 56 . HA 1 1 721 1 2 1 1 58 ARG H . 58 . HN 1 1 722 1 1 1 1 57 TYR QD . 57 . HD# 1 1 722 1 2 1 1 58 ARG H . 58 . HN 1 1 723 1 1 1 1 57 TYR HB2 . 57 . HB2 1 1 723 1 2 1 1 58 ARG H . 58 . HN 1 1 724 1 1 1 1 57 TYR HB3 . 57 . HB1 1 1 724 1 2 1 1 58 ARG H . 58 . HN 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 3.4 1.8 3.5 1 1 2 1 . . . . . 3.4 1.8 3.5 1 1 3 1 . . . . . 4.5 1.8 5.0 1 1 4 1 . . . . . 3.4 1.8 3.5 1 1 5 1 . . . . . 4.5 1.8 5.0 1 1 6 1 . . . . . 4.5 1.8 5.0 1 1 7 1 . . . . . 3.4 1.8 3.5 1 1 8 1 . . . . . 6.0 1.8 6.0 1 1 9 1 . . . . . 3.4 1.8 3.5 1 1 10 1 . . . . . 2.8 1.8 2.8 1 1 11 1 . . . . . 2.8 1.8 2.8 1 1 12 1 . . . . . 4.5 1.8 5.0 1 1 13 1 . . . . . 2.8 1.8 2.8 1 1 14 1 . . . . . 2.8 1.8 2.8 1 1 15 1 . . . . . 3.4 1.8 3.5 1 1 16 1 . . . . . 2.8 1.8 2.8 1 1 17 1 . . . . . 2.8 1.8 2.8 1 1 18 1 . . . . . 3.4 1.8 3.5 1 1 19 1 . . . . . 4.5 1.8 5.0 1 1 20 1 . . . . . 2.8 1.8 2.8 1 1 21 1 . . . . . 4.5 1.8 5.0 1 1 22 1 . . . . . 3.4 1.8 3.5 1 1 23 1 . . . . . 3.4 1.8 3.5 1 1 24 1 . . . . . 3.4 1.8 3.5 1 1 25 1 . . . . . 6.0 1.8 6.0 1 1 26 1 . . . . . 4.5 1.8 5.0 1 1 27 1 . . . . . 4.5 1.8 5.0 1 1 28 1 . . . . . 3.4 1.8 3.5 1 1 29 1 . . . . . 2.8 1.8 2.8 1 1 30 1 . . . . . 2.8 1.8 2.8 1 1 31 1 . . . . . 2.8 1.8 2.8 1 1 32 1 . . . . . 2.8 1.8 2.8 1 1 33 1 . . . . . 2.8 1.8 2.8 1 1 34 1 . . . . . 3.4 1.8 3.5 1 1 35 1 . . . . . 6.0 1.8 6.0 1 1 36 1 . . . . . 3.4 1.8 3.5 1 1 37 1 . . . . . 3.4 1.8 3.5 1 1 38 1 . . . . . 2.8 1.8 2.8 1 1 39 1 . . . . . 3.4 1.8 3.5 1 1 40 1 . . . . . 2.8 1.8 2.8 1 1 41 1 . . . . . 2.8 1.8 2.8 1 1 42 1 . . . . . 4.5 1.8 5.0 1 1 43 1 . . . . . 4.5 1.8 5.0 1 1 44 1 . . . . . 6.0 1.8 6.0 1 1 45 1 . . . . . 2.8 1.8 2.8 1 1 46 1 . . . . . 4.5 1.8 5.0 1 1 47 1 . . . . . 4.5 1.8 5.0 1 1 48 1 . . . . . 4.5 1.8 5.0 1 1 49 1 . . . . . 3.4 1.8 3.5 1 1 50 1 . . . . . 3.4 1.8 3.5 1 1 51 1 . . . . . 2.8 1.8 2.8 1 1 52 1 . . . . . 2.8 1.8 2.8 1 1 53 1 . . . . . 2.8 1.8 2.8 1 1 54 1 . . . . . 2.8 1.8 2.8 1 1 55 1 . . . . . 2.8 1.8 2.8 1 1 56 1 . . . . . 4.5 1.8 5.0 1 1 57 1 . . . . . 2.8 1.8 2.8 1 1 58 1 . . . . . 2.8 1.8 2.8 1 1 59 1 . . . . . 4.5 1.8 5.0 1 1 60 1 . . . . . 3.4 1.8 3.5 1 1 61 1 . . . . . 4.5 1.8 5.0 1 1 62 1 . . . . . 3.4 1.8 3.5 1 1 63 1 . . . . . 3.4 1.8 3.5 1 1 64 1 . . . . . 3.4 1.8 3.5 1 1 65 1 . . . . . 3.4 1.8 3.5 1 1 66 1 . . . . . 3.4 1.8 3.5 1 1 67 1 . . . . . 6.0 1.8 6.0 1 1 68 1 . . . . . 3.4 1.8 3.5 1 1 69 1 . . . . . 4.5 1.8 5.0 1 1 70 1 . . . . . 3.4 1.8 3.5 1 1 71 1 . . . . . 2.8 1.8 2.8 1 1 72 1 . . . . . 3.4 1.8 3.5 1 1 73 1 . . . . . 2.8 1.8 2.8 1 1 74 1 . . . . . 4.5 1.8 5.0 1 1 75 1 . . . . . 4.5 1.8 5.0 1 1 76 1 . . . . . 4.5 1.8 5.0 1 1 77 1 . . . . . 3.4 1.8 3.5 1 1 78 1 . . . . . 3.4 1.8 3.5 1 1 79 1 . . . . . 3.4 1.8 3.5 1 1 80 1 . . . . . 3.4 1.8 3.5 1 1 81 1 . . . . . 3.4 1.8 3.5 1 1 82 1 . . . . . 3.4 1.8 3.5 1 1 83 1 . . . . . 3.4 1.8 3.5 1 1 84 1 . . . . . 4.5 1.8 5.0 1 1 85 1 . . . . . 4.5 1.8 5.0 1 1 86 1 . . . . . 4.5 1.8 5.0 1 1 87 1 . . . . . 3.4 1.8 3.5 1 1 88 1 . . . . . 3.4 1.8 3.5 1 1 89 1 . . . . . 3.4 1.8 3.5 1 1 90 1 . . . . . 3.4 1.8 3.5 1 1 91 1 . . . . . 2.8 1.8 2.8 1 1 92 1 . . . . . 2.8 1.8 2.8 1 1 93 1 . . . . . 3.4 1.8 3.5 1 1 94 1 . . . . . 2.8 1.8 2.8 1 1 95 1 . . . . . 2.8 1.8 2.8 1 1 96 1 . . . . . 3.4 1.8 3.5 1 1 97 1 . . . . . 2.8 1.8 2.8 1 1 98 1 . . . . . 3.4 1.8 3.5 1 1 99 1 . . . . . 2.8 1.8 2.8 1 1 100 1 . . . . . 3.4 1.8 3.5 1 1 101 1 . . . . . 6.0 1.8 6.0 1 1 102 1 . . . . . 3.4 1.8 3.5 1 1 103 1 . . . . . 3.4 1.8 3.5 1 1 104 1 . . . . . 3.4 1.8 3.5 1 1 105 1 . . . . . 3.4 1.8 3.5 1 1 106 1 . . . . . 3.4 1.8 3.5 1 1 107 1 . . . . . 4.5 1.8 5.0 1 1 108 1 . . . . . 2.8 1.8 2.8 1 1 109 1 . . . . . 2.8 1.8 2.8 1 1 110 1 . . . . . 4.5 1.8 5.0 1 1 111 1 . . . . . 3.4 1.8 3.5 1 1 112 1 . . . . . 2.8 1.8 2.8 1 1 113 1 . . . . . 3.4 1.8 3.5 1 1 114 1 . . . . . 4.5 1.8 5.0 1 1 115 1 . . . . . 4.5 1.8 5.0 1 1 116 1 . . . . . 4.5 1.8 5.0 1 1 117 1 . . . . . 4.5 1.8 5.0 1 1 118 1 . . . . . 4.5 1.8 5.0 1 1 119 1 . . . . . 4.5 1.8 5.0 1 1 120 1 . . . . . 4.5 1.8 5.0 1 1 121 1 . . . . . 3.4 1.8 3.5 1 1 122 1 . . . . . 4.5 1.8 5.0 1 1 123 1 . . . . . 2.8 1.8 2.8 1 1 124 1 . . . . . 4.5 1.8 5.0 1 1 125 1 . . . . . 4.5 1.8 5.0 1 1 126 1 . . . . . 4.5 1.8 5.0 1 1 127 1 . . . . . 4.5 1.8 5.0 1 1 128 1 . . . . . 4.5 1.8 5.0 1 1 129 1 . . . . . 3.4 1.8 3.5 1 1 130 1 . . . . . 4.5 1.8 5.0 1 1 131 1 . . . . . 4.5 1.8 5.0 1 1 132 1 . . . . . 6.0 1.8 6.0 1 1 133 1 . . . . . 3.4 1.8 3.5 1 1 134 1 . . . . . 6.0 1.8 6.0 1 1 135 1 . . . . . 6.0 1.8 6.0 1 1 136 1 . . . . . 3.4 1.8 3.5 1 1 137 1 . . . . . 4.5 1.8 5.0 1 1 138 1 . . . . . 4.5 1.8 5.0 1 1 139 1 . . . . . 4.5 1.8 5.0 1 1 140 1 . . . . . 4.5 1.8 5.0 1 1 141 1 . . . . . 2.8 1.8 2.8 1 1 142 1 . . . . . 4.5 1.8 5.0 1 1 143 1 . . . . . 4.5 1.8 5.0 1 1 144 1 . . . . . 3.4 1.8 3.5 1 1 145 1 . . . . . 4.5 1.8 5.0 1 1 146 1 . . . . . 4.5 1.8 5.0 1 1 147 1 . . . . . 4.5 1.8 5.0 1 1 148 1 . . . . . 4.5 1.8 5.0 1 1 149 1 . . . . . 4.5 1.8 5.0 1 1 150 1 . . . . . 4.5 1.8 5.0 1 1 151 1 . . . . . 3.4 1.8 3.5 1 1 152 1 . . . . . 4.5 1.8 5.0 1 1 153 1 . . . . . 4.5 1.8 5.0 1 1 154 1 . . . . . 3.4 1.8 3.5 1 1 155 1 . . . . . 3.4 1.8 3.5 1 1 156 1 . . . . . 4.5 1.8 5.0 1 1 157 1 . . . . . 6.0 1.8 6.0 1 1 158 1 . . . . . 4.5 1.8 5.0 1 1 159 1 . . . . . 4.5 1.8 5.0 1 1 160 1 . . . . . 4.5 1.8 5.0 1 1 161 1 . . . . . 4.5 1.8 5.0 1 1 162 1 . . . . . 4.5 1.8 5.0 1 1 163 1 . . . . . 4.5 1.8 5.0 1 1 164 1 . . . . . 4.5 1.8 5.0 1 1 165 1 . . . . . 4.5 1.8 5.0 1 1 166 1 . . . . . 4.5 1.8 5.0 1 1 167 1 . . . . . 4.5 1.8 5.0 1 1 168 1 . . . . . 4.5 1.8 5.0 1 1 169 1 . . . . . 4.5 1.8 5.0 1 1 170 1 . . . . . 6.0 1.8 6.0 1 1 171 1 . . . . . 6.0 1.8 6.0 1 1 172 1 . . . . . 4.5 1.8 5.0 1 1 173 1 . . . . . 4.5 1.8 5.0 1 1 174 1 . . . . . 3.4 1.8 3.5 1 1 175 1 . . . . . 6.0 1.8 6.0 1 1 176 1 . . . . . 4.5 1.8 5.0 1 1 177 1 . . . . . 2.8 1.8 2.8 1 1 178 1 . . . . . 6.0 1.8 6.0 1 1 179 1 . . . . . 3.4 1.8 3.5 1 1 180 1 . . . . . 4.5 1.8 5.0 1 1 181 1 . . . . . 4.5 1.8 5.0 1 1 182 1 . . . . . 3.4 1.8 3.5 1 1 183 1 . . . . . 4.5 1.8 5.0 1 1 184 1 . . . . . 6.0 1.8 6.0 1 1 185 1 . . . . . 4.5 1.8 5.0 1 1 186 1 . . . . . 4.5 1.8 5.0 1 1 187 1 . . . . . 6.0 1.8 6.0 1 1 188 1 . . . . . 6.0 1.8 6.0 1 1 189 1 . . . . . 4.5 1.8 5.0 1 1 190 1 . . . . . 4.5 1.8 5.0 1 1 191 1 . . . . . 4.5 1.8 5.0 1 1 192 1 . . . . . 4.5 1.8 5.0 1 1 193 1 . . . . . 4.5 1.8 5.0 1 1 194 1 . . . . . 2.8 1.8 2.8 1 1 195 1 . . . . . 6.0 1.8 6.0 1 1 196 1 . . . . . 4.5 1.8 5.0 1 1 197 1 . . . . . 3.4 1.8 3.5 1 1 198 1 . . . . . 4.5 1.8 5.0 1 1 199 1 . . . . . 3.4 1.8 3.5 1 1 200 1 . . . . . 3.4 1.8 3.5 1 1 201 1 . . . . . 4.5 1.8 5.0 1 1 202 1 . . . . . 4.5 1.8 5.0 1 1 203 1 . . . . . 3.4 1.8 3.5 1 1 204 1 . . . . . 4.5 1.8 5.0 1 1 205 1 . . . . . 6.0 1.8 6.0 1 1 206 1 . . . . . 4.5 1.8 5.0 1 1 207 1 . . . . . 4.5 1.8 5.0 1 1 208 1 . . . . . 6.0 1.8 6.0 1 1 209 1 . . . . . 3.4 1.8 3.5 1 1 210 1 . . . . . 6.0 1.8 6.0 1 1 211 1 . . . . . 4.5 1.8 5.0 1 1 212 1 . . . . . 4.5 1.8 5.0 1 1 213 1 . . . . . 4.5 1.8 5.0 1 1 214 1 . . . . . 4.5 1.8 5.0 1 1 215 1 . . . . . 3.4 1.8 3.5 1 1 216 1 . . . . . 6.0 1.8 6.0 1 1 217 1 . . . . . 4.5 1.8 5.0 1 1 218 1 . . . . . 4.5 1.8 5.0 1 1 219 1 . . . . . 3.4 1.8 3.5 1 1 220 1 . . . . . 6.0 1.8 6.0 1 1 221 1 . . . . . 4.5 1.8 5.0 1 1 222 1 . . . . . 6.0 1.8 6.0 1 1 223 1 . . . . . 6.0 1.8 6.0 1 1 224 1 . . . . . 4.5 1.8 5.0 1 1 225 1 . . . . . 4.5 1.8 5.0 1 1 226 1 . . . . . 4.5 1.8 5.0 1 1 227 1 . . . . . 3.4 1.8 3.5 1 1 228 1 . . . . . 3.4 1.8 3.5 1 1 229 1 . . . . . 2.8 1.8 2.8 1 1 230 1 . . . . . 6.0 1.8 6.0 1 1 231 1 . . . . . 2.8 1.8 2.8 1 1 232 1 . . . . . 4.5 1.8 5.0 1 1 233 1 . . . . . 3.4 1.8 3.5 1 1 234 1 . . . . . 3.4 1.8 3.5 1 1 235 1 . . . . . 6.0 1.8 6.0 1 1 236 1 . . . . . 6.0 1.8 6.0 1 1 237 1 . . . . . 3.4 1.8 3.5 1 1 238 1 . . . . . 3.4 1.8 3.5 1 1 239 1 . . . . . 6.0 1.8 6.0 1 1 240 1 . . . . . 4.5 1.8 5.0 1 1 241 1 . . . . . 4.5 1.8 5.0 1 1 242 1 . . . . . 6.0 1.8 6.0 1 1 243 1 . . . . . 4.5 1.8 5.0 1 1 244 1 . . . . . 4.5 1.8 5.0 1 1 245 1 . . . . . 6.0 1.8 6.0 1 1 246 1 . . . . . 6.0 1.8 6.0 1 1 247 1 . . . . . 4.5 1.8 5.0 1 1 248 1 . . . . . 4.5 1.8 5.0 1 1 249 1 . . . . . 6.0 1.8 6.0 1 1 250 1 . . . . . 4.5 1.8 5.0 1 1 251 1 . . . . . 4.5 1.8 5.0 1 1 252 1 . . . . . 4.5 1.8 5.0 1 1 253 1 . . . . . 6.0 1.8 6.0 1 1 254 1 . . . . . 6.0 1.8 6.0 1 1 255 1 . . . . . 6.0 1.8 6.0 1 1 256 1 . . . . . 4.5 1.8 5.0 1 1 257 1 . . . . . 4.5 1.8 5.0 1 1 258 1 . . . . . 3.4 1.8 3.5 1 1 259 1 . . . . . 3.4 1.8 3.5 1 1 260 1 . . . . . 4.5 1.8 5.0 1 1 261 1 . . . . . 6.0 1.8 6.0 1 1 262 1 . . . . . 6.0 1.8 6.0 1 1 263 1 . . . . . 3.4 1.8 3.5 1 1 264 1 . . . . . 3.4 1.8 3.5 1 1 265 1 . . . . . 3.4 1.8 3.5 1 1 266 1 . . . . . 6.0 1.8 6.0 1 1 267 1 . . . . . 4.5 1.8 5.0 1 1 268 1 . . . . . 4.5 1.8 5.0 1 1 269 1 . . . . . 6.0 1.8 6.0 1 1 270 1 . . . . . 4.5 1.8 5.0 1 1 271 1 . . . . . 3.4 1.8 3.5 1 1 272 1 . . . . . 4.5 1.8 5.0 1 1 273 1 . . . . . 3.4 1.8 3.5 1 1 274 1 . . . . . 4.5 1.8 5.0 1 1 275 1 . . . . . 6.0 1.8 6.0 1 1 276 1 . . . . . 3.4 1.8 3.5 1 1 277 1 . . . . . 6.0 1.8 6.0 1 1 278 1 . . . . . 4.5 1.8 5.0 1 1 279 1 . . . . . 6.0 1.8 6.0 1 1 280 1 . . . . . 4.5 1.8 5.0 1 1 281 1 . . . . . 4.5 1.8 5.0 1 1 282 1 . . . . . 4.5 1.8 5.0 1 1 283 1 . . . . . 4.5 1.8 5.0 1 1 284 1 . . . . . 3.4 1.8 3.5 1 1 285 1 . . . . . 4.5 1.8 5.0 1 1 286 1 . . . . . 4.5 1.8 5.0 1 1 287 1 . . . . . 4.5 1.8 5.0 1 1 288 1 . . . . . 4.5 1.8 5.0 1 1 289 1 . . . . . 4.5 1.8 5.0 1 1 290 1 . . . . . 2.8 1.8 2.8 1 1 291 1 . . . . . 6.0 1.8 6.0 1 1 292 1 . . . . . 4.5 1.8 5.0 1 1 293 1 . . . . . 4.5 1.8 5.0 1 1 294 1 . . . . . 4.5 1.8 5.0 1 1 295 1 . . . . . 6.0 1.8 6.0 1 1 296 1 . . . . . 4.5 1.8 5.0 1 1 297 1 . . . . . 3.4 1.8 3.5 1 1 298 1 . . . . . 4.5 1.8 5.0 1 1 299 1 . . . . . 4.5 1.8 5.0 1 1 300 1 . . . . . 6.0 1.8 6.0 1 1 301 1 . . . . . 6.0 1.8 6.0 1 1 302 1 . . . . . 4.5 1.8 5.0 1 1 303 1 . . . . . 3.4 1.8 3.5 1 1 304 1 . . . . . 4.5 1.8 5.0 1 1 305 1 . . . . . 6.0 1.8 6.0 1 1 306 1 . . . . . 3.4 1.8 3.5 1 1 307 1 . . . . . 3.4 1.8 3.5 1 1 308 1 . . . . . 6.0 1.8 6.0 1 1 309 1 . . . . . 3.4 1.8 3.5 1 1 310 1 . . . . . 4.5 1.8 5.0 1 1 311 1 . . . . . 4.5 1.8 5.0 1 1 312 1 . . . . . 4.5 1.8 5.0 1 1 313 1 . . . . . 6.0 1.8 6.0 1 1 314 1 . . . . . 6.0 1.8 6.0 1 1 315 1 . . . . . 2.8 1.8 2.8 1 1 316 1 . . . . . 4.5 1.8 5.0 1 1 317 1 . . . . . 4.5 1.8 5.0 1 1 318 1 . . . . . 4.5 1.8 5.0 1 1 319 1 . . . . . 4.5 1.8 5.0 1 1 320 1 . . . . . 3.4 0.8 3.4 1 1 321 1 . . . . . 4.5 1.8 5.0 1 1 322 1 . . . . . 6.0 1.8 6.0 1 1 323 1 . . . . . 2.8 1.8 2.8 1 1 324 1 . . . . . 3.4 1.8 3.5 1 1 325 1 . . . . . 4.5 1.8 5.0 1 1 326 1 . . . . . 4.5 1.8 5.0 1 1 327 1 . . . . . 4.5 1.8 5.0 1 1 328 1 . . . . . 3.4 1.8 3.5 1 1 329 1 . . . . . 6.0 1.8 6.0 1 1 330 1 . . . . . 4.5 1.8 5.0 1 1 331 1 . . . . . 6.0 1.8 6.0 1 1 332 1 . . . . . 4.5 1.8 5.0 1 1 333 1 . . . . . 3.4 1.8 3.5 1 1 334 1 . . . . . 4.5 1.8 5.0 1 1 335 1 . . . . . 3.4 1.8 3.5 1 1 336 1 . . . . . 4.5 1.8 5.0 1 1 337 1 . . . . . 3.4 1.8 3.5 1 1 338 1 . . . . . 6.0 1.8 6.0 1 1 339 1 . . . . . 4.5 1.8 5.0 1 1 340 1 . . . . . 6.0 1.8 6.0 1 1 341 1 . . . . . 4.5 1.8 5.0 1 1 342 1 . . . . . 4.5 1.8 5.0 1 1 343 1 . . . . . 3.4 1.8 3.5 1 1 344 1 . . . . . 4.5 1.8 5.0 1 1 345 1 . . . . . 6.0 1.8 6.0 1 1 346 1 . . . . . 4.5 1.8 5.0 1 1 347 1 . . . . . 4.5 1.8 5.0 1 1 348 1 . . . . . 6.0 1.8 6.0 1 1 349 1 . . . . . 4.5 1.8 5.0 1 1 350 1 . . . . . 6.0 1.8 6.0 1 1 351 1 . . . . . 6.0 1.8 6.0 1 1 352 1 . . . . . 6.0 1.8 6.0 1 1 353 1 . . . . . 6.0 1.8 6.0 1 1 354 1 . . . . . 4.5 1.8 5.0 1 1 355 1 . . . . . 6.0 1.8 6.0 1 1 356 1 . . . . . 4.5 1.8 5.0 1 1 357 1 . . . . . 2.8 1.8 2.8 1 1 358 1 . . . . . 6.0 1.8 6.0 1 1 359 1 . . . . . 2.8 1.8 2.8 1 1 360 1 . . . . . 4.5 1.8 5.0 1 1 361 1 . . . . . 4.5 1.8 5.0 1 1 362 1 . . . . . 6.0 1.8 6.0 1 1 363 1 . . . . . 4.5 1.8 5.0 1 1 364 1 . . . . . 3.4 1.8 3.5 1 1 365 1 . . . . . 4.5 1.8 5.0 1 1 366 1 . . . . . 6.0 1.8 6.0 1 1 367 1 . . . . . 4.5 1.8 5.0 1 1 368 1 . . . . . 3.4 1.8 3.5 1 1 369 1 . . . . . 4.5 1.8 5.0 1 1 370 1 . . . . . 3.4 1.8 3.5 1 1 371 1 . . . . . 4.5 1.8 5.0 1 1 372 1 . . . . . 4.5 1.8 5.0 1 1 373 1 . . . . . 4.5 1.8 5.0 1 1 374 1 . . . . . 3.4 1.8 3.5 1 1 375 1 . . . . . 3.4 1.8 3.5 1 1 376 1 . . . . . 4.5 1.8 5.0 1 1 377 1 . . . . . 4.5 1.8 5.0 1 1 378 1 . . . . . 4.5 1.8 5.0 1 1 379 1 . . . . . 6.0 1.8 6.0 1 1 380 1 . . . . . 4.5 1.8 5.0 1 1 381 1 . . . . . 4.5 1.8 5.0 1 1 382 1 . . . . . 6.0 1.8 6.0 1 1 383 1 . . . . . 4.5 1.8 5.0 1 1 384 1 . . . . . 4.5 1.8 5.0 1 1 385 1 . . . . . 3.4 1.8 3.5 1 1 386 1 . . . . . 4.5 1.8 5.0 1 1 387 1 . . . . . 3.4 1.8 3.5 1 1 388 1 . . . . . 2.8 1.8 2.8 1 1 389 1 . . . . . 4.5 1.8 5.0 1 1 390 1 . . . . . 2.8 1.8 2.8 1 1 391 1 . . . . . 6.0 1.8 6.0 1 1 392 1 . . . . . 4.5 1.8 5.0 1 1 393 1 . . . . . 4.5 1.8 5.0 1 1 394 1 . . . . . 6.0 1.8 6.0 1 1 395 1 . . . . . 3.4 1.8 3.5 1 1 396 1 . . . . . 4.5 1.8 5.0 1 1 397 1 . . . . . 6.0 1.8 6.0 1 1 398 1 . . . . . 3.4 1.8 3.5 1 1 399 1 . . . . . 2.8 1.8 2.8 1 1 400 1 . . . . . 4.5 1.8 5.0 1 1 401 1 . . . . . 4.5 1.8 5.0 1 1 402 1 . . . . . 6.0 1.8 6.0 1 1 403 1 . . . . . 3.4 1.8 3.5 1 1 404 1 . . . . . 4.5 1.8 5.0 1 1 405 1 . . . . . 4.5 1.8 5.0 1 1 406 1 . . . . . 4.5 1.8 5.0 1 1 407 1 . . . . . 2.8 1.8 2.8 1 1 408 1 . . . . . 4.5 1.8 5.0 1 1 409 1 . . . . . 4.5 1.8 5.0 1 1 410 1 . . . . . 4.5 1.8 5.0 1 1 411 1 . . . . . 4.5 1.8 5.0 1 1 412 1 . . . . . 4.5 1.8 5.0 1 1 413 1 . . . . . 4.5 1.8 5.0 1 1 414 1 . . . . . 4.5 1.8 5.0 1 1 415 1 . . . . . 2.8 1.8 2.8 1 1 416 1 . . . . . 2.8 1.8 2.8 1 1 417 1 . . . . . 3.4 1.8 3.5 1 1 418 1 . . . . . 4.5 1.8 5.0 1 1 419 1 . . . . . 3.4 1.8 3.5 1 1 420 1 . . . . . 6.0 1.8 6.0 1 1 421 1 . . . . . 6.0 1.8 6.0 1 1 422 1 . . . . . 6.0 1.8 6.0 1 1 423 1 . . . . . 2.8 1.8 2.8 1 1 424 1 . . . . . 4.5 1.8 5.0 1 1 425 1 . . . . . 6.0 1.8 6.0 1 1 426 1 . . . . . 4.5 1.8 5.0 1 1 427 1 . . . . . 4.5 1.8 5.0 1 1 428 1 . . . . . 4.5 1.8 5.0 1 1 429 1 . . . . . 6.0 1.8 6.0 1 1 430 1 . . . . . 6.0 1.8 6.0 1 1 431 1 . . . . . 4.5 1.8 5.0 1 1 432 1 . . . . . 3.4 1.8 3.5 1 1 433 1 . . . . . 2.8 1.8 2.8 1 1 434 1 . . . . . 3.4 1.8 3.5 1 1 435 1 . . . . . 4.5 1.8 5.0 1 1 436 1 . . . . . 4.5 1.8 5.0 1 1 437 1 . . . . . 4.5 1.8 5.0 1 1 438 1 . . . . . 3.4 1.8 3.5 1 1 439 1 . . . . . 3.4 1.8 3.5 1 1 440 1 . . . . . 4.5 1.8 5.0 1 1 441 1 . . . . . 4.5 1.8 5.0 1 1 442 1 . . . . . 6.0 1.8 6.0 1 1 443 1 . . . . . 4.5 1.8 5.0 1 1 444 1 . . . . . 3.4 1.8 3.5 1 1 445 1 . . . . . 3.4 1.8 3.5 1 1 446 1 . . . . . 4.5 1.8 5.0 1 1 447 1 . . . . . 4.5 1.8 5.0 1 1 448 1 . . . . . 6.0 1.8 6.0 1 1 449 1 . . . . . 4.5 1.8 5.0 1 1 450 1 . . . . . 3.4 1.8 3.5 1 1 451 1 . . . . . 4.5 1.8 5.0 1 1 452 1 . . . . . 2.8 1.8 2.8 1 1 453 1 . . . . . 4.5 1.8 5.0 1 1 454 1 . . . . . 4.5 1.8 5.0 1 1 455 1 . . . . . 6.0 1.8 6.0 1 1 456 1 . . . . . 6.0 1.8 6.0 1 1 457 1 . . . . . 6.0 1.8 6.0 1 1 458 1 . . . . . 4.5 1.8 5.0 1 1 459 1 . . . . . 3.4 1.8 3.5 1 1 460 1 . . . . . 2.8 1.8 2.8 1 1 461 1 . . . . . 3.4 1.8 3.5 1 1 462 1 . . . . . 6.0 1.8 6.0 1 1 463 1 . . . . . 4.5 1.8 5.0 1 1 464 1 . . . . . 4.5 1.8 5.0 1 1 465 1 . . . . . 6.0 1.8 6.0 1 1 466 1 . . . . . 4.5 1.8 5.0 1 1 467 1 . . . . . 6.0 1.8 6.0 1 1 468 1 . . . . . 4.5 1.8 5.0 1 1 469 1 . . . . . 4.5 1.8 5.0 1 1 470 1 . . . . . 4.5 1.8 5.0 1 1 471 1 . . . . . 4.5 1.8 5.0 1 1 472 1 . . . . . 4.5 1.8 5.0 1 1 473 1 . . . . . 4.5 1.8 5.0 1 1 474 1 . . . . . 3.4 1.8 3.5 1 1 475 1 . . . . . 2.8 1.8 2.8 1 1 476 1 . . . . . 6.0 1.8 6.0 1 1 477 1 . . . . . 6.0 1.8 6.0 1 1 478 1 . . . . . 4.5 1.8 5.0 1 1 479 1 . . . . . 6.0 1.8 6.0 1 1 480 1 . . . . . 6.0 1.8 6.0 1 1 481 1 . . . . . 4.5 1.8 5.0 1 1 482 1 . . . . . 4.5 1.8 5.0 1 1 483 1 . . . . . 6.0 1.8 6.0 1 1 484 1 . . . . . 4.5 1.8 5.0 1 1 485 1 . . . . . 4.5 1.8 5.0 1 1 486 1 . . . . . 3.4 1.8 3.5 1 1 487 1 . . . . . 4.5 1.8 5.0 1 1 488 1 . . . . . 6.0 1.8 6.0 1 1 489 1 . . . . . 6.0 1.8 6.0 1 1 490 1 . . . . . 4.5 1.8 5.0 1 1 491 1 . . . . . 4.5 1.8 5.0 1 1 492 1 . . . . . 3.4 1.8 3.5 1 1 493 1 . . . . . 3.4 1.8 3.5 1 1 494 1 . . . . . 6.0 1.8 6.0 1 1 495 1 . . . . . 2.8 1.8 2.8 1 1 496 1 . . . . . 6.0 1.8 6.0 1 1 497 1 . . . . . 4.5 1.8 5.0 1 1 498 1 . . . . . 4.5 1.8 5.0 1 1 499 1 . . . . . 4.5 1.8 5.0 1 1 500 1 . . . . . 6.0 1.8 6.0 1 1 501 1 . . . . . 6.0 1.8 6.0 1 1 502 1 . . . . . 6.0 1.8 6.0 1 1 503 1 . . . . . 2.8 1.8 2.8 1 1 504 1 . . . . . 6.0 1.8 6.0 1 1 505 1 . . . . . 6.0 1.8 6.0 1 1 506 1 . . . . . 4.5 1.8 5.0 1 1 507 1 . . . . . 4.5 1.8 5.0 1 1 508 1 . . . . . 4.5 1.8 5.0 1 1 509 1 . . . . . 4.5 1.8 5.0 1 1 510 1 . . . . . 4.5 1.8 5.0 1 1 511 1 . . . . . 6.0 1.8 6.0 1 1 512 1 . . . . . 6.0 1.8 6.0 1 1 513 1 . . . . . 4.5 1.8 5.0 1 1 514 1 . . . . . 4.5 1.8 5.0 1 1 515 1 . . . . . 4.5 1.8 5.0 1 1 516 1 . . . . . 6.0 1.8 6.0 1 1 517 1 . . . . . 4.5 1.8 5.0 1 1 518 1 . . . . . 4.5 1.8 5.0 1 1 519 1 . . . . . 4.5 1.8 5.0 1 1 520 1 . . . . . 6.0 1.8 6.0 1 1 521 1 . . . . . 4.5 1.8 5.0 1 1 522 1 . . . . . 2.8 1.8 2.8 1 1 523 1 . . . . . 4.5 1.8 5.0 1 1 524 1 . . . . . 6.0 1.8 6.0 1 1 525 1 . . . . . 6.0 1.8 6.0 1 1 526 1 . . . . . 2.8 1.8 2.8 1 1 527 1 . . . . . 6.0 1.8 6.0 1 1 528 1 . . . . . 4.5 1.8 5.0 1 1 529 1 . . . . . 3.4 1.8 3.5 1 1 530 1 . . . . . 4.5 1.8 5.0 1 1 531 1 . . . . . 6.0 1.8 6.0 1 1 532 1 . . . . . 6.0 1.8 6.0 1 1 533 1 . . . . . 4.5 1.8 5.0 1 1 534 1 . . . . . 3.4 1.8 3.5 1 1 535 1 . . . . . 3.4 1.8 3.5 1 1 536 1 . . . . . 6.0 1.8 6.0 1 1 537 1 . . . . . 4.5 1.8 5.0 1 1 538 1 . . . . . 6.0 1.8 6.0 1 1 539 1 . . . . . 4.5 1.8 5.0 1 1 540 1 . . . . . 2.8 1.8 2.8 1 1 541 1 . . . . . 4.5 1.8 5.0 1 1 542 1 . . . . . 6.0 1.8 6.0 1 1 543 1 . . . . . 4.5 1.8 5.0 1 1 544 1 . . . . . 4.5 1.8 5.0 1 1 545 1 . . . . . 4.5 1.8 5.0 1 1 546 1 . . . . . 4.5 1.8 5.0 1 1 547 1 . . . . . 4.5 1.8 5.0 1 1 548 1 . . . . . 4.5 1.8 5.0 1 1 549 1 . . . . . 4.5 1.8 5.0 1 1 550 1 . . . . . 4.5 1.8 5.0 1 1 551 1 . . . . . 2.8 1.8 2.8 1 1 552 1 . . . . . 3.4 1.8 3.5 1 1 553 1 . . . . . 6.0 1.8 6.0 1 1 554 1 . . . . . 4.5 1.8 5.0 1 1 555 1 . . . . . 2.8 1.8 2.8 1 1 556 1 . . . . . 6.0 1.8 6.0 1 1 557 1 . . . . . 4.5 1.8 5.0 1 1 558 1 . . . . . 4.5 1.8 5.0 1 1 559 1 . . . . . 6.0 1.8 6.0 1 1 560 1 . . . . . 6.0 1.8 6.0 1 1 561 1 . . . . . 4.5 1.8 5.0 1 1 562 1 . . . . . 6.0 1.8 6.0 1 1 563 1 . . . . . 4.5 1.8 5.0 1 1 564 1 . . . . . 4.5 1.8 5.0 1 1 565 1 . . . . . 2.8 1.8 2.8 1 1 566 1 . . . . . 6.0 1.8 6.0 1 1 567 1 . . . . . 4.5 1.8 5.0 1 1 568 1 . . . . . 4.5 1.8 5.0 1 1 569 1 . . . . . 4.5 1.8 5.0 1 1 570 1 . . . . . 4.5 1.8 5.0 1 1 571 1 . . . . . 6.0 1.8 6.0 1 1 572 1 . . . . . 4.5 1.8 5.0 1 1 573 1 . . . . . 4.5 1.8 5.0 1 1 574 1 . . . . . 6.0 1.8 6.0 1 1 575 1 . . . . . 4.5 1.8 5.0 1 1 576 1 . . . . . 4.5 1.8 5.0 1 1 577 1 . . . . . 3.4 1.8 3.5 1 1 578 1 . . . . . 4.5 1.8 5.0 1 1 579 1 . . . . . 4.5 1.8 5.0 1 1 580 1 . . . . . 4.5 1.8 5.0 1 1 581 1 . . . . . 3.4 1.8 3.5 1 1 582 1 . . . . . 4.5 1.8 5.0 1 1 583 1 . . . . . 3.4 1.8 3.5 1 1 584 1 . . . . . 2.8 1.8 2.8 1 1 585 1 . . . . . 6.0 1.8 6.0 1 1 586 1 . . . . . 4.5 1.8 5.0 1 1 587 1 . . . . . 4.5 1.8 5.0 1 1 588 1 . . . . . 4.5 1.8 5.0 1 1 589 1 . . . . . 4.5 1.8 5.0 1 1 590 1 . . . . . 6.0 1.8 6.0 1 1 591 1 . . . . . 2.8 1.8 2.8 1 1 592 1 . . . . . 3.4 1.8 3.5 1 1 593 1 . . . . . 4.5 1.8 5.0 1 1 594 1 . . . . . 6.0 1.8 6.0 1 1 595 1 . . . . . 6.0 1.8 6.0 1 1 596 1 . . . . . 4.5 1.8 5.0 1 1 597 1 . . . . . 6.0 1.8 6.0 1 1 598 1 . . . . . 6.0 1.8 6.0 1 1 599 1 . . . . . 6.0 1.8 6.0 1 1 600 1 . . . . . 3.4 1.8 3.5 1 1 601 1 . . . . . 6.0 1.8 6.0 1 1 602 1 . . . . . 6.0 1.8 6.0 1 1 603 1 . . . . . 4.5 1.8 5.0 1 1 604 1 . . . . . 6.0 1.8 6.0 1 1 605 1 . . . . . 6.0 1.8 6.0 1 1 606 1 . . . . . 4.5 1.8 5.0 1 1 607 1 . . . . . 4.5 1.8 5.0 1 1 608 1 . . . . . 4.5 1.8 5.0 1 1 609 1 . . . . . 3.4 1.8 3.5 1 1 610 1 . . . . . 4.5 1.8 5.0 1 1 611 1 . . . . . 4.5 1.8 5.0 1 1 612 1 . . . . . 4.5 1.8 5.0 1 1 613 1 . . . . . 4.5 1.8 5.0 1 1 614 1 . . . . . 6.0 1.8 6.0 1 1 615 1 . . . . . 4.5 1.8 5.0 1 1 616 1 . . . . . 3.4 1.8 3.5 1 1 617 1 . . . . . 4.5 1.8 5.0 1 1 618 1 . . . . . 4.5 1.8 5.0 1 1 619 1 . . . . . 3.4 1.8 3.5 1 1 620 1 . . . . . 6.0 1.8 6.0 1 1 621 1 . . . . . 6.0 1.8 6.0 1 1 622 1 . . . . . 3.4 1.8 3.5 1 1 623 1 . . . . . 4.5 1.8 5.0 1 1 624 1 . . . . . 4.5 1.8 5.0 1 1 625 1 . . . . . 6.0 1.8 6.0 1 1 626 1 . . . . . 4.5 1.8 5.0 1 1 627 1 . . . . . 6.0 1.8 6.0 1 1 628 1 . . . . . 4.5 1.8 5.0 1 1 629 1 . . . . . 3.4 1.8 3.5 1 1 630 1 . . . . . 4.5 1.8 5.0 1 1 631 1 . . . . . 4.5 1.8 5.0 1 1 632 1 . . . . . 3.4 1.8 3.5 1 1 633 1 . . . . . 6.0 1.8 6.0 1 1 634 1 . . . . . 4.5 1.8 5.0 1 1 635 1 . . . . . 4.5 1.8 5.0 1 1 636 1 . . . . . 4.5 1.8 5.0 1 1 637 1 . . . . . 2.8 1.8 2.8 1 1 638 1 . . . . . 4.5 1.8 5.0 1 1 639 1 . . . . . 6.0 1.8 6.0 1 1 640 1 . . . . . 4.5 1.8 5.0 1 1 641 1 . . . . . 3.4 1.8 3.5 1 1 642 1 . . . . . 3.4 1.8 3.5 1 1 643 1 . . . . . 6.0 1.8 6.0 1 1 644 1 . . . . . 4.5 1.8 5.0 1 1 645 1 . . . . . 4.5 1.8 5.0 1 1 646 1 . . . . . 4.5 1.8 5.0 1 1 647 1 . . . . . 4.5 1.8 5.0 1 1 648 1 . . . . . 3.4 1.8 3.5 1 1 649 1 . . . . . 3.4 1.8 3.5 1 1 650 1 . . . . . 4.5 1.8 5.0 1 1 651 1 . . . . . 4.5 1.8 5.0 1 1 652 1 . . . . . 4.5 1.8 5.0 1 1 653 1 . . . . . 3.4 1.8 3.5 1 1 654 1 . . . . . 4.5 1.8 5.0 1 1 655 1 . . . . . 4.5 1.8 5.0 1 1 656 1 . . . . . 3.4 1.8 3.5 1 1 657 1 . . . . . 4.5 1.8 5.0 1 1 658 1 . . . . . 6.0 1.8 6.0 1 1 659 1 . . . . . 6.0 1.8 6.0 1 1 660 1 . . . . . 6.0 1.8 6.0 1 1 661 1 . . . . . 4.5 1.8 5.0 1 1 662 1 . . . . . 3.4 1.8 3.5 1 1 663 1 . . . . . 4.5 1.8 5.0 1 1 664 1 . . . . . 6.0 1.8 6.0 1 1 665 1 . . . . . 4.5 1.8 5.0 1 1 666 1 . . . . . 6.0 1.8 6.0 1 1 667 1 . . . . . 3.4 1.8 3.5 1 1 668 1 . . . . . 4.5 1.8 5.0 1 1 669 1 . . . . . 4.5 1.8 5.0 1 1 670 1 . . . . . 4.5 1.8 5.0 1 1 671 1 . . . . . 4.5 1.8 5.0 1 1 672 1 . . . . . 6.0 1.8 6.0 1 1 673 1 . . . . . 3.4 1.8 3.5 1 1 674 1 . . . . . 4.5 1.8 5.0 1 1 675 1 . . . . . 4.5 1.8 5.0 1 1 676 1 . . . . . 3.4 1.8 3.5 1 1 677 1 . . . . . 4.5 1.8 5.0 1 1 678 1 . . . . . 4.5 1.8 5.0 1 1 679 1 . . . . . 4.5 1.8 5.0 1 1 680 1 . . . . . 2.8 1.8 2.8 1 1 681 1 . . . . . 6.0 1.8 6.0 1 1 682 1 . . . . . 4.5 1.8 5.0 1 1 683 1 . . . . . 3.4 1.8 3.5 1 1 684 1 . . . . . 6.0 1.8 6.0 1 1 685 1 . . . . . 4.5 1.8 5.0 1 1 686 1 . . . . . 4.5 1.8 5.0 1 1 687 1 . . . . . 4.5 1.8 5.0 1 1 688 1 . . . . . 4.5 1.8 5.0 1 1 689 1 . . . . . 3.4 1.8 3.5 1 1 690 1 . . . . . 6.0 1.8 6.0 1 1 691 1 . . . . . 3.4 1.8 3.5 1 1 692 1 . . . . . 3.4 1.8 3.5 1 1 693 1 . . . . . 2.8 1.8 2.8 1 1 694 1 . . . . . 6.0 1.8 6.0 1 1 695 1 . . . . . 4.5 1.8 5.0 1 1 696 1 . . . . . 6.0 1.8 6.0 1 1 697 1 . . . . . 4.5 1.8 5.0 1 1 698 1 . . . . . 6.0 1.8 6.0 1 1 699 1 . . . . . 4.5 1.8 5.0 1 1 700 1 . . . . . 4.5 1.8 5.0 1 1 701 1 . . . . . 4.5 1.8 5.0 1 1 702 1 . . . . . 6.0 1.8 6.0 1 1 703 1 . . . . . 3.4 1.8 3.5 1 1 704 1 . . . . . 6.0 1.8 6.0 1 1 705 1 . . . . . 4.5 1.8 5.0 1 1 706 1 . . . . . 4.5 1.8 5.0 1 1 707 1 . . . . . 6.0 1.8 6.0 1 1 708 1 . . . . . 4.5 1.8 5.0 1 1 709 1 . . . . . 6.0 1.8 6.0 1 1 710 1 . . . . . 4.5 1.8 5.0 1 1 711 1 . . . . . 4.5 1.8 5.0 1 1 712 1 . . . . . 6.0 1.8 6.0 1 1 713 1 . . . . . 4.5 1.8 5.0 1 1 714 1 . . . . . 4.5 1.8 5.0 1 1 715 1 . . . . . 6.0 1.8 6.0 1 1 716 1 . . . . . 4.5 1.8 5.0 1 1 717 1 . . . . . 4.5 1.8 5.0 1 1 718 1 . . . . . 3.4 1.8 3.5 1 1 719 1 . . . . . 4.5 1.8 5.0 1 1 720 1 . . . . . 6.0 1.8 6.0 1 1 721 1 . . . . . 4.5 1.8 5.0 1 1 722 1 . . . . . 4.5 1.8 5.0 1 1 723 1 . . . . . 4.5 1.8 5.0 1 1 724 1 . . . . . 6.0 1.8 6.0 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 NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 2 2 1 . . . 1 2 3 1 . . . 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 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 19 ALA H . 19 . HN 1 2 1 1 2 1 1 45 VAL QG . 45 . HG## 1 2 2 1 1 1 1 20 LEU H . 20 . HN 1 2 2 1 2 1 1 45 VAL QG . 45 . HG## 1 2 3 1 1 1 1 9 HIS HE1 . 9 . HE1 1 2 3 1 2 1 1 45 VAL QG . 45 . HG## 1 2 4 1 1 1 1 16 VAL HA . 16 . HA 1 2 4 1 2 1 1 30 TRP HH2 . 30 . HH2 1 2 4 1 2 1 1 30 TRP HZ3 . 30 . HZ3 1 2 5 1 1 1 1 3 LYS HA . 3 . HA 1 2 5 1 2 1 1 30 TRP HH2 . 30 . HH2 1 2 5 1 2 1 1 30 TRP HZ3 . 30 . HZ3 1 2 6 1 1 1 1 27 VAL MG1 . 27 . HG1# 1 2 6 1 2 1 1 30 TRP HH2 . 30 . HH2 1 2 6 1 2 1 1 30 TRP HZ3 . 30 . HZ3 1 2 7 1 1 1 1 6 VAL MG2 . 6 . HG2# 1 2 7 1 2 1 1 30 TRP HH2 . 30 . HH2 1 2 7 1 2 1 1 30 TRP HZ3 . 30 . HZ3 1 2 8 1 1 1 1 20 LEU MD1 . 20 . HD1# 1 2 8 1 2 1 1 30 TRP HH2 . 30 . HH2 1 2 8 1 2 1 1 30 TRP HZ3 . 30 . HZ3 1 2 9 1 1 1 1 27 VAL MG2 . 27 . HG2# 1 2 9 1 1 1 1 34 ILE MD . 34 . HD1# 1 2 9 1 2 1 1 30 TRP HE3 . 30 . HE3 1 2 10 1 1 1 1 27 VAL MG2 . 27 . HG2# 1 2 10 1 1 1 1 34 ILE MD . 34 . HD1# 1 2 10 1 2 1 1 30 TRP HZ2 . 30 . HZ2 1 2 11 1 1 1 1 34 ILE HB . 34 . HB 1 2 11 1 1 1 1 34 ILE QG . 34 . HG1# 1 2 11 1 2 1 1 52 TYR QE . 52 . HE# 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 . . . . . 4.5 1.8 5.0 1 2 2 1 . . . . . 6.0 1.8 6.0 1 2 3 1 . . . . . 6.0 1.8 6.0 1 2 4 1 . . . . . 4.5 1.8 5.0 1 2 5 1 . . . . . 4.5 1.8 5.0 1 2 6 1 . . . . . 3.4 1.8 3.5 1 2 7 1 . . . . . 3.4 1.8 3.5 1 2 8 1 . . . . . 2.8 1.8 2.8 1 2 9 1 . . . . . 4.5 1.8 5.0 1 2 10 1 . . . . . 3.4 1.8 3.5 1 2 11 1 . . . . . 6.0 1.8 6.0 1 2 stop_ save_ save_CNS/XPLOR_distance_constraints_4_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 3 _Distance_constraint_list.Constraint_type 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 3 2 1 . . . 1 3 3 1 . . . 1 3 4 1 . . . 1 3 5 1 . . . 1 3 6 1 . . . 1 3 7 1 . . . 1 3 8 1 . . . 1 3 9 1 . . . 1 3 10 1 . . . 1 3 11 1 . . . 1 3 12 1 . . . 1 3 13 1 . . . 1 3 14 1 . . . 1 3 15 1 . . . 1 3 16 1 . . . 1 3 17 1 . . . 1 3 18 1 . . . 1 3 19 1 . . . 1 3 20 1 . . . 1 3 21 1 . . . 1 3 22 1 . . . 1 3 23 1 . . . 1 3 24 1 . . . 1 3 25 1 . . . 1 3 26 1 . . . 1 3 27 1 . . . 1 3 28 1 . . . 1 3 29 1 . . . 1 3 30 1 . . . 1 3 31 1 . . . 1 3 32 1 . . . 1 3 33 1 . . . 1 3 34 1 . . . 1 3 35 1 . . . 1 3 36 1 . . . 1 3 37 1 . . . 1 3 38 1 . . . 1 3 39 1 . . . 1 3 40 1 . . . 1 3 41 1 . . . 1 3 42 1 . . . 1 3 43 1 . . . 1 3 44 1 . . . 1 3 45 1 . . . 1 3 46 1 . . . 1 3 47 1 . . . 1 3 48 1 . . . 1 3 49 1 . . . 1 3 50 1 . . . 1 3 51 1 . . . 1 3 52 1 . . . 1 3 53 1 . . . 1 3 54 1 . . . 1 3 55 1 . . . 1 3 56 1 . . . 1 3 57 1 . . . 1 3 58 1 . . . 1 3 59 1 . . . 1 3 60 1 . . . 1 3 61 1 . . . 1 3 62 1 . . . 1 3 63 1 . . . 1 3 64 1 . . . 1 3 65 1 . . . 1 3 66 1 . . . 1 3 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 1 MET ME . 1 . HE# 1 3 1 1 2 1 1 43 GLU HA . 43 . HA 1 3 2 1 1 1 1 1 MET ME . 1 . HE# 1 3 2 1 2 1 1 39 ALA HA . 39 . HA 1 3 3 1 1 1 1 1 MET ME . 1 . HE# 1 3 3 1 2 1 1 50 LEU HB3 . 50 . HB1 1 3 4 1 1 1 1 1 MET ME . 1 . HE# 1 3 4 1 2 1 1 50 LEU HB2 . 50 . HB2 1 3 5 1 1 1 1 1 MET HB3 . 1 . HB1 1 3 5 1 2 1 1 34 ILE MD . 34 . HD1# 1 3 6 1 1 1 1 1 MET HB2 . 1 . HB2 1 3 6 1 2 1 1 34 ILE MD . 34 . HD1# 1 3 7 1 1 1 1 2 TYR HB3 . 2 . HB1 1 3 7 1 2 1 1 4 LYS QB . 4 . HB# 1 3 8 1 1 1 1 2 TYR HA . 2 . HA 1 3 8 1 2 1 1 34 ILE MG . 34 . HG2# 1 3 9 1 1 1 1 2 TYR HA . 2 . HA 1 3 9 1 2 1 1 33 VAL MG1 . 33 . HG1# 1 3 10 1 1 1 1 3 LYS HD3 . 3 . HD1 1 3 10 1 2 1 1 30 TRP HB3 . 30 . HB1 1 3 11 1 1 1 1 3 LYS HD3 . 3 . HD1 1 3 11 1 2 1 1 30 TRP HB2 . 30 . HB2 1 3 12 1 1 1 1 3 LYS QD . 3 . HD# 1 3 12 1 2 1 1 34 ILE MG . 34 . HG2# 1 3 13 1 1 1 1 4 LYS HA . 4 . HA 1 3 13 1 2 1 1 7 ILE MG . 7 . HG2# 1 3 14 1 1 1 1 4 LYS HA . 4 . HA 1 3 14 1 2 1 1 7 ILE HB . 7 . HB 1 3 15 1 1 1 1 5 ASP HB2 . 5 . HB2 1 3 15 1 2 1 1 50 LEU MD2 . 50 . HD2# 1 3 16 1 1 1 1 6 VAL HB . 6 . HB 1 3 16 1 2 1 1 34 ILE MD . 34 . HD1# 1 3 17 1 1 1 1 6 VAL HB . 6 . HB 1 3 17 1 2 1 1 16 VAL MG2 . 16 . HG2# 1 3 18 1 1 1 1 7 ILE MG . 7 . HG2# 1 3 18 1 2 1 1 13 GLN HA . 13 . HA 1 3 19 1 1 1 1 7 ILE QG . 7 . HG1# 1 3 19 1 2 1 1 13 GLN HA . 13 . HA 1 3 20 1 1 1 1 7 ILE MD . 7 . HD1# 1 3 20 1 2 1 1 13 GLN HA . 13 . HA 1 3 21 1 1 1 1 7 ILE MG . 7 . HG2# 1 3 21 1 2 1 1 13 GLN H . 13 . HN 1 3 22 1 1 1 1 9 HIS QB . 9 . HB# 1 3 22 1 2 1 1 50 LEU MD2 . 50 . HD2# 1 3 23 1 1 1 1 12 THR HB . 12 . HB 1 3 23 1 2 1 1 14 ARG HB3 . 14 . HB1 1 3 24 1 1 1 1 12 THR HB . 12 . HB 1 3 24 1 2 1 1 14 ARG HB2 . 14 . HB2 1 3 25 1 1 1 1 13 GLN HA . 13 . HA 1 3 25 1 2 1 1 16 VAL HB . 16 . HB 1 3 26 1 1 1 1 13 GLN HB2 . 13 . HB2 1 3 26 1 2 1 1 27 VAL MG1 . 27 . HG1# 1 3 27 1 1 1 1 14 ARG HA . 14 . HA 1 3 27 1 2 1 1 24 ASP QB . 24 . HB# 1 3 28 1 1 1 1 15 ALA MB . 15 . HB# 1 3 28 1 2 1 1 16 VAL MG2 . 16 . HG2# 1 3 29 1 1 1 1 16 VAL HA . 16 . HA 1 3 29 1 2 1 1 27 VAL MG2 . 27 . HG2# 1 3 30 1 1 1 1 16 VAL HB . 16 . HB 1 3 30 1 2 1 1 27 VAL MG1 . 27 . HG1# 1 3 31 1 1 1 1 16 VAL HB . 16 . HB 1 3 31 1 2 1 1 27 VAL MG2 . 27 . HG2# 1 3 32 1 1 1 1 16 VAL MG1 . 16 . HG1# 1 3 32 1 2 1 1 17 ALA HA . 17 . HA 1 3 33 1 1 1 1 16 VAL HA . 16 . HA 1 3 33 1 2 1 1 19 ALA MB . 19 . HB# 1 3 34 1 1 1 1 17 ALA HA . 17 . HA 1 3 34 1 2 1 1 20 LEU QB . 20 . HB# 1 3 35 1 1 1 1 17 ALA HA . 17 . HA 1 3 35 1 2 1 1 22 ILE HG12 . 22 . HG12 1 3 36 1 1 1 1 19 ALA MB . 19 . HB# 1 3 36 1 2 1 1 45 VAL HB . 45 . HB 1 3 37 1 1 1 1 20 LEU QB . 20 . HB# 1 3 37 1 2 1 1 22 ILE MD . 22 . HD1# 1 3 38 1 1 1 1 20 LEU MD1 . 20 . HD1# 1 3 38 1 2 1 1 27 VAL MG2 . 27 . HG2# 1 3 39 1 1 1 1 20 LEU MD2 . 20 . HD2# 1 3 39 1 2 1 1 38 ASP HA . 38 . HA 1 3 40 1 1 1 1 20 LEU MD2 . 20 . HD2# 1 3 40 1 2 1 1 41 ARG QG . 41 . HG# 1 3 41 1 1 1 1 20 LEU MD2 . 20 . HD2# 1 3 41 1 2 1 1 41 ARG QD . 41 . HD# 1 3 42 1 1 1 1 20 LEU MD2 . 20 . HD2# 1 3 42 1 2 1 1 42 LEU H . 42 . HN 1 3 43 1 1 1 1 22 ILE HB . 22 . HB 1 3 43 1 2 1 1 26 ALA MB . 26 . HB# 1 3 44 1 1 1 1 22 ILE MD . 22 . HD1# 1 3 44 1 2 1 1 27 VAL MG2 . 27 . HG2# 1 3 45 1 1 1 1 23 SER QB . 23 . HB# 1 3 45 1 2 1 1 24 ASP QB . 24 . HB# 1 3 46 1 1 1 1 23 SER QB . 23 . HB# 1 3 46 1 2 1 1 25 ALA MB . 25 . HB# 1 3 47 1 1 1 1 23 SER HB3 . 23 . HB1 1 3 47 1 2 1 1 26 ALA MB . 26 . HB# 1 3 48 1 1 1 1 24 ASP QB . 24 . HB# 1 3 48 1 2 1 1 27 VAL MG2 . 27 . HG2# 1 3 49 1 1 1 1 32 GLU QB . 32 . HB# 1 3 49 1 2 1 1 33 VAL MG2 . 33 . HG2# 1 3 50 1 1 1 1 33 VAL HA . 33 . HA 1 3 50 1 2 1 1 34 ILE MG . 34 . HG2# 1 3 51 1 1 1 1 34 ILE HB . 34 . HB 1 3 51 1 2 1 1 35 PRO HD3 . 35 . HD1 1 3 52 1 1 1 1 34 ILE HB . 34 . HB 1 3 52 1 2 1 1 35 PRO HD2 . 35 . HD2 1 3 53 1 1 1 1 34 ILE HB . 34 . HB 1 3 53 1 2 1 1 39 ALA MB . 39 . HB# 1 3 54 1 1 1 1 34 ILE MD . 34 . HD1# 1 3 54 1 2 1 1 35 PRO HD3 . 35 . HD1 1 3 55 1 1 1 1 35 PRO HA . 35 . HA 1 3 55 1 2 1 1 36 GLU QB . 36 . HB# 1 3 56 1 1 1 1 24 ASP HA . 24 . HA 1 3 56 1 2 1 1 27 VAL HB . 27 . HB 1 3 57 1 1 1 1 38 ASP HA . 38 . HA 1 3 57 1 2 1 1 41 ARG HD3 . 41 . HD1 1 3 58 1 1 1 1 38 ASP HA . 38 . HA 1 3 58 1 2 1 1 41 ARG HD2 . 41 . HD2 1 3 59 1 1 1 1 39 ALA MB . 39 . HB# 1 3 59 1 2 1 1 52 TYR QB . 52 . HB# 1 3 60 1 1 1 1 41 ARG HA . 41 . HA 1 3 60 1 2 1 1 44 ILE MD . 44 . HD1# 1 3 61 1 1 1 1 41 ARG HA . 41 . HA 1 3 61 1 2 1 1 44 ILE HB . 44 . HB 1 3 62 1 1 1 1 42 LEU HA . 42 . HA 1 3 62 1 2 1 1 45 VAL HB . 45 . HB 1 3 63 1 1 1 1 43 GLU QB . 43 . HB# 1 3 63 1 2 1 1 52 TYR H . 52 . HN 1 3 64 1 1 1 1 46 THR HB . 46 . HB 1 3 64 1 2 1 1 49 ALA MB . 49 . HB# 1 3 65 1 1 1 1 52 TYR HA . 52 . HA 1 3 65 1 2 1 1 53 GLN QG . 53 . HG# 1 3 66 1 1 1 1 53 GLN HA . 53 . HA 1 3 66 1 2 1 1 54 GLU QG . 54 . HG# 1 3 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 4.5 1.8 5.0 1 3 2 1 . . . . . 4.5 1.8 5.0 1 3 3 1 . . . . . 4.5 1.8 5.0 1 3 4 1 . . . . . 4.5 1.8 5.0 1 3 5 1 . . . . . 4.5 1.8 5.0 1 3 6 1 . . . . . 4.5 1.8 5.0 1 3 7 1 . . . . . 4.5 1.8 5.0 1 3 8 1 . . . . . 4.5 1.8 5.0 1 3 9 1 . . . . . 4.5 1.8 5.0 1 3 10 1 . . . . . 4.5 1.8 5.0 1 3 11 1 . . . . . 4.5 1.8 5.0 1 3 12 1 . . . . . 4.5 1.8 5.0 1 3 13 1 . . . . . 4.5 1.8 5.0 1 3 14 1 . . . . . 4.5 1.8 5.0 1 3 15 1 . . . . . 4.5 1.8 5.0 1 3 16 1 . . . . . 4.5 1.8 5.0 1 3 17 1 . . . . . 4.5 1.8 5.0 1 3 18 1 . . . . . 4.5 1.8 5.0 1 3 19 1 . . . . . 4.5 1.8 5.0 1 3 20 1 . . . . . 4.5 1.8 5.0 1 3 21 1 . . . . . 4.5 1.8 5.0 1 3 22 1 . . . . . 4.5 1.8 5.0 1 3 23 1 . . . . . 4.5 1.8 5.0 1 3 24 1 . . . . . 4.5 1.8 5.0 1 3 25 1 . . . . . 4.5 1.8 5.0 1 3 26 1 . . . . . 4.5 1.8 5.0 1 3 27 1 . . . . . 4.5 1.8 5.0 1 3 28 1 . . . . . 4.5 1.8 5.0 1 3 29 1 . . . . . 4.5 1.8 5.0 1 3 30 1 . . . . . 4.5 1.8 5.0 1 3 31 1 . . . . . 4.5 1.8 5.0 1 3 32 1 . . . . . 4.5 1.8 5.0 1 3 33 1 . . . . . 4.5 1.8 5.0 1 3 34 1 . . . . . 4.5 1.8 5.0 1 3 35 1 . . . . . 4.5 1.8 5.0 1 3 36 1 . . . . . 4.5 1.8 5.0 1 3 37 1 . . . . . 4.5 1.8 5.0 1 3 38 1 . . . . . 4.5 1.8 5.0 1 3 39 1 . . . . . 4.5 1.8 5.0 1 3 40 1 . . . . . 4.5 1.8 5.0 1 3 41 1 . . . . . 4.5 1.8 5.0 1 3 42 1 . . . . . 4.5 1.8 5.0 1 3 43 1 . . . . . 4.5 1.8 5.0 1 3 44 1 . . . . . 4.5 1.8 5.0 1 3 45 1 . . . . . 4.5 1.8 5.0 1 3 46 1 . . . . . 4.5 1.8 5.0 1 3 47 1 . . . . . 6.0 1.8 6.0 1 3 48 1 . . . . . 4.5 1.8 5.0 1 3 49 1 . . . . . 4.5 1.8 5.0 1 3 50 1 . . . . . 4.5 1.8 5.0 1 3 51 1 . . . . . 4.5 1.8 5.0 1 3 52 1 . . . . . 4.5 1.8 5.0 1 3 53 1 . . . . . 4.5 1.8 5.0 1 3 54 1 . . . . . 6.0 1.8 6.0 1 3 55 1 . . . . . 4.5 1.8 5.0 1 3 56 1 . . . . . 4.5 1.8 5.0 1 3 57 1 . . . . . 4.5 1.8 5.0 1 3 58 1 . . . . . 4.5 1.8 5.0 1 3 59 1 . . . . . 4.5 1.8 5.0 1 3 60 1 . . . . . 4.5 1.8 5.0 1 3 61 1 . . . . . 4.5 1.8 5.0 1 3 62 1 . . . . . 4.5 1.8 5.0 1 3 63 1 . . . . . 4.5 1.8 5.0 1 3 64 1 . . . . . 4.5 1.8 5.0 1 3 65 1 . . . . . 4.5 1.8 5.0 1 3 66 1 . . . . . 4.5 1.8 5.0 1 3 stop_ save_ save_CNS/XPLOR_distance_constraints_5_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 4 _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 4 2 1 . . . 1 4 3 1 . . . 1 4 4 1 . . . 1 4 5 1 . . . 1 4 6 1 . . . 1 4 7 1 . . . 1 4 8 1 . . . 1 4 9 1 . . . 1 4 10 1 . . . 1 4 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 14 ARG H . 14 . HN 1 4 1 1 2 1 1 15 ALA H . 15 . HN 1 4 2 1 1 1 1 33 VAL HA . 33 . HA 1 4 2 1 2 1 1 34 ILE H . 34 . HN 1 4 3 1 1 1 1 1 MET ME . 1 . HE# 1 4 3 1 2 1 1 50 LEU H . 50 . HN 1 4 4 1 1 1 1 51 LYS QE . 51 . HE# 1 4 4 1 2 1 1 53 GLN QE . 53 . HE2# 1 4 5 1 1 1 1 51 LYS QG . 51 . HG# 1 4 5 1 2 1 1 53 GLN QE . 53 . HE2# 1 4 6 1 1 1 1 27 VAL HB . 27 . HB 1 4 6 1 2 1 1 28 SER H . 28 . HN 1 4 7 1 1 1 1 13 GLN QE . 13 . HE2# 1 4 7 1 2 1 1 24 ASP QB . 24 . HB# 1 4 8 1 1 1 1 16 VAL HA . 16 . HA 1 4 8 1 2 1 1 20 LEU H . 20 . HN 1 4 9 1 1 1 1 13 GLN HE21 . 13 . HE21 1 4 9 1 2 1 1 28 SER HA . 28 . HA 1 4 10 1 1 1 1 19 ALA HA . 19 . HA 1 4 10 1 2 1 1 20 LEU H . 20 . HN 1 4 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 . . . . . 4.5 1.8 5.0 1 4 2 1 . . . . . 4.5 1.8 5.0 1 4 3 1 . . . . . 4.5 1.8 5.0 1 4 4 1 . . . . . 4.5 1.8 5.0 1 4 5 1 . . . . . 4.5 1.8 5.0 1 4 6 1 . . . . . 4.5 1.8 5.0 1 4 7 1 . . . . . 4.5 1.8 5.0 1 4 8 1 . . . . . 4.5 1.8 5.0 1 4 9 1 . . . . . 4.5 1.8 5.0 1 4 10 1 . . . . . 4.5 1.8 5.0 1 4 stop_ save_ save_CNS/XPLOR_distance_constraints_6_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 5 _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 5 2 1 . . . 1 5 3 1 . . . 1 5 4 1 . . . 1 5 5 1 . . . 1 5 6 1 . . . 1 5 7 1 . . . 1 5 8 1 . . . 1 5 9 1 . . . 1 5 10 1 . . . 1 5 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 O . 3 . O 1 5 1 1 2 1 1 7 ILE H . 7 . HN 1 5 2 1 1 1 1 3 LYS O . 3 . O 1 5 2 1 2 1 1 7 ILE N . 7 . N 1 5 3 1 1 1 1 13 GLN O . 13 . O 1 5 3 1 2 1 1 16 VAL H . 16 . HN 1 5 4 1 1 1 1 13 GLN O . 13 . O 1 5 4 1 2 1 1 16 VAL N . 16 . N 1 5 5 1 1 1 1 41 ARG O . 41 . O 1 5 5 1 2 1 1 45 VAL H . 45 . HN 1 5 6 1 1 1 1 41 ARG O . 41 . O 1 5 6 1 2 1 1 45 VAL N . 45 . N 1 5 7 1 1 1 1 1 MET O . 1 . O 1 5 7 1 2 1 1 34 ILE H . 34 . HN 1 5 8 1 1 1 1 1 MET O . 1 . O 1 5 8 1 2 1 1 34 ILE N . 34 . N 1 5 9 1 1 1 1 30 TRP HE1 . 30 . HE1 1 5 9 1 2 1 1 38 ASP OD2 . 38 . OD2 1 5 10 1 1 1 1 30 TRP NE1 . 30 . NE1 1 5 10 1 2 1 1 38 ASP OD2 . 38 . OD2 1 5 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 2.0 1.5 2.3 1 5 2 1 . . . . . 3.0 2.4 3.3 1 5 3 1 . . . . . 2.0 1.5 2.3 1 5 4 1 . . . . . 3.0 2.4 3.3 1 5 5 1 . . . . . 2.0 1.5 2.3 1 5 6 1 . . . . . 3.0 2.4 3.3 1 5 7 1 . . . . . 2.0 1.5 2.3 1 5 8 1 . . . . . 3.0 2.4 3.3 1 5 9 1 . . . . . 2.0 1.5 2.3 1 5 10 1 . . . . . 3.0 2.4 3.3 1 5 stop_ save_ save_CNS/XPLOR_dihedral_7 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID 1 _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID . _Torsion_angle_constraint_list.Block_ID . loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 . 1 1 2 TYR C 1 1 3 LYS N 1 1 3 LYS CA 1 1 3 LYS C -89.99999 -40.0 . 2 . C . 3 . N . 3 . CA . 3 . C 1 1 2 . 1 1 3 LYS C 1 1 4 LYS N 1 1 4 LYS CA 1 1 4 LYS C -89.99999 -40.0 . 3 . C . 4 . N . 4 . CA . 4 . C 1 1 3 . 1 1 6 VAL C 1 1 7 ILE N 1 1 7 ILE CA 1 1 7 ILE C -89.99999 -40.0 . 6 . C . 7 . N . 7 . CA . 7 . C 1 1 4 . 1 1 7 ILE C 1 1 8 ASP N 1 1 8 ASP CA 1 1 8 ASP C -89.99999 -40.0 . 7 . C . 8 . N . 8 . CA . 8 . C 1 1 5 . 1 1 8 ASP C 1 1 9 HIS N 1 1 9 HIS CA 1 1 9 HIS C -89.99999 -40.0 . 8 . C . 9 . N . 9 . CA . 9 . C 1 1 6 . 1 1 9 HIS C 1 1 10 PHE N 1 1 10 PHE CA 1 1 10 PHE C -160.0 -80.0 . 9 . C . 10 . N . 10 . CA . 10 . C 1 1 7 . 1 1 11 GLY C 1 1 12 THR N 1 1 12 THR CA 1 1 12 THR C -160.0 -80.0 . 11 . C . 12 . N . 12 . CA . 12 . C 1 1 8 . 1 1 12 THR C 1 1 13 GLN N 1 1 13 GLN CA 1 1 13 GLN C -89.99999 -40.0 . 12 . C . 13 . N . 13 . CA . 13 . C 1 1 9 . 1 1 13 GLN C 1 1 14 ARG N 1 1 14 ARG CA 1 1 14 ARG C -89.99999 -40.0 . 13 . C . 14 . N . 14 . CA . 14 . C 1 1 10 . 1 1 15 ALA C 1 1 16 VAL N 1 1 16 VAL CA 1 1 16 VAL C -89.99999 -40.0 . 15 . C . 16 . N . 16 . CA . 16 . C 1 1 11 . 1 1 16 VAL C 1 1 17 ALA N 1 1 17 ALA CA 1 1 17 ALA C -89.99999 -40.0 . 16 . C . 17 . N . 17 . CA . 17 . C 1 1 12 . 1 1 17 ALA C 1 1 18 LYS N 1 1 18 LYS CA 1 1 18 LYS C -89.99999 -40.0 . 17 . C . 18 . N . 18 . CA . 18 . C 1 1 13 . 1 1 19 ALA C 1 1 20 LEU N 1 1 20 LEU CA 1 1 20 LEU C -160.0 -80.0 . 19 . C . 20 . N . 20 . CA . 20 . C 1 1 14 . 1 1 21 GLY C 1 1 22 ILE N 1 1 22 ILE CA 1 1 22 ILE C -160.0 -80.0 . 21 . C . 22 . N . 22 . CA . 22 . C 1 1 15 . 1 1 23 SER C 1 1 24 ASP N 1 1 24 ASP CA 1 1 24 ASP C -89.99999 -40.0 . 23 . C . 24 . N . 24 . CA . 24 . C 1 1 16 . 1 1 24 ASP C 1 1 25 ALA N 1 1 25 ALA CA 1 1 25 ALA C -89.99999 -40.0 . 24 . C . 25 . N . 25 . CA . 25 . C 1 1 17 . 1 1 25 ALA C 1 1 26 ALA N 1 1 26 ALA CA 1 1 26 ALA C -89.99999 -40.0 . 25 . C . 26 . N . 26 . CA . 26 . C 1 1 18 . 1 1 27 VAL C 1 1 28 SER N 1 1 28 SER CA 1 1 28 SER C -89.99999 -40.0 . 27 . C . 28 . N . 28 . CA . 28 . C 1 1 19 . 1 1 30 TRP C 1 1 31 LYS N 1 1 31 LYS CA 1 1 31 LYS C -160.0 -80.0 . 30 . C . 31 . N . 31 . CA . 31 . C 1 1 20 . 1 1 31 LYS C 1 1 32 GLU N 1 1 32 GLU CA 1 1 32 GLU C -89.99999 -40.0 . 31 . C . 32 . N . 32 . CA . 32 . C 1 1 21 . 1 1 32 GLU C 1 1 33 VAL N 1 1 33 VAL CA 1 1 33 VAL C -160.0 -80.0 . 32 . C . 33 . N . 33 . CA . 33 . C 1 1 22 . 1 1 35 PRO C 1 1 36 GLU N 1 1 36 GLU CA 1 1 36 GLU C -89.99999 -40.0 . 35 . C . 36 . N . 36 . CA . 36 . C 1 1 23 . 1 1 36 GLU C 1 1 37 LYS N 1 1 37 LYS CA 1 1 37 LYS C -89.99999 -40.0 . 36 . C . 37 . N . 37 . CA . 37 . C 1 1 24 . 1 1 37 LYS C 1 1 38 ASP N 1 1 38 ASP CA 1 1 38 ASP C -160.0 -80.0 . 37 . C . 38 . N . 38 . CA . 38 . C 1 1 25 . 1 1 38 ASP C 1 1 39 ALA N 1 1 39 ALA CA 1 1 39 ALA C -89.99999 -40.0 . 38 . C . 39 . N . 39 . CA . 39 . C 1 1 26 . 1 1 39 ALA C 1 1 40 TYR N 1 1 40 TYR CA 1 1 40 TYR C -89.99999 -40.0 . 39 . C . 40 . N . 40 . CA . 40 . C 1 1 27 . 1 1 40 TYR C 1 1 41 ARG N 1 1 41 ARG CA 1 1 41 ARG C -89.99999 -40.0 . 40 . C . 41 . N . 41 . CA . 41 . C 1 1 28 . 1 1 41 ARG C 1 1 42 LEU N 1 1 42 LEU CA 1 1 42 LEU C -89.99999 -40.0 . 41 . C . 42 . N . 42 . CA . 42 . C 1 1 29 . 1 1 42 LEU C 1 1 43 GLU N 1 1 43 GLU CA 1 1 43 GLU C -89.99999 -40.0 . 42 . C . 43 . N . 43 . CA . 43 . C 1 1 30 . 1 1 44 ILE C 1 1 45 VAL N 1 1 45 VAL CA 1 1 45 VAL C -89.99999 -40.0 . 44 . C . 45 . N . 45 . CA . 45 . C 1 1 31 . 1 1 45 VAL C 1 1 46 THR N 1 1 46 THR CA 1 1 46 THR C -160.0 -80.0 . 45 . C . 46 . N . 46 . CA . 46 . C 1 1 32 . 1 1 48 GLY C 1 1 49 ALA N 1 1 49 ALA CA 1 1 49 ALA C -89.99999 -40.0 . 48 . C . 49 . N . 49 . CA . 49 . C 1 1 33 . 1 1 49 ALA C 1 1 50 LEU N 1 1 50 LEU CA 1 1 50 LEU C -160.0 -80.0 . 49 . C . 50 . N . 50 . CA . 50 . C 1 1 34 . 1 1 50 LEU C 1 1 51 LYS N 1 1 51 LYS CA 1 1 51 LYS C -160.0 -80.0 . 50 . C . 51 . N . 51 . CA . 51 . C 1 1 35 . 1 1 52 TYR C 1 1 53 GLN N 1 1 53 GLN CA 1 1 53 GLN C -160.0 -80.0 . 52 . C . 53 . N . 53 . CA . 53 . C 1 1 36 . 1 1 53 GLN C 1 1 54 GLU N 1 1 54 GLU CA 1 1 54 GLU C -89.99999 -40.0 . 53 . C . 54 . N . 54 . CA . 54 . C 1 1 37 . 1 1 54 GLU C 1 1 55 ASN N 1 1 55 ASN CA 1 1 55 ASN C -89.99999 -40.0 . 54 . C . 55 . N . 55 . CA . 55 . C 1 1 38 . 1 1 56 ALA C 1 1 57 TYR N 1 1 57 TYR CA 1 1 57 TYR C -160.0 -80.0 . 56 . C . 57 . N . 57 . CA . 57 . C 1 1 39 . 1 1 57 TYR C 1 1 58 ARG N 1 1 58 ARG CA 1 1 58 ARG C -160.0 -80.0 . 57 . C . 58 . N . 58 . CA . 58 . C 1 1 40 . 1 1 58 ARG C 1 1 59 GLN N 1 1 59 GLN CA 1 1 59 GLN C -160.0 -80.0 . 58 . C . 59 . N . 59 . CA . 59 . C 1 1 41 . 1 1 60 ALA C 1 1 61 ALA N 1 1 61 ALA CA 1 1 61 ALA C -160.0 -80.0 . 60 . C . 61 . N . 61 . CA . 61 . C 1 1 42 . 1 1 3 LYS N 1 1 3 LYS CA 1 1 3 LYS CB 1 1 3 LYS CG 140.0 220.0 . 3 . N . 3 . CA . 3 . CB . 3 . CG 1 1 43 . 1 1 9 HIS N 1 1 9 HIS CA 1 1 9 HIS CB 1 1 9 HIS CG 140.0 220.0 . 9 . N . 9 . CA . 9 . CB . 9 . CG 1 1 44 . 1 1 36 GLU N 1 1 36 GLU CA 1 1 36 GLU CB 1 1 36 GLU CG 140.0 220.0 . 36 . N . 36 . CA . 36 . CB . 36 . CG 1 1 45 . 1 1 52 TYR N 1 1 52 TYR CA 1 1 52 TYR CB 1 1 52 TYR CG 140.0 220.0 . 52 . N . 52 . CA . 52 . CB . 52 . CG 1 1 46 . 1 1 22 ILE N 1 1 22 ILE CA 1 1 22 ILE CB 1 1 22 ILE CG1 20.0 100.0 . 22 . N . 22 . CA . 22 . CB . 22 . CG1 1 1 stop_ save_ save_conformer_family_coord_set_1 _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Entry_ID 1 _Conformer_family_coord_set.ID 1 loop_ _Atom_site.Model_ID _Atom_site.ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Occupancy _Atom_site.Uncertainty _Atom_site.PDBX_label_asym_ID _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID 1 1 1 1 1 MET C C -5.018 6.311 -1.041 1.00 . A A . 1 MET C 1 1 1 2 1 1 1 MET CA C -4.219 7.172 -0.069 1.00 . A A . 1 MET CA 1 1 1 3 1 1 1 MET CB C -3.442 6.288 0.910 1.00 . A A . 1 MET CB 1 1 1 4 1 1 1 MET CE C -0.599 7.146 3.089 1.00 . A A . 1 MET CE 1 1 1 5 1 1 1 MET CG C -1.933 6.412 0.774 1.00 . A A . 1 MET CG 1 1 1 6 1 1 1 MET H1 H -5.401 8.848 0.083 1.00 . A A . 1 MET H1 1 1 1 7 1 1 1 MET H2 H -4.570 8.425 1.525 1.00 . A A . 1 MET H2 1 1 1 8 1 1 1 MET H3 H -5.932 7.513 1.017 1.00 . A A . 1 MET H3 1 1 1 9 1 1 1 MET HA H -3.522 7.779 -0.628 1.00 . A A . 1 MET HA 1 1 1 10 1 1 1 MET HB2 H -3.716 6.561 1.919 1.00 . A A . 1 MET HB2 1 1 1 11 1 1 1 MET HB3 H -3.713 5.255 0.741 1.00 . A A . 1 MET HB3 1 1 1 12 1 1 1 MET HE1 H -0.293 7.923 2.404 1.00 . A A . 1 MET HE1 1 1 1 13 1 1 1 MET HE2 H 0.219 6.912 3.756 1.00 . A A . 1 MET HE2 1 1 1 14 1 1 1 MET HE3 H -1.448 7.484 3.663 1.00 . A A . 1 MET HE3 1 1 1 15 1 1 1 MET HG2 H -1.625 5.913 -0.131 1.00 . A A . 1 MET HG2 1 1 1 16 1 1 1 MET HG3 H -1.676 7.459 0.714 1.00 . A A . 1 MET HG3 1 1 1 17 1 1 1 MET N N -5.111 8.071 0.709 1.00 . A A . 1 MET N 1 1 1 18 1 1 1 MET O O -5.801 5.454 -0.630 1.00 . A A . 1 MET O 1 1 1 19 1 1 1 MET SD S -1.049 5.678 2.166 1.00 . A A . 1 MET SD 1 1 1 20 1 1 2 TYR C C -4.774 4.496 -3.691 1.00 . A A . 2 TYR C 1 1 1 21 1 1 2 TYR CA C -5.514 5.790 -3.366 1.00 . A A . 2 TYR CA 1 1 1 22 1 1 2 TYR CB C -5.668 6.638 -4.630 1.00 . A A . 2 TYR CB 1 1 1 23 1 1 2 TYR CD1 C -7.554 8.079 -3.772 1.00 . A A . 2 TYR CD1 1 1 1 24 1 1 2 TYR CD2 C -7.803 7.056 -5.912 1.00 . A A . 2 TYR CD2 1 1 1 25 1 1 2 TYR CE1 C -8.804 8.659 -3.899 1.00 . A A . 2 TYR CE1 1 1 1 26 1 1 2 TYR CE2 C -9.051 7.633 -6.046 1.00 . A A . 2 TYR CE2 1 1 1 27 1 1 2 TYR CG C -7.034 7.270 -4.773 1.00 . A A . 2 TYR CG 1 1 1 28 1 1 2 TYR CZ C -9.548 8.433 -5.037 1.00 . A A . 2 TYR CZ 1 1 1 29 1 1 2 TYR H H -4.177 7.239 -2.599 1.00 . A A . 2 TYR H 1 1 1 30 1 1 2 TYR HA H -6.494 5.544 -2.988 1.00 . A A . 2 TYR HA 1 1 1 31 1 1 2 TYR HB2 H -4.936 7.432 -4.613 1.00 . A A . 2 TYR HB2 1 1 1 32 1 1 2 TYR HB3 H -5.495 6.017 -5.497 1.00 . A A . 2 TYR HB3 1 1 1 33 1 1 2 TYR HD1 H -6.969 8.255 -2.882 1.00 . A A . 2 TYR HD1 1 1 1 34 1 1 2 TYR HD2 H -7.412 6.429 -6.699 1.00 . A A . 2 TYR HD2 1 1 1 35 1 1 2 TYR HE1 H -9.190 9.285 -3.109 1.00 . A A . 2 TYR HE1 1 1 1 36 1 1 2 TYR HE2 H -9.635 7.456 -6.938 1.00 . A A . 2 TYR HE2 1 1 1 37 1 1 2 TYR HH H -10.690 9.893 -5.528 1.00 . A A . 2 TYR HH 1 1 1 38 1 1 2 TYR N N -4.814 6.543 -2.334 1.00 . A A . 2 TYR N 1 1 1 39 1 1 2 TYR O O -3.547 4.477 -3.781 1.00 . A A . 2 TYR O 1 1 1 40 1 1 2 TYR OH O -10.790 9.008 -5.168 1.00 . A A . 2 TYR OH 1 1 1 41 1 1 3 LYS C C -4.150 2.178 -5.480 1.00 . A A . 3 LYS C 1 1 1 42 1 1 3 LYS CA C -4.945 2.118 -4.180 1.00 . A A . 3 LYS CA 1 1 1 43 1 1 3 LYS CB C -6.042 1.057 -4.288 1.00 . A A . 3 LYS CB 1 1 1 44 1 1 3 LYS CD C -5.586 -1.285 -5.084 1.00 . A A . 3 LYS CD 1 1 1 45 1 1 3 LYS CE C -6.975 -1.849 -5.337 1.00 . A A . 3 LYS CE 1 1 1 46 1 1 3 LYS CG C -5.579 -0.337 -3.895 1.00 . A A . 3 LYS CG 1 1 1 47 1 1 3 LYS H H -6.502 3.496 -3.780 1.00 . A A . 3 LYS H 1 1 1 48 1 1 3 LYS HA H -4.277 1.852 -3.375 1.00 . A A . 3 LYS HA 1 1 1 49 1 1 3 LYS HB2 H -6.862 1.336 -3.643 1.00 . A A . 3 LYS HB2 1 1 1 50 1 1 3 LYS HB3 H -6.394 1.024 -5.308 1.00 . A A . 3 LYS HB3 1 1 1 51 1 1 3 LYS HD2 H -5.262 -0.748 -5.962 1.00 . A A . 3 LYS HD2 1 1 1 52 1 1 3 LYS HD3 H -4.907 -2.100 -4.886 1.00 . A A . 3 LYS HD3 1 1 1 53 1 1 3 LYS HE2 H -7.031 -2.839 -4.910 1.00 . A A . 3 LYS HE2 1 1 1 54 1 1 3 LYS HE3 H -7.702 -1.211 -4.858 1.00 . A A . 3 LYS HE3 1 1 1 55 1 1 3 LYS HG2 H -4.573 -0.275 -3.505 1.00 . A A . 3 LYS HG2 1 1 1 56 1 1 3 LYS HG3 H -6.239 -0.723 -3.134 1.00 . A A . 3 LYS HG3 1 1 1 57 1 1 3 LYS HZ1 H -8.144 -2.498 -6.943 1.00 . A A . 3 LYS HZ1 1 1 1 58 1 1 3 LYS HZ2 H -6.495 -2.374 -7.300 1.00 . A A . 3 LYS HZ2 1 1 1 59 1 1 3 LYS HZ3 H -7.440 -0.976 -7.177 1.00 . A A . 3 LYS HZ3 1 1 1 60 1 1 3 LYS N N -5.529 3.417 -3.865 1.00 . A A . 3 LYS N 1 1 1 61 1 1 3 LYS NZ N -7.286 -1.930 -6.791 1.00 . A A . 3 LYS NZ 1 1 1 62 1 1 3 LYS O O -3.160 1.465 -5.647 1.00 . A A . 3 LYS O 1 1 1 63 1 1 4 LYS C C -2.474 3.650 -7.487 1.00 . A A . 4 LYS C 1 1 1 64 1 1 4 LYS CA C -3.914 3.188 -7.682 1.00 . A A . 4 LYS CA 1 1 1 65 1 1 4 LYS CB C -4.669 4.187 -8.562 1.00 . A A . 4 LYS CB 1 1 1 66 1 1 4 LYS CD C -3.599 5.711 -10.256 1.00 . A A . 4 LYS CD 1 1 1 67 1 1 4 LYS CE C -4.559 6.478 -11.151 1.00 . A A . 4 LYS CE 1 1 1 68 1 1 4 LYS CG C -4.106 4.305 -9.970 1.00 . A A . 4 LYS CG 1 1 1 69 1 1 4 LYS H H -5.381 3.576 -6.206 1.00 . A A . 4 LYS H 1 1 1 70 1 1 4 LYS HA H -3.909 2.225 -8.170 1.00 . A A . 4 LYS HA 1 1 1 71 1 1 4 LYS HB2 H -5.701 3.876 -8.635 1.00 . A A . 4 LYS HB2 1 1 1 72 1 1 4 LYS HB3 H -4.628 5.161 -8.096 1.00 . A A . 4 LYS HB3 1 1 1 73 1 1 4 LYS HD2 H -3.491 6.243 -9.323 1.00 . A A . 4 LYS HD2 1 1 1 74 1 1 4 LYS HD3 H -2.639 5.643 -10.747 1.00 . A A . 4 LYS HD3 1 1 1 75 1 1 4 LYS HE2 H -4.263 7.517 -11.168 1.00 . A A . 4 LYS HE2 1 1 1 76 1 1 4 LYS HE3 H -4.500 6.072 -12.151 1.00 . A A . 4 LYS HE3 1 1 1 77 1 1 4 LYS HG2 H -3.286 3.610 -10.077 1.00 . A A . 4 LYS HG2 1 1 1 78 1 1 4 LYS HG3 H -4.882 4.060 -10.678 1.00 . A A . 4 LYS HG3 1 1 1 79 1 1 4 LYS HZ1 H -6.525 5.789 -11.316 1.00 . A A . 4 LYS HZ1 1 1 1 80 1 1 4 LYS HZ2 H -6.395 7.328 -10.632 1.00 . A A . 4 LYS HZ2 1 1 1 81 1 1 4 LYS HZ3 H -5.993 5.963 -9.719 1.00 . A A . 4 LYS HZ3 1 1 1 82 1 1 4 LYS N N -4.587 3.035 -6.398 1.00 . A A . 4 LYS N 1 1 1 83 1 1 4 LYS NZ N -5.966 6.384 -10.671 1.00 . A A . 4 LYS NZ 1 1 1 84 1 1 4 LYS O O -1.590 3.305 -8.271 1.00 . A A . 4 LYS O 1 1 1 85 1 1 5 ASP C C -0.065 3.872 -5.449 1.00 . A A . 5 ASP C 1 1 1 86 1 1 5 ASP CA C -0.914 4.940 -6.135 1.00 . A A . 5 ASP CA 1 1 1 87 1 1 5 ASP CB C -1.008 6.181 -5.247 1.00 . A A . 5 ASP CB 1 1 1 88 1 1 5 ASP CG C -1.911 7.247 -5.836 1.00 . A A . 5 ASP CG 1 1 1 89 1 1 5 ASP H H -2.993 4.669 -5.848 1.00 . A A . 5 ASP H 1 1 1 90 1 1 5 ASP HA H -0.444 5.210 -7.070 1.00 . A A . 5 ASP HA 1 1 1 91 1 1 5 ASP HB2 H -1.400 5.898 -4.282 1.00 . A A . 5 ASP HB2 1 1 1 92 1 1 5 ASP HB3 H -0.022 6.601 -5.120 1.00 . A A . 5 ASP HB3 1 1 1 93 1 1 5 ASP N N -2.246 4.430 -6.435 1.00 . A A . 5 ASP N 1 1 1 94 1 1 5 ASP O O 1.095 3.666 -5.804 1.00 . A A . 5 ASP O 1 1 1 95 1 1 5 ASP OD1 O -1.788 7.527 -7.048 1.00 . A A . 5 ASP OD1 1 1 1 96 1 1 5 ASP OD2 O -2.742 7.803 -5.087 1.00 . A A . 5 ASP OD2 1 1 1 97 1 1 6 VAL C C 0.562 1.073 -4.667 1.00 . A A . 6 VAL C 1 1 1 98 1 1 6 VAL CA C 0.036 2.156 -3.729 1.00 . A A . 6 VAL CA 1 1 1 99 1 1 6 VAL CB C -0.892 1.510 -2.685 1.00 . A A . 6 VAL CB 1 1 1 100 1 1 6 VAL CG1 C -0.075 0.783 -1.643 1.00 . A A . 6 VAL CG1 1 1 1 101 1 1 6 VAL CG2 C -1.788 2.551 -2.026 1.00 . A A . 6 VAL CG2 1 1 1 102 1 1 6 VAL H H -1.577 3.405 -4.227 1.00 . A A . 6 VAL H 1 1 1 103 1 1 6 VAL HA H 0.870 2.607 -3.211 1.00 . A A . 6 VAL HA 1 1 1 104 1 1 6 VAL HB H -1.521 0.791 -3.187 1.00 . A A . 6 VAL HB 1 1 1 105 1 1 6 VAL HG11 H -0.734 0.253 -0.975 1.00 . A A . 6 VAL HG11 1 1 1 106 1 1 6 VAL HG12 H 0.505 1.502 -1.087 1.00 . A A . 6 VAL HG12 1 1 1 107 1 1 6 VAL HG13 H 0.586 0.086 -2.131 1.00 . A A . 6 VAL HG13 1 1 1 108 1 1 6 VAL HG21 H -2.137 2.174 -1.075 1.00 . A A . 6 VAL HG21 1 1 1 109 1 1 6 VAL HG22 H -2.634 2.754 -2.664 1.00 . A A . 6 VAL HG22 1 1 1 110 1 1 6 VAL HG23 H -1.228 3.460 -1.869 1.00 . A A . 6 VAL HG23 1 1 1 111 1 1 6 VAL N N -0.654 3.198 -4.466 1.00 . A A . 6 VAL N 1 1 1 112 1 1 6 VAL O O 1.737 0.712 -4.618 1.00 . A A . 6 VAL O 1 1 1 113 1 1 7 ILE C C 1.176 -0.013 -7.392 1.00 . A A . 7 ILE C 1 1 1 114 1 1 7 ILE CA C 0.053 -0.483 -6.470 1.00 . A A . 7 ILE CA 1 1 1 115 1 1 7 ILE CB C -1.159 -0.921 -7.320 1.00 . A A . 7 ILE CB 1 1 1 116 1 1 7 ILE CD1 C -3.418 -2.091 -7.200 1.00 . A A . 7 ILE CD1 1 1 1 117 1 1 7 ILE CG1 C -2.208 -1.599 -6.435 1.00 . A A . 7 ILE CG1 1 1 1 118 1 1 7 ILE CG2 C -0.723 -1.852 -8.442 1.00 . A A . 7 ILE CG2 1 1 1 119 1 1 7 ILE H H -1.241 0.889 -5.510 1.00 . A A . 7 ILE H 1 1 1 120 1 1 7 ILE HA H 0.399 -1.337 -5.907 1.00 . A A . 7 ILE HA 1 1 1 121 1 1 7 ILE HB H -1.594 -0.040 -7.767 1.00 . A A . 7 ILE HB 1 1 1 122 1 1 7 ILE HD11 H -3.096 -2.600 -8.096 1.00 . A A . 7 ILE HD11 1 1 1 123 1 1 7 ILE HD12 H -4.043 -1.252 -7.466 1.00 . A A . 7 ILE HD12 1 1 1 124 1 1 7 ILE HD13 H -3.981 -2.776 -6.581 1.00 . A A . 7 ILE HD13 1 1 1 125 1 1 7 ILE HG12 H -1.760 -2.449 -5.943 1.00 . A A . 7 ILE HG12 1 1 1 126 1 1 7 ILE HG13 H -2.550 -0.896 -5.689 1.00 . A A . 7 ILE HG13 1 1 1 127 1 1 7 ILE HG21 H -1.590 -2.182 -8.995 1.00 . A A . 7 ILE HG21 1 1 1 128 1 1 7 ILE HG22 H -0.215 -2.708 -8.022 1.00 . A A . 7 ILE HG22 1 1 1 129 1 1 7 ILE HG23 H -0.051 -1.325 -9.105 1.00 . A A . 7 ILE HG23 1 1 1 130 1 1 7 ILE N N -0.319 0.558 -5.520 1.00 . A A . 7 ILE N 1 1 1 131 1 1 7 ILE O O 1.981 -0.814 -7.864 1.00 . A A . 7 ILE O 1 1 1 132 1 1 8 ASP C C 3.578 1.955 -7.765 1.00 . A A . 8 ASP C 1 1 1 133 1 1 8 ASP CA C 2.249 1.864 -8.504 1.00 . A A . 8 ASP CA 1 1 1 134 1 1 8 ASP CB C 1.821 3.253 -8.990 1.00 . A A . 8 ASP CB 1 1 1 135 1 1 8 ASP CG C 1.874 3.377 -10.500 1.00 . A A . 8 ASP CG 1 1 1 136 1 1 8 ASP H H 0.560 1.880 -7.237 1.00 . A A . 8 ASP H 1 1 1 137 1 1 8 ASP HA H 2.368 1.213 -9.357 1.00 . A A . 8 ASP HA 1 1 1 138 1 1 8 ASP HB2 H 0.808 3.442 -8.668 1.00 . A A . 8 ASP HB2 1 1 1 139 1 1 8 ASP HB3 H 2.476 3.996 -8.561 1.00 . A A . 8 ASP HB3 1 1 1 140 1 1 8 ASP N N 1.225 1.291 -7.644 1.00 . A A . 8 ASP N 1 1 1 141 1 1 8 ASP O O 4.645 1.941 -8.377 1.00 . A A . 8 ASP O 1 1 1 142 1 1 8 ASP OD1 O 2.765 2.755 -11.116 1.00 . A A . 8 ASP OD1 1 1 1 143 1 1 8 ASP OD2 O 1.025 4.098 -11.065 1.00 . A A . 8 ASP OD2 1 1 1 144 1 1 9 HIS C C 5.246 0.741 -5.317 1.00 . A A . 9 HIS C 1 1 1 145 1 1 9 HIS CA C 4.694 2.134 -5.613 1.00 . A A . 9 HIS CA 1 1 1 146 1 1 9 HIS CB C 4.378 2.869 -4.307 1.00 . A A . 9 HIS CB 1 1 1 147 1 1 9 HIS CD2 C 5.942 1.817 -2.524 1.00 . A A . 9 HIS CD2 1 1 1 148 1 1 9 HIS CE1 C 7.163 3.582 -2.084 1.00 . A A . 9 HIS CE1 1 1 1 149 1 1 9 HIS CG C 5.489 2.828 -3.302 1.00 . A A . 9 HIS CG 1 1 1 150 1 1 9 HIS H H 2.622 2.049 -6.010 1.00 . A A . 9 HIS H 1 1 1 151 1 1 9 HIS HA H 5.432 2.693 -6.163 1.00 . A A . 9 HIS HA 1 1 1 152 1 1 9 HIS HB2 H 4.171 3.905 -4.527 1.00 . A A . 9 HIS HB2 1 1 1 153 1 1 9 HIS HB3 H 3.504 2.422 -3.856 1.00 . A A . 9 HIS HB3 1 1 1 154 1 1 9 HIS HD1 H 6.194 4.812 -3.401 1.00 . A A . 9 HIS HD1 1 1 1 155 1 1 9 HIS HD2 H 5.555 0.807 -2.496 1.00 . A A . 9 HIS HD2 1 1 1 156 1 1 9 HIS HE1 H 7.908 4.236 -1.655 1.00 . A A . 9 HIS HE1 1 1 1 157 1 1 9 HIS HE2 H 7.577 1.778 -1.209 1.00 . A A . 9 HIS HE2 1 1 1 158 1 1 9 HIS N N 3.502 2.046 -6.441 1.00 . A A . 9 HIS N 1 1 1 159 1 1 9 HIS ND1 N 6.275 3.921 -3.001 1.00 . A A . 9 HIS ND1 1 1 1 160 1 1 9 HIS NE2 N 6.982 2.311 -1.777 1.00 . A A . 9 HIS NE2 1 1 1 161 1 1 9 HIS O O 6.453 0.561 -5.151 1.00 . A A . 9 HIS O 1 1 1 162 1 1 10 PHE C C 4.930 -2.407 -6.261 1.00 . A A . 10 PHE C 1 1 1 163 1 1 10 PHE CA C 4.737 -1.615 -4.971 1.00 . A A . 10 PHE CA 1 1 1 164 1 1 10 PHE CB C 3.678 -2.287 -4.102 1.00 . A A . 10 PHE CB 1 1 1 165 1 1 10 PHE CD1 C 4.641 -2.673 -1.827 1.00 . A A . 10 PHE CD1 1 1 1 166 1 1 10 PHE CD2 C 3.096 -0.882 -2.111 1.00 . A A . 10 PHE CD2 1 1 1 167 1 1 10 PHE CE1 C 4.768 -2.356 -0.486 1.00 . A A . 10 PHE CE1 1 1 1 168 1 1 10 PHE CE2 C 3.216 -0.558 -0.773 1.00 . A A . 10 PHE CE2 1 1 1 169 1 1 10 PHE CG C 3.806 -1.940 -2.649 1.00 . A A . 10 PHE CG 1 1 1 170 1 1 10 PHE CZ C 4.053 -1.297 0.041 1.00 . A A . 10 PHE CZ 1 1 1 171 1 1 10 PHE H H 3.403 -0.029 -5.389 1.00 . A A . 10 PHE H 1 1 1 172 1 1 10 PHE HA H 5.670 -1.597 -4.428 1.00 . A A . 10 PHE HA 1 1 1 173 1 1 10 PHE HB2 H 2.698 -1.978 -4.434 1.00 . A A . 10 PHE HB2 1 1 1 174 1 1 10 PHE HB3 H 3.765 -3.358 -4.200 1.00 . A A . 10 PHE HB3 1 1 1 175 1 1 10 PHE HD1 H 5.198 -3.498 -2.241 1.00 . A A . 10 PHE HD1 1 1 1 176 1 1 10 PHE HD2 H 2.441 -0.305 -2.748 1.00 . A A . 10 PHE HD2 1 1 1 177 1 1 10 PHE HE1 H 5.422 -2.935 0.147 1.00 . A A . 10 PHE HE1 1 1 1 178 1 1 10 PHE HE2 H 2.658 0.272 -0.365 1.00 . A A . 10 PHE HE2 1 1 1 179 1 1 10 PHE HZ H 4.150 -1.046 1.087 1.00 . A A . 10 PHE HZ 1 1 1 180 1 1 10 PHE N N 4.351 -0.238 -5.251 1.00 . A A . 10 PHE N 1 1 1 181 1 1 10 PHE O O 5.727 -3.344 -6.311 1.00 . A A . 10 PHE O 1 1 1 182 1 1 11 GLY C C 3.356 -3.910 -8.650 1.00 . A A . 11 GLY C 1 1 1 183 1 1 11 GLY CA C 4.293 -2.722 -8.570 1.00 . A A . 11 GLY CA 1 1 1 184 1 1 11 GLY H H 3.570 -1.280 -7.201 1.00 . A A . 11 GLY H 1 1 1 185 1 1 11 GLY HA2 H 4.054 -2.031 -9.366 1.00 . A A . 11 GLY HA2 1 1 1 186 1 1 11 GLY HA3 H 5.308 -3.069 -8.701 1.00 . A A . 11 GLY HA3 1 1 1 187 1 1 11 GLY N N 4.192 -2.031 -7.299 1.00 . A A . 11 GLY N 1 1 1 188 1 1 11 GLY O O 2.570 -4.030 -9.591 1.00 . A A . 11 GLY O 1 1 1 189 1 1 12 THR C C 1.825 -6.023 -6.281 1.00 . A A . 12 THR C 1 1 1 190 1 1 12 THR CA C 2.583 -5.969 -7.603 1.00 . A A . 12 THR CA 1 1 1 191 1 1 12 THR CB C 3.421 -7.236 -7.779 1.00 . A A . 12 THR CB 1 1 1 192 1 1 12 THR CG2 C 3.921 -7.430 -9.194 1.00 . A A . 12 THR CG2 1 1 1 193 1 1 12 THR H H 4.077 -4.630 -6.932 1.00 . A A . 12 THR H 1 1 1 194 1 1 12 THR HA H 1.871 -5.901 -8.412 1.00 . A A . 12 THR HA 1 1 1 195 1 1 12 THR HB H 2.816 -8.094 -7.521 1.00 . A A . 12 THR HB 1 1 1 196 1 1 12 THR HG1 H 5.074 -6.429 -7.104 1.00 . A A . 12 THR HG1 1 1 1 197 1 1 12 THR HG21 H 3.329 -6.831 -9.870 1.00 . A A . 12 THR HG21 1 1 1 198 1 1 12 THR HG22 H 3.835 -8.472 -9.466 1.00 . A A . 12 THR HG22 1 1 1 199 1 1 12 THR HG23 H 4.955 -7.126 -9.255 1.00 . A A . 12 THR HG23 1 1 1 200 1 1 12 THR N N 3.434 -4.786 -7.655 1.00 . A A . 12 THR N 1 1 1 201 1 1 12 THR O O 2.397 -5.785 -5.216 1.00 . A A . 12 THR O 1 1 1 202 1 1 12 THR OG1 O 4.550 -7.213 -6.923 1.00 . A A . 12 THR OG1 1 1 1 203 1 1 13 GLN C C 0.340 -7.282 -4.087 1.00 . A A . 13 GLN C 1 1 1 204 1 1 13 GLN CA C -0.305 -6.410 -5.160 1.00 . A A . 13 GLN CA 1 1 1 205 1 1 13 GLN CB C -1.687 -6.960 -5.518 1.00 . A A . 13 GLN CB 1 1 1 206 1 1 13 GLN CD C -3.001 -8.692 -6.805 1.00 . A A . 13 GLN CD 1 1 1 207 1 1 13 GLN CG C -1.641 -8.272 -6.286 1.00 . A A . 13 GLN CG 1 1 1 208 1 1 13 GLN H H 0.133 -6.506 -7.231 1.00 . A A . 13 GLN H 1 1 1 209 1 1 13 GLN HA H -0.419 -5.409 -4.772 1.00 . A A . 13 GLN HA 1 1 1 210 1 1 13 GLN HB2 H -2.245 -7.120 -4.608 1.00 . A A . 13 GLN HB2 1 1 1 211 1 1 13 GLN HB3 H -2.206 -6.232 -6.123 1.00 . A A . 13 GLN HB3 1 1 1 212 1 1 13 GLN HE21 H -3.626 -9.046 -4.951 1.00 . A A . 13 GLN HE21 1 1 1 213 1 1 13 GLN HE22 H -4.782 -9.342 -6.200 1.00 . A A . 13 GLN HE22 1 1 1 214 1 1 13 GLN HG2 H -0.973 -8.157 -7.127 1.00 . A A . 13 GLN HG2 1 1 1 215 1 1 13 GLN HG3 H -1.266 -9.043 -5.632 1.00 . A A . 13 GLN HG3 1 1 1 216 1 1 13 GLN N N 0.533 -6.331 -6.354 1.00 . A A . 13 GLN N 1 1 1 217 1 1 13 GLN NE2 N -3.893 -9.064 -5.892 1.00 . A A . 13 GLN NE2 1 1 1 218 1 1 13 GLN O O 0.432 -6.886 -2.925 1.00 . A A . 13 GLN O 1 1 1 219 1 1 13 GLN OE1 O -3.251 -8.682 -8.010 1.00 . A A . 13 GLN OE1 1 1 1 220 1 1 14 ARG C C 2.490 -8.703 -2.716 1.00 . A A . 14 ARG C 1 1 1 221 1 1 14 ARG CA C 1.426 -9.403 -3.559 1.00 . A A . 14 ARG CA 1 1 1 222 1 1 14 ARG CB C 2.053 -10.565 -4.331 1.00 . A A . 14 ARG CB 1 1 1 223 1 1 14 ARG CD C 1.846 -12.935 -5.142 1.00 . A A . 14 ARG CD 1 1 1 224 1 1 14 ARG CG C 1.143 -11.776 -4.454 1.00 . A A . 14 ARG CG 1 1 1 225 1 1 14 ARG CZ C 3.238 -14.852 -4.464 1.00 . A A . 14 ARG CZ 1 1 1 226 1 1 14 ARG H H 0.688 -8.728 -5.425 1.00 . A A . 14 ARG H 1 1 1 227 1 1 14 ARG HA H 0.662 -9.791 -2.902 1.00 . A A . 14 ARG HA 1 1 1 228 1 1 14 ARG HB2 H 2.304 -10.227 -5.326 1.00 . A A . 14 ARG HB2 1 1 1 229 1 1 14 ARG HB3 H 2.957 -10.871 -3.827 1.00 . A A . 14 ARG HB3 1 1 1 230 1 1 14 ARG HD2 H 1.155 -13.401 -5.830 1.00 . A A . 14 ARG HD2 1 1 1 231 1 1 14 ARG HD3 H 2.694 -12.552 -5.689 1.00 . A A . 14 ARG HD3 1 1 1 232 1 1 14 ARG HE H 1.911 -13.929 -3.292 1.00 . A A . 14 ARG HE 1 1 1 233 1 1 14 ARG HG2 H 0.839 -12.088 -3.465 1.00 . A A . 14 ARG HG2 1 1 1 234 1 1 14 ARG HG3 H 0.271 -11.501 -5.030 1.00 . A A . 14 ARG HG3 1 1 1 235 1 1 14 ARG HH11 H 3.531 -14.236 -6.367 1.00 . A A . 14 ARG HH11 1 1 1 236 1 1 14 ARG HH12 H 4.497 -15.583 -5.865 1.00 . A A . 14 ARG HH12 1 1 1 237 1 1 14 ARG HH21 H 3.180 -15.700 -2.630 1.00 . A A . 14 ARG HH21 1 1 1 238 1 1 14 ARG HH22 H 4.298 -16.415 -3.743 1.00 . A A . 14 ARG HH22 1 1 1 239 1 1 14 ARG N N 0.788 -8.470 -4.485 1.00 . A A . 14 ARG N 1 1 1 240 1 1 14 ARG NE N 2.310 -13.937 -4.186 1.00 . A A . 14 ARG NE 1 1 1 241 1 1 14 ARG NH1 N 3.802 -14.894 -5.664 1.00 . A A . 14 ARG NH1 1 1 1 242 1 1 14 ARG NH2 N 3.601 -15.728 -3.536 1.00 . A A . 14 ARG NH2 1 1 1 243 1 1 14 ARG O O 2.719 -9.067 -1.562 1.00 . A A . 14 ARG O 1 1 1 244 1 1 15 ALA C C 3.591 -6.178 -1.421 1.00 . A A . 15 ALA C 1 1 1 245 1 1 15 ALA CA C 4.172 -6.950 -2.602 1.00 . A A . 15 ALA CA 1 1 1 246 1 1 15 ALA CB C 4.874 -6.001 -3.562 1.00 . A A . 15 ALA CB 1 1 1 247 1 1 15 ALA H H 2.907 -7.455 -4.221 1.00 . A A . 15 ALA H 1 1 1 248 1 1 15 ALA HA H 4.902 -7.655 -2.233 1.00 . A A . 15 ALA HA 1 1 1 249 1 1 15 ALA HB1 H 4.658 -6.295 -4.580 1.00 . A A . 15 ALA HB1 1 1 1 250 1 1 15 ALA HB2 H 5.939 -6.041 -3.394 1.00 . A A . 15 ALA HB2 1 1 1 251 1 1 15 ALA HB3 H 4.520 -4.994 -3.397 1.00 . A A . 15 ALA HB3 1 1 1 252 1 1 15 ALA N N 3.135 -7.700 -3.299 1.00 . A A . 15 ALA N 1 1 1 253 1 1 15 ALA O O 4.096 -6.263 -0.302 1.00 . A A . 15 ALA O 1 1 1 254 1 1 16 VAL C C 1.457 -5.513 0.532 1.00 . A A . 16 VAL C 1 1 1 255 1 1 16 VAL CA C 1.874 -4.635 -0.644 1.00 . A A . 16 VAL CA 1 1 1 256 1 1 16 VAL CB C 0.629 -3.894 -1.178 1.00 . A A . 16 VAL CB 1 1 1 257 1 1 16 VAL CG1 C 0.442 -2.593 -0.428 1.00 . A A . 16 VAL CG1 1 1 1 258 1 1 16 VAL CG2 C 0.732 -3.629 -2.675 1.00 . A A . 16 VAL CG2 1 1 1 259 1 1 16 VAL H H 2.173 -5.395 -2.589 1.00 . A A . 16 VAL H 1 1 1 260 1 1 16 VAL HA H 2.581 -3.898 -0.294 1.00 . A A . 16 VAL HA 1 1 1 261 1 1 16 VAL HB H -0.238 -4.513 -1.000 1.00 . A A . 16 VAL HB 1 1 1 262 1 1 16 VAL HG11 H -0.089 -2.780 0.492 1.00 . A A . 16 VAL HG11 1 1 1 263 1 1 16 VAL HG12 H -0.123 -1.905 -1.038 1.00 . A A . 16 VAL HG12 1 1 1 264 1 1 16 VAL HG13 H 1.409 -2.170 -0.208 1.00 . A A . 16 VAL HG13 1 1 1 265 1 1 16 VAL HG21 H 1.741 -3.334 -2.920 1.00 . A A . 16 VAL HG21 1 1 1 266 1 1 16 VAL HG22 H 0.048 -2.840 -2.949 1.00 . A A . 16 VAL HG22 1 1 1 267 1 1 16 VAL HG23 H 0.479 -4.529 -3.217 1.00 . A A . 16 VAL HG23 1 1 1 268 1 1 16 VAL N N 2.527 -5.423 -1.680 1.00 . A A . 16 VAL N 1 1 1 269 1 1 16 VAL O O 1.685 -5.165 1.691 1.00 . A A . 16 VAL O 1 1 1 270 1 1 17 ALA C C 1.564 -8.064 2.104 1.00 . A A . 17 ALA C 1 1 1 271 1 1 17 ALA CA C 0.395 -7.578 1.255 1.00 . A A . 17 ALA CA 1 1 1 272 1 1 17 ALA CB C -0.327 -8.759 0.623 1.00 . A A . 17 ALA CB 1 1 1 273 1 1 17 ALA H H 0.691 -6.871 -0.719 1.00 . A A . 17 ALA H 1 1 1 274 1 1 17 ALA HA H -0.307 -7.057 1.889 1.00 . A A . 17 ALA HA 1 1 1 275 1 1 17 ALA HB1 H 0.348 -9.599 0.556 1.00 . A A . 17 ALA HB1 1 1 1 276 1 1 17 ALA HB2 H -0.662 -8.488 -0.367 1.00 . A A . 17 ALA HB2 1 1 1 277 1 1 17 ALA HB3 H -1.178 -9.028 1.230 1.00 . A A . 17 ALA HB3 1 1 1 278 1 1 17 ALA N N 0.845 -6.651 0.224 1.00 . A A . 17 ALA N 1 1 1 279 1 1 17 ALA O O 1.414 -8.313 3.301 1.00 . A A . 17 ALA O 1 1 1 280 1 1 18 LYS C C 4.492 -7.544 3.066 1.00 . A A . 18 LYS C 1 1 1 281 1 1 18 LYS CA C 3.925 -8.649 2.179 1.00 . A A . 18 LYS CA 1 1 1 282 1 1 18 LYS CB C 4.984 -9.111 1.174 1.00 . A A . 18 LYS CB 1 1 1 283 1 1 18 LYS CD C 7.015 -10.090 2.280 1.00 . A A . 18 LYS CD 1 1 1 284 1 1 18 LYS CE C 7.676 -11.362 2.787 1.00 . A A . 18 LYS CE 1 1 1 285 1 1 18 LYS CG C 5.697 -10.388 1.587 1.00 . A A . 18 LYS CG 1 1 1 286 1 1 18 LYS H H 2.786 -7.979 0.525 1.00 . A A . 18 LYS H 1 1 1 287 1 1 18 LYS HA H 3.645 -9.485 2.802 1.00 . A A . 18 LYS HA 1 1 1 288 1 1 18 LYS HB2 H 4.508 -9.281 0.220 1.00 . A A . 18 LYS HB2 1 1 1 289 1 1 18 LYS HB3 H 5.723 -8.331 1.064 1.00 . A A . 18 LYS HB3 1 1 1 290 1 1 18 LYS HD2 H 7.679 -9.606 1.579 1.00 . A A . 18 LYS HD2 1 1 1 291 1 1 18 LYS HD3 H 6.831 -9.433 3.117 1.00 . A A . 18 LYS HD3 1 1 1 292 1 1 18 LYS HE2 H 8.551 -11.094 3.362 1.00 . A A . 18 LYS HE2 1 1 1 293 1 1 18 LYS HE3 H 6.977 -11.888 3.421 1.00 . A A . 18 LYS HE3 1 1 1 294 1 1 18 LYS HG2 H 5.062 -10.941 2.263 1.00 . A A . 18 LYS HG2 1 1 1 295 1 1 18 LYS HG3 H 5.888 -10.982 0.704 1.00 . A A . 18 LYS HG3 1 1 1 296 1 1 18 LYS HZ1 H 7.307 -12.363 0.991 1.00 . A A . 18 LYS HZ1 1 1 1 297 1 1 18 LYS HZ2 H 8.340 -13.196 2.039 1.00 . A A . 18 LYS HZ2 1 1 1 298 1 1 18 LYS HZ3 H 8.912 -11.859 1.176 1.00 . A A . 18 LYS HZ3 1 1 1 299 1 1 18 LYS N N 2.729 -8.194 1.480 1.00 . A A . 18 LYS N 1 1 1 300 1 1 18 LYS NZ N 8.088 -12.258 1.671 1.00 . A A . 18 LYS NZ 1 1 1 301 1 1 18 LYS O O 5.101 -7.817 4.101 1.00 . A A . 18 LYS O 1 1 1 302 1 1 19 ALA C C 4.003 -4.980 4.710 1.00 . A A . 19 ALA C 1 1 1 303 1 1 19 ALA CA C 4.781 -5.152 3.409 1.00 . A A . 19 ALA CA 1 1 1 304 1 1 19 ALA CB C 4.693 -3.887 2.569 1.00 . A A . 19 ALA CB 1 1 1 305 1 1 19 ALA H H 3.797 -6.143 1.819 1.00 . A A . 19 ALA H 1 1 1 306 1 1 19 ALA HA H 5.821 -5.329 3.644 1.00 . A A . 19 ALA HA 1 1 1 307 1 1 19 ALA HB1 H 3.911 -3.999 1.833 1.00 . A A . 19 ALA HB1 1 1 1 308 1 1 19 ALA HB2 H 5.636 -3.722 2.069 1.00 . A A . 19 ALA HB2 1 1 1 309 1 1 19 ALA HB3 H 4.471 -3.045 3.207 1.00 . A A . 19 ALA HB3 1 1 1 310 1 1 19 ALA N N 4.289 -6.297 2.653 1.00 . A A . 19 ALA N 1 1 1 311 1 1 19 ALA O O 4.592 -4.837 5.783 1.00 . A A . 19 ALA O 1 1 1 312 1 1 20 LEU C C 1.701 -6.157 6.541 1.00 . A A . 20 LEU C 1 1 1 313 1 1 20 LEU CA C 1.819 -4.842 5.776 1.00 . A A . 20 LEU CA 1 1 1 314 1 1 20 LEU CB C 0.432 -4.357 5.354 1.00 . A A . 20 LEU CB 1 1 1 315 1 1 20 LEU CD1 C -0.886 -3.107 3.627 1.00 . A A . 20 LEU CD1 1 1 1 316 1 1 20 LEU CD2 C 0.659 -1.869 5.154 1.00 . A A . 20 LEU CD2 1 1 1 317 1 1 20 LEU CG C 0.425 -3.166 4.395 1.00 . A A . 20 LEU CG 1 1 1 318 1 1 20 LEU H H 2.268 -5.114 3.725 1.00 . A A . 20 LEU H 1 1 1 319 1 1 20 LEU HA H 2.269 -4.104 6.423 1.00 . A A . 20 LEU HA 1 1 1 320 1 1 20 LEU HB2 H -0.085 -5.180 4.880 1.00 . A A . 20 LEU HB2 1 1 1 321 1 1 20 LEU HB3 H -0.114 -4.076 6.243 1.00 . A A . 20 LEU HB3 1 1 1 322 1 1 20 LEU HD11 H -0.741 -2.554 2.710 1.00 . A A . 20 LEU HD11 1 1 1 323 1 1 20 LEU HD12 H -1.634 -2.615 4.229 1.00 . A A . 20 LEU HD12 1 1 1 324 1 1 20 LEU HD13 H -1.212 -4.110 3.393 1.00 . A A . 20 LEU HD13 1 1 1 325 1 1 20 LEU HD21 H 1.278 -1.212 4.563 1.00 . A A . 20 LEU HD21 1 1 1 326 1 1 20 LEU HD22 H 1.152 -2.083 6.091 1.00 . A A . 20 LEU HD22 1 1 1 327 1 1 20 LEU HD23 H -0.290 -1.390 5.350 1.00 . A A . 20 LEU HD23 1 1 1 328 1 1 20 LEU HG H 1.225 -3.285 3.678 1.00 . A A . 20 LEU HG 1 1 1 329 1 1 20 LEU N N 2.679 -4.996 4.608 1.00 . A A . 20 LEU N 1 1 1 330 1 1 20 LEU O O 1.588 -6.166 7.767 1.00 . A A . 20 LEU O 1 1 1 331 1 1 21 GLY C C 0.273 -9.220 6.201 1.00 . A A . 21 GLY C 1 1 1 332 1 1 21 GLY CA C 1.623 -8.570 6.433 1.00 . A A . 21 GLY CA 1 1 1 333 1 1 21 GLY H H 1.820 -7.195 4.836 1.00 . A A . 21 GLY H 1 1 1 334 1 1 21 GLY HA2 H 2.393 -9.213 6.029 1.00 . A A . 21 GLY HA2 1 1 1 335 1 1 21 GLY HA3 H 1.781 -8.463 7.495 1.00 . A A . 21 GLY HA3 1 1 1 336 1 1 21 GLY N N 1.728 -7.265 5.808 1.00 . A A . 21 GLY N 1 1 1 337 1 1 21 GLY O O -0.183 -10.023 7.014 1.00 . A A . 21 GLY O 1 1 1 338 1 1 22 ILE C C -1.602 -10.260 3.481 1.00 . A A . 22 ILE C 1 1 1 339 1 1 22 ILE CA C -1.673 -9.423 4.754 1.00 . A A . 22 ILE CA 1 1 1 340 1 1 22 ILE CB C -2.723 -8.313 4.567 1.00 . A A . 22 ILE CB 1 1 1 341 1 1 22 ILE CD1 C -3.262 -6.218 3.222 1.00 . A A . 22 ILE CD1 1 1 1 342 1 1 22 ILE CG1 C -2.260 -7.316 3.501 1.00 . A A . 22 ILE CG1 1 1 1 343 1 1 22 ILE CG2 C -2.985 -7.602 5.886 1.00 . A A . 22 ILE CG2 1 1 1 344 1 1 22 ILE H H 0.048 -8.224 4.482 1.00 . A A . 22 ILE H 1 1 1 345 1 1 22 ILE HA H -1.989 -10.054 5.572 1.00 . A A . 22 ILE HA 1 1 1 346 1 1 22 ILE HB H -3.646 -8.771 4.242 1.00 . A A . 22 ILE HB 1 1 1 347 1 1 22 ILE HD11 H -4.230 -6.511 3.599 1.00 . A A . 22 ILE HD11 1 1 1 348 1 1 22 ILE HD12 H -3.325 -6.051 2.157 1.00 . A A . 22 ILE HD12 1 1 1 349 1 1 22 ILE HD13 H -2.946 -5.308 3.711 1.00 . A A . 22 ILE HD13 1 1 1 350 1 1 22 ILE HG12 H -1.342 -6.850 3.829 1.00 . A A . 22 ILE HG12 1 1 1 351 1 1 22 ILE HG13 H -2.078 -7.846 2.577 1.00 . A A . 22 ILE HG13 1 1 1 352 1 1 22 ILE HG21 H -3.175 -6.554 5.700 1.00 . A A . 22 ILE HG21 1 1 1 353 1 1 22 ILE HG22 H -2.122 -7.703 6.526 1.00 . A A . 22 ILE HG22 1 1 1 354 1 1 22 ILE HG23 H -3.845 -8.042 6.368 1.00 . A A . 22 ILE HG23 1 1 1 355 1 1 22 ILE N N -0.368 -8.869 5.091 1.00 . A A . 22 ILE N 1 1 1 356 1 1 22 ILE O O -0.538 -10.406 2.881 1.00 . A A . 22 ILE O 1 1 1 357 1 1 23 SER C C -3.068 -10.770 0.639 1.00 . A A . 23 SER C 1 1 1 358 1 1 23 SER CA C -2.810 -11.630 1.872 1.00 . A A . 23 SER CA 1 1 1 359 1 1 23 SER CB C -3.907 -12.686 2.011 1.00 . A A . 23 SER CB 1 1 1 360 1 1 23 SER H H -3.559 -10.655 3.594 1.00 . A A . 23 SER H 1 1 1 361 1 1 23 SER HA H -1.858 -12.126 1.755 1.00 . A A . 23 SER HA 1 1 1 362 1 1 23 SER HB2 H -4.861 -12.196 2.144 1.00 . A A . 23 SER HB2 1 1 1 363 1 1 23 SER HB3 H -3.937 -13.291 1.116 1.00 . A A . 23 SER HB3 1 1 1 364 1 1 23 SER HG H -2.744 -13.783 3.140 1.00 . A A . 23 SER HG 1 1 1 365 1 1 23 SER N N -2.743 -10.808 3.074 1.00 . A A . 23 SER N 1 1 1 366 1 1 23 SER O O -3.497 -9.620 0.751 1.00 . A A . 23 SER O 1 1 1 367 1 1 23 SER OG O -3.669 -13.528 3.124 1.00 . A A . 23 SER OG 1 1 1 368 1 1 24 ASP C C -4.484 -10.272 -1.985 1.00 . A A . 24 ASP C 1 1 1 369 1 1 24 ASP CA C -3.011 -10.616 -1.788 1.00 . A A . 24 ASP CA 1 1 1 370 1 1 24 ASP CB C -2.510 -11.453 -2.967 1.00 . A A . 24 ASP CB 1 1 1 371 1 1 24 ASP CG C -3.206 -12.796 -3.058 1.00 . A A . 24 ASP CG 1 1 1 372 1 1 24 ASP H H -2.466 -12.251 -0.561 1.00 . A A . 24 ASP H 1 1 1 373 1 1 24 ASP HA H -2.442 -9.699 -1.743 1.00 . A A . 24 ASP HA 1 1 1 374 1 1 24 ASP HB2 H -2.687 -10.913 -3.885 1.00 . A A . 24 ASP HB2 1 1 1 375 1 1 24 ASP HB3 H -1.450 -11.624 -2.853 1.00 . A A . 24 ASP HB3 1 1 1 376 1 1 24 ASP N N -2.806 -11.332 -0.536 1.00 . A A . 24 ASP N 1 1 1 377 1 1 24 ASP O O -4.819 -9.245 -2.578 1.00 . A A . 24 ASP O 1 1 1 378 1 1 24 ASP OD1 O -3.667 -13.299 -2.011 1.00 . A A . 24 ASP OD1 1 1 1 379 1 1 24 ASP OD2 O -3.291 -13.346 -4.176 1.00 . A A . 24 ASP OD2 1 1 1 380 1 1 25 ALA C C -7.219 -9.619 -0.936 1.00 . A A . 25 ALA C 1 1 1 381 1 1 25 ALA CA C -6.798 -10.922 -1.605 1.00 . A A . 25 ALA CA 1 1 1 382 1 1 25 ALA CB C -7.557 -12.095 -1.001 1.00 . A A . 25 ALA CB 1 1 1 383 1 1 25 ALA H H -5.033 -11.935 -1.023 1.00 . A A . 25 ALA H 1 1 1 384 1 1 25 ALA HA H -7.040 -10.870 -2.656 1.00 . A A . 25 ALA HA 1 1 1 385 1 1 25 ALA HB1 H -8.619 -11.924 -1.100 1.00 . A A . 25 ALA HB1 1 1 1 386 1 1 25 ALA HB2 H -7.303 -12.189 0.045 1.00 . A A . 25 ALA HB2 1 1 1 387 1 1 25 ALA HB3 H -7.289 -13.004 -1.520 1.00 . A A . 25 ALA HB3 1 1 1 388 1 1 25 ALA N N -5.360 -11.135 -1.483 1.00 . A A . 25 ALA N 1 1 1 389 1 1 25 ALA O O -8.015 -8.857 -1.485 1.00 . A A . 25 ALA O 1 1 1 390 1 1 26 ALA C C -6.643 -6.908 0.194 1.00 . A A . 26 ALA C 1 1 1 391 1 1 26 ALA CA C -6.999 -8.155 0.996 1.00 . A A . 26 ALA CA 1 1 1 392 1 1 26 ALA CB C -6.273 -8.150 2.333 1.00 . A A . 26 ALA CB 1 1 1 393 1 1 26 ALA H H -6.051 -10.013 0.638 1.00 . A A . 26 ALA H 1 1 1 394 1 1 26 ALA HA H -8.061 -8.155 1.191 1.00 . A A . 26 ALA HA 1 1 1 395 1 1 26 ALA HB1 H -5.363 -8.726 2.250 1.00 . A A . 26 ALA HB1 1 1 1 396 1 1 26 ALA HB2 H -6.909 -8.585 3.089 1.00 . A A . 26 ALA HB2 1 1 1 397 1 1 26 ALA HB3 H -6.031 -7.133 2.607 1.00 . A A . 26 ALA HB3 1 1 1 398 1 1 26 ALA N N -6.679 -9.368 0.252 1.00 . A A . 26 ALA N 1 1 1 399 1 1 26 ALA O O -7.371 -5.915 0.215 1.00 . A A . 26 ALA O 1 1 1 400 1 1 27 VAL C C -6.051 -5.546 -2.450 1.00 . A A . 27 VAL C 1 1 1 401 1 1 27 VAL CA C -5.068 -5.842 -1.323 1.00 . A A . 27 VAL CA 1 1 1 402 1 1 27 VAL CB C -3.676 -6.108 -1.928 1.00 . A A . 27 VAL CB 1 1 1 403 1 1 27 VAL CG1 C -3.151 -4.865 -2.632 1.00 . A A . 27 VAL CG1 1 1 1 404 1 1 27 VAL CG2 C -2.704 -6.568 -0.852 1.00 . A A . 27 VAL CG2 1 1 1 405 1 1 27 VAL H H -4.982 -7.786 -0.490 1.00 . A A . 27 VAL H 1 1 1 406 1 1 27 VAL HA H -5.000 -4.976 -0.681 1.00 . A A . 27 VAL HA 1 1 1 407 1 1 27 VAL HB H -3.769 -6.897 -2.660 1.00 . A A . 27 VAL HB 1 1 1 408 1 1 27 VAL HG11 H -2.147 -5.047 -2.982 1.00 . A A . 27 VAL HG11 1 1 1 409 1 1 27 VAL HG12 H -3.149 -4.035 -1.941 1.00 . A A . 27 VAL HG12 1 1 1 410 1 1 27 VAL HG13 H -3.790 -4.632 -3.471 1.00 . A A . 27 VAL HG13 1 1 1 411 1 1 27 VAL HG21 H -1.707 -6.619 -1.263 1.00 . A A . 27 VAL HG21 1 1 1 412 1 1 27 VAL HG22 H -2.997 -7.545 -0.497 1.00 . A A . 27 VAL HG22 1 1 1 413 1 1 27 VAL HG23 H -2.720 -5.868 -0.030 1.00 . A A . 27 VAL HG23 1 1 1 414 1 1 27 VAL N N -5.519 -6.967 -0.513 1.00 . A A . 27 VAL N 1 1 1 415 1 1 27 VAL O O -6.495 -4.411 -2.619 1.00 . A A . 27 VAL O 1 1 1 416 1 1 28 SER C C -8.701 -6.017 -3.834 1.00 . A A . 28 SER C 1 1 1 417 1 1 28 SER CA C -7.319 -6.425 -4.333 1.00 . A A . 28 SER CA 1 1 1 418 1 1 28 SER CB C -7.414 -7.730 -5.126 1.00 . A A . 28 SER CB 1 1 1 419 1 1 28 SER H H -6.000 -7.457 -3.037 1.00 . A A . 28 SER H 1 1 1 420 1 1 28 SER HA H -6.938 -5.648 -4.978 1.00 . A A . 28 SER HA 1 1 1 421 1 1 28 SER HB2 H -8.410 -7.831 -5.529 1.00 . A A . 28 SER HB2 1 1 1 422 1 1 28 SER HB3 H -6.697 -7.709 -5.935 1.00 . A A . 28 SER HB3 1 1 1 423 1 1 28 SER HG H -7.571 -9.627 -4.664 1.00 . A A . 28 SER HG 1 1 1 424 1 1 28 SER N N -6.388 -6.576 -3.220 1.00 . A A . 28 SER N 1 1 1 425 1 1 28 SER O O -9.421 -5.279 -4.506 1.00 . A A . 28 SER O 1 1 1 426 1 1 28 SER OG O -7.140 -8.850 -4.302 1.00 . A A . 28 SER OG 1 1 1 427 1 1 29 GLN C C -10.480 -4.699 -1.753 1.00 . A A . 29 GLN C 1 1 1 428 1 1 29 GLN CA C -10.360 -6.190 -2.064 1.00 . A A . 29 GLN CA 1 1 1 429 1 1 29 GLN CB C -10.570 -7.006 -0.787 1.00 . A A . 29 GLN CB 1 1 1 430 1 1 29 GLN CD C -12.030 -9.070 -0.859 1.00 . A A . 29 GLN CD 1 1 1 431 1 1 29 GLN CG C -11.980 -7.567 -0.654 1.00 . A A . 29 GLN CG 1 1 1 432 1 1 29 GLN H H -8.447 -7.087 -2.164 1.00 . A A . 29 GLN H 1 1 1 433 1 1 29 GLN HA H -11.120 -6.457 -2.780 1.00 . A A . 29 GLN HA 1 1 1 434 1 1 29 GLN HB2 H -9.880 -7.832 -0.781 1.00 . A A . 29 GLN HB2 1 1 1 435 1 1 29 GLN HB3 H -10.380 -6.376 0.069 1.00 . A A . 29 GLN HB3 1 1 1 436 1 1 29 GLN HE21 H -13.110 -9.282 0.795 1.00 . A A . 29 GLN HE21 1 1 1 437 1 1 29 GLN HE22 H -12.750 -10.740 -0.055 1.00 . A A . 29 GLN HE22 1 1 1 438 1 1 29 GLN HG2 H -12.350 -7.342 0.335 1.00 . A A . 29 GLN HG2 1 1 1 439 1 1 29 GLN HG3 H -12.610 -7.096 -1.392 1.00 . A A . 29 GLN HG3 1 1 1 440 1 1 29 GLN N N -9.065 -6.504 -2.651 1.00 . A A . 29 GLN N 1 1 1 441 1 1 29 GLN NE2 N -12.700 -9.768 0.052 1.00 . A A . 29 GLN NE2 1 1 1 442 1 1 29 GLN O O -11.580 -4.169 -1.626 1.00 . A A . 29 GLN O 1 1 1 443 1 1 29 GLN OE1 O -11.480 -9.595 -1.824 1.00 . A A . 29 GLN OE1 1 1 1 444 1 1 30 TRP C C -10.160 -1.816 -2.335 1.00 . A A . 30 TRP C 1 1 1 445 1 1 30 TRP CA C -9.319 -2.598 -1.333 1.00 . A A . 30 TRP CA 1 1 1 446 1 1 30 TRP CB C -7.881 -2.072 -1.346 1.00 . A A . 30 TRP CB 1 1 1 447 1 1 30 TRP CD1 C -7.508 -3.160 0.948 1.00 . A A . 30 TRP CD1 1 1 1 448 1 1 30 TRP CD2 C -5.635 -2.449 -0.051 1.00 . A A . 30 TRP CD2 1 1 1 449 1 1 30 TRP CE2 C -5.293 -3.021 1.189 1.00 . A A . 30 TRP CE2 1 1 1 450 1 1 30 TRP CE3 C -4.617 -1.933 -0.858 1.00 . A A . 30 TRP CE3 1 1 1 451 1 1 30 TRP CG C -7.056 -2.549 -0.187 1.00 . A A . 30 TRP CG 1 1 1 452 1 1 30 TRP CH2 C -3.001 -2.578 0.829 1.00 . A A . 30 TRP CH2 1 1 1 453 1 1 30 TRP CZ2 C -3.976 -3.091 1.641 1.00 . A A . 30 TRP CZ2 1 1 1 454 1 1 30 TRP CZ3 C -3.311 -2.002 -0.409 1.00 . A A . 30 TRP CZ3 1 1 1 455 1 1 30 TRP H H -8.488 -4.501 -1.740 1.00 . A A . 30 TRP H 1 1 1 456 1 1 30 TRP HA H -9.734 -2.458 -0.346 1.00 . A A . 30 TRP HA 1 1 1 457 1 1 30 TRP HB2 H -7.396 -2.395 -2.253 1.00 . A A . 30 TRP HB2 1 1 1 458 1 1 30 TRP HB3 H -7.901 -0.991 -1.319 1.00 . A A . 30 TRP HB3 1 1 1 459 1 1 30 TRP HD1 H -8.547 -3.380 1.148 1.00 . A A . 30 TRP HD1 1 1 1 460 1 1 30 TRP HE1 H -6.521 -3.886 2.654 1.00 . A A . 30 TRP HE1 1 1 1 461 1 1 30 TRP HE3 H -4.836 -1.486 -1.815 1.00 . A A . 30 TRP HE3 1 1 1 462 1 1 30 TRP HH2 H -1.967 -2.609 1.140 1.00 . A A . 30 TRP HH2 1 1 1 463 1 1 30 TRP HZ2 H -3.720 -3.531 2.593 1.00 . A A . 30 TRP HZ2 1 1 1 464 1 1 30 TRP HZ3 H -2.512 -1.607 -1.019 1.00 . A A . 30 TRP HZ3 1 1 1 465 1 1 30 TRP N N -9.337 -4.026 -1.630 1.00 . A A . 30 TRP N 1 1 1 466 1 1 30 TRP NE1 N -6.453 -3.447 1.781 1.00 . A A . 30 TRP NE1 1 1 1 467 1 1 30 TRP O O -10.530 -2.335 -3.388 1.00 . A A . 30 TRP O 1 1 1 468 1 1 31 LYS C C -10.470 1.548 -3.250 1.00 . A A . 31 LYS C 1 1 1 469 1 1 31 LYS CA C -11.250 0.295 -2.868 1.00 . A A . 31 LYS CA 1 1 1 470 1 1 31 LYS CB C -12.560 0.683 -2.172 1.00 . A A . 31 LYS CB 1 1 1 471 1 1 31 LYS CD C -14.270 0.016 -0.451 1.00 . A A . 31 LYS CD 1 1 1 472 1 1 31 LYS CE C -14.210 -0.780 0.845 1.00 . A A . 31 LYS CE 1 1 1 473 1 1 31 LYS CG C -13.240 -0.475 -1.457 1.00 . A A . 31 LYS CG 1 1 1 474 1 1 31 LYS H H -10.130 -0.209 -1.148 1.00 . A A . 31 LYS H 1 1 1 475 1 1 31 LYS HA H -11.480 -0.260 -3.766 1.00 . A A . 31 LYS HA 1 1 1 476 1 1 31 LYS HB2 H -12.350 1.454 -1.445 1.00 . A A . 31 LYS HB2 1 1 1 477 1 1 31 LYS HB3 H -13.240 1.072 -2.910 1.00 . A A . 31 LYS HB3 1 1 1 478 1 1 31 LYS HD2 H -14.070 1.055 -0.231 1.00 . A A . 31 LYS HD2 1 1 1 479 1 1 31 LYS HD3 H -15.250 -0.087 -0.880 1.00 . A A . 31 LYS HD3 1 1 1 480 1 1 31 LYS HE2 H -13.350 -1.440 0.810 1.00 . A A . 31 LYS HE2 1 1 1 481 1 1 31 LYS HE3 H -14.090 -0.091 1.669 1.00 . A A . 31 LYS HE3 1 1 1 482 1 1 31 LYS HG2 H -13.730 -1.098 -2.188 1.00 . A A . 31 LYS HG2 1 1 1 483 1 1 31 LYS HG3 H -12.480 -1.053 -0.939 1.00 . A A . 31 LYS HG3 1 1 1 484 1 1 31 LYS HZ1 H -15.360 -2.127 1.944 1.00 . A A . 31 LYS HZ1 1 1 1 485 1 1 31 LYS HZ2 H -15.560 -2.260 0.270 1.00 . A A . 31 LYS HZ2 1 1 1 486 1 1 31 LYS HZ3 H -16.270 -0.969 1.106 1.00 . A A . 31 LYS HZ3 1 1 1 487 1 1 31 LYS N N -10.450 -0.565 -2.001 1.00 . A A . 31 LYS N 1 1 1 488 1 1 31 LYS NZ N -15.440 -1.590 1.056 1.00 . A A . 31 LYS NZ 1 1 1 489 1 1 31 LYS O O -9.254 1.597 -3.097 1.00 . A A . 31 LYS O 1 1 1 490 1 1 32 GLU C C -9.617 4.331 -3.051 1.00 . A A . 32 GLU C 1 1 1 491 1 1 32 GLU CA C -10.540 3.814 -4.147 1.00 . A A . 32 GLU CA 1 1 1 492 1 1 32 GLU CB C -11.610 4.866 -4.473 1.00 . A A . 32 GLU CB 1 1 1 493 1 1 32 GLU CD C -12.610 6.354 -6.253 1.00 . A A . 32 GLU CD 1 1 1 494 1 1 32 GLU CG C -11.770 5.127 -5.963 1.00 . A A . 32 GLU CG 1 1 1 495 1 1 32 GLU H H -12.150 2.463 -3.846 1.00 . A A . 32 GLU H 1 1 1 496 1 1 32 GLU HA H -9.961 3.621 -5.034 1.00 . A A . 32 GLU HA 1 1 1 497 1 1 32 GLU HB2 H -12.560 4.532 -4.084 1.00 . A A . 32 GLU HB2 1 1 1 498 1 1 32 GLU HB3 H -11.340 5.796 -3.994 1.00 . A A . 32 GLU HB3 1 1 1 499 1 1 32 GLU HG2 H -10.790 5.268 -6.397 1.00 . A A . 32 GLU HG2 1 1 1 500 1 1 32 GLU HG3 H -12.240 4.268 -6.416 1.00 . A A . 32 GLU HG3 1 1 1 501 1 1 32 GLU N N -11.180 2.560 -3.747 1.00 . A A . 32 GLU N 1 1 1 502 1 1 32 GLU O O -8.633 5.016 -3.329 1.00 . A A . 32 GLU O 1 1 1 503 1 1 32 GLU OE1 O -13.840 6.292 -6.053 1.00 . A A . 32 GLU OE1 1 1 1 504 1 1 32 GLU OE2 O -12.030 7.379 -6.679 1.00 . A A . 32 GLU OE2 1 1 1 505 1 1 33 VAL C C -8.795 3.230 0.231 1.00 . A A . 33 VAL C 1 1 1 506 1 1 33 VAL CA C -9.132 4.415 -0.666 1.00 . A A . 33 VAL CA 1 1 1 507 1 1 33 VAL CB C -9.855 5.489 0.168 1.00 . A A . 33 VAL CB 1 1 1 508 1 1 33 VAL CG1 C -8.928 6.055 1.232 1.00 . A A . 33 VAL CG1 1 1 1 509 1 1 33 VAL CG2 C -10.380 6.597 -0.730 1.00 . A A . 33 VAL CG2 1 1 1 510 1 1 33 VAL H H -10.730 3.443 -1.649 1.00 . A A . 33 VAL H 1 1 1 511 1 1 33 VAL HA H -8.213 4.841 -1.045 1.00 . A A . 33 VAL HA 1 1 1 512 1 1 33 VAL HB H -10.690 5.025 0.665 1.00 . A A . 33 VAL HB 1 1 1 513 1 1 33 VAL HG11 H -8.128 5.355 1.422 1.00 . A A . 33 VAL HG11 1 1 1 514 1 1 33 VAL HG12 H -9.484 6.221 2.144 1.00 . A A . 33 VAL HG12 1 1 1 515 1 1 33 VAL HG13 H -8.513 6.991 0.887 1.00 . A A . 33 VAL HG13 1 1 1 516 1 1 33 VAL HG21 H -11.280 6.257 -1.229 1.00 . A A . 33 VAL HG21 1 1 1 517 1 1 33 VAL HG22 H -9.639 6.852 -1.466 1.00 . A A . 33 VAL HG22 1 1 1 518 1 1 33 VAL HG23 H -10.610 7.466 -0.132 1.00 . A A . 33 VAL HG23 1 1 1 519 1 1 33 VAL N N -9.937 3.993 -1.805 1.00 . A A . 33 VAL N 1 1 1 520 1 1 33 VAL O O -9.684 2.606 0.811 1.00 . A A . 33 VAL O 1 1 1 521 1 1 34 ILE C C -7.527 1.962 2.613 1.00 . A A . 34 ILE C 1 1 1 522 1 1 34 ILE CA C -7.054 1.809 1.169 1.00 . A A . 34 ILE CA 1 1 1 523 1 1 34 ILE CB C -5.518 1.677 1.154 1.00 . A A . 34 ILE CB 1 1 1 524 1 1 34 ILE CD1 C -3.391 2.972 1.673 1.00 . A A . 34 ILE CD1 1 1 1 525 1 1 34 ILE CG1 C -4.860 3.048 1.322 1.00 . A A . 34 ILE CG1 1 1 1 526 1 1 34 ILE CG2 C -5.057 1.017 -0.135 1.00 . A A . 34 ILE CG2 1 1 1 527 1 1 34 ILE H H -6.845 3.456 -0.146 1.00 . A A . 34 ILE H 1 1 1 528 1 1 34 ILE HA H -7.475 0.901 0.759 1.00 . A A . 34 ILE HA 1 1 1 529 1 1 34 ILE HB H -5.227 1.043 1.978 1.00 . A A . 34 ILE HB 1 1 1 530 1 1 34 ILE HD11 H -3.067 3.919 2.078 1.00 . A A . 34 ILE HD11 1 1 1 531 1 1 34 ILE HD12 H -2.820 2.747 0.784 1.00 . A A . 34 ILE HD12 1 1 1 532 1 1 34 ILE HD13 H -3.236 2.195 2.406 1.00 . A A . 34 ILE HD13 1 1 1 533 1 1 34 ILE HG12 H -4.953 3.602 0.400 1.00 . A A . 34 ILE HG12 1 1 1 534 1 1 34 ILE HG13 H -5.364 3.588 2.112 1.00 . A A . 34 ILE HG13 1 1 1 535 1 1 34 ILE HG21 H -4.079 0.584 0.014 1.00 . A A . 34 ILE HG21 1 1 1 536 1 1 34 ILE HG22 H -5.006 1.758 -0.920 1.00 . A A . 34 ILE HG22 1 1 1 537 1 1 34 ILE HG23 H -5.755 0.243 -0.413 1.00 . A A . 34 ILE HG23 1 1 1 538 1 1 34 ILE N N -7.507 2.923 0.343 1.00 . A A . 34 ILE N 1 1 1 539 1 1 34 ILE O O -7.785 3.073 3.075 1.00 . A A . 34 ILE O 1 1 1 540 1 1 35 PRO C C -7.310 1.849 5.592 1.00 . A A . 35 PRO C 1 1 1 541 1 1 35 PRO CA C -8.091 0.852 4.741 1.00 . A A . 35 PRO CA 1 1 1 542 1 1 35 PRO CB C -7.823 -0.579 5.210 1.00 . A A . 35 PRO CB 1 1 1 543 1 1 35 PRO CD C -7.360 -0.527 2.867 1.00 . A A . 35 PRO CD 1 1 1 544 1 1 35 PRO CG C -7.890 -1.400 3.971 1.00 . A A . 35 PRO CG 1 1 1 545 1 1 35 PRO HA H -9.148 1.065 4.818 1.00 . A A . 35 PRO HA 1 1 1 546 1 1 35 PRO HB2 H -6.845 -0.632 5.669 1.00 . A A . 35 PRO HB2 1 1 1 547 1 1 35 PRO HB3 H -8.576 -0.876 5.922 1.00 . A A . 35 PRO HB3 1 1 1 548 1 1 35 PRO HD2 H -6.298 -0.677 2.744 1.00 . A A . 35 PRO HD2 1 1 1 549 1 1 35 PRO HD3 H -7.879 -0.728 1.942 1.00 . A A . 35 PRO HD3 1 1 1 550 1 1 35 PRO HG2 H -7.276 -2.281 4.079 1.00 . A A . 35 PRO HG2 1 1 1 551 1 1 35 PRO HG3 H -8.913 -1.677 3.769 1.00 . A A . 35 PRO HG3 1 1 1 552 1 1 35 PRO N N -7.646 0.840 3.344 1.00 . A A . 35 PRO N 1 1 1 553 1 1 35 PRO O O -6.207 2.259 5.233 1.00 . A A . 35 PRO O 1 1 1 554 1 1 36 GLU C C -6.018 2.583 8.277 1.00 . A A . 36 GLU C 1 1 1 555 1 1 36 GLU CA C -7.259 3.187 7.627 1.00 . A A . 36 GLU CA 1 1 1 556 1 1 36 GLU CB C -8.249 3.630 8.706 1.00 . A A . 36 GLU CB 1 1 1 557 1 1 36 GLU CD C -8.127 4.361 11.120 1.00 . A A . 36 GLU CD 1 1 1 558 1 1 36 GLU CG C -7.668 4.623 9.700 1.00 . A A . 36 GLU CG 1 1 1 559 1 1 36 GLU H H -8.776 1.875 6.951 1.00 . A A . 36 GLU H 1 1 1 560 1 1 36 GLU HA H -6.963 4.048 7.047 1.00 . A A . 36 GLU HA 1 1 1 561 1 1 36 GLU HB2 H -9.102 4.091 8.227 1.00 . A A . 36 GLU HB2 1 1 1 562 1 1 36 GLU HB3 H -8.582 2.761 9.251 1.00 . A A . 36 GLU HB3 1 1 1 563 1 1 36 GLU HG2 H -6.591 4.558 9.667 1.00 . A A . 36 GLU HG2 1 1 1 564 1 1 36 GLU HG3 H -7.976 5.619 9.415 1.00 . A A . 36 GLU HG3 1 1 1 565 1 1 36 GLU N N -7.894 2.235 6.722 1.00 . A A . 36 GLU N 1 1 1 566 1 1 36 GLU O O -5.034 3.280 8.524 1.00 . A A . 36 GLU O 1 1 1 567 1 1 36 GLU OE1 O -7.467 3.562 11.818 1.00 . A A . 36 GLU OE1 1 1 1 568 1 1 36 GLU OE2 O -9.145 4.953 11.535 1.00 . A A . 36 GLU OE2 1 1 1 569 1 1 37 LYS C C -3.907 0.177 8.149 1.00 . A A . 37 LYS C 1 1 1 570 1 1 37 LYS CA C -4.949 0.591 9.182 1.00 . A A . 37 LYS CA 1 1 1 571 1 1 37 LYS CB C -5.446 -0.636 9.951 1.00 . A A . 37 LYS CB 1 1 1 572 1 1 37 LYS CD C -4.131 -0.592 12.092 1.00 . A A . 37 LYS CD 1 1 1 573 1 1 37 LYS CE C -3.765 -2.058 12.261 1.00 . A A . 37 LYS CE 1 1 1 574 1 1 37 LYS CG C -5.502 -0.430 11.456 1.00 . A A . 37 LYS CG 1 1 1 575 1 1 37 LYS H H -6.882 0.780 8.339 1.00 . A A . 37 LYS H 1 1 1 576 1 1 37 LYS HA H -4.488 1.277 9.878 1.00 . A A . 37 LYS HA 1 1 1 577 1 1 37 LYS HB2 H -6.438 -0.885 9.606 1.00 . A A . 37 LYS HB2 1 1 1 578 1 1 37 LYS HB3 H -4.785 -1.466 9.748 1.00 . A A . 37 LYS HB3 1 1 1 579 1 1 37 LYS HD2 H -3.394 -0.118 11.462 1.00 . A A . 37 LYS HD2 1 1 1 580 1 1 37 LYS HD3 H -4.138 -0.117 13.063 1.00 . A A . 37 LYS HD3 1 1 1 581 1 1 37 LYS HE2 H -3.079 -2.151 13.090 1.00 . A A . 37 LYS HE2 1 1 1 582 1 1 37 LYS HE3 H -4.664 -2.617 12.477 1.00 . A A . 37 LYS HE3 1 1 1 583 1 1 37 LYS HG2 H -5.867 0.566 11.659 1.00 . A A . 37 LYS HG2 1 1 1 584 1 1 37 LYS HG3 H -6.177 -1.157 11.884 1.00 . A A . 37 LYS HG3 1 1 1 585 1 1 37 LYS HZ1 H -3.839 -3.098 10.452 1.00 . A A . 37 LYS HZ1 1 1 1 586 1 1 37 LYS HZ2 H -2.390 -3.301 11.301 1.00 . A A . 37 LYS HZ2 1 1 1 587 1 1 37 LYS HZ3 H -2.693 -1.853 10.481 1.00 . A A . 37 LYS HZ3 1 1 1 588 1 1 37 LYS N N -6.070 1.284 8.556 1.00 . A A . 37 LYS N 1 1 1 589 1 1 37 LYS NZ N -3.128 -2.616 11.038 1.00 . A A . 37 LYS NZ 1 1 1 590 1 1 37 LYS O O -2.735 -0.008 8.478 1.00 . A A . 37 LYS O 1 1 1 591 1 1 38 ASP C C -2.619 0.851 5.355 1.00 . A A . 38 ASP C 1 1 1 592 1 1 38 ASP CA C -3.424 -0.352 5.828 1.00 . A A . 38 ASP CA 1 1 1 593 1 1 38 ASP CB C -4.202 -0.958 4.659 1.00 . A A . 38 ASP CB 1 1 1 594 1 1 38 ASP CG C -4.989 -2.189 5.067 1.00 . A A . 38 ASP CG 1 1 1 595 1 1 38 ASP H H -5.277 0.199 6.690 1.00 . A A . 38 ASP H 1 1 1 596 1 1 38 ASP HA H -2.744 -1.093 6.222 1.00 . A A . 38 ASP HA 1 1 1 597 1 1 38 ASP HB2 H -4.893 -0.224 4.273 1.00 . A A . 38 ASP HB2 1 1 1 598 1 1 38 ASP HB3 H -3.509 -1.239 3.880 1.00 . A A . 38 ASP HB3 1 1 1 599 1 1 38 ASP N N -4.333 0.036 6.898 1.00 . A A . 38 ASP N 1 1 1 600 1 1 38 ASP O O -1.413 0.752 5.124 1.00 . A A . 38 ASP O 1 1 1 601 1 1 38 ASP OD1 O -5.409 -2.263 6.241 1.00 . A A . 38 ASP OD1 1 1 1 602 1 1 38 ASP OD2 O -5.186 -3.078 4.213 1.00 . A A . 38 ASP OD2 1 1 1 603 1 1 39 ALA C C -1.597 3.663 5.814 1.00 . A A . 39 ALA C 1 1 1 604 1 1 39 ALA CA C -2.636 3.215 4.790 1.00 . A A . 39 ALA CA 1 1 1 605 1 1 39 ALA CB C -3.665 4.313 4.566 1.00 . A A . 39 ALA CB 1 1 1 606 1 1 39 ALA H H -4.249 2.005 5.429 1.00 . A A . 39 ALA H 1 1 1 607 1 1 39 ALA HA H -2.141 3.018 3.850 1.00 . A A . 39 ALA HA 1 1 1 608 1 1 39 ALA HB1 H -4.276 4.065 3.712 1.00 . A A . 39 ALA HB1 1 1 1 609 1 1 39 ALA HB2 H -3.159 5.251 4.386 1.00 . A A . 39 ALA HB2 1 1 1 610 1 1 39 ALA HB3 H -4.291 4.405 5.442 1.00 . A A . 39 ALA HB3 1 1 1 611 1 1 39 ALA N N -3.291 1.989 5.223 1.00 . A A . 39 ALA N 1 1 1 612 1 1 39 ALA O O -0.623 4.334 5.471 1.00 . A A . 39 ALA O 1 1 1 613 1 1 40 TYR C C 0.456 2.964 7.968 1.00 . A A . 40 TYR C 1 1 1 614 1 1 40 TYR CA C -0.896 3.650 8.147 1.00 . A A . 40 TYR CA 1 1 1 615 1 1 40 TYR CB C -1.497 3.274 9.501 1.00 . A A . 40 TYR CB 1 1 1 616 1 1 40 TYR CD1 C -0.528 4.945 11.125 1.00 . A A . 40 TYR CD1 1 1 1 617 1 1 40 TYR CD2 C 0.124 2.661 11.334 1.00 . A A . 40 TYR CD2 1 1 1 618 1 1 40 TYR CE1 C 0.276 5.278 12.198 1.00 . A A . 40 TYR CE1 1 1 1 619 1 1 40 TYR CE2 C 0.931 2.986 12.408 1.00 . A A . 40 TYR CE2 1 1 1 620 1 1 40 TYR CG C -0.617 3.634 10.675 1.00 . A A . 40 TYR CG 1 1 1 621 1 1 40 TYR CZ C 1.003 4.296 12.836 1.00 . A A . 40 TYR CZ 1 1 1 622 1 1 40 TYR H H -2.608 2.754 7.284 1.00 . A A . 40 TYR H 1 1 1 623 1 1 40 TYR HA H -0.751 4.719 8.112 1.00 . A A . 40 TYR HA 1 1 1 624 1 1 40 TYR HB2 H -2.440 3.791 9.624 1.00 . A A . 40 TYR HB2 1 1 1 625 1 1 40 TYR HB3 H -1.668 2.206 9.527 1.00 . A A . 40 TYR HB3 1 1 1 626 1 1 40 TYR HD1 H -1.099 5.712 10.623 1.00 . A A . 40 TYR HD1 1 1 1 627 1 1 40 TYR HD2 H 0.066 1.638 10.995 1.00 . A A . 40 TYR HD2 1 1 1 628 1 1 40 TYR HE1 H 0.332 6.303 12.532 1.00 . A A . 40 TYR HE1 1 1 1 629 1 1 40 TYR HE2 H 1.501 2.218 12.908 1.00 . A A . 40 TYR HE2 1 1 1 630 1 1 40 TYR HH H 1.362 5.282 14.447 1.00 . A A . 40 TYR HH 1 1 1 631 1 1 40 TYR N N -1.813 3.288 7.072 1.00 . A A . 40 TYR N 1 1 1 632 1 1 40 TYR O O 1.461 3.616 7.683 1.00 . A A . 40 TYR O 1 1 1 633 1 1 40 TYR OH O 1.804 4.623 13.906 1.00 . A A . 40 TYR OH 1 1 1 634 1 1 41 ARG C C 2.338 1.084 6.635 1.00 . A A . 41 ARG C 1 1 1 635 1 1 41 ARG CA C 1.703 0.872 8.007 1.00 . A A . 41 ARG CA 1 1 1 636 1 1 41 ARG CB C 1.417 -0.616 8.225 1.00 . A A . 41 ARG CB 1 1 1 637 1 1 41 ARG CD C -0.207 -1.409 9.976 1.00 . A A . 41 ARG CD 1 1 1 638 1 1 41 ARG CG C 1.226 -0.990 9.686 1.00 . A A . 41 ARG CG 1 1 1 639 1 1 41 ARG CZ C -0.308 -1.608 12.430 1.00 . A A . 41 ARG CZ 1 1 1 640 1 1 41 ARG H H -0.360 1.185 8.372 1.00 . A A . 41 ARG H 1 1 1 641 1 1 41 ARG HA H 2.393 1.210 8.765 1.00 . A A . 41 ARG HA 1 1 1 642 1 1 41 ARG HB2 H 0.520 -0.881 7.685 1.00 . A A . 41 ARG HB2 1 1 1 643 1 1 41 ARG HB3 H 2.244 -1.189 7.833 1.00 . A A . 41 ARG HB3 1 1 1 644 1 1 41 ARG HD2 H -0.854 -0.966 9.234 1.00 . A A . 41 ARG HD2 1 1 1 645 1 1 41 ARG HD3 H -0.273 -2.486 9.911 1.00 . A A . 41 ARG HD3 1 1 1 646 1 1 41 ARG HE H -1.223 -0.194 11.357 1.00 . A A . 41 ARG HE 1 1 1 647 1 1 41 ARG HG2 H 1.885 -1.811 9.926 1.00 . A A . 41 ARG HG2 1 1 1 648 1 1 41 ARG HG3 H 1.473 -0.137 10.302 1.00 . A A . 41 ARG HG3 1 1 1 649 1 1 41 ARG HH11 H 0.812 -3.025 11.520 1.00 . A A . 41 ARG HH11 1 1 1 650 1 1 41 ARG HH12 H 0.724 -3.143 13.246 1.00 . A A . 41 ARG HH12 1 1 1 651 1 1 41 ARG HH21 H -1.340 -0.349 13.627 1.00 . A A . 41 ARG HH21 1 1 1 652 1 1 41 ARG HH22 H -0.499 -1.624 14.442 1.00 . A A . 41 ARG HH22 1 1 1 653 1 1 41 ARG N N 0.473 1.647 8.144 1.00 . A A . 41 ARG N 1 1 1 654 1 1 41 ARG NE N -0.646 -0.985 11.302 1.00 . A A . 41 ARG NE 1 1 1 655 1 1 41 ARG NH1 N 0.474 -2.680 12.396 1.00 . A A . 41 ARG NH1 1 1 1 656 1 1 41 ARG NH2 N -0.751 -1.157 13.594 1.00 . A A . 41 ARG NH2 1 1 1 657 1 1 41 ARG O O 3.555 0.984 6.482 1.00 . A A . 41 ARG O 1 1 1 658 1 1 42 LEU C C 2.987 2.755 4.239 1.00 . A A . 42 LEU C 1 1 1 659 1 1 42 LEU CA C 1.989 1.602 4.283 1.00 . A A . 42 LEU CA 1 1 1 660 1 1 42 LEU CB C 0.815 1.888 3.344 1.00 . A A . 42 LEU CB 1 1 1 661 1 1 42 LEU CD1 C -1.042 1.020 1.901 1.00 . A A . 42 LEU CD1 1 1 1 662 1 1 42 LEU CD2 C 1.260 0.057 1.693 1.00 . A A . 42 LEU CD2 1 1 1 663 1 1 42 LEU CG C 0.236 0.658 2.644 1.00 . A A . 42 LEU CG 1 1 1 664 1 1 42 LEU H H 0.547 1.443 5.822 1.00 . A A . 42 LEU H 1 1 1 665 1 1 42 LEU HA H 2.485 0.701 3.956 1.00 . A A . 42 LEU HA 1 1 1 666 1 1 42 LEU HB2 H 0.028 2.356 3.918 1.00 . A A . 42 LEU HB2 1 1 1 667 1 1 42 LEU HB3 H 1.147 2.583 2.586 1.00 . A A . 42 LEU HB3 1 1 1 668 1 1 42 LEU HD11 H -1.062 2.084 1.717 1.00 . A A . 42 LEU HD11 1 1 1 669 1 1 42 LEU HD12 H -1.896 0.741 2.499 1.00 . A A . 42 LEU HD12 1 1 1 670 1 1 42 LEU HD13 H -1.073 0.490 0.960 1.00 . A A . 42 LEU HD13 1 1 1 671 1 1 42 LEU HD21 H 1.988 0.809 1.427 1.00 . A A . 42 LEU HD21 1 1 1 672 1 1 42 LEU HD22 H 0.760 -0.294 0.801 1.00 . A A . 42 LEU HD22 1 1 1 673 1 1 42 LEU HD23 H 1.758 -0.770 2.176 1.00 . A A . 42 LEU HD23 1 1 1 674 1 1 42 LEU HG H -0.010 -0.087 3.387 1.00 . A A . 42 LEU HG 1 1 1 675 1 1 42 LEU N N 1.507 1.378 5.640 1.00 . A A . 42 LEU N 1 1 1 676 1 1 42 LEU O O 3.925 2.748 3.441 1.00 . A A . 42 LEU O 1 1 1 677 1 1 43 GLU C C 5.042 4.532 5.692 1.00 . A A . 43 GLU C 1 1 1 678 1 1 43 GLU CA C 3.661 4.908 5.157 1.00 . A A . 43 GLU CA 1 1 1 679 1 1 43 GLU CB C 3.042 5.999 6.035 1.00 . A A . 43 GLU CB 1 1 1 680 1 1 43 GLU CD C 3.381 8.221 7.187 1.00 . A A . 43 GLU CD 1 1 1 681 1 1 43 GLU CG C 3.892 7.255 6.136 1.00 . A A . 43 GLU CG 1 1 1 682 1 1 43 GLU H H 2.015 3.698 5.710 1.00 . A A . 43 GLU H 1 1 1 683 1 1 43 GLU HA H 3.772 5.289 4.153 1.00 . A A . 43 GLU HA 1 1 1 684 1 1 43 GLU HB2 H 2.081 6.272 5.625 1.00 . A A . 43 GLU HB2 1 1 1 685 1 1 43 GLU HB3 H 2.900 5.606 7.030 1.00 . A A . 43 GLU HB3 1 1 1 686 1 1 43 GLU HG2 H 4.902 6.972 6.391 1.00 . A A . 43 GLU HG2 1 1 1 687 1 1 43 GLU HG3 H 3.891 7.753 5.178 1.00 . A A . 43 GLU HG3 1 1 1 688 1 1 43 GLU N N 2.780 3.747 5.100 1.00 . A A . 43 GLU N 1 1 1 689 1 1 43 GLU O O 6.018 5.246 5.466 1.00 . A A . 43 GLU O 1 1 1 690 1 1 43 GLU OE1 O 2.769 7.756 8.171 1.00 . A A . 43 GLU OE1 1 1 1 691 1 1 43 GLU OE2 O 3.591 9.442 7.025 1.00 . A A . 43 GLU OE2 1 1 1 692 1 1 44 ILE C C 7.148 2.076 5.980 1.00 . A A . 44 ILE C 1 1 1 693 1 1 44 ILE CA C 6.383 2.951 6.967 1.00 . A A . 44 ILE CA 1 1 1 694 1 1 44 ILE CB C 6.161 2.162 8.270 1.00 . A A . 44 ILE CB 1 1 1 695 1 1 44 ILE CD1 C 5.468 2.676 10.678 1.00 . A A . 44 ILE CD1 1 1 1 696 1 1 44 ILE CG1 C 5.238 2.951 9.207 1.00 . A A . 44 ILE CG1 1 1 1 697 1 1 44 ILE CG2 C 7.500 1.862 8.935 1.00 . A A . 44 ILE CG2 1 1 1 698 1 1 44 ILE H H 4.309 2.882 6.554 1.00 . A A . 44 ILE H 1 1 1 699 1 1 44 ILE HA H 6.978 3.821 7.201 1.00 . A A . 44 ILE HA 1 1 1 700 1 1 44 ILE HB H 5.692 1.223 8.020 1.00 . A A . 44 ILE HB 1 1 1 701 1 1 44 ILE HD11 H 6.477 2.962 10.940 1.00 . A A . 44 ILE HD11 1 1 1 702 1 1 44 ILE HD12 H 5.327 1.625 10.874 1.00 . A A . 44 ILE HD12 1 1 1 703 1 1 44 ILE HD13 H 4.767 3.251 11.265 1.00 . A A . 44 ILE HD13 1 1 1 704 1 1 44 ILE HG12 H 5.388 4.007 9.044 1.00 . A A . 44 ILE HG12 1 1 1 705 1 1 44 ILE HG13 H 4.211 2.701 8.981 1.00 . A A . 44 ILE HG13 1 1 1 706 1 1 44 ILE HG21 H 7.791 2.700 9.551 1.00 . A A . 44 ILE HG21 1 1 1 707 1 1 44 ILE HG22 H 8.250 1.695 8.177 1.00 . A A . 44 ILE HG22 1 1 1 708 1 1 44 ILE HG23 H 7.406 0.979 9.549 1.00 . A A . 44 ILE HG23 1 1 1 709 1 1 44 ILE N N 5.120 3.410 6.402 1.00 . A A . 44 ILE N 1 1 1 710 1 1 44 ILE O O 8.333 2.293 5.731 1.00 . A A . 44 ILE O 1 1 1 711 1 1 45 VAL C C 7.624 0.920 3.256 1.00 . A A . 45 VAL C 1 1 1 712 1 1 45 VAL CA C 7.078 0.169 4.465 1.00 . A A . 45 VAL CA 1 1 1 713 1 1 45 VAL CB C 6.080 -0.899 3.974 1.00 . A A . 45 VAL CB 1 1 1 714 1 1 45 VAL CG1 C 5.941 -2.012 5.000 1.00 . A A . 45 VAL CG1 1 1 1 715 1 1 45 VAL CG2 C 4.728 -0.274 3.666 1.00 . A A . 45 VAL CG2 1 1 1 716 1 1 45 VAL H H 5.521 0.960 5.664 1.00 . A A . 45 VAL H 1 1 1 717 1 1 45 VAL HA H 7.894 -0.334 4.962 1.00 . A A . 45 VAL HA 1 1 1 718 1 1 45 VAL HB H 6.469 -1.327 3.062 1.00 . A A . 45 VAL HB 1 1 1 719 1 1 45 VAL HG11 H 4.910 -2.332 5.048 1.00 . A A . 45 VAL HG11 1 1 1 720 1 1 45 VAL HG12 H 6.252 -1.650 5.968 1.00 . A A . 45 VAL HG12 1 1 1 721 1 1 45 VAL HG13 H 6.563 -2.846 4.712 1.00 . A A . 45 VAL HG13 1 1 1 722 1 1 45 VAL HG21 H 4.870 0.635 3.100 1.00 . A A . 45 VAL HG21 1 1 1 723 1 1 45 VAL HG22 H 4.216 -0.046 4.590 1.00 . A A . 45 VAL HG22 1 1 1 724 1 1 45 VAL HG23 H 4.134 -0.968 3.089 1.00 . A A . 45 VAL HG23 1 1 1 725 1 1 45 VAL N N 6.463 1.083 5.424 1.00 . A A . 45 VAL N 1 1 1 726 1 1 45 VAL O O 8.674 0.570 2.717 1.00 . A A . 45 VAL O 1 1 1 727 1 1 46 THR C C 8.375 3.775 2.059 1.00 . A A . 46 THR C 1 1 1 728 1 1 46 THR CA C 7.301 2.750 1.688 1.00 . A A . 46 THR CA 1 1 1 729 1 1 46 THR CB C 6.080 3.464 1.111 1.00 . A A . 46 THR CB 1 1 1 730 1 1 46 THR CG2 C 5.013 2.514 0.613 1.00 . A A . 46 THR CG2 1 1 1 731 1 1 46 THR H H 6.073 2.174 3.298 1.00 . A A . 46 THR H 1 1 1 732 1 1 46 THR HA H 7.700 2.083 0.939 1.00 . A A . 46 THR HA 1 1 1 733 1 1 46 THR HB H 6.395 4.071 0.281 1.00 . A A . 46 THR HB 1 1 1 734 1 1 46 THR HG1 H 5.049 3.778 2.748 1.00 . A A . 46 THR HG1 1 1 1 735 1 1 46 THR HG21 H 4.237 3.074 0.113 1.00 . A A . 46 THR HG21 1 1 1 736 1 1 46 THR HG22 H 4.588 1.979 1.450 1.00 . A A . 46 THR HG22 1 1 1 737 1 1 46 THR HG23 H 5.450 1.809 -0.078 1.00 . A A . 46 THR HG23 1 1 1 738 1 1 46 THR N N 6.901 1.950 2.832 1.00 . A A . 46 THR N 1 1 1 739 1 1 46 THR O O 8.758 4.605 1.235 1.00 . A A . 46 THR O 1 1 1 740 1 1 46 THR OG1 O 5.489 4.310 2.081 1.00 . A A . 46 THR OG1 1 1 1 741 1 1 47 ALA C C 9.340 6.062 3.855 1.00 . A A . 47 ALA C 1 1 1 742 1 1 47 ALA CA C 9.887 4.642 3.763 1.00 . A A . 47 ALA CA 1 1 1 743 1 1 47 ALA CB C 11.099 4.599 2.842 1.00 . A A . 47 ALA CB 1 1 1 744 1 1 47 ALA H H 8.520 3.037 3.916 1.00 . A A . 47 ALA H 1 1 1 745 1 1 47 ALA HA H 10.200 4.326 4.747 1.00 . A A . 47 ALA HA 1 1 1 746 1 1 47 ALA HB1 H 11.370 3.572 2.653 1.00 . A A . 47 ALA HB1 1 1 1 747 1 1 47 ALA HB2 H 11.927 5.108 3.315 1.00 . A A . 47 ALA HB2 1 1 1 748 1 1 47 ALA HB3 H 10.860 5.087 1.910 1.00 . A A . 47 ALA HB3 1 1 1 749 1 1 47 ALA N N 8.861 3.716 3.299 1.00 . A A . 47 ALA N 1 1 1 750 1 1 47 ALA O O 10.059 7.032 3.611 1.00 . A A . 47 ALA O 1 1 1 751 1 1 48 GLY C C 7.116 8.099 2.980 1.00 . A A . 48 GLY C 1 1 1 752 1 1 48 GLY CA C 7.441 7.482 4.327 1.00 . A A . 48 GLY CA 1 1 1 753 1 1 48 GLY H H 7.540 5.367 4.389 1.00 . A A . 48 GLY H 1 1 1 754 1 1 48 GLY HA2 H 6.528 7.382 4.894 1.00 . A A . 48 GLY HA2 1 1 1 755 1 1 48 GLY HA3 H 8.111 8.140 4.859 1.00 . A A . 48 GLY HA3 1 1 1 756 1 1 48 GLY N N 8.064 6.176 4.207 1.00 . A A . 48 GLY N 1 1 1 757 1 1 48 GLY O O 7.040 9.321 2.853 1.00 . A A . 48 GLY O 1 1 1 758 1 1 49 ALA C C 5.307 8.531 0.631 1.00 . A A . 49 ALA C 1 1 1 759 1 1 49 ALA CA C 6.602 7.726 0.632 1.00 . A A . 49 ALA CA 1 1 1 760 1 1 49 ALA CB C 6.499 6.554 -0.331 1.00 . A A . 49 ALA CB 1 1 1 761 1 1 49 ALA H H 6.995 6.290 2.135 1.00 . A A . 49 ALA H 1 1 1 762 1 1 49 ALA HA H 7.410 8.365 0.301 1.00 . A A . 49 ALA HA 1 1 1 763 1 1 49 ALA HB1 H 5.686 5.911 -0.028 1.00 . A A . 49 ALA HB1 1 1 1 764 1 1 49 ALA HB2 H 7.424 5.995 -0.320 1.00 . A A . 49 ALA HB2 1 1 1 765 1 1 49 ALA HB3 H 6.314 6.922 -1.329 1.00 . A A . 49 ALA HB3 1 1 1 766 1 1 49 ALA N N 6.923 7.254 1.973 1.00 . A A . 49 ALA N 1 1 1 767 1 1 49 ALA O O 5.301 9.719 0.310 1.00 . A A . 49 ALA O 1 1 1 768 1 1 50 LEU C C 2.597 9.016 2.453 1.00 . A A . 50 LEU C 1 1 1 769 1 1 50 LEU CA C 2.907 8.528 1.042 1.00 . A A . 50 LEU CA 1 1 1 770 1 1 50 LEU CB C 1.815 7.566 0.570 1.00 . A A . 50 LEU CB 1 1 1 771 1 1 50 LEU CD1 C 1.557 5.385 -0.643 1.00 . A A . 50 LEU CD1 1 1 1 772 1 1 50 LEU CD2 C 1.633 7.528 -1.930 1.00 . A A . 50 LEU CD2 1 1 1 773 1 1 50 LEU CG C 2.146 6.787 -0.704 1.00 . A A . 50 LEU CG 1 1 1 774 1 1 50 LEU H H 4.280 6.929 1.244 1.00 . A A . 50 LEU H 1 1 1 775 1 1 50 LEU HA H 2.939 9.378 0.378 1.00 . A A . 50 LEU HA 1 1 1 776 1 1 50 LEU HB2 H 1.621 6.857 1.362 1.00 . A A . 50 LEU HB2 1 1 1 777 1 1 50 LEU HB3 H 0.916 8.136 0.392 1.00 . A A . 50 LEU HB3 1 1 1 778 1 1 50 LEU HD11 H 1.468 4.987 -1.643 1.00 . A A . 50 LEU HD11 1 1 1 779 1 1 50 LEU HD12 H 0.581 5.425 -0.183 1.00 . A A . 50 LEU HD12 1 1 1 780 1 1 50 LEU HD13 H 2.205 4.747 -0.059 1.00 . A A . 50 LEU HD13 1 1 1 781 1 1 50 LEU HD21 H 0.616 7.849 -1.758 1.00 . A A . 50 LEU HD21 1 1 1 782 1 1 50 LEU HD22 H 1.663 6.871 -2.788 1.00 . A A . 50 LEU HD22 1 1 1 783 1 1 50 LEU HD23 H 2.256 8.390 -2.116 1.00 . A A . 50 LEU HD23 1 1 1 784 1 1 50 LEU HG H 3.218 6.694 -0.794 1.00 . A A . 50 LEU HG 1 1 1 785 1 1 50 LEU N N 4.210 7.875 0.996 1.00 . A A . 50 LEU N 1 1 1 786 1 1 50 LEU O O 2.607 8.237 3.407 1.00 . A A . 50 LEU O 1 1 1 787 1 1 51 LYS C C 0.561 10.629 4.268 1.00 . A A . 51 LYS C 1 1 1 788 1 1 51 LYS CA C 2.012 10.900 3.879 1.00 . A A . 51 LYS CA 1 1 1 789 1 1 51 LYS CB C 2.274 12.407 3.856 1.00 . A A . 51 LYS CB 1 1 1 790 1 1 51 LYS CD C 1.803 14.622 2.765 1.00 . A A . 51 LYS CD 1 1 1 791 1 1 51 LYS CE C 0.604 15.558 2.721 1.00 . A A . 51 LYS CE 1 1 1 792 1 1 51 LYS CG C 1.373 13.168 2.897 1.00 . A A . 51 LYS CG 1 1 1 793 1 1 51 LYS H H 2.330 10.882 1.786 1.00 . A A . 51 LYS H 1 1 1 794 1 1 51 LYS HA H 2.659 10.442 4.613 1.00 . A A . 51 LYS HA 1 1 1 795 1 1 51 LYS HB2 H 2.122 12.801 4.850 1.00 . A A . 51 LYS HB2 1 1 1 796 1 1 51 LYS HB3 H 3.300 12.576 3.564 1.00 . A A . 51 LYS HB3 1 1 1 797 1 1 51 LYS HD2 H 2.419 14.884 3.612 1.00 . A A . 51 LYS HD2 1 1 1 798 1 1 51 LYS HD3 H 2.371 14.737 1.855 1.00 . A A . 51 LYS HD3 1 1 1 799 1 1 51 LYS HE2 H 0.641 16.127 1.805 1.00 . A A . 51 LYS HE2 1 1 1 800 1 1 51 LYS HE3 H -0.300 14.967 2.740 1.00 . A A . 51 LYS HE3 1 1 1 801 1 1 51 LYS HG2 H 1.422 12.701 1.925 1.00 . A A . 51 LYS HG2 1 1 1 802 1 1 51 LYS HG3 H 0.359 13.133 3.267 1.00 . A A . 51 LYS HG3 1 1 1 803 1 1 51 LYS HZ1 H 1.560 16.636 4.233 1.00 . A A . 51 LYS HZ1 1 1 1 804 1 1 51 LYS HZ2 H 0.002 16.121 4.640 1.00 . A A . 51 LYS HZ2 1 1 1 805 1 1 51 LYS HZ3 H 0.211 17.421 3.579 1.00 . A A . 51 LYS HZ3 1 1 1 806 1 1 51 LYS N N 2.322 10.311 2.581 1.00 . A A . 51 LYS N 1 1 1 807 1 1 51 LYS NZ N 0.593 16.500 3.874 1.00 . A A . 51 LYS NZ 1 1 1 808 1 1 51 LYS O O -0.366 11.036 3.569 1.00 . A A . 51 LYS O 1 1 1 809 1 1 52 TYR C C -1.700 10.860 6.332 1.00 . A A . 52 TYR C 1 1 1 810 1 1 52 TYR CA C -0.962 9.609 5.870 1.00 . A A . 52 TYR CA 1 1 1 811 1 1 52 TYR CB C -0.878 8.602 7.018 1.00 . A A . 52 TYR CB 1 1 1 812 1 1 52 TYR CD1 C -3.291 8.603 7.771 1.00 . A A . 52 TYR CD1 1 1 1 813 1 1 52 TYR CD2 C -2.312 6.527 7.126 1.00 . A A . 52 TYR CD2 1 1 1 814 1 1 52 TYR CE1 C -4.485 7.961 8.040 1.00 . A A . 52 TYR CE1 1 1 1 815 1 1 52 TYR CE2 C -3.502 5.879 7.393 1.00 . A A . 52 TYR CE2 1 1 1 816 1 1 52 TYR CG C -2.186 7.898 7.309 1.00 . A A . 52 TYR CG 1 1 1 817 1 1 52 TYR CZ C -4.585 6.599 7.850 1.00 . A A . 52 TYR CZ 1 1 1 818 1 1 52 TYR H H 1.153 9.638 5.899 1.00 . A A . 52 TYR H 1 1 1 819 1 1 52 TYR HA H -1.510 9.163 5.052 1.00 . A A . 52 TYR HA 1 1 1 820 1 1 52 TYR HB2 H -0.145 7.848 6.774 1.00 . A A . 52 TYR HB2 1 1 1 821 1 1 52 TYR HB3 H -0.570 9.117 7.917 1.00 . A A . 52 TYR HB3 1 1 1 822 1 1 52 TYR HD1 H -3.212 9.669 7.918 1.00 . A A . 52 TYR HD1 1 1 1 823 1 1 52 TYR HD2 H -1.463 5.966 6.766 1.00 . A A . 52 TYR HD2 1 1 1 824 1 1 52 TYR HE1 H -5.332 8.525 8.399 1.00 . A A . 52 TYR HE1 1 1 1 825 1 1 52 TYR HE2 H -3.581 4.813 7.244 1.00 . A A . 52 TYR HE2 1 1 1 826 1 1 52 TYR HH H -6.283 5.879 7.311 1.00 . A A . 52 TYR HH 1 1 1 827 1 1 52 TYR N N 0.374 9.936 5.387 1.00 . A A . 52 TYR N 1 1 1 828 1 1 52 TYR O O -1.147 11.689 7.057 1.00 . A A . 52 TYR O 1 1 1 829 1 1 52 TYR OH O -5.771 5.955 8.119 1.00 . A A . 52 TYR OH 1 1 1 830 1 1 53 GLN C C -5.155 11.675 6.741 1.00 . A A . 53 GLN C 1 1 1 831 1 1 53 GLN CA C -3.775 12.133 6.285 1.00 . A A . 53 GLN CA 1 1 1 832 1 1 53 GLN CB C -3.909 13.100 5.105 1.00 . A A . 53 GLN CB 1 1 1 833 1 1 53 GLN CD C -5.184 13.114 2.924 1.00 . A A . 53 GLN CD 1 1 1 834 1 1 53 GLN CG C -4.147 12.407 3.772 1.00 . A A . 53 GLN CG 1 1 1 835 1 1 53 GLN H H -3.339 10.291 5.340 1.00 . A A . 53 GLN H 1 1 1 836 1 1 53 GLN HA H -3.288 12.641 7.102 1.00 . A A . 53 GLN HA 1 1 1 837 1 1 53 GLN HB2 H -4.738 13.767 5.292 1.00 . A A . 53 GLN HB2 1 1 1 838 1 1 53 GLN HB3 H -3.002 13.681 5.027 1.00 . A A . 53 GLN HB3 1 1 1 839 1 1 53 GLN HE21 H -4.410 14.880 3.403 1.00 . A A . 53 GLN HE21 1 1 1 840 1 1 53 GLN HE22 H -5.775 14.922 2.346 1.00 . A A . 53 GLN HE22 1 1 1 841 1 1 53 GLN HG2 H -3.216 12.377 3.226 1.00 . A A . 53 GLN HG2 1 1 1 842 1 1 53 GLN HG3 H -4.484 11.398 3.962 1.00 . A A . 53 GLN HG3 1 1 1 843 1 1 53 GLN N N -2.954 10.987 5.913 1.00 . A A . 53 GLN N 1 1 1 844 1 1 53 GLN NE2 N -5.117 14.440 2.888 1.00 . A A . 53 GLN NE2 1 1 1 845 1 1 53 GLN O O -5.717 10.731 6.188 1.00 . A A . 53 GLN O 1 1 1 846 1 1 53 GLN OE1 O -6.038 12.476 2.307 1.00 . A A . 53 GLN OE1 1 1 1 847 1 1 54 GLU C C -8.127 12.689 7.503 1.00 . A A . 54 GLU C 1 1 1 848 1 1 54 GLU CA C -7.011 11.996 8.284 1.00 . A A . 54 GLU CA 1 1 1 849 1 1 54 GLU CB C -7.097 12.370 9.767 1.00 . A A . 54 GLU CB 1 1 1 850 1 1 54 GLU CD C -7.550 11.177 11.946 1.00 . A A . 54 GLU CD 1 1 1 851 1 1 54 GLU CG C -6.685 11.245 10.703 1.00 . A A . 54 GLU CG 1 1 1 852 1 1 54 GLU H H -5.199 13.087 8.155 1.00 . A A . 54 GLU H 1 1 1 853 1 1 54 GLU HA H -7.133 10.927 8.186 1.00 . A A . 54 GLU HA 1 1 1 854 1 1 54 GLU HB2 H -6.453 13.216 9.950 1.00 . A A . 54 GLU HB2 1 1 1 855 1 1 54 GLU HB3 H -8.115 12.646 9.998 1.00 . A A . 54 GLU HB3 1 1 1 856 1 1 54 GLU HG2 H -6.764 10.307 10.175 1.00 . A A . 54 GLU HG2 1 1 1 857 1 1 54 GLU HG3 H -5.659 11.403 11.003 1.00 . A A . 54 GLU HG3 1 1 1 858 1 1 54 GLU N N -5.695 12.344 7.753 1.00 . A A . 54 GLU N 1 1 1 859 1 1 54 GLU O O -9.062 13.233 8.090 1.00 . A A . 54 GLU O 1 1 1 860 1 1 54 GLU OE1 O -8.752 10.865 11.817 1.00 . A A . 54 GLU OE1 1 1 1 861 1 1 54 GLU OE2 O -7.025 11.435 13.050 1.00 . A A . 54 GLU OE2 1 1 1 862 1 1 55 ASN C C -10.130 12.295 4.970 1.00 . A A . 55 ASN C 1 1 1 863 1 1 55 ASN CA C -9.031 13.287 5.326 1.00 . A A . 55 ASN CA 1 1 1 864 1 1 55 ASN CB C -8.384 13.832 4.051 1.00 . A A . 55 ASN CB 1 1 1 865 1 1 55 ASN CG C -7.925 15.269 4.205 1.00 . A A . 55 ASN CG 1 1 1 866 1 1 55 ASN H H -7.264 12.214 5.763 1.00 . A A . 55 ASN H 1 1 1 867 1 1 55 ASN HA H -9.466 14.106 5.876 1.00 . A A . 55 ASN HA 1 1 1 868 1 1 55 ASN HB2 H -7.527 13.226 3.802 1.00 . A A . 55 ASN HB2 1 1 1 869 1 1 55 ASN HB3 H -9.099 13.785 3.243 1.00 . A A . 55 ASN HB3 1 1 1 870 1 1 55 ASN HD21 H -9.022 15.813 2.637 1.00 . A A . 55 ASN HD21 1 1 1 871 1 1 55 ASN HD22 H -8.126 17.077 3.402 1.00 . A A . 55 ASN HD22 1 1 1 872 1 1 55 ASN N N -8.026 12.664 6.177 1.00 . A A . 55 ASN N 1 1 1 873 1 1 55 ASN ND2 N -8.406 16.141 3.326 1.00 . A A . 55 ASN ND2 1 1 1 874 1 1 55 ASN O O -11.290 12.495 5.311 1.00 . A A . 55 ASN O 1 1 1 875 1 1 55 ASN OD1 O -7.149 15.594 5.104 1.00 . A A . 55 ASN OD1 1 1 1 876 1 1 56 ALA C C -10.920 9.165 4.978 1.00 . A A . 56 ALA C 1 1 1 877 1 1 56 ALA CA C -10.700 10.198 3.874 1.00 . A A . 56 ALA CA 1 1 1 878 1 1 56 ALA CB C -10.230 9.517 2.599 1.00 . A A . 56 ALA CB 1 1 1 879 1 1 56 ALA H H -8.811 11.121 4.036 1.00 . A A . 56 ALA H 1 1 1 880 1 1 56 ALA HA H -11.650 10.685 3.664 1.00 . A A . 56 ALA HA 1 1 1 881 1 1 56 ALA HB1 H -10.440 10.152 1.751 1.00 . A A . 56 ALA HB1 1 1 1 882 1 1 56 ALA HB2 H -10.750 8.577 2.480 1.00 . A A . 56 ALA HB2 1 1 1 883 1 1 56 ALA HB3 H -9.172 9.337 2.660 1.00 . A A . 56 ALA HB3 1 1 1 884 1 1 56 ALA N N -9.755 11.224 4.279 1.00 . A A . 56 ALA N 1 1 1 885 1 1 56 ALA O O -11.780 8.297 4.865 1.00 . A A . 56 ALA O 1 1 1 886 1 1 57 TYR C C -10.890 8.997 8.372 1.00 . A A . 57 TYR C 1 1 1 887 1 1 57 TYR CA C -10.240 8.325 7.162 1.00 . A A . 57 TYR CA 1 1 1 888 1 1 57 TYR CB C -8.866 7.782 7.540 1.00 . A A . 57 TYR CB 1 1 1 889 1 1 57 TYR CD1 C -8.453 6.388 5.475 1.00 . A A . 57 TYR CD1 1 1 1 890 1 1 57 TYR CD2 C -6.805 7.994 6.099 1.00 . A A . 57 TYR CD2 1 1 1 891 1 1 57 TYR CE1 C -7.688 6.018 4.387 1.00 . A A . 57 TYR CE1 1 1 1 892 1 1 57 TYR CE2 C -6.033 7.630 5.010 1.00 . A A . 57 TYR CE2 1 1 1 893 1 1 57 TYR CG C -8.026 7.381 6.348 1.00 . A A . 57 TYR CG 1 1 1 894 1 1 57 TYR CZ C -6.479 6.641 4.159 1.00 . A A . 57 TYR CZ 1 1 1 895 1 1 57 TYR H H -9.460 9.968 6.085 1.00 . A A . 57 TYR H 1 1 1 896 1 1 57 TYR HA H -10.870 7.504 6.845 1.00 . A A . 57 TYR HA 1 1 1 897 1 1 57 TYR HB2 H -8.326 8.541 8.085 1.00 . A A . 57 TYR HB2 1 1 1 898 1 1 57 TYR HB3 H -8.991 6.913 8.168 1.00 . A A . 57 TYR HB3 1 1 1 899 1 1 57 TYR HD1 H -9.400 5.902 5.657 1.00 . A A . 57 TYR HD1 1 1 1 900 1 1 57 TYR HD2 H -6.458 8.769 6.769 1.00 . A A . 57 TYR HD2 1 1 1 901 1 1 57 TYR HE1 H -8.037 5.245 3.720 1.00 . A A . 57 TYR HE1 1 1 1 902 1 1 57 TYR HE2 H -5.087 8.119 4.833 1.00 . A A . 57 TYR HE2 1 1 1 903 1 1 57 TYR HH H -6.285 6.053 2.337 1.00 . A A . 57 TYR HH 1 1 1 904 1 1 57 TYR N N -10.130 9.258 6.045 1.00 . A A . 57 TYR N 1 1 1 905 1 1 57 TYR O O -10.590 8.651 9.515 1.00 . A A . 57 TYR O 1 1 1 906 1 1 57 TYR OH O -5.713 6.275 3.074 1.00 . A A . 57 TYR OH 1 1 1 907 1 1 58 ARG C C -13.970 10.667 8.951 1.00 . A A . 58 ARG C 1 1 1 908 1 1 58 ARG CA C -12.460 10.671 9.178 1.00 . A A . 58 ARG CA 1 1 1 909 1 1 58 ARG CB C -11.950 12.110 9.268 1.00 . A A . 58 ARG CB 1 1 1 910 1 1 58 ARG CD C -13.570 12.886 11.023 1.00 . A A . 58 ARG CD 1 1 1 911 1 1 58 ARG CG C -12.110 12.726 10.650 1.00 . A A . 58 ARG CG 1 1 1 912 1 1 58 ARG CZ C -13.580 13.163 13.473 1.00 . A A . 58 ARG CZ 1 1 1 913 1 1 58 ARG H H -11.970 10.182 7.178 1.00 . A A . 58 ARG H 1 1 1 914 1 1 58 ARG HA H -12.250 10.163 10.109 1.00 . A A . 58 ARG HA 1 1 1 915 1 1 58 ARG HB2 H -10.900 12.125 9.009 1.00 . A A . 58 ARG HB2 1 1 1 916 1 1 58 ARG HB3 H -12.500 12.718 8.562 1.00 . A A . 58 ARG HB3 1 1 1 917 1 1 58 ARG HD2 H -14.080 13.389 10.216 1.00 . A A . 58 ARG HD2 1 1 1 918 1 1 58 ARG HD3 H -14.000 11.906 11.164 1.00 . A A . 58 ARG HD3 1 1 1 919 1 1 58 ARG HE H -13.990 14.606 12.157 1.00 . A A . 58 ARG HE 1 1 1 920 1 1 58 ARG HG2 H -11.630 12.086 11.375 1.00 . A A . 58 ARG HG2 1 1 1 921 1 1 58 ARG HG3 H -11.640 13.697 10.655 1.00 . A A . 58 ARG HG3 1 1 1 922 1 1 58 ARG HH11 H -13.110 11.299 12.843 1.00 . A A . 58 ARG HH11 1 1 1 923 1 1 58 ARG HH12 H -13.120 11.521 14.560 1.00 . A A . 58 ARG HH12 1 1 1 924 1 1 58 ARG HH21 H -14.010 14.899 14.415 1.00 . A A . 58 ARG HH21 1 1 1 925 1 1 58 ARG HH22 H -13.630 13.564 15.454 1.00 . A A . 58 ARG HH22 1 1 1 926 1 1 58 ARG N N -11.770 9.953 8.110 1.00 . A A . 58 ARG N 1 1 1 927 1 1 58 ARG NE N -13.740 13.663 12.250 1.00 . A A . 58 ARG NE 1 1 1 928 1 1 58 ARG NH1 N -13.240 11.890 13.638 1.00 . A A . 58 ARG NH1 1 1 1 929 1 1 58 ARG NH2 N -13.750 13.938 14.534 1.00 . A A . 58 ARG NH2 1 1 1 930 1 1 58 ARG O O -14.490 11.460 8.165 1.00 . A A . 58 ARG O 1 1 1 931 1 1 59 GLN C C -16.770 9.541 10.881 1.00 . A A . 59 GLN C 1 1 1 932 1 1 59 GLN CA C -16.110 9.668 9.513 1.00 . A A . 59 GLN CA 1 1 1 933 1 1 59 GLN CB C -16.480 8.467 8.641 1.00 . A A . 59 GLN CB 1 1 1 934 1 1 59 GLN CD C -17.430 7.947 6.355 1.00 . A A . 59 GLN CD 1 1 1 935 1 1 59 GLN CG C -16.420 8.755 7.150 1.00 . A A . 59 GLN CG 1 1 1 936 1 1 59 GLN H H -14.190 9.167 10.252 1.00 . A A . 59 GLN H 1 1 1 937 1 1 59 GLN HA H -16.470 10.569 9.038 1.00 . A A . 59 GLN HA 1 1 1 938 1 1 59 GLN HB2 H -15.800 7.656 8.857 1.00 . A A . 59 GLN HB2 1 1 1 939 1 1 59 GLN HB3 H -17.490 8.157 8.883 1.00 . A A . 59 GLN HB3 1 1 1 940 1 1 59 GLN HE21 H -16.030 6.617 5.883 1.00 . A A . 59 GLN HE21 1 1 1 941 1 1 59 GLN HE22 H -17.600 6.304 5.250 1.00 . A A . 59 GLN HE22 1 1 1 942 1 1 59 GLN HG2 H -16.620 9.805 6.991 1.00 . A A . 59 GLN HG2 1 1 1 943 1 1 59 GLN HG3 H -15.430 8.520 6.792 1.00 . A A . 59 GLN HG3 1 1 1 944 1 1 59 GLN N N -14.670 9.772 9.641 1.00 . A A . 59 GLN N 1 1 1 945 1 1 59 GLN NE2 N -16.970 6.845 5.771 1.00 . A A . 59 GLN NE2 1 1 1 946 1 1 59 GLN O O -17.110 8.440 11.321 1.00 . A A . 59 GLN O 1 1 1 947 1 1 59 GLN OE1 O -18.600 8.308 6.269 1.00 . A A . 59 GLN OE1 1 1 1 948 1 1 60 ALA C C -18.230 12.040 13.155 1.00 . A A . 60 ALA C 1 1 1 949 1 1 60 ALA CA C -17.580 10.690 12.871 1.00 . A A . 60 ALA CA 1 1 1 950 1 1 60 ALA CB C -16.550 10.361 13.941 1.00 . A A . 60 ALA CB 1 1 1 951 1 1 60 ALA H H -16.670 11.521 11.148 1.00 . A A . 60 ALA H 1 1 1 952 1 1 60 ALA HA H -18.340 9.924 12.889 1.00 . A A . 60 ALA HA 1 1 1 953 1 1 60 ALA HB1 H -17.050 9.951 14.806 1.00 . A A . 60 ALA HB1 1 1 1 954 1 1 60 ALA HB2 H -16.020 11.259 14.221 1.00 . A A . 60 ALA HB2 1 1 1 955 1 1 60 ALA HB3 H -15.850 9.637 13.553 1.00 . A A . 60 ALA HB3 1 1 1 956 1 1 60 ALA N N -16.960 10.674 11.552 1.00 . A A . 60 ALA N 1 1 1 957 1 1 60 ALA O O -17.820 12.758 14.069 1.00 . A A . 60 ALA O 1 1 1 958 1 1 61 ALA C C -21.460 13.455 12.386 1.00 . A A . 61 ALA C 1 1 1 959 1 1 61 ALA CA C -19.950 13.645 12.537 1.00 . A A . 61 ALA CA 1 1 1 960 1 1 61 ALA CB C -19.450 14.670 11.533 1.00 . A A . 61 ALA CB 1 1 1 961 1 1 61 ALA H H -19.520 11.767 11.657 1.00 . A A . 61 ALA H 1 1 1 962 1 1 61 ALA HA H -19.740 14.014 13.530 1.00 . A A . 61 ALA HA 1 1 1 963 1 1 61 ALA HB1 H -19.490 14.254 10.538 1.00 . A A . 61 ALA HB1 1 1 1 964 1 1 61 ALA HB2 H -18.420 14.927 11.766 1.00 . A A . 61 ALA HB2 1 1 1 965 1 1 61 ALA HB3 H -20.060 15.556 11.583 1.00 . A A . 61 ALA HB3 1 1 1 966 1 1 61 ALA N N -19.240 12.380 12.369 1.00 . A A . 61 ALA N 1 1 1 967 1 1 61 ALA O O -22.220 14.179 13.066 1.00 . A A . 61 ALA O 1 1 1 968 1 1 61 ALA OXT O -21.870 12.585 11.590 1.00 . A A . 61 ALA OXT 1 1 2 969 1 1 1 MET C C -5.399 6.312 -1.034 1.00 . A A . 1 MET C 1 1 2 970 1 1 1 MET CA C -4.589 7.265 -0.161 1.00 . A A . 1 MET CA 1 1 2 971 1 1 1 MET CB C -3.692 6.473 0.792 1.00 . A A . 1 MET CB 1 1 2 972 1 1 1 MET CE C -0.941 7.363 2.342 1.00 . A A . 1 MET CE 1 1 2 973 1 1 1 MET CG C -2.306 6.193 0.233 1.00 . A A . 1 MET CG 1 1 2 974 1 1 1 MET H1 H -6.222 7.554 1.055 1.00 . A A . 1 MET H1 1 1 2 975 1 1 1 MET H2 H -5.875 8.862 -0.001 1.00 . A A . 1 MET H2 1 1 2 976 1 1 1 MET H3 H -4.897 8.589 1.383 1.00 . A A . 1 MET H3 1 1 2 977 1 1 1 MET HA H -3.971 7.884 -0.797 1.00 . A A . 1 MET HA 1 1 2 978 1 1 1 MET HB2 H -3.581 7.030 1.710 1.00 . A A . 1 MET HB2 1 1 2 979 1 1 1 MET HB3 H -4.167 5.528 1.010 1.00 . A A . 1 MET HB3 1 1 2 980 1 1 1 MET HE1 H -0.347 8.027 1.729 1.00 . A A . 1 MET HE1 1 1 2 981 1 1 1 MET HE2 H -0.455 7.223 3.296 1.00 . A A . 1 MET HE2 1 1 2 982 1 1 1 MET HE3 H -1.919 7.796 2.497 1.00 . A A . 1 MET HE3 1 1 2 983 1 1 1 MET HG2 H -2.371 5.364 -0.455 1.00 . A A . 1 MET HG2 1 1 2 984 1 1 1 MET HG3 H -1.961 7.071 -0.293 1.00 . A A . 1 MET HG3 1 1 2 985 1 1 1 MET N N -5.475 8.146 0.640 1.00 . A A . 1 MET N 1 1 2 986 1 1 1 MET O O -6.159 5.482 -0.531 1.00 . A A . 1 MET O 1 1 2 987 1 1 1 MET SD S -1.110 5.782 1.519 1.00 . A A . 1 MET SD 1 1 2 988 1 1 2 TYR C C -5.137 4.341 -3.620 1.00 . A A . 2 TYR C 1 1 2 989 1 1 2 TYR CA C -5.946 5.591 -3.293 1.00 . A A . 2 TYR CA 1 1 2 990 1 1 2 TYR CB C -6.245 6.371 -4.574 1.00 . A A . 2 TYR CB 1 1 2 991 1 1 2 TYR CD1 C -7.045 8.686 -3.961 1.00 . A A . 2 TYR CD1 1 1 2 992 1 1 2 TYR CD2 C -8.660 7.096 -4.701 1.00 . A A . 2 TYR CD2 1 1 2 993 1 1 2 TYR CE1 C -8.041 9.632 -3.806 1.00 . A A . 2 TYR CE1 1 1 2 994 1 1 2 TYR CE2 C -9.661 8.037 -4.549 1.00 . A A . 2 TYR CE2 1 1 2 995 1 1 2 TYR CG C -7.338 7.404 -4.411 1.00 . A A . 2 TYR CG 1 1 2 996 1 1 2 TYR CZ C -9.347 9.302 -4.102 1.00 . A A . 2 TYR CZ 1 1 2 997 1 1 2 TYR H H -4.612 7.117 -2.685 1.00 . A A . 2 TYR H 1 1 2 998 1 1 2 TYR HA H -6.877 5.295 -2.836 1.00 . A A . 2 TYR HA 1 1 2 999 1 1 2 TYR HB2 H -5.350 6.884 -4.893 1.00 . A A . 2 TYR HB2 1 1 2 1000 1 1 2 TYR HB3 H -6.552 5.680 -5.345 1.00 . A A . 2 TYR HB3 1 1 2 1001 1 1 2 TYR HD1 H -6.021 8.941 -3.731 1.00 . A A . 2 TYR HD1 1 1 2 1002 1 1 2 TYR HD2 H -8.903 6.106 -5.053 1.00 . A A . 2 TYR HD2 1 1 2 1003 1 1 2 TYR HE1 H -7.794 10.623 -3.456 1.00 . A A . 2 TYR HE1 1 1 2 1004 1 1 2 TYR HE2 H -10.680 7.778 -4.779 1.00 . A A . 2 TYR HE2 1 1 2 1005 1 1 2 TYR HH H -10.380 10.792 -4.735 1.00 . A A . 2 TYR HH 1 1 2 1006 1 1 2 TYR N N -5.232 6.438 -2.346 1.00 . A A . 2 TYR N 1 1 2 1007 1 1 2 TYR O O -3.907 4.379 -3.669 1.00 . A A . 2 TYR O 1 1 2 1008 1 1 2 TYR OH O -10.340 10.241 -3.950 1.00 . A A . 2 TYR OH 1 1 2 1009 1 1 3 LYS C C -4.255 2.126 -5.369 1.00 . A A . 3 LYS C 1 1 2 1010 1 1 3 LYS CA C -5.184 1.968 -4.168 1.00 . A A . 3 LYS CA 1 1 2 1011 1 1 3 LYS CB C -6.230 0.890 -4.456 1.00 . A A . 3 LYS CB 1 1 2 1012 1 1 3 LYS CD C -6.726 -1.552 -4.787 1.00 . A A . 3 LYS CD 1 1 2 1013 1 1 3 LYS CE C -7.011 -1.857 -6.248 1.00 . A A . 3 LYS CE 1 1 2 1014 1 1 3 LYS CG C -5.638 -0.499 -4.641 1.00 . A A . 3 LYS CG 1 1 2 1015 1 1 3 LYS H H -6.815 3.264 -3.791 1.00 . A A . 3 LYS H 1 1 2 1016 1 1 3 LYS HA H -4.597 1.669 -3.313 1.00 . A A . 3 LYS HA 1 1 2 1017 1 1 3 LYS HB2 H -6.928 0.853 -3.634 1.00 . A A . 3 LYS HB2 1 1 2 1018 1 1 3 LYS HB3 H -6.762 1.153 -5.358 1.00 . A A . 3 LYS HB3 1 1 2 1019 1 1 3 LYS HD2 H -6.404 -2.459 -4.297 1.00 . A A . 3 LYS HD2 1 1 2 1020 1 1 3 LYS HD3 H -7.629 -1.189 -4.321 1.00 . A A . 3 LYS HD3 1 1 2 1021 1 1 3 LYS HE2 H -6.072 -1.947 -6.774 1.00 . A A . 3 LYS HE2 1 1 2 1022 1 1 3 LYS HE3 H -7.549 -2.792 -6.309 1.00 . A A . 3 LYS HE3 1 1 2 1023 1 1 3 LYS HG2 H -5.024 -0.503 -5.528 1.00 . A A . 3 LYS HG2 1 1 2 1024 1 1 3 LYS HG3 H -5.032 -0.739 -3.779 1.00 . A A . 3 LYS HG3 1 1 2 1025 1 1 3 LYS HZ1 H -7.228 0.042 -7.093 1.00 . A A . 3 LYS HZ1 1 1 2 1026 1 1 3 LYS HZ2 H -8.597 -0.497 -6.260 1.00 . A A . 3 LYS HZ2 1 1 2 1027 1 1 3 LYS HZ3 H -8.230 -1.134 -7.784 1.00 . A A . 3 LYS HZ3 1 1 2 1028 1 1 3 LYS N N -5.836 3.231 -3.844 1.00 . A A . 3 LYS N 1 1 2 1029 1 1 3 LYS NZ N -7.824 -0.787 -6.891 1.00 . A A . 3 LYS NZ 1 1 2 1030 1 1 3 LYS O O -3.248 1.427 -5.484 1.00 . A A . 3 LYS O 1 1 2 1031 1 1 4 LYS C C -2.398 3.771 -7.067 1.00 . A A . 4 LYS C 1 1 2 1032 1 1 4 LYS CA C -3.799 3.305 -7.449 1.00 . A A . 4 LYS CA 1 1 2 1033 1 1 4 LYS CB C -4.476 4.355 -8.330 1.00 . A A . 4 LYS CB 1 1 2 1034 1 1 4 LYS CD C -4.431 5.645 -10.485 1.00 . A A . 4 LYS CD 1 1 2 1035 1 1 4 LYS CE C -4.035 5.609 -11.953 1.00 . A A . 4 LYS CE 1 1 2 1036 1 1 4 LYS CG C -3.905 4.432 -9.736 1.00 . A A . 4 LYS CG 1 1 2 1037 1 1 4 LYS H H -5.415 3.577 -6.111 1.00 . A A . 4 LYS H 1 1 2 1038 1 1 4 LYS HA H -3.721 2.380 -8.000 1.00 . A A . 4 LYS HA 1 1 2 1039 1 1 4 LYS HB2 H -5.528 4.123 -8.405 1.00 . A A . 4 LYS HB2 1 1 2 1040 1 1 4 LYS HB3 H -4.363 5.324 -7.867 1.00 . A A . 4 LYS HB3 1 1 2 1041 1 1 4 LYS HD2 H -5.508 5.661 -10.414 1.00 . A A . 4 LYS HD2 1 1 2 1042 1 1 4 LYS HD3 H -4.024 6.539 -10.034 1.00 . A A . 4 LYS HD3 1 1 2 1043 1 1 4 LYS HE2 H -2.995 5.325 -12.026 1.00 . A A . 4 LYS HE2 1 1 2 1044 1 1 4 LYS HE3 H -4.644 4.874 -12.458 1.00 . A A . 4 LYS HE3 1 1 2 1045 1 1 4 LYS HG2 H -2.829 4.497 -9.675 1.00 . A A . 4 LYS HG2 1 1 2 1046 1 1 4 LYS HG3 H -4.182 3.538 -10.276 1.00 . A A . 4 LYS HG3 1 1 2 1047 1 1 4 LYS HZ1 H -4.773 6.817 -13.490 1.00 . A A . 4 LYS HZ1 1 1 2 1048 1 1 4 LYS HZ2 H -3.300 7.346 -12.851 1.00 . A A . 4 LYS HZ2 1 1 2 1049 1 1 4 LYS HZ3 H -4.732 7.581 -11.980 1.00 . A A . 4 LYS HZ3 1 1 2 1050 1 1 4 LYS N N -4.601 3.051 -6.259 1.00 . A A . 4 LYS N 1 1 2 1051 1 1 4 LYS NZ N -4.223 6.931 -12.615 1.00 . A A . 4 LYS NZ 1 1 2 1052 1 1 4 LYS O O -1.411 3.368 -7.683 1.00 . A A . 4 LYS O 1 1 2 1053 1 1 5 ASP C C -0.179 4.027 -4.995 1.00 . A A . 5 ASP C 1 1 2 1054 1 1 5 ASP CA C -1.038 5.141 -5.585 1.00 . A A . 5 ASP CA 1 1 2 1055 1 1 5 ASP CB C -1.258 6.238 -4.543 1.00 . A A . 5 ASP CB 1 1 2 1056 1 1 5 ASP CG C -1.549 7.586 -5.173 1.00 . A A . 5 ASP CG 1 1 2 1057 1 1 5 ASP H H -3.142 4.904 -5.598 1.00 . A A . 5 ASP H 1 1 2 1058 1 1 5 ASP HA H -0.523 5.563 -6.435 1.00 . A A . 5 ASP HA 1 1 2 1059 1 1 5 ASP HB2 H -2.093 5.968 -3.914 1.00 . A A . 5 ASP HB2 1 1 2 1060 1 1 5 ASP HB3 H -0.370 6.330 -3.932 1.00 . A A . 5 ASP HB3 1 1 2 1061 1 1 5 ASP N N -2.319 4.621 -6.049 1.00 . A A . 5 ASP N 1 1 2 1062 1 1 5 ASP O O 0.967 3.833 -5.401 1.00 . A A . 5 ASP O 1 1 2 1063 1 1 5 ASP OD1 O -0.642 8.142 -5.829 1.00 . A A . 5 ASP OD1 1 1 2 1064 1 1 5 ASP OD2 O -2.683 8.084 -5.011 1.00 . A A . 5 ASP OD2 1 1 2 1065 1 1 6 VAL C C 0.496 1.210 -4.414 1.00 . A A . 6 VAL C 1 1 2 1066 1 1 6 VAL CA C -0.035 2.207 -3.387 1.00 . A A . 6 VAL CA 1 1 2 1067 1 1 6 VAL CB C -0.952 1.467 -2.398 1.00 . A A . 6 VAL CB 1 1 2 1068 1 1 6 VAL CG1 C -0.124 0.641 -1.444 1.00 . A A . 6 VAL CG1 1 1 2 1069 1 1 6 VAL CG2 C -1.831 2.445 -1.629 1.00 . A A . 6 VAL CG2 1 1 2 1070 1 1 6 VAL H H -1.651 3.497 -3.751 1.00 . A A . 6 VAL H 1 1 2 1071 1 1 6 VAL HA H 0.796 2.623 -2.838 1.00 . A A . 6 VAL HA 1 1 2 1072 1 1 6 VAL HB H -1.592 0.801 -2.957 1.00 . A A . 6 VAL HB 1 1 2 1073 1 1 6 VAL HG11 H 0.142 -0.292 -1.915 1.00 . A A . 6 VAL HG11 1 1 2 1074 1 1 6 VAL HG12 H -0.694 0.448 -0.549 1.00 . A A . 6 VAL HG12 1 1 2 1075 1 1 6 VAL HG13 H 0.771 1.187 -1.191 1.00 . A A . 6 VAL HG13 1 1 2 1076 1 1 6 VAL HG21 H -1.264 3.333 -1.396 1.00 . A A . 6 VAL HG21 1 1 2 1077 1 1 6 VAL HG22 H -2.169 1.982 -0.714 1.00 . A A . 6 VAL HG22 1 1 2 1078 1 1 6 VAL HG23 H -2.687 2.711 -2.233 1.00 . A A . 6 VAL HG23 1 1 2 1079 1 1 6 VAL N N -0.740 3.297 -4.034 1.00 . A A . 6 VAL N 1 1 2 1080 1 1 6 VAL O O 1.675 0.855 -4.398 1.00 . A A . 6 VAL O 1 1 2 1081 1 1 7 ILE C C 1.078 0.392 -7.250 1.00 . A A . 7 ILE C 1 1 2 1082 1 1 7 ILE CA C -0.007 -0.188 -6.341 1.00 . A A . 7 ILE CA 1 1 2 1083 1 1 7 ILE CB C -1.227 -0.599 -7.192 1.00 . A A . 7 ILE CB 1 1 2 1084 1 1 7 ILE CD1 C -3.395 -1.936 -7.134 1.00 . A A . 7 ILE CD1 1 1 2 1085 1 1 7 ILE CG1 C -2.194 -1.442 -6.358 1.00 . A A . 7 ILE CG1 1 1 2 1086 1 1 7 ILE CG2 C -0.786 -1.363 -8.435 1.00 . A A . 7 ILE CG2 1 1 2 1087 1 1 7 ILE H H -1.307 1.086 -5.265 1.00 . A A . 7 ILE H 1 1 2 1088 1 1 7 ILE HA H 0.382 -1.072 -5.855 1.00 . A A . 7 ILE HA 1 1 2 1089 1 1 7 ILE HB H -1.731 0.300 -7.514 1.00 . A A . 7 ILE HB 1 1 2 1090 1 1 7 ILE HD11 H -3.883 -2.724 -6.578 1.00 . A A . 7 ILE HD11 1 1 2 1091 1 1 7 ILE HD12 H -3.074 -2.316 -8.092 1.00 . A A . 7 ILE HD12 1 1 2 1092 1 1 7 ILE HD13 H -4.088 -1.120 -7.284 1.00 . A A . 7 ILE HD13 1 1 2 1093 1 1 7 ILE HG12 H -1.670 -2.305 -5.975 1.00 . A A . 7 ILE HG12 1 1 2 1094 1 1 7 ILE HG13 H -2.554 -0.848 -5.529 1.00 . A A . 7 ILE HG13 1 1 2 1095 1 1 7 ILE HG21 H -1.655 -1.733 -8.956 1.00 . A A . 7 ILE HG21 1 1 2 1096 1 1 7 ILE HG22 H -0.159 -2.192 -8.144 1.00 . A A . 7 ILE HG22 1 1 2 1097 1 1 7 ILE HG23 H -0.230 -0.700 -9.082 1.00 . A A . 7 ILE HG23 1 1 2 1098 1 1 7 ILE N N -0.383 0.764 -5.305 1.00 . A A . 7 ILE N 1 1 2 1099 1 1 7 ILE O O 1.863 -0.347 -7.843 1.00 . A A . 7 ILE O 1 1 2 1100 1 1 8 ASP C C 3.461 2.403 -7.480 1.00 . A A . 8 ASP C 1 1 2 1101 1 1 8 ASP CA C 2.106 2.390 -8.177 1.00 . A A . 8 ASP CA 1 1 2 1102 1 1 8 ASP CB C 1.656 3.823 -8.482 1.00 . A A . 8 ASP CB 1 1 2 1103 1 1 8 ASP CG C 1.504 4.076 -9.969 1.00 . A A . 8 ASP CG 1 1 2 1104 1 1 8 ASP H H 0.471 2.251 -6.849 1.00 . A A . 8 ASP H 1 1 2 1105 1 1 8 ASP HA H 2.194 1.842 -9.104 1.00 . A A . 8 ASP HA 1 1 2 1106 1 1 8 ASP HB2 H 0.704 4.003 -8.007 1.00 . A A . 8 ASP HB2 1 1 2 1107 1 1 8 ASP HB3 H 2.386 4.517 -8.090 1.00 . A A . 8 ASP HB3 1 1 2 1108 1 1 8 ASP N N 1.117 1.716 -7.349 1.00 . A A . 8 ASP N 1 1 2 1109 1 1 8 ASP O O 4.506 2.437 -8.129 1.00 . A A . 8 ASP O 1 1 2 1110 1 1 8 ASP OD1 O 2.409 3.685 -10.734 1.00 . A A . 8 ASP OD1 1 1 2 1111 1 1 8 ASP OD2 O 0.479 4.668 -10.369 1.00 . A A . 8 ASP OD2 1 1 2 1112 1 1 9 HIS C C 5.184 0.955 -5.191 1.00 . A A . 9 HIS C 1 1 2 1113 1 1 9 HIS CA C 4.652 2.375 -5.362 1.00 . A A . 9 HIS CA 1 1 2 1114 1 1 9 HIS CB C 4.396 3.016 -3.993 1.00 . A A . 9 HIS CB 1 1 2 1115 1 1 9 HIS CD2 C 5.910 1.780 -2.287 1.00 . A A . 9 HIS CD2 1 1 2 1116 1 1 9 HIS CE1 C 7.296 3.417 -1.838 1.00 . A A . 9 HIS CE1 1 1 2 1117 1 1 9 HIS CG C 5.528 2.849 -3.024 1.00 . A A . 9 HIS CG 1 1 2 1118 1 1 9 HIS H H 2.567 2.343 -5.692 1.00 . A A . 9 HIS H 1 1 2 1119 1 1 9 HIS HA H 5.382 2.961 -5.894 1.00 . A A . 9 HIS HA 1 1 2 1120 1 1 9 HIS HB2 H 4.229 4.074 -4.125 1.00 . A A . 9 HIS HB2 1 1 2 1121 1 1 9 HIS HB3 H 3.515 2.570 -3.556 1.00 . A A . 9 HIS HB3 1 1 2 1122 1 1 9 HIS HD1 H 6.404 4.764 -3.093 1.00 . A A . 9 HIS HD1 1 1 2 1123 1 1 9 HIS HD2 H 5.437 0.807 -2.272 1.00 . A A . 9 HIS HD2 1 1 2 1124 1 1 9 HIS HE1 H 8.109 3.989 -1.416 1.00 . A A . 9 HIS HE1 1 1 2 1125 1 1 9 HIS HE2 H 7.472 1.608 -0.893 1.00 . A A . 9 HIS HE2 1 1 2 1126 1 1 9 HIS N N 3.431 2.372 -6.152 1.00 . A A . 9 HIS N 1 1 2 1127 1 1 9 HIS ND1 N 6.416 3.859 -2.719 1.00 . A A . 9 HIS ND1 1 1 2 1128 1 1 9 HIS NE2 N 7.011 2.159 -1.559 1.00 . A A . 9 HIS NE2 1 1 2 1129 1 1 9 HIS O O 6.393 0.736 -5.129 1.00 . A A . 9 HIS O 1 1 2 1130 1 1 10 PHE C C 4.811 -2.094 -6.294 1.00 . A A . 10 PHE C 1 1 2 1131 1 1 10 PHE CA C 4.639 -1.405 -4.945 1.00 . A A . 10 PHE CA 1 1 2 1132 1 1 10 PHE CB C 3.578 -2.132 -4.119 1.00 . A A . 10 PHE CB 1 1 2 1133 1 1 10 PHE CD1 C 4.581 -2.690 -1.893 1.00 . A A . 10 PHE CD1 1 1 2 1134 1 1 10 PHE CD2 C 2.997 -0.912 -2.006 1.00 . A A . 10 PHE CD2 1 1 2 1135 1 1 10 PHE CE1 C 4.720 -2.484 -0.533 1.00 . A A . 10 PHE CE1 1 1 2 1136 1 1 10 PHE CE2 C 3.130 -0.702 -0.648 1.00 . A A . 10 PHE CE2 1 1 2 1137 1 1 10 PHE CG C 3.720 -1.907 -2.642 1.00 . A A . 10 PHE CG 1 1 2 1138 1 1 10 PHE CZ C 3.993 -1.488 0.090 1.00 . A A . 10 PHE CZ 1 1 2 1139 1 1 10 PHE H H 3.320 0.236 -5.166 1.00 . A A . 10 PHE H 1 1 2 1140 1 1 10 PHE HA H 5.577 -1.439 -4.413 1.00 . A A . 10 PHE HA 1 1 2 1141 1 1 10 PHE HB2 H 2.600 -1.786 -4.416 1.00 . A A . 10 PHE HB2 1 1 2 1142 1 1 10 PHE HB3 H 3.652 -3.195 -4.304 1.00 . A A . 10 PHE HB3 1 1 2 1143 1 1 10 PHE HD1 H 5.150 -3.468 -2.381 1.00 . A A . 10 PHE HD1 1 1 2 1144 1 1 10 PHE HD2 H 2.321 -0.297 -2.583 1.00 . A A . 10 PHE HD2 1 1 2 1145 1 1 10 PHE HE1 H 5.395 -3.101 0.041 1.00 . A A . 10 PHE HE1 1 1 2 1146 1 1 10 PHE HE2 H 2.560 0.078 -0.163 1.00 . A A . 10 PHE HE2 1 1 2 1147 1 1 10 PHE HZ H 4.099 -1.325 1.153 1.00 . A A . 10 PHE HZ 1 1 2 1148 1 1 10 PHE N N 4.269 -0.005 -5.112 1.00 . A A . 10 PHE N 1 1 2 1149 1 1 10 PHE O O 5.700 -2.926 -6.469 1.00 . A A . 10 PHE O 1 1 2 1150 1 1 11 GLY C C 3.077 -3.525 -8.708 1.00 . A A . 11 GLY C 1 1 2 1151 1 1 11 GLY CA C 4.018 -2.344 -8.564 1.00 . A A . 11 GLY CA 1 1 2 1152 1 1 11 GLY H H 3.257 -1.080 -7.046 1.00 . A A . 11 GLY H 1 1 2 1153 1 1 11 GLY HA2 H 3.758 -1.598 -9.301 1.00 . A A . 11 GLY HA2 1 1 2 1154 1 1 11 GLY HA3 H 5.029 -2.678 -8.744 1.00 . A A . 11 GLY HA3 1 1 2 1155 1 1 11 GLY N N 3.948 -1.745 -7.244 1.00 . A A . 11 GLY N 1 1 2 1156 1 1 11 GLY O O 2.491 -3.736 -9.769 1.00 . A A . 11 GLY O 1 1 2 1157 1 1 12 THR C C 1.403 -5.637 -6.267 1.00 . A A . 12 THR C 1 1 2 1158 1 1 12 THR CA C 2.057 -5.457 -7.634 1.00 . A A . 12 THR CA 1 1 2 1159 1 1 12 THR CB C 2.845 -6.715 -8.007 1.00 . A A . 12 THR CB 1 1 2 1160 1 1 12 THR CG2 C 3.094 -6.845 -9.495 1.00 . A A . 12 THR CG2 1 1 2 1161 1 1 12 THR H H 3.427 -4.070 -6.817 1.00 . A A . 12 THR H 1 1 2 1162 1 1 12 THR HA H 1.287 -5.293 -8.371 1.00 . A A . 12 THR HA 1 1 2 1163 1 1 12 THR HB H 2.288 -7.583 -7.687 1.00 . A A . 12 THR HB 1 1 2 1164 1 1 12 THR HG1 H 4.613 -5.962 -7.630 1.00 . A A . 12 THR HG1 1 1 2 1165 1 1 12 THR HG21 H 2.264 -7.362 -9.953 1.00 . A A . 12 THR HG21 1 1 2 1166 1 1 12 THR HG22 H 4.003 -7.404 -9.659 1.00 . A A . 12 THR HG22 1 1 2 1167 1 1 12 THR HG23 H 3.191 -5.862 -9.931 1.00 . A A . 12 THR HG23 1 1 2 1168 1 1 12 THR N N 2.934 -4.292 -7.633 1.00 . A A . 12 THR N 1 1 2 1169 1 1 12 THR O O 2.021 -5.375 -5.234 1.00 . A A . 12 THR O 1 1 2 1170 1 1 12 THR OG1 O 4.104 -6.729 -7.359 1.00 . A A . 12 THR OG1 1 1 2 1171 1 1 13 GLN C C 0.194 -7.176 -4.062 1.00 . A A . 13 GLN C 1 1 2 1172 1 1 13 GLN CA C -0.589 -6.289 -5.028 1.00 . A A . 13 GLN CA 1 1 2 1173 1 1 13 GLN CB C -1.952 -6.920 -5.324 1.00 . A A . 13 GLN CB 1 1 2 1174 1 1 13 GLN CD C -3.172 -8.501 -6.870 1.00 . A A . 13 GLN CD 1 1 2 1175 1 1 13 GLN CG C -1.870 -8.185 -6.161 1.00 . A A . 13 GLN CG 1 1 2 1176 1 1 13 GLN H H -0.289 -6.267 -7.125 1.00 . A A . 13 GLN H 1 1 2 1177 1 1 13 GLN HA H -0.742 -5.325 -4.567 1.00 . A A . 13 GLN HA 1 1 2 1178 1 1 13 GLN HB2 H -2.434 -7.163 -4.388 1.00 . A A . 13 GLN HB2 1 1 2 1179 1 1 13 GLN HB3 H -2.559 -6.202 -5.854 1.00 . A A . 13 GLN HB3 1 1 2 1180 1 1 13 GLN HE21 H -4.206 -7.997 -5.249 1.00 . A A . 13 GLN HE21 1 1 2 1181 1 1 13 GLN HE22 H -5.142 -8.516 -6.604 1.00 . A A . 13 GLN HE22 1 1 2 1182 1 1 13 GLN HG2 H -1.095 -8.060 -6.903 1.00 . A A . 13 GLN HG2 1 1 2 1183 1 1 13 GLN HG3 H -1.618 -9.013 -5.514 1.00 . A A . 13 GLN HG3 1 1 2 1184 1 1 13 GLN N N 0.150 -6.080 -6.269 1.00 . A A . 13 GLN N 1 1 2 1185 1 1 13 GLN NE2 N -4.287 -8.319 -6.171 1.00 . A A . 13 GLN NE2 1 1 2 1186 1 1 13 GLN O O 0.351 -6.844 -2.886 1.00 . A A . 13 GLN O 1 1 2 1187 1 1 13 GLN OE1 O -3.176 -8.903 -8.033 1.00 . A A . 13 GLN OE1 1 1 2 1188 1 1 14 ARG C C 2.541 -8.532 -2.959 1.00 . A A . 14 ARG C 1 1 2 1189 1 1 14 ARG CA C 1.449 -9.244 -3.757 1.00 . A A . 14 ARG CA 1 1 2 1190 1 1 14 ARG CB C 2.071 -10.313 -4.653 1.00 . A A . 14 ARG CB 1 1 2 1191 1 1 14 ARG CD C 2.243 -10.451 -7.160 1.00 . A A . 14 ARG CD 1 1 2 1192 1 1 14 ARG CG C 2.734 -9.753 -5.902 1.00 . A A . 14 ARG CG 1 1 2 1193 1 1 14 ARG CZ C 4.224 -10.291 -8.616 1.00 . A A . 14 ARG CZ 1 1 2 1194 1 1 14 ARG H H 0.527 -8.515 -5.509 1.00 . A A . 14 ARG H 1 1 2 1195 1 1 14 ARG HA H 0.768 -9.718 -3.067 1.00 . A A . 14 ARG HA 1 1 2 1196 1 1 14 ARG HB2 H 2.814 -10.849 -4.088 1.00 . A A . 14 ARG HB2 1 1 2 1197 1 1 14 ARG HB3 H 1.299 -11.004 -4.959 1.00 . A A . 14 ARG HB3 1 1 2 1198 1 1 14 ARG HD2 H 2.394 -11.515 -7.049 1.00 . A A . 14 ARG HD2 1 1 2 1199 1 1 14 ARG HD3 H 1.189 -10.247 -7.281 1.00 . A A . 14 ARG HD3 1 1 2 1200 1 1 14 ARG HE H 2.458 -9.440 -8.991 1.00 . A A . 14 ARG HE 1 1 2 1201 1 1 14 ARG HG2 H 2.509 -8.700 -5.976 1.00 . A A . 14 ARG HG2 1 1 2 1202 1 1 14 ARG HG3 H 3.803 -9.888 -5.820 1.00 . A A . 14 ARG HG3 1 1 2 1203 1 1 14 ARG HH11 H 4.503 -11.388 -6.940 1.00 . A A . 14 ARG HH11 1 1 2 1204 1 1 14 ARG HH12 H 5.881 -11.260 -7.982 1.00 . A A . 14 ARG HH12 1 1 2 1205 1 1 14 ARG HH21 H 4.269 -9.271 -10.360 1.00 . A A . 14 ARG HH21 1 1 2 1206 1 1 14 ARG HH22 H 5.748 -10.058 -9.922 1.00 . A A . 14 ARG HH22 1 1 2 1207 1 1 14 ARG N N 0.684 -8.306 -4.566 1.00 . A A . 14 ARG N 1 1 2 1208 1 1 14 ARG NE N 2.953 -9.996 -8.352 1.00 . A A . 14 ARG NE 1 1 2 1209 1 1 14 ARG NH1 N 4.927 -11.040 -7.777 1.00 . A A . 14 ARG NH1 1 1 2 1210 1 1 14 ARG NH2 N 4.795 -9.836 -9.724 1.00 . A A . 14 ARG NH2 1 1 2 1211 1 1 14 ARG O O 2.798 -8.872 -1.805 1.00 . A A . 14 ARG O 1 1 2 1212 1 1 15 ALA C C 3.722 -6.096 -1.673 1.00 . A A . 15 ALA C 1 1 2 1213 1 1 15 ALA CA C 4.238 -6.790 -2.929 1.00 . A A . 15 ALA CA 1 1 2 1214 1 1 15 ALA CB C 4.829 -5.771 -3.893 1.00 . A A . 15 ALA CB 1 1 2 1215 1 1 15 ALA H H 2.926 -7.322 -4.503 1.00 . A A . 15 ALA H 1 1 2 1216 1 1 15 ALA HA H 5.018 -7.483 -2.651 1.00 . A A . 15 ALA HA 1 1 2 1217 1 1 15 ALA HB1 H 5.547 -5.157 -3.371 1.00 . A A . 15 ALA HB1 1 1 2 1218 1 1 15 ALA HB2 H 4.040 -5.147 -4.287 1.00 . A A . 15 ALA HB2 1 1 2 1219 1 1 15 ALA HB3 H 5.318 -6.287 -4.706 1.00 . A A . 15 ALA HB3 1 1 2 1220 1 1 15 ALA N N 3.176 -7.547 -3.583 1.00 . A A . 15 ALA N 1 1 2 1221 1 1 15 ALA O O 4.342 -6.172 -0.611 1.00 . A A . 15 ALA O 1 1 2 1222 1 1 16 VAL C C 1.680 -5.661 0.472 1.00 . A A . 16 VAL C 1 1 2 1223 1 1 16 VAL CA C 1.988 -4.708 -0.678 1.00 . A A . 16 VAL CA 1 1 2 1224 1 1 16 VAL CB C 0.686 -3.977 -1.081 1.00 . A A . 16 VAL CB 1 1 2 1225 1 1 16 VAL CG1 C 0.550 -2.689 -0.298 1.00 . A A . 16 VAL CG1 1 1 2 1226 1 1 16 VAL CG2 C 0.643 -3.691 -2.577 1.00 . A A . 16 VAL CG2 1 1 2 1227 1 1 16 VAL H H 2.141 -5.392 -2.669 1.00 . A A . 16 VAL H 1 1 2 1228 1 1 16 VAL HA H 2.697 -3.968 -0.337 1.00 . A A . 16 VAL HA 1 1 2 1229 1 1 16 VAL HB H -0.152 -4.613 -0.833 1.00 . A A . 16 VAL HB 1 1 2 1230 1 1 16 VAL HG11 H -0.491 -2.510 -0.080 1.00 . A A . 16 VAL HG11 1 1 2 1231 1 1 16 VAL HG12 H 0.944 -1.874 -0.886 1.00 . A A . 16 VAL HG12 1 1 2 1232 1 1 16 VAL HG13 H 1.105 -2.772 0.623 1.00 . A A . 16 VAL HG13 1 1 2 1233 1 1 16 VAL HG21 H 1.617 -3.360 -2.908 1.00 . A A . 16 VAL HG21 1 1 2 1234 1 1 16 VAL HG22 H -0.088 -2.921 -2.776 1.00 . A A . 16 VAL HG22 1 1 2 1235 1 1 16 VAL HG23 H 0.371 -4.592 -3.108 1.00 . A A . 16 VAL HG23 1 1 2 1236 1 1 16 VAL N N 2.587 -5.418 -1.800 1.00 . A A . 16 VAL N 1 1 2 1237 1 1 16 VAL O O 2.028 -5.393 1.623 1.00 . A A . 16 VAL O 1 1 2 1238 1 1 17 ALA C C 1.907 -8.284 1.887 1.00 . A A . 17 ALA C 1 1 2 1239 1 1 17 ALA CA C 0.669 -7.765 1.163 1.00 . A A . 17 ALA CA 1 1 2 1240 1 1 17 ALA CB C -0.094 -8.916 0.521 1.00 . A A . 17 ALA CB 1 1 2 1241 1 1 17 ALA H H 0.774 -6.929 -0.779 1.00 . A A . 17 ALA H 1 1 2 1242 1 1 17 ALA HA H 0.017 -7.289 1.882 1.00 . A A . 17 ALA HA 1 1 2 1243 1 1 17 ALA HB1 H 0.209 -9.847 0.978 1.00 . A A . 17 ALA HB1 1 1 2 1244 1 1 17 ALA HB2 H 0.122 -8.945 -0.535 1.00 . A A . 17 ALA HB2 1 1 2 1245 1 1 17 ALA HB3 H -1.153 -8.771 0.668 1.00 . A A . 17 ALA HB3 1 1 2 1246 1 1 17 ALA N N 1.025 -6.772 0.155 1.00 . A A . 17 ALA N 1 1 2 1247 1 1 17 ALA O O 1.881 -8.514 3.095 1.00 . A A . 17 ALA O 1 1 2 1248 1 1 18 LYS C C 4.879 -7.909 2.613 1.00 . A A . 18 LYS C 1 1 2 1249 1 1 18 LYS CA C 4.237 -8.962 1.713 1.00 . A A . 18 LYS CA 1 1 2 1250 1 1 18 LYS CB C 5.209 -9.366 0.600 1.00 . A A . 18 LYS CB 1 1 2 1251 1 1 18 LYS CD C 4.944 -11.412 -0.850 1.00 . A A . 18 LYS CD 1 1 2 1252 1 1 18 LYS CE C 6.097 -11.983 -1.661 1.00 . A A . 18 LYS CE 1 1 2 1253 1 1 18 LYS CG C 5.417 -10.869 0.493 1.00 . A A . 18 LYS CG 1 1 2 1254 1 1 18 LYS H H 2.951 -8.269 0.182 1.00 . A A . 18 LYS H 1 1 2 1255 1 1 18 LYS HA H 4.006 -9.834 2.308 1.00 . A A . 18 LYS HA 1 1 2 1256 1 1 18 LYS HB2 H 4.826 -9.006 -0.343 1.00 . A A . 18 LYS HB2 1 1 2 1257 1 1 18 LYS HB3 H 6.168 -8.904 0.788 1.00 . A A . 18 LYS HB3 1 1 2 1258 1 1 18 LYS HD2 H 4.221 -12.194 -0.674 1.00 . A A . 18 LYS HD2 1 1 2 1259 1 1 18 LYS HD3 H 4.482 -10.612 -1.409 1.00 . A A . 18 LYS HD3 1 1 2 1260 1 1 18 LYS HE2 H 5.742 -12.213 -2.655 1.00 . A A . 18 LYS HE2 1 1 2 1261 1 1 18 LYS HE3 H 6.879 -11.240 -1.723 1.00 . A A . 18 LYS HE3 1 1 2 1262 1 1 18 LYS HG2 H 6.469 -11.084 0.604 1.00 . A A . 18 LYS HG2 1 1 2 1263 1 1 18 LYS HG3 H 4.866 -11.356 1.283 1.00 . A A . 18 LYS HG3 1 1 2 1264 1 1 18 LYS HZ1 H 7.614 -13.392 -1.396 1.00 . A A . 18 LYS HZ1 1 1 2 1265 1 1 18 LYS HZ2 H 6.054 -14.038 -1.289 1.00 . A A . 18 LYS HZ2 1 1 2 1266 1 1 18 LYS HZ3 H 6.678 -13.123 -0.012 1.00 . A A . 18 LYS HZ3 1 1 2 1267 1 1 18 LYS N N 2.991 -8.470 1.139 1.00 . A A . 18 LYS N 1 1 2 1268 1 1 18 LYS NZ N 6.649 -13.220 -1.046 1.00 . A A . 18 LYS NZ 1 1 2 1269 1 1 18 LYS O O 5.576 -8.240 3.572 1.00 . A A . 18 LYS O 1 1 2 1270 1 1 19 ALA C C 4.368 -5.284 4.331 1.00 . A A . 19 ALA C 1 1 2 1271 1 1 19 ALA CA C 5.195 -5.542 3.077 1.00 . A A . 19 ALA CA 1 1 2 1272 1 1 19 ALA CB C 5.276 -4.280 2.229 1.00 . A A . 19 ALA CB 1 1 2 1273 1 1 19 ALA H H 4.077 -6.438 1.520 1.00 . A A . 19 ALA H 1 1 2 1274 1 1 19 ALA HA H 6.198 -5.815 3.369 1.00 . A A . 19 ALA HA 1 1 2 1275 1 1 19 ALA HB1 H 5.430 -3.426 2.870 1.00 . A A . 19 ALA HB1 1 1 2 1276 1 1 19 ALA HB2 H 4.356 -4.158 1.678 1.00 . A A . 19 ALA HB2 1 1 2 1277 1 1 19 ALA HB3 H 6.103 -4.365 1.539 1.00 . A A . 19 ALA HB3 1 1 2 1278 1 1 19 ALA N N 4.640 -6.640 2.297 1.00 . A A . 19 ALA N 1 1 2 1279 1 1 19 ALA O O 4.914 -5.103 5.420 1.00 . A A . 19 ALA O 1 1 2 1280 1 1 20 LEU C C 1.960 -6.303 6.121 1.00 . A A . 20 LEU C 1 1 2 1281 1 1 20 LEU CA C 2.147 -5.033 5.295 1.00 . A A . 20 LEU CA 1 1 2 1282 1 1 20 LEU CB C 0.792 -4.534 4.792 1.00 . A A . 20 LEU CB 1 1 2 1283 1 1 20 LEU CD1 C -0.492 -2.959 3.326 1.00 . A A . 20 LEU CD1 1 1 2 1284 1 1 20 LEU CD2 C 1.169 -2.063 4.967 1.00 . A A . 20 LEU CD2 1 1 2 1285 1 1 20 LEU CG C 0.834 -3.210 4.026 1.00 . A A . 20 LEU CG 1 1 2 1286 1 1 20 LEU H H 2.671 -5.418 3.281 1.00 . A A . 20 LEU H 1 1 2 1287 1 1 20 LEU HA H 2.590 -4.273 5.922 1.00 . A A . 20 LEU HA 1 1 2 1288 1 1 20 LEU HB2 H 0.373 -5.289 4.143 1.00 . A A . 20 LEU HB2 1 1 2 1289 1 1 20 LEU HB3 H 0.138 -4.412 5.642 1.00 . A A . 20 LEU HB3 1 1 2 1290 1 1 20 LEU HD11 H -0.694 -1.898 3.310 1.00 . A A . 20 LEU HD11 1 1 2 1291 1 1 20 LEU HD12 H -1.282 -3.469 3.858 1.00 . A A . 20 LEU HD12 1 1 2 1292 1 1 20 LEU HD13 H -0.441 -3.332 2.313 1.00 . A A . 20 LEU HD13 1 1 2 1293 1 1 20 LEU HD21 H 0.294 -1.804 5.545 1.00 . A A . 20 LEU HD21 1 1 2 1294 1 1 20 LEU HD22 H 1.486 -1.206 4.390 1.00 . A A . 20 LEU HD22 1 1 2 1295 1 1 20 LEU HD23 H 1.965 -2.363 5.632 1.00 . A A . 20 LEU HD23 1 1 2 1296 1 1 20 LEU HG H 1.605 -3.263 3.271 1.00 . A A . 20 LEU HG 1 1 2 1297 1 1 20 LEU N N 3.048 -5.269 4.174 1.00 . A A . 20 LEU N 1 1 2 1298 1 1 20 LEU O O 1.745 -6.240 7.331 1.00 . A A . 20 LEU O 1 1 2 1299 1 1 21 GLY C C 0.545 -9.379 5.866 1.00 . A A . 21 GLY C 1 1 2 1300 1 1 21 GLY CA C 1.883 -8.718 6.149 1.00 . A A . 21 GLY CA 1 1 2 1301 1 1 21 GLY H H 2.219 -7.440 4.494 1.00 . A A . 21 GLY H 1 1 2 1302 1 1 21 GLY HA2 H 2.672 -9.386 5.837 1.00 . A A . 21 GLY HA2 1 1 2 1303 1 1 21 GLY HA3 H 1.968 -8.547 7.212 1.00 . A A . 21 GLY HA3 1 1 2 1304 1 1 21 GLY N N 2.044 -7.452 5.458 1.00 . A A . 21 GLY N 1 1 2 1305 1 1 21 GLY O O 0.315 -10.520 6.265 1.00 . A A . 21 GLY O 1 1 2 1306 1 1 22 ILE C C -1.590 -10.129 3.646 1.00 . A A . 22 ILE C 1 1 2 1307 1 1 22 ILE CA C -1.659 -9.196 4.848 1.00 . A A . 22 ILE CA 1 1 2 1308 1 1 22 ILE CB C -2.663 -8.067 4.548 1.00 . A A . 22 ILE CB 1 1 2 1309 1 1 22 ILE CD1 C -3.173 -6.204 2.892 1.00 . A A . 22 ILE CD1 1 1 2 1310 1 1 22 ILE CG1 C -2.140 -7.173 3.422 1.00 . A A . 22 ILE CG1 1 1 2 1311 1 1 22 ILE CG2 C -2.931 -7.249 5.802 1.00 . A A . 22 ILE CG2 1 1 2 1312 1 1 22 ILE H H -0.106 -7.760 4.884 1.00 . A A . 22 ILE H 1 1 2 1313 1 1 22 ILE HA H -2.017 -9.750 5.702 1.00 . A A . 22 ILE HA 1 1 2 1314 1 1 22 ILE HB H -3.593 -8.516 4.238 1.00 . A A . 22 ILE HB 1 1 2 1315 1 1 22 ILE HD11 H -3.826 -5.896 3.695 1.00 . A A . 22 ILE HD11 1 1 2 1316 1 1 22 ILE HD12 H -3.755 -6.685 2.119 1.00 . A A . 22 ILE HD12 1 1 2 1317 1 1 22 ILE HD13 H -2.676 -5.337 2.480 1.00 . A A . 22 ILE HD13 1 1 2 1318 1 1 22 ILE HG12 H -1.303 -6.597 3.788 1.00 . A A . 22 ILE HG12 1 1 2 1319 1 1 22 ILE HG13 H -1.813 -7.794 2.601 1.00 . A A . 22 ILE HG13 1 1 2 1320 1 1 22 ILE HG21 H -3.087 -7.913 6.639 1.00 . A A . 22 ILE HG21 1 1 2 1321 1 1 22 ILE HG22 H -3.812 -6.641 5.655 1.00 . A A . 22 ILE HG22 1 1 2 1322 1 1 22 ILE HG23 H -2.083 -6.609 6.004 1.00 . A A . 22 ILE HG23 1 1 2 1323 1 1 22 ILE N N -0.341 -8.663 5.176 1.00 . A A . 22 ILE N 1 1 2 1324 1 1 22 ILE O O -0.527 -10.320 3.055 1.00 . A A . 22 ILE O 1 1 2 1325 1 1 23 SER C C -3.003 -10.863 0.849 1.00 . A A . 23 SER C 1 1 2 1326 1 1 23 SER CA C -2.800 -11.626 2.155 1.00 . A A . 23 SER CA 1 1 2 1327 1 1 23 SER CB C -3.937 -12.631 2.354 1.00 . A A . 23 SER CB 1 1 2 1328 1 1 23 SER H H -3.544 -10.518 3.799 1.00 . A A . 23 SER H 1 1 2 1329 1 1 23 SER HA H -1.865 -12.161 2.104 1.00 . A A . 23 SER HA 1 1 2 1330 1 1 23 SER HB2 H -4.882 -12.142 2.178 1.00 . A A . 23 SER HB2 1 1 2 1331 1 1 23 SER HB3 H -3.818 -13.447 1.657 1.00 . A A . 23 SER HB3 1 1 2 1332 1 1 23 SER HG H -4.409 -13.984 3.688 1.00 . A A . 23 SER HG 1 1 2 1333 1 1 23 SER N N -2.730 -10.710 3.288 1.00 . A A . 23 SER N 1 1 2 1334 1 1 23 SER O O -3.461 -9.721 0.851 1.00 . A A . 23 SER O 1 1 2 1335 1 1 23 SER OG O -3.932 -13.151 3.672 1.00 . A A . 23 SER OG 1 1 2 1336 1 1 24 ASP C C -4.257 -10.517 -1.850 1.00 . A A . 24 ASP C 1 1 2 1337 1 1 24 ASP CA C -2.802 -10.887 -1.577 1.00 . A A . 24 ASP CA 1 1 2 1338 1 1 24 ASP CB C -2.293 -11.834 -2.666 1.00 . A A . 24 ASP CB 1 1 2 1339 1 1 24 ASP CG C -2.863 -13.231 -2.528 1.00 . A A . 24 ASP CG 1 1 2 1340 1 1 24 ASP H H -2.299 -12.414 -0.198 1.00 . A A . 24 ASP H 1 1 2 1341 1 1 24 ASP HA H -2.206 -9.987 -1.588 1.00 . A A . 24 ASP HA 1 1 2 1342 1 1 24 ASP HB2 H -2.573 -11.444 -3.632 1.00 . A A . 24 ASP HB2 1 1 2 1343 1 1 24 ASP HB3 H -1.216 -11.896 -2.605 1.00 . A A . 24 ASP HB3 1 1 2 1344 1 1 24 ASP N N -2.659 -11.504 -0.263 1.00 . A A . 24 ASP N 1 1 2 1345 1 1 24 ASP O O -4.539 -9.552 -2.560 1.00 . A A . 24 ASP O 1 1 2 1346 1 1 24 ASP OD1 O -3.980 -13.470 -3.033 1.00 . A A . 24 ASP OD1 1 1 2 1347 1 1 24 ASP OD2 O -2.191 -14.089 -1.917 1.00 . A A . 24 ASP OD2 1 1 2 1348 1 1 25 ALA C C -7.020 -9.729 -0.810 1.00 . A A . 25 ALA C 1 1 2 1349 1 1 25 ALA CA C -6.602 -11.042 -1.463 1.00 . A A . 25 ALA CA 1 1 2 1350 1 1 25 ALA CB C -7.414 -12.197 -0.898 1.00 . A A . 25 ALA CB 1 1 2 1351 1 1 25 ALA H H -4.890 -12.044 -0.724 1.00 . A A . 25 ALA H 1 1 2 1352 1 1 25 ALA HA H -6.796 -10.981 -2.525 1.00 . A A . 25 ALA HA 1 1 2 1353 1 1 25 ALA HB1 H -7.388 -13.028 -1.589 1.00 . A A . 25 ALA HB1 1 1 2 1354 1 1 25 ALA HB2 H -8.437 -11.881 -0.756 1.00 . A A . 25 ALA HB2 1 1 2 1355 1 1 25 ALA HB3 H -6.996 -12.504 0.049 1.00 . A A . 25 ALA HB3 1 1 2 1356 1 1 25 ALA N N -5.177 -11.289 -1.280 1.00 . A A . 25 ALA N 1 1 2 1357 1 1 25 ALA O O -7.841 -8.990 -1.351 1.00 . A A . 25 ALA O 1 1 2 1358 1 1 26 ALA C C -6.431 -6.988 0.250 1.00 . A A . 26 ALA C 1 1 2 1359 1 1 26 ALA CA C -6.763 -8.222 1.083 1.00 . A A . 26 ALA CA 1 1 2 1360 1 1 26 ALA CB C -6.012 -8.184 2.406 1.00 . A A . 26 ALA CB 1 1 2 1361 1 1 26 ALA H H -5.800 -10.074 0.738 1.00 . A A . 26 ALA H 1 1 2 1362 1 1 26 ALA HA H -7.823 -8.224 1.298 1.00 . A A . 26 ALA HA 1 1 2 1363 1 1 26 ALA HB1 H -5.772 -7.161 2.656 1.00 . A A . 26 ALA HB1 1 1 2 1364 1 1 26 ALA HB2 H -5.100 -8.756 2.317 1.00 . A A . 26 ALA HB2 1 1 2 1365 1 1 26 ALA HB3 H -6.630 -8.610 3.183 1.00 . A A . 26 ALA HB3 1 1 2 1366 1 1 26 ALA N N -6.448 -9.445 0.357 1.00 . A A . 26 ALA N 1 1 2 1367 1 1 26 ALA O O -7.209 -6.036 0.194 1.00 . A A . 26 ALA O 1 1 2 1368 1 1 27 VAL C C -5.698 -5.780 -2.483 1.00 . A A . 27 VAL C 1 1 2 1369 1 1 27 VAL CA C -4.836 -5.899 -1.231 1.00 . A A . 27 VAL CA 1 1 2 1370 1 1 27 VAL CB C -3.359 -6.053 -1.648 1.00 . A A . 27 VAL CB 1 1 2 1371 1 1 27 VAL CG1 C -2.918 -4.883 -2.515 1.00 . A A . 27 VAL CG1 1 1 2 1372 1 1 27 VAL CG2 C -2.469 -6.180 -0.421 1.00 . A A . 27 VAL CG2 1 1 2 1373 1 1 27 VAL H H -4.695 -7.801 -0.316 1.00 . A A . 27 VAL H 1 1 2 1374 1 1 27 VAL HA H -4.932 -4.992 -0.652 1.00 . A A . 27 VAL HA 1 1 2 1375 1 1 27 VAL HB H -3.264 -6.958 -2.230 1.00 . A A . 27 VAL HB 1 1 2 1376 1 1 27 VAL HG11 H -2.962 -3.971 -1.940 1.00 . A A . 27 VAL HG11 1 1 2 1377 1 1 27 VAL HG12 H -3.576 -4.802 -3.371 1.00 . A A . 27 VAL HG12 1 1 2 1378 1 1 27 VAL HG13 H -1.906 -5.048 -2.856 1.00 . A A . 27 VAL HG13 1 1 2 1379 1 1 27 VAL HG21 H -2.739 -7.069 0.131 1.00 . A A . 27 VAL HG21 1 1 2 1380 1 1 27 VAL HG22 H -2.600 -5.313 0.210 1.00 . A A . 27 VAL HG22 1 1 2 1381 1 1 27 VAL HG23 H -1.438 -6.248 -0.730 1.00 . A A . 27 VAL HG23 1 1 2 1382 1 1 27 VAL N N -5.271 -7.014 -0.399 1.00 . A A . 27 VAL N 1 1 2 1383 1 1 27 VAL O O -5.962 -4.679 -2.966 1.00 . A A . 27 VAL O 1 1 2 1384 1 1 28 SER C C -8.380 -6.457 -3.891 1.00 . A A . 28 SER C 1 1 2 1385 1 1 28 SER CA C -6.967 -6.941 -4.202 1.00 . A A . 28 SER CA 1 1 2 1386 1 1 28 SER CB C -7.014 -8.353 -4.792 1.00 . A A . 28 SER CB 1 1 2 1387 1 1 28 SER H H -5.891 -7.768 -2.577 1.00 . A A . 28 SER H 1 1 2 1388 1 1 28 SER HA H -6.520 -6.274 -4.926 1.00 . A A . 28 SER HA 1 1 2 1389 1 1 28 SER HB2 H -7.284 -8.295 -5.836 1.00 . A A . 28 SER HB2 1 1 2 1390 1 1 28 SER HB3 H -6.043 -8.813 -4.695 1.00 . A A . 28 SER HB3 1 1 2 1391 1 1 28 SER HG H -7.678 -10.070 -4.120 1.00 . A A . 28 SER HG 1 1 2 1392 1 1 28 SER N N -6.135 -6.920 -3.005 1.00 . A A . 28 SER N 1 1 2 1393 1 1 28 SER O O -9.042 -5.859 -4.739 1.00 . A A . 28 SER O 1 1 2 1394 1 1 28 SER OG O -7.969 -9.156 -4.119 1.00 . A A . 28 SER OG 1 1 2 1395 1 1 29 GLN C C -10.220 -4.810 -1.979 1.00 . A A . 29 GLN C 1 1 2 1396 1 1 29 GLN CA C -10.160 -6.313 -2.246 1.00 . A A . 29 GLN CA 1 1 2 1397 1 1 29 GLN CB C -10.580 -7.083 -0.990 1.00 . A A . 29 GLN CB 1 1 2 1398 1 1 29 GLN CD C -11.050 -9.452 -0.248 1.00 . A A . 29 GLN CD 1 1 2 1399 1 1 29 GLN CG C -11.310 -8.379 -1.287 1.00 . A A . 29 GLN CG 1 1 2 1400 1 1 29 GLN H H -8.257 -7.201 -2.040 1.00 . A A . 29 GLN H 1 1 2 1401 1 1 29 GLN HA H -10.850 -6.551 -3.043 1.00 . A A . 29 GLN HA 1 1 2 1402 1 1 29 GLN HB2 H -9.697 -7.318 -0.419 1.00 . A A . 29 GLN HB2 1 1 2 1403 1 1 29 GLN HB3 H -11.220 -6.455 -0.394 1.00 . A A . 29 GLN HB3 1 1 2 1404 1 1 29 GLN HE21 H -10.030 -10.525 -1.578 1.00 . A A . 29 GLN HE21 1 1 2 1405 1 1 29 GLN HE22 H -10.150 -11.209 0.003 1.00 . A A . 29 GLN HE22 1 1 2 1406 1 1 29 GLN HG2 H -12.370 -8.180 -1.311 1.00 . A A . 29 GLN HG2 1 1 2 1407 1 1 29 GLN HG3 H -10.990 -8.746 -2.252 1.00 . A A . 29 GLN HG3 1 1 2 1408 1 1 29 GLN N N -8.834 -6.720 -2.672 1.00 . A A . 29 GLN N 1 1 2 1409 1 1 29 GLN NE2 N -10.340 -10.501 -0.648 1.00 . A A . 29 GLN NE2 1 1 2 1410 1 1 29 GLN O O -11.310 -4.231 -1.898 1.00 . A A . 29 GLN O 1 1 2 1411 1 1 29 GLN OE1 O -11.470 -9.336 0.903 1.00 . A A . 29 GLN OE1 1 1 2 1412 1 1 30 TRP C C -9.806 -1.960 -2.605 1.00 . A A . 30 TRP C 1 1 2 1413 1 1 30 TRP CA C -8.992 -2.746 -1.581 1.00 . A A . 30 TRP CA 1 1 2 1414 1 1 30 TRP CB C -7.537 -2.272 -1.606 1.00 . A A . 30 TRP CB 1 1 2 1415 1 1 30 TRP CD1 C -7.338 -2.900 0.874 1.00 . A A . 30 TRP CD1 1 1 2 1416 1 1 30 TRP CD2 C -5.396 -2.360 -0.099 1.00 . A A . 30 TRP CD2 1 1 2 1417 1 1 30 TRP CE2 C -5.148 -2.680 1.248 1.00 . A A . 30 TRP CE2 1 1 2 1418 1 1 30 TRP CE3 C -4.322 -1.987 -0.912 1.00 . A A . 30 TRP CE3 1 1 2 1419 1 1 30 TRP CG C -6.804 -2.506 -0.320 1.00 . A A . 30 TRP CG 1 1 2 1420 1 1 30 TRP CH2 C -2.838 -2.274 0.981 1.00 . A A . 30 TRP CH2 1 1 2 1421 1 1 30 TRP CZ2 C -3.869 -2.641 1.799 1.00 . A A . 30 TRP CZ2 1 1 2 1422 1 1 30 TRP CZ3 C -3.054 -1.947 -0.364 1.00 . A A . 30 TRP CZ3 1 1 2 1423 1 1 30 TRP H H -8.231 -4.693 -1.913 1.00 . A A . 30 TRP H 1 1 2 1424 1 1 30 TRP HA H -9.402 -2.567 -0.598 1.00 . A A . 30 TRP HA 1 1 2 1425 1 1 30 TRP HB2 H -7.009 -2.795 -2.389 1.00 . A A . 30 TRP HB2 1 1 2 1426 1 1 30 TRP HB3 H -7.517 -1.212 -1.813 1.00 . A A . 30 TRP HB3 1 1 2 1427 1 1 30 TRP HD1 H -8.388 -3.095 1.036 1.00 . A A . 30 TRP HD1 1 1 2 1428 1 1 30 TRP HE1 H -6.481 -3.274 2.755 1.00 . A A . 30 TRP HE1 1 1 2 1429 1 1 30 TRP HE3 H -4.470 -1.733 -1.951 1.00 . A A . 30 TRP HE3 1 1 2 1430 1 1 30 TRP HH2 H -1.829 -2.229 1.366 1.00 . A A . 30 TRP HH2 1 1 2 1431 1 1 30 TRP HZ2 H -3.685 -2.890 2.833 1.00 . A A . 30 TRP HZ2 1 1 2 1432 1 1 30 TRP HZ3 H -2.212 -1.663 -0.977 1.00 . A A . 30 TRP HZ3 1 1 2 1433 1 1 30 TRP N N -9.063 -4.181 -1.840 1.00 . A A . 30 TRP N 1 1 2 1434 1 1 30 TRP NE1 N -6.348 -3.006 1.821 1.00 . A A . 30 TRP NE1 1 1 2 1435 1 1 30 TRP O O -9.608 -2.103 -3.810 1.00 . A A . 30 TRP O 1 1 2 1436 1 1 31 LYS C C -10.790 0.914 -3.469 1.00 . A A . 31 LYS C 1 1 2 1437 1 1 31 LYS CA C -11.550 -0.315 -2.985 1.00 . A A . 31 LYS CA 1 1 2 1438 1 1 31 LYS CB C -12.830 0.110 -2.248 1.00 . A A . 31 LYS CB 1 1 2 1439 1 1 31 LYS CD C -14.880 -1.322 -1.987 1.00 . A A . 31 LYS CD 1 1 2 1440 1 1 31 LYS CE C -15.950 -0.647 -1.143 1.00 . A A . 31 LYS CE 1 1 2 1441 1 1 31 LYS CG C -13.480 -1.017 -1.467 1.00 . A A . 31 LYS CG 1 1 2 1442 1 1 31 LYS H H -10.820 -1.056 -1.143 1.00 . A A . 31 LYS H 1 1 2 1443 1 1 31 LYS HA H -11.820 -0.916 -3.840 1.00 . A A . 31 LYS HA 1 1 2 1444 1 1 31 LYS HB2 H -12.580 0.902 -1.557 1.00 . A A . 31 LYS HB2 1 1 2 1445 1 1 31 LYS HB3 H -13.540 0.482 -2.970 1.00 . A A . 31 LYS HB3 1 1 2 1446 1 1 31 LYS HD2 H -14.960 -0.965 -3.004 1.00 . A A . 31 LYS HD2 1 1 2 1447 1 1 31 LYS HD3 H -15.030 -2.391 -1.964 1.00 . A A . 31 LYS HD3 1 1 2 1448 1 1 31 LYS HE2 H -15.520 -0.386 -0.186 1.00 . A A . 31 LYS HE2 1 1 2 1449 1 1 31 LYS HE3 H -16.270 0.250 -1.648 1.00 . A A . 31 LYS HE3 1 1 2 1450 1 1 31 LYS HG2 H -12.870 -1.906 -1.557 1.00 . A A . 31 LYS HG2 1 1 2 1451 1 1 31 LYS HG3 H -13.550 -0.731 -0.427 1.00 . A A . 31 LYS HG3 1 1 2 1452 1 1 31 LYS HZ1 H -17.170 -2.252 -1.674 1.00 . A A . 31 LYS HZ1 1 1 2 1453 1 1 31 LYS HZ2 H -18.000 -0.974 -0.933 1.00 . A A . 31 LYS HZ2 1 1 2 1454 1 1 31 LYS HZ3 H -17.040 -2.014 -0.004 1.00 . A A . 31 LYS HZ3 1 1 2 1455 1 1 31 LYS N N -10.710 -1.128 -2.113 1.00 . A A . 31 LYS N 1 1 2 1456 1 1 31 LYS NZ N -17.120 -1.534 -0.922 1.00 . A A . 31 LYS NZ 1 1 2 1457 1 1 31 LYS O O -9.568 0.971 -3.370 1.00 . A A . 31 LYS O 1 1 2 1458 1 1 32 GLU C C -9.965 3.721 -3.435 1.00 . A A . 32 GLU C 1 1 2 1459 1 1 32 GLU CA C -10.900 3.126 -4.482 1.00 . A A . 32 GLU CA 1 1 2 1460 1 1 32 GLU CB C -11.980 4.146 -4.860 1.00 . A A . 32 GLU CB 1 1 2 1461 1 1 32 GLU CD C -13.600 4.688 -6.719 1.00 . A A . 32 GLU CD 1 1 2 1462 1 1 32 GLU CG C -12.180 4.285 -6.360 1.00 . A A . 32 GLU CG 1 1 2 1463 1 1 32 GLU H H -12.490 1.798 -4.039 1.00 . A A . 32 GLU H 1 1 2 1464 1 1 32 GLU HA H -10.330 2.878 -5.362 1.00 . A A . 32 GLU HA 1 1 2 1465 1 1 32 GLU HB2 H -12.920 3.843 -4.417 1.00 . A A . 32 GLU HB2 1 1 2 1466 1 1 32 GLU HB3 H -11.700 5.113 -4.465 1.00 . A A . 32 GLU HB3 1 1 2 1467 1 1 32 GLU HG2 H -11.510 5.037 -6.735 1.00 . A A . 32 GLU HG2 1 1 2 1468 1 1 32 GLU HG3 H -11.960 3.337 -6.829 1.00 . A A . 32 GLU HG3 1 1 2 1469 1 1 32 GLU N N -11.520 1.899 -3.988 1.00 . A A . 32 GLU N 1 1 2 1470 1 1 32 GLU O O -8.935 4.307 -3.773 1.00 . A A . 32 GLU O 1 1 2 1471 1 1 32 GLU OE1 O -14.090 5.702 -6.174 1.00 . A A . 32 GLU OE1 1 1 2 1472 1 1 32 GLU OE2 O -14.220 3.989 -7.546 1.00 . A A . 32 GLU OE2 1 1 2 1473 1 1 33 VAL C C -9.182 2.978 -0.068 1.00 . A A . 33 VAL C 1 1 2 1474 1 1 33 VAL CA C -9.512 4.079 -1.070 1.00 . A A . 33 VAL CA 1 1 2 1475 1 1 33 VAL CB C -10.220 5.231 -0.339 1.00 . A A . 33 VAL CB 1 1 2 1476 1 1 33 VAL CG1 C -9.285 5.902 0.650 1.00 . A A . 33 VAL CG1 1 1 2 1477 1 1 33 VAL CG2 C -10.770 6.242 -1.338 1.00 . A A . 33 VAL CG2 1 1 2 1478 1 1 33 VAL H H -11.150 3.083 -1.961 1.00 . A A . 33 VAL H 1 1 2 1479 1 1 33 VAL HA H -8.592 4.460 -1.489 1.00 . A A . 33 VAL HA 1 1 2 1480 1 1 33 VAL HB H -11.050 4.820 0.214 1.00 . A A . 33 VAL HB 1 1 2 1481 1 1 33 VAL HG11 H -9.830 6.166 1.543 1.00 . A A . 33 VAL HG11 1 1 2 1482 1 1 33 VAL HG12 H -8.870 6.793 0.203 1.00 . A A . 33 VAL HG12 1 1 2 1483 1 1 33 VAL HG13 H -8.486 5.220 0.903 1.00 . A A . 33 VAL HG13 1 1 2 1484 1 1 33 VAL HG21 H -11.800 6.019 -1.548 1.00 . A A . 33 VAL HG21 1 1 2 1485 1 1 33 VAL HG22 H -10.190 6.192 -2.252 1.00 . A A . 33 VAL HG22 1 1 2 1486 1 1 33 VAL HG23 H -10.690 7.236 -0.919 1.00 . A A . 33 VAL HG23 1 1 2 1487 1 1 33 VAL N N -10.320 3.562 -2.166 1.00 . A A . 33 VAL N 1 1 2 1488 1 1 33 VAL O O -10.060 2.248 0.380 1.00 . A A . 33 VAL O 1 1 2 1489 1 1 34 ILE C C -8.010 2.113 2.624 1.00 . A A . 34 ILE C 1 1 2 1490 1 1 34 ILE CA C -7.457 1.846 1.228 1.00 . A A . 34 ILE CA 1 1 2 1491 1 1 34 ILE CB C -5.920 1.791 1.312 1.00 . A A . 34 ILE CB 1 1 2 1492 1 1 34 ILE CD1 C -3.862 3.168 1.884 1.00 . A A . 34 ILE CD1 1 1 2 1493 1 1 34 ILE CG1 C -5.360 3.164 1.683 1.00 . A A . 34 ILE CG1 1 1 2 1494 1 1 34 ILE CG2 C -5.330 1.309 -0.005 1.00 . A A . 34 ILE CG2 1 1 2 1495 1 1 34 ILE H H -7.244 3.473 -0.114 1.00 . A A . 34 ILE H 1 1 2 1496 1 1 34 ILE HA H -7.814 0.886 0.886 1.00 . A A . 34 ILE HA 1 1 2 1497 1 1 34 ILE HB H -5.650 1.082 2.078 1.00 . A A . 34 ILE HB 1 1 2 1498 1 1 34 ILE HD11 H -3.372 2.956 0.944 1.00 . A A . 34 ILE HD11 1 1 2 1499 1 1 34 ILE HD12 H -3.594 2.411 2.608 1.00 . A A . 34 ILE HD12 1 1 2 1500 1 1 34 ILE HD13 H -3.548 4.135 2.243 1.00 . A A . 34 ILE HD13 1 1 2 1501 1 1 34 ILE HG12 H -5.590 3.866 0.896 1.00 . A A . 34 ILE HG12 1 1 2 1502 1 1 34 ILE HG13 H -5.819 3.497 2.602 1.00 . A A . 34 ILE HG13 1 1 2 1503 1 1 34 ILE HG21 H -4.275 1.122 0.123 1.00 . A A . 34 ILE HG21 1 1 2 1504 1 1 34 ILE HG22 H -5.473 2.067 -0.761 1.00 . A A . 34 ILE HG22 1 1 2 1505 1 1 34 ILE HG23 H -5.824 0.398 -0.309 1.00 . A A . 34 ILE HG23 1 1 2 1506 1 1 34 ILE N N -7.904 2.861 0.280 1.00 . A A . 34 ILE N 1 1 2 1507 1 1 34 ILE O O -8.447 3.223 2.925 1.00 . A A . 34 ILE O 1 1 2 1508 1 1 35 PRO C C -7.785 2.360 5.628 1.00 . A A . 35 PRO C 1 1 2 1509 1 1 35 PRO CA C -8.494 1.238 4.876 1.00 . A A . 35 PRO CA 1 1 2 1510 1 1 35 PRO CB C -8.184 -0.117 5.518 1.00 . A A . 35 PRO CB 1 1 2 1511 1 1 35 PRO CD C -7.492 -0.261 3.237 1.00 . A A . 35 PRO CD 1 1 2 1512 1 1 35 PRO CG C -8.057 -1.064 4.375 1.00 . A A . 35 PRO CG 1 1 2 1513 1 1 35 PRO HA H -9.559 1.415 4.892 1.00 . A A . 35 PRO HA 1 1 2 1514 1 1 35 PRO HB2 H -7.265 -0.052 6.081 1.00 . A A . 35 PRO HB2 1 1 2 1515 1 1 35 PRO HB3 H -8.994 -0.402 6.174 1.00 . A A . 35 PRO HB3 1 1 2 1516 1 1 35 PRO HD2 H -6.412 -0.286 3.257 1.00 . A A . 35 PRO HD2 1 1 2 1517 1 1 35 PRO HD3 H -7.863 -0.631 2.292 1.00 . A A . 35 PRO HD3 1 1 2 1518 1 1 35 PRO HG2 H -7.385 -1.868 4.636 1.00 . A A . 35 PRO HG2 1 1 2 1519 1 1 35 PRO HG3 H -9.027 -1.457 4.111 1.00 . A A . 35 PRO HG3 1 1 2 1520 1 1 35 PRO N N -7.995 1.097 3.504 1.00 . A A . 35 PRO N 1 1 2 1521 1 1 35 PRO O O -6.708 2.804 5.228 1.00 . A A . 35 PRO O 1 1 2 1522 1 1 36 GLU C C -6.559 3.439 8.237 1.00 . A A . 36 GLU C 1 1 2 1523 1 1 36 GLU CA C -7.827 3.892 7.519 1.00 . A A . 36 GLU CA 1 1 2 1524 1 1 36 GLU CB C -8.855 4.385 8.541 1.00 . A A . 36 GLU CB 1 1 2 1525 1 1 36 GLU CD C -7.879 5.042 10.775 1.00 . A A . 36 GLU CD 1 1 2 1526 1 1 36 GLU CG C -8.350 5.521 9.416 1.00 . A A . 36 GLU CG 1 1 2 1527 1 1 36 GLU H H -9.255 2.426 6.977 1.00 . A A . 36 GLU H 1 1 2 1528 1 1 36 GLU HA H -7.579 4.705 6.855 1.00 . A A . 36 GLU HA 1 1 2 1529 1 1 36 GLU HB2 H -9.734 4.729 8.013 1.00 . A A . 36 GLU HB2 1 1 2 1530 1 1 36 GLU HB3 H -9.132 3.560 9.182 1.00 . A A . 36 GLU HB3 1 1 2 1531 1 1 36 GLU HG2 H -7.523 6.003 8.915 1.00 . A A . 36 GLU HG2 1 1 2 1532 1 1 36 GLU HG3 H -9.150 6.231 9.558 1.00 . A A . 36 GLU HG3 1 1 2 1533 1 1 36 GLU N N -8.397 2.817 6.714 1.00 . A A . 36 GLU N 1 1 2 1534 1 1 36 GLU O O -5.644 4.232 8.456 1.00 . A A . 36 GLU O 1 1 2 1535 1 1 36 GLU OE1 O -8.681 4.411 11.494 1.00 . A A . 36 GLU OE1 1 1 2 1536 1 1 36 GLU OE2 O -6.706 5.301 11.121 1.00 . A A . 36 GLU OE2 1 1 2 1537 1 1 37 LYS C C -4.306 1.085 8.343 1.00 . A A . 37 LYS C 1 1 2 1538 1 1 37 LYS CA C -5.356 1.616 9.314 1.00 . A A . 37 LYS CA 1 1 2 1539 1 1 37 LYS CB C -5.794 0.504 10.268 1.00 . A A . 37 LYS CB 1 1 2 1540 1 1 37 LYS CD C -7.342 -1.468 10.450 1.00 . A A . 37 LYS CD 1 1 2 1541 1 1 37 LYS CE C -8.784 -1.127 10.105 1.00 . A A . 37 LYS CE 1 1 2 1542 1 1 37 LYS CG C -6.364 -0.717 9.562 1.00 . A A . 37 LYS CG 1 1 2 1543 1 1 37 LYS H H -7.275 1.580 8.416 1.00 . A A . 37 LYS H 1 1 2 1544 1 1 37 LYS HA H -4.915 2.416 9.890 1.00 . A A . 37 LYS HA 1 1 2 1545 1 1 37 LYS HB2 H -4.942 0.189 10.852 1.00 . A A . 37 LYS HB2 1 1 2 1546 1 1 37 LYS HB3 H -6.551 0.893 10.934 1.00 . A A . 37 LYS HB3 1 1 2 1547 1 1 37 LYS HD2 H -7.193 -2.529 10.318 1.00 . A A . 37 LYS HD2 1 1 2 1548 1 1 37 LYS HD3 H -7.157 -1.201 11.480 1.00 . A A . 37 LYS HD3 1 1 2 1549 1 1 37 LYS HE2 H -9.351 -1.051 11.019 1.00 . A A . 37 LYS HE2 1 1 2 1550 1 1 37 LYS HE3 H -8.801 -0.178 9.589 1.00 . A A . 37 LYS HE3 1 1 2 1551 1 1 37 LYS HG2 H -6.876 -0.397 8.668 1.00 . A A . 37 LYS HG2 1 1 2 1552 1 1 37 LYS HG3 H -5.551 -1.379 9.297 1.00 . A A . 37 LYS HG3 1 1 2 1553 1 1 37 LYS HZ1 H -8.889 -2.231 8.335 1.00 . A A . 37 LYS HZ1 1 1 2 1554 1 1 37 LYS HZ2 H -10.390 -1.914 9.035 1.00 . A A . 37 LYS HZ2 1 1 2 1555 1 1 37 LYS HZ3 H -9.381 -3.089 9.707 1.00 . A A . 37 LYS HZ3 1 1 2 1556 1 1 37 LYS N N -6.513 2.164 8.611 1.00 . A A . 37 LYS N 1 1 2 1557 1 1 37 LYS NZ N -9.406 -2.164 9.235 1.00 . A A . 37 LYS NZ 1 1 2 1558 1 1 37 LYS O O -3.150 0.888 8.719 1.00 . A A . 37 LYS O 1 1 2 1559 1 1 38 ASP C C -2.919 1.490 5.548 1.00 . A A . 38 ASP C 1 1 2 1560 1 1 38 ASP CA C -3.779 0.356 6.090 1.00 . A A . 38 ASP CA 1 1 2 1561 1 1 38 ASP CB C -4.545 -0.318 4.949 1.00 . A A . 38 ASP CB 1 1 2 1562 1 1 38 ASP CG C -4.400 -1.828 4.967 1.00 . A A . 38 ASP CG 1 1 2 1563 1 1 38 ASP H H -5.635 1.035 6.847 1.00 . A A . 38 ASP H 1 1 2 1564 1 1 38 ASP HA H -3.136 -0.371 6.563 1.00 . A A . 38 ASP HA 1 1 2 1565 1 1 38 ASP HB2 H -5.592 -0.076 5.038 1.00 . A A . 38 ASP HB2 1 1 2 1566 1 1 38 ASP HB3 H -4.173 0.049 4.004 1.00 . A A . 38 ASP HB3 1 1 2 1567 1 1 38 ASP N N -4.704 0.858 7.097 1.00 . A A . 38 ASP N 1 1 2 1568 1 1 38 ASP O O -1.713 1.332 5.355 1.00 . A A . 38 ASP O 1 1 2 1569 1 1 38 ASP OD1 O -3.424 -2.324 5.568 1.00 . A A . 38 ASP OD1 1 1 2 1570 1 1 38 ASP OD2 O -5.264 -2.514 4.382 1.00 . A A . 38 ASP OD2 1 1 2 1571 1 1 39 ALA C C -1.729 4.234 5.756 1.00 . A A . 39 ALA C 1 1 2 1572 1 1 39 ALA CA C -2.839 3.803 4.804 1.00 . A A . 39 ALA CA 1 1 2 1573 1 1 39 ALA CB C -3.813 4.948 4.572 1.00 . A A . 39 ALA CB 1 1 2 1574 1 1 39 ALA H H -4.506 2.701 5.492 1.00 . A A . 39 ALA H 1 1 2 1575 1 1 39 ALA HA H -2.400 3.538 3.854 1.00 . A A . 39 ALA HA 1 1 2 1576 1 1 39 ALA HB1 H -4.259 5.237 5.512 1.00 . A A . 39 ALA HB1 1 1 2 1577 1 1 39 ALA HB2 H -4.587 4.630 3.889 1.00 . A A . 39 ALA HB2 1 1 2 1578 1 1 39 ALA HB3 H -3.285 5.791 4.150 1.00 . A A . 39 ALA HB3 1 1 2 1579 1 1 39 ALA N N -3.545 2.637 5.314 1.00 . A A . 39 ALA N 1 1 2 1580 1 1 39 ALA O O -0.736 4.830 5.336 1.00 . A A . 39 ALA O 1 1 2 1581 1 1 40 TYR C C 0.322 3.395 7.961 1.00 . A A . 40 TYR C 1 1 2 1582 1 1 40 TYR CA C -0.906 4.300 8.046 1.00 . A A . 40 TYR CA 1 1 2 1583 1 1 40 TYR CB C -1.513 4.223 9.449 1.00 . A A . 40 TYR CB 1 1 2 1584 1 1 40 TYR CD1 C -0.377 5.914 10.942 1.00 . A A . 40 TYR CD1 1 1 2 1585 1 1 40 TYR CD2 C 0.213 3.617 11.190 1.00 . A A . 40 TYR CD2 1 1 2 1586 1 1 40 TYR CE1 C 0.511 6.255 11.944 1.00 . A A . 40 TYR CE1 1 1 2 1587 1 1 40 TYR CE2 C 1.103 3.950 12.192 1.00 . A A . 40 TYR CE2 1 1 2 1588 1 1 40 TYR CG C -0.542 4.591 10.548 1.00 . A A . 40 TYR CG 1 1 2 1589 1 1 40 TYR CZ C 1.248 5.269 12.566 1.00 . A A . 40 TYR CZ 1 1 2 1590 1 1 40 TYR H H -2.712 3.460 7.324 1.00 . A A . 40 TYR H 1 1 2 1591 1 1 40 TYR HA H -0.600 5.318 7.852 1.00 . A A . 40 TYR HA 1 1 2 1592 1 1 40 TYR HB2 H -2.353 4.903 9.507 1.00 . A A . 40 TYR HB2 1 1 2 1593 1 1 40 TYR HB3 H -1.856 3.213 9.630 1.00 . A A . 40 TYR HB3 1 1 2 1594 1 1 40 TYR HD1 H -0.957 6.683 10.454 1.00 . A A . 40 TYR HD1 1 1 2 1595 1 1 40 TYR HD2 H 0.097 2.584 10.893 1.00 . A A . 40 TYR HD2 1 1 2 1596 1 1 40 TYR HE1 H 0.624 7.288 12.236 1.00 . A A . 40 TYR HE1 1 1 2 1597 1 1 40 TYR HE2 H 1.681 3.178 12.679 1.00 . A A . 40 TYR HE2 1 1 2 1598 1 1 40 TYR HH H 1.699 6.178 14.199 1.00 . A A . 40 TYR HH 1 1 2 1599 1 1 40 TYR N N -1.899 3.935 7.043 1.00 . A A . 40 TYR N 1 1 2 1600 1 1 40 TYR O O 1.457 3.871 7.996 1.00 . A A . 40 TYR O 1 1 2 1601 1 1 40 TYR OH O 2.135 5.604 13.563 1.00 . A A . 40 TYR OH 1 1 2 1602 1 1 41 ARG C C 2.019 1.339 6.525 1.00 . A A . 41 ARG C 1 1 2 1603 1 1 41 ARG CA C 1.174 1.123 7.777 1.00 . A A . 41 ARG CA 1 1 2 1604 1 1 41 ARG CB C 0.617 -0.302 7.786 1.00 . A A . 41 ARG CB 1 1 2 1605 1 1 41 ARG CD C -0.802 -1.690 9.336 1.00 . A A . 41 ARG CD 1 1 2 1606 1 1 41 ARG CG C 0.486 -0.895 9.182 1.00 . A A . 41 ARG CG 1 1 2 1607 1 1 41 ARG CZ C -1.424 -3.999 9.931 1.00 . A A . 41 ARG CZ 1 1 2 1608 1 1 41 ARG H H -0.840 1.773 7.841 1.00 . A A . 41 ARG H 1 1 2 1609 1 1 41 ARG HA H 1.803 1.257 8.646 1.00 . A A . 41 ARG HA 1 1 2 1610 1 1 41 ARG HB2 H -0.361 -0.295 7.327 1.00 . A A . 41 ARG HB2 1 1 2 1611 1 1 41 ARG HB3 H 1.272 -0.936 7.210 1.00 . A A . 41 ARG HB3 1 1 2 1612 1 1 41 ARG HD2 H -1.307 -1.360 10.230 1.00 . A A . 41 ARG HD2 1 1 2 1613 1 1 41 ARG HD3 H -1.431 -1.502 8.478 1.00 . A A . 41 ARG HD3 1 1 2 1614 1 1 41 ARG HE H 0.316 -3.456 9.117 1.00 . A A . 41 ARG HE 1 1 2 1615 1 1 41 ARG HG2 H 1.324 -1.549 9.363 1.00 . A A . 41 ARG HG2 1 1 2 1616 1 1 41 ARG HG3 H 0.492 -0.091 9.905 1.00 . A A . 41 ARG HG3 1 1 2 1617 1 1 41 ARG HH11 H -2.847 -2.617 10.332 1.00 . A A . 41 ARG HH11 1 1 2 1618 1 1 41 ARG HH12 H -3.259 -4.249 10.742 1.00 . A A . 41 ARG HH12 1 1 2 1619 1 1 41 ARG HH21 H -0.224 -5.602 9.657 1.00 . A A . 41 ARG HH21 1 1 2 1620 1 1 41 ARG HH22 H -1.771 -5.943 10.359 1.00 . A A . 41 ARG HH22 1 1 2 1621 1 1 41 ARG N N 0.088 2.092 7.859 1.00 . A A . 41 ARG N 1 1 2 1622 1 1 41 ARG NE N -0.550 -3.126 9.435 1.00 . A A . 41 ARG NE 1 1 2 1623 1 1 41 ARG NH1 N -2.607 -3.588 10.371 1.00 . A A . 41 ARG NH1 1 1 2 1624 1 1 41 ARG NH2 N -1.115 -5.286 9.986 1.00 . A A . 41 ARG NH2 1 1 2 1625 1 1 41 ARG O O 3.223 1.082 6.525 1.00 . A A . 41 ARG O 1 1 2 1626 1 1 42 LEU C C 3.215 3.051 4.379 1.00 . A A . 42 LEU C 1 1 2 1627 1 1 42 LEU CA C 2.075 2.051 4.198 1.00 . A A . 42 LEU CA 1 1 2 1628 1 1 42 LEU CB C 1.094 2.568 3.145 1.00 . A A . 42 LEU CB 1 1 2 1629 1 1 42 LEU CD1 C -1.038 2.239 1.874 1.00 . A A . 42 LEU CD1 1 1 2 1630 1 1 42 LEU CD2 C 0.702 0.443 1.876 1.00 . A A . 42 LEU CD2 1 1 2 1631 1 1 42 LEU CG C 0.049 1.553 2.686 1.00 . A A . 42 LEU CG 1 1 2 1632 1 1 42 LEU H H 0.420 1.991 5.517 1.00 . A A . 42 LEU H 1 1 2 1633 1 1 42 LEU HA H 2.487 1.113 3.862 1.00 . A A . 42 LEU HA 1 1 2 1634 1 1 42 LEU HB2 H 0.579 3.426 3.552 1.00 . A A . 42 LEU HB2 1 1 2 1635 1 1 42 LEU HB3 H 1.660 2.885 2.281 1.00 . A A . 42 LEU HB3 1 1 2 1636 1 1 42 LEU HD11 H -1.267 3.198 2.316 1.00 . A A . 42 LEU HD11 1 1 2 1637 1 1 42 LEU HD12 H -1.926 1.624 1.871 1.00 . A A . 42 LEU HD12 1 1 2 1638 1 1 42 LEU HD13 H -0.696 2.382 0.860 1.00 . A A . 42 LEU HD13 1 1 2 1639 1 1 42 LEU HD21 H -0.040 -0.298 1.615 1.00 . A A . 42 LEU HD21 1 1 2 1640 1 1 42 LEU HD22 H 1.482 -0.020 2.462 1.00 . A A . 42 LEU HD22 1 1 2 1641 1 1 42 LEU HD23 H 1.128 0.858 0.974 1.00 . A A . 42 LEU HD23 1 1 2 1642 1 1 42 LEU HG H -0.416 1.106 3.553 1.00 . A A . 42 LEU HG 1 1 2 1643 1 1 42 LEU N N 1.380 1.808 5.459 1.00 . A A . 42 LEU N 1 1 2 1644 1 1 42 LEU O O 4.294 2.885 3.812 1.00 . A A . 42 LEU O 1 1 2 1645 1 1 43 GLU C C 5.210 4.537 6.098 1.00 . A A . 43 GLU C 1 1 2 1646 1 1 43 GLU CA C 3.969 5.119 5.420 1.00 . A A . 43 GLU CA 1 1 2 1647 1 1 43 GLU CB C 3.380 6.234 6.284 1.00 . A A . 43 GLU CB 1 1 2 1648 1 1 43 GLU CD C 3.941 8.332 7.575 1.00 . A A . 43 GLU CD 1 1 2 1649 1 1 43 GLU CG C 4.266 7.465 6.374 1.00 . A A . 43 GLU CG 1 1 2 1650 1 1 43 GLU H H 2.085 4.169 5.591 1.00 . A A . 43 GLU H 1 1 2 1651 1 1 43 GLU HA H 4.259 5.532 4.466 1.00 . A A . 43 GLU HA 1 1 2 1652 1 1 43 GLU HB2 H 2.427 6.531 5.869 1.00 . A A . 43 GLU HB2 1 1 2 1653 1 1 43 GLU HB3 H 3.225 5.854 7.284 1.00 . A A . 43 GLU HB3 1 1 2 1654 1 1 43 GLU HG2 H 5.295 7.147 6.448 1.00 . A A . 43 GLU HG2 1 1 2 1655 1 1 43 GLU HG3 H 4.135 8.053 5.477 1.00 . A A . 43 GLU HG3 1 1 2 1656 1 1 43 GLU N N 2.965 4.089 5.168 1.00 . A A . 43 GLU N 1 1 2 1657 1 1 43 GLU O O 6.272 5.155 6.093 1.00 . A A . 43 GLU O 1 1 2 1658 1 1 43 GLU OE1 O 3.058 9.207 7.454 1.00 . A A . 43 GLU OE1 1 1 2 1659 1 1 43 GLU OE2 O 4.569 8.136 8.636 1.00 . A A . 43 GLU OE2 1 1 2 1660 1 1 44 ILE C C 6.939 1.765 6.426 1.00 . A A . 44 ILE C 1 1 2 1661 1 1 44 ILE CA C 6.182 2.703 7.363 1.00 . A A . 44 ILE CA 1 1 2 1662 1 1 44 ILE CB C 5.704 1.907 8.591 1.00 . A A . 44 ILE CB 1 1 2 1663 1 1 44 ILE CD1 C 4.830 2.448 10.938 1.00 . A A . 44 ILE CD1 1 1 2 1664 1 1 44 ILE CG1 C 4.797 2.788 9.462 1.00 . A A . 44 ILE CG1 1 1 2 1665 1 1 44 ILE CG2 C 6.899 1.388 9.381 1.00 . A A . 44 ILE CG2 1 1 2 1666 1 1 44 ILE H H 4.198 2.903 6.659 1.00 . A A . 44 ILE H 1 1 2 1667 1 1 44 ILE HA H 6.857 3.474 7.706 1.00 . A A . 44 ILE HA 1 1 2 1668 1 1 44 ILE HB H 5.138 1.056 8.242 1.00 . A A . 44 ILE HB 1 1 2 1669 1 1 44 ILE HD11 H 5.836 2.574 11.311 1.00 . A A . 44 ILE HD11 1 1 2 1670 1 1 44 ILE HD12 H 4.518 1.424 11.077 1.00 . A A . 44 ILE HD12 1 1 2 1671 1 1 44 ILE HD13 H 4.163 3.105 11.474 1.00 . A A . 44 ILE HD13 1 1 2 1672 1 1 44 ILE HG12 H 5.102 3.819 9.356 1.00 . A A . 44 ILE HG12 1 1 2 1673 1 1 44 ILE HG13 H 3.776 2.687 9.122 1.00 . A A . 44 ILE HG13 1 1 2 1674 1 1 44 ILE HG21 H 6.551 0.783 10.205 1.00 . A A . 44 ILE HG21 1 1 2 1675 1 1 44 ILE HG22 H 7.467 2.223 9.763 1.00 . A A . 44 ILE HG22 1 1 2 1676 1 1 44 ILE HG23 H 7.525 0.792 8.734 1.00 . A A . 44 ILE HG23 1 1 2 1677 1 1 44 ILE N N 5.070 3.351 6.682 1.00 . A A . 44 ILE N 1 1 2 1678 1 1 44 ILE O O 8.164 1.826 6.327 1.00 . A A . 44 ILE O 1 1 2 1679 1 1 45 VAL C C 7.473 0.659 3.647 1.00 . A A . 45 VAL C 1 1 2 1680 1 1 45 VAL CA C 6.805 -0.055 4.815 1.00 . A A . 45 VAL CA 1 1 2 1681 1 1 45 VAL CB C 5.764 -1.047 4.260 1.00 . A A . 45 VAL CB 1 1 2 1682 1 1 45 VAL CG1 C 5.439 -2.115 5.293 1.00 . A A . 45 VAL CG1 1 1 2 1683 1 1 45 VAL CG2 C 4.503 -0.318 3.818 1.00 . A A . 45 VAL CG2 1 1 2 1684 1 1 45 VAL H H 5.231 0.895 5.864 1.00 . A A . 45 VAL H 1 1 2 1685 1 1 45 VAL HA H 7.551 -0.616 5.355 1.00 . A A . 45 VAL HA 1 1 2 1686 1 1 45 VAL HB H 6.192 -1.531 3.395 1.00 . A A . 45 VAL HB 1 1 2 1687 1 1 45 VAL HG11 H 5.599 -1.718 6.283 1.00 . A A . 45 VAL HG11 1 1 2 1688 1 1 45 VAL HG12 H 6.078 -2.972 5.138 1.00 . A A . 45 VAL HG12 1 1 2 1689 1 1 45 VAL HG13 H 4.405 -2.413 5.187 1.00 . A A . 45 VAL HG13 1 1 2 1690 1 1 45 VAL HG21 H 3.883 -0.992 3.244 1.00 . A A . 45 VAL HG21 1 1 2 1691 1 1 45 VAL HG22 H 4.772 0.529 3.206 1.00 . A A . 45 VAL HG22 1 1 2 1692 1 1 45 VAL HG23 H 3.959 0.021 4.685 1.00 . A A . 45 VAL HG23 1 1 2 1693 1 1 45 VAL N N 6.202 0.897 5.742 1.00 . A A . 45 VAL N 1 1 2 1694 1 1 45 VAL O O 8.541 0.255 3.185 1.00 . A A . 45 VAL O 1 1 2 1695 1 1 46 THR C C 8.446 3.467 2.499 1.00 . A A . 46 THR C 1 1 2 1696 1 1 46 THR CA C 7.352 2.493 2.054 1.00 . A A . 46 THR CA 1 1 2 1697 1 1 46 THR CB C 6.210 3.262 1.395 1.00 . A A . 46 THR CB 1 1 2 1698 1 1 46 THR CG2 C 5.051 2.379 0.985 1.00 . A A . 46 THR CG2 1 1 2 1699 1 1 46 THR H H 5.986 1.989 3.575 1.00 . A A . 46 THR H 1 1 2 1700 1 1 46 THR HA H 7.768 1.804 1.336 1.00 . A A . 46 THR HA 1 1 2 1701 1 1 46 THR HB H 6.584 3.746 0.513 1.00 . A A . 46 THR HB 1 1 2 1702 1 1 46 THR HG1 H 5.463 3.857 3.106 1.00 . A A . 46 THR HG1 1 1 2 1703 1 1 46 THR HG21 H 4.157 2.695 1.502 1.00 . A A . 46 THR HG21 1 1 2 1704 1 1 46 THR HG22 H 5.273 1.354 1.240 1.00 . A A . 46 THR HG22 1 1 2 1705 1 1 46 THR HG23 H 4.897 2.460 -0.080 1.00 . A A . 46 THR HG23 1 1 2 1706 1 1 46 THR N N 6.833 1.720 3.170 1.00 . A A . 46 THR N 1 1 2 1707 1 1 46 THR O O 8.936 4.262 1.698 1.00 . A A . 46 THR O 1 1 2 1708 1 1 46 THR OG1 O 5.705 4.257 2.268 1.00 . A A . 46 THR OG1 1 1 2 1709 1 1 47 ALA C C 9.401 5.738 4.284 1.00 . A A . 47 ALA C 1 1 2 1710 1 1 47 ALA CA C 9.859 4.284 4.305 1.00 . A A . 47 ALA CA 1 1 2 1711 1 1 47 ALA CB C 11.152 4.125 3.516 1.00 . A A . 47 ALA CB 1 1 2 1712 1 1 47 ALA H H 8.404 2.754 4.370 1.00 . A A . 47 ALA H 1 1 2 1713 1 1 47 ALA HA H 10.052 3.994 5.327 1.00 . A A . 47 ALA HA 1 1 2 1714 1 1 47 ALA HB1 H 11.147 3.174 3.007 1.00 . A A . 47 ALA HB1 1 1 2 1715 1 1 47 ALA HB2 H 11.994 4.170 4.190 1.00 . A A . 47 ALA HB2 1 1 2 1716 1 1 47 ALA HB3 H 11.230 4.922 2.789 1.00 . A A . 47 ALA HB3 1 1 2 1717 1 1 47 ALA N N 8.827 3.403 3.773 1.00 . A A . 47 ALA N 1 1 2 1718 1 1 47 ALA O O 10.208 6.654 4.132 1.00 . A A . 47 ALA O 1 1 2 1719 1 1 48 GLY C C 7.325 7.819 3.033 1.00 . A A . 48 GLY C 1 1 2 1720 1 1 48 GLY CA C 7.549 7.284 4.435 1.00 . A A . 48 GLY CA 1 1 2 1721 1 1 48 GLY H H 7.499 5.172 4.556 1.00 . A A . 48 GLY H 1 1 2 1722 1 1 48 GLY HA2 H 6.606 7.279 4.962 1.00 . A A . 48 GLY HA2 1 1 2 1723 1 1 48 GLY HA3 H 8.233 7.941 4.953 1.00 . A A . 48 GLY HA3 1 1 2 1724 1 1 48 GLY N N 8.096 5.941 4.439 1.00 . A A . 48 GLY N 1 1 2 1725 1 1 48 GLY O O 7.309 9.032 2.820 1.00 . A A . 48 GLY O 1 1 2 1726 1 1 49 ALA C C 5.580 8.013 0.534 1.00 . A A . 49 ALA C 1 1 2 1727 1 1 49 ALA CA C 6.922 7.305 0.691 1.00 . A A . 49 ALA CA 1 1 2 1728 1 1 49 ALA CB C 6.988 6.088 -0.219 1.00 . A A . 49 ALA CB 1 1 2 1729 1 1 49 ALA H H 7.169 5.962 2.307 1.00 . A A . 49 ALA H 1 1 2 1730 1 1 49 ALA HA H 7.712 7.985 0.403 1.00 . A A . 49 ALA HA 1 1 2 1731 1 1 49 ALA HB1 H 6.051 5.553 -0.175 1.00 . A A . 49 ALA HB1 1 1 2 1732 1 1 49 ALA HB2 H 7.789 5.439 0.106 1.00 . A A . 49 ALA HB2 1 1 2 1733 1 1 49 ALA HB3 H 7.174 6.406 -1.234 1.00 . A A . 49 ALA HB3 1 1 2 1734 1 1 49 ALA N N 7.148 6.914 2.077 1.00 . A A . 49 ALA N 1 1 2 1735 1 1 49 ALA O O 5.514 9.139 0.043 1.00 . A A . 49 ALA O 1 1 2 1736 1 1 50 LEU C C 2.818 8.670 2.141 1.00 . A A . 50 LEU C 1 1 2 1737 1 1 50 LEU CA C 3.172 7.908 0.868 1.00 . A A . 50 LEU CA 1 1 2 1738 1 1 50 LEU CB C 2.145 6.801 0.618 1.00 . A A . 50 LEU CB 1 1 2 1739 1 1 50 LEU CD1 C 3.083 4.815 -0.591 1.00 . A A . 50 LEU CD1 1 1 2 1740 1 1 50 LEU CD2 C 0.897 5.792 -1.309 1.00 . A A . 50 LEU CD2 1 1 2 1741 1 1 50 LEU CG C 2.273 6.093 -0.732 1.00 . A A . 50 LEU CG 1 1 2 1742 1 1 50 LEU H H 4.630 6.449 1.342 1.00 . A A . 50 LEU H 1 1 2 1743 1 1 50 LEU HA H 3.157 8.596 0.036 1.00 . A A . 50 LEU HA 1 1 2 1744 1 1 50 LEU HB2 H 2.246 6.063 1.401 1.00 . A A . 50 LEU HB2 1 1 2 1745 1 1 50 LEU HB3 H 1.157 7.234 0.680 1.00 . A A . 50 LEU HB3 1 1 2 1746 1 1 50 LEU HD11 H 2.729 4.082 -1.301 1.00 . A A . 50 LEU HD11 1 1 2 1747 1 1 50 LEU HD12 H 2.972 4.426 0.411 1.00 . A A . 50 LEU HD12 1 1 2 1748 1 1 50 LEU HD13 H 4.126 5.025 -0.780 1.00 . A A . 50 LEU HD13 1 1 2 1749 1 1 50 LEU HD21 H 0.381 5.095 -0.665 1.00 . A A . 50 LEU HD21 1 1 2 1750 1 1 50 LEU HD22 H 1.007 5.360 -2.293 1.00 . A A . 50 LEU HD22 1 1 2 1751 1 1 50 LEU HD23 H 0.328 6.708 -1.379 1.00 . A A . 50 LEU HD23 1 1 2 1752 1 1 50 LEU HG H 2.792 6.741 -1.424 1.00 . A A . 50 LEU HG 1 1 2 1753 1 1 50 LEU N N 4.513 7.344 0.958 1.00 . A A . 50 LEU N 1 1 2 1754 1 1 50 LEU O O 3.013 8.170 3.249 1.00 . A A . 50 LEU O 1 1 2 1755 1 1 51 LYS C C 0.518 10.370 3.602 1.00 . A A . 51 LYS C 1 1 2 1756 1 1 51 LYS CA C 1.923 10.714 3.113 1.00 . A A . 51 LYS CA 1 1 2 1757 1 1 51 LYS CB C 1.993 12.194 2.736 1.00 . A A . 51 LYS CB 1 1 2 1758 1 1 51 LYS CD C 3.753 12.957 1.109 1.00 . A A . 51 LYS CD 1 1 2 1759 1 1 51 LYS CE C 3.420 14.381 0.691 1.00 . A A . 51 LYS CE 1 1 2 1760 1 1 51 LYS CG C 3.413 12.713 2.571 1.00 . A A . 51 LYS CG 1 1 2 1761 1 1 51 LYS H H 2.169 10.228 1.068 1.00 . A A . 51 LYS H 1 1 2 1762 1 1 51 LYS HA H 2.624 10.520 3.910 1.00 . A A . 51 LYS HA 1 1 2 1763 1 1 51 LYS HB2 H 1.467 12.342 1.805 1.00 . A A . 51 LYS HB2 1 1 2 1764 1 1 51 LYS HB3 H 1.510 12.773 3.510 1.00 . A A . 51 LYS HB3 1 1 2 1765 1 1 51 LYS HD2 H 4.807 12.786 0.961 1.00 . A A . 51 LYS HD2 1 1 2 1766 1 1 51 LYS HD3 H 3.185 12.270 0.499 1.00 . A A . 51 LYS HD3 1 1 2 1767 1 1 51 LYS HE2 H 2.346 14.492 0.660 1.00 . A A . 51 LYS HE2 1 1 2 1768 1 1 51 LYS HE3 H 3.833 15.061 1.420 1.00 . A A . 51 LYS HE3 1 1 2 1769 1 1 51 LYS HG2 H 3.511 13.642 3.113 1.00 . A A . 51 LYS HG2 1 1 2 1770 1 1 51 LYS HG3 H 4.102 11.985 2.975 1.00 . A A . 51 LYS HG3 1 1 2 1771 1 1 51 LYS HZ1 H 4.923 14.289 -0.758 1.00 . A A . 51 LYS HZ1 1 1 2 1772 1 1 51 LYS HZ2 H 4.056 15.740 -0.762 1.00 . A A . 51 LYS HZ2 1 1 2 1773 1 1 51 LYS HZ3 H 3.356 14.338 -1.397 1.00 . A A . 51 LYS HZ3 1 1 2 1774 1 1 51 LYS N N 2.299 9.882 1.975 1.00 . A A . 51 LYS N 1 1 2 1775 1 1 51 LYS NZ N 3.978 14.709 -0.650 1.00 . A A . 51 LYS NZ 1 1 2 1776 1 1 51 LYS O O -0.474 10.856 3.060 1.00 . A A . 51 LYS O 1 1 2 1777 1 1 52 TYR C C -1.596 10.345 5.725 1.00 . A A . 52 TYR C 1 1 2 1778 1 1 52 TYR CA C -0.838 9.133 5.199 1.00 . A A . 52 TYR CA 1 1 2 1779 1 1 52 TYR CB C -0.621 8.117 6.325 1.00 . A A . 52 TYR CB 1 1 2 1780 1 1 52 TYR CD1 C -3.040 7.386 6.468 1.00 . A A . 52 TYR CD1 1 1 2 1781 1 1 52 TYR CD2 C -1.883 7.862 8.496 1.00 . A A . 52 TYR CD2 1 1 2 1782 1 1 52 TYR CE1 C -4.177 7.077 7.186 1.00 . A A . 52 TYR CE1 1 1 2 1783 1 1 52 TYR CE2 C -3.017 7.552 9.221 1.00 . A A . 52 TYR CE2 1 1 2 1784 1 1 52 TYR CG C -1.873 7.784 7.109 1.00 . A A . 52 TYR CG 1 1 2 1785 1 1 52 TYR CZ C -4.163 7.160 8.561 1.00 . A A . 52 TYR CZ 1 1 2 1786 1 1 52 TYR H H 1.271 9.184 5.024 1.00 . A A . 52 TYR H 1 1 2 1787 1 1 52 TYR HA H -1.419 8.670 4.415 1.00 . A A . 52 TYR HA 1 1 2 1788 1 1 52 TYR HB2 H -0.245 7.197 5.903 1.00 . A A . 52 TYR HB2 1 1 2 1789 1 1 52 TYR HB3 H 0.109 8.513 7.017 1.00 . A A . 52 TYR HB3 1 1 2 1790 1 1 52 TYR HD1 H -3.055 7.324 5.391 1.00 . A A . 52 TYR HD1 1 1 2 1791 1 1 52 TYR HD2 H -0.985 8.172 9.010 1.00 . A A . 52 TYR HD2 1 1 2 1792 1 1 52 TYR HE1 H -5.069 6.765 6.668 1.00 . A A . 52 TYR HE1 1 1 2 1793 1 1 52 TYR HE2 H -3.005 7.622 10.297 1.00 . A A . 52 TYR HE2 1 1 2 1794 1 1 52 TYR HH H -5.301 7.343 10.101 1.00 . A A . 52 TYR HH 1 1 2 1795 1 1 52 TYR N N 0.444 9.535 4.633 1.00 . A A . 52 TYR N 1 1 2 1796 1 1 52 TYR O O -1.030 11.191 6.416 1.00 . A A . 52 TYR O 1 1 2 1797 1 1 52 TYR OH O -5.296 6.849 9.278 1.00 . A A . 52 TYR OH 1 1 2 1798 1 1 53 GLN C C -5.070 11.050 6.312 1.00 . A A . 53 GLN C 1 1 2 1799 1 1 53 GLN CA C -3.709 11.539 5.834 1.00 . A A . 53 GLN CA 1 1 2 1800 1 1 53 GLN CB C -3.885 12.555 4.703 1.00 . A A . 53 GLN CB 1 1 2 1801 1 1 53 GLN CD C -3.092 11.481 2.558 1.00 . A A . 53 GLN CD 1 1 2 1802 1 1 53 GLN CG C -4.287 11.926 3.379 1.00 . A A . 53 GLN CG 1 1 2 1803 1 1 53 GLN H H -3.276 9.723 4.838 1.00 . A A . 53 GLN H 1 1 2 1804 1 1 53 GLN HA H -3.204 12.017 6.659 1.00 . A A . 53 GLN HA 1 1 2 1805 1 1 53 GLN HB2 H -4.649 13.263 4.987 1.00 . A A . 53 GLN HB2 1 1 2 1806 1 1 53 GLN HB3 H -2.953 13.081 4.560 1.00 . A A . 53 GLN HB3 1 1 2 1807 1 1 53 GLN HE21 H -2.545 13.372 2.281 1.00 . A A . 53 GLN HE21 1 1 2 1808 1 1 53 GLN HE22 H -1.531 12.182 1.546 1.00 . A A . 53 GLN HE22 1 1 2 1809 1 1 53 GLN HG2 H -4.909 11.067 3.575 1.00 . A A . 53 GLN HG2 1 1 2 1810 1 1 53 GLN HG3 H -4.848 12.652 2.806 1.00 . A A . 53 GLN HG3 1 1 2 1811 1 1 53 GLN N N -2.879 10.427 5.393 1.00 . A A . 53 GLN N 1 1 2 1812 1 1 53 GLN NE2 N -2.310 12.442 2.080 1.00 . A A . 53 GLN NE2 1 1 2 1813 1 1 53 GLN O O -5.891 10.591 5.519 1.00 . A A . 53 GLN O 1 1 2 1814 1 1 53 GLN OE1 O -2.874 10.286 2.357 1.00 . A A . 53 GLN OE1 1 1 2 1815 1 1 54 GLU C C -7.733 11.562 7.666 1.00 . A A . 54 GLU C 1 1 2 1816 1 1 54 GLU CA C -6.567 10.733 8.204 1.00 . A A . 54 GLU CA 1 1 2 1817 1 1 54 GLU CB C -6.505 10.849 9.731 1.00 . A A . 54 GLU CB 1 1 2 1818 1 1 54 GLU CD C -7.313 9.503 11.711 1.00 . A A . 54 GLU CD 1 1 2 1819 1 1 54 GLU CG C -6.482 9.507 10.442 1.00 . A A . 54 GLU CG 1 1 2 1820 1 1 54 GLU H H -4.611 11.537 8.195 1.00 . A A . 54 GLU H 1 1 2 1821 1 1 54 GLU HA H -6.724 9.698 7.939 1.00 . A A . 54 GLU HA 1 1 2 1822 1 1 54 GLU HB2 H -5.611 11.392 10.003 1.00 . A A . 54 GLU HB2 1 1 2 1823 1 1 54 GLU HB3 H -7.368 11.400 10.076 1.00 . A A . 54 GLU HB3 1 1 2 1824 1 1 54 GLU HG2 H -6.870 8.752 9.774 1.00 . A A . 54 GLU HG2 1 1 2 1825 1 1 54 GLU HG3 H -5.459 9.267 10.698 1.00 . A A . 54 GLU HG3 1 1 2 1826 1 1 54 GLU N N -5.303 11.159 7.616 1.00 . A A . 54 GLU N 1 1 2 1827 1 1 54 GLU O O -8.894 11.183 7.819 1.00 . A A . 54 GLU O 1 1 2 1828 1 1 54 GLU OE1 O -7.594 10.599 12.239 1.00 . A A . 54 GLU OE1 1 1 2 1829 1 1 54 GLU OE2 O -7.681 8.405 12.175 1.00 . A A . 54 GLU OE2 1 1 2 1830 1 1 55 ASN C C -9.423 12.786 5.605 1.00 . A A . 55 ASN C 1 1 2 1831 1 1 55 ASN CA C -8.447 13.569 6.478 1.00 . A A . 55 ASN CA 1 1 2 1832 1 1 55 ASN CB C -7.803 14.691 5.662 1.00 . A A . 55 ASN CB 1 1 2 1833 1 1 55 ASN CG C -7.219 15.781 6.539 1.00 . A A . 55 ASN CG 1 1 2 1834 1 1 55 ASN H H -6.479 12.947 6.944 1.00 . A A . 55 ASN H 1 1 2 1835 1 1 55 ASN HA H -8.990 14.000 7.302 1.00 . A A . 55 ASN HA 1 1 2 1836 1 1 55 ASN HB2 H -7.010 14.278 5.057 1.00 . A A . 55 ASN HB2 1 1 2 1837 1 1 55 ASN HB3 H -8.550 15.132 5.019 1.00 . A A . 55 ASN HB3 1 1 2 1838 1 1 55 ASN HD21 H -6.899 16.925 4.945 1.00 . A A . 55 ASN HD21 1 1 2 1839 1 1 55 ASN HD22 H -6.423 17.602 6.461 1.00 . A A . 55 ASN HD22 1 1 2 1840 1 1 55 ASN N N -7.420 12.693 7.035 1.00 . A A . 55 ASN N 1 1 2 1841 1 1 55 ASN ND2 N -6.806 16.880 5.919 1.00 . A A . 55 ASN ND2 1 1 2 1842 1 1 55 ASN O O -10.630 12.954 5.712 1.00 . A A . 55 ASN O 1 1 2 1843 1 1 55 ASN OD1 O -7.140 15.637 7.759 1.00 . A A . 55 ASN OD1 1 1 2 1844 1 1 56 ALA C C -10.070 9.783 4.520 1.00 . A A . 56 ALA C 1 1 2 1845 1 1 56 ALA CA C -9.710 11.113 3.863 1.00 . A A . 56 ALA CA 1 1 2 1846 1 1 56 ALA CB C -8.990 10.870 2.546 1.00 . A A . 56 ALA CB 1 1 2 1847 1 1 56 ALA H H -7.910 11.832 4.712 1.00 . A A . 56 ALA H 1 1 2 1848 1 1 56 ALA HA H -10.610 11.662 3.654 1.00 . A A . 56 ALA HA 1 1 2 1849 1 1 56 ALA HB1 H -7.923 10.907 2.707 1.00 . A A . 56 ALA HB1 1 1 2 1850 1 1 56 ALA HB2 H -9.274 11.634 1.835 1.00 . A A . 56 ALA HB2 1 1 2 1851 1 1 56 ALA HB3 H -9.263 9.899 2.160 1.00 . A A . 56 ALA HB3 1 1 2 1852 1 1 56 ALA N N -8.885 11.926 4.748 1.00 . A A . 56 ALA N 1 1 2 1853 1 1 56 ALA O O -10.560 8.867 3.857 1.00 . A A . 56 ALA O 1 1 2 1854 1 1 57 TYR C C -10.890 8.790 7.859 1.00 . A A . 57 TYR C 1 1 2 1855 1 1 57 TYR CA C -10.140 8.469 6.570 1.00 . A A . 57 TYR CA 1 1 2 1856 1 1 57 TYR CB C -8.854 7.719 6.885 1.00 . A A . 57 TYR CB 1 1 2 1857 1 1 57 TYR CD1 C -8.630 6.427 4.735 1.00 . A A . 57 TYR CD1 1 1 2 1858 1 1 57 TYR CD2 C -6.814 7.819 5.400 1.00 . A A . 57 TYR CD2 1 1 2 1859 1 1 57 TYR CE1 C -7.934 6.051 3.604 1.00 . A A . 57 TYR CE1 1 1 2 1860 1 1 57 TYR CE2 C -6.110 7.448 4.270 1.00 . A A . 57 TYR CE2 1 1 2 1861 1 1 57 TYR CG C -8.083 7.314 5.652 1.00 . A A . 57 TYR CG 1 1 2 1862 1 1 57 TYR CZ C -6.674 6.564 3.375 1.00 . A A . 57 TYR CZ 1 1 2 1863 1 1 57 TYR H H -9.454 10.443 6.302 1.00 . A A . 57 TYR H 1 1 2 1864 1 1 57 TYR HA H -10.770 7.846 5.949 1.00 . A A . 57 TYR HA 1 1 2 1865 1 1 57 TYR HB2 H -8.215 8.349 7.485 1.00 . A A . 57 TYR HB2 1 1 2 1866 1 1 57 TYR HB3 H -9.092 6.822 7.439 1.00 . A A . 57 TYR HB3 1 1 2 1867 1 1 57 TYR HD1 H -9.616 6.026 4.917 1.00 . A A . 57 TYR HD1 1 1 2 1868 1 1 57 TYR HD2 H -6.372 8.511 6.104 1.00 . A A . 57 TYR HD2 1 1 2 1869 1 1 57 TYR HE1 H -8.378 5.362 2.903 1.00 . A A . 57 TYR HE1 1 1 2 1870 1 1 57 TYR HE2 H -5.123 7.851 4.091 1.00 . A A . 57 TYR HE2 1 1 2 1871 1 1 57 TYR HH H -6.547 5.680 1.667 1.00 . A A . 57 TYR HH 1 1 2 1872 1 1 57 TYR N N -9.844 9.684 5.826 1.00 . A A . 57 TYR N 1 1 2 1873 1 1 57 TYR O O -10.840 8.029 8.826 1.00 . A A . 57 TYR O 1 1 2 1874 1 1 57 TYR OH O -5.976 6.191 2.248 1.00 . A A . 57 TYR OH 1 1 2 1875 1 1 58 ARG C C -13.820 10.530 8.684 1.00 . A A . 58 ARG C 1 1 2 1876 1 1 58 ARG CA C -12.350 10.347 9.034 1.00 . A A . 58 ARG CA 1 1 2 1877 1 1 58 ARG CB C -11.770 11.651 9.593 1.00 . A A . 58 ARG CB 1 1 2 1878 1 1 58 ARG CD C -11.990 12.248 12.025 1.00 . A A . 58 ARG CD 1 1 2 1879 1 1 58 ARG CG C -11.170 11.505 10.982 1.00 . A A . 58 ARG CG 1 1 2 1880 1 1 58 ARG CZ C -12.870 11.806 14.285 1.00 . A A . 58 ARG CZ 1 1 2 1881 1 1 58 ARG H H -11.590 10.485 7.065 1.00 . A A . 58 ARG H 1 1 2 1882 1 1 58 ARG HA H -12.260 9.574 9.784 1.00 . A A . 58 ARG HA 1 1 2 1883 1 1 58 ARG HB2 H -11.000 12.004 8.926 1.00 . A A . 58 ARG HB2 1 1 2 1884 1 1 58 ARG HB3 H -12.560 12.389 9.638 1.00 . A A . 58 ARG HB3 1 1 2 1885 1 1 58 ARG HD2 H -11.580 13.237 12.152 1.00 . A A . 58 ARG HD2 1 1 2 1886 1 1 58 ARG HD3 H -13.010 12.326 11.673 1.00 . A A . 58 ARG HD3 1 1 2 1887 1 1 58 ARG HE H -11.300 10.889 13.468 1.00 . A A . 58 ARG HE 1 1 2 1888 1 1 58 ARG HG2 H -11.140 10.457 11.242 1.00 . A A . 58 ARG HG2 1 1 2 1889 1 1 58 ARG HG3 H -10.170 11.905 10.974 1.00 . A A . 58 ARG HG3 1 1 2 1890 1 1 58 ARG HH11 H -13.880 13.219 13.253 1.00 . A A . 58 ARG HH11 1 1 2 1891 1 1 58 ARG HH12 H -14.480 12.892 14.846 1.00 . A A . 58 ARG HH12 1 1 2 1892 1 1 58 ARG HH21 H -12.080 10.456 15.564 1.00 . A A . 58 ARG HH21 1 1 2 1893 1 1 58 ARG HH22 H -13.460 11.324 16.159 1.00 . A A . 58 ARG HH22 1 1 2 1894 1 1 58 ARG N N -11.590 9.921 7.864 1.00 . A A . 58 ARG N 1 1 2 1895 1 1 58 ARG NE N -11.990 11.563 13.316 1.00 . A A . 58 ARG NE 1 1 2 1896 1 1 58 ARG NH1 N -13.820 12.714 14.113 1.00 . A A . 58 ARG NH1 1 1 2 1897 1 1 58 ARG NH2 N -12.800 11.140 15.429 1.00 . A A . 58 ARG NH2 1 1 2 1898 1 1 58 ARG O O -14.710 10.121 9.437 1.00 . A A . 58 ARG O 1 1 2 1899 1 1 59 GLN C C -15.520 11.404 5.560 1.00 . A A . 59 GLN C 1 1 2 1900 1 1 59 GLN CA C -15.450 11.387 7.083 1.00 . A A . 59 GLN CA 1 1 2 1901 1 1 59 GLN CB C -15.970 12.710 7.647 1.00 . A A . 59 GLN CB 1 1 2 1902 1 1 59 GLN CD C -18.040 14.062 8.137 1.00 . A A . 59 GLN CD 1 1 2 1903 1 1 59 GLN CG C -17.440 12.676 8.015 1.00 . A A . 59 GLN CG 1 1 2 1904 1 1 59 GLN H H -13.330 11.451 6.976 1.00 . A A . 59 GLN H 1 1 2 1905 1 1 59 GLN HA H -16.060 10.581 7.455 1.00 . A A . 59 GLN HA 1 1 2 1906 1 1 59 GLN HB2 H -15.400 12.958 8.533 1.00 . A A . 59 GLN HB2 1 1 2 1907 1 1 59 GLN HB3 H -15.820 13.485 6.909 1.00 . A A . 59 GLN HB3 1 1 2 1908 1 1 59 GLN HE21 H -16.450 14.696 9.138 1.00 . A A . 59 GLN HE21 1 1 2 1909 1 1 59 GLN HE22 H -17.680 15.873 8.875 1.00 . A A . 59 GLN HE22 1 1 2 1910 1 1 59 GLN HG2 H -17.980 12.133 7.252 1.00 . A A . 59 GLN HG2 1 1 2 1911 1 1 59 GLN HG3 H -17.550 12.167 8.962 1.00 . A A . 59 GLN HG3 1 1 2 1912 1 1 59 GLN N N -14.080 11.148 7.534 1.00 . A A . 59 GLN N 1 1 2 1913 1 1 59 GLN NE2 N -17.320 14.968 8.781 1.00 . A A . 59 GLN NE2 1 1 2 1914 1 1 59 GLN O O -16.300 12.157 4.978 1.00 . A A . 59 GLN O 1 1 2 1915 1 1 59 GLN OE1 O -19.150 14.315 7.656 1.00 . A A . 59 GLN OE1 1 1 2 1916 1 1 60 ALA C C -15.090 9.104 2.982 1.00 . A A . 60 ALA C 1 1 2 1917 1 1 60 ALA CA C -14.690 10.493 3.464 1.00 . A A . 60 ALA CA 1 1 2 1918 1 1 60 ALA CB C -13.310 10.860 2.937 1.00 . A A . 60 ALA CB 1 1 2 1919 1 1 60 ALA H H -14.110 9.996 5.439 1.00 . A A . 60 ALA H 1 1 2 1920 1 1 60 ALA HA H -15.400 11.214 3.081 1.00 . A A . 60 ALA HA 1 1 2 1921 1 1 60 ALA HB1 H -12.820 11.532 3.631 1.00 . A A . 60 ALA HB1 1 1 2 1922 1 1 60 ALA HB2 H -13.410 11.346 1.978 1.00 . A A . 60 ALA HB2 1 1 2 1923 1 1 60 ALA HB3 H -12.710 9.964 2.827 1.00 . A A . 60 ALA HB3 1 1 2 1924 1 1 60 ALA N N -14.710 10.573 4.919 1.00 . A A . 60 ALA N 1 1 2 1925 1 1 60 ALA O O -14.510 8.100 3.405 1.00 . A A . 60 ALA O 1 1 2 1926 1 1 61 ALA C C -16.930 7.926 0.083 1.00 . A A . 61 ALA C 1 1 2 1927 1 1 61 ALA CA C -16.550 7.787 1.552 1.00 . A A . 61 ALA CA 1 1 2 1928 1 1 61 ALA CB C -17.740 7.282 2.362 1.00 . A A . 61 ALA CB 1 1 2 1929 1 1 61 ALA H H -16.490 9.889 1.794 1.00 . A A . 61 ALA H 1 1 2 1930 1 1 61 ALA HA H -15.750 7.065 1.641 1.00 . A A . 61 ALA HA 1 1 2 1931 1 1 61 ALA HB1 H -17.580 7.503 3.407 1.00 . A A . 61 ALA HB1 1 1 2 1932 1 1 61 ALA HB2 H -17.840 6.215 2.228 1.00 . A A . 61 ALA HB2 1 1 2 1933 1 1 61 ALA HB3 H -18.640 7.773 2.022 1.00 . A A . 61 ALA HB3 1 1 2 1934 1 1 61 ALA N N -16.070 9.054 2.094 1.00 . A A . 61 ALA N 1 1 2 1935 1 1 61 ALA O O -16.780 6.936 -0.662 1.00 . A A . 61 ALA O 1 1 2 1936 1 1 61 ALA OXT O -17.380 9.024 -0.311 1.00 . A A . 61 ALA OXT 1 1 3 1937 1 1 1 MET C C -5.304 6.783 -1.060 1.00 . A A . 1 MET C 1 1 3 1938 1 1 1 MET CA C -4.482 7.775 -0.240 1.00 . A A . 1 MET CA 1 1 3 1939 1 1 1 MET CB C -3.029 7.779 -0.721 1.00 . A A . 1 MET CB 1 1 3 1940 1 1 1 MET CE C -0.641 6.310 1.855 1.00 . A A . 1 MET CE 1 1 3 1941 1 1 1 MET CG C -2.269 6.507 -0.379 1.00 . A A . 1 MET CG 1 1 3 1942 1 1 1 MET H1 H -5.369 7.842 1.616 1.00 . A A . 1 MET H1 1 1 3 1943 1 1 1 MET H2 H -3.653 7.831 1.645 1.00 . A A . 1 MET H2 1 1 3 1944 1 1 1 MET H3 H -4.517 6.392 1.284 1.00 . A A . 1 MET H3 1 1 3 1945 1 1 1 MET HA H -4.900 8.763 -0.363 1.00 . A A . 1 MET HA 1 1 3 1946 1 1 1 MET HB2 H -3.016 7.903 -1.794 1.00 . A A . 1 MET HB2 1 1 3 1947 1 1 1 MET HB3 H -2.514 8.612 -0.266 1.00 . A A . 1 MET HB3 1 1 3 1948 1 1 1 MET HE1 H -0.259 7.101 2.484 1.00 . A A . 1 MET HE1 1 1 3 1949 1 1 1 MET HE2 H -0.039 5.424 1.987 1.00 . A A . 1 MET HE2 1 1 3 1950 1 1 1 MET HE3 H -1.663 6.095 2.126 1.00 . A A . 1 MET HE3 1 1 3 1951 1 1 1 MET HG2 H -2.786 5.999 0.421 1.00 . A A . 1 MET HG2 1 1 3 1952 1 1 1 MET HG3 H -2.248 5.871 -1.253 1.00 . A A . 1 MET HG3 1 1 3 1953 1 1 1 MET N N -4.507 7.429 1.207 1.00 . A A . 1 MET N 1 1 3 1954 1 1 1 MET O O -5.931 5.876 -0.511 1.00 . A A . 1 MET O 1 1 3 1955 1 1 1 MET SD S -0.573 6.827 0.141 1.00 . A A . 1 MET SD 1 1 3 1956 1 1 2 TYR C C -5.233 4.835 -3.605 1.00 . A A . 2 TYR C 1 1 3 1957 1 1 2 TYR CA C -6.040 6.086 -3.271 1.00 . A A . 2 TYR CA 1 1 3 1958 1 1 2 TYR CB C -6.413 6.828 -4.555 1.00 . A A . 2 TYR CB 1 1 3 1959 1 1 2 TYR CD1 C -7.881 8.700 -3.706 1.00 . A A . 2 TYR CD1 1 1 3 1960 1 1 2 TYR CD2 C -8.853 7.076 -5.156 1.00 . A A . 2 TYR CD2 1 1 3 1961 1 1 2 TYR CE1 C -9.093 9.359 -3.626 1.00 . A A . 2 TYR CE1 1 1 3 1962 1 1 2 TYR CE2 C -10.060 7.730 -5.081 1.00 . A A . 2 TYR CE2 1 1 3 1963 1 1 2 TYR CG C -7.741 7.549 -4.471 1.00 . A A . 2 TYR CG 1 1 3 1964 1 1 2 TYR CZ C -10.180 8.871 -4.315 1.00 . A A . 2 TYR CZ 1 1 3 1965 1 1 2 TYR H H -4.777 7.704 -2.755 1.00 . A A . 2 TYR H 1 1 3 1966 1 1 2 TYR HA H -6.945 5.789 -2.763 1.00 . A A . 2 TYR HA 1 1 3 1967 1 1 2 TYR HB2 H -5.652 7.561 -4.774 1.00 . A A . 2 TYR HB2 1 1 3 1968 1 1 2 TYR HB3 H -6.469 6.120 -5.369 1.00 . A A . 2 TYR HB3 1 1 3 1969 1 1 2 TYR HD1 H -7.026 9.080 -3.167 1.00 . A A . 2 TYR HD1 1 1 3 1970 1 1 2 TYR HD2 H -8.760 6.183 -5.755 1.00 . A A . 2 TYR HD2 1 1 3 1971 1 1 2 TYR HE1 H -9.182 10.253 -3.024 1.00 . A A . 2 TYR HE1 1 1 3 1972 1 1 2 TYR HE2 H -10.920 7.348 -5.621 1.00 . A A . 2 TYR HE2 1 1 3 1973 1 1 2 TYR HH H -11.360 10.318 -4.778 1.00 . A A . 2 TYR HH 1 1 3 1974 1 1 2 TYR N N -5.295 6.963 -2.377 1.00 . A A . 2 TYR N 1 1 3 1975 1 1 2 TYR O O -4.018 4.900 -3.794 1.00 . A A . 2 TYR O 1 1 3 1976 1 1 2 TYR OH O -11.390 9.525 -4.237 1.00 . A A . 2 TYR OH 1 1 3 1977 1 1 3 LYS C C -4.506 2.505 -5.304 1.00 . A A . 3 LYS C 1 1 3 1978 1 1 3 LYS CA C -5.266 2.428 -3.982 1.00 . A A . 3 LYS CA 1 1 3 1979 1 1 3 LYS CB C -6.301 1.301 -4.040 1.00 . A A . 3 LYS CB 1 1 3 1980 1 1 3 LYS CD C -5.539 -0.886 -5.018 1.00 . A A . 3 LYS CD 1 1 3 1981 1 1 3 LYS CE C -6.694 -1.850 -5.233 1.00 . A A . 3 LYS CE 1 1 3 1982 1 1 3 LYS CG C -5.722 -0.072 -3.746 1.00 . A A . 3 LYS CG 1 1 3 1983 1 1 3 LYS H H -6.883 3.711 -3.511 1.00 . A A . 3 LYS H 1 1 3 1984 1 1 3 LYS HA H -4.563 2.216 -3.191 1.00 . A A . 3 LYS HA 1 1 3 1985 1 1 3 LYS HB2 H -7.077 1.504 -3.316 1.00 . A A . 3 LYS HB2 1 1 3 1986 1 1 3 LYS HB3 H -6.739 1.282 -5.028 1.00 . A A . 3 LYS HB3 1 1 3 1987 1 1 3 LYS HD2 H -5.484 -0.213 -5.861 1.00 . A A . 3 LYS HD2 1 1 3 1988 1 1 3 LYS HD3 H -4.621 -1.450 -4.944 1.00 . A A . 3 LYS HD3 1 1 3 1989 1 1 3 LYS HE2 H -6.626 -2.259 -6.230 1.00 . A A . 3 LYS HE2 1 1 3 1990 1 1 3 LYS HE3 H -6.619 -2.651 -4.512 1.00 . A A . 3 LYS HE3 1 1 3 1991 1 1 3 LYS HG2 H -4.762 0.047 -3.268 1.00 . A A . 3 LYS HG2 1 1 3 1992 1 1 3 LYS HG3 H -6.394 -0.601 -3.084 1.00 . A A . 3 LYS HG3 1 1 3 1993 1 1 3 LYS HZ1 H -8.114 -0.417 -5.775 1.00 . A A . 3 LYS HZ1 1 1 3 1994 1 1 3 LYS HZ2 H -8.097 -0.773 -4.122 1.00 . A A . 3 LYS HZ2 1 1 3 1995 1 1 3 LYS HZ3 H -8.785 -1.865 -5.215 1.00 . A A . 3 LYS HZ3 1 1 3 1996 1 1 3 LYS N N -5.917 3.697 -3.674 1.00 . A A . 3 LYS N 1 1 3 1997 1 1 3 LYS NZ N -8.015 -1.179 -5.076 1.00 . A A . 3 LYS NZ 1 1 3 1998 1 1 3 LYS O O -3.509 1.811 -5.499 1.00 . A A . 3 LYS O 1 1 3 1999 1 1 4 LYS C C -2.899 3.961 -7.365 1.00 . A A . 4 LYS C 1 1 3 2000 1 1 4 LYS CA C -4.352 3.518 -7.512 1.00 . A A . 4 LYS CA 1 1 3 2001 1 1 4 LYS CB C -5.124 4.538 -8.351 1.00 . A A . 4 LYS CB 1 1 3 2002 1 1 4 LYS CD C -3.810 5.924 -9.987 1.00 . A A . 4 LYS CD 1 1 3 2003 1 1 4 LYS CE C -4.139 6.589 -11.315 1.00 . A A . 4 LYS CE 1 1 3 2004 1 1 4 LYS CG C -4.622 4.656 -9.782 1.00 . A A . 4 LYS CG 1 1 3 2005 1 1 4 LYS H H -5.787 3.876 -5.998 1.00 . A A . 4 LYS H 1 1 3 2006 1 1 4 LYS HA H -4.376 2.563 -8.016 1.00 . A A . 4 LYS HA 1 1 3 2007 1 1 4 LYS HB2 H -6.165 4.250 -8.381 1.00 . A A . 4 LYS HB2 1 1 3 2008 1 1 4 LYS HB3 H -5.043 5.508 -7.882 1.00 . A A . 4 LYS HB3 1 1 3 2009 1 1 4 LYS HD2 H -4.028 6.616 -9.187 1.00 . A A . 4 LYS HD2 1 1 3 2010 1 1 4 LYS HD3 H -2.758 5.674 -9.972 1.00 . A A . 4 LYS HD3 1 1 3 2011 1 1 4 LYS HE2 H -5.208 6.726 -11.378 1.00 . A A . 4 LYS HE2 1 1 3 2012 1 1 4 LYS HE3 H -3.649 7.550 -11.353 1.00 . A A . 4 LYS HE3 1 1 3 2013 1 1 4 LYS HG2 H -4.000 3.803 -10.005 1.00 . A A . 4 LYS HG2 1 1 3 2014 1 1 4 LYS HG3 H -5.471 4.669 -10.450 1.00 . A A . 4 LYS HG3 1 1 3 2015 1 1 4 LYS HZ1 H -2.746 6.081 -12.786 1.00 . A A . 4 LYS HZ1 1 1 3 2016 1 1 4 LYS HZ2 H -4.355 5.869 -13.264 1.00 . A A . 4 LYS HZ2 1 1 3 2017 1 1 4 LYS HZ3 H -3.638 4.766 -12.203 1.00 . A A . 4 LYS HZ3 1 1 3 2018 1 1 4 LYS N N -4.987 3.351 -6.209 1.00 . A A . 4 LYS N 1 1 3 2019 1 1 4 LYS NZ N -3.688 5.769 -12.472 1.00 . A A . 4 LYS NZ 1 1 3 2020 1 1 4 LYS O O -2.069 3.696 -8.234 1.00 . A A . 4 LYS O 1 1 3 2021 1 1 5 ASP C C -0.384 4.018 -5.382 1.00 . A A . 5 ASP C 1 1 3 2022 1 1 5 ASP CA C -1.244 5.115 -6.003 1.00 . A A . 5 ASP CA 1 1 3 2023 1 1 5 ASP CB C -1.278 6.336 -5.082 1.00 . A A . 5 ASP CB 1 1 3 2024 1 1 5 ASP CG C 0.011 7.132 -5.131 1.00 . A A . 5 ASP CG 1 1 3 2025 1 1 5 ASP H H -3.301 4.818 -5.602 1.00 . A A . 5 ASP H 1 1 3 2026 1 1 5 ASP HA H -0.810 5.402 -6.949 1.00 . A A . 5 ASP HA 1 1 3 2027 1 1 5 ASP HB2 H -2.090 6.981 -5.380 1.00 . A A . 5 ASP HB2 1 1 3 2028 1 1 5 ASP HB3 H -1.439 6.007 -4.065 1.00 . A A . 5 ASP HB3 1 1 3 2029 1 1 5 ASP N N -2.597 4.636 -6.259 1.00 . A A . 5 ASP N 1 1 3 2030 1 1 5 ASP O O 0.752 3.795 -5.801 1.00 . A A . 5 ASP O 1 1 3 2031 1 1 5 ASP OD1 O 1.088 6.532 -4.936 1.00 . A A . 5 ASP OD1 1 1 3 2032 1 1 5 ASP OD2 O -0.057 8.357 -5.365 1.00 . A A . 5 ASP OD2 1 1 3 2033 1 1 6 VAL C C 0.295 1.228 -4.682 1.00 . A A . 6 VAL C 1 1 3 2034 1 1 6 VAL CA C -0.223 2.272 -3.696 1.00 . A A . 6 VAL CA 1 1 3 2035 1 1 6 VAL CB C -1.129 1.581 -2.661 1.00 . A A . 6 VAL CB 1 1 3 2036 1 1 6 VAL CG1 C -0.292 0.777 -1.696 1.00 . A A . 6 VAL CG1 1 1 3 2037 1 1 6 VAL CG2 C -1.979 2.596 -1.909 1.00 . A A . 6 VAL CG2 1 1 3 2038 1 1 6 VAL H H -1.833 3.561 -4.085 1.00 . A A . 6 VAL H 1 1 3 2039 1 1 6 VAL HA H 0.617 2.707 -3.174 1.00 . A A . 6 VAL HA 1 1 3 2040 1 1 6 VAL HB H -1.789 0.904 -3.184 1.00 . A A . 6 VAL HB 1 1 3 2041 1 1 6 VAL HG11 H 0.088 -0.099 -2.193 1.00 . A A . 6 VAL HG11 1 1 3 2042 1 1 6 VAL HG12 H -0.897 0.484 -0.853 1.00 . A A . 6 VAL HG12 1 1 3 2043 1 1 6 VAL HG13 H 0.532 1.385 -1.354 1.00 . A A . 6 VAL HG13 1 1 3 2044 1 1 6 VAL HG21 H -1.385 3.472 -1.692 1.00 . A A . 6 VAL HG21 1 1 3 2045 1 1 6 VAL HG22 H -2.328 2.160 -0.984 1.00 . A A . 6 VAL HG22 1 1 3 2046 1 1 6 VAL HG23 H -2.826 2.878 -2.517 1.00 . A A . 6 VAL HG23 1 1 3 2047 1 1 6 VAL N N -0.931 3.339 -4.378 1.00 . A A . 6 VAL N 1 1 3 2048 1 1 6 VAL O O 1.487 0.926 -4.712 1.00 . A A . 6 VAL O 1 1 3 2049 1 1 7 ILE C C 0.841 0.184 -7.412 1.00 . A A . 7 ILE C 1 1 3 2050 1 1 7 ILE CA C -0.248 -0.331 -6.472 1.00 . A A . 7 ILE CA 1 1 3 2051 1 1 7 ILE CB C -1.476 -0.775 -7.296 1.00 . A A . 7 ILE CB 1 1 3 2052 1 1 7 ILE CD1 C -3.653 -2.097 -7.154 1.00 . A A . 7 ILE CD1 1 1 3 2053 1 1 7 ILE CG1 C -2.453 -1.551 -6.409 1.00 . A A . 7 ILE CG1 1 1 3 2054 1 1 7 ILE CG2 C -1.049 -1.620 -8.490 1.00 . A A . 7 ILE CG2 1 1 3 2055 1 1 7 ILE H H -1.547 0.961 -5.412 1.00 . A A . 7 ILE H 1 1 3 2056 1 1 7 ILE HA H 0.132 -1.192 -5.939 1.00 . A A . 7 ILE HA 1 1 3 2057 1 1 7 ILE HB H -1.967 0.110 -7.672 1.00 . A A . 7 ILE HB 1 1 3 2058 1 1 7 ILE HD11 H -4.142 -2.846 -6.549 1.00 . A A . 7 ILE HD11 1 1 3 2059 1 1 7 ILE HD12 H -3.328 -2.541 -8.083 1.00 . A A . 7 ILE HD12 1 1 3 2060 1 1 7 ILE HD13 H -4.344 -1.293 -7.361 1.00 . A A . 7 ILE HD13 1 1 3 2061 1 1 7 ILE HG12 H -1.935 -2.385 -5.960 1.00 . A A . 7 ILE HG12 1 1 3 2062 1 1 7 ILE HG13 H -2.816 -0.897 -5.629 1.00 . A A . 7 ILE HG13 1 1 3 2063 1 1 7 ILE HG21 H -1.926 -1.979 -9.009 1.00 . A A . 7 ILE HG21 1 1 3 2064 1 1 7 ILE HG22 H -0.465 -2.460 -8.145 1.00 . A A . 7 ILE HG22 1 1 3 2065 1 1 7 ILE HG23 H -0.454 -1.017 -9.161 1.00 . A A . 7 ILE HG23 1 1 3 2066 1 1 7 ILE N N -0.611 0.680 -5.485 1.00 . A A . 7 ILE N 1 1 3 2067 1 1 7 ILE O O 1.625 -0.595 -7.954 1.00 . A A . 7 ILE O 1 1 3 2068 1 1 8 ASP C C 3.227 2.199 -7.756 1.00 . A A . 8 ASP C 1 1 3 2069 1 1 8 ASP CA C 1.882 2.112 -8.466 1.00 . A A . 8 ASP CA 1 1 3 2070 1 1 8 ASP CB C 1.423 3.506 -8.900 1.00 . A A . 8 ASP CB 1 1 3 2071 1 1 8 ASP CG C 1.497 3.698 -10.401 1.00 . A A . 8 ASP CG 1 1 3 2072 1 1 8 ASP H H 0.241 2.069 -7.136 1.00 . A A . 8 ASP H 1 1 3 2073 1 1 8 ASP HA H 1.989 1.489 -9.341 1.00 . A A . 8 ASP HA 1 1 3 2074 1 1 8 ASP HB2 H 0.400 3.657 -8.587 1.00 . A A . 8 ASP HB2 1 1 3 2075 1 1 8 ASP HB3 H 2.051 4.249 -8.429 1.00 . A A . 8 ASP HB3 1 1 3 2076 1 1 8 ASP N N 0.886 1.498 -7.598 1.00 . A A . 8 ASP N 1 1 3 2077 1 1 8 ASP O O 4.281 2.178 -8.390 1.00 . A A . 8 ASP O 1 1 3 2078 1 1 8 ASP OD1 O 0.880 2.895 -11.132 1.00 . A A . 8 ASP OD1 1 1 3 2079 1 1 8 ASP OD2 O 2.171 4.650 -10.847 1.00 . A A . 8 ASP OD2 1 1 3 2080 1 1 9 HIS C C 4.930 0.986 -5.318 1.00 . A A . 9 HIS C 1 1 3 2081 1 1 9 HIS CA C 4.388 2.380 -5.627 1.00 . A A . 9 HIS CA 1 1 3 2082 1 1 9 HIS CB C 4.106 3.142 -4.327 1.00 . A A . 9 HIS CB 1 1 3 2083 1 1 9 HIS CD2 C 5.620 1.988 -2.563 1.00 . A A . 9 HIS CD2 1 1 3 2084 1 1 9 HIS CE1 C 6.875 3.707 -2.039 1.00 . A A . 9 HIS CE1 1 1 3 2085 1 1 9 HIS CG C 5.201 3.038 -3.309 1.00 . A A . 9 HIS CG 1 1 3 2086 1 1 9 HIS H H 2.308 2.304 -5.982 1.00 . A A . 9 HIS H 1 1 3 2087 1 1 9 HIS HA H 5.124 2.921 -6.200 1.00 . A A . 9 HIS HA 1 1 3 2088 1 1 9 HIS HB2 H 3.968 4.188 -4.556 1.00 . A A . 9 HIS HB2 1 1 3 2089 1 1 9 HIS HB3 H 3.202 2.754 -3.882 1.00 . A A . 9 HIS HB3 1 1 3 2090 1 1 9 HIS HD1 H 5.953 5.007 -3.324 1.00 . A A . 9 HIS HD1 1 1 3 2091 1 1 9 HIS HD2 H 5.210 0.987 -2.578 1.00 . A A . 9 HIS HD2 1 1 3 2092 1 1 9 HIS HE1 H 7.628 4.326 -1.575 1.00 . A A . 9 HIS HE1 1 1 3 2093 1 1 9 HIS HE2 H 7.222 1.867 -1.211 1.00 . A A . 9 HIS HE2 1 1 3 2094 1 1 9 HIS N N 3.179 2.294 -6.430 1.00 . A A . 9 HIS N 1 1 3 2095 1 1 9 HIS ND1 N 6.008 4.100 -2.956 1.00 . A A . 9 HIS ND1 1 1 3 2096 1 1 9 HIS NE2 N 6.660 2.430 -1.783 1.00 . A A . 9 HIS NE2 1 1 3 2097 1 1 9 HIS O O 6.136 0.798 -5.157 1.00 . A A . 9 HIS O 1 1 3 2098 1 1 10 PHE C C 4.552 -2.178 -6.220 1.00 . A A . 10 PHE C 1 1 3 2099 1 1 10 PHE CA C 4.409 -1.362 -4.939 1.00 . A A . 10 PHE CA 1 1 3 2100 1 1 10 PHE CB C 3.369 -2.010 -4.026 1.00 . A A . 10 PHE CB 1 1 3 2101 1 1 10 PHE CD1 C 4.367 -2.223 -1.738 1.00 . A A . 10 PHE CD1 1 1 3 2102 1 1 10 PHE CD2 C 2.723 -0.536 -2.103 1.00 . A A . 10 PHE CD2 1 1 3 2103 1 1 10 PHE CE1 C 4.483 -1.830 -0.418 1.00 . A A . 10 PHE CE1 1 1 3 2104 1 1 10 PHE CE2 C 2.832 -0.138 -0.785 1.00 . A A . 10 PHE CE2 1 1 3 2105 1 1 10 PHE CG C 3.488 -1.582 -2.594 1.00 . A A . 10 PHE CG 1 1 3 2106 1 1 10 PHE CZ C 3.715 -0.785 0.059 1.00 . A A . 10 PHE CZ 1 1 3 2107 1 1 10 PHE H H 3.081 0.227 -5.368 1.00 . A A . 10 PHE H 1 1 3 2108 1 1 10 PHE HA H 5.359 -1.343 -4.427 1.00 . A A . 10 PHE HA 1 1 3 2109 1 1 10 PHE HB2 H 2.381 -1.747 -4.371 1.00 . A A . 10 PHE HB2 1 1 3 2110 1 1 10 PHE HB3 H 3.484 -3.082 -4.064 1.00 . A A . 10 PHE HB3 1 1 3 2111 1 1 10 PHE HD1 H 4.968 -3.039 -2.112 1.00 . A A . 10 PHE HD1 1 1 3 2112 1 1 10 PHE HD2 H 2.035 -0.029 -2.763 1.00 . A A . 10 PHE HD2 1 1 3 2113 1 1 10 PHE HE1 H 5.172 -2.338 0.240 1.00 . A A . 10 PHE HE1 1 1 3 2114 1 1 10 PHE HE2 H 2.231 0.678 -0.415 1.00 . A A . 10 PHE HE2 1 1 3 2115 1 1 10 PHE HZ H 3.802 -0.476 1.090 1.00 . A A . 10 PHE HZ 1 1 3 2116 1 1 10 PHE N N 4.027 0.014 -5.233 1.00 . A A . 10 PHE N 1 1 3 2117 1 1 10 PHE O O 5.321 -3.138 -6.272 1.00 . A A . 10 PHE O 1 1 3 2118 1 1 11 GLY C C 2.874 -3.660 -8.560 1.00 . A A . 11 GLY C 1 1 3 2119 1 1 11 GLY CA C 3.859 -2.508 -8.512 1.00 . A A . 11 GLY CA 1 1 3 2120 1 1 11 GLY H H 3.205 -1.026 -7.149 1.00 . A A . 11 GLY H 1 1 3 2121 1 1 11 GLY HA2 H 3.633 -1.820 -9.313 1.00 . A A . 11 GLY HA2 1 1 3 2122 1 1 11 GLY HA3 H 4.857 -2.897 -8.652 1.00 . A A . 11 GLY HA3 1 1 3 2123 1 1 11 GLY N N 3.803 -1.796 -7.249 1.00 . A A . 11 GLY N 1 1 3 2124 1 1 11 GLY O O 2.074 -3.765 -9.491 1.00 . A A . 11 GLY O 1 1 3 2125 1 1 12 THR C C 1.436 -5.779 -6.066 1.00 . A A . 12 THR C 1 1 3 2126 1 1 12 THR CA C 2.032 -5.666 -7.465 1.00 . A A . 12 THR CA 1 1 3 2127 1 1 12 THR CB C 2.780 -6.953 -7.821 1.00 . A A . 12 THR CB 1 1 3 2128 1 1 12 THR CG2 C 2.995 -7.129 -9.309 1.00 . A A . 12 THR CG2 1 1 3 2129 1 1 12 THR H H 3.585 -4.375 -6.835 1.00 . A A . 12 THR H 1 1 3 2130 1 1 12 THR HA H 1.233 -5.516 -8.175 1.00 . A A . 12 THR HA 1 1 3 2131 1 1 12 THR HB H 2.207 -7.798 -7.467 1.00 . A A . 12 THR HB 1 1 3 2132 1 1 12 THR HG1 H 3.942 -6.924 -6.244 1.00 . A A . 12 THR HG1 1 1 3 2133 1 1 12 THR HG21 H 4.023 -7.405 -9.494 1.00 . A A . 12 THR HG21 1 1 3 2134 1 1 12 THR HG22 H 2.775 -6.201 -9.816 1.00 . A A . 12 THR HG22 1 1 3 2135 1 1 12 THR HG23 H 2.341 -7.906 -9.676 1.00 . A A . 12 THR HG23 1 1 3 2136 1 1 12 THR N N 2.928 -4.519 -7.548 1.00 . A A . 12 THR N 1 1 3 2137 1 1 12 THR O O 2.117 -5.535 -5.071 1.00 . A A . 12 THR O 1 1 3 2138 1 1 12 THR OG1 O 4.051 -6.983 -7.196 1.00 . A A . 12 THR OG1 1 1 3 2139 1 1 13 GLN C C 0.278 -7.153 -3.750 1.00 . A A . 13 GLN C 1 1 3 2140 1 1 13 GLN CA C -0.528 -6.286 -4.717 1.00 . A A . 13 GLN CA 1 1 3 2141 1 1 13 GLN CB C -1.921 -6.888 -4.921 1.00 . A A . 13 GLN CB 1 1 3 2142 1 1 13 GLN CD C -2.937 -7.791 -7.054 1.00 . A A . 13 GLN CD 1 1 3 2143 1 1 13 GLN CG C -1.953 -8.031 -5.926 1.00 . A A . 13 GLN CG 1 1 3 2144 1 1 13 GLN H H -0.331 -6.325 -6.825 1.00 . A A . 13 GLN H 1 1 3 2145 1 1 13 GLN HA H -0.633 -5.300 -4.290 1.00 . A A . 13 GLN HA 1 1 3 2146 1 1 13 GLN HB2 H -2.281 -7.260 -3.974 1.00 . A A . 13 GLN HB2 1 1 3 2147 1 1 13 GLN HB3 H -2.586 -6.112 -5.270 1.00 . A A . 13 GLN HB3 1 1 3 2148 1 1 13 GLN HE21 H -4.339 -7.253 -5.750 1.00 . A A . 13 GLN HE21 1 1 3 2149 1 1 13 GLN HE22 H -4.805 -7.214 -7.413 1.00 . A A . 13 GLN HE22 1 1 3 2150 1 1 13 GLN HG2 H -0.967 -8.151 -6.349 1.00 . A A . 13 GLN HG2 1 1 3 2151 1 1 13 GLN HG3 H -2.233 -8.938 -5.410 1.00 . A A . 13 GLN HG3 1 1 3 2152 1 1 13 GLN N N 0.161 -6.146 -5.996 1.00 . A A . 13 GLN N 1 1 3 2153 1 1 13 GLN NE2 N -4.149 -7.378 -6.703 1.00 . A A . 13 GLN NE2 1 1 3 2154 1 1 13 GLN O O 0.463 -6.794 -2.585 1.00 . A A . 13 GLN O 1 1 3 2155 1 1 13 GLN OE1 O -2.610 -7.973 -8.226 1.00 . A A . 13 GLN OE1 1 1 3 2156 1 1 14 ARG C C 2.630 -8.478 -2.646 1.00 . A A . 14 ARG C 1 1 3 2157 1 1 14 ARG CA C 1.543 -9.215 -3.424 1.00 . A A . 14 ARG CA 1 1 3 2158 1 1 14 ARG CB C 2.175 -10.293 -4.305 1.00 . A A . 14 ARG CB 1 1 3 2159 1 1 14 ARG CD C 2.542 -12.760 -4.621 1.00 . A A . 14 ARG CD 1 1 3 2160 1 1 14 ARG CG C 2.306 -11.643 -3.616 1.00 . A A . 14 ARG CG 1 1 3 2161 1 1 14 ARG CZ C 4.582 -13.897 -3.838 1.00 . A A . 14 ARG CZ 1 1 3 2162 1 1 14 ARG H H 0.577 -8.522 -5.175 1.00 . A A . 14 ARG H 1 1 3 2163 1 1 14 ARG HA H 0.872 -9.687 -2.720 1.00 . A A . 14 ARG HA 1 1 3 2164 1 1 14 ARG HB2 H 1.568 -10.422 -5.189 1.00 . A A . 14 ARG HB2 1 1 3 2165 1 1 14 ARG HB3 H 3.160 -9.967 -4.601 1.00 . A A . 14 ARG HB3 1 1 3 2166 1 1 14 ARG HD2 H 1.979 -13.627 -4.312 1.00 . A A . 14 ARG HD2 1 1 3 2167 1 1 14 ARG HD3 H 2.195 -12.434 -5.591 1.00 . A A . 14 ARG HD3 1 1 3 2168 1 1 14 ARG HE H 4.460 -12.766 -5.477 1.00 . A A . 14 ARG HE 1 1 3 2169 1 1 14 ARG HG2 H 3.139 -11.607 -2.931 1.00 . A A . 14 ARG HG2 1 1 3 2170 1 1 14 ARG HG3 H 1.396 -11.846 -3.070 1.00 . A A . 14 ARG HG3 1 1 3 2171 1 1 14 ARG HH11 H 2.960 -14.187 -2.665 1.00 . A A . 14 ARG HH11 1 1 3 2172 1 1 14 ARG HH12 H 4.408 -14.978 -2.138 1.00 . A A . 14 ARG HH12 1 1 3 2173 1 1 14 ARG HH21 H 6.364 -13.807 -4.786 1.00 . A A . 14 ARG HH21 1 1 3 2174 1 1 14 ARG HH22 H 6.340 -14.762 -3.342 1.00 . A A . 14 ARG HH22 1 1 3 2175 1 1 14 ARG N N 0.756 -8.293 -4.240 1.00 . A A . 14 ARG N 1 1 3 2176 1 1 14 ARG NE N 3.953 -13.121 -4.717 1.00 . A A . 14 ARG NE 1 1 3 2177 1 1 14 ARG NH1 N 3.929 -14.395 -2.795 1.00 . A A . 14 ARG NH1 1 1 3 2178 1 1 14 ARG NH2 N 5.867 -14.178 -4.002 1.00 . A A . 14 ARG NH2 1 1 3 2179 1 1 14 ARG O O 2.980 -8.865 -1.532 1.00 . A A . 14 ARG O 1 1 3 2180 1 1 15 ALA C C 3.680 -5.934 -1.348 1.00 . A A . 15 ALA C 1 1 3 2181 1 1 15 ALA CA C 4.205 -6.626 -2.601 1.00 . A A . 15 ALA CA 1 1 3 2182 1 1 15 ALA CB C 4.767 -5.603 -3.580 1.00 . A A . 15 ALA CB 1 1 3 2183 1 1 15 ALA H H 2.840 -7.154 -4.130 1.00 . A A . 15 ALA H 1 1 3 2184 1 1 15 ALA HA H 5.005 -7.297 -2.322 1.00 . A A . 15 ALA HA 1 1 3 2185 1 1 15 ALA HB1 H 4.479 -4.610 -3.269 1.00 . A A . 15 ALA HB1 1 1 3 2186 1 1 15 ALA HB2 H 4.376 -5.798 -4.568 1.00 . A A . 15 ALA HB2 1 1 3 2187 1 1 15 ALA HB3 H 5.843 -5.678 -3.598 1.00 . A A . 15 ALA HB3 1 1 3 2188 1 1 15 ALA N N 3.159 -7.415 -3.241 1.00 . A A . 15 ALA N 1 1 3 2189 1 1 15 ALA O O 4.279 -6.030 -0.277 1.00 . A A . 15 ALA O 1 1 3 2190 1 1 16 VAL C C 1.591 -5.493 0.755 1.00 . A A . 16 VAL C 1 1 3 2191 1 1 16 VAL CA C 1.950 -4.528 -0.370 1.00 . A A . 16 VAL CA 1 1 3 2192 1 1 16 VAL CB C 0.680 -3.753 -0.789 1.00 . A A . 16 VAL CB 1 1 3 2193 1 1 16 VAL CG1 C 0.591 -2.451 -0.019 1.00 . A A . 16 VAL CG1 1 1 3 2194 1 1 16 VAL CG2 C 0.655 -3.482 -2.288 1.00 . A A . 16 VAL CG2 1 1 3 2195 1 1 16 VAL H H 2.128 -5.198 -2.365 1.00 . A A . 16 VAL H 1 1 3 2196 1 1 16 VAL HA H 2.674 -3.816 0.001 1.00 . A A . 16 VAL HA 1 1 3 2197 1 1 16 VAL HB H -0.184 -4.352 -0.537 1.00 . A A . 16 VAL HB 1 1 3 2198 1 1 16 VAL HG11 H 0.087 -2.621 0.920 1.00 . A A . 16 VAL HG11 1 1 3 2199 1 1 16 VAL HG12 H 0.038 -1.729 -0.600 1.00 . A A . 16 VAL HG12 1 1 3 2200 1 1 16 VAL HG13 H 1.586 -2.080 0.165 1.00 . A A . 16 VAL HG13 1 1 3 2201 1 1 16 VAL HG21 H 1.656 -3.272 -2.633 1.00 . A A . 16 VAL HG21 1 1 3 2202 1 1 16 VAL HG22 H 0.018 -2.633 -2.489 1.00 . A A . 16 VAL HG22 1 1 3 2203 1 1 16 VAL HG23 H 0.270 -4.349 -2.804 1.00 . A A . 16 VAL HG23 1 1 3 2204 1 1 16 VAL N N 2.558 -5.237 -1.489 1.00 . A A . 16 VAL N 1 1 3 2205 1 1 16 VAL O O 1.797 -5.197 1.931 1.00 . A A . 16 VAL O 1 1 3 2206 1 1 17 ALA C C 1.846 -8.081 2.221 1.00 . A A . 17 ALA C 1 1 3 2207 1 1 17 ALA CA C 0.659 -7.661 1.361 1.00 . A A . 17 ALA CA 1 1 3 2208 1 1 17 ALA CB C 0.060 -8.868 0.658 1.00 . A A . 17 ALA CB 1 1 3 2209 1 1 17 ALA H H 0.910 -6.829 -0.568 1.00 . A A . 17 ALA H 1 1 3 2210 1 1 17 ALA HA H -0.099 -7.232 1.999 1.00 . A A . 17 ALA HA 1 1 3 2211 1 1 17 ALA HB1 H 0.264 -9.759 1.234 1.00 . A A . 17 ALA HB1 1 1 3 2212 1 1 17 ALA HB2 H 0.497 -8.967 -0.324 1.00 . A A . 17 ALA HB2 1 1 3 2213 1 1 17 ALA HB3 H -1.008 -8.738 0.564 1.00 . A A . 17 ALA HB3 1 1 3 2214 1 1 17 ALA N N 1.050 -6.650 0.383 1.00 . A A . 17 ALA N 1 1 3 2215 1 1 17 ALA O O 1.688 -8.403 3.400 1.00 . A A . 17 ALA O 1 1 3 2216 1 1 18 LYS C C 4.742 -7.319 3.221 1.00 . A A . 18 LYS C 1 1 3 2217 1 1 18 LYS CA C 4.247 -8.460 2.338 1.00 . A A . 18 LYS CA 1 1 3 2218 1 1 18 LYS CB C 5.341 -8.864 1.347 1.00 . A A . 18 LYS CB 1 1 3 2219 1 1 18 LYS CD C 7.512 -10.076 0.986 1.00 . A A . 18 LYS CD 1 1 3 2220 1 1 18 LYS CE C 7.135 -10.762 -0.316 1.00 . A A . 18 LYS CE 1 1 3 2221 1 1 18 LYS CG C 6.305 -9.903 1.895 1.00 . A A . 18 LYS CG 1 1 3 2222 1 1 18 LYS H H 3.096 -7.813 0.684 1.00 . A A . 18 LYS H 1 1 3 2223 1 1 18 LYS HA H 4.012 -9.308 2.964 1.00 . A A . 18 LYS HA 1 1 3 2224 1 1 18 LYS HB2 H 4.874 -9.268 0.460 1.00 . A A . 18 LYS HB2 1 1 3 2225 1 1 18 LYS HB3 H 5.907 -7.986 1.076 1.00 . A A . 18 LYS HB3 1 1 3 2226 1 1 18 LYS HD2 H 7.925 -9.105 0.763 1.00 . A A . 18 LYS HD2 1 1 3 2227 1 1 18 LYS HD3 H 8.251 -10.675 1.498 1.00 . A A . 18 LYS HD3 1 1 3 2228 1 1 18 LYS HE2 H 6.201 -10.352 -0.669 1.00 . A A . 18 LYS HE2 1 1 3 2229 1 1 18 LYS HE3 H 7.909 -10.572 -1.046 1.00 . A A . 18 LYS HE3 1 1 3 2230 1 1 18 LYS HG2 H 6.643 -9.587 2.870 1.00 . A A . 18 LYS HG2 1 1 3 2231 1 1 18 LYS HG3 H 5.790 -10.849 1.979 1.00 . A A . 18 LYS HG3 1 1 3 2232 1 1 18 LYS HZ1 H 6.307 -12.606 -0.843 1.00 . A A . 18 LYS HZ1 1 1 3 2233 1 1 18 LYS HZ2 H 6.631 -12.448 0.810 1.00 . A A . 18 LYS HZ2 1 1 3 2234 1 1 18 LYS HZ3 H 7.899 -12.707 -0.278 1.00 . A A . 18 LYS HZ3 1 1 3 2235 1 1 18 LYS N N 3.033 -8.078 1.625 1.00 . A A . 18 LYS N 1 1 3 2236 1 1 18 LYS NZ N 6.983 -12.234 -0.146 1.00 . A A . 18 LYS NZ 1 1 3 2237 1 1 18 LYS O O 5.351 -7.549 4.267 1.00 . A A . 18 LYS O 1 1 3 2238 1 1 19 ALA C C 4.022 -4.712 4.781 1.00 . A A . 19 ALA C 1 1 3 2239 1 1 19 ALA CA C 4.893 -4.912 3.546 1.00 . A A . 19 ALA CA 1 1 3 2240 1 1 19 ALA CB C 4.852 -3.676 2.657 1.00 . A A . 19 ALA CB 1 1 3 2241 1 1 19 ALA H H 3.987 -5.970 1.953 1.00 . A A . 19 ALA H 1 1 3 2242 1 1 19 ALA HA H 5.916 -5.064 3.861 1.00 . A A . 19 ALA HA 1 1 3 2243 1 1 19 ALA HB1 H 4.126 -2.977 3.045 1.00 . A A . 19 ALA HB1 1 1 3 2244 1 1 19 ALA HB2 H 4.573 -3.964 1.654 1.00 . A A . 19 ALA HB2 1 1 3 2245 1 1 19 ALA HB3 H 5.826 -3.212 2.641 1.00 . A A . 19 ALA HB3 1 1 3 2246 1 1 19 ALA N N 4.476 -6.089 2.795 1.00 . A A . 19 ALA N 1 1 3 2247 1 1 19 ALA O O 4.528 -4.498 5.883 1.00 . A A . 19 ALA O 1 1 3 2248 1 1 20 LEU C C 1.638 -5.890 6.506 1.00 . A A . 20 LEU C 1 1 3 2249 1 1 20 LEU CA C 1.765 -4.607 5.689 1.00 . A A . 20 LEU CA 1 1 3 2250 1 1 20 LEU CB C 0.394 -4.193 5.152 1.00 . A A . 20 LEU CB 1 1 3 2251 1 1 20 LEU CD1 C -0.822 -3.150 3.225 1.00 . A A . 20 LEU CD1 1 1 3 2252 1 1 20 LEU CD2 C 0.531 -1.721 4.768 1.00 . A A . 20 LEU CD2 1 1 3 2253 1 1 20 LEU CG C 0.419 -3.083 4.101 1.00 . A A . 20 LEU CG 1 1 3 2254 1 1 20 LEU H H 2.365 -4.955 3.688 1.00 . A A . 20 LEU H 1 1 3 2255 1 1 20 LEU HA H 2.144 -3.825 6.328 1.00 . A A . 20 LEU HA 1 1 3 2256 1 1 20 LEU HB2 H -0.076 -5.064 4.718 1.00 . A A . 20 LEU HB2 1 1 3 2257 1 1 20 LEU HB3 H -0.207 -3.857 5.984 1.00 . A A . 20 LEU HB3 1 1 3 2258 1 1 20 LEU HD11 H -1.072 -2.158 2.879 1.00 . A A . 20 LEU HD11 1 1 3 2259 1 1 20 LEU HD12 H -1.646 -3.548 3.798 1.00 . A A . 20 LEU HD12 1 1 3 2260 1 1 20 LEU HD13 H -0.631 -3.790 2.378 1.00 . A A . 20 LEU HD13 1 1 3 2261 1 1 20 LEU HD21 H -0.458 -1.326 4.947 1.00 . A A . 20 LEU HD21 1 1 3 2262 1 1 20 LEU HD22 H 1.077 -1.049 4.123 1.00 . A A . 20 LEU HD22 1 1 3 2263 1 1 20 LEU HD23 H 1.054 -1.823 5.708 1.00 . A A . 20 LEU HD23 1 1 3 2264 1 1 20 LEU HG H 1.282 -3.217 3.465 1.00 . A A . 20 LEU HG 1 1 3 2265 1 1 20 LEU N N 2.708 -4.782 4.591 1.00 . A A . 20 LEU N 1 1 3 2266 1 1 20 LEU O O 1.433 -5.848 7.718 1.00 . A A . 20 LEU O 1 1 3 2267 1 1 21 GLY C C 0.281 -8.927 6.373 1.00 . A A . 21 GLY C 1 1 3 2268 1 1 21 GLY CA C 1.658 -8.308 6.511 1.00 . A A . 21 GLY CA 1 1 3 2269 1 1 21 GLY H H 1.926 -7.000 4.867 1.00 . A A . 21 GLY H 1 1 3 2270 1 1 21 GLY HA2 H 2.389 -8.984 6.093 1.00 . A A . 21 GLY HA2 1 1 3 2271 1 1 21 GLY HA3 H 1.874 -8.165 7.559 1.00 . A A . 21 GLY HA3 1 1 3 2272 1 1 21 GLY N N 1.763 -7.029 5.832 1.00 . A A . 21 GLY N 1 1 3 2273 1 1 21 GLY O O -0.156 -9.685 7.239 1.00 . A A . 21 GLY O 1 1 3 2274 1 1 22 ILE C C -1.748 -10.054 3.820 1.00 . A A . 22 ILE C 1 1 3 2275 1 1 22 ILE CA C -1.741 -9.132 5.033 1.00 . A A . 22 ILE CA 1 1 3 2276 1 1 22 ILE CB C -2.760 -8.001 4.810 1.00 . A A . 22 ILE CB 1 1 3 2277 1 1 22 ILE CD1 C -3.377 -6.124 3.204 1.00 . A A . 22 ILE CD1 1 1 3 2278 1 1 22 ILE CG1 C -2.314 -7.102 3.655 1.00 . A A . 22 ILE CG1 1 1 3 2279 1 1 22 ILE CG2 C -2.938 -7.187 6.082 1.00 . A A . 22 ILE CG2 1 1 3 2280 1 1 22 ILE H H -0.003 -7.993 4.628 1.00 . A A . 22 ILE H 1 1 3 2281 1 1 22 ILE HA H -2.043 -9.696 5.904 1.00 . A A . 22 ILE HA 1 1 3 2282 1 1 22 ILE HB H -3.712 -8.448 4.563 1.00 . A A . 22 ILE HB 1 1 3 2283 1 1 22 ILE HD11 H -3.026 -5.114 3.358 1.00 . A A . 22 ILE HD11 1 1 3 2284 1 1 22 ILE HD12 H -4.279 -6.282 3.777 1.00 . A A . 22 ILE HD12 1 1 3 2285 1 1 22 ILE HD13 H -3.587 -6.277 2.155 1.00 . A A . 22 ILE HD13 1 1 3 2286 1 1 22 ILE HG12 H -1.451 -6.534 3.961 1.00 . A A . 22 ILE HG12 1 1 3 2287 1 1 22 ILE HG13 H -2.052 -7.720 2.808 1.00 . A A . 22 ILE HG13 1 1 3 2288 1 1 22 ILE HG21 H -3.162 -6.161 5.827 1.00 . A A . 22 ILE HG21 1 1 3 2289 1 1 22 ILE HG22 H -2.027 -7.223 6.662 1.00 . A A . 22 ILE HG22 1 1 3 2290 1 1 22 ILE HG23 H -3.750 -7.599 6.664 1.00 . A A . 22 ILE HG23 1 1 3 2291 1 1 22 ILE N N -0.405 -8.603 5.281 1.00 . A A . 22 ILE N 1 1 3 2292 1 1 22 ILE O O -0.716 -10.269 3.184 1.00 . A A . 22 ILE O 1 1 3 2293 1 1 23 SER C C -3.167 -10.711 1.060 1.00 . A A . 23 SER C 1 1 3 2294 1 1 23 SER CA C -3.061 -11.496 2.363 1.00 . A A . 23 SER CA 1 1 3 2295 1 1 23 SER CB C -4.295 -12.384 2.538 1.00 . A A . 23 SER CB 1 1 3 2296 1 1 23 SER H H -3.706 -10.388 4.048 1.00 . A A . 23 SER H 1 1 3 2297 1 1 23 SER HA H -2.182 -12.122 2.322 1.00 . A A . 23 SER HA 1 1 3 2298 1 1 23 SER HB2 H -5.180 -11.768 2.555 1.00 . A A . 23 SER HB2 1 1 3 2299 1 1 23 SER HB3 H -4.355 -13.080 1.714 1.00 . A A . 23 SER HB3 1 1 3 2300 1 1 23 SER HG H -4.785 -13.897 3.684 1.00 . A A . 23 SER HG 1 1 3 2301 1 1 23 SER N N -2.919 -10.597 3.502 1.00 . A A . 23 SER N 1 1 3 2302 1 1 23 SER O O -3.667 -9.585 1.041 1.00 . A A . 23 SER O 1 1 3 2303 1 1 23 SER OG O -4.228 -13.118 3.750 1.00 . A A . 23 SER OG 1 1 3 2304 1 1 24 ASP C C -4.173 -10.357 -1.742 1.00 . A A . 24 ASP C 1 1 3 2305 1 1 24 ASP CA C -2.736 -10.666 -1.334 1.00 . A A . 24 ASP CA 1 1 3 2306 1 1 24 ASP CB C -2.075 -11.556 -2.387 1.00 . A A . 24 ASP CB 1 1 3 2307 1 1 24 ASP CG C -2.704 -12.933 -2.458 1.00 . A A . 24 ASP CG 1 1 3 2308 1 1 24 ASP H H -2.308 -12.207 0.051 1.00 . A A . 24 ASP H 1 1 3 2309 1 1 24 ASP HA H -2.187 -9.737 -1.264 1.00 . A A . 24 ASP HA 1 1 3 2310 1 1 24 ASP HB2 H -2.169 -11.087 -3.355 1.00 . A A . 24 ASP HB2 1 1 3 2311 1 1 24 ASP HB3 H -1.028 -11.669 -2.147 1.00 . A A . 24 ASP HB3 1 1 3 2312 1 1 24 ASP N N -2.694 -11.310 -0.026 1.00 . A A . 24 ASP N 1 1 3 2313 1 1 24 ASP O O -4.435 -9.376 -2.437 1.00 . A A . 24 ASP O 1 1 3 2314 1 1 24 ASP OD1 O -3.008 -13.503 -1.388 1.00 . A A . 24 ASP OD1 1 1 3 2315 1 1 24 ASP OD2 O -2.891 -13.444 -3.582 1.00 . A A . 24 ASP OD2 1 1 3 2316 1 1 25 ALA C C -7.045 -9.723 -1.026 1.00 . A A . 25 ALA C 1 1 3 2317 1 1 25 ALA CA C -6.512 -11.019 -1.623 1.00 . A A . 25 ALA CA 1 1 3 2318 1 1 25 ALA CB C -7.323 -12.206 -1.124 1.00 . A A . 25 ALA CB 1 1 3 2319 1 1 25 ALA H H -4.830 -11.966 -0.754 1.00 . A A . 25 ALA H 1 1 3 2320 1 1 25 ALA HA H -6.607 -10.976 -2.699 1.00 . A A . 25 ALA HA 1 1 3 2321 1 1 25 ALA HB1 H -7.774 -11.959 -0.175 1.00 . A A . 25 ALA HB1 1 1 3 2322 1 1 25 ALA HB2 H -6.673 -13.060 -1.003 1.00 . A A . 25 ALA HB2 1 1 3 2323 1 1 25 ALA HB3 H -8.097 -12.440 -1.839 1.00 . A A . 25 ALA HB3 1 1 3 2324 1 1 25 ALA N N -5.101 -11.202 -1.305 1.00 . A A . 25 ALA N 1 1 3 2325 1 1 25 ALA O O -7.793 -8.990 -1.675 1.00 . A A . 25 ALA O 1 1 3 2326 1 1 26 ALA C C -6.667 -6.987 0.136 1.00 . A A . 26 ALA C 1 1 3 2327 1 1 26 ALA CA C -7.097 -8.234 0.899 1.00 . A A . 26 ALA CA 1 1 3 2328 1 1 26 ALA CB C -6.547 -8.203 2.317 1.00 . A A . 26 ALA CB 1 1 3 2329 1 1 26 ALA H H -6.060 -10.067 0.679 1.00 . A A . 26 ALA H 1 1 3 2330 1 1 26 ALA HA H -8.175 -8.257 0.955 1.00 . A A . 26 ALA HA 1 1 3 2331 1 1 26 ALA HB1 H -5.564 -8.649 2.334 1.00 . A A . 26 ALA HB1 1 1 3 2332 1 1 26 ALA HB2 H -7.206 -8.759 2.970 1.00 . A A . 26 ALA HB2 1 1 3 2333 1 1 26 ALA HB3 H -6.484 -7.181 2.656 1.00 . A A . 26 ALA HB3 1 1 3 2334 1 1 26 ALA N N -6.657 -9.445 0.214 1.00 . A A . 26 ALA N 1 1 3 2335 1 1 26 ALA O O -7.387 -5.989 0.102 1.00 . A A . 26 ALA O 1 1 3 2336 1 1 27 VAL C C -5.812 -5.659 -2.478 1.00 . A A . 27 VAL C 1 1 3 2337 1 1 27 VAL CA C -4.963 -5.925 -1.239 1.00 . A A . 27 VAL CA 1 1 3 2338 1 1 27 VAL CB C -3.504 -6.172 -1.670 1.00 . A A . 27 VAL CB 1 1 3 2339 1 1 27 VAL CG1 C -2.931 -4.942 -2.357 1.00 . A A . 27 VAL CG1 1 1 3 2340 1 1 27 VAL CG2 C -2.655 -6.567 -0.471 1.00 . A A . 27 VAL CG2 1 1 3 2341 1 1 27 VAL H H -4.961 -7.872 -0.412 1.00 . A A . 27 VAL H 1 1 3 2342 1 1 27 VAL HA H -4.987 -5.051 -0.604 1.00 . A A . 27 VAL HA 1 1 3 2343 1 1 27 VAL HB H -3.493 -6.989 -2.377 1.00 . A A . 27 VAL HB 1 1 3 2344 1 1 27 VAL HG11 H -3.627 -4.589 -3.104 1.00 . A A . 27 VAL HG11 1 1 3 2345 1 1 27 VAL HG12 H -1.994 -5.198 -2.830 1.00 . A A . 27 VAL HG12 1 1 3 2346 1 1 27 VAL HG13 H -2.764 -4.166 -1.625 1.00 . A A . 27 VAL HG13 1 1 3 2347 1 1 27 VAL HG21 H -2.954 -7.544 -0.125 1.00 . A A . 27 VAL HG21 1 1 3 2348 1 1 27 VAL HG22 H -2.793 -5.846 0.321 1.00 . A A . 27 VAL HG22 1 1 3 2349 1 1 27 VAL HG23 H -1.614 -6.589 -0.760 1.00 . A A . 27 VAL HG23 1 1 3 2350 1 1 27 VAL N N -5.489 -7.050 -0.475 1.00 . A A . 27 VAL N 1 1 3 2351 1 1 27 VAL O O -6.232 -4.529 -2.724 1.00 . A A . 27 VAL O 1 1 3 2352 1 1 28 SER C C -8.300 -6.199 -4.133 1.00 . A A . 28 SER C 1 1 3 2353 1 1 28 SER CA C -6.863 -6.587 -4.466 1.00 . A A . 28 SER CA 1 1 3 2354 1 1 28 SER CB C -6.845 -7.902 -5.250 1.00 . A A . 28 SER CB 1 1 3 2355 1 1 28 SER H H -5.701 -7.585 -3.005 1.00 . A A . 28 SER H 1 1 3 2356 1 1 28 SER HA H -6.426 -5.811 -5.076 1.00 . A A . 28 SER HA 1 1 3 2357 1 1 28 SER HB2 H -5.955 -8.458 -4.995 1.00 . A A . 28 SER HB2 1 1 3 2358 1 1 28 SER HB3 H -7.718 -8.483 -4.992 1.00 . A A . 28 SER HB3 1 1 3 2359 1 1 28 SER HG H -7.749 -7.502 -6.941 1.00 . A A . 28 SER HG 1 1 3 2360 1 1 28 SER N N -6.062 -6.708 -3.254 1.00 . A A . 28 SER N 1 1 3 2361 1 1 28 SER O O -8.968 -5.522 -4.914 1.00 . A A . 28 SER O 1 1 3 2362 1 1 28 SER OG O -6.850 -7.664 -6.646 1.00 . A A . 28 SER OG 1 1 3 2363 1 1 29 GLN C C -10.290 -4.843 -2.237 1.00 . A A . 29 GLN C 1 1 3 2364 1 1 29 GLN CA C -10.120 -6.333 -2.528 1.00 . A A . 29 GLN CA 1 1 3 2365 1 1 29 GLN CB C -10.470 -7.151 -1.282 1.00 . A A . 29 GLN CB 1 1 3 2366 1 1 29 GLN CD C -11.960 -8.985 -0.385 1.00 . A A . 29 GLN CD 1 1 3 2367 1 1 29 GLN CG C -11.830 -7.828 -1.357 1.00 . A A . 29 GLN CG 1 1 3 2368 1 1 29 GLN H H -8.188 -7.170 -2.387 1.00 . A A . 29 GLN H 1 1 3 2369 1 1 29 GLN HA H -10.800 -6.609 -3.325 1.00 . A A . 29 GLN HA 1 1 3 2370 1 1 29 GLN HB2 H -9.722 -7.915 -1.147 1.00 . A A . 29 GLN HB2 1 1 3 2371 1 1 29 GLN HB3 H -10.460 -6.498 -0.420 1.00 . A A . 29 GLN HB3 1 1 3 2372 1 1 29 GLN HE21 H -11.440 -7.803 1.128 1.00 . A A . 29 GLN HE21 1 1 3 2373 1 1 29 GLN HE22 H -11.770 -9.448 1.540 1.00 . A A . 29 GLN HE22 1 1 3 2374 1 1 29 GLN HG2 H -12.590 -7.100 -1.128 1.00 . A A . 29 GLN HG2 1 1 3 2375 1 1 29 GLN HG3 H -11.970 -8.200 -2.360 1.00 . A A . 29 GLN HG3 1 1 3 2376 1 1 29 GLN N N -8.769 -6.634 -2.968 1.00 . A A . 29 GLN N 1 1 3 2377 1 1 29 GLN NE2 N -11.700 -8.719 0.890 1.00 . A A . 29 GLN NE2 1 1 3 2378 1 1 29 GLN O O -11.410 -4.333 -2.199 1.00 . A A . 29 GLN O 1 1 3 2379 1 1 29 GLN OE1 O -12.280 -10.105 -0.775 1.00 . A A . 29 GLN OE1 1 1 3 2380 1 1 30 TRP C C -10.030 -1.963 -2.784 1.00 . A A . 30 TRP C 1 1 3 2381 1 1 30 TRP CA C -9.208 -2.717 -1.745 1.00 . A A . 30 TRP CA 1 1 3 2382 1 1 30 TRP CB C -7.786 -2.151 -1.709 1.00 . A A . 30 TRP CB 1 1 3 2383 1 1 30 TRP CD1 C -7.549 -2.974 0.710 1.00 . A A . 30 TRP CD1 1 1 3 2384 1 1 30 TRP CD2 C -5.618 -2.384 -0.259 1.00 . A A . 30 TRP CD2 1 1 3 2385 1 1 30 TRP CE2 C -5.348 -2.812 1.055 1.00 . A A . 30 TRP CE2 1 1 3 2386 1 1 30 TRP CE3 C -4.555 -1.964 -1.063 1.00 . A A . 30 TRP CE3 1 1 3 2387 1 1 30 TRP CG C -7.031 -2.496 -0.461 1.00 . A A . 30 TRP CG 1 1 3 2388 1 1 30 TRP CH2 C -3.036 -2.416 0.771 1.00 . A A . 30 TRP CH2 1 1 3 2389 1 1 30 TRP CZ2 C -4.058 -2.833 1.581 1.00 . A A . 30 TRP CZ2 1 1 3 2390 1 1 30 TRP CZ3 C -3.275 -1.983 -0.539 1.00 . A A . 30 TRP CZ3 1 1 3 2391 1 1 30 TRP H H -8.314 -4.607 -2.073 1.00 . A A . 30 TRP H 1 1 3 2392 1 1 30 TRP HA H -9.663 -2.583 -0.776 1.00 . A A . 30 TRP HA 1 1 3 2393 1 1 30 TRP HB2 H -7.232 -2.539 -2.549 1.00 . A A . 30 TRP HB2 1 1 3 2394 1 1 30 TRP HB3 H -7.834 -1.075 -1.783 1.00 . A A . 30 TRP HB3 1 1 3 2395 1 1 30 TRP HD1 H -8.598 -3.167 0.877 1.00 . A A . 30 TRP HD1 1 1 3 2396 1 1 30 TRP HE1 H -6.660 -3.504 2.539 1.00 . A A . 30 TRP HE1 1 1 3 2397 1 1 30 TRP HE3 H -4.718 -1.627 -2.075 1.00 . A A . 30 TRP HE3 1 1 3 2398 1 1 30 TRP HH2 H -2.021 -2.415 1.139 1.00 . A A . 30 TRP HH2 1 1 3 2399 1 1 30 TRP HZ2 H -3.857 -3.164 2.588 1.00 . A A . 30 TRP HZ2 1 1 3 2400 1 1 30 TRP HZ3 H -2.442 -1.661 -1.145 1.00 . A A . 30 TRP HZ3 1 1 3 2401 1 1 30 TRP N N -9.178 -4.147 -2.033 1.00 . A A . 30 TRP N 1 1 3 2402 1 1 30 TRP NE1 N -6.542 -3.167 1.625 1.00 . A A . 30 TRP NE1 1 1 3 2403 1 1 30 TRP O O -10.080 -2.353 -3.951 1.00 . A A . 30 TRP O 1 1 3 2404 1 1 31 LYS C C -10.670 1.114 -3.784 1.00 . A A . 31 LYS C 1 1 3 2405 1 1 31 LYS CA C -11.480 -0.066 -3.248 1.00 . A A . 31 LYS CA 1 1 3 2406 1 1 31 LYS CB C -12.730 0.436 -2.515 1.00 . A A . 31 LYS CB 1 1 3 2407 1 1 31 LYS CD C -14.940 -0.544 -1.843 1.00 . A A . 31 LYS CD 1 1 3 2408 1 1 31 LYS CE C -15.650 -0.994 -0.573 1.00 . A A . 31 LYS CE 1 1 3 2409 1 1 31 LYS CG C -13.430 -0.642 -1.707 1.00 . A A . 31 LYS CG 1 1 3 2410 1 1 31 LYS H H -10.580 -0.618 -1.413 1.00 . A A . 31 LYS H 1 1 3 2411 1 1 31 LYS HA H -11.790 -0.686 -4.076 1.00 . A A . 31 LYS HA 1 1 3 2412 1 1 31 LYS HB2 H -12.440 1.230 -1.843 1.00 . A A . 31 LYS HB2 1 1 3 2413 1 1 31 LYS HB3 H -13.430 0.826 -3.241 1.00 . A A . 31 LYS HB3 1 1 3 2414 1 1 31 LYS HD2 H -15.210 0.482 -2.047 1.00 . A A . 31 LYS HD2 1 1 3 2415 1 1 31 LYS HD3 H -15.260 -1.173 -2.662 1.00 . A A . 31 LYS HD3 1 1 3 2416 1 1 31 LYS HE2 H -15.320 -1.992 -0.327 1.00 . A A . 31 LYS HE2 1 1 3 2417 1 1 31 LYS HE3 H -15.380 -0.320 0.228 1.00 . A A . 31 LYS HE3 1 1 3 2418 1 1 31 LYS HG2 H -13.110 -1.610 -2.058 1.00 . A A . 31 LYS HG2 1 1 3 2419 1 1 31 LYS HG3 H -13.170 -0.528 -0.666 1.00 . A A . 31 LYS HG3 1 1 3 2420 1 1 31 LYS HZ1 H -17.540 -1.798 -0.207 1.00 . A A . 31 LYS HZ1 1 1 3 2421 1 1 31 LYS HZ2 H -17.380 -1.094 -1.736 1.00 . A A . 31 LYS HZ2 1 1 3 2422 1 1 31 LYS HZ3 H -17.530 -0.113 -0.367 1.00 . A A . 31 LYS HZ3 1 1 3 2423 1 1 31 LYS N N -10.660 -0.879 -2.354 1.00 . A A . 31 LYS N 1 1 3 2424 1 1 31 LYS NZ N -17.130 -1.000 -0.733 1.00 . A A . 31 LYS NZ 1 1 3 2425 1 1 31 LYS O O -9.451 1.122 -3.702 1.00 . A A . 31 LYS O 1 1 3 2426 1 1 32 GLU C C -9.737 3.888 -3.871 1.00 . A A . 32 GLU C 1 1 3 2427 1 1 32 GLU CA C -10.710 3.289 -4.882 1.00 . A A . 32 GLU CA 1 1 3 2428 1 1 32 GLU CB C -11.750 4.335 -5.292 1.00 . A A . 32 GLU CB 1 1 3 2429 1 1 32 GLU CD C -12.890 5.526 -7.203 1.00 . A A . 32 GLU CD 1 1 3 2430 1 1 32 GLU CG C -12.060 4.329 -6.777 1.00 . A A . 32 GLU CG 1 1 3 2431 1 1 32 GLU H H -12.340 2.044 -4.372 1.00 . A A . 32 GLU H 1 1 3 2432 1 1 32 GLU HA H -10.160 2.983 -5.756 1.00 . A A . 32 GLU HA 1 1 3 2433 1 1 32 GLU HB2 H -12.660 4.147 -4.750 1.00 . A A . 32 GLU HB2 1 1 3 2434 1 1 32 GLU HB3 H -11.380 5.316 -5.028 1.00 . A A . 32 GLU HB3 1 1 3 2435 1 1 32 GLU HG2 H -11.130 4.339 -7.330 1.00 . A A . 32 GLU HG2 1 1 3 2436 1 1 32 GLU HG3 H -12.610 3.428 -7.013 1.00 . A A . 32 GLU HG3 1 1 3 2437 1 1 32 GLU N N -11.370 2.107 -4.334 1.00 . A A . 32 GLU N 1 1 3 2438 1 1 32 GLU O O -8.734 4.494 -4.246 1.00 . A A . 32 GLU O 1 1 3 2439 1 1 32 GLU OE1 O -12.860 6.554 -6.495 1.00 . A A . 32 GLU OE1 1 1 3 2440 1 1 32 GLU OE2 O -13.570 5.434 -8.245 1.00 . A A . 32 GLU OE2 1 1 3 2441 1 1 33 VAL C C -8.813 3.128 -0.540 1.00 . A A . 33 VAL C 1 1 3 2442 1 1 33 VAL CA C -9.190 4.231 -1.525 1.00 . A A . 33 VAL CA 1 1 3 2443 1 1 33 VAL CB C -9.883 5.376 -0.759 1.00 . A A . 33 VAL CB 1 1 3 2444 1 1 33 VAL CG1 C -8.907 6.047 0.199 1.00 . A A . 33 VAL CG1 1 1 3 2445 1 1 33 VAL CG2 C -10.470 6.389 -1.731 1.00 . A A . 33 VAL CG2 1 1 3 2446 1 1 33 VAL H H -10.850 3.218 -2.354 1.00 . A A . 33 VAL H 1 1 3 2447 1 1 33 VAL HA H -8.289 4.619 -1.976 1.00 . A A . 33 VAL HA 1 1 3 2448 1 1 33 VAL HB H -10.690 4.956 -0.178 1.00 . A A . 33 VAL HB 1 1 3 2449 1 1 33 VAL HG11 H -9.331 6.061 1.192 1.00 . A A . 33 VAL HG11 1 1 3 2450 1 1 33 VAL HG12 H -8.720 7.061 -0.126 1.00 . A A . 33 VAL HG12 1 1 3 2451 1 1 33 VAL HG13 H -7.980 5.496 0.211 1.00 . A A . 33 VAL HG13 1 1 3 2452 1 1 33 VAL HG21 H -9.681 7.017 -2.117 1.00 . A A . 33 VAL HG21 1 1 3 2453 1 1 33 VAL HG22 H -11.190 7.000 -1.218 1.00 . A A . 33 VAL HG22 1 1 3 2454 1 1 33 VAL HG23 H -10.940 5.869 -2.547 1.00 . A A . 33 VAL HG23 1 1 3 2455 1 1 33 VAL N N -10.030 3.712 -2.588 1.00 . A A . 33 VAL N 1 1 3 2456 1 1 33 VAL O O -9.654 2.314 -0.157 1.00 . A A . 33 VAL O 1 1 3 2457 1 1 34 ILE C C -7.634 2.322 2.201 1.00 . A A . 34 ILE C 1 1 3 2458 1 1 34 ILE CA C -7.068 2.090 0.803 1.00 . A A . 34 ILE CA 1 1 3 2459 1 1 34 ILE CB C -5.528 2.063 0.885 1.00 . A A . 34 ILE CB 1 1 3 2460 1 1 34 ILE CD1 C -3.540 3.533 1.490 1.00 . A A . 34 ILE CD1 1 1 3 2461 1 1 34 ILE CG1 C -4.966 3.483 0.989 1.00 . A A . 34 ILE CG1 1 1 3 2462 1 1 34 ILE CG2 C -4.943 1.344 -0.319 1.00 . A A . 34 ILE CG2 1 1 3 2463 1 1 34 ILE H H -6.920 3.776 -0.475 1.00 . A A . 34 ILE H 1 1 3 2464 1 1 34 ILE HA H -7.404 1.126 0.449 1.00 . A A . 34 ILE HA 1 1 3 2465 1 1 34 ILE HB H -5.248 1.511 1.771 1.00 . A A . 34 ILE HB 1 1 3 2466 1 1 34 ILE HD11 H -3.454 2.939 2.388 1.00 . A A . 34 ILE HD11 1 1 3 2467 1 1 34 ILE HD12 H -3.270 4.556 1.707 1.00 . A A . 34 ILE HD12 1 1 3 2468 1 1 34 ILE HD13 H -2.878 3.138 0.734 1.00 . A A . 34 ILE HD13 1 1 3 2469 1 1 34 ILE HG12 H -4.991 3.943 0.013 1.00 . A A . 34 ILE HG12 1 1 3 2470 1 1 34 ILE HG13 H -5.577 4.054 1.669 1.00 . A A . 34 ILE HG13 1 1 3 2471 1 1 34 ILE HG21 H -5.653 0.615 -0.684 1.00 . A A . 34 ILE HG21 1 1 3 2472 1 1 34 ILE HG22 H -4.030 0.843 -0.031 1.00 . A A . 34 ILE HG22 1 1 3 2473 1 1 34 ILE HG23 H -4.731 2.060 -1.099 1.00 . A A . 34 ILE HG23 1 1 3 2474 1 1 34 ILE N N -7.545 3.102 -0.135 1.00 . A A . 34 ILE N 1 1 3 2475 1 1 34 ILE O O -7.951 3.451 2.574 1.00 . A A . 34 ILE O 1 1 3 2476 1 1 35 PRO C C -7.586 2.385 5.199 1.00 . A A . 35 PRO C 1 1 3 2477 1 1 35 PRO CA C -8.303 1.333 4.361 1.00 . A A . 35 PRO CA 1 1 3 2478 1 1 35 PRO CB C -8.052 -0.066 4.929 1.00 . A A . 35 PRO CB 1 1 3 2479 1 1 35 PRO CD C -7.420 -0.140 2.629 1.00 . A A . 35 PRO CD 1 1 3 2480 1 1 35 PRO CG C -8.023 -0.957 3.737 1.00 . A A . 35 PRO CG 1 1 3 2481 1 1 35 PRO HA H -9.363 1.538 4.358 1.00 . A A . 35 PRO HA 1 1 3 2482 1 1 35 PRO HB2 H -7.109 -0.078 5.457 1.00 . A A . 35 PRO HB2 1 1 3 2483 1 1 35 PRO HB3 H -8.852 -0.333 5.604 1.00 . A A . 35 PRO HB3 1 1 3 2484 1 1 35 PRO HD2 H -6.348 -0.271 2.602 1.00 . A A . 35 PRO HD2 1 1 3 2485 1 1 35 PRO HD3 H -7.858 -0.409 1.680 1.00 . A A . 35 PRO HD3 1 1 3 2486 1 1 35 PRO HG2 H -7.412 -1.823 3.941 1.00 . A A . 35 PRO HG2 1 1 3 2487 1 1 35 PRO HG3 H -9.027 -1.256 3.477 1.00 . A A . 35 PRO HG3 1 1 3 2488 1 1 35 PRO N N -7.772 1.246 2.997 1.00 . A A . 35 PRO N 1 1 3 2489 1 1 35 PRO O O -6.725 3.109 4.700 1.00 . A A . 35 PRO O 1 1 3 2490 1 1 36 GLU C C -6.072 2.878 8.011 1.00 . A A . 36 GLU C 1 1 3 2491 1 1 36 GLU CA C -7.346 3.435 7.383 1.00 . A A . 36 GLU CA 1 1 3 2492 1 1 36 GLU CB C -8.340 3.821 8.480 1.00 . A A . 36 GLU CB 1 1 3 2493 1 1 36 GLU CD C -7.270 4.510 10.661 1.00 . A A . 36 GLU CD 1 1 3 2494 1 1 36 GLU CG C -7.869 4.976 9.348 1.00 . A A . 36 GLU CG 1 1 3 2495 1 1 36 GLU H H -8.647 1.865 6.811 1.00 . A A . 36 GLU H 1 1 3 2496 1 1 36 GLU HA H -7.097 4.315 6.811 1.00 . A A . 36 GLU HA 1 1 3 2497 1 1 36 GLU HB2 H -9.274 4.104 8.019 1.00 . A A . 36 GLU HB2 1 1 3 2498 1 1 36 GLU HB3 H -8.507 2.965 9.117 1.00 . A A . 36 GLU HB3 1 1 3 2499 1 1 36 GLU HG2 H -7.121 5.535 8.808 1.00 . A A . 36 GLU HG2 1 1 3 2500 1 1 36 GLU HG3 H -8.713 5.616 9.561 1.00 . A A . 36 GLU HG3 1 1 3 2501 1 1 36 GLU N N -7.952 2.469 6.474 1.00 . A A . 36 GLU N 1 1 3 2502 1 1 36 GLU O O -5.033 3.537 8.018 1.00 . A A . 36 GLU O 1 1 3 2503 1 1 36 GLU OE1 O -6.439 3.577 10.637 1.00 . A A . 36 GLU OE1 1 1 3 2504 1 1 36 GLU OE2 O -7.631 5.078 11.713 1.00 . A A . 36 GLU OE2 1 1 3 2505 1 1 37 LYS C C -3.971 0.600 8.152 1.00 . A A . 37 LYS C 1 1 3 2506 1 1 37 LYS CA C -5.015 1.022 9.179 1.00 . A A . 37 LYS CA 1 1 3 2507 1 1 37 LYS CB C -5.468 -0.195 9.990 1.00 . A A . 37 LYS CB 1 1 3 2508 1 1 37 LYS CD C -7.019 -1.137 11.728 1.00 . A A . 37 LYS CD 1 1 3 2509 1 1 37 LYS CE C -8.386 -0.951 12.364 1.00 . A A . 37 LYS CE 1 1 3 2510 1 1 37 LYS CG C -6.575 0.114 10.986 1.00 . A A . 37 LYS CG 1 1 3 2511 1 1 37 LYS H H -7.019 1.188 8.511 1.00 . A A . 37 LYS H 1 1 3 2512 1 1 37 LYS HA H -4.566 1.740 9.848 1.00 . A A . 37 LYS HA 1 1 3 2513 1 1 37 LYS HB2 H -5.827 -0.952 9.310 1.00 . A A . 37 LYS HB2 1 1 3 2514 1 1 37 LYS HB3 H -4.622 -0.585 10.535 1.00 . A A . 37 LYS HB3 1 1 3 2515 1 1 37 LYS HD2 H -7.067 -1.959 11.029 1.00 . A A . 37 LYS HD2 1 1 3 2516 1 1 37 LYS HD3 H -6.299 -1.359 12.501 1.00 . A A . 37 LYS HD3 1 1 3 2517 1 1 37 LYS HE2 H -8.620 -1.830 12.947 1.00 . A A . 37 LYS HE2 1 1 3 2518 1 1 37 LYS HE3 H -8.353 -0.088 13.013 1.00 . A A . 37 LYS HE3 1 1 3 2519 1 1 37 LYS HG2 H -6.211 0.836 11.702 1.00 . A A . 37 LYS HG2 1 1 3 2520 1 1 37 LYS HG3 H -7.420 0.525 10.453 1.00 . A A . 37 LYS HG3 1 1 3 2521 1 1 37 LYS HZ1 H -9.315 -1.409 10.550 1.00 . A A . 37 LYS HZ1 1 1 3 2522 1 1 37 LYS HZ2 H -9.419 0.223 10.978 1.00 . A A . 37 LYS HZ2 1 1 3 2523 1 1 37 LYS HZ3 H -10.380 -0.920 11.764 1.00 . A A . 37 LYS HZ3 1 1 3 2524 1 1 37 LYS N N -6.162 1.662 8.543 1.00 . A A . 37 LYS N 1 1 3 2525 1 1 37 LYS NZ N -9.451 -0.750 11.344 1.00 . A A . 37 LYS NZ 1 1 3 2526 1 1 37 LYS O O -2.804 0.401 8.491 1.00 . A A . 37 LYS O 1 1 3 2527 1 1 38 ASP C C -2.649 1.266 5.376 1.00 . A A . 38 ASP C 1 1 3 2528 1 1 38 ASP CA C -3.473 0.070 5.836 1.00 . A A . 38 ASP CA 1 1 3 2529 1 1 38 ASP CB C -4.246 -0.522 4.656 1.00 . A A . 38 ASP CB 1 1 3 2530 1 1 38 ASP CG C -4.374 -2.030 4.749 1.00 . A A . 38 ASP CG 1 1 3 2531 1 1 38 ASP H H -5.328 0.635 6.682 1.00 . A A . 38 ASP H 1 1 3 2532 1 1 38 ASP HA H -2.805 -0.680 6.235 1.00 . A A . 38 ASP HA 1 1 3 2533 1 1 38 ASP HB2 H -5.237 -0.096 4.633 1.00 . A A . 38 ASP HB2 1 1 3 2534 1 1 38 ASP HB3 H -3.731 -0.278 3.738 1.00 . A A . 38 ASP HB3 1 1 3 2535 1 1 38 ASP N N -4.388 0.465 6.897 1.00 . A A . 38 ASP N 1 1 3 2536 1 1 38 ASP O O -1.429 1.176 5.234 1.00 . A A . 38 ASP O 1 1 3 2537 1 1 38 ASP OD1 O -3.516 -2.659 5.404 1.00 . A A . 38 ASP OD1 1 1 3 2538 1 1 38 ASP OD2 O -5.331 -2.581 4.167 1.00 . A A . 38 ASP OD2 1 1 3 2539 1 1 39 ALA C C -1.638 4.071 5.765 1.00 . A A . 39 ALA C 1 1 3 2540 1 1 39 ALA CA C -2.653 3.608 4.724 1.00 . A A . 39 ALA CA 1 1 3 2541 1 1 39 ALA CB C -3.672 4.704 4.453 1.00 . A A . 39 ALA CB 1 1 3 2542 1 1 39 ALA H H -4.292 2.400 5.294 1.00 . A A . 39 ALA H 1 1 3 2543 1 1 39 ALA HA H -2.132 3.394 3.801 1.00 . A A . 39 ALA HA 1 1 3 2544 1 1 39 ALA HB1 H -3.973 5.154 5.386 1.00 . A A . 39 ALA HB1 1 1 3 2545 1 1 39 ALA HB2 H -4.535 4.278 3.963 1.00 . A A . 39 ALA HB2 1 1 3 2546 1 1 39 ALA HB3 H -3.230 5.456 3.817 1.00 . A A . 39 ALA HB3 1 1 3 2547 1 1 39 ALA N N -3.322 2.390 5.157 1.00 . A A . 39 ALA N 1 1 3 2548 1 1 39 ALA O O -0.667 4.754 5.438 1.00 . A A . 39 ALA O 1 1 3 2549 1 1 40 TYR C C 0.360 3.334 8.002 1.00 . A A . 40 TYR C 1 1 3 2550 1 1 40 TYR CA C -0.970 4.075 8.106 1.00 . A A . 40 TYR CA 1 1 3 2551 1 1 40 TYR CB C -1.624 3.785 9.459 1.00 . A A . 40 TYR CB 1 1 3 2552 1 1 40 TYR CD1 C -0.475 5.449 10.969 1.00 . A A . 40 TYR CD1 1 1 3 2553 1 1 40 TYR CD2 C -0.192 3.128 11.431 1.00 . A A . 40 TYR CD2 1 1 3 2554 1 1 40 TYR CE1 C 0.326 5.766 12.048 1.00 . A A . 40 TYR CE1 1 1 3 2555 1 1 40 TYR CE2 C 0.610 3.436 12.512 1.00 . A A . 40 TYR CE2 1 1 3 2556 1 1 40 TYR CG C -0.748 4.127 10.642 1.00 . A A . 40 TYR CG 1 1 3 2557 1 1 40 TYR CZ C 0.867 4.756 12.818 1.00 . A A . 40 TYR CZ 1 1 3 2558 1 1 40 TYR H H -2.659 3.150 7.225 1.00 . A A . 40 TYR H 1 1 3 2559 1 1 40 TYR HA H -0.786 5.135 8.026 1.00 . A A . 40 TYR HA 1 1 3 2560 1 1 40 TYR HB2 H -2.535 4.366 9.543 1.00 . A A . 40 TYR HB2 1 1 3 2561 1 1 40 TYR HB3 H -1.866 2.732 9.516 1.00 . A A . 40 TYR HB3 1 1 3 2562 1 1 40 TYR HD1 H -0.900 6.237 10.367 1.00 . A A . 40 TYR HD1 1 1 3 2563 1 1 40 TYR HD2 H -0.396 2.094 11.188 1.00 . A A . 40 TYR HD2 1 1 3 2564 1 1 40 TYR HE1 H 0.527 6.800 12.286 1.00 . A A . 40 TYR HE1 1 1 3 2565 1 1 40 TYR HE2 H 1.033 2.645 13.114 1.00 . A A . 40 TYR HE2 1 1 3 2566 1 1 40 TYR HH H 2.587 5.053 13.623 1.00 . A A . 40 TYR HH 1 1 3 2567 1 1 40 TYR N N -1.868 3.695 7.021 1.00 . A A . 40 TYR N 1 1 3 2568 1 1 40 TYR O O 1.418 3.953 7.893 1.00 . A A . 40 TYR O 1 1 3 2569 1 1 40 TYR OH O 1.667 5.067 13.893 1.00 . A A . 40 TYR OH 1 1 3 2570 1 1 41 ARG C C 2.206 1.373 6.619 1.00 . A A . 41 ARG C 1 1 3 2571 1 1 41 ARG CA C 1.496 1.182 7.958 1.00 . A A . 41 ARG CA 1 1 3 2572 1 1 41 ARG CB C 1.136 -0.294 8.154 1.00 . A A . 41 ARG CB 1 1 3 2573 1 1 41 ARG CD C 0.251 -0.693 10.472 1.00 . A A . 41 ARG CD 1 1 3 2574 1 1 41 ARG CG C 1.451 -0.817 9.545 1.00 . A A . 41 ARG CG 1 1 3 2575 1 1 41 ARG CZ C 0.926 -2.005 12.446 1.00 . A A . 41 ARG CZ 1 1 3 2576 1 1 41 ARG H H -0.576 1.573 8.133 1.00 . A A . 41 ARG H 1 1 3 2577 1 1 41 ARG HA H 2.163 1.487 8.750 1.00 . A A . 41 ARG HA 1 1 3 2578 1 1 41 ARG HB2 H 0.079 -0.420 7.977 1.00 . A A . 41 ARG HB2 1 1 3 2579 1 1 41 ARG HB3 H 1.685 -0.886 7.438 1.00 . A A . 41 ARG HB3 1 1 3 2580 1 1 41 ARG HD2 H -0.200 0.277 10.328 1.00 . A A . 41 ARG HD2 1 1 3 2581 1 1 41 ARG HD3 H -0.463 -1.462 10.216 1.00 . A A . 41 ARG HD3 1 1 3 2582 1 1 41 ARG HE H 0.656 -0.028 12.423 1.00 . A A . 41 ARG HE 1 1 3 2583 1 1 41 ARG HG2 H 1.732 -1.856 9.473 1.00 . A A . 41 ARG HG2 1 1 3 2584 1 1 41 ARG HG3 H 2.272 -0.248 9.956 1.00 . A A . 41 ARG HG3 1 1 3 2585 1 1 41 ARG HH11 H 0.649 -3.100 10.767 1.00 . A A . 41 ARG HH11 1 1 3 2586 1 1 41 ARG HH12 H 1.125 -3.998 12.170 1.00 . A A . 41 ARG HH12 1 1 3 2587 1 1 41 ARG HH21 H 1.280 -1.208 14.270 1.00 . A A . 41 ARG HH21 1 1 3 2588 1 1 41 ARG HH22 H 1.482 -2.925 14.158 1.00 . A A . 41 ARG HH22 1 1 3 2589 1 1 41 ARG N N 0.297 2.007 8.042 1.00 . A A . 41 ARG N 1 1 3 2590 1 1 41 ARG NE N 0.626 -0.840 11.876 1.00 . A A . 41 ARG NE 1 1 3 2591 1 1 41 ARG NH1 N 0.898 -3.127 11.735 1.00 . A A . 41 ARG NH1 1 1 3 2592 1 1 41 ARG NH2 N 1.256 -2.050 13.730 1.00 . A A . 41 ARG NH2 1 1 3 2593 1 1 41 ARG O O 3.425 1.231 6.528 1.00 . A A . 41 ARG O 1 1 3 2594 1 1 42 LEU C C 3.096 2.949 4.265 1.00 . A A . 42 LEU C 1 1 3 2595 1 1 42 LEU CA C 1.992 1.894 4.250 1.00 . A A . 42 LEU CA 1 1 3 2596 1 1 42 LEU CB C 0.890 2.312 3.274 1.00 . A A . 42 LEU CB 1 1 3 2597 1 1 42 LEU CD1 C -1.300 1.691 2.225 1.00 . A A . 42 LEU CD1 1 1 3 2598 1 1 42 LEU CD2 C 0.773 0.418 1.635 1.00 . A A . 42 LEU CD2 1 1 3 2599 1 1 42 LEU CG C 0.032 1.165 2.736 1.00 . A A . 42 LEU CG 1 1 3 2600 1 1 42 LEU H H 0.469 1.785 5.716 1.00 . A A . 42 LEU H 1 1 3 2601 1 1 42 LEU HA H 2.413 0.956 3.920 1.00 . A A . 42 LEU HA 1 1 3 2602 1 1 42 LEU HB2 H 0.242 3.014 3.778 1.00 . A A . 42 LEU HB2 1 1 3 2603 1 1 42 LEU HB3 H 1.351 2.811 2.435 1.00 . A A . 42 LEU HB3 1 1 3 2604 1 1 42 LEU HD11 H -2.053 1.563 2.989 1.00 . A A . 42 LEU HD11 1 1 3 2605 1 1 42 LEU HD12 H -1.588 1.146 1.340 1.00 . A A . 42 LEU HD12 1 1 3 2606 1 1 42 LEU HD13 H -1.206 2.741 1.989 1.00 . A A . 42 LEU HD13 1 1 3 2607 1 1 42 LEU HD21 H 0.614 -0.644 1.750 1.00 . A A . 42 LEU HD21 1 1 3 2608 1 1 42 LEU HD22 H 1.829 0.633 1.701 1.00 . A A . 42 LEU HD22 1 1 3 2609 1 1 42 LEU HD23 H 0.401 0.736 0.672 1.00 . A A . 42 LEU HD23 1 1 3 2610 1 1 42 LEU HG H -0.168 0.469 3.536 1.00 . A A . 42 LEU HG 1 1 3 2611 1 1 42 LEU N N 1.436 1.689 5.583 1.00 . A A . 42 LEU N 1 1 3 2612 1 1 42 LEU O O 4.096 2.824 3.558 1.00 . A A . 42 LEU O 1 1 3 2613 1 1 43 GLU C C 5.186 4.575 5.799 1.00 . A A . 43 GLU C 1 1 3 2614 1 1 43 GLU CA C 3.882 5.065 5.174 1.00 . A A . 43 GLU CA 1 1 3 2615 1 1 43 GLU CB C 3.310 6.218 6.003 1.00 . A A . 43 GLU CB 1 1 3 2616 1 1 43 GLU CD C 3.853 8.349 7.244 1.00 . A A . 43 GLU CD 1 1 3 2617 1 1 43 GLU CG C 4.252 7.404 6.127 1.00 . A A . 43 GLU CG 1 1 3 2618 1 1 43 GLU H H 2.086 4.030 5.607 1.00 . A A . 43 GLU H 1 1 3 2619 1 1 43 GLU HA H 4.088 5.421 4.176 1.00 . A A . 43 GLU HA 1 1 3 2620 1 1 43 GLU HB2 H 2.395 6.559 5.540 1.00 . A A . 43 GLU HB2 1 1 3 2621 1 1 43 GLU HB3 H 3.088 5.856 6.996 1.00 . A A . 43 GLU HB3 1 1 3 2622 1 1 43 GLU HG2 H 5.248 7.039 6.325 1.00 . A A . 43 GLU HG2 1 1 3 2623 1 1 43 GLU HG3 H 4.248 7.950 5.195 1.00 . A A . 43 GLU HG3 1 1 3 2624 1 1 43 GLU N N 2.905 3.986 5.071 1.00 . A A . 43 GLU N 1 1 3 2625 1 1 43 GLU O O 6.243 5.172 5.596 1.00 . A A . 43 GLU O 1 1 3 2626 1 1 43 GLU OE1 O 2.645 8.634 7.379 1.00 . A A . 43 GLU OE1 1 1 3 2627 1 1 43 GLU OE2 O 4.750 8.806 7.983 1.00 . A A . 43 GLU OE2 1 1 3 2628 1 1 44 ILE C C 7.038 1.975 6.295 1.00 . A A . 44 ILE C 1 1 3 2629 1 1 44 ILE CA C 6.284 2.930 7.218 1.00 . A A . 44 ILE CA 1 1 3 2630 1 1 44 ILE CB C 5.906 2.185 8.508 1.00 . A A . 44 ILE CB 1 1 3 2631 1 1 44 ILE CD1 C 5.086 2.798 10.853 1.00 . A A . 44 ILE CD1 1 1 3 2632 1 1 44 ILE CG1 C 4.985 3.062 9.367 1.00 . A A . 44 ILE CG1 1 1 3 2633 1 1 44 ILE CG2 C 7.163 1.788 9.273 1.00 . A A . 44 ILE CG2 1 1 3 2634 1 1 44 ILE H H 4.239 3.057 6.693 1.00 . A A . 44 ILE H 1 1 3 2635 1 1 44 ILE HA H 6.937 3.749 7.484 1.00 . A A . 44 ILE HA 1 1 3 2636 1 1 44 ILE HB H 5.381 1.282 8.235 1.00 . A A . 44 ILE HB 1 1 3 2637 1 1 44 ILE HD11 H 6.094 3.001 11.183 1.00 . A A . 44 ILE HD11 1 1 3 2638 1 1 44 ILE HD12 H 4.843 1.764 11.052 1.00 . A A . 44 ILE HD12 1 1 3 2639 1 1 44 ILE HD13 H 4.396 3.440 11.381 1.00 . A A . 44 ILE HD13 1 1 3 2640 1 1 44 ILE HG12 H 5.231 4.100 9.200 1.00 . A A . 44 ILE HG12 1 1 3 2641 1 1 44 ILE HG13 H 3.959 2.891 9.069 1.00 . A A . 44 ILE HG13 1 1 3 2642 1 1 44 ILE HG21 H 6.977 0.878 9.825 1.00 . A A . 44 ILE HG21 1 1 3 2643 1 1 44 ILE HG22 H 7.431 2.577 9.959 1.00 . A A . 44 ILE HG22 1 1 3 2644 1 1 44 ILE HG23 H 7.973 1.626 8.576 1.00 . A A . 44 ILE HG23 1 1 3 2645 1 1 44 ILE N N 5.108 3.489 6.563 1.00 . A A . 44 ILE N 1 1 3 2646 1 1 44 ILE O O 8.258 2.073 6.146 1.00 . A A . 44 ILE O 1 1 3 2647 1 1 45 VAL C C 7.577 0.754 3.591 1.00 . A A . 45 VAL C 1 1 3 2648 1 1 45 VAL CA C 6.909 0.075 4.778 1.00 . A A . 45 VAL CA 1 1 3 2649 1 1 45 VAL CB C 5.866 -0.928 4.250 1.00 . A A . 45 VAL CB 1 1 3 2650 1 1 45 VAL CG1 C 5.569 -1.993 5.295 1.00 . A A . 45 VAL CG1 1 1 3 2651 1 1 45 VAL CG2 C 4.590 -0.212 3.830 1.00 . A A . 45 VAL CG2 1 1 3 2652 1 1 45 VAL H H 5.342 1.022 5.843 1.00 . A A . 45 VAL H 1 1 3 2653 1 1 45 VAL HA H 7.656 -0.475 5.332 1.00 . A A . 45 VAL HA 1 1 3 2654 1 1 45 VAL HB H 6.279 -1.414 3.379 1.00 . A A . 45 VAL HB 1 1 3 2655 1 1 45 VAL HG11 H 6.217 -2.842 5.135 1.00 . A A . 45 VAL HG11 1 1 3 2656 1 1 45 VAL HG12 H 4.539 -2.304 5.209 1.00 . A A . 45 VAL HG12 1 1 3 2657 1 1 45 VAL HG13 H 5.742 -1.587 6.280 1.00 . A A . 45 VAL HG13 1 1 3 2658 1 1 45 VAL HG21 H 3.985 -0.877 3.231 1.00 . A A . 45 VAL HG21 1 1 3 2659 1 1 45 VAL HG22 H 4.842 0.664 3.249 1.00 . A A . 45 VAL HG22 1 1 3 2660 1 1 45 VAL HG23 H 4.036 0.086 4.708 1.00 . A A . 45 VAL HG23 1 1 3 2661 1 1 45 VAL N N 6.308 1.052 5.682 1.00 . A A . 45 VAL N 1 1 3 2662 1 1 45 VAL O O 8.628 0.317 3.121 1.00 . A A . 45 VAL O 1 1 3 2663 1 1 46 THR C C 8.599 3.518 2.375 1.00 . A A . 46 THR C 1 1 3 2664 1 1 46 THR CA C 7.477 2.562 1.966 1.00 . A A . 46 THR CA 1 1 3 2665 1 1 46 THR CB C 6.342 3.343 1.307 1.00 . A A . 46 THR CB 1 1 3 2666 1 1 46 THR CG2 C 5.281 2.455 0.695 1.00 . A A . 46 THR CG2 1 1 3 2667 1 1 46 THR H H 6.120 2.114 3.515 1.00 . A A . 46 THR H 1 1 3 2668 1 1 46 THR HA H 7.866 1.850 1.256 1.00 . A A . 46 THR HA 1 1 3 2669 1 1 46 THR HB H 6.753 3.957 0.525 1.00 . A A . 46 THR HB 1 1 3 2670 1 1 46 THR HG1 H 4.968 4.640 1.829 1.00 . A A . 46 THR HG1 1 1 3 2671 1 1 46 THR HG21 H 5.752 1.603 0.226 1.00 . A A . 46 THR HG21 1 1 3 2672 1 1 46 THR HG22 H 4.728 3.014 -0.045 1.00 . A A . 46 THR HG22 1 1 3 2673 1 1 46 THR HG23 H 4.607 2.115 1.467 1.00 . A A . 46 THR HG23 1 1 3 2674 1 1 46 THR N N 6.956 1.820 3.103 1.00 . A A . 46 THR N 1 1 3 2675 1 1 46 THR O O 9.056 4.326 1.565 1.00 . A A . 46 THR O 1 1 3 2676 1 1 46 THR OG1 O 5.705 4.191 2.249 1.00 . A A . 46 THR OG1 1 1 3 2677 1 1 47 ALA C C 9.663 5.748 4.160 1.00 . A A . 47 ALA C 1 1 3 2678 1 1 47 ALA CA C 10.108 4.291 4.125 1.00 . A A . 47 ALA CA 1 1 3 2679 1 1 47 ALA CB C 11.359 4.136 3.269 1.00 . A A . 47 ALA CB 1 1 3 2680 1 1 47 ALA H H 8.644 2.771 4.233 1.00 . A A . 47 ALA H 1 1 3 2681 1 1 47 ALA HA H 10.349 3.975 5.130 1.00 . A A . 47 ALA HA 1 1 3 2682 1 1 47 ALA HB1 H 12.041 3.452 3.751 1.00 . A A . 47 ALA HB1 1 1 3 2683 1 1 47 ALA HB2 H 11.836 5.098 3.151 1.00 . A A . 47 ALA HB2 1 1 3 2684 1 1 47 ALA HB3 H 11.085 3.748 2.299 1.00 . A A . 47 ALA HB3 1 1 3 2685 1 1 47 ALA N N 9.041 3.430 3.628 1.00 . A A . 47 ALA N 1 1 3 2686 1 1 47 ALA O O 10.475 6.660 4.003 1.00 . A A . 47 ALA O 1 1 3 2687 1 1 48 GLY C C 7.629 7.920 3.052 1.00 . A A . 48 GLY C 1 1 3 2688 1 1 48 GLY CA C 7.836 7.309 4.427 1.00 . A A . 48 GLY CA 1 1 3 2689 1 1 48 GLY H H 7.769 5.194 4.493 1.00 . A A . 48 GLY H 1 1 3 2690 1 1 48 GLY HA2 H 6.889 7.288 4.944 1.00 . A A . 48 GLY HA2 1 1 3 2691 1 1 48 GLY HA3 H 8.523 7.930 4.983 1.00 . A A . 48 GLY HA3 1 1 3 2692 1 1 48 GLY N N 8.368 5.960 4.371 1.00 . A A . 48 GLY N 1 1 3 2693 1 1 48 GLY O O 7.336 9.111 2.937 1.00 . A A . 48 GLY O 1 1 3 2694 1 1 49 ALA C C 6.160 8.050 0.413 1.00 . A A . 49 ALA C 1 1 3 2695 1 1 49 ALA CA C 7.595 7.591 0.642 1.00 . A A . 49 ALA CA 1 1 3 2696 1 1 49 ALA CB C 7.972 6.506 -0.355 1.00 . A A . 49 ALA CB 1 1 3 2697 1 1 49 ALA H H 8.005 6.169 2.156 1.00 . A A . 49 ALA H 1 1 3 2698 1 1 49 ALA HA H 8.259 8.429 0.495 1.00 . A A . 49 ALA HA 1 1 3 2699 1 1 49 ALA HB1 H 7.324 6.566 -1.216 1.00 . A A . 49 ALA HB1 1 1 3 2700 1 1 49 ALA HB2 H 7.865 5.537 0.109 1.00 . A A . 49 ALA HB2 1 1 3 2701 1 1 49 ALA HB3 H 8.997 6.644 -0.666 1.00 . A A . 49 ALA HB3 1 1 3 2702 1 1 49 ALA N N 7.774 7.109 2.007 1.00 . A A . 49 ALA N 1 1 3 2703 1 1 49 ALA O O 5.918 9.050 -0.263 1.00 . A A . 49 ALA O 1 1 3 2704 1 1 50 LEU C C 3.253 8.220 2.151 1.00 . A A . 50 LEU C 1 1 3 2705 1 1 50 LEU CA C 3.801 7.647 0.848 1.00 . A A . 50 LEU CA 1 1 3 2706 1 1 50 LEU CB C 2.999 6.408 0.446 1.00 . A A . 50 LEU CB 1 1 3 2707 1 1 50 LEU CD1 C 2.153 4.864 -1.338 1.00 . A A . 50 LEU CD1 1 1 3 2708 1 1 50 LEU CD2 C 2.279 7.324 -1.775 1.00 . A A . 50 LEU CD2 1 1 3 2709 1 1 50 LEU CG C 2.922 6.146 -1.060 1.00 . A A . 50 LEU CG 1 1 3 2710 1 1 50 LEU H H 5.470 6.532 1.513 1.00 . A A . 50 LEU H 1 1 3 2711 1 1 50 LEU HA H 3.707 8.394 0.073 1.00 . A A . 50 LEU HA 1 1 3 2712 1 1 50 LEU HB2 H 3.448 5.546 0.918 1.00 . A A . 50 LEU HB2 1 1 3 2713 1 1 50 LEU HB3 H 1.992 6.519 0.820 1.00 . A A . 50 LEU HB3 1 1 3 2714 1 1 50 LEU HD11 H 2.826 4.022 -1.293 1.00 . A A . 50 LEU HD11 1 1 3 2715 1 1 50 LEU HD12 H 1.710 4.918 -2.322 1.00 . A A . 50 LEU HD12 1 1 3 2716 1 1 50 LEU HD13 H 1.376 4.745 -0.599 1.00 . A A . 50 LEU HD13 1 1 3 2717 1 1 50 LEU HD21 H 1.619 7.842 -1.093 1.00 . A A . 50 LEU HD21 1 1 3 2718 1 1 50 LEU HD22 H 1.712 6.966 -2.621 1.00 . A A . 50 LEU HD22 1 1 3 2719 1 1 50 LEU HD23 H 3.047 8.002 -2.116 1.00 . A A . 50 LEU HD23 1 1 3 2720 1 1 50 LEU HG H 3.924 6.025 -1.448 1.00 . A A . 50 LEU HG 1 1 3 2721 1 1 50 LEU N N 5.212 7.315 0.984 1.00 . A A . 50 LEU N 1 1 3 2722 1 1 50 LEU O O 3.314 7.575 3.197 1.00 . A A . 50 LEU O 1 1 3 2723 1 1 51 LYS C C 0.767 9.587 3.563 1.00 . A A . 51 LYS C 1 1 3 2724 1 1 51 LYS CA C 2.172 10.099 3.258 1.00 . A A . 51 LYS CA 1 1 3 2725 1 1 51 LYS CB C 2.142 11.614 3.049 1.00 . A A . 51 LYS CB 1 1 3 2726 1 1 51 LYS CD C 3.579 12.637 1.255 1.00 . A A . 51 LYS CD 1 1 3 2727 1 1 51 LYS CE C 4.623 13.722 1.048 1.00 . A A . 51 LYS CE 1 1 3 2728 1 1 51 LYS CG C 3.501 12.206 2.711 1.00 . A A . 51 LYS CG 1 1 3 2729 1 1 51 LYS H H 2.707 9.903 1.218 1.00 . A A . 51 LYS H 1 1 3 2730 1 1 51 LYS HA H 2.814 9.872 4.095 1.00 . A A . 51 LYS HA 1 1 3 2731 1 1 51 LYS HB2 H 1.461 11.842 2.241 1.00 . A A . 51 LYS HB2 1 1 3 2732 1 1 51 LYS HB3 H 1.784 12.082 3.953 1.00 . A A . 51 LYS HB3 1 1 3 2733 1 1 51 LYS HD2 H 3.839 11.781 0.650 1.00 . A A . 51 LYS HD2 1 1 3 2734 1 1 51 LYS HD3 H 2.614 13.015 0.949 1.00 . A A . 51 LYS HD3 1 1 3 2735 1 1 51 LYS HE2 H 4.828 14.193 1.998 1.00 . A A . 51 LYS HE2 1 1 3 2736 1 1 51 LYS HE3 H 5.528 13.266 0.671 1.00 . A A . 51 LYS HE3 1 1 3 2737 1 1 51 LYS HG2 H 3.674 13.068 3.339 1.00 . A A . 51 LYS HG2 1 1 3 2738 1 1 51 LYS HG3 H 4.264 11.464 2.899 1.00 . A A . 51 LYS HG3 1 1 3 2739 1 1 51 LYS HZ1 H 3.688 14.311 -0.725 1.00 . A A . 51 LYS HZ1 1 1 3 2740 1 1 51 LYS HZ2 H 4.977 15.307 -0.266 1.00 . A A . 51 LYS HZ2 1 1 3 2741 1 1 51 LYS HZ3 H 3.498 15.410 0.549 1.00 . A A . 51 LYS HZ3 1 1 3 2742 1 1 51 LYS N N 2.724 9.436 2.081 1.00 . A A . 51 LYS N 1 1 3 2743 1 1 51 LYS NZ N 4.165 14.760 0.084 1.00 . A A . 51 LYS NZ 1 1 3 2744 1 1 51 LYS O O -0.066 9.452 2.667 1.00 . A A . 51 LYS O 1 1 3 2745 1 1 52 TYR C C -1.691 9.969 5.696 1.00 . A A . 52 TYR C 1 1 3 2746 1 1 52 TYR CA C -0.791 8.814 5.268 1.00 . A A . 52 TYR CA 1 1 3 2747 1 1 52 TYR CB C -0.621 7.816 6.421 1.00 . A A . 52 TYR CB 1 1 3 2748 1 1 52 TYR CD1 C -3.064 7.165 6.561 1.00 . A A . 52 TYR CD1 1 1 3 2749 1 1 52 TYR CD2 C -1.909 7.659 8.587 1.00 . A A . 52 TYR CD2 1 1 3 2750 1 1 52 TYR CE1 C -4.217 6.911 7.276 1.00 . A A . 52 TYR CE1 1 1 3 2751 1 1 52 TYR CE2 C -3.059 7.408 9.308 1.00 . A A . 52 TYR CE2 1 1 3 2752 1 1 52 TYR CG C -1.890 7.543 7.203 1.00 . A A . 52 TYR CG 1 1 3 2753 1 1 52 TYR CZ C -4.211 7.035 8.648 1.00 . A A . 52 TYR CZ 1 1 3 2754 1 1 52 TYR H H 1.217 9.438 5.506 1.00 . A A . 52 TYR H 1 1 3 2755 1 1 52 TYR HA H -1.247 8.308 4.431 1.00 . A A . 52 TYR HA 1 1 3 2756 1 1 52 TYR HB2 H -0.272 6.876 6.023 1.00 . A A . 52 TYR HB2 1 1 3 2757 1 1 52 TYR HB3 H 0.116 8.202 7.112 1.00 . A A . 52 TYR HB3 1 1 3 2758 1 1 52 TYR HD1 H -3.071 7.073 5.485 1.00 . A A . 52 TYR HD1 1 1 3 2759 1 1 52 TYR HD2 H -1.006 7.952 9.101 1.00 . A A . 52 TYR HD2 1 1 3 2760 1 1 52 TYR HE1 H -5.116 6.617 6.757 1.00 . A A . 52 TYR HE1 1 1 3 2761 1 1 52 TYR HE2 H -3.054 7.506 10.383 1.00 . A A . 52 TYR HE2 1 1 3 2762 1 1 52 TYR HH H -6.094 7.254 8.966 1.00 . A A . 52 TYR HH 1 1 3 2763 1 1 52 TYR N N 0.511 9.308 4.839 1.00 . A A . 52 TYR N 1 1 3 2764 1 1 52 TYR O O -1.304 10.800 6.516 1.00 . A A . 52 TYR O 1 1 3 2765 1 1 52 TYR OH O -5.358 6.783 9.364 1.00 . A A . 52 TYR OH 1 1 3 2766 1 1 53 GLN C C -5.115 10.471 6.069 1.00 . A A . 53 GLN C 1 1 3 2767 1 1 53 GLN CA C -3.850 11.061 5.459 1.00 . A A . 53 GLN CA 1 1 3 2768 1 1 53 GLN CB C -4.199 11.869 4.209 1.00 . A A . 53 GLN CB 1 1 3 2769 1 1 53 GLN CD C -2.380 13.621 4.193 1.00 . A A . 53 GLN CD 1 1 3 2770 1 1 53 GLN CG C -2.983 12.424 3.485 1.00 . A A . 53 GLN CG 1 1 3 2771 1 1 53 GLN H H -3.146 9.317 4.489 1.00 . A A . 53 GLN H 1 1 3 2772 1 1 53 GLN HA H -3.390 11.714 6.185 1.00 . A A . 53 GLN HA 1 1 3 2773 1 1 53 GLN HB2 H -4.740 11.234 3.523 1.00 . A A . 53 GLN HB2 1 1 3 2774 1 1 53 GLN HB3 H -4.831 12.696 4.493 1.00 . A A . 53 GLN HB3 1 1 3 2775 1 1 53 GLN HE21 H -0.552 13.043 3.668 1.00 . A A . 53 GLN HE21 1 1 3 2776 1 1 53 GLN HE22 H -0.640 14.496 4.598 1.00 . A A . 53 GLN HE22 1 1 3 2777 1 1 53 GLN HG2 H -2.234 11.650 3.420 1.00 . A A . 53 GLN HG2 1 1 3 2778 1 1 53 GLN HG3 H -3.277 12.724 2.490 1.00 . A A . 53 GLN HG3 1 1 3 2779 1 1 53 GLN N N -2.894 10.010 5.134 1.00 . A A . 53 GLN N 1 1 3 2780 1 1 53 GLN NE2 N -1.057 13.732 4.149 1.00 . A A . 53 GLN NE2 1 1 3 2781 1 1 53 GLN O O -5.916 9.845 5.376 1.00 . A A . 53 GLN O 1 1 3 2782 1 1 53 GLN OE1 O -3.095 14.439 4.773 1.00 . A A . 53 GLN OE1 1 1 3 2783 1 1 54 GLU C C -7.686 11.046 7.846 1.00 . A A . 54 GLU C 1 1 3 2784 1 1 54 GLU CA C -6.457 10.168 8.081 1.00 . A A . 54 GLU CA 1 1 3 2785 1 1 54 GLU CB C -6.163 10.076 9.579 1.00 . A A . 54 GLU CB 1 1 3 2786 1 1 54 GLU CD C -4.593 11.379 11.073 1.00 . A A . 54 GLU CD 1 1 3 2787 1 1 54 GLU CG C -5.847 11.419 10.221 1.00 . A A . 54 GLU CG 1 1 3 2788 1 1 54 GLU H H -4.614 11.187 7.867 1.00 . A A . 54 GLU H 1 1 3 2789 1 1 54 GLU HA H -6.663 9.177 7.706 1.00 . A A . 54 GLU HA 1 1 3 2790 1 1 54 GLU HB2 H -7.026 9.658 10.078 1.00 . A A . 54 GLU HB2 1 1 3 2791 1 1 54 GLU HB3 H -5.318 9.422 9.729 1.00 . A A . 54 GLU HB3 1 1 3 2792 1 1 54 GLU HG2 H -5.710 12.153 9.441 1.00 . A A . 54 GLU HG2 1 1 3 2793 1 1 54 GLU HG3 H -6.679 11.710 10.845 1.00 . A A . 54 GLU HG3 1 1 3 2794 1 1 54 GLU N N -5.289 10.679 7.370 1.00 . A A . 54 GLU N 1 1 3 2795 1 1 54 GLU O O -8.746 10.801 8.421 1.00 . A A . 54 GLU O 1 1 3 2796 1 1 54 GLU OE1 O -3.531 10.984 10.547 1.00 . A A . 54 GLU OE1 1 1 3 2797 1 1 54 GLU OE2 O -4.674 11.740 12.266 1.00 . A A . 54 GLU OE2 1 1 3 2798 1 1 55 ASN C C -9.886 12.182 6.253 1.00 . A A . 55 ASN C 1 1 3 2799 1 1 55 ASN CA C -8.657 12.966 6.702 1.00 . A A . 55 ASN CA 1 1 3 2800 1 1 55 ASN CB C -8.252 13.971 5.623 1.00 . A A . 55 ASN CB 1 1 3 2801 1 1 55 ASN CG C -7.305 15.033 6.147 1.00 . A A . 55 ASN CG 1 1 3 2802 1 1 55 ASN H H -6.683 12.219 6.567 1.00 . A A . 55 ASN H 1 1 3 2803 1 1 55 ASN HA H -8.897 13.498 7.607 1.00 . A A . 55 ASN HA 1 1 3 2804 1 1 55 ASN HB2 H -7.764 13.447 4.816 1.00 . A A . 55 ASN HB2 1 1 3 2805 1 1 55 ASN HB3 H -9.139 14.460 5.245 1.00 . A A . 55 ASN HB3 1 1 3 2806 1 1 55 ASN HD21 H -5.923 14.483 4.827 1.00 . A A . 55 ASN HD21 1 1 3 2807 1 1 55 ASN HD22 H -5.485 15.785 5.874 1.00 . A A . 55 ASN HD22 1 1 3 2808 1 1 55 ASN N N -7.547 12.066 7.000 1.00 . A A . 55 ASN N 1 1 3 2809 1 1 55 ASN ND2 N -6.118 15.107 5.556 1.00 . A A . 55 ASN ND2 1 1 3 2810 1 1 55 ASN O O -10.870 12.094 6.978 1.00 . A A . 55 ASN O 1 1 3 2811 1 1 55 ASN OD1 O -7.636 15.776 7.070 1.00 . A A . 55 ASN OD1 1 1 3 2812 1 1 56 ALA C C -11.170 9.586 5.362 1.00 . A A . 56 ALA C 1 1 3 2813 1 1 56 ALA CA C -10.910 10.829 4.516 1.00 . A A . 56 ALA CA 1 1 3 2814 1 1 56 ALA CB C -10.630 10.439 3.074 1.00 . A A . 56 ALA CB 1 1 3 2815 1 1 56 ALA H H -8.993 11.713 4.527 1.00 . A A . 56 ALA H 1 1 3 2816 1 1 56 ALA HA H -11.800 11.450 4.527 1.00 . A A . 56 ALA HA 1 1 3 2817 1 1 56 ALA HB1 H -9.936 11.145 2.641 1.00 . A A . 56 ALA HB1 1 1 3 2818 1 1 56 ALA HB2 H -11.550 10.446 2.509 1.00 . A A . 56 ALA HB2 1 1 3 2819 1 1 56 ALA HB3 H -10.190 9.449 3.048 1.00 . A A . 56 ALA HB3 1 1 3 2820 1 1 56 ALA N N -9.811 11.611 5.056 1.00 . A A . 56 ALA N 1 1 3 2821 1 1 56 ALA O O -12.230 8.962 5.262 1.00 . A A . 56 ALA O 1 1 3 2822 1 1 57 TYR C C -10.830 8.438 8.443 1.00 . A A . 57 TYR C 1 1 3 2823 1 1 57 TYR CA C -10.310 8.056 7.058 1.00 . A A . 57 TYR CA 1 1 3 2824 1 1 57 TYR CB C -8.964 7.357 7.179 1.00 . A A . 57 TYR CB 1 1 3 2825 1 1 57 TYR CD1 C -9.113 6.225 4.933 1.00 . A A . 57 TYR CD1 1 1 3 2826 1 1 57 TYR CD2 C -7.079 7.336 5.495 1.00 . A A . 57 TYR CD2 1 1 3 2827 1 1 57 TYR CE1 C -8.583 5.866 3.711 1.00 . A A . 57 TYR CE1 1 1 3 2828 1 1 57 TYR CE2 C -6.542 6.978 4.275 1.00 . A A . 57 TYR CE2 1 1 3 2829 1 1 57 TYR CG C -8.373 6.965 5.845 1.00 . A A . 57 TYR CG 1 1 3 2830 1 1 57 TYR CZ C -7.299 6.244 3.385 1.00 . A A . 57 TYR CZ 1 1 3 2831 1 1 57 TYR H H -9.377 9.760 6.232 1.00 . A A . 57 TYR H 1 1 3 2832 1 1 57 TYR HA H -11.020 7.377 6.599 1.00 . A A . 57 TYR HA 1 1 3 2833 1 1 57 TYR HB2 H -8.267 8.018 7.670 1.00 . A A . 57 TYR HB2 1 1 3 2834 1 1 57 TYR HB3 H -9.081 6.461 7.769 1.00 . A A . 57 TYR HB3 1 1 3 2835 1 1 57 TYR HD1 H -10.110 5.932 5.190 1.00 . A A . 57 TYR HD1 1 1 3 2836 1 1 57 TYR HD2 H -6.487 7.910 6.194 1.00 . A A . 57 TYR HD2 1 1 3 2837 1 1 57 TYR HE1 H -9.176 5.290 3.014 1.00 . A A . 57 TYR HE1 1 1 3 2838 1 1 57 TYR HE2 H -5.534 7.274 4.019 1.00 . A A . 57 TYR HE2 1 1 3 2839 1 1 57 TYR HH H -7.160 5.059 1.879 1.00 . A A . 57 TYR HH 1 1 3 2840 1 1 57 TYR N N -10.190 9.226 6.196 1.00 . A A . 57 TYR N 1 1 3 2841 1 1 57 TYR O O -10.660 7.689 9.405 1.00 . A A . 57 TYR O 1 1 3 2842 1 1 57 TYR OH O -6.768 5.886 2.167 1.00 . A A . 57 TYR OH 1 1 3 2843 1 1 58 ARG C C -13.410 9.526 10.038 1.00 . A A . 58 ARG C 1 1 3 2844 1 1 58 ARG CA C -12.000 10.076 9.808 1.00 . A A . 58 ARG CA 1 1 3 2845 1 1 58 ARG CB C -12.030 11.606 9.838 1.00 . A A . 58 ARG CB 1 1 3 2846 1 1 58 ARG CD C -13.340 13.194 11.283 1.00 . A A . 58 ARG CD 1 1 3 2847 1 1 58 ARG CG C -12.210 12.185 11.234 1.00 . A A . 58 ARG CG 1 1 3 2848 1 1 58 ARG CZ C -13.570 15.632 11.564 1.00 . A A . 58 ARG CZ 1 1 3 2849 1 1 58 ARG H H -11.570 10.159 7.740 1.00 . A A . 58 ARG H 1 1 3 2850 1 1 58 ARG HA H -11.360 9.722 10.596 1.00 . A A . 58 ARG HA 1 1 3 2851 1 1 58 ARG HB2 H -11.110 11.980 9.429 1.00 . A A . 58 ARG HB2 1 1 3 2852 1 1 58 ARG HB3 H -12.850 11.951 9.222 1.00 . A A . 58 ARG HB3 1 1 3 2853 1 1 58 ARG HD2 H -14.010 13.006 10.457 1.00 . A A . 58 ARG HD2 1 1 3 2854 1 1 58 ARG HD3 H -13.880 13.069 12.214 1.00 . A A . 58 ARG HD3 1 1 3 2855 1 1 58 ARG HE H -11.960 14.710 10.847 1.00 . A A . 58 ARG HE 1 1 3 2856 1 1 58 ARG HG2 H -12.420 11.381 11.921 1.00 . A A . 58 ARG HG2 1 1 3 2857 1 1 58 ARG HG3 H -11.290 12.675 11.526 1.00 . A A . 58 ARG HG3 1 1 3 2858 1 1 58 ARG HH11 H -15.200 14.567 12.129 1.00 . A A . 58 ARG HH11 1 1 3 2859 1 1 58 ARG HH12 H -15.330 16.284 12.316 1.00 . A A . 58 ARG HH12 1 1 3 2860 1 1 58 ARG HH21 H -12.130 16.967 11.093 1.00 . A A . 58 ARG HH21 1 1 3 2861 1 1 58 ARG HH22 H -13.590 17.646 11.727 1.00 . A A . 58 ARG HH22 1 1 3 2862 1 1 58 ARG N N -11.460 9.605 8.539 1.00 . A A . 58 ARG N 1 1 3 2863 1 1 58 ARG NE N -12.860 14.570 11.197 1.00 . A A . 58 ARG NE 1 1 3 2864 1 1 58 ARG NH1 N -14.800 15.481 12.042 1.00 . A A . 58 ARG NH1 1 1 3 2865 1 1 58 ARG NH2 N -13.060 16.848 11.453 1.00 . A A . 58 ARG NH2 1 1 3 2866 1 1 58 ARG O O -13.820 9.297 11.175 1.00 . A A . 58 ARG O 1 1 3 2867 1 1 59 GLN C C -15.830 7.961 7.792 1.00 . A A . 59 GLN C 1 1 3 2868 1 1 59 GLN CA C -15.500 8.789 9.029 1.00 . A A . 59 GLN CA 1 1 3 2869 1 1 59 GLN CB C -16.500 9.935 9.183 1.00 . A A . 59 GLN CB 1 1 3 2870 1 1 59 GLN CD C -16.600 11.448 11.205 1.00 . A A . 59 GLN CD 1 1 3 2871 1 1 59 GLN CG C -17.000 10.114 10.607 1.00 . A A . 59 GLN CG 1 1 3 2872 1 1 59 GLN H H -13.760 9.516 8.070 1.00 . A A . 59 GLN H 1 1 3 2873 1 1 59 GLN HA H -15.560 8.152 9.900 1.00 . A A . 59 GLN HA 1 1 3 2874 1 1 59 GLN HB2 H -16.030 10.854 8.870 1.00 . A A . 59 GLN HB2 1 1 3 2875 1 1 59 GLN HB3 H -17.350 9.742 8.545 1.00 . A A . 59 GLN HB3 1 1 3 2876 1 1 59 GLN HE21 H -16.910 10.744 13.040 1.00 . A A . 59 GLN HE21 1 1 3 2877 1 1 59 GLN HE22 H -16.370 12.385 12.943 1.00 . A A . 59 GLN HE22 1 1 3 2878 1 1 59 GLN HG2 H -18.080 10.050 10.604 1.00 . A A . 59 GLN HG2 1 1 3 2879 1 1 59 GLN HG3 H -16.600 9.324 11.220 1.00 . A A . 59 GLN HG3 1 1 3 2880 1 1 59 GLN N N -14.140 9.313 8.949 1.00 . A A . 59 GLN N 1 1 3 2881 1 1 59 GLN NE2 N -16.630 11.535 12.530 1.00 . A A . 59 GLN NE2 1 1 3 2882 1 1 59 GLN O O -15.860 8.479 6.676 1.00 . A A . 59 GLN O 1 1 3 2883 1 1 59 GLN OE1 O -16.270 12.391 10.485 1.00 . A A . 59 GLN OE1 1 1 3 2884 1 1 60 ALA C C -17.930 5.693 6.700 1.00 . A A . 60 ALA C 1 1 3 2885 1 1 60 ALA CA C -16.420 5.774 6.901 1.00 . A A . 60 ALA CA 1 1 3 2886 1 1 60 ALA CB C -15.850 4.390 7.159 1.00 . A A . 60 ALA CB 1 1 3 2887 1 1 60 ALA H H -16.050 6.318 8.912 1.00 . A A . 60 ALA H 1 1 3 2888 1 1 60 ALA HA H -15.970 6.165 6.001 1.00 . A A . 60 ALA HA 1 1 3 2889 1 1 60 ALA HB1 H -16.450 3.650 6.654 1.00 . A A . 60 ALA HB1 1 1 3 2890 1 1 60 ALA HB2 H -15.850 4.191 8.221 1.00 . A A . 60 ALA HB2 1 1 3 2891 1 1 60 ALA HB3 H -14.840 4.347 6.785 1.00 . A A . 60 ALA HB3 1 1 3 2892 1 1 60 ALA N N -16.090 6.673 7.999 1.00 . A A . 60 ALA N 1 1 3 2893 1 1 60 ALA O O -18.460 6.140 5.681 1.00 . A A . 60 ALA O 1 1 3 2894 1 1 61 ALA C C -20.720 5.253 8.965 1.00 . A A . 61 ALA C 1 1 3 2895 1 1 61 ALA CA C -20.080 4.979 7.611 1.00 . A A . 61 ALA CA 1 1 3 2896 1 1 61 ALA CB C -20.450 3.589 7.119 1.00 . A A . 61 ALA CB 1 1 3 2897 1 1 61 ALA H H -18.150 4.783 8.467 1.00 . A A . 61 ALA H 1 1 3 2898 1 1 61 ALA HA H -20.450 5.700 6.895 1.00 . A A . 61 ALA HA 1 1 3 2899 1 1 61 ALA HB1 H -20.220 2.864 7.885 1.00 . A A . 61 ALA HB1 1 1 3 2900 1 1 61 ALA HB2 H -19.890 3.361 6.226 1.00 . A A . 61 ALA HB2 1 1 3 2901 1 1 61 ALA HB3 H -21.500 3.557 6.895 1.00 . A A . 61 ALA HB3 1 1 3 2902 1 1 61 ALA N N -18.630 5.120 7.681 1.00 . A A . 61 ALA N 1 1 3 2903 1 1 61 ALA O O -20.080 4.954 9.995 1.00 . A A . 61 ALA O 1 1 3 2904 1 1 61 ALA OXT O -21.860 5.765 8.987 1.00 . A A . 61 ALA OXT 1 1 4 2905 1 1 1 MET C C -5.558 6.715 -1.384 1.00 . A A . 1 MET C 1 1 4 2906 1 1 1 MET CA C -4.856 7.844 -0.636 1.00 . A A . 1 MET CA 1 1 4 2907 1 1 1 MET CB C -3.360 7.550 -0.519 1.00 . A A . 1 MET CB 1 1 4 2908 1 1 1 MET CE C -0.732 6.661 2.058 1.00 . A A . 1 MET CE 1 1 4 2909 1 1 1 MET CG C -3.026 6.485 0.514 1.00 . A A . 1 MET CG 1 1 4 2910 1 1 1 MET H1 H -6.353 8.447 0.640 1.00 . A A . 1 MET H1 1 1 4 2911 1 1 1 MET H2 H -4.765 8.625 1.265 1.00 . A A . 1 MET H2 1 1 4 2912 1 1 1 MET H3 H -5.480 7.068 1.164 1.00 . A A . 1 MET H3 1 1 4 2913 1 1 1 MET HA H -4.996 8.766 -1.179 1.00 . A A . 1 MET HA 1 1 4 2914 1 1 1 MET HB2 H -2.995 7.216 -1.479 1.00 . A A . 1 MET HB2 1 1 4 2915 1 1 1 MET HB3 H -2.847 8.460 -0.246 1.00 . A A . 1 MET HB3 1 1 4 2916 1 1 1 MET HE1 H -0.625 5.766 2.655 1.00 . A A . 1 MET HE1 1 1 4 2917 1 1 1 MET HE2 H -0.114 7.445 2.470 1.00 . A A . 1 MET HE2 1 1 4 2918 1 1 1 MET HE3 H -0.426 6.454 1.044 1.00 . A A . 1 MET HE3 1 1 4 2919 1 1 1 MET HG2 H -3.914 5.902 0.707 1.00 . A A . 1 MET HG2 1 1 4 2920 1 1 1 MET HG3 H -2.256 5.843 0.113 1.00 . A A . 1 MET HG3 1 1 4 2921 1 1 1 MET N N -5.415 8.011 0.731 1.00 . A A . 1 MET N 1 1 4 2922 1 1 1 MET O O -6.130 5.812 -0.774 1.00 . A A . 1 MET O 1 1 4 2923 1 1 1 MET SD S -2.445 7.185 2.071 1.00 . A A . 1 MET SD 1 1 4 2924 1 1 2 TYR C C -5.235 4.539 -3.696 1.00 . A A . 2 TYR C 1 1 4 2925 1 1 2 TYR CA C -6.140 5.757 -3.545 1.00 . A A . 2 TYR CA 1 1 4 2926 1 1 2 TYR CB C -6.473 6.334 -4.923 1.00 . A A . 2 TYR CB 1 1 4 2927 1 1 2 TYR CD1 C -8.309 7.771 -3.953 1.00 . A A . 2 TYR CD1 1 1 4 2928 1 1 2 TYR CD2 C -8.652 6.809 -6.107 1.00 . A A . 2 TYR CD2 1 1 4 2929 1 1 2 TYR CE1 C -9.555 8.366 -4.016 1.00 . A A . 2 TYR CE1 1 1 4 2930 1 1 2 TYR CE2 C -9.899 7.401 -6.178 1.00 . A A . 2 TYR CE2 1 1 4 2931 1 1 2 TYR CG C -7.838 6.983 -4.996 1.00 . A A . 2 TYR CG 1 1 4 2932 1 1 2 TYR CZ C -10.340 8.179 -5.130 1.00 . A A . 2 TYR CZ 1 1 4 2933 1 1 2 TYR H H -5.038 7.519 -3.139 1.00 . A A . 2 TYR H 1 1 4 2934 1 1 2 TYR HA H -7.057 5.453 -3.062 1.00 . A A . 2 TYR HA 1 1 4 2935 1 1 2 TYR HB2 H -5.737 7.080 -5.180 1.00 . A A . 2 TYR HB2 1 1 4 2936 1 1 2 TYR HB3 H -6.444 5.539 -5.654 1.00 . A A . 2 TYR HB3 1 1 4 2937 1 1 2 TYR HD1 H -7.688 7.917 -3.082 1.00 . A A . 2 TYR HD1 1 1 4 2938 1 1 2 TYR HD2 H -8.299 6.201 -6.926 1.00 . A A . 2 TYR HD2 1 1 4 2939 1 1 2 TYR HE1 H -9.905 8.975 -3.195 1.00 . A A . 2 TYR HE1 1 1 4 2940 1 1 2 TYR HE2 H -10.510 7.253 -7.051 1.00 . A A . 2 TYR HE2 1 1 4 2941 1 1 2 TYR HH H -11.530 9.662 -4.847 1.00 . A A . 2 TYR HH 1 1 4 2942 1 1 2 TYR N N -5.509 6.773 -2.712 1.00 . A A . 2 TYR N 1 1 4 2943 1 1 2 TYR O O -4.024 4.623 -3.496 1.00 . A A . 2 TYR O 1 1 4 2944 1 1 2 TYR OH O -11.580 8.769 -5.196 1.00 . A A . 2 TYR OH 1 1 4 2945 1 1 3 LYS C C -4.120 2.279 -5.409 1.00 . A A . 3 LYS C 1 1 4 2946 1 1 3 LYS CA C -5.083 2.168 -4.231 1.00 . A A . 3 LYS CA 1 1 4 2947 1 1 3 LYS CB C -6.041 0.997 -4.451 1.00 . A A . 3 LYS CB 1 1 4 2948 1 1 3 LYS CD C -5.499 -1.220 -5.513 1.00 . A A . 3 LYS CD 1 1 4 2949 1 1 3 LYS CE C -6.768 -2.058 -5.513 1.00 . A A . 3 LYS CE 1 1 4 2950 1 1 3 LYS CG C -5.393 -0.366 -4.259 1.00 . A A . 3 LYS CG 1 1 4 2951 1 1 3 LYS H H -6.802 3.403 -4.199 1.00 . A A . 3 LYS H 1 1 4 2952 1 1 3 LYS HA H -4.514 1.993 -3.331 1.00 . A A . 3 LYS HA 1 1 4 2953 1 1 3 LYS HB2 H -6.861 1.081 -3.752 1.00 . A A . 3 LYS HB2 1 1 4 2954 1 1 3 LYS HB3 H -6.430 1.049 -5.457 1.00 . A A . 3 LYS HB3 1 1 4 2955 1 1 3 LYS HD2 H -5.508 -0.572 -6.377 1.00 . A A . 3 LYS HD2 1 1 4 2956 1 1 3 LYS HD3 H -4.644 -1.876 -5.563 1.00 . A A . 3 LYS HD3 1 1 4 2957 1 1 3 LYS HE2 H -6.506 -3.084 -5.304 1.00 . A A . 3 LYS HE2 1 1 4 2958 1 1 3 LYS HE3 H -7.427 -1.691 -4.739 1.00 . A A . 3 LYS HE3 1 1 4 2959 1 1 3 LYS HG2 H -4.349 -0.226 -4.019 1.00 . A A . 3 LYS HG2 1 1 4 2960 1 1 3 LYS HG3 H -5.887 -0.876 -3.444 1.00 . A A . 3 LYS HG3 1 1 4 2961 1 1 3 LYS HZ1 H -6.861 -2.360 -7.578 1.00 . A A . 3 LYS HZ1 1 1 4 2962 1 1 3 LYS HZ2 H -7.731 -1.012 -7.043 1.00 . A A . 3 LYS HZ2 1 1 4 2963 1 1 3 LYS HZ3 H -8.342 -2.568 -6.788 1.00 . A A . 3 LYS HZ3 1 1 4 2964 1 1 3 LYS N N -5.833 3.405 -4.053 1.00 . A A . 3 LYS N 1 1 4 2965 1 1 3 LYS NZ N -7.475 -1.995 -6.821 1.00 . A A . 3 LYS NZ 1 1 4 2966 1 1 3 LYS O O -3.032 1.706 -5.391 1.00 . A A . 3 LYS O 1 1 4 2967 1 1 4 LYS C C -2.303 3.673 -7.260 1.00 . A A . 4 LYS C 1 1 4 2968 1 1 4 LYS CA C -3.711 3.210 -7.626 1.00 . A A . 4 LYS CA 1 1 4 2969 1 1 4 LYS CB C -4.366 4.226 -8.564 1.00 . A A . 4 LYS CB 1 1 4 2970 1 1 4 LYS CD C -2.915 5.833 -9.846 1.00 . A A . 4 LYS CD 1 1 4 2971 1 1 4 LYS CE C -3.939 6.955 -9.935 1.00 . A A . 4 LYS CE 1 1 4 2972 1 1 4 LYS CG C -3.582 4.467 -9.846 1.00 . A A . 4 LYS CG 1 1 4 2973 1 1 4 LYS H H -5.411 3.450 -6.388 1.00 . A A . 4 LYS H 1 1 4 2974 1 1 4 LYS HA H -3.642 2.259 -8.135 1.00 . A A . 4 LYS HA 1 1 4 2975 1 1 4 LYS HB2 H -5.350 3.870 -8.831 1.00 . A A . 4 LYS HB2 1 1 4 2976 1 1 4 LYS HB3 H -4.463 5.168 -8.043 1.00 . A A . 4 LYS HB3 1 1 4 2977 1 1 4 LYS HD2 H -2.351 5.948 -8.932 1.00 . A A . 4 LYS HD2 1 1 4 2978 1 1 4 LYS HD3 H -2.248 5.899 -10.693 1.00 . A A . 4 LYS HD3 1 1 4 2979 1 1 4 LYS HE2 H -4.803 6.593 -10.472 1.00 . A A . 4 LYS HE2 1 1 4 2980 1 1 4 LYS HE3 H -4.231 7.238 -8.934 1.00 . A A . 4 LYS HE3 1 1 4 2981 1 1 4 LYS HG2 H -2.820 3.707 -9.938 1.00 . A A . 4 LYS HG2 1 1 4 2982 1 1 4 LYS HG3 H -4.258 4.407 -10.686 1.00 . A A . 4 LYS HG3 1 1 4 2983 1 1 4 LYS HZ1 H -4.138 8.589 -11.219 1.00 . A A . 4 LYS HZ1 1 1 4 2984 1 1 4 LYS HZ2 H -2.607 7.871 -11.256 1.00 . A A . 4 LYS HZ2 1 1 4 2985 1 1 4 LYS HZ3 H -3.052 8.846 -9.947 1.00 . A A . 4 LYS HZ3 1 1 4 2986 1 1 4 LYS N N -4.532 3.020 -6.433 1.00 . A A . 4 LYS N 1 1 4 2987 1 1 4 LYS NZ N -3.396 8.149 -10.639 1.00 . A A . 4 LYS NZ 1 1 4 2988 1 1 4 LYS O O -1.314 3.161 -7.787 1.00 . A A . 4 LYS O 1 1 4 2989 1 1 5 ASP C C -0.084 4.077 -5.283 1.00 . A A . 5 ASP C 1 1 4 2990 1 1 5 ASP CA C -0.930 5.172 -5.922 1.00 . A A . 5 ASP CA 1 1 4 2991 1 1 5 ASP CB C -1.132 6.321 -4.934 1.00 . A A . 5 ASP CB 1 1 4 2992 1 1 5 ASP CG C 0.082 7.225 -4.843 1.00 . A A . 5 ASP CG 1 1 4 2993 1 1 5 ASP H H -3.041 5.010 -5.969 1.00 . A A . 5 ASP H 1 1 4 2994 1 1 5 ASP HA H -0.414 5.543 -6.795 1.00 . A A . 5 ASP HA 1 1 4 2995 1 1 5 ASP HB2 H -1.977 6.915 -5.248 1.00 . A A . 5 ASP HB2 1 1 4 2996 1 1 5 ASP HB3 H -1.329 5.913 -3.953 1.00 . A A . 5 ASP HB3 1 1 4 2997 1 1 5 ASP N N -2.218 4.643 -6.355 1.00 . A A . 5 ASP N 1 1 4 2998 1 1 5 ASP O O 1.063 3.860 -5.672 1.00 . A A . 5 ASP O 1 1 4 2999 1 1 5 ASP OD1 O 1.215 6.699 -4.862 1.00 . A A . 5 ASP OD1 1 1 4 3000 1 1 5 ASP OD2 O -0.101 8.457 -4.753 1.00 . A A . 5 ASP OD2 1 1 4 3001 1 1 6 VAL C C 0.507 1.251 -4.596 1.00 . A A . 6 VAL C 1 1 4 3002 1 1 6 VAL CA C 0.032 2.316 -3.613 1.00 . A A . 6 VAL CA 1 1 4 3003 1 1 6 VAL CB C -0.877 1.659 -2.559 1.00 . A A . 6 VAL CB 1 1 4 3004 1 1 6 VAL CG1 C -0.042 0.890 -1.562 1.00 . A A . 6 VAL CG1 1 1 4 3005 1 1 6 VAL CG2 C -1.733 2.697 -1.847 1.00 . A A . 6 VAL CG2 1 1 4 3006 1 1 6 VAL H H -1.573 3.600 -4.037 1.00 . A A . 6 VAL H 1 1 4 3007 1 1 6 VAL HA H 0.889 2.738 -3.109 1.00 . A A . 6 VAL HA 1 1 4 3008 1 1 6 VAL HB H -1.534 0.963 -3.061 1.00 . A A . 6 VAL HB 1 1 4 3009 1 1 6 VAL HG11 H 0.504 0.116 -2.076 1.00 . A A . 6 VAL HG11 1 1 4 3010 1 1 6 VAL HG12 H -0.686 0.450 -0.820 1.00 . A A . 6 VAL HG12 1 1 4 3011 1 1 6 VAL HG13 H 0.651 1.567 -1.089 1.00 . A A . 6 VAL HG13 1 1 4 3012 1 1 6 VAL HG21 H -1.206 3.640 -1.818 1.00 . A A . 6 VAL HG21 1 1 4 3013 1 1 6 VAL HG22 H -1.935 2.367 -0.839 1.00 . A A . 6 VAL HG22 1 1 4 3014 1 1 6 VAL HG23 H -2.665 2.822 -2.378 1.00 . A A . 6 VAL HG23 1 1 4 3015 1 1 6 VAL N N -0.660 3.387 -4.303 1.00 . A A . 6 VAL N 1 1 4 3016 1 1 6 VAL O O 1.669 0.847 -4.578 1.00 . A A . 6 VAL O 1 1 4 3017 1 1 7 ILE C C 1.043 0.267 -7.375 1.00 . A A . 7 ILE C 1 1 4 3018 1 1 7 ILE CA C -0.078 -0.207 -6.455 1.00 . A A . 7 ILE CA 1 1 4 3019 1 1 7 ILE CB C -1.318 -0.566 -7.303 1.00 . A A . 7 ILE CB 1 1 4 3020 1 1 7 ILE CD1 C -1.916 -2.419 -5.662 1.00 . A A . 7 ILE CD1 1 1 4 3021 1 1 7 ILE CG1 C -2.397 -1.206 -6.427 1.00 . A A . 7 ILE CG1 1 1 4 3022 1 1 7 ILE CG2 C -0.938 -1.497 -8.446 1.00 . A A . 7 ILE CG2 1 1 4 3023 1 1 7 ILE H H -1.310 1.171 -5.424 1.00 . A A . 7 ILE H 1 1 4 3024 1 1 7 ILE HA H 0.246 -1.096 -5.934 1.00 . A A . 7 ILE HA 1 1 4 3025 1 1 7 ILE HB H -1.708 0.345 -7.731 1.00 . A A . 7 ILE HB 1 1 4 3026 1 1 7 ILE HD11 H -1.495 -3.137 -6.351 1.00 . A A . 7 ILE HD11 1 1 4 3027 1 1 7 ILE HD12 H -2.747 -2.866 -5.137 1.00 . A A . 7 ILE HD12 1 1 4 3028 1 1 7 ILE HD13 H -1.160 -2.120 -4.951 1.00 . A A . 7 ILE HD13 1 1 4 3029 1 1 7 ILE HG12 H -2.746 -0.481 -5.708 1.00 . A A . 7 ILE HG12 1 1 4 3030 1 1 7 ILE HG13 H -3.224 -1.515 -7.050 1.00 . A A . 7 ILE HG13 1 1 4 3031 1 1 7 ILE HG21 H -0.232 -0.998 -9.094 1.00 . A A . 7 ILE HG21 1 1 4 3032 1 1 7 ILE HG22 H -1.823 -1.754 -9.010 1.00 . A A . 7 ILE HG22 1 1 4 3033 1 1 7 ILE HG23 H -0.489 -2.394 -8.047 1.00 . A A . 7 ILE HG23 1 1 4 3034 1 1 7 ILE N N -0.401 0.806 -5.458 1.00 . A A . 7 ILE N 1 1 4 3035 1 1 7 ILE O O 1.835 -0.534 -7.870 1.00 . A A . 7 ILE O 1 1 4 3036 1 1 8 ASP C C 3.464 2.232 -7.716 1.00 . A A . 8 ASP C 1 1 4 3037 1 1 8 ASP CA C 2.131 2.159 -8.451 1.00 . A A . 8 ASP CA 1 1 4 3038 1 1 8 ASP CB C 1.705 3.556 -8.909 1.00 . A A . 8 ASP CB 1 1 4 3039 1 1 8 ASP CG C 1.715 3.697 -10.418 1.00 . A A . 8 ASP CG 1 1 4 3040 1 1 8 ASP H H 0.450 2.164 -7.171 1.00 . A A . 8 ASP H 1 1 4 3041 1 1 8 ASP HA H 2.242 1.523 -9.317 1.00 . A A . 8 ASP HA 1 1 4 3042 1 1 8 ASP HB2 H 0.706 3.755 -8.553 1.00 . A A . 8 ASP HB2 1 1 4 3043 1 1 8 ASP HB3 H 2.383 4.288 -8.493 1.00 . A A . 8 ASP HB3 1 1 4 3044 1 1 8 ASP N N 1.106 1.575 -7.595 1.00 . A A . 8 ASP N 1 1 4 3045 1 1 8 ASP O O 4.527 2.242 -8.337 1.00 . A A . 8 ASP O 1 1 4 3046 1 1 8 ASP OD1 O 1.512 2.677 -11.110 1.00 . A A . 8 ASP OD1 1 1 4 3047 1 1 8 ASP OD2 O 1.922 4.826 -10.908 1.00 . A A . 8 ASP OD2 1 1 4 3048 1 1 9 HIS C C 5.166 0.949 -5.332 1.00 . A A . 9 HIS C 1 1 4 3049 1 1 9 HIS CA C 4.597 2.346 -5.569 1.00 . A A . 9 HIS CA 1 1 4 3050 1 1 9 HIS CB C 4.285 3.024 -4.232 1.00 . A A . 9 HIS CB 1 1 4 3051 1 1 9 HIS CD2 C 5.908 2.010 -2.479 1.00 . A A . 9 HIS CD2 1 1 4 3052 1 1 9 HIS CE1 C 7.140 3.788 -2.114 1.00 . A A . 9 HIS CE1 1 1 4 3053 1 1 9 HIS CG C 5.429 3.006 -3.262 1.00 . A A . 9 HIS CG 1 1 4 3054 1 1 9 HIS H H 2.523 2.263 -5.952 1.00 . A A . 9 HIS H 1 1 4 3055 1 1 9 HIS HA H 5.324 2.935 -6.102 1.00 . A A . 9 HIS HA 1 1 4 3056 1 1 9 HIS HB2 H 4.023 4.057 -4.412 1.00 . A A . 9 HIS HB2 1 1 4 3057 1 1 9 HIS HB3 H 3.449 2.523 -3.769 1.00 . A A . 9 HIS HB3 1 1 4 3058 1 1 9 HIS HD1 H 6.127 4.988 -3.425 1.00 . A A . 9 HIS HD1 1 1 4 3059 1 1 9 HIS HD2 H 5.525 1.002 -2.418 1.00 . A A . 9 HIS HD2 1 1 4 3060 1 1 9 HIS HE1 H 7.897 4.450 -1.723 1.00 . A A . 9 HIS HE1 1 1 4 3061 1 1 9 HIS HE2 H 7.573 2.008 -1.200 1.00 . A A . 9 HIS HE2 1 1 4 3062 1 1 9 HIS N N 3.398 2.277 -6.389 1.00 . A A . 9 HIS N 1 1 4 3063 1 1 9 HIS ND1 N 6.221 4.106 -3.010 1.00 . A A . 9 HIS ND1 1 1 4 3064 1 1 9 HIS NE2 N 6.971 2.523 -1.777 1.00 . A A . 9 HIS NE2 1 1 4 3065 1 1 9 HIS O O 6.378 0.776 -5.199 1.00 . A A . 9 HIS O 1 1 4 3066 1 1 10 PHE C C 4.868 -2.160 -6.377 1.00 . A A . 10 PHE C 1 1 4 3067 1 1 10 PHE CA C 4.687 -1.420 -5.055 1.00 . A A . 10 PHE CA 1 1 4 3068 1 1 10 PHE CB C 3.654 -2.138 -4.191 1.00 . A A . 10 PHE CB 1 1 4 3069 1 1 10 PHE CD1 C 4.660 -2.548 -1.936 1.00 . A A . 10 PHE CD1 1 1 4 3070 1 1 10 PHE CD2 C 3.050 -0.804 -2.157 1.00 . A A . 10 PHE CD2 1 1 4 3071 1 1 10 PHE CE1 C 4.793 -2.260 -0.590 1.00 . A A . 10 PHE CE1 1 1 4 3072 1 1 10 PHE CE2 C 3.177 -0.510 -0.813 1.00 . A A . 10 PHE CE2 1 1 4 3073 1 1 10 PHE CG C 3.789 -1.823 -2.731 1.00 . A A . 10 PHE CG 1 1 4 3074 1 1 10 PHE CZ C 4.050 -1.240 -0.028 1.00 . A A . 10 PHE CZ 1 1 4 3075 1 1 10 PHE H H 3.330 0.165 -5.391 1.00 . A A . 10 PHE H 1 1 4 3076 1 1 10 PHE HA H 5.630 -1.408 -4.531 1.00 . A A . 10 PHE HA 1 1 4 3077 1 1 10 PHE HB2 H 2.664 -1.845 -4.505 1.00 . A A . 10 PHE HB2 1 1 4 3078 1 1 10 PHE HB3 H 3.765 -3.204 -4.316 1.00 . A A . 10 PHE HB3 1 1 4 3079 1 1 10 PHE HD1 H 5.240 -3.343 -2.378 1.00 . A A . 10 PHE HD1 1 1 4 3080 1 1 10 PHE HD2 H 2.368 -0.234 -2.769 1.00 . A A . 10 PHE HD2 1 1 4 3081 1 1 10 PHE HE1 H 5.476 -2.831 0.020 1.00 . A A . 10 PHE HE1 1 1 4 3082 1 1 10 PHE HE2 H 2.594 0.288 -0.376 1.00 . A A . 10 PHE HE2 1 1 4 3083 1 1 10 PHE HZ H 4.151 -1.013 1.023 1.00 . A A . 10 PHE HZ 1 1 4 3084 1 1 10 PHE N N 4.281 -0.039 -5.279 1.00 . A A . 10 PHE N 1 1 4 3085 1 1 10 PHE O O 5.807 -2.938 -6.540 1.00 . A A . 10 PHE O 1 1 4 3086 1 1 11 GLY C C 3.156 -3.806 -8.678 1.00 . A A . 11 GLY C 1 1 4 3087 1 1 11 GLY CA C 4.032 -2.571 -8.607 1.00 . A A . 11 GLY CA 1 1 4 3088 1 1 11 GLY H H 3.229 -1.288 -7.126 1.00 . A A . 11 GLY H 1 1 4 3089 1 1 11 GLY HA2 H 3.716 -1.875 -9.370 1.00 . A A . 11 GLY HA2 1 1 4 3090 1 1 11 GLY HA3 H 5.055 -2.858 -8.796 1.00 . A A . 11 GLY HA3 1 1 4 3091 1 1 11 GLY N N 3.958 -1.916 -7.314 1.00 . A A . 11 GLY N 1 1 4 3092 1 1 11 GLY O O 2.610 -4.130 -9.732 1.00 . A A . 11 GLY O 1 1 4 3093 1 1 12 THR C C 1.552 -5.829 -6.107 1.00 . A A . 12 THR C 1 1 4 3094 1 1 12 THR CA C 2.206 -5.702 -7.478 1.00 . A A . 12 THR CA 1 1 4 3095 1 1 12 THR CB C 3.059 -6.938 -7.767 1.00 . A A . 12 THR CB 1 1 4 3096 1 1 12 THR CG2 C 3.362 -7.128 -9.237 1.00 . A A . 12 THR CG2 1 1 4 3097 1 1 12 THR H H 3.481 -4.184 -6.741 1.00 . A A . 12 THR H 1 1 4 3098 1 1 12 THR HA H 1.434 -5.624 -8.229 1.00 . A A . 12 THR HA 1 1 4 3099 1 1 12 THR HB H 2.531 -7.816 -7.422 1.00 . A A . 12 THR HB 1 1 4 3100 1 1 12 THR HG1 H 4.760 -6.066 -7.338 1.00 . A A . 12 THR HG1 1 1 4 3101 1 1 12 THR HG21 H 3.399 -8.184 -9.464 1.00 . A A . 12 THR HG21 1 1 4 3102 1 1 12 THR HG22 H 4.313 -6.675 -9.470 1.00 . A A . 12 THR HG22 1 1 4 3103 1 1 12 THR HG23 H 2.587 -6.661 -9.828 1.00 . A A . 12 THR HG23 1 1 4 3104 1 1 12 THR N N 3.023 -4.496 -7.549 1.00 . A A . 12 THR N 1 1 4 3105 1 1 12 THR O O 2.116 -5.407 -5.097 1.00 . A A . 12 THR O 1 1 4 3106 1 1 12 THR OG1 O 4.295 -6.866 -7.079 1.00 . A A . 12 THR OG1 1 1 4 3107 1 1 13 GLN C C 0.452 -7.382 -3.819 1.00 . A A . 13 GLN C 1 1 4 3108 1 1 13 GLN CA C -0.375 -6.590 -4.828 1.00 . A A . 13 GLN CA 1 1 4 3109 1 1 13 GLN CB C -1.703 -7.303 -5.088 1.00 . A A . 13 GLN CB 1 1 4 3110 1 1 13 GLN CD C -3.424 -7.416 -6.933 1.00 . A A . 13 GLN CD 1 1 4 3111 1 1 13 GLN CG C -2.646 -6.522 -5.987 1.00 . A A . 13 GLN CG 1 1 4 3112 1 1 13 GLN H H -0.044 -6.723 -6.914 1.00 . A A . 13 GLN H 1 1 4 3113 1 1 13 GLN HA H -0.577 -5.610 -4.420 1.00 . A A . 13 GLN HA 1 1 4 3114 1 1 13 GLN HB2 H -1.500 -8.255 -5.556 1.00 . A A . 13 GLN HB2 1 1 4 3115 1 1 13 GLN HB3 H -2.198 -7.472 -4.144 1.00 . A A . 13 GLN HB3 1 1 4 3116 1 1 13 GLN HE21 H -4.807 -7.728 -5.540 1.00 . A A . 13 GLN HE21 1 1 4 3117 1 1 13 GLN HE22 H -5.070 -8.525 -7.049 1.00 . A A . 13 GLN HE22 1 1 4 3118 1 1 13 GLN HG2 H -3.347 -5.981 -5.369 1.00 . A A . 13 GLN HG2 1 1 4 3119 1 1 13 GLN HG3 H -2.069 -5.820 -6.572 1.00 . A A . 13 GLN HG3 1 1 4 3120 1 1 13 GLN N N 0.357 -6.409 -6.077 1.00 . A A . 13 GLN N 1 1 4 3121 1 1 13 GLN NE2 N -4.546 -7.943 -6.460 1.00 . A A . 13 GLN NE2 1 1 4 3122 1 1 13 GLN O O 0.614 -6.965 -2.672 1.00 . A A . 13 GLN O 1 1 4 3123 1 1 13 GLN OE1 O -3.021 -7.631 -8.076 1.00 . A A . 13 GLN OE1 1 1 4 3124 1 1 14 ARG C C 2.796 -8.582 -2.594 1.00 . A A . 14 ARG C 1 1 4 3125 1 1 14 ARG CA C 1.782 -9.390 -3.401 1.00 . A A . 14 ARG CA 1 1 4 3126 1 1 14 ARG CB C 2.506 -10.439 -4.246 1.00 . A A . 14 ARG CB 1 1 4 3127 1 1 14 ARG CD C 2.362 -12.677 -5.384 1.00 . A A . 14 ARG CD 1 1 4 3128 1 1 14 ARG CG C 1.788 -11.778 -4.301 1.00 . A A . 14 ARG CG 1 1 4 3129 1 1 14 ARG CZ C 2.363 -11.516 -7.564 1.00 . A A . 14 ARG CZ 1 1 4 3130 1 1 14 ARG H H 0.803 -8.801 -5.183 1.00 . A A . 14 ARG H 1 1 4 3131 1 1 14 ARG HA H 1.116 -9.893 -2.715 1.00 . A A . 14 ARG HA 1 1 4 3132 1 1 14 ARG HB2 H 2.603 -10.066 -5.255 1.00 . A A . 14 ARG HB2 1 1 4 3133 1 1 14 ARG HB3 H 3.492 -10.601 -3.835 1.00 . A A . 14 ARG HB3 1 1 4 3134 1 1 14 ARG HD2 H 3.432 -12.551 -5.414 1.00 . A A . 14 ARG HD2 1 1 4 3135 1 1 14 ARG HD3 H 2.130 -13.704 -5.141 1.00 . A A . 14 ARG HD3 1 1 4 3136 1 1 14 ARG HE H 0.980 -12.823 -6.962 1.00 . A A . 14 ARG HE 1 1 4 3137 1 1 14 ARG HG2 H 1.893 -12.272 -3.346 1.00 . A A . 14 ARG HG2 1 1 4 3138 1 1 14 ARG HG3 H 0.742 -11.606 -4.506 1.00 . A A . 14 ARG HG3 1 1 4 3139 1 1 14 ARG HH11 H 3.924 -11.032 -6.371 1.00 . A A . 14 ARG HH11 1 1 4 3140 1 1 14 ARG HH12 H 3.892 -10.240 -7.909 1.00 . A A . 14 ARG HH12 1 1 4 3141 1 1 14 ARG HH21 H 0.945 -11.777 -8.979 1.00 . A A . 14 ARG HH21 1 1 4 3142 1 1 14 ARG HH22 H 2.203 -10.661 -9.388 1.00 . A A . 14 ARG HH22 1 1 4 3143 1 1 14 ARG N N 0.971 -8.526 -4.258 1.00 . A A . 14 ARG N 1 1 4 3144 1 1 14 ARG NE N 1.809 -12.369 -6.703 1.00 . A A . 14 ARG NE 1 1 4 3145 1 1 14 ARG NH1 N 3.484 -10.877 -7.255 1.00 . A A . 14 ARG NH1 1 1 4 3146 1 1 14 ARG NH2 N 1.789 -11.300 -8.740 1.00 . A A . 14 ARG NH2 1 1 4 3147 1 1 14 ARG O O 2.994 -8.828 -1.404 1.00 . A A . 14 ARG O 1 1 4 3148 1 1 15 ALA C C 3.802 -6.029 -1.405 1.00 . A A . 15 ALA C 1 1 4 3149 1 1 15 ALA CA C 4.421 -6.771 -2.585 1.00 . A A . 15 ALA CA 1 1 4 3150 1 1 15 ALA CB C 5.021 -5.785 -3.575 1.00 . A A . 15 ALA CB 1 1 4 3151 1 1 15 ALA H H 3.231 -7.463 -4.193 1.00 . A A . 15 ALA H 1 1 4 3152 1 1 15 ALA HA H 5.214 -7.408 -2.221 1.00 . A A . 15 ALA HA 1 1 4 3153 1 1 15 ALA HB1 H 4.516 -4.834 -3.485 1.00 . A A . 15 ALA HB1 1 1 4 3154 1 1 15 ALA HB2 H 4.901 -6.162 -4.579 1.00 . A A . 15 ALA HB2 1 1 4 3155 1 1 15 ALA HB3 H 6.072 -5.655 -3.362 1.00 . A A . 15 ALA HB3 1 1 4 3156 1 1 15 ALA N N 3.432 -7.614 -3.246 1.00 . A A . 15 ALA N 1 1 4 3157 1 1 15 ALA O O 4.333 -6.054 -0.295 1.00 . A A . 15 ALA O 1 1 4 3158 1 1 16 VAL C C 1.609 -5.517 0.555 1.00 . A A . 16 VAL C 1 1 4 3159 1 1 16 VAL CA C 1.980 -4.619 -0.621 1.00 . A A . 16 VAL CA 1 1 4 3160 1 1 16 VAL CB C 0.698 -3.951 -1.161 1.00 . A A . 16 VAL CB 1 1 4 3161 1 1 16 VAL CG1 C 0.421 -2.675 -0.396 1.00 . A A . 16 VAL CG1 1 1 4 3162 1 1 16 VAL CG2 C 0.803 -3.659 -2.652 1.00 . A A . 16 VAL CG2 1 1 4 3163 1 1 16 VAL H H 2.305 -5.386 -2.557 1.00 . A A . 16 VAL H 1 1 4 3164 1 1 16 VAL HA H 2.645 -3.842 -0.271 1.00 . A A . 16 VAL HA 1 1 4 3165 1 1 16 VAL HB H -0.131 -4.626 -1.003 1.00 . A A . 16 VAL HB 1 1 4 3166 1 1 16 VAL HG11 H 0.078 -2.919 0.597 1.00 . A A . 16 VAL HG11 1 1 4 3167 1 1 16 VAL HG12 H -0.337 -2.105 -0.911 1.00 . A A . 16 VAL HG12 1 1 4 3168 1 1 16 VAL HG13 H 1.328 -2.097 -0.333 1.00 . A A . 16 VAL HG13 1 1 4 3169 1 1 16 VAL HG21 H 0.601 -4.562 -3.211 1.00 . A A . 16 VAL HG21 1 1 4 3170 1 1 16 VAL HG22 H 1.799 -3.310 -2.881 1.00 . A A . 16 VAL HG22 1 1 4 3171 1 1 16 VAL HG23 H 0.085 -2.899 -2.923 1.00 . A A . 16 VAL HG23 1 1 4 3172 1 1 16 VAL N N 2.677 -5.368 -1.656 1.00 . A A . 16 VAL N 1 1 4 3173 1 1 16 VAL O O 1.829 -5.162 1.712 1.00 . A A . 16 VAL O 1 1 4 3174 1 1 17 ALA C C 1.824 -8.011 2.168 1.00 . A A . 17 ALA C 1 1 4 3175 1 1 17 ALA CA C 0.644 -7.630 1.281 1.00 . A A . 17 ALA CA 1 1 4 3176 1 1 17 ALA CB C 0.035 -8.872 0.648 1.00 . A A . 17 ALA CB 1 1 4 3177 1 1 17 ALA H H 0.897 -6.909 -0.693 1.00 . A A . 17 ALA H 1 1 4 3178 1 1 17 ALA HA H -0.113 -7.158 1.890 1.00 . A A . 17 ALA HA 1 1 4 3179 1 1 17 ALA HB1 H -0.083 -9.639 1.398 1.00 . A A . 17 ALA HB1 1 1 4 3180 1 1 17 ALA HB2 H 0.686 -9.233 -0.135 1.00 . A A . 17 ALA HB2 1 1 4 3181 1 1 17 ALA HB3 H -0.929 -8.627 0.228 1.00 . A A . 17 ALA HB3 1 1 4 3182 1 1 17 ALA N N 1.046 -6.682 0.249 1.00 . A A . 17 ALA N 1 1 4 3183 1 1 17 ALA O O 1.684 -8.136 3.384 1.00 . A A . 17 ALA O 1 1 4 3184 1 1 18 LYS C C 4.713 -7.380 3.099 1.00 . A A . 18 LYS C 1 1 4 3185 1 1 18 LYS CA C 4.193 -8.561 2.285 1.00 . A A . 18 LYS CA 1 1 4 3186 1 1 18 LYS CB C 5.274 -9.050 1.318 1.00 . A A . 18 LYS CB 1 1 4 3187 1 1 18 LYS CD C 5.190 -11.188 -0.005 1.00 . A A . 18 LYS CD 1 1 4 3188 1 1 18 LYS CE C 4.583 -12.573 0.143 1.00 . A A . 18 LYS CE 1 1 4 3189 1 1 18 LYS CG C 5.478 -10.556 1.347 1.00 . A A . 18 LYS CG 1 1 4 3190 1 1 18 LYS H H 3.035 -8.080 0.579 1.00 . A A . 18 LYS H 1 1 4 3191 1 1 18 LYS HA H 3.936 -9.364 2.961 1.00 . A A . 18 LYS HA 1 1 4 3192 1 1 18 LYS HB2 H 4.999 -8.763 0.314 1.00 . A A . 18 LYS HB2 1 1 4 3193 1 1 18 LYS HB3 H 6.210 -8.577 1.573 1.00 . A A . 18 LYS HB3 1 1 4 3194 1 1 18 LYS HD2 H 4.499 -10.560 -0.545 1.00 . A A . 18 LYS HD2 1 1 4 3195 1 1 18 LYS HD3 H 6.115 -11.267 -0.559 1.00 . A A . 18 LYS HD3 1 1 4 3196 1 1 18 LYS HE2 H 4.446 -13.001 -0.837 1.00 . A A . 18 LYS HE2 1 1 4 3197 1 1 18 LYS HE3 H 5.262 -13.190 0.713 1.00 . A A . 18 LYS HE3 1 1 4 3198 1 1 18 LYS HG2 H 6.502 -10.766 1.619 1.00 . A A . 18 LYS HG2 1 1 4 3199 1 1 18 LYS HG3 H 4.813 -10.986 2.083 1.00 . A A . 18 LYS HG3 1 1 4 3200 1 1 18 LYS HZ1 H 2.828 -11.596 0.719 1.00 . A A . 18 LYS HZ1 1 1 4 3201 1 1 18 LYS HZ2 H 3.394 -12.711 1.857 1.00 . A A . 18 LYS HZ2 1 1 4 3202 1 1 18 LYS HZ3 H 2.632 -13.254 0.448 1.00 . A A . 18 LYS HZ3 1 1 4 3203 1 1 18 LYS N N 2.987 -8.195 1.550 1.00 . A A . 18 LYS N 1 1 4 3204 1 1 18 LYS NZ N 3.267 -12.530 0.840 1.00 . A A . 18 LYS NZ 1 1 4 3205 1 1 18 LYS O O 5.348 -7.561 4.138 1.00 . A A . 18 LYS O 1 1 4 3206 1 1 19 ALA C C 4.038 -4.688 4.542 1.00 . A A . 19 ALA C 1 1 4 3207 1 1 19 ALA CA C 4.884 -4.961 3.304 1.00 . A A . 19 ALA CA 1 1 4 3208 1 1 19 ALA CB C 4.838 -3.773 2.354 1.00 . A A . 19 ALA CB 1 1 4 3209 1 1 19 ALA H H 3.932 -6.087 1.787 1.00 . A A . 19 ALA H 1 1 4 3210 1 1 19 ALA HA H 5.911 -5.107 3.608 1.00 . A A . 19 ALA HA 1 1 4 3211 1 1 19 ALA HB1 H 4.040 -3.105 2.647 1.00 . A A . 19 ALA HB1 1 1 4 3212 1 1 19 ALA HB2 H 4.662 -4.123 1.347 1.00 . A A . 19 ALA HB2 1 1 4 3213 1 1 19 ALA HB3 H 5.780 -3.244 2.391 1.00 . A A . 19 ALA HB3 1 1 4 3214 1 1 19 ALA N N 4.441 -6.170 2.621 1.00 . A A . 19 ALA N 1 1 4 3215 1 1 19 ALA O O 4.565 -4.514 5.641 1.00 . A A . 19 ALA O 1 1 4 3216 1 1 20 LEU C C 1.582 -5.663 6.286 1.00 . A A . 20 LEU C 1 1 4 3217 1 1 20 LEU CA C 1.803 -4.398 5.464 1.00 . A A . 20 LEU CA 1 1 4 3218 1 1 20 LEU CB C 0.462 -3.882 4.938 1.00 . A A . 20 LEU CB 1 1 4 3219 1 1 20 LEU CD1 C -0.836 -2.494 3.304 1.00 . A A . 20 LEU CD1 1 1 4 3220 1 1 20 LEU CD2 C 1.378 -1.688 4.147 1.00 . A A . 20 LEU CD2 1 1 4 3221 1 1 20 LEU CG C 0.555 -2.909 3.763 1.00 . A A . 20 LEU CG 1 1 4 3222 1 1 20 LEU H H 2.359 -4.796 3.460 1.00 . A A . 20 LEU H 1 1 4 3223 1 1 20 LEU HA H 2.245 -3.645 6.098 1.00 . A A . 20 LEU HA 1 1 4 3224 1 1 20 LEU HB2 H -0.129 -4.732 4.627 1.00 . A A . 20 LEU HB2 1 1 4 3225 1 1 20 LEU HB3 H -0.052 -3.386 5.746 1.00 . A A . 20 LEU HB3 1 1 4 3226 1 1 20 LEU HD11 H -0.769 -1.580 2.733 1.00 . A A . 20 LEU HD11 1 1 4 3227 1 1 20 LEU HD12 H -1.465 -2.334 4.167 1.00 . A A . 20 LEU HD12 1 1 4 3228 1 1 20 LEU HD13 H -1.259 -3.274 2.690 1.00 . A A . 20 LEU HD13 1 1 4 3229 1 1 20 LEU HD21 H 2.081 -1.957 4.920 1.00 . A A . 20 LEU HD21 1 1 4 3230 1 1 20 LEU HD22 H 0.722 -0.912 4.511 1.00 . A A . 20 LEU HD22 1 1 4 3231 1 1 20 LEU HD23 H 1.915 -1.330 3.281 1.00 . A A . 20 LEU HD23 1 1 4 3232 1 1 20 LEU HG H 1.047 -3.399 2.934 1.00 . A A . 20 LEU HG 1 1 4 3233 1 1 20 LEU N N 2.721 -4.651 4.358 1.00 . A A . 20 LEU N 1 1 4 3234 1 1 20 LEU O O 1.411 -5.602 7.504 1.00 . A A . 20 LEU O 1 1 4 3235 1 1 21 GLY C C -0.085 -8.453 6.377 1.00 . A A . 21 GLY C 1 1 4 3236 1 1 21 GLY CA C 1.380 -8.070 6.293 1.00 . A A . 21 GLY CA 1 1 4 3237 1 1 21 GLY H H 1.723 -6.793 4.642 1.00 . A A . 21 GLY H 1 1 4 3238 1 1 21 GLY HA2 H 1.913 -8.845 5.761 1.00 . A A . 21 GLY HA2 1 1 4 3239 1 1 21 GLY HA3 H 1.778 -7.995 7.294 1.00 . A A . 21 GLY HA3 1 1 4 3240 1 1 21 GLY N N 1.583 -6.807 5.611 1.00 . A A . 21 GLY N 1 1 4 3241 1 1 21 GLY O O -0.578 -8.818 7.445 1.00 . A A . 21 GLY O 1 1 4 3242 1 1 22 ILE C C -2.431 -9.978 4.377 1.00 . A A . 22 ILE C 1 1 4 3243 1 1 22 ILE CA C -2.200 -8.709 5.199 1.00 . A A . 22 ILE CA 1 1 4 3244 1 1 22 ILE CB C -3.051 -7.551 4.620 1.00 . A A . 22 ILE CB 1 1 4 3245 1 1 22 ILE CD1 C -3.041 -5.624 2.958 1.00 . A A . 22 ILE CD1 1 1 4 3246 1 1 22 ILE CG1 C -2.234 -6.710 3.634 1.00 . A A . 22 ILE CG1 1 1 4 3247 1 1 22 ILE CG2 C -3.588 -6.681 5.743 1.00 . A A . 22 ILE CG2 1 1 4 3248 1 1 22 ILE H H -0.332 -8.071 4.430 1.00 . A A . 22 ILE H 1 1 4 3249 1 1 22 ILE HA H -2.528 -8.892 6.212 1.00 . A A . 22 ILE HA 1 1 4 3250 1 1 22 ILE HB H -3.895 -7.981 4.103 1.00 . A A . 22 ILE HB 1 1 4 3251 1 1 22 ILE HD11 H -3.689 -6.063 2.215 1.00 . A A . 22 ILE HD11 1 1 4 3252 1 1 22 ILE HD12 H -2.372 -4.921 2.481 1.00 . A A . 22 ILE HD12 1 1 4 3253 1 1 22 ILE HD13 H -3.638 -5.107 3.695 1.00 . A A . 22 ILE HD13 1 1 4 3254 1 1 22 ILE HG12 H -1.420 -6.238 4.162 1.00 . A A . 22 ILE HG12 1 1 4 3255 1 1 22 ILE HG13 H -1.833 -7.354 2.865 1.00 . A A . 22 ILE HG13 1 1 4 3256 1 1 22 ILE HG21 H -4.604 -6.968 5.963 1.00 . A A . 22 ILE HG21 1 1 4 3257 1 1 22 ILE HG22 H -3.565 -5.645 5.437 1.00 . A A . 22 ILE HG22 1 1 4 3258 1 1 22 ILE HG23 H -2.976 -6.810 6.622 1.00 . A A . 22 ILE HG23 1 1 4 3259 1 1 22 ILE N N -0.782 -8.368 5.249 1.00 . A A . 22 ILE N 1 1 4 3260 1 1 22 ILE O O -2.298 -11.090 4.892 1.00 . A A . 22 ILE O 1 1 4 3261 1 1 23 SER C C -3.294 -10.485 0.798 1.00 . A A . 23 SER C 1 1 4 3262 1 1 23 SER CA C -3.017 -10.952 2.222 1.00 . A A . 23 SER CA 1 1 4 3263 1 1 23 SER CB C -4.196 -11.781 2.739 1.00 . A A . 23 SER CB 1 1 4 3264 1 1 23 SER H H -2.867 -8.911 2.742 1.00 . A A . 23 SER H 1 1 4 3265 1 1 23 SER HA H -2.130 -11.567 2.222 1.00 . A A . 23 SER HA 1 1 4 3266 1 1 23 SER HB2 H -4.881 -11.136 3.270 1.00 . A A . 23 SER HB2 1 1 4 3267 1 1 23 SER HB3 H -4.706 -12.238 1.904 1.00 . A A . 23 SER HB3 1 1 4 3268 1 1 23 SER HG H -4.510 -13.314 3.918 1.00 . A A . 23 SER HG 1 1 4 3269 1 1 23 SER N N -2.775 -9.815 3.102 1.00 . A A . 23 SER N 1 1 4 3270 1 1 23 SER O O -3.747 -9.361 0.580 1.00 . A A . 23 SER O 1 1 4 3271 1 1 23 SER OG O -3.756 -12.801 3.620 1.00 . A A . 23 SER OG 1 1 4 3272 1 1 24 ASP C C -4.707 -10.685 -1.836 1.00 . A A . 24 ASP C 1 1 4 3273 1 1 24 ASP CA C -3.241 -11.030 -1.574 1.00 . A A . 24 ASP CA 1 1 4 3274 1 1 24 ASP CB C -2.814 -12.203 -2.460 1.00 . A A . 24 ASP CB 1 1 4 3275 1 1 24 ASP CG C -1.497 -11.943 -3.165 1.00 . A A . 24 ASP CG 1 1 4 3276 1 1 24 ASP H H -2.663 -12.235 0.068 1.00 . A A . 24 ASP H 1 1 4 3277 1 1 24 ASP HA H -2.635 -10.171 -1.814 1.00 . A A . 24 ASP HA 1 1 4 3278 1 1 24 ASP HB2 H -2.705 -13.086 -1.851 1.00 . A A . 24 ASP HB2 1 1 4 3279 1 1 24 ASP HB3 H -3.573 -12.377 -3.209 1.00 . A A . 24 ASP HB3 1 1 4 3280 1 1 24 ASP N N -3.021 -11.354 -0.169 1.00 . A A . 24 ASP N 1 1 4 3281 1 1 24 ASP O O -5.032 -10.051 -2.840 1.00 . A A . 24 ASP O 1 1 4 3282 1 1 24 ASP OD1 O -0.534 -11.524 -2.489 1.00 . A A . 24 ASP OD1 1 1 4 3283 1 1 24 ASP OD2 O -1.429 -12.159 -4.394 1.00 . A A . 24 ASP OD2 1 1 4 3284 1 1 25 ALA C C -7.358 -9.429 -0.600 1.00 . A A . 25 ALA C 1 1 4 3285 1 1 25 ALA CA C -7.013 -10.837 -1.071 1.00 . A A . 25 ALA CA 1 1 4 3286 1 1 25 ALA CB C -7.821 -11.866 -0.296 1.00 . A A . 25 ALA CB 1 1 4 3287 1 1 25 ALA H H -5.271 -11.605 -0.150 1.00 . A A . 25 ALA H 1 1 4 3288 1 1 25 ALA HA H -7.267 -10.929 -2.117 1.00 . A A . 25 ALA HA 1 1 4 3289 1 1 25 ALA HB1 H -7.230 -12.242 0.526 1.00 . A A . 25 ALA HB1 1 1 4 3290 1 1 25 ALA HB2 H -8.088 -12.683 -0.950 1.00 . A A . 25 ALA HB2 1 1 4 3291 1 1 25 ALA HB3 H -8.719 -11.404 0.088 1.00 . A A . 25 ALA HB3 1 1 4 3292 1 1 25 ALA N N -5.587 -11.104 -0.930 1.00 . A A . 25 ALA N 1 1 4 3293 1 1 25 ALA O O -8.092 -8.702 -1.271 1.00 . A A . 25 ALA O 1 1 4 3294 1 1 26 ALA C C -6.647 -6.629 0.149 1.00 . A A . 26 ALA C 1 1 4 3295 1 1 26 ALA CA C -7.076 -7.726 1.116 1.00 . A A . 26 ALA CA 1 1 4 3296 1 1 26 ALA CB C -6.353 -7.571 2.445 1.00 . A A . 26 ALA CB 1 1 4 3297 1 1 26 ALA H H -6.247 -9.672 1.044 1.00 . A A . 26 ALA H 1 1 4 3298 1 1 26 ALA HA H -8.137 -7.637 1.299 1.00 . A A . 26 ALA HA 1 1 4 3299 1 1 26 ALA HB1 H -6.895 -6.880 3.072 1.00 . A A . 26 ALA HB1 1 1 4 3300 1 1 26 ALA HB2 H -5.355 -7.193 2.272 1.00 . A A . 26 ALA HB2 1 1 4 3301 1 1 26 ALA HB3 H -6.292 -8.531 2.936 1.00 . A A . 26 ALA HB3 1 1 4 3302 1 1 26 ALA N N -6.824 -9.048 0.556 1.00 . A A . 26 ALA N 1 1 4 3303 1 1 26 ALA O O -7.368 -5.653 -0.059 1.00 . A A . 26 ALA O 1 1 4 3304 1 1 27 VAL C C -5.811 -5.751 -2.640 1.00 . A A . 27 VAL C 1 1 4 3305 1 1 27 VAL CA C -4.943 -5.820 -1.389 1.00 . A A . 27 VAL CA 1 1 4 3306 1 1 27 VAL CB C -3.497 -6.157 -1.796 1.00 . A A . 27 VAL CB 1 1 4 3307 1 1 27 VAL CG1 C -2.936 -5.084 -2.720 1.00 . A A . 27 VAL CG1 1 1 4 3308 1 1 27 VAL CG2 C -2.620 -6.319 -0.564 1.00 . A A . 27 VAL CG2 1 1 4 3309 1 1 27 VAL H H -4.939 -7.594 -0.235 1.00 . A A . 27 VAL H 1 1 4 3310 1 1 27 VAL HA H -4.945 -4.853 -0.908 1.00 . A A . 27 VAL HA 1 1 4 3311 1 1 27 VAL HB H -3.504 -7.093 -2.333 1.00 . A A . 27 VAL HB 1 1 4 3312 1 1 27 VAL HG11 H -3.530 -5.040 -3.621 1.00 . A A . 27 VAL HG11 1 1 4 3313 1 1 27 VAL HG12 H -1.914 -5.326 -2.972 1.00 . A A . 27 VAL HG12 1 1 4 3314 1 1 27 VAL HG13 H -2.966 -4.127 -2.220 1.00 . A A . 27 VAL HG13 1 1 4 3315 1 1 27 VAL HG21 H -2.688 -7.337 -0.206 1.00 . A A . 27 VAL HG21 1 1 4 3316 1 1 27 VAL HG22 H -2.955 -5.643 0.209 1.00 . A A . 27 VAL HG22 1 1 4 3317 1 1 27 VAL HG23 H -1.595 -6.096 -0.818 1.00 . A A . 27 VAL HG23 1 1 4 3318 1 1 27 VAL N N -5.468 -6.795 -0.441 1.00 . A A . 27 VAL N 1 1 4 3319 1 1 27 VAL O O -6.115 -4.667 -3.138 1.00 . A A . 27 VAL O 1 1 4 3320 1 1 28 SER C C -8.447 -6.468 -4.056 1.00 . A A . 28 SER C 1 1 4 3321 1 1 28 SER CA C -7.039 -6.982 -4.341 1.00 . A A . 28 SER CA 1 1 4 3322 1 1 28 SER CB C -7.106 -8.419 -4.861 1.00 . A A . 28 SER CB 1 1 4 3323 1 1 28 SER H H -5.933 -7.744 -2.706 1.00 . A A . 28 SER H 1 1 4 3324 1 1 28 SER HA H -6.586 -6.357 -5.095 1.00 . A A . 28 SER HA 1 1 4 3325 1 1 28 SER HB2 H -6.207 -8.945 -4.576 1.00 . A A . 28 SER HB2 1 1 4 3326 1 1 28 SER HB3 H -7.963 -8.916 -4.433 1.00 . A A . 28 SER HB3 1 1 4 3327 1 1 28 SER HG H -7.950 -9.016 -6.525 1.00 . A A . 28 SER HG 1 1 4 3328 1 1 28 SER N N -6.207 -6.913 -3.146 1.00 . A A . 28 SER N 1 1 4 3329 1 1 28 SER O O -9.118 -5.940 -4.943 1.00 . A A . 28 SER O 1 1 4 3330 1 1 28 SER OG O -7.220 -8.447 -6.274 1.00 . A A . 28 SER OG 1 1 4 3331 1 1 29 GLN C C -10.240 -4.677 -2.121 1.00 . A A . 29 GLN C 1 1 4 3332 1 1 29 GLN CA C -10.220 -6.176 -2.410 1.00 . A A . 29 GLN CA 1 1 4 3333 1 1 29 GLN CB C -10.680 -6.950 -1.176 1.00 . A A . 29 GLN CB 1 1 4 3334 1 1 29 GLN CD C -11.300 -9.202 -0.211 1.00 . A A . 29 GLN CD 1 1 4 3335 1 1 29 GLN CG C -11.070 -8.390 -1.471 1.00 . A A . 29 GLN CG 1 1 4 3336 1 1 29 GLN H H -8.310 -7.054 -2.149 1.00 . A A . 29 GLN H 1 1 4 3337 1 1 29 GLN HA H -10.890 -6.381 -3.228 1.00 . A A . 29 GLN HA 1 1 4 3338 1 1 29 GLN HB2 H -9.891 -6.958 -0.447 1.00 . A A . 29 GLN HB2 1 1 4 3339 1 1 29 GLN HB3 H -11.540 -6.447 -0.755 1.00 . A A . 29 GLN HB3 1 1 4 3340 1 1 29 GLN HE21 H -11.420 -10.873 -1.281 1.00 . A A . 29 GLN HE21 1 1 4 3341 1 1 29 GLN HE22 H -11.610 -11.060 0.426 1.00 . A A . 29 GLN HE22 1 1 4 3342 1 1 29 GLN HG2 H -11.980 -8.391 -2.051 1.00 . A A . 29 GLN HG2 1 1 4 3343 1 1 29 GLN HG3 H -10.280 -8.853 -2.043 1.00 . A A . 29 GLN HG3 1 1 4 3344 1 1 29 GLN N N -8.890 -6.625 -2.812 1.00 . A A . 29 GLN N 1 1 4 3345 1 1 29 GLN NE2 N -11.460 -10.510 -0.373 1.00 . A A . 29 GLN NE2 1 1 4 3346 1 1 29 GLN O O -11.300 -4.083 -1.969 1.00 . A A . 29 GLN O 1 1 4 3347 1 1 29 GLN OE1 O -11.330 -8.659 0.894 1.00 . A A . 29 GLN OE1 1 1 4 3348 1 1 30 TRP C C -9.789 -1.825 -2.760 1.00 . A A . 30 TRP C 1 1 4 3349 1 1 30 TRP CA C -8.954 -2.634 -1.773 1.00 . A A . 30 TRP CA 1 1 4 3350 1 1 30 TRP CB C -7.493 -2.185 -1.839 1.00 . A A . 30 TRP CB 1 1 4 3351 1 1 30 TRP CD1 C -7.204 -2.991 0.579 1.00 . A A . 30 TRP CD1 1 1 4 3352 1 1 30 TRP CD2 C -5.309 -2.305 -0.397 1.00 . A A . 30 TRP CD2 1 1 4 3353 1 1 30 TRP CE2 C -5.014 -2.718 0.916 1.00 . A A . 30 TRP CE2 1 1 4 3354 1 1 30 TRP CE3 C -4.269 -1.832 -1.203 1.00 . A A . 30 TRP CE3 1 1 4 3355 1 1 30 TRP CG C -6.715 -2.489 -0.594 1.00 . A A . 30 TRP CG 1 1 4 3356 1 1 30 TRP CH2 C -2.727 -2.205 0.627 1.00 . A A . 30 TRP CH2 1 1 4 3357 1 1 30 TRP CZ2 C -3.723 -2.672 1.439 1.00 . A A . 30 TRP CZ2 1 1 4 3358 1 1 30 TRP CZ3 C -2.990 -1.788 -0.683 1.00 . A A . 30 TRP CZ3 1 1 4 3359 1 1 30 TRP H H -8.240 -4.587 -2.175 1.00 . A A . 30 TRP H 1 1 4 3360 1 1 30 TRP HA H -9.330 -2.461 -0.776 1.00 . A A . 30 TRP HA 1 1 4 3361 1 1 30 TRP HB2 H -7.008 -2.684 -2.664 1.00 . A A . 30 TRP HB2 1 1 4 3362 1 1 30 TRP HB3 H -7.459 -1.118 -2.002 1.00 . A A . 30 TRP HB3 1 1 4 3363 1 1 30 TRP HD1 H -8.241 -3.238 0.751 1.00 . A A . 30 TRP HD1 1 1 4 3364 1 1 30 TRP HE1 H -6.284 -3.474 2.404 1.00 . A A . 30 TRP HE1 1 1 4 3365 1 1 30 TRP HE3 H -4.452 -1.507 -2.217 1.00 . A A . 30 TRP HE3 1 1 4 3366 1 1 30 TRP HH2 H -1.712 -2.152 0.992 1.00 . A A . 30 TRP HH2 1 1 4 3367 1 1 30 TRP HZ2 H -3.503 -2.992 2.447 1.00 . A A . 30 TRP HZ2 1 1 4 3368 1 1 30 TRP HZ3 H -2.175 -1.426 -1.292 1.00 . A A . 30 TRP HZ3 1 1 4 3369 1 1 30 TRP N N -9.059 -4.065 -2.045 1.00 . A A . 30 TRP N 1 1 4 3370 1 1 30 TRP NE1 N -6.187 -3.132 1.491 1.00 . A A . 30 TRP NE1 1 1 4 3371 1 1 30 TRP O O -9.664 -1.986 -3.974 1.00 . A A . 30 TRP O 1 1 4 3372 1 1 31 LYS C C -10.740 1.126 -3.536 1.00 . A A . 31 LYS C 1 1 4 3373 1 1 31 LYS CA C -11.490 -0.114 -3.062 1.00 . A A . 31 LYS CA 1 1 4 3374 1 1 31 LYS CB C -12.750 0.291 -2.288 1.00 . A A . 31 LYS CB 1 1 4 3375 1 1 31 LYS CD C -15.240 0.079 -2.018 1.00 . A A . 31 LYS CD 1 1 4 3376 1 1 31 LYS CE C -16.520 -0.057 -2.820 1.00 . A A . 31 LYS CE 1 1 4 3377 1 1 31 LYS CG C -14.020 -0.326 -2.837 1.00 . A A . 31 LYS CG 1 1 4 3378 1 1 31 LYS H H -10.690 -0.869 -1.255 1.00 . A A . 31 LYS H 1 1 4 3379 1 1 31 LYS HA H -11.780 -0.695 -3.925 1.00 . A A . 31 LYS HA 1 1 4 3380 1 1 31 LYS HB2 H -12.640 -0.019 -1.259 1.00 . A A . 31 LYS HB2 1 1 4 3381 1 1 31 LYS HB3 H -12.850 1.367 -2.321 1.00 . A A . 31 LYS HB3 1 1 4 3382 1 1 31 LYS HD2 H -15.300 -0.557 -1.147 1.00 . A A . 31 LYS HD2 1 1 4 3383 1 1 31 LYS HD3 H -15.120 1.108 -1.708 1.00 . A A . 31 LYS HD3 1 1 4 3384 1 1 31 LYS HE2 H -16.370 -0.783 -3.605 1.00 . A A . 31 LYS HE2 1 1 4 3385 1 1 31 LYS HE3 H -17.310 -0.403 -2.163 1.00 . A A . 31 LYS HE3 1 1 4 3386 1 1 31 LYS HG2 H -14.160 0.006 -3.855 1.00 . A A . 31 LYS HG2 1 1 4 3387 1 1 31 LYS HG3 H -13.930 -1.402 -2.817 1.00 . A A . 31 LYS HG3 1 1 4 3388 1 1 31 LYS HZ1 H -16.430 1.385 -4.328 1.00 . A A . 31 LYS HZ1 1 1 4 3389 1 1 31 LYS HZ2 H -16.710 2.023 -2.788 1.00 . A A . 31 LYS HZ2 1 1 4 3390 1 1 31 LYS HZ3 H -17.960 1.233 -3.617 1.00 . A A . 31 LYS HZ3 1 1 4 3391 1 1 31 LYS N N -10.640 -0.952 -2.230 1.00 . A A . 31 LYS N 1 1 4 3392 1 1 31 LYS NZ N -16.930 1.236 -3.431 1.00 . A A . 31 LYS NZ 1 1 4 3393 1 1 31 LYS O O -9.518 1.201 -3.423 1.00 . A A . 31 LYS O 1 1 4 3394 1 1 32 GLU C C -9.933 3.942 -3.524 1.00 . A A . 32 GLU C 1 1 4 3395 1 1 32 GLU CA C -10.880 3.335 -4.560 1.00 . A A . 32 GLU CA 1 1 4 3396 1 1 32 GLU CB C -11.970 4.342 -4.927 1.00 . A A . 32 GLU CB 1 1 4 3397 1 1 32 GLU CD C -13.470 4.714 -6.921 1.00 . A A . 32 GLU CD 1 1 4 3398 1 1 32 GLU CG C -12.050 4.641 -6.414 1.00 . A A . 32 GLU CG 1 1 4 3399 1 1 32 GLU H H -12.440 1.979 -4.132 1.00 . A A . 32 GLU H 1 1 4 3400 1 1 32 GLU HA H -10.310 3.096 -5.448 1.00 . A A . 32 GLU HA 1 1 4 3401 1 1 32 GLU HB2 H -12.920 3.947 -4.609 1.00 . A A . 32 GLU HB2 1 1 4 3402 1 1 32 GLU HB3 H -11.780 5.269 -4.404 1.00 . A A . 32 GLU HB3 1 1 4 3403 1 1 32 GLU HG2 H -11.570 5.589 -6.604 1.00 . A A . 32 GLU HG2 1 1 4 3404 1 1 32 GLU HG3 H -11.530 3.861 -6.952 1.00 . A A . 32 GLU HG3 1 1 4 3405 1 1 32 GLU N N -11.470 2.097 -4.068 1.00 . A A . 32 GLU N 1 1 4 3406 1 1 32 GLU O O -8.982 4.641 -3.875 1.00 . A A . 32 GLU O 1 1 4 3407 1 1 32 GLU OE1 O -14.100 5.787 -6.785 1.00 . A A . 32 GLU OE1 1 1 4 3408 1 1 32 GLU OE2 O -13.970 3.697 -7.454 1.00 . A A . 32 GLU OE2 1 1 4 3409 1 1 33 VAL C C -8.922 3.064 -0.238 1.00 . A A . 33 VAL C 1 1 4 3410 1 1 33 VAL CA C -9.371 4.186 -1.169 1.00 . A A . 33 VAL CA 1 1 4 3411 1 1 33 VAL CB C -10.120 5.253 -0.346 1.00 . A A . 33 VAL CB 1 1 4 3412 1 1 33 VAL CG1 C -9.163 5.971 0.593 1.00 . A A . 33 VAL CG1 1 1 4 3413 1 1 33 VAL CG2 C -10.820 6.243 -1.263 1.00 . A A . 33 VAL CG2 1 1 4 3414 1 1 33 VAL H H -10.970 3.105 -2.034 1.00 . A A . 33 VAL H 1 1 4 3415 1 1 33 VAL HA H -8.499 4.647 -1.608 1.00 . A A . 33 VAL HA 1 1 4 3416 1 1 33 VAL HB H -10.860 4.756 0.253 1.00 . A A . 33 VAL HB 1 1 4 3417 1 1 33 VAL HG11 H -8.780 6.856 0.109 1.00 . A A . 33 VAL HG11 1 1 4 3418 1 1 33 VAL HG12 H -8.343 5.315 0.844 1.00 . A A . 33 VAL HG12 1 1 4 3419 1 1 33 VAL HG13 H -9.687 6.254 1.495 1.00 . A A . 33 VAL HG13 1 1 4 3420 1 1 33 VAL HG21 H -11.830 5.908 -1.452 1.00 . A A . 33 VAL HG21 1 1 4 3421 1 1 33 VAL HG22 H -10.280 6.312 -2.197 1.00 . A A . 33 VAL HG22 1 1 4 3422 1 1 33 VAL HG23 H -10.840 7.214 -0.791 1.00 . A A . 33 VAL HG23 1 1 4 3423 1 1 33 VAL N N -10.200 3.669 -2.251 1.00 . A A . 33 VAL N 1 1 4 3424 1 1 33 VAL O O -9.726 2.225 0.169 1.00 . A A . 33 VAL O 1 1 4 3425 1 1 34 ILE C C -7.601 2.188 2.401 1.00 . A A . 34 ILE C 1 1 4 3426 1 1 34 ILE CA C -7.081 2.033 0.974 1.00 . A A . 34 ILE CA 1 1 4 3427 1 1 34 ILE CB C -5.541 2.086 1.002 1.00 . A A . 34 ILE CB 1 1 4 3428 1 1 34 ILE CD1 C -3.570 3.587 1.575 1.00 . A A . 34 ILE CD1 1 1 4 3429 1 1 34 ILE CG1 C -5.062 3.498 1.341 1.00 . A A . 34 ILE CG1 1 1 4 3430 1 1 34 ILE CG2 C -4.969 1.631 -0.331 1.00 . A A . 34 ILE CG2 1 1 4 3431 1 1 34 ILE H H -7.045 3.751 -0.265 1.00 . A A . 34 ILE H 1 1 4 3432 1 1 34 ILE HA H -7.380 1.067 0.594 1.00 . A A . 34 ILE HA 1 1 4 3433 1 1 34 ILE HB H -5.195 1.404 1.764 1.00 . A A . 34 ILE HB 1 1 4 3434 1 1 34 ILE HD11 H -3.052 3.512 0.630 1.00 . A A . 34 ILE HD11 1 1 4 3435 1 1 34 ILE HD12 H -3.257 2.780 2.220 1.00 . A A . 34 ILE HD12 1 1 4 3436 1 1 34 ILE HD13 H -3.335 4.533 2.039 1.00 . A A . 34 ILE HD13 1 1 4 3437 1 1 34 ILE HG12 H -5.308 4.162 0.526 1.00 . A A . 34 ILE HG12 1 1 4 3438 1 1 34 ILE HG13 H -5.560 3.835 2.238 1.00 . A A . 34 ILE HG13 1 1 4 3439 1 1 34 ILE HG21 H -3.891 1.651 -0.284 1.00 . A A . 34 ILE HG21 1 1 4 3440 1 1 34 ILE HG22 H -5.308 2.292 -1.113 1.00 . A A . 34 ILE HG22 1 1 4 3441 1 1 34 ILE HG23 H -5.302 0.625 -0.541 1.00 . A A . 34 ILE HG23 1 1 4 3442 1 1 34 ILE N N -7.635 3.055 0.093 1.00 . A A . 34 ILE N 1 1 4 3443 1 1 34 ILE O O -7.932 3.290 2.833 1.00 . A A . 34 ILE O 1 1 4 3444 1 1 35 PRO C C -7.420 2.120 5.394 1.00 . A A . 35 PRO C 1 1 4 3445 1 1 35 PRO CA C -8.157 1.093 4.539 1.00 . A A . 35 PRO CA 1 1 4 3446 1 1 35 PRO CB C -7.866 -0.325 5.034 1.00 . A A . 35 PRO CB 1 1 4 3447 1 1 35 PRO CD C -7.300 -0.281 2.716 1.00 . A A . 35 PRO CD 1 1 4 3448 1 1 35 PRO CG C -7.856 -1.158 3.801 1.00 . A A . 35 PRO CG 1 1 4 3449 1 1 35 PRO HA H -9.219 1.284 4.586 1.00 . A A . 35 PRO HA 1 1 4 3450 1 1 35 PRO HB2 H -6.908 -0.346 5.534 1.00 . A A . 35 PRO HB2 1 1 4 3451 1 1 35 PRO HB3 H -8.643 -0.638 5.716 1.00 . A A . 35 PRO HB3 1 1 4 3452 1 1 35 PRO HD2 H -6.226 -0.384 2.659 1.00 . A A . 35 PRO HD2 1 1 4 3453 1 1 35 PRO HD3 H -7.754 -0.519 1.765 1.00 . A A . 35 PRO HD3 1 1 4 3454 1 1 35 PRO HG2 H -7.225 -2.024 3.945 1.00 . A A . 35 PRO HG2 1 1 4 3455 1 1 35 PRO HG3 H -8.862 -1.465 3.555 1.00 . A A . 35 PRO HG3 1 1 4 3456 1 1 35 PRO N N -7.677 1.076 3.153 1.00 . A A . 35 PRO N 1 1 4 3457 1 1 35 PRO O O -6.354 2.607 5.014 1.00 . A A . 35 PRO O 1 1 4 3458 1 1 36 GLU C C -6.110 2.876 8.070 1.00 . A A . 36 GLU C 1 1 4 3459 1 1 36 GLU CA C -7.397 3.418 7.453 1.00 . A A . 36 GLU CA 1 1 4 3460 1 1 36 GLU CB C -8.388 3.789 8.559 1.00 . A A . 36 GLU CB 1 1 4 3461 1 1 36 GLU CD C -8.840 5.141 10.644 1.00 . A A . 36 GLU CD 1 1 4 3462 1 1 36 GLU CG C -7.851 4.816 9.541 1.00 . A A . 36 GLU CG 1 1 4 3463 1 1 36 GLU H H -8.846 2.025 6.790 1.00 . A A . 36 GLU H 1 1 4 3464 1 1 36 GLU HA H -7.162 4.304 6.883 1.00 . A A . 36 GLU HA 1 1 4 3465 1 1 36 GLU HB2 H -9.282 4.191 8.104 1.00 . A A . 36 GLU HB2 1 1 4 3466 1 1 36 GLU HB3 H -8.646 2.895 9.109 1.00 . A A . 36 GLU HB3 1 1 4 3467 1 1 36 GLU HG2 H -6.949 4.427 9.991 1.00 . A A . 36 GLU HG2 1 1 4 3468 1 1 36 GLU HG3 H -7.622 5.725 9.002 1.00 . A A . 36 GLU HG3 1 1 4 3469 1 1 36 GLU N N -7.996 2.446 6.545 1.00 . A A . 36 GLU N 1 1 4 3470 1 1 36 GLU O O -5.104 3.581 8.147 1.00 . A A . 36 GLU O 1 1 4 3471 1 1 36 GLU OE1 O -9.220 4.216 11.391 1.00 . A A . 36 GLU OE1 1 1 4 3472 1 1 36 GLU OE2 O -9.234 6.321 10.758 1.00 . A A . 36 GLU OE2 1 1 4 3473 1 1 37 LYS C C -3.960 0.575 8.079 1.00 . A A . 37 LYS C 1 1 4 3474 1 1 37 LYS CA C -4.988 0.991 9.127 1.00 . A A . 37 LYS CA 1 1 4 3475 1 1 37 LYS CB C -5.418 -0.227 9.948 1.00 . A A . 37 LYS CB 1 1 4 3476 1 1 37 LYS CD C -5.982 -1.172 12.206 1.00 . A A . 37 LYS CD 1 1 4 3477 1 1 37 LYS CE C -4.774 -2.093 12.248 1.00 . A A . 37 LYS CE 1 1 4 3478 1 1 37 LYS CG C -5.694 0.089 11.408 1.00 . A A . 37 LYS CG 1 1 4 3479 1 1 37 LYS H H -6.983 1.112 8.426 1.00 . A A . 37 LYS H 1 1 4 3480 1 1 37 LYS HA H -4.532 1.714 9.786 1.00 . A A . 37 LYS HA 1 1 4 3481 1 1 37 LYS HB2 H -6.319 -0.638 9.515 1.00 . A A . 37 LYS HB2 1 1 4 3482 1 1 37 LYS HB3 H -4.637 -0.971 9.904 1.00 . A A . 37 LYS HB3 1 1 4 3483 1 1 37 LYS HD2 H -6.249 -0.897 13.215 1.00 . A A . 37 LYS HD2 1 1 4 3484 1 1 37 LYS HD3 H -6.807 -1.697 11.744 1.00 . A A . 37 LYS HD3 1 1 4 3485 1 1 37 LYS HE2 H -4.972 -2.895 12.945 1.00 . A A . 37 LYS HE2 1 1 4 3486 1 1 37 LYS HE3 H -4.614 -2.503 11.263 1.00 . A A . 37 LYS HE3 1 1 4 3487 1 1 37 LYS HG2 H -4.830 0.579 11.831 1.00 . A A . 37 LYS HG2 1 1 4 3488 1 1 37 LYS HG3 H -6.549 0.747 11.471 1.00 . A A . 37 LYS HG3 1 1 4 3489 1 1 37 LYS HZ1 H -2.817 -2.055 12.980 1.00 . A A . 37 LYS HZ1 1 1 4 3490 1 1 37 LYS HZ2 H -3.759 -0.740 13.475 1.00 . A A . 37 LYS HZ2 1 1 4 3491 1 1 37 LYS HZ3 H -3.167 -0.806 11.892 1.00 . A A . 37 LYS HZ3 1 1 4 3492 1 1 37 LYS N N -6.151 1.622 8.512 1.00 . A A . 37 LYS N 1 1 4 3493 1 1 37 LYS NZ N -3.544 -1.373 12.679 1.00 . A A . 37 LYS NZ 1 1 4 3494 1 1 37 LYS O O -2.790 0.363 8.399 1.00 . A A . 37 LYS O 1 1 4 3495 1 1 38 ASP C C -2.674 1.274 5.291 1.00 . A A . 38 ASP C 1 1 4 3496 1 1 38 ASP CA C -3.499 0.078 5.747 1.00 . A A . 38 ASP CA 1 1 4 3497 1 1 38 ASP CB C -4.295 -0.492 4.573 1.00 . A A . 38 ASP CB 1 1 4 3498 1 1 38 ASP CG C -4.940 -1.824 4.904 1.00 . A A . 38 ASP CG 1 1 4 3499 1 1 38 ASP H H -5.336 0.646 6.628 1.00 . A A . 38 ASP H 1 1 4 3500 1 1 38 ASP HA H -2.832 -0.684 6.125 1.00 . A A . 38 ASP HA 1 1 4 3501 1 1 38 ASP HB2 H -5.074 0.205 4.302 1.00 . A A . 38 ASP HB2 1 1 4 3502 1 1 38 ASP HB3 H -3.633 -0.631 3.730 1.00 . A A . 38 ASP HB3 1 1 4 3503 1 1 38 ASP N N -4.396 0.463 6.829 1.00 . A A . 38 ASP N 1 1 4 3504 1 1 38 ASP O O -1.460 1.172 5.106 1.00 . A A . 38 ASP O 1 1 4 3505 1 1 38 ASP OD1 O -5.304 -2.031 6.080 1.00 . A A . 38 ASP OD1 1 1 4 3506 1 1 38 ASP OD2 O -5.079 -2.660 3.987 1.00 . A A . 38 ASP OD2 1 1 4 3507 1 1 39 ALA C C -1.612 4.059 5.713 1.00 . A A . 39 ALA C 1 1 4 3508 1 1 39 ALA CA C -2.669 3.631 4.697 1.00 . A A . 39 ALA CA 1 1 4 3509 1 1 39 ALA CB C -3.684 4.745 4.491 1.00 . A A . 39 ALA CB 1 1 4 3510 1 1 39 ALA H H -4.304 2.429 5.290 1.00 . A A . 39 ALA H 1 1 4 3511 1 1 39 ALA HA H -2.187 3.437 3.751 1.00 . A A . 39 ALA HA 1 1 4 3512 1 1 39 ALA HB1 H -3.181 5.629 4.127 1.00 . A A . 39 ALA HB1 1 1 4 3513 1 1 39 ALA HB2 H -4.170 4.969 5.429 1.00 . A A . 39 ALA HB2 1 1 4 3514 1 1 39 ALA HB3 H -4.424 4.430 3.771 1.00 . A A . 39 ALA HB3 1 1 4 3515 1 1 39 ALA N N -3.339 2.411 5.122 1.00 . A A . 39 ALA N 1 1 4 3516 1 1 39 ALA O O -0.645 4.733 5.366 1.00 . A A . 39 ALA O 1 1 4 3517 1 1 40 TYR C C 0.458 3.264 7.855 1.00 . A A . 40 TYR C 1 1 4 3518 1 1 40 TYR CA C -0.865 4.007 8.028 1.00 . A A . 40 TYR CA 1 1 4 3519 1 1 40 TYR CB C -1.471 3.684 9.397 1.00 . A A . 40 TYR CB 1 1 4 3520 1 1 40 TYR CD1 C 0.000 5.198 10.786 1.00 . A A . 40 TYR CD1 1 1 4 3521 1 1 40 TYR CD2 C -0.164 2.904 11.413 1.00 . A A . 40 TYR CD2 1 1 4 3522 1 1 40 TYR CE1 C 0.863 5.429 11.841 1.00 . A A . 40 TYR CE1 1 1 4 3523 1 1 40 TYR CE2 C 0.698 3.127 12.470 1.00 . A A . 40 TYR CE2 1 1 4 3524 1 1 40 TYR CG C -0.528 3.934 10.555 1.00 . A A . 40 TYR CG 1 1 4 3525 1 1 40 TYR CZ C 1.208 4.391 12.679 1.00 . A A . 40 TYR CZ 1 1 4 3526 1 1 40 TYR H H -2.597 3.124 7.189 1.00 . A A . 40 TYR H 1 1 4 3527 1 1 40 TYR HA H -0.676 5.068 7.970 1.00 . A A . 40 TYR HA 1 1 4 3528 1 1 40 TYR HB2 H -2.347 4.299 9.548 1.00 . A A . 40 TYR HB2 1 1 4 3529 1 1 40 TYR HB3 H -1.756 2.640 9.420 1.00 . A A . 40 TYR HB3 1 1 4 3530 1 1 40 TYR HD1 H -0.274 6.010 10.129 1.00 . A A . 40 TYR HD1 1 1 4 3531 1 1 40 TYR HD2 H -0.566 1.915 11.246 1.00 . A A . 40 TYR HD2 1 1 4 3532 1 1 40 TYR HE1 H 1.262 6.418 12.005 1.00 . A A . 40 TYR HE1 1 1 4 3533 1 1 40 TYR HE2 H 0.969 2.313 13.126 1.00 . A A . 40 TYR HE2 1 1 4 3534 1 1 40 TYR HH H 2.832 4.042 13.648 1.00 . A A . 40 TYR HH 1 1 4 3535 1 1 40 TYR N N -1.804 3.661 6.969 1.00 . A A . 40 TYR N 1 1 4 3536 1 1 40 TYR O O 1.523 3.875 7.802 1.00 . A A . 40 TYR O 1 1 4 3537 1 1 40 TYR OH O 2.068 4.616 13.729 1.00 . A A . 40 TYR OH 1 1 4 3538 1 1 41 ARG C C 2.351 1.494 6.359 1.00 . A A . 41 ARG C 1 1 4 3539 1 1 41 ARG CA C 1.570 1.108 7.612 1.00 . A A . 41 ARG CA 1 1 4 3540 1 1 41 ARG CB C 1.181 -0.370 7.547 1.00 . A A . 41 ARG CB 1 1 4 3541 1 1 41 ARG CD C 0.593 -2.006 9.369 1.00 . A A . 41 ARG CD 1 1 4 3542 1 1 41 ARG CG C 0.152 -0.775 8.591 1.00 . A A . 41 ARG CG 1 1 4 3543 1 1 41 ARG CZ C 3.036 -2.163 9.710 1.00 . A A . 41 ARG CZ 1 1 4 3544 1 1 41 ARG H H -0.498 1.507 7.826 1.00 . A A . 41 ARG H 1 1 4 3545 1 1 41 ARG HA H 2.201 1.266 8.475 1.00 . A A . 41 ARG HA 1 1 4 3546 1 1 41 ARG HB2 H 0.771 -0.579 6.570 1.00 . A A . 41 ARG HB2 1 1 4 3547 1 1 41 ARG HB3 H 2.067 -0.969 7.692 1.00 . A A . 41 ARG HB3 1 1 4 3548 1 1 41 ARG HD2 H -0.189 -2.273 10.063 1.00 . A A . 41 ARG HD2 1 1 4 3549 1 1 41 ARG HD3 H 0.746 -2.818 8.676 1.00 . A A . 41 ARG HD3 1 1 4 3550 1 1 41 ARG HE H 1.754 -1.298 10.971 1.00 . A A . 41 ARG HE 1 1 4 3551 1 1 41 ARG HG2 H 0.016 0.044 9.283 1.00 . A A . 41 ARG HG2 1 1 4 3552 1 1 41 ARG HG3 H -0.783 -0.988 8.095 1.00 . A A . 41 ARG HG3 1 1 4 3553 1 1 41 ARG HH11 H 2.396 -2.992 7.978 1.00 . A A . 41 ARG HH11 1 1 4 3554 1 1 41 ARG HH12 H 4.100 -3.090 8.262 1.00 . A A . 41 ARG HH12 1 1 4 3555 1 1 41 ARG HH21 H 3.992 -1.429 11.331 1.00 . A A . 41 ARG HH21 1 1 4 3556 1 1 41 ARG HH22 H 5.006 -2.204 10.160 1.00 . A A . 41 ARG HH22 1 1 4 3557 1 1 41 ARG N N 0.380 1.938 7.773 1.00 . A A . 41 ARG N 1 1 4 3558 1 1 41 ARG NE N 1.828 -1.772 10.116 1.00 . A A . 41 ARG NE 1 1 4 3559 1 1 41 ARG NH1 N 3.188 -2.801 8.555 1.00 . A A . 41 ARG NH1 1 1 4 3560 1 1 41 ARG NH2 N 4.099 -1.912 10.461 1.00 . A A . 41 ARG NH2 1 1 4 3561 1 1 41 ARG O O 3.567 1.318 6.297 1.00 . A A . 41 ARG O 1 1 4 3562 1 1 42 LEU C C 3.487 3.317 4.357 1.00 . A A . 42 LEU C 1 1 4 3563 1 1 42 LEU CA C 2.274 2.423 4.106 1.00 . A A . 42 LEU CA 1 1 4 3564 1 1 42 LEU CB C 1.267 3.157 3.219 1.00 . A A . 42 LEU CB 1 1 4 3565 1 1 42 LEU CD1 C -0.631 3.084 1.585 1.00 . A A . 42 LEU CD1 1 1 4 3566 1 1 42 LEU CD2 C 0.982 1.177 1.710 1.00 . A A . 42 LEU CD2 1 1 4 3567 1 1 42 LEU CG C 0.260 2.260 2.500 1.00 . A A . 42 LEU CG 1 1 4 3568 1 1 42 LEU H H 0.677 2.130 5.466 1.00 . A A . 42 LEU H 1 1 4 3569 1 1 42 LEU HA H 2.601 1.530 3.596 1.00 . A A . 42 LEU HA 1 1 4 3570 1 1 42 LEU HB2 H 0.719 3.857 3.837 1.00 . A A . 42 LEU HB2 1 1 4 3571 1 1 42 LEU HB3 H 1.814 3.716 2.475 1.00 . A A . 42 LEU HB3 1 1 4 3572 1 1 42 LEU HD11 H -0.033 3.520 0.798 1.00 . A A . 42 LEU HD11 1 1 4 3573 1 1 42 LEU HD12 H -1.102 3.872 2.157 1.00 . A A . 42 LEU HD12 1 1 4 3574 1 1 42 LEU HD13 H -1.390 2.450 1.153 1.00 . A A . 42 LEU HD13 1 1 4 3575 1 1 42 LEU HD21 H 0.290 0.713 1.023 1.00 . A A . 42 LEU HD21 1 1 4 3576 1 1 42 LEU HD22 H 1.368 0.432 2.390 1.00 . A A . 42 LEU HD22 1 1 4 3577 1 1 42 LEU HD23 H 1.798 1.618 1.158 1.00 . A A . 42 LEU HD23 1 1 4 3578 1 1 42 LEU HG H -0.370 1.776 3.233 1.00 . A A . 42 LEU HG 1 1 4 3579 1 1 42 LEU N N 1.645 2.018 5.360 1.00 . A A . 42 LEU N 1 1 4 3580 1 1 42 LEU O O 4.559 3.101 3.793 1.00 . A A . 42 LEU O 1 1 4 3581 1 1 43 GLU C C 5.582 4.529 6.137 1.00 . A A . 43 GLU C 1 1 4 3582 1 1 43 GLU CA C 4.382 5.255 5.531 1.00 . A A . 43 GLU CA 1 1 4 3583 1 1 43 GLU CB C 3.878 6.325 6.499 1.00 . A A . 43 GLU CB 1 1 4 3584 1 1 43 GLU CD C 4.606 8.279 7.926 1.00 . A A . 43 GLU CD 1 1 4 3585 1 1 43 GLU CG C 4.814 7.515 6.633 1.00 . A A . 43 GLU CG 1 1 4 3586 1 1 43 GLU H H 2.428 4.447 5.620 1.00 . A A . 43 GLU H 1 1 4 3587 1 1 43 GLU HA H 4.692 5.731 4.613 1.00 . A A . 43 GLU HA 1 1 4 3588 1 1 43 GLU HB2 H 2.920 6.686 6.154 1.00 . A A . 43 GLU HB2 1 1 4 3589 1 1 43 GLU HB3 H 3.755 5.882 7.476 1.00 . A A . 43 GLU HB3 1 1 4 3590 1 1 43 GLU HG2 H 5.833 7.161 6.603 1.00 . A A . 43 GLU HG2 1 1 4 3591 1 1 43 GLU HG3 H 4.644 8.187 5.804 1.00 . A A . 43 GLU HG3 1 1 4 3592 1 1 43 GLU N N 3.306 4.324 5.205 1.00 . A A . 43 GLU N 1 1 4 3593 1 1 43 GLU O O 6.695 5.055 6.142 1.00 . A A . 43 GLU O 1 1 4 3594 1 1 43 GLU OE1 O 5.158 7.854 8.962 1.00 . A A . 43 GLU OE1 1 1 4 3595 1 1 43 GLU OE2 O 3.889 9.302 7.903 1.00 . A A . 43 GLU OE2 1 1 4 3596 1 1 44 ILE C C 7.096 1.628 6.242 1.00 . A A . 44 ILE C 1 1 4 3597 1 1 44 ILE CA C 6.420 2.542 7.261 1.00 . A A . 44 ILE CA 1 1 4 3598 1 1 44 ILE CB C 5.891 1.688 8.427 1.00 . A A . 44 ILE CB 1 1 4 3599 1 1 44 ILE CD1 C 5.078 2.101 10.820 1.00 . A A . 44 ILE CD1 1 1 4 3600 1 1 44 ILE CG1 C 5.057 2.559 9.377 1.00 . A A . 44 ILE CG1 1 1 4 3601 1 1 44 ILE CG2 C 7.052 1.022 9.159 1.00 . A A . 44 ILE CG2 1 1 4 3602 1 1 44 ILE H H 4.445 2.956 6.624 1.00 . A A . 44 ILE H 1 1 4 3603 1 1 44 ILE HA H 7.153 3.229 7.656 1.00 . A A . 44 ILE HA 1 1 4 3604 1 1 44 ILE HB H 5.263 0.910 8.019 1.00 . A A . 44 ILE HB 1 1 4 3605 1 1 44 ILE HD11 H 6.083 2.182 11.205 1.00 . A A . 44 ILE HD11 1 1 4 3606 1 1 44 ILE HD12 H 4.750 1.075 10.876 1.00 . A A . 44 ILE HD12 1 1 4 3607 1 1 44 ILE HD13 H 4.416 2.724 11.404 1.00 . A A . 44 ILE HD13 1 1 4 3608 1 1 44 ILE HG12 H 5.435 3.570 9.348 1.00 . A A . 44 ILE HG12 1 1 4 3609 1 1 44 ILE HG13 H 4.029 2.557 9.043 1.00 . A A . 44 ILE HG13 1 1 4 3610 1 1 44 ILE HG21 H 7.627 0.432 8.460 1.00 . A A . 44 ILE HG21 1 1 4 3611 1 1 44 ILE HG22 H 6.666 0.382 9.938 1.00 . A A . 44 ILE HG22 1 1 4 3612 1 1 44 ILE HG23 H 7.684 1.781 9.597 1.00 . A A . 44 ILE HG23 1 1 4 3613 1 1 44 ILE N N 5.353 3.325 6.651 1.00 . A A . 44 ILE N 1 1 4 3614 1 1 44 ILE O O 8.323 1.583 6.152 1.00 . A A . 44 ILE O 1 1 4 3615 1 1 45 VAL C C 7.491 0.739 3.333 1.00 . A A . 45 VAL C 1 1 4 3616 1 1 45 VAL CA C 6.810 -0.015 4.469 1.00 . A A . 45 VAL CA 1 1 4 3617 1 1 45 VAL CB C 5.700 -0.905 3.878 1.00 . A A . 45 VAL CB 1 1 4 3618 1 1 45 VAL CG1 C 5.303 -1.992 4.864 1.00 . A A . 45 VAL CG1 1 1 4 3619 1 1 45 VAL CG2 C 4.492 -0.071 3.476 1.00 . A A . 45 VAL CG2 1 1 4 3620 1 1 45 VAL H H 5.322 0.977 5.598 1.00 . A A . 45 VAL H 1 1 4 3621 1 1 45 VAL HA H 7.535 -0.655 4.948 1.00 . A A . 45 VAL HA 1 1 4 3622 1 1 45 VAL HB H 6.089 -1.380 2.991 1.00 . A A . 45 VAL HB 1 1 4 3623 1 1 45 VAL HG11 H 4.247 -2.197 4.767 1.00 . A A . 45 VAL HG11 1 1 4 3624 1 1 45 VAL HG12 H 5.515 -1.661 5.869 1.00 . A A . 45 VAL HG12 1 1 4 3625 1 1 45 VAL HG13 H 5.864 -2.890 4.654 1.00 . A A . 45 VAL HG13 1 1 4 3626 1 1 45 VAL HG21 H 3.787 -0.694 2.946 1.00 . A A . 45 VAL HG21 1 1 4 3627 1 1 45 VAL HG22 H 4.809 0.738 2.836 1.00 . A A . 45 VAL HG22 1 1 4 3628 1 1 45 VAL HG23 H 4.021 0.333 4.360 1.00 . A A . 45 VAL HG23 1 1 4 3629 1 1 45 VAL N N 6.290 0.900 5.478 1.00 . A A . 45 VAL N 1 1 4 3630 1 1 45 VAL O O 8.535 0.320 2.833 1.00 . A A . 45 VAL O 1 1 4 3631 1 1 46 THR C C 8.567 3.560 2.331 1.00 . A A . 46 THR C 1 1 4 3632 1 1 46 THR CA C 7.425 2.664 1.848 1.00 . A A . 46 THR CA 1 1 4 3633 1 1 46 THR CB C 6.310 3.517 1.251 1.00 . A A . 46 THR CB 1 1 4 3634 1 1 46 THR CG2 C 5.099 2.713 0.832 1.00 . A A . 46 THR CG2 1 1 4 3635 1 1 46 THR H H 6.057 2.129 3.359 1.00 . A A . 46 THR H 1 1 4 3636 1 1 46 THR HA H 7.802 1.998 1.087 1.00 . A A . 46 THR HA 1 1 4 3637 1 1 46 THR HB H 6.690 4.021 0.380 1.00 . A A . 46 THR HB 1 1 4 3638 1 1 46 THR HG1 H 5.750 4.090 3.038 1.00 . A A . 46 THR HG1 1 1 4 3639 1 1 46 THR HG21 H 4.865 2.925 -0.201 1.00 . A A . 46 THR HG21 1 1 4 3640 1 1 46 THR HG22 H 4.257 2.979 1.453 1.00 . A A . 46 THR HG22 1 1 4 3641 1 1 46 THR HG23 H 5.309 1.660 0.943 1.00 . A A . 46 THR HG23 1 1 4 3642 1 1 46 THR N N 6.888 1.850 2.927 1.00 . A A . 46 THR N 1 1 4 3643 1 1 46 THR O O 9.111 4.348 1.558 1.00 . A A . 46 THR O 1 1 4 3644 1 1 46 THR OG1 O 5.876 4.497 2.178 1.00 . A A . 46 THR OG1 1 1 4 3645 1 1 47 ALA C C 9.622 5.718 4.213 1.00 . A A . 47 ALA C 1 1 4 3646 1 1 47 ALA CA C 10.002 4.243 4.177 1.00 . A A . 47 ALA CA 1 1 4 3647 1 1 47 ALA CB C 11.287 4.047 3.384 1.00 . A A . 47 ALA CB 1 1 4 3648 1 1 47 ALA H H 8.461 2.798 4.181 1.00 . A A . 47 ALA H 1 1 4 3649 1 1 47 ALA HA H 10.176 3.902 5.187 1.00 . A A . 47 ALA HA 1 1 4 3650 1 1 47 ALA HB1 H 11.412 4.866 2.691 1.00 . A A . 47 ALA HB1 1 1 4 3651 1 1 47 ALA HB2 H 11.235 3.117 2.838 1.00 . A A . 47 ALA HB2 1 1 4 3652 1 1 47 ALA HB3 H 12.127 4.018 4.062 1.00 . A A . 47 ALA HB3 1 1 4 3653 1 1 47 ALA N N 8.926 3.440 3.608 1.00 . A A . 47 ALA N 1 1 4 3654 1 1 47 ALA O O 10.480 6.594 4.106 1.00 . A A . 47 ALA O 1 1 4 3655 1 1 48 GLY C C 7.657 7.958 3.040 1.00 . A A . 48 GLY C 1 1 4 3656 1 1 48 GLY CA C 7.859 7.358 4.418 1.00 . A A . 48 GLY CA 1 1 4 3657 1 1 48 GLY H H 7.690 5.246 4.450 1.00 . A A . 48 GLY H 1 1 4 3658 1 1 48 GLY HA2 H 6.921 7.384 4.951 1.00 . A A . 48 GLY HA2 1 1 4 3659 1 1 48 GLY HA3 H 8.580 7.955 4.956 1.00 . A A . 48 GLY HA3 1 1 4 3660 1 1 48 GLY N N 8.330 5.987 4.368 1.00 . A A . 48 GLY N 1 1 4 3661 1 1 48 GLY O O 7.732 9.175 2.869 1.00 . A A . 48 GLY O 1 1 4 3662 1 1 49 ALA C C 5.728 7.976 0.474 1.00 . A A . 49 ALA C 1 1 4 3663 1 1 49 ALA CA C 7.179 7.562 0.689 1.00 . A A . 49 ALA CA 1 1 4 3664 1 1 49 ALA CB C 7.572 6.474 -0.300 1.00 . A A . 49 ALA CB 1 1 4 3665 1 1 49 ALA H H 7.345 6.147 2.253 1.00 . A A . 49 ALA H 1 1 4 3666 1 1 49 ALA HA H 7.816 8.418 0.517 1.00 . A A . 49 ALA HA 1 1 4 3667 1 1 49 ALA HB1 H 6.726 5.826 -0.478 1.00 . A A . 49 ALA HB1 1 1 4 3668 1 1 49 ALA HB2 H 8.388 5.895 0.106 1.00 . A A . 49 ALA HB2 1 1 4 3669 1 1 49 ALA HB3 H 7.880 6.927 -1.231 1.00 . A A . 49 ALA HB3 1 1 4 3670 1 1 49 ALA N N 7.394 7.105 2.056 1.00 . A A . 49 ALA N 1 1 4 3671 1 1 49 ALA O O 5.446 8.954 -0.218 1.00 . A A . 49 ALA O 1 1 4 3672 1 1 50 LEU C C 2.879 8.265 2.175 1.00 . A A . 50 LEU C 1 1 4 3673 1 1 50 LEU CA C 3.387 7.511 0.951 1.00 . A A . 50 LEU CA 1 1 4 3674 1 1 50 LEU CB C 2.597 6.212 0.773 1.00 . A A . 50 LEU CB 1 1 4 3675 1 1 50 LEU CD1 C 2.063 4.212 -0.640 1.00 . A A . 50 LEU CD1 1 1 4 3676 1 1 50 LEU CD2 C 1.863 6.511 -1.605 1.00 . A A . 50 LEU CD2 1 1 4 3677 1 1 50 LEU CG C 2.632 5.622 -0.638 1.00 . A A . 50 LEU CG 1 1 4 3678 1 1 50 LEU H H 5.099 6.457 1.611 1.00 . A A . 50 LEU H 1 1 4 3679 1 1 50 LEU HA H 3.246 8.130 0.078 1.00 . A A . 50 LEU HA 1 1 4 3680 1 1 50 LEU HB2 H 2.994 5.478 1.459 1.00 . A A . 50 LEU HB2 1 1 4 3681 1 1 50 LEU HB3 H 1.566 6.403 1.035 1.00 . A A . 50 LEU HB3 1 1 4 3682 1 1 50 LEU HD11 H 1.020 4.245 -0.921 1.00 . A A . 50 LEU HD11 1 1 4 3683 1 1 50 LEU HD12 H 2.157 3.784 0.348 1.00 . A A . 50 LEU HD12 1 1 4 3684 1 1 50 LEU HD13 H 2.606 3.605 -1.348 1.00 . A A . 50 LEU HD13 1 1 4 3685 1 1 50 LEU HD21 H 0.860 6.131 -1.724 1.00 . A A . 50 LEU HD21 1 1 4 3686 1 1 50 LEU HD22 H 2.363 6.514 -2.563 1.00 . A A . 50 LEU HD22 1 1 4 3687 1 1 50 LEU HD23 H 1.825 7.516 -1.215 1.00 . A A . 50 LEU HD23 1 1 4 3688 1 1 50 LEU HG H 3.657 5.568 -0.973 1.00 . A A . 50 LEU HG 1 1 4 3689 1 1 50 LEU N N 4.810 7.223 1.073 1.00 . A A . 50 LEU N 1 1 4 3690 1 1 50 LEU O O 3.030 7.803 3.308 1.00 . A A . 50 LEU O 1 1 4 3691 1 1 51 LYS C C 0.399 9.729 3.496 1.00 . A A . 51 LYS C 1 1 4 3692 1 1 51 LYS CA C 1.756 10.248 3.028 1.00 . A A . 51 LYS CA 1 1 4 3693 1 1 51 LYS CB C 1.631 11.705 2.583 1.00 . A A . 51 LYS CB 1 1 4 3694 1 1 51 LYS CD C 3.351 12.710 4.115 1.00 . A A . 51 LYS CD 1 1 4 3695 1 1 51 LYS CE C 3.503 12.957 5.607 1.00 . A A . 51 LYS CE 1 1 4 3696 1 1 51 LYS CG C 1.889 12.706 3.697 1.00 . A A . 51 LYS CG 1 1 4 3697 1 1 51 LYS H H 2.194 9.745 1.020 1.00 . A A . 51 LYS H 1 1 4 3698 1 1 51 LYS HA H 2.452 10.191 3.852 1.00 . A A . 51 LYS HA 1 1 4 3699 1 1 51 LYS HB2 H 2.343 11.889 1.790 1.00 . A A . 51 LYS HB2 1 1 4 3700 1 1 51 LYS HB3 H 0.633 11.870 2.203 1.00 . A A . 51 LYS HB3 1 1 4 3701 1 1 51 LYS HD2 H 3.787 11.751 3.874 1.00 . A A . 51 LYS HD2 1 1 4 3702 1 1 51 LYS HD3 H 3.868 13.489 3.575 1.00 . A A . 51 LYS HD3 1 1 4 3703 1 1 51 LYS HE2 H 2.970 13.861 5.865 1.00 . A A . 51 LYS HE2 1 1 4 3704 1 1 51 LYS HE3 H 3.075 12.123 6.143 1.00 . A A . 51 LYS HE3 1 1 4 3705 1 1 51 LYS HG2 H 1.623 13.693 3.349 1.00 . A A . 51 LYS HG2 1 1 4 3706 1 1 51 LYS HG3 H 1.280 12.445 4.550 1.00 . A A . 51 LYS HG3 1 1 4 3707 1 1 51 LYS HZ1 H 5.000 13.649 6.889 1.00 . A A . 51 LYS HZ1 1 1 4 3708 1 1 51 LYS HZ2 H 5.455 13.611 5.262 1.00 . A A . 51 LYS HZ2 1 1 4 3709 1 1 51 LYS HZ3 H 5.362 12.173 6.145 1.00 . A A . 51 LYS HZ3 1 1 4 3710 1 1 51 LYS N N 2.282 9.428 1.943 1.00 . A A . 51 LYS N 1 1 4 3711 1 1 51 LYS NZ N 4.930 13.109 6.004 1.00 . A A . 51 LYS NZ 1 1 4 3712 1 1 51 LYS O O -0.547 9.645 2.715 1.00 . A A . 51 LYS O 1 1 4 3713 1 1 52 TYR C C -1.738 10.014 5.973 1.00 . A A . 52 TYR C 1 1 4 3714 1 1 52 TYR CA C -0.926 8.879 5.354 1.00 . A A . 52 TYR CA 1 1 4 3715 1 1 52 TYR CB C -0.618 7.811 6.409 1.00 . A A . 52 TYR CB 1 1 4 3716 1 1 52 TYR CD1 C -3.021 7.062 6.659 1.00 . A A . 52 TYR CD1 1 1 4 3717 1 1 52 TYR CD2 C -1.725 7.373 8.636 1.00 . A A . 52 TYR CD2 1 1 4 3718 1 1 52 TYR CE1 C -4.109 6.692 7.426 1.00 . A A . 52 TYR CE1 1 1 4 3719 1 1 52 TYR CE2 C -2.809 7.004 9.409 1.00 . A A . 52 TYR CE2 1 1 4 3720 1 1 52 TYR CG C -1.812 7.408 7.249 1.00 . A A . 52 TYR CG 1 1 4 3721 1 1 52 TYR CZ C -3.998 6.664 8.800 1.00 . A A . 52 TYR CZ 1 1 4 3722 1 1 52 TYR H H 1.104 9.479 5.351 1.00 . A A . 52 TYR H 1 1 4 3723 1 1 52 TYR HA H -1.502 8.432 4.557 1.00 . A A . 52 TYR HA 1 1 4 3724 1 1 52 TYR HB2 H -0.250 6.925 5.915 1.00 . A A . 52 TYR HB2 1 1 4 3725 1 1 52 TYR HB3 H 0.145 8.186 7.076 1.00 . A A . 52 TYR HB3 1 1 4 3726 1 1 52 TYR HD1 H -3.109 7.084 5.583 1.00 . A A . 52 TYR HD1 1 1 4 3727 1 1 52 TYR HD2 H -0.793 7.641 9.110 1.00 . A A . 52 TYR HD2 1 1 4 3728 1 1 52 TYR HE1 H -5.038 6.424 6.948 1.00 . A A . 52 TYR HE1 1 1 4 3729 1 1 52 TYR HE2 H -2.722 6.984 10.485 1.00 . A A . 52 TYR HE2 1 1 4 3730 1 1 52 TYR HH H -5.478 5.505 9.199 1.00 . A A . 52 TYR HH 1 1 4 3731 1 1 52 TYR N N 0.314 9.387 4.778 1.00 . A A . 52 TYR N 1 1 4 3732 1 1 52 TYR O O -1.230 10.780 6.792 1.00 . A A . 52 TYR O 1 1 4 3733 1 1 52 TYR OH O -5.078 6.296 9.566 1.00 . A A . 52 TYR OH 1 1 4 3734 1 1 53 GLN C C -5.207 10.556 6.562 1.00 . A A . 53 GLN C 1 1 4 3735 1 1 53 GLN CA C -3.884 11.152 6.095 1.00 . A A . 53 GLN CA 1 1 4 3736 1 1 53 GLN CB C -4.139 12.215 5.025 1.00 . A A . 53 GLN CB 1 1 4 3737 1 1 53 GLN CD C -3.184 11.243 2.898 1.00 . A A . 53 GLN CD 1 1 4 3738 1 1 53 GLN CG C -4.439 11.639 3.651 1.00 . A A . 53 GLN CG 1 1 4 3739 1 1 53 GLN H H -3.351 9.472 4.923 1.00 . A A . 53 GLN H 1 1 4 3740 1 1 53 GLN HA H -3.393 11.612 6.939 1.00 . A A . 53 GLN HA 1 1 4 3741 1 1 53 GLN HB2 H -4.979 12.822 5.329 1.00 . A A . 53 GLN HB2 1 1 4 3742 1 1 53 GLN HB3 H -3.265 12.845 4.944 1.00 . A A . 53 GLN HB3 1 1 4 3743 1 1 53 GLN HE21 H -2.488 13.100 3.035 1.00 . A A . 53 GLN HE21 1 1 4 3744 1 1 53 GLN HE22 H -1.468 11.975 2.209 1.00 . A A . 53 GLN HE22 1 1 4 3745 1 1 53 GLN HG2 H -5.059 10.763 3.771 1.00 . A A . 53 GLN HG2 1 1 4 3746 1 1 53 GLN HG3 H -4.971 12.380 3.073 1.00 . A A . 53 GLN HG3 1 1 4 3747 1 1 53 GLN N N -3.002 10.113 5.578 1.00 . A A . 53 GLN N 1 1 4 3748 1 1 53 GLN NE2 N -2.290 12.203 2.694 1.00 . A A . 53 GLN NE2 1 1 4 3749 1 1 53 GLN O O -5.963 9.996 5.769 1.00 . A A . 53 GLN O 1 1 4 3750 1 1 53 GLN OE1 O -3.019 10.088 2.507 1.00 . A A . 53 GLN OE1 1 1 4 3751 1 1 54 GLU C C -7.928 10.980 8.022 1.00 . A A . 54 GLU C 1 1 4 3752 1 1 54 GLU CA C -6.710 10.157 8.439 1.00 . A A . 54 GLU CA 1 1 4 3753 1 1 54 GLU CB C -6.603 10.128 9.964 1.00 . A A . 54 GLU CB 1 1 4 3754 1 1 54 GLU CD C -5.623 8.988 11.994 1.00 . A A . 54 GLU CD 1 1 4 3755 1 1 54 GLU CG C -5.871 8.909 10.500 1.00 . A A . 54 GLU CG 1 1 4 3756 1 1 54 GLU H H -4.836 11.141 8.438 1.00 . A A . 54 GLU H 1 1 4 3757 1 1 54 GLU HA H -6.839 9.148 8.081 1.00 . A A . 54 GLU HA 1 1 4 3758 1 1 54 GLU HB2 H -6.076 11.012 10.293 1.00 . A A . 54 GLU HB2 1 1 4 3759 1 1 54 GLU HB3 H -7.598 10.137 10.384 1.00 . A A . 54 GLU HB3 1 1 4 3760 1 1 54 GLU HG2 H -6.463 8.030 10.296 1.00 . A A . 54 GLU HG2 1 1 4 3761 1 1 54 GLU HG3 H -4.919 8.827 9.996 1.00 . A A . 54 GLU HG3 1 1 4 3762 1 1 54 GLU N N -5.479 10.684 7.858 1.00 . A A . 54 GLU N 1 1 4 3763 1 1 54 GLU O O -9.062 10.623 8.340 1.00 . A A . 54 GLU O 1 1 4 3764 1 1 54 GLU OE1 O -6.611 9.003 12.760 1.00 . A A . 54 GLU OE1 1 1 4 3765 1 1 54 GLU OE2 O -4.443 9.036 12.400 1.00 . A A . 54 GLU OE2 1 1 4 3766 1 1 55 ASN C C -9.907 12.134 6.227 1.00 . A A . 55 ASN C 1 1 4 3767 1 1 55 ASN CA C -8.784 12.949 6.864 1.00 . A A . 55 ASN CA 1 1 4 3768 1 1 55 ASN CB C -8.263 13.987 5.867 1.00 . A A . 55 ASN CB 1 1 4 3769 1 1 55 ASN CG C -7.777 15.250 6.551 1.00 . A A . 55 ASN CG 1 1 4 3770 1 1 55 ASN H H -6.775 12.329 7.090 1.00 . A A . 55 ASN H 1 1 4 3771 1 1 55 ASN HA H -9.175 13.458 7.729 1.00 . A A . 55 ASN HA 1 1 4 3772 1 1 55 ASN HB2 H -7.439 13.563 5.311 1.00 . A A . 55 ASN HB2 1 1 4 3773 1 1 55 ASN HB3 H -9.056 14.251 5.184 1.00 . A A . 55 ASN HB3 1 1 4 3774 1 1 55 ASN HD21 H -6.355 15.476 5.179 1.00 . A A . 55 ASN HD21 1 1 4 3775 1 1 55 ASN HD22 H -6.407 16.685 6.413 1.00 . A A . 55 ASN HD22 1 1 4 3776 1 1 55 ASN N N -7.695 12.086 7.313 1.00 . A A . 55 ASN N 1 1 4 3777 1 1 55 ASN ND2 N -6.742 15.866 5.991 1.00 . A A . 55 ASN ND2 1 1 4 3778 1 1 55 ASN O O -11.000 12.039 6.776 1.00 . A A . 55 ASN O 1 1 4 3779 1 1 55 ASN OD1 O -8.325 15.668 7.571 1.00 . A A . 55 ASN OD1 1 1 4 3780 1 1 56 ALA C C -10.930 9.467 5.156 1.00 . A A . 56 ALA C 1 1 4 3781 1 1 56 ALA CA C -10.610 10.734 4.370 1.00 . A A . 56 ALA CA 1 1 4 3782 1 1 56 ALA CB C -10.100 10.379 2.979 1.00 . A A . 56 ALA CB 1 1 4 3783 1 1 56 ALA H H -8.729 11.652 4.685 1.00 . A A . 56 ALA H 1 1 4 3784 1 1 56 ALA HA H -11.510 11.322 4.264 1.00 . A A . 56 ALA HA 1 1 4 3785 1 1 56 ALA HB1 H -10.480 9.405 2.700 1.00 . A A . 56 ALA HB1 1 1 4 3786 1 1 56 ALA HB2 H -9.028 10.366 2.979 1.00 . A A . 56 ALA HB2 1 1 4 3787 1 1 56 ALA HB3 H -10.450 11.115 2.271 1.00 . A A . 56 ALA HB3 1 1 4 3788 1 1 56 ALA N N -9.624 11.544 5.071 1.00 . A A . 56 ALA N 1 1 4 3789 1 1 56 ALA O O -11.930 8.795 4.882 1.00 . A A . 56 ALA O 1 1 4 3790 1 1 57 TYR C C -10.930 8.317 8.296 1.00 . A A . 57 TYR C 1 1 4 3791 1 1 57 TYR CA C -10.290 7.958 6.959 1.00 . A A . 57 TYR CA 1 1 4 3792 1 1 57 TYR CB C -8.962 7.251 7.191 1.00 . A A . 57 TYR CB 1 1 4 3793 1 1 57 TYR CD1 C -8.798 6.232 4.891 1.00 . A A . 57 TYR CD1 1 1 4 3794 1 1 57 TYR CD2 C -6.909 7.420 5.730 1.00 . A A . 57 TYR CD2 1 1 4 3795 1 1 57 TYR CE1 C -8.116 5.966 3.720 1.00 . A A . 57 TYR CE1 1 1 4 3796 1 1 57 TYR CE2 C -6.220 7.157 4.559 1.00 . A A . 57 TYR CE2 1 1 4 3797 1 1 57 TYR CG C -8.207 6.962 5.915 1.00 . A A . 57 TYR CG 1 1 4 3798 1 1 57 TYR CZ C -6.827 6.430 3.560 1.00 . A A . 57 TYR CZ 1 1 4 3799 1 1 57 TYR H H -9.320 9.715 6.308 1.00 . A A . 57 TYR H 1 1 4 3800 1 1 57 TYR HA H -10.950 7.291 6.425 1.00 . A A . 57 TYR HA 1 1 4 3801 1 1 57 TYR HB2 H -8.337 7.873 7.814 1.00 . A A . 57 TYR HB2 1 1 4 3802 1 1 57 TYR HB3 H -9.141 6.311 7.692 1.00 . A A . 57 TYR HB3 1 1 4 3803 1 1 57 TYR HD1 H -9.806 5.871 5.020 1.00 . A A . 57 TYR HD1 1 1 4 3804 1 1 57 TYR HD2 H -6.434 7.990 6.516 1.00 . A A . 57 TYR HD2 1 1 4 3805 1 1 57 TYR HE1 H -8.593 5.396 2.938 1.00 . A A . 57 TYR HE1 1 1 4 3806 1 1 57 TYR HE2 H -5.210 7.521 4.436 1.00 . A A . 57 TYR HE2 1 1 4 3807 1 1 57 TYR HH H -6.601 5.485 1.896 1.00 . A A . 57 TYR HH 1 1 4 3808 1 1 57 TYR N N -10.090 9.143 6.136 1.00 . A A . 57 TYR N 1 1 4 3809 1 1 57 TYR O O -10.780 7.595 9.282 1.00 . A A . 57 TYR O 1 1 4 3810 1 1 57 TYR OH O -6.143 6.166 2.394 1.00 . A A . 57 TYR OH 1 1 4 3811 1 1 58 ARG C C -13.820 9.668 9.451 1.00 . A A . 58 ARG C 1 1 4 3812 1 1 58 ARG CA C -12.310 9.886 9.543 1.00 . A A . 58 ARG CA 1 1 4 3813 1 1 58 ARG CB C -12.010 11.365 9.799 1.00 . A A . 58 ARG CB 1 1 4 3814 1 1 58 ARG CD C -10.610 13.032 11.055 1.00 . A A . 58 ARG CD 1 1 4 3815 1 1 58 ARG CG C -11.130 11.603 11.015 1.00 . A A . 58 ARG CG 1 1 4 3816 1 1 58 ARG CZ C -8.890 12.900 12.807 1.00 . A A . 58 ARG CZ 1 1 4 3817 1 1 58 ARG H H -11.740 9.969 7.509 1.00 . A A . 58 ARG H 1 1 4 3818 1 1 58 ARG HA H -11.930 9.302 10.366 1.00 . A A . 58 ARG HA 1 1 4 3819 1 1 58 ARG HB2 H -11.510 11.771 8.934 1.00 . A A . 58 ARG HB2 1 1 4 3820 1 1 58 ARG HB3 H -12.940 11.894 9.945 1.00 . A A . 58 ARG HB3 1 1 4 3821 1 1 58 ARG HD2 H -9.854 13.144 10.299 1.00 . A A . 58 ARG HD2 1 1 4 3822 1 1 58 ARG HD3 H -11.430 13.703 10.841 1.00 . A A . 58 ARG HD3 1 1 4 3823 1 1 58 ARG HE H -10.560 13.987 12.926 1.00 . A A . 58 ARG HE 1 1 4 3824 1 1 58 ARG HG2 H -11.710 11.418 11.909 1.00 . A A . 58 ARG HG2 1 1 4 3825 1 1 58 ARG HG3 H -10.290 10.925 10.981 1.00 . A A . 58 ARG HG3 1 1 4 3826 1 1 58 ARG HH11 H -8.503 11.785 11.164 1.00 . A A . 58 ARG HH11 1 1 4 3827 1 1 58 ARG HH12 H -7.303 11.712 12.410 1.00 . A A . 58 ARG HH12 1 1 4 3828 1 1 58 ARG HH21 H -8.982 13.893 14.565 1.00 . A A . 58 ARG HH21 1 1 4 3829 1 1 58 ARG HH22 H -7.575 12.910 14.341 1.00 . A A . 58 ARG HH22 1 1 4 3830 1 1 58 ARG N N -11.650 9.436 8.326 1.00 . A A . 58 ARG N 1 1 4 3831 1 1 58 ARG NE N -10.050 13.373 12.357 1.00 . A A . 58 ARG NE 1 1 4 3832 1 1 58 ARG NH1 N -8.173 12.063 12.066 1.00 . A A . 58 ARG NH1 1 1 4 3833 1 1 58 ARG NH2 N -8.445 13.264 14.002 1.00 . A A . 58 ARG NH2 1 1 4 3834 1 1 58 ARG O O -14.400 9.700 8.363 1.00 . A A . 58 ARG O 1 1 4 3835 1 1 59 GLN C C -16.650 10.548 10.687 1.00 . A A . 59 GLN C 1 1 4 3836 1 1 59 GLN CA C -15.890 9.223 10.645 1.00 . A A . 59 GLN CA 1 1 4 3837 1 1 59 GLN CB C -16.260 8.375 11.864 1.00 . A A . 59 GLN CB 1 1 4 3838 1 1 59 GLN CD C -16.950 6.064 11.117 1.00 . A A . 59 GLN CD 1 1 4 3839 1 1 59 GLN CG C -17.420 7.420 11.616 1.00 . A A . 59 GLN CG 1 1 4 3840 1 1 59 GLN H H -13.940 9.433 11.433 1.00 . A A . 59 GLN H 1 1 4 3841 1 1 59 GLN HA H -16.180 8.692 9.750 1.00 . A A . 59 GLN HA 1 1 4 3842 1 1 59 GLN HB2 H -15.400 7.794 12.157 1.00 . A A . 59 GLN HB2 1 1 4 3843 1 1 59 GLN HB3 H -16.530 9.033 12.677 1.00 . A A . 59 GLN HB3 1 1 4 3844 1 1 59 GLN HE21 H -18.310 5.157 12.248 1.00 . A A . 59 GLN HE21 1 1 4 3845 1 1 59 GLN HE22 H -17.310 4.117 11.298 1.00 . A A . 59 GLN HE22 1 1 4 3846 1 1 59 GLN HG2 H -17.960 7.280 12.539 1.00 . A A . 59 GLN HG2 1 1 4 3847 1 1 59 GLN HG3 H -18.070 7.854 10.876 1.00 . A A . 59 GLN HG3 1 1 4 3848 1 1 59 GLN N N -14.450 9.447 10.599 1.00 . A A . 59 GLN N 1 1 4 3849 1 1 59 GLN NE2 N -17.590 5.006 11.604 1.00 . A A . 59 GLN NE2 1 1 4 3850 1 1 59 GLN O O -16.500 11.333 11.624 1.00 . A A . 59 GLN O 1 1 4 3851 1 1 59 GLN OE1 O -16.030 5.969 10.303 1.00 . A A . 59 GLN OE1 1 1 4 3852 1 1 60 ALA C C -19.420 11.859 8.629 1.00 . A A . 60 ALA C 1 1 4 3853 1 1 60 ALA CA C -18.240 12.019 9.586 1.00 . A A . 60 ALA CA 1 1 4 3854 1 1 60 ALA CB C -17.360 13.176 9.146 1.00 . A A . 60 ALA CB 1 1 4 3855 1 1 60 ALA H H -17.540 10.126 8.949 1.00 . A A . 60 ALA H 1 1 4 3856 1 1 60 ALA HA H -18.620 12.240 10.573 1.00 . A A . 60 ALA HA 1 1 4 3857 1 1 60 ALA HB1 H -17.970 14.046 8.962 1.00 . A A . 60 ALA HB1 1 1 4 3858 1 1 60 ALA HB2 H -16.830 12.906 8.242 1.00 . A A . 60 ALA HB2 1 1 4 3859 1 1 60 ALA HB3 H -16.650 13.398 9.925 1.00 . A A . 60 ALA HB3 1 1 4 3860 1 1 60 ALA N N -17.460 10.790 9.667 1.00 . A A . 60 ALA N 1 1 4 3861 1 1 60 ALA O O -19.270 11.975 7.414 1.00 . A A . 60 ALA O 1 1 4 3862 1 1 61 ALA C C -22.530 12.740 8.194 1.00 . A A . 61 ALA C 1 1 4 3863 1 1 61 ALA CA C -21.800 11.416 8.386 1.00 . A A . 61 ALA CA 1 1 4 3864 1 1 61 ALA CB C -22.720 10.392 9.035 1.00 . A A . 61 ALA CB 1 1 4 3865 1 1 61 ALA H H -20.660 11.512 10.164 1.00 . A A . 61 ALA H 1 1 4 3866 1 1 61 ALA HA H -21.510 11.036 7.418 1.00 . A A . 61 ALA HA 1 1 4 3867 1 1 61 ALA HB1 H -23.650 10.349 8.489 1.00 . A A . 61 ALA HB1 1 1 4 3868 1 1 61 ALA HB2 H -22.920 10.680 10.057 1.00 . A A . 61 ALA HB2 1 1 4 3869 1 1 61 ALA HB3 H -22.250 9.422 9.019 1.00 . A A . 61 ALA HB3 1 1 4 3870 1 1 61 ALA N N -20.600 11.592 9.188 1.00 . A A . 61 ALA N 1 1 4 3871 1 1 61 ALA O O -22.960 13.332 9.207 1.00 . A A . 61 ALA O 1 1 4 3872 1 1 61 ALA OXT O -22.670 13.176 7.031 1.00 . A A . 61 ALA OXT 1 1 5 3873 1 1 1 MET C C -4.970 6.014 -0.916 1.00 . A A . 1 MET C 1 1 5 3874 1 1 1 MET CA C -4.173 6.946 -0.010 1.00 . A A . 1 MET CA 1 1 5 3875 1 1 1 MET CB C -3.367 6.133 1.007 1.00 . A A . 1 MET CB 1 1 5 3876 1 1 1 MET CE C -0.826 6.720 2.860 1.00 . A A . 1 MET CE 1 1 5 3877 1 1 1 MET CG C -1.973 5.766 0.524 1.00 . A A . 1 MET CG 1 1 5 3878 1 1 1 MET H1 H -5.875 7.322 1.083 1.00 . A A . 1 MET H1 1 1 5 3879 1 1 1 MET H2 H -5.379 8.611 0.063 1.00 . A A . 1 MET H2 1 1 5 3880 1 1 1 MET H3 H -4.522 8.283 1.515 1.00 . A A . 1 MET H3 1 1 5 3881 1 1 1 MET HA H -3.495 7.531 -0.615 1.00 . A A . 1 MET HA 1 1 5 3882 1 1 1 MET HB2 H -3.270 6.708 1.915 1.00 . A A . 1 MET HB2 1 1 5 3883 1 1 1 MET HB3 H -3.900 5.220 1.224 1.00 . A A . 1 MET HB3 1 1 5 3884 1 1 1 MET HE1 H 0.204 6.974 3.063 1.00 . A A . 1 MET HE1 1 1 5 3885 1 1 1 MET HE2 H -1.346 6.554 3.792 1.00 . A A . 1 MET HE2 1 1 5 3886 1 1 1 MET HE3 H -1.298 7.532 2.327 1.00 . A A . 1 MET HE3 1 1 5 3887 1 1 1 MET HG2 H -2.054 4.962 -0.193 1.00 . A A . 1 MET HG2 1 1 5 3888 1 1 1 MET HG3 H -1.533 6.629 0.046 1.00 . A A . 1 MET HG3 1 1 5 3889 1 1 1 MET N N -5.067 7.874 0.729 1.00 . A A . 1 MET N 1 1 5 3890 1 1 1 MET O O -5.796 5.232 -0.446 1.00 . A A . 1 MET O 1 1 5 3891 1 1 1 MET SD S -0.891 5.233 1.865 1.00 . A A . 1 MET SD 1 1 5 3892 1 1 2 TYR C C -4.665 3.967 -3.430 1.00 . A A . 2 TYR C 1 1 5 3893 1 1 2 TYR CA C -5.415 5.273 -3.192 1.00 . A A . 2 TYR CA 1 1 5 3894 1 1 2 TYR CB C -5.579 6.027 -4.511 1.00 . A A . 2 TYR CB 1 1 5 3895 1 1 2 TYR CD1 C -7.245 7.629 -3.494 1.00 . A A . 2 TYR CD1 1 1 5 3896 1 1 2 TYR CD2 C -7.614 6.892 -5.731 1.00 . A A . 2 TYR CD2 1 1 5 3897 1 1 2 TYR CE1 C -8.393 8.396 -3.553 1.00 . A A . 2 TYR CE1 1 1 5 3898 1 1 2 TYR CE2 C -8.763 7.656 -5.797 1.00 . A A . 2 TYR CE2 1 1 5 3899 1 1 2 TYR CG C -6.837 6.865 -4.580 1.00 . A A . 2 TYR CG 1 1 5 3900 1 1 2 TYR CZ C -9.148 8.406 -4.706 1.00 . A A . 2 TYR CZ 1 1 5 3901 1 1 2 TYR H H -4.050 6.750 -2.531 1.00 . A A . 2 TYR H 1 1 5 3902 1 1 2 TYR HA H -6.393 5.046 -2.794 1.00 . A A . 2 TYR HA 1 1 5 3903 1 1 2 TYR HB2 H -4.736 6.686 -4.648 1.00 . A A . 2 TYR HB2 1 1 5 3904 1 1 2 TYR HB3 H -5.610 5.316 -5.323 1.00 . A A . 2 TYR HB3 1 1 5 3905 1 1 2 TYR HD1 H -6.651 7.618 -2.591 1.00 . A A . 2 TYR HD1 1 1 5 3906 1 1 2 TYR HD2 H -7.311 6.303 -6.583 1.00 . A A . 2 TYR HD2 1 1 5 3907 1 1 2 TYR HE1 H -8.694 8.983 -2.699 1.00 . A A . 2 TYR HE1 1 1 5 3908 1 1 2 TYR HE2 H -9.355 7.663 -6.700 1.00 . A A . 2 TYR HE2 1 1 5 3909 1 1 2 TYR HH H -11.060 8.600 -4.686 1.00 . A A . 2 TYR HH 1 1 5 3910 1 1 2 TYR N N -4.719 6.106 -2.218 1.00 . A A . 2 TYR N 1 1 5 3911 1 1 2 TYR O O -3.440 3.913 -3.320 1.00 . A A . 2 TYR O 1 1 5 3912 1 1 2 TYR OH O -10.290 9.170 -4.768 1.00 . A A . 2 TYR OH 1 1 5 3913 1 1 3 LYS C C -3.913 1.651 -5.241 1.00 . A A . 3 LYS C 1 1 5 3914 1 1 3 LYS CA C -4.818 1.608 -4.013 1.00 . A A . 3 LYS CA 1 1 5 3915 1 1 3 LYS CB C -5.915 0.560 -4.209 1.00 . A A . 3 LYS CB 1 1 5 3916 1 1 3 LYS CD C -6.516 -1.821 -4.748 1.00 . A A . 3 LYS CD 1 1 5 3917 1 1 3 LYS CE C -6.792 -2.000 -6.231 1.00 . A A . 3 LYS CE 1 1 5 3918 1 1 3 LYS CG C -5.384 -0.834 -4.507 1.00 . A A . 3 LYS CG 1 1 5 3919 1 1 3 LYS H H -6.380 3.023 -3.829 1.00 . A A . 3 LYS H 1 1 5 3920 1 1 3 LYS HA H -4.224 1.338 -3.153 1.00 . A A . 3 LYS HA 1 1 5 3921 1 1 3 LYS HB2 H -6.513 0.509 -3.311 1.00 . A A . 3 LYS HB2 1 1 5 3922 1 1 3 LYS HB3 H -6.545 0.865 -5.032 1.00 . A A . 3 LYS HB3 1 1 5 3923 1 1 3 LYS HD2 H -6.243 -2.775 -4.324 1.00 . A A . 3 LYS HD2 1 1 5 3924 1 1 3 LYS HD3 H -7.409 -1.452 -4.265 1.00 . A A . 3 LYS HD3 1 1 5 3925 1 1 3 LYS HE2 H -5.870 -2.256 -6.729 1.00 . A A . 3 LYS HE2 1 1 5 3926 1 1 3 LYS HE3 H -7.503 -2.805 -6.357 1.00 . A A . 3 LYS HE3 1 1 5 3927 1 1 3 LYS HG2 H -4.764 -0.790 -5.391 1.00 . A A . 3 LYS HG2 1 1 5 3928 1 1 3 LYS HG3 H -4.795 -1.170 -3.667 1.00 . A A . 3 LYS HG3 1 1 5 3929 1 1 3 LYS HZ1 H -8.187 -0.448 -6.321 1.00 . A A . 3 LYS HZ1 1 1 5 3930 1 1 3 LYS HZ2 H -7.619 -0.946 -7.834 1.00 . A A . 3 LYS HZ2 1 1 5 3931 1 1 3 LYS HZ3 H -6.635 -0.006 -6.830 1.00 . A A . 3 LYS HZ3 1 1 5 3932 1 1 3 LYS N N -5.409 2.916 -3.757 1.00 . A A . 3 LYS N 1 1 5 3933 1 1 3 LYS NZ N -7.348 -0.764 -6.847 1.00 . A A . 3 LYS NZ 1 1 5 3934 1 1 3 LYS O O -2.876 0.989 -5.283 1.00 . A A . 3 LYS O 1 1 5 3935 1 1 4 LYS C C -2.124 3.049 -7.178 1.00 . A A . 4 LYS C 1 1 5 3936 1 1 4 LYS CA C -3.541 2.562 -7.469 1.00 . A A . 4 LYS CA 1 1 5 3937 1 1 4 LYS CB C -4.236 3.528 -8.431 1.00 . A A . 4 LYS CB 1 1 5 3938 1 1 4 LYS CD C -3.963 2.325 -10.620 1.00 . A A . 4 LYS CD 1 1 5 3939 1 1 4 LYS CE C -5.111 2.594 -11.580 1.00 . A A . 4 LYS CE 1 1 5 3940 1 1 4 LYS CG C -3.609 3.565 -9.814 1.00 . A A . 4 LYS CG 1 1 5 3941 1 1 4 LYS H H -5.150 2.934 -6.144 1.00 . A A . 4 LYS H 1 1 5 3942 1 1 4 LYS HA H -3.487 1.588 -7.930 1.00 . A A . 4 LYS HA 1 1 5 3943 1 1 4 LYS HB2 H -5.269 3.233 -8.535 1.00 . A A . 4 LYS HB2 1 1 5 3944 1 1 4 LYS HB3 H -4.194 4.525 -8.014 1.00 . A A . 4 LYS HB3 1 1 5 3945 1 1 4 LYS HD2 H -3.098 2.016 -11.187 1.00 . A A . 4 LYS HD2 1 1 5 3946 1 1 4 LYS HD3 H -4.251 1.537 -9.940 1.00 . A A . 4 LYS HD3 1 1 5 3947 1 1 4 LYS HE2 H -6.015 2.736 -11.009 1.00 . A A . 4 LYS HE2 1 1 5 3948 1 1 4 LYS HE3 H -4.893 3.493 -12.139 1.00 . A A . 4 LYS HE3 1 1 5 3949 1 1 4 LYS HG2 H -3.969 4.438 -10.339 1.00 . A A . 4 LYS HG2 1 1 5 3950 1 1 4 LYS HG3 H -2.535 3.622 -9.711 1.00 . A A . 4 LYS HG3 1 1 5 3951 1 1 4 LYS HZ1 H -4.395 1.154 -12.915 1.00 . A A . 4 LYS HZ1 1 1 5 3952 1 1 4 LYS HZ2 H -5.917 1.771 -13.323 1.00 . A A . 4 LYS HZ2 1 1 5 3953 1 1 4 LYS HZ3 H -5.766 0.666 -12.050 1.00 . A A . 4 LYS HZ3 1 1 5 3954 1 1 4 LYS N N -4.313 2.433 -6.237 1.00 . A A . 4 LYS N 1 1 5 3955 1 1 4 LYS NZ N -5.312 1.468 -12.533 1.00 . A A . 4 LYS NZ 1 1 5 3956 1 1 4 LYS O O -1.158 2.557 -7.763 1.00 . A A . 4 LYS O 1 1 5 3957 1 1 5 ASP C C 0.175 3.513 -5.261 1.00 . A A . 5 ASP C 1 1 5 3958 1 1 5 ASP CA C -0.709 4.571 -5.910 1.00 . A A . 5 ASP CA 1 1 5 3959 1 1 5 ASP CB C -0.887 5.756 -4.960 1.00 . A A . 5 ASP CB 1 1 5 3960 1 1 5 ASP CG C 0.314 6.682 -4.959 1.00 . A A . 5 ASP CG 1 1 5 3961 1 1 5 ASP H H -2.815 4.368 -5.846 1.00 . A A . 5 ASP H 1 1 5 3962 1 1 5 ASP HA H -0.232 4.916 -6.815 1.00 . A A . 5 ASP HA 1 1 5 3963 1 1 5 ASP HB2 H -1.756 6.324 -5.261 1.00 . A A . 5 ASP HB2 1 1 5 3964 1 1 5 ASP HB3 H -1.035 5.386 -3.956 1.00 . A A . 5 ASP HB3 1 1 5 3965 1 1 5 ASP N N -2.008 4.017 -6.276 1.00 . A A . 5 ASP N 1 1 5 3966 1 1 5 ASP O O 1.328 3.326 -5.653 1.00 . A A . 5 ASP O 1 1 5 3967 1 1 5 ASP OD1 O 1.454 6.175 -5.025 1.00 . A A . 5 ASP OD1 1 1 5 3968 1 1 5 ASP OD2 O 0.114 7.912 -4.891 1.00 . A A . 5 ASP OD2 1 1 5 3969 1 1 6 VAL C C 0.884 0.724 -4.512 1.00 . A A . 6 VAL C 1 1 5 3970 1 1 6 VAL CA C 0.364 1.790 -3.554 1.00 . A A . 6 VAL CA 1 1 5 3971 1 1 6 VAL CB C -0.520 1.119 -2.489 1.00 . A A . 6 VAL CB 1 1 5 3972 1 1 6 VAL CG1 C 0.344 0.397 -1.481 1.00 . A A . 6 VAL CG1 1 1 5 3973 1 1 6 VAL CG2 C -1.414 2.135 -1.792 1.00 . A A . 6 VAL CG2 1 1 5 3974 1 1 6 VAL H H -1.285 3.013 -3.991 1.00 . A A . 6 VAL H 1 1 5 3975 1 1 6 VAL HA H 1.203 2.254 -3.055 1.00 . A A . 6 VAL HA 1 1 5 3976 1 1 6 VAL HB H -1.149 0.390 -2.978 1.00 . A A . 6 VAL HB 1 1 5 3977 1 1 6 VAL HG11 H 0.729 -0.509 -1.921 1.00 . A A . 6 VAL HG11 1 1 5 3978 1 1 6 VAL HG12 H -0.246 0.158 -0.610 1.00 . A A . 6 VAL HG12 1 1 5 3979 1 1 6 VAL HG13 H 1.162 1.039 -1.198 1.00 . A A . 6 VAL HG13 1 1 5 3980 1 1 6 VAL HG21 H -1.586 1.825 -0.773 1.00 . A A . 6 VAL HG21 1 1 5 3981 1 1 6 VAL HG22 H -2.358 2.200 -2.313 1.00 . A A . 6 VAL HG22 1 1 5 3982 1 1 6 VAL HG23 H -0.933 3.102 -1.798 1.00 . A A . 6 VAL HG23 1 1 5 3983 1 1 6 VAL N N -0.367 2.823 -4.263 1.00 . A A . 6 VAL N 1 1 5 3984 1 1 6 VAL O O 2.051 0.334 -4.452 1.00 . A A . 6 VAL O 1 1 5 3985 1 1 7 ILE C C 1.446 -0.261 -7.326 1.00 . A A . 7 ILE C 1 1 5 3986 1 1 7 ILE CA C 0.376 -0.772 -6.364 1.00 . A A . 7 ILE CA 1 1 5 3987 1 1 7 ILE CB C -0.854 -1.239 -7.170 1.00 . A A . 7 ILE CB 1 1 5 3988 1 1 7 ILE CD1 C -3.191 -2.222 -6.938 1.00 . A A . 7 ILE CD1 1 1 5 3989 1 1 7 ILE CG1 C -1.906 -1.838 -6.235 1.00 . A A . 7 ILE CG1 1 1 5 3990 1 1 7 ILE CG2 C -0.448 -2.249 -8.234 1.00 . A A . 7 ILE CG2 1 1 5 3991 1 1 7 ILE H H -0.907 0.601 -5.390 1.00 . A A . 7 ILE H 1 1 5 3992 1 1 7 ILE HA H 0.768 -1.620 -5.820 1.00 . A A . 7 ILE HA 1 1 5 3993 1 1 7 ILE HB H -1.276 -0.379 -7.670 1.00 . A A . 7 ILE HB 1 1 5 3994 1 1 7 ILE HD11 H -3.718 -2.956 -6.346 1.00 . A A . 7 ILE HD11 1 1 5 3995 1 1 7 ILE HD12 H -2.961 -2.639 -7.907 1.00 . A A . 7 ILE HD12 1 1 5 3996 1 1 7 ILE HD13 H -3.810 -1.347 -7.061 1.00 . A A . 7 ILE HD13 1 1 5 3997 1 1 7 ILE HG12 H -1.504 -2.726 -5.772 1.00 . A A . 7 ILE HG12 1 1 5 3998 1 1 7 ILE HG13 H -2.149 -1.117 -5.470 1.00 . A A . 7 ILE HG13 1 1 5 3999 1 1 7 ILE HG21 H 0.011 -3.105 -7.761 1.00 . A A . 7 ILE HG21 1 1 5 4000 1 1 7 ILE HG22 H 0.258 -1.792 -8.912 1.00 . A A . 7 ILE HG22 1 1 5 4001 1 1 7 ILE HG23 H -1.322 -2.565 -8.784 1.00 . A A . 7 ILE HG23 1 1 5 4002 1 1 7 ILE N N 0.009 0.251 -5.394 1.00 . A A . 7 ILE N 1 1 5 4003 1 1 7 ILE O O 2.323 -1.015 -7.748 1.00 . A A . 7 ILE O 1 1 5 4004 1 1 8 ASP C C 3.647 1.912 -7.847 1.00 . A A . 8 ASP C 1 1 5 4005 1 1 8 ASP CA C 2.335 1.630 -8.570 1.00 . A A . 8 ASP CA 1 1 5 4006 1 1 8 ASP CB C 1.767 2.924 -9.160 1.00 . A A . 8 ASP CB 1 1 5 4007 1 1 8 ASP CG C 1.737 2.904 -10.675 1.00 . A A . 8 ASP CG 1 1 5 4008 1 1 8 ASP H H 0.653 1.571 -7.291 1.00 . A A . 8 ASP H 1 1 5 4009 1 1 8 ASP HA H 2.522 0.930 -9.373 1.00 . A A . 8 ASP HA 1 1 5 4010 1 1 8 ASP HB2 H 0.759 3.064 -8.800 1.00 . A A . 8 ASP HB2 1 1 5 4011 1 1 8 ASP HB3 H 2.377 3.757 -8.840 1.00 . A A . 8 ASP HB3 1 1 5 4012 1 1 8 ASP N N 1.371 1.021 -7.663 1.00 . A A . 8 ASP N 1 1 5 4013 1 1 8 ASP O O 4.705 1.992 -8.470 1.00 . A A . 8 ASP O 1 1 5 4014 1 1 8 ASP OD1 O 2.731 2.454 -11.282 1.00 . A A . 8 ASP OD1 1 1 5 4015 1 1 8 ASP OD2 O 0.719 3.338 -11.255 1.00 . A A . 8 ASP OD2 1 1 5 4016 1 1 9 HIS C C 5.480 1.033 -5.387 1.00 . A A . 9 HIS C 1 1 5 4017 1 1 9 HIS CA C 4.745 2.329 -5.721 1.00 . A A . 9 HIS CA 1 1 5 4018 1 1 9 HIS CB C 4.351 3.060 -4.434 1.00 . A A . 9 HIS CB 1 1 5 4019 1 1 9 HIS CD2 C 6.099 2.371 -2.644 1.00 . A A . 9 HIS CD2 1 1 5 4020 1 1 9 HIS CE1 C 7.076 4.315 -2.383 1.00 . A A . 9 HIS CE1 1 1 5 4021 1 1 9 HIS CG C 5.487 3.249 -3.474 1.00 . A A . 9 HIS CG 1 1 5 4022 1 1 9 HIS H H 2.696 1.983 -6.089 1.00 . A A . 9 HIS H 1 1 5 4023 1 1 9 HIS HA H 5.399 2.962 -6.299 1.00 . A A . 9 HIS HA 1 1 5 4024 1 1 9 HIS HB2 H 3.967 4.037 -4.687 1.00 . A A . 9 HIS HB2 1 1 5 4025 1 1 9 HIS HB3 H 3.579 2.495 -3.930 1.00 . A A . 9 HIS HB3 1 1 5 4026 1 1 9 HIS HD1 H 5.907 5.296 -3.746 1.00 . A A . 9 HIS HD1 1 1 5 4027 1 1 9 HIS HD2 H 5.856 1.323 -2.528 1.00 . A A . 9 HIS HD2 1 1 5 4028 1 1 9 HIS HE1 H 7.739 5.094 -2.035 1.00 . A A . 9 HIS HE1 1 1 5 4029 1 1 9 HIS HE2 H 7.748 2.662 -1.379 1.00 . A A . 9 HIS HE2 1 1 5 4030 1 1 9 HIS N N 3.567 2.059 -6.529 1.00 . A A . 9 HIS N 1 1 5 4031 1 1 9 HIS ND1 N 6.122 4.458 -3.286 1.00 . A A . 9 HIS ND1 1 1 5 4032 1 1 9 HIS NE2 N 7.083 3.059 -1.979 1.00 . A A . 9 HIS NE2 1 1 5 4033 1 1 9 HIS O O 6.685 1.039 -5.132 1.00 . A A . 9 HIS O 1 1 5 4034 1 1 10 PHE C C 5.714 -2.116 -6.359 1.00 . A A . 10 PHE C 1 1 5 4035 1 1 10 PHE CA C 5.330 -1.376 -5.082 1.00 . A A . 10 PHE CA 1 1 5 4036 1 1 10 PHE CB C 4.349 -2.221 -4.267 1.00 . A A . 10 PHE CB 1 1 5 4037 1 1 10 PHE CD1 C 4.144 -0.502 -2.451 1.00 . A A . 10 PHE CD1 1 1 5 4038 1 1 10 PHE CD2 C 4.363 -2.791 -1.822 1.00 . A A . 10 PHE CD2 1 1 5 4039 1 1 10 PHE CE1 C 4.083 -0.138 -1.121 1.00 . A A . 10 PHE CE1 1 1 5 4040 1 1 10 PHE CE2 C 4.303 -2.433 -0.489 1.00 . A A . 10 PHE CE2 1 1 5 4041 1 1 10 PHE CG C 4.285 -1.830 -2.817 1.00 . A A . 10 PHE CG 1 1 5 4042 1 1 10 PHE CZ C 4.162 -1.105 -0.138 1.00 . A A . 10 PHE CZ 1 1 5 4043 1 1 10 PHE H H 3.791 -0.020 -5.596 1.00 . A A . 10 PHE H 1 1 5 4044 1 1 10 PHE HA H 6.219 -1.207 -4.495 1.00 . A A . 10 PHE HA 1 1 5 4045 1 1 10 PHE HB2 H 3.359 -2.114 -4.683 1.00 . A A . 10 PHE HB2 1 1 5 4046 1 1 10 PHE HB3 H 4.648 -3.257 -4.320 1.00 . A A . 10 PHE HB3 1 1 5 4047 1 1 10 PHE HD1 H 4.082 0.253 -3.220 1.00 . A A . 10 PHE HD1 1 1 5 4048 1 1 10 PHE HD2 H 4.474 -3.830 -2.096 1.00 . A A . 10 PHE HD2 1 1 5 4049 1 1 10 PHE HE1 H 3.971 0.902 -0.850 1.00 . A A . 10 PHE HE1 1 1 5 4050 1 1 10 PHE HE2 H 4.366 -3.191 0.276 1.00 . A A . 10 PHE HE2 1 1 5 4051 1 1 10 PHE HZ H 4.115 -0.823 0.903 1.00 . A A . 10 PHE HZ 1 1 5 4052 1 1 10 PHE N N 4.747 -0.077 -5.388 1.00 . A A . 10 PHE N 1 1 5 4053 1 1 10 PHE O O 6.825 -2.629 -6.480 1.00 . A A . 10 PHE O 1 1 5 4054 1 1 11 GLY C C 4.022 -3.929 -8.854 1.00 . A A . 11 GLY C 1 1 5 4055 1 1 11 GLY CA C 5.041 -2.845 -8.565 1.00 . A A . 11 GLY CA 1 1 5 4056 1 1 11 GLY H H 3.916 -1.738 -7.154 1.00 . A A . 11 GLY H 1 1 5 4057 1 1 11 GLY HA2 H 5.018 -2.120 -9.365 1.00 . A A . 11 GLY HA2 1 1 5 4058 1 1 11 GLY HA3 H 6.023 -3.292 -8.527 1.00 . A A . 11 GLY HA3 1 1 5 4059 1 1 11 GLY N N 4.784 -2.165 -7.308 1.00 . A A . 11 GLY N 1 1 5 4060 1 1 11 GLY O O 3.751 -4.243 -10.014 1.00 . A A . 11 GLY O 1 1 5 4061 1 1 12 THR C C 1.485 -5.546 -6.769 1.00 . A A . 12 THR C 1 1 5 4062 1 1 12 THR CA C 2.459 -5.559 -7.941 1.00 . A A . 12 THR CA 1 1 5 4063 1 1 12 THR CB C 3.143 -6.924 -8.037 1.00 . A A . 12 THR CB 1 1 5 4064 1 1 12 THR CG2 C 3.568 -7.283 -9.445 1.00 . A A . 12 THR CG2 1 1 5 4065 1 1 12 THR H H 3.713 -4.209 -6.899 1.00 . A A . 12 THR H 1 1 5 4066 1 1 12 THR HA H 1.911 -5.376 -8.853 1.00 . A A . 12 THR HA 1 1 5 4067 1 1 12 THR HB H 2.456 -7.683 -7.694 1.00 . A A . 12 THR HB 1 1 5 4068 1 1 12 THR HG1 H 4.613 -7.869 -7.153 1.00 . A A . 12 THR HG1 1 1 5 4069 1 1 12 THR HG21 H 3.712 -8.351 -9.516 1.00 . A A . 12 THR HG21 1 1 5 4070 1 1 12 THR HG22 H 4.492 -6.777 -9.682 1.00 . A A . 12 THR HG22 1 1 5 4071 1 1 12 THR HG23 H 2.801 -6.977 -10.141 1.00 . A A . 12 THR HG23 1 1 5 4072 1 1 12 THR N N 3.455 -4.503 -7.798 1.00 . A A . 12 THR N 1 1 5 4073 1 1 12 THR O O 1.587 -4.708 -5.874 1.00 . A A . 12 THR O 1 1 5 4074 1 1 12 THR OG1 O 4.297 -6.964 -7.218 1.00 . A A . 12 THR OG1 1 1 5 4075 1 1 13 GLN C C 0.072 -7.415 -4.557 1.00 . A A . 13 GLN C 1 1 5 4076 1 1 13 GLN CA C -0.454 -6.575 -5.716 1.00 . A A . 13 GLN CA 1 1 5 4077 1 1 13 GLN CB C -1.751 -7.181 -6.252 1.00 . A A . 13 GLN CB 1 1 5 4078 1 1 13 GLN CD C -4.127 -6.355 -6.497 1.00 . A A . 13 GLN CD 1 1 5 4079 1 1 13 GLN CG C -2.677 -6.163 -6.898 1.00 . A A . 13 GLN CG 1 1 5 4080 1 1 13 GLN H H 0.509 -7.123 -7.521 1.00 . A A . 13 GLN H 1 1 5 4081 1 1 13 GLN HA H -0.652 -5.576 -5.359 1.00 . A A . 13 GLN HA 1 1 5 4082 1 1 13 GLN HB2 H -1.509 -7.932 -6.989 1.00 . A A . 13 GLN HB2 1 1 5 4083 1 1 13 GLN HB3 H -2.281 -7.649 -5.435 1.00 . A A . 13 GLN HB3 1 1 5 4084 1 1 13 GLN HE21 H -3.993 -8.306 -6.858 1.00 . A A . 13 GLN HE21 1 1 5 4085 1 1 13 GLN HE22 H -5.532 -7.749 -6.307 1.00 . A A . 13 GLN HE22 1 1 5 4086 1 1 13 GLN HG2 H -2.367 -5.171 -6.599 1.00 . A A . 13 GLN HG2 1 1 5 4087 1 1 13 GLN HG3 H -2.601 -6.253 -7.971 1.00 . A A . 13 GLN HG3 1 1 5 4088 1 1 13 GLN N N 0.539 -6.480 -6.780 1.00 . A A . 13 GLN N 1 1 5 4089 1 1 13 GLN NE2 N -4.598 -7.595 -6.560 1.00 . A A . 13 GLN NE2 1 1 5 4090 1 1 13 GLN O O 0.061 -6.978 -3.405 1.00 . A A . 13 GLN O 1 1 5 4091 1 1 13 GLN OE1 O -4.816 -5.401 -6.134 1.00 . A A . 13 GLN OE1 1 1 5 4092 1 1 14 ARG C C 2.176 -8.851 -3.053 1.00 . A A . 14 ARG C 1 1 5 4093 1 1 14 ARG CA C 1.064 -9.524 -3.851 1.00 . A A . 14 ARG CA 1 1 5 4094 1 1 14 ARG CB C 1.588 -10.807 -4.501 1.00 . A A . 14 ARG CB 1 1 5 4095 1 1 14 ARG CD C 1.999 -13.274 -4.232 1.00 . A A . 14 ARG CD 1 1 5 4096 1 1 14 ARG CG C 1.207 -12.071 -3.746 1.00 . A A . 14 ARG CG 1 1 5 4097 1 1 14 ARG CZ C 0.695 -14.261 -6.077 1.00 . A A . 14 ARG CZ 1 1 5 4098 1 1 14 ARG H H 0.515 -8.914 -5.803 1.00 . A A . 14 ARG H 1 1 5 4099 1 1 14 ARG HA H 0.257 -9.777 -3.179 1.00 . A A . 14 ARG HA 1 1 5 4100 1 1 14 ARG HB2 H 1.189 -10.877 -5.502 1.00 . A A . 14 ARG HB2 1 1 5 4101 1 1 14 ARG HB3 H 2.666 -10.756 -4.555 1.00 . A A . 14 ARG HB3 1 1 5 4102 1 1 14 ARG HD2 H 2.713 -12.947 -4.974 1.00 . A A . 14 ARG HD2 1 1 5 4103 1 1 14 ARG HD3 H 2.527 -13.704 -3.393 1.00 . A A . 14 ARG HD3 1 1 5 4104 1 1 14 ARG HE H 0.874 -15.049 -4.252 1.00 . A A . 14 ARG HE 1 1 5 4105 1 1 14 ARG HG2 H 1.405 -11.924 -2.695 1.00 . A A . 14 ARG HG2 1 1 5 4106 1 1 14 ARG HG3 H 0.154 -12.261 -3.892 1.00 . A A . 14 ARG HG3 1 1 5 4107 1 1 14 ARG HH11 H 1.614 -12.520 -6.543 1.00 . A A . 14 ARG HH11 1 1 5 4108 1 1 14 ARG HH12 H 0.694 -13.236 -7.821 1.00 . A A . 14 ARG HH12 1 1 5 4109 1 1 14 ARG HH21 H -0.339 -15.992 -5.934 1.00 . A A . 14 ARG HH21 1 1 5 4110 1 1 14 ARG HH22 H -0.416 -15.207 -7.476 1.00 . A A . 14 ARG HH22 1 1 5 4111 1 1 14 ARG N N 0.532 -8.623 -4.867 1.00 . A A . 14 ARG N 1 1 5 4112 1 1 14 ARG NE N 1.137 -14.295 -4.822 1.00 . A A . 14 ARG NE 1 1 5 4113 1 1 14 ARG NH1 N 1.028 -13.256 -6.879 1.00 . A A . 14 ARG NH1 1 1 5 4114 1 1 14 ARG NH2 N -0.083 -15.233 -6.533 1.00 . A A . 14 ARG NH2 1 1 5 4115 1 1 14 ARG O O 2.392 -9.167 -1.882 1.00 . A A . 14 ARG O 1 1 5 4116 1 1 15 ALA C C 3.447 -6.369 -1.874 1.00 . A A . 15 ALA C 1 1 5 4117 1 1 15 ALA CA C 3.966 -7.203 -3.041 1.00 . A A . 15 ALA CA 1 1 5 4118 1 1 15 ALA CB C 4.691 -6.320 -4.047 1.00 . A A . 15 ALA CB 1 1 5 4119 1 1 15 ALA H H 2.659 -7.714 -4.625 1.00 . A A . 15 ALA H 1 1 5 4120 1 1 15 ALA HA H 4.668 -7.932 -2.665 1.00 . A A . 15 ALA HA 1 1 5 4121 1 1 15 ALA HB1 H 5.738 -6.587 -4.070 1.00 . A A . 15 ALA HB1 1 1 5 4122 1 1 15 ALA HB2 H 4.591 -5.284 -3.756 1.00 . A A . 15 ALA HB2 1 1 5 4123 1 1 15 ALA HB3 H 4.261 -6.462 -5.027 1.00 . A A . 15 ALA HB3 1 1 5 4124 1 1 15 ALA N N 2.878 -7.922 -3.693 1.00 . A A . 15 ALA N 1 1 5 4125 1 1 15 ALA O O 4.030 -6.369 -0.791 1.00 . A A . 15 ALA O 1 1 5 4126 1 1 16 VAL C C 1.354 -5.645 0.145 1.00 . A A . 16 VAL C 1 1 5 4127 1 1 16 VAL CA C 1.751 -4.822 -1.076 1.00 . A A . 16 VAL CA 1 1 5 4128 1 1 16 VAL CB C 0.505 -4.075 -1.598 1.00 . A A . 16 VAL CB 1 1 5 4129 1 1 16 VAL CG1 C 0.358 -2.752 -0.878 1.00 . A A . 16 VAL CG1 1 1 5 4130 1 1 16 VAL CG2 C 0.575 -3.852 -3.103 1.00 . A A . 16 VAL CG2 1 1 5 4131 1 1 16 VAL H H 1.930 -5.699 -2.985 1.00 . A A . 16 VAL H 1 1 5 4132 1 1 16 VAL HA H 2.485 -4.088 -0.778 1.00 . A A . 16 VAL HA 1 1 5 4133 1 1 16 VAL HB H -0.366 -4.678 -1.382 1.00 . A A . 16 VAL HB 1 1 5 4134 1 1 16 VAL HG11 H -0.399 -2.160 -1.367 1.00 . A A . 16 VAL HG11 1 1 5 4135 1 1 16 VAL HG12 H 1.301 -2.228 -0.907 1.00 . A A . 16 VAL HG12 1 1 5 4136 1 1 16 VAL HG13 H 0.073 -2.930 0.147 1.00 . A A . 16 VAL HG13 1 1 5 4137 1 1 16 VAL HG21 H 0.280 -4.756 -3.615 1.00 . A A . 16 VAL HG21 1 1 5 4138 1 1 16 VAL HG22 H 1.586 -3.594 -3.383 1.00 . A A . 16 VAL HG22 1 1 5 4139 1 1 16 VAL HG23 H -0.091 -3.048 -3.379 1.00 . A A . 16 VAL HG23 1 1 5 4140 1 1 16 VAL N N 2.349 -5.659 -2.104 1.00 . A A . 16 VAL N 1 1 5 4141 1 1 16 VAL O O 1.340 -5.141 1.268 1.00 . A A . 16 VAL O 1 1 5 4142 1 1 17 ALA C C 1.820 -8.237 1.842 1.00 . A A . 17 ALA C 1 1 5 4143 1 1 17 ALA CA C 0.624 -7.805 0.997 1.00 . A A . 17 ALA CA 1 1 5 4144 1 1 17 ALA CB C -0.095 -9.023 0.433 1.00 . A A . 17 ALA CB 1 1 5 4145 1 1 17 ALA H H 1.052 -7.256 -1.001 1.00 . A A . 17 ALA H 1 1 5 4146 1 1 17 ALA HA H -0.072 -7.269 1.627 1.00 . A A . 17 ALA HA 1 1 5 4147 1 1 17 ALA HB1 H -0.317 -8.858 -0.611 1.00 . A A . 17 ALA HB1 1 1 5 4148 1 1 17 ALA HB2 H -1.015 -9.181 0.976 1.00 . A A . 17 ALA HB2 1 1 5 4149 1 1 17 ALA HB3 H 0.537 -9.894 0.534 1.00 . A A . 17 ALA HB3 1 1 5 4150 1 1 17 ALA N N 1.026 -6.913 -0.083 1.00 . A A . 17 ALA N 1 1 5 4151 1 1 17 ALA O O 1.667 -8.599 3.008 1.00 . A A . 17 ALA O 1 1 5 4152 1 1 18 LYS C C 4.877 -7.405 2.662 1.00 . A A . 18 LYS C 1 1 5 4153 1 1 18 LYS CA C 4.225 -8.597 1.957 1.00 . A A . 18 LYS CA 1 1 5 4154 1 1 18 LYS CB C 5.216 -9.257 0.987 1.00 . A A . 18 LYS CB 1 1 5 4155 1 1 18 LYS CD C 6.458 -8.713 -1.131 1.00 . A A . 18 LYS CD 1 1 5 4156 1 1 18 LYS CE C 7.742 -9.524 -1.211 1.00 . A A . 18 LYS CE 1 1 5 4157 1 1 18 LYS CG C 6.161 -8.282 0.296 1.00 . A A . 18 LYS CG 1 1 5 4158 1 1 18 LYS H H 3.073 -7.908 0.315 1.00 . A A . 18 LYS H 1 1 5 4159 1 1 18 LYS HA H 3.941 -9.321 2.705 1.00 . A A . 18 LYS HA 1 1 5 4160 1 1 18 LYS HB2 H 5.813 -9.970 1.536 1.00 . A A . 18 LYS HB2 1 1 5 4161 1 1 18 LYS HB3 H 4.658 -9.782 0.227 1.00 . A A . 18 LYS HB3 1 1 5 4162 1 1 18 LYS HD2 H 5.640 -9.318 -1.493 1.00 . A A . 18 LYS HD2 1 1 5 4163 1 1 18 LYS HD3 H 6.559 -7.833 -1.748 1.00 . A A . 18 LYS HD3 1 1 5 4164 1 1 18 LYS HE2 H 8.269 -9.250 -2.113 1.00 . A A . 18 LYS HE2 1 1 5 4165 1 1 18 LYS HE3 H 8.354 -9.290 -0.353 1.00 . A A . 18 LYS HE3 1 1 5 4166 1 1 18 LYS HG2 H 5.705 -7.305 0.279 1.00 . A A . 18 LYS HG2 1 1 5 4167 1 1 18 LYS HG3 H 7.087 -8.241 0.851 1.00 . A A . 18 LYS HG3 1 1 5 4168 1 1 18 LYS HZ1 H 8.208 -11.492 -0.694 1.00 . A A . 18 LYS HZ1 1 1 5 4169 1 1 18 LYS HZ2 H 7.475 -11.338 -2.211 1.00 . A A . 18 LYS HZ2 1 1 5 4170 1 1 18 LYS HZ3 H 6.546 -11.188 -0.805 1.00 . A A . 18 LYS HZ3 1 1 5 4171 1 1 18 LYS N N 3.011 -8.203 1.248 1.00 . A A . 18 LYS N 1 1 5 4172 1 1 18 LYS NZ N 7.475 -10.988 -1.232 1.00 . A A . 18 LYS NZ 1 1 5 4173 1 1 18 LYS O O 6.064 -7.439 2.982 1.00 . A A . 18 LYS O 1 1 5 4174 1 1 19 ALA C C 3.840 -4.883 4.858 1.00 . A A . 19 ALA C 1 1 5 4175 1 1 19 ALA CA C 4.608 -5.163 3.570 1.00 . A A . 19 ALA CA 1 1 5 4176 1 1 19 ALA CB C 4.533 -3.964 2.637 1.00 . A A . 19 ALA CB 1 1 5 4177 1 1 19 ALA H H 3.157 -6.380 2.630 1.00 . A A . 19 ALA H 1 1 5 4178 1 1 19 ALA HA H 5.647 -5.337 3.814 1.00 . A A . 19 ALA HA 1 1 5 4179 1 1 19 ALA HB1 H 5.455 -3.886 2.078 1.00 . A A . 19 ALA HB1 1 1 5 4180 1 1 19 ALA HB2 H 4.387 -3.066 3.217 1.00 . A A . 19 ALA HB2 1 1 5 4181 1 1 19 ALA HB3 H 3.707 -4.091 1.955 1.00 . A A . 19 ALA HB3 1 1 5 4182 1 1 19 ALA N N 4.096 -6.355 2.904 1.00 . A A . 19 ALA N 1 1 5 4183 1 1 19 ALA O O 4.430 -4.544 5.884 1.00 . A A . 19 ALA O 1 1 5 4184 1 1 20 LEU C C 1.408 -6.085 6.714 1.00 . A A . 20 LEU C 1 1 5 4185 1 1 20 LEU CA C 1.670 -4.787 5.955 1.00 . A A . 20 LEU CA 1 1 5 4186 1 1 20 LEU CB C 0.344 -4.159 5.522 1.00 . A A . 20 LEU CB 1 1 5 4187 1 1 20 LEU CD1 C -0.822 -2.988 3.637 1.00 . A A . 20 LEU CD1 1 1 5 4188 1 1 20 LEU CD2 C 0.783 -1.731 5.084 1.00 . A A . 20 LEU CD2 1 1 5 4189 1 1 20 LEU CG C 0.460 -3.075 4.449 1.00 . A A . 20 LEU CG 1 1 5 4190 1 1 20 LEU H H 2.107 -5.296 3.948 1.00 . A A . 20 LEU H 1 1 5 4191 1 1 20 LEU HA H 2.186 -4.100 6.610 1.00 . A A . 20 LEU HA 1 1 5 4192 1 1 20 LEU HB2 H -0.295 -4.944 5.145 1.00 . A A . 20 LEU HB2 1 1 5 4193 1 1 20 LEU HB3 H -0.126 -3.723 6.393 1.00 . A A . 20 LEU HB3 1 1 5 4194 1 1 20 LEU HD11 H -1.547 -2.391 4.169 1.00 . A A . 20 LEU HD11 1 1 5 4195 1 1 20 LEU HD12 H -1.218 -3.982 3.482 1.00 . A A . 20 LEU HD12 1 1 5 4196 1 1 20 LEU HD13 H -0.612 -2.532 2.681 1.00 . A A . 20 LEU HD13 1 1 5 4197 1 1 20 LEU HD21 H 1.478 -1.875 5.897 1.00 . A A . 20 LEU HD21 1 1 5 4198 1 1 20 LEU HD22 H -0.125 -1.282 5.461 1.00 . A A . 20 LEU HD22 1 1 5 4199 1 1 20 LEU HD23 H 1.223 -1.080 4.344 1.00 . A A . 20 LEU HD23 1 1 5 4200 1 1 20 LEU HG H 1.265 -3.329 3.776 1.00 . A A . 20 LEU HG 1 1 5 4201 1 1 20 LEU N N 2.520 -5.025 4.796 1.00 . A A . 20 LEU N 1 1 5 4202 1 1 20 LEU O O 1.215 -6.077 7.930 1.00 . A A . 20 LEU O 1 1 5 4203 1 1 21 GLY C C -0.190 -9.065 6.244 1.00 . A A . 21 GLY C 1 1 5 4204 1 1 21 GLY CA C 1.163 -8.487 6.610 1.00 . A A . 21 GLY CA 1 1 5 4205 1 1 21 GLY H H 1.562 -7.145 5.023 1.00 . A A . 21 GLY H 1 1 5 4206 1 1 21 GLY HA2 H 1.933 -9.176 6.292 1.00 . A A . 21 GLY HA2 1 1 5 4207 1 1 21 GLY HA3 H 1.215 -8.374 7.682 1.00 . A A . 21 GLY HA3 1 1 5 4208 1 1 21 GLY N N 1.403 -7.200 5.988 1.00 . A A . 21 GLY N 1 1 5 4209 1 1 21 GLY O O -0.837 -9.719 7.062 1.00 . A A . 21 GLY O 1 1 5 4210 1 1 22 ILE C C -1.736 -10.171 3.285 1.00 . A A . 22 ILE C 1 1 5 4211 1 1 22 ILE CA C -1.906 -9.317 4.535 1.00 . A A . 22 ILE CA 1 1 5 4212 1 1 22 ILE CB C -2.873 -8.160 4.221 1.00 . A A . 22 ILE CB 1 1 5 4213 1 1 22 ILE CD1 C -3.151 -6.054 2.822 1.00 . A A . 22 ILE CD1 1 1 5 4214 1 1 22 ILE CG1 C -2.256 -7.217 3.188 1.00 . A A . 22 ILE CG1 1 1 5 4215 1 1 22 ILE CG2 C -3.226 -7.404 5.493 1.00 . A A . 22 ILE CG2 1 1 5 4216 1 1 22 ILE H H -0.060 -8.291 4.405 1.00 . A A . 22 ILE H 1 1 5 4217 1 1 22 ILE HA H -2.341 -9.921 5.318 1.00 . A A . 22 ILE HA 1 1 5 4218 1 1 22 ILE HB H -3.784 -8.579 3.819 1.00 . A A . 22 ILE HB 1 1 5 4219 1 1 22 ILE HD11 H -2.573 -5.307 2.296 1.00 . A A . 22 ILE HD11 1 1 5 4220 1 1 22 ILE HD12 H -3.567 -5.622 3.720 1.00 . A A . 22 ILE HD12 1 1 5 4221 1 1 22 ILE HD13 H -3.951 -6.402 2.185 1.00 . A A . 22 ILE HD13 1 1 5 4222 1 1 22 ILE HG12 H -1.335 -6.815 3.581 1.00 . A A . 22 ILE HG12 1 1 5 4223 1 1 22 ILE HG13 H -2.046 -7.772 2.285 1.00 . A A . 22 ILE HG13 1 1 5 4224 1 1 22 ILE HG21 H -3.074 -8.048 6.348 1.00 . A A . 22 ILE HG21 1 1 5 4225 1 1 22 ILE HG22 H -4.261 -7.098 5.455 1.00 . A A . 22 ILE HG22 1 1 5 4226 1 1 22 ILE HG23 H -2.596 -6.533 5.582 1.00 . A A . 22 ILE HG23 1 1 5 4227 1 1 22 ILE N N -0.621 -8.820 5.010 1.00 . A A . 22 ILE N 1 1 5 4228 1 1 22 ILE O O -0.617 -10.398 2.823 1.00 . A A . 22 ILE O 1 1 5 4229 1 1 23 SER C C -3.151 -10.645 0.303 1.00 . A A . 23 SER C 1 1 5 4230 1 1 23 SER CA C -2.828 -11.471 1.542 1.00 . A A . 23 SER CA 1 1 5 4231 1 1 23 SER CB C -3.824 -12.626 1.673 1.00 . A A . 23 SER CB 1 1 5 4232 1 1 23 SER H H -3.715 -10.427 3.155 1.00 . A A . 23 SER H 1 1 5 4233 1 1 23 SER HA H -1.832 -11.878 1.440 1.00 . A A . 23 SER HA 1 1 5 4234 1 1 23 SER HB2 H -4.758 -12.250 2.065 1.00 . A A . 23 SER HB2 1 1 5 4235 1 1 23 SER HB3 H -3.993 -13.066 0.702 1.00 . A A . 23 SER HB3 1 1 5 4236 1 1 23 SER HG H -2.410 -13.801 2.352 1.00 . A A . 23 SER HG 1 1 5 4237 1 1 23 SER N N -2.853 -10.643 2.741 1.00 . A A . 23 SER N 1 1 5 4238 1 1 23 SER O O -3.445 -9.453 0.399 1.00 . A A . 23 SER O 1 1 5 4239 1 1 23 SER OG O -3.333 -13.626 2.550 1.00 . A A . 23 SER OG 1 1 5 4240 1 1 24 ASP C C -4.864 -10.254 -2.224 1.00 . A A . 24 ASP C 1 1 5 4241 1 1 24 ASP CA C -3.383 -10.607 -2.120 1.00 . A A . 24 ASP CA 1 1 5 4242 1 1 24 ASP CB C -2.972 -11.487 -3.302 1.00 . A A . 24 ASP CB 1 1 5 4243 1 1 24 ASP CG C -3.158 -10.789 -4.634 1.00 . A A . 24 ASP CG 1 1 5 4244 1 1 24 ASP H H -2.854 -12.234 -0.873 1.00 . A A . 24 ASP H 1 1 5 4245 1 1 24 ASP HA H -2.805 -9.695 -2.145 1.00 . A A . 24 ASP HA 1 1 5 4246 1 1 24 ASP HB2 H -1.931 -11.755 -3.198 1.00 . A A . 24 ASP HB2 1 1 5 4247 1 1 24 ASP HB3 H -3.571 -12.385 -3.298 1.00 . A A . 24 ASP HB3 1 1 5 4248 1 1 24 ASP N N -3.095 -11.285 -0.860 1.00 . A A . 24 ASP N 1 1 5 4249 1 1 24 ASP O O -5.234 -9.277 -2.876 1.00 . A A . 24 ASP O 1 1 5 4250 1 1 24 ASP OD1 O -2.353 -9.889 -4.952 1.00 . A A . 24 ASP OD1 1 1 5 4251 1 1 24 ASP OD2 O -4.109 -11.144 -5.361 1.00 . A A . 24 ASP OD2 1 1 5 4252 1 1 25 ALA C C -7.506 -9.516 -0.919 1.00 . A A . 25 ALA C 1 1 5 4253 1 1 25 ALA CA C -7.145 -10.831 -1.602 1.00 . A A . 25 ALA CA 1 1 5 4254 1 1 25 ALA CB C -7.871 -11.990 -0.936 1.00 . A A . 25 ALA CB 1 1 5 4255 1 1 25 ALA H H -5.349 -11.820 -1.079 1.00 . A A . 25 ALA H 1 1 5 4256 1 1 25 ALA HA H -7.459 -10.785 -2.634 1.00 . A A . 25 ALA HA 1 1 5 4257 1 1 25 ALA HB1 H -7.618 -12.017 0.114 1.00 . A A . 25 ALA HB1 1 1 5 4258 1 1 25 ALA HB2 H -7.572 -12.917 -1.403 1.00 . A A . 25 ALA HB2 1 1 5 4259 1 1 25 ALA HB3 H -8.937 -11.859 -1.047 1.00 . A A . 25 ALA HB3 1 1 5 4260 1 1 25 ALA N N -5.705 -11.056 -1.581 1.00 . A A . 25 ALA N 1 1 5 4261 1 1 25 ALA O O -8.267 -8.714 -1.457 1.00 . A A . 25 ALA O 1 1 5 4262 1 1 26 ALA C C -6.808 -6.845 0.240 1.00 . A A . 26 ALA C 1 1 5 4263 1 1 26 ALA CA C -7.217 -8.085 1.028 1.00 . A A . 26 ALA CA 1 1 5 4264 1 1 26 ALA CB C -6.490 -8.128 2.364 1.00 . A A . 26 ALA CB 1 1 5 4265 1 1 26 ALA H H -6.354 -9.980 0.649 1.00 . A A . 26 ALA H 1 1 5 4266 1 1 26 ALA HA H -8.279 -8.040 1.227 1.00 . A A . 26 ALA HA 1 1 5 4267 1 1 26 ALA HB1 H -7.115 -7.691 3.130 1.00 . A A . 26 ALA HB1 1 1 5 4268 1 1 26 ALA HB2 H -5.568 -7.569 2.290 1.00 . A A . 26 ALA HB2 1 1 5 4269 1 1 26 ALA HB3 H -6.269 -9.154 2.622 1.00 . A A . 26 ALA HB3 1 1 5 4270 1 1 26 ALA N N -6.953 -9.302 0.271 1.00 . A A . 26 ALA N 1 1 5 4271 1 1 26 ALA O O -7.410 -5.782 0.381 1.00 . A A . 26 ALA O 1 1 5 4272 1 1 27 VAL C C -6.231 -5.599 -2.567 1.00 . A A . 27 VAL C 1 1 5 4273 1 1 27 VAL CA C -5.291 -5.883 -1.400 1.00 . A A . 27 VAL CA 1 1 5 4274 1 1 27 VAL CB C -3.879 -6.170 -1.947 1.00 . A A . 27 VAL CB 1 1 5 4275 1 1 27 VAL CG1 C -3.346 -4.970 -2.718 1.00 . A A . 27 VAL CG1 1 1 5 4276 1 1 27 VAL CG2 C -2.934 -6.544 -0.815 1.00 . A A . 27 VAL CG2 1 1 5 4277 1 1 27 VAL H H -5.341 -7.865 -0.657 1.00 . A A . 27 VAL H 1 1 5 4278 1 1 27 VAL HA H -5.240 -5.007 -0.770 1.00 . A A . 27 VAL HA 1 1 5 4279 1 1 27 VAL HB H -3.942 -7.007 -2.627 1.00 . A A . 27 VAL HB 1 1 5 4280 1 1 27 VAL HG11 H -4.024 -4.733 -3.526 1.00 . A A . 27 VAL HG11 1 1 5 4281 1 1 27 VAL HG12 H -2.373 -5.205 -3.122 1.00 . A A . 27 VAL HG12 1 1 5 4282 1 1 27 VAL HG13 H -3.267 -4.122 -2.054 1.00 . A A . 27 VAL HG13 1 1 5 4283 1 1 27 VAL HG21 H -2.023 -6.952 -1.227 1.00 . A A . 27 VAL HG21 1 1 5 4284 1 1 27 VAL HG22 H -3.405 -7.283 -0.184 1.00 . A A . 27 VAL HG22 1 1 5 4285 1 1 27 VAL HG23 H -2.704 -5.665 -0.231 1.00 . A A . 27 VAL HG23 1 1 5 4286 1 1 27 VAL N N -5.781 -6.992 -0.589 1.00 . A A . 27 VAL N 1 1 5 4287 1 1 27 VAL O O -6.548 -4.446 -2.855 1.00 . A A . 27 VAL O 1 1 5 4288 1 1 28 SER C C -8.947 -6.023 -3.920 1.00 . A A . 28 SER C 1 1 5 4289 1 1 28 SER CA C -7.577 -6.521 -4.372 1.00 . A A . 28 SER CA 1 1 5 4290 1 1 28 SER CB C -7.720 -7.859 -5.102 1.00 . A A . 28 SER CB 1 1 5 4291 1 1 28 SER H H -6.385 -7.554 -2.960 1.00 . A A . 28 SER H 1 1 5 4292 1 1 28 SER HA H -7.148 -5.797 -5.048 1.00 . A A . 28 SER HA 1 1 5 4293 1 1 28 SER HB2 H -7.003 -8.561 -4.705 1.00 . A A . 28 SER HB2 1 1 5 4294 1 1 28 SER HB3 H -8.719 -8.243 -4.956 1.00 . A A . 28 SER HB3 1 1 5 4295 1 1 28 SER HG H -7.937 -6.923 -6.810 1.00 . A A . 28 SER HG 1 1 5 4296 1 1 28 SER N N -6.673 -6.658 -3.236 1.00 . A A . 28 SER N 1 1 5 4297 1 1 28 SER O O -9.648 -5.342 -4.669 1.00 . A A . 28 SER O 1 1 5 4298 1 1 28 SER OG O -7.488 -7.709 -6.492 1.00 . A A . 28 SER OG 1 1 5 4299 1 1 29 GLN C C -10.600 -4.470 -1.779 1.00 . A A . 29 GLN C 1 1 5 4300 1 1 29 GLN CA C -10.600 -5.954 -2.142 1.00 . A A . 29 GLN CA 1 1 5 4301 1 1 29 GLN CB C -10.940 -6.790 -0.907 1.00 . A A . 29 GLN CB 1 1 5 4302 1 1 29 GLN CD C -11.000 -9.169 -0.057 1.00 . A A . 29 GLN CD 1 1 5 4303 1 1 29 GLN CG C -11.270 -8.241 -1.227 1.00 . A A . 29 GLN CG 1 1 5 4304 1 1 29 GLN H H -8.720 -6.911 -2.144 1.00 . A A . 29 GLN H 1 1 5 4305 1 1 29 GLN HA H -11.360 -6.124 -2.897 1.00 . A A . 29 GLN HA 1 1 5 4306 1 1 29 GLN HB2 H -10.100 -6.771 -0.231 1.00 . A A . 29 GLN HB2 1 1 5 4307 1 1 29 GLN HB3 H -11.800 -6.355 -0.415 1.00 . A A . 29 GLN HB3 1 1 5 4308 1 1 29 GLN HE21 H -11.800 -10.695 -1.050 1.00 . A A . 29 GLN HE21 1 1 5 4309 1 1 29 GLN HE22 H -11.210 -11.055 0.535 1.00 . A A . 29 GLN HE22 1 1 5 4310 1 1 29 GLN HG2 H -12.310 -8.315 -1.491 1.00 . A A . 29 GLN HG2 1 1 5 4311 1 1 29 GLN HG3 H -10.660 -8.557 -2.064 1.00 . A A . 29 GLN HG3 1 1 5 4312 1 1 29 GLN N N -9.321 -6.366 -2.693 1.00 . A A . 29 GLN N 1 1 5 4313 1 1 29 GLN NE2 N -11.370 -10.433 -0.205 1.00 . A A . 29 GLN NE2 1 1 5 4314 1 1 29 GLN O O -11.660 -3.855 -1.640 1.00 . A A . 29 GLN O 1 1 5 4315 1 1 29 GLN OE1 O -10.460 -8.754 0.967 1.00 . A A . 29 GLN OE1 1 1 5 4316 1 1 30 TRP C C -10.070 -1.606 -2.232 1.00 . A A . 30 TRP C 1 1 5 4317 1 1 30 TRP CA C -9.277 -2.488 -1.275 1.00 . A A . 30 TRP CA 1 1 5 4318 1 1 30 TRP CB C -7.805 -2.072 -1.295 1.00 . A A . 30 TRP CB 1 1 5 4319 1 1 30 TRP CD1 C -7.530 -3.079 1.050 1.00 . A A . 30 TRP CD1 1 1 5 4320 1 1 30 TRP CD2 C -5.602 -2.551 0.040 1.00 . A A . 30 TRP CD2 1 1 5 4321 1 1 30 TRP CE2 C -5.312 -3.090 1.308 1.00 . A A . 30 TRP CE2 1 1 5 4322 1 1 30 TRP CE3 C -4.544 -2.147 -0.779 1.00 . A A . 30 TRP CE3 1 1 5 4323 1 1 30 TRP CG C -7.028 -2.553 -0.106 1.00 . A A . 30 TRP CG 1 1 5 4324 1 1 30 TRP CH2 C -2.992 -2.831 0.952 1.00 . A A . 30 TRP CH2 1 1 5 4325 1 1 30 TRP CZ2 C -4.008 -3.234 1.774 1.00 . A A . 30 TRP CZ2 1 1 5 4326 1 1 30 TRP CZ3 C -3.251 -2.292 -0.313 1.00 . A A . 30 TRP CZ3 1 1 5 4327 1 1 30 TRP H H -8.603 -4.438 -1.745 1.00 . A A . 30 TRP H 1 1 5 4328 1 1 30 TRP HA H -9.666 -2.356 -0.276 1.00 . A A . 30 TRP HA 1 1 5 4329 1 1 30 TRP HB2 H -7.338 -2.471 -2.182 1.00 . A A . 30 TRP HB2 1 1 5 4330 1 1 30 TRP HB3 H -7.745 -0.994 -1.317 1.00 . A A . 30 TRP HB3 1 1 5 4331 1 1 30 TRP HD1 H -8.584 -3.213 1.250 1.00 . A A . 30 TRP HD1 1 1 5 4332 1 1 30 TRP HE1 H -6.611 -3.796 2.797 1.00 . A A . 30 TRP HE1 1 1 5 4333 1 1 30 TRP HE3 H -4.725 -1.730 -1.758 1.00 . A A . 30 TRP HE3 1 1 5 4334 1 1 30 TRP HH2 H -1.965 -2.924 1.275 1.00 . A A . 30 TRP HH2 1 1 5 4335 1 1 30 TRP HZ2 H -3.793 -3.649 2.748 1.00 . A A . 30 TRP HZ2 1 1 5 4336 1 1 30 TRP HZ3 H -2.420 -1.984 -0.932 1.00 . A A . 30 TRP HZ3 1 1 5 4337 1 1 30 TRP N N -9.411 -3.899 -1.624 1.00 . A A . 30 TRP N 1 1 5 4338 1 1 30 TRP NE1 N -6.506 -3.404 1.905 1.00 . A A . 30 TRP NE1 1 1 5 4339 1 1 30 TRP O O -10.050 -1.811 -3.446 1.00 . A A . 30 TRP O 1 1 5 4340 1 1 31 LYS C C -10.720 1.465 -2.966 1.00 . A A . 31 LYS C 1 1 5 4341 1 1 31 LYS CA C -11.570 0.292 -2.482 1.00 . A A . 31 LYS CA 1 1 5 4342 1 1 31 LYS CB C -12.770 0.800 -1.669 1.00 . A A . 31 LYS CB 1 1 5 4343 1 1 31 LYS CD C -15.260 1.130 -1.630 1.00 . A A . 31 LYS CD 1 1 5 4344 1 1 31 LYS CE C -16.590 0.436 -1.843 1.00 . A A . 31 LYS CE 1 1 5 4345 1 1 31 LYS CG C -14.110 0.306 -2.185 1.00 . A A . 31 LYS CG 1 1 5 4346 1 1 31 LYS H H -10.750 -0.510 -0.705 1.00 . A A . 31 LYS H 1 1 5 4347 1 1 31 LYS HA H -11.940 -0.253 -3.340 1.00 . A A . 31 LYS HA 1 1 5 4348 1 1 31 LYS HB2 H -12.660 0.473 -0.647 1.00 . A A . 31 LYS HB2 1 1 5 4349 1 1 31 LYS HB3 H -12.770 1.880 -1.692 1.00 . A A . 31 LYS HB3 1 1 5 4350 1 1 31 LYS HD2 H -15.100 1.279 -0.572 1.00 . A A . 31 LYS HD2 1 1 5 4351 1 1 31 LYS HD3 H -15.270 2.088 -2.130 1.00 . A A . 31 LYS HD3 1 1 5 4352 1 1 31 LYS HE2 H -16.480 -0.610 -1.603 1.00 . A A . 31 LYS HE2 1 1 5 4353 1 1 31 LYS HE3 H -17.320 0.882 -1.183 1.00 . A A . 31 LYS HE3 1 1 5 4354 1 1 31 LYS HG2 H -14.120 0.375 -3.262 1.00 . A A . 31 LYS HG2 1 1 5 4355 1 1 31 LYS HG3 H -14.240 -0.724 -1.888 1.00 . A A . 31 LYS HG3 1 1 5 4356 1 1 31 LYS HZ1 H -16.410 0.077 -3.892 1.00 . A A . 31 LYS HZ1 1 1 5 4357 1 1 31 LYS HZ2 H -17.120 1.566 -3.518 1.00 . A A . 31 LYS HZ2 1 1 5 4358 1 1 31 LYS HZ3 H -18.010 0.141 -3.346 1.00 . A A . 31 LYS HZ3 1 1 5 4359 1 1 31 LYS N N -10.770 -0.624 -1.679 1.00 . A A . 31 LYS N 1 1 5 4360 1 1 31 LYS NZ N -17.070 0.564 -3.248 1.00 . A A . 31 LYS NZ 1 1 5 4361 1 1 31 LYS O O -9.502 1.433 -2.874 1.00 . A A . 31 LYS O 1 1 5 4362 1 1 32 GLU C C -9.674 4.185 -2.951 1.00 . A A . 32 GLU C 1 1 5 4363 1 1 32 GLU CA C -10.690 3.684 -3.974 1.00 . A A . 32 GLU CA 1 1 5 4364 1 1 32 GLU CB C -11.690 4.793 -4.301 1.00 . A A . 32 GLU CB 1 1 5 4365 1 1 32 GLU CD C -12.500 6.496 -5.983 1.00 . A A . 32 GLU CD 1 1 5 4366 1 1 32 GLU CG C -11.510 5.387 -5.689 1.00 . A A . 32 GLU CG 1 1 5 4367 1 1 32 GLU H H -12.360 2.469 -3.525 1.00 . A A . 32 GLU H 1 1 5 4368 1 1 32 GLU HA H -10.160 3.407 -4.877 1.00 . A A . 32 GLU HA 1 1 5 4369 1 1 32 GLU HB2 H -12.690 4.389 -4.236 1.00 . A A . 32 GLU HB2 1 1 5 4370 1 1 32 GLU HB3 H -11.580 5.588 -3.576 1.00 . A A . 32 GLU HB3 1 1 5 4371 1 1 32 GLU HG2 H -10.510 5.788 -5.767 1.00 . A A . 32 GLU HG2 1 1 5 4372 1 1 32 GLU HG3 H -11.640 4.604 -6.421 1.00 . A A . 32 GLU HG3 1 1 5 4373 1 1 32 GLU N N -11.380 2.501 -3.479 1.00 . A A . 32 GLU N 1 1 5 4374 1 1 32 GLU O O -8.654 4.774 -3.310 1.00 . A A . 32 GLU O 1 1 5 4375 1 1 32 GLU OE1 O -12.900 7.200 -5.034 1.00 . A A . 32 GLU OE1 1 1 5 4376 1 1 32 GLU OE2 O -12.870 6.662 -7.164 1.00 . A A . 32 GLU OE2 1 1 5 4377 1 1 33 VAL C C -8.803 3.206 0.362 1.00 . A A . 33 VAL C 1 1 5 4378 1 1 33 VAL CA C -9.069 4.360 -0.599 1.00 . A A . 33 VAL CA 1 1 5 4379 1 1 33 VAL CB C -9.658 5.547 0.190 1.00 . A A . 33 VAL CB 1 1 5 4380 1 1 33 VAL CG1 C -8.654 6.061 1.212 1.00 . A A . 33 VAL CG1 1 1 5 4381 1 1 33 VAL CG2 C -10.080 6.660 -0.755 1.00 . A A . 33 VAL CG2 1 1 5 4382 1 1 33 VAL H H -10.780 3.465 -1.453 1.00 . A A . 33 VAL H 1 1 5 4383 1 1 33 VAL HA H -8.135 4.673 -1.040 1.00 . A A . 33 VAL HA 1 1 5 4384 1 1 33 VAL HB H -10.530 5.202 0.721 1.00 . A A . 33 VAL HB 1 1 5 4385 1 1 33 VAL HG11 H -8.839 5.591 2.167 1.00 . A A . 33 VAL HG11 1 1 5 4386 1 1 33 VAL HG12 H -8.757 7.131 1.311 1.00 . A A . 33 VAL HG12 1 1 5 4387 1 1 33 VAL HG13 H -7.653 5.824 0.884 1.00 . A A . 33 VAL HG13 1 1 5 4388 1 1 33 VAL HG21 H -9.254 7.337 -0.909 1.00 . A A . 33 VAL HG21 1 1 5 4389 1 1 33 VAL HG22 H -10.910 7.199 -0.327 1.00 . A A . 33 VAL HG22 1 1 5 4390 1 1 33 VAL HG23 H -10.370 6.235 -1.704 1.00 . A A . 33 VAL HG23 1 1 5 4391 1 1 33 VAL N N -9.958 3.941 -1.675 1.00 . A A . 33 VAL N 1 1 5 4392 1 1 33 VAL O O -9.716 2.710 1.021 1.00 . A A . 33 VAL O 1 1 5 4393 1 1 34 ILE C C -7.637 1.919 2.746 1.00 . A A . 34 ILE C 1 1 5 4394 1 1 34 ILE CA C -7.159 1.681 1.316 1.00 . A A . 34 ILE CA 1 1 5 4395 1 1 34 ILE CB C -5.631 1.476 1.324 1.00 . A A . 34 ILE CB 1 1 5 4396 1 1 34 ILE CD1 C -3.432 2.675 1.766 1.00 . A A . 34 ILE CD1 1 1 5 4397 1 1 34 ILE CG1 C -4.912 2.817 1.484 1.00 . A A . 34 ILE CG1 1 1 5 4398 1 1 34 ILE CG2 C -5.182 0.777 0.051 1.00 . A A . 34 ILE CG2 1 1 5 4399 1 1 34 ILE H H -6.861 3.215 -0.115 1.00 . A A . 34 ILE H 1 1 5 4400 1 1 34 ILE HA H -7.619 0.779 0.939 1.00 . A A . 34 ILE HA 1 1 5 4401 1 1 34 ILE HB H -5.382 0.841 2.160 1.00 . A A . 34 ILE HB 1 1 5 4402 1 1 34 ILE HD11 H -2.929 2.318 0.879 1.00 . A A . 34 ILE HD11 1 1 5 4403 1 1 34 ILE HD12 H -3.285 1.970 2.572 1.00 . A A . 34 ILE HD12 1 1 5 4404 1 1 34 ILE HD13 H -3.026 3.634 2.048 1.00 . A A . 34 ILE HD13 1 1 5 4405 1 1 34 ILE HG12 H -5.021 3.388 0.575 1.00 . A A . 34 ILE HG12 1 1 5 4406 1 1 34 ILE HG13 H -5.356 3.361 2.303 1.00 . A A . 34 ILE HG13 1 1 5 4407 1 1 34 ILE HG21 H -5.890 0.001 -0.203 1.00 . A A . 34 ILE HG21 1 1 5 4408 1 1 34 ILE HG22 H -4.207 0.340 0.205 1.00 . A A . 34 ILE HG22 1 1 5 4409 1 1 34 ILE HG23 H -5.132 1.494 -0.755 1.00 . A A . 34 ILE HG23 1 1 5 4410 1 1 34 ILE N N -7.545 2.781 0.436 1.00 . A A . 34 ILE N 1 1 5 4411 1 1 34 ILE O O -7.933 3.049 3.131 1.00 . A A . 34 ILE O 1 1 5 4412 1 1 35 PRO C C -7.450 2.041 5.722 1.00 . A A . 35 PRO C 1 1 5 4413 1 1 35 PRO CA C -8.171 0.942 4.948 1.00 . A A . 35 PRO CA 1 1 5 4414 1 1 35 PRO CB C -7.827 -0.432 5.523 1.00 . A A . 35 PRO CB 1 1 5 4415 1 1 35 PRO CD C -7.392 -0.540 3.175 1.00 . A A . 35 PRO CD 1 1 5 4416 1 1 35 PRO CG C -7.865 -1.349 4.351 1.00 . A A . 35 PRO CG 1 1 5 4417 1 1 35 PRO HA H -9.237 1.103 5.009 1.00 . A A . 35 PRO HA 1 1 5 4418 1 1 35 PRO HB2 H -6.844 -0.403 5.971 1.00 . A A . 35 PRO HB2 1 1 5 4419 1 1 35 PRO HB3 H -8.560 -0.710 6.266 1.00 . A A . 35 PRO HB3 1 1 5 4420 1 1 35 PRO HD2 H -6.326 -0.658 3.040 1.00 . A A . 35 PRO HD2 1 1 5 4421 1 1 35 PRO HD3 H -7.921 -0.830 2.278 1.00 . A A . 35 PRO HD3 1 1 5 4422 1 1 35 PRO HG2 H -7.207 -2.188 4.519 1.00 . A A . 35 PRO HG2 1 1 5 4423 1 1 35 PRO HG3 H -8.877 -1.692 4.186 1.00 . A A . 35 PRO HG3 1 1 5 4424 1 1 35 PRO N N -7.723 0.848 3.555 1.00 . A A . 35 PRO N 1 1 5 4425 1 1 35 PRO O O -6.550 2.698 5.197 1.00 . A A . 35 PRO O 1 1 5 4426 1 1 36 GLU C C -5.972 2.739 8.474 1.00 . A A . 36 GLU C 1 1 5 4427 1 1 36 GLU CA C -7.254 3.255 7.824 1.00 . A A . 36 GLU CA 1 1 5 4428 1 1 36 GLU CB C -8.248 3.692 8.903 1.00 . A A . 36 GLU CB 1 1 5 4429 1 1 36 GLU CD C -8.520 4.845 11.134 1.00 . A A . 36 GLU CD 1 1 5 4430 1 1 36 GLU CG C -7.692 4.726 9.870 1.00 . A A . 36 GLU CG 1 1 5 4431 1 1 36 GLU H H -8.578 1.681 7.331 1.00 . A A . 36 GLU H 1 1 5 4432 1 1 36 GLU HA H -7.011 4.106 7.205 1.00 . A A . 36 GLU HA 1 1 5 4433 1 1 36 GLU HB2 H -9.120 4.114 8.423 1.00 . A A . 36 GLU HB2 1 1 5 4434 1 1 36 GLU HB3 H -8.547 2.824 9.472 1.00 . A A . 36 GLU HB3 1 1 5 4435 1 1 36 GLU HG2 H -6.687 4.441 10.142 1.00 . A A . 36 GLU HG2 1 1 5 4436 1 1 36 GLU HG3 H -7.673 5.687 9.378 1.00 . A A . 36 GLU HG3 1 1 5 4437 1 1 36 GLU N N -7.855 2.236 6.973 1.00 . A A . 36 GLU N 1 1 5 4438 1 1 36 GLU O O -5.043 3.506 8.730 1.00 . A A . 36 GLU O 1 1 5 4439 1 1 36 GLU OE1 O -9.530 5.581 11.114 1.00 . A A . 36 GLU OE1 1 1 5 4440 1 1 36 GLU OE2 O -8.159 4.205 12.143 1.00 . A A . 36 GLU OE2 1 1 5 4441 1 1 37 LYS C C -3.757 0.357 8.319 1.00 . A A . 37 LYS C 1 1 5 4442 1 1 37 LYS CA C -4.765 0.824 9.365 1.00 . A A . 37 LYS CA 1 1 5 4443 1 1 37 LYS CB C -5.192 -0.355 10.240 1.00 . A A . 37 LYS CB 1 1 5 4444 1 1 37 LYS CD C -7.161 -1.921 10.191 1.00 . A A . 37 LYS CD 1 1 5 4445 1 1 37 LYS CE C -8.419 -1.437 9.488 1.00 . A A . 37 LYS CE 1 1 5 4446 1 1 37 LYS CG C -5.904 -1.456 9.471 1.00 . A A . 37 LYS CG 1 1 5 4447 1 1 37 LYS H H -6.704 0.879 8.516 1.00 . A A . 37 LYS H 1 1 5 4448 1 1 37 LYS HA H -4.293 1.570 9.989 1.00 . A A . 37 LYS HA 1 1 5 4449 1 1 37 LYS HB2 H -4.314 -0.780 10.705 1.00 . A A . 37 LYS HB2 1 1 5 4450 1 1 37 LYS HB3 H -5.857 0.006 11.010 1.00 . A A . 37 LYS HB3 1 1 5 4451 1 1 37 LYS HD2 H -7.170 -3.000 10.219 1.00 . A A . 37 LYS HD2 1 1 5 4452 1 1 37 LYS HD3 H -7.151 -1.534 11.200 1.00 . A A . 37 LYS HD3 1 1 5 4453 1 1 37 LYS HE2 H -8.198 -0.510 8.980 1.00 . A A . 37 LYS HE2 1 1 5 4454 1 1 37 LYS HE3 H -8.720 -2.180 8.765 1.00 . A A . 37 LYS HE3 1 1 5 4455 1 1 37 LYS HG2 H -6.177 -1.082 8.496 1.00 . A A . 37 LYS HG2 1 1 5 4456 1 1 37 LYS HG3 H -5.232 -2.296 9.361 1.00 . A A . 37 LYS HG3 1 1 5 4457 1 1 37 LYS HZ1 H -9.594 -0.201 10.695 1.00 . A A . 37 LYS HZ1 1 1 5 4458 1 1 37 LYS HZ2 H -9.387 -1.761 11.311 1.00 . A A . 37 LYS HZ2 1 1 5 4459 1 1 37 LYS HZ3 H -10.440 -1.498 10.014 1.00 . A A . 37 LYS HZ3 1 1 5 4460 1 1 37 LYS N N -5.931 1.438 8.742 1.00 . A A . 37 LYS N 1 1 5 4461 1 1 37 LYS NZ N -9.538 -1.208 10.444 1.00 . A A . 37 LYS NZ 1 1 5 4462 1 1 37 LYS O O -2.574 0.189 8.618 1.00 . A A . 37 LYS O 1 1 5 4463 1 1 38 ASP C C -2.563 0.865 5.437 1.00 . A A . 38 ASP C 1 1 5 4464 1 1 38 ASP CA C -3.355 -0.302 6.014 1.00 . A A . 38 ASP CA 1 1 5 4465 1 1 38 ASP CB C -4.176 -0.974 4.910 1.00 . A A . 38 ASP CB 1 1 5 4466 1 1 38 ASP CG C -4.302 -2.472 5.110 1.00 . A A . 38 ASP CG 1 1 5 4467 1 1 38 ASP H H -5.177 0.294 6.911 1.00 . A A . 38 ASP H 1 1 5 4468 1 1 38 ASP HA H -2.663 -1.022 6.425 1.00 . A A . 38 ASP HA 1 1 5 4469 1 1 38 ASP HB2 H -5.168 -0.547 4.898 1.00 . A A . 38 ASP HB2 1 1 5 4470 1 1 38 ASP HB3 H -3.701 -0.794 3.957 1.00 . A A . 38 ASP HB3 1 1 5 4471 1 1 38 ASP N N -4.226 0.147 7.093 1.00 . A A . 38 ASP N 1 1 5 4472 1 1 38 ASP O O -1.372 0.741 5.152 1.00 . A A . 38 ASP O 1 1 5 4473 1 1 38 ASP OD1 O -3.551 -3.027 5.939 1.00 . A A . 38 ASP OD1 1 1 5 4474 1 1 38 ASP OD2 O -5.155 -3.090 4.438 1.00 . A A . 38 ASP OD2 1 1 5 4475 1 1 39 ALA C C -1.574 3.760 5.727 1.00 . A A . 39 ALA C 1 1 5 4476 1 1 39 ALA CA C -2.587 3.195 4.737 1.00 . A A . 39 ALA CA 1 1 5 4477 1 1 39 ALA CB C -3.629 4.247 4.388 1.00 . A A . 39 ALA CB 1 1 5 4478 1 1 39 ALA H H -4.178 2.042 5.523 1.00 . A A . 39 ALA H 1 1 5 4479 1 1 39 ALA HA H -2.072 2.916 3.830 1.00 . A A . 39 ALA HA 1 1 5 4480 1 1 39 ALA HB1 H -3.831 4.855 5.256 1.00 . A A . 39 ALA HB1 1 1 5 4481 1 1 39 ALA HB2 H -4.539 3.760 4.070 1.00 . A A . 39 ALA HB2 1 1 5 4482 1 1 39 ALA HB3 H -3.257 4.872 3.589 1.00 . A A . 39 ALA HB3 1 1 5 4483 1 1 39 ALA N N -3.231 2.003 5.273 1.00 . A A . 39 ALA N 1 1 5 4484 1 1 39 ALA O O -0.619 4.433 5.336 1.00 . A A . 39 ALA O 1 1 5 4485 1 1 40 TYR C C 0.462 3.272 7.974 1.00 . A A . 40 TYR C 1 1 5 4486 1 1 40 TYR CA C -0.895 3.964 8.055 1.00 . A A . 40 TYR CA 1 1 5 4487 1 1 40 TYR CB C -1.523 3.730 9.431 1.00 . A A . 40 TYR CB 1 1 5 4488 1 1 40 TYR CD1 C -0.472 5.454 10.943 1.00 . A A . 40 TYR CD1 1 1 5 4489 1 1 40 TYR CD2 C 0.066 3.161 11.306 1.00 . A A . 40 TYR CD2 1 1 5 4490 1 1 40 TYR CE1 C 0.348 5.817 11.995 1.00 . A A . 40 TYR CE1 1 1 5 4491 1 1 40 TYR CE2 C 0.886 3.515 12.360 1.00 . A A . 40 TYR CE2 1 1 5 4492 1 1 40 TYR CG C -0.627 4.122 10.582 1.00 . A A . 40 TYR CG 1 1 5 4493 1 1 40 TYR CZ C 1.024 4.845 12.700 1.00 . A A . 40 TYR CZ 1 1 5 4494 1 1 40 TYR H H -2.568 2.944 7.258 1.00 . A A . 40 TYR H 1 1 5 4495 1 1 40 TYR HA H -0.755 5.025 7.910 1.00 . A A . 40 TYR HA 1 1 5 4496 1 1 40 TYR HB2 H -2.433 4.309 9.507 1.00 . A A . 40 TYR HB2 1 1 5 4497 1 1 40 TYR HB3 H -1.759 2.678 9.536 1.00 . A A . 40 TYR HB3 1 1 5 4498 1 1 40 TYR HD1 H -1.005 6.214 10.390 1.00 . A A . 40 TYR HD1 1 1 5 4499 1 1 40 TYR HD2 H -0.046 2.120 11.036 1.00 . A A . 40 TYR HD2 1 1 5 4500 1 1 40 TYR HE1 H 0.454 6.859 12.260 1.00 . A A . 40 TYR HE1 1 1 5 4501 1 1 40 TYR HE2 H 1.417 2.752 12.912 1.00 . A A . 40 TYR HE2 1 1 5 4502 1 1 40 TYR HH H 1.394 5.851 14.297 1.00 . A A . 40 TYR HH 1 1 5 4503 1 1 40 TYR N N -1.788 3.484 7.009 1.00 . A A . 40 TYR N 1 1 5 4504 1 1 40 TYR O O 1.493 3.924 7.801 1.00 . A A . 40 TYR O 1 1 5 4505 1 1 40 TYR OH O 1.841 5.202 13.749 1.00 . A A . 40 TYR OH 1 1 5 4506 1 1 41 ARG C C 2.440 1.421 6.744 1.00 . A A . 41 ARG C 1 1 5 4507 1 1 41 ARG CA C 1.688 1.167 8.047 1.00 . A A . 41 ARG CA 1 1 5 4508 1 1 41 ARG CB C 1.375 -0.323 8.184 1.00 . A A . 41 ARG CB 1 1 5 4509 1 1 41 ARG CD C -0.263 -1.910 9.237 1.00 . A A . 41 ARG CD 1 1 5 4510 1 1 41 ARG CG C 0.589 -0.667 9.438 1.00 . A A . 41 ARG CG 1 1 5 4511 1 1 41 ARG CZ C -1.495 -3.494 10.666 1.00 . A A . 41 ARG CZ 1 1 5 4512 1 1 41 ARG H H -0.398 1.488 8.240 1.00 . A A . 41 ARG H 1 1 5 4513 1 1 41 ARG HA H 2.310 1.473 8.874 1.00 . A A . 41 ARG HA 1 1 5 4514 1 1 41 ARG HB2 H 0.800 -0.639 7.327 1.00 . A A . 41 ARG HB2 1 1 5 4515 1 1 41 ARG HB3 H 2.304 -0.873 8.206 1.00 . A A . 41 ARG HB3 1 1 5 4516 1 1 41 ARG HD2 H -1.208 -1.618 8.803 1.00 . A A . 41 ARG HD2 1 1 5 4517 1 1 41 ARG HD3 H 0.251 -2.576 8.560 1.00 . A A . 41 ARG HD3 1 1 5 4518 1 1 41 ARG HE H 0.078 -2.413 11.249 1.00 . A A . 41 ARG HE 1 1 5 4519 1 1 41 ARG HG2 H 1.279 -0.845 10.248 1.00 . A A . 41 ARG HG2 1 1 5 4520 1 1 41 ARG HG3 H -0.056 0.164 9.687 1.00 . A A . 41 ARG HG3 1 1 5 4521 1 1 41 ARG HH11 H -2.201 -3.347 8.776 1.00 . A A . 41 ARG HH11 1 1 5 4522 1 1 41 ARG HH12 H -3.052 -4.453 9.801 1.00 . A A . 41 ARG HH12 1 1 5 4523 1 1 41 ARG HH21 H -1.038 -3.869 12.600 1.00 . A A . 41 ARG HH21 1 1 5 4524 1 1 41 ARG HH22 H -2.391 -4.750 11.973 1.00 . A A . 41 ARG HH22 1 1 5 4525 1 1 41 ARG N N 0.456 1.950 8.103 1.00 . A A . 41 ARG N 1 1 5 4526 1 1 41 ARG NE N -0.515 -2.611 10.494 1.00 . A A . 41 ARG NE 1 1 5 4527 1 1 41 ARG NH1 N -2.316 -3.788 9.666 1.00 . A A . 41 ARG NH1 1 1 5 4528 1 1 41 ARG NH2 N -1.655 -4.086 11.842 1.00 . A A . 41 ARG NH2 1 1 5 4529 1 1 41 ARG O O 3.667 1.318 6.696 1.00 . A A . 41 ARG O 1 1 5 4530 1 1 42 LEU C C 3.315 3.154 4.477 1.00 . A A . 42 LEU C 1 1 5 4531 1 1 42 LEU CA C 2.300 2.019 4.389 1.00 . A A . 42 LEU CA 1 1 5 4532 1 1 42 LEU CB C 1.216 2.364 3.365 1.00 . A A . 42 LEU CB 1 1 5 4533 1 1 42 LEU CD1 C -0.583 1.583 1.803 1.00 . A A . 42 LEU CD1 1 1 5 4534 1 1 42 LEU CD2 C 1.698 0.565 1.687 1.00 . A A . 42 LEU CD2 1 1 5 4535 1 1 42 LEU CG C 0.643 1.168 2.602 1.00 . A A . 42 LEU CG 1 1 5 4536 1 1 42 LEU H H 0.728 1.818 5.791 1.00 . A A . 42 LEU H 1 1 5 4537 1 1 42 LEU HA H 2.810 1.121 4.071 1.00 . A A . 42 LEU HA 1 1 5 4538 1 1 42 LEU HB2 H 0.407 2.857 3.883 1.00 . A A . 42 LEU HB2 1 1 5 4539 1 1 42 LEU HB3 H 1.635 3.053 2.647 1.00 . A A . 42 LEU HB3 1 1 5 4540 1 1 42 LEU HD11 H -0.305 1.735 0.771 1.00 . A A . 42 LEU HD11 1 1 5 4541 1 1 42 LEU HD12 H -0.983 2.502 2.207 1.00 . A A . 42 LEU HD12 1 1 5 4542 1 1 42 LEU HD13 H -1.331 0.808 1.863 1.00 . A A . 42 LEU HD13 1 1 5 4543 1 1 42 LEU HD21 H 1.498 -0.488 1.553 1.00 . A A . 42 LEU HD21 1 1 5 4544 1 1 42 LEU HD22 H 2.674 0.692 2.131 1.00 . A A . 42 LEU HD22 1 1 5 4545 1 1 42 LEU HD23 H 1.671 1.062 0.729 1.00 . A A . 42 LEU HD23 1 1 5 4546 1 1 42 LEU HG H 0.338 0.410 3.310 1.00 . A A . 42 LEU HG 1 1 5 4547 1 1 42 LEU N N 1.699 1.753 5.691 1.00 . A A . 42 LEU N 1 1 5 4548 1 1 42 LEU O O 4.422 3.051 3.948 1.00 . A A . 42 LEU O 1 1 5 4549 1 1 43 GLU C C 5.162 4.983 5.878 1.00 . A A . 43 GLU C 1 1 5 4550 1 1 43 GLU CA C 3.809 5.392 5.302 1.00 . A A . 43 GLU CA 1 1 5 4551 1 1 43 GLU CB C 3.153 6.439 6.206 1.00 . A A . 43 GLU CB 1 1 5 4552 1 1 43 GLU CD C 3.471 8.595 7.481 1.00 . A A . 43 GLU CD 1 1 5 4553 1 1 43 GLU CG C 3.965 7.715 6.351 1.00 . A A . 43 GLU CG 1 1 5 4554 1 1 43 GLU H H 2.036 4.259 5.545 1.00 . A A . 43 GLU H 1 1 5 4555 1 1 43 GLU HA H 3.965 5.822 4.324 1.00 . A A . 43 GLU HA 1 1 5 4556 1 1 43 GLU HB2 H 2.188 6.697 5.796 1.00 . A A . 43 GLU HB2 1 1 5 4557 1 1 43 GLU HB3 H 3.013 6.012 7.189 1.00 . A A . 43 GLU HB3 1 1 5 4558 1 1 43 GLU HG2 H 4.995 7.451 6.544 1.00 . A A . 43 GLU HG2 1 1 5 4559 1 1 43 GLU HG3 H 3.904 8.271 5.427 1.00 . A A . 43 GLU HG3 1 1 5 4560 1 1 43 GLU N N 2.932 4.237 5.146 1.00 . A A . 43 GLU N 1 1 5 4561 1 1 43 GLU O O 6.179 5.621 5.611 1.00 . A A . 43 GLU O 1 1 5 4562 1 1 43 GLU OE1 O 3.627 8.198 8.655 1.00 . A A . 43 GLU OE1 1 1 5 4563 1 1 43 GLU OE2 O 2.926 9.681 7.193 1.00 . A A . 43 GLU OE2 1 1 5 4564 1 1 44 ILE C C 7.100 2.432 6.352 1.00 . A A . 44 ILE C 1 1 5 4565 1 1 44 ILE CA C 6.393 3.419 7.276 1.00 . A A . 44 ILE CA 1 1 5 4566 1 1 44 ILE CB C 6.115 2.734 8.625 1.00 . A A . 44 ILE CB 1 1 5 4567 1 1 44 ILE CD1 C 5.512 3.458 11.004 1.00 . A A . 44 ILE CD1 1 1 5 4568 1 1 44 ILE CG1 C 5.290 3.667 9.521 1.00 . A A . 44 ILE CG1 1 1 5 4569 1 1 44 ILE CG2 C 7.425 2.336 9.295 1.00 . A A . 44 ILE CG2 1 1 5 4570 1 1 44 ILE H H 4.323 3.445 6.842 1.00 . A A . 44 ILE H 1 1 5 4571 1 1 44 ILE HA H 7.044 4.263 7.454 1.00 . A A . 44 ILE HA 1 1 5 4572 1 1 44 ILE HB H 5.548 1.834 8.437 1.00 . A A . 44 ILE HB 1 1 5 4573 1 1 44 ILE HD11 H 4.889 4.140 11.562 1.00 . A A . 44 ILE HD11 1 1 5 4574 1 1 44 ILE HD12 H 6.549 3.644 11.239 1.00 . A A . 44 ILE HD12 1 1 5 4575 1 1 44 ILE HD13 H 5.261 2.441 11.266 1.00 . A A . 44 ILE HD13 1 1 5 4576 1 1 44 ILE HG12 H 5.545 4.690 9.293 1.00 . A A . 44 ILE HG12 1 1 5 4577 1 1 44 ILE HG13 H 4.239 3.512 9.319 1.00 . A A . 44 ILE HG13 1 1 5 4578 1 1 44 ILE HG21 H 7.999 3.223 9.518 1.00 . A A . 44 ILE HG21 1 1 5 4579 1 1 44 ILE HG22 H 7.990 1.700 8.630 1.00 . A A . 44 ILE HG22 1 1 5 4580 1 1 44 ILE HG23 H 7.214 1.803 10.210 1.00 . A A . 44 ILE HG23 1 1 5 4581 1 1 44 ILE N N 5.166 3.914 6.667 1.00 . A A . 44 ILE N 1 1 5 4582 1 1 44 ILE O O 8.318 2.488 6.177 1.00 . A A . 44 ILE O 1 1 5 4583 1 1 45 VAL C C 7.487 1.178 3.625 1.00 . A A . 45 VAL C 1 1 5 4584 1 1 45 VAL CA C 6.866 0.526 4.855 1.00 . A A . 45 VAL CA 1 1 5 4585 1 1 45 VAL CB C 5.770 -0.474 4.419 1.00 . A A . 45 VAL CB 1 1 5 4586 1 1 45 VAL CG1 C 5.100 -0.044 3.119 1.00 . A A . 45 VAL CG1 1 1 5 4587 1 1 45 VAL CG2 C 6.346 -1.876 4.293 1.00 . A A . 45 VAL CG2 1 1 5 4588 1 1 45 VAL H H 5.363 1.536 5.945 1.00 . A A . 45 VAL H 1 1 5 4589 1 1 45 VAL HA H 7.632 -0.023 5.384 1.00 . A A . 45 VAL HA 1 1 5 4590 1 1 45 VAL HB H 5.014 -0.489 5.188 1.00 . A A . 45 VAL HB 1 1 5 4591 1 1 45 VAL HG11 H 5.800 -0.145 2.302 1.00 . A A . 45 VAL HG11 1 1 5 4592 1 1 45 VAL HG12 H 4.787 0.986 3.198 1.00 . A A . 45 VAL HG12 1 1 5 4593 1 1 45 VAL HG13 H 4.239 -0.669 2.933 1.00 . A A . 45 VAL HG13 1 1 5 4594 1 1 45 VAL HG21 H 7.273 -1.935 4.845 1.00 . A A . 45 VAL HG21 1 1 5 4595 1 1 45 VAL HG22 H 6.532 -2.096 3.252 1.00 . A A . 45 VAL HG22 1 1 5 4596 1 1 45 VAL HG23 H 5.643 -2.592 4.693 1.00 . A A . 45 VAL HG23 1 1 5 4597 1 1 45 VAL N N 6.325 1.528 5.763 1.00 . A A . 45 VAL N 1 1 5 4598 1 1 45 VAL O O 8.523 0.738 3.127 1.00 . A A . 45 VAL O 1 1 5 4599 1 1 46 THR C C 8.438 3.916 2.306 1.00 . A A . 46 THR C 1 1 5 4600 1 1 46 THR CA C 7.304 2.948 1.963 1.00 . A A . 46 THR CA 1 1 5 4601 1 1 46 THR CB C 6.144 3.711 1.330 1.00 . A A . 46 THR CB 1 1 5 4602 1 1 46 THR CG2 C 5.103 2.809 0.704 1.00 . A A . 46 THR CG2 1 1 5 4603 1 1 46 THR H H 6.012 2.522 3.577 1.00 . A A . 46 THR H 1 1 5 4604 1 1 46 THR HA H 7.670 2.221 1.256 1.00 . A A . 46 THR HA 1 1 5 4605 1 1 46 THR HB H 6.531 4.352 0.559 1.00 . A A . 46 THR HB 1 1 5 4606 1 1 46 THR HG1 H 6.145 4.987 2.816 1.00 . A A . 46 THR HG1 1 1 5 4607 1 1 46 THR HG21 H 4.197 3.370 0.532 1.00 . A A . 46 THR HG21 1 1 5 4608 1 1 46 THR HG22 H 4.894 1.985 1.371 1.00 . A A . 46 THR HG22 1 1 5 4609 1 1 46 THR HG23 H 5.475 2.427 -0.234 1.00 . A A . 46 THR HG23 1 1 5 4610 1 1 46 THR N N 6.835 2.228 3.138 1.00 . A A . 46 THR N 1 1 5 4611 1 1 46 THR O O 8.929 4.636 1.436 1.00 . A A . 46 THR O 1 1 5 4612 1 1 46 THR OG1 O 5.490 4.521 2.292 1.00 . A A . 46 THR OG1 1 1 5 4613 1 1 47 ALA C C 9.496 6.277 3.978 1.00 . A A . 47 ALA C 1 1 5 4614 1 1 47 ALA CA C 9.931 4.816 4.011 1.00 . A A . 47 ALA CA 1 1 5 4615 1 1 47 ALA CB C 11.170 4.614 3.150 1.00 . A A . 47 ALA CB 1 1 5 4616 1 1 47 ALA H H 8.432 3.340 4.225 1.00 . A A . 47 ALA H 1 1 5 4617 1 1 47 ALA HA H 10.184 4.552 5.028 1.00 . A A . 47 ALA HA 1 1 5 4618 1 1 47 ALA HB1 H 12.040 4.971 3.681 1.00 . A A . 47 ALA HB1 1 1 5 4619 1 1 47 ALA HB2 H 11.063 5.164 2.227 1.00 . A A . 47 ALA HB2 1 1 5 4620 1 1 47 ALA HB3 H 11.290 3.563 2.930 1.00 . A A . 47 ALA HB3 1 1 5 4621 1 1 47 ALA N N 8.855 3.933 3.571 1.00 . A A . 47 ALA N 1 1 5 4622 1 1 47 ALA O O 10.268 7.159 3.603 1.00 . A A . 47 ALA O 1 1 5 4623 1 1 48 GLY C C 7.474 8.423 2.999 1.00 . A A . 48 GLY C 1 1 5 4624 1 1 48 GLY CA C 7.735 7.883 4.392 1.00 . A A . 48 GLY CA 1 1 5 4625 1 1 48 GLY H H 7.683 5.783 4.669 1.00 . A A . 48 GLY H 1 1 5 4626 1 1 48 GLY HA2 H 6.811 7.895 4.949 1.00 . A A . 48 GLY HA2 1 1 5 4627 1 1 48 GLY HA3 H 8.449 8.523 4.886 1.00 . A A . 48 GLY HA3 1 1 5 4628 1 1 48 GLY N N 8.253 6.527 4.378 1.00 . A A . 48 GLY N 1 1 5 4629 1 1 48 GLY O O 7.487 9.635 2.786 1.00 . A A . 48 GLY O 1 1 5 4630 1 1 49 ALA C C 5.564 8.504 0.535 1.00 . A A . 49 ALA C 1 1 5 4631 1 1 49 ALA CA C 6.967 7.924 0.674 1.00 . A A . 49 ALA CA 1 1 5 4632 1 1 49 ALA CB C 7.145 6.740 -0.265 1.00 . A A . 49 ALA CB 1 1 5 4633 1 1 49 ALA H H 7.234 6.572 2.280 1.00 . A A . 49 ALA H 1 1 5 4634 1 1 49 ALA HA H 7.687 8.682 0.400 1.00 . A A . 49 ALA HA 1 1 5 4635 1 1 49 ALA HB1 H 6.244 6.144 -0.268 1.00 . A A . 49 ALA HB1 1 1 5 4636 1 1 49 ALA HB2 H 7.974 6.135 0.073 1.00 . A A . 49 ALA HB2 1 1 5 4637 1 1 49 ALA HB3 H 7.344 7.098 -1.263 1.00 . A A . 49 ALA HB3 1 1 5 4638 1 1 49 ALA N N 7.234 7.525 2.050 1.00 . A A . 49 ALA N 1 1 5 4639 1 1 49 ALA O O 5.381 9.591 -0.013 1.00 . A A . 49 ALA O 1 1 5 4640 1 1 50 LEU C C 2.816 9.013 2.217 1.00 . A A . 50 LEU C 1 1 5 4641 1 1 50 LEU CA C 3.187 8.212 0.974 1.00 . A A . 50 LEU CA 1 1 5 4642 1 1 50 LEU CB C 2.254 7.007 0.830 1.00 . A A . 50 LEU CB 1 1 5 4643 1 1 50 LEU CD1 C 1.642 5.121 -0.705 1.00 . A A . 50 LEU CD1 1 1 5 4644 1 1 50 LEU CD2 C 0.727 7.412 -1.115 1.00 . A A . 50 LEU CD2 1 1 5 4645 1 1 50 LEU CG C 1.920 6.614 -0.610 1.00 . A A . 50 LEU CG 1 1 5 4646 1 1 50 LEU H H 4.785 6.914 1.464 1.00 . A A . 50 LEU H 1 1 5 4647 1 1 50 LEU HA H 3.080 8.845 0.107 1.00 . A A . 50 LEU HA 1 1 5 4648 1 1 50 LEU HB2 H 2.718 6.160 1.314 1.00 . A A . 50 LEU HB2 1 1 5 4649 1 1 50 LEU HB3 H 1.330 7.231 1.342 1.00 . A A . 50 LEU HB3 1 1 5 4650 1 1 50 LEU HD11 H 2.270 4.594 -0.003 1.00 . A A . 50 LEU HD11 1 1 5 4651 1 1 50 LEU HD12 H 1.855 4.780 -1.707 1.00 . A A . 50 LEU HD12 1 1 5 4652 1 1 50 LEU HD13 H 0.605 4.933 -0.473 1.00 . A A . 50 LEU HD13 1 1 5 4653 1 1 50 LEU HD21 H 0.113 7.713 -0.279 1.00 . A A . 50 LEU HD21 1 1 5 4654 1 1 50 LEU HD22 H 0.145 6.802 -1.790 1.00 . A A . 50 LEU HD22 1 1 5 4655 1 1 50 LEU HD23 H 1.078 8.291 -1.638 1.00 . A A . 50 LEU HD23 1 1 5 4656 1 1 50 LEU HG H 2.766 6.837 -1.243 1.00 . A A . 50 LEU HG 1 1 5 4657 1 1 50 LEU N N 4.575 7.771 1.037 1.00 . A A . 50 LEU N 1 1 5 4658 1 1 50 LEU O O 3.334 8.765 3.305 1.00 . A A . 50 LEU O 1 1 5 4659 1 1 51 LYS C C 0.082 10.409 3.627 1.00 . A A . 51 LYS C 1 1 5 4660 1 1 51 LYS CA C 1.477 10.814 3.158 1.00 . A A . 51 LYS CA 1 1 5 4661 1 1 51 LYS CB C 1.486 12.289 2.745 1.00 . A A . 51 LYS CB 1 1 5 4662 1 1 51 LYS CD C 1.679 14.557 3.812 1.00 . A A . 51 LYS CD 1 1 5 4663 1 1 51 LYS CE C 2.732 15.611 4.114 1.00 . A A . 51 LYS CE 1 1 5 4664 1 1 51 LYS CG C 2.297 13.174 3.678 1.00 . A A . 51 LYS CG 1 1 5 4665 1 1 51 LYS H H 1.538 10.127 1.156 1.00 . A A . 51 LYS H 1 1 5 4666 1 1 51 LYS HA H 2.171 10.673 3.972 1.00 . A A . 51 LYS HA 1 1 5 4667 1 1 51 LYS HB2 H 1.905 12.371 1.754 1.00 . A A . 51 LYS HB2 1 1 5 4668 1 1 51 LYS HB3 H 0.471 12.655 2.730 1.00 . A A . 51 LYS HB3 1 1 5 4669 1 1 51 LYS HD2 H 1.186 14.811 2.886 1.00 . A A . 51 LYS HD2 1 1 5 4670 1 1 51 LYS HD3 H 0.956 14.539 4.615 1.00 . A A . 51 LYS HD3 1 1 5 4671 1 1 51 LYS HE2 H 3.620 15.122 4.484 1.00 . A A . 51 LYS HE2 1 1 5 4672 1 1 51 LYS HE3 H 2.966 16.140 3.201 1.00 . A A . 51 LYS HE3 1 1 5 4673 1 1 51 LYS HG2 H 2.338 12.712 4.653 1.00 . A A . 51 LYS HG2 1 1 5 4674 1 1 51 LYS HG3 H 3.298 13.274 3.283 1.00 . A A . 51 LYS HG3 1 1 5 4675 1 1 51 LYS HZ1 H 3.051 16.879 5.744 1.00 . A A . 51 LYS HZ1 1 1 5 4676 1 1 51 LYS HZ2 H 1.519 16.163 5.724 1.00 . A A . 51 LYS HZ2 1 1 5 4677 1 1 51 LYS HZ3 H 1.871 17.434 4.664 1.00 . A A . 51 LYS HZ3 1 1 5 4678 1 1 51 LYS N N 1.917 9.977 2.048 1.00 . A A . 51 LYS N 1 1 5 4679 1 1 51 LYS NZ N 2.259 16.590 5.133 1.00 . A A . 51 LYS NZ 1 1 5 4680 1 1 51 LYS O O -0.866 10.388 2.843 1.00 . A A . 51 LYS O 1 1 5 4681 1 1 52 TYR C C -2.179 10.897 5.799 1.00 . A A . 52 TYR C 1 1 5 4682 1 1 52 TYR CA C -1.311 9.682 5.486 1.00 . A A . 52 TYR CA 1 1 5 4683 1 1 52 TYR CB C -1.084 8.862 6.758 1.00 . A A . 52 TYR CB 1 1 5 4684 1 1 52 TYR CD1 C -3.368 8.753 7.830 1.00 . A A . 52 TYR CD1 1 1 5 4685 1 1 52 TYR CD2 C -2.405 6.728 7.024 1.00 . A A . 52 TYR CD2 1 1 5 4686 1 1 52 TYR CE1 C -4.488 8.059 8.248 1.00 . A A . 52 TYR CE1 1 1 5 4687 1 1 52 TYR CE2 C -3.520 6.027 7.439 1.00 . A A . 52 TYR CE2 1 1 5 4688 1 1 52 TYR CG C -2.309 8.101 7.212 1.00 . A A . 52 TYR CG 1 1 5 4689 1 1 52 TYR CZ C -4.559 6.697 8.050 1.00 . A A . 52 TYR CZ 1 1 5 4690 1 1 52 TYR H H 0.759 10.123 5.487 1.00 . A A . 52 TYR H 1 1 5 4691 1 1 52 TYR HA H -1.821 9.069 4.759 1.00 . A A . 52 TYR HA 1 1 5 4692 1 1 52 TYR HB2 H -0.296 8.147 6.581 1.00 . A A . 52 TYR HB2 1 1 5 4693 1 1 52 TYR HB3 H -0.790 9.526 7.557 1.00 . A A . 52 TYR HB3 1 1 5 4694 1 1 52 TYR HD1 H -3.309 9.820 7.984 1.00 . A A . 52 TYR HD1 1 1 5 4695 1 1 52 TYR HD2 H -1.589 6.205 6.545 1.00 . A A . 52 TYR HD2 1 1 5 4696 1 1 52 TYR HE1 H -5.301 8.584 8.727 1.00 . A A . 52 TYR HE1 1 1 5 4697 1 1 52 TYR HE2 H -3.577 4.960 7.283 1.00 . A A . 52 TYR HE2 1 1 5 4698 1 1 52 TYR HH H -5.404 5.147 8.811 1.00 . A A . 52 TYR HH 1 1 5 4699 1 1 52 TYR N N -0.033 10.086 4.911 1.00 . A A . 52 TYR N 1 1 5 4700 1 1 52 TYR O O -1.723 11.852 6.429 1.00 . A A . 52 TYR O 1 1 5 4701 1 1 52 TYR OH O -5.671 6.003 8.464 1.00 . A A . 52 TYR OH 1 1 5 4702 1 1 53 GLN C C -5.649 11.446 6.235 1.00 . A A . 53 GLN C 1 1 5 4703 1 1 53 GLN CA C -4.362 11.952 5.588 1.00 . A A . 53 GLN CA 1 1 5 4704 1 1 53 GLN CB C -4.685 12.663 4.273 1.00 . A A . 53 GLN CB 1 1 5 4705 1 1 53 GLN CD C -3.442 14.445 2.979 1.00 . A A . 53 GLN CD 1 1 5 4706 1 1 53 GLN CG C -3.454 13.001 3.448 1.00 . A A . 53 GLN CG 1 1 5 4707 1 1 53 GLN H H -3.735 10.066 4.859 1.00 . A A . 53 GLN H 1 1 5 4708 1 1 53 GLN HA H -3.889 12.653 6.259 1.00 . A A . 53 GLN HA 1 1 5 4709 1 1 53 GLN HB2 H -5.326 12.026 3.680 1.00 . A A . 53 GLN HB2 1 1 5 4710 1 1 53 GLN HB3 H -5.209 13.580 4.493 1.00 . A A . 53 GLN HB3 1 1 5 4711 1 1 53 GLN HE21 H -2.101 14.005 1.578 1.00 . A A . 53 GLN HE21 1 1 5 4712 1 1 53 GLN HE22 H -2.608 15.654 1.640 1.00 . A A . 53 GLN HE22 1 1 5 4713 1 1 53 GLN HG2 H -2.574 12.828 4.048 1.00 . A A . 53 GLN HG2 1 1 5 4714 1 1 53 GLN HG3 H -3.430 12.357 2.581 1.00 . A A . 53 GLN HG3 1 1 5 4715 1 1 53 GLN N N -3.430 10.854 5.355 1.00 . A A . 53 GLN N 1 1 5 4716 1 1 53 GLN NE2 N -2.635 14.729 1.964 1.00 . A A . 53 GLN NE2 1 1 5 4717 1 1 53 GLN O O -6.477 10.813 5.579 1.00 . A A . 53 GLN O 1 1 5 4718 1 1 53 GLN OE1 O -4.150 15.291 3.523 1.00 . A A . 53 GLN OE1 1 1 5 4719 1 1 54 GLU C C -8.263 11.883 7.641 1.00 . A A . 54 GLU C 1 1 5 4720 1 1 54 GLU CA C -6.993 11.307 8.260 1.00 . A A . 54 GLU CA 1 1 5 4721 1 1 54 GLU CB C -6.887 11.735 9.725 1.00 . A A . 54 GLU CB 1 1 5 4722 1 1 54 GLU CD C -7.135 13.692 11.302 1.00 . A A . 54 GLU CD 1 1 5 4723 1 1 54 GLU CG C -6.743 13.237 9.910 1.00 . A A . 54 GLU CG 1 1 5 4724 1 1 54 GLU H H -5.112 12.239 7.990 1.00 . A A . 54 GLU H 1 1 5 4725 1 1 54 GLU HA H -7.042 10.228 8.214 1.00 . A A . 54 GLU HA 1 1 5 4726 1 1 54 GLU HB2 H -7.777 11.413 10.246 1.00 . A A . 54 GLU HB2 1 1 5 4727 1 1 54 GLU HB3 H -6.028 11.255 10.168 1.00 . A A . 54 GLU HB3 1 1 5 4728 1 1 54 GLU HG2 H -5.713 13.511 9.734 1.00 . A A . 54 GLU HG2 1 1 5 4729 1 1 54 GLU HG3 H -7.375 13.738 9.192 1.00 . A A . 54 GLU HG3 1 1 5 4730 1 1 54 GLU N N -5.808 11.731 7.523 1.00 . A A . 54 GLU N 1 1 5 4731 1 1 54 GLU O O -9.358 11.364 7.855 1.00 . A A . 54 GLU O 1 1 5 4732 1 1 54 GLU OE1 O -8.191 13.246 11.798 1.00 . A A . 54 GLU OE1 1 1 5 4733 1 1 54 GLU OE2 O -6.386 14.496 11.896 1.00 . A A . 54 GLU OE2 1 1 5 4734 1 1 55 ASN C C -10.080 12.600 5.433 1.00 . A A . 55 ASN C 1 1 5 4735 1 1 55 ASN CA C -9.250 13.607 6.225 1.00 . A A . 55 ASN CA 1 1 5 4736 1 1 55 ASN CB C -8.767 14.725 5.301 1.00 . A A . 55 ASN CB 1 1 5 4737 1 1 55 ASN CG C -7.999 15.799 6.046 1.00 . A A . 55 ASN CG 1 1 5 4738 1 1 55 ASN H H -7.216 13.330 6.740 1.00 . A A . 55 ASN H 1 1 5 4739 1 1 55 ASN HA H -9.869 14.035 6.999 1.00 . A A . 55 ASN HA 1 1 5 4740 1 1 55 ASN HB2 H -8.122 14.305 4.544 1.00 . A A . 55 ASN HB2 1 1 5 4741 1 1 55 ASN HB3 H -9.622 15.184 4.825 1.00 . A A . 55 ASN HB3 1 1 5 4742 1 1 55 ASN HD21 H -9.560 16.127 7.234 1.00 . A A . 55 ASN HD21 1 1 5 4743 1 1 55 ASN HD22 H -8.165 17.103 7.536 1.00 . A A . 55 ASN HD22 1 1 5 4744 1 1 55 ASN N N -8.112 12.959 6.873 1.00 . A A . 55 ASN N 1 1 5 4745 1 1 55 ASN ND2 N -8.638 16.404 7.039 1.00 . A A . 55 ASN ND2 1 1 5 4746 1 1 55 ASN O O -11.280 12.779 5.255 1.00 . A A . 55 ASN O 1 1 5 4747 1 1 55 ASN OD1 O -6.842 16.082 5.730 1.00 . A A . 55 ASN OD1 1 1 5 4748 1 1 56 ALA C C -10.490 9.324 5.072 1.00 . A A . 56 ALA C 1 1 5 4749 1 1 56 ALA CA C -10.110 10.509 4.191 1.00 . A A . 56 ALA CA 1 1 5 4750 1 1 56 ALA CB C -9.236 10.052 3.033 1.00 . A A . 56 ALA CB 1 1 5 4751 1 1 56 ALA H H -8.470 11.453 5.136 1.00 . A A . 56 ALA H 1 1 5 4752 1 1 56 ALA HA H -11.010 10.942 3.780 1.00 . A A . 56 ALA HA 1 1 5 4753 1 1 56 ALA HB1 H -8.366 10.689 2.967 1.00 . A A . 56 ALA HB1 1 1 5 4754 1 1 56 ALA HB2 H -9.796 10.112 2.111 1.00 . A A . 56 ALA HB2 1 1 5 4755 1 1 56 ALA HB3 H -8.922 9.031 3.198 1.00 . A A . 56 ALA HB3 1 1 5 4756 1 1 56 ALA N N -9.430 11.542 4.962 1.00 . A A . 56 ALA N 1 1 5 4757 1 1 56 ALA O O -11.430 8.593 4.774 1.00 . A A . 56 ALA O 1 1 5 4758 1 1 57 TYR C C -10.810 8.509 8.287 1.00 . A A . 57 TYR C 1 1 5 4759 1 1 57 TYR CA C -10.000 8.036 7.082 1.00 . A A . 57 TYR CA 1 1 5 4760 1 1 57 TYR CB C -8.690 7.416 7.550 1.00 . A A . 57 TYR CB 1 1 5 4761 1 1 57 TYR CD1 C -7.832 6.044 5.612 1.00 . A A . 57 TYR CD1 1 1 5 4762 1 1 57 TYR CD2 C -6.656 8.037 6.188 1.00 . A A . 57 TYR CD2 1 1 5 4763 1 1 57 TYR CE1 C -6.937 5.806 4.587 1.00 . A A . 57 TYR CE1 1 1 5 4764 1 1 57 TYR CE2 C -5.757 7.806 5.164 1.00 . A A . 57 TYR CE2 1 1 5 4765 1 1 57 TYR CG C -7.708 7.161 6.429 1.00 . A A . 57 TYR CG 1 1 5 4766 1 1 57 TYR CZ C -5.901 6.690 4.368 1.00 . A A . 57 TYR CZ 1 1 5 4767 1 1 57 TYR H H -9.006 9.747 6.345 1.00 . A A . 57 TYR H 1 1 5 4768 1 1 57 TYR HA H -10.570 7.286 6.552 1.00 . A A . 57 TYR HA 1 1 5 4769 1 1 57 TYR HB2 H -8.219 8.081 8.258 1.00 . A A . 57 TYR HB2 1 1 5 4770 1 1 57 TYR HB3 H -8.897 6.473 8.033 1.00 . A A . 57 TYR HB3 1 1 5 4771 1 1 57 TYR HD1 H -8.645 5.354 5.787 1.00 . A A . 57 TYR HD1 1 1 5 4772 1 1 57 TYR HD2 H -6.545 8.910 6.813 1.00 . A A . 57 TYR HD2 1 1 5 4773 1 1 57 TYR HE1 H -7.051 4.932 3.964 1.00 . A A . 57 TYR HE1 1 1 5 4774 1 1 57 TYR HE2 H -4.946 8.498 4.991 1.00 . A A . 57 TYR HE2 1 1 5 4775 1 1 57 TYR HH H -5.471 6.082 2.595 1.00 . A A . 57 TYR HH 1 1 5 4776 1 1 57 TYR N N -9.748 9.135 6.159 1.00 . A A . 57 TYR N 1 1 5 4777 1 1 57 TYR O O -10.690 7.961 9.382 1.00 . A A . 57 TYR O 1 1 5 4778 1 1 57 TYR OH O -5.008 6.456 3.348 1.00 . A A . 57 TYR OH 1 1 5 4779 1 1 58 ARG C C -13.950 9.845 8.867 1.00 . A A . 58 ARG C 1 1 5 4780 1 1 58 ARG CA C -12.460 10.072 9.150 1.00 . A A . 58 ARG CA 1 1 5 4781 1 1 58 ARG CB C -12.190 11.566 9.328 1.00 . A A . 58 ARG CB 1 1 5 4782 1 1 58 ARG CD C -12.740 13.820 8.361 1.00 . A A . 58 ARG CD 1 1 5 4783 1 1 58 ARG CG C -12.380 12.376 8.055 1.00 . A A . 58 ARG CG 1 1 5 4784 1 1 58 ARG CZ C -12.280 16.037 7.390 1.00 . A A . 58 ARG CZ 1 1 5 4785 1 1 58 ARG H H -11.690 9.923 7.183 1.00 . A A . 58 ARG H 1 1 5 4786 1 1 58 ARG HA H -12.200 9.559 10.063 1.00 . A A . 58 ARG HA 1 1 5 4787 1 1 58 ARG HB2 H -12.860 11.958 10.078 1.00 . A A . 58 ARG HB2 1 1 5 4788 1 1 58 ARG HB3 H -11.170 11.697 9.664 1.00 . A A . 58 ARG HB3 1 1 5 4789 1 1 58 ARG HD2 H -13.800 13.880 8.538 1.00 . A A . 58 ARG HD2 1 1 5 4790 1 1 58 ARG HD3 H -12.210 14.131 9.249 1.00 . A A . 58 ARG HD3 1 1 5 4791 1 1 58 ARG HE H -12.230 14.316 6.382 1.00 . A A . 58 ARG HE 1 1 5 4792 1 1 58 ARG HG2 H -11.460 12.359 7.491 1.00 . A A . 58 ARG HG2 1 1 5 4793 1 1 58 ARG HG3 H -13.170 11.931 7.469 1.00 . A A . 58 ARG HG3 1 1 5 4794 1 1 58 ARG HH11 H -12.730 16.063 9.363 1.00 . A A . 58 ARG HH11 1 1 5 4795 1 1 58 ARG HH12 H -12.400 17.609 8.656 1.00 . A A . 58 ARG HH12 1 1 5 4796 1 1 58 ARG HH21 H -11.800 16.349 5.452 1.00 . A A . 58 ARG HH21 1 1 5 4797 1 1 58 ARG HH22 H -11.870 17.772 6.438 1.00 . A A . 58 ARG HH22 1 1 5 4798 1 1 58 ARG N N -11.640 9.528 8.078 1.00 . A A . 58 ARG N 1 1 5 4799 1 1 58 ARG NE N -12.390 14.718 7.262 1.00 . A A . 58 ARG NE 1 1 5 4800 1 1 58 ARG NH1 N -12.480 16.617 8.567 1.00 . A A . 58 ARG NH1 1 1 5 4801 1 1 58 ARG NH2 N -11.960 16.781 6.340 1.00 . A A . 58 ARG NH2 1 1 5 4802 1 1 58 ARG O O -14.740 9.627 9.787 1.00 . A A . 58 ARG O 1 1 5 4803 1 1 59 GLN C C -16.030 8.211 7.073 1.00 . A A . 59 GLN C 1 1 5 4804 1 1 59 GLN CA C -15.710 9.696 7.193 1.00 . A A . 59 GLN CA 1 1 5 4805 1 1 59 GLN CB C -15.980 10.398 5.860 1.00 . A A . 59 GLN CB 1 1 5 4806 1 1 59 GLN CD C -16.970 12.612 6.574 1.00 . A A . 59 GLN CD 1 1 5 4807 1 1 59 GLN CG C -15.800 11.905 5.918 1.00 . A A . 59 GLN CG 1 1 5 4808 1 1 59 GLN H H -13.640 10.074 6.905 1.00 . A A . 59 GLN H 1 1 5 4809 1 1 59 GLN HA H -16.340 10.131 7.953 1.00 . A A . 59 GLN HA 1 1 5 4810 1 1 59 GLN HB2 H -15.310 10.004 5.114 1.00 . A A . 59 GLN HB2 1 1 5 4811 1 1 59 GLN HB3 H -17.000 10.191 5.561 1.00 . A A . 59 GLN HB3 1 1 5 4812 1 1 59 GLN HE21 H -16.280 12.134 8.376 1.00 . A A . 59 GLN HE21 1 1 5 4813 1 1 59 GLN HE22 H -17.750 13.043 8.351 1.00 . A A . 59 GLN HE22 1 1 5 4814 1 1 59 GLN HG2 H -14.900 12.126 6.481 1.00 . A A . 59 GLN HG2 1 1 5 4815 1 1 59 GLN HG3 H -15.690 12.281 4.910 1.00 . A A . 59 GLN HG3 1 1 5 4816 1 1 59 GLN N N -14.320 9.896 7.593 1.00 . A A . 59 GLN N 1 1 5 4817 1 1 59 GLN NE2 N -17.000 12.594 7.900 1.00 . A A . 59 GLN NE2 1 1 5 4818 1 1 59 GLN O O -17.020 7.737 7.625 1.00 . A A . 59 GLN O 1 1 5 4819 1 1 59 GLN OE1 O -17.830 13.165 5.895 1.00 . A A . 59 GLN OE1 1 1 5 4820 1 1 60 ALA C C -14.080 5.286 6.339 1.00 . A A . 60 ALA C 1 1 5 4821 1 1 60 ALA CA C -15.380 6.050 6.159 1.00 . A A . 60 ALA CA 1 1 5 4822 1 1 60 ALA CB C -15.970 5.778 4.781 1.00 . A A . 60 ALA CB 1 1 5 4823 1 1 60 ALA H H -14.410 7.918 5.935 1.00 . A A . 60 ALA H 1 1 5 4824 1 1 60 ALA HA H -16.090 5.710 6.900 1.00 . A A . 60 ALA HA 1 1 5 4825 1 1 60 ALA HB1 H -16.440 6.675 4.409 1.00 . A A . 60 ALA HB1 1 1 5 4826 1 1 60 ALA HB2 H -16.700 4.987 4.850 1.00 . A A . 60 ALA HB2 1 1 5 4827 1 1 60 ALA HB3 H -15.180 5.480 4.107 1.00 . A A . 60 ALA HB3 1 1 5 4828 1 1 60 ALA N N -15.190 7.482 6.351 1.00 . A A . 60 ALA N 1 1 5 4829 1 1 60 ALA O O -13.110 5.502 5.604 1.00 . A A . 60 ALA O 1 1 5 4830 1 1 61 ALA C C -13.150 2.106 7.453 1.00 . A A . 61 ALA C 1 1 5 4831 1 1 61 ALA CA C -12.860 3.596 7.599 1.00 . A A . 61 ALA CA 1 1 5 4832 1 1 61 ALA CB C -12.330 3.899 8.995 1.00 . A A . 61 ALA CB 1 1 5 4833 1 1 61 ALA H H -14.850 4.265 7.876 1.00 . A A . 61 ALA H 1 1 5 4834 1 1 61 ALA HA H -12.100 3.875 6.885 1.00 . A A . 61 ALA HA 1 1 5 4835 1 1 61 ALA HB1 H -13.150 4.218 9.626 1.00 . A A . 61 ALA HB1 1 1 5 4836 1 1 61 ALA HB2 H -11.590 4.686 8.938 1.00 . A A . 61 ALA HB2 1 1 5 4837 1 1 61 ALA HB3 H -11.880 3.011 9.410 1.00 . A A . 61 ALA HB3 1 1 5 4838 1 1 61 ALA N N -14.050 4.392 7.323 1.00 . A A . 61 ALA N 1 1 5 4839 1 1 61 ALA O O -12.860 1.551 6.374 1.00 . A A . 61 ALA O 1 1 5 4840 1 1 61 ALA OXT O -13.660 1.507 8.424 1.00 . A A . 61 ALA OXT 1 1 6 4841 1 1 1 MET C C -4.543 5.922 -0.938 1.00 . A A . 1 MET C 1 1 6 4842 1 1 1 MET CA C -3.561 6.728 -0.093 1.00 . A A . 1 MET CA 1 1 6 4843 1 1 1 MET CB C -2.711 5.791 0.768 1.00 . A A . 1 MET CB 1 1 6 4844 1 1 1 MET CE C -0.717 6.987 3.572 1.00 . A A . 1 MET CE 1 1 6 4845 1 1 1 MET CG C -1.281 6.269 0.956 1.00 . A A . 1 MET CG 1 1 6 4846 1 1 1 MET H1 H -5.074 7.169 1.229 1.00 . A A . 1 MET H1 1 1 6 4847 1 1 1 MET H2 H -4.603 8.475 0.218 1.00 . A A . 1 MET H2 1 1 6 4848 1 1 1 MET H3 H -3.601 7.996 1.527 1.00 . A A . 1 MET H3 1 1 6 4849 1 1 1 MET HA H -2.913 7.294 -0.747 1.00 . A A . 1 MET HA 1 1 6 4850 1 1 1 MET HB2 H -3.170 5.704 1.743 1.00 . A A . 1 MET HB2 1 1 6 4851 1 1 1 MET HB3 H -2.685 4.817 0.304 1.00 . A A . 1 MET HB3 1 1 6 4852 1 1 1 MET HE1 H -1.252 6.663 4.453 1.00 . A A . 1 MET HE1 1 1 6 4853 1 1 1 MET HE2 H -1.275 7.772 3.083 1.00 . A A . 1 MET HE2 1 1 6 4854 1 1 1 MET HE3 H 0.254 7.361 3.860 1.00 . A A . 1 MET HE3 1 1 6 4855 1 1 1 MET HG2 H -0.696 5.955 0.105 1.00 . A A . 1 MET HG2 1 1 6 4856 1 1 1 MET HG3 H -1.279 7.346 1.016 1.00 . A A . 1 MET HG3 1 1 6 4857 1 1 1 MET N N -4.274 7.677 0.801 1.00 . A A . 1 MET N 1 1 6 4858 1 1 1 MET O O -5.434 5.258 -0.407 1.00 . A A . 1 MET O 1 1 6 4859 1 1 1 MET SD S -0.518 5.606 2.451 1.00 . A A . 1 MET SD 1 1 6 4860 1 1 2 TYR C C -4.664 3.893 -3.510 1.00 . A A . 2 TYR C 1 1 6 4861 1 1 2 TYR CA C -5.247 5.261 -3.172 1.00 . A A . 2 TYR CA 1 1 6 4862 1 1 2 TYR CB C -5.457 6.070 -4.454 1.00 . A A . 2 TYR CB 1 1 6 4863 1 1 2 TYR CD1 C -6.708 7.903 -3.250 1.00 . A A . 2 TYR CD1 1 1 6 4864 1 1 2 TYR CD2 C -7.512 7.204 -5.383 1.00 . A A . 2 TYR CD2 1 1 6 4865 1 1 2 TYR CE1 C -7.733 8.825 -3.161 1.00 . A A . 2 TYR CE1 1 1 6 4866 1 1 2 TYR CE2 C -8.538 8.125 -5.302 1.00 . A A . 2 TYR CE2 1 1 6 4867 1 1 2 TYR CG C -6.580 7.077 -4.360 1.00 . A A . 2 TYR CG 1 1 6 4868 1 1 2 TYR CZ C -8.646 8.932 -4.189 1.00 . A A . 2 TYR CZ 1 1 6 4869 1 1 2 TYR H H -3.646 6.532 -2.618 1.00 . A A . 2 TYR H 1 1 6 4870 1 1 2 TYR HA H -6.199 5.125 -2.684 1.00 . A A . 2 TYR HA 1 1 6 4871 1 1 2 TYR HB2 H -4.549 6.606 -4.685 1.00 . A A . 2 TYR HB2 1 1 6 4872 1 1 2 TYR HB3 H -5.684 5.392 -5.265 1.00 . A A . 2 TYR HB3 1 1 6 4873 1 1 2 TYR HD1 H -5.991 7.816 -2.446 1.00 . A A . 2 TYR HD1 1 1 6 4874 1 1 2 TYR HD2 H -7.427 6.571 -6.253 1.00 . A A . 2 TYR HD2 1 1 6 4875 1 1 2 TYR HE1 H -7.815 9.458 -2.289 1.00 . A A . 2 TYR HE1 1 1 6 4876 1 1 2 TYR HE2 H -9.254 8.209 -6.107 1.00 . A A . 2 TYR HE2 1 1 6 4877 1 1 2 TYR HH H -10.030 9.836 -3.220 1.00 . A A . 2 TYR HH 1 1 6 4878 1 1 2 TYR N N -4.375 5.985 -2.255 1.00 . A A . 2 TYR N 1 1 6 4879 1 1 2 TYR O O -3.446 3.724 -3.570 1.00 . A A . 2 TYR O 1 1 6 4880 1 1 2 TYR OH O -9.667 9.851 -4.105 1.00 . A A . 2 TYR OH 1 1 6 4881 1 1 3 LYS C C -4.236 1.555 -5.304 1.00 . A A . 3 LYS C 1 1 6 4882 1 1 3 LYS CA C -5.117 1.562 -4.057 1.00 . A A . 3 LYS CA 1 1 6 4883 1 1 3 LYS CB C -6.337 0.665 -4.273 1.00 . A A . 3 LYS CB 1 1 6 4884 1 1 3 LYS CD C -7.194 -1.526 -5.154 1.00 . A A . 3 LYS CD 1 1 6 4885 1 1 3 LYS CE C -6.794 -2.570 -6.184 1.00 . A A . 3 LYS CE 1 1 6 4886 1 1 3 LYS CG C -5.985 -0.771 -4.624 1.00 . A A . 3 LYS CG 1 1 6 4887 1 1 3 LYS H H -6.500 3.116 -3.663 1.00 . A A . 3 LYS H 1 1 6 4888 1 1 3 LYS HA H -4.543 1.183 -3.224 1.00 . A A . 3 LYS HA 1 1 6 4889 1 1 3 LYS HB2 H -6.926 0.656 -3.367 1.00 . A A . 3 LYS HB2 1 1 6 4890 1 1 3 LYS HB3 H -6.932 1.074 -5.076 1.00 . A A . 3 LYS HB3 1 1 6 4891 1 1 3 LYS HD2 H -7.687 -2.019 -4.330 1.00 . A A . 3 LYS HD2 1 1 6 4892 1 1 3 LYS HD3 H -7.873 -0.823 -5.612 1.00 . A A . 3 LYS HD3 1 1 6 4893 1 1 3 LYS HE2 H -5.930 -3.104 -5.819 1.00 . A A . 3 LYS HE2 1 1 6 4894 1 1 3 LYS HE3 H -7.614 -3.260 -6.314 1.00 . A A . 3 LYS HE3 1 1 6 4895 1 1 3 LYS HG2 H -5.216 -0.768 -5.382 1.00 . A A . 3 LYS HG2 1 1 6 4896 1 1 3 LYS HG3 H -5.618 -1.269 -3.739 1.00 . A A . 3 LYS HG3 1 1 6 4897 1 1 3 LYS HZ1 H -5.680 -2.470 -7.947 1.00 . A A . 3 LYS HZ1 1 1 6 4898 1 1 3 LYS HZ2 H -6.183 -0.962 -7.368 1.00 . A A . 3 LYS HZ2 1 1 6 4899 1 1 3 LYS HZ3 H -7.292 -1.988 -8.127 1.00 . A A . 3 LYS HZ3 1 1 6 4900 1 1 3 LYS N N -5.541 2.920 -3.726 1.00 . A A . 3 LYS N 1 1 6 4901 1 1 3 LYS NZ N -6.464 -1.954 -7.499 1.00 . A A . 3 LYS NZ 1 1 6 4902 1 1 3 LYS O O -3.356 0.707 -5.448 1.00 . A A . 3 LYS O 1 1 6 4903 1 1 4 LYS C C -2.290 3.083 -7.157 1.00 . A A . 4 LYS C 1 1 6 4904 1 1 4 LYS CA C -3.710 2.601 -7.438 1.00 . A A . 4 LYS CA 1 1 6 4905 1 1 4 LYS CB C -4.398 3.552 -8.419 1.00 . A A . 4 LYS CB 1 1 6 4906 1 1 4 LYS CD C -4.013 4.665 -10.642 1.00 . A A . 4 LYS CD 1 1 6 4907 1 1 4 LYS CE C -2.621 5.192 -10.950 1.00 . A A . 4 LYS CE 1 1 6 4908 1 1 4 LYS CG C -3.958 3.360 -9.862 1.00 . A A . 4 LYS CG 1 1 6 4909 1 1 4 LYS H H -5.197 3.150 -6.033 1.00 . A A . 4 LYS H 1 1 6 4910 1 1 4 LYS HA H -3.661 1.616 -7.878 1.00 . A A . 4 LYS HA 1 1 6 4911 1 1 4 LYS HB2 H -5.464 3.394 -8.368 1.00 . A A . 4 LYS HB2 1 1 6 4912 1 1 4 LYS HB3 H -4.179 4.570 -8.130 1.00 . A A . 4 LYS HB3 1 1 6 4913 1 1 4 LYS HD2 H -4.535 4.495 -11.572 1.00 . A A . 4 LYS HD2 1 1 6 4914 1 1 4 LYS HD3 H -4.546 5.401 -10.057 1.00 . A A . 4 LYS HD3 1 1 6 4915 1 1 4 LYS HE2 H -2.641 6.271 -10.911 1.00 . A A . 4 LYS HE2 1 1 6 4916 1 1 4 LYS HE3 H -1.935 4.819 -10.203 1.00 . A A . 4 LYS HE3 1 1 6 4917 1 1 4 LYS HG2 H -2.944 2.989 -9.871 1.00 . A A . 4 LYS HG2 1 1 6 4918 1 1 4 LYS HG3 H -4.611 2.641 -10.334 1.00 . A A . 4 LYS HG3 1 1 6 4919 1 1 4 LYS HZ1 H -2.636 3.893 -12.586 1.00 . A A . 4 LYS HZ1 1 1 6 4920 1 1 4 LYS HZ2 H -1.126 4.590 -12.278 1.00 . A A . 4 LYS HZ2 1 1 6 4921 1 1 4 LYS HZ3 H -2.349 5.509 -12.997 1.00 . A A . 4 LYS HZ3 1 1 6 4922 1 1 4 LYS N N -4.481 2.502 -6.204 1.00 . A A . 4 LYS N 1 1 6 4923 1 1 4 LYS NZ N -2.150 4.766 -12.297 1.00 . A A . 4 LYS NZ 1 1 6 4924 1 1 4 LYS O O -1.327 2.577 -7.732 1.00 . A A . 4 LYS O 1 1 6 4925 1 1 5 ASP C C 0.030 3.554 -5.287 1.00 . A A . 5 ASP C 1 1 6 4926 1 1 5 ASP CA C -0.866 4.618 -5.915 1.00 . A A . 5 ASP CA 1 1 6 4927 1 1 5 ASP CB C -1.034 5.793 -4.949 1.00 . A A . 5 ASP CB 1 1 6 4928 1 1 5 ASP CG C -1.573 7.033 -5.635 1.00 . A A . 5 ASP CG 1 1 6 4929 1 1 5 ASP H H -2.973 4.429 -5.846 1.00 . A A . 5 ASP H 1 1 6 4930 1 1 5 ASP HA H -0.399 4.975 -6.821 1.00 . A A . 5 ASP HA 1 1 6 4931 1 1 5 ASP HB2 H -1.720 5.511 -4.166 1.00 . A A . 5 ASP HB2 1 1 6 4932 1 1 5 ASP HB3 H -0.076 6.032 -4.513 1.00 . A A . 5 ASP HB3 1 1 6 4933 1 1 5 ASP N N -2.168 4.066 -6.270 1.00 . A A . 5 ASP N 1 1 6 4934 1 1 5 ASP O O 1.164 3.351 -5.719 1.00 . A A . 5 ASP O 1 1 6 4935 1 1 5 ASP OD1 O -2.285 6.887 -6.652 1.00 . A A . 5 ASP OD1 1 1 6 4936 1 1 5 ASP OD2 O -1.284 8.148 -5.157 1.00 . A A . 5 ASP OD2 1 1 6 4937 1 1 6 VAL C C 0.752 0.774 -4.543 1.00 . A A . 6 VAL C 1 1 6 4938 1 1 6 VAL CA C 0.258 1.843 -3.573 1.00 . A A . 6 VAL CA 1 1 6 4939 1 1 6 VAL CB C -0.604 1.176 -2.486 1.00 . A A . 6 VAL CB 1 1 6 4940 1 1 6 VAL CG1 C 0.278 0.432 -1.511 1.00 . A A . 6 VAL CG1 1 1 6 4941 1 1 6 VAL CG2 C -1.458 2.203 -1.756 1.00 . A A . 6 VAL CG2 1 1 6 4942 1 1 6 VAL H H -1.391 3.085 -3.961 1.00 . A A . 6 VAL H 1 1 6 4943 1 1 6 VAL HA H 1.109 2.305 -3.095 1.00 . A A . 6 VAL HA 1 1 6 4944 1 1 6 VAL HB H -1.261 0.462 -2.963 1.00 . A A . 6 VAL HB 1 1 6 4945 1 1 6 VAL HG11 H -0.308 0.131 -0.657 1.00 . A A . 6 VAL HG11 1 1 6 4946 1 1 6 VAL HG12 H 1.076 1.084 -1.191 1.00 . A A . 6 VAL HG12 1 1 6 4947 1 1 6 VAL HG13 H 0.691 -0.438 -1.994 1.00 . A A . 6 VAL HG13 1 1 6 4948 1 1 6 VAL HG21 H -0.987 3.172 -1.816 1.00 . A A . 6 VAL HG21 1 1 6 4949 1 1 6 VAL HG22 H -1.559 1.915 -0.719 1.00 . A A . 6 VAL HG22 1 1 6 4950 1 1 6 VAL HG23 H -2.436 2.249 -2.213 1.00 . A A . 6 VAL HG23 1 1 6 4951 1 1 6 VAL N N -0.486 2.880 -4.264 1.00 . A A . 6 VAL N 1 1 6 4952 1 1 6 VAL O O 1.919 0.381 -4.507 1.00 . A A . 6 VAL O 1 1 6 4953 1 1 7 ILE C C 1.242 -0.206 -7.378 1.00 . A A . 7 ILE C 1 1 6 4954 1 1 7 ILE CA C 0.200 -0.719 -6.385 1.00 . A A . 7 ILE CA 1 1 6 4955 1 1 7 ILE CB C -1.048 -1.196 -7.159 1.00 . A A . 7 ILE CB 1 1 6 4956 1 1 7 ILE CD1 C -3.374 -2.180 -6.841 1.00 . A A . 7 ILE CD1 1 1 6 4957 1 1 7 ILE CG1 C -2.040 -1.863 -6.202 1.00 . A A . 7 ILE CG1 1 1 6 4958 1 1 7 ILE CG2 C -0.659 -2.155 -8.274 1.00 . A A . 7 ILE CG2 1 1 6 4959 1 1 7 ILE H H -1.057 0.658 -5.386 1.00 . A A . 7 ILE H 1 1 6 4960 1 1 7 ILE HA H 0.613 -1.564 -5.852 1.00 . A A . 7 ILE HA 1 1 6 4961 1 1 7 ILE HB H -1.518 -0.334 -7.607 1.00 . A A . 7 ILE HB 1 1 6 4962 1 1 7 ILE HD11 H -3.652 -1.379 -7.511 1.00 . A A . 7 ILE HD11 1 1 6 4963 1 1 7 ILE HD12 H -4.125 -2.284 -6.072 1.00 . A A . 7 ILE HD12 1 1 6 4964 1 1 7 ILE HD13 H -3.299 -3.104 -7.396 1.00 . A A . 7 ILE HD13 1 1 6 4965 1 1 7 ILE HG12 H -1.616 -2.791 -5.846 1.00 . A A . 7 ILE HG12 1 1 6 4966 1 1 7 ILE HG13 H -2.219 -1.207 -5.364 1.00 . A A . 7 ILE HG13 1 1 6 4967 1 1 7 ILE HG21 H -0.029 -1.640 -8.986 1.00 . A A . 7 ILE HG21 1 1 6 4968 1 1 7 ILE HG22 H -1.548 -2.509 -8.773 1.00 . A A . 7 ILE HG22 1 1 6 4969 1 1 7 ILE HG23 H -0.121 -2.994 -7.858 1.00 . A A . 7 ILE HG23 1 1 6 4970 1 1 7 ILE N N -0.143 0.306 -5.408 1.00 . A A . 7 ILE N 1 1 6 4971 1 1 7 ILE O O 2.081 -0.967 -7.860 1.00 . A A . 7 ILE O 1 1 6 4972 1 1 8 ASP C C 3.468 1.932 -7.927 1.00 . A A . 8 ASP C 1 1 6 4973 1 1 8 ASP CA C 2.124 1.698 -8.605 1.00 . A A . 8 ASP CA 1 1 6 4974 1 1 8 ASP CB C 1.564 3.020 -9.137 1.00 . A A . 8 ASP CB 1 1 6 4975 1 1 8 ASP CG C 1.440 3.028 -10.648 1.00 . A A . 8 ASP CG 1 1 6 4976 1 1 8 ASP H H 0.498 1.643 -7.257 1.00 . A A . 8 ASP H 1 1 6 4977 1 1 8 ASP HA H 2.265 1.016 -9.431 1.00 . A A . 8 ASP HA 1 1 6 4978 1 1 8 ASP HB2 H 0.586 3.186 -8.714 1.00 . A A . 8 ASP HB2 1 1 6 4979 1 1 8 ASP HB3 H 2.219 3.827 -8.843 1.00 . A A . 8 ASP HB3 1 1 6 4980 1 1 8 ASP N N 1.184 1.087 -7.676 1.00 . A A . 8 ASP N 1 1 6 4981 1 1 8 ASP O O 4.512 1.945 -8.579 1.00 . A A . 8 ASP O 1 1 6 4982 1 1 8 ASP OD1 O 1.165 1.958 -11.226 1.00 . A A . 8 ASP OD1 1 1 6 4983 1 1 8 ASP OD2 O 1.618 4.107 -11.252 1.00 . A A . 8 ASP OD2 1 1 6 4984 1 1 9 HIS C C 5.307 1.019 -5.467 1.00 . A A . 9 HIS C 1 1 6 4985 1 1 9 HIS CA C 4.644 2.342 -5.841 1.00 . A A . 9 HIS CA 1 1 6 4986 1 1 9 HIS CB C 4.325 3.148 -4.578 1.00 . A A . 9 HIS CB 1 1 6 4987 1 1 9 HIS CD2 C 6.246 2.447 -2.980 1.00 . A A . 9 HIS CD2 1 1 6 4988 1 1 9 HIS CE1 C 7.068 4.440 -2.573 1.00 . A A . 9 HIS CE1 1 1 6 4989 1 1 9 HIS CG C 5.504 3.343 -3.674 1.00 . A A . 9 HIS CG 1 1 6 4990 1 1 9 HIS H H 2.569 2.090 -6.147 1.00 . A A . 9 HIS H 1 1 6 4991 1 1 9 HIS HA H 5.321 2.910 -6.458 1.00 . A A . 9 HIS HA 1 1 6 4992 1 1 9 HIS HB2 H 3.962 4.123 -4.864 1.00 . A A . 9 HIS HB2 1 1 6 4993 1 1 9 HIS HB3 H 3.557 2.634 -4.017 1.00 . A A . 9 HIS HB3 1 1 6 4994 1 1 9 HIS HD1 H 5.725 5.438 -3.751 1.00 . A A . 9 HIS HD1 1 1 6 4995 1 1 9 HIS HD2 H 6.107 1.376 -2.962 1.00 . A A . 9 HIS HD2 1 1 6 4996 1 1 9 HIS HE1 H 7.681 5.237 -2.182 1.00 . A A . 9 HIS HE1 1 1 6 4997 1 1 9 HIS HE2 H 7.946 2.763 -1.789 1.00 . A A . 9 HIS HE2 1 1 6 4998 1 1 9 HIS N N 3.432 2.113 -6.611 1.00 . A A . 9 HIS N 1 1 6 4999 1 1 9 HIS ND1 N 6.044 4.581 -3.396 1.00 . A A . 9 HIS ND1 1 1 6 5000 1 1 9 HIS NE2 N 7.210 3.154 -2.304 1.00 . A A . 9 HIS NE2 1 1 6 5001 1 1 9 HIS O O 6.521 0.957 -5.264 1.00 . A A . 9 HIS O 1 1 6 5002 1 1 10 PHE C C 5.365 -2.156 -6.278 1.00 . A A . 10 PHE C 1 1 6 5003 1 1 10 PHE CA C 5.013 -1.356 -5.027 1.00 . A A . 10 PHE CA 1 1 6 5004 1 1 10 PHE CB C 3.979 -2.119 -4.196 1.00 . A A . 10 PHE CB 1 1 6 5005 1 1 10 PHE CD1 C 3.852 -0.331 -2.442 1.00 . A A . 10 PHE CD1 1 1 6 5006 1 1 10 PHE CD2 C 3.917 -2.608 -1.737 1.00 . A A . 10 PHE CD2 1 1 6 5007 1 1 10 PHE CE1 C 3.790 0.080 -1.125 1.00 . A A . 10 PHE CE1 1 1 6 5008 1 1 10 PHE CE2 C 3.856 -2.204 -0.416 1.00 . A A . 10 PHE CE2 1 1 6 5009 1 1 10 PHE CG C 3.915 -1.677 -2.763 1.00 . A A . 10 PHE CG 1 1 6 5010 1 1 10 PHE CZ C 3.793 -0.858 -0.110 1.00 . A A . 10 PHE CZ 1 1 6 5011 1 1 10 PHE H H 3.546 0.076 -5.549 1.00 . A A . 10 PHE H 1 1 6 5012 1 1 10 PHE HA H 5.906 -1.221 -4.436 1.00 . A A . 10 PHE HA 1 1 6 5013 1 1 10 PHE HB2 H 3.001 -1.975 -4.631 1.00 . A A . 10 PHE HB2 1 1 6 5014 1 1 10 PHE HB3 H 4.223 -3.171 -4.210 1.00 . A A . 10 PHE HB3 1 1 6 5015 1 1 10 PHE HD1 H 3.850 0.402 -3.234 1.00 . A A . 10 PHE HD1 1 1 6 5016 1 1 10 PHE HD2 H 3.966 -3.659 -1.975 1.00 . A A . 10 PHE HD2 1 1 6 5017 1 1 10 PHE HE1 H 3.741 1.132 -0.888 1.00 . A A . 10 PHE HE1 1 1 6 5018 1 1 10 PHE HE2 H 3.858 -2.938 0.374 1.00 . A A . 10 PHE HE2 1 1 6 5019 1 1 10 PHE HZ H 3.745 -0.540 0.920 1.00 . A A . 10 PHE HZ 1 1 6 5020 1 1 10 PHE N N 4.505 -0.036 -5.378 1.00 . A A . 10 PHE N 1 1 6 5021 1 1 10 PHE O O 6.455 -2.717 -6.381 1.00 . A A . 10 PHE O 1 1 6 5022 1 1 11 GLY C C 3.673 -4.079 -8.635 1.00 . A A . 11 GLY C 1 1 6 5023 1 1 11 GLY CA C 4.657 -2.939 -8.453 1.00 . A A . 11 GLY CA 1 1 6 5024 1 1 11 GLY H H 3.580 -1.739 -7.082 1.00 . A A . 11 GLY H 1 1 6 5025 1 1 11 GLY HA2 H 4.565 -2.260 -9.287 1.00 . A A . 11 GLY HA2 1 1 6 5026 1 1 11 GLY HA3 H 5.660 -3.343 -8.440 1.00 . A A . 11 GLY HA3 1 1 6 5027 1 1 11 GLY N N 4.431 -2.204 -7.223 1.00 . A A . 11 GLY N 1 1 6 5028 1 1 11 GLY O O 3.367 -4.471 -9.761 1.00 . A A . 11 GLY O 1 1 6 5029 1 1 12 THR C C 1.446 -5.804 -6.250 1.00 . A A . 12 THR C 1 1 6 5030 1 1 12 THR CA C 2.220 -5.712 -7.561 1.00 . A A . 12 THR CA 1 1 6 5031 1 1 12 THR CB C 2.941 -7.033 -7.837 1.00 . A A . 12 THR CB 1 1 6 5032 1 1 12 THR CG2 C 3.077 -7.345 -9.311 1.00 . A A . 12 THR CG2 1 1 6 5033 1 1 12 THR H H 3.459 -4.255 -6.654 1.00 . A A . 12 THR H 1 1 6 5034 1 1 12 THR HA H 1.524 -5.519 -8.364 1.00 . A A . 12 THR HA 1 1 6 5035 1 1 12 THR HB H 2.385 -7.837 -7.378 1.00 . A A . 12 THR HB 1 1 6 5036 1 1 12 THR HG1 H 4.783 -6.372 -7.743 1.00 . A A . 12 THR HG1 1 1 6 5037 1 1 12 THR HG21 H 2.120 -7.216 -9.795 1.00 . A A . 12 THR HG21 1 1 6 5038 1 1 12 THR HG22 H 3.409 -8.365 -9.434 1.00 . A A . 12 THR HG22 1 1 6 5039 1 1 12 THR HG23 H 3.798 -6.675 -9.756 1.00 . A A . 12 THR HG23 1 1 6 5040 1 1 12 THR N N 3.177 -4.612 -7.522 1.00 . A A . 12 THR N 1 1 6 5041 1 1 12 THR O O 1.892 -5.300 -5.219 1.00 . A A . 12 THR O 1 1 6 5042 1 1 12 THR OG1 O 4.244 -7.017 -7.280 1.00 . A A . 12 THR OG1 1 1 6 5043 1 1 13 GLN C C 0.130 -7.505 -4.080 1.00 . A A . 13 GLN C 1 1 6 5044 1 1 13 GLN CA C -0.549 -6.608 -5.110 1.00 . A A . 13 GLN CA 1 1 6 5045 1 1 13 GLN CB C -1.912 -7.189 -5.491 1.00 . A A . 13 GLN CB 1 1 6 5046 1 1 13 GLN CD C -3.184 -9.122 -6.501 1.00 . A A . 13 GLN CD 1 1 6 5047 1 1 13 GLN CG C -1.824 -8.495 -6.264 1.00 . A A . 13 GLN CG 1 1 6 5048 1 1 13 GLN H H -0.016 -6.832 -7.147 1.00 . A A . 13 GLN H 1 1 6 5049 1 1 13 GLN HA H -0.693 -5.630 -4.677 1.00 . A A . 13 GLN HA 1 1 6 5050 1 1 13 GLN HB2 H -2.478 -7.368 -4.590 1.00 . A A . 13 GLN HB2 1 1 6 5051 1 1 13 GLN HB3 H -2.439 -6.470 -6.101 1.00 . A A . 13 GLN HB3 1 1 6 5052 1 1 13 GLN HE21 H -3.909 -7.379 -7.121 1.00 . A A . 13 GLN HE21 1 1 6 5053 1 1 13 GLN HE22 H -5.023 -8.698 -7.126 1.00 . A A . 13 GLN HE22 1 1 6 5054 1 1 13 GLN HG2 H -1.361 -8.304 -7.221 1.00 . A A . 13 GLN HG2 1 1 6 5055 1 1 13 GLN HG3 H -1.217 -9.190 -5.704 1.00 . A A . 13 GLN HG3 1 1 6 5056 1 1 13 GLN N N 0.286 -6.452 -6.296 1.00 . A A . 13 GLN N 1 1 6 5057 1 1 13 GLN NE2 N -4.135 -8.319 -6.963 1.00 . A A . 13 GLN NE2 1 1 6 5058 1 1 13 GLN O O 0.108 -7.219 -2.883 1.00 . A A . 13 GLN O 1 1 6 5059 1 1 13 GLN OE1 O -3.377 -10.317 -6.273 1.00 . A A . 13 GLN OE1 1 1 6 5060 1 1 14 ARG C C 2.527 -8.832 -2.885 1.00 . A A . 14 ARG C 1 1 6 5061 1 1 14 ARG CA C 1.422 -9.529 -3.673 1.00 . A A . 14 ARG CA 1 1 6 5062 1 1 14 ARG CB C 2.011 -10.683 -4.486 1.00 . A A . 14 ARG CB 1 1 6 5063 1 1 14 ARG CD C 2.540 -13.135 -4.623 1.00 . A A . 14 ARG CD 1 1 6 5064 1 1 14 ARG CG C 1.935 -12.026 -3.778 1.00 . A A . 14 ARG CG 1 1 6 5065 1 1 14 ARG CZ C 2.163 -14.206 -6.810 1.00 . A A . 14 ARG CZ 1 1 6 5066 1 1 14 ARG H H 0.719 -8.763 -5.517 1.00 . A A . 14 ARG H 1 1 6 5067 1 1 14 ARG HA H 0.695 -9.923 -2.979 1.00 . A A . 14 ARG HA 1 1 6 5068 1 1 14 ARG HB2 H 1.472 -10.762 -5.420 1.00 . A A . 14 ARG HB2 1 1 6 5069 1 1 14 ARG HB3 H 3.049 -10.469 -4.696 1.00 . A A . 14 ARG HB3 1 1 6 5070 1 1 14 ARG HD2 H 3.586 -12.918 -4.785 1.00 . A A . 14 ARG HD2 1 1 6 5071 1 1 14 ARG HD3 H 2.446 -14.070 -4.089 1.00 . A A . 14 ARG HD3 1 1 6 5072 1 1 14 ARG HE H 1.180 -12.605 -6.135 1.00 . A A . 14 ARG HE 1 1 6 5073 1 1 14 ARG HG2 H 2.477 -11.962 -2.846 1.00 . A A . 14 ARG HG2 1 1 6 5074 1 1 14 ARG HG3 H 0.899 -12.261 -3.580 1.00 . A A . 14 ARG HG3 1 1 6 5075 1 1 14 ARG HH11 H 3.595 -15.085 -5.685 1.00 . A A . 14 ARG HH11 1 1 6 5076 1 1 14 ARG HH12 H 3.309 -15.818 -7.227 1.00 . A A . 14 ARG HH12 1 1 6 5077 1 1 14 ARG HH21 H 0.803 -13.570 -8.164 1.00 . A A . 14 ARG HH21 1 1 6 5078 1 1 14 ARG HH22 H 1.725 -14.958 -8.635 1.00 . A A . 14 ARG HH22 1 1 6 5079 1 1 14 ARG N N 0.735 -8.589 -4.554 1.00 . A A . 14 ARG N 1 1 6 5080 1 1 14 ARG NE N 1.875 -13.261 -5.919 1.00 . A A . 14 ARG NE 1 1 6 5081 1 1 14 ARG NH1 N 3.099 -15.110 -6.553 1.00 . A A . 14 ARG NH1 1 1 6 5082 1 1 14 ARG NH2 N 1.510 -14.247 -7.964 1.00 . A A . 14 ARG NH2 1 1 6 5083 1 1 14 ARG O O 2.851 -9.231 -1.767 1.00 . A A . 14 ARG O 1 1 6 5084 1 1 15 ALA C C 3.651 -6.279 -1.612 1.00 . A A . 15 ALA C 1 1 6 5085 1 1 15 ALA CA C 4.169 -7.036 -2.830 1.00 . A A . 15 ALA CA 1 1 6 5086 1 1 15 ALA CB C 4.808 -6.073 -3.818 1.00 . A A . 15 ALA CB 1 1 6 5087 1 1 15 ALA H H 2.798 -7.518 -4.368 1.00 . A A . 15 ALA H 1 1 6 5088 1 1 15 ALA HA H 4.923 -7.738 -2.509 1.00 . A A . 15 ALA HA 1 1 6 5089 1 1 15 ALA HB1 H 4.617 -6.413 -4.826 1.00 . A A . 15 ALA HB1 1 1 6 5090 1 1 15 ALA HB2 H 5.873 -6.034 -3.647 1.00 . A A . 15 ALA HB2 1 1 6 5091 1 1 15 ALA HB3 H 4.386 -5.087 -3.686 1.00 . A A . 15 ALA HB3 1 1 6 5092 1 1 15 ALA N N 3.100 -7.789 -3.475 1.00 . A A . 15 ALA N 1 1 6 5093 1 1 15 ALA O O 4.337 -6.178 -0.594 1.00 . A A . 15 ALA O 1 1 6 5094 1 1 16 VAL C C 1.338 -5.943 0.469 1.00 . A A . 16 VAL C 1 1 6 5095 1 1 16 VAL CA C 1.829 -5.001 -0.626 1.00 . A A . 16 VAL CA 1 1 6 5096 1 1 16 VAL CB C 0.645 -4.117 -1.096 1.00 . A A . 16 VAL CB 1 1 6 5097 1 1 16 VAL CG1 C 0.788 -2.713 -0.541 1.00 . A A . 16 VAL CG1 1 1 6 5098 1 1 16 VAL CG2 C 0.543 -4.073 -2.616 1.00 . A A . 16 VAL CG2 1 1 6 5099 1 1 16 VAL H H 1.940 -5.864 -2.554 1.00 . A A . 16 VAL H 1 1 6 5100 1 1 16 VAL HA H 2.589 -4.355 -0.209 1.00 . A A . 16 VAL HA 1 1 6 5101 1 1 16 VAL HB H -0.270 -4.540 -0.710 1.00 . A A . 16 VAL HB 1 1 6 5102 1 1 16 VAL HG11 H 1.168 -2.762 0.468 1.00 . A A . 16 VAL HG11 1 1 6 5103 1 1 16 VAL HG12 H -0.177 -2.227 -0.540 1.00 . A A . 16 VAL HG12 1 1 6 5104 1 1 16 VAL HG13 H 1.473 -2.153 -1.158 1.00 . A A . 16 VAL HG13 1 1 6 5105 1 1 16 VAL HG21 H 0.089 -4.986 -2.973 1.00 . A A . 16 VAL HG21 1 1 6 5106 1 1 16 VAL HG22 H 1.532 -3.974 -3.040 1.00 . A A . 16 VAL HG22 1 1 6 5107 1 1 16 VAL HG23 H -0.062 -3.230 -2.912 1.00 . A A . 16 VAL HG23 1 1 6 5108 1 1 16 VAL N N 2.437 -5.749 -1.721 1.00 . A A . 16 VAL N 1 1 6 5109 1 1 16 VAL O O 1.381 -5.611 1.654 1.00 . A A . 16 VAL O 1 1 6 5110 1 1 17 ALA C C 1.479 -8.572 1.957 1.00 . A A . 17 ALA C 1 1 6 5111 1 1 17 ALA CA C 0.375 -8.111 1.011 1.00 . A A . 17 ALA CA 1 1 6 5112 1 1 17 ALA CB C -0.218 -9.299 0.266 1.00 . A A . 17 ALA CB 1 1 6 5113 1 1 17 ALA H H 0.864 -7.328 -0.893 1.00 . A A . 17 ALA H 1 1 6 5114 1 1 17 ALA HA H -0.413 -7.652 1.591 1.00 . A A . 17 ALA HA 1 1 6 5115 1 1 17 ALA HB1 H 0.101 -9.272 -0.766 1.00 . A A . 17 ALA HB1 1 1 6 5116 1 1 17 ALA HB2 H -1.295 -9.251 0.311 1.00 . A A . 17 ALA HB2 1 1 6 5117 1 1 17 ALA HB3 H 0.121 -10.218 0.722 1.00 . A A . 17 ALA HB3 1 1 6 5118 1 1 17 ALA N N 0.873 -7.122 0.065 1.00 . A A . 17 ALA N 1 1 6 5119 1 1 17 ALA O O 1.214 -8.960 3.095 1.00 . A A . 17 ALA O 1 1 6 5120 1 1 18 LYS C C 4.384 -7.788 3.129 1.00 . A A . 18 LYS C 1 1 6 5121 1 1 18 LYS CA C 3.863 -8.945 2.283 1.00 . A A . 18 LYS CA 1 1 6 5122 1 1 18 LYS CB C 4.979 -9.480 1.381 1.00 . A A . 18 LYS CB 1 1 6 5123 1 1 18 LYS CD C 6.643 -11.304 0.917 1.00 . A A . 18 LYS CD 1 1 6 5124 1 1 18 LYS CE C 6.014 -11.631 -0.427 1.00 . A A . 18 LYS CE 1 1 6 5125 1 1 18 LYS CG C 5.618 -10.759 1.897 1.00 . A A . 18 LYS CG 1 1 6 5126 1 1 18 LYS H H 2.868 -8.215 0.564 1.00 . A A . 18 LYS H 1 1 6 5127 1 1 18 LYS HA H 3.536 -9.737 2.940 1.00 . A A . 18 LYS HA 1 1 6 5128 1 1 18 LYS HB2 H 4.571 -9.675 0.401 1.00 . A A . 18 LYS HB2 1 1 6 5129 1 1 18 LYS HB3 H 5.750 -8.726 1.296 1.00 . A A . 18 LYS HB3 1 1 6 5130 1 1 18 LYS HD2 H 7.415 -10.563 0.770 1.00 . A A . 18 LYS HD2 1 1 6 5131 1 1 18 LYS HD3 H 7.079 -12.203 1.329 1.00 . A A . 18 LYS HD3 1 1 6 5132 1 1 18 LYS HE2 H 6.371 -12.597 -0.752 1.00 . A A . 18 LYS HE2 1 1 6 5133 1 1 18 LYS HE3 H 4.941 -11.667 -0.309 1.00 . A A . 18 LYS HE3 1 1 6 5134 1 1 18 LYS HG2 H 6.107 -10.552 2.838 1.00 . A A . 18 LYS HG2 1 1 6 5135 1 1 18 LYS HG3 H 4.845 -11.500 2.046 1.00 . A A . 18 LYS HG3 1 1 6 5136 1 1 18 LYS HZ1 H 5.674 -10.666 -2.249 1.00 . A A . 18 LYS HZ1 1 1 6 5137 1 1 18 LYS HZ2 H 7.310 -10.792 -1.834 1.00 . A A . 18 LYS HZ2 1 1 6 5138 1 1 18 LYS HZ3 H 6.324 -9.663 -1.051 1.00 . A A . 18 LYS HZ3 1 1 6 5139 1 1 18 LYS N N 2.718 -8.531 1.479 1.00 . A A . 18 LYS N 1 1 6 5140 1 1 18 LYS NZ N 6.354 -10.617 -1.463 1.00 . A A . 18 LYS NZ 1 1 6 5141 1 1 18 LYS O O 4.910 -7.993 4.223 1.00 . A A . 18 LYS O 1 1 6 5142 1 1 19 ALA C C 3.875 -5.150 4.593 1.00 . A A . 19 ALA C 1 1 6 5143 1 1 19 ALA CA C 4.690 -5.381 3.326 1.00 . A A . 19 ALA CA 1 1 6 5144 1 1 19 ALA CB C 4.613 -4.163 2.416 1.00 . A A . 19 ALA CB 1 1 6 5145 1 1 19 ALA H H 3.808 -6.471 1.740 1.00 . A A . 19 ALA H 1 1 6 5146 1 1 19 ALA HA H 5.724 -5.532 3.598 1.00 . A A . 19 ALA HA 1 1 6 5147 1 1 19 ALA HB1 H 5.460 -3.521 2.604 1.00 . A A . 19 ALA HB1 1 1 6 5148 1 1 19 ALA HB2 H 3.698 -3.623 2.615 1.00 . A A . 19 ALA HB2 1 1 6 5149 1 1 19 ALA HB3 H 4.624 -4.483 1.385 1.00 . A A . 19 ALA HB3 1 1 6 5150 1 1 19 ALA N N 4.234 -6.571 2.616 1.00 . A A . 19 ALA N 1 1 6 5151 1 1 19 ALA O O 4.429 -5.013 5.683 1.00 . A A . 19 ALA O 1 1 6 5152 1 1 20 LEU C C 1.457 -6.182 6.361 1.00 . A A . 20 LEU C 1 1 6 5153 1 1 20 LEU CA C 1.664 -4.890 5.577 1.00 . A A . 20 LEU CA 1 1 6 5154 1 1 20 LEU CB C 0.316 -4.349 5.096 1.00 . A A . 20 LEU CB 1 1 6 5155 1 1 20 LEU CD1 C -0.843 -3.034 3.304 1.00 . A A . 20 LEU CD1 1 1 6 5156 1 1 20 LEU CD2 C 0.570 -1.858 5.000 1.00 . A A . 20 LEU CD2 1 1 6 5157 1 1 20 LEU CG C 0.397 -3.127 4.180 1.00 . A A . 20 LEU CG 1 1 6 5158 1 1 20 LEU H H 2.172 -5.221 3.548 1.00 . A A . 20 LEU H 1 1 6 5159 1 1 20 LEU HA H 2.124 -4.160 6.226 1.00 . A A . 20 LEU HA 1 1 6 5160 1 1 20 LEU HB2 H -0.197 -5.140 4.566 1.00 . A A . 20 LEU HB2 1 1 6 5161 1 1 20 LEU HB3 H -0.270 -4.082 5.963 1.00 . A A . 20 LEU HB3 1 1 6 5162 1 1 20 LEU HD11 H -1.036 -1.999 3.062 1.00 . A A . 20 LEU HD11 1 1 6 5163 1 1 20 LEU HD12 H -1.690 -3.444 3.834 1.00 . A A . 20 LEU HD12 1 1 6 5164 1 1 20 LEU HD13 H -0.683 -3.592 2.394 1.00 . A A . 20 LEU HD13 1 1 6 5165 1 1 20 LEU HD21 H -0.369 -1.601 5.466 1.00 . A A . 20 LEU HD21 1 1 6 5166 1 1 20 LEU HD22 H 0.885 -1.053 4.354 1.00 . A A . 20 LEU HD22 1 1 6 5167 1 1 20 LEU HD23 H 1.318 -2.020 5.762 1.00 . A A . 20 LEU HD23 1 1 6 5168 1 1 20 LEU HG H 1.256 -3.228 3.532 1.00 . A A . 20 LEU HG 1 1 6 5169 1 1 20 LEU N N 2.555 -5.106 4.442 1.00 . A A . 20 LEU N 1 1 6 5170 1 1 20 LEU O O 1.282 -6.158 7.579 1.00 . A A . 20 LEU O 1 1 6 5171 1 1 21 GLY C C -0.080 -9.183 6.036 1.00 . A A . 21 GLY C 1 1 6 5172 1 1 21 GLY CA C 1.292 -8.593 6.303 1.00 . A A . 21 GLY CA 1 1 6 5173 1 1 21 GLY H H 1.623 -7.265 4.687 1.00 . A A . 21 GLY H 1 1 6 5174 1 1 21 GLY HA2 H 2.043 -9.278 5.940 1.00 . A A . 21 GLY HA2 1 1 6 5175 1 1 21 GLY HA3 H 1.416 -8.467 7.368 1.00 . A A . 21 GLY HA3 1 1 6 5176 1 1 21 GLY N N 1.479 -7.308 5.656 1.00 . A A . 21 GLY N 1 1 6 5177 1 1 21 GLY O O -0.597 -9.956 6.844 1.00 . A A . 21 GLY O 1 1 6 5178 1 1 22 ILE C C -1.913 -10.199 3.290 1.00 . A A . 22 ILE C 1 1 6 5179 1 1 22 ILE CA C -1.988 -9.318 4.533 1.00 . A A . 22 ILE CA 1 1 6 5180 1 1 22 ILE CB C -2.975 -8.163 4.270 1.00 . A A . 22 ILE CB 1 1 6 5181 1 1 22 ILE CD1 C -3.378 -6.116 2.813 1.00 . A A . 22 ILE CD1 1 1 6 5182 1 1 22 ILE CG1 C -2.440 -7.249 3.166 1.00 . A A . 22 ILE CG1 1 1 6 5183 1 1 22 ILE CG2 C -3.218 -7.373 5.548 1.00 . A A . 22 ILE CG2 1 1 6 5184 1 1 22 ILE H H -0.207 -8.199 4.301 1.00 . A A . 22 ILE H 1 1 6 5185 1 1 22 ILE HA H -2.367 -9.906 5.357 1.00 . A A . 22 ILE HA 1 1 6 5186 1 1 22 ILE HB H -3.915 -8.588 3.954 1.00 . A A . 22 ILE HB 1 1 6 5187 1 1 22 ILE HD11 H -4.382 -6.370 3.122 1.00 . A A . 22 ILE HD11 1 1 6 5188 1 1 22 ILE HD12 H -3.361 -5.953 1.745 1.00 . A A . 22 ILE HD12 1 1 6 5189 1 1 22 ILE HD13 H -3.062 -5.216 3.320 1.00 . A A . 22 ILE HD13 1 1 6 5190 1 1 22 ILE HG12 H -1.503 -6.816 3.485 1.00 . A A . 22 ILE HG12 1 1 6 5191 1 1 22 ILE HG13 H -2.275 -7.834 2.273 1.00 . A A . 22 ILE HG13 1 1 6 5192 1 1 22 ILE HG21 H -2.336 -7.412 6.168 1.00 . A A . 22 ILE HG21 1 1 6 5193 1 1 22 ILE HG22 H -4.053 -7.802 6.082 1.00 . A A . 22 ILE HG22 1 1 6 5194 1 1 22 ILE HG23 H -3.439 -6.347 5.298 1.00 . A A . 22 ILE HG23 1 1 6 5195 1 1 22 ILE N N -0.669 -8.818 4.903 1.00 . A A . 22 ILE N 1 1 6 5196 1 1 22 ILE O O -0.834 -10.422 2.740 1.00 . A A . 22 ILE O 1 1 6 5197 1 1 23 SER C C -3.390 -10.730 0.419 1.00 . A A . 23 SER C 1 1 6 5198 1 1 23 SER CA C -3.128 -11.553 1.676 1.00 . A A . 23 SER CA 1 1 6 5199 1 1 23 SER CB C -4.222 -12.609 1.845 1.00 . A A . 23 SER CB 1 1 6 5200 1 1 23 SER H H -3.891 -10.484 3.335 1.00 . A A . 23 SER H 1 1 6 5201 1 1 23 SER HA H -2.175 -12.050 1.575 1.00 . A A . 23 SER HA 1 1 6 5202 1 1 23 SER HB2 H -5.163 -12.121 2.056 1.00 . A A . 23 SER HB2 1 1 6 5203 1 1 23 SER HB3 H -4.311 -13.183 0.935 1.00 . A A . 23 SER HB3 1 1 6 5204 1 1 23 SER HG H -4.017 -14.399 2.616 1.00 . A A . 23 SER HG 1 1 6 5205 1 1 23 SER N N -3.065 -10.697 2.853 1.00 . A A . 23 SER N 1 1 6 5206 1 1 23 SER O O -3.815 -9.578 0.497 1.00 . A A . 23 SER O 1 1 6 5207 1 1 23 SER OG O -3.920 -13.491 2.913 1.00 . A A . 23 SER OG 1 1 6 5208 1 1 24 ASP C C -4.799 -10.229 -2.174 1.00 . A A . 24 ASP C 1 1 6 5209 1 1 24 ASP CA C -3.342 -10.654 -2.014 1.00 . A A . 24 ASP CA 1 1 6 5210 1 1 24 ASP CB C -2.936 -11.567 -3.173 1.00 . A A . 24 ASP CB 1 1 6 5211 1 1 24 ASP CG C -1.531 -12.110 -3.017 1.00 . A A . 24 ASP CG 1 1 6 5212 1 1 24 ASP H H -2.798 -12.251 -0.737 1.00 . A A . 24 ASP H 1 1 6 5213 1 1 24 ASP HA H -2.719 -9.773 -2.028 1.00 . A A . 24 ASP HA 1 1 6 5214 1 1 24 ASP HB2 H -3.622 -12.400 -3.223 1.00 . A A . 24 ASP HB2 1 1 6 5215 1 1 24 ASP HB3 H -2.987 -11.010 -4.097 1.00 . A A . 24 ASP HB3 1 1 6 5216 1 1 24 ASP N N -3.134 -11.331 -0.739 1.00 . A A . 24 ASP N 1 1 6 5217 1 1 24 ASP O O -5.096 -9.220 -2.815 1.00 . A A . 24 ASP O 1 1 6 5218 1 1 24 ASP OD1 O -0.746 -11.512 -2.250 1.00 . A A . 24 ASP OD1 1 1 6 5219 1 1 24 ASP OD2 O -1.214 -13.133 -3.657 1.00 . A A . 24 ASP OD2 1 1 6 5220 1 1 25 ALA C C -7.446 -9.364 -1.010 1.00 . A A . 25 ALA C 1 1 6 5221 1 1 25 ALA CA C -7.130 -10.706 -1.660 1.00 . A A . 25 ALA CA 1 1 6 5222 1 1 25 ALA CB C -7.933 -11.816 -1.001 1.00 . A A . 25 ALA CB 1 1 6 5223 1 1 25 ALA H H -5.406 -11.793 -1.087 1.00 . A A . 25 ALA H 1 1 6 5224 1 1 25 ALA HA H -7.406 -10.665 -2.703 1.00 . A A . 25 ALA HA 1 1 6 5225 1 1 25 ALA HB1 H -7.853 -11.731 0.073 1.00 . A A . 25 ALA HB1 1 1 6 5226 1 1 25 ALA HB2 H -7.550 -12.776 -1.316 1.00 . A A . 25 ALA HB2 1 1 6 5227 1 1 25 ALA HB3 H -8.971 -11.730 -1.291 1.00 . A A . 25 ALA HB3 1 1 6 5228 1 1 25 ALA N N -5.705 -11.003 -1.583 1.00 . A A . 25 ALA N 1 1 6 5229 1 1 25 ALA O O -8.158 -8.539 -1.582 1.00 . A A . 25 ALA O 1 1 6 5230 1 1 26 ALA C C -6.659 -6.705 0.109 1.00 . A A . 26 ALA C 1 1 6 5231 1 1 26 ALA CA C -7.137 -7.908 0.916 1.00 . A A . 26 ALA CA 1 1 6 5232 1 1 26 ALA CB C -6.438 -7.952 2.266 1.00 . A A . 26 ALA CB 1 1 6 5233 1 1 26 ALA H H -6.352 -9.846 0.594 1.00 . A A . 26 ALA H 1 1 6 5234 1 1 26 ALA HA H -8.200 -7.812 1.091 1.00 . A A . 26 ALA HA 1 1 6 5235 1 1 26 ALA HB1 H -6.381 -6.954 2.675 1.00 . A A . 26 ALA HB1 1 1 6 5236 1 1 26 ALA HB2 H -5.440 -8.347 2.141 1.00 . A A . 26 ALA HB2 1 1 6 5237 1 1 26 ALA HB3 H -6.995 -8.587 2.939 1.00 . A A . 26 ALA HB3 1 1 6 5238 1 1 26 ALA N N -6.911 -9.151 0.189 1.00 . A A . 26 ALA N 1 1 6 5239 1 1 26 ALA O O -7.278 -5.641 0.136 1.00 . A A . 26 ALA O 1 1 6 5240 1 1 27 VAL C C -5.878 -5.520 -2.628 1.00 . A A . 27 VAL C 1 1 6 5241 1 1 27 VAL CA C -4.991 -5.812 -1.421 1.00 . A A . 27 VAL CA 1 1 6 5242 1 1 27 VAL CB C -3.573 -6.165 -1.910 1.00 . A A . 27 VAL CB 1 1 6 5243 1 1 27 VAL CG1 C -2.974 -5.011 -2.701 1.00 . A A . 27 VAL CG1 1 1 6 5244 1 1 27 VAL CG2 C -2.682 -6.532 -0.733 1.00 . A A . 27 VAL CG2 1 1 6 5245 1 1 27 VAL H H -5.105 -7.753 -0.587 1.00 . A A . 27 VAL H 1 1 6 5246 1 1 27 VAL HA H -4.929 -4.924 -0.810 1.00 . A A . 27 VAL HA 1 1 6 5247 1 1 27 VAL HB H -3.642 -7.022 -2.564 1.00 . A A . 27 VAL HB 1 1 6 5248 1 1 27 VAL HG11 H -1.973 -5.270 -3.014 1.00 . A A . 27 VAL HG11 1 1 6 5249 1 1 27 VAL HG12 H -2.940 -4.127 -2.081 1.00 . A A . 27 VAL HG12 1 1 6 5250 1 1 27 VAL HG13 H -3.584 -4.817 -3.572 1.00 . A A . 27 VAL HG13 1 1 6 5251 1 1 27 VAL HG21 H -2.580 -5.679 -0.078 1.00 . A A . 27 VAL HG21 1 1 6 5252 1 1 27 VAL HG22 H -1.707 -6.823 -1.098 1.00 . A A . 27 VAL HG22 1 1 6 5253 1 1 27 VAL HG23 H -3.123 -7.353 -0.190 1.00 . A A . 27 VAL HG23 1 1 6 5254 1 1 27 VAL N N -5.553 -6.881 -0.607 1.00 . A A . 27 VAL N 1 1 6 5255 1 1 27 VAL O O -6.123 -4.362 -2.966 1.00 . A A . 27 VAL O 1 1 6 5256 1 1 28 SER C C -8.591 -5.916 -4.047 1.00 . A A . 28 SER C 1 1 6 5257 1 1 28 SER CA C -7.214 -6.433 -4.446 1.00 . A A . 28 SER CA 1 1 6 5258 1 1 28 SER CB C -7.349 -7.771 -5.174 1.00 . A A . 28 SER CB 1 1 6 5259 1 1 28 SER H H -6.124 -7.477 -2.960 1.00 . A A . 28 SER H 1 1 6 5260 1 1 28 SER HA H -6.751 -5.717 -5.108 1.00 . A A . 28 SER HA 1 1 6 5261 1 1 28 SER HB2 H -8.299 -7.805 -5.685 1.00 . A A . 28 SER HB2 1 1 6 5262 1 1 28 SER HB3 H -6.549 -7.868 -5.895 1.00 . A A . 28 SER HB3 1 1 6 5263 1 1 28 SER HG H -7.868 -8.692 -3.525 1.00 . A A . 28 SER HG 1 1 6 5264 1 1 28 SER N N -6.354 -6.578 -3.276 1.00 . A A . 28 SER N 1 1 6 5265 1 1 28 SER O O -9.245 -5.206 -4.811 1.00 . A A . 28 SER O 1 1 6 5266 1 1 28 SER OG O -7.281 -8.857 -4.265 1.00 . A A . 28 SER OG 1 1 6 5267 1 1 29 GLN C C -10.330 -4.357 -2.017 1.00 . A A . 29 GLN C 1 1 6 5268 1 1 29 GLN CA C -10.320 -5.851 -2.341 1.00 . A A . 29 GLN CA 1 1 6 5269 1 1 29 GLN CB C -10.700 -6.660 -1.097 1.00 . A A . 29 GLN CB 1 1 6 5270 1 1 29 GLN CD C -11.640 -8.954 -1.579 1.00 . A A . 29 GLN CD 1 1 6 5271 1 1 29 GLN CG C -11.960 -7.499 -1.277 1.00 . A A . 29 GLN CG 1 1 6 5272 1 1 29 GLN H H -8.461 -6.845 -2.281 1.00 . A A . 29 GLN H 1 1 6 5273 1 1 29 GLN HA H -11.050 -6.038 -3.115 1.00 . A A . 29 GLN HA 1 1 6 5274 1 1 29 GLN HB2 H -9.889 -7.320 -0.850 1.00 . A A . 29 GLN HB2 1 1 6 5275 1 1 29 GLN HB3 H -10.870 -5.981 -0.273 1.00 . A A . 29 GLN HB3 1 1 6 5276 1 1 29 GLN HE21 H -11.290 -9.302 0.346 1.00 . A A . 29 GLN HE21 1 1 6 5277 1 1 29 GLN HE22 H -11.110 -10.657 -0.708 1.00 . A A . 29 GLN HE22 1 1 6 5278 1 1 29 GLN HG2 H -12.540 -7.454 -0.369 1.00 . A A . 29 GLN HG2 1 1 6 5279 1 1 29 GLN HG3 H -12.530 -7.093 -2.095 1.00 . A A . 29 GLN HG3 1 1 6 5280 1 1 29 GLN N N -9.028 -6.278 -2.844 1.00 . A A . 29 GLN N 1 1 6 5281 1 1 29 GLN NE2 N -11.310 -9.714 -0.542 1.00 . A A . 29 GLN NE2 1 1 6 5282 1 1 29 GLN O O -11.390 -3.746 -1.882 1.00 . A A . 29 GLN O 1 1 6 5283 1 1 29 GLN OE1 O -11.700 -9.386 -2.729 1.00 . A A . 29 GLN OE1 1 1 6 5284 1 1 30 TRP C C -9.832 -1.502 -2.544 1.00 . A A . 30 TRP C 1 1 6 5285 1 1 30 TRP CA C -9.015 -2.353 -1.575 1.00 . A A . 30 TRP CA 1 1 6 5286 1 1 30 TRP CB C -7.546 -1.929 -1.624 1.00 . A A . 30 TRP CB 1 1 6 5287 1 1 30 TRP CD1 C -7.276 -2.714 0.803 1.00 . A A . 30 TRP CD1 1 1 6 5288 1 1 30 TRP CD2 C -5.346 -2.300 -0.254 1.00 . A A . 30 TRP CD2 1 1 6 5289 1 1 30 TRP CE2 C -5.058 -2.718 1.059 1.00 . A A . 30 TRP CE2 1 1 6 5290 1 1 30 TRP CE3 C -4.285 -1.984 -1.107 1.00 . A A . 30 TRP CE3 1 1 6 5291 1 1 30 TRP CG C -6.770 -2.303 -0.398 1.00 . A A . 30 TRP CG 1 1 6 5292 1 1 30 TRP CH2 C -2.736 -2.514 0.679 1.00 . A A . 30 TRP CH2 1 1 6 5293 1 1 30 TRP CZ2 C -3.754 -2.830 1.537 1.00 . A A . 30 TRP CZ2 1 1 6 5294 1 1 30 TRP CZ3 C -2.992 -2.095 -0.632 1.00 . A A . 30 TRP CZ3 1 1 6 5295 1 1 30 TRP H H -8.331 -4.309 -2.002 1.00 . A A . 30 TRP H 1 1 6 5296 1 1 30 TRP HA H -9.391 -2.198 -0.575 1.00 . A A . 30 TRP HA 1 1 6 5297 1 1 30 TRP HB2 H -7.072 -2.398 -2.473 1.00 . A A . 30 TRP HB2 1 1 6 5298 1 1 30 TRP HB3 H -7.493 -0.856 -1.739 1.00 . A A . 30 TRP HB3 1 1 6 5299 1 1 30 TRP HD1 H -8.329 -2.819 1.014 1.00 . A A . 30 TRP HD1 1 1 6 5300 1 1 30 TRP HE1 H -6.360 -3.271 2.609 1.00 . A A . 30 TRP HE1 1 1 6 5301 1 1 30 TRP HE3 H -4.463 -1.659 -2.122 1.00 . A A . 30 TRP HE3 1 1 6 5302 1 1 30 TRP HH2 H -1.710 -2.585 1.007 1.00 . A A . 30 TRP HH2 1 1 6 5303 1 1 30 TRP HZ2 H -3.540 -3.153 2.544 1.00 . A A . 30 TRP HZ2 1 1 6 5304 1 1 30 TRP HZ3 H -2.159 -1.855 -1.278 1.00 . A A . 30 TRP HZ3 1 1 6 5305 1 1 30 TRP N N -9.143 -3.773 -1.887 1.00 . A A . 30 TRP N 1 1 6 5306 1 1 30 TRP NE1 N -6.252 -2.965 1.684 1.00 . A A . 30 TRP NE1 1 1 6 5307 1 1 30 TRP O O -10.020 -1.873 -3.701 1.00 . A A . 30 TRP O 1 1 6 5308 1 1 31 LYS C C -10.300 1.822 -3.192 1.00 . A A . 31 LYS C 1 1 6 5309 1 1 31 LYS CA C -11.090 0.553 -2.881 1.00 . A A . 31 LYS CA 1 1 6 5310 1 1 31 LYS CB C -12.400 0.907 -2.167 1.00 . A A . 31 LYS CB 1 1 6 5311 1 1 31 LYS CD C -14.370 0.119 -0.820 1.00 . A A . 31 LYS CD 1 1 6 5312 1 1 31 LYS CE C -15.570 0.082 -1.748 1.00 . A A . 31 LYS CE 1 1 6 5313 1 1 31 LYS CG C -13.090 -0.291 -1.542 1.00 . A A . 31 LYS CG 1 1 6 5314 1 1 31 LYS H H -10.100 -0.115 -1.131 1.00 . A A . 31 LYS H 1 1 6 5315 1 1 31 LYS HA H -11.320 0.049 -3.808 1.00 . A A . 31 LYS HA 1 1 6 5316 1 1 31 LYS HB2 H -12.180 1.621 -1.385 1.00 . A A . 31 LYS HB2 1 1 6 5317 1 1 31 LYS HB3 H -13.070 1.357 -2.880 1.00 . A A . 31 LYS HB3 1 1 6 5318 1 1 31 LYS HD2 H -14.540 -0.561 0.001 1.00 . A A . 31 LYS HD2 1 1 6 5319 1 1 31 LYS HD3 H -14.240 1.123 -0.440 1.00 . A A . 31 LYS HD3 1 1 6 5320 1 1 31 LYS HE2 H -15.480 0.884 -2.466 1.00 . A A . 31 LYS HE2 1 1 6 5321 1 1 31 LYS HE3 H -15.580 -0.865 -2.267 1.00 . A A . 31 LYS HE3 1 1 6 5322 1 1 31 LYS HG2 H -13.340 -0.995 -2.321 1.00 . A A . 31 LYS HG2 1 1 6 5323 1 1 31 LYS HG3 H -12.420 -0.757 -0.836 1.00 . A A . 31 LYS HG3 1 1 6 5324 1 1 31 LYS HZ1 H -17.520 0.795 -1.570 1.00 . A A . 31 LYS HZ1 1 1 6 5325 1 1 31 LYS HZ2 H -16.680 0.734 -0.105 1.00 . A A . 31 LYS HZ2 1 1 6 5326 1 1 31 LYS HZ3 H -17.260 -0.692 -0.804 1.00 . A A . 31 LYS HZ3 1 1 6 5327 1 1 31 LYS N N -10.300 -0.356 -2.062 1.00 . A A . 31 LYS N 1 1 6 5328 1 1 31 LYS NZ N -16.850 0.241 -1.005 1.00 . A A . 31 LYS NZ 1 1 6 5329 1 1 31 LYS O O -9.084 1.857 -3.035 1.00 . A A . 31 LYS O 1 1 6 5330 1 1 32 GLU C C -9.439 4.591 -2.836 1.00 . A A . 32 GLU C 1 1 6 5331 1 1 32 GLU CA C -10.360 4.134 -3.962 1.00 . A A . 32 GLU CA 1 1 6 5332 1 1 32 GLU CB C -11.420 5.206 -4.235 1.00 . A A . 32 GLU CB 1 1 6 5333 1 1 32 GLU CD C -12.720 4.347 -6.225 1.00 . A A . 32 GLU CD 1 1 6 5334 1 1 32 GLU CG C -11.740 5.382 -5.711 1.00 . A A . 32 GLU CG 1 1 6 5335 1 1 32 GLU H H -11.970 2.776 -3.736 1.00 . A A . 32 GLU H 1 1 6 5336 1 1 32 GLU HA H -9.779 3.986 -4.856 1.00 . A A . 32 GLU HA 1 1 6 5337 1 1 32 GLU HB2 H -12.330 4.934 -3.722 1.00 . A A . 32 GLU HB2 1 1 6 5338 1 1 32 GLU HB3 H -11.070 6.151 -3.849 1.00 . A A . 32 GLU HB3 1 1 6 5339 1 1 32 GLU HG2 H -12.160 6.363 -5.859 1.00 . A A . 32 GLU HG2 1 1 6 5340 1 1 32 GLU HG3 H -10.820 5.300 -6.276 1.00 . A A . 32 GLU HG3 1 1 6 5341 1 1 32 GLU N N -11.000 2.864 -3.632 1.00 . A A . 32 GLU N 1 1 6 5342 1 1 32 GLU O O -8.460 5.297 -3.074 1.00 . A A . 32 GLU O 1 1 6 5343 1 1 32 GLU OE1 O -13.650 3.986 -5.473 1.00 . A A . 32 GLU OE1 1 1 6 5344 1 1 32 GLU OE2 O -12.560 3.896 -7.378 1.00 . A A . 32 GLU OE2 1 1 6 5345 1 1 33 VAL C C -8.703 3.331 0.442 1.00 . A A . 33 VAL C 1 1 6 5346 1 1 33 VAL CA C -8.952 4.543 -0.452 1.00 . A A . 33 VAL CA 1 1 6 5347 1 1 33 VAL CB C -9.630 5.648 0.378 1.00 . A A . 33 VAL CB 1 1 6 5348 1 1 33 VAL CG1 C -8.697 6.148 1.471 1.00 . A A . 33 VAL CG1 1 1 6 5349 1 1 33 VAL CG2 C -10.070 6.794 -0.521 1.00 . A A . 33 VAL CG2 1 1 6 5350 1 1 33 VAL H H -10.540 3.617 -1.486 1.00 . A A . 33 VAL H 1 1 6 5351 1 1 33 VAL HA H -8.003 4.918 -0.808 1.00 . A A . 33 VAL HA 1 1 6 5352 1 1 33 VAL HB H -10.500 5.230 0.849 1.00 . A A . 33 VAL HB 1 1 6 5353 1 1 33 VAL HG11 H -7.956 5.391 1.686 1.00 . A A . 33 VAL HG11 1 1 6 5354 1 1 33 VAL HG12 H -9.268 6.357 2.364 1.00 . A A . 33 VAL HG12 1 1 6 5355 1 1 33 VAL HG13 H -8.204 7.050 1.140 1.00 . A A . 33 VAL HG13 1 1 6 5356 1 1 33 VAL HG21 H -9.203 7.260 -0.962 1.00 . A A . 33 VAL HG21 1 1 6 5357 1 1 33 VAL HG22 H -10.610 7.522 0.064 1.00 . A A . 33 VAL HG22 1 1 6 5358 1 1 33 VAL HG23 H -10.710 6.412 -1.302 1.00 . A A . 33 VAL HG23 1 1 6 5359 1 1 33 VAL N N -9.755 4.179 -1.612 1.00 . A A . 33 VAL N 1 1 6 5360 1 1 33 VAL O O -9.636 2.771 1.018 1.00 . A A . 33 VAL O 1 1 6 5361 1 1 34 ILE C C -7.542 1.969 2.818 1.00 . A A . 34 ILE C 1 1 6 5362 1 1 34 ILE CA C -7.066 1.788 1.377 1.00 . A A . 34 ILE CA 1 1 6 5363 1 1 34 ILE CB C -5.541 1.572 1.374 1.00 . A A . 34 ILE CB 1 1 6 5364 1 1 34 ILE CD1 C -3.326 2.686 1.943 1.00 . A A . 34 ILE CD1 1 1 6 5365 1 1 34 ILE CG1 C -4.821 2.855 1.791 1.00 . A A . 34 ILE CG1 1 1 6 5366 1 1 34 ILE CG2 C -5.072 1.118 0.001 1.00 . A A . 34 ILE CG2 1 1 6 5367 1 1 34 ILE H H -6.740 3.422 0.070 1.00 . A A . 34 ILE H 1 1 6 5368 1 1 34 ILE HA H -7.536 0.910 0.960 1.00 . A A . 34 ILE HA 1 1 6 5369 1 1 34 ILE HB H -5.308 0.792 2.082 1.00 . A A . 34 ILE HB 1 1 6 5370 1 1 34 ILE HD11 H -2.870 3.648 2.127 1.00 . A A . 34 ILE HD11 1 1 6 5371 1 1 34 ILE HD12 H -2.918 2.261 1.037 1.00 . A A . 34 ILE HD12 1 1 6 5372 1 1 34 ILE HD13 H -3.121 2.027 2.774 1.00 . A A . 34 ILE HD13 1 1 6 5373 1 1 34 ILE HG12 H -4.993 3.616 1.045 1.00 . A A . 34 ILE HG12 1 1 6 5374 1 1 34 ILE HG13 H -5.216 3.192 2.738 1.00 . A A . 34 ILE HG13 1 1 6 5375 1 1 34 ILE HG21 H -5.197 1.924 -0.707 1.00 . A A . 34 ILE HG21 1 1 6 5376 1 1 34 ILE HG22 H -5.659 0.267 -0.317 1.00 . A A . 34 ILE HG22 1 1 6 5377 1 1 34 ILE HG23 H -4.031 0.839 0.049 1.00 . A A . 34 ILE HG23 1 1 6 5378 1 1 34 ILE N N -7.440 2.933 0.553 1.00 . A A . 34 ILE N 1 1 6 5379 1 1 34 ILE O O -7.831 3.085 3.247 1.00 . A A . 34 ILE O 1 1 6 5380 1 1 35 PRO C C -7.364 1.996 5.788 1.00 . A A . 35 PRO C 1 1 6 5381 1 1 35 PRO CA C -8.078 0.915 4.981 1.00 . A A . 35 PRO CA 1 1 6 5382 1 1 35 PRO CB C -7.723 -0.474 5.510 1.00 . A A . 35 PRO CB 1 1 6 5383 1 1 35 PRO CD C -7.310 -0.507 3.155 1.00 . A A . 35 PRO CD 1 1 6 5384 1 1 35 PRO CG C -7.774 -1.354 4.309 1.00 . A A . 35 PRO CG 1 1 6 5385 1 1 35 PRO HA H -9.146 1.066 5.049 1.00 . A A . 35 PRO HA 1 1 6 5386 1 1 35 PRO HB2 H -6.735 -0.454 5.947 1.00 . A A . 35 PRO HB2 1 1 6 5387 1 1 35 PRO HB3 H -8.447 -0.777 6.252 1.00 . A A . 35 PRO HB3 1 1 6 5388 1 1 35 PRO HD2 H -6.249 -0.626 3.005 1.00 . A A . 35 PRO HD2 1 1 6 5389 1 1 35 PRO HD3 H -7.852 -0.765 2.257 1.00 . A A . 35 PRO HD3 1 1 6 5390 1 1 35 PRO HG2 H -7.114 -2.198 4.444 1.00 . A A . 35 PRO HG2 1 1 6 5391 1 1 35 PRO HG3 H -8.787 -1.691 4.143 1.00 . A A . 35 PRO HG3 1 1 6 5392 1 1 35 PRO N N -7.632 0.867 3.585 1.00 . A A . 35 PRO N 1 1 6 5393 1 1 35 PRO O O -6.382 2.580 5.329 1.00 . A A . 35 PRO O 1 1 6 5394 1 1 36 GLU C C -5.958 2.805 8.448 1.00 . A A . 36 GLU C 1 1 6 5395 1 1 36 GLU CA C -7.286 3.276 7.858 1.00 . A A . 36 GLU CA 1 1 6 5396 1 1 36 GLU CB C -8.261 3.623 8.986 1.00 . A A . 36 GLU CB 1 1 6 5397 1 1 36 GLU CD C -8.443 4.674 11.276 1.00 . A A . 36 GLU CD 1 1 6 5398 1 1 36 GLU CG C -7.743 4.695 9.932 1.00 . A A . 36 GLU CG 1 1 6 5399 1 1 36 GLU H H -8.655 1.763 7.295 1.00 . A A . 36 GLU H 1 1 6 5400 1 1 36 GLU HA H -7.109 4.160 7.265 1.00 . A A . 36 GLU HA 1 1 6 5401 1 1 36 GLU HB2 H -9.185 3.973 8.552 1.00 . A A . 36 GLU HB2 1 1 6 5402 1 1 36 GLU HB3 H -8.458 2.731 9.562 1.00 . A A . 36 GLU HB3 1 1 6 5403 1 1 36 GLU HG2 H -6.687 4.538 10.092 1.00 . A A . 36 GLU HG2 1 1 6 5404 1 1 36 GLU HG3 H -7.897 5.663 9.477 1.00 . A A . 36 GLU HG3 1 1 6 5405 1 1 36 GLU N N -7.868 2.261 6.988 1.00 . A A . 36 GLU N 1 1 6 5406 1 1 36 GLU O O -4.983 3.554 8.481 1.00 . A A . 36 GLU O 1 1 6 5407 1 1 36 GLU OE1 O -9.606 4.221 11.333 1.00 . A A . 36 GLU OE1 1 1 6 5408 1 1 36 GLU OE2 O -7.829 5.110 12.273 1.00 . A A . 36 GLU OE2 1 1 6 5409 1 1 37 LYS C C -3.748 0.500 8.449 1.00 . A A . 37 LYS C 1 1 6 5410 1 1 37 LYS CA C -4.723 0.999 9.515 1.00 . A A . 37 LYS CA 1 1 6 5411 1 1 37 LYS CB C -5.085 -0.145 10.464 1.00 . A A . 37 LYS CB 1 1 6 5412 1 1 37 LYS CD C -7.224 -1.354 9.924 1.00 . A A . 37 LYS CD 1 1 6 5413 1 1 37 LYS CE C -7.928 -1.500 8.583 1.00 . A A . 37 LYS CE 1 1 6 5414 1 1 37 LYS CG C -5.711 -1.341 9.764 1.00 . A A . 37 LYS CG 1 1 6 5415 1 1 37 LYS H H -6.741 1.014 8.871 1.00 . A A . 37 LYS H 1 1 6 5416 1 1 37 LYS HA H -4.240 1.782 10.080 1.00 . A A . 37 LYS HA 1 1 6 5417 1 1 37 LYS HB2 H -4.189 -0.478 10.965 1.00 . A A . 37 LYS HB2 1 1 6 5418 1 1 37 LYS HB3 H -5.785 0.221 11.200 1.00 . A A . 37 LYS HB3 1 1 6 5419 1 1 37 LYS HD2 H -7.502 -2.185 10.555 1.00 . A A . 37 LYS HD2 1 1 6 5420 1 1 37 LYS HD3 H -7.537 -0.429 10.385 1.00 . A A . 37 LYS HD3 1 1 6 5421 1 1 37 LYS HE2 H -8.262 -0.525 8.258 1.00 . A A . 37 LYS HE2 1 1 6 5422 1 1 37 LYS HE3 H -7.226 -1.895 7.863 1.00 . A A . 37 LYS HE3 1 1 6 5423 1 1 37 LYS HG2 H -5.470 -1.297 8.713 1.00 . A A . 37 LYS HG2 1 1 6 5424 1 1 37 LYS HG3 H -5.305 -2.247 10.190 1.00 . A A . 37 LYS HG3 1 1 6 5425 1 1 37 LYS HZ1 H -9.483 -2.591 7.715 1.00 . A A . 37 LYS HZ1 1 1 6 5426 1 1 37 LYS HZ2 H -9.847 -1.981 9.251 1.00 . A A . 37 LYS HZ2 1 1 6 5427 1 1 37 LYS HZ3 H -8.821 -3.316 9.094 1.00 . A A . 37 LYS HZ3 1 1 6 5428 1 1 37 LYS N N -5.930 1.563 8.919 1.00 . A A . 37 LYS N 1 1 6 5429 1 1 37 LYS NZ N -9.101 -2.410 8.667 1.00 . A A . 37 LYS NZ 1 1 6 5430 1 1 37 LYS O O -2.584 0.230 8.743 1.00 . A A . 37 LYS O 1 1 6 5431 1 1 38 ASP C C -2.496 1.037 5.596 1.00 . A A . 38 ASP C 1 1 6 5432 1 1 38 ASP CA C -3.379 -0.090 6.120 1.00 . A A . 38 ASP CA 1 1 6 5433 1 1 38 ASP CB C -4.239 -0.652 4.985 1.00 . A A . 38 ASP CB 1 1 6 5434 1 1 38 ASP CG C -4.687 -2.076 5.250 1.00 . A A . 38 ASP CG 1 1 6 5435 1 1 38 ASP H H -5.159 0.605 7.031 1.00 . A A . 38 ASP H 1 1 6 5436 1 1 38 ASP HA H -2.747 -0.877 6.504 1.00 . A A . 38 ASP HA 1 1 6 5437 1 1 38 ASP HB2 H -5.116 -0.035 4.866 1.00 . A A . 38 ASP HB2 1 1 6 5438 1 1 38 ASP HB3 H -3.667 -0.638 4.068 1.00 . A A . 38 ASP HB3 1 1 6 5439 1 1 38 ASP N N -4.224 0.378 7.212 1.00 . A A . 38 ASP N 1 1 6 5440 1 1 38 ASP O O -1.287 0.870 5.443 1.00 . A A . 38 ASP O 1 1 6 5441 1 1 38 ASP OD1 O -4.766 -2.462 6.435 1.00 . A A . 38 ASP OD1 1 1 6 5442 1 1 38 ASP OD2 O -4.959 -2.804 4.272 1.00 . A A . 38 ASP OD2 1 1 6 5443 1 1 39 ALA C C -1.345 3.816 5.850 1.00 . A A . 39 ALA C 1 1 6 5444 1 1 39 ALA CA C -2.374 3.341 4.830 1.00 . A A . 39 ALA CA 1 1 6 5445 1 1 39 ALA CB C -3.335 4.468 4.481 1.00 . A A . 39 ALA CB 1 1 6 5446 1 1 39 ALA H H -4.075 2.259 5.476 1.00 . A A . 39 ALA H 1 1 6 5447 1 1 39 ALA HA H -1.859 3.044 3.927 1.00 . A A . 39 ALA HA 1 1 6 5448 1 1 39 ALA HB1 H -2.981 4.982 3.599 1.00 . A A . 39 ALA HB1 1 1 6 5449 1 1 39 ALA HB2 H -3.389 5.163 5.305 1.00 . A A . 39 ALA HB2 1 1 6 5450 1 1 39 ALA HB3 H -4.315 4.058 4.289 1.00 . A A . 39 ALA HB3 1 1 6 5451 1 1 39 ALA N N -3.108 2.186 5.330 1.00 . A A . 39 ALA N 1 1 6 5452 1 1 39 ALA O O -0.319 4.393 5.488 1.00 . A A . 39 ALA O 1 1 6 5453 1 1 40 TYR C C 0.618 3.260 8.078 1.00 . A A . 40 TYR C 1 1 6 5454 1 1 40 TYR CA C -0.726 3.976 8.197 1.00 . A A . 40 TYR CA 1 1 6 5455 1 1 40 TYR CB C -1.359 3.680 9.559 1.00 . A A . 40 TYR CB 1 1 6 5456 1 1 40 TYR CD1 C -0.363 5.364 11.152 1.00 . A A . 40 TYR CD1 1 1 6 5457 1 1 40 TYR CD2 C 0.245 3.075 11.411 1.00 . A A . 40 TYR CD2 1 1 6 5458 1 1 40 TYR CE1 C 0.443 5.704 12.221 1.00 . A A . 40 TYR CE1 1 1 6 5459 1 1 40 TYR CE2 C 1.054 3.407 12.482 1.00 . A A . 40 TYR CE2 1 1 6 5460 1 1 40 TYR CG C -0.475 4.048 10.729 1.00 . A A . 40 TYR CG 1 1 6 5461 1 1 40 TYR CZ C 1.149 4.722 12.882 1.00 . A A . 40 TYR CZ 1 1 6 5462 1 1 40 TYR H H -2.460 3.109 7.353 1.00 . A A . 40 TYR H 1 1 6 5463 1 1 40 TYR HA H -0.562 5.039 8.110 1.00 . A A . 40 TYR HA 1 1 6 5464 1 1 40 TYR HB2 H -2.278 4.240 9.649 1.00 . A A . 40 TYR HB2 1 1 6 5465 1 1 40 TYR HB3 H -1.575 2.622 9.623 1.00 . A A . 40 TYR HB3 1 1 6 5466 1 1 40 TYR HD1 H -0.918 6.133 10.632 1.00 . A A . 40 TYR HD1 1 1 6 5467 1 1 40 TYR HD2 H 0.169 2.045 11.093 1.00 . A A . 40 TYR HD2 1 1 6 5468 1 1 40 TYR HE1 H 0.517 6.736 12.536 1.00 . A A . 40 TYR HE1 1 1 6 5469 1 1 40 TYR HE2 H 1.607 2.637 12.999 1.00 . A A . 40 TYR HE2 1 1 6 5470 1 1 40 TYR HH H 2.776 4.564 13.896 1.00 . A A . 40 TYR HH 1 1 6 5471 1 1 40 TYR N N -1.627 3.573 7.126 1.00 . A A . 40 TYR N 1 1 6 5472 1 1 40 TYR O O 1.668 3.899 8.012 1.00 . A A . 40 TYR O 1 1 6 5473 1 1 40 TYR OH O 1.953 5.057 13.949 1.00 . A A . 40 TYR OH 1 1 6 5474 1 1 41 ARG C C 2.513 1.409 6.632 1.00 . A A . 41 ARG C 1 1 6 5475 1 1 41 ARG CA C 1.790 1.130 7.945 1.00 . A A . 41 ARG CA 1 1 6 5476 1 1 41 ARG CB C 1.453 -0.359 8.046 1.00 . A A . 41 ARG CB 1 1 6 5477 1 1 41 ARG CD C 0.364 -2.211 9.348 1.00 . A A . 41 ARG CD 1 1 6 5478 1 1 41 ARG CG C 0.607 -0.712 9.259 1.00 . A A . 41 ARG CG 1 1 6 5479 1 1 41 ARG CZ C -0.980 -2.559 11.385 1.00 . A A . 41 ARG CZ 1 1 6 5480 1 1 41 ARG H H -0.292 1.481 8.111 1.00 . A A . 41 ARG H 1 1 6 5481 1 1 41 ARG HA H 2.438 1.398 8.765 1.00 . A A . 41 ARG HA 1 1 6 5482 1 1 41 ARG HB2 H 0.913 -0.656 7.159 1.00 . A A . 41 ARG HB2 1 1 6 5483 1 1 41 ARG HB3 H 2.373 -0.922 8.100 1.00 . A A . 41 ARG HB3 1 1 6 5484 1 1 41 ARG HD2 H -0.518 -2.454 8.777 1.00 . A A . 41 ARG HD2 1 1 6 5485 1 1 41 ARG HD3 H 1.217 -2.726 8.930 1.00 . A A . 41 ARG HD3 1 1 6 5486 1 1 41 ARG HE H 0.946 -3.042 11.188 1.00 . A A . 41 ARG HE 1 1 6 5487 1 1 41 ARG HG2 H 1.119 -0.386 10.151 1.00 . A A . 41 ARG HG2 1 1 6 5488 1 1 41 ARG HG3 H -0.344 -0.206 9.182 1.00 . A A . 41 ARG HG3 1 1 6 5489 1 1 41 ARG HH11 H -1.991 -1.710 9.854 1.00 . A A . 41 ARG HH11 1 1 6 5490 1 1 41 ARG HH12 H -2.911 -1.970 11.296 1.00 . A A . 41 ARG HH12 1 1 6 5491 1 1 41 ARG HH21 H -0.265 -3.385 13.086 1.00 . A A . 41 ARG HH21 1 1 6 5492 1 1 41 ARG HH22 H -1.933 -2.919 13.131 1.00 . A A . 41 ARG HH22 1 1 6 5493 1 1 41 ARG N N 0.575 1.931 8.054 1.00 . A A . 41 ARG N 1 1 6 5494 1 1 41 ARG NE N 0.174 -2.653 10.729 1.00 . A A . 41 ARG NE 1 1 6 5495 1 1 41 ARG NH1 N -2.048 -2.036 10.796 1.00 . A A . 41 ARG NH1 1 1 6 5496 1 1 41 ARG NH2 N -1.067 -2.989 12.637 1.00 . A A . 41 ARG NH2 1 1 6 5497 1 1 41 ARG O O 3.740 1.324 6.557 1.00 . A A . 41 ARG O 1 1 6 5498 1 1 42 LEU C C 3.335 3.161 4.365 1.00 . A A . 42 LEU C 1 1 6 5499 1 1 42 LEU CA C 2.315 2.028 4.286 1.00 . A A . 42 LEU CA 1 1 6 5500 1 1 42 LEU CB C 1.207 2.393 3.295 1.00 . A A . 42 LEU CB 1 1 6 5501 1 1 42 LEU CD1 C -0.468 1.688 1.567 1.00 . A A . 42 LEU CD1 1 1 6 5502 1 1 42 LEU CD2 C 1.628 0.361 1.888 1.00 . A A . 42 LEU CD2 1 1 6 5503 1 1 42 LEU CG C 0.565 1.207 2.574 1.00 . A A . 42 LEU CG 1 1 6 5504 1 1 42 LEU H H 0.776 1.788 5.719 1.00 . A A . 42 LEU H 1 1 6 5505 1 1 42 LEU HA H 2.816 1.136 3.938 1.00 . A A . 42 LEU HA 1 1 6 5506 1 1 42 LEU HB2 H 0.433 2.923 3.833 1.00 . A A . 42 LEU HB2 1 1 6 5507 1 1 42 LEU HB3 H 1.621 3.055 2.550 1.00 . A A . 42 LEU HB3 1 1 6 5508 1 1 42 LEU HD11 H -0.828 2.663 1.858 1.00 . A A . 42 LEU HD11 1 1 6 5509 1 1 42 LEU HD12 H -1.294 0.993 1.538 1.00 . A A . 42 LEU HD12 1 1 6 5510 1 1 42 LEU HD13 H -0.015 1.750 0.588 1.00 . A A . 42 LEU HD13 1 1 6 5511 1 1 42 LEU HD21 H 1.222 -0.059 0.980 1.00 . A A . 42 LEU HD21 1 1 6 5512 1 1 42 LEU HD22 H 1.935 -0.436 2.549 1.00 . A A . 42 LEU HD22 1 1 6 5513 1 1 42 LEU HD23 H 2.480 0.980 1.649 1.00 . A A . 42 LEU HD23 1 1 6 5514 1 1 42 LEU HG H 0.058 0.584 3.299 1.00 . A A . 42 LEU HG 1 1 6 5515 1 1 42 LEU N N 1.747 1.740 5.597 1.00 . A A . 42 LEU N 1 1 6 5516 1 1 42 LEU O O 4.440 3.053 3.835 1.00 . A A . 42 LEU O 1 1 6 5517 1 1 43 GLU C C 5.195 5.002 5.733 1.00 . A A . 43 GLU C 1 1 6 5518 1 1 43 GLU CA C 3.833 5.406 5.174 1.00 . A A . 43 GLU CA 1 1 6 5519 1 1 43 GLU CB C 3.186 6.451 6.086 1.00 . A A . 43 GLU CB 1 1 6 5520 1 1 43 GLU CD C 3.542 8.620 7.328 1.00 . A A . 43 GLU CD 1 1 6 5521 1 1 43 GLU CG C 3.952 7.762 6.148 1.00 . A A . 43 GLU CG 1 1 6 5522 1 1 43 GLU H H 2.059 4.277 5.426 1.00 . A A . 43 GLU H 1 1 6 5523 1 1 43 GLU HA H 3.975 5.838 4.195 1.00 . A A . 43 GLU HA 1 1 6 5524 1 1 43 GLU HB2 H 2.190 6.657 5.727 1.00 . A A . 43 GLU HB2 1 1 6 5525 1 1 43 GLU HB3 H 3.123 6.048 7.086 1.00 . A A . 43 GLU HB3 1 1 6 5526 1 1 43 GLU HG2 H 5.006 7.544 6.229 1.00 . A A . 43 GLU HG2 1 1 6 5527 1 1 43 GLU HG3 H 3.768 8.315 5.237 1.00 . A A . 43 GLU HG3 1 1 6 5528 1 1 43 GLU N N 2.953 4.249 5.027 1.00 . A A . 43 GLU N 1 1 6 5529 1 1 43 GLU O O 6.207 5.642 5.448 1.00 . A A . 43 GLU O 1 1 6 5530 1 1 43 GLU OE1 O 2.404 8.460 7.812 1.00 . A A . 43 GLU OE1 1 1 6 5531 1 1 43 GLU OE2 O 4.363 9.453 7.771 1.00 . A A . 43 GLU OE2 1 1 6 5532 1 1 44 ILE C C 7.176 2.493 6.187 1.00 . A A . 44 ILE C 1 1 6 5533 1 1 44 ILE CA C 6.453 3.454 7.126 1.00 . A A . 44 ILE CA 1 1 6 5534 1 1 44 ILE CB C 6.188 2.746 8.466 1.00 . A A . 44 ILE CB 1 1 6 5535 1 1 44 ILE CD1 C 5.575 3.444 10.853 1.00 . A A . 44 ILE CD1 1 1 6 5536 1 1 44 ILE CG1 C 5.334 3.644 9.371 1.00 . A A . 44 ILE CG1 1 1 6 5537 1 1 44 ILE CG2 C 7.509 2.379 9.135 1.00 . A A . 44 ILE CG2 1 1 6 5538 1 1 44 ILE H H 4.375 3.470 6.720 1.00 . A A . 44 ILE H 1 1 6 5539 1 1 44 ILE HA H 7.088 4.306 7.315 1.00 . A A . 44 ILE HA 1 1 6 5540 1 1 44 ILE HB H 5.650 1.832 8.266 1.00 . A A . 44 ILE HB 1 1 6 5541 1 1 44 ILE HD11 H 5.354 2.421 11.119 1.00 . A A . 44 ILE HD11 1 1 6 5542 1 1 44 ILE HD12 H 4.935 4.108 11.415 1.00 . A A . 44 ILE HD12 1 1 6 5543 1 1 44 ILE HD13 H 6.608 3.660 11.080 1.00 . A A . 44 ILE HD13 1 1 6 5544 1 1 44 ILE HG12 H 5.545 4.677 9.142 1.00 . A A . 44 ILE HG12 1 1 6 5545 1 1 44 ILE HG13 H 4.289 3.446 9.175 1.00 . A A . 44 ILE HG13 1 1 6 5546 1 1 44 ILE HG21 H 7.312 1.835 10.047 1.00 . A A . 44 ILE HG21 1 1 6 5547 1 1 44 ILE HG22 H 8.059 3.280 9.365 1.00 . A A . 44 ILE HG22 1 1 6 5548 1 1 44 ILE HG23 H 8.091 1.763 8.466 1.00 . A A . 44 ILE HG23 1 1 6 5549 1 1 44 ILE N N 5.214 3.938 6.530 1.00 . A A . 44 ILE N 1 1 6 5550 1 1 44 ILE O O 8.390 2.582 6.003 1.00 . A A . 44 ILE O 1 1 6 5551 1 1 45 VAL C C 7.579 1.266 3.449 1.00 . A A . 45 VAL C 1 1 6 5552 1 1 45 VAL CA C 6.979 0.592 4.679 1.00 . A A . 45 VAL CA 1 1 6 5553 1 1 45 VAL CB C 5.907 -0.431 4.243 1.00 . A A . 45 VAL CB 1 1 6 5554 1 1 45 VAL CG1 C 5.214 -0.005 2.953 1.00 . A A . 45 VAL CG1 1 1 6 5555 1 1 45 VAL CG2 C 6.519 -1.816 4.096 1.00 . A A . 45 VAL CG2 1 1 6 5556 1 1 45 VAL H H 5.459 1.554 5.787 1.00 . A A . 45 VAL H 1 1 6 5557 1 1 45 VAL HA H 7.762 0.058 5.199 1.00 . A A . 45 VAL HA 1 1 6 5558 1 1 45 VAL HB H 5.159 -0.475 5.017 1.00 . A A . 45 VAL HB 1 1 6 5559 1 1 45 VAL HG11 H 5.903 -0.101 2.126 1.00 . A A . 45 VAL HG11 1 1 6 5560 1 1 45 VAL HG12 H 4.893 1.022 3.037 1.00 . A A . 45 VAL HG12 1 1 6 5561 1 1 45 VAL HG13 H 4.355 -0.638 2.782 1.00 . A A . 45 VAL HG13 1 1 6 5562 1 1 45 VAL HG21 H 6.728 -2.009 3.054 1.00 . A A . 45 VAL HG21 1 1 6 5563 1 1 45 VAL HG22 H 5.826 -2.557 4.468 1.00 . A A . 45 VAL HG22 1 1 6 5564 1 1 45 VAL HG23 H 7.436 -1.866 4.664 1.00 . A A . 45 VAL HG23 1 1 6 5565 1 1 45 VAL N N 6.419 1.574 5.598 1.00 . A A . 45 VAL N 1 1 6 5566 1 1 45 VAL O O 8.621 0.852 2.941 1.00 . A A . 45 VAL O 1 1 6 5567 1 1 46 THR C C 8.465 4.033 2.141 1.00 . A A . 46 THR C 1 1 6 5568 1 1 46 THR CA C 7.349 3.043 1.800 1.00 . A A . 46 THR CA 1 1 6 5569 1 1 46 THR CB C 6.169 3.786 1.178 1.00 . A A . 46 THR CB 1 1 6 5570 1 1 46 THR CG2 C 5.171 2.869 0.502 1.00 . A A . 46 THR CG2 1 1 6 5571 1 1 46 THR H H 6.076 2.577 3.421 1.00 . A A . 46 THR H 1 1 6 5572 1 1 46 THR HA H 7.727 2.328 1.086 1.00 . A A . 46 THR HA 1 1 6 5573 1 1 46 THR HB H 6.542 4.470 0.437 1.00 . A A . 46 THR HB 1 1 6 5574 1 1 46 THR HG1 H 5.523 5.468 1.946 1.00 . A A . 46 THR HG1 1 1 6 5575 1 1 46 THR HG21 H 4.221 2.932 1.013 1.00 . A A . 46 THR HG21 1 1 6 5576 1 1 46 THR HG22 H 5.535 1.854 0.538 1.00 . A A . 46 THR HG22 1 1 6 5577 1 1 46 THR HG23 H 5.046 3.171 -0.528 1.00 . A A . 46 THR HG23 1 1 6 5578 1 1 46 THR N N 6.903 2.304 2.974 1.00 . A A . 46 THR N 1 1 6 5579 1 1 46 THR O O 8.920 4.783 1.277 1.00 . A A . 46 THR O 1 1 6 5580 1 1 46 THR OG1 O 5.473 4.533 2.159 1.00 . A A . 46 THR OG1 1 1 6 5581 1 1 47 ALA C C 9.495 6.383 3.865 1.00 . A A . 47 ALA C 1 1 6 5582 1 1 47 ALA CA C 9.970 4.933 3.836 1.00 . A A . 47 ALA CA 1 1 6 5583 1 1 47 ALA CB C 11.190 4.794 2.935 1.00 . A A . 47 ALA CB 1 1 6 5584 1 1 47 ALA H H 8.511 3.416 4.046 1.00 . A A . 47 ALA H 1 1 6 5585 1 1 47 ALA HA H 10.258 4.642 4.836 1.00 . A A . 47 ALA HA 1 1 6 5586 1 1 47 ALA HB1 H 12.069 5.122 3.467 1.00 . A A . 47 ALA HB1 1 1 6 5587 1 1 47 ALA HB2 H 11.056 5.401 2.052 1.00 . A A . 47 ALA HB2 1 1 6 5588 1 1 47 ALA HB3 H 11.308 3.761 2.646 1.00 . A A . 47 ALA HB3 1 1 6 5589 1 1 47 ALA N N 8.906 4.035 3.399 1.00 . A A . 47 ALA N 1 1 6 5590 1 1 47 ALA O O 10.285 7.309 3.680 1.00 . A A . 47 ALA O 1 1 6 5591 1 1 48 GLY C C 7.281 8.457 2.793 1.00 . A A . 48 GLY C 1 1 6 5592 1 1 48 GLY CA C 7.648 7.914 4.160 1.00 . A A . 48 GLY CA 1 1 6 5593 1 1 48 GLY H H 7.620 5.798 4.250 1.00 . A A . 48 GLY H 1 1 6 5594 1 1 48 GLY HA2 H 6.762 7.898 4.778 1.00 . A A . 48 GLY HA2 1 1 6 5595 1 1 48 GLY HA3 H 8.376 8.572 4.611 1.00 . A A . 48 GLY HA3 1 1 6 5596 1 1 48 GLY N N 8.202 6.573 4.105 1.00 . A A . 48 GLY N 1 1 6 5597 1 1 48 GLY O O 7.187 9.670 2.605 1.00 . A A . 48 GLY O 1 1 6 5598 1 1 49 ALA C C 5.333 8.628 0.460 1.00 . A A . 49 ALA C 1 1 6 5599 1 1 49 ALA CA C 6.706 7.968 0.482 1.00 . A A . 49 ALA CA 1 1 6 5600 1 1 49 ALA CB C 6.734 6.770 -0.457 1.00 . A A . 49 ALA CB 1 1 6 5601 1 1 49 ALA H H 7.155 6.607 2.040 1.00 . A A . 49 ALA H 1 1 6 5602 1 1 49 ALA HA H 7.443 8.680 0.138 1.00 . A A . 49 ALA HA 1 1 6 5603 1 1 49 ALA HB1 H 6.777 7.116 -1.480 1.00 . A A . 49 ALA HB1 1 1 6 5604 1 1 49 ALA HB2 H 5.841 6.181 -0.313 1.00 . A A . 49 ALA HB2 1 1 6 5605 1 1 49 ALA HB3 H 7.603 6.165 -0.244 1.00 . A A . 49 ALA HB3 1 1 6 5606 1 1 49 ALA N N 7.068 7.561 1.834 1.00 . A A . 49 ALA N 1 1 6 5607 1 1 49 ALA O O 5.205 9.807 0.134 1.00 . A A . 49 ALA O 1 1 6 5608 1 1 50 LEU C C 2.555 8.810 2.246 1.00 . A A . 50 LEU C 1 1 6 5609 1 1 50 LEU CA C 2.942 8.370 0.837 1.00 . A A . 50 LEU CA 1 1 6 5610 1 1 50 LEU CB C 1.966 7.303 0.336 1.00 . A A . 50 LEU CB 1 1 6 5611 1 1 50 LEU CD1 C 1.898 5.312 -1.189 1.00 . A A . 50 LEU CD1 1 1 6 5612 1 1 50 LEU CD2 C 1.437 7.597 -2.095 1.00 . A A . 50 LEU CD2 1 1 6 5613 1 1 50 LEU CG C 2.235 6.793 -1.081 1.00 . A A . 50 LEU CG 1 1 6 5614 1 1 50 LEU H H 4.474 6.927 1.063 1.00 . A A . 50 LEU H 1 1 6 5615 1 1 50 LEU HA H 2.896 9.225 0.180 1.00 . A A . 50 LEU HA 1 1 6 5616 1 1 50 LEU HB2 H 2.006 6.463 1.014 1.00 . A A . 50 LEU HB2 1 1 6 5617 1 1 50 LEU HB3 H 0.970 7.717 0.361 1.00 . A A . 50 LEU HB3 1 1 6 5618 1 1 50 LEU HD11 H 1.938 4.862 -0.209 1.00 . A A . 50 LEU HD11 1 1 6 5619 1 1 50 LEU HD12 H 2.613 4.827 -1.837 1.00 . A A . 50 LEU HD12 1 1 6 5620 1 1 50 LEU HD13 H 0.905 5.198 -1.598 1.00 . A A . 50 LEU HD13 1 1 6 5621 1 1 50 LEU HD21 H 1.923 7.545 -3.058 1.00 . A A . 50 LEU HD21 1 1 6 5622 1 1 50 LEU HD22 H 1.384 8.628 -1.776 1.00 . A A . 50 LEU HD22 1 1 6 5623 1 1 50 LEU HD23 H 0.440 7.192 -2.173 1.00 . A A . 50 LEU HD23 1 1 6 5624 1 1 50 LEU HG H 3.284 6.914 -1.307 1.00 . A A . 50 LEU HG 1 1 6 5625 1 1 50 LEU N N 4.307 7.859 0.812 1.00 . A A . 50 LEU N 1 1 6 5626 1 1 50 LEU O O 2.606 8.019 3.189 1.00 . A A . 50 LEU O 1 1 6 5627 1 1 51 LYS C C 0.344 10.220 4.023 1.00 . A A . 51 LYS C 1 1 6 5628 1 1 51 LYS CA C 1.776 10.617 3.677 1.00 . A A . 51 LYS CA 1 1 6 5629 1 1 51 LYS CB C 1.911 12.140 3.680 1.00 . A A . 51 LYS CB 1 1 6 5630 1 1 51 LYS CD C 2.340 13.327 1.505 1.00 . A A . 51 LYS CD 1 1 6 5631 1 1 51 LYS CE C 1.771 14.373 0.562 1.00 . A A . 51 LYS CE 1 1 6 5632 1 1 51 LYS CG C 1.283 12.811 2.470 1.00 . A A . 51 LYS CG 1 1 6 5633 1 1 51 LYS H H 2.151 10.656 1.593 1.00 . A A . 51 LYS H 1 1 6 5634 1 1 51 LYS HA H 2.439 10.204 4.423 1.00 . A A . 51 LYS HA 1 1 6 5635 1 1 51 LYS HB2 H 1.435 12.530 4.568 1.00 . A A . 51 LYS HB2 1 1 6 5636 1 1 51 LYS HB3 H 2.960 12.396 3.705 1.00 . A A . 51 LYS HB3 1 1 6 5637 1 1 51 LYS HD2 H 3.147 13.766 2.071 1.00 . A A . 51 LYS HD2 1 1 6 5638 1 1 51 LYS HD3 H 2.716 12.497 0.924 1.00 . A A . 51 LYS HD3 1 1 6 5639 1 1 51 LYS HE2 H 2.582 14.810 -0.002 1.00 . A A . 51 LYS HE2 1 1 6 5640 1 1 51 LYS HE3 H 1.080 13.893 -0.116 1.00 . A A . 51 LYS HE3 1 1 6 5641 1 1 51 LYS HG2 H 0.659 12.094 1.956 1.00 . A A . 51 LYS HG2 1 1 6 5642 1 1 51 LYS HG3 H 0.679 13.642 2.805 1.00 . A A . 51 LYS HG3 1 1 6 5643 1 1 51 LYS HZ1 H 0.119 15.124 1.598 1.00 . A A . 51 LYS HZ1 1 1 6 5644 1 1 51 LYS HZ2 H 0.938 16.285 0.682 1.00 . A A . 51 LYS HZ2 1 1 6 5645 1 1 51 LYS HZ3 H 1.601 15.735 2.138 1.00 . A A . 51 LYS HZ3 1 1 6 5646 1 1 51 LYS N N 2.169 10.074 2.382 1.00 . A A . 51 LYS N 1 1 6 5647 1 1 51 LYS NZ N 1.058 15.455 1.297 1.00 . A A . 51 LYS NZ 1 1 6 5648 1 1 51 LYS O O -0.513 10.121 3.144 1.00 . A A . 51 LYS O 1 1 6 5649 1 1 52 TYR C C -2.189 10.798 5.743 1.00 . A A . 52 TYR C 1 1 6 5650 1 1 52 TYR CA C -1.233 9.610 5.773 1.00 . A A . 52 TYR CA 1 1 6 5651 1 1 52 TYR CB C -1.152 9.040 7.191 1.00 . A A . 52 TYR CB 1 1 6 5652 1 1 52 TYR CD1 C -2.397 6.847 7.332 1.00 . A A . 52 TYR CD1 1 1 6 5653 1 1 52 TYR CD2 C -3.454 8.799 8.200 1.00 . A A . 52 TYR CD2 1 1 6 5654 1 1 52 TYR CE1 C -3.496 6.089 7.687 1.00 . A A . 52 TYR CE1 1 1 6 5655 1 1 52 TYR CE2 C -4.556 8.049 8.559 1.00 . A A . 52 TYR CE2 1 1 6 5656 1 1 52 TYR CG C -2.357 8.213 7.582 1.00 . A A . 52 TYR CG 1 1 6 5657 1 1 52 TYR CZ C -4.572 6.694 8.300 1.00 . A A . 52 TYR CZ 1 1 6 5658 1 1 52 TYR H H 0.819 10.089 5.960 1.00 . A A . 52 TYR H 1 1 6 5659 1 1 52 TYR HA H -1.607 8.844 5.109 1.00 . A A . 52 TYR HA 1 1 6 5660 1 1 52 TYR HB2 H -0.279 8.409 7.268 1.00 . A A . 52 TYR HB2 1 1 6 5661 1 1 52 TYR HB3 H -1.066 9.854 7.894 1.00 . A A . 52 TYR HB3 1 1 6 5662 1 1 52 TYR HD1 H -1.552 6.377 6.851 1.00 . A A . 52 TYR HD1 1 1 6 5663 1 1 52 TYR HD2 H -3.439 9.861 8.402 1.00 . A A . 52 TYR HD2 1 1 6 5664 1 1 52 TYR HE1 H -3.508 5.029 7.485 1.00 . A A . 52 TYR HE1 1 1 6 5665 1 1 52 TYR HE2 H -5.399 8.522 9.040 1.00 . A A . 52 TYR HE2 1 1 6 5666 1 1 52 TYR HH H -6.265 5.870 7.908 1.00 . A A . 52 TYR HH 1 1 6 5667 1 1 52 TYR N N 0.094 9.995 5.308 1.00 . A A . 52 TYR N 1 1 6 5668 1 1 52 TYR O O -1.767 11.948 5.853 1.00 . A A . 52 TYR O 1 1 6 5669 1 1 52 TYR OH O -5.668 5.941 8.657 1.00 . A A . 52 TYR OH 1 1 6 5670 1 1 53 GLN C C -5.766 11.106 6.269 1.00 . A A . 53 GLN C 1 1 6 5671 1 1 53 GLN CA C -4.495 11.554 5.554 1.00 . A A . 53 GLN CA 1 1 6 5672 1 1 53 GLN CB C -4.813 11.926 4.104 1.00 . A A . 53 GLN CB 1 1 6 5673 1 1 53 GLN CD C -3.764 12.623 1.914 1.00 . A A . 53 GLN CD 1 1 6 5674 1 1 53 GLN CG C -3.710 12.723 3.426 1.00 . A A . 53 GLN CG 1 1 6 5675 1 1 53 GLN H H -3.752 9.573 5.515 1.00 . A A . 53 GLN H 1 1 6 5676 1 1 53 GLN HA H -4.100 12.421 6.059 1.00 . A A . 53 GLN HA 1 1 6 5677 1 1 53 GLN HB2 H -4.974 11.021 3.539 1.00 . A A . 53 GLN HB2 1 1 6 5678 1 1 53 GLN HB3 H -5.717 12.517 4.086 1.00 . A A . 53 GLN HB3 1 1 6 5679 1 1 53 GLN HE21 H -2.911 14.411 1.742 1.00 . A A . 53 GLN HE21 1 1 6 5680 1 1 53 GLN HE22 H -3.295 13.617 0.257 1.00 . A A . 53 GLN HE22 1 1 6 5681 1 1 53 GLN HG2 H -3.809 13.761 3.706 1.00 . A A . 53 GLN HG2 1 1 6 5682 1 1 53 GLN HG3 H -2.755 12.349 3.764 1.00 . A A . 53 GLN HG3 1 1 6 5683 1 1 53 GLN N N -3.478 10.509 5.597 1.00 . A A . 53 GLN N 1 1 6 5684 1 1 53 GLN NE2 N -3.274 13.655 1.235 1.00 . A A . 53 GLN NE2 1 1 6 5685 1 1 53 GLN O O -6.639 10.476 5.672 1.00 . A A . 53 GLN O 1 1 6 5686 1 1 53 GLN OE1 O -4.238 11.630 1.362 1.00 . A A . 53 GLN OE1 1 1 6 5687 1 1 54 GLU C C -8.314 11.614 7.759 1.00 . A A . 54 GLU C 1 1 6 5688 1 1 54 GLU CA C -7.019 11.071 8.361 1.00 . A A . 54 GLU CA 1 1 6 5689 1 1 54 GLU CB C -6.855 11.593 9.788 1.00 . A A . 54 GLU CB 1 1 6 5690 1 1 54 GLU CD C -5.583 13.442 10.947 1.00 . A A . 54 GLU CD 1 1 6 5691 1 1 54 GLU CG C -6.580 13.086 9.861 1.00 . A A . 54 GLU CG 1 1 6 5692 1 1 54 GLU H H -5.130 11.939 7.971 1.00 . A A . 54 GLU H 1 1 6 5693 1 1 54 GLU HA H -7.077 9.994 8.389 1.00 . A A . 54 GLU HA 1 1 6 5694 1 1 54 GLU HB2 H -7.759 11.388 10.343 1.00 . A A . 54 GLU HB2 1 1 6 5695 1 1 54 GLU HB3 H -6.031 11.073 10.257 1.00 . A A . 54 GLU HB3 1 1 6 5696 1 1 54 GLU HG2 H -6.186 13.413 8.911 1.00 . A A . 54 GLU HG2 1 1 6 5697 1 1 54 GLU HG3 H -7.508 13.600 10.063 1.00 . A A . 54 GLU HG3 1 1 6 5698 1 1 54 GLU N N -5.860 11.436 7.553 1.00 . A A . 54 GLU N 1 1 6 5699 1 1 54 GLU O O -9.401 11.134 8.074 1.00 . A A . 54 GLU O 1 1 6 5700 1 1 54 GLU OE1 O -5.406 12.633 11.880 1.00 . A A . 54 GLU OE1 1 1 6 5701 1 1 54 GLU OE2 O -4.978 14.532 10.860 1.00 . A A . 54 GLU OE2 1 1 6 5702 1 1 55 ASN C C -10.320 12.180 5.719 1.00 . A A . 55 ASN C 1 1 6 5703 1 1 55 ASN CA C -9.358 13.235 6.261 1.00 . A A . 55 ASN CA 1 1 6 5704 1 1 55 ASN CB C -8.912 14.160 5.126 1.00 . A A . 55 ASN CB 1 1 6 5705 1 1 55 ASN CG C -8.309 15.453 5.638 1.00 . A A . 55 ASN CG 1 1 6 5706 1 1 55 ASN H H -7.303 12.970 6.691 1.00 . A A . 55 ASN H 1 1 6 5707 1 1 55 ASN HA H -9.870 13.821 7.008 1.00 . A A . 55 ASN HA 1 1 6 5708 1 1 55 ASN HB2 H -8.172 13.653 4.526 1.00 . A A . 55 ASN HB2 1 1 6 5709 1 1 55 ASN HB3 H -9.767 14.400 4.510 1.00 . A A . 55 ASN HB3 1 1 6 5710 1 1 55 ASN HD21 H -6.564 14.999 4.800 1.00 . A A . 55 ASN HD21 1 1 6 5711 1 1 55 ASN HD22 H -6.619 16.502 5.649 1.00 . A A . 55 ASN HD22 1 1 6 5712 1 1 55 ASN N N -8.193 12.623 6.898 1.00 . A A . 55 ASN N 1 1 6 5713 1 1 55 ASN ND2 N -7.036 15.673 5.331 1.00 . A A . 55 ASN ND2 1 1 6 5714 1 1 55 ASN O O -11.380 11.943 6.298 1.00 . A A . 55 ASN O 1 1 6 5715 1 1 55 ASN OD1 O -8.979 16.245 6.301 1.00 . A A . 55 ASN OD1 1 1 6 5716 1 1 56 ALA C C -11.110 9.410 4.957 1.00 . A A . 56 ALA C 1 1 6 5717 1 1 56 ALA CA C -10.780 10.537 3.982 1.00 . A A . 56 ALA CA 1 1 6 5718 1 1 56 ALA CB C -10.090 9.981 2.743 1.00 . A A . 56 ALA CB 1 1 6 5719 1 1 56 ALA H H -9.096 11.797 4.189 1.00 . A A . 56 ALA H 1 1 6 5720 1 1 56 ALA HA H -11.700 11.007 3.670 1.00 . A A . 56 ALA HA 1 1 6 5721 1 1 56 ALA HB1 H -9.481 10.747 2.299 1.00 . A A . 56 ALA HB1 1 1 6 5722 1 1 56 ALA HB2 H -10.840 9.662 2.031 1.00 . A A . 56 ALA HB2 1 1 6 5723 1 1 56 ALA HB3 H -9.483 9.139 3.022 1.00 . A A . 56 ALA HB3 1 1 6 5724 1 1 56 ALA N N -9.951 11.559 4.605 1.00 . A A . 56 ALA N 1 1 6 5725 1 1 56 ALA O O -12.150 8.761 4.844 1.00 . A A . 56 ALA O 1 1 6 5726 1 1 57 TYR C C -11.350 8.573 8.019 1.00 . A A . 57 TYR C 1 1 6 5727 1 1 57 TYR CA C -10.410 8.123 6.900 1.00 . A A . 57 TYR CA 1 1 6 5728 1 1 57 TYR CB C -9.066 7.699 7.488 1.00 . A A . 57 TYR CB 1 1 6 5729 1 1 57 TYR CD1 C -8.366 6.343 5.477 1.00 . A A . 57 TYR CD1 1 1 6 5730 1 1 57 TYR CD2 C -6.785 7.858 6.418 1.00 . A A . 57 TYR CD2 1 1 6 5731 1 1 57 TYR CE1 C -7.443 5.970 4.518 1.00 . A A . 57 TYR CE1 1 1 6 5732 1 1 57 TYR CE2 C -5.856 7.491 5.461 1.00 . A A . 57 TYR CE2 1 1 6 5733 1 1 57 TYR CG C -8.053 7.293 6.441 1.00 . A A . 57 TYR CG 1 1 6 5734 1 1 57 TYR CZ C -6.190 6.546 4.514 1.00 . A A . 57 TYR CZ 1 1 6 5735 1 1 57 TYR H H -9.404 9.724 5.947 1.00 . A A . 57 TYR H 1 1 6 5736 1 1 57 TYR HA H -10.850 7.276 6.397 1.00 . A A . 57 TYR HA 1 1 6 5737 1 1 57 TYR HB2 H -8.650 8.521 8.050 1.00 . A A . 57 TYR HB2 1 1 6 5738 1 1 57 TYR HB3 H -9.217 6.857 8.147 1.00 . A A . 57 TYR HB3 1 1 6 5739 1 1 57 TYR HD1 H -9.348 5.895 5.481 1.00 . A A . 57 TYR HD1 1 1 6 5740 1 1 57 TYR HD2 H -6.526 8.600 7.160 1.00 . A A . 57 TYR HD2 1 1 6 5741 1 1 57 TYR HE1 H -7.706 5.231 3.777 1.00 . A A . 57 TYR HE1 1 1 6 5742 1 1 57 TYR HE2 H -4.875 7.942 5.459 1.00 . A A . 57 TYR HE2 1 1 6 5743 1 1 57 TYR HH H -5.716 6.027 2.725 1.00 . A A . 57 TYR HH 1 1 6 5744 1 1 57 TYR N N -10.210 9.176 5.910 1.00 . A A . 57 TYR N 1 1 6 5745 1 1 57 TYR O O -11.810 7.755 8.814 1.00 . A A . 57 TYR O 1 1 6 5746 1 1 57 TYR OH O -5.269 6.177 3.562 1.00 . A A . 57 TYR OH 1 1 6 5747 1 1 58 ARG C C -13.970 10.195 8.737 1.00 . A A . 58 ARG C 1 1 6 5748 1 1 58 ARG CA C -12.510 10.416 9.105 1.00 . A A . 58 ARG CA 1 1 6 5749 1 1 58 ARG CB C -12.240 11.910 9.300 1.00 . A A . 58 ARG CB 1 1 6 5750 1 1 58 ARG CD C -14.000 12.384 11.030 1.00 . A A . 58 ARG CD 1 1 6 5751 1 1 58 ARG CG C -12.510 12.397 10.713 1.00 . A A . 58 ARG CG 1 1 6 5752 1 1 58 ARG CZ C -15.420 12.592 13.032 1.00 . A A . 58 ARG CZ 1 1 6 5753 1 1 58 ARG H H -11.230 10.480 7.422 1.00 . A A . 58 ARG H 1 1 6 5754 1 1 58 ARG HA H -12.300 9.900 10.030 1.00 . A A . 58 ARG HA 1 1 6 5755 1 1 58 ARG HB2 H -11.200 12.111 9.066 1.00 . A A . 58 ARG HB2 1 1 6 5756 1 1 58 ARG HB3 H -12.870 12.468 8.621 1.00 . A A . 58 ARG HB3 1 1 6 5757 1 1 58 ARG HD2 H -14.510 13.048 10.347 1.00 . A A . 58 ARG HD2 1 1 6 5758 1 1 58 ARG HD3 H -14.370 11.379 10.897 1.00 . A A . 58 ARG HD3 1 1 6 5759 1 1 58 ARG HE H -13.560 13.292 12.873 1.00 . A A . 58 ARG HE 1 1 6 5760 1 1 58 ARG HG2 H -12.000 11.753 11.412 1.00 . A A . 58 ARG HG2 1 1 6 5761 1 1 58 ARG HG3 H -12.140 13.407 10.813 1.00 . A A . 58 ARG HG3 1 1 6 5762 1 1 58 ARG HH11 H -16.290 11.624 11.483 1.00 . A A . 58 ARG HH11 1 1 6 5763 1 1 58 ARG HH12 H -17.270 11.782 12.903 1.00 . A A . 58 ARG HH12 1 1 6 5764 1 1 58 ARG HH21 H -14.840 13.502 14.742 1.00 . A A . 58 ARG HH21 1 1 6 5765 1 1 58 ARG HH22 H -16.450 12.849 14.753 1.00 . A A . 58 ARG HH22 1 1 6 5766 1 1 58 ARG N N -11.620 9.872 8.079 1.00 . A A . 58 ARG N 1 1 6 5767 1 1 58 ARG NE N -14.270 12.813 12.399 1.00 . A A . 58 ARG NE 1 1 6 5768 1 1 58 ARG NH1 N -16.410 11.946 12.422 1.00 . A A . 58 ARG NH1 1 1 6 5769 1 1 58 ARG NH2 N -15.580 13.015 14.278 1.00 . A A . 58 ARG NH2 1 1 6 5770 1 1 58 ARG O O -14.600 11.041 8.099 1.00 . A A . 58 ARG O 1 1 6 5771 1 1 59 GLN C C -16.650 8.354 10.138 1.00 . A A . 59 GLN C 1 1 6 5772 1 1 59 GLN CA C -15.900 8.715 8.859 1.00 . A A . 59 GLN CA 1 1 6 5773 1 1 59 GLN CB C -15.970 7.554 7.864 1.00 . A A . 59 GLN CB 1 1 6 5774 1 1 59 GLN CD C -15.210 8.023 5.502 1.00 . A A . 59 GLN CD 1 1 6 5775 1 1 59 GLN CG C -16.380 7.978 6.462 1.00 . A A . 59 GLN CG 1 1 6 5776 1 1 59 GLN H H -13.960 8.415 9.650 1.00 . A A . 59 GLN H 1 1 6 5777 1 1 59 GLN HA H -16.370 9.584 8.417 1.00 . A A . 59 GLN HA 1 1 6 5778 1 1 59 GLN HB2 H -15.000 7.084 7.807 1.00 . A A . 59 GLN HB2 1 1 6 5779 1 1 59 GLN HB3 H -16.690 6.831 8.221 1.00 . A A . 59 GLN HB3 1 1 6 5780 1 1 59 GLN HE21 H -15.990 9.606 4.586 1.00 . A A . 59 GLN HE21 1 1 6 5781 1 1 59 GLN HE22 H -14.480 9.040 3.956 1.00 . A A . 59 GLN HE22 1 1 6 5782 1 1 59 GLN HG2 H -17.110 7.275 6.084 1.00 . A A . 59 GLN HG2 1 1 6 5783 1 1 59 GLN HG3 H -16.820 8.961 6.512 1.00 . A A . 59 GLN HG3 1 1 6 5784 1 1 59 GLN N N -14.510 9.050 9.145 1.00 . A A . 59 GLN N 1 1 6 5785 1 1 59 GLN NE2 N -15.230 8.987 4.589 1.00 . A A . 59 GLN NE2 1 1 6 5786 1 1 59 GLN O O -16.290 7.398 10.829 1.00 . A A . 59 GLN O 1 1 6 5787 1 1 59 GLN OE1 O -14.290 7.203 5.583 1.00 . A A . 59 GLN OE1 1 1 6 5788 1 1 60 ALA C C -19.410 7.692 11.453 1.00 . A A . 60 ALA C 1 1 6 5789 1 1 60 ALA CA C -18.480 8.886 11.645 1.00 . A A . 60 ALA CA 1 1 6 5790 1 1 60 ALA CB C -19.280 10.129 12.001 1.00 . A A . 60 ALA CB 1 1 6 5791 1 1 60 ALA H H -17.920 9.871 9.859 1.00 . A A . 60 ALA H 1 1 6 5792 1 1 60 ALA HA H -17.810 8.675 12.460 1.00 . A A . 60 ALA HA 1 1 6 5793 1 1 60 ALA HB1 H -18.760 11.006 11.649 1.00 . A A . 60 ALA HB1 1 1 6 5794 1 1 60 ALA HB2 H -19.400 10.186 13.073 1.00 . A A . 60 ALA HB2 1 1 6 5795 1 1 60 ALA HB3 H -20.260 10.077 11.533 1.00 . A A . 60 ALA HB3 1 1 6 5796 1 1 60 ALA N N -17.680 9.125 10.448 1.00 . A A . 60 ALA N 1 1 6 5797 1 1 60 ALA O O -19.470 7.109 10.370 1.00 . A A . 60 ALA O 1 1 6 5798 1 1 61 ALA C C -22.480 6.644 12.826 1.00 . A A . 61 ALA C 1 1 6 5799 1 1 61 ALA CA C -21.060 6.210 12.454 1.00 . A A . 61 ALA CA 1 1 6 5800 1 1 61 ALA CB C -20.590 5.093 13.375 1.00 . A A . 61 ALA CB 1 1 6 5801 1 1 61 ALA H H -20.040 7.837 13.345 1.00 . A A . 61 ALA H 1 1 6 5802 1 1 61 ALA HA H -21.070 5.831 11.443 1.00 . A A . 61 ALA HA 1 1 6 5803 1 1 61 ALA HB1 H -21.180 4.204 13.190 1.00 . A A . 61 ALA HB1 1 1 6 5804 1 1 61 ALA HB2 H -20.720 5.398 14.404 1.00 . A A . 61 ALA HB2 1 1 6 5805 1 1 61 ALA HB3 H -19.550 4.884 13.185 1.00 . A A . 61 ALA HB3 1 1 6 5806 1 1 61 ALA N N -20.140 7.333 12.509 1.00 . A A . 61 ALA N 1 1 6 5807 1 1 61 ALA O O -23.240 7.012 11.911 1.00 . A A . 61 ALA O 1 1 6 5808 1 1 61 ALA OXT O -22.810 6.614 14.031 1.00 . A A . 61 ALA OXT 1 1 7 5809 1 1 1 MET C C -5.481 6.584 -1.065 1.00 . A A . 1 MET C 1 1 7 5810 1 1 1 MET CA C -4.654 7.609 -0.295 1.00 . A A . 1 MET CA 1 1 7 5811 1 1 1 MET CB C -3.162 7.402 -0.573 1.00 . A A . 1 MET CB 1 1 7 5812 1 1 1 MET CE C -0.259 5.591 1.599 1.00 . A A . 1 MET CE 1 1 7 5813 1 1 1 MET CG C -2.554 6.235 0.187 1.00 . A A . 1 MET CG 1 1 7 5814 1 1 1 MET H1 H -5.871 7.755 1.357 1.00 . A A . 1 MET H1 1 1 7 5815 1 1 1 MET H2 H -4.224 8.142 1.646 1.00 . A A . 1 MET H2 1 1 7 5816 1 1 1 MET H3 H -4.700 6.508 1.442 1.00 . A A . 1 MET H3 1 1 7 5817 1 1 1 MET HA H -4.940 8.602 -0.609 1.00 . A A . 1 MET HA 1 1 7 5818 1 1 1 MET HB2 H -3.027 7.224 -1.630 1.00 . A A . 1 MET HB2 1 1 7 5819 1 1 1 MET HB3 H -2.629 8.300 -0.298 1.00 . A A . 1 MET HB3 1 1 7 5820 1 1 1 MET HE1 H -1.093 5.128 2.107 1.00 . A A . 1 MET HE1 1 1 7 5821 1 1 1 MET HE2 H 0.070 6.451 2.163 1.00 . A A . 1 MET HE2 1 1 7 5822 1 1 1 MET HE3 H 0.551 4.883 1.516 1.00 . A A . 1 MET HE3 1 1 7 5823 1 1 1 MET HG2 H -2.760 6.363 1.240 1.00 . A A . 1 MET HG2 1 1 7 5824 1 1 1 MET HG3 H -3.014 5.320 -0.157 1.00 . A A . 1 MET HG3 1 1 7 5825 1 1 1 MET N N -4.883 7.492 1.169 1.00 . A A . 1 MET N 1 1 7 5826 1 1 1 MET O O -6.268 5.840 -0.480 1.00 . A A . 1 MET O 1 1 7 5827 1 1 1 MET SD S -0.770 6.109 -0.038 1.00 . A A . 1 MET SD 1 1 7 5828 1 1 2 TYR C C -5.291 4.297 -3.354 1.00 . A A . 2 TYR C 1 1 7 5829 1 1 2 TYR CA C -6.032 5.626 -3.234 1.00 . A A . 2 TYR CA 1 1 7 5830 1 1 2 TYR CB C -6.246 6.234 -4.621 1.00 . A A . 2 TYR CB 1 1 7 5831 1 1 2 TYR CD1 C -8.150 7.682 -3.817 1.00 . A A . 2 TYR CD1 1 1 7 5832 1 1 2 TYR CD2 C -8.347 6.650 -5.957 1.00 . A A . 2 TYR CD2 1 1 7 5833 1 1 2 TYR CE1 C -9.395 8.261 -3.978 1.00 . A A . 2 TYR CE1 1 1 7 5834 1 1 2 TYR CE2 C -9.592 7.226 -6.126 1.00 . A A . 2 TYR CE2 1 1 7 5835 1 1 2 TYR CG C -7.606 6.867 -4.803 1.00 . A A . 2 TYR CG 1 1 7 5836 1 1 2 TYR CZ C -10.110 8.031 -5.134 1.00 . A A . 2 TYR CZ 1 1 7 5837 1 1 2 TYR H H -4.660 7.177 -2.790 1.00 . A A . 2 TYR H 1 1 7 5838 1 1 2 TYR HA H -6.994 5.448 -2.778 1.00 . A A . 2 TYR HA 1 1 7 5839 1 1 2 TYR HB2 H -5.500 6.997 -4.791 1.00 . A A . 2 TYR HB2 1 1 7 5840 1 1 2 TYR HB3 H -6.137 5.460 -5.367 1.00 . A A . 2 TYR HB3 1 1 7 5841 1 1 2 TYR HD1 H -7.588 7.860 -2.913 1.00 . A A . 2 TYR HD1 1 1 7 5842 1 1 2 TYR HD2 H -7.939 6.017 -6.732 1.00 . A A . 2 TYR HD2 1 1 7 5843 1 1 2 TYR HE1 H -9.801 8.892 -3.201 1.00 . A A . 2 TYR HE1 1 1 7 5844 1 1 2 TYR HE2 H -10.150 7.045 -7.031 1.00 . A A . 2 TYR HE2 1 1 7 5845 1 1 2 TYR HH H -11.450 8.885 -6.211 1.00 . A A . 2 TYR HH 1 1 7 5846 1 1 2 TYR N N -5.300 6.557 -2.381 1.00 . A A . 2 TYR N 1 1 7 5847 1 1 2 TYR O O -4.085 4.222 -3.113 1.00 . A A . 2 TYR O 1 1 7 5848 1 1 2 TYR OH O -11.350 8.606 -5.298 1.00 . A A . 2 TYR OH 1 1 7 5849 1 1 3 LYS C C -4.506 1.874 -5.087 1.00 . A A . 3 LYS C 1 1 7 5850 1 1 3 LYS CA C -5.441 1.924 -3.880 1.00 . A A . 3 LYS CA 1 1 7 5851 1 1 3 LYS CB C -6.549 0.879 -4.031 1.00 . A A . 3 LYS CB 1 1 7 5852 1 1 3 LYS CD C -6.771 -1.213 -5.409 1.00 . A A . 3 LYS CD 1 1 7 5853 1 1 3 LYS CE C -6.918 -2.707 -5.171 1.00 . A A . 3 LYS CE 1 1 7 5854 1 1 3 LYS CG C -6.036 -0.535 -4.261 1.00 . A A . 3 LYS CG 1 1 7 5855 1 1 3 LYS H H -6.978 3.378 -3.903 1.00 . A A . 3 LYS H 1 1 7 5856 1 1 3 LYS HA H -4.871 1.706 -2.989 1.00 . A A . 3 LYS HA 1 1 7 5857 1 1 3 LYS HB2 H -7.149 0.878 -3.133 1.00 . A A . 3 LYS HB2 1 1 7 5858 1 1 3 LYS HB3 H -7.175 1.155 -4.868 1.00 . A A . 3 LYS HB3 1 1 7 5859 1 1 3 LYS HD2 H -7.753 -0.776 -5.503 1.00 . A A . 3 LYS HD2 1 1 7 5860 1 1 3 LYS HD3 H -6.216 -1.055 -6.322 1.00 . A A . 3 LYS HD3 1 1 7 5861 1 1 3 LYS HE2 H -7.411 -2.862 -4.223 1.00 . A A . 3 LYS HE2 1 1 7 5862 1 1 3 LYS HE3 H -7.522 -3.126 -5.962 1.00 . A A . 3 LYS HE3 1 1 7 5863 1 1 3 LYS HG2 H -4.984 -0.492 -4.498 1.00 . A A . 3 LYS HG2 1 1 7 5864 1 1 3 LYS HG3 H -6.182 -1.112 -3.360 1.00 . A A . 3 LYS HG3 1 1 7 5865 1 1 3 LYS HZ1 H -5.367 -3.754 -6.100 1.00 . A A . 3 LYS HZ1 1 1 7 5866 1 1 3 LYS HZ2 H -5.628 -4.202 -4.490 1.00 . A A . 3 LYS HZ2 1 1 7 5867 1 1 3 LYS HZ3 H -4.855 -2.741 -4.845 1.00 . A A . 3 LYS HZ3 1 1 7 5868 1 1 3 LYS N N -6.022 3.253 -3.726 1.00 . A A . 3 LYS N 1 1 7 5869 1 1 3 LYS NZ N -5.600 -3.400 -5.150 1.00 . A A . 3 LYS NZ 1 1 7 5870 1 1 3 LYS O O -3.533 1.119 -5.099 1.00 . A A . 3 LYS O 1 1 7 5871 1 1 4 LYS C C -2.577 3.195 -6.998 1.00 . A A . 4 LYS C 1 1 7 5872 1 1 4 LYS CA C -3.995 2.726 -7.308 1.00 . A A . 4 LYS CA 1 1 7 5873 1 1 4 LYS CB C -4.636 3.655 -8.341 1.00 . A A . 4 LYS CB 1 1 7 5874 1 1 4 LYS CD C -5.279 3.539 -10.769 1.00 . A A . 4 LYS CD 1 1 7 5875 1 1 4 LYS CE C -4.776 4.050 -12.109 1.00 . A A . 4 LYS CE 1 1 7 5876 1 1 4 LYS CG C -4.147 3.417 -9.760 1.00 . A A . 4 LYS CG 1 1 7 5877 1 1 4 LYS H H -5.596 3.259 -6.029 1.00 . A A . 4 LYS H 1 1 7 5878 1 1 4 LYS HA H -3.951 1.727 -7.714 1.00 . A A . 4 LYS HA 1 1 7 5879 1 1 4 LYS HB2 H -5.707 3.509 -8.322 1.00 . A A . 4 LYS HB2 1 1 7 5880 1 1 4 LYS HB3 H -4.416 4.678 -8.074 1.00 . A A . 4 LYS HB3 1 1 7 5881 1 1 4 LYS HD2 H -5.727 2.567 -10.912 1.00 . A A . 4 LYS HD2 1 1 7 5882 1 1 4 LYS HD3 H -6.017 4.226 -10.384 1.00 . A A . 4 LYS HD3 1 1 7 5883 1 1 4 LYS HE2 H -3.728 3.809 -12.204 1.00 . A A . 4 LYS HE2 1 1 7 5884 1 1 4 LYS HE3 H -5.329 3.561 -12.898 1.00 . A A . 4 LYS HE3 1 1 7 5885 1 1 4 LYS HG2 H -3.387 4.146 -9.996 1.00 . A A . 4 LYS HG2 1 1 7 5886 1 1 4 LYS HG3 H -3.726 2.423 -9.823 1.00 . A A . 4 LYS HG3 1 1 7 5887 1 1 4 LYS HZ1 H -4.598 6.001 -11.385 1.00 . A A . 4 LYS HZ1 1 1 7 5888 1 1 4 LYS HZ2 H -5.950 5.757 -12.372 1.00 . A A . 4 LYS HZ2 1 1 7 5889 1 1 4 LYS HZ3 H -4.411 5.873 -13.061 1.00 . A A . 4 LYS HZ3 1 1 7 5890 1 1 4 LYS N N -4.807 2.681 -6.097 1.00 . A A . 4 LYS N 1 1 7 5891 1 1 4 LYS NZ N -4.945 5.524 -12.241 1.00 . A A . 4 LYS NZ 1 1 7 5892 1 1 4 LYS O O -1.605 2.665 -7.537 1.00 . A A . 4 LYS O 1 1 7 5893 1 1 5 ASP C C -0.301 3.670 -5.080 1.00 . A A . 5 ASP C 1 1 7 5894 1 1 5 ASP CA C -1.165 4.736 -5.747 1.00 . A A . 5 ASP CA 1 1 7 5895 1 1 5 ASP CB C -1.343 5.927 -4.806 1.00 . A A . 5 ASP CB 1 1 7 5896 1 1 5 ASP CG C -0.195 6.914 -4.897 1.00 . A A . 5 ASP CG 1 1 7 5897 1 1 5 ASP H H -3.276 4.576 -5.733 1.00 . A A . 5 ASP H 1 1 7 5898 1 1 5 ASP HA H -0.671 5.071 -6.648 1.00 . A A . 5 ASP HA 1 1 7 5899 1 1 5 ASP HB2 H -2.257 6.444 -5.058 1.00 . A A . 5 ASP HB2 1 1 7 5900 1 1 5 ASP HB3 H -1.406 5.569 -3.789 1.00 . A A . 5 ASP HB3 1 1 7 5901 1 1 5 ASP N N -2.465 4.194 -6.128 1.00 . A A . 5 ASP N 1 1 7 5902 1 1 5 ASP O O 0.870 3.503 -5.421 1.00 . A A . 5 ASP O 1 1 7 5903 1 1 5 ASP OD1 O 0.306 7.140 -6.019 1.00 . A A . 5 ASP OD1 1 1 7 5904 1 1 5 ASP OD2 O 0.204 7.459 -3.847 1.00 . A A . 5 ASP OD2 1 1 7 5905 1 1 6 VAL C C 0.371 0.854 -4.361 1.00 . A A . 6 VAL C 1 1 7 5906 1 1 6 VAL CA C -0.180 1.909 -3.407 1.00 . A A . 6 VAL CA 1 1 7 5907 1 1 6 VAL CB C -1.103 1.227 -2.382 1.00 . A A . 6 VAL CB 1 1 7 5908 1 1 6 VAL CG1 C -0.278 0.506 -1.343 1.00 . A A . 6 VAL CG1 1 1 7 5909 1 1 6 VAL CG2 C -2.030 2.237 -1.716 1.00 . A A . 6 VAL CG2 1 1 7 5910 1 1 6 VAL H H -1.817 3.131 -3.895 1.00 . A A . 6 VAL H 1 1 7 5911 1 1 6 VAL HA H 0.642 2.365 -2.874 1.00 . A A . 6 VAL HA 1 1 7 5912 1 1 6 VAL HB H -1.709 0.499 -2.899 1.00 . A A . 6 VAL HB 1 1 7 5913 1 1 6 VAL HG11 H 0.163 -0.373 -1.782 1.00 . A A . 6 VAL HG11 1 1 7 5914 1 1 6 VAL HG12 H -0.911 0.223 -0.516 1.00 . A A . 6 VAL HG12 1 1 7 5915 1 1 6 VAL HG13 H 0.501 1.166 -0.992 1.00 . A A . 6 VAL HG13 1 1 7 5916 1 1 6 VAL HG21 H -2.953 2.299 -2.274 1.00 . A A . 6 VAL HG21 1 1 7 5917 1 1 6 VAL HG22 H -1.553 3.205 -1.699 1.00 . A A . 6 VAL HG22 1 1 7 5918 1 1 6 VAL HG23 H -2.241 1.920 -0.705 1.00 . A A . 6 VAL HG23 1 1 7 5919 1 1 6 VAL N N -0.885 2.953 -4.126 1.00 . A A . 6 VAL N 1 1 7 5920 1 1 6 VAL O O 1.510 0.409 -4.219 1.00 . A A . 6 VAL O 1 1 7 5921 1 1 7 ILE C C 1.012 0.018 -7.269 1.00 . A A . 7 ILE C 1 1 7 5922 1 1 7 ILE CA C -0.036 -0.542 -6.311 1.00 . A A . 7 ILE CA 1 1 7 5923 1 1 7 ILE CB C -1.246 -1.054 -7.123 1.00 . A A . 7 ILE CB 1 1 7 5924 1 1 7 ILE CD1 C -3.483 -2.252 -6.914 1.00 . A A . 7 ILE CD1 1 1 7 5925 1 1 7 ILE CG1 C -2.271 -1.707 -6.192 1.00 . A A . 7 ILE CG1 1 1 7 5926 1 1 7 ILE CG2 C -0.795 -2.038 -8.194 1.00 . A A . 7 ILE CG2 1 1 7 5927 1 1 7 ILE H H -1.339 0.853 -5.395 1.00 . A A . 7 ILE H 1 1 7 5928 1 1 7 ILE HA H 0.390 -1.376 -5.774 1.00 . A A . 7 ILE HA 1 1 7 5929 1 1 7 ILE HB H -1.705 -0.210 -7.614 1.00 . A A . 7 ILE HB 1 1 7 5930 1 1 7 ILE HD11 H -3.397 -2.042 -7.972 1.00 . A A . 7 ILE HD11 1 1 7 5931 1 1 7 ILE HD12 H -4.375 -1.783 -6.526 1.00 . A A . 7 ILE HD12 1 1 7 5932 1 1 7 ILE HD13 H -3.542 -3.319 -6.764 1.00 . A A . 7 ILE HD13 1 1 7 5933 1 1 7 ILE HG12 H -1.802 -2.525 -5.668 1.00 . A A . 7 ILE HG12 1 1 7 5934 1 1 7 ILE HG13 H -2.612 -0.973 -5.474 1.00 . A A . 7 ILE HG13 1 1 7 5935 1 1 7 ILE HG21 H -0.309 -2.881 -7.726 1.00 . A A . 7 ILE HG21 1 1 7 5936 1 1 7 ILE HG22 H -0.104 -1.546 -8.862 1.00 . A A . 7 ILE HG22 1 1 7 5937 1 1 7 ILE HG23 H -1.654 -2.380 -8.752 1.00 . A A . 7 ILE HG23 1 1 7 5938 1 1 7 ILE N N -0.443 0.460 -5.333 1.00 . A A . 7 ILE N 1 1 7 5939 1 1 7 ILE O O 1.918 -0.694 -7.700 1.00 . A A . 7 ILE O 1 1 7 5940 1 1 8 ASP C C 3.128 2.264 -7.780 1.00 . A A . 8 ASP C 1 1 7 5941 1 1 8 ASP CA C 1.819 1.955 -8.498 1.00 . A A . 8 ASP CA 1 1 7 5942 1 1 8 ASP CB C 1.207 3.244 -9.055 1.00 . A A . 8 ASP CB 1 1 7 5943 1 1 8 ASP CG C 0.995 3.180 -10.555 1.00 . A A . 8 ASP CG 1 1 7 5944 1 1 8 ASP H H 0.145 1.817 -7.218 1.00 . A A . 8 ASP H 1 1 7 5945 1 1 8 ASP HA H 2.022 1.279 -9.314 1.00 . A A . 8 ASP HA 1 1 7 5946 1 1 8 ASP HB2 H 0.251 3.413 -8.583 1.00 . A A . 8 ASP HB2 1 1 7 5947 1 1 8 ASP HB3 H 1.864 4.074 -8.837 1.00 . A A . 8 ASP HB3 1 1 7 5948 1 1 8 ASP N N 0.883 1.300 -7.596 1.00 . A A . 8 ASP N 1 1 7 5949 1 1 8 ASP O O 4.176 2.409 -8.409 1.00 . A A . 8 ASP O 1 1 7 5950 1 1 8 ASP OD1 O 0.332 2.231 -11.021 1.00 . A A . 8 ASP OD1 1 1 7 5951 1 1 8 ASP OD2 O 1.492 4.082 -11.263 1.00 . A A . 8 ASP OD2 1 1 7 5952 1 1 9 HIS C C 5.017 1.368 -5.360 1.00 . A A . 9 HIS C 1 1 7 5953 1 1 9 HIS CA C 4.237 2.646 -5.651 1.00 . A A . 9 HIS CA 1 1 7 5954 1 1 9 HIS CB C 3.831 3.329 -4.341 1.00 . A A . 9 HIS CB 1 1 7 5955 1 1 9 HIS CD2 C 5.717 2.566 -2.727 1.00 . A A . 9 HIS CD2 1 1 7 5956 1 1 9 HIS CE1 C 6.412 4.545 -2.087 1.00 . A A . 9 HIS CE1 1 1 7 5957 1 1 9 HIS CG C 4.959 3.490 -3.365 1.00 . A A . 9 HIS CG 1 1 7 5958 1 1 9 HIS H H 2.197 2.231 -6.008 1.00 . A A . 9 HIS H 1 1 7 5959 1 1 9 HIS HA H 4.862 3.315 -6.217 1.00 . A A . 9 HIS HA 1 1 7 5960 1 1 9 HIS HB2 H 3.443 4.312 -4.562 1.00 . A A . 9 HIS HB2 1 1 7 5961 1 1 9 HIS HB3 H 3.059 2.744 -3.863 1.00 . A A . 9 HIS HB3 1 1 7 5962 1 1 9 HIS HD1 H 5.073 5.591 -3.227 1.00 . A A . 9 HIS HD1 1 1 7 5963 1 1 9 HIS HD2 H 5.632 1.493 -2.821 1.00 . A A . 9 HIS HD2 1 1 7 5964 1 1 9 HIS HE1 H 6.964 5.327 -1.589 1.00 . A A . 9 HIS HE1 1 1 7 5965 1 1 9 HIS HE2 H 7.240 2.840 -1.310 1.00 . A A . 9 HIS HE2 1 1 7 5966 1 1 9 HIS N N 3.060 2.360 -6.455 1.00 . A A . 9 HIS N 1 1 7 5967 1 1 9 HIS ND1 N 5.419 4.719 -2.942 1.00 . A A . 9 HIS ND1 1 1 7 5968 1 1 9 HIS NE2 N 6.611 3.248 -1.940 1.00 . A A . 9 HIS NE2 1 1 7 5969 1 1 9 HIS O O 6.232 1.400 -5.171 1.00 . A A . 9 HIS O 1 1 7 5970 1 1 10 PHE C C 5.323 -1.749 -6.341 1.00 . A A . 10 PHE C 1 1 7 5971 1 1 10 PHE CA C 4.936 -1.042 -5.045 1.00 . A A . 10 PHE CA 1 1 7 5972 1 1 10 PHE CB C 3.999 -1.931 -4.227 1.00 . A A . 10 PHE CB 1 1 7 5973 1 1 10 PHE CD1 C 3.732 -0.230 -2.403 1.00 . A A . 10 PHE CD1 1 1 7 5974 1 1 10 PHE CD2 C 4.066 -2.508 -1.786 1.00 . A A . 10 PHE CD2 1 1 7 5975 1 1 10 PHE CE1 C 3.668 0.126 -1.070 1.00 . A A . 10 PHE CE1 1 1 7 5976 1 1 10 PHE CE2 C 4.003 -2.158 -0.450 1.00 . A A . 10 PHE CE2 1 1 7 5977 1 1 10 PHE CG C 3.930 -1.549 -2.776 1.00 . A A . 10 PHE CG 1 1 7 5978 1 1 10 PHE CZ C 3.804 -0.839 -0.092 1.00 . A A . 10 PHE CZ 1 1 7 5979 1 1 10 PHE H H 3.341 0.280 -5.475 1.00 . A A . 10 PHE H 1 1 7 5980 1 1 10 PHE HA H 5.829 -0.854 -4.471 1.00 . A A . 10 PHE HA 1 1 7 5981 1 1 10 PHE HB2 H 3.001 -1.863 -4.636 1.00 . A A . 10 PHE HB2 1 1 7 5982 1 1 10 PHE HB3 H 4.339 -2.954 -4.287 1.00 . A A . 10 PHE HB3 1 1 7 5983 1 1 10 PHE HD1 H 3.627 0.526 -3.166 1.00 . A A . 10 PHE HD1 1 1 7 5984 1 1 10 PHE HD2 H 4.222 -3.539 -2.065 1.00 . A A . 10 PHE HD2 1 1 7 5985 1 1 10 PHE HE1 H 3.512 1.158 -0.794 1.00 . A A . 10 PHE HE1 1 1 7 5986 1 1 10 PHE HE2 H 4.110 -2.915 0.311 1.00 . A A . 10 PHE HE2 1 1 7 5987 1 1 10 PHE HZ H 3.756 -0.564 0.951 1.00 . A A . 10 PHE HZ 1 1 7 5988 1 1 10 PHE N N 4.309 0.242 -5.320 1.00 . A A . 10 PHE N 1 1 7 5989 1 1 10 PHE O O 6.449 -2.226 -6.488 1.00 . A A . 10 PHE O 1 1 7 5990 1 1 11 GLY C C 3.908 -3.788 -8.679 1.00 . A A . 11 GLY C 1 1 7 5991 1 1 11 GLY CA C 4.640 -2.467 -8.546 1.00 . A A . 11 GLY CA 1 1 7 5992 1 1 11 GLY H H 3.502 -1.418 -7.101 1.00 . A A . 11 GLY H 1 1 7 5993 1 1 11 GLY HA2 H 4.326 -1.812 -9.344 1.00 . A A . 11 GLY HA2 1 1 7 5994 1 1 11 GLY HA3 H 5.701 -2.645 -8.637 1.00 . A A . 11 GLY HA3 1 1 7 5995 1 1 11 GLY N N 4.380 -1.816 -7.276 1.00 . A A . 11 GLY N 1 1 7 5996 1 1 11 GLY O O 3.580 -4.214 -9.787 1.00 . A A . 11 GLY O 1 1 7 5997 1 1 12 THR C C 1.974 -5.800 -6.380 1.00 . A A . 12 THR C 1 1 7 5998 1 1 12 THR CA C 2.957 -5.719 -7.543 1.00 . A A . 12 THR CA 1 1 7 5999 1 1 12 THR CB C 3.962 -6.870 -7.456 1.00 . A A . 12 THR CB 1 1 7 6000 1 1 12 THR CG2 C 4.480 -7.314 -8.806 1.00 . A A . 12 THR CG2 1 1 7 6001 1 1 12 THR H H 3.941 -4.048 -6.697 1.00 . A A . 12 THR H 1 1 7 6002 1 1 12 THR HA H 2.408 -5.802 -8.468 1.00 . A A . 12 THR HA 1 1 7 6003 1 1 12 THR HB H 3.481 -7.720 -6.991 1.00 . A A . 12 THR HB 1 1 7 6004 1 1 12 THR HG1 H 5.538 -7.293 -6.375 1.00 . A A . 12 THR HG1 1 1 7 6005 1 1 12 THR HG21 H 3.716 -7.882 -9.316 1.00 . A A . 12 THR HG21 1 1 7 6006 1 1 12 THR HG22 H 5.357 -7.931 -8.670 1.00 . A A . 12 THR HG22 1 1 7 6007 1 1 12 THR HG23 H 4.739 -6.447 -9.396 1.00 . A A . 12 THR HG23 1 1 7 6008 1 1 12 THR N N 3.654 -4.439 -7.548 1.00 . A A . 12 THR N 1 1 7 6009 1 1 12 THR O O 2.066 -5.031 -5.421 1.00 . A A . 12 THR O 1 1 7 6010 1 1 12 THR OG1 O 5.078 -6.503 -6.667 1.00 . A A . 12 THR OG1 1 1 7 6011 1 1 13 GLN C C 0.625 -7.662 -4.229 1.00 . A A . 13 GLN C 1 1 7 6012 1 1 13 GLN CA C 0.034 -6.916 -5.421 1.00 . A A . 13 GLN CA 1 1 7 6013 1 1 13 GLN CB C -1.176 -7.677 -5.969 1.00 . A A . 13 GLN CB 1 1 7 6014 1 1 13 GLN CD C -3.433 -7.485 -7.087 1.00 . A A . 13 GLN CD 1 1 7 6015 1 1 13 GLN CG C -2.375 -6.787 -6.253 1.00 . A A . 13 GLN CG 1 1 7 6016 1 1 13 GLN H H 1.012 -7.318 -7.254 1.00 . A A . 13 GLN H 1 1 7 6017 1 1 13 GLN HA H -0.284 -5.937 -5.095 1.00 . A A . 13 GLN HA 1 1 7 6018 1 1 13 GLN HB2 H -0.893 -8.167 -6.888 1.00 . A A . 13 GLN HB2 1 1 7 6019 1 1 13 GLN HB3 H -1.474 -8.425 -5.249 1.00 . A A . 13 GLN HB3 1 1 7 6020 1 1 13 GLN HE21 H -4.750 -6.060 -6.652 1.00 . A A . 13 GLN HE21 1 1 7 6021 1 1 13 GLN HE22 H -5.325 -7.327 -7.675 1.00 . A A . 13 GLN HE22 1 1 7 6022 1 1 13 GLN HG2 H -2.817 -6.490 -5.315 1.00 . A A . 13 GLN HG2 1 1 7 6023 1 1 13 GLN HG3 H -2.039 -5.910 -6.786 1.00 . A A . 13 GLN HG3 1 1 7 6024 1 1 13 GLN N N 1.034 -6.734 -6.467 1.00 . A A . 13 GLN N 1 1 7 6025 1 1 13 GLN NE2 N -4.623 -6.898 -7.143 1.00 . A A . 13 GLN NE2 1 1 7 6026 1 1 13 GLN O O 0.536 -7.203 -3.089 1.00 . A A . 13 GLN O 1 1 7 6027 1 1 13 GLN OE1 O -3.183 -8.538 -7.672 1.00 . A A . 13 GLN OE1 1 1 7 6028 1 1 14 ARG C C 2.780 -8.794 -2.585 1.00 . A A . 14 ARG C 1 1 7 6029 1 1 14 ARG CA C 1.839 -9.629 -3.450 1.00 . A A . 14 ARG CA 1 1 7 6030 1 1 14 ARG CB C 2.599 -10.807 -4.065 1.00 . A A . 14 ARG CB 1 1 7 6031 1 1 14 ARG CD C 3.438 -13.101 -3.473 1.00 . A A . 14 ARG CD 1 1 7 6032 1 1 14 ARG CG C 2.255 -12.148 -3.438 1.00 . A A . 14 ARG CG 1 1 7 6033 1 1 14 ARG CZ C 4.281 -14.955 -4.861 1.00 . A A . 14 ARG CZ 1 1 7 6034 1 1 14 ARG H H 1.270 -9.128 -5.427 1.00 . A A . 14 ARG H 1 1 7 6035 1 1 14 ARG HA H 1.044 -10.012 -2.828 1.00 . A A . 14 ARG HA 1 1 7 6036 1 1 14 ARG HB2 H 2.366 -10.858 -5.119 1.00 . A A . 14 ARG HB2 1 1 7 6037 1 1 14 ARG HB3 H 3.659 -10.640 -3.948 1.00 . A A . 14 ARG HB3 1 1 7 6038 1 1 14 ARG HD2 H 4.344 -12.524 -3.591 1.00 . A A . 14 ARG HD2 1 1 7 6039 1 1 14 ARG HD3 H 3.476 -13.643 -2.540 1.00 . A A . 14 ARG HD3 1 1 7 6040 1 1 14 ARG HE H 2.532 -14.028 -5.127 1.00 . A A . 14 ARG HE 1 1 7 6041 1 1 14 ARG HG2 H 1.964 -11.989 -2.411 1.00 . A A . 14 ARG HG2 1 1 7 6042 1 1 14 ARG HG3 H 1.433 -12.589 -3.983 1.00 . A A . 14 ARG HG3 1 1 7 6043 1 1 14 ARG HH11 H 5.521 -14.397 -3.365 1.00 . A A . 14 ARG HH11 1 1 7 6044 1 1 14 ARG HH12 H 6.090 -15.699 -4.354 1.00 . A A . 14 ARG HH12 1 1 7 6045 1 1 14 ARG HH21 H 3.279 -15.741 -6.431 1.00 . A A . 14 ARG HH21 1 1 7 6046 1 1 14 ARG HH22 H 4.818 -16.463 -6.096 1.00 . A A . 14 ARG HH22 1 1 7 6047 1 1 14 ARG N N 1.231 -8.816 -4.499 1.00 . A A . 14 ARG N 1 1 7 6048 1 1 14 ARG NE N 3.341 -14.056 -4.573 1.00 . A A . 14 ARG NE 1 1 7 6049 1 1 14 ARG NH1 N 5.388 -15.023 -4.133 1.00 . A A . 14 ARG NH1 1 1 7 6050 1 1 14 ARG NH2 N 4.112 -15.787 -5.879 1.00 . A A . 14 ARG NH2 1 1 7 6051 1 1 14 ARG O O 2.948 -9.063 -1.397 1.00 . A A . 14 ARG O 1 1 7 6052 1 1 15 ALA C C 3.583 -6.117 -1.391 1.00 . A A . 15 ALA C 1 1 7 6053 1 1 15 ALA CA C 4.309 -6.904 -2.477 1.00 . A A . 15 ALA CA 1 1 7 6054 1 1 15 ALA CB C 4.996 -5.956 -3.448 1.00 . A A . 15 ALA CB 1 1 7 6055 1 1 15 ALA H H 3.211 -7.614 -4.142 1.00 . A A . 15 ALA H 1 1 7 6056 1 1 15 ALA HA H 5.066 -7.521 -2.015 1.00 . A A . 15 ALA HA 1 1 7 6057 1 1 15 ALA HB1 H 5.130 -6.450 -4.399 1.00 . A A . 15 ALA HB1 1 1 7 6058 1 1 15 ALA HB2 H 5.959 -5.670 -3.051 1.00 . A A . 15 ALA HB2 1 1 7 6059 1 1 15 ALA HB3 H 4.387 -5.074 -3.582 1.00 . A A . 15 ALA HB3 1 1 7 6060 1 1 15 ALA N N 3.387 -7.779 -3.191 1.00 . A A . 15 ALA N 1 1 7 6061 1 1 15 ALA O O 4.035 -6.054 -0.247 1.00 . A A . 15 ALA O 1 1 7 6062 1 1 16 VAL C C 1.199 -5.596 0.351 1.00 . A A . 16 VAL C 1 1 7 6063 1 1 16 VAL CA C 1.663 -4.735 -0.819 1.00 . A A . 16 VAL CA 1 1 7 6064 1 1 16 VAL CB C 0.426 -4.093 -1.487 1.00 . A A . 16 VAL CB 1 1 7 6065 1 1 16 VAL CG1 C 0.179 -2.714 -0.909 1.00 . A A . 16 VAL CG1 1 1 7 6066 1 1 16 VAL CG2 C 0.583 -4.009 -3.001 1.00 . A A . 16 VAL CG2 1 1 7 6067 1 1 16 VAL H H 2.148 -5.605 -2.681 1.00 . A A . 16 VAL H 1 1 7 6068 1 1 16 VAL HA H 2.292 -3.943 -0.439 1.00 . A A . 16 VAL HA 1 1 7 6069 1 1 16 VAL HB H -0.436 -4.709 -1.270 1.00 . A A . 16 VAL HB 1 1 7 6070 1 1 16 VAL HG11 H -0.563 -2.204 -1.503 1.00 . A A . 16 VAL HG11 1 1 7 6071 1 1 16 VAL HG12 H 1.102 -2.154 -0.922 1.00 . A A . 16 VAL HG12 1 1 7 6072 1 1 16 VAL HG13 H -0.172 -2.809 0.107 1.00 . A A . 16 VAL HG13 1 1 7 6073 1 1 16 VAL HG21 H -0.120 -3.291 -3.396 1.00 . A A . 16 VAL HG21 1 1 7 6074 1 1 16 VAL HG22 H 0.390 -4.978 -3.437 1.00 . A A . 16 VAL HG22 1 1 7 6075 1 1 16 VAL HG23 H 1.590 -3.698 -3.241 1.00 . A A . 16 VAL HG23 1 1 7 6076 1 1 16 VAL N N 2.455 -5.519 -1.758 1.00 . A A . 16 VAL N 1 1 7 6077 1 1 16 VAL O O 1.085 -5.117 1.480 1.00 . A A . 16 VAL O 1 1 7 6078 1 1 17 ALA C C 1.635 -8.267 1.969 1.00 . A A . 17 ALA C 1 1 7 6079 1 1 17 ALA CA C 0.474 -7.794 1.099 1.00 . A A . 17 ALA CA 1 1 7 6080 1 1 17 ALA CB C -0.227 -8.983 0.457 1.00 . A A . 17 ALA CB 1 1 7 6081 1 1 17 ALA H H 1.037 -7.186 -0.847 1.00 . A A . 17 ALA H 1 1 7 6082 1 1 17 ALA HA H -0.242 -7.278 1.721 1.00 . A A . 17 ALA HA 1 1 7 6083 1 1 17 ALA HB1 H 0.431 -9.839 0.468 1.00 . A A . 17 ALA HB1 1 1 7 6084 1 1 17 ALA HB2 H -0.484 -8.740 -0.563 1.00 . A A . 17 ALA HB2 1 1 7 6085 1 1 17 ALA HB3 H -1.125 -9.212 1.011 1.00 . A A . 17 ALA HB3 1 1 7 6086 1 1 17 ALA N N 0.930 -6.866 0.071 1.00 . A A . 17 ALA N 1 1 7 6087 1 1 17 ALA O O 1.445 -8.620 3.133 1.00 . A A . 17 ALA O 1 1 7 6088 1 1 18 LYS C C 4.558 -7.585 3.017 1.00 . A A . 18 LYS C 1 1 7 6089 1 1 18 LYS CA C 4.024 -8.704 2.127 1.00 . A A . 18 LYS CA 1 1 7 6090 1 1 18 LYS CB C 5.109 -9.156 1.150 1.00 . A A . 18 LYS CB 1 1 7 6091 1 1 18 LYS CD C 7.181 -10.542 0.829 1.00 . A A . 18 LYS CD 1 1 7 6092 1 1 18 LYS CE C 6.548 -11.861 0.418 1.00 . A A . 18 LYS CE 1 1 7 6093 1 1 18 LYS CG C 6.311 -9.795 1.827 1.00 . A A . 18 LYS CG 1 1 7 6094 1 1 18 LYS H H 2.924 -7.982 0.468 1.00 . A A . 18 LYS H 1 1 7 6095 1 1 18 LYS HA H 3.744 -9.540 2.751 1.00 . A A . 18 LYS HA 1 1 7 6096 1 1 18 LYS HB2 H 4.686 -9.875 0.465 1.00 . A A . 18 LYS HB2 1 1 7 6097 1 1 18 LYS HB3 H 5.452 -8.298 0.589 1.00 . A A . 18 LYS HB3 1 1 7 6098 1 1 18 LYS HD2 H 7.314 -9.929 -0.049 1.00 . A A . 18 LYS HD2 1 1 7 6099 1 1 18 LYS HD3 H 8.142 -10.741 1.282 1.00 . A A . 18 LYS HD3 1 1 7 6100 1 1 18 LYS HE2 H 6.798 -12.612 1.153 1.00 . A A . 18 LYS HE2 1 1 7 6101 1 1 18 LYS HE3 H 5.475 -11.736 0.384 1.00 . A A . 18 LYS HE3 1 1 7 6102 1 1 18 LYS HG2 H 6.903 -9.021 2.294 1.00 . A A . 18 LYS HG2 1 1 7 6103 1 1 18 LYS HG3 H 5.963 -10.487 2.579 1.00 . A A . 18 LYS HG3 1 1 7 6104 1 1 18 LYS HZ1 H 7.967 -12.750 -0.833 1.00 . A A . 18 LYS HZ1 1 1 7 6105 1 1 18 LYS HZ2 H 7.087 -11.506 -1.569 1.00 . A A . 18 LYS HZ2 1 1 7 6106 1 1 18 LYS HZ3 H 6.366 -13.014 -1.316 1.00 . A A . 18 LYS HZ3 1 1 7 6107 1 1 18 LYS N N 2.836 -8.273 1.400 1.00 . A A . 18 LYS N 1 1 7 6108 1 1 18 LYS NZ N 7.025 -12.314 -0.919 1.00 . A A . 18 LYS NZ 1 1 7 6109 1 1 18 LYS O O 5.170 -7.842 4.053 1.00 . A A . 18 LYS O 1 1 7 6110 1 1 19 ALA C C 4.005 -5.037 4.669 1.00 . A A . 19 ALA C 1 1 7 6111 1 1 19 ALA CA C 4.784 -5.186 3.366 1.00 . A A . 19 ALA CA 1 1 7 6112 1 1 19 ALA CB C 4.662 -3.923 2.529 1.00 . A A . 19 ALA CB 1 1 7 6113 1 1 19 ALA H H 3.832 -6.200 1.770 1.00 . A A . 19 ALA H 1 1 7 6114 1 1 19 ALA HA H 5.829 -5.336 3.599 1.00 . A A . 19 ALA HA 1 1 7 6115 1 1 19 ALA HB1 H 3.723 -3.935 1.994 1.00 . A A . 19 ALA HB1 1 1 7 6116 1 1 19 ALA HB2 H 5.478 -3.879 1.822 1.00 . A A . 19 ALA HB2 1 1 7 6117 1 1 19 ALA HB3 H 4.698 -3.058 3.174 1.00 . A A . 19 ALA HB3 1 1 7 6118 1 1 19 ALA N N 4.324 -6.343 2.606 1.00 . A A . 19 ALA N 1 1 7 6119 1 1 19 ALA O O 4.593 -4.913 5.744 1.00 . A A . 19 ALA O 1 1 7 6120 1 1 20 LEU C C 1.696 -6.230 6.484 1.00 . A A . 20 LEU C 1 1 7 6121 1 1 20 LEU CA C 1.823 -4.905 5.739 1.00 . A A . 20 LEU CA 1 1 7 6122 1 1 20 LEU CB C 0.438 -4.404 5.327 1.00 . A A . 20 LEU CB 1 1 7 6123 1 1 20 LEU CD1 C -0.905 -3.001 3.743 1.00 . A A . 20 LEU CD1 1 1 7 6124 1 1 20 LEU CD2 C 0.762 -1.920 5.261 1.00 . A A . 20 LEU CD2 1 1 7 6125 1 1 20 LEU CG C 0.438 -3.159 4.440 1.00 . A A . 20 LEU CG 1 1 7 6126 1 1 20 LEU H H 2.268 -5.144 3.683 1.00 . A A . 20 LEU H 1 1 7 6127 1 1 20 LEU HA H 2.276 -4.179 6.396 1.00 . A A . 20 LEU HA 1 1 7 6128 1 1 20 LEU HB2 H -0.066 -5.200 4.797 1.00 . A A . 20 LEU HB2 1 1 7 6129 1 1 20 LEU HB3 H -0.123 -4.181 6.222 1.00 . A A . 20 LEU HB3 1 1 7 6130 1 1 20 LEU HD11 H -1.126 -1.951 3.623 1.00 . A A . 20 LEU HD11 1 1 7 6131 1 1 20 LEU HD12 H -1.677 -3.466 4.337 1.00 . A A . 20 LEU HD12 1 1 7 6132 1 1 20 LEU HD13 H -0.864 -3.473 2.772 1.00 . A A . 20 LEU HD13 1 1 7 6133 1 1 20 LEU HD21 H -0.033 -1.737 5.967 1.00 . A A . 20 LEU HD21 1 1 7 6134 1 1 20 LEU HD22 H 0.867 -1.070 4.604 1.00 . A A . 20 LEU HD22 1 1 7 6135 1 1 20 LEU HD23 H 1.688 -2.077 5.796 1.00 . A A . 20 LEU HD23 1 1 7 6136 1 1 20 LEU HG H 1.197 -3.267 3.679 1.00 . A A . 20 LEU HG 1 1 7 6137 1 1 20 LEU N N 2.680 -5.043 4.567 1.00 . A A . 20 LEU N 1 1 7 6138 1 1 20 LEU O O 1.594 -6.255 7.711 1.00 . A A . 20 LEU O 1 1 7 6139 1 1 21 GLY C C 0.258 -9.302 6.049 1.00 . A A . 21 GLY C 1 1 7 6140 1 1 21 GLY CA C 1.590 -8.639 6.343 1.00 . A A . 21 GLY CA 1 1 7 6141 1 1 21 GLY H H 1.790 -7.245 4.764 1.00 . A A . 21 GLY H 1 1 7 6142 1 1 21 GLY HA2 H 2.382 -9.269 5.966 1.00 . A A . 21 GLY HA2 1 1 7 6143 1 1 21 GLY HA3 H 1.701 -8.541 7.414 1.00 . A A . 21 GLY HA3 1 1 7 6144 1 1 21 GLY N N 1.705 -7.326 5.737 1.00 . A A . 21 GLY N 1 1 7 6145 1 1 21 GLY O O -0.195 -10.163 6.804 1.00 . A A . 21 GLY O 1 1 7 6146 1 1 22 ILE C C -1.529 -10.282 3.278 1.00 . A A . 22 ILE C 1 1 7 6147 1 1 22 ILE CA C -1.657 -9.460 4.555 1.00 . A A . 22 ILE CA 1 1 7 6148 1 1 22 ILE CB C -2.709 -8.354 4.340 1.00 . A A . 22 ILE CB 1 1 7 6149 1 1 22 ILE CD1 C -3.225 -6.257 2.992 1.00 . A A . 22 ILE CD1 1 1 7 6150 1 1 22 ILE CG1 C -2.239 -7.371 3.266 1.00 . A A . 22 ILE CG1 1 1 7 6151 1 1 22 ILE CG2 C -2.989 -7.626 5.646 1.00 . A A . 22 ILE CG2 1 1 7 6152 1 1 22 ILE H H 0.041 -8.212 4.387 1.00 . A A . 22 ILE H 1 1 7 6153 1 1 22 ILE HA H -2.000 -10.103 5.353 1.00 . A A . 22 ILE HA 1 1 7 6154 1 1 22 ILE HB H -3.627 -8.819 4.014 1.00 . A A . 22 ILE HB 1 1 7 6155 1 1 22 ILE HD11 H -4.220 -6.669 2.910 1.00 . A A . 22 ILE HD11 1 1 7 6156 1 1 22 ILE HD12 H -2.963 -5.762 2.069 1.00 . A A . 22 ILE HD12 1 1 7 6157 1 1 22 ILE HD13 H -3.197 -5.544 3.803 1.00 . A A . 22 ILE HD13 1 1 7 6158 1 1 22 ILE HG12 H -1.310 -6.919 3.583 1.00 . A A . 22 ILE HG12 1 1 7 6159 1 1 22 ILE HG13 H -2.077 -7.907 2.342 1.00 . A A . 22 ILE HG13 1 1 7 6160 1 1 22 ILE HG21 H -3.506 -6.702 5.440 1.00 . A A . 22 ILE HG21 1 1 7 6161 1 1 22 ILE HG22 H -2.055 -7.414 6.146 1.00 . A A . 22 ILE HG22 1 1 7 6162 1 1 22 ILE HG23 H -3.601 -8.250 6.282 1.00 . A A . 22 ILE HG23 1 1 7 6163 1 1 22 ILE N N -0.371 -8.900 4.949 1.00 . A A . 22 ILE N 1 1 7 6164 1 1 22 ILE O O -0.432 -10.451 2.746 1.00 . A A . 22 ILE O 1 1 7 6165 1 1 23 SER C C -2.991 -10.737 0.358 1.00 . A A . 23 SER C 1 1 7 6166 1 1 23 SER CA C -2.664 -11.598 1.575 1.00 . A A . 23 SER CA 1 1 7 6167 1 1 23 SER CB C -3.681 -12.735 1.699 1.00 . A A . 23 SER CB 1 1 7 6168 1 1 23 SER H H -3.498 -10.625 3.259 1.00 . A A . 23 SER H 1 1 7 6169 1 1 23 SER HA H -1.678 -12.020 1.448 1.00 . A A . 23 SER HA 1 1 7 6170 1 1 23 SER HB2 H -3.730 -13.274 0.765 1.00 . A A . 23 SER HB2 1 1 7 6171 1 1 23 SER HB3 H -3.370 -13.406 2.487 1.00 . A A . 23 SER HB3 1 1 7 6172 1 1 23 SER HG H -5.504 -12.215 1.209 1.00 . A A . 23 SER HG 1 1 7 6173 1 1 23 SER N N -2.654 -10.793 2.791 1.00 . A A . 23 SER N 1 1 7 6174 1 1 23 SER O O -3.574 -9.660 0.486 1.00 . A A . 23 SER O 1 1 7 6175 1 1 23 SER OG O -4.970 -12.235 2.006 1.00 . A A . 23 SER OG 1 1 7 6176 1 1 24 ASP C C -4.360 -10.228 -2.244 1.00 . A A . 24 ASP C 1 1 7 6177 1 1 24 ASP CA C -2.868 -10.493 -2.061 1.00 . A A . 24 ASP CA 1 1 7 6178 1 1 24 ASP CB C -2.328 -11.280 -3.258 1.00 . A A . 24 ASP CB 1 1 7 6179 1 1 24 ASP CG C -2.750 -12.735 -3.232 1.00 . A A . 24 ASP CG 1 1 7 6180 1 1 24 ASP H H -2.154 -12.085 -0.860 1.00 . A A . 24 ASP H 1 1 7 6181 1 1 24 ASP HA H -2.351 -9.547 -2.002 1.00 . A A . 24 ASP HA 1 1 7 6182 1 1 24 ASP HB2 H -2.698 -10.834 -4.169 1.00 . A A . 24 ASP HB2 1 1 7 6183 1 1 24 ASP HB3 H -1.249 -11.237 -3.253 1.00 . A A . 24 ASP HB3 1 1 7 6184 1 1 24 ASP N N -2.615 -11.220 -0.822 1.00 . A A . 24 ASP N 1 1 7 6185 1 1 24 ASP O O -4.754 -9.232 -2.851 1.00 . A A . 24 ASP O 1 1 7 6186 1 1 24 ASP OD1 O -2.152 -13.513 -2.461 1.00 . A A . 24 ASP OD1 1 1 7 6187 1 1 24 ASP OD2 O -3.681 -13.097 -3.984 1.00 . A A . 24 ASP OD2 1 1 7 6188 1 1 25 ALA C C -7.118 -9.727 -1.110 1.00 . A A . 25 ALA C 1 1 7 6189 1 1 25 ALA CA C -6.633 -10.987 -1.818 1.00 . A A . 25 ALA CA 1 1 7 6190 1 1 25 ALA CB C -7.321 -12.216 -1.243 1.00 . A A . 25 ALA CB 1 1 7 6191 1 1 25 ALA H H -4.812 -11.899 -1.241 1.00 . A A . 25 ALA H 1 1 7 6192 1 1 25 ALA HA H -6.885 -10.920 -2.866 1.00 . A A . 25 ALA HA 1 1 7 6193 1 1 25 ALA HB1 H -6.855 -13.107 -1.636 1.00 . A A . 25 ALA HB1 1 1 7 6194 1 1 25 ALA HB2 H -8.365 -12.206 -1.518 1.00 . A A . 25 ALA HB2 1 1 7 6195 1 1 25 ALA HB3 H -7.232 -12.208 -0.167 1.00 . A A . 25 ALA HB3 1 1 7 6196 1 1 25 ALA N N -5.185 -11.126 -1.713 1.00 . A A . 25 ALA N 1 1 7 6197 1 1 25 ALA O O -7.949 -8.989 -1.636 1.00 . A A . 25 ALA O 1 1 7 6198 1 1 26 ALA C C -6.666 -7.030 0.110 1.00 . A A . 26 ALA C 1 1 7 6199 1 1 26 ALA CA C -6.972 -8.316 0.868 1.00 . A A . 26 ALA CA 1 1 7 6200 1 1 26 ALA CB C -6.256 -8.323 2.211 1.00 . A A . 26 ALA CB 1 1 7 6201 1 1 26 ALA H H -5.934 -10.114 0.454 1.00 . A A . 26 ALA H 1 1 7 6202 1 1 26 ALA HA H -8.036 -8.370 1.054 1.00 . A A . 26 ALA HA 1 1 7 6203 1 1 26 ALA HB1 H -6.509 -7.426 2.756 1.00 . A A . 26 ALA HB1 1 1 7 6204 1 1 26 ALA HB2 H -5.189 -8.357 2.050 1.00 . A A . 26 ALA HB2 1 1 7 6205 1 1 26 ALA HB3 H -6.561 -9.189 2.778 1.00 . A A . 26 ALA HB3 1 1 7 6206 1 1 26 ALA N N -6.592 -9.488 0.088 1.00 . A A . 26 ALA N 1 1 7 6207 1 1 26 ALA O O -7.488 -6.113 0.065 1.00 . A A . 26 ALA O 1 1 7 6208 1 1 27 VAL C C -5.997 -5.547 -2.428 1.00 . A A . 27 VAL C 1 1 7 6209 1 1 27 VAL CA C -5.067 -5.793 -1.244 1.00 . A A . 27 VAL CA 1 1 7 6210 1 1 27 VAL CB C -3.619 -5.940 -1.756 1.00 . A A . 27 VAL CB 1 1 7 6211 1 1 27 VAL CG1 C -3.190 -4.700 -2.529 1.00 . A A . 27 VAL CG1 1 1 7 6212 1 1 27 VAL CG2 C -2.671 -6.207 -0.596 1.00 . A A . 27 VAL CG2 1 1 7 6213 1 1 27 VAL H H -4.870 -7.730 -0.415 1.00 . A A . 27 VAL H 1 1 7 6214 1 1 27 VAL HA H -5.109 -4.939 -0.583 1.00 . A A . 27 VAL HA 1 1 7 6215 1 1 27 VAL HB H -3.580 -6.786 -2.427 1.00 . A A . 27 VAL HB 1 1 7 6216 1 1 27 VAL HG11 H -2.126 -4.739 -2.707 1.00 . A A . 27 VAL HG11 1 1 7 6217 1 1 27 VAL HG12 H -3.428 -3.818 -1.954 1.00 . A A . 27 VAL HG12 1 1 7 6218 1 1 27 VAL HG13 H -3.714 -4.666 -3.473 1.00 . A A . 27 VAL HG13 1 1 7 6219 1 1 27 VAL HG21 H -1.657 -6.261 -0.966 1.00 . A A . 27 VAL HG21 1 1 7 6220 1 1 27 VAL HG22 H -2.932 -7.143 -0.126 1.00 . A A . 27 VAL HG22 1 1 7 6221 1 1 27 VAL HG23 H -2.748 -5.405 0.123 1.00 . A A . 27 VAL HG23 1 1 7 6222 1 1 27 VAL N N -5.481 -6.967 -0.486 1.00 . A A . 27 VAL N 1 1 7 6223 1 1 27 VAL O O -6.359 -4.408 -2.719 1.00 . A A . 27 VAL O 1 1 7 6224 1 1 28 SER C C -8.663 -6.065 -3.832 1.00 . A A . 28 SER C 1 1 7 6225 1 1 28 SER CA C -7.270 -6.520 -4.259 1.00 . A A . 28 SER CA 1 1 7 6226 1 1 28 SER CB C -7.359 -7.864 -4.985 1.00 . A A . 28 SER CB 1 1 7 6227 1 1 28 SER H H -6.061 -7.506 -2.828 1.00 . A A . 28 SER H 1 1 7 6228 1 1 28 SER HA H -6.856 -5.785 -4.932 1.00 . A A . 28 SER HA 1 1 7 6229 1 1 28 SER HB2 H -8.249 -7.882 -5.596 1.00 . A A . 28 SER HB2 1 1 7 6230 1 1 28 SER HB3 H -6.489 -7.991 -5.611 1.00 . A A . 28 SER HB3 1 1 7 6231 1 1 28 SER HG H -6.529 -9.189 -3.805 1.00 . A A . 28 SER HG 1 1 7 6232 1 1 28 SER N N -6.382 -6.623 -3.107 1.00 . A A . 28 SER N 1 1 7 6233 1 1 28 SER O O -9.379 -5.423 -4.601 1.00 . A A . 28 SER O 1 1 7 6234 1 1 28 SER OG O -7.419 -8.939 -4.062 1.00 . A A . 28 SER OG 1 1 7 6235 1 1 29 GLN C C -10.420 -4.526 -1.811 1.00 . A A . 29 GLN C 1 1 7 6236 1 1 29 GLN CA C -10.340 -6.028 -2.073 1.00 . A A . 29 GLN CA 1 1 7 6237 1 1 29 GLN CB C -10.630 -6.800 -0.784 1.00 . A A . 29 GLN CB 1 1 7 6238 1 1 29 GLN CD C -11.100 -9.207 -0.175 1.00 . A A . 29 GLN CD 1 1 7 6239 1 1 29 GLN CG C -11.540 -8.005 -0.989 1.00 . A A . 29 GLN CG 1 1 7 6240 1 1 29 GLN H H -8.426 -6.914 -2.037 1.00 . A A . 29 GLN H 1 1 7 6241 1 1 29 GLN HA H -11.080 -6.290 -2.812 1.00 . A A . 29 GLN HA 1 1 7 6242 1 1 29 GLN HB2 H -9.702 -7.145 -0.368 1.00 . A A . 29 GLN HB2 1 1 7 6243 1 1 29 GLN HB3 H -11.110 -6.136 -0.077 1.00 . A A . 29 GLN HB3 1 1 7 6244 1 1 29 GLN HE21 H -12.080 -10.425 -1.398 1.00 . A A . 29 GLN HE21 1 1 7 6245 1 1 29 GLN HE22 H -11.250 -11.187 -0.090 1.00 . A A . 29 GLN HE22 1 1 7 6246 1 1 29 GLN HG2 H -12.540 -7.738 -0.695 1.00 . A A . 29 GLN HG2 1 1 7 6247 1 1 29 GLN HG3 H -11.530 -8.272 -2.035 1.00 . A A . 29 GLN HG3 1 1 7 6248 1 1 29 GLN N N -9.040 -6.402 -2.603 1.00 . A A . 29 GLN N 1 1 7 6249 1 1 29 GLN NE2 N -11.520 -10.393 -0.597 1.00 . A A . 29 GLN NE2 1 1 7 6250 1 1 29 GLN O O -11.510 -3.958 -1.734 1.00 . A A . 29 GLN O 1 1 7 6251 1 1 29 GLN OE1 O -10.390 -9.071 0.822 1.00 . A A . 29 GLN OE1 1 1 7 6252 1 1 30 TRP C C -10.030 -1.676 -2.440 1.00 . A A . 30 TRP C 1 1 7 6253 1 1 30 TRP CA C -9.211 -2.449 -1.418 1.00 . A A . 30 TRP CA 1 1 7 6254 1 1 30 TRP CB C -7.760 -1.960 -1.451 1.00 . A A . 30 TRP CB 1 1 7 6255 1 1 30 TRP CD1 C -7.475 -2.759 0.971 1.00 . A A . 30 TRP CD1 1 1 7 6256 1 1 30 TRP CD2 C -5.559 -2.224 -0.055 1.00 . A A . 30 TRP CD2 1 1 7 6257 1 1 30 TRP CE2 C -5.263 -2.643 1.255 1.00 . A A . 30 TRP CE2 1 1 7 6258 1 1 30 TRP CE3 C -4.508 -1.837 -0.893 1.00 . A A . 30 TRP CE3 1 1 7 6259 1 1 30 TRP CG C -6.980 -2.306 -0.219 1.00 . A A . 30 TRP CG 1 1 7 6260 1 1 30 TRP CH2 C -2.953 -2.303 0.906 1.00 . A A . 30 TRP CH2 1 1 7 6261 1 1 30 TRP CZ2 C -3.960 -2.687 1.747 1.00 . A A . 30 TRP CZ2 1 1 7 6262 1 1 30 TRP CZ3 C -3.217 -1.880 -0.402 1.00 . A A . 30 TRP CZ3 1 1 7 6263 1 1 30 TRP H H -8.431 -4.390 -1.742 1.00 . A A . 30 TRP H 1 1 7 6264 1 1 30 TRP HA H -9.618 -2.271 -0.433 1.00 . A A . 30 TRP HA 1 1 7 6265 1 1 30 TRP HB2 H -7.258 -2.406 -2.297 1.00 . A A . 30 TRP HB2 1 1 7 6266 1 1 30 TRP HB3 H -7.753 -0.885 -1.562 1.00 . A A . 30 TRP HB3 1 1 7 6267 1 1 30 TRP HD1 H -8.524 -2.928 1.170 1.00 . A A . 30 TRP HD1 1 1 7 6268 1 1 30 TRP HE1 H -6.550 -3.287 2.782 1.00 . A A . 30 TRP HE1 1 1 7 6269 1 1 30 TRP HE3 H -4.693 -1.509 -1.904 1.00 . A A . 30 TRP HE3 1 1 7 6270 1 1 30 TRP HH2 H -1.928 -2.320 1.246 1.00 . A A . 30 TRP HH2 1 1 7 6271 1 1 30 TRP HZ2 H -3.740 -3.011 2.753 1.00 . A A . 30 TRP HZ2 1 1 7 6272 1 1 30 TRP HZ3 H -2.393 -1.586 -1.034 1.00 . A A . 30 TRP HZ3 1 1 7 6273 1 1 30 TRP N N -9.266 -3.885 -1.672 1.00 . A A . 30 TRP N 1 1 7 6274 1 1 30 TRP NE1 N -6.449 -2.964 1.862 1.00 . A A . 30 TRP NE1 1 1 7 6275 1 1 30 TRP O O -10.010 -1.979 -3.632 1.00 . A A . 30 TRP O 1 1 7 6276 1 1 31 LYS C C -10.850 1.390 -3.291 1.00 . A A . 31 LYS C 1 1 7 6277 1 1 31 LYS CA C -11.600 0.142 -2.835 1.00 . A A . 31 LYS CA 1 1 7 6278 1 1 31 LYS CB C -12.890 0.538 -2.110 1.00 . A A . 31 LYS CB 1 1 7 6279 1 1 31 LYS CD C -13.590 1.116 0.234 1.00 . A A . 31 LYS CD 1 1 7 6280 1 1 31 LYS CE C -13.130 1.763 1.530 1.00 . A A . 31 LYS CE 1 1 7 6281 1 1 31 LYS CG C -12.670 1.459 -0.921 1.00 . A A . 31 LYS CG 1 1 7 6282 1 1 31 LYS H H -10.750 -0.482 -1.004 1.00 . A A . 31 LYS H 1 1 7 6283 1 1 31 LYS HA H -11.860 -0.449 -3.703 1.00 . A A . 31 LYS HA 1 1 7 6284 1 1 31 LYS HB2 H -13.550 1.039 -2.807 1.00 . A A . 31 LYS HB2 1 1 7 6285 1 1 31 LYS HB3 H -13.380 -0.358 -1.755 1.00 . A A . 31 LYS HB3 1 1 7 6286 1 1 31 LYS HD2 H -14.590 1.466 0.002 1.00 . A A . 31 LYS HD2 1 1 7 6287 1 1 31 LYS HD3 H -13.610 0.043 0.363 1.00 . A A . 31 LYS HD3 1 1 7 6288 1 1 31 LYS HE2 H -12.060 1.884 1.497 1.00 . A A . 31 LYS HE2 1 1 7 6289 1 1 31 LYS HE3 H -13.600 2.732 1.620 1.00 . A A . 31 LYS HE3 1 1 7 6290 1 1 31 LYS HG2 H -11.640 1.360 -0.590 1.00 . A A . 31 LYS HG2 1 1 7 6291 1 1 31 LYS HG3 H -12.850 2.478 -1.227 1.00 . A A . 31 LYS HG3 1 1 7 6292 1 1 31 LYS HZ1 H -12.680 0.361 3.011 1.00 . A A . 31 LYS HZ1 1 1 7 6293 1 1 31 LYS HZ2 H -14.290 0.311 2.494 1.00 . A A . 31 LYS HZ2 1 1 7 6294 1 1 31 LYS HZ3 H -13.760 1.557 3.511 1.00 . A A . 31 LYS HZ3 1 1 7 6295 1 1 31 LYS N N -10.770 -0.676 -1.965 1.00 . A A . 31 LYS N 1 1 7 6296 1 1 31 LYS NZ N -13.490 0.940 2.719 1.00 . A A . 31 LYS NZ 1 1 7 6297 1 1 31 LYS O O -9.638 1.485 -3.128 1.00 . A A . 31 LYS O 1 1 7 6298 1 1 32 GLU C C -10.080 4.214 -3.277 1.00 . A A . 32 GLU C 1 1 7 6299 1 1 32 GLU CA C -10.980 3.586 -4.344 1.00 . A A . 32 GLU CA 1 1 7 6300 1 1 32 GLU CB C -12.070 4.577 -4.764 1.00 . A A . 32 GLU CB 1 1 7 6301 1 1 32 GLU CD C -13.560 4.631 -6.799 1.00 . A A . 32 GLU CD 1 1 7 6302 1 1 32 GLU CG C -12.150 4.788 -6.267 1.00 . A A . 32 GLU CG 1 1 7 6303 1 1 32 GLU H H -12.540 2.213 -3.968 1.00 . A A . 32 GLU H 1 1 7 6304 1 1 32 GLU HA H -10.370 3.347 -5.206 1.00 . A A . 32 GLU HA 1 1 7 6305 1 1 32 GLU HB2 H -13.020 4.210 -4.417 1.00 . A A . 32 GLU HB2 1 1 7 6306 1 1 32 GLU HB3 H -11.870 5.532 -4.299 1.00 . A A . 32 GLU HB3 1 1 7 6307 1 1 32 GLU HG2 H -11.800 5.782 -6.498 1.00 . A A . 32 GLU HG2 1 1 7 6308 1 1 32 GLU HG3 H -11.510 4.063 -6.754 1.00 . A A . 32 GLU HG3 1 1 7 6309 1 1 32 GLU N N -11.580 2.346 -3.865 1.00 . A A . 32 GLU N 1 1 7 6310 1 1 32 GLU O O -9.126 4.917 -3.593 1.00 . A A . 32 GLU O 1 1 7 6311 1 1 32 GLU OE1 O -14.510 5.011 -6.083 1.00 . A A . 32 GLU OE1 1 1 7 6312 1 1 32 GLU OE2 O -13.720 4.129 -7.933 1.00 . A A . 32 GLU OE2 1 1 7 6313 1 1 33 VAL C C -9.224 3.376 0.063 1.00 . A A . 33 VAL C 1 1 7 6314 1 1 33 VAL CA C -9.628 4.487 -0.901 1.00 . A A . 33 VAL CA 1 1 7 6315 1 1 33 VAL CB C -10.410 5.561 -0.129 1.00 . A A . 33 VAL CB 1 1 7 6316 1 1 33 VAL CG1 C -9.511 6.289 0.850 1.00 . A A . 33 VAL CG1 1 1 7 6317 1 1 33 VAL CG2 C -11.060 6.543 -1.092 1.00 . A A . 33 VAL CG2 1 1 7 6318 1 1 33 VAL H H -11.180 3.382 -1.824 1.00 . A A . 33 VAL H 1 1 7 6319 1 1 33 VAL HA H -8.736 4.944 -1.306 1.00 . A A . 33 VAL HA 1 1 7 6320 1 1 33 VAL HB H -11.190 5.071 0.433 1.00 . A A . 33 VAL HB 1 1 7 6321 1 1 33 VAL HG11 H -8.526 6.395 0.420 1.00 . A A . 33 VAL HG11 1 1 7 6322 1 1 33 VAL HG12 H -9.443 5.721 1.766 1.00 . A A . 33 VAL HG12 1 1 7 6323 1 1 33 VAL HG13 H -9.920 7.266 1.062 1.00 . A A . 33 VAL HG13 1 1 7 6324 1 1 33 VAL HG21 H -12.080 6.227 -1.298 1.00 . A A . 33 VAL HG21 1 1 7 6325 1 1 33 VAL HG22 H -10.500 6.570 -2.014 1.00 . A A . 33 VAL HG22 1 1 7 6326 1 1 33 VAL HG23 H -11.080 7.528 -0.648 1.00 . A A . 33 VAL HG23 1 1 7 6327 1 1 33 VAL N N -10.400 3.951 -2.013 1.00 . A A . 33 VAL N 1 1 7 6328 1 1 33 VAL O O -10.070 2.693 0.630 1.00 . A A . 33 VAL O 1 1 7 6329 1 1 34 ILE C C -7.892 2.383 2.569 1.00 . A A . 34 ILE C 1 1 7 6330 1 1 34 ILE CA C -7.406 2.168 1.140 1.00 . A A . 34 ILE CA 1 1 7 6331 1 1 34 ILE CB C -5.865 2.123 1.139 1.00 . A A . 34 ILE CB 1 1 7 6332 1 1 34 ILE CD1 C -3.861 3.584 1.703 1.00 . A A . 34 ILE CD1 1 1 7 6333 1 1 34 ILE CG1 C -5.287 3.538 1.201 1.00 . A A . 34 ILE CG1 1 1 7 6334 1 1 34 ILE CG2 C -5.356 1.393 -0.093 1.00 . A A . 34 ILE CG2 1 1 7 6335 1 1 34 ILE H H -7.286 3.775 -0.237 1.00 . A A . 34 ILE H 1 1 7 6336 1 1 34 ILE HA H -7.771 1.213 0.787 1.00 . A A . 34 ILE HA 1 1 7 6337 1 1 34 ILE HB H -5.543 1.573 2.009 1.00 . A A . 34 ILE HB 1 1 7 6338 1 1 34 ILE HD11 H -3.796 3.070 2.650 1.00 . A A . 34 ILE HD11 1 1 7 6339 1 1 34 ILE HD12 H -3.557 4.613 1.830 1.00 . A A . 34 ILE HD12 1 1 7 6340 1 1 34 ILE HD13 H -3.212 3.102 0.987 1.00 . A A . 34 ILE HD13 1 1 7 6341 1 1 34 ILE HG12 H -5.305 3.972 0.214 1.00 . A A . 34 ILE HG12 1 1 7 6342 1 1 34 ILE HG13 H -5.892 4.138 1.865 1.00 . A A . 34 ILE HG13 1 1 7 6343 1 1 34 ILE HG21 H -4.406 0.929 0.131 1.00 . A A . 34 ILE HG21 1 1 7 6344 1 1 34 ILE HG22 H -5.229 2.097 -0.902 1.00 . A A . 34 ILE HG22 1 1 7 6345 1 1 34 ILE HG23 H -6.069 0.636 -0.383 1.00 . A A . 34 ILE HG23 1 1 7 6346 1 1 34 ILE N N -7.919 3.200 0.243 1.00 . A A . 34 ILE N 1 1 7 6347 1 1 34 ILE O O -8.235 3.501 2.956 1.00 . A A . 34 ILE O 1 1 7 6348 1 1 35 PRO C C -7.629 2.451 5.564 1.00 . A A . 35 PRO C 1 1 7 6349 1 1 35 PRO CA C -8.378 1.383 4.772 1.00 . A A . 35 PRO CA 1 1 7 6350 1 1 35 PRO CB C -8.063 -0.010 5.324 1.00 . A A . 35 PRO CB 1 1 7 6351 1 1 35 PRO CD C -7.540 -0.061 2.994 1.00 . A A . 35 PRO CD 1 1 7 6352 1 1 35 PRO CG C -8.059 -0.898 4.128 1.00 . A A . 35 PRO CG 1 1 7 6353 1 1 35 PRO HA H -9.440 1.568 4.836 1.00 . A A . 35 PRO HA 1 1 7 6354 1 1 35 PRO HB2 H -7.101 0.002 5.811 1.00 . A A . 35 PRO HB2 1 1 7 6355 1 1 35 PRO HB3 H -8.829 -0.301 6.029 1.00 . A A . 35 PRO HB3 1 1 7 6356 1 1 35 PRO HD2 H -6.466 -0.150 2.921 1.00 . A A . 35 PRO HD2 1 1 7 6357 1 1 35 PRO HD3 H -8.009 -0.349 2.066 1.00 . A A . 35 PRO HD3 1 1 7 6358 1 1 35 PRO HG2 H -7.409 -1.743 4.301 1.00 . A A . 35 PRO HG2 1 1 7 6359 1 1 35 PRO HG3 H -9.064 -1.234 3.917 1.00 . A A . 35 PRO HG3 1 1 7 6360 1 1 35 PRO N N -7.930 1.308 3.378 1.00 . A A . 35 PRO N 1 1 7 6361 1 1 35 PRO O O -6.758 3.138 5.029 1.00 . A A . 35 PRO O 1 1 7 6362 1 1 36 GLU C C -5.999 3.046 8.229 1.00 . A A . 36 GLU C 1 1 7 6363 1 1 36 GLU CA C -7.335 3.568 7.706 1.00 . A A . 36 GLU CA 1 1 7 6364 1 1 36 GLU CB C -8.254 3.918 8.879 1.00 . A A . 36 GLU CB 1 1 7 6365 1 1 36 GLU CD C -8.587 5.261 10.994 1.00 . A A . 36 GLU CD 1 1 7 6366 1 1 36 GLU CG C -7.641 4.903 9.864 1.00 . A A . 36 GLU CG 1 1 7 6367 1 1 36 GLU H H -8.674 2.007 7.209 1.00 . A A . 36 GLU H 1 1 7 6368 1 1 36 GLU HA H -7.156 4.457 7.122 1.00 . A A . 36 GLU HA 1 1 7 6369 1 1 36 GLU HB2 H -9.164 4.351 8.490 1.00 . A A . 36 GLU HB2 1 1 7 6370 1 1 36 GLU HB3 H -8.497 3.012 9.414 1.00 . A A . 36 GLU HB3 1 1 7 6371 1 1 36 GLU HG2 H -6.752 4.463 10.287 1.00 . A A . 36 GLU HG2 1 1 7 6372 1 1 36 GLU HG3 H -7.378 5.807 9.333 1.00 . A A . 36 GLU HG3 1 1 7 6373 1 1 36 GLU N N -7.974 2.583 6.840 1.00 . A A . 36 GLU N 1 1 7 6374 1 1 36 GLU O O -4.971 3.714 8.110 1.00 . A A . 36 GLU O 1 1 7 6375 1 1 36 GLU OE1 O -8.793 4.414 11.887 1.00 . A A . 36 GLU OE1 1 1 7 6376 1 1 36 GLU OE2 O -9.122 6.390 10.985 1.00 . A A . 36 GLU OE2 1 1 7 6377 1 1 37 LYS C C -3.829 0.888 8.243 1.00 . A A . 37 LYS C 1 1 7 6378 1 1 37 LYS CA C -4.812 1.243 9.352 1.00 . A A . 37 LYS CA 1 1 7 6379 1 1 37 LYS CB C -5.162 -0.007 10.162 1.00 . A A . 37 LYS CB 1 1 7 6380 1 1 37 LYS CD C -6.682 -1.075 11.854 1.00 . A A . 37 LYS CD 1 1 7 6381 1 1 37 LYS CE C -5.718 -1.527 12.939 1.00 . A A . 37 LYS CE 1 1 7 6382 1 1 37 LYS CG C -6.231 0.229 11.217 1.00 . A A . 37 LYS CG 1 1 7 6383 1 1 37 LYS H H -6.872 1.368 8.877 1.00 . A A . 37 LYS H 1 1 7 6384 1 1 37 LYS HA H -4.346 1.966 10.005 1.00 . A A . 37 LYS HA 1 1 7 6385 1 1 37 LYS HB2 H -5.517 -0.771 9.486 1.00 . A A . 37 LYS HB2 1 1 7 6386 1 1 37 LYS HB3 H -4.270 -0.362 10.657 1.00 . A A . 37 LYS HB3 1 1 7 6387 1 1 37 LYS HD2 H -7.658 -0.932 12.292 1.00 . A A . 37 LYS HD2 1 1 7 6388 1 1 37 LYS HD3 H -6.736 -1.837 11.091 1.00 . A A . 37 LYS HD3 1 1 7 6389 1 1 37 LYS HE2 H -4.784 -1.813 12.477 1.00 . A A . 37 LYS HE2 1 1 7 6390 1 1 37 LYS HE3 H -5.547 -0.705 13.617 1.00 . A A . 37 LYS HE3 1 1 7 6391 1 1 37 LYS HG2 H -5.828 0.873 11.985 1.00 . A A . 37 LYS HG2 1 1 7 6392 1 1 37 LYS HG3 H -7.080 0.707 10.754 1.00 . A A . 37 LYS HG3 1 1 7 6393 1 1 37 LYS HZ1 H -5.878 -2.674 14.678 1.00 . A A . 37 LYS HZ1 1 1 7 6394 1 1 37 LYS HZ2 H -5.968 -3.577 13.252 1.00 . A A . 37 LYS HZ2 1 1 7 6395 1 1 37 LYS HZ3 H -7.290 -2.644 13.745 1.00 . A A . 37 LYS HZ3 1 1 7 6396 1 1 37 LYS N N -6.023 1.852 8.810 1.00 . A A . 37 LYS N 1 1 7 6397 1 1 37 LYS NZ N -6.251 -2.687 13.708 1.00 . A A . 37 LYS NZ 1 1 7 6398 1 1 37 LYS O O -2.634 0.723 8.493 1.00 . A A . 37 LYS O 1 1 7 6399 1 1 38 ASP C C -2.734 1.694 5.412 1.00 . A A . 38 ASP C 1 1 7 6400 1 1 38 ASP CA C -3.479 0.452 5.881 1.00 . A A . 38 ASP CA 1 1 7 6401 1 1 38 ASP CB C -4.313 -0.124 4.735 1.00 . A A . 38 ASP CB 1 1 7 6402 1 1 38 ASP CG C -5.044 -1.391 5.135 1.00 . A A . 38 ASP CG 1 1 7 6403 1 1 38 ASP H H -5.286 0.925 6.871 1.00 . A A . 38 ASP H 1 1 7 6404 1 1 38 ASP HA H -2.760 -0.286 6.204 1.00 . A A . 38 ASP HA 1 1 7 6405 1 1 38 ASP HB2 H -5.043 0.608 4.425 1.00 . A A . 38 ASP HB2 1 1 7 6406 1 1 38 ASP HB3 H -3.661 -0.352 3.905 1.00 . A A . 38 ASP HB3 1 1 7 6407 1 1 38 ASP N N -4.328 0.778 7.017 1.00 . A A . 38 ASP N 1 1 7 6408 1 1 38 ASP O O -1.517 1.670 5.228 1.00 . A A . 38 ASP O 1 1 7 6409 1 1 38 ASP OD1 O -5.436 -1.503 6.315 1.00 . A A . 38 ASP OD1 1 1 7 6410 1 1 38 ASP OD2 O -5.226 -2.270 4.265 1.00 . A A . 38 ASP OD2 1 1 7 6411 1 1 39 ALA C C -1.811 4.507 5.778 1.00 . A A . 39 ALA C 1 1 7 6412 1 1 39 ALA CA C -2.881 4.042 4.797 1.00 . A A . 39 ALA CA 1 1 7 6413 1 1 39 ALA CB C -3.959 5.107 4.645 1.00 . A A . 39 ALA CB 1 1 7 6414 1 1 39 ALA H H -4.436 2.742 5.403 1.00 . A A . 39 ALA H 1 1 7 6415 1 1 39 ALA HA H -2.427 3.883 3.830 1.00 . A A . 39 ALA HA 1 1 7 6416 1 1 39 ALA HB1 H -3.535 5.983 4.175 1.00 . A A . 39 ALA HB1 1 1 7 6417 1 1 39 ALA HB2 H -4.344 5.371 5.619 1.00 . A A . 39 ALA HB2 1 1 7 6418 1 1 39 ALA HB3 H -4.760 4.722 4.032 1.00 . A A . 39 ALA HB3 1 1 7 6419 1 1 39 ALA N N -3.473 2.784 5.232 1.00 . A A . 39 ALA N 1 1 7 6420 1 1 39 ALA O O -0.858 5.185 5.394 1.00 . A A . 39 ALA O 1 1 7 6421 1 1 40 TYR C C 0.228 3.632 8.021 1.00 . A A . 40 TYR C 1 1 7 6422 1 1 40 TYR CA C -1.016 4.515 8.078 1.00 . A A . 40 TYR CA 1 1 7 6423 1 1 40 TYR CB C -1.665 4.420 9.460 1.00 . A A . 40 TYR CB 1 1 7 6424 1 1 40 TYR CD1 C 0.106 3.761 11.132 1.00 . A A . 40 TYR CD1 1 1 7 6425 1 1 40 TYR CD2 C -0.664 6.017 11.140 1.00 . A A . 40 TYR CD2 1 1 7 6426 1 1 40 TYR CE1 C 0.969 4.048 12.174 1.00 . A A . 40 TYR CE1 1 1 7 6427 1 1 40 TYR CE2 C 0.196 6.313 12.180 1.00 . A A . 40 TYR CE2 1 1 7 6428 1 1 40 TYR CG C -0.723 4.739 10.599 1.00 . A A . 40 TYR CG 1 1 7 6429 1 1 40 TYR CZ C 1.010 5.325 12.693 1.00 . A A . 40 TYR CZ 1 1 7 6430 1 1 40 TYR H H -2.753 3.593 7.293 1.00 . A A . 40 TYR H 1 1 7 6431 1 1 40 TYR HA H -0.723 5.539 7.897 1.00 . A A . 40 TYR HA 1 1 7 6432 1 1 40 TYR HB2 H -2.492 5.116 9.510 1.00 . A A . 40 TYR HB2 1 1 7 6433 1 1 40 TYR HB3 H -2.036 3.414 9.608 1.00 . A A . 40 TYR HB3 1 1 7 6434 1 1 40 TYR HD1 H 0.071 2.762 10.723 1.00 . A A . 40 TYR HD1 1 1 7 6435 1 1 40 TYR HD2 H -1.304 6.787 10.736 1.00 . A A . 40 TYR HD2 1 1 7 6436 1 1 40 TYR HE1 H 1.607 3.276 12.575 1.00 . A A . 40 TYR HE1 1 1 7 6437 1 1 40 TYR HE2 H 0.227 7.313 12.586 1.00 . A A . 40 TYR HE2 1 1 7 6438 1 1 40 TYR HH H 2.749 5.307 13.511 1.00 . A A . 40 TYR HH 1 1 7 6439 1 1 40 TYR N N -1.972 4.136 7.045 1.00 . A A . 40 TYR N 1 1 7 6440 1 1 40 TYR O O 1.353 4.129 7.956 1.00 . A A . 40 TYR O 1 1 7 6441 1 1 40 TYR OH O 1.867 5.616 13.729 1.00 . A A . 40 TYR OH 1 1 7 6442 1 1 41 ARG C C 1.846 1.422 6.660 1.00 . A A . 41 ARG C 1 1 7 6443 1 1 41 ARG CA C 1.121 1.365 8.003 1.00 . A A . 41 ARG CA 1 1 7 6444 1 1 41 ARG CB C 0.603 -0.052 8.255 1.00 . A A . 41 ARG CB 1 1 7 6445 1 1 41 ARG CD C -0.462 -1.676 9.851 1.00 . A A . 41 ARG CD 1 1 7 6446 1 1 41 ARG CG C 0.062 -0.261 9.660 1.00 . A A . 41 ARG CG 1 1 7 6447 1 1 41 ARG CZ C 0.452 -2.216 12.075 1.00 . A A . 41 ARG CZ 1 1 7 6448 1 1 41 ARG H H -0.902 1.985 8.104 1.00 . A A . 41 ARG H 1 1 7 6449 1 1 41 ARG HA H 1.816 1.627 8.787 1.00 . A A . 41 ARG HA 1 1 7 6450 1 1 41 ARG HB2 H -0.190 -0.262 7.553 1.00 . A A . 41 ARG HB2 1 1 7 6451 1 1 41 ARG HB3 H 1.410 -0.751 8.096 1.00 . A A . 41 ARG HB3 1 1 7 6452 1 1 41 ARG HD2 H -1.432 -1.751 9.385 1.00 . A A . 41 ARG HD2 1 1 7 6453 1 1 41 ARG HD3 H 0.220 -2.366 9.376 1.00 . A A . 41 ARG HD3 1 1 7 6454 1 1 41 ARG HE H -1.491 -2.133 11.626 1.00 . A A . 41 ARG HE 1 1 7 6455 1 1 41 ARG HG2 H 0.855 -0.084 10.372 1.00 . A A . 41 ARG HG2 1 1 7 6456 1 1 41 ARG HG3 H -0.744 0.437 9.834 1.00 . A A . 41 ARG HG3 1 1 7 6457 1 1 41 ARG HH11 H 1.851 -1.841 10.662 1.00 . A A . 41 ARG HH11 1 1 7 6458 1 1 41 ARG HH12 H 2.467 -2.225 12.234 1.00 . A A . 41 ARG HH12 1 1 7 6459 1 1 41 ARG HH21 H -0.680 -2.637 13.694 1.00 . A A . 41 ARG HH21 1 1 7 6460 1 1 41 ARG HH22 H 1.031 -2.677 13.954 1.00 . A A . 41 ARG HH22 1 1 7 6461 1 1 41 ARG N N 0.018 2.320 8.050 1.00 . A A . 41 ARG N 1 1 7 6462 1 1 41 ARG NE N -0.585 -2.029 11.262 1.00 . A A . 41 ARG NE 1 1 7 6463 1 1 41 ARG NH1 N 1.691 -2.084 11.619 1.00 . A A . 41 ARG NH1 1 1 7 6464 1 1 41 ARG NH2 N 0.251 -2.536 13.345 1.00 . A A . 41 ARG NH2 1 1 7 6465 1 1 41 ARG O O 3.001 1.007 6.549 1.00 . A A . 41 ARG O 1 1 7 6466 1 1 42 LEU C C 2.875 3.043 4.268 1.00 . A A . 42 LEU C 1 1 7 6467 1 1 42 LEU CA C 1.734 2.031 4.304 1.00 . A A . 42 LEU CA 1 1 7 6468 1 1 42 LEU CB C 0.659 2.422 3.291 1.00 . A A . 42 LEU CB 1 1 7 6469 1 1 42 LEU CD1 C -1.535 1.787 2.261 1.00 . A A . 42 LEU CD1 1 1 7 6470 1 1 42 LEU CD2 C 0.526 0.478 1.714 1.00 . A A . 42 LEU CD2 1 1 7 6471 1 1 42 LEU CG C -0.209 1.266 2.789 1.00 . A A . 42 LEU CG 1 1 7 6472 1 1 42 LEU H H 0.243 2.238 5.788 1.00 . A A . 42 LEU H 1 1 7 6473 1 1 42 LEU HA H 2.125 1.061 4.043 1.00 . A A . 42 LEU HA 1 1 7 6474 1 1 42 LEU HB2 H 0.012 3.157 3.750 1.00 . A A . 42 LEU HB2 1 1 7 6475 1 1 42 LEU HB3 H 1.143 2.875 2.439 1.00 . A A . 42 LEU HB3 1 1 7 6476 1 1 42 LEU HD11 H -2.051 0.994 1.740 1.00 . A A . 42 LEU HD11 1 1 7 6477 1 1 42 LEU HD12 H -1.355 2.607 1.582 1.00 . A A . 42 LEU HD12 1 1 7 6478 1 1 42 LEU HD13 H -2.140 2.130 3.086 1.00 . A A . 42 LEU HD13 1 1 7 6479 1 1 42 LEU HD21 H 0.891 1.157 0.958 1.00 . A A . 42 LEU HD21 1 1 7 6480 1 1 42 LEU HD22 H -0.150 -0.232 1.264 1.00 . A A . 42 LEU HD22 1 1 7 6481 1 1 42 LEU HD23 H 1.358 -0.047 2.158 1.00 . A A . 42 LEU HD23 1 1 7 6482 1 1 42 LEU HG H -0.415 0.596 3.612 1.00 . A A . 42 LEU HG 1 1 7 6483 1 1 42 LEU N N 1.159 1.929 5.640 1.00 . A A . 42 LEU N 1 1 7 6484 1 1 42 LEU O O 3.814 2.903 3.483 1.00 . A A . 42 LEU O 1 1 7 6485 1 1 43 GLU C C 5.160 4.482 5.587 1.00 . A A . 43 GLU C 1 1 7 6486 1 1 43 GLU CA C 3.822 5.086 5.170 1.00 . A A . 43 GLU CA 1 1 7 6487 1 1 43 GLU CB C 3.418 6.190 6.149 1.00 . A A . 43 GLU CB 1 1 7 6488 1 1 43 GLU CD C 4.823 7.935 7.318 1.00 . A A . 43 GLU CD 1 1 7 6489 1 1 43 GLU CG C 4.238 7.463 6.003 1.00 . A A . 43 GLU CG 1 1 7 6490 1 1 43 GLU H H 2.020 4.119 5.717 1.00 . A A . 43 GLU H 1 1 7 6491 1 1 43 GLU HA H 3.924 5.508 4.183 1.00 . A A . 43 GLU HA 1 1 7 6492 1 1 43 GLU HB2 H 2.379 6.437 5.986 1.00 . A A . 43 GLU HB2 1 1 7 6493 1 1 43 GLU HB3 H 3.539 5.824 7.158 1.00 . A A . 43 GLU HB3 1 1 7 6494 1 1 43 GLU HG2 H 5.046 7.276 5.313 1.00 . A A . 43 GLU HG2 1 1 7 6495 1 1 43 GLU HG3 H 3.602 8.241 5.608 1.00 . A A . 43 GLU HG3 1 1 7 6496 1 1 43 GLU N N 2.790 4.059 5.115 1.00 . A A . 43 GLU N 1 1 7 6497 1 1 43 GLU O O 6.180 4.695 4.933 1.00 . A A . 43 GLU O 1 1 7 6498 1 1 43 GLU OE1 O 4.047 8.141 8.275 1.00 . A A . 43 GLU OE1 1 1 7 6499 1 1 43 GLU OE2 O 6.060 8.098 7.393 1.00 . A A . 43 GLU OE2 1 1 7 6500 1 1 44 ILE C C 6.967 2.131 6.203 1.00 . A A . 44 ILE C 1 1 7 6501 1 1 44 ILE CA C 6.349 3.105 7.203 1.00 . A A . 44 ILE CA 1 1 7 6502 1 1 44 ILE CB C 6.056 2.357 8.513 1.00 . A A . 44 ILE CB 1 1 7 6503 1 1 44 ILE CD1 C 3.780 3.027 9.423 1.00 . A A . 44 ILE CD1 1 1 7 6504 1 1 44 ILE CG1 C 5.271 3.259 9.464 1.00 . A A . 44 ILE CG1 1 1 7 6505 1 1 44 ILE CG2 C 7.351 1.887 9.158 1.00 . A A . 44 ILE CG2 1 1 7 6506 1 1 44 ILE H H 4.302 3.611 7.168 1.00 . A A . 44 ILE H 1 1 7 6507 1 1 44 ILE HA H 7.062 3.886 7.418 1.00 . A A . 44 ILE HA 1 1 7 6508 1 1 44 ILE HB H 5.462 1.487 8.280 1.00 . A A . 44 ILE HB 1 1 7 6509 1 1 44 ILE HD11 H 3.474 2.484 10.305 1.00 . A A . 44 ILE HD11 1 1 7 6510 1 1 44 ILE HD12 H 3.534 2.453 8.544 1.00 . A A . 44 ILE HD12 1 1 7 6511 1 1 44 ILE HD13 H 3.269 3.978 9.387 1.00 . A A . 44 ILE HD13 1 1 7 6512 1 1 44 ILE HG12 H 5.602 3.082 10.470 1.00 . A A . 44 ILE HG12 1 1 7 6513 1 1 44 ILE HG13 H 5.454 4.292 9.206 1.00 . A A . 44 ILE HG13 1 1 7 6514 1 1 44 ILE HG21 H 7.987 2.738 9.348 1.00 . A A . 44 ILE HG21 1 1 7 6515 1 1 44 ILE HG22 H 7.854 1.202 8.493 1.00 . A A . 44 ILE HG22 1 1 7 6516 1 1 44 ILE HG23 H 7.129 1.387 10.089 1.00 . A A . 44 ILE HG23 1 1 7 6517 1 1 44 ILE N N 5.145 3.736 6.685 1.00 . A A . 44 ILE N 1 1 7 6518 1 1 44 ILE O O 8.178 2.149 5.981 1.00 . A A . 44 ILE O 1 1 7 6519 1 1 45 VAL C C 7.323 0.963 3.466 1.00 . A A . 45 VAL C 1 1 7 6520 1 1 45 VAL CA C 6.634 0.291 4.647 1.00 . A A . 45 VAL CA 1 1 7 6521 1 1 45 VAL CB C 5.504 -0.606 4.113 1.00 . A A . 45 VAL CB 1 1 7 6522 1 1 45 VAL CG1 C 5.019 -1.559 5.194 1.00 . A A . 45 VAL CG1 1 1 7 6523 1 1 45 VAL CG2 C 4.359 0.237 3.582 1.00 . A A . 45 VAL CG2 1 1 7 6524 1 1 45 VAL H H 5.180 1.295 5.830 1.00 . A A . 45 VAL H 1 1 7 6525 1 1 45 VAL HA H 7.350 -0.337 5.156 1.00 . A A . 45 VAL HA 1 1 7 6526 1 1 45 VAL HB H 5.897 -1.190 3.298 1.00 . A A . 45 VAL HB 1 1 7 6527 1 1 45 VAL HG11 H 5.535 -2.503 5.099 1.00 . A A . 45 VAL HG11 1 1 7 6528 1 1 45 VAL HG12 H 3.957 -1.719 5.084 1.00 . A A . 45 VAL HG12 1 1 7 6529 1 1 45 VAL HG13 H 5.221 -1.136 6.167 1.00 . A A . 45 VAL HG13 1 1 7 6530 1 1 45 VAL HG21 H 4.713 0.854 2.770 1.00 . A A . 45 VAL HG21 1 1 7 6531 1 1 45 VAL HG22 H 3.981 0.864 4.374 1.00 . A A . 45 VAL HG22 1 1 7 6532 1 1 45 VAL HG23 H 3.571 -0.409 3.227 1.00 . A A . 45 VAL HG23 1 1 7 6533 1 1 45 VAL N N 6.139 1.274 5.610 1.00 . A A . 45 VAL N 1 1 7 6534 1 1 45 VAL O O 8.368 0.507 3.003 1.00 . A A . 45 VAL O 1 1 7 6535 1 1 46 THR C C 8.351 3.766 2.262 1.00 . A A . 46 THR C 1 1 7 6536 1 1 46 THR CA C 7.271 2.769 1.834 1.00 . A A . 46 THR CA 1 1 7 6537 1 1 46 THR CB C 6.147 3.504 1.108 1.00 . A A . 46 THR CB 1 1 7 6538 1 1 46 THR CG2 C 5.169 2.576 0.419 1.00 . A A . 46 THR CG2 1 1 7 6539 1 1 46 THR H H 5.890 2.347 3.372 1.00 . A A . 46 THR H 1 1 7 6540 1 1 46 THR HA H 7.709 2.050 1.159 1.00 . A A . 46 THR HA 1 1 7 6541 1 1 46 THR HB H 6.580 4.140 0.358 1.00 . A A . 46 THR HB 1 1 7 6542 1 1 46 THR HG1 H 4.838 3.767 2.543 1.00 . A A . 46 THR HG1 1 1 7 6543 1 1 46 THR HG21 H 4.774 3.059 -0.463 1.00 . A A . 46 THR HG21 1 1 7 6544 1 1 46 THR HG22 H 4.359 2.342 1.094 1.00 . A A . 46 THR HG22 1 1 7 6545 1 1 46 THR HG23 H 5.675 1.665 0.135 1.00 . A A . 46 THR HG23 1 1 7 6546 1 1 46 THR N N 6.725 2.040 2.971 1.00 . A A . 46 THR N 1 1 7 6547 1 1 46 THR O O 8.432 4.869 1.724 1.00 . A A . 46 THR O 1 1 7 6548 1 1 46 THR OG1 O 5.413 4.317 2.006 1.00 . A A . 46 THR OG1 1 1 7 6549 1 1 47 ALA C C 9.755 5.632 4.042 1.00 . A A . 47 ALA C 1 1 7 6550 1 1 47 ALA CA C 10.261 4.231 3.706 1.00 . A A . 47 ALA CA 1 1 7 6551 1 1 47 ALA CB C 11.375 4.308 2.671 1.00 . A A . 47 ALA CB 1 1 7 6552 1 1 47 ALA H H 9.080 2.480 3.608 1.00 . A A . 47 ALA H 1 1 7 6553 1 1 47 ALA HA H 10.668 3.783 4.600 1.00 . A A . 47 ALA HA 1 1 7 6554 1 1 47 ALA HB1 H 11.087 4.988 1.883 1.00 . A A . 47 ALA HB1 1 1 7 6555 1 1 47 ALA HB2 H 11.548 3.328 2.255 1.00 . A A . 47 ALA HB2 1 1 7 6556 1 1 47 ALA HB3 H 12.279 4.664 3.142 1.00 . A A . 47 ALA HB3 1 1 7 6557 1 1 47 ALA N N 9.185 3.371 3.221 1.00 . A A . 47 ALA N 1 1 7 6558 1 1 47 ALA O O 10.508 6.604 3.980 1.00 . A A . 47 ALA O 1 1 7 6559 1 1 48 GLY C C 7.597 7.869 3.515 1.00 . A A . 48 GLY C 1 1 7 6560 1 1 48 GLY CA C 7.900 7.016 4.735 1.00 . A A . 48 GLY CA 1 1 7 6561 1 1 48 GLY H H 7.925 4.920 4.427 1.00 . A A . 48 GLY H 1 1 7 6562 1 1 48 GLY HA2 H 6.983 6.851 5.280 1.00 . A A . 48 GLY HA2 1 1 7 6563 1 1 48 GLY HA3 H 8.590 7.550 5.372 1.00 . A A . 48 GLY HA3 1 1 7 6564 1 1 48 GLY N N 8.480 5.729 4.396 1.00 . A A . 48 GLY N 1 1 7 6565 1 1 48 GLY O O 7.160 9.012 3.646 1.00 . A A . 48 GLY O 1 1 7 6566 1 1 49 ALA C C 6.102 8.405 0.957 1.00 . A A . 49 ALA C 1 1 7 6567 1 1 49 ALA CA C 7.576 8.040 1.087 1.00 . A A . 49 ALA CA 1 1 7 6568 1 1 49 ALA CB C 8.023 7.212 -0.109 1.00 . A A . 49 ALA CB 1 1 7 6569 1 1 49 ALA H H 8.178 6.403 2.282 1.00 . A A . 49 ALA H 1 1 7 6570 1 1 49 ALA HA H 8.162 8.949 1.105 1.00 . A A . 49 ALA HA 1 1 7 6571 1 1 49 ALA HB1 H 7.734 6.182 0.039 1.00 . A A . 49 ALA HB1 1 1 7 6572 1 1 49 ALA HB2 H 9.097 7.275 -0.209 1.00 . A A . 49 ALA HB2 1 1 7 6573 1 1 49 ALA HB3 H 7.556 7.593 -1.005 1.00 . A A . 49 ALA HB3 1 1 7 6574 1 1 49 ALA N N 7.831 7.316 2.327 1.00 . A A . 49 ALA N 1 1 7 6575 1 1 49 ALA O O 5.758 9.550 0.665 1.00 . A A . 49 ALA O 1 1 7 6576 1 1 50 LEU C C 3.271 8.298 2.362 1.00 . A A . 50 LEU C 1 1 7 6577 1 1 50 LEU CA C 3.796 7.641 1.090 1.00 . A A . 50 LEU CA 1 1 7 6578 1 1 50 LEU CB C 3.072 6.315 0.850 1.00 . A A . 50 LEU CB 1 1 7 6579 1 1 50 LEU CD1 C 2.427 4.457 -0.706 1.00 . A A . 50 LEU CD1 1 1 7 6580 1 1 50 LEU CD2 C 2.427 6.822 -1.517 1.00 . A A . 50 LEU CD2 1 1 7 6581 1 1 50 LEU CG C 3.100 5.816 -0.597 1.00 . A A . 50 LEU CG 1 1 7 6582 1 1 50 LEU H H 5.570 6.532 1.410 1.00 . A A . 50 LEU H 1 1 7 6583 1 1 50 LEU HA H 3.611 8.300 0.256 1.00 . A A . 50 LEU HA 1 1 7 6584 1 1 50 LEU HB2 H 3.529 5.563 1.478 1.00 . A A . 50 LEU HB2 1 1 7 6585 1 1 50 LEU HB3 H 2.042 6.431 1.146 1.00 . A A . 50 LEU HB3 1 1 7 6586 1 1 50 LEU HD11 H 2.554 4.072 -1.706 1.00 . A A . 50 LEU HD11 1 1 7 6587 1 1 50 LEU HD12 H 1.374 4.558 -0.490 1.00 . A A . 50 LEU HD12 1 1 7 6588 1 1 50 LEU HD13 H 2.875 3.775 0.002 1.00 . A A . 50 LEU HD13 1 1 7 6589 1 1 50 LEU HD21 H 2.217 6.355 -2.468 1.00 . A A . 50 LEU HD21 1 1 7 6590 1 1 50 LEU HD22 H 3.082 7.667 -1.668 1.00 . A A . 50 LEU HD22 1 1 7 6591 1 1 50 LEU HD23 H 1.503 7.159 -1.070 1.00 . A A . 50 LEU HD23 1 1 7 6592 1 1 50 LEU HG H 4.127 5.706 -0.912 1.00 . A A . 50 LEU HG 1 1 7 6593 1 1 50 LEU N N 5.236 7.423 1.179 1.00 . A A . 50 LEU N 1 1 7 6594 1 1 50 LEU O O 3.290 7.699 3.436 1.00 . A A . 50 LEU O 1 1 7 6595 1 1 51 LYS C C 0.850 9.854 3.688 1.00 . A A . 51 LYS C 1 1 7 6596 1 1 51 LYS CA C 2.280 10.278 3.373 1.00 . A A . 51 LYS CA 1 1 7 6597 1 1 51 LYS CB C 2.329 11.781 3.098 1.00 . A A . 51 LYS CB 1 1 7 6598 1 1 51 LYS CD C 3.838 12.652 4.908 1.00 . A A . 51 LYS CD 1 1 7 6599 1 1 51 LYS CE C 4.631 13.821 4.348 1.00 . A A . 51 LYS CE 1 1 7 6600 1 1 51 LYS CG C 2.421 12.625 4.358 1.00 . A A . 51 LYS CG 1 1 7 6601 1 1 51 LYS H H 2.821 9.964 1.350 1.00 . A A . 51 LYS H 1 1 7 6602 1 1 51 LYS HA H 2.904 10.057 4.227 1.00 . A A . 51 LYS HA 1 1 7 6603 1 1 51 LYS HB2 H 3.191 11.996 2.483 1.00 . A A . 51 LYS HB2 1 1 7 6604 1 1 51 LYS HB3 H 1.436 12.068 2.563 1.00 . A A . 51 LYS HB3 1 1 7 6605 1 1 51 LYS HD2 H 3.796 12.740 5.984 1.00 . A A . 51 LYS HD2 1 1 7 6606 1 1 51 LYS HD3 H 4.335 11.730 4.639 1.00 . A A . 51 LYS HD3 1 1 7 6607 1 1 51 LYS HE2 H 5.655 13.509 4.203 1.00 . A A . 51 LYS HE2 1 1 7 6608 1 1 51 LYS HE3 H 4.205 14.106 3.397 1.00 . A A . 51 LYS HE3 1 1 7 6609 1 1 51 LYS HG2 H 2.117 13.636 4.127 1.00 . A A . 51 LYS HG2 1 1 7 6610 1 1 51 LYS HG3 H 1.762 12.211 5.106 1.00 . A A . 51 LYS HG3 1 1 7 6611 1 1 51 LYS HZ1 H 5.151 15.780 4.850 1.00 . A A . 51 LYS HZ1 1 1 7 6612 1 1 51 LYS HZ2 H 5.025 14.744 6.180 1.00 . A A . 51 LYS HZ2 1 1 7 6613 1 1 51 LYS HZ3 H 3.628 15.310 5.415 1.00 . A A . 51 LYS HZ3 1 1 7 6614 1 1 51 LYS N N 2.806 9.537 2.233 1.00 . A A . 51 LYS N 1 1 7 6615 1 1 51 LYS NZ N 4.607 14.996 5.262 1.00 . A A . 51 LYS NZ 1 1 7 6616 1 1 51 LYS O O -0.026 9.895 2.824 1.00 . A A . 51 LYS O 1 1 7 6617 1 1 52 TYR C C -1.569 10.220 5.720 1.00 . A A . 52 TYR C 1 1 7 6618 1 1 52 TYR CA C -0.700 9.018 5.368 1.00 . A A . 52 TYR CA 1 1 7 6619 1 1 52 TYR CB C -0.578 8.082 6.575 1.00 . A A . 52 TYR CB 1 1 7 6620 1 1 52 TYR CD1 C -3.030 7.444 6.676 1.00 . A A . 52 TYR CD1 1 1 7 6621 1 1 52 TYR CD2 C -1.940 8.073 8.702 1.00 . A A . 52 TYR CD2 1 1 7 6622 1 1 52 TYR CE1 C -4.206 7.240 7.368 1.00 . A A . 52 TYR CE1 1 1 7 6623 1 1 52 TYR CE2 C -3.115 7.873 9.400 1.00 . A A . 52 TYR CE2 1 1 7 6624 1 1 52 TYR CG C -1.875 7.864 7.330 1.00 . A A . 52 TYR CG 1 1 7 6625 1 1 52 TYR CZ C -4.245 7.456 8.729 1.00 . A A . 52 TYR CZ 1 1 7 6626 1 1 52 TYR H H 1.363 9.440 5.574 1.00 . A A . 52 TYR H 1 1 7 6627 1 1 52 TYR HA H -1.160 8.480 4.552 1.00 . A A . 52 TYR HA 1 1 7 6628 1 1 52 TYR HB2 H -0.228 7.120 6.240 1.00 . A A . 52 TYR HB2 1 1 7 6629 1 1 52 TYR HB3 H 0.141 8.497 7.268 1.00 . A A . 52 TYR HB3 1 1 7 6630 1 1 52 TYR HD1 H -3.005 7.280 5.611 1.00 . A A . 52 TYR HD1 1 1 7 6631 1 1 52 TYR HD2 H -1.055 8.400 9.226 1.00 . A A . 52 TYR HD2 1 1 7 6632 1 1 52 TYR HE1 H -5.086 6.911 6.841 1.00 . A A . 52 TYR HE1 1 1 7 6633 1 1 52 TYR HE2 H -3.146 8.042 10.465 1.00 . A A . 52 TYR HE2 1 1 7 6634 1 1 52 TYR HH H -6.156 7.574 8.900 1.00 . A A . 52 TYR HH 1 1 7 6635 1 1 52 TYR N N 0.623 9.448 4.932 1.00 . A A . 52 TYR N 1 1 7 6636 1 1 52 TYR O O -1.168 11.079 6.506 1.00 . A A . 52 TYR O 1 1 7 6637 1 1 52 TYR OH O -5.416 7.254 9.421 1.00 . A A . 52 TYR OH 1 1 7 6638 1 1 53 GLN C C -5.000 10.830 5.950 1.00 . A A . 53 GLN C 1 1 7 6639 1 1 53 GLN CA C -3.686 11.363 5.395 1.00 . A A . 53 GLN CA 1 1 7 6640 1 1 53 GLN CB C -3.940 12.161 4.114 1.00 . A A . 53 GLN CB 1 1 7 6641 1 1 53 GLN CD C -2.333 13.971 3.388 1.00 . A A . 53 GLN CD 1 1 7 6642 1 1 53 GLN CG C -2.674 12.494 3.343 1.00 . A A . 53 GLN CG 1 1 7 6643 1 1 53 GLN H H -3.023 9.553 4.525 1.00 . A A . 53 GLN H 1 1 7 6644 1 1 53 GLN HA H -3.238 12.011 6.133 1.00 . A A . 53 GLN HA 1 1 7 6645 1 1 53 GLN HB2 H -4.588 11.587 3.469 1.00 . A A . 53 GLN HB2 1 1 7 6646 1 1 53 GLN HB3 H -4.433 13.087 4.373 1.00 . A A . 53 GLN HB3 1 1 7 6647 1 1 53 GLN HE21 H -0.447 13.576 2.898 1.00 . A A . 53 GLN HE21 1 1 7 6648 1 1 53 GLN HE22 H -0.827 15.244 3.133 1.00 . A A . 53 GLN HE22 1 1 7 6649 1 1 53 GLN HG2 H -1.851 11.938 3.770 1.00 . A A . 53 GLN HG2 1 1 7 6650 1 1 53 GLN HG3 H -2.808 12.202 2.313 1.00 . A A . 53 GLN HG3 1 1 7 6651 1 1 53 GLN N N -2.759 10.271 5.137 1.00 . A A . 53 GLN N 1 1 7 6652 1 1 53 GLN NE2 N -1.076 14.297 3.113 1.00 . A A . 53 GLN NE2 1 1 7 6653 1 1 53 GLN O O -5.612 9.934 5.368 1.00 . A A . 53 GLN O 1 1 7 6654 1 1 53 GLN OE1 O -3.189 14.811 3.669 1.00 . A A . 53 GLN OE1 1 1 7 6655 1 1 54 GLU C C -7.866 11.737 7.192 1.00 . A A . 54 GLU C 1 1 7 6656 1 1 54 GLU CA C -6.664 10.956 7.720 1.00 . A A . 54 GLU CA 1 1 7 6657 1 1 54 GLU CB C -6.563 11.127 9.237 1.00 . A A . 54 GLU CB 1 1 7 6658 1 1 54 GLU CD C -5.111 10.941 11.295 1.00 . A A . 54 GLU CD 1 1 7 6659 1 1 54 GLU CG C -5.254 10.623 9.820 1.00 . A A . 54 GLU CG 1 1 7 6660 1 1 54 GLU H H -4.891 12.089 7.498 1.00 . A A . 54 GLU H 1 1 7 6661 1 1 54 GLU HA H -6.807 9.910 7.497 1.00 . A A . 54 GLU HA 1 1 7 6662 1 1 54 GLU HB2 H -6.659 12.175 9.477 1.00 . A A . 54 GLU HB2 1 1 7 6663 1 1 54 GLU HB3 H -7.372 10.584 9.704 1.00 . A A . 54 GLU HB3 1 1 7 6664 1 1 54 GLU HG2 H -5.205 9.552 9.691 1.00 . A A . 54 GLU HG2 1 1 7 6665 1 1 54 GLU HG3 H -4.435 11.085 9.287 1.00 . A A . 54 GLU HG3 1 1 7 6666 1 1 54 GLU N N -5.425 11.381 7.081 1.00 . A A . 54 GLU N 1 1 7 6667 1 1 54 GLU O O -8.885 11.849 7.871 1.00 . A A . 54 GLU O 1 1 7 6668 1 1 54 GLU OE1 O -5.569 12.025 11.716 1.00 . A A . 54 GLU OE1 1 1 7 6669 1 1 54 GLU OE2 O -4.542 10.105 12.031 1.00 . A A . 54 GLU OE2 1 1 7 6670 1 1 55 ASN C C -10.070 12.152 5.231 1.00 . A A . 55 ASN C 1 1 7 6671 1 1 55 ASN CA C -8.838 13.030 5.380 1.00 . A A . 55 ASN CA 1 1 7 6672 1 1 55 ASN CB C -8.420 13.593 4.019 1.00 . A A . 55 ASN CB 1 1 7 6673 1 1 55 ASN CG C -7.717 12.564 3.154 1.00 . A A . 55 ASN CG 1 1 7 6674 1 1 55 ASN H H -6.918 12.150 5.477 1.00 . A A . 55 ASN H 1 1 7 6675 1 1 55 ASN HA H -9.071 13.845 6.044 1.00 . A A . 55 ASN HA 1 1 7 6676 1 1 55 ASN HB2 H -9.300 13.935 3.494 1.00 . A A . 55 ASN HB2 1 1 7 6677 1 1 55 ASN HB3 H -7.752 14.428 4.173 1.00 . A A . 55 ASN HB3 1 1 7 6678 1 1 55 ASN HD21 H -8.864 13.049 1.604 1.00 . A A . 55 ASN HD21 1 1 7 6679 1 1 55 ASN HD22 H -7.698 11.807 1.315 1.00 . A A . 55 ASN HD22 1 1 7 6680 1 1 55 ASN N N -7.748 12.271 5.979 1.00 . A A . 55 ASN N 1 1 7 6681 1 1 55 ASN ND2 N -8.135 12.464 1.898 1.00 . A A . 55 ASN ND2 1 1 7 6682 1 1 55 ASN O O -11.160 12.504 5.693 1.00 . A A . 55 ASN O 1 1 7 6683 1 1 55 ASN OD1 O -6.808 11.872 3.609 1.00 . A A . 55 ASN OD1 1 1 7 6684 1 1 56 ALA C C -10.970 8.988 5.499 1.00 . A A . 56 ALA C 1 1 7 6685 1 1 56 ALA CA C -10.990 10.057 4.409 1.00 . A A . 56 ALA CA 1 1 7 6686 1 1 56 ALA CB C -10.900 9.414 3.033 1.00 . A A . 56 ALA CB 1 1 7 6687 1 1 56 ALA H H -9.005 10.767 4.267 1.00 . A A . 56 ALA H 1 1 7 6688 1 1 56 ALA HA H -11.920 10.607 4.469 1.00 . A A . 56 ALA HA 1 1 7 6689 1 1 56 ALA HB1 H -11.890 9.315 2.618 1.00 . A A . 56 ALA HB1 1 1 7 6690 1 1 56 ALA HB2 H -10.450 8.437 3.119 1.00 . A A . 56 ALA HB2 1 1 7 6691 1 1 56 ALA HB3 H -10.300 10.034 2.383 1.00 . A A . 56 ALA HB3 1 1 7 6692 1 1 56 ALA N N -9.897 10.997 4.599 1.00 . A A . 56 ALA N 1 1 7 6693 1 1 56 ALA O O -11.630 7.957 5.381 1.00 . A A . 56 ALA O 1 1 7 6694 1 1 57 TYR C C -10.270 9.033 9.005 1.00 . A A . 57 TYR C 1 1 7 6695 1 1 57 TYR CA C -10.090 8.311 7.671 1.00 . A A . 57 TYR CA 1 1 7 6696 1 1 57 TYR CB C -8.741 7.607 7.627 1.00 . A A . 57 TYR CB 1 1 7 6697 1 1 57 TYR CD1 C -9.206 6.328 5.505 1.00 . A A . 57 TYR CD1 1 1 7 6698 1 1 57 TYR CD2 C -7.140 7.508 5.671 1.00 . A A . 57 TYR CD2 1 1 7 6699 1 1 57 TYR CE1 C -8.864 5.896 4.239 1.00 . A A . 57 TYR CE1 1 1 7 6700 1 1 57 TYR CE2 C -6.790 7.079 4.404 1.00 . A A . 57 TYR CE2 1 1 7 6701 1 1 57 TYR CG C -8.353 7.139 6.243 1.00 . A A . 57 TYR CG 1 1 7 6702 1 1 57 TYR CZ C -7.656 6.274 3.693 1.00 . A A . 57 TYR CZ 1 1 7 6703 1 1 57 TYR H H -9.707 10.082 6.593 1.00 . A A . 57 TYR H 1 1 7 6704 1 1 57 TYR HA H -10.880 7.574 7.568 1.00 . A A . 57 TYR HA 1 1 7 6705 1 1 57 TYR HB2 H -7.978 8.289 7.973 1.00 . A A . 57 TYR HB2 1 1 7 6706 1 1 57 TYR HB3 H -8.769 6.744 8.275 1.00 . A A . 57 TYR HB3 1 1 7 6707 1 1 57 TYR HD1 H -10.150 6.034 5.936 1.00 . A A . 57 TYR HD1 1 1 7 6708 1 1 57 TYR HD2 H -6.461 8.138 6.230 1.00 . A A . 57 TYR HD2 1 1 7 6709 1 1 57 TYR HE1 H -9.542 5.266 3.683 1.00 . A A . 57 TYR HE1 1 1 7 6710 1 1 57 TYR HE2 H -5.844 7.376 3.976 1.00 . A A . 57 TYR HE2 1 1 7 6711 1 1 57 TYR HH H -6.379 6.001 2.277 1.00 . A A . 57 TYR HH 1 1 7 6712 1 1 57 TYR N N -10.210 9.245 6.559 1.00 . A A . 57 TYR N 1 1 7 6713 1 1 57 TYR O O -9.738 8.605 10.028 1.00 . A A . 57 TYR O 1 1 7 6714 1 1 57 TYR OH O -7.314 5.845 2.429 1.00 . A A . 57 TYR OH 1 1 7 6715 1 1 58 ARG C C -12.610 10.566 10.800 1.00 . A A . 58 ARG C 1 1 7 6716 1 1 58 ARG CA C -11.260 10.915 10.190 1.00 . A A . 58 ARG CA 1 1 7 6717 1 1 58 ARG CB C -11.200 12.411 9.871 1.00 . A A . 58 ARG CB 1 1 7 6718 1 1 58 ARG CD C -10.020 14.577 10.363 1.00 . A A . 58 ARG CD 1 1 7 6719 1 1 58 ARG CG C -10.440 13.224 10.911 1.00 . A A . 58 ARG CG 1 1 7 6720 1 1 58 ARG CZ C -8.020 16.009 10.342 1.00 . A A . 58 ARG CZ 1 1 7 6721 1 1 58 ARG H H -11.420 10.423 8.139 1.00 . A A . 58 ARG H 1 1 7 6722 1 1 58 ARG HA H -10.490 10.675 10.903 1.00 . A A . 58 ARG HA 1 1 7 6723 1 1 58 ARG HB2 H -10.710 12.544 8.919 1.00 . A A . 58 ARG HB2 1 1 7 6724 1 1 58 ARG HB3 H -12.200 12.797 9.805 1.00 . A A . 58 ARG HB3 1 1 7 6725 1 1 58 ARG HD2 H -10.050 14.539 9.284 1.00 . A A . 58 ARG HD2 1 1 7 6726 1 1 58 ARG HD3 H -10.710 15.326 10.713 1.00 . A A . 58 ARG HD3 1 1 7 6727 1 1 58 ARG HE H -8.237 14.362 11.444 1.00 . A A . 58 ARG HE 1 1 7 6728 1 1 58 ARG HG2 H -11.080 13.378 11.767 1.00 . A A . 58 ARG HG2 1 1 7 6729 1 1 58 ARG HG3 H -9.568 12.675 11.213 1.00 . A A . 58 ARG HG3 1 1 7 6730 1 1 58 ARG HH11 H -9.507 16.632 9.117 1.00 . A A . 58 ARG HH11 1 1 7 6731 1 1 58 ARG HH12 H -8.085 17.621 9.122 1.00 . A A . 58 ARG HH12 1 1 7 6732 1 1 58 ARG HH21 H -6.367 15.661 11.450 1.00 . A A . 58 ARG HH21 1 1 7 6733 1 1 58 ARG HH22 H -6.303 17.071 10.445 1.00 . A A . 58 ARG HH22 1 1 7 6734 1 1 58 ARG N N -11.020 10.131 8.985 1.00 . A A . 58 ARG N 1 1 7 6735 1 1 58 ARG NE N -8.677 14.943 10.789 1.00 . A A . 58 ARG NE 1 1 7 6736 1 1 58 ARG NH1 N -8.585 16.820 9.454 1.00 . A A . 58 ARG NH1 1 1 7 6737 1 1 58 ARG NH2 N -6.796 16.268 10.782 1.00 . A A . 58 ARG NH2 1 1 7 6738 1 1 58 ARG O O -13.370 9.764 10.247 1.00 . A A . 58 ARG O 1 1 7 6739 1 1 59 GLN C C -15.050 12.186 12.672 1.00 . A A . 59 GLN C 1 1 7 6740 1 1 59 GLN CA C -14.180 10.926 12.626 1.00 . A A . 59 GLN CA 1 1 7 6741 1 1 59 GLN CB C -13.930 10.420 14.047 1.00 . A A . 59 GLN CB 1 1 7 6742 1 1 59 GLN CD C -13.360 11.212 16.377 1.00 . A A . 59 GLN CD 1 1 7 6743 1 1 59 GLN CG C -13.100 11.374 14.892 1.00 . A A . 59 GLN CG 1 1 7 6744 1 1 59 GLN H H -12.280 11.804 12.336 1.00 . A A . 59 GLN H 1 1 7 6745 1 1 59 GLN HA H -14.710 10.165 12.074 1.00 . A A . 59 GLN HA 1 1 7 6746 1 1 59 GLN HB2 H -14.880 10.271 14.539 1.00 . A A . 59 GLN HB2 1 1 7 6747 1 1 59 GLN HB3 H -13.410 9.476 13.992 1.00 . A A . 59 GLN HB3 1 1 7 6748 1 1 59 GLN HE21 H -12.270 12.828 16.770 1.00 . A A . 59 GLN HE21 1 1 7 6749 1 1 59 GLN HE22 H -12.960 12.037 18.142 1.00 . A A . 59 GLN HE22 1 1 7 6750 1 1 59 GLN HG2 H -12.050 11.182 14.705 1.00 . A A . 59 GLN HG2 1 1 7 6751 1 1 59 GLN HG3 H -13.340 12.387 14.607 1.00 . A A . 59 GLN HG3 1 1 7 6752 1 1 59 GLN N N -12.920 11.175 11.942 1.00 . A A . 59 GLN N 1 1 7 6753 1 1 59 GLN NE2 N -12.810 12.117 17.177 1.00 . A A . 59 GLN NE2 1 1 7 6754 1 1 59 GLN O O -16.060 12.227 13.374 1.00 . A A . 59 GLN O 1 1 7 6755 1 1 59 GLN OE1 O -14.050 10.285 16.800 1.00 . A A . 59 GLN OE1 1 1 7 6756 1 1 60 ALA C C -15.420 15.134 13.248 1.00 . A A . 60 ALA C 1 1 7 6757 1 1 60 ALA CA C -15.400 14.464 11.876 1.00 . A A . 60 ALA CA 1 1 7 6758 1 1 60 ALA CB C -16.810 14.222 11.370 1.00 . A A . 60 ALA CB 1 1 7 6759 1 1 60 ALA H H -13.840 13.120 11.376 1.00 . A A . 60 ALA H 1 1 7 6760 1 1 60 ALA HA H -14.900 15.121 11.178 1.00 . A A . 60 ALA HA 1 1 7 6761 1 1 60 ALA HB1 H -17.100 13.207 11.592 1.00 . A A . 60 ALA HB1 1 1 7 6762 1 1 60 ALA HB2 H -16.840 14.381 10.303 1.00 . A A . 60 ALA HB2 1 1 7 6763 1 1 60 ALA HB3 H -17.490 14.907 11.858 1.00 . A A . 60 ALA HB3 1 1 7 6764 1 1 60 ALA N N -14.650 13.210 11.918 1.00 . A A . 60 ALA N 1 1 7 6765 1 1 60 ALA O O -14.650 16.054 13.517 1.00 . A A . 60 ALA O 1 1 7 6766 1 1 61 ALA C C -16.540 14.114 16.500 1.00 . A A . 61 ALA C 1 1 7 6767 1 1 61 ALA CA C -16.450 15.221 15.455 1.00 . A A . 61 ALA CA 1 1 7 6768 1 1 61 ALA CB C -17.670 16.126 15.537 1.00 . A A . 61 ALA CB 1 1 7 6769 1 1 61 ALA H H -16.910 13.931 13.842 1.00 . A A . 61 ALA H 1 1 7 6770 1 1 61 ALA HA H -15.570 15.820 15.654 1.00 . A A . 61 ALA HA 1 1 7 6771 1 1 61 ALA HB1 H -18.400 15.809 14.809 1.00 . A A . 61 ALA HB1 1 1 7 6772 1 1 61 ALA HB2 H -17.370 17.145 15.331 1.00 . A A . 61 ALA HB2 1 1 7 6773 1 1 61 ALA HB3 H -18.090 16.068 16.527 1.00 . A A . 61 ALA HB3 1 1 7 6774 1 1 61 ALA N N -16.320 14.667 14.113 1.00 . A A . 61 ALA N 1 1 7 6775 1 1 61 ALA O O -15.510 13.838 17.157 1.00 . A A . 61 ALA O 1 1 7 6776 1 1 61 ALA OXT O -17.630 13.533 16.651 1.00 . A A . 61 ALA OXT 1 1 8 6777 1 1 1 MET C C -5.265 6.126 -1.035 1.00 . A A . 1 MET C 1 1 8 6778 1 1 1 MET CA C -4.455 7.039 -0.120 1.00 . A A . 1 MET CA 1 1 8 6779 1 1 1 MET CB C -3.585 6.206 0.824 1.00 . A A . 1 MET CB 1 1 8 6780 1 1 1 MET CE C -0.438 7.295 3.001 1.00 . A A . 1 MET CE 1 1 8 6781 1 1 1 MET CG C -2.144 6.684 0.906 1.00 . A A . 1 MET CG 1 1 8 6782 1 1 1 MET H1 H -4.752 8.638 1.138 1.00 . A A . 1 MET H1 1 1 8 6783 1 1 1 MET H2 H -5.797 7.306 1.415 1.00 . A A . 1 MET H2 1 1 8 6784 1 1 1 MET H3 H -6.047 8.328 0.059 1.00 . A A . 1 MET H3 1 1 8 6785 1 1 1 MET HA H -3.819 7.669 -0.724 1.00 . A A . 1 MET HA 1 1 8 6786 1 1 1 MET HB2 H -4.011 6.247 1.817 1.00 . A A . 1 MET HB2 1 1 8 6787 1 1 1 MET HB3 H -3.581 5.181 0.485 1.00 . A A . 1 MET HB3 1 1 8 6788 1 1 1 MET HE1 H -0.729 6.544 3.722 1.00 . A A . 1 MET HE1 1 1 8 6789 1 1 1 MET HE2 H 0.072 8.100 3.508 1.00 . A A . 1 MET HE2 1 1 8 6790 1 1 1 MET HE3 H 0.222 6.853 2.270 1.00 . A A . 1 MET HE3 1 1 8 6791 1 1 1 MET HG2 H -1.509 5.839 1.124 1.00 . A A . 1 MET HG2 1 1 8 6792 1 1 1 MET HG3 H -1.866 7.106 -0.049 1.00 . A A . 1 MET HG3 1 1 8 6793 1 1 1 MET N N -5.342 7.907 0.696 1.00 . A A . 1 MET N 1 1 8 6794 1 1 1 MET O O -6.131 5.380 -0.576 1.00 . A A . 1 MET O 1 1 8 6795 1 1 1 MET SD S -1.898 7.933 2.183 1.00 . A A . 1 MET SD 1 1 8 6796 1 1 2 TYR C C -4.887 4.101 -3.623 1.00 . A A . 2 TYR C 1 1 8 6797 1 1 2 TYR CA C -5.677 5.367 -3.310 1.00 . A A . 2 TYR CA 1 1 8 6798 1 1 2 TYR CB C -5.920 6.163 -4.594 1.00 . A A . 2 TYR CB 1 1 8 6799 1 1 2 TYR CD1 C -7.680 7.645 -3.556 1.00 . A A . 2 TYR CD1 1 1 8 6800 1 1 2 TYR CD2 C -8.099 6.750 -5.727 1.00 . A A . 2 TYR CD2 1 1 8 6801 1 1 2 TYR CE1 C -8.903 8.288 -3.583 1.00 . A A . 2 TYR CE1 1 1 8 6802 1 1 2 TYR CE2 C -9.323 7.391 -5.760 1.00 . A A . 2 TYR CE2 1 1 8 6803 1 1 2 TYR CG C -7.258 6.866 -4.628 1.00 . A A . 2 TYR CG 1 1 8 6804 1 1 2 TYR CZ C -9.720 8.159 -4.686 1.00 . A A . 2 TYR CZ 1 1 8 6805 1 1 2 TYR H H -4.274 6.801 -2.635 1.00 . A A . 2 TYR H 1 1 8 6806 1 1 2 TYR HA H -6.629 5.087 -2.886 1.00 . A A . 2 TYR HA 1 1 8 6807 1 1 2 TYR HB2 H -5.150 6.911 -4.697 1.00 . A A . 2 TYR HB2 1 1 8 6808 1 1 2 TYR HB3 H -5.877 5.490 -5.439 1.00 . A A . 2 TYR HB3 1 1 8 6809 1 1 2 TYR HD1 H -7.039 7.744 -2.695 1.00 . A A . 2 TYR HD1 1 1 8 6810 1 1 2 TYR HD2 H -7.784 6.148 -6.567 1.00 . A A . 2 TYR HD2 1 1 8 6811 1 1 2 TYR HE1 H -9.214 8.889 -2.741 1.00 . A A . 2 TYR HE1 1 1 8 6812 1 1 2 TYR HE2 H -9.962 7.289 -6.624 1.00 . A A . 2 TYR HE2 1 1 8 6813 1 1 2 TYR HH H -11.390 8.663 -3.879 1.00 . A A . 2 TYR HH 1 1 8 6814 1 1 2 TYR N N -4.975 6.189 -2.331 1.00 . A A . 2 TYR N 1 1 8 6815 1 1 2 TYR O O -3.656 4.108 -3.618 1.00 . A A . 2 TYR O 1 1 8 6816 1 1 2 TYR OH O -10.930 8.798 -4.715 1.00 . A A . 2 TYR OH 1 1 8 6817 1 1 3 LYS C C -4.051 1.867 -5.419 1.00 . A A . 3 LYS C 1 1 8 6818 1 1 3 LYS CA C -4.972 1.739 -4.209 1.00 . A A . 3 LYS CA 1 1 8 6819 1 1 3 LYS CB C -6.038 0.675 -4.476 1.00 . A A . 3 LYS CB 1 1 8 6820 1 1 3 LYS CD C -6.109 -1.749 -5.138 1.00 . A A . 3 LYS CD 1 1 8 6821 1 1 3 LYS CE C -5.246 -2.999 -5.165 1.00 . A A . 3 LYS CE 1 1 8 6822 1 1 3 LYS CG C -5.592 -0.736 -4.129 1.00 . A A . 3 LYS CG 1 1 8 6823 1 1 3 LYS H H -6.582 3.075 -3.882 1.00 . A A . 3 LYS H 1 1 8 6824 1 1 3 LYS HA H -4.385 1.441 -3.355 1.00 . A A . 3 LYS HA 1 1 8 6825 1 1 3 LYS HB2 H -6.915 0.905 -3.889 1.00 . A A . 3 LYS HB2 1 1 8 6826 1 1 3 LYS HB3 H -6.300 0.700 -5.523 1.00 . A A . 3 LYS HB3 1 1 8 6827 1 1 3 LYS HD2 H -7.117 -2.026 -4.871 1.00 . A A . 3 LYS HD2 1 1 8 6828 1 1 3 LYS HD3 H -6.105 -1.298 -6.119 1.00 . A A . 3 LYS HD3 1 1 8 6829 1 1 3 LYS HE2 H -4.206 -2.704 -5.180 1.00 . A A . 3 LYS HE2 1 1 8 6830 1 1 3 LYS HE3 H -5.441 -3.577 -4.274 1.00 . A A . 3 LYS HE3 1 1 8 6831 1 1 3 LYS HG2 H -4.512 -0.771 -4.122 1.00 . A A . 3 LYS HG2 1 1 8 6832 1 1 3 LYS HG3 H -5.968 -0.992 -3.150 1.00 . A A . 3 LYS HG3 1 1 8 6833 1 1 3 LYS HZ1 H -5.304 -3.316 -7.230 1.00 . A A . 3 LYS HZ1 1 1 8 6834 1 1 3 LYS HZ2 H -6.529 -4.114 -6.380 1.00 . A A . 3 LYS HZ2 1 1 8 6835 1 1 3 LYS HZ3 H -4.947 -4.705 -6.334 1.00 . A A . 3 LYS HZ3 1 1 8 6836 1 1 3 LYS N N -5.604 3.016 -3.894 1.00 . A A . 3 LYS N 1 1 8 6837 1 1 3 LYS NZ N -5.526 -3.843 -6.361 1.00 . A A . 3 LYS NZ 1 1 8 6838 1 1 3 LYS O O -3.062 1.143 -5.537 1.00 . A A . 3 LYS O 1 1 8 6839 1 1 4 LYS C C -2.172 3.456 -7.163 1.00 . A A . 4 LYS C 1 1 8 6840 1 1 4 LYS CA C -3.585 3.009 -7.519 1.00 . A A . 4 LYS CA 1 1 8 6841 1 1 4 LYS CB C -4.254 4.055 -8.413 1.00 . A A . 4 LYS CB 1 1 8 6842 1 1 4 LYS CD C -5.017 4.066 -10.810 1.00 . A A . 4 LYS CD 1 1 8 6843 1 1 4 LYS CE C -5.693 5.427 -10.725 1.00 . A A . 4 LYS CE 1 1 8 6844 1 1 4 LYS CG C -3.826 3.974 -9.870 1.00 . A A . 4 LYS CG 1 1 8 6845 1 1 4 LYS H H -5.184 3.334 -6.169 1.00 . A A . 4 LYS H 1 1 8 6846 1 1 4 LYS HA H -3.530 2.074 -8.054 1.00 . A A . 4 LYS HA 1 1 8 6847 1 1 4 LYS HB2 H -5.326 3.920 -8.366 1.00 . A A . 4 LYS HB2 1 1 8 6848 1 1 4 LYS HB3 H -4.008 5.038 -8.042 1.00 . A A . 4 LYS HB3 1 1 8 6849 1 1 4 LYS HD2 H -4.678 3.908 -11.823 1.00 . A A . 4 LYS HD2 1 1 8 6850 1 1 4 LYS HD3 H -5.733 3.302 -10.544 1.00 . A A . 4 LYS HD3 1 1 8 6851 1 1 4 LYS HE2 H -5.036 6.110 -10.207 1.00 . A A . 4 LYS HE2 1 1 8 6852 1 1 4 LYS HE3 H -5.871 5.788 -11.726 1.00 . A A . 4 LYS HE3 1 1 8 6853 1 1 4 LYS HG2 H -3.150 4.788 -10.083 1.00 . A A . 4 LYS HG2 1 1 8 6854 1 1 4 LYS HG3 H -3.321 3.032 -10.034 1.00 . A A . 4 LYS HG3 1 1 8 6855 1 1 4 LYS HZ1 H -6.995 4.538 -9.354 1.00 . A A . 4 LYS HZ1 1 1 8 6856 1 1 4 LYS HZ2 H -7.774 5.259 -10.670 1.00 . A A . 4 LYS HZ2 1 1 8 6857 1 1 4 LYS HZ3 H -7.132 6.223 -9.437 1.00 . A A . 4 LYS HZ3 1 1 8 6858 1 1 4 LYS N N -4.383 2.789 -6.317 1.00 . A A . 4 LYS N 1 1 8 6859 1 1 4 LYS NZ N -6.989 5.357 -9.996 1.00 . A A . 4 LYS NZ 1 1 8 6860 1 1 4 LYS O O -1.193 2.936 -7.697 1.00 . A A . 4 LYS O 1 1 8 6861 1 1 5 ASP C C 0.072 3.843 -5.203 1.00 . A A . 5 ASP C 1 1 8 6862 1 1 5 ASP CA C -0.776 4.944 -5.834 1.00 . A A . 5 ASP CA 1 1 8 6863 1 1 5 ASP CB C -0.963 6.091 -4.840 1.00 . A A . 5 ASP CB 1 1 8 6864 1 1 5 ASP CG C 0.250 6.998 -4.769 1.00 . A A . 5 ASP CG 1 1 8 6865 1 1 5 ASP H H -2.888 4.802 -5.869 1.00 . A A . 5 ASP H 1 1 8 6866 1 1 5 ASP HA H -0.265 5.317 -6.709 1.00 . A A . 5 ASP HA 1 1 8 6867 1 1 5 ASP HB2 H -1.814 6.683 -5.139 1.00 . A A . 5 ASP HB2 1 1 8 6868 1 1 5 ASP HB3 H -1.142 5.682 -3.856 1.00 . A A . 5 ASP HB3 1 1 8 6869 1 1 5 ASP N N -2.071 4.425 -6.258 1.00 . A A . 5 ASP N 1 1 8 6870 1 1 5 ASP O O 1.225 3.640 -5.582 1.00 . A A . 5 ASP O 1 1 8 6871 1 1 5 ASP OD1 O 1.383 6.483 -4.875 1.00 . A A . 5 ASP OD1 1 1 8 6872 1 1 5 ASP OD2 O 0.068 8.223 -4.607 1.00 . A A . 5 ASP OD2 1 1 8 6873 1 1 6 VAL C C 0.745 1.042 -4.538 1.00 . A A . 6 VAL C 1 1 8 6874 1 1 6 VAL CA C 0.180 2.060 -3.551 1.00 . A A . 6 VAL CA 1 1 8 6875 1 1 6 VAL CB C -0.762 1.340 -2.571 1.00 . A A . 6 VAL CB 1 1 8 6876 1 1 6 VAL CG1 C 0.039 0.535 -1.576 1.00 . A A . 6 VAL CG1 1 1 8 6877 1 1 6 VAL CG2 C -1.663 2.333 -1.847 1.00 . A A . 6 VAL CG2 1 1 8 6878 1 1 6 VAL H H -1.426 3.342 -3.979 1.00 . A A . 6 VAL H 1 1 8 6879 1 1 6 VAL HA H 0.995 2.489 -2.985 1.00 . A A . 6 VAL HA 1 1 8 6880 1 1 6 VAL HB H -1.386 0.663 -3.134 1.00 . A A . 6 VAL HB 1 1 8 6881 1 1 6 VAL HG11 H 0.743 1.185 -1.082 1.00 . A A . 6 VAL HG11 1 1 8 6882 1 1 6 VAL HG12 H 0.571 -0.247 -2.095 1.00 . A A . 6 VAL HG12 1 1 8 6883 1 1 6 VAL HG13 H -0.626 0.100 -0.848 1.00 . A A . 6 VAL HG13 1 1 8 6884 1 1 6 VAL HG21 H -2.570 2.477 -2.416 1.00 . A A . 6 VAL HG21 1 1 8 6885 1 1 6 VAL HG22 H -1.149 3.277 -1.744 1.00 . A A . 6 VAL HG22 1 1 8 6886 1 1 6 VAL HG23 H -1.909 1.948 -0.868 1.00 . A A . 6 VAL HG23 1 1 8 6887 1 1 6 VAL N N -0.508 3.136 -4.238 1.00 . A A . 6 VAL N 1 1 8 6888 1 1 6 VAL O O 1.925 0.695 -4.485 1.00 . A A . 6 VAL O 1 1 8 6889 1 1 7 ILE C C 1.430 0.126 -7.312 1.00 . A A . 7 ILE C 1 1 8 6890 1 1 7 ILE CA C 0.298 -0.415 -6.437 1.00 . A A . 7 ILE CA 1 1 8 6891 1 1 7 ILE CB C -0.893 -0.826 -7.332 1.00 . A A . 7 ILE CB 1 1 8 6892 1 1 7 ILE CD1 C -3.107 -2.086 -7.327 1.00 . A A . 7 ILE CD1 1 1 8 6893 1 1 7 ILE CG1 C -1.915 -1.620 -6.518 1.00 . A A . 7 ILE CG1 1 1 8 6894 1 1 7 ILE CG2 C -0.416 -1.639 -8.528 1.00 . A A . 7 ILE CG2 1 1 8 6895 1 1 7 ILE H H -1.038 0.878 -5.428 1.00 . A A . 7 ILE H 1 1 8 6896 1 1 7 ILE HA H 0.650 -1.294 -5.915 1.00 . A A . 7 ILE HA 1 1 8 6897 1 1 7 ILE HB H -1.360 0.072 -7.703 1.00 . A A . 7 ILE HB 1 1 8 6898 1 1 7 ILE HD11 H -2.883 -2.000 -8.380 1.00 . A A . 7 ILE HD11 1 1 8 6899 1 1 7 ILE HD12 H -3.964 -1.471 -7.091 1.00 . A A . 7 ILE HD12 1 1 8 6900 1 1 7 ILE HD13 H -3.326 -3.116 -7.088 1.00 . A A . 7 ILE HD13 1 1 8 6901 1 1 7 ILE HG12 H -1.437 -2.495 -6.104 1.00 . A A . 7 ILE HG12 1 1 8 6902 1 1 7 ILE HG13 H -2.283 -1.002 -5.710 1.00 . A A . 7 ILE HG13 1 1 8 6903 1 1 7 ILE HG21 H -1.267 -1.960 -9.108 1.00 . A A . 7 ILE HG21 1 1 8 6904 1 1 7 ILE HG22 H 0.131 -2.502 -8.182 1.00 . A A . 7 ILE HG22 1 1 8 6905 1 1 7 ILE HG23 H 0.229 -1.026 -9.143 1.00 . A A . 7 ILE HG23 1 1 8 6906 1 1 7 ILE N N -0.109 0.564 -5.438 1.00 . A A . 7 ILE N 1 1 8 6907 1 1 7 ILE O O 2.232 -0.639 -7.846 1.00 . A A . 7 ILE O 1 1 8 6908 1 1 8 ASP C C 3.848 2.099 -7.501 1.00 . A A . 8 ASP C 1 1 8 6909 1 1 8 ASP CA C 2.525 2.082 -8.255 1.00 . A A . 8 ASP CA 1 1 8 6910 1 1 8 ASP CB C 2.110 3.508 -8.624 1.00 . A A . 8 ASP CB 1 1 8 6911 1 1 8 ASP CG C 2.245 3.783 -10.109 1.00 . A A . 8 ASP CG 1 1 8 6912 1 1 8 ASP H H 0.829 2.004 -6.999 1.00 . A A . 8 ASP H 1 1 8 6913 1 1 8 ASP HA H 2.645 1.504 -9.160 1.00 . A A . 8 ASP HA 1 1 8 6914 1 1 8 ASP HB2 H 1.080 3.661 -8.340 1.00 . A A . 8 ASP HB2 1 1 8 6915 1 1 8 ASP HB3 H 2.734 4.210 -8.088 1.00 . A A . 8 ASP HB3 1 1 8 6916 1 1 8 ASP N N 1.491 1.446 -7.450 1.00 . A A . 8 ASP N 1 1 8 6917 1 1 8 ASP O O 4.920 2.088 -8.105 1.00 . A A . 8 ASP O 1 1 8 6918 1 1 8 ASP OD1 O 1.317 3.424 -10.864 1.00 . A A . 8 ASP OD1 1 1 8 6919 1 1 8 ASP OD2 O 3.276 4.358 -10.515 1.00 . A A . 8 ASP OD2 1 1 8 6920 1 1 9 HIS C C 5.444 0.718 -5.078 1.00 . A A . 9 HIS C 1 1 8 6921 1 1 9 HIS CA C 4.948 2.139 -5.336 1.00 . A A . 9 HIS CA 1 1 8 6922 1 1 9 HIS CB C 4.648 2.846 -4.010 1.00 . A A . 9 HIS CB 1 1 8 6923 1 1 9 HIS CD2 C 6.124 1.739 -2.187 1.00 . A A . 9 HIS CD2 1 1 8 6924 1 1 9 HIS CE1 C 7.505 3.404 -1.835 1.00 . A A . 9 HIS CE1 1 1 8 6925 1 1 9 HIS CG C 5.759 2.751 -3.009 1.00 . A A . 9 HIS CG 1 1 8 6926 1 1 9 HIS H H 2.877 2.129 -5.754 1.00 . A A . 9 HIS H 1 1 8 6927 1 1 9 HIS HA H 5.711 2.686 -5.862 1.00 . A A . 9 HIS HA 1 1 8 6928 1 1 9 HIS HB2 H 4.466 3.892 -4.203 1.00 . A A . 9 HIS HB2 1 1 8 6929 1 1 9 HIS HB3 H 3.764 2.408 -3.570 1.00 . A A . 9 HIS HB3 1 1 8 6930 1 1 9 HIS HD1 H 6.642 4.654 -3.205 1.00 . A A . 9 HIS HD1 1 1 8 6931 1 1 9 HIS HD2 H 5.648 0.770 -2.110 1.00 . A A . 9 HIS HD2 1 1 8 6932 1 1 9 HIS HE1 H 8.312 4.005 -1.439 1.00 . A A . 9 HIS HE1 1 1 8 6933 1 1 9 HIS HE2 H 7.741 1.623 -0.852 1.00 . A A . 9 HIS HE2 1 1 8 6934 1 1 9 HIS N N 3.761 2.124 -6.176 1.00 . A A . 9 HIS N 1 1 8 6935 1 1 9 HIS ND1 N 6.643 3.780 -2.763 1.00 . A A . 9 HIS ND1 1 1 8 6936 1 1 9 HIS NE2 N 7.212 2.171 -1.468 1.00 . A A . 9 HIS NE2 1 1 8 6937 1 1 9 HIS O O 6.643 0.487 -4.920 1.00 . A A . 9 HIS O 1 1 8 6938 1 1 10 PHE C C 5.054 -2.375 -6.108 1.00 . A A . 10 PHE C 1 1 8 6939 1 1 10 PHE CA C 4.848 -1.627 -4.795 1.00 . A A . 10 PHE CA 1 1 8 6940 1 1 10 PHE CB C 3.743 -2.299 -3.982 1.00 . A A . 10 PHE CB 1 1 8 6941 1 1 10 PHE CD1 C 4.630 -2.771 -1.689 1.00 . A A . 10 PHE CD1 1 1 8 6942 1 1 10 PHE CD2 C 3.109 -0.959 -1.963 1.00 . A A . 10 PHE CD2 1 1 8 6943 1 1 10 PHE CE1 C 4.714 -2.503 -0.336 1.00 . A A . 10 PHE CE1 1 1 8 6944 1 1 10 PHE CE2 C 3.187 -0.683 -0.611 1.00 . A A . 10 PHE CE2 1 1 8 6945 1 1 10 PHE CG C 3.827 -2.005 -2.514 1.00 . A A . 10 PHE CG 1 1 8 6946 1 1 10 PHE CZ C 3.992 -1.455 0.203 1.00 . A A . 10 PHE CZ 1 1 8 6947 1 1 10 PHE H H 3.574 0.021 -5.168 1.00 . A A . 10 PHE H 1 1 8 6948 1 1 10 PHE HA H 5.766 -1.658 -4.226 1.00 . A A . 10 PHE HA 1 1 8 6949 1 1 10 PHE HB2 H 2.783 -1.955 -4.336 1.00 . A A . 10 PHE HB2 1 1 8 6950 1 1 10 PHE HB3 H 3.810 -3.369 -4.112 1.00 . A A . 10 PHE HB3 1 1 8 6951 1 1 10 PHE HD1 H 5.195 -3.588 -2.113 1.00 . A A . 10 PHE HD1 1 1 8 6952 1 1 10 PHE HD2 H 2.480 -0.355 -2.600 1.00 . A A . 10 PHE HD2 1 1 8 6953 1 1 10 PHE HE1 H 5.345 -3.109 0.298 1.00 . A A . 10 PHE HE1 1 1 8 6954 1 1 10 PHE HE2 H 2.621 0.136 -0.195 1.00 . A A . 10 PHE HE2 1 1 8 6955 1 1 10 PHE HZ H 4.056 -1.243 1.261 1.00 . A A . 10 PHE HZ 1 1 8 6956 1 1 10 PHE N N 4.511 -0.228 -5.035 1.00 . A A . 10 PHE N 1 1 8 6957 1 1 10 PHE O O 5.819 -3.337 -6.172 1.00 . A A . 10 PHE O 1 1 8 6958 1 1 11 GLY C C 3.460 -3.684 -8.629 1.00 . A A . 11 GLY C 1 1 8 6959 1 1 11 GLY CA C 4.478 -2.575 -8.445 1.00 . A A . 11 GLY CA 1 1 8 6960 1 1 11 GLY H H 3.762 -1.164 -7.041 1.00 . A A . 11 GLY H 1 1 8 6961 1 1 11 GLY HA2 H 4.333 -1.835 -9.219 1.00 . A A . 11 GLY HA2 1 1 8 6962 1 1 11 GLY HA3 H 5.470 -2.993 -8.542 1.00 . A A . 11 GLY HA3 1 1 8 6963 1 1 11 GLY N N 4.361 -1.931 -7.151 1.00 . A A . 11 GLY N 1 1 8 6964 1 1 11 GLY O O 2.765 -3.739 -9.643 1.00 . A A . 11 GLY O 1 1 8 6965 1 1 12 THR C C 1.669 -5.796 -6.370 1.00 . A A . 12 THR C 1 1 8 6966 1 1 12 THR CA C 2.430 -5.679 -7.687 1.00 . A A . 12 THR CA 1 1 8 6967 1 1 12 THR CB C 3.167 -6.986 -7.985 1.00 . A A . 12 THR CB 1 1 8 6968 1 1 12 THR CG2 C 3.150 -7.361 -9.451 1.00 . A A . 12 THR CG2 1 1 8 6969 1 1 12 THR H H 3.951 -4.467 -6.856 1.00 . A A . 12 THR H 1 1 8 6970 1 1 12 THR HA H 1.725 -5.484 -8.481 1.00 . A A . 12 THR HA 1 1 8 6971 1 1 12 THR HB H 2.695 -7.788 -7.434 1.00 . A A . 12 THR HB 1 1 8 6972 1 1 12 THR HG1 H 4.569 -6.513 -6.702 1.00 . A A . 12 THR HG1 1 1 8 6973 1 1 12 THR HG21 H 2.460 -6.719 -9.978 1.00 . A A . 12 THR HG21 1 1 8 6974 1 1 12 THR HG22 H 2.838 -8.389 -9.556 1.00 . A A . 12 THR HG22 1 1 8 6975 1 1 12 THR HG23 H 4.141 -7.242 -9.864 1.00 . A A . 12 THR HG23 1 1 8 6976 1 1 12 THR N N 3.372 -4.567 -7.639 1.00 . A A . 12 THR N 1 1 8 6977 1 1 12 THR O O 2.240 -5.620 -5.293 1.00 . A A . 12 THR O 1 1 8 6978 1 1 12 THR OG1 O 4.521 -6.904 -7.578 1.00 . A A . 12 THR OG1 1 1 8 6979 1 1 13 GLN C C 0.181 -7.135 -4.236 1.00 . A A . 13 GLN C 1 1 8 6980 1 1 13 GLN CA C -0.468 -6.226 -5.276 1.00 . A A . 13 GLN CA 1 1 8 6981 1 1 13 GLN CB C -1.844 -6.775 -5.662 1.00 . A A . 13 GLN CB 1 1 8 6982 1 1 13 GLN CD C -3.035 -8.205 -7.370 1.00 . A A . 13 GLN CD 1 1 8 6983 1 1 13 GLN CG C -1.783 -8.018 -6.535 1.00 . A A . 13 GLN CG 1 1 8 6984 1 1 13 GLN H H -0.023 -6.216 -7.349 1.00 . A A . 13 GLN H 1 1 8 6985 1 1 13 GLN HA H -0.592 -5.242 -4.848 1.00 . A A . 13 GLN HA 1 1 8 6986 1 1 13 GLN HB2 H -2.385 -7.021 -4.762 1.00 . A A . 13 GLN HB2 1 1 8 6987 1 1 13 GLN HB3 H -2.385 -6.011 -6.199 1.00 . A A . 13 GLN HB3 1 1 8 6988 1 1 13 GLN HE21 H -4.167 -8.117 -5.738 1.00 . A A . 13 GLN HE21 1 1 8 6989 1 1 13 GLN HE22 H -5.013 -8.344 -7.226 1.00 . A A . 13 GLN HE22 1 1 8 6990 1 1 13 GLN HG2 H -0.936 -7.935 -7.200 1.00 . A A . 13 GLN HG2 1 1 8 6991 1 1 13 GLN HG3 H -1.658 -8.882 -5.902 1.00 . A A . 13 GLN HG3 1 1 8 6992 1 1 13 GLN N N 0.376 -6.090 -6.462 1.00 . A A . 13 GLN N 1 1 8 6993 1 1 13 GLN NE2 N -4.188 -8.223 -6.712 1.00 . A A . 13 GLN NE2 1 1 8 6994 1 1 13 GLN O O 0.314 -6.763 -3.069 1.00 . A A . 13 GLN O 1 1 8 6995 1 1 13 GLN OE1 O -2.968 -8.331 -8.593 1.00 . A A . 13 GLN OE1 1 1 8 6996 1 1 14 ARG C C 2.319 -8.641 -2.942 1.00 . A A . 14 ARG C 1 1 8 6997 1 1 14 ARG CA C 1.223 -9.293 -3.779 1.00 . A A . 14 ARG CA 1 1 8 6998 1 1 14 ARG CB C 1.806 -10.445 -4.598 1.00 . A A . 14 ARG CB 1 1 8 6999 1 1 14 ARG CD C 3.767 -10.769 -6.135 1.00 . A A . 14 ARG CD 1 1 8 7000 1 1 14 ARG CG C 2.481 -9.999 -5.885 1.00 . A A . 14 ARG CG 1 1 8 7001 1 1 14 ARG CZ C 6.044 -10.335 -6.975 1.00 . A A . 14 ARG CZ 1 1 8 7002 1 1 14 ARG H H 0.456 -8.564 -5.606 1.00 . A A . 14 ARG H 1 1 8 7003 1 1 14 ARG HA H 0.465 -9.684 -3.117 1.00 . A A . 14 ARG HA 1 1 8 7004 1 1 14 ARG HB2 H 2.532 -10.962 -3.996 1.00 . A A . 14 ARG HB2 1 1 8 7005 1 1 14 ARG HB3 H 1.010 -11.130 -4.853 1.00 . A A . 14 ARG HB3 1 1 8 7006 1 1 14 ARG HD2 H 4.138 -11.144 -5.194 1.00 . A A . 14 ARG HD2 1 1 8 7007 1 1 14 ARG HD3 H 3.553 -11.599 -6.793 1.00 . A A . 14 ARG HD3 1 1 8 7008 1 1 14 ARG HE H 4.542 -9.021 -7.009 1.00 . A A . 14 ARG HE 1 1 8 7009 1 1 14 ARG HG2 H 1.807 -10.166 -6.711 1.00 . A A . 14 ARG HG2 1 1 8 7010 1 1 14 ARG HG3 H 2.711 -8.945 -5.812 1.00 . A A . 14 ARG HG3 1 1 8 7011 1 1 14 ARG HH11 H 5.771 -12.188 -6.211 1.00 . A A . 14 ARG HH11 1 1 8 7012 1 1 14 ARG HH12 H 7.363 -11.858 -6.806 1.00 . A A . 14 ARG HH12 1 1 8 7013 1 1 14 ARG HH21 H 6.634 -8.585 -7.796 1.00 . A A . 14 ARG HH21 1 1 8 7014 1 1 14 ARG HH22 H 7.854 -9.812 -7.706 1.00 . A A . 14 ARG HH22 1 1 8 7015 1 1 14 ARG N N 0.587 -8.327 -4.665 1.00 . A A . 14 ARG N 1 1 8 7016 1 1 14 ARG NE N 4.796 -9.931 -6.750 1.00 . A A . 14 ARG NE 1 1 8 7017 1 1 14 ARG NH1 N 6.423 -11.561 -6.637 1.00 . A A . 14 ARG NH1 1 1 8 7018 1 1 14 ARG NH2 N 6.916 -9.511 -7.538 1.00 . A A . 14 ARG NH2 1 1 8 7019 1 1 14 ARG O O 2.508 -8.985 -1.774 1.00 . A A . 14 ARG O 1 1 8 7020 1 1 15 ALA C C 3.582 -6.268 -1.619 1.00 . A A . 15 ALA C 1 1 8 7021 1 1 15 ALA CA C 4.113 -7.001 -2.847 1.00 . A A . 15 ALA CA 1 1 8 7022 1 1 15 ALA CB C 4.806 -6.028 -3.789 1.00 . A A . 15 ALA CB 1 1 8 7023 1 1 15 ALA H H 2.841 -7.466 -4.474 1.00 . A A . 15 ALA H 1 1 8 7024 1 1 15 ALA HA H 4.837 -7.736 -2.528 1.00 . A A . 15 ALA HA 1 1 8 7025 1 1 15 ALA HB1 H 4.358 -6.094 -4.769 1.00 . A A . 15 ALA HB1 1 1 8 7026 1 1 15 ALA HB2 H 5.855 -6.278 -3.856 1.00 . A A . 15 ALA HB2 1 1 8 7027 1 1 15 ALA HB3 H 4.701 -5.021 -3.412 1.00 . A A . 15 ALA HB3 1 1 8 7028 1 1 15 ALA N N 3.037 -7.699 -3.543 1.00 . A A . 15 ALA N 1 1 8 7029 1 1 15 ALA O O 4.109 -6.418 -0.517 1.00 . A A . 15 ALA O 1 1 8 7030 1 1 16 VAL C C 1.536 -5.638 0.427 1.00 . A A . 16 VAL C 1 1 8 7031 1 1 16 VAL CA C 1.922 -4.723 -0.731 1.00 . A A . 16 VAL CA 1 1 8 7032 1 1 16 VAL CB C 0.665 -3.951 -1.194 1.00 . A A . 16 VAL CB 1 1 8 7033 1 1 16 VAL CG1 C 0.535 -2.657 -0.419 1.00 . A A . 16 VAL CG1 1 1 8 7034 1 1 16 VAL CG2 C 0.702 -3.667 -2.691 1.00 . A A . 16 VAL CG2 1 1 8 7035 1 1 16 VAL H H 2.156 -5.402 -2.716 1.00 . A A . 16 VAL H 1 1 8 7036 1 1 16 VAL HA H 2.648 -4.004 -0.380 1.00 . A A . 16 VAL HA 1 1 8 7037 1 1 16 VAL HB H -0.204 -4.558 -0.985 1.00 . A A . 16 VAL HB 1 1 8 7038 1 1 16 VAL HG11 H 1.014 -1.864 -0.970 1.00 . A A . 16 VAL HG11 1 1 8 7039 1 1 16 VAL HG12 H 1.012 -2.768 0.542 1.00 . A A . 16 VAL HG12 1 1 8 7040 1 1 16 VAL HG13 H -0.508 -2.423 -0.281 1.00 . A A . 16 VAL HG13 1 1 8 7041 1 1 16 VAL HG21 H 1.718 -3.460 -2.992 1.00 . A A . 16 VAL HG21 1 1 8 7042 1 1 16 VAL HG22 H 0.080 -2.811 -2.910 1.00 . A A . 16 VAL HG22 1 1 8 7043 1 1 16 VAL HG23 H 0.333 -4.526 -3.230 1.00 . A A . 16 VAL HG23 1 1 8 7044 1 1 16 VAL N N 2.530 -5.478 -1.817 1.00 . A A . 16 VAL N 1 1 8 7045 1 1 16 VAL O O 1.562 -5.231 1.590 1.00 . A A . 16 VAL O 1 1 8 7046 1 1 17 ALA C C 1.952 -8.193 2.035 1.00 . A A . 17 ALA C 1 1 8 7047 1 1 17 ALA CA C 0.786 -7.850 1.112 1.00 . A A . 17 ALA CA 1 1 8 7048 1 1 17 ALA CB C 0.248 -9.109 0.447 1.00 . A A . 17 ALA CB 1 1 8 7049 1 1 17 ALA H H 1.177 -7.140 -0.842 1.00 . A A . 17 ALA H 1 1 8 7050 1 1 17 ALA HA H -0.009 -7.417 1.701 1.00 . A A . 17 ALA HA 1 1 8 7051 1 1 17 ALA HB1 H 0.207 -8.963 -0.622 1.00 . A A . 17 ALA HB1 1 1 8 7052 1 1 17 ALA HB2 H -0.745 -9.317 0.819 1.00 . A A . 17 ALA HB2 1 1 8 7053 1 1 17 ALA HB3 H 0.896 -9.943 0.672 1.00 . A A . 17 ALA HB3 1 1 8 7054 1 1 17 ALA N N 1.178 -6.876 0.101 1.00 . A A . 17 ALA N 1 1 8 7055 1 1 17 ALA O O 1.751 -8.585 3.184 1.00 . A A . 17 ALA O 1 1 8 7056 1 1 18 LYS C C 4.644 -7.230 3.320 1.00 . A A . 18 LYS C 1 1 8 7057 1 1 18 LYS CA C 4.367 -8.337 2.309 1.00 . A A . 18 LYS CA 1 1 8 7058 1 1 18 LYS CB C 5.574 -8.513 1.386 1.00 . A A . 18 LYS CB 1 1 8 7059 1 1 18 LYS CD C 7.240 -10.215 0.583 1.00 . A A . 18 LYS CD 1 1 8 7060 1 1 18 LYS CE C 7.575 -11.693 0.698 1.00 . A A . 18 LYS CE 1 1 8 7061 1 1 18 LYS CG C 5.782 -9.947 0.922 1.00 . A A . 18 LYS CG 1 1 8 7062 1 1 18 LYS H H 3.270 -7.727 0.603 1.00 . A A . 18 LYS H 1 1 8 7063 1 1 18 LYS HA H 4.194 -9.260 2.842 1.00 . A A . 18 LYS HA 1 1 8 7064 1 1 18 LYS HB2 H 5.440 -7.891 0.513 1.00 . A A . 18 LYS HB2 1 1 8 7065 1 1 18 LYS HB3 H 6.462 -8.195 1.910 1.00 . A A . 18 LYS HB3 1 1 8 7066 1 1 18 LYS HD2 H 7.429 -9.890 -0.430 1.00 . A A . 18 LYS HD2 1 1 8 7067 1 1 18 LYS HD3 H 7.866 -9.658 1.264 1.00 . A A . 18 LYS HD3 1 1 8 7068 1 1 18 LYS HE2 H 6.814 -12.263 0.185 1.00 . A A . 18 LYS HE2 1 1 8 7069 1 1 18 LYS HE3 H 8.531 -11.869 0.231 1.00 . A A . 18 LYS HE3 1 1 8 7070 1 1 18 LYS HG2 H 5.476 -10.618 1.711 1.00 . A A . 18 LYS HG2 1 1 8 7071 1 1 18 LYS HG3 H 5.178 -10.120 0.044 1.00 . A A . 18 LYS HG3 1 1 8 7072 1 1 18 LYS HZ1 H 7.669 -13.177 2.165 1.00 . A A . 18 LYS HZ1 1 1 8 7073 1 1 18 LYS HZ2 H 6.799 -11.805 2.634 1.00 . A A . 18 LYS HZ2 1 1 8 7074 1 1 18 LYS HZ3 H 8.488 -11.755 2.575 1.00 . A A . 18 LYS HZ3 1 1 8 7075 1 1 18 LYS N N 3.171 -8.041 1.526 1.00 . A A . 18 LYS N 1 1 8 7076 1 1 18 LYS NZ N 7.637 -12.139 2.118 1.00 . A A . 18 LYS NZ 1 1 8 7077 1 1 18 LYS O O 4.813 -7.492 4.511 1.00 . A A . 18 LYS O 1 1 8 7078 1 1 19 ALA C C 3.897 -4.734 4.798 1.00 . A A . 19 ALA C 1 1 8 7079 1 1 19 ALA CA C 4.950 -4.845 3.700 1.00 . A A . 19 ALA CA 1 1 8 7080 1 1 19 ALA CB C 4.991 -3.567 2.875 1.00 . A A . 19 ALA CB 1 1 8 7081 1 1 19 ALA H H 4.548 -5.848 1.880 1.00 . A A . 19 ALA H 1 1 8 7082 1 1 19 ALA HA H 5.918 -4.983 4.156 1.00 . A A . 19 ALA HA 1 1 8 7083 1 1 19 ALA HB1 H 6.014 -3.352 2.599 1.00 . A A . 19 ALA HB1 1 1 8 7084 1 1 19 ALA HB2 H 4.596 -2.749 3.458 1.00 . A A . 19 ALA HB2 1 1 8 7085 1 1 19 ALA HB3 H 4.397 -3.694 1.984 1.00 . A A . 19 ALA HB3 1 1 8 7086 1 1 19 ALA N N 4.690 -5.993 2.839 1.00 . A A . 19 ALA N 1 1 8 7087 1 1 19 ALA O O 4.212 -4.397 5.940 1.00 . A A . 19 ALA O 1 1 8 7088 1 1 20 LEU C C 1.382 -6.271 6.140 1.00 . A A . 20 LEU C 1 1 8 7089 1 1 20 LEU CA C 1.550 -4.946 5.405 1.00 . A A . 20 LEU CA 1 1 8 7090 1 1 20 LEU CB C 0.247 -4.571 4.693 1.00 . A A . 20 LEU CB 1 1 8 7091 1 1 20 LEU CD1 C -1.291 -2.674 4.128 1.00 . A A . 20 LEU CD1 1 1 8 7092 1 1 20 LEU CD2 C -1.276 -3.622 6.441 1.00 . A A . 20 LEU CD2 1 1 8 7093 1 1 20 LEU CG C -0.435 -3.304 5.214 1.00 . A A . 20 LEU CG 1 1 8 7094 1 1 20 LEU H H 2.458 -5.277 3.521 1.00 . A A . 20 LEU H 1 1 8 7095 1 1 20 LEU HA H 1.789 -4.176 6.125 1.00 . A A . 20 LEU HA 1 1 8 7096 1 1 20 LEU HB2 H 0.463 -4.432 3.643 1.00 . A A . 20 LEU HB2 1 1 8 7097 1 1 20 LEU HB3 H -0.446 -5.393 4.794 1.00 . A A . 20 LEU HB3 1 1 8 7098 1 1 20 LEU HD11 H -1.840 -3.446 3.608 1.00 . A A . 20 LEU HD11 1 1 8 7099 1 1 20 LEU HD12 H -0.656 -2.152 3.428 1.00 . A A . 20 LEU HD12 1 1 8 7100 1 1 20 LEU HD13 H -1.985 -1.978 4.575 1.00 . A A . 20 LEU HD13 1 1 8 7101 1 1 20 LEU HD21 H -1.356 -2.740 7.060 1.00 . A A . 20 LEU HD21 1 1 8 7102 1 1 20 LEU HD22 H -0.807 -4.416 7.004 1.00 . A A . 20 LEU HD22 1 1 8 7103 1 1 20 LEU HD23 H -2.262 -3.935 6.132 1.00 . A A . 20 LEU HD23 1 1 8 7104 1 1 20 LEU HG H 0.321 -2.590 5.501 1.00 . A A . 20 LEU HG 1 1 8 7105 1 1 20 LEU N N 2.647 -5.015 4.447 1.00 . A A . 20 LEU N 1 1 8 7106 1 1 20 LEU O O 0.964 -6.303 7.298 1.00 . A A . 20 LEU O 1 1 8 7107 1 1 21 GLY C C 0.204 -9.271 5.893 1.00 . A A . 21 GLY C 1 1 8 7108 1 1 21 GLY CA C 1.589 -8.679 6.064 1.00 . A A . 21 GLY CA 1 1 8 7109 1 1 21 GLY H H 2.038 -7.279 4.540 1.00 . A A . 21 GLY H 1 1 8 7110 1 1 21 GLY HA2 H 2.310 -9.341 5.609 1.00 . A A . 21 GLY HA2 1 1 8 7111 1 1 21 GLY HA3 H 1.806 -8.599 7.120 1.00 . A A . 21 GLY HA3 1 1 8 7112 1 1 21 GLY N N 1.711 -7.366 5.461 1.00 . A A . 21 GLY N 1 1 8 7113 1 1 21 GLY O O -0.246 -10.065 6.718 1.00 . A A . 21 GLY O 1 1 8 7114 1 1 22 ILE C C -1.822 -10.285 3.311 1.00 . A A . 22 ILE C 1 1 8 7115 1 1 22 ILE CA C -1.816 -9.380 4.538 1.00 . A A . 22 ILE CA 1 1 8 7116 1 1 22 ILE CB C -2.807 -8.222 4.314 1.00 . A A . 22 ILE CB 1 1 8 7117 1 1 22 ILE CD1 C -3.233 -6.138 2.916 1.00 . A A . 22 ILE CD1 1 1 8 7118 1 1 22 ILE CG1 C -2.291 -7.283 3.223 1.00 . A A . 22 ILE CG1 1 1 8 7119 1 1 22 ILE CG2 C -3.037 -7.462 5.611 1.00 . A A . 22 ILE CG2 1 1 8 7120 1 1 22 ILE H H -0.061 -8.246 4.195 1.00 . A A . 22 ILE H 1 1 8 7121 1 1 22 ILE HA H -2.146 -9.948 5.396 1.00 . A A . 22 ILE HA 1 1 8 7122 1 1 22 ILE HB H -3.752 -8.642 4.001 1.00 . A A . 22 ILE HB 1 1 8 7123 1 1 22 ILE HD11 H -3.111 -5.837 1.887 1.00 . A A . 22 ILE HD11 1 1 8 7124 1 1 22 ILE HD12 H -3.007 -5.303 3.564 1.00 . A A . 22 ILE HD12 1 1 8 7125 1 1 22 ILE HD13 H -4.252 -6.455 3.081 1.00 . A A . 22 ILE HD13 1 1 8 7126 1 1 22 ILE HG12 H -1.348 -6.860 3.537 1.00 . A A . 22 ILE HG12 1 1 8 7127 1 1 22 ILE HG13 H -2.145 -7.845 2.313 1.00 . A A . 22 ILE HG13 1 1 8 7128 1 1 22 ILE HG21 H -3.378 -6.463 5.388 1.00 . A A . 22 ILE HG21 1 1 8 7129 1 1 22 ILE HG22 H -2.112 -7.412 6.168 1.00 . A A . 22 ILE HG22 1 1 8 7130 1 1 22 ILE HG23 H -3.784 -7.973 6.201 1.00 . A A . 22 ILE HG23 1 1 8 7131 1 1 22 ILE N N -0.474 -8.883 4.816 1.00 . A A . 22 ILE N 1 1 8 7132 1 1 22 ILE O O -0.782 -10.528 2.702 1.00 . A A . 22 ILE O 1 1 8 7133 1 1 23 SER C C -3.349 -10.854 0.522 1.00 . A A . 23 SER C 1 1 8 7134 1 1 23 SER CA C -3.143 -11.662 1.799 1.00 . A A . 23 SER CA 1 1 8 7135 1 1 23 SER CB C -4.315 -12.624 2.003 1.00 . A A . 23 SER CB 1 1 8 7136 1 1 23 SER H H -3.797 -10.552 3.479 1.00 . A A . 23 SER H 1 1 8 7137 1 1 23 SER HA H -2.233 -12.234 1.706 1.00 . A A . 23 SER HA 1 1 8 7138 1 1 23 SER HB2 H -4.094 -13.288 2.824 1.00 . A A . 23 SER HB2 1 1 8 7139 1 1 23 SER HB3 H -5.207 -12.059 2.228 1.00 . A A . 23 SER HB3 1 1 8 7140 1 1 23 SER HG H -5.176 -14.096 1.040 1.00 . A A . 23 SER HG 1 1 8 7141 1 1 23 SER N N -3.002 -10.783 2.954 1.00 . A A . 23 SER N 1 1 8 7142 1 1 23 SER O O -3.732 -9.684 0.570 1.00 . A A . 23 SER O 1 1 8 7143 1 1 23 SER OG O -4.547 -13.399 0.840 1.00 . A A . 23 SER OG 1 1 8 7144 1 1 24 ASP C C -4.699 -10.396 -2.129 1.00 . A A . 24 ASP C 1 1 8 7145 1 1 24 ASP CA C -3.252 -10.824 -1.911 1.00 . A A . 24 ASP CA 1 1 8 7146 1 1 24 ASP CB C -2.807 -11.755 -3.040 1.00 . A A . 24 ASP CB 1 1 8 7147 1 1 24 ASP CG C -2.127 -11.009 -4.169 1.00 . A A . 24 ASP CG 1 1 8 7148 1 1 24 ASP H H -2.793 -12.417 -0.593 1.00 . A A . 24 ASP H 1 1 8 7149 1 1 24 ASP HA H -2.624 -9.946 -1.913 1.00 . A A . 24 ASP HA 1 1 8 7150 1 1 24 ASP HB2 H -2.114 -12.484 -2.646 1.00 . A A . 24 ASP HB2 1 1 8 7151 1 1 24 ASP HB3 H -3.673 -12.265 -3.439 1.00 . A A . 24 ASP HB3 1 1 8 7152 1 1 24 ASP N N -3.094 -11.485 -0.620 1.00 . A A . 24 ASP N 1 1 8 7153 1 1 24 ASP O O -4.967 -9.391 -2.787 1.00 . A A . 24 ASP O 1 1 8 7154 1 1 24 ASP OD1 O -1.607 -9.900 -3.919 1.00 . A A . 24 ASP OD1 1 1 8 7155 1 1 24 ASP OD2 O -2.114 -11.530 -5.303 1.00 . A A . 24 ASP OD2 1 1 8 7156 1 1 25 ALA C C -7.411 -9.573 -0.990 1.00 . A A . 25 ALA C 1 1 8 7157 1 1 25 ALA CA C -7.049 -10.868 -1.709 1.00 . A A . 25 ALA CA 1 1 8 7158 1 1 25 ALA CB C -7.883 -12.021 -1.171 1.00 . A A . 25 ALA CB 1 1 8 7159 1 1 25 ALA H H -5.354 -11.954 -1.062 1.00 . A A . 25 ALA H 1 1 8 7160 1 1 25 ALA HA H -7.269 -10.756 -2.761 1.00 . A A . 25 ALA HA 1 1 8 7161 1 1 25 ALA HB1 H -7.323 -12.940 -1.258 1.00 . A A . 25 ALA HB1 1 1 8 7162 1 1 25 ALA HB2 H -8.797 -12.101 -1.741 1.00 . A A . 25 ALA HB2 1 1 8 7163 1 1 25 ALA HB3 H -8.121 -11.840 -0.133 1.00 . A A . 25 ALA HB3 1 1 8 7164 1 1 25 ALA N N -5.630 -11.166 -1.574 1.00 . A A . 25 ALA N 1 1 8 7165 1 1 25 ALA O O -8.145 -8.740 -1.521 1.00 . A A . 25 ALA O 1 1 8 7166 1 1 26 ALA C C -6.736 -6.952 0.272 1.00 . A A . 26 ALA C 1 1 8 7167 1 1 26 ALA CA C -7.158 -8.215 1.016 1.00 . A A . 26 ALA CA 1 1 8 7168 1 1 26 ALA CB C -6.446 -8.303 2.357 1.00 . A A . 26 ALA CB 1 1 8 7169 1 1 26 ALA H H -6.312 -10.108 0.593 1.00 . A A . 26 ALA H 1 1 8 7170 1 1 26 ALA HA H -8.222 -8.172 1.203 1.00 . A A . 26 ALA HA 1 1 8 7171 1 1 26 ALA HB1 H -7.083 -8.802 3.071 1.00 . A A . 26 ALA HB1 1 1 8 7172 1 1 26 ALA HB2 H -6.220 -7.307 2.710 1.00 . A A . 26 ALA HB2 1 1 8 7173 1 1 26 ALA HB3 H -5.528 -8.861 2.241 1.00 . A A . 26 ALA HB3 1 1 8 7174 1 1 26 ALA N N -6.890 -9.409 0.223 1.00 . A A . 26 ALA N 1 1 8 7175 1 1 26 ALA O O -7.324 -5.886 0.455 1.00 . A A . 26 ALA O 1 1 8 7176 1 1 27 VAL C C -6.144 -5.616 -2.499 1.00 . A A . 27 VAL C 1 1 8 7177 1 1 27 VAL CA C -5.213 -5.946 -1.337 1.00 . A A . 27 VAL CA 1 1 8 7178 1 1 27 VAL CB C -3.800 -6.222 -1.887 1.00 . A A . 27 VAL CB 1 1 8 7179 1 1 27 VAL CG1 C -3.231 -4.977 -2.552 1.00 . A A . 27 VAL CG1 1 1 8 7180 1 1 27 VAL CG2 C -2.882 -6.709 -0.775 1.00 . A A . 27 VAL CG2 1 1 8 7181 1 1 27 VAL H H -5.284 -7.953 -0.669 1.00 . A A . 27 VAL H 1 1 8 7182 1 1 27 VAL HA H -5.159 -5.092 -0.678 1.00 . A A . 27 VAL HA 1 1 8 7183 1 1 27 VAL HB H -3.871 -7.000 -2.632 1.00 . A A . 27 VAL HB 1 1 8 7184 1 1 27 VAL HG11 H -3.605 -4.906 -3.563 1.00 . A A . 27 VAL HG11 1 1 8 7185 1 1 27 VAL HG12 H -2.153 -5.040 -2.570 1.00 . A A . 27 VAL HG12 1 1 8 7186 1 1 27 VAL HG13 H -3.532 -4.102 -1.995 1.00 . A A . 27 VAL HG13 1 1 8 7187 1 1 27 VAL HG21 H -2.722 -5.910 -0.066 1.00 . A A . 27 VAL HG21 1 1 8 7188 1 1 27 VAL HG22 H -1.934 -7.011 -1.198 1.00 . A A . 27 VAL HG22 1 1 8 7189 1 1 27 VAL HG23 H -3.338 -7.549 -0.274 1.00 . A A . 27 VAL HG23 1 1 8 7190 1 1 27 VAL N N -5.713 -7.079 -0.566 1.00 . A A . 27 VAL N 1 1 8 7191 1 1 27 VAL O O -6.630 -4.493 -2.615 1.00 . A A . 27 VAL O 1 1 8 7192 1 1 28 SER C C -8.653 -5.965 -4.075 1.00 . A A . 28 SER C 1 1 8 7193 1 1 28 SER CA C -7.260 -6.414 -4.509 1.00 . A A . 28 SER CA 1 1 8 7194 1 1 28 SER CB C -7.358 -7.710 -5.316 1.00 . A A . 28 SER CB 1 1 8 7195 1 1 28 SER H H -5.971 -7.478 -3.208 1.00 . A A . 28 SER H 1 1 8 7196 1 1 28 SER HA H -6.825 -5.647 -5.129 1.00 . A A . 28 SER HA 1 1 8 7197 1 1 28 SER HB2 H -8.342 -7.785 -5.756 1.00 . A A . 28 SER HB2 1 1 8 7198 1 1 28 SER HB3 H -6.613 -7.701 -6.099 1.00 . A A . 28 SER HB3 1 1 8 7199 1 1 28 SER HG H -6.223 -9.119 -4.564 1.00 . A A . 28 SER HG 1 1 8 7200 1 1 28 SER N N -6.387 -6.603 -3.354 1.00 . A A . 28 SER N 1 1 8 7201 1 1 28 SER O O -9.365 -5.304 -4.832 1.00 . A A . 28 SER O 1 1 8 7202 1 1 28 SER OG O -7.140 -8.843 -4.492 1.00 . A A . 28 SER OG 1 1 8 7203 1 1 29 GLN C C -10.390 -4.490 -1.918 1.00 . A A . 29 GLN C 1 1 8 7204 1 1 29 GLN CA C -10.340 -5.962 -2.327 1.00 . A A . 29 GLN CA 1 1 8 7205 1 1 29 GLN CB C -10.700 -6.847 -1.129 1.00 . A A . 29 GLN CB 1 1 8 7206 1 1 29 GLN CD C -12.870 -7.818 -0.265 1.00 . A A . 29 GLN CD 1 1 8 7207 1 1 29 GLN CG C -11.860 -7.796 -1.396 1.00 . A A . 29 GLN CG 1 1 8 7208 1 1 29 GLN H H -8.430 -6.855 -2.299 1.00 . A A . 29 GLN H 1 1 8 7209 1 1 29 GLN HA H -11.070 -6.125 -3.107 1.00 . A A . 29 GLN HA 1 1 8 7210 1 1 29 GLN HB2 H -9.838 -7.436 -0.863 1.00 . A A . 29 GLN HB2 1 1 8 7211 1 1 29 GLN HB3 H -10.960 -6.216 -0.292 1.00 . A A . 29 GLN HB3 1 1 8 7212 1 1 29 GLN HE21 H -11.670 -8.980 0.816 1.00 . A A . 29 GLN HE21 1 1 8 7213 1 1 29 GLN HE22 H -13.170 -8.553 1.558 1.00 . A A . 29 GLN HE22 1 1 8 7214 1 1 29 GLN HG2 H -12.360 -7.484 -2.300 1.00 . A A . 29 GLN HG2 1 1 8 7215 1 1 29 GLN HG3 H -11.460 -8.793 -1.528 1.00 . A A . 29 GLN HG3 1 1 8 7216 1 1 29 GLN N N -9.038 -6.328 -2.856 1.00 . A A . 29 GLN N 1 1 8 7217 1 1 29 GLN NE2 N -12.530 -8.521 0.813 1.00 . A A . 29 GLN NE2 1 1 8 7218 1 1 29 GLN O O -11.460 -3.919 -1.743 1.00 . A A . 29 GLN O 1 1 8 7219 1 1 29 GLN OE1 O -13.930 -7.210 -0.357 1.00 . A A . 29 GLN OE1 1 1 8 7220 1 1 30 TRP C C -9.962 -1.593 -2.304 1.00 . A A . 30 TRP C 1 1 8 7221 1 1 30 TRP CA C -9.133 -2.474 -1.372 1.00 . A A . 30 TRP CA 1 1 8 7222 1 1 30 TRP CB C -7.677 -2.006 -1.378 1.00 . A A . 30 TRP CB 1 1 8 7223 1 1 30 TRP CD1 C -7.381 -3.018 0.960 1.00 . A A . 30 TRP CD1 1 1 8 7224 1 1 30 TRP CD2 C -5.462 -2.469 -0.055 1.00 . A A . 30 TRP CD2 1 1 8 7225 1 1 30 TRP CE2 C -5.162 -3.009 1.210 1.00 . A A . 30 TRP CE2 1 1 8 7226 1 1 30 TRP CE3 C -4.410 -2.053 -0.876 1.00 . A A . 30 TRP CE3 1 1 8 7227 1 1 30 TRP CG C -6.888 -2.485 -0.196 1.00 . A A . 30 TRP CG 1 1 8 7228 1 1 30 TRP CH2 C -2.846 -2.727 0.847 1.00 . A A . 30 TRP CH2 1 1 8 7229 1 1 30 TRP CZ2 C -3.856 -3.144 1.672 1.00 . A A . 30 TRP CZ2 1 1 8 7230 1 1 30 TRP CZ3 C -3.114 -2.186 -0.416 1.00 . A A . 30 TRP CZ3 1 1 8 7231 1 1 30 TRP H H -8.392 -4.383 -1.913 1.00 . A A . 30 TRP H 1 1 8 7232 1 1 30 TRP HA H -9.526 -2.387 -0.370 1.00 . A A . 30 TRP HA 1 1 8 7233 1 1 30 TRP HB2 H -7.192 -2.370 -2.272 1.00 . A A . 30 TRP HB2 1 1 8 7234 1 1 30 TRP HB3 H -7.655 -0.926 -1.379 1.00 . A A . 30 TRP HB3 1 1 8 7235 1 1 30 TRP HD1 H -8.432 -3.163 1.163 1.00 . A A . 30 TRP HD1 1 1 8 7236 1 1 30 TRP HE1 H -6.447 -3.733 2.702 1.00 . A A . 30 TRP HE1 1 1 8 7237 1 1 30 TRP HE3 H -4.597 -1.634 -1.853 1.00 . A A . 30 TRP HE3 1 1 8 7238 1 1 30 TRP HH2 H -1.818 -2.811 1.165 1.00 . A A . 30 TRP HH2 1 1 8 7239 1 1 30 TRP HZ2 H -3.632 -3.559 2.642 1.00 . A A . 30 TRP HZ2 1 1 8 7240 1 1 30 TRP HZ3 H -2.289 -1.868 -1.037 1.00 . A A . 30 TRP HZ3 1 1 8 7241 1 1 30 TRP N N -9.218 -3.879 -1.764 1.00 . A A . 30 TRP N 1 1 8 7242 1 1 30 TRP NE1 N -6.349 -3.337 1.810 1.00 . A A . 30 TRP NE1 1 1 8 7243 1 1 30 TRP O O -9.839 -1.674 -3.526 1.00 . A A . 30 TRP O 1 1 8 7244 1 1 31 LYS C C -10.860 1.373 -2.946 1.00 . A A . 31 LYS C 1 1 8 7245 1 1 31 LYS CA C -11.650 0.149 -2.486 1.00 . A A . 31 LYS CA 1 1 8 7246 1 1 31 LYS CB C -12.850 0.584 -1.648 1.00 . A A . 31 LYS CB 1 1 8 7247 1 1 31 LYS CD C -13.330 2.621 -0.254 1.00 . A A . 31 LYS CD 1 1 8 7248 1 1 31 LYS CE C -13.180 3.239 1.125 1.00 . A A . 31 LYS CE 1 1 8 7249 1 1 31 LYS CG C -12.480 1.376 -0.407 1.00 . A A . 31 LYS CG 1 1 8 7250 1 1 31 LYS H H -10.850 -0.733 -0.736 1.00 . A A . 31 LYS H 1 1 8 7251 1 1 31 LYS HA H -12.000 -0.387 -3.356 1.00 . A A . 31 LYS HA 1 1 8 7252 1 1 31 LYS HB2 H -13.500 1.195 -2.258 1.00 . A A . 31 LYS HB2 1 1 8 7253 1 1 31 LYS HB3 H -13.390 -0.296 -1.336 1.00 . A A . 31 LYS HB3 1 1 8 7254 1 1 31 LYS HD2 H -13.030 3.346 -0.997 1.00 . A A . 31 LYS HD2 1 1 8 7255 1 1 31 LYS HD3 H -14.370 2.354 -0.404 1.00 . A A . 31 LYS HD3 1 1 8 7256 1 1 31 LYS HE2 H -13.590 2.562 1.859 1.00 . A A . 31 LYS HE2 1 1 8 7257 1 1 31 LYS HE3 H -12.130 3.386 1.324 1.00 . A A . 31 LYS HE3 1 1 8 7258 1 1 31 LYS HG2 H -12.610 0.750 0.462 1.00 . A A . 31 LYS HG2 1 1 8 7259 1 1 31 LYS HG3 H -11.440 1.671 -0.482 1.00 . A A . 31 LYS HG3 1 1 8 7260 1 1 31 LYS HZ1 H -13.420 5.142 1.953 1.00 . A A . 31 LYS HZ1 1 1 8 7261 1 1 31 LYS HZ2 H -14.870 4.403 1.497 1.00 . A A . 31 LYS HZ2 1 1 8 7262 1 1 31 LYS HZ3 H -13.850 5.045 0.318 1.00 . A A . 31 LYS HZ3 1 1 8 7263 1 1 31 LYS N N -10.800 -0.751 -1.714 1.00 . A A . 31 LYS N 1 1 8 7264 1 1 31 LYS NZ N -13.880 4.549 1.230 1.00 . A A . 31 LYS NZ 1 1 8 7265 1 1 31 LYS O O -9.637 1.402 -2.846 1.00 . A A . 31 LYS O 1 1 8 7266 1 1 32 GLU C C -9.927 4.130 -2.900 1.00 . A A . 32 GLU C 1 1 8 7267 1 1 32 GLU CA C -10.930 3.606 -3.922 1.00 . A A . 32 GLU CA 1 1 8 7268 1 1 32 GLU CB C -11.980 4.675 -4.217 1.00 . A A . 32 GLU CB 1 1 8 7269 1 1 32 GLU CD C -13.380 5.804 -5.991 1.00 . A A . 32 GLU CD 1 1 8 7270 1 1 32 GLU CG C -12.150 4.975 -5.698 1.00 . A A . 32 GLU CG 1 1 8 7271 1 1 32 GLU H H -12.540 2.300 -3.504 1.00 . A A . 32 GLU H 1 1 8 7272 1 1 32 GLU HA H -10.400 3.372 -4.838 1.00 . A A . 32 GLU HA 1 1 8 7273 1 1 32 GLU HB2 H -12.940 4.340 -3.833 1.00 . A A . 32 GLU HB2 1 1 8 7274 1 1 32 GLU HB3 H -11.710 5.591 -3.715 1.00 . A A . 32 GLU HB3 1 1 8 7275 1 1 32 GLU HG2 H -11.280 5.518 -6.042 1.00 . A A . 32 GLU HG2 1 1 8 7276 1 1 32 GLU HG3 H -12.220 4.042 -6.236 1.00 . A A . 32 GLU HG3 1 1 8 7277 1 1 32 GLU N N -11.570 2.381 -3.450 1.00 . A A . 32 GLU N 1 1 8 7278 1 1 32 GLU O O -8.925 4.748 -3.259 1.00 . A A . 32 GLU O 1 1 8 7279 1 1 32 GLU OE1 O -14.450 5.505 -5.413 1.00 . A A . 32 GLU OE1 1 1 8 7280 1 1 32 GLU OE2 O -13.290 6.752 -6.799 1.00 . A A . 32 GLU OE2 1 1 8 7281 1 1 33 VAL C C -8.977 3.159 0.379 1.00 . A A . 33 VAL C 1 1 8 7282 1 1 33 VAL CA C -9.327 4.317 -0.549 1.00 . A A . 33 VAL CA 1 1 8 7283 1 1 33 VAL CB C -9.970 5.449 0.277 1.00 . A A . 33 VAL CB 1 1 8 7284 1 1 33 VAL CG1 C -8.982 5.999 1.294 1.00 . A A . 33 VAL CG1 1 1 8 7285 1 1 33 VAL CG2 C -10.470 6.553 -0.639 1.00 . A A . 33 VAL CG2 1 1 8 7286 1 1 33 VAL H H -11.010 3.379 -1.404 1.00 . A A . 33 VAL H 1 1 8 7287 1 1 33 VAL HA H -8.418 4.697 -0.993 1.00 . A A . 33 VAL HA 1 1 8 7288 1 1 33 VAL HB H -10.810 5.040 0.812 1.00 . A A . 33 VAL HB 1 1 8 7289 1 1 33 VAL HG11 H -8.827 5.269 2.076 1.00 . A A . 33 VAL HG11 1 1 8 7290 1 1 33 VAL HG12 H -9.376 6.908 1.723 1.00 . A A . 33 VAL HG12 1 1 8 7291 1 1 33 VAL HG13 H -8.042 6.210 0.808 1.00 . A A . 33 VAL HG13 1 1 8 7292 1 1 33 VAL HG21 H -9.892 6.562 -1.548 1.00 . A A . 33 VAL HG21 1 1 8 7293 1 1 33 VAL HG22 H -10.370 7.507 -0.142 1.00 . A A . 33 VAL HG22 1 1 8 7294 1 1 33 VAL HG23 H -11.510 6.377 -0.878 1.00 . A A . 33 VAL HG23 1 1 8 7295 1 1 33 VAL N N -10.200 3.878 -1.625 1.00 . A A . 33 VAL N 1 1 8 7296 1 1 33 VAL O O -9.853 2.584 1.026 1.00 . A A . 33 VAL O 1 1 8 7297 1 1 34 ILE C C -7.716 1.893 2.723 1.00 . A A . 34 ILE C 1 1 8 7298 1 1 34 ILE CA C -7.224 1.731 1.287 1.00 . A A . 34 ILE CA 1 1 8 7299 1 1 34 ILE CB C -5.686 1.640 1.288 1.00 . A A . 34 ILE CB 1 1 8 7300 1 1 34 ILE CD1 C -3.591 2.997 1.776 1.00 . A A . 34 ILE CD1 1 1 8 7301 1 1 34 ILE CG1 C -5.068 3.030 1.458 1.00 . A A . 34 ILE CG1 1 1 8 7302 1 1 34 ILE CG2 C -5.192 0.990 0.004 1.00 . A A . 34 ILE CG2 1 1 8 7303 1 1 34 ILE H H -7.044 3.320 -0.102 1.00 . A A . 34 ILE H 1 1 8 7304 1 1 34 ILE HA H -7.617 0.807 0.885 1.00 . A A . 34 ILE HA 1 1 8 7305 1 1 34 ILE HB H -5.386 1.016 2.116 1.00 . A A . 34 ILE HB 1 1 8 7306 1 1 34 ILE HD11 H -3.259 3.988 2.053 1.00 . A A . 34 ILE HD11 1 1 8 7307 1 1 34 ILE HD12 H -3.042 2.666 0.907 1.00 . A A . 34 ILE HD12 1 1 8 7308 1 1 34 ILE HD13 H -3.414 2.318 2.596 1.00 . A A . 34 ILE HD13 1 1 8 7309 1 1 34 ILE HG12 H -5.198 3.591 0.544 1.00 . A A . 34 ILE HG12 1 1 8 7310 1 1 34 ILE HG13 H -5.572 3.545 2.265 1.00 . A A . 34 ILE HG13 1 1 8 7311 1 1 34 ILE HG21 H -5.894 0.230 -0.308 1.00 . A A . 34 ILE HG21 1 1 8 7312 1 1 34 ILE HG22 H -4.226 0.538 0.177 1.00 . A A . 34 ILE HG22 1 1 8 7313 1 1 34 ILE HG23 H -5.106 1.739 -0.770 1.00 . A A . 34 ILE HG23 1 1 8 7314 1 1 34 ILE N N -7.693 2.822 0.438 1.00 . A A . 34 ILE N 1 1 8 7315 1 1 34 ILE O O -8.109 2.985 3.134 1.00 . A A . 34 ILE O 1 1 8 7316 1 1 35 PRO C C -7.459 1.914 5.722 1.00 . A A . 35 PRO C 1 1 8 7317 1 1 35 PRO CA C -8.150 0.827 4.905 1.00 . A A . 35 PRO CA 1 1 8 7318 1 1 35 PRO CB C -7.770 -0.559 5.429 1.00 . A A . 35 PRO CB 1 1 8 7319 1 1 35 PRO CD C -7.251 -0.541 3.097 1.00 . A A . 35 PRO CD 1 1 8 7320 1 1 35 PRO CG C -7.730 -1.423 4.216 1.00 . A A . 35 PRO CG 1 1 8 7321 1 1 35 PRO HA H -9.221 0.958 4.971 1.00 . A A . 35 PRO HA 1 1 8 7322 1 1 35 PRO HB2 H -6.807 -0.512 5.915 1.00 . A A . 35 PRO HB2 1 1 8 7323 1 1 35 PRO HB3 H -8.517 -0.901 6.130 1.00 . A A . 35 PRO HB3 1 1 8 7324 1 1 35 PRO HD2 H -6.175 -0.580 3.019 1.00 . A A . 35 PRO HD2 1 1 8 7325 1 1 35 PRO HD3 H -7.711 -0.832 2.163 1.00 . A A . 35 PRO HD3 1 1 8 7326 1 1 35 PRO HG2 H -7.041 -2.241 4.371 1.00 . A A . 35 PRO HG2 1 1 8 7327 1 1 35 PRO HG3 H -8.718 -1.800 3.999 1.00 . A A . 35 PRO HG3 1 1 8 7328 1 1 35 PRO N N -7.701 0.802 3.509 1.00 . A A . 35 PRO N 1 1 8 7329 1 1 35 PRO O O -6.437 2.461 5.310 1.00 . A A . 35 PRO O 1 1 8 7330 1 1 36 GLU C C -6.202 2.751 8.443 1.00 . A A . 36 GLU C 1 1 8 7331 1 1 36 GLU CA C -7.478 3.242 7.766 1.00 . A A . 36 GLU CA 1 1 8 7332 1 1 36 GLU CB C -8.512 3.631 8.824 1.00 . A A . 36 GLU CB 1 1 8 7333 1 1 36 GLU CD C -7.356 4.248 10.983 1.00 . A A . 36 GLU CD 1 1 8 7334 1 1 36 GLU CG C -8.057 4.756 9.739 1.00 . A A . 36 GLU CG 1 1 8 7335 1 1 36 GLU H H -8.844 1.750 7.153 1.00 . A A . 36 GLU H 1 1 8 7336 1 1 36 GLU HA H -7.244 4.108 7.167 1.00 . A A . 36 GLU HA 1 1 8 7337 1 1 36 GLU HB2 H -9.417 3.946 8.326 1.00 . A A . 36 GLU HB2 1 1 8 7338 1 1 36 GLU HB3 H -8.730 2.767 9.434 1.00 . A A . 36 GLU HB3 1 1 8 7339 1 1 36 GLU HG2 H -7.376 5.390 9.195 1.00 . A A . 36 GLU HG2 1 1 8 7340 1 1 36 GLU HG3 H -8.919 5.332 10.039 1.00 . A A . 36 GLU HG3 1 1 8 7341 1 1 36 GLU N N -8.030 2.221 6.883 1.00 . A A . 36 GLU N 1 1 8 7342 1 1 36 GLU O O -5.270 3.524 8.667 1.00 . A A . 36 GLU O 1 1 8 7343 1 1 36 GLU OE1 O -8.057 3.875 11.948 1.00 . A A . 36 GLU OE1 1 1 8 7344 1 1 36 GLU OE2 O -6.108 4.223 10.993 1.00 . A A . 36 GLU OE2 1 1 8 7345 1 1 37 LYS C C -3.975 0.385 8.413 1.00 . A A . 37 LYS C 1 1 8 7346 1 1 37 LYS CA C -5.007 0.872 9.429 1.00 . A A . 37 LYS CA 1 1 8 7347 1 1 37 LYS CB C -5.442 -0.288 10.329 1.00 . A A . 37 LYS CB 1 1 8 7348 1 1 37 LYS CD C -3.919 -0.536 12.313 1.00 . A A . 37 LYS CD 1 1 8 7349 1 1 37 LYS CE C -4.070 -1.281 13.632 1.00 . A A . 37 LYS CE 1 1 8 7350 1 1 37 LYS CG C -5.256 -0.012 11.812 1.00 . A A . 37 LYS CG 1 1 8 7351 1 1 37 LYS H H -6.941 0.898 8.572 1.00 . A A . 37 LYS H 1 1 8 7352 1 1 37 LYS HA H -4.551 1.637 10.041 1.00 . A A . 37 LYS HA 1 1 8 7353 1 1 37 LYS HB2 H -6.488 -0.491 10.152 1.00 . A A . 37 LYS HB2 1 1 8 7354 1 1 37 LYS HB3 H -4.867 -1.166 10.074 1.00 . A A . 37 LYS HB3 1 1 8 7355 1 1 37 LYS HD2 H -3.508 -1.211 11.578 1.00 . A A . 37 LYS HD2 1 1 8 7356 1 1 37 LYS HD3 H -3.247 0.298 12.457 1.00 . A A . 37 LYS HD3 1 1 8 7357 1 1 37 LYS HE2 H -3.096 -1.378 14.089 1.00 . A A . 37 LYS HE2 1 1 8 7358 1 1 37 LYS HE3 H -4.716 -0.708 14.282 1.00 . A A . 37 LYS HE3 1 1 8 7359 1 1 37 LYS HG2 H -5.298 1.053 11.978 1.00 . A A . 37 LYS HG2 1 1 8 7360 1 1 37 LYS HG3 H -6.052 -0.494 12.360 1.00 . A A . 37 LYS HG3 1 1 8 7361 1 1 37 LYS HZ1 H -5.203 -2.670 12.559 1.00 . A A . 37 LYS HZ1 1 1 8 7362 1 1 37 LYS HZ2 H -5.281 -2.873 14.236 1.00 . A A . 37 LYS HZ2 1 1 8 7363 1 1 37 LYS HZ3 H -3.895 -3.348 13.390 1.00 . A A . 37 LYS HZ3 1 1 8 7364 1 1 37 LYS N N -6.167 1.464 8.772 1.00 . A A . 37 LYS N 1 1 8 7365 1 1 37 LYS NZ N -4.653 -2.638 13.441 1.00 . A A . 37 LYS NZ 1 1 8 7366 1 1 37 LYS O O -2.806 0.191 8.752 1.00 . A A . 37 LYS O 1 1 8 7367 1 1 38 ASP C C -2.670 0.879 5.581 1.00 . A A . 38 ASP C 1 1 8 7368 1 1 38 ASP CA C -3.508 -0.274 6.122 1.00 . A A . 38 ASP CA 1 1 8 7369 1 1 38 ASP CB C -4.302 -0.921 4.985 1.00 . A A . 38 ASP CB 1 1 8 7370 1 1 38 ASP CG C -4.735 -2.336 5.316 1.00 . A A . 38 ASP CG 1 1 8 7371 1 1 38 ASP H H -5.347 0.360 6.957 1.00 . A A . 38 ASP H 1 1 8 7372 1 1 38 ASP HA H -2.846 -1.010 6.556 1.00 . A A . 38 ASP HA 1 1 8 7373 1 1 38 ASP HB2 H -5.183 -0.330 4.789 1.00 . A A . 38 ASP HB2 1 1 8 7374 1 1 38 ASP HB3 H -3.687 -0.950 4.098 1.00 . A A . 38 ASP HB3 1 1 8 7375 1 1 38 ASP N N -4.406 0.191 7.172 1.00 . A A . 38 ASP N 1 1 8 7376 1 1 38 ASP O O -1.462 0.742 5.381 1.00 . A A . 38 ASP O 1 1 8 7377 1 1 38 ASP OD1 O -4.826 -2.663 6.517 1.00 . A A . 38 ASP OD1 1 1 8 7378 1 1 38 ASP OD2 O -4.985 -3.116 4.372 1.00 . A A . 38 ASP OD2 1 1 8 7379 1 1 39 ALA C C -1.606 3.708 5.850 1.00 . A A . 39 ALA C 1 1 8 7380 1 1 39 ALA CA C -2.626 3.193 4.841 1.00 . A A . 39 ALA CA 1 1 8 7381 1 1 39 ALA CB C -3.628 4.285 4.494 1.00 . A A . 39 ALA CB 1 1 8 7382 1 1 39 ALA H H -4.277 2.067 5.535 1.00 . A A . 39 ALA H 1 1 8 7383 1 1 39 ALA HA H -2.108 2.911 3.935 1.00 . A A . 39 ALA HA 1 1 8 7384 1 1 39 ALA HB1 H -3.151 5.028 3.875 1.00 . A A . 39 ALA HB1 1 1 8 7385 1 1 39 ALA HB2 H -3.984 4.748 5.404 1.00 . A A . 39 ALA HB2 1 1 8 7386 1 1 39 ALA HB3 H -4.461 3.852 3.961 1.00 . A A . 39 ALA HB3 1 1 8 7387 1 1 39 ALA N N -3.315 2.016 5.352 1.00 . A A . 39 ALA N 1 1 8 7388 1 1 39 ALA O O -0.615 4.339 5.480 1.00 . A A . 39 ALA O 1 1 8 7389 1 1 40 TYR C C 0.339 3.062 8.175 1.00 . A A . 40 TYR C 1 1 8 7390 1 1 40 TYR CA C -0.957 3.871 8.189 1.00 . A A . 40 TYR CA 1 1 8 7391 1 1 40 TYR CB C -1.644 3.736 9.550 1.00 . A A . 40 TYR CB 1 1 8 7392 1 1 40 TYR CD1 C -0.444 5.422 10.995 1.00 . A A . 40 TYR CD1 1 1 8 7393 1 1 40 TYR CD2 C -0.225 3.112 11.539 1.00 . A A . 40 TYR CD2 1 1 8 7394 1 1 40 TYR CE1 C 0.370 5.756 12.059 1.00 . A A . 40 TYR CE1 1 1 8 7395 1 1 40 TYR CE2 C 0.591 3.436 12.607 1.00 . A A . 40 TYR CE2 1 1 8 7396 1 1 40 TYR CG C -0.755 4.097 10.716 1.00 . A A . 40 TYR CG 1 1 8 7397 1 1 40 TYR CZ C 0.885 4.760 12.864 1.00 . A A . 40 TYR CZ 1 1 8 7398 1 1 40 TYR H H -2.661 2.929 7.363 1.00 . A A . 40 TYR H 1 1 8 7399 1 1 40 TYR HA H -0.720 4.910 8.017 1.00 . A A . 40 TYR HA 1 1 8 7400 1 1 40 TYR HB2 H -2.505 4.390 9.577 1.00 . A A . 40 TYR HB2 1 1 8 7401 1 1 40 TYR HB3 H -1.968 2.713 9.681 1.00 . A A . 40 TYR HB3 1 1 8 7402 1 1 40 TYR HD1 H -0.850 6.199 10.364 1.00 . A A . 40 TYR HD1 1 1 8 7403 1 1 40 TYR HD2 H -0.457 2.076 11.334 1.00 . A A . 40 TYR HD2 1 1 8 7404 1 1 40 TYR HE1 H 0.600 6.791 12.258 1.00 . A A . 40 TYR HE1 1 1 8 7405 1 1 40 TYR HE2 H 0.995 2.656 13.236 1.00 . A A . 40 TYR HE2 1 1 8 7406 1 1 40 TYR HH H 2.283 5.804 13.670 1.00 . A A . 40 TYR HH 1 1 8 7407 1 1 40 TYR N N -1.855 3.435 7.129 1.00 . A A . 40 TYR N 1 1 8 7408 1 1 40 TYR O O 1.418 3.597 8.431 1.00 . A A . 40 TYR O 1 1 8 7409 1 1 40 TYR OH O 1.697 5.089 13.924 1.00 . A A . 40 TYR OH 1 1 8 7410 1 1 41 ARG C C 2.171 1.088 6.536 1.00 . A A . 41 ARG C 1 1 8 7411 1 1 41 ARG CA C 1.385 0.892 7.829 1.00 . A A . 41 ARG CA 1 1 8 7412 1 1 41 ARG CB C 0.946 -0.569 7.952 1.00 . A A . 41 ARG CB 1 1 8 7413 1 1 41 ARG CD C 0.694 -2.470 9.576 1.00 . A A . 41 ARG CD 1 1 8 7414 1 1 41 ARG CG C 0.553 -0.971 9.364 1.00 . A A . 41 ARG CG 1 1 8 7415 1 1 41 ARG CZ C 2.533 -4.059 9.987 1.00 . A A . 41 ARG CZ 1 1 8 7416 1 1 41 ARG H H -0.664 1.405 7.681 1.00 . A A . 41 ARG H 1 1 8 7417 1 1 41 ARG HA H 2.021 1.138 8.665 1.00 . A A . 41 ARG HA 1 1 8 7418 1 1 41 ARG HB2 H 0.099 -0.735 7.304 1.00 . A A . 41 ARG HB2 1 1 8 7419 1 1 41 ARG HB3 H 1.759 -1.204 7.634 1.00 . A A . 41 ARG HB3 1 1 8 7420 1 1 41 ARG HD2 H -0.042 -2.789 10.297 1.00 . A A . 41 ARG HD2 1 1 8 7421 1 1 41 ARG HD3 H 0.517 -2.970 8.634 1.00 . A A . 41 ARG HD3 1 1 8 7422 1 1 41 ARG HE H 2.567 -2.121 10.464 1.00 . A A . 41 ARG HE 1 1 8 7423 1 1 41 ARG HG2 H 1.192 -0.456 10.065 1.00 . A A . 41 ARG HG2 1 1 8 7424 1 1 41 ARG HG3 H -0.475 -0.687 9.534 1.00 . A A . 41 ARG HG3 1 1 8 7425 1 1 41 ARG HH11 H 0.909 -4.870 9.095 1.00 . A A . 41 ARG HH11 1 1 8 7426 1 1 41 ARG HH12 H 2.216 -5.964 9.393 1.00 . A A . 41 ARG HH12 1 1 8 7427 1 1 41 ARG HH21 H 4.287 -3.560 10.857 1.00 . A A . 41 ARG HH21 1 1 8 7428 1 1 41 ARG HH22 H 4.134 -5.221 10.394 1.00 . A A . 41 ARG HH22 1 1 8 7429 1 1 41 ARG N N 0.223 1.773 7.874 1.00 . A A . 41 ARG N 1 1 8 7430 1 1 41 ARG NE N 2.024 -2.830 10.061 1.00 . A A . 41 ARG NE 1 1 8 7431 1 1 41 ARG NH1 N 1.828 -5.045 9.447 1.00 . A A . 41 ARG NH1 1 1 8 7432 1 1 41 ARG NH2 N 3.753 -4.300 10.450 1.00 . A A . 41 ARG NH2 1 1 8 7433 1 1 41 ARG O O 3.385 0.883 6.501 1.00 . A A . 41 ARG O 1 1 8 7434 1 1 42 LEU C C 3.071 2.879 4.233 1.00 . A A . 42 LEU C 1 1 8 7435 1 1 42 LEU CA C 2.105 1.700 4.182 1.00 . A A . 42 LEU CA 1 1 8 7436 1 1 42 LEU CB C 1.041 1.943 3.110 1.00 . A A . 42 LEU CB 1 1 8 7437 1 1 42 LEU CD1 C -0.789 1.058 1.642 1.00 . A A . 42 LEU CD1 1 1 8 7438 1 1 42 LEU CD2 C 1.207 -0.363 2.146 1.00 . A A . 42 LEU CD2 1 1 8 7439 1 1 42 LEU CG C 0.260 0.699 2.683 1.00 . A A . 42 LEU CG 1 1 8 7440 1 1 42 LEU H H 0.509 1.625 5.568 1.00 . A A . 42 LEU H 1 1 8 7441 1 1 42 LEU HA H 2.657 0.809 3.929 1.00 . A A . 42 LEU HA 1 1 8 7442 1 1 42 LEU HB2 H 0.339 2.672 3.488 1.00 . A A . 42 LEU HB2 1 1 8 7443 1 1 42 LEU HB3 H 1.525 2.354 2.237 1.00 . A A . 42 LEU HB3 1 1 8 7444 1 1 42 LEU HD11 H -0.383 1.790 0.959 1.00 . A A . 42 LEU HD11 1 1 8 7445 1 1 42 LEU HD12 H -1.659 1.468 2.135 1.00 . A A . 42 LEU HD12 1 1 8 7446 1 1 42 LEU HD13 H -1.071 0.171 1.094 1.00 . A A . 42 LEU HD13 1 1 8 7447 1 1 42 LEU HD21 H 2.078 0.114 1.721 1.00 . A A . 42 LEU HD21 1 1 8 7448 1 1 42 LEU HD22 H 0.705 -0.939 1.382 1.00 . A A . 42 LEU HD22 1 1 8 7449 1 1 42 LEU HD23 H 1.508 -1.016 2.949 1.00 . A A . 42 LEU HD23 1 1 8 7450 1 1 42 LEU HG H -0.250 0.290 3.543 1.00 . A A . 42 LEU HG 1 1 8 7451 1 1 42 LEU N N 1.472 1.481 5.478 1.00 . A A . 42 LEU N 1 1 8 7452 1 1 42 LEU O O 4.087 2.892 3.537 1.00 . A A . 42 LEU O 1 1 8 7453 1 1 43 GLU C C 4.927 4.713 5.840 1.00 . A A . 43 GLU C 1 1 8 7454 1 1 43 GLU CA C 3.586 5.055 5.195 1.00 . A A . 43 GLU CA 1 1 8 7455 1 1 43 GLU CB C 2.867 6.119 6.023 1.00 . A A . 43 GLU CB 1 1 8 7456 1 1 43 GLU CD C 2.853 8.500 6.868 1.00 . A A . 43 GLU CD 1 1 8 7457 1 1 43 GLU CG C 3.636 7.426 6.139 1.00 . A A . 43 GLU CG 1 1 8 7458 1 1 43 GLU H H 1.923 3.804 5.584 1.00 . A A . 43 GLU H 1 1 8 7459 1 1 43 GLU HA H 3.770 5.446 4.205 1.00 . A A . 43 GLU HA 1 1 8 7460 1 1 43 GLU HB2 H 1.911 6.330 5.566 1.00 . A A . 43 GLU HB2 1 1 8 7461 1 1 43 GLU HB3 H 2.701 5.734 7.018 1.00 . A A . 43 GLU HB3 1 1 8 7462 1 1 43 GLU HG2 H 4.553 7.241 6.679 1.00 . A A . 43 GLU HG2 1 1 8 7463 1 1 43 GLU HG3 H 3.869 7.780 5.147 1.00 . A A . 43 GLU HG3 1 1 8 7464 1 1 43 GLU N N 2.747 3.870 5.056 1.00 . A A . 43 GLU N 1 1 8 7465 1 1 43 GLU O O 5.906 5.443 5.678 1.00 . A A . 43 GLU O 1 1 8 7466 1 1 43 GLU OE1 O 2.257 8.190 7.920 1.00 . A A . 43 GLU OE1 1 1 8 7467 1 1 43 GLU OE2 O 2.836 9.652 6.385 1.00 . A A . 43 GLU OE2 1 1 8 7468 1 1 44 ILE C C 7.044 2.298 6.329 1.00 . A A . 44 ILE C 1 1 8 7469 1 1 44 ILE CA C 6.194 3.180 7.240 1.00 . A A . 44 ILE CA 1 1 8 7470 1 1 44 ILE CB C 5.888 2.412 8.540 1.00 . A A . 44 ILE CB 1 1 8 7471 1 1 44 ILE CD1 C 5.032 2.980 10.884 1.00 . A A . 44 ILE CD1 1 1 8 7472 1 1 44 ILE CG1 C 4.891 3.207 9.395 1.00 . A A . 44 ILE CG1 1 1 8 7473 1 1 44 ILE CG2 C 7.178 2.138 9.303 1.00 . A A . 44 ILE CG2 1 1 8 7474 1 1 44 ILE H H 4.158 3.063 6.670 1.00 . A A . 44 ILE H 1 1 8 7475 1 1 44 ILE HA H 6.757 4.065 7.499 1.00 . A A . 44 ILE HA 1 1 8 7476 1 1 44 ILE HB H 5.447 1.463 8.274 1.00 . A A . 44 ILE HB 1 1 8 7477 1 1 44 ILE HD11 H 4.887 1.933 11.105 1.00 . A A . 44 ILE HD11 1 1 8 7478 1 1 44 ILE HD12 H 4.292 3.566 11.409 1.00 . A A . 44 ILE HD12 1 1 8 7479 1 1 44 ILE HD13 H 6.020 3.280 11.200 1.00 . A A . 44 ILE HD13 1 1 8 7480 1 1 44 ILE HG12 H 5.033 4.262 9.209 1.00 . A A . 44 ILE HG12 1 1 8 7481 1 1 44 ILE HG13 H 3.886 2.930 9.109 1.00 . A A . 44 ILE HG13 1 1 8 7482 1 1 44 ILE HG21 H 6.961 1.530 10.169 1.00 . A A . 44 ILE HG21 1 1 8 7483 1 1 44 ILE HG22 H 7.615 3.073 9.618 1.00 . A A . 44 ILE HG22 1 1 8 7484 1 1 44 ILE HG23 H 7.872 1.614 8.661 1.00 . A A . 44 ILE HG23 1 1 8 7485 1 1 44 ILE N N 4.970 3.605 6.574 1.00 . A A . 44 ILE N 1 1 8 7486 1 1 44 ILE O O 8.233 2.550 6.138 1.00 . A A . 44 ILE O 1 1 8 7487 1 1 45 VAL C C 7.685 1.056 3.665 1.00 . A A . 45 VAL C 1 1 8 7488 1 1 45 VAL CA C 7.123 0.338 4.885 1.00 . A A . 45 VAL CA 1 1 8 7489 1 1 45 VAL CB C 6.194 -0.791 4.405 1.00 . A A . 45 VAL CB 1 1 8 7490 1 1 45 VAL CG1 C 5.942 -1.790 5.524 1.00 . A A . 45 VAL CG1 1 1 8 7491 1 1 45 VAL CG2 C 4.885 -0.223 3.874 1.00 . A A . 45 VAL CG2 1 1 8 7492 1 1 45 VAL H H 5.477 1.114 5.969 1.00 . A A . 45 VAL H 1 1 8 7493 1 1 45 VAL HA H 7.938 -0.107 5.437 1.00 . A A . 45 VAL HA 1 1 8 7494 1 1 45 VAL HB H 6.687 -1.307 3.595 1.00 . A A . 45 VAL HB 1 1 8 7495 1 1 45 VAL HG11 H 4.997 -2.286 5.356 1.00 . A A . 45 VAL HG11 1 1 8 7496 1 1 45 VAL HG12 H 5.913 -1.271 6.469 1.00 . A A . 45 VAL HG12 1 1 8 7497 1 1 45 VAL HG13 H 6.735 -2.522 5.538 1.00 . A A . 45 VAL HG13 1 1 8 7498 1 1 45 VAL HG21 H 4.881 -0.277 2.795 1.00 . A A . 45 VAL HG21 1 1 8 7499 1 1 45 VAL HG22 H 4.784 0.806 4.183 1.00 . A A . 45 VAL HG22 1 1 8 7500 1 1 45 VAL HG23 H 4.058 -0.798 4.266 1.00 . A A . 45 VAL HG23 1 1 8 7501 1 1 45 VAL N N 6.425 1.262 5.774 1.00 . A A . 45 VAL N 1 1 8 7502 1 1 45 VAL O O 8.786 0.755 3.205 1.00 . A A . 45 VAL O 1 1 8 7503 1 1 46 THR C C 8.292 3.883 2.309 1.00 . A A . 46 THR C 1 1 8 7504 1 1 46 THR CA C 7.314 2.757 1.962 1.00 . A A . 46 THR CA 1 1 8 7505 1 1 46 THR CB C 6.074 3.336 1.287 1.00 . A A . 46 THR CB 1 1 8 7506 1 1 46 THR CG2 C 4.999 2.304 1.023 1.00 . A A . 46 THR CG2 1 1 8 7507 1 1 46 THR H H 6.043 2.180 3.540 1.00 . A A . 46 THR H 1 1 8 7508 1 1 46 THR HA H 7.795 2.076 1.278 1.00 . A A . 46 THR HA 1 1 8 7509 1 1 46 THR HB H 6.362 3.760 0.342 1.00 . A A . 46 THR HB 1 1 8 7510 1 1 46 THR HG1 H 5.294 4.013 2.950 1.00 . A A . 46 THR HG1 1 1 8 7511 1 1 46 THR HG21 H 4.055 2.801 0.858 1.00 . A A . 46 THR HG21 1 1 8 7512 1 1 46 THR HG22 H 4.915 1.645 1.874 1.00 . A A . 46 THR HG22 1 1 8 7513 1 1 46 THR HG23 H 5.259 1.728 0.146 1.00 . A A . 46 THR HG23 1 1 8 7514 1 1 46 THR N N 6.913 1.998 3.137 1.00 . A A . 46 THR N 1 1 8 7515 1 1 46 THR O O 8.550 4.759 1.484 1.00 . A A . 46 THR O 1 1 8 7516 1 1 46 THR OG1 O 5.502 4.360 2.080 1.00 . A A . 46 THR OG1 1 1 8 7517 1 1 47 ALA C C 9.141 6.262 3.944 1.00 . A A . 47 ALA C 1 1 8 7518 1 1 47 ALA CA C 9.783 4.880 3.953 1.00 . A A . 47 ALA CA 1 1 8 7519 1 1 47 ALA CB C 11.018 4.861 3.063 1.00 . A A . 47 ALA CB 1 1 8 7520 1 1 47 ALA H H 8.601 3.140 4.143 1.00 . A A . 47 ALA H 1 1 8 7521 1 1 47 ALA HA H 10.093 4.644 4.961 1.00 . A A . 47 ALA HA 1 1 8 7522 1 1 47 ALA HB1 H 10.991 3.988 2.428 1.00 . A A . 47 ALA HB1 1 1 8 7523 1 1 47 ALA HB2 H 11.906 4.830 3.678 1.00 . A A . 47 ALA HB2 1 1 8 7524 1 1 47 ALA HB3 H 11.036 5.750 2.451 1.00 . A A . 47 ALA HB3 1 1 8 7525 1 1 47 ALA N N 8.836 3.858 3.524 1.00 . A A . 47 ALA N 1 1 8 7526 1 1 47 ALA O O 9.814 7.269 3.720 1.00 . A A . 47 ALA O 1 1 8 7527 1 1 48 GLY C C 6.941 8.155 2.821 1.00 . A A . 48 GLY C 1 1 8 7528 1 1 48 GLY CA C 7.127 7.569 4.209 1.00 . A A . 48 GLY CA 1 1 8 7529 1 1 48 GLY H H 7.352 5.469 4.364 1.00 . A A . 48 GLY H 1 1 8 7530 1 1 48 GLY HA2 H 6.155 7.417 4.655 1.00 . A A . 48 GLY HA2 1 1 8 7531 1 1 48 GLY HA3 H 7.681 8.273 4.812 1.00 . A A . 48 GLY HA3 1 1 8 7532 1 1 48 GLY N N 7.837 6.304 4.192 1.00 . A A . 48 GLY N 1 1 8 7533 1 1 48 GLY O O 6.742 9.360 2.673 1.00 . A A . 48 GLY O 1 1 8 7534 1 1 49 ALA C C 5.478 8.407 0.227 1.00 . A A . 49 ALA C 1 1 8 7535 1 1 49 ALA CA C 6.838 7.748 0.423 1.00 . A A . 49 ALA CA 1 1 8 7536 1 1 49 ALA CB C 7.005 6.578 -0.534 1.00 . A A . 49 ALA CB 1 1 8 7537 1 1 49 ALA H H 7.164 6.352 1.982 1.00 . A A . 49 ALA H 1 1 8 7538 1 1 49 ALA HA H 7.613 8.471 0.211 1.00 . A A . 49 ALA HA 1 1 8 7539 1 1 49 ALA HB1 H 6.745 5.660 -0.029 1.00 . A A . 49 ALA HB1 1 1 8 7540 1 1 49 ALA HB2 H 8.032 6.528 -0.864 1.00 . A A . 49 ALA HB2 1 1 8 7541 1 1 49 ALA HB3 H 6.358 6.717 -1.387 1.00 . A A . 49 ALA HB3 1 1 8 7542 1 1 49 ALA N N 7.004 7.301 1.803 1.00 . A A . 49 ALA N 1 1 8 7543 1 1 49 ALA O O 5.333 9.331 -0.573 1.00 . A A . 49 ALA O 1 1 8 7544 1 1 50 LEU C C 2.720 9.084 2.218 1.00 . A A . 50 LEU C 1 1 8 7545 1 1 50 LEU CA C 3.135 8.470 0.885 1.00 . A A . 50 LEU CA 1 1 8 7546 1 1 50 LEU CB C 2.145 7.373 0.483 1.00 . A A . 50 LEU CB 1 1 8 7547 1 1 50 LEU CD1 C 2.063 5.086 -0.537 1.00 . A A . 50 LEU CD1 1 1 8 7548 1 1 50 LEU CD2 C 2.116 7.107 -2.009 1.00 . A A . 50 LEU CD2 1 1 8 7549 1 1 50 LEU CG C 2.588 6.504 -0.694 1.00 . A A . 50 LEU CG 1 1 8 7550 1 1 50 LEU H H 4.667 7.192 1.592 1.00 . A A . 50 LEU H 1 1 8 7551 1 1 50 LEU HA H 3.132 9.241 0.130 1.00 . A A . 50 LEU HA 1 1 8 7552 1 1 50 LEU HB2 H 1.983 6.733 1.337 1.00 . A A . 50 LEU HB2 1 1 8 7553 1 1 50 LEU HB3 H 1.208 7.842 0.222 1.00 . A A . 50 LEU HB3 1 1 8 7554 1 1 50 LEU HD11 H 1.120 5.106 -0.011 1.00 . A A . 50 LEU HD11 1 1 8 7555 1 1 50 LEU HD12 H 2.774 4.497 0.022 1.00 . A A . 50 LEU HD12 1 1 8 7556 1 1 50 LEU HD13 H 1.920 4.643 -1.513 1.00 . A A . 50 LEU HD13 1 1 8 7557 1 1 50 LEU HD21 H 1.038 7.164 -2.011 1.00 . A A . 50 LEU HD21 1 1 8 7558 1 1 50 LEU HD22 H 2.445 6.485 -2.829 1.00 . A A . 50 LEU HD22 1 1 8 7559 1 1 50 LEU HD23 H 2.530 8.098 -2.119 1.00 . A A . 50 LEU HD23 1 1 8 7560 1 1 50 LEU HG H 3.668 6.458 -0.716 1.00 . A A . 50 LEU HG 1 1 8 7561 1 1 50 LEU N N 4.485 7.927 0.969 1.00 . A A . 50 LEU N 1 1 8 7562 1 1 50 LEU O O 2.793 8.434 3.261 1.00 . A A . 50 LEU O 1 1 8 7563 1 1 51 LYS C C 0.451 10.646 3.781 1.00 . A A . 51 LYS C 1 1 8 7564 1 1 51 LYS CA C 1.870 11.041 3.384 1.00 . A A . 51 LYS CA 1 1 8 7565 1 1 51 LYS CB C 1.949 12.555 3.172 1.00 . A A . 51 LYS CB 1 1 8 7566 1 1 51 LYS CD C 2.631 14.609 4.451 1.00 . A A . 51 LYS CD 1 1 8 7567 1 1 51 LYS CE C 1.876 15.809 4.999 1.00 . A A . 51 LYS CE 1 1 8 7568 1 1 51 LYS CG C 1.764 13.359 4.449 1.00 . A A . 51 LYS CG 1 1 8 7569 1 1 51 LYS H H 2.258 10.808 1.317 1.00 . A A . 51 LYS H 1 1 8 7570 1 1 51 LYS HA H 2.543 10.764 4.181 1.00 . A A . 51 LYS HA 1 1 8 7571 1 1 51 LYS HB2 H 2.915 12.798 2.756 1.00 . A A . 51 LYS HB2 1 1 8 7572 1 1 51 LYS HB3 H 1.181 12.849 2.474 1.00 . A A . 51 LYS HB3 1 1 8 7573 1 1 51 LYS HD2 H 3.500 14.432 5.066 1.00 . A A . 51 LYS HD2 1 1 8 7574 1 1 51 LYS HD3 H 2.941 14.822 3.438 1.00 . A A . 51 LYS HD3 1 1 8 7575 1 1 51 LYS HE2 H 1.295 16.250 4.201 1.00 . A A . 51 LYS HE2 1 1 8 7576 1 1 51 LYS HE3 H 1.214 15.475 5.784 1.00 . A A . 51 LYS HE3 1 1 8 7577 1 1 51 LYS HG2 H 0.729 13.650 4.532 1.00 . A A . 51 LYS HG2 1 1 8 7578 1 1 51 LYS HG3 H 2.036 12.742 5.293 1.00 . A A . 51 LYS HG3 1 1 8 7579 1 1 51 LYS HZ1 H 2.281 17.477 6.190 1.00 . A A . 51 LYS HZ1 1 1 8 7580 1 1 51 LYS HZ2 H 3.209 17.403 4.777 1.00 . A A . 51 LYS HZ2 1 1 8 7581 1 1 51 LYS HZ3 H 3.569 16.384 6.079 1.00 . A A . 51 LYS HZ3 1 1 8 7582 1 1 51 LYS N N 2.290 10.340 2.177 1.00 . A A . 51 LYS N 1 1 8 7583 1 1 51 LYS NZ N 2.798 16.840 5.550 1.00 . A A . 51 LYS NZ 1 1 8 7584 1 1 51 LYS O O -0.510 10.955 3.076 1.00 . A A . 51 LYS O 1 1 8 7585 1 1 52 TYR C C -1.882 10.726 5.672 1.00 . A A . 52 TYR C 1 1 8 7586 1 1 52 TYR CA C -0.975 9.530 5.406 1.00 . A A . 52 TYR CA 1 1 8 7587 1 1 52 TYR CB C -0.813 8.705 6.685 1.00 . A A . 52 TYR CB 1 1 8 7588 1 1 52 TYR CD1 C -3.116 8.802 7.713 1.00 . A A . 52 TYR CD1 1 1 8 7589 1 1 52 TYR CD2 C -2.281 6.680 7.021 1.00 . A A . 52 TYR CD2 1 1 8 7590 1 1 52 TYR CE1 C -4.288 8.208 8.137 1.00 . A A . 52 TYR CE1 1 1 8 7591 1 1 52 TYR CE2 C -3.451 6.078 7.444 1.00 . A A . 52 TYR CE2 1 1 8 7592 1 1 52 TYR CG C -2.093 8.050 7.148 1.00 . A A . 52 TYR CG 1 1 8 7593 1 1 52 TYR CZ C -4.449 6.846 8.000 1.00 . A A . 52 TYR CZ 1 1 8 7594 1 1 52 TYR H H 1.131 9.751 5.434 1.00 . A A . 52 TYR H 1 1 8 7595 1 1 52 TYR HA H -1.426 8.912 4.644 1.00 . A A . 52 TYR HA 1 1 8 7596 1 1 52 TYR HB2 H -0.085 7.926 6.512 1.00 . A A . 52 TYR HB2 1 1 8 7597 1 1 52 TYR HB3 H -0.461 9.348 7.478 1.00 . A A . 52 TYR HB3 1 1 8 7598 1 1 52 TYR HD1 H -2.986 9.870 7.819 1.00 . A A . 52 TYR HD1 1 1 8 7599 1 1 52 TYR HD2 H -1.495 6.080 6.585 1.00 . A A . 52 TYR HD2 1 1 8 7600 1 1 52 TYR HE1 H -5.071 8.808 8.574 1.00 . A A . 52 TYR HE1 1 1 8 7601 1 1 52 TYR HE2 H -3.580 5.010 7.336 1.00 . A A . 52 TYR HE2 1 1 8 7602 1 1 52 TYR HH H -5.443 5.754 9.225 1.00 . A A . 52 TYR HH 1 1 8 7603 1 1 52 TYR N N 0.327 9.965 4.915 1.00 . A A . 52 TYR N 1 1 8 7604 1 1 52 TYR O O -1.574 11.579 6.505 1.00 . A A . 52 TYR O 1 1 8 7605 1 1 52 TYR OH O -5.612 6.251 8.422 1.00 . A A . 52 TYR OH 1 1 8 7606 1 1 53 GLN C C -5.199 11.414 5.866 1.00 . A A . 53 GLN C 1 1 8 7607 1 1 53 GLN CA C -3.953 11.878 5.116 1.00 . A A . 53 GLN CA 1 1 8 7608 1 1 53 GLN CB C -4.348 12.440 3.748 1.00 . A A . 53 GLN CB 1 1 8 7609 1 1 53 GLN CD C -3.344 14.128 2.158 1.00 . A A . 53 GLN CD 1 1 8 7610 1 1 53 GLN CG C -3.157 12.805 2.876 1.00 . A A . 53 GLN CG 1 1 8 7611 1 1 53 GLN H H -3.191 10.074 4.309 1.00 . A A . 53 GLN H 1 1 8 7612 1 1 53 GLN HA H -3.472 12.654 5.690 1.00 . A A . 53 GLN HA 1 1 8 7613 1 1 53 GLN HB2 H -4.937 11.703 3.225 1.00 . A A . 53 GLN HB2 1 1 8 7614 1 1 53 GLN HB3 H -4.945 13.329 3.896 1.00 . A A . 53 GLN HB3 1 1 8 7615 1 1 53 GLN HE21 H -2.417 13.417 0.550 1.00 . A A . 53 GLN HE21 1 1 8 7616 1 1 53 GLN HE22 H -2.969 15.050 0.436 1.00 . A A . 53 GLN HE22 1 1 8 7617 1 1 53 GLN HG2 H -2.278 12.874 3.498 1.00 . A A . 53 GLN HG2 1 1 8 7618 1 1 53 GLN HG3 H -3.017 12.030 2.137 1.00 . A A . 53 GLN HG3 1 1 8 7619 1 1 53 GLN N N -3.001 10.784 4.958 1.00 . A A . 53 GLN N 1 1 8 7620 1 1 53 GLN NE2 N -2.861 14.207 0.924 1.00 . A A . 53 GLN NE2 1 1 8 7621 1 1 53 GLN O O -5.976 10.606 5.359 1.00 . A A . 53 GLN O 1 1 8 7622 1 1 53 GLN OE1 O -3.917 15.071 2.706 1.00 . A A . 53 GLN OE1 1 1 8 7623 1 1 54 GLU C C -7.840 11.978 7.230 1.00 . A A . 54 GLU C 1 1 8 7624 1 1 54 GLU CA C -6.528 11.573 7.900 1.00 . A A . 54 GLU CA 1 1 8 7625 1 1 54 GLU CB C -6.422 12.238 9.275 1.00 . A A . 54 GLU CB 1 1 8 7626 1 1 54 GLU CD C -6.128 14.380 10.578 1.00 . A A . 54 GLU CD 1 1 8 7627 1 1 54 GLU CG C -6.308 13.752 9.210 1.00 . A A . 54 GLU CG 1 1 8 7628 1 1 54 GLU H H -4.724 12.571 7.425 1.00 . A A . 54 GLU H 1 1 8 7629 1 1 54 GLU HA H -6.520 10.502 8.029 1.00 . A A . 54 GLU HA 1 1 8 7630 1 1 54 GLU HB2 H -7.300 11.987 9.852 1.00 . A A . 54 GLU HB2 1 1 8 7631 1 1 54 GLU HB3 H -5.548 11.854 9.780 1.00 . A A . 54 GLU HB3 1 1 8 7632 1 1 54 GLU HG2 H -5.458 14.012 8.597 1.00 . A A . 54 GLU HG2 1 1 8 7633 1 1 54 GLU HG3 H -7.209 14.148 8.764 1.00 . A A . 54 GLU HG3 1 1 8 7634 1 1 54 GLU N N -5.379 11.931 7.077 1.00 . A A . 54 GLU N 1 1 8 7635 1 1 54 GLU O O -8.908 11.484 7.589 1.00 . A A . 54 GLU O 1 1 8 7636 1 1 54 GLU OE1 O -7.024 14.215 11.431 1.00 . A A . 54 GLU OE1 1 1 8 7637 1 1 54 GLU OE2 O -5.089 15.040 10.796 1.00 . A A . 54 GLU OE2 1 1 8 7638 1 1 55 ASN C C -9.800 12.177 5.071 1.00 . A A . 55 ASN C 1 1 8 7639 1 1 55 ASN CA C -8.937 13.348 5.535 1.00 . A A . 55 ASN CA 1 1 8 7640 1 1 55 ASN CB C -8.524 14.196 4.330 1.00 . A A . 55 ASN CB 1 1 8 7641 1 1 55 ASN CG C -7.882 15.507 4.739 1.00 . A A . 55 ASN CG 1 1 8 7642 1 1 55 ASN H H -6.877 13.240 6.008 1.00 . A A . 55 ASN H 1 1 8 7643 1 1 55 ASN HA H -9.514 13.959 6.212 1.00 . A A . 55 ASN HA 1 1 8 7644 1 1 55 ASN HB2 H -7.816 13.641 3.733 1.00 . A A . 55 ASN HB2 1 1 8 7645 1 1 55 ASN HB3 H -9.398 14.414 3.735 1.00 . A A . 55 ASN HB3 1 1 8 7646 1 1 55 ASN HD21 H -8.013 16.181 2.873 1.00 . A A . 55 ASN HD21 1 1 8 7647 1 1 55 ASN HD22 H -7.304 17.266 4.014 1.00 . A A . 55 ASN HD22 1 1 8 7648 1 1 55 ASN N N -7.755 12.879 6.252 1.00 . A A . 55 ASN N 1 1 8 7649 1 1 55 ASN ND2 N -7.715 16.409 3.778 1.00 . A A . 55 ASN ND2 1 1 8 7650 1 1 55 ASN O O -11.030 12.246 5.107 1.00 . A A . 55 ASN O 1 1 8 7651 1 1 55 ASN OD1 O -7.539 15.707 5.904 1.00 . A A . 55 ASN OD1 1 1 8 7652 1 1 56 ALA C C -9.944 8.853 5.262 1.00 . A A . 56 ALA C 1 1 8 7653 1 1 56 ALA CA C -9.859 9.917 4.170 1.00 . A A . 56 ALA CA 1 1 8 7654 1 1 56 ALA CB C -9.176 9.349 2.936 1.00 . A A . 56 ALA CB 1 1 8 7655 1 1 56 ALA H H -8.169 11.105 4.634 1.00 . A A . 56 ALA H 1 1 8 7656 1 1 56 ALA HA H -10.860 10.216 3.893 1.00 . A A . 56 ALA HA 1 1 8 7657 1 1 56 ALA HB1 H -8.849 10.159 2.301 1.00 . A A . 56 ALA HB1 1 1 8 7658 1 1 56 ALA HB2 H -9.872 8.725 2.394 1.00 . A A . 56 ALA HB2 1 1 8 7659 1 1 56 ALA HB3 H -8.323 8.760 3.236 1.00 . A A . 56 ALA HB3 1 1 8 7660 1 1 56 ALA N N -9.150 11.102 4.639 1.00 . A A . 56 ALA N 1 1 8 7661 1 1 56 ALA O O -10.200 7.684 4.982 1.00 . A A . 56 ALA O 1 1 8 7662 1 1 57 TYR C C -10.300 9.047 8.885 1.00 . A A . 57 TYR C 1 1 8 7663 1 1 57 TYR CA C -9.773 8.346 7.638 1.00 . A A . 57 TYR CA 1 1 8 7664 1 1 57 TYR CB C -8.383 7.771 7.919 1.00 . A A . 57 TYR CB 1 1 8 7665 1 1 57 TYR CD1 C -8.102 6.153 6.000 1.00 . A A . 57 TYR CD1 1 1 8 7666 1 1 57 TYR CD2 C -6.558 7.960 6.185 1.00 . A A . 57 TYR CD2 1 1 8 7667 1 1 57 TYR CE1 C -7.450 5.706 4.867 1.00 . A A . 57 TYR CE1 1 1 8 7668 1 1 57 TYR CE2 C -5.901 7.520 5.050 1.00 . A A . 57 TYR CE2 1 1 8 7669 1 1 57 TYR CG C -7.667 7.285 6.678 1.00 . A A . 57 TYR CG 1 1 8 7670 1 1 57 TYR CZ C -6.352 6.393 4.395 1.00 . A A . 57 TYR CZ 1 1 8 7671 1 1 57 TYR H H -9.513 10.209 6.669 1.00 . A A . 57 TYR H 1 1 8 7672 1 1 57 TYR HA H -10.440 7.538 7.380 1.00 . A A . 57 TYR HA 1 1 8 7673 1 1 57 TYR HB2 H -7.770 8.532 8.377 1.00 . A A . 57 TYR HB2 1 1 8 7674 1 1 57 TYR HB3 H -8.478 6.935 8.596 1.00 . A A . 57 TYR HB3 1 1 8 7675 1 1 57 TYR HD1 H -8.963 5.618 6.372 1.00 . A A . 57 TYR HD1 1 1 8 7676 1 1 57 TYR HD2 H -6.207 8.842 6.699 1.00 . A A . 57 TYR HD2 1 1 8 7677 1 1 57 TYR HE1 H -7.803 4.824 4.353 1.00 . A A . 57 TYR HE1 1 1 8 7678 1 1 57 TYR HE2 H -5.041 8.058 4.682 1.00 . A A . 57 TYR HE2 1 1 8 7679 1 1 57 TYR HH H -6.344 5.633 2.629 1.00 . A A . 57 TYR HH 1 1 8 7680 1 1 57 TYR N N -9.721 9.265 6.507 1.00 . A A . 57 TYR N 1 1 8 7681 1 1 57 TYR O O -9.950 8.691 10.008 1.00 . A A . 57 TYR O 1 1 8 7682 1 1 57 TYR OH O -5.701 5.951 3.267 1.00 . A A . 57 TYR OH 1 1 8 7683 1 1 58 ARG C C -13.240 10.582 9.862 1.00 . A A . 58 ARG C 1 1 8 7684 1 1 58 ARG CA C -11.730 10.801 9.785 1.00 . A A . 58 ARG CA 1 1 8 7685 1 1 58 ARG CB C -11.430 12.291 9.630 1.00 . A A . 58 ARG CB 1 1 8 7686 1 1 58 ARG CD C -13.290 13.655 8.624 1.00 . A A . 58 ARG CD 1 1 8 7687 1 1 58 ARG CG C -12.000 12.899 8.356 1.00 . A A . 58 ARG CG 1 1 8 7688 1 1 58 ARG CZ C -14.150 15.935 8.249 1.00 . A A . 58 ARG CZ 1 1 8 7689 1 1 58 ARG H H -11.400 10.286 7.759 1.00 . A A . 58 ARG H 1 1 8 7690 1 1 58 ARG HA H -11.280 10.444 10.699 1.00 . A A . 58 ARG HA 1 1 8 7691 1 1 58 ARG HB2 H -11.840 12.822 10.472 1.00 . A A . 58 ARG HB2 1 1 8 7692 1 1 58 ARG HB3 H -10.360 12.430 9.621 1.00 . A A . 58 ARG HB3 1 1 8 7693 1 1 58 ARG HD2 H -14.050 13.294 7.947 1.00 . A A . 58 ARG HD2 1 1 8 7694 1 1 58 ARG HD3 H -13.600 13.468 9.641 1.00 . A A . 58 ARG HD3 1 1 8 7695 1 1 58 ARG HE H -12.220 15.456 8.441 1.00 . A A . 58 ARG HE 1 1 8 7696 1 1 58 ARG HG2 H -11.270 13.584 7.940 1.00 . A A . 58 ARG HG2 1 1 8 7697 1 1 58 ARG HG3 H -12.190 12.107 7.648 1.00 . A A . 58 ARG HG3 1 1 8 7698 1 1 58 ARG HH11 H -15.580 14.509 8.355 1.00 . A A . 58 ARG HH11 1 1 8 7699 1 1 58 ARG HH12 H -16.150 16.120 8.092 1.00 . A A . 58 ARG HH12 1 1 8 7700 1 1 58 ARG HH21 H -12.970 17.574 8.097 1.00 . A A . 58 ARG HH21 1 1 8 7701 1 1 58 ARG HH22 H -14.680 17.862 7.946 1.00 . A A . 58 ARG HH22 1 1 8 7702 1 1 58 ARG N N -11.150 10.048 8.679 1.00 . A A . 58 ARG N 1 1 8 7703 1 1 58 ARG NE N -13.130 15.095 8.432 1.00 . A A . 58 ARG NE 1 1 8 7704 1 1 58 ARG NH1 N -15.390 15.484 8.230 1.00 . A A . 58 ARG NH1 1 1 8 7705 1 1 58 ARG NH2 N -13.910 17.229 8.083 1.00 . A A . 58 ARG NH2 1 1 8 7706 1 1 58 ARG O O -13.880 10.219 8.872 1.00 . A A . 58 ARG O 1 1 8 7707 1 1 59 GLN C C -15.820 11.823 12.004 1.00 . A A . 59 GLN C 1 1 8 7708 1 1 59 GLN CA C -15.240 10.635 11.250 1.00 . A A . 59 GLN CA 1 1 8 7709 1 1 59 GLN CB C -15.510 9.341 12.020 1.00 . A A . 59 GLN CB 1 1 8 7710 1 1 59 GLN CD C -13.730 8.022 13.231 1.00 . A A . 59 GLN CD 1 1 8 7711 1 1 59 GLN CG C -14.680 9.200 13.286 1.00 . A A . 59 GLN CG 1 1 8 7712 1 1 59 GLN H H -13.240 11.093 11.794 1.00 . A A . 59 GLN H 1 1 8 7713 1 1 59 GLN HA H -15.710 10.572 10.280 1.00 . A A . 59 GLN HA 1 1 8 7714 1 1 59 GLN HB2 H -16.550 9.314 12.296 1.00 . A A . 59 GLN HB2 1 1 8 7715 1 1 59 GLN HB3 H -15.300 8.500 11.378 1.00 . A A . 59 GLN HB3 1 1 8 7716 1 1 59 GLN HE21 H -12.620 8.948 11.859 1.00 . A A . 59 GLN HE21 1 1 8 7717 1 1 59 GLN HE22 H -12.070 7.381 12.334 1.00 . A A . 59 GLN HE22 1 1 8 7718 1 1 59 GLN HG2 H -14.100 10.103 13.425 1.00 . A A . 59 GLN HG2 1 1 8 7719 1 1 59 GLN HG3 H -15.350 9.067 14.126 1.00 . A A . 59 GLN HG3 1 1 8 7720 1 1 59 GLN N N -13.800 10.806 11.044 1.00 . A A . 59 GLN N 1 1 8 7721 1 1 59 GLN NE2 N -12.700 8.127 12.390 1.00 . A A . 59 GLN NE2 1 1 8 7722 1 1 59 GLN O O -15.120 12.777 12.327 1.00 . A A . 59 GLN O 1 1 8 7723 1 1 59 GLN OE1 O -13.900 7.030 13.937 1.00 . A A . 59 GLN OE1 1 1 8 7724 1 1 60 ALA C C -17.330 12.909 14.446 1.00 . A A . 60 ALA C 1 1 8 7725 1 1 60 ALA CA C -17.800 12.829 13.000 1.00 . A A . 60 ALA CA 1 1 8 7726 1 1 60 ALA CB C -19.310 12.622 12.946 1.00 . A A . 60 ALA CB 1 1 8 7727 1 1 60 ALA H H -17.630 10.972 11.999 1.00 . A A . 60 ALA H 1 1 8 7728 1 1 60 ALA HA H -17.570 13.761 12.503 1.00 . A A . 60 ALA HA 1 1 8 7729 1 1 60 ALA HB1 H -19.800 13.351 13.578 1.00 . A A . 60 ALA HB1 1 1 8 7730 1 1 60 ALA HB2 H -19.550 11.628 13.291 1.00 . A A . 60 ALA HB2 1 1 8 7731 1 1 60 ALA HB3 H -19.650 12.742 11.929 1.00 . A A . 60 ALA HB3 1 1 8 7732 1 1 60 ALA N N -17.120 11.758 12.283 1.00 . A A . 60 ALA N 1 1 8 7733 1 1 60 ALA O O -16.760 13.914 14.868 1.00 . A A . 60 ALA O 1 1 8 7734 1 1 61 ALA C C -16.690 10.401 16.986 1.00 . A A . 61 ALA C 1 1 8 7735 1 1 61 ALA CA C -17.170 11.795 16.604 1.00 . A A . 61 ALA CA 1 1 8 7736 1 1 61 ALA CB C -18.330 12.219 17.499 1.00 . A A . 61 ALA CB 1 1 8 7737 1 1 61 ALA H H -18.030 11.073 14.810 1.00 . A A . 61 ALA H 1 1 8 7738 1 1 61 ALA HA H -16.360 12.498 16.743 1.00 . A A . 61 ALA HA 1 1 8 7739 1 1 61 ALA HB1 H -18.260 11.701 18.445 1.00 . A A . 61 ALA HB1 1 1 8 7740 1 1 61 ALA HB2 H -19.260 11.971 17.020 1.00 . A A . 61 ALA HB2 1 1 8 7741 1 1 61 ALA HB3 H -18.280 13.284 17.668 1.00 . A A . 61 ALA HB3 1 1 8 7742 1 1 61 ALA N N -17.570 11.845 15.203 1.00 . A A . 61 ALA N 1 1 8 7743 1 1 61 ALA O O -16.300 9.638 16.076 1.00 . A A . 61 ALA O 1 1 8 7744 1 1 61 ALA OXT O -16.690 10.084 18.195 1.00 . A A . 61 ALA OXT 1 1 9 7745 1 1 1 MET C C -4.796 6.176 -0.733 1.00 . A A . 1 MET C 1 1 9 7746 1 1 1 MET CA C -3.925 6.952 0.251 1.00 . A A . 1 MET CA 1 1 9 7747 1 1 1 MET CB C -3.114 5.986 1.118 1.00 . A A . 1 MET CB 1 1 9 7748 1 1 1 MET CE C -0.357 7.536 3.334 1.00 . A A . 1 MET CE 1 1 9 7749 1 1 1 MET CG C -1.636 6.331 1.192 1.00 . A A . 1 MET CG 1 1 9 7750 1 1 1 MET H1 H -4.124 8.515 1.573 1.00 . A A . 1 MET H1 1 1 9 7751 1 1 1 MET H2 H -5.179 7.193 1.863 1.00 . A A . 1 MET H2 1 1 9 7752 1 1 1 MET H3 H -5.481 8.263 0.555 1.00 . A A . 1 MET H3 1 1 9 7753 1 1 1 MET HA H -3.248 7.586 -0.303 1.00 . A A . 1 MET HA 1 1 9 7754 1 1 1 MET HB2 H -3.514 5.999 2.122 1.00 . A A . 1 MET HB2 1 1 9 7755 1 1 1 MET HB3 H -3.209 4.990 0.714 1.00 . A A . 1 MET HB3 1 1 9 7756 1 1 1 MET HE1 H 0.520 7.827 2.774 1.00 . A A . 1 MET HE1 1 1 9 7757 1 1 1 MET HE2 H -0.115 7.497 4.386 1.00 . A A . 1 MET HE2 1 1 9 7758 1 1 1 MET HE3 H -1.144 8.258 3.171 1.00 . A A . 1 MET HE3 1 1 9 7759 1 1 1 MET HG2 H -1.115 5.781 0.422 1.00 . A A . 1 MET HG2 1 1 9 7760 1 1 1 MET HG3 H -1.518 7.390 1.018 1.00 . A A . 1 MET HG3 1 1 9 7761 1 1 1 MET N N -4.752 7.808 1.139 1.00 . A A . 1 MET N 1 1 9 7762 1 1 1 MET O O -5.679 5.416 -0.332 1.00 . A A . 1 MET O 1 1 9 7763 1 1 1 MET SD S -0.906 5.921 2.788 1.00 . A A . 1 MET SD 1 1 9 7764 1 1 2 TYR C C -4.601 4.400 -3.488 1.00 . A A . 2 TYR C 1 1 9 7765 1 1 2 TYR CA C -5.298 5.688 -3.063 1.00 . A A . 2 TYR CA 1 1 9 7766 1 1 2 TYR CB C -5.485 6.605 -4.273 1.00 . A A . 2 TYR CB 1 1 9 7767 1 1 2 TYR CD1 C -6.950 8.190 -2.964 1.00 . A A . 2 TYR CD1 1 1 9 7768 1 1 2 TYR CD2 C -7.521 7.746 -5.236 1.00 . A A . 2 TYR CD2 1 1 9 7769 1 1 2 TYR CE1 C -8.036 9.037 -2.851 1.00 . A A . 2 TYR CE1 1 1 9 7770 1 1 2 TYR CE2 C -8.609 8.593 -5.132 1.00 . A A . 2 TYR CE2 1 1 9 7771 1 1 2 TYR CG C -6.674 7.531 -4.156 1.00 . A A . 2 TYR CG 1 1 9 7772 1 1 2 TYR CZ C -8.862 9.235 -3.938 1.00 . A A . 2 TYR CZ 1 1 9 7773 1 1 2 TYR H H -3.823 6.986 -2.279 1.00 . A A . 2 TYR H 1 1 9 7774 1 1 2 TYR HA H -6.267 5.440 -2.658 1.00 . A A . 2 TYR HA 1 1 9 7775 1 1 2 TYR HB2 H -4.601 7.214 -4.393 1.00 . A A . 2 TYR HB2 1 1 9 7776 1 1 2 TYR HB3 H -5.621 6.000 -5.158 1.00 . A A . 2 TYR HB3 1 1 9 7777 1 1 2 TYR HD1 H -6.301 8.034 -2.115 1.00 . A A . 2 TYR HD1 1 1 9 7778 1 1 2 TYR HD2 H -7.320 7.242 -6.168 1.00 . A A . 2 TYR HD2 1 1 9 7779 1 1 2 TYR HE1 H -8.234 9.540 -1.918 1.00 . A A . 2 TYR HE1 1 1 9 7780 1 1 2 TYR HE2 H -9.256 8.747 -5.983 1.00 . A A . 2 TYR HE2 1 1 9 7781 1 1 2 TYR HH H -9.637 10.979 -3.710 1.00 . A A . 2 TYR HH 1 1 9 7782 1 1 2 TYR N N -4.540 6.370 -2.022 1.00 . A A . 2 TYR N 1 1 9 7783 1 1 2 TYR O O -3.373 4.335 -3.539 1.00 . A A . 2 TYR O 1 1 9 7784 1 1 2 TYR OH O -9.944 10.077 -3.830 1.00 . A A . 2 TYR OH 1 1 9 7785 1 1 3 LYS C C -3.983 2.242 -5.456 1.00 . A A . 3 LYS C 1 1 9 7786 1 1 3 LYS CA C -4.851 2.088 -4.212 1.00 . A A . 3 LYS CA 1 1 9 7787 1 1 3 LYS CB C -5.986 1.100 -4.486 1.00 . A A . 3 LYS CB 1 1 9 7788 1 1 3 LYS CD C -6.220 -1.146 -5.590 1.00 . A A . 3 LYS CD 1 1 9 7789 1 1 3 LYS CE C -5.888 -2.626 -5.497 1.00 . A A . 3 LYS CE 1 1 9 7790 1 1 3 LYS CG C -5.539 -0.353 -4.487 1.00 . A A . 3 LYS CG 1 1 9 7791 1 1 3 LYS H H -6.364 3.489 -3.731 1.00 . A A . 3 LYS H 1 1 9 7792 1 1 3 LYS HA H -4.240 1.708 -3.406 1.00 . A A . 3 LYS HA 1 1 9 7793 1 1 3 LYS HB2 H -6.744 1.220 -3.726 1.00 . A A . 3 LYS HB2 1 1 9 7794 1 1 3 LYS HB3 H -6.417 1.324 -5.451 1.00 . A A . 3 LYS HB3 1 1 9 7795 1 1 3 LYS HD2 H -7.289 -1.022 -5.503 1.00 . A A . 3 LYS HD2 1 1 9 7796 1 1 3 LYS HD3 H -5.889 -0.771 -6.548 1.00 . A A . 3 LYS HD3 1 1 9 7797 1 1 3 LYS HE2 H -4.857 -2.770 -5.784 1.00 . A A . 3 LYS HE2 1 1 9 7798 1 1 3 LYS HE3 H -6.025 -2.949 -4.474 1.00 . A A . 3 LYS HE3 1 1 9 7799 1 1 3 LYS HG2 H -4.470 -0.391 -4.639 1.00 . A A . 3 LYS HG2 1 1 9 7800 1 1 3 LYS HG3 H -5.785 -0.796 -3.532 1.00 . A A . 3 LYS HG3 1 1 9 7801 1 1 3 LYS HZ1 H -7.722 -3.061 -6.397 1.00 . A A . 3 LYS HZ1 1 1 9 7802 1 1 3 LYS HZ2 H -6.794 -4.428 -6.040 1.00 . A A . 3 LYS HZ2 1 1 9 7803 1 1 3 LYS HZ3 H -6.380 -3.448 -7.354 1.00 . A A . 3 LYS HZ3 1 1 9 7804 1 1 3 LYS N N -5.392 3.375 -3.791 1.00 . A A . 3 LYS N 1 1 9 7805 1 1 3 LYS NZ N -6.757 -3.448 -6.383 1.00 . A A . 3 LYS NZ 1 1 9 7806 1 1 3 LYS O O -2.897 1.671 -5.544 1.00 . A A . 3 LYS O 1 1 9 7807 1 1 4 LYS C C -2.306 3.687 -7.387 1.00 . A A . 4 LYS C 1 1 9 7808 1 1 4 LYS CA C -3.742 3.252 -7.662 1.00 . A A . 4 LYS CA 1 1 9 7809 1 1 4 LYS CB C -4.456 4.312 -8.503 1.00 . A A . 4 LYS CB 1 1 9 7810 1 1 4 LYS CD C -2.825 5.630 -9.885 1.00 . A A . 4 LYS CD 1 1 9 7811 1 1 4 LYS CE C -2.839 6.394 -11.199 1.00 . A A . 4 LYS CE 1 1 9 7812 1 1 4 LYS CG C -3.848 4.504 -9.882 1.00 . A A . 4 LYS CG 1 1 9 7813 1 1 4 LYS H H -5.342 3.449 -6.289 1.00 . A A . 4 LYS H 1 1 9 7814 1 1 4 LYS HA H -3.724 2.324 -8.213 1.00 . A A . 4 LYS HA 1 1 9 7815 1 1 4 LYS HB2 H -5.489 4.022 -8.626 1.00 . A A . 4 LYS HB2 1 1 9 7816 1 1 4 LYS HB3 H -4.416 5.256 -7.980 1.00 . A A . 4 LYS HB3 1 1 9 7817 1 1 4 LYS HD2 H -3.053 6.314 -9.081 1.00 . A A . 4 LYS HD2 1 1 9 7818 1 1 4 LYS HD3 H -1.841 5.209 -9.735 1.00 . A A . 4 LYS HD3 1 1 9 7819 1 1 4 LYS HE2 H -1.946 6.149 -11.754 1.00 . A A . 4 LYS HE2 1 1 9 7820 1 1 4 LYS HE3 H -3.708 6.094 -11.768 1.00 . A A . 4 LYS HE3 1 1 9 7821 1 1 4 LYS HG2 H -3.361 3.589 -10.182 1.00 . A A . 4 LYS HG2 1 1 9 7822 1 1 4 LYS HG3 H -4.635 4.743 -10.582 1.00 . A A . 4 LYS HG3 1 1 9 7823 1 1 4 LYS HZ1 H -2.374 8.118 -10.114 1.00 . A A . 4 LYS HZ1 1 1 9 7824 1 1 4 LYS HZ2 H -3.873 8.185 -10.896 1.00 . A A . 4 LYS HZ2 1 1 9 7825 1 1 4 LYS HZ3 H -2.446 8.359 -11.787 1.00 . A A . 4 LYS HZ3 1 1 9 7826 1 1 4 LYS N N -4.471 3.020 -6.419 1.00 . A A . 4 LYS N 1 1 9 7827 1 1 4 LYS NZ N -2.886 7.867 -10.984 1.00 . A A . 4 LYS NZ 1 1 9 7828 1 1 4 LYS O O -1.387 3.326 -8.122 1.00 . A A . 4 LYS O 1 1 9 7829 1 1 5 ASP C C 0.030 3.830 -5.317 1.00 . A A . 5 ASP C 1 1 9 7830 1 1 5 ASP CA C -0.794 4.945 -5.953 1.00 . A A . 5 ASP CA 1 1 9 7831 1 1 5 ASP CB C -0.908 6.126 -4.988 1.00 . A A . 5 ASP CB 1 1 9 7832 1 1 5 ASP CG C -1.298 7.412 -5.690 1.00 . A A . 5 ASP CG 1 1 9 7833 1 1 5 ASP H H -2.891 4.717 -5.776 1.00 . A A . 5 ASP H 1 1 9 7834 1 1 5 ASP HA H -0.296 5.274 -6.854 1.00 . A A . 5 ASP HA 1 1 9 7835 1 1 5 ASP HB2 H -1.657 5.903 -4.243 1.00 . A A . 5 ASP HB2 1 1 9 7836 1 1 5 ASP HB3 H 0.045 6.278 -4.502 1.00 . A A . 5 ASP HB3 1 1 9 7837 1 1 5 ASP N N -2.119 4.463 -6.324 1.00 . A A . 5 ASP N 1 1 9 7838 1 1 5 ASP O O 1.147 3.546 -5.749 1.00 . A A . 5 ASP O 1 1 9 7839 1 1 5 ASP OD1 O -0.847 7.623 -6.835 1.00 . A A . 5 ASP OD1 1 1 9 7840 1 1 5 ASP OD2 O -2.058 8.206 -5.096 1.00 . A A . 5 ASP OD2 1 1 9 7841 1 1 6 VAL C C 0.585 1.029 -4.566 1.00 . A A . 6 VAL C 1 1 9 7842 1 1 6 VAL CA C 0.140 2.117 -3.594 1.00 . A A . 6 VAL CA 1 1 9 7843 1 1 6 VAL CB C -0.780 1.494 -2.528 1.00 . A A . 6 VAL CB 1 1 9 7844 1 1 6 VAL CG1 C 0.035 0.671 -1.558 1.00 . A A . 6 VAL CG1 1 1 9 7845 1 1 6 VAL CG2 C -1.568 2.566 -1.787 1.00 . A A . 6 VAL CG2 1 1 9 7846 1 1 6 VAL H H -1.421 3.465 -3.990 1.00 . A A . 6 VAL H 1 1 9 7847 1 1 6 VAL HA H 1.009 2.524 -3.097 1.00 . A A . 6 VAL HA 1 1 9 7848 1 1 6 VAL HB H -1.481 0.837 -3.023 1.00 . A A . 6 VAL HB 1 1 9 7849 1 1 6 VAL HG11 H -0.625 0.059 -0.965 1.00 . A A . 6 VAL HG11 1 1 9 7850 1 1 6 VAL HG12 H 0.591 1.334 -0.915 1.00 . A A . 6 VAL HG12 1 1 9 7851 1 1 6 VAL HG13 H 0.717 0.044 -2.108 1.00 . A A . 6 VAL HG13 1 1 9 7852 1 1 6 VAL HG21 H -1.708 2.265 -0.759 1.00 . A A . 6 VAL HG21 1 1 9 7853 1 1 6 VAL HG22 H -2.530 2.696 -2.259 1.00 . A A . 6 VAL HG22 1 1 9 7854 1 1 6 VAL HG23 H -1.023 3.498 -1.818 1.00 . A A . 6 VAL HG23 1 1 9 7855 1 1 6 VAL N N -0.531 3.199 -4.290 1.00 . A A . 6 VAL N 1 1 9 7856 1 1 6 VAL O O 1.737 0.597 -4.546 1.00 . A A . 6 VAL O 1 1 9 7857 1 1 7 ILE C C 1.088 -0.010 -7.330 1.00 . A A . 7 ILE C 1 1 9 7858 1 1 7 ILE CA C -0.046 -0.440 -6.401 1.00 . A A . 7 ILE CA 1 1 9 7859 1 1 7 ILE CB C -1.295 -0.772 -7.247 1.00 . A A . 7 ILE CB 1 1 9 7860 1 1 7 ILE CD1 C -2.003 -2.517 -5.530 1.00 . A A . 7 ILE CD1 1 1 9 7861 1 1 7 ILE CG1 C -2.413 -1.317 -6.356 1.00 . A A . 7 ILE CG1 1 1 9 7862 1 1 7 ILE CG2 C -0.952 -1.770 -8.343 1.00 . A A . 7 ILE CG2 1 1 9 7863 1 1 7 ILE H H -1.238 0.980 -5.383 1.00 . A A . 7 ILE H 1 1 9 7864 1 1 7 ILE HA H 0.254 -1.332 -5.870 1.00 . A A . 7 ILE HA 1 1 9 7865 1 1 7 ILE HB H -1.634 0.138 -7.718 1.00 . A A . 7 ILE HB 1 1 9 7866 1 1 7 ILE HD11 H -1.134 -2.979 -5.974 1.00 . A A . 7 ILE HD11 1 1 9 7867 1 1 7 ILE HD12 H -2.813 -3.230 -5.501 1.00 . A A . 7 ILE HD12 1 1 9 7868 1 1 7 ILE HD13 H -1.767 -2.198 -4.525 1.00 . A A . 7 ILE HD13 1 1 9 7869 1 1 7 ILE HG12 H -2.734 -0.544 -5.676 1.00 . A A . 7 ILE HG12 1 1 9 7870 1 1 7 ILE HG13 H -3.248 -1.611 -6.976 1.00 . A A . 7 ILE HG13 1 1 9 7871 1 1 7 ILE HG21 H -1.839 -1.996 -8.916 1.00 . A A . 7 ILE HG21 1 1 9 7872 1 1 7 ILE HG22 H -0.570 -2.677 -7.898 1.00 . A A . 7 ILE HG22 1 1 9 7873 1 1 7 ILE HG23 H -0.202 -1.345 -8.993 1.00 . A A . 7 ILE HG23 1 1 9 7874 1 1 7 ILE N N -0.338 0.594 -5.417 1.00 . A A . 7 ILE N 1 1 9 7875 1 1 7 ILE O O 1.879 -0.836 -7.786 1.00 . A A . 7 ILE O 1 1 9 7876 1 1 8 ASP C C 3.527 1.906 -7.741 1.00 . A A . 8 ASP C 1 1 9 7877 1 1 8 ASP CA C 2.194 1.832 -8.473 1.00 . A A . 8 ASP CA 1 1 9 7878 1 1 8 ASP CB C 1.788 3.222 -8.969 1.00 . A A . 8 ASP CB 1 1 9 7879 1 1 8 ASP CG C 1.816 3.327 -10.482 1.00 . A A . 8 ASP CG 1 1 9 7880 1 1 8 ASP H H 0.504 1.894 -7.208 1.00 . A A . 8 ASP H 1 1 9 7881 1 1 8 ASP HA H 2.296 1.171 -9.321 1.00 . A A . 8 ASP HA 1 1 9 7882 1 1 8 ASP HB2 H 0.787 3.438 -8.631 1.00 . A A . 8 ASP HB2 1 1 9 7883 1 1 8 ASP HB3 H 2.467 3.957 -8.563 1.00 . A A . 8 ASP HB3 1 1 9 7884 1 1 8 ASP N N 1.159 1.288 -7.603 1.00 . A A . 8 ASP N 1 1 9 7885 1 1 8 ASP O O 4.590 1.885 -8.359 1.00 . A A . 8 ASP O 1 1 9 7886 1 1 8 ASP OD1 O 1.186 2.478 -11.148 1.00 . A A . 8 ASP OD1 1 1 9 7887 1 1 8 ASP OD2 O 2.465 4.259 -11.001 1.00 . A A . 8 ASP OD2 1 1 9 7888 1 1 9 HIS C C 5.226 0.666 -5.361 1.00 . A A . 9 HIS C 1 1 9 7889 1 1 9 HIS CA C 4.659 2.062 -5.598 1.00 . A A . 9 HIS CA 1 1 9 7890 1 1 9 HIS CB C 4.345 2.743 -4.261 1.00 . A A . 9 HIS CB 1 1 9 7891 1 1 9 HIS CD2 C 5.934 1.617 -2.546 1.00 . A A . 9 HIS CD2 1 1 9 7892 1 1 9 HIS CE1 C 7.121 3.379 -2.002 1.00 . A A . 9 HIS CE1 1 1 9 7893 1 1 9 HIS CG C 5.461 2.664 -3.262 1.00 . A A . 9 HIS CG 1 1 9 7894 1 1 9 HIS H H 2.584 1.997 -5.981 1.00 . A A . 9 HIS H 1 1 9 7895 1 1 9 HIS HA H 5.385 2.649 -6.133 1.00 . A A . 9 HIS HA 1 1 9 7896 1 1 9 HIS HB2 H 4.136 3.787 -4.440 1.00 . A A . 9 HIS HB2 1 1 9 7897 1 1 9 HIS HB3 H 3.474 2.277 -3.825 1.00 . A A . 9 HIS HB3 1 1 9 7898 1 1 9 HIS HD1 H 6.126 4.663 -3.247 1.00 . A A . 9 HIS HD1 1 1 9 7899 1 1 9 HIS HD2 H 5.570 0.600 -2.577 1.00 . A A . 9 HIS HD2 1 1 9 7900 1 1 9 HIS HE1 H 7.852 4.022 -1.534 1.00 . A A . 9 HIS HE1 1 1 9 7901 1 1 9 HIS HE2 H 7.560 1.539 -1.221 1.00 . A A . 9 HIS HE2 1 1 9 7902 1 1 9 HIS N N 3.461 1.988 -6.417 1.00 . A A . 9 HIS N 1 1 9 7903 1 1 9 HIS ND1 N 6.223 3.753 -2.898 1.00 . A A . 9 HIS ND1 1 1 9 7904 1 1 9 HIS NE2 N 6.966 2.089 -1.771 1.00 . A A . 9 HIS NE2 1 1 9 7905 1 1 9 HIS O O 6.436 0.487 -5.229 1.00 . A A . 9 HIS O 1 1 9 7906 1 1 10 PHE C C 4.913 -2.446 -6.406 1.00 . A A . 10 PHE C 1 1 9 7907 1 1 10 PHE CA C 4.738 -1.703 -5.087 1.00 . A A . 10 PHE CA 1 1 9 7908 1 1 10 PHE CB C 3.699 -2.416 -4.228 1.00 . A A . 10 PHE CB 1 1 9 7909 1 1 10 PHE CD1 C 4.704 -2.915 -1.994 1.00 . A A . 10 PHE CD1 1 1 9 7910 1 1 10 PHE CD2 C 3.168 -1.103 -2.164 1.00 . A A . 10 PHE CD2 1 1 9 7911 1 1 10 PHE CE1 C 4.859 -2.663 -0.643 1.00 . A A . 10 PHE CE1 1 1 9 7912 1 1 10 PHE CE2 C 3.316 -0.844 -0.815 1.00 . A A . 10 PHE CE2 1 1 9 7913 1 1 10 PHE CG C 3.858 -2.140 -2.765 1.00 . A A . 10 PHE CG 1 1 9 7914 1 1 10 PHE CZ C 4.164 -1.625 -0.053 1.00 . A A . 10 PHE CZ 1 1 9 7915 1 1 10 PHE H H 3.386 -0.113 -5.419 1.00 . A A . 10 PHE H 1 1 9 7916 1 1 10 PHE HA H 5.679 -1.697 -4.558 1.00 . A A . 10 PHE HA 1 1 9 7917 1 1 10 PHE HB2 H 2.711 -2.091 -4.521 1.00 . A A . 10 PHE HB2 1 1 9 7918 1 1 10 PHE HB3 H 3.783 -3.481 -4.378 1.00 . A A . 10 PHE HB3 1 1 9 7919 1 1 10 PHE HD1 H 5.246 -3.725 -2.458 1.00 . A A . 10 PHE HD1 1 1 9 7920 1 1 10 PHE HD2 H 2.507 -0.493 -2.760 1.00 . A A . 10 PHE HD2 1 1 9 7921 1 1 10 PHE HE1 H 5.521 -3.277 -0.051 1.00 . A A . 10 PHE HE1 1 1 9 7922 1 1 10 PHE HE2 H 2.772 -0.031 -0.358 1.00 . A A . 10 PHE HE2 1 1 9 7923 1 1 10 PHE HZ H 4.281 -1.424 1.001 1.00 . A A . 10 PHE HZ 1 1 9 7924 1 1 10 PHE N N 4.338 -0.320 -5.309 1.00 . A A . 10 PHE N 1 1 9 7925 1 1 10 PHE O O 5.721 -3.369 -6.509 1.00 . A A . 10 PHE O 1 1 9 7926 1 1 11 GLY C C 3.227 -3.821 -8.841 1.00 . A A . 11 GLY C 1 1 9 7927 1 1 11 GLY CA C 4.224 -2.688 -8.709 1.00 . A A . 11 GLY CA 1 1 9 7928 1 1 11 GLY H H 3.515 -1.306 -7.271 1.00 . A A . 11 GLY H 1 1 9 7929 1 1 11 GLY HA2 H 4.027 -1.956 -9.479 1.00 . A A . 11 GLY HA2 1 1 9 7930 1 1 11 GLY HA3 H 5.221 -3.079 -8.846 1.00 . A A . 11 GLY HA3 1 1 9 7931 1 1 11 GLY N N 4.145 -2.043 -7.412 1.00 . A A . 11 GLY N 1 1 9 7932 1 1 11 GLY O O 2.495 -3.905 -9.826 1.00 . A A . 11 GLY O 1 1 9 7933 1 1 12 THR C C 1.423 -5.810 -6.569 1.00 . A A . 12 THR C 1 1 9 7934 1 1 12 THR CA C 2.280 -5.826 -7.830 1.00 . A A . 12 THR CA 1 1 9 7935 1 1 12 THR CB C 3.057 -7.141 -7.919 1.00 . A A . 12 THR CB 1 1 9 7936 1 1 12 THR CG2 C 3.513 -7.474 -9.324 1.00 . A A . 12 THR CG2 1 1 9 7937 1 1 12 THR H H 3.803 -4.566 -7.078 1.00 . A A . 12 THR H 1 1 9 7938 1 1 12 THR HA H 1.635 -5.737 -8.692 1.00 . A A . 12 THR HA 1 1 9 7939 1 1 12 THR HB H 2.421 -7.945 -7.578 1.00 . A A . 12 THR HB 1 1 9 7940 1 1 12 THR HG1 H 4.802 -6.417 -7.404 1.00 . A A . 12 THR HG1 1 1 9 7941 1 1 12 THR HG21 H 2.670 -7.822 -9.902 1.00 . A A . 12 THR HG21 1 1 9 7942 1 1 12 THR HG22 H 4.267 -8.245 -9.284 1.00 . A A . 12 THR HG22 1 1 9 7943 1 1 12 THR HG23 H 3.925 -6.589 -9.787 1.00 . A A . 12 THR HG23 1 1 9 7944 1 1 12 THR N N 3.197 -4.692 -7.837 1.00 . A A . 12 THR N 1 1 9 7945 1 1 12 THR O O 1.549 -4.916 -5.732 1.00 . A A . 12 THR O 1 1 9 7946 1 1 12 THR OG1 O 4.206 -7.100 -7.092 1.00 . A A . 12 THR OG1 1 1 9 7947 1 1 13 GLN C C 0.367 -7.643 -4.134 1.00 . A A . 13 GLN C 1 1 9 7948 1 1 13 GLN CA C -0.322 -6.899 -5.273 1.00 . A A . 13 GLN CA 1 1 9 7949 1 1 13 GLN CB C -1.628 -7.604 -5.643 1.00 . A A . 13 GLN CB 1 1 9 7950 1 1 13 GLN CD C -3.200 -5.917 -6.675 1.00 . A A . 13 GLN CD 1 1 9 7951 1 1 13 GLN CG C -2.262 -7.082 -6.922 1.00 . A A . 13 GLN CG 1 1 9 7952 1 1 13 GLN H H 0.496 -7.489 -7.135 1.00 . A A . 13 GLN H 1 1 9 7953 1 1 13 GLN HA H -0.548 -5.894 -4.945 1.00 . A A . 13 GLN HA 1 1 9 7954 1 1 13 GLN HB2 H -1.429 -8.659 -5.770 1.00 . A A . 13 GLN HB2 1 1 9 7955 1 1 13 GLN HB3 H -2.335 -7.476 -4.837 1.00 . A A . 13 GLN HB3 1 1 9 7956 1 1 13 GLN HE21 H -4.449 -7.100 -5.677 1.00 . A A . 13 GLN HE21 1 1 9 7957 1 1 13 GLN HE22 H -4.927 -5.446 -5.811 1.00 . A A . 13 GLN HE22 1 1 9 7958 1 1 13 GLN HG2 H -1.479 -6.759 -7.592 1.00 . A A . 13 GLN HG2 1 1 9 7959 1 1 13 GLN HG3 H -2.820 -7.883 -7.384 1.00 . A A . 13 GLN HG3 1 1 9 7960 1 1 13 GLN N N 0.551 -6.804 -6.436 1.00 . A A . 13 GLN N 1 1 9 7961 1 1 13 GLN NE2 N -4.304 -6.181 -5.984 1.00 . A A . 13 GLN NE2 1 1 9 7962 1 1 13 GLN O O 0.487 -7.127 -3.023 1.00 . A A . 13 GLN O 1 1 9 7963 1 1 13 GLN OE1 O -2.936 -4.792 -7.100 1.00 . A A . 13 GLN OE1 1 1 9 7964 1 1 14 ARG C C 2.588 -8.892 -2.701 1.00 . A A . 14 ARG C 1 1 9 7965 1 1 14 ARG CA C 1.500 -9.684 -3.421 1.00 . A A . 14 ARG CA 1 1 9 7966 1 1 14 ARG CB C 2.109 -10.921 -4.082 1.00 . A A . 14 ARG CB 1 1 9 7967 1 1 14 ARG CD C 4.094 -12.212 -3.230 1.00 . A A . 14 ARG CD 1 1 9 7968 1 1 14 ARG CG C 2.600 -11.962 -3.087 1.00 . A A . 14 ARG CG 1 1 9 7969 1 1 14 ARG CZ C 5.667 -14.068 -2.832 1.00 . A A . 14 ARG CZ 1 1 9 7970 1 1 14 ARG H H 0.695 -9.217 -5.325 1.00 . A A . 14 ARG H 1 1 9 7971 1 1 14 ARG HA H 0.764 -10.001 -2.698 1.00 . A A . 14 ARG HA 1 1 9 7972 1 1 14 ARG HB2 H 1.364 -11.382 -4.713 1.00 . A A . 14 ARG HB2 1 1 9 7973 1 1 14 ARG HB3 H 2.945 -10.614 -4.694 1.00 . A A . 14 ARG HB3 1 1 9 7974 1 1 14 ARG HD2 H 4.407 -11.898 -4.213 1.00 . A A . 14 ARG HD2 1 1 9 7975 1 1 14 ARG HD3 H 4.615 -11.631 -2.483 1.00 . A A . 14 ARG HD3 1 1 9 7976 1 1 14 ARG HE H 3.700 -14.273 -3.102 1.00 . A A . 14 ARG HE 1 1 9 7977 1 1 14 ARG HG2 H 2.399 -11.612 -2.087 1.00 . A A . 14 ARG HG2 1 1 9 7978 1 1 14 ARG HG3 H 2.072 -12.888 -3.261 1.00 . A A . 14 ARG HG3 1 1 9 7979 1 1 14 ARG HH11 H 6.525 -12.235 -2.872 1.00 . A A . 14 ARG HH11 1 1 9 7980 1 1 14 ARG HH12 H 7.609 -13.556 -2.593 1.00 . A A . 14 ARG HH12 1 1 9 7981 1 1 14 ARG HH21 H 5.126 -16.012 -2.737 1.00 . A A . 14 ARG HH21 1 1 9 7982 1 1 14 ARG HH22 H 6.815 -15.700 -2.518 1.00 . A A . 14 ARG HH22 1 1 9 7983 1 1 14 ARG N N 0.821 -8.862 -4.420 1.00 . A A . 14 ARG N 1 1 9 7984 1 1 14 ARG NE N 4.432 -13.622 -3.054 1.00 . A A . 14 ARG NE 1 1 9 7985 1 1 14 ARG NH1 N 6.683 -13.216 -2.760 1.00 . A A . 14 ARG NH1 1 1 9 7986 1 1 14 ARG NH2 N 5.887 -15.366 -2.684 1.00 . A A . 14 ARG NH2 1 1 9 7987 1 1 14 ARG O O 2.889 -9.152 -1.536 1.00 . A A . 14 ARG O 1 1 9 7988 1 1 15 ALA C C 3.691 -6.273 -1.654 1.00 . A A . 15 ALA C 1 1 9 7989 1 1 15 ALA CA C 4.223 -7.095 -2.823 1.00 . A A . 15 ALA CA 1 1 9 7990 1 1 15 ALA CB C 4.818 -6.185 -3.887 1.00 . A A . 15 ALA CB 1 1 9 7991 1 1 15 ALA H H 2.888 -7.764 -4.324 1.00 . A A . 15 ALA H 1 1 9 7992 1 1 15 ALA HA H 5.005 -7.749 -2.464 1.00 . A A . 15 ALA HA 1 1 9 7993 1 1 15 ALA HB1 H 5.892 -6.291 -3.893 1.00 . A A . 15 ALA HB1 1 1 9 7994 1 1 15 ALA HB2 H 4.559 -5.157 -3.671 1.00 . A A . 15 ALA HB2 1 1 9 7995 1 1 15 ALA HB3 H 4.424 -6.456 -4.856 1.00 . A A . 15 ALA HB3 1 1 9 7996 1 1 15 ALA N N 3.172 -7.925 -3.399 1.00 . A A . 15 ALA N 1 1 9 7997 1 1 15 ALA O O 4.258 -6.289 -0.561 1.00 . A A . 15 ALA O 1 1 9 7998 1 1 16 VAL C C 1.669 -5.545 0.385 1.00 . A A . 16 VAL C 1 1 9 7999 1 1 16 VAL CA C 1.980 -4.729 -0.864 1.00 . A A . 16 VAL CA 1 1 9 8000 1 1 16 VAL CB C 0.676 -4.069 -1.364 1.00 . A A . 16 VAL CB 1 1 9 8001 1 1 16 VAL CG1 C 0.460 -2.749 -0.656 1.00 . A A . 16 VAL CG1 1 1 9 8002 1 1 16 VAL CG2 C 0.697 -3.861 -2.872 1.00 . A A . 16 VAL CG2 1 1 9 8003 1 1 16 VAL H H 2.191 -5.586 -2.779 1.00 . A A . 16 VAL H 1 1 9 8004 1 1 16 VAL HA H 2.678 -3.946 -0.607 1.00 . A A . 16 VAL HA 1 1 9 8005 1 1 16 VAL HB H -0.149 -4.722 -1.122 1.00 . A A . 16 VAL HB 1 1 9 8006 1 1 16 VAL HG11 H -0.563 -2.433 -0.790 1.00 . A A . 16 VAL HG11 1 1 9 8007 1 1 16 VAL HG12 H 1.124 -2.010 -1.074 1.00 . A A . 16 VAL HG12 1 1 9 8008 1 1 16 VAL HG13 H 0.668 -2.869 0.396 1.00 . A A . 16 VAL HG13 1 1 9 8009 1 1 16 VAL HG21 H 0.415 -4.777 -3.368 1.00 . A A . 16 VAL HG21 1 1 9 8010 1 1 16 VAL HG22 H 1.691 -3.576 -3.184 1.00 . A A . 16 VAL HG22 1 1 9 8011 1 1 16 VAL HG23 H 0.000 -3.079 -3.138 1.00 . A A . 16 VAL HG23 1 1 9 8012 1 1 16 VAL N N 2.596 -5.558 -1.892 1.00 . A A . 16 VAL N 1 1 9 8013 1 1 16 VAL O O 1.947 -5.117 1.505 1.00 . A A . 16 VAL O 1 1 9 8014 1 1 17 ALA C C 1.992 -8.121 1.998 1.00 . A A . 17 ALA C 1 1 9 8015 1 1 17 ALA CA C 0.742 -7.605 1.293 1.00 . A A . 17 ALA CA 1 1 9 8016 1 1 17 ALA CB C -0.110 -8.765 0.797 1.00 . A A . 17 ALA CB 1 1 9 8017 1 1 17 ALA H H 0.896 -7.011 -0.733 1.00 . A A . 17 ALA H 1 1 9 8018 1 1 17 ALA HA H 0.154 -7.033 1.998 1.00 . A A . 17 ALA HA 1 1 9 8019 1 1 17 ALA HB1 H 0.301 -9.696 1.162 1.00 . A A . 17 ALA HB1 1 1 9 8020 1 1 17 ALA HB2 H -0.113 -8.772 -0.283 1.00 . A A . 17 ALA HB2 1 1 9 8021 1 1 17 ALA HB3 H -1.120 -8.650 1.160 1.00 . A A . 17 ALA HB3 1 1 9 8022 1 1 17 ALA N N 1.091 -6.725 0.184 1.00 . A A . 17 ALA N 1 1 9 8023 1 1 17 ALA O O 1.977 -8.375 3.203 1.00 . A A . 17 ALA O 1 1 9 8024 1 1 18 LYS C C 4.942 -7.737 2.743 1.00 . A A . 18 LYS C 1 1 9 8025 1 1 18 LYS CA C 4.331 -8.761 1.790 1.00 . A A . 18 LYS CA 1 1 9 8026 1 1 18 LYS CB C 5.315 -9.082 0.662 1.00 . A A . 18 LYS CB 1 1 9 8027 1 1 18 LYS CD C 6.676 -10.824 -0.533 1.00 . A A . 18 LYS CD 1 1 9 8028 1 1 18 LYS CE C 8.081 -10.260 -0.396 1.00 . A A . 18 LYS CE 1 1 9 8029 1 1 18 LYS CG C 5.825 -10.512 0.689 1.00 . A A . 18 LYS CG 1 1 9 8030 1 1 18 LYS H H 3.021 -8.055 0.285 1.00 . A A . 18 LYS H 1 1 9 8031 1 1 18 LYS HA H 4.122 -9.666 2.341 1.00 . A A . 18 LYS HA 1 1 9 8032 1 1 18 LYS HB2 H 4.822 -8.917 -0.286 1.00 . A A . 18 LYS HB2 1 1 9 8033 1 1 18 LYS HB3 H 6.163 -8.417 0.736 1.00 . A A . 18 LYS HB3 1 1 9 8034 1 1 18 LYS HD2 H 6.738 -11.895 -0.650 1.00 . A A . 18 LYS HD2 1 1 9 8035 1 1 18 LYS HD3 H 6.206 -10.391 -1.404 1.00 . A A . 18 LYS HD3 1 1 9 8036 1 1 18 LYS HE2 H 8.159 -9.744 0.549 1.00 . A A . 18 LYS HE2 1 1 9 8037 1 1 18 LYS HE3 H 8.787 -11.078 -0.418 1.00 . A A . 18 LYS HE3 1 1 9 8038 1 1 18 LYS HG2 H 6.424 -10.653 1.577 1.00 . A A . 18 LYS HG2 1 1 9 8039 1 1 18 LYS HG3 H 4.981 -11.186 0.712 1.00 . A A . 18 LYS HG3 1 1 9 8040 1 1 18 LYS HZ1 H 9.118 -8.622 -1.173 1.00 . A A . 18 LYS HZ1 1 1 9 8041 1 1 18 LYS HZ2 H 7.553 -8.796 -1.789 1.00 . A A . 18 LYS HZ2 1 1 9 8042 1 1 18 LYS HZ3 H 8.786 -9.827 -2.315 1.00 . A A . 18 LYS HZ3 1 1 9 8043 1 1 18 LYS N N 3.073 -8.274 1.239 1.00 . A A . 18 LYS N 1 1 9 8044 1 1 18 LYS NZ N 8.407 -9.310 -1.496 1.00 . A A . 18 LYS NZ 1 1 9 8045 1 1 18 LYS O O 5.633 -8.097 3.696 1.00 . A A . 18 LYS O 1 1 9 8046 1 1 19 ALA C C 4.251 -5.054 4.451 1.00 . A A . 19 ALA C 1 1 9 8047 1 1 19 ALA CA C 5.209 -5.387 3.314 1.00 . A A . 19 ALA CA 1 1 9 8048 1 1 19 ALA CB C 5.479 -4.150 2.470 1.00 . A A . 19 ALA CB 1 1 9 8049 1 1 19 ALA H H 4.124 -6.236 1.706 1.00 . A A . 19 ALA H 1 1 9 8050 1 1 19 ALA HA H 6.147 -5.720 3.732 1.00 . A A . 19 ALA HA 1 1 9 8051 1 1 19 ALA HB1 H 6.504 -4.161 2.132 1.00 . A A . 19 ALA HB1 1 1 9 8052 1 1 19 ALA HB2 H 5.304 -3.265 3.064 1.00 . A A . 19 ALA HB2 1 1 9 8053 1 1 19 ALA HB3 H 4.818 -4.145 1.616 1.00 . A A . 19 ALA HB3 1 1 9 8054 1 1 19 ALA N N 4.682 -6.461 2.479 1.00 . A A . 19 ALA N 1 1 9 8055 1 1 19 ALA O O 4.677 -4.780 5.575 1.00 . A A . 19 ALA O 1 1 9 8056 1 1 20 LEU C C 1.678 -5.987 6.053 1.00 . A A . 20 LEU C 1 1 9 8057 1 1 20 LEU CA C 1.937 -4.779 5.157 1.00 . A A . 20 LEU CA 1 1 9 8058 1 1 20 LEU CB C 0.637 -4.340 4.475 1.00 . A A . 20 LEU CB 1 1 9 8059 1 1 20 LEU CD1 C -0.876 -2.426 3.899 1.00 . A A . 20 LEU CD1 1 1 9 8060 1 1 20 LEU CD2 C -0.565 -3.096 6.289 1.00 . A A . 20 LEU CD2 1 1 9 8061 1 1 20 LEU CG C 0.100 -2.980 4.925 1.00 . A A . 20 LEU CG 1 1 9 8062 1 1 20 LEU H H 2.675 -5.304 3.244 1.00 . A A . 20 LEU H 1 1 9 8063 1 1 20 LEU HA H 2.303 -3.968 5.768 1.00 . A A . 20 LEU HA 1 1 9 8064 1 1 20 LEU HB2 H 0.811 -4.301 3.410 1.00 . A A . 20 LEU HB2 1 1 9 8065 1 1 20 LEU HB3 H -0.120 -5.084 4.673 1.00 . A A . 20 LEU HB3 1 1 9 8066 1 1 20 LEU HD11 H -1.260 -1.477 4.243 1.00 . A A . 20 LEU HD11 1 1 9 8067 1 1 20 LEU HD12 H -1.695 -3.119 3.769 1.00 . A A . 20 LEU HD12 1 1 9 8068 1 1 20 LEU HD13 H -0.368 -2.290 2.955 1.00 . A A . 20 LEU HD13 1 1 9 8069 1 1 20 LEU HD21 H -1.308 -3.880 6.261 1.00 . A A . 20 LEU HD21 1 1 9 8070 1 1 20 LEU HD22 H -1.040 -2.160 6.538 1.00 . A A . 20 LEU HD22 1 1 9 8071 1 1 20 LEU HD23 H 0.180 -3.332 7.034 1.00 . A A . 20 LEU HD23 1 1 9 8072 1 1 20 LEU HG H 0.922 -2.286 5.012 1.00 . A A . 20 LEU HG 1 1 9 8073 1 1 20 LEU N N 2.956 -5.079 4.157 1.00 . A A . 20 LEU N 1 1 9 8074 1 1 20 LEU O O 1.282 -5.841 7.210 1.00 . A A . 20 LEU O 1 1 9 8075 1 1 21 GLY C C 0.352 -9.054 5.965 1.00 . A A . 21 GLY C 1 1 9 8076 1 1 21 GLY CA C 1.683 -8.395 6.277 1.00 . A A . 21 GLY CA 1 1 9 8077 1 1 21 GLY H H 2.213 -7.240 4.584 1.00 . A A . 21 GLY H 1 1 9 8078 1 1 21 GLY HA2 H 2.477 -9.092 6.059 1.00 . A A . 21 GLY HA2 1 1 9 8079 1 1 21 GLY HA3 H 1.712 -8.152 7.331 1.00 . A A . 21 GLY HA3 1 1 9 8080 1 1 21 GLY N N 1.901 -7.181 5.512 1.00 . A A . 21 GLY N 1 1 9 8081 1 1 21 GLY O O 0.107 -10.191 6.369 1.00 . A A . 21 GLY O 1 1 9 8082 1 1 22 ILE C C -1.722 -9.812 3.688 1.00 . A A . 22 ILE C 1 1 9 8083 1 1 22 ILE CA C -1.819 -8.868 4.880 1.00 . A A . 22 ILE CA 1 1 9 8084 1 1 22 ILE CB C -2.805 -7.734 4.538 1.00 . A A . 22 ILE CB 1 1 9 8085 1 1 22 ILE CD1 C -3.218 -5.819 2.911 1.00 . A A . 22 ILE CD1 1 1 9 8086 1 1 22 ILE CG1 C -2.248 -6.868 3.405 1.00 . A A . 22 ILE CG1 1 1 9 8087 1 1 22 ILE CG2 C -3.089 -6.888 5.769 1.00 . A A . 22 ILE CG2 1 1 9 8088 1 1 22 ILE H H -0.260 -7.442 4.951 1.00 . A A . 22 ILE H 1 1 9 8089 1 1 22 ILE HA H -2.209 -9.411 5.728 1.00 . A A . 22 ILE HA 1 1 9 8090 1 1 22 ILE HB H -3.734 -8.179 4.215 1.00 . A A . 22 ILE HB 1 1 9 8091 1 1 22 ILE HD11 H -2.684 -5.074 2.341 1.00 . A A . 22 ILE HD11 1 1 9 8092 1 1 22 ILE HD12 H -3.701 -5.349 3.754 1.00 . A A . 22 ILE HD12 1 1 9 8093 1 1 22 ILE HD13 H -3.962 -6.285 2.283 1.00 . A A . 22 ILE HD13 1 1 9 8094 1 1 22 ILE HG12 H -1.362 -6.359 3.754 1.00 . A A . 22 ILE HG12 1 1 9 8095 1 1 22 ILE HG13 H -1.988 -7.501 2.571 1.00 . A A . 22 ILE HG13 1 1 9 8096 1 1 22 ILE HG21 H -2.881 -7.464 6.658 1.00 . A A . 22 ILE HG21 1 1 9 8097 1 1 22 ILE HG22 H -4.128 -6.590 5.769 1.00 . A A . 22 ILE HG22 1 1 9 8098 1 1 22 ILE HG23 H -2.462 -6.009 5.755 1.00 . A A . 22 ILE HG23 1 1 9 8099 1 1 22 ILE N N -0.510 -8.342 5.245 1.00 . A A . 22 ILE N 1 1 9 8100 1 1 22 ILE O O -0.634 -10.060 3.167 1.00 . A A . 22 ILE O 1 1 9 8101 1 1 23 SER C C -3.236 -10.514 0.839 1.00 . A A . 23 SER C 1 1 9 8102 1 1 23 SER CA C -2.909 -11.255 2.130 1.00 . A A . 23 SER CA 1 1 9 8103 1 1 23 SER CB C -3.945 -12.354 2.378 1.00 . A A . 23 SER CB 1 1 9 8104 1 1 23 SER H H -3.699 -10.101 3.719 1.00 . A A . 23 SER H 1 1 9 8105 1 1 23 SER HA H -1.933 -11.709 2.033 1.00 . A A . 23 SER HA 1 1 9 8106 1 1 23 SER HB2 H -4.828 -11.918 2.821 1.00 . A A . 23 SER HB2 1 1 9 8107 1 1 23 SER HB3 H -4.204 -12.819 1.438 1.00 . A A . 23 SER HB3 1 1 9 8108 1 1 23 SER HG H -3.670 -14.216 2.920 1.00 . A A . 23 SER HG 1 1 9 8109 1 1 23 SER N N -2.865 -10.337 3.262 1.00 . A A . 23 SER N 1 1 9 8110 1 1 23 SER O O -3.700 -9.373 0.867 1.00 . A A . 23 SER O 1 1 9 8111 1 1 23 SER OG O -3.437 -13.345 3.253 1.00 . A A . 23 SER OG 1 1 9 8112 1 1 24 ASP C C -4.739 -10.223 -1.742 1.00 . A A . 24 ASP C 1 1 9 8113 1 1 24 ASP CA C -3.261 -10.568 -1.595 1.00 . A A . 24 ASP CA 1 1 9 8114 1 1 24 ASP CB C -2.832 -11.517 -2.714 1.00 . A A . 24 ASP CB 1 1 9 8115 1 1 24 ASP CG C -3.442 -12.898 -2.567 1.00 . A A . 24 ASP CG 1 1 9 8116 1 1 24 ASP H H -2.622 -12.073 -0.250 1.00 . A A . 24 ASP H 1 1 9 8117 1 1 24 ASP HA H -2.683 -9.658 -1.665 1.00 . A A . 24 ASP HA 1 1 9 8118 1 1 24 ASP HB2 H -3.143 -11.108 -3.664 1.00 . A A . 24 ASP HB2 1 1 9 8119 1 1 24 ASP HB3 H -1.756 -11.615 -2.703 1.00 . A A . 24 ASP HB3 1 1 9 8120 1 1 24 ASP N N -2.992 -11.166 -0.293 1.00 . A A . 24 ASP N 1 1 9 8121 1 1 24 ASP O O -5.099 -9.265 -2.425 1.00 . A A . 24 ASP O 1 1 9 8122 1 1 24 ASP OD1 O -3.165 -13.562 -1.545 1.00 . A A . 24 ASP OD1 1 1 9 8123 1 1 24 ASP OD2 O -4.194 -13.316 -3.472 1.00 . A A . 24 ASP OD2 1 1 9 8124 1 1 25 ALA C C -7.401 -9.422 -0.583 1.00 . A A . 25 ALA C 1 1 9 8125 1 1 25 ALA CA C -7.031 -10.788 -1.154 1.00 . A A . 25 ALA CA 1 1 9 8126 1 1 25 ALA CB C -7.768 -11.890 -0.406 1.00 . A A . 25 ALA CB 1 1 9 8127 1 1 25 ALA H H -5.245 -11.758 -0.565 1.00 . A A . 25 ALA H 1 1 9 8128 1 1 25 ALA HA H -7.333 -10.826 -2.191 1.00 . A A . 25 ALA HA 1 1 9 8129 1 1 25 ALA HB1 H -7.347 -11.998 0.582 1.00 . A A . 25 ALA HB1 1 1 9 8130 1 1 25 ALA HB2 H -7.667 -12.820 -0.946 1.00 . A A . 25 ALA HB2 1 1 9 8131 1 1 25 ALA HB3 H -8.814 -11.634 -0.325 1.00 . A A . 25 ALA HB3 1 1 9 8132 1 1 25 ALA N N -5.593 -11.010 -1.094 1.00 . A A . 25 ALA N 1 1 9 8133 1 1 25 ALA O O -8.162 -8.669 -1.191 1.00 . A A . 25 ALA O 1 1 9 8134 1 1 26 ALA C C -6.699 -6.664 0.363 1.00 . A A . 26 ALA C 1 1 9 8135 1 1 26 ALA CA C -7.130 -7.834 1.242 1.00 . A A . 26 ALA CA 1 1 9 8136 1 1 26 ALA CB C -6.429 -7.772 2.590 1.00 . A A . 26 ALA CB 1 1 9 8137 1 1 26 ALA H H -6.259 -9.751 1.025 1.00 . A A . 26 ALA H 1 1 9 8138 1 1 26 ALA HA H -8.195 -7.769 1.413 1.00 . A A . 26 ALA HA 1 1 9 8139 1 1 26 ALA HB1 H -7.096 -8.126 3.361 1.00 . A A . 26 ALA HB1 1 1 9 8140 1 1 26 ALA HB2 H -6.144 -6.752 2.800 1.00 . A A . 26 ALA HB2 1 1 9 8141 1 1 26 ALA HB3 H -5.545 -8.394 2.566 1.00 . A A . 26 ALA HB3 1 1 9 8142 1 1 26 ALA N N -6.857 -9.108 0.589 1.00 . A A . 26 ALA N 1 1 9 8143 1 1 26 ALA O O -7.383 -5.643 0.293 1.00 . A A . 26 ALA O 1 1 9 8144 1 1 27 VAL C C -5.894 -5.629 -2.431 1.00 . A A . 27 VAL C 1 1 9 8145 1 1 27 VAL CA C -5.037 -5.778 -1.177 1.00 . A A . 27 VAL CA 1 1 9 8146 1 1 27 VAL CB C -3.584 -6.070 -1.595 1.00 . A A . 27 VAL CB 1 1 9 8147 1 1 27 VAL CG1 C -3.023 -4.929 -2.431 1.00 . A A . 27 VAL CG1 1 1 9 8148 1 1 27 VAL CG2 C -2.716 -6.318 -0.370 1.00 . A A . 27 VAL CG2 1 1 9 8149 1 1 27 VAL H H -5.060 -7.657 -0.206 1.00 . A A . 27 VAL H 1 1 9 8150 1 1 27 VAL HA H -5.052 -4.846 -0.630 1.00 . A A . 27 VAL HA 1 1 9 8151 1 1 27 VAL HB H -3.578 -6.965 -2.200 1.00 . A A . 27 VAL HB 1 1 9 8152 1 1 27 VAL HG11 H -3.032 -4.019 -1.848 1.00 . A A . 27 VAL HG11 1 1 9 8153 1 1 27 VAL HG12 H -3.633 -4.797 -3.314 1.00 . A A . 27 VAL HG12 1 1 9 8154 1 1 27 VAL HG13 H -2.011 -5.161 -2.724 1.00 . A A . 27 VAL HG13 1 1 9 8155 1 1 27 VAL HG21 H -3.254 -6.940 0.332 1.00 . A A . 27 VAL HG21 1 1 9 8156 1 1 27 VAL HG22 H -2.474 -5.375 0.096 1.00 . A A . 27 VAL HG22 1 1 9 8157 1 1 27 VAL HG23 H -1.806 -6.817 -0.669 1.00 . A A . 27 VAL HG23 1 1 9 8158 1 1 27 VAL N N -5.560 -6.821 -0.303 1.00 . A A . 27 VAL N 1 1 9 8159 1 1 27 VAL O O -6.216 -4.517 -2.847 1.00 . A A . 27 VAL O 1 1 9 8160 1 1 28 SER C C -8.487 -6.252 -3.935 1.00 . A A . 28 SER C 1 1 9 8161 1 1 28 SER CA C -7.078 -6.753 -4.234 1.00 . A A . 28 SER CA 1 1 9 8162 1 1 28 SER CB C -7.139 -8.155 -4.841 1.00 . A A . 28 SER CB 1 1 9 8163 1 1 28 SER H H -5.971 -7.615 -2.650 1.00 . A A . 28 SER H 1 1 9 8164 1 1 28 SER HA H -6.615 -6.083 -4.945 1.00 . A A . 28 SER HA 1 1 9 8165 1 1 28 SER HB2 H -6.138 -8.500 -5.048 1.00 . A A . 28 SER HB2 1 1 9 8166 1 1 28 SER HB3 H -7.613 -8.826 -4.142 1.00 . A A . 28 SER HB3 1 1 9 8167 1 1 28 SER HG H -8.583 -8.808 -5.993 1.00 . A A . 28 SER HG 1 1 9 8168 1 1 28 SER N N -6.260 -6.758 -3.028 1.00 . A A . 28 SER N 1 1 9 8169 1 1 28 SER O O -9.140 -5.655 -4.791 1.00 . A A . 28 SER O 1 1 9 8170 1 1 28 SER OG O -7.880 -8.156 -6.050 1.00 . A A . 28 SER OG 1 1 9 8171 1 1 29 GLN C C -10.330 -4.578 -2.028 1.00 . A A . 29 GLN C 1 1 9 8172 1 1 29 GLN CA C -10.280 -6.080 -2.303 1.00 . A A . 29 GLN CA 1 1 9 8173 1 1 29 GLN CB C -10.720 -6.851 -1.056 1.00 . A A . 29 GLN CB 1 1 9 8174 1 1 29 GLN CD C -12.570 -7.317 0.601 1.00 . A A . 29 GLN CD 1 1 9 8175 1 1 29 GLN CG C -12.200 -6.693 -0.730 1.00 . A A . 29 GLN CG 1 1 9 8176 1 1 29 GLN H H -8.386 -6.984 -2.078 1.00 . A A . 29 GLN H 1 1 9 8177 1 1 29 GLN HA H -10.960 -6.307 -3.109 1.00 . A A . 29 GLN HA 1 1 9 8178 1 1 29 GLN HB2 H -10.520 -7.901 -1.208 1.00 . A A . 29 GLN HB2 1 1 9 8179 1 1 29 GLN HB3 H -10.150 -6.501 -0.211 1.00 . A A . 29 GLN HB3 1 1 9 8180 1 1 29 GLN HE21 H -13.050 -9.018 -0.304 1.00 . A A . 29 GLN HE21 1 1 9 8181 1 1 29 GLN HE22 H -13.250 -9.000 1.413 1.00 . A A . 29 GLN HE22 1 1 9 8182 1 1 29 GLN HG2 H -12.430 -5.641 -0.695 1.00 . A A . 29 GLN HG2 1 1 9 8183 1 1 29 GLN HG3 H -12.780 -7.168 -1.509 1.00 . A A . 29 GLN HG3 1 1 9 8184 1 1 29 GLN N N -8.953 -6.503 -2.716 1.00 . A A . 29 GLN N 1 1 9 8185 1 1 29 GLN NE2 N -13.000 -8.572 0.566 1.00 . A A . 29 GLN NE2 1 1 9 8186 1 1 29 GLN O O -11.410 -4.001 -1.885 1.00 . A A . 29 GLN O 1 1 9 8187 1 1 29 GLN OE1 O -12.470 -6.679 1.649 1.00 . A A . 29 GLN OE1 1 1 9 8188 1 1 30 TRP C C -9.912 -1.722 -2.707 1.00 . A A . 30 TRP C 1 1 9 8189 1 1 30 TRP CA C -9.087 -2.510 -1.692 1.00 . A A . 30 TRP CA 1 1 9 8190 1 1 30 TRP CB C -7.631 -2.042 -1.730 1.00 . A A . 30 TRP CB 1 1 9 8191 1 1 30 TRP CD1 C -7.365 -2.851 0.690 1.00 . A A . 30 TRP CD1 1 1 9 8192 1 1 30 TRP CD2 C -5.447 -2.259 -0.300 1.00 . A A . 30 TRP CD2 1 1 9 8193 1 1 30 TRP CE2 C -5.161 -2.679 1.013 1.00 . A A . 30 TRP CE2 1 1 9 8194 1 1 30 TRP CE3 C -4.392 -1.838 -1.116 1.00 . A A . 30 TRP CE3 1 1 9 8195 1 1 30 TRP CG C -6.861 -2.376 -0.488 1.00 . A A . 30 TRP CG 1 1 9 8196 1 1 30 TRP CH2 C -2.855 -2.274 0.705 1.00 . A A . 30 TRP CH2 1 1 9 8197 1 1 30 TRP CZ2 C -3.867 -2.691 1.527 1.00 . A A . 30 TRP CZ2 1 1 9 8198 1 1 30 TRP CZ3 C -3.109 -1.851 -0.606 1.00 . A A . 30 TRP CZ3 1 1 9 8199 1 1 30 TRP H H -8.336 -4.452 -2.074 1.00 . A A . 30 TRP H 1 1 9 8200 1 1 30 TRP HA H -9.488 -2.332 -0.706 1.00 . A A . 30 TRP HA 1 1 9 8201 1 1 30 TRP HB2 H -7.133 -2.508 -2.567 1.00 . A A . 30 TRP HB2 1 1 9 8202 1 1 30 TRP HB3 H -7.610 -0.969 -1.858 1.00 . A A . 30 TRP HB3 1 1 9 8203 1 1 30 TRP HD1 H -8.412 -3.048 0.869 1.00 . A A . 30 TRP HD1 1 1 9 8204 1 1 30 TRP HE1 H -6.457 -3.369 2.513 1.00 . A A . 30 TRP HE1 1 1 9 8205 1 1 30 TRP HE3 H -4.567 -1.508 -2.130 1.00 . A A . 30 TRP HE3 1 1 9 8206 1 1 30 TRP HH2 H -1.836 -2.267 1.062 1.00 . A A . 30 TRP HH2 1 1 9 8207 1 1 30 TRP HZ2 H -3.656 -3.016 2.535 1.00 . A A . 30 TRP HZ2 1 1 9 8208 1 1 30 TRP HZ3 H -2.282 -1.528 -1.221 1.00 . A A . 30 TRP HZ3 1 1 9 8209 1 1 30 TRP N N -9.167 -3.945 -1.954 1.00 . A A . 30 TRP N 1 1 9 8210 1 1 30 TRP NE1 N -6.349 -3.035 1.596 1.00 . A A . 30 TRP NE1 1 1 9 8211 1 1 30 TRP O O -10.390 -2.274 -3.696 1.00 . A A . 30 TRP O 1 1 9 8212 1 1 31 LYS C C -10.070 1.739 -3.605 1.00 . A A . 31 LYS C 1 1 9 8213 1 1 31 LYS CA C -10.830 0.442 -3.340 1.00 . A A . 31 LYS CA 1 1 9 8214 1 1 31 LYS CB C -12.200 0.746 -2.730 1.00 . A A . 31 LYS CB 1 1 9 8215 1 1 31 LYS CD C -13.580 -1.293 -3.247 1.00 . A A . 31 LYS CD 1 1 9 8216 1 1 31 LYS CE C -15.080 -1.344 -3.048 1.00 . A A . 31 LYS CE 1 1 9 8217 1 1 31 LYS CG C -12.900 -0.478 -2.159 1.00 . A A . 31 LYS CG 1 1 9 8218 1 1 31 LYS H H -9.660 -0.047 -1.646 1.00 . A A . 31 LYS H 1 1 9 8219 1 1 31 LYS HA H -10.970 -0.079 -4.274 1.00 . A A . 31 LYS HA 1 1 9 8220 1 1 31 LYS HB2 H -12.080 1.467 -1.936 1.00 . A A . 31 LYS HB2 1 1 9 8221 1 1 31 LYS HB3 H -12.830 1.170 -3.493 1.00 . A A . 31 LYS HB3 1 1 9 8222 1 1 31 LYS HD2 H -13.370 -0.845 -4.205 1.00 . A A . 31 LYS HD2 1 1 9 8223 1 1 31 LYS HD3 H -13.190 -2.300 -3.226 1.00 . A A . 31 LYS HD3 1 1 9 8224 1 1 31 LYS HE2 H -15.460 -2.257 -3.483 1.00 . A A . 31 LYS HE2 1 1 9 8225 1 1 31 LYS HE3 H -15.300 -1.339 -1.988 1.00 . A A . 31 LYS HE3 1 1 9 8226 1 1 31 LYS HG2 H -12.160 -1.098 -1.664 1.00 . A A . 31 LYS HG2 1 1 9 8227 1 1 31 LYS HG3 H -13.640 -0.155 -1.443 1.00 . A A . 31 LYS HG3 1 1 9 8228 1 1 31 LYS HZ1 H -15.110 0.610 -3.786 1.00 . A A . 31 LYS HZ1 1 1 9 8229 1 1 31 LYS HZ2 H -16.570 0.121 -3.098 1.00 . A A . 31 LYS HZ2 1 1 9 8230 1 1 31 LYS HZ3 H -16.120 -0.452 -4.624 1.00 . A A . 31 LYS HZ3 1 1 9 8231 1 1 31 LYS N N -10.060 -0.427 -2.451 1.00 . A A . 31 LYS N 1 1 9 8232 1 1 31 LYS NZ N -15.770 -0.186 -3.683 1.00 . A A . 31 LYS NZ 1 1 9 8233 1 1 31 LYS O O -8.873 1.829 -3.358 1.00 . A A . 31 LYS O 1 1 9 8234 1 1 32 GLU C C -9.327 4.534 -3.242 1.00 . A A . 32 GLU C 1 1 9 8235 1 1 32 GLU CA C -10.170 4.040 -4.413 1.00 . A A . 32 GLU CA 1 1 9 8236 1 1 32 GLU CB C -11.250 5.069 -4.750 1.00 . A A . 32 GLU CB 1 1 9 8237 1 1 32 GLU CD C -12.040 6.882 -6.323 1.00 . A A . 32 GLU CD 1 1 9 8238 1 1 32 GLU CG C -10.980 5.834 -6.036 1.00 . A A . 32 GLU CG 1 1 9 8239 1 1 32 GLU H H -11.730 2.616 -4.291 1.00 . A A . 32 GLU H 1 1 9 8240 1 1 32 GLU HA H -9.535 3.912 -5.274 1.00 . A A . 32 GLU HA 1 1 9 8241 1 1 32 GLU HB2 H -12.200 4.559 -4.851 1.00 . A A . 32 GLU HB2 1 1 9 8242 1 1 32 GLU HB3 H -11.320 5.782 -3.941 1.00 . A A . 32 GLU HB3 1 1 9 8243 1 1 32 GLU HG2 H -10.020 6.325 -5.954 1.00 . A A . 32 GLU HG2 1 1 9 8244 1 1 32 GLU HG3 H -10.960 5.133 -6.856 1.00 . A A . 32 GLU HG3 1 1 9 8245 1 1 32 GLU N N -10.780 2.745 -4.113 1.00 . A A . 32 GLU N 1 1 9 8246 1 1 32 GLU O O -8.352 5.259 -3.433 1.00 . A A . 32 GLU O 1 1 9 8247 1 1 32 GLU OE1 O -13.230 6.514 -6.426 1.00 . A A . 32 GLU OE1 1 1 9 8248 1 1 32 GLU OE2 O -11.680 8.071 -6.446 1.00 . A A . 32 GLU OE2 1 1 9 8249 1 1 33 VAL C C -8.764 3.342 0.096 1.00 . A A . 33 VAL C 1 1 9 8250 1 1 33 VAL CA C -8.979 4.530 -0.834 1.00 . A A . 33 VAL CA 1 1 9 8251 1 1 33 VAL CB C -9.722 5.641 -0.064 1.00 . A A . 33 VAL CB 1 1 9 8252 1 1 33 VAL CG1 C -8.873 6.151 1.092 1.00 . A A . 33 VAL CG1 1 1 9 8253 1 1 33 VAL CG2 C -10.090 6.778 -1.001 1.00 . A A . 33 VAL CG2 1 1 9 8254 1 1 33 VAL H H -10.490 3.554 -1.944 1.00 . A A . 33 VAL H 1 1 9 8255 1 1 33 VAL HA H -8.017 4.915 -1.139 1.00 . A A . 33 VAL HA 1 1 9 8256 1 1 33 VAL HB H -10.630 5.223 0.343 1.00 . A A . 33 VAL HB 1 1 9 8257 1 1 33 VAL HG11 H -7.828 5.988 0.872 1.00 . A A . 33 VAL HG11 1 1 9 8258 1 1 33 VAL HG12 H -9.138 5.620 1.994 1.00 . A A . 33 VAL HG12 1 1 9 8259 1 1 33 VAL HG13 H -9.051 7.207 1.231 1.00 . A A . 33 VAL HG13 1 1 9 8260 1 1 33 VAL HG21 H -9.396 6.818 -1.820 1.00 . A A . 33 VAL HG21 1 1 9 8261 1 1 33 VAL HG22 H -10.070 7.713 -0.460 1.00 . A A . 33 VAL HG22 1 1 9 8262 1 1 33 VAL HG23 H -11.090 6.612 -1.388 1.00 . A A . 33 VAL HG23 1 1 9 8263 1 1 33 VAL N N -9.706 4.133 -2.033 1.00 . A A . 33 VAL N 1 1 9 8264 1 1 33 VAL O O -9.715 2.808 0.669 1.00 . A A . 33 VAL O 1 1 9 8265 1 1 34 ILE C C -7.659 2.034 2.529 1.00 . A A . 34 ILE C 1 1 9 8266 1 1 34 ILE CA C -7.162 1.808 1.105 1.00 . A A . 34 ILE CA 1 1 9 8267 1 1 34 ILE CB C -5.638 1.581 1.149 1.00 . A A . 34 ILE CB 1 1 9 8268 1 1 34 ILE CD1 C -3.475 2.757 1.789 1.00 . A A . 34 ILE CD1 1 1 9 8269 1 1 34 ILE CG1 C -4.908 2.912 1.331 1.00 . A A . 34 ILE CG1 1 1 9 8270 1 1 34 ILE CG2 C -5.167 0.881 -0.115 1.00 . A A . 34 ILE CG2 1 1 9 8271 1 1 34 ILE H H -6.794 3.402 -0.239 1.00 . A A . 34 ILE H 1 1 9 8272 1 1 34 ILE HA H -7.629 0.920 0.705 1.00 . A A . 34 ILE HA 1 1 9 8273 1 1 34 ILE HB H -5.417 0.940 1.989 1.00 . A A . 34 ILE HB 1 1 9 8274 1 1 34 ILE HD11 H -2.856 2.485 0.947 1.00 . A A . 34 ILE HD11 1 1 9 8275 1 1 34 ILE HD12 H -3.422 1.984 2.541 1.00 . A A . 34 ILE HD12 1 1 9 8276 1 1 34 ILE HD13 H -3.127 3.690 2.206 1.00 . A A . 34 ILE HD13 1 1 9 8277 1 1 34 ILE HG12 H -4.899 3.443 0.390 1.00 . A A . 34 ILE HG12 1 1 9 8278 1 1 34 ILE HG13 H -5.432 3.505 2.068 1.00 . A A . 34 ILE HG13 1 1 9 8279 1 1 34 ILE HG21 H -5.926 0.189 -0.449 1.00 . A A . 34 ILE HG21 1 1 9 8280 1 1 34 ILE HG22 H -4.254 0.342 0.094 1.00 . A A . 34 ILE HG22 1 1 9 8281 1 1 34 ILE HG23 H -4.984 1.615 -0.885 1.00 . A A . 34 ILE HG23 1 1 9 8282 1 1 34 ILE N N -7.508 2.933 0.243 1.00 . A A . 34 ILE N 1 1 9 8283 1 1 34 ILE O O -7.802 3.173 2.969 1.00 . A A . 34 ILE O 1 1 9 8284 1 1 35 PRO C C -7.558 1.983 5.497 1.00 . A A . 35 PRO C 1 1 9 8285 1 1 35 PRO CA C -8.411 1.036 4.654 1.00 . A A . 35 PRO CA 1 1 9 8286 1 1 35 PRO CB C -8.313 -0.403 5.185 1.00 . A A . 35 PRO CB 1 1 9 8287 1 1 35 PRO CD C -7.798 -0.446 2.831 1.00 . A A . 35 PRO CD 1 1 9 8288 1 1 35 PRO CG C -7.631 -1.201 4.119 1.00 . A A . 35 PRO CG 1 1 9 8289 1 1 35 PRO HA H -9.440 1.364 4.688 1.00 . A A . 35 PRO HA 1 1 9 8290 1 1 35 PRO HB2 H -7.743 -0.410 6.101 1.00 . A A . 35 PRO HB2 1 1 9 8291 1 1 35 PRO HB3 H -9.308 -0.780 5.379 1.00 . A A . 35 PRO HB3 1 1 9 8292 1 1 35 PRO HD2 H -6.926 -0.570 2.206 1.00 . A A . 35 PRO HD2 1 1 9 8293 1 1 35 PRO HD3 H -8.686 -0.773 2.313 1.00 . A A . 35 PRO HD3 1 1 9 8294 1 1 35 PRO HG2 H -6.586 -1.305 4.355 1.00 . A A . 35 PRO HG2 1 1 9 8295 1 1 35 PRO HG3 H -8.094 -2.174 4.041 1.00 . A A . 35 PRO HG3 1 1 9 8296 1 1 35 PRO N N -7.931 0.945 3.275 1.00 . A A . 35 PRO N 1 1 9 8297 1 1 35 PRO O O -6.596 2.573 5.006 1.00 . A A . 35 PRO O 1 1 9 8298 1 1 36 GLU C C -5.892 2.413 8.149 1.00 . A A . 36 GLU C 1 1 9 8299 1 1 36 GLU CA C -7.208 3.024 7.670 1.00 . A A . 36 GLU CA 1 1 9 8300 1 1 36 GLU CB C -8.089 3.364 8.874 1.00 . A A . 36 GLU CB 1 1 9 8301 1 1 36 GLU CD C -7.862 4.071 11.288 1.00 . A A . 36 GLU CD 1 1 9 8302 1 1 36 GLU CG C -7.440 4.327 9.855 1.00 . A A . 36 GLU CG 1 1 9 8303 1 1 36 GLU H H -8.708 1.646 7.096 1.00 . A A . 36 GLU H 1 1 9 8304 1 1 36 GLU HA H -6.990 3.935 7.134 1.00 . A A . 36 GLU HA 1 1 9 8305 1 1 36 GLU HB2 H -9.006 3.810 8.520 1.00 . A A . 36 GLU HB2 1 1 9 8306 1 1 36 GLU HB3 H -8.324 2.451 9.401 1.00 . A A . 36 GLU HB3 1 1 9 8307 1 1 36 GLU HG2 H -6.368 4.222 9.788 1.00 . A A . 36 GLU HG2 1 1 9 8308 1 1 36 GLU HG3 H -7.719 5.336 9.587 1.00 . A A . 36 GLU HG3 1 1 9 8309 1 1 36 GLU N N -7.926 2.135 6.763 1.00 . A A . 36 GLU N 1 1 9 8310 1 1 36 GLU O O -4.814 2.925 7.851 1.00 . A A . 36 GLU O 1 1 9 8311 1 1 36 GLU OE1 O -7.526 2.994 11.823 1.00 . A A . 36 GLU OE1 1 1 9 8312 1 1 36 GLU OE2 O -8.529 4.948 11.877 1.00 . A A . 36 GLU OE2 1 1 9 8313 1 1 37 LYS C C -3.802 0.292 8.378 1.00 . A A . 37 LYS C 1 1 9 8314 1 1 37 LYS CA C -4.811 0.663 9.460 1.00 . A A . 37 LYS CA 1 1 9 8315 1 1 37 LYS CB C -5.221 -0.586 10.241 1.00 . A A . 37 LYS CB 1 1 9 8316 1 1 37 LYS CD C -7.013 -2.345 10.346 1.00 . A A . 37 LYS CD 1 1 9 8317 1 1 37 LYS CE C -7.750 -3.427 9.573 1.00 . A A . 37 LYS CE 1 1 9 8318 1 1 37 LYS CG C -6.088 -1.545 9.442 1.00 . A A . 37 LYS CG 1 1 9 8319 1 1 37 LYS H H -6.880 0.979 9.129 1.00 . A A . 37 LYS H 1 1 9 8320 1 1 37 LYS HA H -4.335 1.355 10.138 1.00 . A A . 37 LYS HA 1 1 9 8321 1 1 37 LYS HB2 H -4.330 -1.112 10.549 1.00 . A A . 37 LYS HB2 1 1 9 8322 1 1 37 LYS HB3 H -5.772 -0.282 11.119 1.00 . A A . 37 LYS HB3 1 1 9 8323 1 1 37 LYS HD2 H -6.427 -2.809 11.124 1.00 . A A . 37 LYS HD2 1 1 9 8324 1 1 37 LYS HD3 H -7.736 -1.674 10.788 1.00 . A A . 37 LYS HD3 1 1 9 8325 1 1 37 LYS HE2 H -7.178 -3.674 8.692 1.00 . A A . 37 LYS HE2 1 1 9 8326 1 1 37 LYS HE3 H -7.841 -4.300 10.201 1.00 . A A . 37 LYS HE3 1 1 9 8327 1 1 37 LYS HG2 H -6.686 -0.978 8.745 1.00 . A A . 37 LYS HG2 1 1 9 8328 1 1 37 LYS HG3 H -5.450 -2.227 8.900 1.00 . A A . 37 LYS HG3 1 1 9 8329 1 1 37 LYS HZ1 H -9.818 -3.316 9.842 1.00 . A A . 37 LYS HZ1 1 1 9 8330 1 1 37 LYS HZ2 H -9.343 -3.371 8.221 1.00 . A A . 37 LYS HZ2 1 1 9 8331 1 1 37 LYS HZ3 H -9.148 -1.946 9.110 1.00 . A A . 37 LYS HZ3 1 1 9 8332 1 1 37 LYS N N -5.991 1.331 8.912 1.00 . A A . 37 LYS N 1 1 9 8333 1 1 37 LYS NZ N -9.110 -2.984 9.157 1.00 . A A . 37 LYS NZ 1 1 9 8334 1 1 37 LYS O O -2.613 0.151 8.659 1.00 . A A . 37 LYS O 1 1 9 8335 1 1 38 ASP C C -2.633 1.021 5.561 1.00 . A A . 38 ASP C 1 1 9 8336 1 1 38 ASP CA C -3.375 -0.214 6.050 1.00 . A A . 38 ASP CA 1 1 9 8337 1 1 38 ASP CB C -4.155 -0.850 4.901 1.00 . A A . 38 ASP CB 1 1 9 8338 1 1 38 ASP CG C -4.505 -2.301 5.171 1.00 . A A . 38 ASP CG 1 1 9 8339 1 1 38 ASP H H -5.223 0.263 6.970 1.00 . A A . 38 ASP H 1 1 9 8340 1 1 38 ASP HA H -2.654 -0.926 6.426 1.00 . A A . 38 ASP HA 1 1 9 8341 1 1 38 ASP HB2 H -5.070 -0.298 4.749 1.00 . A A . 38 ASP HB2 1 1 9 8342 1 1 38 ASP HB3 H -3.559 -0.804 4.001 1.00 . A A . 38 ASP HB3 1 1 9 8343 1 1 38 ASP N N -4.268 0.137 7.147 1.00 . A A . 38 ASP N 1 1 9 8344 1 1 38 ASP O O -1.409 1.013 5.429 1.00 . A A . 38 ASP O 1 1 9 8345 1 1 38 ASP OD1 O -4.217 -2.785 6.286 1.00 . A A . 38 ASP OD1 1 1 9 8346 1 1 38 ASP OD2 O -5.070 -2.953 4.268 1.00 . A A . 38 ASP OD2 1 1 9 8347 1 1 39 ALA C C -1.791 3.870 5.867 1.00 . A A . 39 ALA C 1 1 9 8348 1 1 39 ALA CA C -2.791 3.336 4.847 1.00 . A A . 39 ALA CA 1 1 9 8349 1 1 39 ALA CB C -3.878 4.366 4.578 1.00 . A A . 39 ALA CB 1 1 9 8350 1 1 39 ALA H H -4.350 2.037 5.437 1.00 . A A . 39 ALA H 1 1 9 8351 1 1 39 ALA HA H -2.276 3.141 3.919 1.00 . A A . 39 ALA HA 1 1 9 8352 1 1 39 ALA HB1 H -4.420 4.092 3.686 1.00 . A A . 39 ALA HB1 1 1 9 8353 1 1 39 ALA HB2 H -3.427 5.338 4.442 1.00 . A A . 39 ALA HB2 1 1 9 8354 1 1 39 ALA HB3 H -4.558 4.399 5.417 1.00 . A A . 39 ALA HB3 1 1 9 8355 1 1 39 ALA N N -3.381 2.088 5.306 1.00 . A A . 39 ALA N 1 1 9 8356 1 1 39 ALA O O -0.859 4.593 5.515 1.00 . A A . 39 ALA O 1 1 9 8357 1 1 40 TYR C C 0.240 3.217 8.132 1.00 . A A . 40 TYR C 1 1 9 8358 1 1 40 TYR CA C -1.095 3.955 8.197 1.00 . A A . 40 TYR CA 1 1 9 8359 1 1 40 TYR CB C -1.748 3.737 9.563 1.00 . A A . 40 TYR CB 1 1 9 8360 1 1 40 TYR CD1 C -0.698 5.487 11.049 1.00 . A A . 40 TYR CD1 1 1 9 8361 1 1 40 TYR CD2 C -0.213 3.195 11.491 1.00 . A A . 40 TYR CD2 1 1 9 8362 1 1 40 TYR CE1 C 0.106 5.865 12.107 1.00 . A A . 40 TYR CE1 1 1 9 8363 1 1 40 TYR CE2 C 0.592 3.565 12.550 1.00 . A A . 40 TYR CE2 1 1 9 8364 1 1 40 TYR CG C -0.870 4.147 10.724 1.00 . A A . 40 TYR CG 1 1 9 8365 1 1 40 TYR CZ C 0.748 4.901 12.856 1.00 . A A . 40 TYR CZ 1 1 9 8366 1 1 40 TYR H H -2.748 2.928 7.361 1.00 . A A . 40 TYR H 1 1 9 8367 1 1 40 TYR HA H -0.916 5.011 8.058 1.00 . A A . 40 TYR HA 1 1 9 8368 1 1 40 TYR HB2 H -2.660 4.318 9.616 1.00 . A A . 40 TYR HB2 1 1 9 8369 1 1 40 TYR HB3 H -1.985 2.688 9.679 1.00 . A A . 40 TYR HB3 1 1 9 8370 1 1 40 TYR HD1 H -1.204 6.239 10.462 1.00 . A A . 40 TYR HD1 1 1 9 8371 1 1 40 TYR HD2 H -0.336 2.149 11.247 1.00 . A A . 40 TYR HD2 1 1 9 8372 1 1 40 TYR HE1 H 0.227 6.911 12.344 1.00 . A A . 40 TYR HE1 1 1 9 8373 1 1 40 TYR HE2 H 1.096 2.809 13.136 1.00 . A A . 40 TYR HE2 1 1 9 8374 1 1 40 TYR HH H 2.360 4.762 13.893 1.00 . A A . 40 TYR HH 1 1 9 8375 1 1 40 TYR N N -1.987 3.509 7.134 1.00 . A A . 40 TYR N 1 1 9 8376 1 1 40 TYR O O 1.299 3.836 8.034 1.00 . A A . 40 TYR O 1 1 9 8377 1 1 40 TYR OH O 1.549 5.274 13.910 1.00 . A A . 40 TYR OH 1 1 9 8378 1 1 41 ARG C C 2.098 1.216 6.805 1.00 . A A . 41 ARG C 1 1 9 8379 1 1 41 ARG CA C 1.384 1.067 8.146 1.00 . A A . 41 ARG CA 1 1 9 8380 1 1 41 ARG CB C 1.032 -0.402 8.387 1.00 . A A . 41 ARG CB 1 1 9 8381 1 1 41 ARG CD C 0.517 -2.220 10.046 1.00 . A A . 41 ARG CD 1 1 9 8382 1 1 41 ARG CG C 0.797 -0.738 9.851 1.00 . A A . 41 ARG CG 1 1 9 8383 1 1 41 ARG CZ C 1.646 -2.809 12.157 1.00 . A A . 41 ARG CZ 1 1 9 8384 1 1 41 ARG H H -0.694 1.454 8.276 1.00 . A A . 41 ARG H 1 1 9 8385 1 1 41 ARG HA H 2.046 1.402 8.930 1.00 . A A . 41 ARG HA 1 1 9 8386 1 1 41 ARG HB2 H 0.134 -0.640 7.836 1.00 . A A . 41 ARG HB2 1 1 9 8387 1 1 41 ARG HB3 H 1.841 -1.018 8.023 1.00 . A A . 41 ARG HB3 1 1 9 8388 1 1 41 ARG HD2 H -0.426 -2.332 10.560 1.00 . A A . 41 ARG HD2 1 1 9 8389 1 1 41 ARG HD3 H 0.456 -2.695 9.078 1.00 . A A . 41 ARG HD3 1 1 9 8390 1 1 41 ARG HE H 2.236 -3.393 10.341 1.00 . A A . 41 ARG HE 1 1 9 8391 1 1 41 ARG HG2 H 1.677 -0.471 10.417 1.00 . A A . 41 ARG HG2 1 1 9 8392 1 1 41 ARG HG3 H -0.049 -0.171 10.209 1.00 . A A . 41 ARG HG3 1 1 9 8393 1 1 41 ARG HH11 H 0.010 -1.640 12.379 1.00 . A A . 41 ARG HH11 1 1 9 8394 1 1 41 ARG HH12 H 0.821 -2.070 13.848 1.00 . A A . 41 ARG HH12 1 1 9 8395 1 1 41 ARG HH21 H 3.303 -3.961 12.273 1.00 . A A . 41 ARG HH21 1 1 9 8396 1 1 41 ARG HH22 H 2.690 -3.387 13.787 1.00 . A A . 41 ARG HH22 1 1 9 8397 1 1 41 ARG N N 0.181 1.890 8.194 1.00 . A A . 41 ARG N 1 1 9 8398 1 1 41 ARG NE N 1.562 -2.876 10.831 1.00 . A A . 41 ARG NE 1 1 9 8399 1 1 41 ARG NH1 N 0.752 -2.116 12.852 1.00 . A A . 41 ARG NH1 1 1 9 8400 1 1 41 ARG NH2 N 2.627 -3.437 12.791 1.00 . A A . 41 ARG NH2 1 1 9 8401 1 1 41 ARG O O 3.319 1.083 6.723 1.00 . A A . 41 ARG O 1 1 9 8402 1 1 42 LEU C C 2.933 2.764 4.392 1.00 . A A . 42 LEU C 1 1 9 8403 1 1 42 LEU CA C 1.888 1.653 4.418 1.00 . A A . 42 LEU CA 1 1 9 8404 1 1 42 LEU CB C 0.776 1.955 3.411 1.00 . A A . 42 LEU CB 1 1 9 8405 1 1 42 LEU CD1 C -1.004 1.085 1.876 1.00 . A A . 42 LEU CD1 1 1 9 8406 1 1 42 LEU CD2 C 1.347 0.257 1.658 1.00 . A A . 42 LEU CD2 1 1 9 8407 1 1 42 LEU CG C 0.274 0.743 2.623 1.00 . A A . 42 LEU CG 1 1 9 8408 1 1 42 LEU H H 0.361 1.581 5.883 1.00 . A A . 42 LEU H 1 1 9 8409 1 1 42 LEU HA H 2.365 0.724 4.144 1.00 . A A . 42 LEU HA 1 1 9 8410 1 1 42 LEU HB2 H -0.061 2.380 3.947 1.00 . A A . 42 LEU HB2 1 1 9 8411 1 1 42 LEU HB3 H 1.141 2.687 2.708 1.00 . A A . 42 LEU HB3 1 1 9 8412 1 1 42 LEU HD11 H -1.011 0.577 0.921 1.00 . A A . 42 LEU HD11 1 1 9 8413 1 1 42 LEU HD12 H -1.054 2.151 1.716 1.00 . A A . 42 LEU HD12 1 1 9 8414 1 1 42 LEU HD13 H -1.857 0.767 2.458 1.00 . A A . 42 LEU HD13 1 1 9 8415 1 1 42 LEU HD21 H 1.921 1.101 1.304 1.00 . A A . 42 LEU HD21 1 1 9 8416 1 1 42 LEU HD22 H 0.878 -0.236 0.820 1.00 . A A . 42 LEU HD22 1 1 9 8417 1 1 42 LEU HD23 H 1.999 -0.436 2.166 1.00 . A A . 42 LEU HD23 1 1 9 8418 1 1 42 LEU HG H 0.054 -0.060 3.311 1.00 . A A . 42 LEU HG 1 1 9 8419 1 1 42 LEU N N 1.328 1.490 5.756 1.00 . A A . 42 LEU N 1 1 9 8420 1 1 42 LEU O O 3.952 2.657 3.711 1.00 . A A . 42 LEU O 1 1 9 8421 1 1 43 GLU C C 4.933 4.560 5.804 1.00 . A A . 43 GLU C 1 1 9 8422 1 1 43 GLU CA C 3.589 4.966 5.201 1.00 . A A . 43 GLU CA 1 1 9 8423 1 1 43 GLU CB C 2.972 6.100 6.023 1.00 . A A . 43 GLU CB 1 1 9 8424 1 1 43 GLU CD C 3.000 8.563 6.581 1.00 . A A . 43 GLU CD 1 1 9 8425 1 1 43 GLU CG C 3.731 7.413 5.917 1.00 . A A . 43 GLU CG 1 1 9 8426 1 1 43 GLU H H 1.842 3.861 5.658 1.00 . A A . 43 GLU H 1 1 9 8427 1 1 43 GLU HA H 3.753 5.314 4.192 1.00 . A A . 43 GLU HA 1 1 9 8428 1 1 43 GLU HB2 H 1.961 6.266 5.683 1.00 . A A . 43 GLU HB2 1 1 9 8429 1 1 43 GLU HB3 H 2.949 5.806 7.062 1.00 . A A . 43 GLU HB3 1 1 9 8430 1 1 43 GLU HG2 H 4.694 7.297 6.392 1.00 . A A . 43 GLU HG2 1 1 9 8431 1 1 43 GLU HG3 H 3.871 7.650 4.872 1.00 . A A . 43 GLU HG3 1 1 9 8432 1 1 43 GLU N N 2.672 3.833 5.138 1.00 . A A . 43 GLU N 1 1 9 8433 1 1 43 GLU O O 5.926 5.273 5.659 1.00 . A A . 43 GLU O 1 1 9 8434 1 1 43 GLU OE1 O 2.525 8.385 7.723 1.00 . A A . 43 GLU OE1 1 1 9 8435 1 1 43 GLU OE2 O 2.902 9.642 5.960 1.00 . A A . 43 GLU OE2 1 1 9 8436 1 1 44 ILE C C 6.968 2.021 6.166 1.00 . A A . 44 ILE C 1 1 9 8437 1 1 44 ILE CA C 6.184 2.930 7.108 1.00 . A A . 44 ILE CA 1 1 9 8438 1 1 44 ILE CB C 5.881 2.165 8.410 1.00 . A A . 44 ILE CB 1 1 9 8439 1 1 44 ILE CD1 C 5.113 2.743 10.781 1.00 . A A . 44 ILE CD1 1 1 9 8440 1 1 44 ILE CG1 C 4.947 2.997 9.299 1.00 . A A . 44 ILE CG1 1 1 9 8441 1 1 44 ILE CG2 C 7.180 1.825 9.132 1.00 . A A . 44 ILE CG2 1 1 9 8442 1 1 44 ILE H H 4.138 2.891 6.571 1.00 . A A . 44 ILE H 1 1 9 8443 1 1 44 ILE HA H 6.794 3.787 7.358 1.00 . A A . 44 ILE HA 1 1 9 8444 1 1 44 ILE HB H 5.390 1.239 8.149 1.00 . A A . 44 ILE HB 1 1 9 8445 1 1 44 ILE HD11 H 4.382 3.317 11.329 1.00 . A A . 44 ILE HD11 1 1 9 8446 1 1 44 ILE HD12 H 6.106 3.039 11.085 1.00 . A A . 44 ILE HD12 1 1 9 8447 1 1 44 ILE HD13 H 4.973 1.692 10.984 1.00 . A A . 44 ILE HD13 1 1 9 8448 1 1 44 ILE HG12 H 5.135 4.045 9.122 1.00 . A A . 44 ILE HG12 1 1 9 8449 1 1 44 ILE HG13 H 3.923 2.773 9.037 1.00 . A A . 44 ILE HG13 1 1 9 8450 1 1 44 ILE HG21 H 7.910 1.478 8.416 1.00 . A A . 44 ILE HG21 1 1 9 8451 1 1 44 ILE HG22 H 6.993 1.051 9.861 1.00 . A A . 44 ILE HG22 1 1 9 8452 1 1 44 ILE HG23 H 7.555 2.707 9.631 1.00 . A A . 44 ILE HG23 1 1 9 8453 1 1 44 ILE N N 4.960 3.417 6.484 1.00 . A A . 44 ILE N 1 1 9 8454 1 1 44 ILE O O 8.171 2.200 5.974 1.00 . A A . 44 ILE O 1 1 9 8455 1 1 45 VAL C C 7.491 0.822 3.451 1.00 . A A . 45 VAL C 1 1 9 8456 1 1 45 VAL CA C 6.914 0.104 4.665 1.00 . A A . 45 VAL CA 1 1 9 8457 1 1 45 VAL CB C 5.926 -0.975 4.179 1.00 . A A . 45 VAL CB 1 1 9 8458 1 1 45 VAL CG1 C 5.770 -2.066 5.227 1.00 . A A . 45 VAL CG1 1 1 9 8459 1 1 45 VAL CG2 C 4.579 -0.360 3.832 1.00 . A A . 45 VAL CG2 1 1 9 8460 1 1 45 VAL H H 5.325 0.953 5.780 1.00 . A A . 45 VAL H 1 1 9 8461 1 1 45 VAL HA H 7.718 -0.386 5.195 1.00 . A A . 45 VAL HA 1 1 9 8462 1 1 45 VAL HB H 6.332 -1.423 3.285 1.00 . A A . 45 VAL HB 1 1 9 8463 1 1 45 VAL HG11 H 6.607 -2.747 5.167 1.00 . A A . 45 VAL HG11 1 1 9 8464 1 1 45 VAL HG12 H 4.852 -2.607 5.049 1.00 . A A . 45 VAL HG12 1 1 9 8465 1 1 45 VAL HG13 H 5.740 -1.620 6.210 1.00 . A A . 45 VAL HG13 1 1 9 8466 1 1 45 VAL HG21 H 4.004 -1.063 3.247 1.00 . A A . 45 VAL HG21 1 1 9 8467 1 1 45 VAL HG22 H 4.732 0.543 3.263 1.00 . A A . 45 VAL HG22 1 1 9 8468 1 1 45 VAL HG23 H 4.046 -0.128 4.742 1.00 . A A . 45 VAL HG23 1 1 9 8469 1 1 45 VAL N N 6.280 1.044 5.585 1.00 . A A . 45 VAL N 1 1 9 8470 1 1 45 VAL O O 8.557 0.460 2.950 1.00 . A A . 45 VAL O 1 1 9 8471 1 1 46 THR C C 8.275 3.643 2.203 1.00 . A A . 46 THR C 1 1 9 8472 1 1 46 THR CA C 7.211 2.610 1.827 1.00 . A A . 46 THR CA 1 1 9 8473 1 1 46 THR CB C 6.007 3.307 1.198 1.00 . A A . 46 THR CB 1 1 9 8474 1 1 46 THR CG2 C 4.948 2.345 0.705 1.00 . A A . 46 THR CG2 1 1 9 8475 1 1 46 THR H H 5.940 2.077 3.419 1.00 . A A . 46 THR H 1 1 9 8476 1 1 46 THR HA H 7.631 1.924 1.108 1.00 . A A . 46 THR HA 1 1 9 8477 1 1 46 THR HB H 6.343 3.887 0.358 1.00 . A A . 46 THR HB 1 1 9 8478 1 1 46 THR HG1 H 4.958 3.675 2.813 1.00 . A A . 46 THR HG1 1 1 9 8479 1 1 46 THR HG21 H 4.935 2.346 -0.374 1.00 . A A . 46 THR HG21 1 1 9 8480 1 1 46 THR HG22 H 3.981 2.653 1.078 1.00 . A A . 46 THR HG22 1 1 9 8481 1 1 46 THR HG23 H 5.171 1.350 1.061 1.00 . A A . 46 THR HG23 1 1 9 8482 1 1 46 THR N N 6.779 1.839 2.981 1.00 . A A . 46 THR N 1 1 9 8483 1 1 46 THR O O 8.695 4.442 1.365 1.00 . A A . 46 THR O 1 1 9 8484 1 1 46 THR OG1 O 5.394 4.185 2.126 1.00 . A A . 46 THR OG1 1 1 9 8485 1 1 47 ALA C C 9.179 5.992 3.941 1.00 . A A . 47 ALA C 1 1 9 8486 1 1 47 ALA CA C 9.721 4.568 3.934 1.00 . A A . 47 ALA CA 1 1 9 8487 1 1 47 ALA CB C 10.971 4.479 3.073 1.00 . A A . 47 ALA CB 1 1 9 8488 1 1 47 ALA H H 8.342 2.974 4.091 1.00 . A A . 47 ALA H 1 1 9 8489 1 1 47 ALA HA H 9.987 4.290 4.944 1.00 . A A . 47 ALA HA 1 1 9 8490 1 1 47 ALA HB1 H 10.976 3.540 2.539 1.00 . A A . 47 ALA HB1 1 1 9 8491 1 1 47 ALA HB2 H 11.847 4.539 3.702 1.00 . A A . 47 ALA HB2 1 1 9 8492 1 1 47 ALA HB3 H 10.981 5.296 2.365 1.00 . A A . 47 ALA HB3 1 1 9 8493 1 1 47 ALA N N 8.708 3.629 3.464 1.00 . A A . 47 ALA N 1 1 9 8494 1 1 47 ALA O O 9.920 6.950 3.725 1.00 . A A . 47 ALA O 1 1 9 8495 1 1 48 GLY C C 6.985 7.980 2.834 1.00 . A A . 48 GLY C 1 1 9 8496 1 1 48 GLY CA C 7.258 7.434 4.222 1.00 . A A . 48 GLY CA 1 1 9 8497 1 1 48 GLY H H 7.339 5.321 4.356 1.00 . A A . 48 GLY H 1 1 9 8498 1 1 48 GLY HA2 H 6.325 7.363 4.759 1.00 . A A . 48 GLY HA2 1 1 9 8499 1 1 48 GLY HA3 H 7.912 8.116 4.743 1.00 . A A . 48 GLY HA3 1 1 9 8500 1 1 48 GLY N N 7.880 6.122 4.191 1.00 . A A . 48 GLY N 1 1 9 8501 1 1 48 GLY O O 6.899 9.192 2.644 1.00 . A A . 48 GLY O 1 1 9 8502 1 1 49 ALA C C 5.274 8.268 0.388 1.00 . A A . 49 ALA C 1 1 9 8503 1 1 49 ALA CA C 6.579 7.485 0.486 1.00 . A A . 49 ALA CA 1 1 9 8504 1 1 49 ALA CB C 6.535 6.264 -0.420 1.00 . A A . 49 ALA CB 1 1 9 8505 1 1 49 ALA H H 6.923 6.131 2.075 1.00 . A A . 49 ALA H 1 1 9 8506 1 1 49 ALA HA H 7.391 8.118 0.159 1.00 . A A . 49 ALA HA 1 1 9 8507 1 1 49 ALA HB1 H 7.310 5.572 -0.129 1.00 . A A . 49 ALA HB1 1 1 9 8508 1 1 49 ALA HB2 H 6.691 6.570 -1.445 1.00 . A A . 49 ALA HB2 1 1 9 8509 1 1 49 ALA HB3 H 5.571 5.784 -0.331 1.00 . A A . 49 ALA HB3 1 1 9 8510 1 1 49 ALA N N 6.845 7.083 1.862 1.00 . A A . 49 ALA N 1 1 9 8511 1 1 49 ALA O O 5.247 9.389 -0.119 1.00 . A A . 49 ALA O 1 1 9 8512 1 1 50 LEU C C 2.653 9.122 2.125 1.00 . A A . 50 LEU C 1 1 9 8513 1 1 50 LEU CA C 2.886 8.312 0.854 1.00 . A A . 50 LEU CA 1 1 9 8514 1 1 50 LEU CB C 1.784 7.261 0.694 1.00 . A A . 50 LEU CB 1 1 9 8515 1 1 50 LEU CD1 C 1.374 5.012 -0.336 1.00 . A A . 50 LEU CD1 1 1 9 8516 1 1 50 LEU CD2 C 1.062 7.085 -1.700 1.00 . A A . 50 LEU CD2 1 1 9 8517 1 1 50 LEU CG C 1.865 6.430 -0.587 1.00 . A A . 50 LEU CG 1 1 9 8518 1 1 50 LEU H H 4.281 6.776 1.275 1.00 . A A . 50 LEU H 1 1 9 8519 1 1 50 LEU HA H 2.861 8.978 0.005 1.00 . A A . 50 LEU HA 1 1 9 8520 1 1 50 LEU HB2 H 1.830 6.590 1.539 1.00 . A A . 50 LEU HB2 1 1 9 8521 1 1 50 LEU HB3 H 0.829 7.767 0.708 1.00 . A A . 50 LEU HB3 1 1 9 8522 1 1 50 LEU HD11 H 1.453 4.784 0.717 1.00 . A A . 50 LEU HD11 1 1 9 8523 1 1 50 LEU HD12 H 1.977 4.316 -0.901 1.00 . A A . 50 LEU HD12 1 1 9 8524 1 1 50 LEU HD13 H 0.342 4.929 -0.645 1.00 . A A . 50 LEU HD13 1 1 9 8525 1 1 50 LEU HD21 H 0.082 6.635 -1.749 1.00 . A A . 50 LEU HD21 1 1 9 8526 1 1 50 LEU HD22 H 1.571 6.944 -2.643 1.00 . A A . 50 LEU HD22 1 1 9 8527 1 1 50 LEU HD23 H 0.963 8.141 -1.499 1.00 . A A . 50 LEU HD23 1 1 9 8528 1 1 50 LEU HG H 2.896 6.373 -0.906 1.00 . A A . 50 LEU HG 1 1 9 8529 1 1 50 LEU N N 4.195 7.670 0.882 1.00 . A A . 50 LEU N 1 1 9 8530 1 1 50 LEU O O 3.348 8.939 3.124 1.00 . A A . 50 LEU O 1 1 9 8531 1 1 51 LYS C C -0.056 10.579 3.736 1.00 . A A . 51 LYS C 1 1 9 8532 1 1 51 LYS CA C 1.355 10.860 3.230 1.00 . A A . 51 LYS CA 1 1 9 8533 1 1 51 LYS CB C 1.493 12.339 2.860 1.00 . A A . 51 LYS CB 1 1 9 8534 1 1 51 LYS CD C 1.859 14.671 3.717 1.00 . A A . 51 LYS CD 1 1 9 8535 1 1 51 LYS CE C 2.771 15.196 2.619 1.00 . A A . 51 LYS CE 1 1 9 8536 1 1 51 LYS CG C 2.088 13.189 3.970 1.00 . A A . 51 LYS CG 1 1 9 8537 1 1 51 LYS H H 1.155 10.122 1.254 1.00 . A A . 51 LYS H 1 1 9 8538 1 1 51 LYS HA H 2.059 10.628 4.015 1.00 . A A . 51 LYS HA 1 1 9 8539 1 1 51 LYS HB2 H 2.128 12.423 1.990 1.00 . A A . 51 LYS HB2 1 1 9 8540 1 1 51 LYS HB3 H 0.516 12.730 2.620 1.00 . A A . 51 LYS HB3 1 1 9 8541 1 1 51 LYS HD2 H 0.833 14.822 3.421 1.00 . A A . 51 LYS HD2 1 1 9 8542 1 1 51 LYS HD3 H 2.058 15.216 4.628 1.00 . A A . 51 LYS HD3 1 1 9 8543 1 1 51 LYS HE2 H 3.767 15.311 3.020 1.00 . A A . 51 LYS HE2 1 1 9 8544 1 1 51 LYS HE3 H 2.790 14.480 1.811 1.00 . A A . 51 LYS HE3 1 1 9 8545 1 1 51 LYS HG2 H 1.624 12.920 4.905 1.00 . A A . 51 LYS HG2 1 1 9 8546 1 1 51 LYS HG3 H 3.150 13.002 4.023 1.00 . A A . 51 LYS HG3 1 1 9 8547 1 1 51 LYS HZ1 H 1.286 16.619 2.258 1.00 . A A . 51 LYS HZ1 1 1 9 8548 1 1 51 LYS HZ2 H 2.490 16.571 1.071 1.00 . A A . 51 LYS HZ2 1 1 9 8549 1 1 51 LYS HZ3 H 2.810 17.283 2.571 1.00 . A A . 51 LYS HZ3 1 1 9 8550 1 1 51 LYS N N 1.674 10.020 2.080 1.00 . A A . 51 LYS N 1 1 9 8551 1 1 51 LYS NZ N 2.306 16.509 2.093 1.00 . A A . 51 LYS NZ 1 1 9 8552 1 1 51 LYS O O -1.041 10.899 3.069 1.00 . A A . 51 LYS O 1 1 9 8553 1 1 52 TYR C C -2.262 10.918 5.755 1.00 . A A . 52 TYR C 1 1 9 8554 1 1 52 TYR CA C -1.438 9.655 5.514 1.00 . A A . 52 TYR CA 1 1 9 8555 1 1 52 TYR CB C -1.240 8.905 6.832 1.00 . A A . 52 TYR CB 1 1 9 8556 1 1 52 TYR CD1 C -3.481 8.863 7.995 1.00 . A A . 52 TYR CD1 1 1 9 8557 1 1 52 TYR CD2 C -2.650 6.827 7.076 1.00 . A A . 52 TYR CD2 1 1 9 8558 1 1 52 TYR CE1 C -4.615 8.208 8.432 1.00 . A A . 52 TYR CE1 1 1 9 8559 1 1 52 TYR CE2 C -3.782 6.164 7.511 1.00 . A A . 52 TYR CE2 1 1 9 8560 1 1 52 TYR CG C -2.481 8.184 7.310 1.00 . A A . 52 TYR CG 1 1 9 8561 1 1 52 TYR CZ C -4.761 6.857 8.189 1.00 . A A . 52 TYR CZ 1 1 9 8562 1 1 52 TYR H H 0.674 9.749 5.402 1.00 . A A . 52 TYR H 1 1 9 8563 1 1 52 TYR HA H -1.972 9.018 4.824 1.00 . A A . 52 TYR HA 1 1 9 8564 1 1 52 TYR HB2 H -0.458 8.171 6.706 1.00 . A A . 52 TYR HB2 1 1 9 8565 1 1 52 TYR HB3 H -0.947 9.608 7.598 1.00 . A A . 52 TYR HB3 1 1 9 8566 1 1 52 TYR HD1 H -3.363 9.920 8.183 1.00 . A A . 52 TYR HD1 1 1 9 8567 1 1 52 TYR HD2 H -1.882 6.284 6.545 1.00 . A A . 52 TYR HD2 1 1 9 8568 1 1 52 TYR HE1 H -5.381 8.753 8.963 1.00 . A A . 52 TYR HE1 1 1 9 8569 1 1 52 TYR HE2 H -3.897 5.107 7.319 1.00 . A A . 52 TYR HE2 1 1 9 8570 1 1 52 TYR HH H -6.561 6.837 8.874 1.00 . A A . 52 TYR HH 1 1 9 8571 1 1 52 TYR N N -0.147 9.980 4.918 1.00 . A A . 52 TYR N 1 1 9 8572 1 1 52 TYR O O -1.741 11.932 6.220 1.00 . A A . 52 TYR O 1 1 9 8573 1 1 52 TYR OH O -5.889 6.198 8.625 1.00 . A A . 52 TYR OH 1 1 9 8574 1 1 53 GLN C C -5.693 11.569 6.398 1.00 . A A . 53 GLN C 1 1 9 8575 1 1 53 GLN CA C -4.449 11.981 5.616 1.00 . A A . 53 GLN CA 1 1 9 8576 1 1 53 GLN CB C -4.852 12.560 4.259 1.00 . A A . 53 GLN CB 1 1 9 8577 1 1 53 GLN CD C -3.784 13.343 2.107 1.00 . A A . 53 GLN CD 1 1 9 8578 1 1 53 GLN CG C -3.776 13.424 3.621 1.00 . A A . 53 GLN CG 1 1 9 8579 1 1 53 GLN H H -3.904 10.010 5.070 1.00 . A A . 53 GLN H 1 1 9 8580 1 1 53 GLN HA H -3.920 12.736 6.177 1.00 . A A . 53 GLN HA 1 1 9 8581 1 1 53 GLN HB2 H -5.077 11.746 3.585 1.00 . A A . 53 GLN HB2 1 1 9 8582 1 1 53 GLN HB3 H -5.738 13.163 4.386 1.00 . A A . 53 GLN HB3 1 1 9 8583 1 1 53 GLN HE21 H -2.109 12.271 2.129 1.00 . A A . 53 GLN HE21 1 1 9 8584 1 1 53 GLN HE22 H -2.766 12.604 0.567 1.00 . A A . 53 GLN HE22 1 1 9 8585 1 1 53 GLN HG2 H -3.937 14.451 3.912 1.00 . A A . 53 GLN HG2 1 1 9 8586 1 1 53 GLN HG3 H -2.811 13.096 3.980 1.00 . A A . 53 GLN HG3 1 1 9 8587 1 1 53 GLN N N -3.549 10.847 5.435 1.00 . A A . 53 GLN N 1 1 9 8588 1 1 53 GLN NE2 N -2.786 12.672 1.544 1.00 . A A . 53 GLN NE2 1 1 9 8589 1 1 53 GLN O O -6.541 10.835 5.889 1.00 . A A . 53 GLN O 1 1 9 8590 1 1 53 GLN OE1 O -4.678 13.878 1.450 1.00 . A A . 53 GLN OE1 1 1 9 8591 1 1 54 GLU C C -8.255 12.037 7.794 1.00 . A A . 54 GLU C 1 1 9 8592 1 1 54 GLU CA C -6.934 11.725 8.491 1.00 . A A . 54 GLU CA 1 1 9 8593 1 1 54 GLU CB C -6.843 12.505 9.807 1.00 . A A . 54 GLU CB 1 1 9 8594 1 1 54 GLU CD C -5.242 12.506 11.761 1.00 . A A . 54 GLU CD 1 1 9 8595 1 1 54 GLU CG C -6.240 11.703 10.948 1.00 . A A . 54 GLU CG 1 1 9 8596 1 1 54 GLU H H -5.085 12.625 7.982 1.00 . A A . 54 GLU H 1 1 9 8597 1 1 54 GLU HA H -6.898 10.669 8.708 1.00 . A A . 54 GLU HA 1 1 9 8598 1 1 54 GLU HB2 H -6.232 13.382 9.649 1.00 . A A . 54 GLU HB2 1 1 9 8599 1 1 54 GLU HB3 H -7.836 12.816 10.097 1.00 . A A . 54 GLU HB3 1 1 9 8600 1 1 54 GLU HG2 H -7.036 11.379 11.602 1.00 . A A . 54 GLU HG2 1 1 9 8601 1 1 54 GLU HG3 H -5.738 10.839 10.538 1.00 . A A . 54 GLU HG3 1 1 9 8602 1 1 54 GLU N N -5.795 12.045 7.634 1.00 . A A . 54 GLU N 1 1 9 8603 1 1 54 GLU O O -9.256 11.350 8.002 1.00 . A A . 54 GLU O 1 1 9 8604 1 1 54 GLU OE1 O -4.137 12.775 11.246 1.00 . A A . 54 GLU OE1 1 1 9 8605 1 1 54 GLU OE2 O -5.567 12.864 12.911 1.00 . A A . 54 GLU OE2 1 1 9 8606 1 1 55 ASN C C -10.000 12.322 5.409 1.00 . A A . 55 ASN C 1 1 9 8607 1 1 55 ASN CA C -9.452 13.479 6.237 1.00 . A A . 55 ASN CA 1 1 9 8608 1 1 55 ASN CB C -9.149 14.672 5.330 1.00 . A A . 55 ASN CB 1 1 9 8609 1 1 55 ASN CG C -7.861 14.496 4.548 1.00 . A A . 55 ASN CG 1 1 9 8610 1 1 55 ASN H H -7.423 13.585 6.838 1.00 . A A . 55 ASN H 1 1 9 8611 1 1 55 ASN HA H -10.190 13.772 6.965 1.00 . A A . 55 ASN HA 1 1 9 8612 1 1 55 ASN HB2 H -9.959 14.798 4.627 1.00 . A A . 55 ASN HB2 1 1 9 8613 1 1 55 ASN HB3 H -9.060 15.563 5.936 1.00 . A A . 55 ASN HB3 1 1 9 8614 1 1 55 ASN HD21 H -8.782 13.301 3.252 1.00 . A A . 55 ASN HD21 1 1 9 8615 1 1 55 ASN HD22 H -7.105 13.582 2.951 1.00 . A A . 55 ASN HD22 1 1 9 8616 1 1 55 ASN N N -8.251 13.075 6.965 1.00 . A A . 55 ASN N 1 1 9 8617 1 1 55 ASN ND2 N -7.922 13.715 3.476 1.00 . A A . 55 ASN ND2 1 1 9 8618 1 1 55 ASN O O -11.190 12.301 5.074 1.00 . A A . 55 ASN O 1 1 9 8619 1 1 55 ASN OD1 O -6.823 15.055 4.903 1.00 . A A . 55 ASN OD1 1 1 9 8620 1 1 56 ALA C C -9.762 8.971 5.171 1.00 . A A . 56 ALA C 1 1 9 8621 1 1 56 ALA CA C -9.564 10.204 4.294 1.00 . A A . 56 ALA CA 1 1 9 8622 1 1 56 ALA CB C -8.539 9.917 3.206 1.00 . A A . 56 ALA CB 1 1 9 8623 1 1 56 ALA H H -8.219 11.428 5.375 1.00 . A A . 56 ALA H 1 1 9 8624 1 1 56 ALA HA H -10.500 10.446 3.814 1.00 . A A . 56 ALA HA 1 1 9 8625 1 1 56 ALA HB1 H -9.049 9.641 2.295 1.00 . A A . 56 ALA HB1 1 1 9 8626 1 1 56 ALA HB2 H -7.898 9.106 3.521 1.00 . A A . 56 ALA HB2 1 1 9 8627 1 1 56 ALA HB3 H -7.942 10.800 3.033 1.00 . A A . 56 ALA HB3 1 1 9 8628 1 1 56 ALA N N -9.150 11.359 5.081 1.00 . A A . 56 ALA N 1 1 9 8629 1 1 56 ALA O O -9.817 7.846 4.671 1.00 . A A . 56 ALA O 1 1 9 8630 1 1 57 TYR C C -10.790 8.560 8.669 1.00 . A A . 57 TYR C 1 1 9 8631 1 1 57 TYR CA C -10.060 8.085 7.420 1.00 . A A . 57 TYR CA 1 1 9 8632 1 1 57 TYR CB C -8.715 7.478 7.810 1.00 . A A . 57 TYR CB 1 1 9 8633 1 1 57 TYR CD1 C -8.030 6.108 5.804 1.00 . A A . 57 TYR CD1 1 1 9 8634 1 1 57 TYR CD2 C -6.747 8.045 6.333 1.00 . A A . 57 TYR CD2 1 1 9 8635 1 1 57 TYR CE1 C -7.209 5.856 4.722 1.00 . A A . 57 TYR CE1 1 1 9 8636 1 1 57 TYR CE2 C -5.922 7.800 5.252 1.00 . A A . 57 TYR CE2 1 1 9 8637 1 1 57 TYR CG C -7.814 7.205 6.628 1.00 . A A . 57 TYR CG 1 1 9 8638 1 1 57 TYR CZ C -6.156 6.704 4.449 1.00 . A A . 57 TYR CZ 1 1 9 8639 1 1 57 TYR H H -9.821 10.100 6.820 1.00 . A A . 57 TYR H 1 1 9 8640 1 1 57 TYR HA H -10.660 7.329 6.931 1.00 . A A . 57 TYR HA 1 1 9 8641 1 1 57 TYR HB2 H -8.199 8.159 8.470 1.00 . A A . 57 TYR HB2 1 1 9 8642 1 1 57 TYR HB3 H -8.883 6.543 8.323 1.00 . A A . 57 TYR HB3 1 1 9 8643 1 1 57 TYR HD1 H -8.856 5.445 6.018 1.00 . A A . 57 TYR HD1 1 1 9 8644 1 1 57 TYR HD2 H -6.564 8.901 6.965 1.00 . A A . 57 TYR HD2 1 1 9 8645 1 1 57 TYR HE1 H -7.394 4.998 4.094 1.00 . A A . 57 TYR HE1 1 1 9 8646 1 1 57 TYR HE2 H -5.099 8.464 5.040 1.00 . A A . 57 TYR HE2 1 1 9 8647 1 1 57 TYR HH H -5.535 5.595 3.002 1.00 . A A . 57 TYR HH 1 1 9 8648 1 1 57 TYR N N -9.871 9.184 6.479 1.00 . A A . 57 TYR N 1 1 9 8649 1 1 57 TYR O O -10.610 8.009 9.756 1.00 . A A . 57 TYR O 1 1 9 8650 1 1 57 TYR OH O -5.335 6.459 3.370 1.00 . A A . 57 TYR OH 1 1 9 8651 1 1 58 ARG C C -13.880 10.182 9.294 1.00 . A A . 58 ARG C 1 1 9 8652 1 1 58 ARG CA C -12.390 10.135 9.624 1.00 . A A . 58 ARG CA 1 1 9 8653 1 1 58 ARG CB C -11.880 11.538 9.969 1.00 . A A . 58 ARG CB 1 1 9 8654 1 1 58 ARG CD C -11.990 11.334 12.472 1.00 . A A . 58 ARG CD 1 1 9 8655 1 1 58 ARG CG C -12.480 12.097 11.252 1.00 . A A . 58 ARG CG 1 1 9 8656 1 1 58 ARG CZ C -12.850 10.786 14.714 1.00 . A A . 58 ARG CZ 1 1 9 8657 1 1 58 ARG H H -11.730 9.983 7.618 1.00 . A A . 58 ARG H 1 1 9 8658 1 1 58 ARG HA H -12.240 9.489 10.476 1.00 . A A . 58 ARG HA 1 1 9 8659 1 1 58 ARG HB2 H -10.810 11.506 10.077 1.00 . A A . 58 ARG HB2 1 1 9 8660 1 1 58 ARG HB3 H -12.140 12.208 9.160 1.00 . A A . 58 ARG HB3 1 1 9 8661 1 1 58 ARG HD2 H -11.590 10.381 12.150 1.00 . A A . 58 ARG HD2 1 1 9 8662 1 1 58 ARG HD3 H -11.200 11.905 12.948 1.00 . A A . 58 ARG HD3 1 1 9 8663 1 1 58 ARG HE H -13.980 11.178 13.116 1.00 . A A . 58 ARG HE 1 1 9 8664 1 1 58 ARG HG2 H -12.190 13.133 11.349 1.00 . A A . 58 ARG HG2 1 1 9 8665 1 1 58 ARG HG3 H -13.550 12.026 11.201 1.00 . A A . 58 ARG HG3 1 1 9 8666 1 1 58 ARG HH11 H -10.830 10.818 14.580 1.00 . A A . 58 ARG HH11 1 1 9 8667 1 1 58 ARG HH12 H -11.470 10.436 16.146 1.00 . A A . 58 ARG HH12 1 1 9 8668 1 1 58 ARG HH21 H -14.810 10.674 15.175 1.00 . A A . 58 ARG HH21 1 1 9 8669 1 1 58 ARG HH22 H -13.730 10.354 16.484 1.00 . A A . 58 ARG HH22 1 1 9 8670 1 1 58 ARG N N -11.620 9.586 8.508 1.00 . A A . 58 ARG N 1 1 9 8671 1 1 58 ARG NE N -13.060 11.099 13.437 1.00 . A A . 58 ARG NE 1 1 9 8672 1 1 58 ARG NH1 N -11.610 10.671 15.184 1.00 . A A . 58 ARG NH1 1 1 9 8673 1 1 58 ARG NH2 N -13.880 10.589 15.524 1.00 . A A . 58 ARG NH2 1 1 9 8674 1 1 58 ARG O O -14.360 11.155 8.718 1.00 . A A . 58 ARG O 1 1 9 8675 1 1 59 GLN C C -16.700 8.068 10.367 1.00 . A A . 59 GLN C 1 1 9 8676 1 1 59 GLN CA C -16.030 9.048 9.409 1.00 . A A . 59 GLN CA 1 1 9 8677 1 1 59 GLN CB C -16.290 8.623 7.963 1.00 . A A . 59 GLN CB 1 1 9 8678 1 1 59 GLN CD C -16.270 6.627 6.415 1.00 . A A . 59 GLN CD 1 1 9 8679 1 1 59 GLN CG C -15.590 7.332 7.571 1.00 . A A . 59 GLN CG 1 1 9 8680 1 1 59 GLN H H -14.150 8.382 10.121 1.00 . A A . 59 GLN H 1 1 9 8681 1 1 59 GLN HA H -16.440 10.029 9.567 1.00 . A A . 59 GLN HA 1 1 9 8682 1 1 59 GLN HB2 H -17.350 8.487 7.824 1.00 . A A . 59 GLN HB2 1 1 9 8683 1 1 59 GLN HB3 H -15.940 9.407 7.303 1.00 . A A . 59 GLN HB3 1 1 9 8684 1 1 59 GLN HE21 H -17.960 6.500 7.456 1.00 . A A . 59 GLN HE21 1 1 9 8685 1 1 59 GLN HE22 H -18.000 5.824 5.864 1.00 . A A . 59 GLN HE22 1 1 9 8686 1 1 59 GLN HG2 H -14.570 7.559 7.287 1.00 . A A . 59 GLN HG2 1 1 9 8687 1 1 59 GLN HG3 H -15.580 6.670 8.426 1.00 . A A . 59 GLN HG3 1 1 9 8688 1 1 59 GLN N N -14.590 9.126 9.665 1.00 . A A . 59 GLN N 1 1 9 8689 1 1 59 GLN NE2 N -17.540 6.282 6.596 1.00 . A A . 59 GLN NE2 1 1 9 8690 1 1 59 GLN O O -16.040 7.211 10.956 1.00 . A A . 59 GLN O 1 1 9 8691 1 1 59 GLN OE1 O -15.660 6.394 5.370 1.00 . A A . 59 GLN OE1 1 1 9 8692 1 1 60 ALA C C -19.550 6.284 10.604 1.00 . A A . 60 ALA C 1 1 9 8693 1 1 60 ALA CA C -18.770 7.323 11.399 1.00 . A A . 60 ALA CA 1 1 9 8694 1 1 60 ALA CB C -19.710 8.143 12.269 1.00 . A A . 60 ALA CB 1 1 9 8695 1 1 60 ALA H H -18.480 8.899 10.016 1.00 . A A . 60 ALA H 1 1 9 8696 1 1 60 ALA HA H -18.070 6.815 12.047 1.00 . A A . 60 ALA HA 1 1 9 8697 1 1 60 ALA HB1 H -19.980 9.055 11.754 1.00 . A A . 60 ALA HB1 1 1 9 8698 1 1 60 ALA HB2 H -19.220 8.385 13.200 1.00 . A A . 60 ALA HB2 1 1 9 8699 1 1 60 ALA HB3 H -20.610 7.571 12.470 1.00 . A A . 60 ALA HB3 1 1 9 8700 1 1 60 ALA N N -18.010 8.198 10.514 1.00 . A A . 60 ALA N 1 1 9 8701 1 1 60 ALA O O -19.580 6.319 9.374 1.00 . A A . 60 ALA O 1 1 9 8702 1 1 61 ALA C C -22.400 4.776 10.407 1.00 . A A . 61 ALA C 1 1 9 8703 1 1 61 ALA CA C -20.970 4.308 10.676 1.00 . A A . 61 ALA CA 1 1 9 8704 1 1 61 ALA CB C -20.980 3.057 11.540 1.00 . A A . 61 ALA CB 1 1 9 8705 1 1 61 ALA H H -20.130 5.384 12.293 1.00 . A A . 61 ALA H 1 1 9 8706 1 1 61 ALA HA H -20.500 4.067 9.734 1.00 . A A . 61 ALA HA 1 1 9 8707 1 1 61 ALA HB1 H -19.970 2.811 11.824 1.00 . A A . 61 ALA HB1 1 1 9 8708 1 1 61 ALA HB2 H -21.410 2.237 10.981 1.00 . A A . 61 ALA HB2 1 1 9 8709 1 1 61 ALA HB3 H -21.570 3.234 12.426 1.00 . A A . 61 ALA HB3 1 1 9 8710 1 1 61 ALA N N -20.190 5.359 11.315 1.00 . A A . 61 ALA N 1 1 9 8711 1 1 61 ALA O O -22.970 4.373 9.371 1.00 . A A . 61 ALA O 1 1 9 8712 1 1 61 ALA OXT O -22.940 5.542 11.236 1.00 . A A . 61 ALA OXT 1 1 10 8713 1 1 1 MET C C -5.114 6.336 -1.349 1.00 . A A . 1 MET C 1 1 10 8714 1 1 1 MET CA C -4.249 7.295 -0.537 1.00 . A A . 1 MET CA 1 1 10 8715 1 1 1 MET CB C -3.266 6.508 0.332 1.00 . A A . 1 MET CB 1 1 10 8716 1 1 1 MET CE C -0.620 6.797 3.013 1.00 . A A . 1 MET CE 1 1 10 8717 1 1 1 MET CG C -1.989 7.275 0.650 1.00 . A A . 1 MET CG 1 1 10 8718 1 1 1 MET H1 H -5.565 8.851 -0.256 1.00 . A A . 1 MET H1 1 1 10 8719 1 1 1 MET H2 H -4.443 8.620 1.023 1.00 . A A . 1 MET H2 1 1 10 8720 1 1 1 MET H3 H -5.764 7.541 0.831 1.00 . A A . 1 MET H3 1 1 10 8721 1 1 1 MET HA H -3.697 7.929 -1.214 1.00 . A A . 1 MET HA 1 1 10 8722 1 1 1 MET HB2 H -3.749 6.253 1.263 1.00 . A A . 1 MET HB2 1 1 10 8723 1 1 1 MET HB3 H -2.993 5.600 -0.183 1.00 . A A . 1 MET HB3 1 1 10 8724 1 1 1 MET HE1 H -0.503 5.930 2.379 1.00 . A A . 1 MET HE1 1 1 10 8725 1 1 1 MET HE2 H -0.876 6.480 4.012 1.00 . A A . 1 MET HE2 1 1 10 8726 1 1 1 MET HE3 H 0.306 7.353 3.037 1.00 . A A . 1 MET HE3 1 1 10 8727 1 1 1 MET HG2 H -1.144 6.629 0.468 1.00 . A A . 1 MET HG2 1 1 10 8728 1 1 1 MET HG3 H -1.932 8.134 0.001 1.00 . A A . 1 MET HG3 1 1 10 8729 1 1 1 MET N N -5.080 8.154 0.345 1.00 . A A . 1 MET N 1 1 10 8730 1 1 1 MET O O -5.912 5.581 -0.792 1.00 . A A . 1 MET O 1 1 10 8731 1 1 1 MET SD S -1.925 7.839 2.362 1.00 . A A . 1 MET SD 1 1 10 8732 1 1 2 TYR C C -5.001 4.175 -3.765 1.00 . A A . 2 TYR C 1 1 10 8733 1 1 2 TYR CA C -5.716 5.505 -3.555 1.00 . A A . 2 TYR CA 1 1 10 8734 1 1 2 TYR CB C -5.944 6.194 -4.902 1.00 . A A . 2 TYR CB 1 1 10 8735 1 1 2 TYR CD1 C -7.471 7.920 -3.868 1.00 . A A . 2 TYR CD1 1 1 10 8736 1 1 2 TYR CD2 C -8.033 7.064 -6.021 1.00 . A A . 2 TYR CD2 1 1 10 8737 1 1 2 TYR CE1 C -8.593 8.725 -3.891 1.00 . A A . 2 TYR CE1 1 1 10 8738 1 1 2 TYR CE2 C -9.157 7.867 -6.051 1.00 . A A . 2 TYR CE2 1 1 10 8739 1 1 2 TYR CG C -7.172 7.076 -4.931 1.00 . A A . 2 TYR CG 1 1 10 8740 1 1 2 TYR CZ C -9.433 8.696 -4.985 1.00 . A A . 2 TYR CZ 1 1 10 8741 1 1 2 TYR H H -4.299 6.993 -3.051 1.00 . A A . 2 TYR H 1 1 10 8742 1 1 2 TYR HA H -6.673 5.317 -3.091 1.00 . A A . 2 TYR HA 1 1 10 8743 1 1 2 TYR HB2 H -5.088 6.811 -5.131 1.00 . A A . 2 TYR HB2 1 1 10 8744 1 1 2 TYR HB3 H -6.056 5.442 -5.668 1.00 . A A . 2 TYR HB3 1 1 10 8745 1 1 2 TYR HD1 H -6.812 7.941 -3.012 1.00 . A A . 2 TYR HD1 1 1 10 8746 1 1 2 TYR HD2 H -7.814 6.412 -6.854 1.00 . A A . 2 TYR HD2 1 1 10 8747 1 1 2 TYR HE1 H -8.808 9.375 -3.056 1.00 . A A . 2 TYR HE1 1 1 10 8748 1 1 2 TYR HE2 H -9.814 7.843 -6.908 1.00 . A A . 2 TYR HE2 1 1 10 8749 1 1 2 TYR HH H -11.320 8.958 -5.177 1.00 . A A . 2 TYR HH 1 1 10 8750 1 1 2 TYR N N -4.950 6.371 -2.666 1.00 . A A . 2 TYR N 1 1 10 8751 1 1 2 TYR O O -3.772 4.117 -3.801 1.00 . A A . 2 TYR O 1 1 10 8752 1 1 2 TYR OH O -10.550 9.498 -5.012 1.00 . A A . 2 TYR OH 1 1 10 8753 1 1 3 LYS C C -4.347 1.734 -5.358 1.00 . A A . 3 LYS C 1 1 10 8754 1 1 3 LYS CA C -5.221 1.774 -4.108 1.00 . A A . 3 LYS CA 1 1 10 8755 1 1 3 LYS CB C -6.344 0.741 -4.223 1.00 . A A . 3 LYS CB 1 1 10 8756 1 1 3 LYS CD C -6.014 -1.664 -4.885 1.00 . A A . 3 LYS CD 1 1 10 8757 1 1 3 LYS CE C -7.438 -2.141 -5.114 1.00 . A A . 3 LYS CE 1 1 10 8758 1 1 3 LYS CG C -5.941 -0.649 -3.756 1.00 . A A . 3 LYS CG 1 1 10 8759 1 1 3 LYS H H -6.753 3.216 -3.865 1.00 . A A . 3 LYS H 1 1 10 8760 1 1 3 LYS HA H -4.612 1.536 -3.249 1.00 . A A . 3 LYS HA 1 1 10 8761 1 1 3 LYS HB2 H -7.181 1.069 -3.626 1.00 . A A . 3 LYS HB2 1 1 10 8762 1 1 3 LYS HB3 H -6.652 0.676 -5.255 1.00 . A A . 3 LYS HB3 1 1 10 8763 1 1 3 LYS HD2 H -5.649 -1.207 -5.792 1.00 . A A . 3 LYS HD2 1 1 10 8764 1 1 3 LYS HD3 H -5.394 -2.513 -4.634 1.00 . A A . 3 LYS HD3 1 1 10 8765 1 1 3 LYS HE2 H -7.575 -3.083 -4.603 1.00 . A A . 3 LYS HE2 1 1 10 8766 1 1 3 LYS HE3 H -8.119 -1.409 -4.706 1.00 . A A . 3 LYS HE3 1 1 10 8767 1 1 3 LYS HG2 H -4.927 -0.613 -3.383 1.00 . A A . 3 LYS HG2 1 1 10 8768 1 1 3 LYS HG3 H -6.605 -0.957 -2.963 1.00 . A A . 3 LYS HG3 1 1 10 8769 1 1 3 LYS HZ1 H -6.854 -2.487 -7.089 1.00 . A A . 3 LYS HZ1 1 1 10 8770 1 1 3 LYS HZ2 H -8.208 -1.483 -6.941 1.00 . A A . 3 LYS HZ2 1 1 10 8771 1 1 3 LYS HZ3 H -8.360 -3.150 -6.694 1.00 . A A . 3 LYS HZ3 1 1 10 8772 1 1 3 LYS N N -5.780 3.105 -3.903 1.00 . A A . 3 LYS N 1 1 10 8773 1 1 3 LYS NZ N -7.735 -2.328 -6.561 1.00 . A A . 3 LYS NZ 1 1 10 8774 1 1 3 LYS O O -3.362 0.999 -5.415 1.00 . A A . 3 LYS O 1 1 10 8775 1 1 4 LYS C C -2.561 3.135 -7.373 1.00 . A A . 4 LYS C 1 1 10 8776 1 1 4 LYS CA C -3.966 2.586 -7.605 1.00 . A A . 4 LYS CA 1 1 10 8777 1 1 4 LYS CB C -4.702 3.452 -8.629 1.00 . A A . 4 LYS CB 1 1 10 8778 1 1 4 LYS CD C -4.602 1.666 -10.392 1.00 . A A . 4 LYS CD 1 1 10 8779 1 1 4 LYS CE C -5.182 1.497 -11.786 1.00 . A A . 4 LYS CE 1 1 10 8780 1 1 4 LYS CG C -4.346 3.130 -10.069 1.00 . A A . 4 LYS CG 1 1 10 8781 1 1 4 LYS H H -5.511 3.094 -6.251 1.00 . A A . 4 LYS H 1 1 10 8782 1 1 4 LYS HA H -3.886 1.580 -7.989 1.00 . A A . 4 LYS HA 1 1 10 8783 1 1 4 LYS HB2 H -5.765 3.312 -8.503 1.00 . A A . 4 LYS HB2 1 1 10 8784 1 1 4 LYS HB3 H -4.461 4.488 -8.444 1.00 . A A . 4 LYS HB3 1 1 10 8785 1 1 4 LYS HD2 H -3.669 1.126 -10.333 1.00 . A A . 4 LYS HD2 1 1 10 8786 1 1 4 LYS HD3 H -5.298 1.265 -9.670 1.00 . A A . 4 LYS HD3 1 1 10 8787 1 1 4 LYS HE2 H -4.495 1.920 -12.504 1.00 . A A . 4 LYS HE2 1 1 10 8788 1 1 4 LYS HE3 H -5.306 0.443 -11.986 1.00 . A A . 4 LYS HE3 1 1 10 8789 1 1 4 LYS HG2 H -4.945 3.742 -10.725 1.00 . A A . 4 LYS HG2 1 1 10 8790 1 1 4 LYS HG3 H -3.299 3.346 -10.228 1.00 . A A . 4 LYS HG3 1 1 10 8791 1 1 4 LYS HZ1 H -6.948 2.280 -10.992 1.00 . A A . 4 LYS HZ1 1 1 10 8792 1 1 4 LYS HZ2 H -7.130 1.611 -12.535 1.00 . A A . 4 LYS HZ2 1 1 10 8793 1 1 4 LYS HZ3 H -6.378 3.115 -12.349 1.00 . A A . 4 LYS HZ3 1 1 10 8794 1 1 4 LYS N N -4.716 2.530 -6.356 1.00 . A A . 4 LYS N 1 1 10 8795 1 1 4 LYS NZ N -6.502 2.173 -11.924 1.00 . A A . 4 LYS NZ 1 1 10 8796 1 1 4 LYS O O -1.620 2.777 -8.082 1.00 . A A . 4 LYS O 1 1 10 8797 1 1 5 ASP C C -0.221 3.594 -5.375 1.00 . A A . 5 ASP C 1 1 10 8798 1 1 5 ASP CA C -1.138 4.606 -6.056 1.00 . A A . 5 ASP CA 1 1 10 8799 1 1 5 ASP CB C -1.331 5.824 -5.151 1.00 . A A . 5 ASP CB 1 1 10 8800 1 1 5 ASP CG C -0.046 6.601 -4.947 1.00 . A A . 5 ASP CG 1 1 10 8801 1 1 5 ASP H H -3.216 4.254 -5.850 1.00 . A A . 5 ASP H 1 1 10 8802 1 1 5 ASP HA H -0.680 4.924 -6.981 1.00 . A A . 5 ASP HA 1 1 10 8803 1 1 5 ASP HB2 H -2.061 6.483 -5.597 1.00 . A A . 5 ASP HB2 1 1 10 8804 1 1 5 ASP HB3 H -1.690 5.496 -4.186 1.00 . A A . 5 ASP HB3 1 1 10 8805 1 1 5 ASP N N -2.428 4.006 -6.379 1.00 . A A . 5 ASP N 1 1 10 8806 1 1 5 ASP O O 0.942 3.449 -5.747 1.00 . A A . 5 ASP O 1 1 10 8807 1 1 5 ASP OD1 O 0.906 6.034 -4.371 1.00 . A A . 5 ASP OD1 1 1 10 8808 1 1 5 ASP OD2 O 0.009 7.779 -5.362 1.00 . A A . 5 ASP OD2 1 1 10 8809 1 1 6 VAL C C 0.572 0.839 -4.583 1.00 . A A . 6 VAL C 1 1 10 8810 1 1 6 VAL CA C 0.009 1.902 -3.644 1.00 . A A . 6 VAL CA 1 1 10 8811 1 1 6 VAL CB C -0.860 1.215 -2.575 1.00 . A A . 6 VAL CB 1 1 10 8812 1 1 6 VAL CG1 C 0.020 0.548 -1.546 1.00 . A A . 6 VAL CG1 1 1 10 8813 1 1 6 VAL CG2 C -1.799 2.209 -1.906 1.00 . A A . 6 VAL CG2 1 1 10 8814 1 1 6 VAL H H -1.681 3.051 -4.123 1.00 . A A . 6 VAL H 1 1 10 8815 1 1 6 VAL HA H 0.826 2.403 -3.148 1.00 . A A . 6 VAL HA 1 1 10 8816 1 1 6 VAL HB H -1.457 0.455 -3.058 1.00 . A A . 6 VAL HB 1 1 10 8817 1 1 6 VAL HG11 H 0.816 1.222 -1.273 1.00 . A A . 6 VAL HG11 1 1 10 8818 1 1 6 VAL HG12 H 0.436 -0.355 -1.963 1.00 . A A . 6 VAL HG12 1 1 10 8819 1 1 6 VAL HG13 H -0.566 0.309 -0.673 1.00 . A A . 6 VAL HG13 1 1 10 8820 1 1 6 VAL HG21 H -2.099 1.827 -0.941 1.00 . A A . 6 VAL HG21 1 1 10 8821 1 1 6 VAL HG22 H -2.672 2.353 -2.525 1.00 . A A . 6 VAL HG22 1 1 10 8822 1 1 6 VAL HG23 H -1.291 3.155 -1.777 1.00 . A A . 6 VAL HG23 1 1 10 8823 1 1 6 VAL N N -0.753 2.895 -4.377 1.00 . A A . 6 VAL N 1 1 10 8824 1 1 6 VAL O O 1.746 0.479 -4.497 1.00 . A A . 6 VAL O 1 1 10 8825 1 1 7 ILE C C 1.207 -0.149 -7.378 1.00 . A A . 7 ILE C 1 1 10 8826 1 1 7 ILE CA C 0.133 -0.680 -6.432 1.00 . A A . 7 ILE CA 1 1 10 8827 1 1 7 ILE CB C -1.069 -1.183 -7.256 1.00 . A A . 7 ILE CB 1 1 10 8828 1 1 7 ILE CD1 C -3.435 -2.101 -7.045 1.00 . A A . 7 ILE CD1 1 1 10 8829 1 1 7 ILE CG1 C -2.144 -1.757 -6.333 1.00 . A A . 7 ILE CG1 1 1 10 8830 1 1 7 ILE CG2 C -0.626 -2.227 -8.272 1.00 . A A . 7 ILE CG2 1 1 10 8831 1 1 7 ILE H H -1.198 0.669 -5.493 1.00 . A A . 7 ILE H 1 1 10 8832 1 1 7 ILE HA H 0.537 -1.514 -5.875 1.00 . A A . 7 ILE HA 1 1 10 8833 1 1 7 ILE HB H -1.482 -0.345 -7.797 1.00 . A A . 7 ILE HB 1 1 10 8834 1 1 7 ILE HD11 H -4.151 -2.478 -6.331 1.00 . A A . 7 ILE HD11 1 1 10 8835 1 1 7 ILE HD12 H -3.241 -2.853 -7.794 1.00 . A A . 7 ILE HD12 1 1 10 8836 1 1 7 ILE HD13 H -3.830 -1.215 -7.518 1.00 . A A . 7 ILE HD13 1 1 10 8837 1 1 7 ILE HG12 H -1.771 -2.660 -5.873 1.00 . A A . 7 ILE HG12 1 1 10 8838 1 1 7 ILE HG13 H -2.371 -1.035 -5.563 1.00 . A A . 7 ILE HG13 1 1 10 8839 1 1 7 ILE HG21 H -0.211 -3.079 -7.755 1.00 . A A . 7 ILE HG21 1 1 10 8840 1 1 7 ILE HG22 H 0.125 -1.799 -8.921 1.00 . A A . 7 ILE HG22 1 1 10 8841 1 1 7 ILE HG23 H -1.474 -2.541 -8.861 1.00 . A A . 7 ILE HG23 1 1 10 8842 1 1 7 ILE N N -0.276 0.341 -5.476 1.00 . A A . 7 ILE N 1 1 10 8843 1 1 7 ILE O O 2.134 -0.870 -7.747 1.00 . A A . 7 ILE O 1 1 10 8844 1 1 8 ASP C C 3.323 2.078 -7.902 1.00 . A A . 8 ASP C 1 1 10 8845 1 1 8 ASP CA C 2.041 1.746 -8.653 1.00 . A A . 8 ASP CA 1 1 10 8846 1 1 8 ASP CB C 1.445 3.015 -9.267 1.00 . A A . 8 ASP CB 1 1 10 8847 1 1 8 ASP CG C 1.445 2.981 -10.783 1.00 . A A . 8 ASP CG 1 1 10 8848 1 1 8 ASP H H 0.325 1.641 -7.425 1.00 . A A . 8 ASP H 1 1 10 8849 1 1 8 ASP HA H 2.268 1.045 -9.443 1.00 . A A . 8 ASP HA 1 1 10 8850 1 1 8 ASP HB2 H 0.425 3.125 -8.929 1.00 . A A . 8 ASP HB2 1 1 10 8851 1 1 8 ASP HB3 H 2.021 3.870 -8.944 1.00 . A A . 8 ASP HB3 1 1 10 8852 1 1 8 ASP N N 1.078 1.116 -7.759 1.00 . A A . 8 ASP N 1 1 10 8853 1 1 8 ASP O O 4.394 2.198 -8.500 1.00 . A A . 8 ASP O 1 1 10 8854 1 1 8 ASP OD1 O 0.489 2.426 -11.364 1.00 . A A . 8 ASP OD1 1 1 10 8855 1 1 8 ASP OD2 O 2.400 3.510 -11.389 1.00 . A A . 8 ASP OD2 1 1 10 8856 1 1 9 HIS C C 5.133 1.263 -5.412 1.00 . A A . 9 HIS C 1 1 10 8857 1 1 9 HIS CA C 4.354 2.531 -5.747 1.00 . A A . 9 HIS CA 1 1 10 8858 1 1 9 HIS CB C 3.891 3.227 -4.460 1.00 . A A . 9 HIS CB 1 1 10 8859 1 1 9 HIS CD2 C 5.740 2.517 -2.781 1.00 . A A . 9 HIS CD2 1 1 10 8860 1 1 9 HIS CE1 C 6.351 4.512 -2.112 1.00 . A A . 9 HIS CE1 1 1 10 8861 1 1 9 HIS CG C 4.979 3.418 -3.446 1.00 . A A . 9 HIS CG 1 1 10 8862 1 1 9 HIS H H 2.329 2.107 -6.168 1.00 . A A . 9 HIS H 1 1 10 8863 1 1 9 HIS HA H 4.991 3.199 -6.300 1.00 . A A . 9 HIS HA 1 1 10 8864 1 1 9 HIS HB2 H 3.498 4.200 -4.709 1.00 . A A . 9 HIS HB2 1 1 10 8865 1 1 9 HIS HB3 H 3.111 2.637 -4.004 1.00 . A A . 9 HIS HB3 1 1 10 8866 1 1 9 HIS HD1 H 5.025 5.520 -3.301 1.00 . A A . 9 HIS HD1 1 1 10 8867 1 1 9 HIS HD2 H 5.691 1.441 -2.878 1.00 . A A . 9 HIS HD2 1 1 10 8868 1 1 9 HIS HE1 H 6.861 5.311 -1.594 1.00 . A A . 9 HIS HE1 1 1 10 8869 1 1 9 HIS HE2 H 7.309 2.837 -1.425 1.00 . A A . 9 HIS HE2 1 1 10 8870 1 1 9 HIS N N 3.208 2.220 -6.586 1.00 . A A . 9 HIS N 1 1 10 8871 1 1 9 HIS ND1 N 5.387 4.659 -3.005 1.00 . A A . 9 HIS ND1 1 1 10 8872 1 1 9 HIS NE2 N 6.583 3.221 -1.959 1.00 . A A . 9 HIS NE2 1 1 10 8873 1 1 9 HIS O O 6.338 1.310 -5.168 1.00 . A A . 9 HIS O 1 1 10 8874 1 1 10 PHE C C 5.450 -1.887 -6.362 1.00 . A A . 10 PHE C 1 1 10 8875 1 1 10 PHE CA C 5.060 -1.146 -5.088 1.00 . A A . 10 PHE CA 1 1 10 8876 1 1 10 PHE CB C 4.115 -2.010 -4.252 1.00 . A A . 10 PHE CB 1 1 10 8877 1 1 10 PHE CD1 C 3.834 -0.251 -2.487 1.00 . A A . 10 PHE CD1 1 1 10 8878 1 1 10 PHE CD2 C 4.120 -2.515 -1.795 1.00 . A A . 10 PHE CD2 1 1 10 8879 1 1 10 PHE CE1 C 3.747 0.146 -1.167 1.00 . A A . 10 PHE CE1 1 1 10 8880 1 1 10 PHE CE2 C 4.034 -2.123 -0.472 1.00 . A A . 10 PHE CE2 1 1 10 8881 1 1 10 PHE CG C 4.022 -1.584 -2.816 1.00 . A A . 10 PHE CG 1 1 10 8882 1 1 10 PHE CZ C 3.847 -0.791 -0.158 1.00 . A A . 10 PHE CZ 1 1 10 8883 1 1 10 PHE H H 3.476 0.158 -5.597 1.00 . A A . 10 PHE H 1 1 10 8884 1 1 10 PHE HA H 5.948 -0.944 -4.513 1.00 . A A . 10 PHE HA 1 1 10 8885 1 1 10 PHE HB2 H 3.123 -1.962 -4.678 1.00 . A A . 10 PHE HB2 1 1 10 8886 1 1 10 PHE HB3 H 4.461 -3.033 -4.275 1.00 . A A . 10 PHE HB3 1 1 10 8887 1 1 10 PHE HD1 H 3.757 0.482 -3.274 1.00 . A A . 10 PHE HD1 1 1 10 8888 1 1 10 PHE HD2 H 4.267 -3.556 -2.040 1.00 . A A . 10 PHE HD2 1 1 10 8889 1 1 10 PHE HE1 H 3.600 1.188 -0.925 1.00 . A A . 10 PHE HE1 1 1 10 8890 1 1 10 PHE HE2 H 4.111 -2.858 0.314 1.00 . A A . 10 PHE HE2 1 1 10 8891 1 1 10 PHE HZ H 3.778 -0.483 0.875 1.00 . A A . 10 PHE HZ 1 1 10 8892 1 1 10 PHE N N 4.434 0.132 -5.399 1.00 . A A . 10 PHE N 1 1 10 8893 1 1 10 PHE O O 6.569 -2.386 -6.485 1.00 . A A . 10 PHE O 1 1 10 8894 1 1 11 GLY C C 3.907 -3.866 -8.747 1.00 . A A . 11 GLY C 1 1 10 8895 1 1 11 GLY CA C 4.783 -2.642 -8.560 1.00 . A A . 11 GLY CA 1 1 10 8896 1 1 11 GLY H H 3.645 -1.542 -7.154 1.00 . A A . 11 GLY H 1 1 10 8897 1 1 11 GLY HA2 H 4.603 -1.957 -9.376 1.00 . A A . 11 GLY HA2 1 1 10 8898 1 1 11 GLY HA3 H 5.819 -2.946 -8.582 1.00 . A A . 11 GLY HA3 1 1 10 8899 1 1 11 GLY N N 4.518 -1.957 -7.308 1.00 . A A . 11 GLY N 1 1 10 8900 1 1 11 GLY O O 3.574 -4.233 -9.873 1.00 . A A . 11 GLY O 1 1 10 8901 1 1 12 THR C C 1.714 -5.706 -6.515 1.00 . A A . 12 THR C 1 1 10 8902 1 1 12 THR CA C 2.693 -5.690 -7.684 1.00 . A A . 12 THR CA 1 1 10 8903 1 1 12 THR CB C 3.556 -6.952 -7.657 1.00 . A A . 12 THR CB 1 1 10 8904 1 1 12 THR CG2 C 4.481 -7.070 -8.849 1.00 . A A . 12 THR CG2 1 1 10 8905 1 1 12 THR H H 3.834 -4.157 -6.769 1.00 . A A . 12 THR H 1 1 10 8906 1 1 12 THR HA H 2.134 -5.666 -8.607 1.00 . A A . 12 THR HA 1 1 10 8907 1 1 12 THR HB H 2.909 -7.818 -7.654 1.00 . A A . 12 THR HB 1 1 10 8908 1 1 12 THR HG1 H 5.021 -6.301 -6.533 1.00 . A A . 12 THR HG1 1 1 10 8909 1 1 12 THR HG21 H 3.895 -7.146 -9.754 1.00 . A A . 12 THR HG21 1 1 10 8910 1 1 12 THR HG22 H 5.096 -7.952 -8.743 1.00 . A A . 12 THR HG22 1 1 10 8911 1 1 12 THR HG23 H 5.112 -6.195 -8.902 1.00 . A A . 12 THR HG23 1 1 10 8912 1 1 12 THR N N 3.535 -4.499 -7.639 1.00 . A A . 12 THR N 1 1 10 8913 1 1 12 THR O O 1.706 -4.796 -5.685 1.00 . A A . 12 THR O 1 1 10 8914 1 1 12 THR OG1 O 4.355 -6.991 -6.489 1.00 . A A . 12 THR OG1 1 1 10 8915 1 1 13 GLN C C 0.488 -7.640 -4.198 1.00 . A A . 13 GLN C 1 1 10 8916 1 1 13 GLN CA C -0.095 -6.881 -5.386 1.00 . A A . 13 GLN CA 1 1 10 8917 1 1 13 GLN CB C -1.344 -7.598 -5.903 1.00 . A A . 13 GLN CB 1 1 10 8918 1 1 13 GLN CD C -3.228 -5.924 -6.061 1.00 . A A . 13 GLN CD 1 1 10 8919 1 1 13 GLN CG C -2.203 -6.742 -6.819 1.00 . A A . 13 GLN CG 1 1 10 8920 1 1 13 GLN H H 0.942 -7.439 -7.144 1.00 . A A . 13 GLN H 1 1 10 8921 1 1 13 GLN HA H -0.370 -5.887 -5.064 1.00 . A A . 13 GLN HA 1 1 10 8922 1 1 13 GLN HB2 H -1.039 -8.478 -6.450 1.00 . A A . 13 GLN HB2 1 1 10 8923 1 1 13 GLN HB3 H -1.947 -7.900 -5.059 1.00 . A A . 13 GLN HB3 1 1 10 8924 1 1 13 GLN HE21 H -4.014 -7.581 -5.289 1.00 . A A . 13 GLN HE21 1 1 10 8925 1 1 13 GLN HE22 H -4.764 -6.100 -4.809 1.00 . A A . 13 GLN HE22 1 1 10 8926 1 1 13 GLN HG2 H -1.561 -6.067 -7.367 1.00 . A A . 13 GLN HG2 1 1 10 8927 1 1 13 GLN HG3 H -2.721 -7.388 -7.513 1.00 . A A . 13 GLN HG3 1 1 10 8928 1 1 13 GLN N N 0.889 -6.746 -6.454 1.00 . A A . 13 GLN N 1 1 10 8929 1 1 13 GLN NE2 N -4.089 -6.604 -5.311 1.00 . A A . 13 GLN NE2 1 1 10 8930 1 1 13 GLN O O 0.440 -7.168 -3.063 1.00 . A A . 13 GLN O 1 1 10 8931 1 1 13 GLN OE1 O -3.248 -4.697 -6.145 1.00 . A A . 13 GLN OE1 1 1 10 8932 1 1 14 ARG C C 2.634 -8.856 -2.591 1.00 . A A . 14 ARG C 1 1 10 8933 1 1 14 ARG CA C 1.631 -9.650 -3.424 1.00 . A A . 14 ARG CA 1 1 10 8934 1 1 14 ARG CB C 2.318 -10.869 -4.041 1.00 . A A . 14 ARG CB 1 1 10 8935 1 1 14 ARG CD C 2.745 -13.323 -3.713 1.00 . A A . 14 ARG CD 1 1 10 8936 1 1 14 ARG CG C 2.629 -11.966 -3.037 1.00 . A A . 14 ARG CG 1 1 10 8937 1 1 14 ARG CZ C 2.859 -15.681 -3.007 1.00 . A A . 14 ARG CZ 1 1 10 8938 1 1 14 ARG H H 1.044 -9.142 -5.396 1.00 . A A . 14 ARG H 1 1 10 8939 1 1 14 ARG HA H 0.833 -9.988 -2.778 1.00 . A A . 14 ARG HA 1 1 10 8940 1 1 14 ARG HB2 H 1.675 -11.282 -4.805 1.00 . A A . 14 ARG HB2 1 1 10 8941 1 1 14 ARG HB3 H 3.246 -10.552 -4.495 1.00 . A A . 14 ARG HB3 1 1 10 8942 1 1 14 ARG HD2 H 1.810 -13.548 -4.204 1.00 . A A . 14 ARG HD2 1 1 10 8943 1 1 14 ARG HD3 H 3.536 -13.278 -4.449 1.00 . A A . 14 ARG HD3 1 1 10 8944 1 1 14 ARG HE H 3.411 -14.124 -1.886 1.00 . A A . 14 ARG HE 1 1 10 8945 1 1 14 ARG HG2 H 3.564 -11.739 -2.548 1.00 . A A . 14 ARG HG2 1 1 10 8946 1 1 14 ARG HG3 H 1.837 -12.005 -2.304 1.00 . A A . 14 ARG HG3 1 1 10 8947 1 1 14 ARG HH11 H 2.140 -15.401 -4.875 1.00 . A A . 14 ARG HH11 1 1 10 8948 1 1 14 ARG HH12 H 2.230 -17.048 -4.356 1.00 . A A . 14 ARG HH12 1 1 10 8949 1 1 14 ARG HH21 H 3.528 -16.292 -1.201 1.00 . A A . 14 ARG HH21 1 1 10 8950 1 1 14 ARG HH22 H 3.015 -17.556 -2.268 1.00 . A A . 14 ARG HH22 1 1 10 8951 1 1 14 ARG N N 1.038 -8.821 -4.469 1.00 . A A . 14 ARG N 1 1 10 8952 1 1 14 ARG NE N 3.048 -14.387 -2.758 1.00 . A A . 14 ARG NE 1 1 10 8953 1 1 14 ARG NH1 N 2.369 -16.074 -4.176 1.00 . A A . 14 ARG NH1 1 1 10 8954 1 1 14 ARG NH2 N 3.159 -16.584 -2.083 1.00 . A A . 14 ARG NH2 1 1 10 8955 1 1 14 ARG O O 2.821 -9.125 -1.405 1.00 . A A . 14 ARG O 1 1 10 8956 1 1 15 ALA C C 3.603 -6.232 -1.423 1.00 . A A . 15 ALA C 1 1 10 8957 1 1 15 ALA CA C 4.257 -7.044 -2.536 1.00 . A A . 15 ALA CA 1 1 10 8958 1 1 15 ALA CB C 4.952 -6.122 -3.526 1.00 . A A . 15 ALA CB 1 1 10 8959 1 1 15 ALA H H 3.083 -7.708 -4.166 1.00 . A A . 15 ALA H 1 1 10 8960 1 1 15 ALA HA H 5.001 -7.696 -2.101 1.00 . A A . 15 ALA HA 1 1 10 8961 1 1 15 ALA HB1 H 5.180 -6.671 -4.428 1.00 . A A . 15 ALA HB1 1 1 10 8962 1 1 15 ALA HB2 H 5.866 -5.749 -3.090 1.00 . A A . 15 ALA HB2 1 1 10 8963 1 1 15 ALA HB3 H 4.301 -5.293 -3.763 1.00 . A A . 15 ALA HB3 1 1 10 8964 1 1 15 ALA N N 3.275 -7.876 -3.220 1.00 . A A . 15 ALA N 1 1 10 8965 1 1 15 ALA O O 4.102 -6.187 -0.298 1.00 . A A . 15 ALA O 1 1 10 8966 1 1 16 VAL C C 1.287 -5.628 0.400 1.00 . A A . 16 VAL C 1 1 10 8967 1 1 16 VAL CA C 1.763 -4.779 -0.774 1.00 . A A . 16 VAL CA 1 1 10 8968 1 1 16 VAL CB C 0.540 -4.064 -1.399 1.00 . A A . 16 VAL CB 1 1 10 8969 1 1 16 VAL CG1 C 0.398 -2.672 -0.817 1.00 . A A . 16 VAL CG1 1 1 10 8970 1 1 16 VAL CG2 C 0.646 -3.992 -2.918 1.00 . A A . 16 VAL CG2 1 1 10 8971 1 1 16 VAL H H 2.139 -5.665 -2.655 1.00 . A A . 16 VAL H 1 1 10 8972 1 1 16 VAL HA H 2.441 -4.025 -0.404 1.00 . A A . 16 VAL HA 1 1 10 8973 1 1 16 VAL HB H -0.348 -4.627 -1.146 1.00 . A A . 16 VAL HB 1 1 10 8974 1 1 16 VAL HG11 H 1.303 -2.115 -1.007 1.00 . A A . 16 VAL HG11 1 1 10 8975 1 1 16 VAL HG12 H 0.234 -2.742 0.247 1.00 . A A . 16 VAL HG12 1 1 10 8976 1 1 16 VAL HG13 H -0.437 -2.171 -1.283 1.00 . A A . 16 VAL HG13 1 1 10 8977 1 1 16 VAL HG21 H -0.011 -3.219 -3.288 1.00 . A A . 16 VAL HG21 1 1 10 8978 1 1 16 VAL HG22 H 0.357 -4.942 -3.344 1.00 . A A . 16 VAL HG22 1 1 10 8979 1 1 16 VAL HG23 H 1.664 -3.766 -3.197 1.00 . A A . 16 VAL HG23 1 1 10 8980 1 1 16 VAL N N 2.484 -5.590 -1.745 1.00 . A A . 16 VAL N 1 1 10 8981 1 1 16 VAL O O 1.287 -5.177 1.546 1.00 . A A . 16 VAL O 1 1 10 8982 1 1 17 ALA C C 1.541 -8.215 2.051 1.00 . A A . 17 ALA C 1 1 10 8983 1 1 17 ALA CA C 0.404 -7.772 1.137 1.00 . A A . 17 ALA CA 1 1 10 8984 1 1 17 ALA CB C -0.265 -8.980 0.499 1.00 . A A . 17 ALA CB 1 1 10 8985 1 1 17 ALA H H 0.906 -7.161 -0.826 1.00 . A A . 17 ALA H 1 1 10 8986 1 1 17 ALA HA H -0.337 -7.251 1.726 1.00 . A A . 17 ALA HA 1 1 10 8987 1 1 17 ALA HB1 H -1.184 -9.202 1.021 1.00 . A A . 17 ALA HB1 1 1 10 8988 1 1 17 ALA HB2 H 0.397 -9.833 0.559 1.00 . A A . 17 ALA HB2 1 1 10 8989 1 1 17 ALA HB3 H -0.481 -8.768 -0.538 1.00 . A A . 17 ALA HB3 1 1 10 8990 1 1 17 ALA N N 0.883 -6.859 0.107 1.00 . A A . 17 ALA N 1 1 10 8991 1 1 17 ALA O O 1.334 -8.463 3.240 1.00 . A A . 17 ALA O 1 1 10 8992 1 1 18 LYS C C 4.427 -7.582 3.125 1.00 . A A . 18 LYS C 1 1 10 8993 1 1 18 LYS CA C 3.911 -8.726 2.257 1.00 . A A . 18 LYS CA 1 1 10 8994 1 1 18 LYS CB C 5.017 -9.212 1.314 1.00 . A A . 18 LYS CB 1 1 10 8995 1 1 18 LYS CD C 5.674 -11.364 0.186 1.00 . A A . 18 LYS CD 1 1 10 8996 1 1 18 LYS CE C 4.887 -12.657 0.047 1.00 . A A . 18 LYS CE 1 1 10 8997 1 1 18 LYS CG C 5.385 -10.673 1.512 1.00 . A A . 18 LYS CG 1 1 10 8998 1 1 18 LYS H H 2.842 -8.101 0.538 1.00 . A A . 18 LYS H 1 1 10 8999 1 1 18 LYS HA H 3.615 -9.543 2.897 1.00 . A A . 18 LYS HA 1 1 10 9000 1 1 18 LYS HB2 H 4.688 -9.080 0.294 1.00 . A A . 18 LYS HB2 1 1 10 9001 1 1 18 LYS HB3 H 5.903 -8.615 1.476 1.00 . A A . 18 LYS HB3 1 1 10 9002 1 1 18 LYS HD2 H 5.400 -10.700 -0.622 1.00 . A A . 18 LYS HD2 1 1 10 9003 1 1 18 LYS HD3 H 6.729 -11.587 0.131 1.00 . A A . 18 LYS HD3 1 1 10 9004 1 1 18 LYS HE2 H 5.014 -13.035 -0.956 1.00 . A A . 18 LYS HE2 1 1 10 9005 1 1 18 LYS HE3 H 5.273 -13.376 0.754 1.00 . A A . 18 LYS HE3 1 1 10 9006 1 1 18 LYS HG2 H 6.266 -10.732 2.133 1.00 . A A . 18 LYS HG2 1 1 10 9007 1 1 18 LYS HG3 H 4.564 -11.177 2.000 1.00 . A A . 18 LYS HG3 1 1 10 9008 1 1 18 LYS HZ1 H 2.877 -13.157 -0.222 1.00 . A A . 18 LYS HZ1 1 1 10 9009 1 1 18 LYS HZ2 H 3.146 -11.502 0.002 1.00 . A A . 18 LYS HZ2 1 1 10 9010 1 1 18 LYS HZ3 H 3.233 -12.558 1.320 1.00 . A A . 18 LYS HZ3 1 1 10 9011 1 1 18 LYS N N 2.741 -8.313 1.491 1.00 . A A . 18 LYS N 1 1 10 9012 1 1 18 LYS NZ N 3.435 -12.454 0.305 1.00 . A A . 18 LYS NZ 1 1 10 9013 1 1 18 LYS O O 5.013 -7.809 4.184 1.00 . A A . 18 LYS O 1 1 10 9014 1 1 19 ALA C C 3.859 -4.989 4.686 1.00 . A A . 19 ALA C 1 1 10 9015 1 1 19 ALA CA C 4.654 -5.174 3.398 1.00 . A A . 19 ALA CA 1 1 10 9016 1 1 19 ALA CB C 4.535 -3.937 2.521 1.00 . A A . 19 ALA CB 1 1 10 9017 1 1 19 ALA H H 3.740 -6.238 1.816 1.00 . A A . 19 ALA H 1 1 10 9018 1 1 19 ALA HA H 5.697 -5.309 3.647 1.00 . A A . 19 ALA HA 1 1 10 9019 1 1 19 ALA HB1 H 3.720 -4.068 1.825 1.00 . A A . 19 ALA HB1 1 1 10 9020 1 1 19 ALA HB2 H 5.456 -3.792 1.976 1.00 . A A . 19 ALA HB2 1 1 10 9021 1 1 19 ALA HB3 H 4.343 -3.074 3.141 1.00 . A A . 19 ALA HB3 1 1 10 9022 1 1 19 ALA N N 4.210 -6.354 2.667 1.00 . A A . 19 ALA N 1 1 10 9023 1 1 19 ALA O O 4.432 -4.851 5.767 1.00 . A A . 19 ALA O 1 1 10 9024 1 1 20 LEU C C 1.508 -6.115 6.489 1.00 . A A . 20 LEU C 1 1 10 9025 1 1 20 LEU CA C 1.662 -4.808 5.718 1.00 . A A . 20 LEU CA 1 1 10 9026 1 1 20 LEU CB C 0.290 -4.299 5.274 1.00 . A A . 20 LEU CB 1 1 10 9027 1 1 20 LEU CD1 C -0.906 -3.226 3.350 1.00 . A A . 20 LEU CD1 1 1 10 9028 1 1 20 LEU CD2 C 0.411 -1.818 4.944 1.00 . A A . 20 LEU CD2 1 1 10 9029 1 1 20 LEU CG C 0.321 -3.166 4.247 1.00 . A A . 20 LEU CG 1 1 10 9030 1 1 20 LEU H H 2.137 -5.092 3.675 1.00 . A A . 20 LEU H 1 1 10 9031 1 1 20 LEU HA H 2.115 -4.074 6.368 1.00 . A A . 20 LEU HA 1 1 10 9032 1 1 20 LEU HB2 H -0.257 -5.128 4.849 1.00 . A A . 20 LEU HB2 1 1 10 9033 1 1 20 LEU HB3 H -0.240 -3.948 6.146 1.00 . A A . 20 LEU HB3 1 1 10 9034 1 1 20 LEU HD11 H -1.212 -2.222 3.092 1.00 . A A . 20 LEU HD11 1 1 10 9035 1 1 20 LEU HD12 H -1.709 -3.723 3.873 1.00 . A A . 20 LEU HD12 1 1 10 9036 1 1 20 LEU HD13 H -0.668 -3.773 2.450 1.00 . A A . 20 LEU HD13 1 1 10 9037 1 1 20 LEU HD21 H -0.493 -1.643 5.508 1.00 . A A . 20 LEU HD21 1 1 10 9038 1 1 20 LEU HD22 H 0.532 -1.038 4.206 1.00 . A A . 20 LEU HD22 1 1 10 9039 1 1 20 LEU HD23 H 1.259 -1.813 5.613 1.00 . A A . 20 LEU HD23 1 1 10 9040 1 1 20 LEU HG H 1.196 -3.280 3.621 1.00 . A A . 20 LEU HG 1 1 10 9041 1 1 20 LEU N N 2.536 -4.981 4.564 1.00 . A A . 20 LEU N 1 1 10 9042 1 1 20 LEU O O 1.365 -6.113 7.712 1.00 . A A . 20 LEU O 1 1 10 9043 1 1 21 GLY C C 0.054 -9.172 6.116 1.00 . A A . 21 GLY C 1 1 10 9044 1 1 21 GLY CA C 1.397 -8.528 6.400 1.00 . A A . 21 GLY CA 1 1 10 9045 1 1 21 GLY H H 1.652 -7.170 4.796 1.00 . A A . 21 GLY H 1 1 10 9046 1 1 21 GLY HA2 H 2.180 -9.178 6.037 1.00 . A A . 21 GLY HA2 1 1 10 9047 1 1 21 GLY HA3 H 1.508 -8.410 7.468 1.00 . A A . 21 GLY HA3 1 1 10 9048 1 1 21 GLY N N 1.536 -7.230 5.766 1.00 . A A . 21 GLY N 1 1 10 9049 1 1 21 GLY O O -0.433 -9.980 6.907 1.00 . A A . 21 GLY O 1 1 10 9050 1 1 22 ILE C C -1.716 -10.230 3.350 1.00 . A A . 22 ILE C 1 1 10 9051 1 1 22 ILE CA C -1.839 -9.361 4.598 1.00 . A A . 22 ILE CA 1 1 10 9052 1 1 22 ILE CB C -2.867 -8.244 4.333 1.00 . A A . 22 ILE CB 1 1 10 9053 1 1 22 ILE CD1 C -3.366 -6.254 2.827 1.00 . A A . 22 ILE CD1 1 1 10 9054 1 1 22 ILE CG1 C -2.358 -7.306 3.236 1.00 . A A . 22 ILE CG1 1 1 10 9055 1 1 22 ILE CG2 C -3.150 -7.472 5.611 1.00 . A A . 22 ILE CG2 1 1 10 9056 1 1 22 ILE H H -0.106 -8.165 4.396 1.00 . A A . 22 ILE H 1 1 10 9057 1 1 22 ILE HA H -2.202 -9.970 5.414 1.00 . A A . 22 ILE HA 1 1 10 9058 1 1 22 ILE HB H -3.787 -8.702 4.006 1.00 . A A . 22 ILE HB 1 1 10 9059 1 1 22 ILE HD11 H -4.115 -6.703 2.190 1.00 . A A . 22 ILE HD11 1 1 10 9060 1 1 22 ILE HD12 H -2.863 -5.464 2.289 1.00 . A A . 22 ILE HD12 1 1 10 9061 1 1 22 ILE HD13 H -3.839 -5.847 3.707 1.00 . A A . 22 ILE HD13 1 1 10 9062 1 1 22 ILE HG12 H -1.474 -6.797 3.588 1.00 . A A . 22 ILE HG12 1 1 10 9063 1 1 22 ILE HG13 H -2.110 -7.888 2.361 1.00 . A A . 22 ILE HG13 1 1 10 9064 1 1 22 ILE HG21 H -2.294 -7.532 6.267 1.00 . A A . 22 ILE HG21 1 1 10 9065 1 1 22 ILE HG22 H -4.012 -7.895 6.105 1.00 . A A . 22 ILE HG22 1 1 10 9066 1 1 22 ILE HG23 H -3.347 -6.436 5.370 1.00 . A A . 22 ILE HG23 1 1 10 9067 1 1 22 ILE N N -0.546 -8.814 4.985 1.00 . A A . 22 ILE N 1 1 10 9068 1 1 22 ILE O O -0.622 -10.415 2.816 1.00 . A A . 22 ILE O 1 1 10 9069 1 1 23 SER C C -3.170 -10.787 0.454 1.00 . A A . 23 SER C 1 1 10 9070 1 1 23 SER CA C -2.861 -11.607 1.703 1.00 . A A . 23 SER CA 1 1 10 9071 1 1 23 SER CB C -3.895 -12.723 1.863 1.00 . A A . 23 SER CB 1 1 10 9072 1 1 23 SER H H -3.686 -10.575 3.357 1.00 . A A . 23 SER H 1 1 10 9073 1 1 23 SER HA H -1.881 -12.048 1.597 1.00 . A A . 23 SER HA 1 1 10 9074 1 1 23 SER HB2 H -4.741 -12.350 2.423 1.00 . A A . 23 SER HB2 1 1 10 9075 1 1 23 SER HB3 H -4.225 -13.048 0.887 1.00 . A A . 23 SER HB3 1 1 10 9076 1 1 23 SER HG H -3.136 -13.577 3.455 1.00 . A A . 23 SER HG 1 1 10 9077 1 1 23 SER N N -2.844 -10.759 2.890 1.00 . A A . 23 SER N 1 1 10 9078 1 1 23 SER O O -3.646 -9.656 0.544 1.00 . A A . 23 SER O 1 1 10 9079 1 1 23 SER OG O -3.346 -13.832 2.553 1.00 . A A . 23 SER OG 1 1 10 9080 1 1 24 ASP C C -4.621 -10.332 -2.125 1.00 . A A . 24 ASP C 1 1 10 9081 1 1 24 ASP CA C -3.144 -10.689 -1.979 1.00 . A A . 24 ASP CA 1 1 10 9082 1 1 24 ASP CB C -2.704 -11.572 -3.148 1.00 . A A . 24 ASP CB 1 1 10 9083 1 1 24 ASP CG C -3.382 -12.928 -3.136 1.00 . A A . 24 ASP CG 1 1 10 9084 1 1 24 ASP H H -2.517 -12.270 -0.718 1.00 . A A . 24 ASP H 1 1 10 9085 1 1 24 ASP HA H -2.564 -9.779 -1.988 1.00 . A A . 24 ASP HA 1 1 10 9086 1 1 24 ASP HB2 H -2.948 -11.077 -4.076 1.00 . A A . 24 ASP HB2 1 1 10 9087 1 1 24 ASP HB3 H -1.636 -11.723 -3.095 1.00 . A A . 24 ASP HB3 1 1 10 9088 1 1 24 ASP N N -2.896 -11.366 -0.711 1.00 . A A . 24 ASP N 1 1 10 9089 1 1 24 ASP O O -4.968 -9.327 -2.746 1.00 . A A . 24 ASP O 1 1 10 9090 1 1 24 ASP OD1 O -3.552 -13.497 -2.037 1.00 . A A . 24 ASP OD1 1 1 10 9091 1 1 24 ASP OD2 O -3.745 -13.420 -4.225 1.00 . A A . 24 ASP OD2 1 1 10 9092 1 1 25 ALA C C -7.307 -9.639 -0.908 1.00 . A A . 25 ALA C 1 1 10 9093 1 1 25 ALA CA C -6.923 -10.935 -1.614 1.00 . A A . 25 ALA CA 1 1 10 9094 1 1 25 ALA CB C -7.670 -12.111 -1.005 1.00 . A A . 25 ALA CB 1 1 10 9095 1 1 25 ALA H H -5.145 -11.945 -1.068 1.00 . A A . 25 ALA H 1 1 10 9096 1 1 25 ALA HA H -7.200 -10.862 -2.655 1.00 . A A . 25 ALA HA 1 1 10 9097 1 1 25 ALA HB1 H -7.952 -11.872 0.010 1.00 . A A . 25 ALA HB1 1 1 10 9098 1 1 25 ALA HB2 H -7.030 -12.982 -1.004 1.00 . A A . 25 ALA HB2 1 1 10 9099 1 1 25 ALA HB3 H -8.556 -12.314 -1.586 1.00 . A A . 25 ALA HB3 1 1 10 9100 1 1 25 ALA N N -5.484 -11.162 -1.548 1.00 . A A . 25 ALA N 1 1 10 9101 1 1 25 ALA O O -8.154 -8.886 -1.390 1.00 . A A . 25 ALA O 1 1 10 9102 1 1 26 ALA C C -6.611 -6.926 0.208 1.00 . A A . 26 ALA C 1 1 10 9103 1 1 26 ALA CA C -6.954 -8.179 1.007 1.00 . A A . 26 ALA CA 1 1 10 9104 1 1 26 ALA CB C -6.179 -8.203 2.316 1.00 . A A . 26 ALA CB 1 1 10 9105 1 1 26 ALA H H -6.013 -10.023 0.567 1.00 . A A . 26 ALA H 1 1 10 9106 1 1 26 ALA HA H -8.008 -8.168 1.240 1.00 . A A . 26 ALA HA 1 1 10 9107 1 1 26 ALA HB1 H -6.590 -8.962 2.964 1.00 . A A . 26 ALA HB1 1 1 10 9108 1 1 26 ALA HB2 H -6.256 -7.238 2.796 1.00 . A A . 26 ALA HB2 1 1 10 9109 1 1 26 ALA HB3 H -5.141 -8.424 2.115 1.00 . A A . 26 ALA HB3 1 1 10 9110 1 1 26 ALA N N -6.678 -9.384 0.234 1.00 . A A . 26 ALA N 1 1 10 9111 1 1 26 ALA O O -7.310 -5.915 0.290 1.00 . A A . 26 ALA O 1 1 10 9112 1 1 27 VAL C C -6.098 -5.576 -2.488 1.00 . A A . 27 VAL C 1 1 10 9113 1 1 27 VAL CA C -5.097 -5.871 -1.377 1.00 . A A . 27 VAL CA 1 1 10 9114 1 1 27 VAL CB C -3.713 -6.132 -2.003 1.00 . A A . 27 VAL CB 1 1 10 9115 1 1 27 VAL CG1 C -3.209 -4.893 -2.729 1.00 . A A . 27 VAL CG1 1 1 10 9116 1 1 27 VAL CG2 C -2.722 -6.575 -0.938 1.00 . A A . 27 VAL CG2 1 1 10 9117 1 1 27 VAL H H -5.016 -7.833 -0.587 1.00 . A A . 27 VAL H 1 1 10 9118 1 1 27 VAL HA H -5.021 -5.006 -0.735 1.00 . A A . 27 VAL HA 1 1 10 9119 1 1 27 VAL HB H -3.813 -6.929 -2.726 1.00 . A A . 27 VAL HB 1 1 10 9120 1 1 27 VAL HG11 H -3.970 -4.540 -3.408 1.00 . A A . 27 VAL HG11 1 1 10 9121 1 1 27 VAL HG12 H -2.316 -5.139 -3.284 1.00 . A A . 27 VAL HG12 1 1 10 9122 1 1 27 VAL HG13 H -2.984 -4.121 -2.007 1.00 . A A . 27 VAL HG13 1 1 10 9123 1 1 27 VAL HG21 H -1.716 -6.380 -1.280 1.00 . A A . 27 VAL HG21 1 1 10 9124 1 1 27 VAL HG22 H -2.840 -7.633 -0.754 1.00 . A A . 27 VAL HG22 1 1 10 9125 1 1 27 VAL HG23 H -2.904 -6.029 -0.026 1.00 . A A . 27 VAL HG23 1 1 10 9126 1 1 27 VAL N N -5.532 -6.998 -0.564 1.00 . A A . 27 VAL N 1 1 10 9127 1 1 27 VAL O O -6.546 -4.439 -2.649 1.00 . A A . 27 VAL O 1 1 10 9128 1 1 28 SER C C -8.788 -6.109 -3.822 1.00 . A A . 28 SER C 1 1 10 9129 1 1 28 SER CA C -7.398 -6.453 -4.348 1.00 . A A . 28 SER CA 1 1 10 9130 1 1 28 SER CB C -7.459 -7.738 -5.179 1.00 . A A . 28 SER CB 1 1 10 9131 1 1 28 SER H H -6.059 -7.485 -3.076 1.00 . A A . 28 SER H 1 1 10 9132 1 1 28 SER HA H -7.054 -5.646 -4.978 1.00 . A A . 28 SER HA 1 1 10 9133 1 1 28 SER HB2 H -6.461 -8.126 -5.310 1.00 . A A . 28 SER HB2 1 1 10 9134 1 1 28 SER HB3 H -8.065 -8.469 -4.662 1.00 . A A . 28 SER HB3 1 1 10 9135 1 1 28 SER HG H -8.816 -6.957 -6.357 1.00 . A A . 28 SER HG 1 1 10 9136 1 1 28 SER N N -6.449 -6.603 -3.253 1.00 . A A . 28 SER N 1 1 10 9137 1 1 28 SER O O -9.551 -5.396 -4.473 1.00 . A A . 28 SER O 1 1 10 9138 1 1 28 SER OG O -8.026 -7.495 -6.454 1.00 . A A . 28 SER OG 1 1 10 9139 1 1 29 GLN C C -10.570 -4.888 -1.676 1.00 . A A . 29 GLN C 1 1 10 9140 1 1 29 GLN CA C -10.400 -6.367 -2.022 1.00 . A A . 29 GLN CA 1 1 10 9141 1 1 29 GLN CB C -10.560 -7.218 -0.760 1.00 . A A . 29 GLN CB 1 1 10 9142 1 1 29 GLN CD C -12.260 -8.390 0.699 1.00 . A A . 29 GLN CD 1 1 10 9143 1 1 29 GLN CG C -11.970 -7.193 -0.187 1.00 . A A . 29 GLN CG 1 1 10 9144 1 1 29 GLN H H -8.458 -7.181 -2.167 1.00 . A A . 29 GLN H 1 1 10 9145 1 1 29 GLN HA H -11.170 -6.645 -2.731 1.00 . A A . 29 GLN HA 1 1 10 9146 1 1 29 GLN HB2 H -10.310 -8.241 -0.995 1.00 . A A . 29 GLN HB2 1 1 10 9147 1 1 29 GLN HB3 H -9.888 -6.852 -0.004 1.00 . A A . 29 GLN HB3 1 1 10 9148 1 1 29 GLN HE21 H -11.850 -9.630 -0.799 1.00 . A A . 29 GLN HE21 1 1 10 9149 1 1 29 GLN HE22 H -12.310 -10.377 0.690 1.00 . A A . 29 GLN HE22 1 1 10 9150 1 1 29 GLN HG2 H -12.090 -6.294 0.399 1.00 . A A . 29 GLN HG2 1 1 10 9151 1 1 29 GLN HG3 H -12.680 -7.189 -1.003 1.00 . A A . 29 GLN HG3 1 1 10 9152 1 1 29 GLN N N -9.109 -6.620 -2.637 1.00 . A A . 29 GLN N 1 1 10 9153 1 1 29 GLN NE2 N -12.120 -9.586 0.140 1.00 . A A . 29 GLN NE2 1 1 10 9154 1 1 29 GLN O O -11.690 -4.397 -1.542 1.00 . A A . 29 GLN O 1 1 10 9155 1 1 29 GLN OE1 O -12.600 -8.240 1.872 1.00 . A A . 29 GLN OE1 1 1 10 9156 1 1 30 TRP C C -10.340 -1.982 -2.190 1.00 . A A . 30 TRP C 1 1 10 9157 1 1 30 TRP CA C -9.482 -2.763 -1.198 1.00 . A A . 30 TRP CA 1 1 10 9158 1 1 30 TRP CB C -8.061 -2.194 -1.183 1.00 . A A . 30 TRP CB 1 1 10 9159 1 1 30 TRP CD1 C -7.681 -3.259 1.119 1.00 . A A . 30 TRP CD1 1 1 10 9160 1 1 30 TRP CD2 C -5.802 -2.650 0.065 1.00 . A A . 30 TRP CD2 1 1 10 9161 1 1 30 TRP CE2 C -5.457 -3.216 1.307 1.00 . A A . 30 TRP CE2 1 1 10 9162 1 1 30 TRP CE3 C -4.782 -2.194 -0.773 1.00 . A A . 30 TRP CE3 1 1 10 9163 1 1 30 TRP CG C -7.231 -2.687 -0.037 1.00 . A A . 30 TRP CG 1 1 10 9164 1 1 30 TRP CH2 C -3.157 -2.882 0.887 1.00 . A A . 30 TRP CH2 1 1 10 9165 1 1 30 TRP CZ2 C -4.136 -3.337 1.729 1.00 . A A . 30 TRP CZ2 1 1 10 9166 1 1 30 TRP CZ3 C -3.470 -2.314 -0.354 1.00 . A A . 30 TRP CZ3 1 1 10 9167 1 1 30 TRP H H -8.589 -4.629 -1.646 1.00 . A A . 30 TRP H 1 1 10 9168 1 1 30 TRP HA H -9.909 -2.661 -0.213 1.00 . A A . 30 TRP HA 1 1 10 9169 1 1 30 TRP HB2 H -7.560 -2.472 -2.098 1.00 . A A . 30 TRP HB2 1 1 10 9170 1 1 30 TRP HB3 H -8.113 -1.118 -1.120 1.00 . A A . 30 TRP HB3 1 1 10 9171 1 1 30 TRP HD1 H -8.724 -3.427 1.347 1.00 . A A . 30 TRP HD1 1 1 10 9172 1 1 30 TRP HE1 H -6.689 -4.001 2.814 1.00 . A A . 30 TRP HE1 1 1 10 9173 1 1 30 TRP HE3 H -5.003 -1.752 -1.734 1.00 . A A . 30 TRP HE3 1 1 10 9174 1 1 30 TRP HH2 H -2.119 -2.956 1.175 1.00 . A A . 30 TRP HH2 1 1 10 9175 1 1 30 TRP HZ2 H -3.877 -3.774 2.681 1.00 . A A . 30 TRP HZ2 1 1 10 9176 1 1 30 TRP HZ3 H -2.669 -1.965 -0.989 1.00 . A A . 30 TRP HZ3 1 1 10 9177 1 1 30 TRP N N -9.454 -4.185 -1.530 1.00 . A A . 30 TRP N 1 1 10 9178 1 1 30 TRP NE1 N -6.622 -3.580 1.932 1.00 . A A . 30 TRP NE1 1 1 10 9179 1 1 30 TRP O O -10.640 -2.466 -3.280 1.00 . A A . 30 TRP O 1 1 10 9180 1 1 31 LYS C C -10.740 1.275 -3.160 1.00 . A A . 31 LYS C 1 1 10 9181 1 1 31 LYS CA C -11.540 0.081 -2.651 1.00 . A A . 31 LYS CA 1 1 10 9182 1 1 31 LYS CB C -12.780 0.565 -1.882 1.00 . A A . 31 LYS CB 1 1 10 9183 1 1 31 LYS CD C -13.430 -0.276 0.400 1.00 . A A . 31 LYS CD 1 1 10 9184 1 1 31 LYS CE C -14.780 -0.550 1.053 1.00 . A A . 31 LYS CE 1 1 10 9185 1 1 31 LYS CG C -13.470 -0.538 -1.100 1.00 . A A . 31 LYS CG 1 1 10 9186 1 1 31 LYS H H -10.450 -0.443 -0.920 1.00 . A A . 31 LYS H 1 1 10 9187 1 1 31 LYS HA H -11.870 -0.506 -3.498 1.00 . A A . 31 LYS HA 1 1 10 9188 1 1 31 LYS HB2 H -12.470 1.336 -1.189 1.00 . A A . 31 LYS HB2 1 1 10 9189 1 1 31 LYS HB3 H -13.480 0.980 -2.584 1.00 . A A . 31 LYS HB3 1 1 10 9190 1 1 31 LYS HD2 H -12.690 -0.919 0.846 1.00 . A A . 31 LYS HD2 1 1 10 9191 1 1 31 LYS HD3 H -13.160 0.758 0.568 1.00 . A A . 31 LYS HD3 1 1 10 9192 1 1 31 LYS HE2 H -15.410 -1.067 0.346 1.00 . A A . 31 LYS HE2 1 1 10 9193 1 1 31 LYS HE3 H -14.620 -1.175 1.920 1.00 . A A . 31 LYS HE3 1 1 10 9194 1 1 31 LYS HG2 H -14.500 -0.592 -1.415 1.00 . A A . 31 LYS HG2 1 1 10 9195 1 1 31 LYS HG3 H -12.980 -1.477 -1.304 1.00 . A A . 31 LYS HG3 1 1 10 9196 1 1 31 LYS HZ1 H -14.750 1.443 1.679 1.00 . A A . 31 LYS HZ1 1 1 10 9197 1 1 31 LYS HZ2 H -16.020 0.537 2.335 1.00 . A A . 31 LYS HZ2 1 1 10 9198 1 1 31 LYS HZ3 H -16.090 1.045 0.722 1.00 . A A . 31 LYS HZ3 1 1 10 9199 1 1 31 LYS N N -10.720 -0.771 -1.801 1.00 . A A . 31 LYS N 1 1 10 9200 1 1 31 LYS NZ N -15.460 0.705 1.477 1.00 . A A . 31 LYS NZ 1 1 10 9201 1 1 31 LYS O O -9.515 1.275 -3.102 1.00 . A A . 31 LYS O 1 1 10 9202 1 1 32 GLU C C -9.770 4.036 -3.178 1.00 . A A . 32 GLU C 1 1 10 9203 1 1 32 GLU CA C -10.790 3.494 -4.174 1.00 . A A . 32 GLU CA 1 1 10 9204 1 1 32 GLU CB C -11.830 4.567 -4.493 1.00 . A A . 32 GLU CB 1 1 10 9205 1 1 32 GLU CD C -13.330 5.537 -6.282 1.00 . A A . 32 GLU CD 1 1 10 9206 1 1 32 GLU CG C -12.050 4.780 -5.982 1.00 . A A . 32 GLU CG 1 1 10 9207 1 1 32 GLU H H -12.420 2.236 -3.677 1.00 . A A . 32 GLU H 1 1 10 9208 1 1 32 GLU HA H -10.270 3.224 -5.084 1.00 . A A . 32 GLU HA 1 1 10 9209 1 1 32 GLU HB2 H -12.770 4.278 -4.051 1.00 . A A . 32 GLU HB2 1 1 10 9210 1 1 32 GLU HB3 H -11.510 5.505 -4.060 1.00 . A A . 32 GLU HB3 1 1 10 9211 1 1 32 GLU HG2 H -11.220 5.341 -6.378 1.00 . A A . 32 GLU HG2 1 1 10 9212 1 1 32 GLU HG3 H -12.100 3.816 -6.467 1.00 . A A . 32 GLU HG3 1 1 10 9213 1 1 32 GLU N N -11.440 2.294 -3.656 1.00 . A A . 32 GLU N 1 1 10 9214 1 1 32 GLU O O -8.734 4.578 -3.567 1.00 . A A . 32 GLU O 1 1 10 9215 1 1 32 GLU OE1 O -14.400 4.901 -6.299 1.00 . A A . 32 GLU OE1 1 1 10 9216 1 1 32 GLU OE2 O -13.260 6.764 -6.499 1.00 . A A . 32 GLU OE2 1 1 10 9217 1 1 33 VAL C C -8.780 3.219 0.094 1.00 . A A . 33 VAL C 1 1 10 9218 1 1 33 VAL CA C -9.174 4.358 -0.840 1.00 . A A . 33 VAL CA 1 1 10 9219 1 1 33 VAL CB C -9.822 5.485 -0.014 1.00 . A A . 33 VAL CB 1 1 10 9220 1 1 33 VAL CG1 C -8.819 6.078 0.965 1.00 . A A . 33 VAL CG1 1 1 10 9221 1 1 33 VAL CG2 C -10.380 6.562 -0.928 1.00 . A A . 33 VAL CG2 1 1 10 9222 1 1 33 VAL H H -10.900 3.445 -1.644 1.00 . A A . 33 VAL H 1 1 10 9223 1 1 33 VAL HA H -8.283 4.751 -1.309 1.00 . A A . 33 VAL HA 1 1 10 9224 1 1 33 VAL HB H -10.630 5.063 0.555 1.00 . A A . 33 VAL HB 1 1 10 9225 1 1 33 VAL HG11 H -7.817 5.929 0.588 1.00 . A A . 33 VAL HG11 1 1 10 9226 1 1 33 VAL HG12 H -8.919 5.591 1.923 1.00 . A A . 33 VAL HG12 1 1 10 9227 1 1 33 VAL HG13 H -9.007 7.135 1.077 1.00 . A A . 33 VAL HG13 1 1 10 9228 1 1 33 VAL HG21 H -10.880 7.312 -0.335 1.00 . A A . 33 VAL HG21 1 1 10 9229 1 1 33 VAL HG22 H -11.080 6.116 -1.616 1.00 . A A . 33 VAL HG22 1 1 10 9230 1 1 33 VAL HG23 H -9.580 7.021 -1.483 1.00 . A A . 33 VAL HG23 1 1 10 9231 1 1 33 VAL N N -10.060 3.886 -1.891 1.00 . A A . 33 VAL N 1 1 10 9232 1 1 33 VAL O O -9.638 2.568 0.691 1.00 . A A . 33 VAL O 1 1 10 9233 1 1 34 ILE C C -7.489 2.066 2.505 1.00 . A A . 34 ILE C 1 1 10 9234 1 1 34 ILE CA C -6.969 1.919 1.077 1.00 . A A . 34 ILE CA 1 1 10 9235 1 1 34 ILE CB C -5.428 1.902 1.104 1.00 . A A . 34 ILE CB 1 1 10 9236 1 1 34 ILE CD1 C -3.389 3.354 1.563 1.00 . A A . 34 ILE CD1 1 1 10 9237 1 1 34 ILE CG1 C -4.878 3.317 1.300 1.00 . A A . 34 ILE CG1 1 1 10 9238 1 1 34 ILE CG2 C -4.881 1.286 -0.174 1.00 . A A . 34 ILE CG2 1 1 10 9239 1 1 34 ILE H H -6.843 3.535 -0.287 1.00 . A A . 34 ILE H 1 1 10 9240 1 1 34 ILE HA H -7.311 0.976 0.677 1.00 . A A . 34 ILE HA 1 1 10 9241 1 1 34 ILE HB H -5.114 1.286 1.933 1.00 . A A . 34 ILE HB 1 1 10 9242 1 1 34 ILE HD11 H -3.117 2.530 2.205 1.00 . A A . 34 ILE HD11 1 1 10 9243 1 1 34 ILE HD12 H -3.131 4.286 2.042 1.00 . A A . 34 ILE HD12 1 1 10 9244 1 1 34 ILE HD13 H -2.857 3.270 0.626 1.00 . A A . 34 ILE HD13 1 1 10 9245 1 1 34 ILE HG12 H -5.070 3.897 0.410 1.00 . A A . 34 ILE HG12 1 1 10 9246 1 1 34 ILE HG13 H -5.377 3.778 2.140 1.00 . A A . 34 ILE HG13 1 1 10 9247 1 1 34 ILE HG21 H -4.557 0.275 0.025 1.00 . A A . 34 ILE HG21 1 1 10 9248 1 1 34 ILE HG22 H -4.043 1.869 -0.525 1.00 . A A . 34 ILE HG22 1 1 10 9249 1 1 34 ILE HG23 H -5.654 1.273 -0.927 1.00 . A A . 34 ILE HG23 1 1 10 9250 1 1 34 ILE N N -7.477 2.983 0.216 1.00 . A A . 34 ILE N 1 1 10 9251 1 1 34 ILE O O -7.775 3.175 2.959 1.00 . A A . 34 ILE O 1 1 10 9252 1 1 35 PRO C C -7.370 1.958 5.490 1.00 . A A . 35 PRO C 1 1 10 9253 1 1 35 PRO CA C -8.110 0.950 4.615 1.00 . A A . 35 PRO CA 1 1 10 9254 1 1 35 PRO CB C -7.840 -0.477 5.093 1.00 . A A . 35 PRO CB 1 1 10 9255 1 1 35 PRO CD C -7.303 -0.419 2.766 1.00 . A A . 35 PRO CD 1 1 10 9256 1 1 35 PRO CG C -7.865 -1.298 3.850 1.00 . A A . 35 PRO CG 1 1 10 9257 1 1 35 PRO HA H -9.171 1.153 4.656 1.00 . A A . 35 PRO HA 1 1 10 9258 1 1 35 PRO HB2 H -6.877 -0.522 5.580 1.00 . A A . 35 PRO HB2 1 1 10 9259 1 1 35 PRO HB3 H -8.614 -0.781 5.781 1.00 . A A . 35 PRO HB3 1 1 10 9260 1 1 35 PRO HD2 H -6.236 -0.559 2.682 1.00 . A A . 35 PRO HD2 1 1 10 9261 1 1 35 PRO HD3 H -7.788 -0.626 1.823 1.00 . A A . 35 PRO HD3 1 1 10 9262 1 1 35 PRO HG2 H -7.251 -2.176 3.978 1.00 . A A . 35 PRO HG2 1 1 10 9263 1 1 35 PRO HG3 H -8.881 -1.579 3.615 1.00 . A A . 35 PRO HG3 1 1 10 9264 1 1 35 PRO N N -7.620 0.945 3.233 1.00 . A A . 35 PRO N 1 1 10 9265 1 1 35 PRO O O -6.241 2.348 5.189 1.00 . A A . 35 PRO O 1 1 10 9266 1 1 36 GLU C C -6.208 2.760 8.201 1.00 . A A . 36 GLU C 1 1 10 9267 1 1 36 GLU CA C -7.429 3.343 7.493 1.00 . A A . 36 GLU CA 1 1 10 9268 1 1 36 GLU CB C -8.469 3.784 8.526 1.00 . A A . 36 GLU CB 1 1 10 9269 1 1 36 GLU CD C -8.626 4.687 10.879 1.00 . A A . 36 GLU CD 1 1 10 9270 1 1 36 GLU CG C -7.946 4.798 9.528 1.00 . A A . 36 GLU CG 1 1 10 9271 1 1 36 GLU H H -8.916 2.032 6.752 1.00 . A A . 36 GLU H 1 1 10 9272 1 1 36 GLU HA H -7.119 4.203 6.919 1.00 . A A . 36 GLU HA 1 1 10 9273 1 1 36 GLU HB2 H -9.309 4.223 8.006 1.00 . A A . 36 GLU HB2 1 1 10 9274 1 1 36 GLU HB3 H -8.810 2.915 9.069 1.00 . A A . 36 GLU HB3 1 1 10 9275 1 1 36 GLU HG2 H -6.887 4.640 9.663 1.00 . A A . 36 GLU HG2 1 1 10 9276 1 1 36 GLU HG3 H -8.114 5.791 9.138 1.00 . A A . 36 GLU HG3 1 1 10 9277 1 1 36 GLU N N -8.018 2.377 6.571 1.00 . A A . 36 GLU N 1 1 10 9278 1 1 36 GLU O O -5.296 3.490 8.585 1.00 . A A . 36 GLU O 1 1 10 9279 1 1 36 GLU OE1 O -8.619 3.580 11.458 1.00 . A A . 36 GLU OE1 1 1 10 9280 1 1 36 GLU OE2 O -9.165 5.708 11.358 1.00 . A A . 36 GLU OE2 1 1 10 9281 1 1 37 LYS C C -4.011 0.348 8.061 1.00 . A A . 37 LYS C 1 1 10 9282 1 1 37 LYS CA C -5.093 0.771 9.050 1.00 . A A . 37 LYS CA 1 1 10 9283 1 1 37 LYS CB C -5.602 -0.449 9.820 1.00 . A A . 37 LYS CB 1 1 10 9284 1 1 37 LYS CD C -6.067 -1.335 12.126 1.00 . A A . 37 LYS CD 1 1 10 9285 1 1 37 LYS CE C -6.827 -1.090 13.419 1.00 . A A . 37 LYS CE 1 1 10 9286 1 1 37 LYS CG C -6.113 -0.120 11.213 1.00 . A A . 37 LYS CG 1 1 10 9287 1 1 37 LYS H H -6.958 0.911 8.057 1.00 . A A . 37 LYS H 1 1 10 9288 1 1 37 LYS HA H -4.663 1.469 9.751 1.00 . A A . 37 LYS HA 1 1 10 9289 1 1 37 LYS HB2 H -6.407 -0.903 9.262 1.00 . A A . 37 LYS HB2 1 1 10 9290 1 1 37 LYS HB3 H -4.796 -1.162 9.916 1.00 . A A . 37 LYS HB3 1 1 10 9291 1 1 37 LYS HD2 H -6.511 -2.176 11.613 1.00 . A A . 37 LYS HD2 1 1 10 9292 1 1 37 LYS HD3 H -5.036 -1.557 12.361 1.00 . A A . 37 LYS HD3 1 1 10 9293 1 1 37 LYS HE2 H -6.519 -0.140 13.828 1.00 . A A . 37 LYS HE2 1 1 10 9294 1 1 37 LYS HE3 H -7.885 -1.060 13.199 1.00 . A A . 37 LYS HE3 1 1 10 9295 1 1 37 LYS HG2 H -5.499 0.660 11.636 1.00 . A A . 37 LYS HG2 1 1 10 9296 1 1 37 LYS HG3 H -7.135 0.224 11.138 1.00 . A A . 37 LYS HG3 1 1 10 9297 1 1 37 LYS HZ1 H -6.791 -3.089 14.023 1.00 . A A . 37 LYS HZ1 1 1 10 9298 1 1 37 LYS HZ2 H -7.163 -2.005 15.266 1.00 . A A . 37 LYS HZ2 1 1 10 9299 1 1 37 LYS HZ3 H -5.571 -2.142 14.713 1.00 . A A . 37 LYS HZ3 1 1 10 9300 1 1 37 LYS N N -6.201 1.442 8.379 1.00 . A A . 37 LYS N 1 1 10 9301 1 1 37 LYS NZ N -6.571 -2.156 14.426 1.00 . A A . 37 LYS NZ 1 1 10 9302 1 1 37 LYS O O -2.847 0.194 8.433 1.00 . A A . 37 LYS O 1 1 10 9303 1 1 38 ASP C C -2.640 0.951 5.285 1.00 . A A . 38 ASP C 1 1 10 9304 1 1 38 ASP CA C -3.442 -0.246 5.777 1.00 . A A . 38 ASP CA 1 1 10 9305 1 1 38 ASP CB C -4.169 -0.911 4.605 1.00 . A A . 38 ASP CB 1 1 10 9306 1 1 38 ASP CG C -4.228 -2.419 4.745 1.00 . A A . 38 ASP CG 1 1 10 9307 1 1 38 ASP H H -5.334 0.295 6.561 1.00 . A A . 38 ASP H 1 1 10 9308 1 1 38 ASP HA H -2.764 -0.961 6.219 1.00 . A A . 38 ASP HA 1 1 10 9309 1 1 38 ASP HB2 H -5.180 -0.533 4.556 1.00 . A A . 38 ASP HB2 1 1 10 9310 1 1 38 ASP HB3 H -3.654 -0.671 3.687 1.00 . A A . 38 ASP HB3 1 1 10 9311 1 1 38 ASP N N -4.395 0.158 6.804 1.00 . A A . 38 ASP N 1 1 10 9312 1 1 38 ASP O O -1.444 0.840 5.009 1.00 . A A . 38 ASP O 1 1 10 9313 1 1 38 ASP OD1 O -3.276 -3.000 5.308 1.00 . A A . 38 ASP OD1 1 1 10 9314 1 1 38 ASP OD2 O -5.226 -3.020 4.294 1.00 . A A . 38 ASP OD2 1 1 10 9315 1 1 39 ALA C C -1.632 3.804 5.769 1.00 . A A . 39 ALA C 1 1 10 9316 1 1 39 ALA CA C -2.647 3.320 4.738 1.00 . A A . 39 ALA CA 1 1 10 9317 1 1 39 ALA CB C -3.681 4.402 4.463 1.00 . A A . 39 ALA CB 1 1 10 9318 1 1 39 ALA H H -4.251 2.125 5.427 1.00 . A A . 39 ALA H 1 1 10 9319 1 1 39 ALA HA H -2.131 3.103 3.815 1.00 . A A . 39 ALA HA 1 1 10 9320 1 1 39 ALA HB1 H -4.517 3.974 3.930 1.00 . A A . 39 ALA HB1 1 1 10 9321 1 1 39 ALA HB2 H -3.235 5.182 3.864 1.00 . A A . 39 ALA HB2 1 1 10 9322 1 1 39 ALA HB3 H -4.024 4.817 5.398 1.00 . A A . 39 ALA HB3 1 1 10 9323 1 1 39 ALA N N -3.301 2.099 5.186 1.00 . A A . 39 ALA N 1 1 10 9324 1 1 39 ALA O O -0.672 4.496 5.430 1.00 . A A . 39 ALA O 1 1 10 9325 1 1 40 TYR C C 0.388 3.106 7.996 1.00 . A A . 40 TYR C 1 1 10 9326 1 1 40 TYR CA C -0.952 3.832 8.106 1.00 . A A . 40 TYR CA 1 1 10 9327 1 1 40 TYR CB C -1.595 3.540 9.463 1.00 . A A . 40 TYR CB 1 1 10 9328 1 1 40 TYR CD1 C -0.617 5.200 11.094 1.00 . A A . 40 TYR CD1 1 1 10 9329 1 1 40 TYR CD2 C 0.019 2.912 11.300 1.00 . A A . 40 TYR CD2 1 1 10 9330 1 1 40 TYR CE1 C 0.187 5.526 12.169 1.00 . A A . 40 TYR CE1 1 1 10 9331 1 1 40 TYR CE2 C 0.825 3.230 12.376 1.00 . A A . 40 TYR CE2 1 1 10 9332 1 1 40 TYR CG C -0.715 3.891 10.641 1.00 . A A . 40 TYR CG 1 1 10 9333 1 1 40 TYR CZ C 0.906 4.538 12.807 1.00 . A A . 40 TYR CZ 1 1 10 9334 1 1 40 TYR H H -2.632 2.882 7.238 1.00 . A A . 40 TYR H 1 1 10 9335 1 1 40 TYR HA H -0.781 4.894 8.021 1.00 . A A . 40 TYR HA 1 1 10 9336 1 1 40 TYR HB2 H -2.509 4.111 9.551 1.00 . A A . 40 TYR HB2 1 1 10 9337 1 1 40 TYR HB3 H -1.826 2.484 9.524 1.00 . A A . 40 TYR HB3 1 1 10 9338 1 1 40 TYR HD1 H -1.181 5.972 10.591 1.00 . A A . 40 TYR HD1 1 1 10 9339 1 1 40 TYR HD2 H -0.046 1.889 10.960 1.00 . A A . 40 TYR HD2 1 1 10 9340 1 1 40 TYR HE1 H 0.249 6.550 12.505 1.00 . A A . 40 TYR HE1 1 1 10 9341 1 1 40 TYR HE2 H 1.388 2.455 12.877 1.00 . A A . 40 TYR HE2 1 1 10 9342 1 1 40 TYR HH H 2.146 5.695 13.711 1.00 . A A . 40 TYR HH 1 1 10 9343 1 1 40 TYR N N -1.849 3.435 7.029 1.00 . A A . 40 TYR N 1 1 10 9344 1 1 40 TYR O O 1.442 3.738 7.925 1.00 . A A . 40 TYR O 1 1 10 9345 1 1 40 TYR OH O 1.708 4.857 13.879 1.00 . A A . 40 TYR OH 1 1 10 9346 1 1 41 ARG C C 2.309 1.273 6.599 1.00 . A A . 41 ARG C 1 1 10 9347 1 1 41 ARG CA C 1.546 0.968 7.886 1.00 . A A . 41 ARG CA 1 1 10 9348 1 1 41 ARG CB C 1.192 -0.520 7.940 1.00 . A A . 41 ARG CB 1 1 10 9349 1 1 41 ARG CD C -0.578 -1.839 9.148 1.00 . A A . 41 ARG CD 1 1 10 9350 1 1 41 ARG CG C 0.661 -0.970 9.292 1.00 . A A . 41 ARG CG 1 1 10 9351 1 1 41 ARG CZ C -1.289 -4.094 9.840 1.00 . A A . 41 ARG CZ 1 1 10 9352 1 1 41 ARG H H -0.533 1.334 8.046 1.00 . A A . 41 ARG H 1 1 10 9353 1 1 41 ARG HA H 2.176 1.209 8.729 1.00 . A A . 41 ARG HA 1 1 10 9354 1 1 41 ARG HB2 H 0.439 -0.725 7.193 1.00 . A A . 41 ARG HB2 1 1 10 9355 1 1 41 ARG HB3 H 2.077 -1.096 7.716 1.00 . A A . 41 ARG HB3 1 1 10 9356 1 1 41 ARG HD2 H -1.446 -1.254 9.413 1.00 . A A . 41 ARG HD2 1 1 10 9357 1 1 41 ARG HD3 H -0.661 -2.158 8.119 1.00 . A A . 41 ARG HD3 1 1 10 9358 1 1 41 ARG HE H 0.123 -3.011 10.746 1.00 . A A . 41 ARG HE 1 1 10 9359 1 1 41 ARG HG2 H 1.428 -1.537 9.799 1.00 . A A . 41 ARG HG2 1 1 10 9360 1 1 41 ARG HG3 H 0.411 -0.096 9.877 1.00 . A A . 41 ARG HG3 1 1 10 9361 1 1 41 ARG HH11 H -2.263 -3.367 8.224 1.00 . A A . 41 ARG HH11 1 1 10 9362 1 1 41 ARG HH12 H -2.746 -4.951 8.730 1.00 . A A . 41 ARG HH12 1 1 10 9363 1 1 41 ARG HH21 H -0.510 -5.094 11.414 1.00 . A A . 41 ARG HH21 1 1 10 9364 1 1 41 ARG HH22 H -1.750 -5.932 10.543 1.00 . A A . 41 ARG HH22 1 1 10 9365 1 1 41 ARG N N 0.337 1.779 7.985 1.00 . A A . 41 ARG N 1 1 10 9366 1 1 41 ARG NE N -0.522 -3.019 10.007 1.00 . A A . 41 ARG NE 1 1 10 9367 1 1 41 ARG NH1 N -2.171 -4.141 8.851 1.00 . A A . 41 ARG NH1 1 1 10 9368 1 1 41 ARG NH2 N -1.173 -5.124 10.667 1.00 . A A . 41 ARG NH2 1 1 10 9369 1 1 41 ARG O O 3.532 1.139 6.547 1.00 . A A . 41 ARG O 1 1 10 9370 1 1 42 LEU C C 3.274 3.065 4.436 1.00 . A A . 42 LEU C 1 1 10 9371 1 1 42 LEU CA C 2.190 2.002 4.280 1.00 . A A . 42 LEU CA 1 1 10 9372 1 1 42 LEU CB C 1.124 2.489 3.294 1.00 . A A . 42 LEU CB 1 1 10 9373 1 1 42 LEU CD1 C -0.737 1.946 1.704 1.00 . A A . 42 LEU CD1 1 1 10 9374 1 1 42 LEU CD2 C 1.457 0.758 1.511 1.00 . A A . 42 LEU CD2 1 1 10 9375 1 1 42 LEU CG C 0.455 1.389 2.468 1.00 . A A . 42 LEU CG 1 1 10 9376 1 1 42 LEU H H 0.611 1.765 5.668 1.00 . A A . 42 LEU H 1 1 10 9377 1 1 42 LEU HA H 2.638 1.101 3.892 1.00 . A A . 42 LEU HA 1 1 10 9378 1 1 42 LEU HB2 H 0.359 3.007 3.853 1.00 . A A . 42 LEU HB2 1 1 10 9379 1 1 42 LEU HB3 H 1.584 3.189 2.615 1.00 . A A . 42 LEU HB3 1 1 10 9380 1 1 42 LEU HD11 H -1.010 2.907 2.115 1.00 . A A . 42 LEU HD11 1 1 10 9381 1 1 42 LEU HD12 H -1.571 1.266 1.795 1.00 . A A . 42 LEU HD12 1 1 10 9382 1 1 42 LEU HD13 H -0.476 2.060 0.662 1.00 . A A . 42 LEU HD13 1 1 10 9383 1 1 42 LEU HD21 H 2.437 0.756 1.965 1.00 . A A . 42 LEU HD21 1 1 10 9384 1 1 42 LEU HD22 H 1.487 1.329 0.594 1.00 . A A . 42 LEU HD22 1 1 10 9385 1 1 42 LEU HD23 H 1.157 -0.256 1.295 1.00 . A A . 42 LEU HD23 1 1 10 9386 1 1 42 LEU HG H 0.094 0.616 3.132 1.00 . A A . 42 LEU HG 1 1 10 9387 1 1 42 LEU N N 1.581 1.681 5.566 1.00 . A A . 42 LEU N 1 1 10 9388 1 1 42 LEU O O 4.325 2.992 3.799 1.00 . A A . 42 LEU O 1 1 10 9389 1 1 43 GLU C C 5.295 4.594 6.043 1.00 . A A . 43 GLU C 1 1 10 9390 1 1 43 GLU CA C 3.960 5.130 5.527 1.00 . A A . 43 GLU CA 1 1 10 9391 1 1 43 GLU CB C 3.380 6.130 6.528 1.00 . A A . 43 GLU CB 1 1 10 9392 1 1 43 GLU CD C 3.915 8.127 7.979 1.00 . A A . 43 GLU CD 1 1 10 9393 1 1 43 GLU CG C 4.219 7.387 6.691 1.00 . A A . 43 GLU CG 1 1 10 9394 1 1 43 GLU H H 2.154 4.052 5.764 1.00 . A A . 43 GLU H 1 1 10 9395 1 1 43 GLU HA H 4.130 5.636 4.588 1.00 . A A . 43 GLU HA 1 1 10 9396 1 1 43 GLU HB2 H 2.394 6.421 6.199 1.00 . A A . 43 GLU HB2 1 1 10 9397 1 1 43 GLU HB3 H 3.298 5.650 7.493 1.00 . A A . 43 GLU HB3 1 1 10 9398 1 1 43 GLU HG2 H 5.262 7.111 6.692 1.00 . A A . 43 GLU HG2 1 1 10 9399 1 1 43 GLU HG3 H 4.021 8.046 5.858 1.00 . A A . 43 GLU HG3 1 1 10 9400 1 1 43 GLU N N 3.010 4.050 5.286 1.00 . A A . 43 GLU N 1 1 10 9401 1 1 43 GLU O O 6.319 5.272 5.957 1.00 . A A . 43 GLU O 1 1 10 9402 1 1 43 GLU OE1 O 2.753 8.546 8.163 1.00 . A A . 43 GLU OE1 1 1 10 9403 1 1 43 GLU OE2 O 4.839 8.287 8.804 1.00 . A A . 43 GLU OE2 1 1 10 9404 1 1 44 ILE C C 7.239 1.985 6.038 1.00 . A A . 44 ILE C 1 1 10 9405 1 1 44 ILE CA C 6.491 2.766 7.114 1.00 . A A . 44 ILE CA 1 1 10 9406 1 1 44 ILE CB C 6.172 1.824 8.289 1.00 . A A . 44 ILE CB 1 1 10 9407 1 1 44 ILE CD1 C 5.451 2.062 10.733 1.00 . A A . 44 ILE CD1 1 1 10 9408 1 1 44 ILE CG1 C 5.279 2.544 9.308 1.00 . A A . 44 ILE CG1 1 1 10 9409 1 1 44 ILE CG2 C 7.466 1.334 8.933 1.00 . A A . 44 ILE CG2 1 1 10 9410 1 1 44 ILE H H 4.435 2.885 6.630 1.00 . A A . 44 ILE H 1 1 10 9411 1 1 44 ILE HA H 7.129 3.556 7.482 1.00 . A A . 44 ILE HA 1 1 10 9412 1 1 44 ILE HB H 5.646 0.966 7.901 1.00 . A A . 44 ILE HB 1 1 10 9413 1 1 44 ILE HD11 H 4.778 2.604 11.380 1.00 . A A . 44 ILE HD11 1 1 10 9414 1 1 44 ILE HD12 H 6.470 2.234 11.047 1.00 . A A . 44 ILE HD12 1 1 10 9415 1 1 44 ILE HD13 H 5.233 1.005 10.785 1.00 . A A . 44 ILE HD13 1 1 10 9416 1 1 44 ILE HG12 H 5.505 3.599 9.290 1.00 . A A . 44 ILE HG12 1 1 10 9417 1 1 44 ILE HG13 H 4.245 2.399 9.032 1.00 . A A . 44 ILE HG13 1 1 10 9418 1 1 44 ILE HG21 H 7.231 0.624 9.713 1.00 . A A . 44 ILE HG21 1 1 10 9419 1 1 44 ILE HG22 H 7.997 2.173 9.358 1.00 . A A . 44 ILE HG22 1 1 10 9420 1 1 44 ILE HG23 H 8.082 0.857 8.186 1.00 . A A . 44 ILE HG23 1 1 10 9421 1 1 44 ILE N N 5.280 3.378 6.583 1.00 . A A . 44 ILE N 1 1 10 9422 1 1 44 ILE O O 8.443 2.160 5.853 1.00 . A A . 44 ILE O 1 1 10 9423 1 1 45 VAL C C 7.648 1.156 3.142 1.00 . A A . 45 VAL C 1 1 10 9424 1 1 45 VAL CA C 7.117 0.298 4.286 1.00 . A A . 45 VAL CA 1 1 10 9425 1 1 45 VAL CB C 6.112 -0.720 3.715 1.00 . A A . 45 VAL CB 1 1 10 9426 1 1 45 VAL CG1 C 5.978 -1.919 4.640 1.00 . A A . 45 VAL CG1 1 1 10 9427 1 1 45 VAL CG2 C 4.759 -0.066 3.473 1.00 . A A . 45 VAL CG2 1 1 10 9428 1 1 45 VAL H H 5.565 1.015 5.536 1.00 . A A . 45 VAL H 1 1 10 9429 1 1 45 VAL HA H 7.940 -0.249 4.720 1.00 . A A . 45 VAL HA 1 1 10 9430 1 1 45 VAL HB H 6.491 -1.067 2.765 1.00 . A A . 45 VAL HB 1 1 10 9431 1 1 45 VAL HG11 H 4.932 -2.146 4.788 1.00 . A A . 45 VAL HG11 1 1 10 9432 1 1 45 VAL HG12 H 6.435 -1.694 5.592 1.00 . A A . 45 VAL HG12 1 1 10 9433 1 1 45 VAL HG13 H 6.471 -2.773 4.198 1.00 . A A . 45 VAL HG13 1 1 10 9434 1 1 45 VAL HG21 H 4.904 0.898 3.009 1.00 . A A . 45 VAL HG21 1 1 10 9435 1 1 45 VAL HG22 H 4.247 0.060 4.414 1.00 . A A . 45 VAL HG22 1 1 10 9436 1 1 45 VAL HG23 H 4.168 -0.694 2.822 1.00 . A A . 45 VAL HG23 1 1 10 9437 1 1 45 VAL N N 6.520 1.114 5.338 1.00 . A A . 45 VAL N 1 1 10 9438 1 1 45 VAL O O 8.686 0.853 2.555 1.00 . A A . 45 VAL O 1 1 10 9439 1 1 46 THR C C 8.364 4.131 2.191 1.00 . A A . 46 THR C 1 1 10 9440 1 1 46 THR CA C 7.305 3.119 1.745 1.00 . A A . 46 THR CA 1 1 10 9441 1 1 46 THR CB C 6.071 3.853 1.230 1.00 . A A . 46 THR CB 1 1 10 9442 1 1 46 THR CG2 C 5.029 2.928 0.636 1.00 . A A . 46 THR CG2 1 1 10 9443 1 1 46 THR H H 6.100 2.406 3.320 1.00 . A A . 46 THR H 1 1 10 9444 1 1 46 THR HA H 7.712 2.520 0.947 1.00 . A A . 46 THR HA 1 1 10 9445 1 1 46 THR HB H 6.373 4.544 0.465 1.00 . A A . 46 THR HB 1 1 10 9446 1 1 46 THR HG1 H 4.671 5.030 1.930 1.00 . A A . 46 THR HG1 1 1 10 9447 1 1 46 THR HG21 H 4.836 3.214 -0.387 1.00 . A A . 46 THR HG21 1 1 10 9448 1 1 46 THR HG22 H 4.116 3.001 1.208 1.00 . A A . 46 THR HG22 1 1 10 9449 1 1 46 THR HG23 H 5.391 1.912 0.664 1.00 . A A . 46 THR HG23 1 1 10 9450 1 1 46 THR N N 6.921 2.221 2.824 1.00 . A A . 46 THR N 1 1 10 9451 1 1 46 THR O O 8.647 5.092 1.476 1.00 . A A . 46 THR O 1 1 10 9452 1 1 46 THR OG1 O 5.451 4.587 2.271 1.00 . A A . 46 THR OG1 1 1 10 9453 1 1 47 ALA C C 9.412 6.213 4.125 1.00 . A A . 47 ALA C 1 1 10 9454 1 1 47 ALA CA C 9.972 4.815 3.888 1.00 . A A . 47 ALA CA 1 1 10 9455 1 1 47 ALA CB C 11.157 4.875 2.935 1.00 . A A . 47 ALA CB 1 1 10 9456 1 1 47 ALA H H 8.687 3.136 3.898 1.00 . A A . 47 ALA H 1 1 10 9457 1 1 47 ALA HA H 10.320 4.414 4.829 1.00 . A A . 47 ALA HA 1 1 10 9458 1 1 47 ALA HB1 H 11.864 4.100 3.190 1.00 . A A . 47 ALA HB1 1 1 10 9459 1 1 47 ALA HB2 H 11.634 5.839 3.015 1.00 . A A . 47 ALA HB2 1 1 10 9460 1 1 47 ALA HB3 H 10.811 4.727 1.921 1.00 . A A . 47 ALA HB3 1 1 10 9461 1 1 47 ALA N N 8.948 3.916 3.368 1.00 . A A . 47 ALA N 1 1 10 9462 1 1 47 ALA O O 10.138 7.204 4.052 1.00 . A A . 47 ALA O 1 1 10 9463 1 1 48 GLY C C 7.207 8.343 3.383 1.00 . A A . 48 GLY C 1 1 10 9464 1 1 48 GLY CA C 7.482 7.567 4.658 1.00 . A A . 48 GLY CA 1 1 10 9465 1 1 48 GLY H H 7.586 5.462 4.459 1.00 . A A . 48 GLY H 1 1 10 9466 1 1 48 GLY HA2 H 6.546 7.400 5.171 1.00 . A A . 48 GLY HA2 1 1 10 9467 1 1 48 GLY HA3 H 8.127 8.158 5.293 1.00 . A A . 48 GLY HA3 1 1 10 9468 1 1 48 GLY N N 8.115 6.286 4.411 1.00 . A A . 48 GLY N 1 1 10 9469 1 1 48 GLY O O 7.035 9.562 3.418 1.00 . A A . 48 GLY O 1 1 10 9470 1 1 49 ALA C C 5.451 8.733 0.874 1.00 . A A . 49 ALA C 1 1 10 9471 1 1 49 ALA CA C 6.903 8.277 0.972 1.00 . A A . 49 ALA CA 1 1 10 9472 1 1 49 ALA CB C 7.240 7.328 -0.168 1.00 . A A . 49 ALA CB 1 1 10 9473 1 1 49 ALA H H 7.303 6.671 2.289 1.00 . A A . 49 ALA H 1 1 10 9474 1 1 49 ALA HA H 7.546 9.142 0.892 1.00 . A A . 49 ALA HA 1 1 10 9475 1 1 49 ALA HB1 H 8.229 7.551 -0.542 1.00 . A A . 49 ALA HB1 1 1 10 9476 1 1 49 ALA HB2 H 6.520 7.451 -0.964 1.00 . A A . 49 ALA HB2 1 1 10 9477 1 1 49 ALA HB3 H 7.212 6.310 0.190 1.00 . A A . 49 ALA HB3 1 1 10 9478 1 1 49 ALA N N 7.162 7.639 2.256 1.00 . A A . 49 ALA N 1 1 10 9479 1 1 49 ALA O O 5.166 9.843 0.425 1.00 . A A . 49 ALA O 1 1 10 9480 1 1 50 LEU C C 2.671 8.810 2.589 1.00 . A A . 50 LEU C 1 1 10 9481 1 1 50 LEU CA C 3.113 8.183 1.273 1.00 . A A . 50 LEU CA 1 1 10 9482 1 1 50 LEU CB C 2.298 6.918 0.994 1.00 . A A . 50 LEU CB 1 1 10 9483 1 1 50 LEU CD1 C 1.874 4.960 -0.514 1.00 . A A . 50 LEU CD1 1 1 10 9484 1 1 50 LEU CD2 C 1.614 7.289 -1.389 1.00 . A A . 50 LEU CD2 1 1 10 9485 1 1 50 LEU CG C 2.390 6.389 -0.439 1.00 . A A . 50 LEU CG 1 1 10 9486 1 1 50 LEU H H 4.827 7.001 1.655 1.00 . A A . 50 LEU H 1 1 10 9487 1 1 50 LEU HA H 2.947 8.891 0.474 1.00 . A A . 50 LEU HA 1 1 10 9488 1 1 50 LEU HB2 H 2.635 6.142 1.666 1.00 . A A . 50 LEU HB2 1 1 10 9489 1 1 50 LEU HB3 H 1.261 7.131 1.209 1.00 . A A . 50 LEU HB3 1 1 10 9490 1 1 50 LEU HD11 H 0.952 4.880 0.044 1.00 . A A . 50 LEU HD11 1 1 10 9491 1 1 50 LEU HD12 H 2.608 4.289 -0.093 1.00 . A A . 50 LEU HD12 1 1 10 9492 1 1 50 LEU HD13 H 1.695 4.696 -1.545 1.00 . A A . 50 LEU HD13 1 1 10 9493 1 1 50 LEU HD21 H 0.784 7.738 -0.862 1.00 . A A . 50 LEU HD21 1 1 10 9494 1 1 50 LEU HD22 H 1.241 6.703 -2.215 1.00 . A A . 50 LEU HD22 1 1 10 9495 1 1 50 LEU HD23 H 2.266 8.065 -1.762 1.00 . A A . 50 LEU HD23 1 1 10 9496 1 1 50 LEU HG H 3.424 6.386 -0.749 1.00 . A A . 50 LEU HG 1 1 10 9497 1 1 50 LEU N N 4.537 7.869 1.304 1.00 . A A . 50 LEU N 1 1 10 9498 1 1 50 LEU O O 2.680 8.157 3.633 1.00 . A A . 50 LEU O 1 1 10 9499 1 1 51 LYS C C 0.400 10.450 4.068 1.00 . A A . 51 LYS C 1 1 10 9500 1 1 51 LYS CA C 1.846 10.795 3.728 1.00 . A A . 51 LYS CA 1 1 10 9501 1 1 51 LYS CB C 1.992 12.306 3.525 1.00 . A A . 51 LYS CB 1 1 10 9502 1 1 51 LYS CD C 4.317 13.233 3.292 1.00 . A A . 51 LYS CD 1 1 10 9503 1 1 51 LYS CE C 3.943 14.372 2.359 1.00 . A A . 51 LYS CE 1 1 10 9504 1 1 51 LYS CG C 3.185 12.904 4.252 1.00 . A A . 51 LYS CG 1 1 10 9505 1 1 51 LYS H H 2.304 10.550 1.676 1.00 . A A . 51 LYS H 1 1 10 9506 1 1 51 LYS HA H 2.478 10.490 4.550 1.00 . A A . 51 LYS HA 1 1 10 9507 1 1 51 LYS HB2 H 2.101 12.507 2.470 1.00 . A A . 51 LYS HB2 1 1 10 9508 1 1 51 LYS HB3 H 1.097 12.795 3.885 1.00 . A A . 51 LYS HB3 1 1 10 9509 1 1 51 LYS HD2 H 5.188 13.518 3.863 1.00 . A A . 51 LYS HD2 1 1 10 9510 1 1 51 LYS HD3 H 4.542 12.355 2.703 1.00 . A A . 51 LYS HD3 1 1 10 9511 1 1 51 LYS HE2 H 4.837 14.733 1.876 1.00 . A A . 51 LYS HE2 1 1 10 9512 1 1 51 LYS HE3 H 3.256 14.000 1.613 1.00 . A A . 51 LYS HE3 1 1 10 9513 1 1 51 LYS HG2 H 2.874 13.811 4.750 1.00 . A A . 51 LYS HG2 1 1 10 9514 1 1 51 LYS HG3 H 3.540 12.194 4.986 1.00 . A A . 51 LYS HG3 1 1 10 9515 1 1 51 LYS HZ1 H 3.526 16.402 2.624 1.00 . A A . 51 LYS HZ1 1 1 10 9516 1 1 51 LYS HZ2 H 3.645 15.533 4.070 1.00 . A A . 51 LYS HZ2 1 1 10 9517 1 1 51 LYS HZ3 H 2.267 15.376 3.101 1.00 . A A . 51 LYS HZ3 1 1 10 9518 1 1 51 LYS N N 2.287 10.080 2.536 1.00 . A A . 51 LYS N 1 1 10 9519 1 1 51 LYS NZ N 3.301 15.500 3.089 1.00 . A A . 51 LYS NZ 1 1 10 9520 1 1 51 LYS O O -0.495 10.581 3.233 1.00 . A A . 51 LYS O 1 1 10 9521 1 1 52 TYR C C -1.974 10.887 6.094 1.00 . A A . 52 TYR C 1 1 10 9522 1 1 52 TYR CA C -1.158 9.643 5.757 1.00 . A A . 52 TYR CA 1 1 10 9523 1 1 52 TYR CB C -1.071 8.728 6.979 1.00 . A A . 52 TYR CB 1 1 10 9524 1 1 52 TYR CD1 C -3.429 8.847 7.872 1.00 . A A . 52 TYR CD1 1 1 10 9525 1 1 52 TYR CD2 C -2.597 6.726 7.173 1.00 . A A . 52 TYR CD2 1 1 10 9526 1 1 52 TYR CE1 C -4.636 8.268 8.213 1.00 . A A . 52 TYR CE1 1 1 10 9527 1 1 52 TYR CE2 C -3.802 6.139 7.510 1.00 . A A . 52 TYR CE2 1 1 10 9528 1 1 52 TYR CG C -2.390 8.088 7.348 1.00 . A A . 52 TYR CG 1 1 10 9529 1 1 52 TYR CZ C -4.817 6.913 8.028 1.00 . A A . 52 TYR CZ 1 1 10 9530 1 1 52 TYR H H 0.934 9.926 5.923 1.00 . A A . 52 TYR H 1 1 10 9531 1 1 52 TYR HA H -1.647 9.114 4.952 1.00 . A A . 52 TYR HA 1 1 10 9532 1 1 52 TYR HB2 H -0.364 7.937 6.778 1.00 . A A . 52 TYR HB2 1 1 10 9533 1 1 52 TYR HB3 H -0.731 9.303 7.826 1.00 . A A . 52 TYR HB3 1 1 10 9534 1 1 52 TYR HD1 H -3.284 9.908 8.015 1.00 . A A . 52 TYR HD1 1 1 10 9535 1 1 52 TYR HD2 H -1.800 6.121 6.767 1.00 . A A . 52 TYR HD2 1 1 10 9536 1 1 52 TYR HE1 H -5.430 8.875 8.619 1.00 . A A . 52 TYR HE1 1 1 10 9537 1 1 52 TYR HE2 H -3.945 5.077 7.367 1.00 . A A . 52 TYR HE2 1 1 10 9538 1 1 52 TYR HH H -6.445 6.001 7.574 1.00 . A A . 52 TYR HH 1 1 10 9539 1 1 52 TYR N N 0.179 10.008 5.302 1.00 . A A . 52 TYR N 1 1 10 9540 1 1 52 TYR O O -1.476 11.812 6.737 1.00 . A A . 52 TYR O 1 1 10 9541 1 1 52 TYR OH O -6.018 6.333 8.365 1.00 . A A . 52 TYR OH 1 1 10 9542 1 1 53 GLN C C -5.424 11.568 6.540 1.00 . A A . 53 GLN C 1 1 10 9543 1 1 53 GLN CA C -4.114 12.034 5.915 1.00 . A A . 53 GLN CA 1 1 10 9544 1 1 53 GLN CB C -4.395 12.793 4.618 1.00 . A A . 53 GLN CB 1 1 10 9545 1 1 53 GLN CD C -2.956 12.690 2.542 1.00 . A A . 53 GLN CD 1 1 10 9546 1 1 53 GLN CG C -3.139 13.293 3.922 1.00 . A A . 53 GLN CG 1 1 10 9547 1 1 53 GLN H H -3.569 10.136 5.151 1.00 . A A . 53 GLN H 1 1 10 9548 1 1 53 GLN HA H -3.614 12.694 6.607 1.00 . A A . 53 GLN HA 1 1 10 9549 1 1 53 GLN HB2 H -4.922 12.139 3.938 1.00 . A A . 53 GLN HB2 1 1 10 9550 1 1 53 GLN HB3 H -5.020 13.645 4.840 1.00 . A A . 53 GLN HB3 1 1 10 9551 1 1 53 GLN HE21 H -1.701 14.151 2.044 1.00 . A A . 53 GLN HE21 1 1 10 9552 1 1 53 GLN HE22 H -1.998 12.967 0.822 1.00 . A A . 53 GLN HE22 1 1 10 9553 1 1 53 GLN HG2 H -3.201 14.367 3.823 1.00 . A A . 53 GLN HG2 1 1 10 9554 1 1 53 GLN HG3 H -2.282 13.039 4.527 1.00 . A A . 53 GLN HG3 1 1 10 9555 1 1 53 GLN N N -3.229 10.903 5.658 1.00 . A A . 53 GLN N 1 1 10 9556 1 1 53 GLN NE2 N -2.135 13.335 1.720 1.00 . A A . 53 GLN NE2 1 1 10 9557 1 1 53 GLN O O -6.304 11.050 5.851 1.00 . A A . 53 GLN O 1 1 10 9558 1 1 53 GLN OE1 O -3.543 11.659 2.220 1.00 . A A . 53 GLN OE1 1 1 10 9559 1 1 54 GLU C C -7.999 11.985 7.954 1.00 . A A . 54 GLU C 1 1 10 9560 1 1 54 GLU CA C -6.754 11.356 8.572 1.00 . A A . 54 GLU CA 1 1 10 9561 1 1 54 GLU CB C -6.645 11.753 10.046 1.00 . A A . 54 GLU CB 1 1 10 9562 1 1 54 GLU CD C -5.972 11.073 12.384 1.00 . A A . 54 GLU CD 1 1 10 9563 1 1 54 GLU CG C -6.066 10.659 10.928 1.00 . A A . 54 GLU CG 1 1 10 9564 1 1 54 GLU H H -4.813 12.175 8.345 1.00 . A A . 54 GLU H 1 1 10 9565 1 1 54 GLU HA H -6.838 10.282 8.504 1.00 . A A . 54 GLU HA 1 1 10 9566 1 1 54 GLU HB2 H -6.011 12.623 10.126 1.00 . A A . 54 GLU HB2 1 1 10 9567 1 1 54 GLU HB3 H -7.630 12.000 10.414 1.00 . A A . 54 GLU HB3 1 1 10 9568 1 1 54 GLU HG2 H -6.699 9.786 10.859 1.00 . A A . 54 GLU HG2 1 1 10 9569 1 1 54 GLU HG3 H -5.076 10.414 10.574 1.00 . A A . 54 GLU HG3 1 1 10 9570 1 1 54 GLU N N -5.549 11.757 7.851 1.00 . A A . 54 GLU N 1 1 10 9571 1 1 54 GLU O O -9.100 11.447 8.071 1.00 . A A . 54 GLU O 1 1 10 9572 1 1 54 GLU OE1 O -4.947 11.676 12.765 1.00 . A A . 54 GLU OE1 1 1 10 9573 1 1 54 GLU OE2 O -6.924 10.795 13.143 1.00 . A A . 54 GLU OE2 1 1 10 9574 1 1 55 ASN C C -9.635 12.919 5.649 1.00 . A A . 55 ASN C 1 1 10 9575 1 1 55 ASN CA C -8.932 13.823 6.659 1.00 . A A . 55 ASN CA 1 1 10 9576 1 1 55 ASN CB C -8.437 15.094 5.966 1.00 . A A . 55 ASN CB 1 1 10 9577 1 1 55 ASN CG C -9.380 16.263 6.159 1.00 . A A . 55 ASN CG 1 1 10 9578 1 1 55 ASN H H -6.919 13.507 7.234 1.00 . A A . 55 ASN H 1 1 10 9579 1 1 55 ASN HA H -9.637 14.095 7.430 1.00 . A A . 55 ASN HA 1 1 10 9580 1 1 55 ASN HB2 H -7.472 15.363 6.369 1.00 . A A . 55 ASN HB2 1 1 10 9581 1 1 55 ASN HB3 H -8.338 14.904 4.907 1.00 . A A . 55 ASN HB3 1 1 10 9582 1 1 55 ASN HD21 H -9.258 16.067 8.135 1.00 . A A . 55 ASN HD21 1 1 10 9583 1 1 55 ASN HD22 H -10.270 17.343 7.569 1.00 . A A . 55 ASN HD22 1 1 10 9584 1 1 55 ASN N N -7.820 13.125 7.295 1.00 . A A . 55 ASN N 1 1 10 9585 1 1 55 ASN ND2 N -9.666 16.591 7.414 1.00 . A A . 55 ASN ND2 1 1 10 9586 1 1 55 ASN O O -10.830 13.060 5.404 1.00 . A A . 55 ASN O 1 1 10 9587 1 1 55 ASN OD1 O -9.847 16.866 5.193 1.00 . A A . 55 ASN OD1 1 1 10 9588 1 1 56 ALA C C -9.734 9.703 4.710 1.00 . A A . 56 ALA C 1 1 10 9589 1 1 56 ALA CA C -9.434 11.065 4.085 1.00 . A A . 56 ALA CA 1 1 10 9590 1 1 56 ALA CB C -8.473 10.907 2.916 1.00 . A A . 56 ALA CB 1 1 10 9591 1 1 56 ALA H H -7.933 11.927 5.303 1.00 . A A . 56 ALA H 1 1 10 9592 1 1 56 ALA HA H -10.350 11.487 3.710 1.00 . A A . 56 ALA HA 1 1 10 9593 1 1 56 ALA HB1 H -7.884 11.806 2.811 1.00 . A A . 56 ALA HB1 1 1 10 9594 1 1 56 ALA HB2 H -9.035 10.738 2.010 1.00 . A A . 56 ALA HB2 1 1 10 9595 1 1 56 ALA HB3 H -7.821 10.067 3.098 1.00 . A A . 56 ALA HB3 1 1 10 9596 1 1 56 ALA N N -8.881 11.992 5.067 1.00 . A A . 56 ALA N 1 1 10 9597 1 1 56 ALA O O -9.910 8.713 4.002 1.00 . A A . 56 ALA O 1 1 10 9598 1 1 57 TYR C C -10.950 8.677 7.969 1.00 . A A . 57 TYR C 1 1 10 9599 1 1 57 TYR CA C -10.060 8.421 6.751 1.00 . A A . 57 TYR CA 1 1 10 9600 1 1 57 TYR CB C -8.765 7.752 7.189 1.00 . A A . 57 TYR CB 1 1 10 9601 1 1 57 TYR CD1 C -8.111 6.457 5.123 1.00 . A A . 57 TYR CD1 1 1 10 9602 1 1 57 TYR CD2 C -6.641 8.169 5.890 1.00 . A A . 57 TYR CD2 1 1 10 9603 1 1 57 TYR CE1 C -7.252 6.180 4.077 1.00 . A A . 57 TYR CE1 1 1 10 9604 1 1 57 TYR CE2 C -5.776 7.898 4.846 1.00 . A A . 57 TYR CE2 1 1 10 9605 1 1 57 TYR CG C -7.822 7.454 6.045 1.00 . A A . 57 TYR CG 1 1 10 9606 1 1 57 TYR CZ C -6.087 6.904 3.943 1.00 . A A . 57 TYR CZ 1 1 10 9607 1 1 57 TYR H H -9.640 10.482 6.550 1.00 . A A . 57 TYR H 1 1 10 9608 1 1 57 TYR HA H -10.590 7.759 6.075 1.00 . A A . 57 TYR HA 1 1 10 9609 1 1 57 TYR HB2 H -8.250 8.401 7.881 1.00 . A A . 57 TYR HB2 1 1 10 9610 1 1 57 TYR HB3 H -8.996 6.819 7.683 1.00 . A A . 57 TYR HB3 1 1 10 9611 1 1 57 TYR HD1 H -9.026 5.892 5.230 1.00 . A A . 57 TYR HD1 1 1 10 9612 1 1 57 TYR HD2 H -6.403 8.948 6.598 1.00 . A A . 57 TYR HD2 1 1 10 9613 1 1 57 TYR HE1 H -7.495 5.401 3.370 1.00 . A A . 57 TYR HE1 1 1 10 9614 1 1 57 TYR HE2 H -4.862 8.465 4.742 1.00 . A A . 57 TYR HE2 1 1 10 9615 1 1 57 TYR HH H -4.828 7.447 2.593 1.00 . A A . 57 TYR HH 1 1 10 9616 1 1 57 TYR N N -9.790 9.661 6.038 1.00 . A A . 57 TYR N 1 1 10 9617 1 1 57 TYR O O -10.950 7.895 8.920 1.00 . A A . 57 TYR O 1 1 10 9618 1 1 57 TYR OH O -5.226 6.631 2.904 1.00 . A A . 57 TYR OH 1 1 10 9619 1 1 58 ARG C C -14.040 9.930 8.646 1.00 . A A . 58 ARG C 1 1 10 9620 1 1 58 ARG CA C -12.580 10.132 9.037 1.00 . A A . 58 ARG CA 1 1 10 9621 1 1 58 ARG CB C -12.350 11.585 9.457 1.00 . A A . 58 ARG CB 1 1 10 9622 1 1 58 ARG CD C -10.780 12.714 11.063 1.00 . A A . 58 ARG CD 1 1 10 9623 1 1 58 ARG CG C -11.930 11.736 10.913 1.00 . A A . 58 ARG CG 1 1 10 9624 1 1 58 ARG CZ C -10.400 12.690 13.499 1.00 . A A . 58 ARG CZ 1 1 10 9625 1 1 58 ARG H H -11.650 10.361 7.151 1.00 . A A . 58 ARG H 1 1 10 9626 1 1 58 ARG HA H -12.350 9.485 9.870 1.00 . A A . 58 ARG HA 1 1 10 9627 1 1 58 ARG HB2 H -11.570 12.006 8.836 1.00 . A A . 58 ARG HB2 1 1 10 9628 1 1 58 ARG HB3 H -13.260 12.147 9.308 1.00 . A A . 58 ARG HB3 1 1 10 9629 1 1 58 ARG HD2 H -9.853 12.182 10.909 1.00 . A A . 58 ARG HD2 1 1 10 9630 1 1 58 ARG HD3 H -10.880 13.488 10.316 1.00 . A A . 58 ARG HD3 1 1 10 9631 1 1 58 ARG HE H -11.010 14.275 12.451 1.00 . A A . 58 ARG HE 1 1 10 9632 1 1 58 ARG HG2 H -12.770 12.101 11.482 1.00 . A A . 58 ARG HG2 1 1 10 9633 1 1 58 ARG HG3 H -11.630 10.772 11.291 1.00 . A A . 58 ARG HG3 1 1 10 9634 1 1 58 ARG HH11 H -10.040 10.925 12.579 1.00 . A A . 58 ARG HH11 1 1 10 9635 1 1 58 ARG HH12 H -9.785 10.936 14.290 1.00 . A A . 58 ARG HH12 1 1 10 9636 1 1 58 ARG HH21 H -10.670 14.291 14.703 1.00 . A A . 58 ARG HH21 1 1 10 9637 1 1 58 ARG HH22 H -10.140 12.847 15.497 1.00 . A A . 58 ARG HH22 1 1 10 9638 1 1 58 ARG N N -11.700 9.776 7.935 1.00 . A A . 58 ARG N 1 1 10 9639 1 1 58 ARG NE N -10.750 13.332 12.387 1.00 . A A . 58 ARG NE 1 1 10 9640 1 1 58 ARG NH1 N -10.040 11.413 13.451 1.00 . A A . 58 ARG NH1 1 1 10 9641 1 1 58 ARG NH2 N -10.400 13.329 14.662 1.00 . A A . 58 ARG NH2 1 1 10 9642 1 1 58 ARG O O -14.340 9.356 7.599 1.00 . A A . 58 ARG O 1 1 10 9643 1 1 59 GLN C C -17.000 11.633 8.932 1.00 . A A . 59 GLN C 1 1 10 9644 1 1 59 GLN CA C -16.380 10.275 9.238 1.00 . A A . 59 GLN CA 1 1 10 9645 1 1 59 GLN CB C -17.080 9.635 10.442 1.00 . A A . 59 GLN CB 1 1 10 9646 1 1 59 GLN CD C -17.270 7.289 11.360 1.00 . A A . 59 GLN CD 1 1 10 9647 1 1 59 GLN CG C -17.540 8.210 10.188 1.00 . A A . 59 GLN CG 1 1 10 9648 1 1 59 GLN H H -14.650 10.852 10.314 1.00 . A A . 59 GLN H 1 1 10 9649 1 1 59 GLN HA H -16.500 9.633 8.378 1.00 . A A . 59 GLN HA 1 1 10 9650 1 1 59 GLN HB2 H -16.390 9.623 11.276 1.00 . A A . 59 GLN HB2 1 1 10 9651 1 1 59 GLN HB3 H -17.940 10.231 10.704 1.00 . A A . 59 GLN HB3 1 1 10 9652 1 1 59 GLN HE21 H -15.390 7.037 10.756 1.00 . A A . 59 GLN HE21 1 1 10 9653 1 1 59 GLN HE22 H -15.840 6.189 12.193 1.00 . A A . 59 GLN HE22 1 1 10 9654 1 1 59 GLN HG2 H -18.610 8.223 9.999 1.00 . A A . 59 GLN HG2 1 1 10 9655 1 1 59 GLN HG3 H -17.030 7.827 9.319 1.00 . A A . 59 GLN HG3 1 1 10 9656 1 1 59 GLN N N -14.950 10.404 9.495 1.00 . A A . 59 GLN N 1 1 10 9657 1 1 59 GLN NE2 N -16.040 6.788 11.445 1.00 . A A . 59 GLN NE2 1 1 10 9658 1 1 59 GLN O O -17.950 11.731 8.151 1.00 . A A . 59 GLN O 1 1 10 9659 1 1 59 GLN OE1 O -18.150 7.031 12.181 1.00 . A A . 59 GLN OE1 1 1 10 9660 1 1 60 ALA C C -16.090 14.802 8.368 1.00 . A A . 60 ALA C 1 1 10 9661 1 1 60 ALA CA C -16.970 14.031 9.344 1.00 . A A . 60 ALA CA 1 1 10 9662 1 1 60 ALA CB C -17.060 14.769 10.671 1.00 . A A . 60 ALA CB 1 1 10 9663 1 1 60 ALA H H -15.710 12.538 10.163 1.00 . A A . 60 ALA H 1 1 10 9664 1 1 60 ALA HA H -17.970 13.955 8.933 1.00 . A A . 60 ALA HA 1 1 10 9665 1 1 60 ALA HB1 H -17.700 14.222 11.345 1.00 . A A . 60 ALA HB1 1 1 10 9666 1 1 60 ALA HB2 H -17.470 15.757 10.507 1.00 . A A . 60 ALA HB2 1 1 10 9667 1 1 60 ALA HB3 H -16.070 14.854 11.104 1.00 . A A . 60 ALA HB3 1 1 10 9668 1 1 60 ALA N N -16.460 12.679 9.551 1.00 . A A . 60 ALA N 1 1 10 9669 1 1 60 ALA O O -16.490 15.068 7.234 1.00 . A A . 60 ALA O 1 1 10 9670 1 1 61 ALA C C -12.580 15.240 7.982 1.00 . A A . 61 ALA C 1 1 10 9671 1 1 61 ALA CA C -13.950 15.899 7.979 1.00 . A A . 61 ALA CA 1 1 10 9672 1 1 61 ALA CB C -13.850 17.340 8.450 1.00 . A A . 61 ALA CB 1 1 10 9673 1 1 61 ALA H H -14.630 14.916 9.726 1.00 . A A . 61 ALA H 1 1 10 9674 1 1 61 ALA HA H -14.330 15.901 6.969 1.00 . A A . 61 ALA HA 1 1 10 9675 1 1 61 ALA HB1 H -14.730 17.595 9.022 1.00 . A A . 61 ALA HB1 1 1 10 9676 1 1 61 ALA HB2 H -13.770 17.995 7.595 1.00 . A A . 61 ALA HB2 1 1 10 9677 1 1 61 ALA HB3 H -12.970 17.456 9.071 1.00 . A A . 61 ALA HB3 1 1 10 9678 1 1 61 ALA N N -14.890 15.158 8.814 1.00 . A A . 61 ALA N 1 1 10 9679 1 1 61 ALA O O -12.010 15.036 6.885 1.00 . A A . 61 ALA O 1 1 10 9680 1 1 61 ALA OXT O -12.070 14.934 9.083 1.00 . A A . 61 ALA OXT 1 1 11 9681 1 1 1 MET C C -5.137 6.197 -0.626 1.00 . A A . 1 MET C 1 1 11 9682 1 1 1 MET CA C -4.324 7.082 0.313 1.00 . A A . 1 MET CA 1 1 11 9683 1 1 1 MET CB C -3.326 6.236 1.107 1.00 . A A . 1 MET CB 1 1 11 9684 1 1 1 MET CE C -0.373 6.535 2.886 1.00 . A A . 1 MET CE 1 1 11 9685 1 1 1 MET CG C -1.903 6.325 0.584 1.00 . A A . 1 MET CG 1 1 11 9686 1 1 1 MET H1 H -6.036 8.138 0.749 1.00 . A A . 1 MET H1 1 1 11 9687 1 1 1 MET H2 H -4.662 8.590 1.672 1.00 . A A . 1 MET H2 1 1 11 9688 1 1 1 MET H3 H -5.483 7.122 2.014 1.00 . A A . 1 MET H3 1 1 11 9689 1 1 1 MET HA H -3.786 7.814 -0.269 1.00 . A A . 1 MET HA 1 1 11 9690 1 1 1 MET HB2 H -3.330 6.566 2.137 1.00 . A A . 1 MET HB2 1 1 11 9691 1 1 1 MET HB3 H -3.636 5.202 1.070 1.00 . A A . 1 MET HB3 1 1 11 9692 1 1 1 MET HE1 H -0.857 7.477 2.675 1.00 . A A . 1 MET HE1 1 1 11 9693 1 1 1 MET HE2 H 0.695 6.683 2.949 1.00 . A A . 1 MET HE2 1 1 11 9694 1 1 1 MET HE3 H -0.738 6.144 3.824 1.00 . A A . 1 MET HE3 1 1 11 9695 1 1 1 MET HG2 H -1.882 5.952 -0.430 1.00 . A A . 1 MET HG2 1 1 11 9696 1 1 1 MET HG3 H -1.596 7.361 0.591 1.00 . A A . 1 MET HG3 1 1 11 9697 1 1 1 MET N N -5.206 7.797 1.274 1.00 . A A . 1 MET N 1 1 11 9698 1 1 1 MET O O -5.883 5.322 -0.183 1.00 . A A . 1 MET O 1 1 11 9699 1 1 1 MET SD S -0.737 5.370 1.574 1.00 . A A . 1 MET SD 1 1 11 9700 1 1 2 TYR C C -5.001 4.336 -3.213 1.00 . A A . 2 TYR C 1 1 11 9701 1 1 2 TYR CA C -5.711 5.657 -2.928 1.00 . A A . 2 TYR CA 1 1 11 9702 1 1 2 TYR CB C -5.856 6.464 -4.220 1.00 . A A . 2 TYR CB 1 1 11 9703 1 1 2 TYR CD1 C -7.664 8.024 -3.403 1.00 . A A . 2 TYR CD1 1 1 11 9704 1 1 2 TYR CD2 C -8.013 6.879 -5.465 1.00 . A A . 2 TYR CD2 1 1 11 9705 1 1 2 TYR CE1 C -8.895 8.639 -3.532 1.00 . A A . 2 TYR CE1 1 1 11 9706 1 1 2 TYR CE2 C -9.244 7.490 -5.601 1.00 . A A . 2 TYR CE2 1 1 11 9707 1 1 2 TYR CG C -7.202 7.134 -4.366 1.00 . A A . 2 TYR CG 1 1 11 9708 1 1 2 TYR CZ C -9.680 8.370 -4.633 1.00 . A A . 2 TYR CZ 1 1 11 9709 1 1 2 TYR H H -4.381 7.142 -2.217 1.00 . A A . 2 TYR H 1 1 11 9710 1 1 2 TYR HA H -6.692 5.443 -2.535 1.00 . A A . 2 TYR HA 1 1 11 9711 1 1 2 TYR HB2 H -5.098 7.233 -4.243 1.00 . A A . 2 TYR HB2 1 1 11 9712 1 1 2 TYR HB3 H -5.718 5.805 -5.066 1.00 . A A . 2 TYR HB3 1 1 11 9713 1 1 2 TYR HD1 H -7.046 8.235 -2.543 1.00 . A A . 2 TYR HD1 1 1 11 9714 1 1 2 TYR HD2 H -7.668 6.189 -6.222 1.00 . A A . 2 TYR HD2 1 1 11 9715 1 1 2 TYR HE1 H -9.237 9.328 -2.773 1.00 . A A . 2 TYR HE1 1 1 11 9716 1 1 2 TYR HE2 H -9.860 7.278 -6.463 1.00 . A A . 2 TYR HE2 1 1 11 9717 1 1 2 TYR HH H -11.410 8.850 -3.963 1.00 . A A . 2 TYR HH 1 1 11 9718 1 1 2 TYR N N -4.988 6.431 -1.926 1.00 . A A . 2 TYR N 1 1 11 9719 1 1 2 TYR O O -3.788 4.218 -3.026 1.00 . A A . 2 TYR O 1 1 11 9720 1 1 2 TYR OH O -10.900 8.980 -4.766 1.00 . A A . 2 TYR OH 1 1 11 9721 1 1 3 LYS C C -4.355 2.085 -5.235 1.00 . A A . 3 LYS C 1 1 11 9722 1 1 3 LYS CA C -5.214 2.033 -3.976 1.00 . A A . 3 LYS CA 1 1 11 9723 1 1 3 LYS CB C -6.347 1.019 -4.157 1.00 . A A . 3 LYS CB 1 1 11 9724 1 1 3 LYS CD C -6.665 -0.973 -5.657 1.00 . A A . 3 LYS CD 1 1 11 9725 1 1 3 LYS CE C -6.722 -2.490 -5.572 1.00 . A A . 3 LYS CE 1 1 11 9726 1 1 3 LYS CG C -5.866 -0.379 -4.508 1.00 . A A . 3 LYS CG 1 1 11 9727 1 1 3 LYS H H -6.723 3.506 -3.791 1.00 . A A . 3 LYS H 1 1 11 9728 1 1 3 LYS HA H -4.598 1.727 -3.144 1.00 . A A . 3 LYS HA 1 1 11 9729 1 1 3 LYS HB2 H -6.912 0.961 -3.238 1.00 . A A . 3 LYS HB2 1 1 11 9730 1 1 3 LYS HB3 H -6.997 1.362 -4.947 1.00 . A A . 3 LYS HB3 1 1 11 9731 1 1 3 LYS HD2 H -7.669 -0.582 -5.625 1.00 . A A . 3 LYS HD2 1 1 11 9732 1 1 3 LYS HD3 H -6.196 -0.691 -6.589 1.00 . A A . 3 LYS HD3 1 1 11 9733 1 1 3 LYS HE2 H -5.731 -2.885 -5.736 1.00 . A A . 3 LYS HE2 1 1 11 9734 1 1 3 LYS HE3 H -7.060 -2.768 -4.583 1.00 . A A . 3 LYS HE3 1 1 11 9735 1 1 3 LYS HG2 H -4.825 -0.331 -4.793 1.00 . A A . 3 LYS HG2 1 1 11 9736 1 1 3 LYS HG3 H -5.973 -1.015 -3.641 1.00 . A A . 3 LYS HG3 1 1 11 9737 1 1 3 LYS HZ1 H -7.109 -3.587 -7.307 1.00 . A A . 3 LYS HZ1 1 1 11 9738 1 1 3 LYS HZ2 H -8.195 -2.317 -7.046 1.00 . A A . 3 LYS HZ2 1 1 11 9739 1 1 3 LYS HZ3 H -8.310 -3.730 -6.123 1.00 . A A . 3 LYS HZ3 1 1 11 9740 1 1 3 LYS N N -5.764 3.348 -3.665 1.00 . A A . 3 LYS N 1 1 11 9741 1 1 3 LYS NZ N -7.649 -3.071 -6.583 1.00 . A A . 3 LYS NZ 1 1 11 9742 1 1 3 LYS O O -3.393 1.329 -5.373 1.00 . A A . 3 LYS O 1 1 11 9743 1 1 4 LYS C C -2.542 3.606 -7.140 1.00 . A A . 4 LYS C 1 1 11 9744 1 1 4 LYS CA C -3.968 3.129 -7.399 1.00 . A A . 4 LYS CA 1 1 11 9745 1 1 4 LYS CB C -4.685 4.114 -8.326 1.00 . A A . 4 LYS CB 1 1 11 9746 1 1 4 LYS CD C -4.799 5.188 -10.594 1.00 . A A . 4 LYS CD 1 1 11 9747 1 1 4 LYS CE C -3.887 6.401 -10.690 1.00 . A A . 4 LYS CE 1 1 11 9748 1 1 4 LYS CG C -4.174 4.085 -9.757 1.00 . A A . 4 LYS CG 1 1 11 9749 1 1 4 LYS H H -5.484 3.555 -5.984 1.00 . A A . 4 LYS H 1 1 11 9750 1 1 4 LYS HA H -3.929 2.163 -7.878 1.00 . A A . 4 LYS HA 1 1 11 9751 1 1 4 LYS HB2 H -5.739 3.878 -8.337 1.00 . A A . 4 LYS HB2 1 1 11 9752 1 1 4 LYS HB3 H -4.554 5.114 -7.940 1.00 . A A . 4 LYS HB3 1 1 11 9753 1 1 4 LYS HD2 H -4.984 4.812 -11.589 1.00 . A A . 4 LYS HD2 1 1 11 9754 1 1 4 LYS HD3 H -5.733 5.486 -10.141 1.00 . A A . 4 LYS HD3 1 1 11 9755 1 1 4 LYS HE2 H -2.881 6.101 -10.436 1.00 . A A . 4 LYS HE2 1 1 11 9756 1 1 4 LYS HE3 H -3.906 6.771 -11.704 1.00 . A A . 4 LYS HE3 1 1 11 9757 1 1 4 LYS HG2 H -3.102 4.216 -9.750 1.00 . A A . 4 LYS HG2 1 1 11 9758 1 1 4 LYS HG3 H -4.418 3.128 -10.197 1.00 . A A . 4 LYS HG3 1 1 11 9759 1 1 4 LYS HZ1 H -3.479 7.973 -9.375 1.00 . A A . 4 LYS HZ1 1 1 11 9760 1 1 4 LYS HZ2 H -4.874 7.098 -8.985 1.00 . A A . 4 LYS HZ2 1 1 11 9761 1 1 4 LYS HZ3 H -4.893 8.185 -10.281 1.00 . A A . 4 LYS HZ3 1 1 11 9762 1 1 4 LYS N N -4.708 2.982 -6.151 1.00 . A A . 4 LYS N 1 1 11 9763 1 1 4 LYS NZ N -4.313 7.491 -9.768 1.00 . A A . 4 LYS NZ 1 1 11 9764 1 1 4 LYS O O -1.604 3.191 -7.820 1.00 . A A . 4 LYS O 1 1 11 9765 1 1 5 ASP C C -0.193 3.939 -5.177 1.00 . A A . 5 ASP C 1 1 11 9766 1 1 5 ASP CA C -1.075 5.015 -5.804 1.00 . A A . 5 ASP CA 1 1 11 9767 1 1 5 ASP CB C -1.221 6.195 -4.839 1.00 . A A . 5 ASP CB 1 1 11 9768 1 1 5 ASP CG C -0.234 7.307 -5.134 1.00 . A A . 5 ASP CG 1 1 11 9769 1 1 5 ASP H H -3.171 4.775 -5.645 1.00 . A A . 5 ASP H 1 1 11 9770 1 1 5 ASP HA H -0.607 5.362 -6.713 1.00 . A A . 5 ASP HA 1 1 11 9771 1 1 5 ASP HB2 H -2.220 6.596 -4.921 1.00 . A A . 5 ASP HB2 1 1 11 9772 1 1 5 ASP HB3 H -1.057 5.849 -3.829 1.00 . A A . 5 ASP HB3 1 1 11 9773 1 1 5 ASP N N -2.386 4.482 -6.151 1.00 . A A . 5 ASP N 1 1 11 9774 1 1 5 ASP O O 0.952 3.744 -5.587 1.00 . A A . 5 ASP O 1 1 11 9775 1 1 5 ASP OD1 O 0.936 7.190 -4.707 1.00 . A A . 5 ASP OD1 1 1 11 9776 1 1 5 ASP OD2 O -0.629 8.295 -5.788 1.00 . A A . 5 ASP OD2 1 1 11 9777 1 1 6 VAL C C 0.493 1.132 -4.473 1.00 . A A . 6 VAL C 1 1 11 9778 1 1 6 VAL CA C -0.004 2.194 -3.495 1.00 . A A . 6 VAL CA 1 1 11 9779 1 1 6 VAL CB C -0.886 1.519 -2.427 1.00 . A A . 6 VAL CB 1 1 11 9780 1 1 6 VAL CG1 C -0.021 0.775 -1.438 1.00 . A A . 6 VAL CG1 1 1 11 9781 1 1 6 VAL CG2 C -1.759 2.542 -1.711 1.00 . A A . 6 VAL CG2 1 1 11 9782 1 1 6 VAL H H -1.643 3.443 -3.896 1.00 . A A . 6 VAL H 1 1 11 9783 1 1 6 VAL HA H 0.845 2.642 -3.000 1.00 . A A . 6 VAL HA 1 1 11 9784 1 1 6 VAL HB H -1.530 0.806 -2.919 1.00 . A A . 6 VAL HB 1 1 11 9785 1 1 6 VAL HG11 H -0.546 -0.099 -1.088 1.00 . A A . 6 VAL HG11 1 1 11 9786 1 1 6 VAL HG12 H 0.200 1.423 -0.605 1.00 . A A . 6 VAL HG12 1 1 11 9787 1 1 6 VAL HG13 H 0.895 0.479 -1.920 1.00 . A A . 6 VAL HG13 1 1 11 9788 1 1 6 VAL HG21 H -1.383 3.535 -1.903 1.00 . A A . 6 VAL HG21 1 1 11 9789 1 1 6 VAL HG22 H -1.742 2.350 -0.647 1.00 . A A . 6 VAL HG22 1 1 11 9790 1 1 6 VAL HG23 H -2.773 2.464 -2.072 1.00 . A A . 6 VAL HG23 1 1 11 9791 1 1 6 VAL N N -0.732 3.244 -4.181 1.00 . A A . 6 VAL N 1 1 11 9792 1 1 6 VAL O O 1.665 0.756 -4.453 1.00 . A A . 6 VAL O 1 1 11 9793 1 1 7 ILE C C 1.001 0.147 -7.281 1.00 . A A . 7 ILE C 1 1 11 9794 1 1 7 ILE CA C -0.062 -0.364 -6.311 1.00 . A A . 7 ILE CA 1 1 11 9795 1 1 7 ILE CB C -1.307 -0.814 -7.106 1.00 . A A . 7 ILE CB 1 1 11 9796 1 1 7 ILE CD1 C -3.519 -2.063 -6.894 1.00 . A A . 7 ILE CD1 1 1 11 9797 1 1 7 ILE CG1 C -2.290 -1.537 -6.182 1.00 . A A . 7 ILE CG1 1 1 11 9798 1 1 7 ILE CG2 C -0.909 -1.713 -8.270 1.00 . A A . 7 ILE CG2 1 1 11 9799 1 1 7 ILE H H -1.325 0.993 -5.291 1.00 . A A . 7 ILE H 1 1 11 9800 1 1 7 ILE HA H 0.330 -1.221 -5.782 1.00 . A A . 7 ILE HA 1 1 11 9801 1 1 7 ILE HB H -1.786 0.064 -7.511 1.00 . A A . 7 ILE HB 1 1 11 9802 1 1 7 ILE HD11 H -4.397 -1.564 -6.511 1.00 . A A . 7 ILE HD11 1 1 11 9803 1 1 7 ILE HD12 H -3.606 -3.127 -6.725 1.00 . A A . 7 ILE HD12 1 1 11 9804 1 1 7 ILE HD13 H -3.430 -1.872 -7.954 1.00 . A A . 7 ILE HD13 1 1 11 9805 1 1 7 ILE HG12 H -1.791 -2.376 -5.721 1.00 . A A . 7 ILE HG12 1 1 11 9806 1 1 7 ILE HG13 H -2.619 -0.853 -5.413 1.00 . A A . 7 ILE HG13 1 1 11 9807 1 1 7 ILE HG21 H -0.352 -2.559 -7.897 1.00 . A A . 7 ILE HG21 1 1 11 9808 1 1 7 ILE HG22 H -0.294 -1.153 -8.960 1.00 . A A . 7 ILE HG22 1 1 11 9809 1 1 7 ILE HG23 H -1.796 -2.060 -8.778 1.00 . A A . 7 ILE HG23 1 1 11 9810 1 1 7 ILE N N -0.407 0.654 -5.325 1.00 . A A . 7 ILE N 1 1 11 9811 1 1 7 ILE O O 1.797 -0.631 -7.809 1.00 . A A . 7 ILE O 1 1 11 9812 1 1 8 ASP C C 3.344 2.165 -7.742 1.00 . A A . 8 ASP C 1 1 11 9813 1 1 8 ASP CA C 1.980 2.065 -8.410 1.00 . A A . 8 ASP CA 1 1 11 9814 1 1 8 ASP CB C 1.500 3.453 -8.844 1.00 . A A . 8 ASP CB 1 1 11 9815 1 1 8 ASP CG C 1.417 3.592 -10.351 1.00 . A A . 8 ASP CG 1 1 11 9816 1 1 8 ASP H H 0.359 2.022 -7.057 1.00 . A A . 8 ASP H 1 1 11 9817 1 1 8 ASP HA H 2.064 1.433 -9.284 1.00 . A A . 8 ASP HA 1 1 11 9818 1 1 8 ASP HB2 H 0.519 3.632 -8.431 1.00 . A A . 8 ASP HB2 1 1 11 9819 1 1 8 ASP HB3 H 2.186 4.198 -8.470 1.00 . A A . 8 ASP HB3 1 1 11 9820 1 1 8 ASP N N 1.013 1.454 -7.509 1.00 . A A . 8 ASP N 1 1 11 9821 1 1 8 ASP O O 4.376 2.202 -8.414 1.00 . A A . 8 ASP O 1 1 11 9822 1 1 8 ASP OD1 O 2.479 3.578 -11.008 1.00 . A A . 8 ASP OD1 1 1 11 9823 1 1 8 ASP OD2 O 0.289 3.712 -10.875 1.00 . A A . 8 ASP OD2 1 1 11 9824 1 1 9 HIS C C 5.181 0.911 -5.441 1.00 . A A . 9 HIS C 1 1 11 9825 1 1 9 HIS CA C 4.580 2.298 -5.655 1.00 . A A . 9 HIS CA 1 1 11 9826 1 1 9 HIS CB C 4.325 2.981 -4.307 1.00 . A A . 9 HIS CB 1 1 11 9827 1 1 9 HIS CD2 C 5.923 1.859 -2.597 1.00 . A A . 9 HIS CD2 1 1 11 9828 1 1 9 HIS CE1 C 7.238 3.572 -2.213 1.00 . A A . 9 HIS CE1 1 1 11 9829 1 1 9 HIS CG C 5.478 2.892 -3.353 1.00 . A A . 9 HIS CG 1 1 11 9830 1 1 9 HIS H H 2.491 2.170 -5.933 1.00 . A A . 9 HIS H 1 1 11 9831 1 1 9 HIS HA H 5.270 2.894 -6.228 1.00 . A A . 9 HIS HA 1 1 11 9832 1 1 9 HIS HB2 H 4.117 4.027 -4.475 1.00 . A A . 9 HIS HB2 1 1 11 9833 1 1 9 HIS HB3 H 3.469 2.523 -3.837 1.00 . A A . 9 HIS HB3 1 1 11 9834 1 1 9 HIS HD1 H 6.262 4.843 -3.485 1.00 . A A . 9 HIS HD1 1 1 11 9835 1 1 9 HIS HD2 H 5.495 0.868 -2.550 1.00 . A A . 9 HIS HD2 1 1 11 9836 1 1 9 HIS HE1 H 8.028 4.192 -1.818 1.00 . A A . 9 HIS HE1 1 1 11 9837 1 1 9 HIS HE2 H 7.599 1.756 -1.337 1.00 . A A . 9 HIS HE2 1 1 11 9838 1 1 9 HIS N N 3.343 2.206 -6.414 1.00 . A A . 9 HIS N 1 1 11 9839 1 1 9 HIS ND1 N 6.323 3.950 -3.089 1.00 . A A . 9 HIS ND1 1 1 11 9840 1 1 9 HIS NE2 N 7.017 2.309 -1.899 1.00 . A A . 9 HIS NE2 1 1 11 9841 1 1 9 HIS O O 6.400 0.748 -5.409 1.00 . A A . 9 HIS O 1 1 11 9842 1 1 10 PHE C C 4.944 -2.183 -6.409 1.00 . A A . 10 PHE C 1 1 11 9843 1 1 10 PHE CA C 4.745 -1.457 -5.083 1.00 . A A . 10 PHE CA 1 1 11 9844 1 1 10 PHE CB C 3.722 -2.202 -4.230 1.00 . A A . 10 PHE CB 1 1 11 9845 1 1 10 PHE CD1 C 4.777 -2.769 -2.033 1.00 . A A . 10 PHE CD1 1 1 11 9846 1 1 10 PHE CD2 C 3.213 -0.973 -2.106 1.00 . A A . 10 PHE CD2 1 1 11 9847 1 1 10 PHE CE1 C 4.954 -2.566 -0.678 1.00 . A A . 10 PHE CE1 1 1 11 9848 1 1 10 PHE CE2 C 3.384 -0.763 -0.751 1.00 . A A . 10 PHE CE2 1 1 11 9849 1 1 10 PHE CG C 3.906 -1.977 -2.759 1.00 . A A . 10 PHE CG 1 1 11 9850 1 1 10 PHE CZ C 4.255 -1.561 -0.035 1.00 . A A . 10 PHE CZ 1 1 11 9851 1 1 10 PHE H H 3.352 0.114 -5.329 1.00 . A A . 10 PHE H 1 1 11 9852 1 1 10 PHE HA H 5.685 -1.432 -4.552 1.00 . A A . 10 PHE HA 1 1 11 9853 1 1 10 PHE HB2 H 2.729 -1.870 -4.497 1.00 . A A . 10 PHE HB2 1 1 11 9854 1 1 10 PHE HB3 H 3.805 -3.262 -4.420 1.00 . A A . 10 PHE HB3 1 1 11 9855 1 1 10 PHE HD1 H 5.321 -3.552 -2.538 1.00 . A A . 10 PHE HD1 1 1 11 9856 1 1 10 PHE HD2 H 2.532 -0.350 -2.666 1.00 . A A . 10 PHE HD2 1 1 11 9857 1 1 10 PHE HE1 H 5.637 -3.191 -0.122 1.00 . A A . 10 PHE HE1 1 1 11 9858 1 1 10 PHE HE2 H 2.838 0.025 -0.253 1.00 . A A . 10 PHE HE2 1 1 11 9859 1 1 10 PHE HZ H 4.392 -1.400 1.023 1.00 . A A . 10 PHE HZ 1 1 11 9860 1 1 10 PHE N N 4.311 -0.083 -5.295 1.00 . A A . 10 PHE N 1 1 11 9861 1 1 10 PHE O O 5.909 -2.928 -6.582 1.00 . A A . 10 PHE O 1 1 11 9862 1 1 11 GLY C C 3.283 -3.879 -8.706 1.00 . A A . 11 GLY C 1 1 11 9863 1 1 11 GLY CA C 4.111 -2.610 -8.638 1.00 . A A . 11 GLY CA 1 1 11 9864 1 1 11 GLY H H 3.272 -1.364 -7.145 1.00 . A A . 11 GLY H 1 1 11 9865 1 1 11 GLY HA2 H 3.762 -1.923 -9.396 1.00 . A A . 11 GLY HA2 1 1 11 9866 1 1 11 GLY HA3 H 5.143 -2.856 -8.837 1.00 . A A . 11 GLY HA3 1 1 11 9867 1 1 11 GLY N N 4.022 -1.964 -7.341 1.00 . A A . 11 GLY N 1 1 11 9868 1 1 11 GLY O O 2.800 -4.259 -9.774 1.00 . A A . 11 GLY O 1 1 11 9869 1 1 12 THR C C 1.631 -5.864 -6.137 1.00 . A A . 12 THR C 1 1 11 9870 1 1 12 THR CA C 2.341 -5.762 -7.482 1.00 . A A . 12 THR CA 1 1 11 9871 1 1 12 THR CB C 3.247 -6.979 -7.689 1.00 . A A . 12 THR CB 1 1 11 9872 1 1 12 THR CG2 C 3.408 -7.365 -9.143 1.00 . A A . 12 THR CG2 1 1 11 9873 1 1 12 THR H H 3.526 -4.175 -6.745 1.00 . A A . 12 THR H 1 1 11 9874 1 1 12 THR HA H 1.600 -5.739 -8.266 1.00 . A A . 12 THR HA 1 1 11 9875 1 1 12 THR HB H 2.824 -7.823 -7.165 1.00 . A A . 12 THR HB 1 1 11 9876 1 1 12 THR HG1 H 4.464 -6.348 -6.288 1.00 . A A . 12 THR HG1 1 1 11 9877 1 1 12 THR HG21 H 3.019 -8.362 -9.295 1.00 . A A . 12 THR HG21 1 1 11 9878 1 1 12 THR HG22 H 4.454 -7.344 -9.408 1.00 . A A . 12 THR HG22 1 1 11 9879 1 1 12 THR HG23 H 2.865 -6.669 -9.763 1.00 . A A . 12 THR HG23 1 1 11 9880 1 1 12 THR N N 3.116 -4.532 -7.560 1.00 . A A . 12 THR N 1 1 11 9881 1 1 12 THR O O 2.217 -5.575 -5.092 1.00 . A A . 12 THR O 1 1 11 9882 1 1 12 THR OG1 O 4.541 -6.734 -7.164 1.00 . A A . 12 THR OG1 1 1 11 9883 1 1 13 GLN C C 0.314 -7.235 -3.896 1.00 . A A . 13 GLN C 1 1 11 9884 1 1 13 GLN CA C -0.424 -6.405 -4.946 1.00 . A A . 13 GLN CA 1 1 11 9885 1 1 13 GLN CB C -1.779 -7.046 -5.258 1.00 . A A . 13 GLN CB 1 1 11 9886 1 1 13 GLN CD C -3.013 -8.838 -6.539 1.00 . A A . 13 GLN CD 1 1 11 9887 1 1 13 GLN CG C -1.673 -8.354 -6.025 1.00 . A A . 13 GLN CG 1 1 11 9888 1 1 13 GLN H H -0.046 -6.485 -7.028 1.00 . A A . 13 GLN H 1 1 11 9889 1 1 13 GLN HA H -0.590 -5.416 -4.551 1.00 . A A . 13 GLN HA 1 1 11 9890 1 1 13 GLN HB2 H -2.295 -7.240 -4.330 1.00 . A A . 13 GLN HB2 1 1 11 9891 1 1 13 GLN HB3 H -2.363 -6.354 -5.847 1.00 . A A . 13 GLN HB3 1 1 11 9892 1 1 13 GLN HE21 H -3.326 -7.094 -7.441 1.00 . A A . 13 GLN HE21 1 1 11 9893 1 1 13 GLN HE22 H -4.582 -8.266 -7.621 1.00 . A A . 13 GLN HE22 1 1 11 9894 1 1 13 GLN HG2 H -1.012 -8.210 -6.867 1.00 . A A . 13 GLN HG2 1 1 11 9895 1 1 13 GLN HG3 H -1.261 -9.108 -5.370 1.00 . A A . 13 GLN HG3 1 1 11 9896 1 1 13 GLN N N 0.367 -6.271 -6.166 1.00 . A A . 13 GLN N 1 1 11 9897 1 1 13 GLN NE2 N -3.711 -7.979 -7.274 1.00 . A A . 13 GLN NE2 1 1 11 9898 1 1 13 GLN O O 0.431 -6.827 -2.741 1.00 . A A . 13 GLN O 1 1 11 9899 1 1 13 GLN OE1 O -3.418 -9.972 -6.282 1.00 . A A . 13 GLN OE1 1 1 11 9900 1 1 14 ARG C C 2.560 -8.533 -2.572 1.00 . A A . 14 ARG C 1 1 11 9901 1 1 14 ARG CA C 1.533 -9.294 -3.408 1.00 . A A . 14 ARG CA 1 1 11 9902 1 1 14 ARG CB C 2.233 -10.397 -4.207 1.00 . A A . 14 ARG CB 1 1 11 9903 1 1 14 ARG CD C 3.705 -12.348 -3.608 1.00 . A A . 14 ARG CD 1 1 11 9904 1 1 14 ARG CG C 2.328 -11.718 -3.462 1.00 . A A . 14 ARG CG 1 1 11 9905 1 1 14 ARG CZ C 5.566 -10.745 -3.333 1.00 . A A . 14 ARG CZ 1 1 11 9906 1 1 14 ARG H H 0.681 -8.667 -5.242 1.00 . A A . 14 ARG H 1 1 11 9907 1 1 14 ARG HA H 0.814 -9.748 -2.744 1.00 . A A . 14 ARG HA 1 1 11 9908 1 1 14 ARG HB2 H 1.685 -10.562 -5.123 1.00 . A A . 14 ARG HB2 1 1 11 9909 1 1 14 ARG HB3 H 3.232 -10.070 -4.449 1.00 . A A . 14 ARG HB3 1 1 11 9910 1 1 14 ARG HD2 H 3.654 -13.371 -3.267 1.00 . A A . 14 ARG HD2 1 1 11 9911 1 1 14 ARG HD3 H 3.987 -12.332 -4.649 1.00 . A A . 14 ARG HD3 1 1 11 9912 1 1 14 ARG HE H 4.769 -11.842 -1.868 1.00 . A A . 14 ARG HE 1 1 11 9913 1 1 14 ARG HG2 H 2.132 -11.546 -2.414 1.00 . A A . 14 ARG HG2 1 1 11 9914 1 1 14 ARG HG3 H 1.588 -12.398 -3.859 1.00 . A A . 14 ARG HG3 1 1 11 9915 1 1 14 ARG HH11 H 4.868 -10.871 -5.228 1.00 . A A . 14 ARG HH11 1 1 11 9916 1 1 14 ARG HH12 H 6.174 -9.763 -4.992 1.00 . A A . 14 ARG HH12 1 1 11 9917 1 1 14 ARG HH21 H 6.485 -10.383 -1.568 1.00 . A A . 14 ARG HH21 1 1 11 9918 1 1 14 ARG HH22 H 7.091 -9.485 -2.920 1.00 . A A . 14 ARG HH22 1 1 11 9919 1 1 14 ARG N N 0.808 -8.399 -4.309 1.00 . A A . 14 ARG N 1 1 11 9920 1 1 14 ARG NE N 4.718 -11.640 -2.826 1.00 . A A . 14 ARG NE 1 1 11 9921 1 1 14 ARG NH1 N 5.532 -10.435 -4.624 1.00 . A A . 14 ARG NH1 1 1 11 9922 1 1 14 ARG NH2 N 6.453 -10.156 -2.542 1.00 . A A . 14 ARG NH2 1 1 11 9923 1 1 14 ARG O O 2.702 -8.778 -1.374 1.00 . A A . 14 ARG O 1 1 11 9924 1 1 15 ALA C C 3.672 -6.033 -1.367 1.00 . A A . 15 ALA C 1 1 11 9925 1 1 15 ALA CA C 4.283 -6.817 -2.524 1.00 . A A . 15 ALA CA 1 1 11 9926 1 1 15 ALA CB C 4.967 -5.874 -3.501 1.00 . A A . 15 ALA CB 1 1 11 9927 1 1 15 ALA H H 3.115 -7.461 -4.166 1.00 . A A . 15 ALA H 1 1 11 9928 1 1 15 ALA HA H 5.029 -7.494 -2.132 1.00 . A A . 15 ALA HA 1 1 11 9929 1 1 15 ALA HB1 H 4.286 -5.080 -3.771 1.00 . A A . 15 ALA HB1 1 1 11 9930 1 1 15 ALA HB2 H 5.254 -6.420 -4.387 1.00 . A A . 15 ALA HB2 1 1 11 9931 1 1 15 ALA HB3 H 5.848 -5.452 -3.038 1.00 . A A . 15 ALA HB3 1 1 11 9932 1 1 15 ALA N N 3.273 -7.611 -3.210 1.00 . A A . 15 ALA N 1 1 11 9933 1 1 15 ALA O O 4.185 -6.057 -0.247 1.00 . A A . 15 ALA O 1 1 11 9934 1 1 16 VAL C C 1.460 -5.416 0.546 1.00 . A A . 16 VAL C 1 1 11 9935 1 1 16 VAL CA C 1.891 -4.547 -0.630 1.00 . A A . 16 VAL CA 1 1 11 9936 1 1 16 VAL CB C 0.649 -3.829 -1.202 1.00 . A A . 16 VAL CB 1 1 11 9937 1 1 16 VAL CG1 C 0.430 -2.519 -0.477 1.00 . A A . 16 VAL CG1 1 1 11 9938 1 1 16 VAL CG2 C 0.781 -3.587 -2.699 1.00 . A A . 16 VAL CG2 1 1 11 9939 1 1 16 VAL H H 2.214 -5.358 -2.550 1.00 . A A . 16 VAL H 1 1 11 9940 1 1 16 VAL HA H 2.581 -3.796 -0.275 1.00 . A A . 16 VAL HA 1 1 11 9941 1 1 16 VAL HB H -0.215 -4.457 -1.033 1.00 . A A . 16 VAL HB 1 1 11 9942 1 1 16 VAL HG11 H 0.606 -2.659 0.579 1.00 . A A . 16 VAL HG11 1 1 11 9943 1 1 16 VAL HG12 H -0.585 -2.185 -0.634 1.00 . A A . 16 VAL HG12 1 1 11 9944 1 1 16 VAL HG13 H 1.117 -1.782 -0.862 1.00 . A A . 16 VAL HG13 1 1 11 9945 1 1 16 VAL HG21 H 0.095 -2.808 -3.000 1.00 . A A . 16 VAL HG21 1 1 11 9946 1 1 16 VAL HG22 H 0.550 -4.496 -3.232 1.00 . A A . 16 VAL HG22 1 1 11 9947 1 1 16 VAL HG23 H 1.791 -3.283 -2.927 1.00 . A A . 16 VAL HG23 1 1 11 9948 1 1 16 VAL N N 2.574 -5.338 -1.644 1.00 . A A . 16 VAL N 1 1 11 9949 1 1 16 VAL O O 1.713 -5.081 1.704 1.00 . A A . 16 VAL O 1 1 11 9950 1 1 17 ALA C C 1.509 -7.979 2.107 1.00 . A A . 17 ALA C 1 1 11 9951 1 1 17 ALA CA C 0.343 -7.452 1.277 1.00 . A A . 17 ALA CA 1 1 11 9952 1 1 17 ALA CB C -0.426 -8.605 0.649 1.00 . A A . 17 ALA CB 1 1 11 9953 1 1 17 ALA H H 0.637 -6.747 -0.698 1.00 . A A . 17 ALA H 1 1 11 9954 1 1 17 ALA HA H -0.332 -6.910 1.923 1.00 . A A . 17 ALA HA 1 1 11 9955 1 1 17 ALA HB1 H -1.485 -8.398 0.694 1.00 . A A . 17 ALA HB1 1 1 11 9956 1 1 17 ALA HB2 H -0.214 -9.516 1.189 1.00 . A A . 17 ALA HB2 1 1 11 9957 1 1 17 ALA HB3 H -0.124 -8.720 -0.382 1.00 . A A . 17 ALA HB3 1 1 11 9958 1 1 17 ALA N N 0.809 -6.534 0.242 1.00 . A A . 17 ALA N 1 1 11 9959 1 1 17 ALA O O 1.356 -8.268 3.294 1.00 . A A . 17 ALA O 1 1 11 9960 1 1 18 LYS C C 4.439 -7.527 3.082 1.00 . A A . 18 LYS C 1 1 11 9961 1 1 18 LYS CA C 3.863 -8.593 2.156 1.00 . A A . 18 LYS CA 1 1 11 9962 1 1 18 LYS CB C 4.918 -9.021 1.134 1.00 . A A . 18 LYS CB 1 1 11 9963 1 1 18 LYS CD C 5.899 -11.321 1.401 1.00 . A A . 18 LYS CD 1 1 11 9964 1 1 18 LYS CE C 6.014 -12.696 0.763 1.00 . A A . 18 LYS CE 1 1 11 9965 1 1 18 LYS CG C 4.818 -10.485 0.735 1.00 . A A . 18 LYS CG 1 1 11 9966 1 1 18 LYS H H 2.729 -7.852 0.529 1.00 . A A . 18 LYS H 1 1 11 9967 1 1 18 LYS HA H 3.577 -9.450 2.746 1.00 . A A . 18 LYS HA 1 1 11 9968 1 1 18 LYS HB2 H 4.805 -8.419 0.245 1.00 . A A . 18 LYS HB2 1 1 11 9969 1 1 18 LYS HB3 H 5.898 -8.850 1.552 1.00 . A A . 18 LYS HB3 1 1 11 9970 1 1 18 LYS HD2 H 6.847 -10.811 1.304 1.00 . A A . 18 LYS HD2 1 1 11 9971 1 1 18 LYS HD3 H 5.657 -11.437 2.448 1.00 . A A . 18 LYS HD3 1 1 11 9972 1 1 18 LYS HE2 H 5.454 -13.403 1.359 1.00 . A A . 18 LYS HE2 1 1 11 9973 1 1 18 LYS HE3 H 5.594 -12.653 -0.231 1.00 . A A . 18 LYS HE3 1 1 11 9974 1 1 18 LYS HG2 H 3.852 -10.863 1.030 1.00 . A A . 18 LYS HG2 1 1 11 9975 1 1 18 LYS HG3 H 4.925 -10.563 -0.338 1.00 . A A . 18 LYS HG3 1 1 11 9976 1 1 18 LYS HZ1 H 7.657 -13.765 1.481 1.00 . A A . 18 LYS HZ1 1 1 11 9977 1 1 18 LYS HZ2 H 8.069 -12.333 0.683 1.00 . A A . 18 LYS HZ2 1 1 11 9978 1 1 18 LYS HZ3 H 7.577 -13.684 -0.208 1.00 . A A . 18 LYS HZ3 1 1 11 9979 1 1 18 LYS N N 2.671 -8.100 1.475 1.00 . A A . 18 LYS N 1 1 11 9980 1 1 18 LYS NZ N 7.428 -13.151 0.674 1.00 . A A . 18 LYS NZ 1 1 11 9981 1 1 18 LYS O O 4.970 -7.839 4.150 1.00 . A A . 18 LYS O 1 1 11 9982 1 1 19 ALA C C 3.971 -4.903 4.681 1.00 . A A . 19 ALA C 1 1 11 9983 1 1 19 ALA CA C 4.847 -5.157 3.459 1.00 . A A . 19 ALA CA 1 1 11 9984 1 1 19 ALA CB C 4.942 -3.901 2.605 1.00 . A A . 19 ALA CB 1 1 11 9985 1 1 19 ALA H H 3.903 -6.084 1.807 1.00 . A A . 19 ALA H 1 1 11 9986 1 1 19 ALA HA H 5.843 -5.415 3.790 1.00 . A A . 19 ALA HA 1 1 11 9987 1 1 19 ALA HB1 H 5.653 -4.062 1.807 1.00 . A A . 19 ALA HB1 1 1 11 9988 1 1 19 ALA HB2 H 5.268 -3.074 3.218 1.00 . A A . 19 ALA HB2 1 1 11 9989 1 1 19 ALA HB3 H 3.973 -3.679 2.184 1.00 . A A . 19 ALA HB3 1 1 11 9990 1 1 19 ALA N N 4.335 -6.270 2.668 1.00 . A A . 19 ALA N 1 1 11 9991 1 1 19 ALA O O 4.475 -4.648 5.776 1.00 . A A . 19 ALA O 1 1 11 9992 1 1 20 LEU C C 1.520 -6.013 6.402 1.00 . A A . 20 LEU C 1 1 11 9993 1 1 20 LEU CA C 1.713 -4.747 5.575 1.00 . A A . 20 LEU CA 1 1 11 9994 1 1 20 LEU CB C 0.368 -4.276 5.019 1.00 . A A . 20 LEU CB 1 1 11 9995 1 1 20 LEU CD1 C -0.884 -2.762 3.461 1.00 . A A . 20 LEU CD1 1 1 11 9996 1 1 20 LEU CD2 C 0.692 -1.794 5.145 1.00 . A A . 20 LEU CD2 1 1 11 9997 1 1 20 LEU CG C 0.415 -2.971 4.221 1.00 . A A . 20 LEU CG 1 1 11 9998 1 1 20 LEU H H 2.317 -5.176 3.592 1.00 . A A . 20 LEU H 1 1 11 9999 1 1 20 LEU HA H 2.118 -3.975 6.211 1.00 . A A . 20 LEU HA 1 1 11 10000 1 1 20 LEU HB2 H -0.024 -5.052 4.377 1.00 . A A . 20 LEU HB2 1 1 11 10001 1 1 20 LEU HB3 H -0.312 -4.140 5.847 1.00 . A A . 20 LEU HB3 1 1 11 10002 1 1 20 LEU HD11 H -0.672 -2.331 2.495 1.00 . A A . 20 LEU HD11 1 1 11 10003 1 1 20 LEU HD12 H -1.526 -2.097 4.020 1.00 . A A . 20 LEU HD12 1 1 11 10004 1 1 20 LEU HD13 H -1.382 -3.713 3.329 1.00 . A A . 20 LEU HD13 1 1 11 10005 1 1 20 LEU HD21 H 1.243 -1.038 4.607 1.00 . A A . 20 LEU HD21 1 1 11 10006 1 1 20 LEU HD22 H 1.271 -2.128 5.991 1.00 . A A . 20 LEU HD22 1 1 11 10007 1 1 20 LEU HD23 H -0.245 -1.380 5.489 1.00 . A A . 20 LEU HD23 1 1 11 10008 1 1 20 LEU HG H 1.218 -3.028 3.500 1.00 . A A . 20 LEU HG 1 1 11 10009 1 1 20 LEU N N 2.659 -4.971 4.488 1.00 . A A . 20 LEU N 1 1 11 10010 1 1 20 LEU O O 1.266 -5.948 7.603 1.00 . A A . 20 LEU O 1 1 11 10011 1 1 21 GLY C C 0.171 -9.121 6.097 1.00 . A A . 21 GLY C 1 1 11 10012 1 1 21 GLY CA C 1.478 -8.430 6.440 1.00 . A A . 21 GLY CA 1 1 11 10013 1 1 21 GLY H H 1.846 -7.155 4.791 1.00 . A A . 21 GLY H 1 1 11 10014 1 1 21 GLY HA2 H 2.296 -9.081 6.175 1.00 . A A . 21 GLY HA2 1 1 11 10015 1 1 21 GLY HA3 H 1.508 -8.251 7.506 1.00 . A A . 21 GLY HA3 1 1 11 10016 1 1 21 GLY N N 1.643 -7.165 5.749 1.00 . A A . 21 GLY N 1 1 11 10017 1 1 21 GLY O O -0.052 -10.267 6.490 1.00 . A A . 21 GLY O 1 1 11 10018 1 1 22 ILE C C -1.835 -9.926 3.777 1.00 . A A . 22 ILE C 1 1 11 10019 1 1 22 ILE CA C -1.984 -8.991 4.973 1.00 . A A . 22 ILE CA 1 1 11 10020 1 1 22 ILE CB C -2.995 -7.883 4.619 1.00 . A A . 22 ILE CB 1 1 11 10021 1 1 22 ILE CD1 C -3.472 -6.039 2.931 1.00 . A A . 22 ILE CD1 1 1 11 10022 1 1 22 ILE CG1 C -2.450 -7.003 3.493 1.00 . A A . 22 ILE CG1 1 1 11 10023 1 1 22 ILE CG2 C -3.313 -7.044 5.848 1.00 . A A . 22 ILE CG2 1 1 11 10024 1 1 22 ILE H H -0.466 -7.521 5.078 1.00 . A A . 22 ILE H 1 1 11 10025 1 1 22 ILE HA H -2.372 -9.551 5.811 1.00 . A A . 22 ILE HA 1 1 11 10026 1 1 22 ILE HB H -3.909 -8.353 4.289 1.00 . A A . 22 ILE HB 1 1 11 10027 1 1 22 ILE HD11 H -4.127 -6.564 2.252 1.00 . A A . 22 ILE HD11 1 1 11 10028 1 1 22 ILE HD12 H -2.965 -5.246 2.402 1.00 . A A . 22 ILE HD12 1 1 11 10029 1 1 22 ILE HD13 H -4.051 -5.618 3.739 1.00 . A A . 22 ILE HD13 1 1 11 10030 1 1 22 ILE HG12 H -1.619 -6.424 3.867 1.00 . A A . 22 ILE HG12 1 1 11 10031 1 1 22 ILE HG13 H -2.108 -7.635 2.685 1.00 . A A . 22 ILE HG13 1 1 11 10032 1 1 22 ILE HG21 H -2.400 -6.622 6.241 1.00 . A A . 22 ILE HG21 1 1 11 10033 1 1 22 ILE HG22 H -3.773 -7.667 6.600 1.00 . A A . 22 ILE HG22 1 1 11 10034 1 1 22 ILE HG23 H -3.989 -6.248 5.576 1.00 . A A . 22 ILE HG23 1 1 11 10035 1 1 22 ILE N N -0.697 -8.429 5.363 1.00 . A A . 22 ILE N 1 1 11 10036 1 1 22 ILE O O -0.730 -10.139 3.279 1.00 . A A . 22 ILE O 1 1 11 10037 1 1 23 SER C C -3.015 -10.620 0.869 1.00 . A A . 23 SER C 1 1 11 10038 1 1 23 SER CA C -2.947 -11.391 2.184 1.00 . A A . 23 SER CA 1 1 11 10039 1 1 23 SER CB C -4.119 -12.368 2.279 1.00 . A A . 23 SER CB 1 1 11 10040 1 1 23 SER H H -3.804 -10.269 3.762 1.00 . A A . 23 SER H 1 1 11 10041 1 1 23 SER HA H -2.022 -11.949 2.212 1.00 . A A . 23 SER HA 1 1 11 10042 1 1 23 SER HB2 H -5.011 -11.894 1.894 1.00 . A A . 23 SER HB2 1 1 11 10043 1 1 23 SER HB3 H -3.900 -13.249 1.694 1.00 . A A . 23 SER HB3 1 1 11 10044 1 1 23 SER HG H -4.777 -12.038 4.094 1.00 . A A . 23 SER HG 1 1 11 10045 1 1 23 SER N N -2.954 -10.478 3.322 1.00 . A A . 23 SER N 1 1 11 10046 1 1 23 SER O O -3.531 -9.504 0.819 1.00 . A A . 23 SER O 1 1 11 10047 1 1 23 SER OG O -4.354 -12.757 3.621 1.00 . A A . 23 SER OG 1 1 11 10048 1 1 24 ASP C C -3.918 -10.311 -1.974 1.00 . A A . 24 ASP C 1 1 11 10049 1 1 24 ASP CA C -2.493 -10.594 -1.507 1.00 . A A . 24 ASP CA 1 1 11 10050 1 1 24 ASP CB C -1.780 -11.488 -2.526 1.00 . A A . 24 ASP CB 1 1 11 10051 1 1 24 ASP CG C -2.254 -12.927 -2.464 1.00 . A A . 24 ASP CG 1 1 11 10052 1 1 24 ASP H H -2.096 -12.114 -0.088 1.00 . A A . 24 ASP H 1 1 11 10053 1 1 24 ASP HA H -1.961 -9.660 -1.428 1.00 . A A . 24 ASP HA 1 1 11 10054 1 1 24 ASP HB2 H -1.967 -11.110 -3.519 1.00 . A A . 24 ASP HB2 1 1 11 10055 1 1 24 ASP HB3 H -0.718 -11.469 -2.329 1.00 . A A . 24 ASP HB3 1 1 11 10056 1 1 24 ASP N N -2.492 -11.225 -0.192 1.00 . A A . 24 ASP N 1 1 11 10057 1 1 24 ASP O O -4.165 -9.343 -2.694 1.00 . A A . 24 ASP O 1 1 11 10058 1 1 24 ASP OD1 O -3.465 -13.162 -2.660 1.00 . A A . 24 ASP OD1 1 1 11 10059 1 1 24 ASP OD2 O -1.414 -13.819 -2.220 1.00 . A A . 24 ASP OD2 1 1 11 10060 1 1 25 ALA C C -6.837 -9.730 -1.324 1.00 . A A . 25 ALA C 1 1 11 10061 1 1 25 ALA CA C -6.252 -11.000 -1.932 1.00 . A A . 25 ALA CA 1 1 11 10062 1 1 25 ALA CB C -7.056 -12.216 -1.497 1.00 . A A . 25 ALA CB 1 1 11 10063 1 1 25 ALA H H -4.593 -11.912 -0.985 1.00 . A A . 25 ALA H 1 1 11 10064 1 1 25 ALA HA H -6.302 -10.929 -3.009 1.00 . A A . 25 ALA HA 1 1 11 10065 1 1 25 ALA HB1 H -7.815 -12.426 -2.235 1.00 . A A . 25 ALA HB1 1 1 11 10066 1 1 25 ALA HB2 H -7.524 -12.017 -0.544 1.00 . A A . 25 ALA HB2 1 1 11 10067 1 1 25 ALA HB3 H -6.398 -13.067 -1.404 1.00 . A A . 25 ALA HB3 1 1 11 10068 1 1 25 ALA N N -4.851 -11.160 -1.558 1.00 . A A . 25 ALA N 1 1 11 10069 1 1 25 ALA O O -7.605 -9.017 -1.972 1.00 . A A . 25 ALA O 1 1 11 10070 1 1 26 ALA C C -6.577 -6.997 -0.139 1.00 . A A . 26 ALA C 1 1 11 10071 1 1 26 ALA CA C -6.957 -8.266 0.616 1.00 . A A . 26 ALA CA 1 1 11 10072 1 1 26 ALA CB C -6.412 -8.222 2.035 1.00 . A A . 26 ALA CB 1 1 11 10073 1 1 26 ALA H H -5.853 -10.057 0.385 1.00 . A A . 26 ALA H 1 1 11 10074 1 1 26 ALA HA H -8.033 -8.331 0.670 1.00 . A A . 26 ALA HA 1 1 11 10075 1 1 26 ALA HB1 H -7.106 -8.710 2.702 1.00 . A A . 26 ALA HB1 1 1 11 10076 1 1 26 ALA HB2 H -6.281 -7.193 2.340 1.00 . A A . 26 ALA HB2 1 1 11 10077 1 1 26 ALA HB3 H -5.459 -8.731 2.070 1.00 . A A . 26 ALA HB3 1 1 11 10078 1 1 26 ALA N N -6.469 -9.451 -0.078 1.00 . A A . 26 ALA N 1 1 11 10079 1 1 26 ALA O O -7.304 -6.004 -0.112 1.00 . A A . 26 ALA O 1 1 11 10080 1 1 27 VAL C C -5.836 -5.647 -2.801 1.00 . A A . 27 VAL C 1 1 11 10081 1 1 27 VAL CA C -4.955 -5.894 -1.581 1.00 . A A . 27 VAL CA 1 1 11 10082 1 1 27 VAL CB C -3.499 -6.096 -2.043 1.00 . A A . 27 VAL CB 1 1 11 10083 1 1 27 VAL CG1 C -2.993 -4.867 -2.783 1.00 . A A . 27 VAL CG1 1 1 11 10084 1 1 27 VAL CG2 C -2.604 -6.418 -0.856 1.00 . A A . 27 VAL CG2 1 1 11 10085 1 1 27 VAL H H -4.899 -7.859 -0.799 1.00 . A A . 27 VAL H 1 1 11 10086 1 1 27 VAL HA H -4.991 -5.024 -0.940 1.00 . A A . 27 VAL HA 1 1 11 10087 1 1 27 VAL HB H -3.473 -6.935 -2.724 1.00 . A A . 27 VAL HB 1 1 11 10088 1 1 27 VAL HG11 H -1.979 -5.038 -3.113 1.00 . A A . 27 VAL HG11 1 1 11 10089 1 1 27 VAL HG12 H -3.019 -4.013 -2.123 1.00 . A A . 27 VAL HG12 1 1 11 10090 1 1 27 VAL HG13 H -3.623 -4.679 -3.640 1.00 . A A . 27 VAL HG13 1 1 11 10091 1 1 27 VAL HG21 H -2.763 -7.442 -0.551 1.00 . A A . 27 VAL HG21 1 1 11 10092 1 1 27 VAL HG22 H -2.842 -5.757 -0.035 1.00 . A A . 27 VAL HG22 1 1 11 10093 1 1 27 VAL HG23 H -1.571 -6.283 -1.138 1.00 . A A . 27 VAL HG23 1 1 11 10094 1 1 27 VAL N N -5.433 -7.038 -0.815 1.00 . A A . 27 VAL N 1 1 11 10095 1 1 27 VAL O O -6.173 -4.506 -3.116 1.00 . A A . 27 VAL O 1 1 11 10096 1 1 28 SER C C -8.473 -6.232 -4.297 1.00 . A A . 28 SER C 1 1 11 10097 1 1 28 SER CA C -7.046 -6.624 -4.672 1.00 . A A . 28 SER CA 1 1 11 10098 1 1 28 SER CB C -7.053 -7.951 -5.433 1.00 . A A . 28 SER CB 1 1 11 10099 1 1 28 SER H H -5.904 -7.609 -3.186 1.00 . A A . 28 SER H 1 1 11 10100 1 1 28 SER HA H -6.630 -5.856 -5.307 1.00 . A A . 28 SER HA 1 1 11 10101 1 1 28 SER HB2 H -8.012 -8.084 -5.913 1.00 . A A . 28 SER HB2 1 1 11 10102 1 1 28 SER HB3 H -6.275 -7.938 -6.182 1.00 . A A . 28 SER HB3 1 1 11 10103 1 1 28 SER HG H -6.678 -9.840 -5.072 1.00 . A A . 28 SER HG 1 1 11 10104 1 1 28 SER N N -6.206 -6.725 -3.485 1.00 . A A . 28 SER N 1 1 11 10105 1 1 28 SER O O -9.179 -5.597 -5.082 1.00 . A A . 28 SER O 1 1 11 10106 1 1 28 SER OG O -6.826 -9.043 -4.558 1.00 . A A . 28 SER OG 1 1 11 10107 1 1 29 GLN C C -10.350 -4.829 -2.229 1.00 . A A . 29 GLN C 1 1 11 10108 1 1 29 GLN CA C -10.230 -6.301 -2.617 1.00 . A A . 29 GLN CA 1 1 11 10109 1 1 29 GLN CB C -10.580 -7.186 -1.420 1.00 . A A . 29 GLN CB 1 1 11 10110 1 1 29 GLN CD C -12.430 -8.269 -0.082 1.00 . A A . 29 GLN CD 1 1 11 10111 1 1 29 GLN CG C -12.070 -7.197 -1.091 1.00 . A A . 29 GLN CG 1 1 11 10112 1 1 29 GLN H H -8.283 -7.116 -2.514 1.00 . A A . 29 GLN H 1 1 11 10113 1 1 29 GLN HA H -10.920 -6.506 -3.419 1.00 . A A . 29 GLN HA 1 1 11 10114 1 1 29 GLN HB2 H -10.280 -8.199 -1.631 1.00 . A A . 29 GLN HB2 1 1 11 10115 1 1 29 GLN HB3 H -10.050 -6.828 -0.552 1.00 . A A . 29 GLN HB3 1 1 11 10116 1 1 29 GLN HE21 H -12.200 -9.683 -1.460 1.00 . A A . 29 GLN HE21 1 1 11 10117 1 1 29 GLN HE22 H -12.660 -10.234 0.110 1.00 . A A . 29 GLN HE22 1 1 11 10118 1 1 29 GLN HG2 H -12.340 -6.235 -0.687 1.00 . A A . 29 GLN HG2 1 1 11 10119 1 1 29 GLN HG3 H -12.620 -7.376 -2.001 1.00 . A A . 29 GLN HG3 1 1 11 10120 1 1 29 GLN N N -8.892 -6.614 -3.095 1.00 . A A . 29 GLN N 1 1 11 10121 1 1 29 GLN NE2 N -12.430 -9.521 -0.521 1.00 . A A . 29 GLN NE2 1 1 11 10122 1 1 29 GLN O O -11.460 -4.313 -2.060 1.00 . A A . 29 GLN O 1 1 11 10123 1 1 29 GLN OE1 O -12.710 -7.973 1.081 1.00 . A A . 29 GLN OE1 1 1 11 10124 1 1 30 TRP C C -10.100 -1.920 -2.644 1.00 . A A . 30 TRP C 1 1 11 10125 1 1 30 TRP CA C -9.209 -2.739 -1.716 1.00 . A A . 30 TRP CA 1 1 11 10126 1 1 30 TRP CB C -7.780 -2.189 -1.757 1.00 . A A . 30 TRP CB 1 1 11 10127 1 1 30 TRP CD1 C -7.463 -2.937 0.678 1.00 . A A . 30 TRP CD1 1 1 11 10128 1 1 30 TRP CD2 C -5.567 -2.363 -0.366 1.00 . A A . 30 TRP CD2 1 1 11 10129 1 1 30 TRP CE2 C -5.256 -2.750 0.951 1.00 . A A . 30 TRP CE2 1 1 11 10130 1 1 30 TRP CE3 C -4.531 -1.961 -1.213 1.00 . A A . 30 TRP CE3 1 1 11 10131 1 1 30 TRP CG C -6.985 -2.490 -0.522 1.00 . A A . 30 TRP CG 1 1 11 10132 1 1 30 TRP CH2 C -2.956 -2.348 0.588 1.00 . A A . 30 TRP CH2 1 1 11 10133 1 1 30 TRP CZ2 C -3.951 -2.746 1.440 1.00 . A A . 30 TRP CZ2 1 1 11 10134 1 1 30 TRP CZ3 C -3.236 -1.957 -0.727 1.00 . A A . 30 TRP CZ3 1 1 11 10135 1 1 30 TRP H H -8.367 -4.611 -2.230 1.00 . A A . 30 TRP H 1 1 11 10136 1 1 30 TRP HA H -9.587 -2.657 -0.708 1.00 . A A . 30 TRP HA 1 1 11 10137 1 1 30 TRP HB2 H -7.262 -2.621 -2.600 1.00 . A A . 30 TRP HB2 1 1 11 10138 1 1 30 TRP HB3 H -7.820 -1.116 -1.877 1.00 . A A . 30 TRP HB3 1 1 11 10139 1 1 30 TRP HD1 H -8.505 -3.132 0.882 1.00 . A A . 30 TRP HD1 1 1 11 10140 1 1 30 TRP HE1 H -6.518 -3.405 2.493 1.00 . A A . 30 TRP HE1 1 1 11 10141 1 1 30 TRP HE3 H -4.726 -1.657 -2.231 1.00 . A A . 30 TRP HE3 1 1 11 10142 1 1 30 TRP HH2 H -1.931 -2.328 0.927 1.00 . A A . 30 TRP HH2 1 1 11 10143 1 1 30 TRP HZ2 H -3.717 -3.045 2.451 1.00 . A A . 30 TRP HZ2 1 1 11 10144 1 1 30 TRP HZ3 H -2.422 -1.648 -1.368 1.00 . A A . 30 TRP HZ3 1 1 11 10145 1 1 30 TRP N N -9.220 -4.151 -2.086 1.00 . A A . 30 TRP N 1 1 11 10146 1 1 30 TRP NE1 N -6.429 -3.095 1.569 1.00 . A A . 30 TRP NE1 1 1 11 10147 1 1 30 TRP O O -10.560 -2.414 -3.673 1.00 . A A . 30 TRP O 1 1 11 10148 1 1 31 LYS C C -10.460 1.534 -3.353 1.00 . A A . 31 LYS C 1 1 11 10149 1 1 31 LYS CA C -11.180 0.220 -3.065 1.00 . A A . 31 LYS CA 1 1 11 10150 1 1 31 LYS CB C -12.500 0.488 -2.338 1.00 . A A . 31 LYS CB 1 1 11 10151 1 1 31 LYS CD C -12.890 0.588 0.145 1.00 . A A . 31 LYS CD 1 1 11 10152 1 1 31 LYS CE C -11.800 -0.162 0.886 1.00 . A A . 31 LYS CE 1 1 11 10153 1 1 31 LYS CG C -12.350 1.317 -1.071 1.00 . A A . 31 LYS CG 1 1 11 10154 1 1 31 LYS H H -9.950 -0.332 -1.438 1.00 . A A . 31 LYS H 1 1 11 10155 1 1 31 LYS HA H -11.390 -0.273 -4.003 1.00 . A A . 31 LYS HA 1 1 11 10156 1 1 31 LYS HB2 H -13.170 1.014 -3.007 1.00 . A A . 31 LYS HB2 1 1 11 10157 1 1 31 LYS HB3 H -12.950 -0.457 -2.072 1.00 . A A . 31 LYS HB3 1 1 11 10158 1 1 31 LYS HD2 H -13.340 1.310 0.815 1.00 . A A . 31 LYS HD2 1 1 11 10159 1 1 31 LYS HD3 H -13.650 -0.116 -0.178 1.00 . A A . 31 LYS HD3 1 1 11 10160 1 1 31 LYS HE2 H -10.840 0.234 0.585 1.00 . A A . 31 LYS HE2 1 1 11 10161 1 1 31 LYS HE3 H -11.930 -0.011 1.948 1.00 . A A . 31 LYS HE3 1 1 11 10162 1 1 31 LYS HG2 H -11.300 1.521 -0.913 1.00 . A A . 31 LYS HG2 1 1 11 10163 1 1 31 LYS HG3 H -12.880 2.247 -1.195 1.00 . A A . 31 LYS HG3 1 1 11 10164 1 1 31 LYS HZ1 H -11.150 -2.122 1.204 1.00 . A A . 31 LYS HZ1 1 1 11 10165 1 1 31 LYS HZ2 H -11.580 -1.795 -0.398 1.00 . A A . 31 LYS HZ2 1 1 11 10166 1 1 31 LYS HZ3 H -12.790 -2.000 0.774 1.00 . A A . 31 LYS HZ3 1 1 11 10167 1 1 31 LYS N N -10.340 -0.668 -2.270 1.00 . A A . 31 LYS N 1 1 11 10168 1 1 31 LYS NZ N -11.830 -1.622 0.596 1.00 . A A . 31 LYS NZ 1 1 11 10169 1 1 31 LYS O O -9.244 1.630 -3.189 1.00 . A A . 31 LYS O 1 1 11 10170 1 1 32 GLU C C -9.737 4.340 -2.960 1.00 . A A . 32 GLU C 1 1 11 10171 1 1 32 GLU CA C -10.630 3.853 -4.091 1.00 . A A . 32 GLU CA 1 1 11 10172 1 1 32 GLU CB C -11.740 4.873 -4.349 1.00 . A A . 32 GLU CB 1 1 11 10173 1 1 32 GLU CD C -13.260 5.961 -6.050 1.00 . A A . 32 GLU CD 1 1 11 10174 1 1 32 GLU CG C -12.060 5.071 -5.823 1.00 . A A . 32 GLU CG 1 1 11 10175 1 1 32 GLU H H -12.170 2.411 -3.895 1.00 . A A . 32 GLU H 1 1 11 10176 1 1 32 GLU HA H -10.040 3.749 -4.987 1.00 . A A . 32 GLU HA 1 1 11 10177 1 1 32 GLU HB2 H -12.650 4.538 -3.855 1.00 . A A . 32 GLU HB2 1 1 11 10178 1 1 32 GLU HB3 H -11.450 5.825 -3.936 1.00 . A A . 32 GLU HB3 1 1 11 10179 1 1 32 GLU HG2 H -11.200 5.522 -6.303 1.00 . A A . 32 GLU HG2 1 1 11 10180 1 1 32 GLU HG3 H -12.250 4.106 -6.270 1.00 . A A . 32 GLU HG3 1 1 11 10181 1 1 32 GLU N N -11.210 2.546 -3.781 1.00 . A A . 32 GLU N 1 1 11 10182 1 1 32 GLU O O -8.785 5.087 -3.189 1.00 . A A . 32 GLU O 1 1 11 10183 1 1 32 GLU OE1 O -14.400 5.462 -5.918 1.00 . A A . 32 GLU OE1 1 1 11 10184 1 1 32 GLU OE2 O -13.070 7.156 -6.357 1.00 . A A . 32 GLU OE2 1 1 11 10185 1 1 33 VAL C C -8.977 3.093 0.321 1.00 . A A . 33 VAL C 1 1 11 10186 1 1 33 VAL CA C -9.256 4.296 -0.573 1.00 . A A . 33 VAL CA 1 1 11 10187 1 1 33 VAL CB C -9.973 5.381 0.253 1.00 . A A . 33 VAL CB 1 1 11 10188 1 1 33 VAL CG1 C -9.065 5.896 1.362 1.00 . A A . 33 VAL CG1 1 1 11 10189 1 1 33 VAL CG2 C -10.420 6.523 -0.644 1.00 . A A . 33 VAL CG2 1 1 11 10190 1 1 33 VAL H H -10.810 3.313 -1.621 1.00 . A A . 33 VAL H 1 1 11 10191 1 1 33 VAL HA H -8.316 4.699 -0.922 1.00 . A A . 33 VAL HA 1 1 11 10192 1 1 33 VAL HB H -10.840 4.941 0.710 1.00 . A A . 33 VAL HB 1 1 11 10193 1 1 33 VAL HG11 H -9.650 6.075 2.252 1.00 . A A . 33 VAL HG11 1 1 11 10194 1 1 33 VAL HG12 H -8.598 6.818 1.046 1.00 . A A . 33 VAL HG12 1 1 11 10195 1 1 33 VAL HG13 H -8.303 5.160 1.573 1.00 . A A . 33 VAL HG13 1 1 11 10196 1 1 33 VAL HG21 H -9.782 6.581 -1.508 1.00 . A A . 33 VAL HG21 1 1 11 10197 1 1 33 VAL HG22 H -10.380 7.452 -0.096 1.00 . A A . 33 VAL HG22 1 1 11 10198 1 1 33 VAL HG23 H -11.440 6.343 -0.965 1.00 . A A . 33 VAL HG23 1 1 11 10199 1 1 33 VAL N N -10.040 3.909 -1.739 1.00 . A A . 33 VAL N 1 1 11 10200 1 1 33 VAL O O -9.901 2.460 0.831 1.00 . A A . 33 VAL O 1 1 11 10201 1 1 34 ILE C C -7.753 1.836 2.778 1.00 . A A . 34 ILE C 1 1 11 10202 1 1 34 ILE CA C -7.300 1.649 1.331 1.00 . A A . 34 ILE CA 1 1 11 10203 1 1 34 ILE CB C -5.773 1.440 1.306 1.00 . A A . 34 ILE CB 1 1 11 10204 1 1 34 ILE CD1 C -3.549 2.571 1.791 1.00 . A A . 34 ILE CD1 1 1 11 10205 1 1 34 ILE CG1 C -5.053 2.719 1.737 1.00 . A A . 34 ILE CG1 1 1 11 10206 1 1 34 ILE CG2 C -5.322 1.014 -0.083 1.00 . A A . 34 ILE CG2 1 1 11 10207 1 1 34 ILE H H -7.007 3.322 0.067 1.00 . A A . 34 ILE H 1 1 11 10208 1 1 34 ILE HA H -7.769 0.762 0.931 1.00 . A A . 34 ILE HA 1 1 11 10209 1 1 34 ILE HB H -5.530 0.648 1.996 1.00 . A A . 34 ILE HB 1 1 11 10210 1 1 34 ILE HD11 H -3.192 2.182 0.849 1.00 . A A . 34 ILE HD11 1 1 11 10211 1 1 34 ILE HD12 H -3.283 1.890 2.586 1.00 . A A . 34 ILE HD12 1 1 11 10212 1 1 34 ILE HD13 H -3.099 3.535 1.976 1.00 . A A . 34 ILE HD13 1 1 11 10213 1 1 34 ILE HG12 H -5.283 3.509 1.037 1.00 . A A . 34 ILE HG12 1 1 11 10214 1 1 34 ILE HG13 H -5.395 3.004 2.721 1.00 . A A . 34 ILE HG13 1 1 11 10215 1 1 34 ILE HG21 H -5.533 1.804 -0.789 1.00 . A A . 34 ILE HG21 1 1 11 10216 1 1 34 ILE HG22 H -5.852 0.120 -0.374 1.00 . A A . 34 ILE HG22 1 1 11 10217 1 1 34 ILE HG23 H -4.260 0.816 -0.070 1.00 . A A . 34 ILE HG23 1 1 11 10218 1 1 34 ILE N N -7.698 2.781 0.502 1.00 . A A . 34 ILE N 1 1 11 10219 1 1 34 ILE O O -8.015 2.957 3.214 1.00 . A A . 34 ILE O 1 1 11 10220 1 1 35 PRO C C -7.499 1.801 5.761 1.00 . A A . 35 PRO C 1 1 11 10221 1 1 35 PRO CA C -8.283 0.780 4.942 1.00 . A A . 35 PRO CA 1 1 11 10222 1 1 35 PRO CB C -8.003 -0.639 5.445 1.00 . A A . 35 PRO CB 1 1 11 10223 1 1 35 PRO CD C -7.565 -0.644 3.096 1.00 . A A . 35 PRO CD 1 1 11 10224 1 1 35 PRO CG C -8.080 -1.491 4.227 1.00 . A A . 35 PRO CG 1 1 11 10225 1 1 35 PRO HA H -9.338 0.990 5.025 1.00 . A A . 35 PRO HA 1 1 11 10226 1 1 35 PRO HB2 H -7.023 -0.677 5.896 1.00 . A A . 35 PRO HB2 1 1 11 10227 1 1 35 PRO HB3 H -8.751 -0.921 6.171 1.00 . A A . 35 PRO HB3 1 1 11 10228 1 1 35 PRO HD2 H -6.502 -0.790 2.967 1.00 . A A . 35 PRO HD2 1 1 11 10229 1 1 35 PRO HD3 H -8.092 -0.872 2.182 1.00 . A A . 35 PRO HD3 1 1 11 10230 1 1 35 PRO HG2 H -7.459 -2.367 4.351 1.00 . A A . 35 PRO HG2 1 1 11 10231 1 1 35 PRO HG3 H -9.104 -1.778 4.043 1.00 . A A . 35 PRO HG3 1 1 11 10232 1 1 35 PRO N N -7.855 0.733 3.541 1.00 . A A . 35 PRO N 1 1 11 10233 1 1 35 PRO O O -6.385 2.183 5.398 1.00 . A A . 35 PRO O 1 1 11 10234 1 1 36 GLU C C -6.127 2.706 8.281 1.00 . A A . 36 GLU C 1 1 11 10235 1 1 36 GLU CA C -7.459 3.220 7.742 1.00 . A A . 36 GLU CA 1 1 11 10236 1 1 36 GLU CB C -8.393 3.562 8.906 1.00 . A A . 36 GLU CB 1 1 11 10237 1 1 36 GLU CD C -7.397 5.090 10.652 1.00 . A A . 36 GLU CD 1 1 11 10238 1 1 36 GLU CG C -8.250 4.990 9.402 1.00 . A A . 36 GLU CG 1 1 11 10239 1 1 36 GLU H H -8.980 1.898 7.098 1.00 . A A . 36 GLU H 1 1 11 10240 1 1 36 GLU HA H -7.279 4.113 7.165 1.00 . A A . 36 GLU HA 1 1 11 10241 1 1 36 GLU HB2 H -9.415 3.413 8.588 1.00 . A A . 36 GLU HB2 1 1 11 10242 1 1 36 GLU HB3 H -8.183 2.894 9.728 1.00 . A A . 36 GLU HB3 1 1 11 10243 1 1 36 GLU HG2 H -7.793 5.582 8.626 1.00 . A A . 36 GLU HG2 1 1 11 10244 1 1 36 GLU HG3 H -9.232 5.381 9.623 1.00 . A A . 36 GLU HG3 1 1 11 10245 1 1 36 GLU N N -8.092 2.240 6.867 1.00 . A A . 36 GLU N 1 1 11 10246 1 1 36 GLU O O -5.114 3.402 8.225 1.00 . A A . 36 GLU O 1 1 11 10247 1 1 36 GLU OE1 O -6.600 4.162 10.902 1.00 . A A . 36 GLU OE1 1 1 11 10248 1 1 36 GLU OE2 O -7.528 6.096 11.380 1.00 . A A . 36 GLU OE2 1 1 11 10249 1 1 37 LYS C C -3.978 0.413 8.282 1.00 . A A . 37 LYS C 1 1 11 10250 1 1 37 LYS CA C -4.933 0.887 9.375 1.00 . A A . 37 LYS CA 1 1 11 10251 1 1 37 LYS CB C -5.303 -0.286 10.286 1.00 . A A . 37 LYS CB 1 1 11 10252 1 1 37 LYS CD C -5.585 -0.201 12.784 1.00 . A A . 37 LYS CD 1 1 11 10253 1 1 37 LYS CE C -5.001 1.050 13.420 1.00 . A A . 37 LYS CE 1 1 11 10254 1 1 37 LYS CG C -6.219 0.103 11.436 1.00 . A A . 37 LYS CG 1 1 11 10255 1 1 37 LYS H H -6.980 0.985 8.836 1.00 . A A . 37 LYS H 1 1 11 10256 1 1 37 LYS HA H -4.435 1.641 9.964 1.00 . A A . 37 LYS HA 1 1 11 10257 1 1 37 LYS HB2 H -5.801 -1.041 9.695 1.00 . A A . 37 LYS HB2 1 1 11 10258 1 1 37 LYS HB3 H -4.397 -0.704 10.698 1.00 . A A . 37 LYS HB3 1 1 11 10259 1 1 37 LYS HD2 H -6.339 -0.607 13.442 1.00 . A A . 37 LYS HD2 1 1 11 10260 1 1 37 LYS HD3 H -4.797 -0.926 12.645 1.00 . A A . 37 LYS HD3 1 1 11 10261 1 1 37 LYS HE2 H -5.802 1.749 13.613 1.00 . A A . 37 LYS HE2 1 1 11 10262 1 1 37 LYS HE3 H -4.529 0.779 14.353 1.00 . A A . 37 LYS HE3 1 1 11 10263 1 1 37 LYS HG2 H -6.425 1.161 11.377 1.00 . A A . 37 LYS HG2 1 1 11 10264 1 1 37 LYS HG3 H -7.143 -0.452 11.349 1.00 . A A . 37 LYS HG3 1 1 11 10265 1 1 37 LYS HZ1 H -3.258 2.160 13.115 1.00 . A A . 37 LYS HZ1 1 1 11 10266 1 1 37 LYS HZ2 H -4.449 2.423 11.945 1.00 . A A . 37 LYS HZ2 1 1 11 10267 1 1 37 LYS HZ3 H -3.545 0.993 11.923 1.00 . A A . 37 LYS HZ3 1 1 11 10268 1 1 37 LYS N N -6.139 1.488 8.814 1.00 . A A . 37 LYS N 1 1 11 10269 1 1 37 LYS NZ N -3.993 1.702 12.540 1.00 . A A . 37 LYS NZ 1 1 11 10270 1 1 37 LYS O O -2.805 0.148 8.549 1.00 . A A . 37 LYS O 1 1 11 10271 1 1 38 ASP C C -2.785 1.003 5.418 1.00 . A A . 38 ASP C 1 1 11 10272 1 1 38 ASP CA C -3.649 -0.138 5.940 1.00 . A A . 38 ASP CA 1 1 11 10273 1 1 38 ASP CB C -4.523 -0.690 4.813 1.00 . A A . 38 ASP CB 1 1 11 10274 1 1 38 ASP CG C -4.829 -2.167 4.986 1.00 . A A . 38 ASP CG 1 1 11 10275 1 1 38 ASP H H -5.417 0.526 6.895 1.00 . A A . 38 ASP H 1 1 11 10276 1 1 38 ASP HA H -3.002 -0.925 6.301 1.00 . A A . 38 ASP HA 1 1 11 10277 1 1 38 ASP HB2 H -5.457 -0.150 4.792 1.00 . A A . 38 ASP HB2 1 1 11 10278 1 1 38 ASP HB3 H -4.013 -0.555 3.870 1.00 . A A . 38 ASP HB3 1 1 11 10279 1 1 38 ASP N N -4.476 0.305 7.055 1.00 . A A . 38 ASP N 1 1 11 10280 1 1 38 ASP O O -1.579 0.846 5.225 1.00 . A A . 38 ASP O 1 1 11 10281 1 1 38 ASP OD1 O -4.603 -2.694 6.096 1.00 . A A . 38 ASP OD1 1 1 11 10282 1 1 38 ASP OD2 O -5.293 -2.795 4.012 1.00 . A A . 38 ASP OD2 1 1 11 10283 1 1 39 ALA C C -1.660 3.806 5.715 1.00 . A A . 39 ALA C 1 1 11 10284 1 1 39 ALA CA C -2.692 3.326 4.700 1.00 . A A . 39 ALA CA 1 1 11 10285 1 1 39 ALA CB C -3.672 4.442 4.369 1.00 . A A . 39 ALA CB 1 1 11 10286 1 1 39 ALA H H -4.370 2.222 5.370 1.00 . A A . 39 ALA H 1 1 11 10287 1 1 39 ALA HA H -2.181 3.045 3.791 1.00 . A A . 39 ALA HA 1 1 11 10288 1 1 39 ALA HB1 H -3.411 4.878 3.416 1.00 . A A . 39 ALA HB1 1 1 11 10289 1 1 39 ALA HB2 H -3.628 5.199 5.137 1.00 . A A . 39 ALA HB2 1 1 11 10290 1 1 39 ALA HB3 H -4.673 4.038 4.317 1.00 . A A . 39 ALA HB3 1 1 11 10291 1 1 39 ALA N N -3.408 2.156 5.195 1.00 . A A . 39 ALA N 1 1 11 10292 1 1 39 ALA O O -0.679 4.457 5.357 1.00 . A A . 39 ALA O 1 1 11 10293 1 1 40 TYR C C 0.373 3.183 7.904 1.00 . A A . 40 TYR C 1 1 11 10294 1 1 40 TYR CA C -0.977 3.880 8.049 1.00 . A A . 40 TYR CA 1 1 11 10295 1 1 40 TYR CB C -1.588 3.557 9.414 1.00 . A A . 40 TYR CB 1 1 11 10296 1 1 40 TYR CD1 C -0.346 5.207 10.864 1.00 . A A . 40 TYR CD1 1 1 11 10297 1 1 40 TYR CD2 C -0.166 2.889 11.387 1.00 . A A . 40 TYR CD2 1 1 11 10298 1 1 40 TYR CE1 C 0.482 5.517 11.924 1.00 . A A . 40 TYR CE1 1 1 11 10299 1 1 40 TYR CE2 C 0.663 3.190 12.452 1.00 . A A . 40 TYR CE2 1 1 11 10300 1 1 40 TYR CG C -0.683 3.890 10.578 1.00 . A A . 40 TYR CG 1 1 11 10301 1 1 40 TYR CZ C 0.983 4.505 12.716 1.00 . A A . 40 TYR CZ 1 1 11 10302 1 1 40 TYR H H -2.686 2.960 7.212 1.00 . A A . 40 TYR H 1 1 11 10303 1 1 40 TYR HA H -0.828 4.946 7.975 1.00 . A A . 40 TYR HA 1 1 11 10304 1 1 40 TYR HB2 H -2.503 4.120 9.534 1.00 . A A . 40 TYR HB2 1 1 11 10305 1 1 40 TYR HB3 H -1.811 2.498 9.460 1.00 . A A . 40 TYR HB3 1 1 11 10306 1 1 40 TYR HD1 H -0.742 5.997 10.242 1.00 . A A . 40 TYR HD1 1 1 11 10307 1 1 40 TYR HD2 H -0.420 1.859 11.178 1.00 . A A . 40 TYR HD2 1 1 11 10308 1 1 40 TYR HE1 H 0.732 6.547 12.131 1.00 . A A . 40 TYR HE1 1 1 11 10309 1 1 40 TYR HE2 H 1.056 2.397 13.071 1.00 . A A . 40 TYR HE2 1 1 11 10310 1 1 40 TYR HH H 1.349 5.396 14.380 1.00 . A A . 40 TYR HH 1 1 11 10311 1 1 40 TYR N N -1.888 3.480 6.985 1.00 . A A . 40 TYR N 1 1 11 10312 1 1 40 TYR O O 1.377 3.813 7.573 1.00 . A A . 40 TYR O 1 1 11 10313 1 1 40 TYR OH O 1.809 4.808 13.774 1.00 . A A . 40 TYR OH 1 1 11 10314 1 1 41 ARG C C 2.212 1.181 6.654 1.00 . A A . 41 ARG C 1 1 11 10315 1 1 41 ARG CA C 1.614 1.092 8.055 1.00 . A A . 41 ARG CA 1 1 11 10316 1 1 41 ARG CB C 1.336 -0.371 8.408 1.00 . A A . 41 ARG CB 1 1 11 10317 1 1 41 ARG CD C -0.326 -1.721 9.723 1.00 . A A . 41 ARG CD 1 1 11 10318 1 1 41 ARG CG C 0.648 -0.554 9.750 1.00 . A A . 41 ARG CG 1 1 11 10319 1 1 41 ARG CZ C 0.826 -3.543 10.919 1.00 . A A . 41 ARG CZ 1 1 11 10320 1 1 41 ARG H H -0.445 1.432 8.416 1.00 . A A . 41 ARG H 1 1 11 10321 1 1 41 ARG HA H 2.323 1.493 8.763 1.00 . A A . 41 ARG HA 1 1 11 10322 1 1 41 ARG HB2 H 0.704 -0.799 7.642 1.00 . A A . 41 ARG HB2 1 1 11 10323 1 1 41 ARG HB3 H 2.273 -0.908 8.431 1.00 . A A . 41 ARG HB3 1 1 11 10324 1 1 41 ARG HD2 H -0.994 -1.636 10.567 1.00 . A A . 41 ARG HD2 1 1 11 10325 1 1 41 ARG HD3 H -0.897 -1.675 8.808 1.00 . A A . 41 ARG HD3 1 1 11 10326 1 1 41 ARG HE H 0.478 -3.503 8.953 1.00 . A A . 41 ARG HE 1 1 11 10327 1 1 41 ARG HG2 H 1.397 -0.740 10.505 1.00 . A A . 41 ARG HG2 1 1 11 10328 1 1 41 ARG HG3 H 0.108 0.349 9.993 1.00 . A A . 41 ARG HG3 1 1 11 10329 1 1 41 ARG HH11 H 0.227 -2.014 12.099 1.00 . A A . 41 ARG HH11 1 1 11 10330 1 1 41 ARG HH12 H 1.036 -3.310 12.915 1.00 . A A . 41 ARG HH12 1 1 11 10331 1 1 41 ARG HH21 H 1.541 -5.208 10.025 1.00 . A A . 41 ARG HH21 1 1 11 10332 1 1 41 ARG HH22 H 1.783 -5.123 11.738 1.00 . A A . 41 ARG HH22 1 1 11 10333 1 1 41 ARG N N 0.388 1.877 8.155 1.00 . A A . 41 ARG N 1 1 11 10334 1 1 41 ARG NE N 0.360 -3.009 9.791 1.00 . A A . 41 ARG NE 1 1 11 10335 1 1 41 ARG NH1 N 0.685 -2.903 12.072 1.00 . A A . 41 ARG NH1 1 1 11 10336 1 1 41 ARG NH2 N 1.433 -4.721 10.892 1.00 . A A . 41 ARG NH2 1 1 11 10337 1 1 41 ARG O O 3.424 1.057 6.478 1.00 . A A . 41 ARG O 1 1 11 10338 1 1 42 LEU C C 2.805 2.628 4.101 1.00 . A A . 42 LEU C 1 1 11 10339 1 1 42 LEU CA C 1.800 1.493 4.275 1.00 . A A . 42 LEU CA 1 1 11 10340 1 1 42 LEU CB C 0.602 1.706 3.346 1.00 . A A . 42 LEU CB 1 1 11 10341 1 1 42 LEU CD1 C -1.112 0.764 1.776 1.00 . A A . 42 LEU CD1 1 1 11 10342 1 1 42 LEU CD2 C 1.176 -0.256 1.892 1.00 . A A . 42 LEU CD2 1 1 11 10343 1 1 42 LEU CG C 0.069 0.436 2.679 1.00 . A A . 42 LEU CG 1 1 11 10344 1 1 42 LEU H H 0.400 1.481 5.863 1.00 . A A . 42 LEU H 1 1 11 10345 1 1 42 LEU HA H 2.281 0.563 4.017 1.00 . A A . 42 LEU HA 1 1 11 10346 1 1 42 LEU HB2 H -0.198 2.149 3.922 1.00 . A A . 42 LEU HB2 1 1 11 10347 1 1 42 LEU HB3 H 0.891 2.398 2.571 1.00 . A A . 42 LEU HB3 1 1 11 10348 1 1 42 LEU HD11 H -1.173 1.832 1.635 1.00 . A A . 42 LEU HD11 1 1 11 10349 1 1 42 LEU HD12 H -2.023 0.409 2.234 1.00 . A A . 42 LEU HD12 1 1 11 10350 1 1 42 LEU HD13 H -0.979 0.282 0.818 1.00 . A A . 42 LEU HD13 1 1 11 10351 1 1 42 LEU HD21 H 0.830 -0.469 0.892 1.00 . A A . 42 LEU HD21 1 1 11 10352 1 1 42 LEU HD22 H 1.441 -1.180 2.383 1.00 . A A . 42 LEU HD22 1 1 11 10353 1 1 42 LEU HD23 H 2.041 0.388 1.844 1.00 . A A . 42 LEU HD23 1 1 11 10354 1 1 42 LEU HG H -0.276 -0.245 3.442 1.00 . A A . 42 LEU HG 1 1 11 10355 1 1 42 LEU N N 1.355 1.393 5.660 1.00 . A A . 42 LEU N 1 1 11 10356 1 1 42 LEU O O 3.735 2.528 3.300 1.00 . A A . 42 LEU O 1 1 11 10357 1 1 43 GLU C C 4.866 4.534 5.393 1.00 . A A . 43 GLU C 1 1 11 10358 1 1 43 GLU CA C 3.508 4.855 4.777 1.00 . A A . 43 GLU CA 1 1 11 10359 1 1 43 GLU CB C 2.885 6.060 5.486 1.00 . A A . 43 GLU CB 1 1 11 10360 1 1 43 GLU CD C 3.568 8.312 6.404 1.00 . A A . 43 GLU CD 1 1 11 10361 1 1 43 GLU CG C 3.616 7.366 5.220 1.00 . A A . 43 GLU CG 1 1 11 10362 1 1 43 GLU H H 1.857 3.728 5.473 1.00 . A A . 43 GLU H 1 1 11 10363 1 1 43 GLU HA H 3.648 5.097 3.734 1.00 . A A . 43 GLU HA 1 1 11 10364 1 1 43 GLU HB2 H 1.863 6.170 5.155 1.00 . A A . 43 GLU HB2 1 1 11 10365 1 1 43 GLU HB3 H 2.892 5.879 6.550 1.00 . A A . 43 GLU HB3 1 1 11 10366 1 1 43 GLU HG2 H 4.647 7.147 4.994 1.00 . A A . 43 GLU HG2 1 1 11 10367 1 1 43 GLU HG3 H 3.158 7.853 4.371 1.00 . A A . 43 GLU HG3 1 1 11 10368 1 1 43 GLU N N 2.615 3.705 4.853 1.00 . A A . 43 GLU N 1 1 11 10369 1 1 43 GLU O O 5.888 5.088 4.989 1.00 . A A . 43 GLU O 1 1 11 10370 1 1 43 GLU OE1 O 2.596 9.089 6.505 1.00 . A A . 43 GLU OE1 1 1 11 10371 1 1 43 GLU OE2 O 4.504 8.274 7.231 1.00 . A A . 43 GLU OE2 1 1 11 10372 1 1 44 ILE C C 6.896 2.246 6.202 1.00 . A A . 44 ILE C 1 1 11 10373 1 1 44 ILE CA C 6.103 3.241 7.043 1.00 . A A . 44 ILE CA 1 1 11 10374 1 1 44 ILE CB C 5.816 2.620 8.421 1.00 . A A . 44 ILE CB 1 1 11 10375 1 1 44 ILE CD1 C 5.067 3.449 10.726 1.00 . A A . 44 ILE CD1 1 1 11 10376 1 1 44 ILE CG1 C 4.887 3.541 9.225 1.00 . A A . 44 ILE CG1 1 1 11 10377 1 1 44 ILE CG2 C 7.121 2.365 9.164 1.00 . A A . 44 ILE CG2 1 1 11 10378 1 1 44 ILE H H 4.022 3.228 6.650 1.00 . A A . 44 ILE H 1 1 11 10379 1 1 44 ILE HA H 6.699 4.130 7.191 1.00 . A A . 44 ILE HA 1 1 11 10380 1 1 44 ILE HB H 5.325 1.670 8.270 1.00 . A A . 44 ILE HB 1 1 11 10381 1 1 44 ILE HD11 H 4.375 4.117 11.214 1.00 . A A . 44 ILE HD11 1 1 11 10382 1 1 44 ILE HD12 H 6.078 3.727 10.980 1.00 . A A . 44 ILE HD12 1 1 11 10383 1 1 44 ILE HD13 H 4.879 2.436 11.048 1.00 . A A . 44 ILE HD13 1 1 11 10384 1 1 44 ILE HG12 H 5.070 4.564 8.936 1.00 . A A . 44 ILE HG12 1 1 11 10385 1 1 44 ILE HG13 H 3.861 3.289 8.998 1.00 . A A . 44 ILE HG13 1 1 11 10386 1 1 44 ILE HG21 H 7.758 1.732 8.564 1.00 . A A . 44 ILE HG21 1 1 11 10387 1 1 44 ILE HG22 H 6.912 1.877 10.104 1.00 . A A . 44 ILE HG22 1 1 11 10388 1 1 44 ILE HG23 H 7.620 3.304 9.349 1.00 . A A . 44 ILE HG23 1 1 11 10389 1 1 44 ILE N N 4.869 3.635 6.372 1.00 . A A . 44 ILE N 1 1 11 10390 1 1 44 ILE O O 8.109 2.379 6.046 1.00 . A A . 44 ILE O 1 1 11 10391 1 1 45 VAL C C 7.565 0.847 3.649 1.00 . A A . 45 VAL C 1 1 11 10392 1 1 45 VAL CA C 6.843 0.227 4.839 1.00 . A A . 45 VAL CA 1 1 11 10393 1 1 45 VAL CB C 5.820 -0.792 4.311 1.00 . A A . 45 VAL CB 1 1 11 10394 1 1 45 VAL CG1 C 5.327 -1.692 5.433 1.00 . A A . 45 VAL CG1 1 1 11 10395 1 1 45 VAL CG2 C 4.657 -0.081 3.636 1.00 . A A . 45 VAL CG2 1 1 11 10396 1 1 45 VAL H H 5.237 1.195 5.824 1.00 . A A . 45 VAL H 1 1 11 10397 1 1 45 VAL HA H 7.560 -0.298 5.452 1.00 . A A . 45 VAL HA 1 1 11 10398 1 1 45 VAL HB H 6.310 -1.408 3.572 1.00 . A A . 45 VAL HB 1 1 11 10399 1 1 45 VAL HG11 H 6.110 -2.383 5.708 1.00 . A A . 45 VAL HG11 1 1 11 10400 1 1 45 VAL HG12 H 4.462 -2.244 5.098 1.00 . A A . 45 VAL HG12 1 1 11 10401 1 1 45 VAL HG13 H 5.062 -1.088 6.288 1.00 . A A . 45 VAL HG13 1 1 11 10402 1 1 45 VAL HG21 H 5.022 0.487 2.793 1.00 . A A . 45 VAL HG21 1 1 11 10403 1 1 45 VAL HG22 H 4.186 0.586 4.341 1.00 . A A . 45 VAL HG22 1 1 11 10404 1 1 45 VAL HG23 H 3.937 -0.810 3.293 1.00 . A A . 45 VAL HG23 1 1 11 10405 1 1 45 VAL N N 6.202 1.248 5.662 1.00 . A A . 45 VAL N 1 1 11 10406 1 1 45 VAL O O 8.666 0.428 3.289 1.00 . A A . 45 VAL O 1 1 11 10407 1 1 46 THR C C 8.480 3.613 2.275 1.00 . A A . 46 THR C 1 1 11 10408 1 1 46 THR CA C 7.493 2.516 1.876 1.00 . A A . 46 THR CA 1 1 11 10409 1 1 46 THR CB C 6.363 3.113 1.042 1.00 . A A . 46 THR CB 1 1 11 10410 1 1 46 THR CG2 C 5.442 2.072 0.445 1.00 . A A . 46 THR CG2 1 1 11 10411 1 1 46 THR H H 6.053 2.116 3.362 1.00 . A A . 46 THR H 1 1 11 10412 1 1 46 THR HA H 8.011 1.780 1.281 1.00 . A A . 46 THR HA 1 1 11 10413 1 1 46 THR HB H 6.791 3.680 0.235 1.00 . A A . 46 THR HB 1 1 11 10414 1 1 46 THR HG1 H 5.830 4.896 1.654 1.00 . A A . 46 THR HG1 1 1 11 10415 1 1 46 THR HG21 H 6.024 1.229 0.103 1.00 . A A . 46 THR HG21 1 1 11 10416 1 1 46 THR HG22 H 4.904 2.501 -0.387 1.00 . A A . 46 THR HG22 1 1 11 10417 1 1 46 THR HG23 H 4.738 1.741 1.195 1.00 . A A . 46 THR HG23 1 1 11 10418 1 1 46 THR N N 6.930 1.838 3.035 1.00 . A A . 46 THR N 1 1 11 10419 1 1 46 THR O O 8.599 4.627 1.586 1.00 . A A . 46 THR O 1 1 11 10420 1 1 46 THR OG1 O 5.571 3.988 1.827 1.00 . A A . 46 THR OG1 1 1 11 10421 1 1 47 ALA C C 9.605 5.800 3.848 1.00 . A A . 47 ALA C 1 1 11 10422 1 1 47 ALA CA C 10.172 4.382 3.857 1.00 . A A . 47 ALA CA 1 1 11 10423 1 1 47 ALA CB C 11.434 4.312 3.011 1.00 . A A . 47 ALA CB 1 1 11 10424 1 1 47 ALA H H 9.061 2.582 3.888 1.00 . A A . 47 ALA H 1 1 11 10425 1 1 47 ALA HA H 10.435 4.119 4.872 1.00 . A A . 47 ALA HA 1 1 11 10426 1 1 47 ALA HB1 H 11.173 4.036 1.999 1.00 . A A . 47 ALA HB1 1 1 11 10427 1 1 47 ALA HB2 H 12.105 3.575 3.425 1.00 . A A . 47 ALA HB2 1 1 11 10428 1 1 47 ALA HB3 H 11.918 5.279 3.006 1.00 . A A . 47 ALA HB3 1 1 11 10429 1 1 47 ALA N N 9.192 3.409 3.382 1.00 . A A . 47 ALA N 1 1 11 10430 1 1 47 ALA O O 10.309 6.757 3.526 1.00 . A A . 47 ALA O 1 1 11 10431 1 1 48 GLY C C 7.564 7.841 2.843 1.00 . A A . 48 GLY C 1 1 11 10432 1 1 48 GLY CA C 7.696 7.232 4.226 1.00 . A A . 48 GLY CA 1 1 11 10433 1 1 48 GLY H H 7.818 5.129 4.449 1.00 . A A . 48 GLY H 1 1 11 10434 1 1 48 GLY HA2 H 6.712 7.133 4.658 1.00 . A A . 48 GLY HA2 1 1 11 10435 1 1 48 GLY HA3 H 8.284 7.893 4.845 1.00 . A A . 48 GLY HA3 1 1 11 10436 1 1 48 GLY N N 8.331 5.927 4.201 1.00 . A A . 48 GLY N 1 1 11 10437 1 1 48 GLY O O 7.454 9.060 2.704 1.00 . A A . 48 GLY O 1 1 11 10438 1 1 49 ALA C C 6.135 8.196 0.230 1.00 . A A . 49 ALA C 1 1 11 10439 1 1 49 ALA CA C 7.453 7.462 0.442 1.00 . A A . 49 ALA CA 1 1 11 10440 1 1 49 ALA CB C 7.571 6.292 -0.524 1.00 . A A . 49 ALA CB 1 1 11 10441 1 1 49 ALA H H 7.663 6.035 1.990 1.00 . A A . 49 ALA H 1 1 11 10442 1 1 49 ALA HA H 8.270 8.142 0.248 1.00 . A A . 49 ALA HA 1 1 11 10443 1 1 49 ALA HB1 H 6.756 5.604 -0.356 1.00 . A A . 49 ALA HB1 1 1 11 10444 1 1 49 ALA HB2 H 8.510 5.784 -0.362 1.00 . A A . 49 ALA HB2 1 1 11 10445 1 1 49 ALA HB3 H 7.529 6.658 -1.539 1.00 . A A . 49 ALA HB3 1 1 11 10446 1 1 49 ALA N N 7.574 6.995 1.818 1.00 . A A . 49 ALA N 1 1 11 10447 1 1 49 ALA O O 6.058 9.146 -0.549 1.00 . A A . 49 ALA O 1 1 11 10448 1 1 50 LEU C C 3.468 9.189 2.070 1.00 . A A . 50 LEU C 1 1 11 10449 1 1 50 LEU CA C 3.780 8.363 0.827 1.00 . A A . 50 LEU CA 1 1 11 10450 1 1 50 LEU CB C 2.708 7.288 0.630 1.00 . A A . 50 LEU CB 1 1 11 10451 1 1 50 LEU CD1 C 2.120 5.483 -1.010 1.00 . A A . 50 LEU CD1 1 1 11 10452 1 1 50 LEU CD2 C 1.159 7.776 -1.278 1.00 . A A . 50 LEU CD2 1 1 11 10453 1 1 50 LEU CG C 2.370 6.972 -0.828 1.00 . A A . 50 LEU CG 1 1 11 10454 1 1 50 LEU H H 5.224 6.990 1.539 1.00 . A A . 50 LEU H 1 1 11 10455 1 1 50 LEU HA H 3.786 9.015 -0.032 1.00 . A A . 50 LEU HA 1 1 11 10456 1 1 50 LEU HB2 H 3.050 6.379 1.105 1.00 . A A . 50 LEU HB2 1 1 11 10457 1 1 50 LEU HB3 H 1.805 7.613 1.123 1.00 . A A . 50 LEU HB3 1 1 11 10458 1 1 50 LEU HD11 H 1.789 5.056 -0.074 1.00 . A A . 50 LEU HD11 1 1 11 10459 1 1 50 LEU HD12 H 3.034 4.999 -1.322 1.00 . A A . 50 LEU HD12 1 1 11 10460 1 1 50 LEU HD13 H 1.359 5.333 -1.762 1.00 . A A . 50 LEU HD13 1 1 11 10461 1 1 50 LEU HD21 H 1.290 8.080 -2.306 1.00 . A A . 50 LEU HD21 1 1 11 10462 1 1 50 LEU HD22 H 1.057 8.652 -0.655 1.00 . A A . 50 LEU HD22 1 1 11 10463 1 1 50 LEU HD23 H 0.270 7.169 -1.193 1.00 . A A . 50 LEU HD23 1 1 11 10464 1 1 50 LEU HG H 3.207 7.248 -1.453 1.00 . A A . 50 LEU HG 1 1 11 10465 1 1 50 LEU N N 5.098 7.750 0.933 1.00 . A A . 50 LEU N 1 1 11 10466 1 1 50 LEU O O 4.303 9.324 2.964 1.00 . A A . 50 LEU O 1 1 11 10467 1 1 51 LYS C C 0.404 10.233 3.655 1.00 . A A . 51 LYS C 1 1 11 10468 1 1 51 LYS CA C 1.841 10.555 3.256 1.00 . A A . 51 LYS CA 1 1 11 10469 1 1 51 LYS CB C 1.966 12.043 2.919 1.00 . A A . 51 LYS CB 1 1 11 10470 1 1 51 LYS CD C 0.473 13.731 1.804 1.00 . A A . 51 LYS CD 1 1 11 10471 1 1 51 LYS CE C 1.381 14.948 1.716 1.00 . A A . 51 LYS CE 1 1 11 10472 1 1 51 LYS CG C 1.256 12.439 1.634 1.00 . A A . 51 LYS CG 1 1 11 10473 1 1 51 LYS H H 1.637 9.598 1.378 1.00 . A A . 51 LYS H 1 1 11 10474 1 1 51 LYS HA H 2.492 10.328 4.086 1.00 . A A . 51 LYS HA 1 1 11 10475 1 1 51 LYS HB2 H 1.549 12.620 3.730 1.00 . A A . 51 LYS HB2 1 1 11 10476 1 1 51 LYS HB3 H 3.013 12.288 2.815 1.00 . A A . 51 LYS HB3 1 1 11 10477 1 1 51 LYS HD2 H -0.272 13.795 1.026 1.00 . A A . 51 LYS HD2 1 1 11 10478 1 1 51 LYS HD3 H -0.010 13.724 2.770 1.00 . A A . 51 LYS HD3 1 1 11 10479 1 1 51 LYS HE2 H 2.405 14.630 1.852 1.00 . A A . 51 LYS HE2 1 1 11 10480 1 1 51 LYS HE3 H 1.271 15.394 0.739 1.00 . A A . 51 LYS HE3 1 1 11 10481 1 1 51 LYS HG2 H 1.990 12.574 0.855 1.00 . A A . 51 LYS HG2 1 1 11 10482 1 1 51 LYS HG3 H 0.572 11.649 1.355 1.00 . A A . 51 LYS HG3 1 1 11 10483 1 1 51 LYS HZ1 H 0.047 15.889 3.019 1.00 . A A . 51 LYS HZ1 1 1 11 10484 1 1 51 LYS HZ2 H 1.230 16.921 2.386 1.00 . A A . 51 LYS HZ2 1 1 11 10485 1 1 51 LYS HZ3 H 1.635 15.815 3.600 1.00 . A A . 51 LYS HZ3 1 1 11 10486 1 1 51 LYS N N 2.261 9.742 2.121 1.00 . A A . 51 LYS N 1 1 11 10487 1 1 51 LYS NZ N 1.050 15.964 2.752 1.00 . A A . 51 LYS NZ 1 1 11 10488 1 1 51 LYS O O -0.525 10.408 2.866 1.00 . A A . 51 LYS O 1 1 11 10489 1 1 52 TYR C C -2.010 10.635 5.393 1.00 . A A . 52 TYR C 1 1 11 10490 1 1 52 TYR CA C -1.094 9.414 5.388 1.00 . A A . 52 TYR CA 1 1 11 10491 1 1 52 TYR CB C -0.990 8.835 6.801 1.00 . A A . 52 TYR CB 1 1 11 10492 1 1 52 TYR CD1 C -3.278 8.800 7.866 1.00 . A A . 52 TYR CD1 1 1 11 10493 1 1 52 TYR CD2 C -2.380 6.745 7.058 1.00 . A A . 52 TYR CD2 1 1 11 10494 1 1 52 TYR CE1 C -4.421 8.143 8.279 1.00 . A A . 52 TYR CE1 1 1 11 10495 1 1 52 TYR CE2 C -3.521 6.081 7.468 1.00 . A A . 52 TYR CE2 1 1 11 10496 1 1 52 TYR CG C -2.239 8.113 7.250 1.00 . A A . 52 TYR CG 1 1 11 10497 1 1 52 TYR CZ C -4.538 6.785 8.077 1.00 . A A . 52 TYR CZ 1 1 11 10498 1 1 52 TYR H H 1.009 9.643 5.467 1.00 . A A . 52 TYR H 1 1 11 10499 1 1 52 TYR HA H -1.514 8.667 4.732 1.00 . A A . 52 TYR HA 1 1 11 10500 1 1 52 TYR HB2 H -0.171 8.132 6.833 1.00 . A A . 52 TYR HB2 1 1 11 10501 1 1 52 TYR HB3 H -0.799 9.636 7.498 1.00 . A A . 52 TYR HB3 1 1 11 10502 1 1 52 TYR HD1 H -3.183 9.865 8.022 1.00 . A A . 52 TYR HD1 1 1 11 10503 1 1 52 TYR HD2 H -1.582 6.196 6.581 1.00 . A A . 52 TYR HD2 1 1 11 10504 1 1 52 TYR HE1 H -5.217 8.696 8.756 1.00 . A A . 52 TYR HE1 1 1 11 10505 1 1 52 TYR HE2 H -3.614 5.017 7.309 1.00 . A A . 52 TYR HE2 1 1 11 10506 1 1 52 TYR HH H -5.434 5.276 8.860 1.00 . A A . 52 TYR HH 1 1 11 10507 1 1 52 TYR N N 0.230 9.761 4.885 1.00 . A A . 52 TYR N 1 1 11 10508 1 1 52 TYR O O -1.564 11.757 5.630 1.00 . A A . 52 TYR O 1 1 11 10509 1 1 52 TYR OH O -5.674 6.127 8.486 1.00 . A A . 52 TYR OH 1 1 11 10510 1 1 53 GLN C C -5.506 11.128 5.923 1.00 . A A . 53 GLN C 1 1 11 10511 1 1 53 GLN CA C -4.270 11.489 5.105 1.00 . A A . 53 GLN CA 1 1 11 10512 1 1 53 GLN CB C -4.673 11.804 3.662 1.00 . A A . 53 GLN CB 1 1 11 10513 1 1 53 GLN CD C -3.890 12.040 1.271 1.00 . A A . 53 GLN CD 1 1 11 10514 1 1 53 GLN CG C -3.490 12.024 2.734 1.00 . A A . 53 GLN CG 1 1 11 10515 1 1 53 GLN H H -3.588 9.491 4.949 1.00 . A A . 53 GLN H 1 1 11 10516 1 1 53 GLN HA H -3.808 12.362 5.539 1.00 . A A . 53 GLN HA 1 1 11 10517 1 1 53 GLN HB2 H -5.259 10.983 3.276 1.00 . A A . 53 GLN HB2 1 1 11 10518 1 1 53 GLN HB3 H -5.278 12.700 3.657 1.00 . A A . 53 GLN HB3 1 1 11 10519 1 1 53 GLN HE21 H -2.057 11.486 0.739 1.00 . A A . 53 GLN HE21 1 1 11 10520 1 1 53 GLN HE22 H -3.177 11.716 -0.555 1.00 . A A . 53 GLN HE22 1 1 11 10521 1 1 53 GLN HG2 H -3.030 12.971 2.975 1.00 . A A . 53 GLN HG2 1 1 11 10522 1 1 53 GLN HG3 H -2.775 11.228 2.890 1.00 . A A . 53 GLN HG3 1 1 11 10523 1 1 53 GLN N N -3.292 10.407 5.130 1.00 . A A . 53 GLN N 1 1 11 10524 1 1 53 GLN NE2 N -2.946 11.714 0.396 1.00 . A A . 53 GLN NE2 1 1 11 10525 1 1 53 GLN O O -6.472 10.577 5.398 1.00 . A A . 53 GLN O 1 1 11 10526 1 1 53 GLN OE1 O -5.034 12.339 0.933 1.00 . A A . 53 GLN OE1 1 1 11 10527 1 1 54 GLU C C -7.864 11.840 7.632 1.00 . A A . 54 GLU C 1 1 11 10528 1 1 54 GLU CA C -6.581 11.158 8.108 1.00 . A A . 54 GLU CA 1 1 11 10529 1 1 54 GLU CB C -6.249 11.613 9.530 1.00 . A A . 54 GLU CB 1 1 11 10530 1 1 54 GLU CD C -5.635 13.531 11.055 1.00 . A A . 54 GLU CD 1 1 11 10531 1 1 54 GLU CG C -5.891 13.087 9.628 1.00 . A A . 54 GLU CG 1 1 11 10532 1 1 54 GLU H H -4.667 11.886 7.572 1.00 . A A . 54 GLU H 1 1 11 10533 1 1 54 GLU HA H -6.737 10.091 8.110 1.00 . A A . 54 GLU HA 1 1 11 10534 1 1 54 GLU HB2 H -7.105 11.430 10.163 1.00 . A A . 54 GLU HB2 1 1 11 10535 1 1 54 GLU HB3 H -5.412 11.037 9.894 1.00 . A A . 54 GLU HB3 1 1 11 10536 1 1 54 GLU HG2 H -4.999 13.268 9.047 1.00 . A A . 54 GLU HG2 1 1 11 10537 1 1 54 GLU HG3 H -6.707 13.670 9.226 1.00 . A A . 54 GLU HG3 1 1 11 10538 1 1 54 GLU N N -5.466 11.446 7.212 1.00 . A A . 54 GLU N 1 1 11 10539 1 1 54 GLU O O -8.964 11.445 8.016 1.00 . A A . 54 GLU O 1 1 11 10540 1 1 54 GLU OE1 O -5.264 12.675 11.886 1.00 . A A . 54 GLU OE1 1 1 11 10541 1 1 54 GLU OE2 O -5.807 14.735 11.343 1.00 . A A . 54 GLU OE2 1 1 11 10542 1 1 55 ASN C C -9.892 12.661 5.655 1.00 . A A . 55 ASN C 1 1 11 10543 1 1 55 ASN CA C -8.863 13.603 6.278 1.00 . A A . 55 ASN CA 1 1 11 10544 1 1 55 ASN CB C -8.405 14.634 5.243 1.00 . A A . 55 ASN CB 1 1 11 10545 1 1 55 ASN CG C -9.001 16.007 5.492 1.00 . A A . 55 ASN CG 1 1 11 10546 1 1 55 ASN H H -6.813 13.140 6.531 1.00 . A A . 55 ASN H 1 1 11 10547 1 1 55 ASN HA H -9.325 14.121 7.105 1.00 . A A . 55 ASN HA 1 1 11 10548 1 1 55 ASN HB2 H -7.329 14.717 5.281 1.00 . A A . 55 ASN HB2 1 1 11 10549 1 1 55 ASN HB3 H -8.700 14.305 4.258 1.00 . A A . 55 ASN HB3 1 1 11 10550 1 1 55 ASN HD21 H -8.848 16.450 3.559 1.00 . A A . 55 ASN HD21 1 1 11 10551 1 1 55 ASN HD22 H -9.518 17.686 4.562 1.00 . A A . 55 ASN HD22 1 1 11 10552 1 1 55 ASN N N -7.715 12.868 6.799 1.00 . A A . 55 ASN N 1 1 11 10553 1 1 55 ASN ND2 N -9.136 16.793 4.431 1.00 . A A . 55 ASN ND2 1 1 11 10554 1 1 55 ASN O O -11.080 12.747 5.949 1.00 . A A . 55 ASN O 1 1 11 10555 1 1 55 ASN OD1 O -9.336 16.355 6.623 1.00 . A A . 55 ASN OD1 1 1 11 10556 1 1 56 ALA C C -10.520 9.557 4.985 1.00 . A A . 56 ALA C 1 1 11 10557 1 1 56 ALA CA C -10.300 10.808 4.132 1.00 . A A . 56 ALA CA 1 1 11 10558 1 1 56 ALA CB C -9.742 10.428 2.773 1.00 . A A . 56 ALA CB 1 1 11 10559 1 1 56 ALA H H -8.464 11.742 4.599 1.00 . A A . 56 ALA H 1 1 11 10560 1 1 56 ALA HA H -11.250 11.292 3.976 1.00 . A A . 56 ALA HA 1 1 11 10561 1 1 56 ALA HB1 H -10.100 9.451 2.491 1.00 . A A . 56 ALA HB1 1 1 11 10562 1 1 56 ALA HB2 H -8.663 10.406 2.823 1.00 . A A . 56 ALA HB2 1 1 11 10563 1 1 56 ALA HB3 H -10.050 11.155 2.037 1.00 . A A . 56 ALA HB3 1 1 11 10564 1 1 56 ALA N N -9.424 11.762 4.795 1.00 . A A . 56 ALA N 1 1 11 10565 1 1 56 ALA O O -11.140 8.594 4.538 1.00 . A A . 56 ALA O 1 1 11 10566 1 1 57 TYR C C -10.960 8.806 8.349 1.00 . A A . 57 TYR C 1 1 11 10567 1 1 57 TYR CA C -10.140 8.437 7.115 1.00 . A A . 57 TYR CA 1 1 11 10568 1 1 57 TYR CB C -8.767 7.930 7.540 1.00 . A A . 57 TYR CB 1 1 11 10569 1 1 57 TYR CD1 C -8.400 6.373 5.588 1.00 . A A . 57 TYR CD1 1 1 11 10570 1 1 57 TYR CD2 C -6.686 7.946 6.110 1.00 . A A . 57 TYR CD2 1 1 11 10571 1 1 57 TYR CE1 C -7.644 5.892 4.535 1.00 . A A . 57 TYR CE1 1 1 11 10572 1 1 57 TYR CE2 C -5.924 7.470 5.059 1.00 . A A . 57 TYR CE2 1 1 11 10573 1 1 57 TYR CG C -7.935 7.406 6.393 1.00 . A A . 57 TYR CG 1 1 11 10574 1 1 57 TYR CZ C -6.407 6.444 4.275 1.00 . A A . 57 TYR CZ 1 1 11 10575 1 1 57 TYR H H -9.515 10.364 6.513 1.00 . A A . 57 TYR H 1 1 11 10576 1 1 57 TYR HA H -10.650 7.649 6.581 1.00 . A A . 57 TYR HA 1 1 11 10577 1 1 57 TYR HB2 H -8.220 8.739 8.003 1.00 . A A . 57 TYR HB2 1 1 11 10578 1 1 57 TYR HB3 H -8.890 7.131 8.255 1.00 . A A . 57 TYR HB3 1 1 11 10579 1 1 57 TYR HD1 H -9.369 5.943 5.795 1.00 . A A . 57 TYR HD1 1 1 11 10580 1 1 57 TYR HD2 H -6.311 8.750 6.725 1.00 . A A . 57 TYR HD2 1 1 11 10581 1 1 57 TYR HE1 H -8.024 5.089 3.923 1.00 . A A . 57 TYR HE1 1 1 11 10582 1 1 57 TYR HE2 H -4.956 7.903 4.856 1.00 . A A . 57 TYR HE2 1 1 11 10583 1 1 57 TYR HH H -5.852 5.041 3.080 1.00 . A A . 57 TYR HH 1 1 11 10584 1 1 57 TYR N N -10.000 9.573 6.211 1.00 . A A . 57 TYR N 1 1 11 10585 1 1 57 TYR O O -11.450 7.930 9.064 1.00 . A A . 57 TYR O 1 1 11 10586 1 1 57 TYR OH O -5.651 5.968 3.227 1.00 . A A . 57 TYR OH 1 1 11 10587 1 1 58 ARG C C -13.370 10.535 9.464 1.00 . A A . 58 ARG C 1 1 11 10588 1 1 58 ARG CA C -11.870 10.579 9.749 1.00 . A A . 58 ARG CA 1 1 11 10589 1 1 58 ARG CB C -11.450 12.007 10.112 1.00 . A A . 58 ARG CB 1 1 11 10590 1 1 58 ARG CD C -12.080 14.276 9.224 1.00 . A A . 58 ARG CD 1 1 11 10591 1 1 58 ARG CG C -11.400 12.948 8.919 1.00 . A A . 58 ARG CG 1 1 11 10592 1 1 58 ARG CZ C -12.960 16.190 7.946 1.00 . A A . 58 ARG CZ 1 1 11 10593 1 1 58 ARG H H -10.700 10.759 7.998 1.00 . A A . 58 ARG H 1 1 11 10594 1 1 58 ARG HA H -11.660 9.929 10.580 1.00 . A A . 58 ARG HA 1 1 11 10595 1 1 58 ARG HB2 H -12.160 12.404 10.829 1.00 . A A . 58 ARG HB2 1 1 11 10596 1 1 58 ARG HB3 H -10.470 11.978 10.562 1.00 . A A . 58 ARG HB3 1 1 11 10597 1 1 58 ARG HD2 H -13.070 14.085 9.588 1.00 . A A . 58 ARG HD2 1 1 11 10598 1 1 58 ARG HD3 H -11.510 14.788 9.986 1.00 . A A . 58 ARG HD3 1 1 11 10599 1 1 58 ARG HE H -11.590 14.905 7.278 1.00 . A A . 58 ARG HE 1 1 11 10600 1 1 58 ARG HG2 H -10.370 13.131 8.661 1.00 . A A . 58 ARG HG2 1 1 11 10601 1 1 58 ARG HG3 H -11.910 12.482 8.084 1.00 . A A . 58 ARG HG3 1 1 11 10602 1 1 58 ARG HH11 H -13.740 15.989 9.802 1.00 . A A . 58 ARG HH11 1 1 11 10603 1 1 58 ARG HH12 H -14.350 17.325 8.883 1.00 . A A . 58 ARG HH12 1 1 11 10604 1 1 58 ARG HH21 H -12.390 16.661 6.068 1.00 . A A . 58 ARG HH21 1 1 11 10605 1 1 58 ARG HH22 H -13.580 17.707 6.762 1.00 . A A . 58 ARG HH22 1 1 11 10606 1 1 58 ARG N N -11.110 10.105 8.599 1.00 . A A . 58 ARG N 1 1 11 10607 1 1 58 ARG NE N -12.160 15.131 8.041 1.00 . A A . 58 ARG NE 1 1 11 10608 1 1 58 ARG NH1 N -13.750 16.528 8.960 1.00 . A A . 58 ARG NH1 1 1 11 10609 1 1 58 ARG NH2 N -12.980 16.913 6.835 1.00 . A A . 58 ARG NH2 1 1 11 10610 1 1 58 ARG O O -13.880 11.305 8.652 1.00 . A A . 58 ARG O 1 1 11 10611 1 1 59 GLN C C -16.180 9.107 11.275 1.00 . A A . 59 GLN C 1 1 11 10612 1 1 59 GLN CA C -15.510 9.481 9.961 1.00 . A A . 59 GLN CA 1 1 11 10613 1 1 59 GLN CB C -15.800 8.421 8.900 1.00 . A A . 59 GLN CB 1 1 11 10614 1 1 59 GLN CD C -17.930 7.329 8.088 1.00 . A A . 59 GLN CD 1 1 11 10615 1 1 59 GLN CG C -17.140 8.616 8.202 1.00 . A A . 59 GLN CG 1 1 11 10616 1 1 59 GLN H H -13.600 9.042 10.775 1.00 . A A . 59 GLN H 1 1 11 10617 1 1 59 GLN HA H -15.900 10.431 9.627 1.00 . A A . 59 GLN HA 1 1 11 10618 1 1 59 GLN HB2 H -15.020 8.447 8.153 1.00 . A A . 59 GLN HB2 1 1 11 10619 1 1 59 GLN HB3 H -15.810 7.449 9.370 1.00 . A A . 59 GLN HB3 1 1 11 10620 1 1 59 GLN HE21 H -16.440 6.466 7.104 1.00 . A A . 59 GLN HE21 1 1 11 10621 1 1 59 GLN HE22 H -17.830 5.479 7.367 1.00 . A A . 59 GLN HE22 1 1 11 10622 1 1 59 GLN HG2 H -17.720 9.331 8.763 1.00 . A A . 59 GLN HG2 1 1 11 10623 1 1 59 GLN HG3 H -16.960 9.000 7.209 1.00 . A A . 59 GLN HG3 1 1 11 10624 1 1 59 GLN N N -14.070 9.627 10.140 1.00 . A A . 59 GLN N 1 1 11 10625 1 1 59 GLN NE2 N -17.340 6.322 7.455 1.00 . A A . 59 GLN NE2 1 1 11 10626 1 1 59 GLN O O -15.750 8.183 11.966 1.00 . A A . 59 GLN O 1 1 11 10627 1 1 59 GLN OE1 O -19.070 7.239 8.563 1.00 . A A . 59 GLN OE1 1 1 11 10628 1 1 60 ALA C C -19.490 9.602 12.602 1.00 . A A . 60 ALA C 1 1 11 10629 1 1 60 ALA CA C -17.980 9.571 12.847 1.00 . A A . 60 ALA CA 1 1 11 10630 1 1 60 ALA CB C -17.600 10.585 13.913 1.00 . A A . 60 ALA CB 1 1 11 10631 1 1 60 ALA H H -17.540 10.552 11.023 1.00 . A A . 60 ALA H 1 1 11 10632 1 1 60 ALA HA H -17.710 8.589 13.202 1.00 . A A . 60 ALA HA 1 1 11 10633 1 1 60 ALA HB1 H -18.340 11.369 13.949 1.00 . A A . 60 ALA HB1 1 1 11 10634 1 1 60 ALA HB2 H -16.640 11.014 13.674 1.00 . A A . 60 ALA HB2 1 1 11 10635 1 1 60 ALA HB3 H -17.550 10.095 14.874 1.00 . A A . 60 ALA HB3 1 1 11 10636 1 1 60 ALA N N -17.250 9.829 11.616 1.00 . A A . 60 ALA N 1 1 11 10637 1 1 60 ALA O O -20.130 10.635 12.774 1.00 . A A . 60 ALA O 1 1 11 10638 1 1 61 ALA C C -22.030 7.046 12.461 1.00 . A A . 61 ALA C 1 1 11 10639 1 1 61 ALA CA C -21.470 8.359 11.931 1.00 . A A . 61 ALA CA 1 1 11 10640 1 1 61 ALA CB C -21.740 8.486 10.439 1.00 . A A . 61 ALA CB 1 1 11 10641 1 1 61 ALA H H -19.470 7.673 12.080 1.00 . A A . 61 ALA H 1 1 11 10642 1 1 61 ALA HA H -21.960 9.180 12.432 1.00 . A A . 61 ALA HA 1 1 11 10643 1 1 61 ALA HB1 H -20.870 8.143 9.888 1.00 . A A . 61 ALA HB1 1 1 11 10644 1 1 61 ALA HB2 H -21.930 9.520 10.194 1.00 . A A . 61 ALA HB2 1 1 11 10645 1 1 61 ALA HB3 H -22.590 7.885 10.173 1.00 . A A . 61 ALA HB3 1 1 11 10646 1 1 61 ALA N N -20.040 8.462 12.200 1.00 . A A . 61 ALA N 1 1 11 10647 1 1 61 ALA O O -21.240 6.214 12.947 1.00 . A A . 61 ALA O 1 1 11 10648 1 1 61 ALA OXT O -23.270 6.859 12.387 1.00 . A A . 61 ALA OXT 1 1 12 10649 1 1 1 MET C C -4.956 6.257 -0.966 1.00 . A A . 1 MET C 1 1 12 10650 1 1 1 MET CA C -4.138 7.163 -0.048 1.00 . A A . 1 MET CA 1 1 12 10651 1 1 1 MET CB C -3.348 6.326 0.960 1.00 . A A . 1 MET CB 1 1 12 10652 1 1 1 MET CE C -0.605 7.129 3.320 1.00 . A A . 1 MET CE 1 1 12 10653 1 1 1 MET CG C -1.848 6.567 0.908 1.00 . A A . 1 MET CG 1 1 12 10654 1 1 1 MET H1 H -5.692 7.531 1.250 1.00 . A A . 1 MET H1 1 1 12 10655 1 1 1 MET H2 H -5.508 8.698 0.006 1.00 . A A . 1 MET H2 1 1 12 10656 1 1 1 MET H3 H -4.413 8.670 1.326 1.00 . A A . 1 MET H3 1 1 12 10657 1 1 1 MET HA H -3.452 7.742 -0.647 1.00 . A A . 1 MET HA 1 1 12 10658 1 1 1 MET HB2 H -3.694 6.561 1.956 1.00 . A A . 1 MET HB2 1 1 12 10659 1 1 1 MET HB3 H -3.529 5.278 0.765 1.00 . A A . 1 MET HB3 1 1 12 10660 1 1 1 MET HE1 H -0.553 6.790 4.344 1.00 . A A . 1 MET HE1 1 1 12 10661 1 1 1 MET HE2 H -1.385 7.870 3.225 1.00 . A A . 1 MET HE2 1 1 12 10662 1 1 1 MET HE3 H 0.342 7.565 3.036 1.00 . A A . 1 MET HE3 1 1 12 10663 1 1 1 MET HG2 H -1.469 6.197 -0.033 1.00 . A A . 1 MET HG2 1 1 12 10664 1 1 1 MET HG3 H -1.666 7.629 0.976 1.00 . A A . 1 MET HG3 1 1 12 10665 1 1 1 MET N N -5.017 8.100 0.701 1.00 . A A . 1 MET N 1 1 12 10666 1 1 1 MET O O -5.784 5.471 -0.502 1.00 . A A . 1 MET O 1 1 12 10667 1 1 1 MET SD S -0.967 5.742 2.249 1.00 . A A . 1 MET SD 1 1 12 10668 1 1 2 TYR C C -4.705 4.244 -3.498 1.00 . A A . 2 TYR C 1 1 12 10669 1 1 2 TYR CA C -5.429 5.562 -3.249 1.00 . A A . 2 TYR CA 1 1 12 10670 1 1 2 TYR CB C -5.580 6.333 -4.563 1.00 . A A . 2 TYR CB 1 1 12 10671 1 1 2 TYR CD1 C -7.260 7.963 -3.616 1.00 . A A . 2 TYR CD1 1 1 12 10672 1 1 2 TYR CD2 C -7.675 7.047 -5.778 1.00 . A A . 2 TYR CD2 1 1 12 10673 1 1 2 TYR CE1 C -8.432 8.693 -3.696 1.00 . A A . 2 TYR CE1 1 1 12 10674 1 1 2 TYR CE2 C -8.846 7.775 -5.865 1.00 . A A . 2 TYR CE2 1 1 12 10675 1 1 2 TYR CG C -6.862 7.129 -4.654 1.00 . A A . 2 TYR CG 1 1 12 10676 1 1 2 TYR CZ C -9.220 8.595 -4.822 1.00 . A A . 2 TYR CZ 1 1 12 10677 1 1 2 TYR H H -4.045 7.015 -2.576 1.00 . A A . 2 TYR H 1 1 12 10678 1 1 2 TYR HA H -6.411 5.349 -2.853 1.00 . A A . 2 TYR HA 1 1 12 10679 1 1 2 TYR HB2 H -4.755 7.021 -4.665 1.00 . A A . 2 TYR HB2 1 1 12 10680 1 1 2 TYR HB3 H -5.564 5.633 -5.386 1.00 . A A . 2 TYR HB3 1 1 12 10681 1 1 2 TYR HD1 H -6.639 8.038 -2.735 1.00 . A A . 2 TYR HD1 1 1 12 10682 1 1 2 TYR HD2 H -7.380 6.403 -6.592 1.00 . A A . 2 TYR HD2 1 1 12 10683 1 1 2 TYR HE1 H -8.722 9.336 -2.878 1.00 . A A . 2 TYR HE1 1 1 12 10684 1 1 2 TYR HE2 H -9.465 7.698 -6.747 1.00 . A A . 2 TYR HE2 1 1 12 10685 1 1 2 TYR HH H -11.040 8.938 -4.320 1.00 . A A . 2 TYR HH 1 1 12 10686 1 1 2 TYR N N -4.716 6.371 -2.268 1.00 . A A . 2 TYR N 1 1 12 10687 1 1 2 TYR O O -3.476 4.180 -3.452 1.00 . A A . 2 TYR O 1 1 12 10688 1 1 2 TYR OH O -10.380 9.320 -4.906 1.00 . A A . 2 TYR OH 1 1 12 10689 1 1 3 LYS C C -3.940 1.915 -5.202 1.00 . A A . 3 LYS C 1 1 12 10690 1 1 3 LYS CA C -4.907 1.874 -4.022 1.00 . A A . 3 LYS CA 1 1 12 10691 1 1 3 LYS CB C -6.024 0.863 -4.295 1.00 . A A . 3 LYS CB 1 1 12 10692 1 1 3 LYS CD C -6.647 -1.441 -5.080 1.00 . A A . 3 LYS CD 1 1 12 10693 1 1 3 LYS CE C -6.158 -2.486 -6.070 1.00 . A A . 3 LYS CE 1 1 12 10694 1 1 3 LYS CG C -5.517 -0.532 -4.625 1.00 . A A . 3 LYS CG 1 1 12 10695 1 1 3 LYS H H -6.447 3.306 -3.787 1.00 . A A . 3 LYS H 1 1 12 10696 1 1 3 LYS HA H -4.365 1.568 -3.139 1.00 . A A . 3 LYS HA 1 1 12 10697 1 1 3 LYS HB2 H -6.654 0.795 -3.421 1.00 . A A . 3 LYS HB2 1 1 12 10698 1 1 3 LYS HB3 H -6.615 1.214 -5.128 1.00 . A A . 3 LYS HB3 1 1 12 10699 1 1 3 LYS HD2 H -7.062 -1.944 -4.219 1.00 . A A . 3 LYS HD2 1 1 12 10700 1 1 3 LYS HD3 H -7.412 -0.842 -5.551 1.00 . A A . 3 LYS HD3 1 1 12 10701 1 1 3 LYS HE2 H -5.915 -1.995 -7.001 1.00 . A A . 3 LYS HE2 1 1 12 10702 1 1 3 LYS HE3 H -5.272 -2.956 -5.670 1.00 . A A . 3 LYS HE3 1 1 12 10703 1 1 3 LYS HG2 H -4.786 -0.463 -5.416 1.00 . A A . 3 LYS HG2 1 1 12 10704 1 1 3 LYS HG3 H -5.058 -0.956 -3.744 1.00 . A A . 3 LYS HG3 1 1 12 10705 1 1 3 LYS HZ1 H -7.385 -4.063 -5.458 1.00 . A A . 3 LYS HZ1 1 1 12 10706 1 1 3 LYS HZ2 H -6.847 -4.194 -7.055 1.00 . A A . 3 LYS HZ2 1 1 12 10707 1 1 3 LYS HZ3 H -8.067 -3.090 -6.664 1.00 . A A . 3 LYS HZ3 1 1 12 10708 1 1 3 LYS N N -5.475 3.192 -3.764 1.00 . A A . 3 LYS N 1 1 12 10709 1 1 3 LYS NZ N -7.186 -3.532 -6.330 1.00 . A A . 3 LYS NZ 1 1 12 10710 1 1 3 LYS O O -2.855 1.340 -5.148 1.00 . A A . 3 LYS O 1 1 12 10711 1 1 4 LYS C C -2.108 3.192 -7.120 1.00 . A A . 4 LYS C 1 1 12 10712 1 1 4 LYS CA C -3.516 2.717 -7.466 1.00 . A A . 4 LYS CA 1 1 12 10713 1 1 4 LYS CB C -4.161 3.683 -8.462 1.00 . A A . 4 LYS CB 1 1 12 10714 1 1 4 LYS CD C -4.247 4.559 -10.819 1.00 . A A . 4 LYS CD 1 1 12 10715 1 1 4 LYS CE C -4.950 3.752 -11.898 1.00 . A A . 4 LYS CE 1 1 12 10716 1 1 4 LYS CG C -3.511 3.661 -9.837 1.00 . A A . 4 LYS CG 1 1 12 10717 1 1 4 LYS H H -5.222 3.035 -6.251 1.00 . A A . 4 LYS H 1 1 12 10718 1 1 4 LYS HA H -3.451 1.740 -7.919 1.00 . A A . 4 LYS HA 1 1 12 10719 1 1 4 LYS HB2 H -5.203 3.421 -8.577 1.00 . A A . 4 LYS HB2 1 1 12 10720 1 1 4 LYS HB3 H -4.091 4.686 -8.070 1.00 . A A . 4 LYS HB3 1 1 12 10721 1 1 4 LYS HD2 H -4.982 5.139 -10.281 1.00 . A A . 4 LYS HD2 1 1 12 10722 1 1 4 LYS HD3 H -3.535 5.224 -11.286 1.00 . A A . 4 LYS HD3 1 1 12 10723 1 1 4 LYS HE2 H -5.363 2.859 -11.450 1.00 . A A . 4 LYS HE2 1 1 12 10724 1 1 4 LYS HE3 H -5.749 4.347 -12.314 1.00 . A A . 4 LYS HE3 1 1 12 10725 1 1 4 LYS HG2 H -2.491 4.003 -9.746 1.00 . A A . 4 LYS HG2 1 1 12 10726 1 1 4 LYS HG3 H -3.519 2.647 -10.212 1.00 . A A . 4 LYS HG3 1 1 12 10727 1 1 4 LYS HZ1 H -3.888 4.149 -13.652 1.00 . A A . 4 LYS HZ1 1 1 12 10728 1 1 4 LYS HZ2 H -4.406 2.546 -13.515 1.00 . A A . 4 LYS HZ2 1 1 12 10729 1 1 4 LYS HZ3 H -3.095 3.091 -12.595 1.00 . A A . 4 LYS HZ3 1 1 12 10730 1 1 4 LYS N N -4.345 2.599 -6.268 1.00 . A A . 4 LYS N 1 1 12 10731 1 1 4 LYS NZ N -4.020 3.356 -12.992 1.00 . A A . 4 LYS NZ 1 1 12 10732 1 1 4 LYS O O -1.124 2.693 -7.663 1.00 . A A . 4 LYS O 1 1 12 10733 1 1 5 ASP C C 0.131 3.619 -5.148 1.00 . A A . 5 ASP C 1 1 12 10734 1 1 5 ASP CA C -0.730 4.698 -5.794 1.00 . A A . 5 ASP CA 1 1 12 10735 1 1 5 ASP CB C -0.931 5.858 -4.818 1.00 . A A . 5 ASP CB 1 1 12 10736 1 1 5 ASP CG C 0.072 6.975 -5.033 1.00 . A A . 5 ASP CG 1 1 12 10737 1 1 5 ASP H H -2.840 4.516 -5.812 1.00 . A A . 5 ASP H 1 1 12 10738 1 1 5 ASP HA H -0.225 5.065 -6.676 1.00 . A A . 5 ASP HA 1 1 12 10739 1 1 5 ASP HB2 H -1.925 6.262 -4.947 1.00 . A A . 5 ASP HB2 1 1 12 10740 1 1 5 ASP HB3 H -0.826 5.493 -3.807 1.00 . A A . 5 ASP HB3 1 1 12 10741 1 1 5 ASP N N -2.020 4.158 -6.211 1.00 . A A . 5 ASP N 1 1 12 10742 1 1 5 ASP O O 1.278 3.406 -5.542 1.00 . A A . 5 ASP O 1 1 12 10743 1 1 5 ASP OD1 O 1.168 6.695 -5.563 1.00 . A A . 5 ASP OD1 1 1 12 10744 1 1 5 ASP OD2 O -0.238 8.129 -4.670 1.00 . A A . 5 ASP OD2 1 1 12 10745 1 1 6 VAL C C 0.753 0.799 -4.414 1.00 . A A . 6 VAL C 1 1 12 10746 1 1 6 VAL CA C 0.279 1.883 -3.451 1.00 . A A . 6 VAL CA 1 1 12 10747 1 1 6 VAL CB C -0.613 1.242 -2.374 1.00 . A A . 6 VAL CB 1 1 12 10748 1 1 6 VAL CG1 C 0.239 0.504 -1.368 1.00 . A A . 6 VAL CG1 1 1 12 10749 1 1 6 VAL CG2 C -1.473 2.287 -1.675 1.00 . A A . 6 VAL CG2 1 1 12 10750 1 1 6 VAL H H -1.341 3.148 -3.882 1.00 . A A . 6 VAL H 1 1 12 10751 1 1 6 VAL HA H 1.138 2.322 -2.964 1.00 . A A . 6 VAL HA 1 1 12 10752 1 1 6 VAL HB H -1.267 0.528 -2.854 1.00 . A A . 6 VAL HB 1 1 12 10753 1 1 6 VAL HG11 H 0.949 -0.118 -1.891 1.00 . A A . 6 VAL HG11 1 1 12 10754 1 1 6 VAL HG12 H -0.391 -0.108 -0.744 1.00 . A A . 6 VAL HG12 1 1 12 10755 1 1 6 VAL HG13 H 0.767 1.221 -0.761 1.00 . A A . 6 VAL HG13 1 1 12 10756 1 1 6 VAL HG21 H -0.899 3.189 -1.532 1.00 . A A . 6 VAL HG21 1 1 12 10757 1 1 6 VAL HG22 H -1.792 1.906 -0.715 1.00 . A A . 6 VAL HG22 1 1 12 10758 1 1 6 VAL HG23 H -2.340 2.503 -2.282 1.00 . A A . 6 VAL HG23 1 1 12 10759 1 1 6 VAL N N -0.429 2.938 -4.153 1.00 . A A . 6 VAL N 1 1 12 10760 1 1 6 VAL O O 1.852 0.265 -4.271 1.00 . A A . 6 VAL O 1 1 12 10761 1 1 7 ILE C C 1.323 -0.056 -7.339 1.00 . A A . 7 ILE C 1 1 12 10762 1 1 7 ILE CA C 0.242 -0.545 -6.378 1.00 . A A . 7 ILE CA 1 1 12 10763 1 1 7 ILE CB C -1.004 -0.964 -7.185 1.00 . A A . 7 ILE CB 1 1 12 10764 1 1 7 ILE CD1 C -1.680 -2.798 -5.554 1.00 . A A . 7 ILE CD1 1 1 12 10765 1 1 7 ILE CG1 C -2.082 -1.516 -6.250 1.00 . A A . 7 ILE CG1 1 1 12 10766 1 1 7 ILE CG2 C -0.636 -1.994 -8.243 1.00 . A A . 7 ILE CG2 1 1 12 10767 1 1 7 ILE H H -0.950 0.937 -5.452 1.00 . A A . 7 ILE H 1 1 12 10768 1 1 7 ILE HA H 0.611 -1.410 -5.847 1.00 . A A . 7 ILE HA 1 1 12 10769 1 1 7 ILE HB H -1.389 -0.090 -7.687 1.00 . A A . 7 ILE HB 1 1 12 10770 1 1 7 ILE HD11 H -1.764 -2.670 -4.485 1.00 . A A . 7 ILE HD11 1 1 12 10771 1 1 7 ILE HD12 H -0.658 -3.041 -5.807 1.00 . A A . 7 ILE HD12 1 1 12 10772 1 1 7 ILE HD13 H -2.330 -3.600 -5.873 1.00 . A A . 7 ILE HD13 1 1 12 10773 1 1 7 ILE HG12 H -2.299 -0.782 -5.487 1.00 . A A . 7 ILE HG12 1 1 12 10774 1 1 7 ILE HG13 H -2.977 -1.712 -6.819 1.00 . A A . 7 ILE HG13 1 1 12 10775 1 1 7 ILE HG21 H -1.517 -2.259 -8.809 1.00 . A A . 7 ILE HG21 1 1 12 10776 1 1 7 ILE HG22 H -0.237 -2.876 -7.764 1.00 . A A . 7 ILE HG22 1 1 12 10777 1 1 7 ILE HG23 H 0.106 -1.575 -8.906 1.00 . A A . 7 ILE HG23 1 1 12 10778 1 1 7 ILE N N -0.086 0.477 -5.392 1.00 . A A . 7 ILE N 1 1 12 10779 1 1 7 ILE O O 2.186 -0.826 -7.761 1.00 . A A . 7 ILE O 1 1 12 10780 1 1 8 ASP C C 3.572 2.043 -7.863 1.00 . A A . 8 ASP C 1 1 12 10781 1 1 8 ASP CA C 2.248 1.818 -8.582 1.00 . A A . 8 ASP CA 1 1 12 10782 1 1 8 ASP CB C 1.721 3.143 -9.139 1.00 . A A . 8 ASP CB 1 1 12 10783 1 1 8 ASP CG C 1.718 3.172 -10.656 1.00 . A A . 8 ASP CG 1 1 12 10784 1 1 8 ASP H H 0.566 1.792 -7.303 1.00 . A A . 8 ASP H 1 1 12 10785 1 1 8 ASP HA H 2.405 1.130 -9.398 1.00 . A A . 8 ASP HA 1 1 12 10786 1 1 8 ASP HB2 H 0.709 3.293 -8.795 1.00 . A A . 8 ASP HB2 1 1 12 10787 1 1 8 ASP HB3 H 2.342 3.952 -8.784 1.00 . A A . 8 ASP HB3 1 1 12 10788 1 1 8 ASP N N 1.272 1.227 -7.676 1.00 . A A . 8 ASP N 1 1 12 10789 1 1 8 ASP O O 4.631 2.090 -8.490 1.00 . A A . 8 ASP O 1 1 12 10790 1 1 8 ASP OD1 O 2.690 2.673 -11.260 1.00 . A A . 8 ASP OD1 1 1 12 10791 1 1 8 ASP OD2 O 0.743 3.692 -11.238 1.00 . A A . 8 ASP OD2 1 1 12 10792 1 1 9 HIS C C 5.383 1.068 -5.432 1.00 . A A . 9 HIS C 1 1 12 10793 1 1 9 HIS CA C 4.693 2.393 -5.737 1.00 . A A . 9 HIS CA 1 1 12 10794 1 1 9 HIS CB C 4.326 3.112 -4.433 1.00 . A A . 9 HIS CB 1 1 12 10795 1 1 9 HIS CD2 C 6.137 2.226 -2.799 1.00 . A A . 9 HIS CD2 1 1 12 10796 1 1 9 HIS CE1 C 6.959 4.153 -2.153 1.00 . A A . 9 HIS CE1 1 1 12 10797 1 1 9 HIS CG C 5.451 3.198 -3.446 1.00 . A A . 9 HIS CG 1 1 12 10798 1 1 9 HIS H H 2.631 2.128 -6.102 1.00 . A A . 9 HIS H 1 1 12 10799 1 1 9 HIS HA H 5.365 3.016 -6.305 1.00 . A A . 9 HIS HA 1 1 12 10800 1 1 9 HIS HB2 H 4.012 4.119 -4.663 1.00 . A A . 9 HIS HB2 1 1 12 10801 1 1 9 HIS HB3 H 3.509 2.586 -3.961 1.00 . A A . 9 HIS HB3 1 1 12 10802 1 1 9 HIS HD1 H 5.705 5.285 -3.308 1.00 . A A . 9 HIS HD1 1 1 12 10803 1 1 9 HIS HD2 H 5.981 1.160 -2.892 1.00 . A A . 9 HIS HD2 1 1 12 10804 1 1 9 HIS HE1 H 7.558 4.898 -1.651 1.00 . A A . 9 HIS HE1 1 1 12 10805 1 1 9 HIS HE2 H 7.648 2.398 -1.352 1.00 . A A . 9 HIS HE2 1 1 12 10806 1 1 9 HIS N N 3.504 2.179 -6.544 1.00 . A A . 9 HIS N 1 1 12 10807 1 1 9 HIS ND1 N 5.990 4.393 -3.019 1.00 . A A . 9 HIS ND1 1 1 12 10808 1 1 9 HIS NE2 N 7.067 2.846 -2.003 1.00 . A A . 9 HIS NE2 1 1 12 10809 1 1 9 HIS O O 6.594 1.022 -5.216 1.00 . A A . 9 HIS O 1 1 12 10810 1 1 10 PHE C C 5.451 -2.087 -6.408 1.00 . A A . 10 PHE C 1 1 12 10811 1 1 10 PHE CA C 5.141 -1.331 -5.120 1.00 . A A . 10 PHE CA 1 1 12 10812 1 1 10 PHE CB C 4.153 -2.131 -4.269 1.00 . A A . 10 PHE CB 1 1 12 10813 1 1 10 PHE CD1 C 4.025 -0.347 -2.507 1.00 . A A . 10 PHE CD1 1 1 12 10814 1 1 10 PHE CD2 C 4.138 -2.623 -1.807 1.00 . A A . 10 PHE CD2 1 1 12 10815 1 1 10 PHE CE1 C 3.979 0.060 -1.188 1.00 . A A . 10 PHE CE1 1 1 12 10816 1 1 10 PHE CE2 C 4.094 -2.223 -0.486 1.00 . A A . 10 PHE CE2 1 1 12 10817 1 1 10 PHE CG C 4.105 -1.693 -2.832 1.00 . A A . 10 PHE CG 1 1 12 10818 1 1 10 PHE CZ C 4.014 -0.879 -0.176 1.00 . A A . 10 PHE CZ 1 1 12 10819 1 1 10 PHE H H 3.645 0.091 -5.582 1.00 . A A . 10 PHE H 1 1 12 10820 1 1 10 PHE HA H 6.055 -1.199 -4.563 1.00 . A A . 10 PHE HA 1 1 12 10821 1 1 10 PHE HB2 H 3.161 -2.023 -4.682 1.00 . A A . 10 PHE HB2 1 1 12 10822 1 1 10 PHE HB3 H 4.434 -3.174 -4.289 1.00 . A A . 10 PHE HB3 1 1 12 10823 1 1 10 PHE HD1 H 4.000 0.387 -3.295 1.00 . A A . 10 PHE HD1 1 1 12 10824 1 1 10 PHE HD2 H 4.200 -3.675 -2.049 1.00 . A A . 10 PHE HD2 1 1 12 10825 1 1 10 PHE HE1 H 3.917 1.111 -0.949 1.00 . A A . 10 PHE HE1 1 1 12 10826 1 1 10 PHE HE2 H 4.119 -2.958 0.303 1.00 . A A . 10 PHE HE2 1 1 12 10827 1 1 10 PHE HZ H 3.978 -0.562 0.856 1.00 . A A . 10 PHE HZ 1 1 12 10828 1 1 10 PHE N N 4.603 -0.008 -5.407 1.00 . A A . 10 PHE N 1 1 12 10829 1 1 10 PHE O O 6.488 -2.738 -6.523 1.00 . A A . 10 PHE O 1 1 12 10830 1 1 11 GLY C C 3.798 -3.856 -8.817 1.00 . A A . 11 GLY C 1 1 12 10831 1 1 11 GLY CA C 4.737 -2.679 -8.642 1.00 . A A . 11 GLY CA 1 1 12 10832 1 1 11 GLY H H 3.733 -1.464 -7.226 1.00 . A A . 11 GLY H 1 1 12 10833 1 1 11 GLY HA2 H 4.570 -1.976 -9.444 1.00 . A A . 11 GLY HA2 1 1 12 10834 1 1 11 GLY HA3 H 5.756 -3.033 -8.694 1.00 . A A . 11 GLY HA3 1 1 12 10835 1 1 11 GLY N N 4.542 -1.997 -7.374 1.00 . A A . 11 GLY N 1 1 12 10836 1 1 11 GLY O O 3.418 -4.194 -9.937 1.00 . A A . 11 GLY O 1 1 12 10837 1 1 12 THR C C 1.556 -5.593 -6.560 1.00 . A A . 12 THR C 1 1 12 10838 1 1 12 THR CA C 2.522 -5.626 -7.739 1.00 . A A . 12 THR CA 1 1 12 10839 1 1 12 THR CB C 3.320 -6.931 -7.724 1.00 . A A . 12 THR CB 1 1 12 10840 1 1 12 THR CG2 C 4.012 -7.226 -9.037 1.00 . A A . 12 THR CG2 1 1 12 10841 1 1 12 THR H H 3.759 -4.162 -6.841 1.00 . A A . 12 THR H 1 1 12 10842 1 1 12 THR HA H 1.954 -5.573 -8.656 1.00 . A A . 12 THR HA 1 1 12 10843 1 1 12 THR HB H 2.648 -7.749 -7.512 1.00 . A A . 12 THR HB 1 1 12 10844 1 1 12 THR HG1 H 3.977 -7.324 -5.921 1.00 . A A . 12 THR HG1 1 1 12 10845 1 1 12 THR HG21 H 4.271 -8.273 -9.080 1.00 . A A . 12 THR HG21 1 1 12 10846 1 1 12 THR HG22 H 4.908 -6.630 -9.113 1.00 . A A . 12 THR HG22 1 1 12 10847 1 1 12 THR HG23 H 3.349 -6.985 -9.854 1.00 . A A . 12 THR HG23 1 1 12 10848 1 1 12 THR N N 3.423 -4.480 -7.706 1.00 . A A . 12 THR N 1 1 12 10849 1 1 12 THR O O 1.698 -4.773 -5.652 1.00 . A A . 12 THR O 1 1 12 10850 1 1 12 THR OG1 O 4.312 -6.899 -6.712 1.00 . A A . 12 THR OG1 1 1 12 10851 1 1 13 GLN C C 0.106 -7.399 -4.343 1.00 . A A . 13 GLN C 1 1 12 10852 1 1 13 GLN CA C -0.414 -6.562 -5.508 1.00 . A A . 13 GLN CA 1 1 12 10853 1 1 13 GLN CB C -1.721 -7.156 -6.034 1.00 . A A . 13 GLN CB 1 1 12 10854 1 1 13 GLN CD C -3.870 -6.020 -6.735 1.00 . A A . 13 GLN CD 1 1 12 10855 1 1 13 GLN CG C -2.414 -6.283 -7.070 1.00 . A A . 13 GLN CG 1 1 12 10856 1 1 13 GLN H H 0.516 -7.118 -7.328 1.00 . A A . 13 GLN H 1 1 12 10857 1 1 13 GLN HA H -0.599 -5.558 -5.159 1.00 . A A . 13 GLN HA 1 1 12 10858 1 1 13 GLN HB2 H -1.513 -8.116 -6.485 1.00 . A A . 13 GLN HB2 1 1 12 10859 1 1 13 GLN HB3 H -2.398 -7.299 -5.204 1.00 . A A . 13 GLN HB3 1 1 12 10860 1 1 13 GLN HE21 H -4.270 -7.967 -6.837 1.00 . A A . 13 GLN HE21 1 1 12 10861 1 1 13 GLN HE22 H -5.609 -6.945 -6.454 1.00 . A A . 13 GLN HE22 1 1 12 10862 1 1 13 GLN HG2 H -1.898 -5.337 -7.126 1.00 . A A . 13 GLN HG2 1 1 12 10863 1 1 13 GLN HG3 H -2.363 -6.777 -8.029 1.00 . A A . 13 GLN HG3 1 1 12 10864 1 1 13 GLN N N 0.576 -6.489 -6.577 1.00 . A A . 13 GLN N 1 1 12 10865 1 1 13 GLN NE2 N -4.663 -7.085 -6.668 1.00 . A A . 13 GLN NE2 1 1 12 10866 1 1 13 GLN O O 0.086 -6.960 -3.193 1.00 . A A . 13 GLN O 1 1 12 10867 1 1 13 GLN OE1 O -4.277 -4.877 -6.538 1.00 . A A . 13 GLN OE1 1 1 12 10868 1 1 14 ARG C C 2.178 -8.823 -2.795 1.00 . A A . 14 ARG C 1 1 12 10869 1 1 14 ARG CA C 1.100 -9.508 -3.631 1.00 . A A . 14 ARG CA 1 1 12 10870 1 1 14 ARG CB C 1.665 -10.773 -4.282 1.00 . A A . 14 ARG CB 1 1 12 10871 1 1 14 ARG CD C 1.757 -13.285 -4.289 1.00 . A A . 14 ARG CD 1 1 12 10872 1 1 14 ARG CG C 1.021 -12.055 -3.780 1.00 . A A . 14 ARG CG 1 1 12 10873 1 1 14 ARG CZ C 1.491 -14.995 -6.042 1.00 . A A . 14 ARG CZ 1 1 12 10874 1 1 14 ARG H H 0.562 -8.898 -5.586 1.00 . A A . 14 ARG H 1 1 12 10875 1 1 14 ARG HA H 0.282 -9.785 -2.981 1.00 . A A . 14 ARG HA 1 1 12 10876 1 1 14 ARG HB2 H 1.511 -10.712 -5.350 1.00 . A A . 14 ARG HB2 1 1 12 10877 1 1 14 ARG HB3 H 2.725 -10.827 -4.084 1.00 . A A . 14 ARG HB3 1 1 12 10878 1 1 14 ARG HD2 H 2.775 -13.009 -4.519 1.00 . A A . 14 ARG HD2 1 1 12 10879 1 1 14 ARG HD3 H 1.753 -14.036 -3.514 1.00 . A A . 14 ARG HD3 1 1 12 10880 1 1 14 ARG HE H 0.414 -13.320 -5.905 1.00 . A A . 14 ARG HE 1 1 12 10881 1 1 14 ARG HG2 H 1.041 -12.057 -2.701 1.00 . A A . 14 ARG HG2 1 1 12 10882 1 1 14 ARG HG3 H -0.002 -12.091 -4.124 1.00 . A A . 14 ARG HG3 1 1 12 10883 1 1 14 ARG HH11 H 2.933 -15.405 -4.685 1.00 . A A . 14 ARG HH11 1 1 12 10884 1 1 14 ARG HH12 H 2.725 -16.592 -5.928 1.00 . A A . 14 ARG HH12 1 1 12 10885 1 1 14 ARG HH21 H 0.140 -14.881 -7.542 1.00 . A A . 14 ARG HH21 1 1 12 10886 1 1 14 ARG HH22 H 1.140 -16.294 -7.549 1.00 . A A . 14 ARG HH22 1 1 12 10887 1 1 14 ARG N N 0.574 -8.606 -4.650 1.00 . A A . 14 ARG N 1 1 12 10888 1 1 14 ARG NE N 1.135 -13.838 -5.491 1.00 . A A . 14 ARG NE 1 1 12 10889 1 1 14 ARG NH1 N 2.462 -15.724 -5.508 1.00 . A A . 14 ARG NH1 1 1 12 10890 1 1 14 ARG NH2 N 0.873 -15.426 -7.134 1.00 . A A . 14 ARG NH2 1 1 12 10891 1 1 14 ARG O O 2.370 -9.145 -1.623 1.00 . A A . 14 ARG O 1 1 12 10892 1 1 15 ALA C C 3.373 -6.309 -1.576 1.00 . A A . 15 ALA C 1 1 12 10893 1 1 15 ALA CA C 3.938 -7.143 -2.721 1.00 . A A . 15 ALA CA 1 1 12 10894 1 1 15 ALA CB C 4.688 -6.256 -3.703 1.00 . A A . 15 ALA CB 1 1 12 10895 1 1 15 ALA H H 2.681 -7.661 -4.343 1.00 . A A . 15 ALA H 1 1 12 10896 1 1 15 ALA HA H 4.634 -7.865 -2.320 1.00 . A A . 15 ALA HA 1 1 12 10897 1 1 15 ALA HB1 H 5.401 -5.647 -3.166 1.00 . A A . 15 ALA HB1 1 1 12 10898 1 1 15 ALA HB2 H 3.987 -5.617 -4.220 1.00 . A A . 15 ALA HB2 1 1 12 10899 1 1 15 ALA HB3 H 5.211 -6.873 -4.420 1.00 . A A . 15 ALA HB3 1 1 12 10900 1 1 15 ALA N N 2.880 -7.874 -3.408 1.00 . A A . 15 ALA N 1 1 12 10901 1 1 15 ALA O O 3.907 -6.318 -0.466 1.00 . A A . 15 ALA O 1 1 12 10902 1 1 16 VAL C C 1.211 -5.578 0.356 1.00 . A A . 16 VAL C 1 1 12 10903 1 1 16 VAL CA C 1.655 -4.749 -0.846 1.00 . A A . 16 VAL CA 1 1 12 10904 1 1 16 VAL CB C 0.431 -3.991 -1.409 1.00 . A A . 16 VAL CB 1 1 12 10905 1 1 16 VAL CG1 C 0.321 -2.629 -0.756 1.00 . A A . 16 VAL CG1 1 1 12 10906 1 1 16 VAL CG2 C 0.510 -3.844 -2.924 1.00 . A A . 16 VAL CG2 1 1 12 10907 1 1 16 VAL H H 1.912 -5.622 -2.751 1.00 . A A . 16 VAL H 1 1 12 10908 1 1 16 VAL HA H 2.381 -4.021 -0.516 1.00 . A A . 16 VAL HA 1 1 12 10909 1 1 16 VAL HB H -0.459 -4.554 -1.168 1.00 . A A . 16 VAL HB 1 1 12 10910 1 1 16 VAL HG11 H -0.031 -2.743 0.256 1.00 . A A . 16 VAL HG11 1 1 12 10911 1 1 16 VAL HG12 H -0.371 -2.019 -1.315 1.00 . A A . 16 VAL HG12 1 1 12 10912 1 1 16 VAL HG13 H 1.293 -2.160 -0.750 1.00 . A A . 16 VAL HG13 1 1 12 10913 1 1 16 VAL HG21 H -0.065 -2.983 -3.232 1.00 . A A . 16 VAL HG21 1 1 12 10914 1 1 16 VAL HG22 H 0.107 -4.730 -3.393 1.00 . A A . 16 VAL HG22 1 1 12 10915 1 1 16 VAL HG23 H 1.539 -3.716 -3.221 1.00 . A A . 16 VAL HG23 1 1 12 10916 1 1 16 VAL N N 2.291 -5.589 -1.852 1.00 . A A . 16 VAL N 1 1 12 10917 1 1 16 VAL O O 1.202 -5.093 1.488 1.00 . A A . 16 VAL O 1 1 12 10918 1 1 17 ALA C C 1.565 -8.185 2.022 1.00 . A A . 17 ALA C 1 1 12 10919 1 1 17 ALA CA C 0.394 -7.724 1.159 1.00 . A A . 17 ALA CA 1 1 12 10920 1 1 17 ALA CB C -0.329 -8.922 0.562 1.00 . A A . 17 ALA CB 1 1 12 10921 1 1 17 ALA H H 0.868 -7.155 -0.823 1.00 . A A . 17 ALA H 1 1 12 10922 1 1 17 ALA HA H -0.307 -7.184 1.779 1.00 . A A . 17 ALA HA 1 1 12 10923 1 1 17 ALA HB1 H -1.231 -9.116 1.124 1.00 . A A . 17 ALA HB1 1 1 12 10924 1 1 17 ALA HB2 H 0.313 -9.790 0.603 1.00 . A A . 17 ALA HB2 1 1 12 10925 1 1 17 ALA HB3 H -0.585 -8.714 -0.467 1.00 . A A . 17 ALA HB3 1 1 12 10926 1 1 17 ALA N N 0.841 -6.827 0.099 1.00 . A A . 17 ALA N 1 1 12 10927 1 1 17 ALA O O 1.392 -8.514 3.195 1.00 . A A . 17 ALA O 1 1 12 10928 1 1 18 LYS C C 4.417 -7.552 3.127 1.00 . A A . 18 LYS C 1 1 12 10929 1 1 18 LYS CA C 3.955 -8.630 2.150 1.00 . A A . 18 LYS CA 1 1 12 10930 1 1 18 LYS CB C 5.076 -8.953 1.160 1.00 . A A . 18 LYS CB 1 1 12 10931 1 1 18 LYS CD C 6.982 -10.464 0.520 1.00 . A A . 18 LYS CD 1 1 12 10932 1 1 18 LYS CE C 6.419 -10.688 -0.875 1.00 . A A . 18 LYS CE 1 1 12 10933 1 1 18 LYS CG C 5.877 -10.191 1.530 1.00 . A A . 18 LYS CG 1 1 12 10934 1 1 18 LYS H H 2.832 -7.936 0.496 1.00 . A A . 18 LYS H 1 1 12 10935 1 1 18 LYS HA H 3.711 -9.522 2.706 1.00 . A A . 18 LYS HA 1 1 12 10936 1 1 18 LYS HB2 H 4.645 -9.109 0.184 1.00 . A A . 18 LYS HB2 1 1 12 10937 1 1 18 LYS HB3 H 5.755 -8.113 1.114 1.00 . A A . 18 LYS HB3 1 1 12 10938 1 1 18 LYS HD2 H 7.649 -9.616 0.495 1.00 . A A . 18 LYS HD2 1 1 12 10939 1 1 18 LYS HD3 H 7.525 -11.345 0.827 1.00 . A A . 18 LYS HD3 1 1 12 10940 1 1 18 LYS HE2 H 5.342 -10.735 -0.815 1.00 . A A . 18 LYS HE2 1 1 12 10941 1 1 18 LYS HE3 H 6.708 -9.858 -1.503 1.00 . A A . 18 LYS HE3 1 1 12 10942 1 1 18 LYS HG2 H 6.323 -10.042 2.504 1.00 . A A . 18 LYS HG2 1 1 12 10943 1 1 18 LYS HG3 H 5.213 -11.042 1.562 1.00 . A A . 18 LYS HG3 1 1 12 10944 1 1 18 LYS HZ1 H 7.964 -11.971 -1.453 1.00 . A A . 18 LYS HZ1 1 1 12 10945 1 1 18 LYS HZ2 H 6.614 -12.024 -2.470 1.00 . A A . 18 LYS HZ2 1 1 12 10946 1 1 18 LYS HZ3 H 6.559 -12.771 -0.953 1.00 . A A . 18 LYS HZ3 1 1 12 10947 1 1 18 LYS N N 2.756 -8.208 1.433 1.00 . A A . 18 LYS N 1 1 12 10948 1 1 18 LYS NZ N 6.925 -11.952 -1.480 1.00 . A A . 18 LYS NZ 1 1 12 10949 1 1 18 LYS O O 4.872 -7.856 4.230 1.00 . A A . 18 LYS O 1 1 12 10950 1 1 19 ALA C C 3.839 -5.076 4.803 1.00 . A A . 19 ALA C 1 1 12 10951 1 1 19 ALA CA C 4.707 -5.174 3.552 1.00 . A A . 19 ALA CA 1 1 12 10952 1 1 19 ALA CB C 4.645 -3.877 2.761 1.00 . A A . 19 ALA CB 1 1 12 10953 1 1 19 ALA H H 3.931 -6.117 1.823 1.00 . A A . 19 ALA H 1 1 12 10954 1 1 19 ALA HA H 5.733 -5.337 3.850 1.00 . A A . 19 ALA HA 1 1 12 10955 1 1 19 ALA HB1 H 4.420 -3.059 3.429 1.00 . A A . 19 ALA HB1 1 1 12 10956 1 1 19 ALA HB2 H 3.873 -3.950 2.010 1.00 . A A . 19 ALA HB2 1 1 12 10957 1 1 19 ALA HB3 H 5.597 -3.699 2.284 1.00 . A A . 19 ALA HB3 1 1 12 10958 1 1 19 ALA N N 4.298 -6.295 2.714 1.00 . A A . 19 ALA N 1 1 12 10959 1 1 19 ALA O O 4.351 -4.970 5.918 1.00 . A A . 19 ALA O 1 1 12 10960 1 1 20 LEU C C 1.443 -6.370 6.425 1.00 . A A . 20 LEU C 1 1 12 10961 1 1 20 LEU CA C 1.587 -5.024 5.723 1.00 . A A . 20 LEU CA 1 1 12 10962 1 1 20 LEU CB C 0.222 -4.544 5.229 1.00 . A A . 20 LEU CB 1 1 12 10963 1 1 20 LEU CD1 C -0.935 -3.101 3.535 1.00 . A A . 20 LEU CD1 1 1 12 10964 1 1 20 LEU CD2 C 0.189 -2.053 5.509 1.00 . A A . 20 LEU CD2 1 1 12 10965 1 1 20 LEU CG C 0.232 -3.196 4.505 1.00 . A A . 20 LEU CG 1 1 12 10966 1 1 20 LEU H H 2.177 -5.196 3.698 1.00 . A A . 20 LEU H 1 1 12 10967 1 1 20 LEU HA H 1.977 -4.304 6.427 1.00 . A A . 20 LEU HA 1 1 12 10968 1 1 20 LEU HB2 H -0.175 -5.289 4.553 1.00 . A A . 20 LEU HB2 1 1 12 10969 1 1 20 LEU HB3 H -0.439 -4.465 6.079 1.00 . A A . 20 LEU HB3 1 1 12 10970 1 1 20 LEU HD11 H -0.620 -2.584 2.640 1.00 . A A . 20 LEU HD11 1 1 12 10971 1 1 20 LEU HD12 H -1.746 -2.558 4.000 1.00 . A A . 20 LEU HD12 1 1 12 10972 1 1 20 LEU HD13 H -1.271 -4.094 3.276 1.00 . A A . 20 LEU HD13 1 1 12 10973 1 1 20 LEU HD21 H -0.835 -1.856 5.786 1.00 . A A . 20 LEU HD21 1 1 12 10974 1 1 20 LEU HD22 H 0.618 -1.168 5.064 1.00 . A A . 20 LEU HD22 1 1 12 10975 1 1 20 LEU HD23 H 0.754 -2.325 6.387 1.00 . A A . 20 LEU HD23 1 1 12 10976 1 1 20 LEU HG H 1.147 -3.108 3.936 1.00 . A A . 20 LEU HG 1 1 12 10977 1 1 20 LEU N N 2.525 -5.111 4.610 1.00 . A A . 20 LEU N 1 1 12 10978 1 1 20 LEU O O 1.134 -6.432 7.615 1.00 . A A . 20 LEU O 1 1 12 10979 1 1 21 GLY C C 0.197 -9.400 6.012 1.00 . A A . 21 GLY C 1 1 12 10980 1 1 21 GLY CA C 1.559 -8.778 6.252 1.00 . A A . 21 GLY CA 1 1 12 10981 1 1 21 GLY H H 1.914 -7.341 4.739 1.00 . A A . 21 GLY H 1 1 12 10982 1 1 21 GLY HA2 H 2.315 -9.411 5.810 1.00 . A A . 21 GLY HA2 1 1 12 10983 1 1 21 GLY HA3 H 1.732 -8.716 7.316 1.00 . A A . 21 GLY HA3 1 1 12 10984 1 1 21 GLY N N 1.670 -7.449 5.681 1.00 . A A . 21 GLY N 1 1 12 10985 1 1 21 GLY O O -0.246 -10.256 6.779 1.00 . A A . 21 GLY O 1 1 12 10986 1 1 22 ILE C C -1.731 -10.334 3.335 1.00 . A A . 22 ILE C 1 1 12 10987 1 1 22 ILE CA C -1.786 -9.489 4.604 1.00 . A A . 22 ILE CA 1 1 12 10988 1 1 22 ILE CB C -2.803 -8.349 4.406 1.00 . A A . 22 ILE CB 1 1 12 10989 1 1 22 ILE CD1 C -3.266 -6.234 3.067 1.00 . A A . 22 ILE CD1 1 1 12 10990 1 1 22 ILE CG1 C -2.319 -7.388 3.321 1.00 . A A . 22 ILE CG1 1 1 12 10991 1 1 22 ILE CG2 C -3.029 -7.609 5.716 1.00 . A A . 22 ILE CG2 1 1 12 10992 1 1 22 ILE H H -0.060 -8.288 4.371 1.00 . A A . 22 ILE H 1 1 12 10993 1 1 22 ILE HA H -2.124 -10.109 5.423 1.00 . A A . 22 ILE HA 1 1 12 10994 1 1 22 ILE HB H -3.743 -8.782 4.102 1.00 . A A . 22 ILE HB 1 1 12 10995 1 1 22 ILE HD11 H -3.629 -5.853 4.011 1.00 . A A . 22 ILE HD11 1 1 12 10996 1 1 22 ILE HD12 H -4.100 -6.576 2.472 1.00 . A A . 22 ILE HD12 1 1 12 10997 1 1 22 ILE HD13 H -2.743 -5.450 2.539 1.00 . A A . 22 ILE HD13 1 1 12 10998 1 1 22 ILE HG12 H -1.365 -6.974 3.613 1.00 . A A . 22 ILE HG12 1 1 12 10999 1 1 22 ILE HG13 H -2.202 -7.931 2.394 1.00 . A A . 22 ILE HG13 1 1 12 11000 1 1 22 ILE HG21 H -3.746 -6.816 5.563 1.00 . A A . 22 ILE HG21 1 1 12 11001 1 1 22 ILE HG22 H -2.094 -7.186 6.056 1.00 . A A . 22 ILE HG22 1 1 12 11002 1 1 22 ILE HG23 H -3.403 -8.296 6.458 1.00 . A A . 22 ILE HG23 1 1 12 11003 1 1 22 ILE N N -0.467 -8.970 4.944 1.00 . A A . 22 ILE N 1 1 12 11004 1 1 22 ILE O O -0.662 -10.534 2.758 1.00 . A A . 22 ILE O 1 1 12 11005 1 1 23 SER C C -3.308 -10.794 0.485 1.00 . A A . 23 SER C 1 1 12 11006 1 1 23 SER CA C -2.969 -11.647 1.702 1.00 . A A . 23 SER CA 1 1 12 11007 1 1 23 SER CB C -4.018 -12.746 1.881 1.00 . A A . 23 SER CB 1 1 12 11008 1 1 23 SER H H -3.707 -10.632 3.408 1.00 . A A . 23 SER H 1 1 12 11009 1 1 23 SER HA H -2.003 -12.104 1.549 1.00 . A A . 23 SER HA 1 1 12 11010 1 1 23 SER HB2 H -4.768 -12.415 2.584 1.00 . A A . 23 SER HB2 1 1 12 11011 1 1 23 SER HB3 H -4.485 -12.952 0.928 1.00 . A A . 23 SER HB3 1 1 12 11012 1 1 23 SER HG H -3.938 -14.264 3.115 1.00 . A A . 23 SER HG 1 1 12 11013 1 1 23 SER N N -2.889 -10.825 2.904 1.00 . A A . 23 SER N 1 1 12 11014 1 1 23 SER O O -3.767 -9.659 0.618 1.00 . A A . 23 SER O 1 1 12 11015 1 1 23 SER OG O -3.431 -13.939 2.369 1.00 . A A . 23 SER OG 1 1 12 11016 1 1 24 ASP C C -4.840 -10.253 -2.027 1.00 . A A . 24 ASP C 1 1 12 11017 1 1 24 ASP CA C -3.366 -10.637 -1.943 1.00 . A A . 24 ASP CA 1 1 12 11018 1 1 24 ASP CB C -2.984 -11.499 -3.147 1.00 . A A . 24 ASP CB 1 1 12 11019 1 1 24 ASP CG C -3.649 -12.861 -3.118 1.00 . A A . 24 ASP CG 1 1 12 11020 1 1 24 ASP H H -2.716 -12.256 -0.743 1.00 . A A . 24 ASP H 1 1 12 11021 1 1 24 ASP HA H -2.770 -9.737 -1.953 1.00 . A A . 24 ASP HA 1 1 12 11022 1 1 24 ASP HB2 H -3.281 -10.994 -4.054 1.00 . A A . 24 ASP HB2 1 1 12 11023 1 1 24 ASP HB3 H -1.913 -11.641 -3.155 1.00 . A A . 24 ASP HB3 1 1 12 11024 1 1 24 ASP N N -3.083 -11.348 -0.702 1.00 . A A . 24 ASP N 1 1 12 11025 1 1 24 ASP O O -5.194 -9.234 -2.618 1.00 . A A . 24 ASP O 1 1 12 11026 1 1 24 ASP OD1 O -4.843 -12.946 -3.475 1.00 . A A . 24 ASP OD1 1 1 12 11027 1 1 24 ASP OD2 O -2.975 -13.842 -2.739 1.00 . A A . 24 ASP OD2 1 1 12 11028 1 1 25 ALA C C -7.455 -9.479 -0.791 1.00 . A A . 25 ALA C 1 1 12 11029 1 1 25 ALA CA C -7.132 -10.823 -1.435 1.00 . A A . 25 ALA CA 1 1 12 11030 1 1 25 ALA CB C -7.867 -11.945 -0.717 1.00 . A A . 25 ALA CB 1 1 12 11031 1 1 25 ALA H H -5.353 -11.873 -0.974 1.00 . A A . 25 ALA H 1 1 12 11032 1 1 25 ALA HA H -7.462 -10.807 -2.464 1.00 . A A . 25 ALA HA 1 1 12 11033 1 1 25 ALA HB1 H -8.166 -12.695 -1.434 1.00 . A A . 25 ALA HB1 1 1 12 11034 1 1 25 ALA HB2 H -8.742 -11.545 -0.228 1.00 . A A . 25 ALA HB2 1 1 12 11035 1 1 25 ALA HB3 H -7.215 -12.391 0.019 1.00 . A A . 25 ALA HB3 1 1 12 11036 1 1 25 ALA N N -5.695 -11.076 -1.430 1.00 . A A . 25 ALA N 1 1 12 11037 1 1 25 ALA O O -8.237 -8.695 -1.329 1.00 . A A . 25 ALA O 1 1 12 11038 1 1 26 ALA C C -6.688 -6.768 0.220 1.00 . A A . 26 ALA C 1 1 12 11039 1 1 26 ALA CA C -7.071 -7.970 1.078 1.00 . A A . 26 ALA CA 1 1 12 11040 1 1 26 ALA CB C -6.285 -7.962 2.382 1.00 . A A . 26 ALA CB 1 1 12 11041 1 1 26 ALA H H -6.235 -9.884 0.739 1.00 . A A . 26 ALA H 1 1 12 11042 1 1 26 ALA HA H -8.122 -7.907 1.319 1.00 . A A . 26 ALA HA 1 1 12 11043 1 1 26 ALA HB1 H -5.313 -8.402 2.219 1.00 . A A . 26 ALA HB1 1 1 12 11044 1 1 26 ALA HB2 H -6.818 -8.532 3.127 1.00 . A A . 26 ALA HB2 1 1 12 11045 1 1 26 ALA HB3 H -6.167 -6.944 2.724 1.00 . A A . 26 ALA HB3 1 1 12 11046 1 1 26 ALA N N -6.847 -9.219 0.363 1.00 . A A . 26 ALA N 1 1 12 11047 1 1 26 ALA O O -7.332 -5.722 0.278 1.00 . A A . 26 ALA O 1 1 12 11048 1 1 27 VAL C C -6.112 -5.652 -2.621 1.00 . A A . 27 VAL C 1 1 12 11049 1 1 27 VAL CA C -5.164 -5.858 -1.444 1.00 . A A . 27 VAL CA 1 1 12 11050 1 1 27 VAL CB C -3.751 -6.151 -1.983 1.00 . A A . 27 VAL CB 1 1 12 11051 1 1 27 VAL CG1 C -3.239 -4.983 -2.812 1.00 . A A . 27 VAL CG1 1 1 12 11052 1 1 27 VAL CG2 C -2.798 -6.460 -0.838 1.00 . A A . 27 VAL CG2 1 1 12 11053 1 1 27 VAL H H -5.161 -7.787 -0.574 1.00 . A A . 27 VAL H 1 1 12 11054 1 1 27 VAL HA H -5.125 -4.948 -0.863 1.00 . A A . 27 VAL HA 1 1 12 11055 1 1 27 VAL HB H -3.804 -7.021 -2.622 1.00 . A A . 27 VAL HB 1 1 12 11056 1 1 27 VAL HG11 H -3.897 -4.822 -3.653 1.00 . A A . 27 VAL HG11 1 1 12 11057 1 1 27 VAL HG12 H -2.243 -5.204 -3.171 1.00 . A A . 27 VAL HG12 1 1 12 11058 1 1 27 VAL HG13 H -3.211 -4.093 -2.201 1.00 . A A . 27 VAL HG13 1 1 12 11059 1 1 27 VAL HG21 H -3.167 -7.310 -0.282 1.00 . A A . 27 VAL HG21 1 1 12 11060 1 1 27 VAL HG22 H -2.731 -5.603 -0.184 1.00 . A A . 27 VAL HG22 1 1 12 11061 1 1 27 VAL HG23 H -1.820 -6.687 -1.235 1.00 . A A . 27 VAL HG23 1 1 12 11062 1 1 27 VAL N N -5.635 -6.929 -0.574 1.00 . A A . 27 VAL N 1 1 12 11063 1 1 27 VAL O O -6.456 -4.520 -2.964 1.00 . A A . 27 VAL O 1 1 12 11064 1 1 28 SER C C -8.817 -6.202 -3.953 1.00 . A A . 28 SER C 1 1 12 11065 1 1 28 SER CA C -7.435 -6.690 -4.379 1.00 . A A . 28 SER CA 1 1 12 11066 1 1 28 SER CB C -7.550 -8.064 -5.041 1.00 . A A . 28 SER CB 1 1 12 11067 1 1 28 SER H H -6.219 -7.626 -2.921 1.00 . A A . 28 SER H 1 1 12 11068 1 1 28 SER HA H -7.024 -5.990 -5.091 1.00 . A A . 28 SER HA 1 1 12 11069 1 1 28 SER HB2 H -6.585 -8.356 -5.431 1.00 . A A . 28 SER HB2 1 1 12 11070 1 1 28 SER HB3 H -7.874 -8.789 -4.310 1.00 . A A . 28 SER HB3 1 1 12 11071 1 1 28 SER HG H -8.282 -7.309 -6.695 1.00 . A A . 28 SER HG 1 1 12 11072 1 1 28 SER N N -6.529 -6.752 -3.239 1.00 . A A . 28 SER N 1 1 12 11073 1 1 28 SER O O -9.534 -5.580 -4.735 1.00 . A A . 28 SER O 1 1 12 11074 1 1 28 SER OG O -8.483 -8.041 -6.108 1.00 . A A . 28 SER OG 1 1 12 11075 1 1 29 GLN C C -10.490 -4.593 -1.842 1.00 . A A . 29 GLN C 1 1 12 11076 1 1 29 GLN CA C -10.480 -6.083 -2.178 1.00 . A A . 29 GLN CA 1 1 12 11077 1 1 29 GLN CB C -10.820 -6.902 -0.932 1.00 . A A . 29 GLN CB 1 1 12 11078 1 1 29 GLN CD C -12.590 -8.203 0.314 1.00 . A A . 29 GLN CD 1 1 12 11079 1 1 29 GLN CG C -12.300 -7.225 -0.808 1.00 . A A . 29 GLN CG 1 1 12 11080 1 1 29 GLN H H -8.568 -6.991 -2.132 1.00 . A A . 29 GLN H 1 1 12 11081 1 1 29 GLN HA H -11.220 -6.276 -2.938 1.00 . A A . 29 GLN HA 1 1 12 11082 1 1 29 GLN HB2 H -10.270 -7.832 -0.965 1.00 . A A . 29 GLN HB2 1 1 12 11083 1 1 29 GLN HB3 H -10.520 -6.347 -0.057 1.00 . A A . 29 GLN HB3 1 1 12 11084 1 1 29 GLN HE21 H -11.570 -7.073 1.596 1.00 . A A . 29 GLN HE21 1 1 12 11085 1 1 29 GLN HE22 H -12.270 -8.515 2.250 1.00 . A A . 29 GLN HE22 1 1 12 11086 1 1 29 GLN HG2 H -12.840 -6.310 -0.615 1.00 . A A . 29 GLN HG2 1 1 12 11087 1 1 29 GLN HG3 H -12.640 -7.655 -1.738 1.00 . A A . 29 GLN HG3 1 1 12 11088 1 1 29 GLN N N -9.183 -6.491 -2.708 1.00 . A A . 29 GLN N 1 1 12 11089 1 1 29 GLN NE2 N -12.090 -7.899 1.507 1.00 . A A . 29 GLN NE2 1 1 12 11090 1 1 29 GLN O O -11.560 -3.996 -1.694 1.00 . A A . 29 GLN O 1 1 12 11091 1 1 29 GLN OE1 O -13.250 -9.220 0.110 1.00 . A A . 29 GLN OE1 1 1 12 11092 1 1 30 TRP C C -10.030 -1.727 -2.356 1.00 . A A . 30 TRP C 1 1 12 11093 1 1 30 TRP CA C -9.202 -2.575 -1.398 1.00 . A A . 30 TRP CA 1 1 12 11094 1 1 30 TRP CB C -7.740 -2.129 -1.449 1.00 . A A . 30 TRP CB 1 1 12 11095 1 1 30 TRP CD1 C -7.416 -3.056 0.920 1.00 . A A . 30 TRP CD1 1 1 12 11096 1 1 30 TRP CD2 C -5.512 -2.519 -0.128 1.00 . A A . 30 TRP CD2 1 1 12 11097 1 1 30 TRP CE2 C -5.195 -3.010 1.153 1.00 . A A . 30 TRP CE2 1 1 12 11098 1 1 30 TRP CE3 C -4.471 -2.117 -0.971 1.00 . A A . 30 TRP CE3 1 1 12 11099 1 1 30 TRP CG C -6.938 -2.556 -0.257 1.00 . A A . 30 TRP CG 1 1 12 11100 1 1 30 TRP CH2 C -2.886 -2.710 0.762 1.00 . A A . 30 TRP CH2 1 1 12 11101 1 1 30 TRP CZ2 C -3.883 -3.111 1.608 1.00 . A A . 30 TRP CZ2 1 1 12 11102 1 1 30 TRP CZ3 C -3.170 -2.216 -0.517 1.00 . A A . 30 TRP CZ3 1 1 12 11103 1 1 30 TRP H H -8.496 -4.521 -1.846 1.00 . A A . 30 TRP H 1 1 12 11104 1 1 30 TRP HA H -9.577 -2.434 -0.395 1.00 . A A . 30 TRP HA 1 1 12 11105 1 1 30 TRP HB2 H -7.275 -2.547 -2.329 1.00 . A A . 30 TRP HB2 1 1 12 11106 1 1 30 TRP HB3 H -7.702 -1.051 -1.508 1.00 . A A . 30 TRP HB3 1 1 12 11107 1 1 30 TRP HD1 H -8.462 -3.207 1.137 1.00 . A A . 30 TRP HD1 1 1 12 11108 1 1 30 TRP HE1 H -6.461 -3.698 2.679 1.00 . A A . 30 TRP HE1 1 1 12 11109 1 1 30 TRP HE3 H -4.672 -1.734 -1.959 1.00 . A A . 30 TRP HE3 1 1 12 11110 1 1 30 TRP HH2 H -1.854 -2.771 1.075 1.00 . A A . 30 TRP HH2 1 1 12 11111 1 1 30 TRP HZ2 H -3.646 -3.489 2.592 1.00 . A A . 30 TRP HZ2 1 1 12 11112 1 1 30 TRP HZ3 H -2.354 -1.911 -1.155 1.00 . A A . 30 TRP HZ3 1 1 12 11113 1 1 30 TRP N N -9.314 -3.995 -1.720 1.00 . A A . 30 TRP N 1 1 12 11114 1 1 30 TRP NE1 N -6.374 -3.332 1.774 1.00 . A A . 30 TRP NE1 1 1 12 11115 1 1 30 TRP O O -10.230 -2.094 -3.514 1.00 . A A . 30 TRP O 1 1 12 11116 1 1 31 LYS C C -10.500 1.543 -3.079 1.00 . A A . 31 LYS C 1 1 12 11117 1 1 31 LYS CA C -11.320 0.316 -2.673 1.00 . A A . 31 LYS CA 1 1 12 11118 1 1 31 LYS CB C -12.570 0.742 -1.899 1.00 . A A . 31 LYS CB 1 1 12 11119 1 1 31 LYS CD C -14.540 0.738 -3.454 1.00 . A A . 31 LYS CD 1 1 12 11120 1 1 31 LYS CE C -14.880 -0.200 -4.603 1.00 . A A . 31 LYS CE 1 1 12 11121 1 1 31 LYS CG C -13.830 0.008 -2.328 1.00 . A A . 31 LYS CG 1 1 12 11122 1 1 31 LYS H H -10.310 -0.352 -0.933 1.00 . A A . 31 LYS H 1 1 12 11123 1 1 31 LYS HA H -11.620 -0.213 -3.565 1.00 . A A . 31 LYS HA 1 1 12 11124 1 1 31 LYS HB2 H -12.410 0.552 -0.848 1.00 . A A . 31 LYS HB2 1 1 12 11125 1 1 31 LYS HB3 H -12.730 1.801 -2.043 1.00 . A A . 31 LYS HB3 1 1 12 11126 1 1 31 LYS HD2 H -15.460 1.160 -3.069 1.00 . A A . 31 LYS HD2 1 1 12 11127 1 1 31 LYS HD3 H -13.910 1.529 -3.821 1.00 . A A . 31 LYS HD3 1 1 12 11128 1 1 31 LYS HE2 H -15.000 -1.201 -4.213 1.00 . A A . 31 LYS HE2 1 1 12 11129 1 1 31 LYS HE3 H -15.810 0.119 -5.051 1.00 . A A . 31 LYS HE3 1 1 12 11130 1 1 31 LYS HG2 H -13.560 -0.982 -2.667 1.00 . A A . 31 LYS HG2 1 1 12 11131 1 1 31 LYS HG3 H -14.490 -0.070 -1.480 1.00 . A A . 31 LYS HG3 1 1 12 11132 1 1 31 LYS HZ1 H -14.070 0.441 -6.417 1.00 . A A . 31 LYS HZ1 1 1 12 11133 1 1 31 LYS HZ2 H -13.700 -1.165 -6.034 1.00 . A A . 31 LYS HZ2 1 1 12 11134 1 1 31 LYS HZ3 H -12.910 0.094 -5.233 1.00 . A A . 31 LYS HZ3 1 1 12 11135 1 1 31 LYS N N -10.510 -0.590 -1.865 1.00 . A A . 31 LYS N 1 1 12 11136 1 1 31 LYS NZ N -13.820 -0.208 -5.645 1.00 . A A . 31 LYS NZ 1 1 12 11137 1 1 31 LYS O O -9.292 1.582 -2.889 1.00 . A A . 31 LYS O 1 1 12 11138 1 1 32 GLU C C -9.583 4.300 -2.985 1.00 . A A . 32 GLU C 1 1 12 11139 1 1 32 GLU CA C -10.510 3.773 -4.071 1.00 . A A . 32 GLU CA 1 1 12 11140 1 1 32 GLU CB C -11.550 4.837 -4.431 1.00 . A A . 32 GLU CB 1 1 12 11141 1 1 32 GLU CD C -12.110 6.725 -6.014 1.00 . A A . 32 GLU CD 1 1 12 11142 1 1 32 GLU CG C -11.370 5.414 -5.826 1.00 . A A . 32 GLU CG 1 1 12 11143 1 1 32 GLU H H -12.150 2.456 -3.765 1.00 . A A . 32 GLU H 1 1 12 11144 1 1 32 GLU HA H -9.936 3.541 -4.949 1.00 . A A . 32 GLU HA 1 1 12 11145 1 1 32 GLU HB2 H -12.540 4.398 -4.371 1.00 . A A . 32 GLU HB2 1 1 12 11146 1 1 32 GLU HB3 H -11.490 5.648 -3.719 1.00 . A A . 32 GLU HB3 1 1 12 11147 1 1 32 GLU HG2 H -10.320 5.581 -6.001 1.00 . A A . 32 GLU HG2 1 1 12 11148 1 1 32 GLU HG3 H -11.750 4.700 -6.546 1.00 . A A . 32 GLU HG3 1 1 12 11149 1 1 32 GLU N N -11.180 2.544 -3.639 1.00 . A A . 32 GLU N 1 1 12 11150 1 1 32 GLU O O -8.573 4.940 -3.279 1.00 . A A . 32 GLU O 1 1 12 11151 1 1 32 GLU OE1 O -12.190 7.508 -5.044 1.00 . A A . 32 GLU OE1 1 1 12 11152 1 1 32 GLU OE2 O -12.610 6.969 -7.133 1.00 . A A . 32 GLU OE2 1 1 12 11153 1 1 33 VAL C C -8.798 3.293 0.327 1.00 . A A . 33 VAL C 1 1 12 11154 1 1 33 VAL CA C -9.114 4.462 -0.601 1.00 . A A . 33 VAL CA 1 1 12 11155 1 1 33 VAL CB C -9.823 5.568 0.204 1.00 . A A . 33 VAL CB 1 1 12 11156 1 1 33 VAL CG1 C -8.903 6.115 1.287 1.00 . A A . 33 VAL CG1 1 1 12 11157 1 1 33 VAL CG2 C -10.290 6.683 -0.718 1.00 . A A . 33 VAL CG2 1 1 12 11158 1 1 33 VAL H H -10.730 3.505 -1.561 1.00 . A A . 33 VAL H 1 1 12 11159 1 1 33 VAL HA H -8.188 4.862 -0.989 1.00 . A A . 33 VAL HA 1 1 12 11160 1 1 33 VAL HB H -10.680 5.137 0.684 1.00 . A A . 33 VAL HB 1 1 12 11161 1 1 33 VAL HG11 H -9.343 7.001 1.719 1.00 . A A . 33 VAL HG11 1 1 12 11162 1 1 33 VAL HG12 H -7.945 6.363 0.854 1.00 . A A . 33 VAL HG12 1 1 12 11163 1 1 33 VAL HG13 H -8.769 5.369 2.056 1.00 . A A . 33 VAL HG13 1 1 12 11164 1 1 33 VAL HG21 H -10.340 6.315 -1.732 1.00 . A A . 33 VAL HG21 1 1 12 11165 1 1 33 VAL HG22 H -9.596 7.508 -0.669 1.00 . A A . 33 VAL HG22 1 1 12 11166 1 1 33 VAL HG23 H -11.270 7.019 -0.405 1.00 . A A . 33 VAL HG23 1 1 12 11167 1 1 33 VAL N N -9.924 4.022 -1.731 1.00 . A A . 33 VAL N 1 1 12 11168 1 1 33 VAL O O -9.697 2.701 0.923 1.00 . A A . 33 VAL O 1 1 12 11169 1 1 34 ILE C C -7.610 2.021 2.722 1.00 . A A . 34 ILE C 1 1 12 11170 1 1 34 ILE CA C -7.083 1.861 1.298 1.00 . A A . 34 ILE CA 1 1 12 11171 1 1 34 ILE CB C -5.546 1.745 1.341 1.00 . A A . 34 ILE CB 1 1 12 11172 1 1 34 ILE CD1 C -3.433 3.058 1.873 1.00 . A A . 34 ILE CD1 1 1 12 11173 1 1 34 ILE CG1 C -4.907 3.121 1.537 1.00 . A A . 34 ILE CG1 1 1 12 11174 1 1 34 ILE CG2 C -5.030 1.094 0.066 1.00 . A A . 34 ILE CG2 1 1 12 11175 1 1 34 ILE H H -6.844 3.471 -0.058 1.00 . A A . 34 ILE H 1 1 12 11176 1 1 34 ILE HA H -7.478 0.945 0.882 1.00 . A A . 34 ILE HA 1 1 12 11177 1 1 34 ILE HB H -5.279 1.110 2.171 1.00 . A A . 34 ILE HB 1 1 12 11178 1 1 34 ILE HD11 H -3.266 2.293 2.617 1.00 . A A . 34 ILE HD11 1 1 12 11179 1 1 34 ILE HD12 H -3.111 4.013 2.261 1.00 . A A . 34 ILE HD12 1 1 12 11180 1 1 34 ILE HD13 H -2.870 2.823 0.982 1.00 . A A . 34 ILE HD13 1 1 12 11181 1 1 34 ILE HG12 H -5.015 3.694 0.629 1.00 . A A . 34 ILE HG12 1 1 12 11182 1 1 34 ILE HG13 H -5.411 3.634 2.343 1.00 . A A . 34 ILE HG13 1 1 12 11183 1 1 34 ILE HG21 H -5.643 1.400 -0.769 1.00 . A A . 34 ILE HG21 1 1 12 11184 1 1 34 ILE HG22 H -5.071 0.020 0.168 1.00 . A A . 34 ILE HG22 1 1 12 11185 1 1 34 ILE HG23 H -4.008 1.401 -0.106 1.00 . A A . 34 ILE HG23 1 1 12 11186 1 1 34 ILE N N -7.514 2.963 0.444 1.00 . A A . 34 ILE N 1 1 12 11187 1 1 34 ILE O O -8.001 3.115 3.128 1.00 . A A . 34 ILE O 1 1 12 11188 1 1 35 PRO C C -7.426 2.007 5.733 1.00 . A A . 35 PRO C 1 1 12 11189 1 1 35 PRO CA C -8.122 0.947 4.885 1.00 . A A . 35 PRO CA 1 1 12 11190 1 1 35 PRO CB C -7.794 -0.456 5.402 1.00 . A A . 35 PRO CB 1 1 12 11191 1 1 35 PRO CD C -7.192 -0.421 3.092 1.00 . A A . 35 PRO CD 1 1 12 11192 1 1 35 PRO CG C -7.734 -1.305 4.180 1.00 . A A . 35 PRO CG 1 1 12 11193 1 1 35 PRO HA H -9.190 1.104 4.921 1.00 . A A . 35 PRO HA 1 1 12 11194 1 1 35 PRO HB2 H -6.845 -0.439 5.919 1.00 . A A . 35 PRO HB2 1 1 12 11195 1 1 35 PRO HB3 H -8.570 -0.786 6.073 1.00 . A A . 35 PRO HB3 1 1 12 11196 1 1 35 PRO HD2 H -6.113 -0.482 3.060 1.00 . A A . 35 PRO HD2 1 1 12 11197 1 1 35 PRO HD3 H -7.615 -0.692 2.137 1.00 . A A . 35 PRO HD3 1 1 12 11198 1 1 35 PRO HG2 H -7.077 -2.145 4.347 1.00 . A A . 35 PRO HG2 1 1 12 11199 1 1 35 PRO HG3 H -8.725 -1.650 3.924 1.00 . A A . 35 PRO HG3 1 1 12 11200 1 1 35 PRO N N -7.633 0.925 3.501 1.00 . A A . 35 PRO N 1 1 12 11201 1 1 35 PRO O O -6.396 2.555 5.344 1.00 . A A . 35 PRO O 1 1 12 11202 1 1 36 GLU C C -6.170 2.788 8.467 1.00 . A A . 36 GLU C 1 1 12 11203 1 1 36 GLU CA C -7.456 3.286 7.808 1.00 . A A . 36 GLU CA 1 1 12 11204 1 1 36 GLU CB C -8.489 3.635 8.882 1.00 . A A . 36 GLU CB 1 1 12 11205 1 1 36 GLU CD C -7.032 4.479 10.768 1.00 . A A . 36 GLU CD 1 1 12 11206 1 1 36 GLU CG C -8.100 4.823 9.748 1.00 . A A . 36 GLU CG 1 1 12 11207 1 1 36 GLU H H -8.827 1.821 7.145 1.00 . A A . 36 GLU H 1 1 12 11208 1 1 36 GLU HA H -7.232 4.174 7.236 1.00 . A A . 36 GLU HA 1 1 12 11209 1 1 36 GLU HB2 H -9.428 3.862 8.401 1.00 . A A . 36 GLU HB2 1 1 12 11210 1 1 36 GLU HB3 H -8.623 2.779 9.526 1.00 . A A . 36 GLU HB3 1 1 12 11211 1 1 36 GLU HG2 H -7.725 5.610 9.111 1.00 . A A . 36 GLU HG2 1 1 12 11212 1 1 36 GLU HG3 H -8.977 5.173 10.272 1.00 . A A . 36 GLU HG3 1 1 12 11213 1 1 36 GLU N N -8.005 2.291 6.896 1.00 . A A . 36 GLU N 1 1 12 11214 1 1 36 GLU O O -5.272 3.575 8.763 1.00 . A A . 36 GLU O 1 1 12 11215 1 1 36 GLU OE1 O -7.275 3.581 11.602 1.00 . A A . 36 GLU OE1 1 1 12 11216 1 1 36 GLU OE2 O -5.952 5.106 10.733 1.00 . A A . 36 GLU OE2 1 1 12 11217 1 1 37 LYS C C -3.874 0.463 8.316 1.00 . A A . 37 LYS C 1 1 12 11218 1 1 37 LYS CA C -4.921 0.891 9.342 1.00 . A A . 37 LYS CA 1 1 12 11219 1 1 37 LYS CB C -5.332 -0.309 10.197 1.00 . A A . 37 LYS CB 1 1 12 11220 1 1 37 LYS CD C -5.892 -1.197 12.482 1.00 . A A . 37 LYS CD 1 1 12 11221 1 1 37 LYS CE C -7.226 -1.088 13.204 1.00 . A A . 37 LYS CE 1 1 12 11222 1 1 37 LYS CG C -5.603 0.044 11.650 1.00 . A A . 37 LYS CG 1 1 12 11223 1 1 37 LYS H H -6.844 0.906 8.454 1.00 . A A . 37 LYS H 1 1 12 11224 1 1 37 LYS HA H -4.483 1.642 9.983 1.00 . A A . 37 LYS HA 1 1 12 11225 1 1 37 LYS HB2 H -6.229 -0.742 9.781 1.00 . A A . 37 LYS HB2 1 1 12 11226 1 1 37 LYS HB3 H -4.542 -1.044 10.169 1.00 . A A . 37 LYS HB3 1 1 12 11227 1 1 37 LYS HD2 H -5.917 -2.058 11.832 1.00 . A A . 37 LYS HD2 1 1 12 11228 1 1 37 LYS HD3 H -5.106 -1.317 13.214 1.00 . A A . 37 LYS HD3 1 1 12 11229 1 1 37 LYS HE2 H -8.012 -0.986 12.471 1.00 . A A . 37 LYS HE2 1 1 12 11230 1 1 37 LYS HE3 H -7.385 -1.989 13.779 1.00 . A A . 37 LYS HE3 1 1 12 11231 1 1 37 LYS HG2 H -4.737 0.543 12.057 1.00 . A A . 37 LYS HG2 1 1 12 11232 1 1 37 LYS HG3 H -6.456 0.705 11.696 1.00 . A A . 37 LYS HG3 1 1 12 11233 1 1 37 LYS HZ1 H -7.079 -0.218 15.098 1.00 . A A . 37 LYS HZ1 1 1 12 11234 1 1 37 LYS HZ2 H -8.205 0.535 14.085 1.00 . A A . 37 LYS HZ2 1 1 12 11235 1 1 37 LYS HZ3 H -6.550 0.783 13.842 1.00 . A A . 37 LYS HZ3 1 1 12 11236 1 1 37 LYS N N -6.094 1.483 8.705 1.00 . A A . 37 LYS N 1 1 12 11237 1 1 37 LYS NZ N -7.268 0.085 14.122 1.00 . A A . 37 LYS NZ 1 1 12 11238 1 1 37 LYS O O -2.702 0.292 8.652 1.00 . A A . 37 LYS O 1 1 12 11239 1 1 38 ASP C C -2.569 1.068 5.510 1.00 . A A . 38 ASP C 1 1 12 11240 1 1 38 ASP CA C -3.374 -0.124 6.014 1.00 . A A . 38 ASP CA 1 1 12 11241 1 1 38 ASP CB C -4.140 -0.768 4.856 1.00 . A A . 38 ASP CB 1 1 12 11242 1 1 38 ASP CG C -4.141 -2.283 4.934 1.00 . A A . 38 ASP CG 1 1 12 11243 1 1 38 ASP H H -5.238 0.433 6.852 1.00 . A A . 38 ASP H 1 1 12 11244 1 1 38 ASP HA H -2.693 -0.849 6.433 1.00 . A A . 38 ASP HA 1 1 12 11245 1 1 38 ASP HB2 H -5.164 -0.426 4.875 1.00 . A A . 38 ASP HB2 1 1 12 11246 1 1 38 ASP HB3 H -3.685 -0.474 3.921 1.00 . A A . 38 ASP HB3 1 1 12 11247 1 1 38 ASP N N -4.294 0.286 7.068 1.00 . A A . 38 ASP N 1 1 12 11248 1 1 38 ASP O O -1.368 0.959 5.262 1.00 . A A . 38 ASP O 1 1 12 11249 1 1 38 ASP OD1 O -3.293 -2.841 5.660 1.00 . A A . 38 ASP OD1 1 1 12 11250 1 1 38 ASP OD2 O -4.989 -2.912 4.267 1.00 . A A . 38 ASP OD2 1 1 12 11251 1 1 39 ALA C C -1.523 3.888 5.893 1.00 . A A . 39 ALA C 1 1 12 11252 1 1 39 ALA CA C -2.581 3.421 4.898 1.00 . A A . 39 ALA CA 1 1 12 11253 1 1 39 ALA CB C -3.607 4.517 4.662 1.00 . A A . 39 ALA CB 1 1 12 11254 1 1 39 ALA H H -4.192 2.234 5.583 1.00 . A A . 39 ALA H 1 1 12 11255 1 1 39 ALA HA H -2.100 3.199 3.956 1.00 . A A . 39 ALA HA 1 1 12 11256 1 1 39 ALA HB1 H -4.307 4.197 3.907 1.00 . A A . 39 ALA HB1 1 1 12 11257 1 1 39 ALA HB2 H -3.104 5.414 4.330 1.00 . A A . 39 ALA HB2 1 1 12 11258 1 1 39 ALA HB3 H -4.135 4.719 5.580 1.00 . A A . 39 ALA HB3 1 1 12 11259 1 1 39 ALA N N -3.236 2.207 5.365 1.00 . A A . 39 ALA N 1 1 12 11260 1 1 39 ALA O O -0.566 4.566 5.522 1.00 . A A . 39 ALA O 1 1 12 11261 1 1 40 TYR C C 0.588 3.223 8.005 1.00 . A A . 40 TYR C 1 1 12 11262 1 1 40 TYR CA C -0.762 3.907 8.203 1.00 . A A . 40 TYR CA 1 1 12 11263 1 1 40 TYR CB C -1.327 3.557 9.581 1.00 . A A . 40 TYR CB 1 1 12 11264 1 1 40 TYR CD1 C -0.204 5.266 11.059 1.00 . A A . 40 TYR CD1 1 1 12 11265 1 1 40 TYR CD2 C 0.248 2.959 11.459 1.00 . A A . 40 TYR CD2 1 1 12 11266 1 1 40 TYR CE1 C 0.634 5.616 12.099 1.00 . A A . 40 TYR CE1 1 1 12 11267 1 1 40 TYR CE2 C 1.087 3.302 12.502 1.00 . A A . 40 TYR CE2 1 1 12 11268 1 1 40 TYR CG C -0.411 3.935 10.722 1.00 . A A . 40 TYR CG 1 1 12 11269 1 1 40 TYR CZ C 1.277 4.631 12.818 1.00 . A A . 40 TYR CZ 1 1 12 11270 1 1 40 TYR H H -2.486 2.981 7.398 1.00 . A A . 40 TYR H 1 1 12 11271 1 1 40 TYR HA H -0.621 4.976 8.143 1.00 . A A . 40 TYR HA 1 1 12 11272 1 1 40 TYR HB2 H -2.265 4.078 9.721 1.00 . A A . 40 TYR HB2 1 1 12 11273 1 1 40 TYR HB3 H -1.499 2.489 9.631 1.00 . A A . 40 TYR HB3 1 1 12 11274 1 1 40 TYR HD1 H -0.710 6.035 10.493 1.00 . A A . 40 TYR HD1 1 1 12 11275 1 1 40 TYR HD2 H 0.097 1.920 11.208 1.00 . A A . 40 TYR HD2 1 1 12 11276 1 1 40 TYR HE1 H 0.782 6.658 12.345 1.00 . A A . 40 TYR HE1 1 1 12 11277 1 1 40 TYR HE2 H 1.592 2.529 13.066 1.00 . A A . 40 TYR HE2 1 1 12 11278 1 1 40 TYR HH H 2.998 5.126 13.516 1.00 . A A . 40 TYR HH 1 1 12 11279 1 1 40 TYR N N -1.702 3.521 7.159 1.00 . A A . 40 TYR N 1 1 12 11280 1 1 40 TYR O O 1.576 3.869 7.658 1.00 . A A . 40 TYR O 1 1 12 11281 1 1 40 TYR OH O 2.113 4.975 13.855 1.00 . A A . 40 TYR OH 1 1 12 11282 1 1 41 ARG C C 2.455 1.327 6.692 1.00 . A A . 41 ARG C 1 1 12 11283 1 1 41 ARG CA C 1.852 1.141 8.081 1.00 . A A . 41 ARG CA 1 1 12 11284 1 1 41 ARG CB C 1.580 -0.343 8.335 1.00 . A A . 41 ARG CB 1 1 12 11285 1 1 41 ARG CD C 0.668 -2.108 9.877 1.00 . A A . 41 ARG CD 1 1 12 11286 1 1 41 ARG CG C 0.957 -0.625 9.693 1.00 . A A . 41 ARG CG 1 1 12 11287 1 1 41 ARG CZ C 1.572 -4.017 11.145 1.00 . A A . 41 ARG CZ 1 1 12 11288 1 1 41 ARG H H -0.198 1.455 8.509 1.00 . A A . 41 ARG H 1 1 12 11289 1 1 41 ARG HA H 2.558 1.497 8.816 1.00 . A A . 41 ARG HA 1 1 12 11290 1 1 41 ARG HB2 H 0.910 -0.711 7.572 1.00 . A A . 41 ARG HB2 1 1 12 11291 1 1 41 ARG HB3 H 2.513 -0.883 8.273 1.00 . A A . 41 ARG HB3 1 1 12 11292 1 1 41 ARG HD2 H -0.303 -2.217 10.340 1.00 . A A . 41 ARG HD2 1 1 12 11293 1 1 41 ARG HD3 H 0.658 -2.583 8.907 1.00 . A A . 41 ARG HD3 1 1 12 11294 1 1 41 ARG HE H 2.455 -2.236 10.975 1.00 . A A . 41 ARG HE 1 1 12 11295 1 1 41 ARG HG2 H 1.640 -0.304 10.465 1.00 . A A . 41 ARG HG2 1 1 12 11296 1 1 41 ARG HG3 H 0.032 -0.074 9.774 1.00 . A A . 41 ARG HG3 1 1 12 11297 1 1 41 ARG HH11 H -0.203 -4.376 10.241 1.00 . A A . 41 ARG HH11 1 1 12 11298 1 1 41 ARG HH12 H 0.454 -5.702 11.139 1.00 . A A . 41 ARG HH12 1 1 12 11299 1 1 41 ARG HH21 H 3.321 -3.981 12.156 1.00 . A A . 41 ARG HH21 1 1 12 11300 1 1 41 ARG HH22 H 2.455 -5.479 12.225 1.00 . A A . 41 ARG HH22 1 1 12 11301 1 1 41 ARG N N 0.623 1.913 8.232 1.00 . A A . 41 ARG N 1 1 12 11302 1 1 41 ARG NE N 1.669 -2.761 10.717 1.00 . A A . 41 ARG NE 1 1 12 11303 1 1 41 ARG NH1 N 0.521 -4.759 10.814 1.00 . A A . 41 ARG NH1 1 1 12 11304 1 1 41 ARG NH2 N 2.527 -4.534 11.905 1.00 . A A . 41 ARG NH2 1 1 12 11305 1 1 41 ARG O O 3.666 1.204 6.508 1.00 . A A . 41 ARG O 1 1 12 11306 1 1 42 LEU C C 3.059 2.968 4.258 1.00 . A A . 42 LEU C 1 1 12 11307 1 1 42 LEU CA C 2.054 1.822 4.341 1.00 . A A . 42 LEU CA 1 1 12 11308 1 1 42 LEU CB C 0.861 2.104 3.426 1.00 . A A . 42 LEU CB 1 1 12 11309 1 1 42 LEU CD1 C -0.955 1.242 1.926 1.00 . A A . 42 LEU CD1 1 1 12 11310 1 1 42 LEU CD2 C 1.370 0.338 1.722 1.00 . A A . 42 LEU CD2 1 1 12 11311 1 1 42 LEU CG C 0.319 0.884 2.678 1.00 . A A . 42 LEU CG 1 1 12 11312 1 1 42 LEU H H 0.649 1.706 5.919 1.00 . A A . 42 LEU H 1 1 12 11313 1 1 42 LEU HA H 2.538 0.914 4.018 1.00 . A A . 42 LEU HA 1 1 12 11314 1 1 42 LEU HB2 H 0.063 2.516 4.027 1.00 . A A . 42 LEU HB2 1 1 12 11315 1 1 42 LEU HB3 H 1.158 2.843 2.696 1.00 . A A . 42 LEU HB3 1 1 12 11316 1 1 42 LEU HD11 H -0.963 0.738 0.970 1.00 . A A . 42 LEU HD11 1 1 12 11317 1 1 42 LEU HD12 H -0.993 2.309 1.770 1.00 . A A . 42 LEU HD12 1 1 12 11318 1 1 42 LEU HD13 H -1.812 0.930 2.504 1.00 . A A . 42 LEU HD13 1 1 12 11319 1 1 42 LEU HD21 H 2.040 -0.316 2.260 1.00 . A A . 42 LEU HD21 1 1 12 11320 1 1 42 LEU HD22 H 1.930 1.157 1.296 1.00 . A A . 42 LEU HD22 1 1 12 11321 1 1 42 LEU HD23 H 0.885 -0.216 0.932 1.00 . A A . 42 LEU HD23 1 1 12 11322 1 1 42 LEU HG H 0.079 0.111 3.391 1.00 . A A . 42 LEU HG 1 1 12 11323 1 1 42 LEU N N 1.603 1.622 5.713 1.00 . A A . 42 LEU N 1 1 12 11324 1 1 42 LEU O O 3.989 2.934 3.453 1.00 . A A . 42 LEU O 1 1 12 11325 1 1 43 GLU C C 5.134 4.770 5.651 1.00 . A A . 43 GLU C 1 1 12 11326 1 1 43 GLU CA C 3.753 5.140 5.113 1.00 . A A . 43 GLU CA 1 1 12 11327 1 1 43 GLU CB C 3.147 6.260 5.961 1.00 . A A . 43 GLU CB 1 1 12 11328 1 1 43 GLU CD C 4.548 7.933 7.237 1.00 . A A . 43 GLU CD 1 1 12 11329 1 1 43 GLU CG C 3.932 7.561 5.903 1.00 . A A . 43 GLU CG 1 1 12 11330 1 1 43 GLU H H 2.104 3.955 5.712 1.00 . A A . 43 GLU H 1 1 12 11331 1 1 43 GLU HA H 3.860 5.491 4.098 1.00 . A A . 43 GLU HA 1 1 12 11332 1 1 43 GLU HB2 H 2.143 6.455 5.614 1.00 . A A . 43 GLU HB2 1 1 12 11333 1 1 43 GLU HB3 H 3.106 5.934 6.990 1.00 . A A . 43 GLU HB3 1 1 12 11334 1 1 43 GLU HG2 H 4.724 7.456 5.176 1.00 . A A . 43 GLU HG2 1 1 12 11335 1 1 43 GLU HG3 H 3.265 8.354 5.597 1.00 . A A . 43 GLU HG3 1 1 12 11336 1 1 43 GLU N N 2.865 3.984 5.094 1.00 . A A . 43 GLU N 1 1 12 11337 1 1 43 GLU O O 6.116 5.464 5.388 1.00 . A A . 43 GLU O 1 1 12 11338 1 1 43 GLU OE1 O 3.789 8.091 8.217 1.00 . A A . 43 GLU OE1 1 1 12 11339 1 1 43 GLU OE2 O 5.787 8.065 7.303 1.00 . A A . 43 GLU OE2 1 1 12 11340 1 1 44 ILE C C 7.238 2.349 6.005 1.00 . A A . 44 ILE C 1 1 12 11341 1 1 44 ILE CA C 6.467 3.229 6.983 1.00 . A A . 44 ILE CA 1 1 12 11342 1 1 44 ILE CB C 6.240 2.450 8.291 1.00 . A A . 44 ILE CB 1 1 12 11343 1 1 44 ILE CD1 C 5.547 3.004 10.691 1.00 . A A . 44 ILE CD1 1 1 12 11344 1 1 44 ILE CG1 C 5.308 3.243 9.216 1.00 . A A . 44 ILE CG1 1 1 12 11345 1 1 44 ILE CG2 C 7.576 2.158 8.965 1.00 . A A . 44 ILE CG2 1 1 12 11346 1 1 44 ILE H H 4.388 3.167 6.587 1.00 . A A . 44 ILE H 1 1 12 11347 1 1 44 ILE HA H 7.058 4.102 7.211 1.00 . A A . 44 ILE HA 1 1 12 11348 1 1 44 ILE HB H 5.775 1.507 8.046 1.00 . A A . 44 ILE HB 1 1 12 11349 1 1 44 ILE HD11 H 4.847 3.587 11.269 1.00 . A A . 44 ILE HD11 1 1 12 11350 1 1 44 ILE HD12 H 6.555 3.298 10.943 1.00 . A A . 44 ILE HD12 1 1 12 11351 1 1 44 ILE HD13 H 5.412 1.955 10.912 1.00 . A A . 44 ILE HD13 1 1 12 11352 1 1 44 ILE HG12 H 5.443 4.298 9.030 1.00 . A A . 44 ILE HG12 1 1 12 11353 1 1 44 ILE HG13 H 4.285 2.974 8.998 1.00 . A A . 44 ILE HG13 1 1 12 11354 1 1 44 ILE HG21 H 8.332 1.995 8.211 1.00 . A A . 44 ILE HG21 1 1 12 11355 1 1 44 ILE HG22 H 7.484 1.275 9.579 1.00 . A A . 44 ILE HG22 1 1 12 11356 1 1 44 ILE HG23 H 7.858 2.998 9.583 1.00 . A A . 44 ILE HG23 1 1 12 11357 1 1 44 ILE N N 5.203 3.680 6.408 1.00 . A A . 44 ILE N 1 1 12 11358 1 1 44 ILE O O 8.427 2.563 5.768 1.00 . A A . 44 ILE O 1 1 12 11359 1 1 45 VAL C C 7.764 1.186 3.301 1.00 . A A . 45 VAL C 1 1 12 11360 1 1 45 VAL CA C 7.178 0.439 4.492 1.00 . A A . 45 VAL CA 1 1 12 11361 1 1 45 VAL CB C 6.174 -0.607 3.972 1.00 . A A . 45 VAL CB 1 1 12 11362 1 1 45 VAL CG1 C 5.999 -1.731 4.982 1.00 . A A . 45 VAL CG1 1 1 12 11363 1 1 45 VAL CG2 C 4.839 0.042 3.646 1.00 . A A . 45 VAL CG2 1 1 12 11364 1 1 45 VAL H H 5.612 1.236 5.674 1.00 . A A . 45 VAL H 1 1 12 11365 1 1 45 VAL HA H 7.975 -0.082 5.005 1.00 . A A . 45 VAL HA 1 1 12 11366 1 1 45 VAL HB H 6.573 -1.031 3.063 1.00 . A A . 45 VAL HB 1 1 12 11367 1 1 45 VAL HG11 H 4.957 -2.009 5.035 1.00 . A A . 45 VAL HG11 1 1 12 11368 1 1 45 VAL HG12 H 6.332 -1.397 5.954 1.00 . A A . 45 VAL HG12 1 1 12 11369 1 1 45 VAL HG13 H 6.585 -2.585 4.676 1.00 . A A . 45 VAL HG13 1 1 12 11370 1 1 45 VAL HG21 H 4.310 0.260 4.562 1.00 . A A . 45 VAL HG21 1 1 12 11371 1 1 45 VAL HG22 H 4.249 -0.631 3.042 1.00 . A A . 45 VAL HG22 1 1 12 11372 1 1 45 VAL HG23 H 5.006 0.959 3.102 1.00 . A A . 45 VAL HG23 1 1 12 11373 1 1 45 VAL N N 6.555 1.356 5.443 1.00 . A A . 45 VAL N 1 1 12 11374 1 1 45 VAL O O 8.816 0.816 2.778 1.00 . A A . 45 VAL O 1 1 12 11375 1 1 46 THR C C 8.573 4.063 2.142 1.00 . A A . 46 THR C 1 1 12 11376 1 1 46 THR CA C 7.513 3.035 1.738 1.00 . A A . 46 THR CA 1 1 12 11377 1 1 46 THR CB C 6.313 3.743 1.112 1.00 . A A . 46 THR CB 1 1 12 11378 1 1 46 THR CG2 C 5.419 2.816 0.318 1.00 . A A . 46 THR CG2 1 1 12 11379 1 1 46 THR H H 6.242 2.476 3.326 1.00 . A A . 46 THR H 1 1 12 11380 1 1 46 THR HA H 7.942 2.365 1.008 1.00 . A A . 46 THR HA 1 1 12 11381 1 1 46 THR HB H 6.672 4.509 0.445 1.00 . A A . 46 THR HB 1 1 12 11382 1 1 46 THR HG1 H 4.774 4.801 1.696 1.00 . A A . 46 THR HG1 1 1 12 11383 1 1 46 THR HG21 H 4.655 2.410 0.965 1.00 . A A . 46 THR HG21 1 1 12 11384 1 1 46 THR HG22 H 6.008 2.008 -0.092 1.00 . A A . 46 THR HG22 1 1 12 11385 1 1 46 THR HG23 H 4.955 3.366 -0.487 1.00 . A A . 46 THR HG23 1 1 12 11386 1 1 46 THR N N 7.074 2.236 2.873 1.00 . A A . 46 THR N 1 1 12 11387 1 1 46 THR O O 8.929 4.935 1.351 1.00 . A A . 46 THR O 1 1 12 11388 1 1 46 THR OG1 O 5.518 4.359 2.109 1.00 . A A . 46 THR OG1 1 1 12 11389 1 1 47 ALA C C 9.542 6.302 3.968 1.00 . A A . 47 ALA C 1 1 12 11390 1 1 47 ALA CA C 10.094 4.884 3.860 1.00 . A A . 47 ALA CA 1 1 12 11391 1 1 47 ALA CB C 11.315 4.857 2.952 1.00 . A A . 47 ALA CB 1 1 12 11392 1 1 47 ALA H H 8.761 3.247 3.961 1.00 . A A . 47 ALA H 1 1 12 11393 1 1 47 ALA HA H 10.398 4.554 4.842 1.00 . A A . 47 ALA HA 1 1 12 11394 1 1 47 ALA HB1 H 11.727 5.852 2.871 1.00 . A A . 47 ALA HB1 1 1 12 11395 1 1 47 ALA HB2 H 11.029 4.505 1.973 1.00 . A A . 47 ALA HB2 1 1 12 11396 1 1 47 ALA HB3 H 12.058 4.192 3.369 1.00 . A A . 47 ALA HB3 1 1 12 11397 1 1 47 ALA N N 9.077 3.960 3.371 1.00 . A A . 47 ALA N 1 1 12 11398 1 1 47 ALA O O 10.267 7.277 3.773 1.00 . A A . 47 ALA O 1 1 12 11399 1 1 48 GLY C C 7.326 8.350 3.076 1.00 . A A . 48 GLY C 1 1 12 11400 1 1 48 GLY CA C 7.631 7.711 4.417 1.00 . A A . 48 GLY CA 1 1 12 11401 1 1 48 GLY H H 7.728 5.597 4.432 1.00 . A A . 48 GLY H 1 1 12 11402 1 1 48 GLY HA2 H 6.708 7.601 4.968 1.00 . A A . 48 GLY HA2 1 1 12 11403 1 1 48 GLY HA3 H 8.292 8.361 4.971 1.00 . A A . 48 GLY HA3 1 1 12 11404 1 1 48 GLY N N 8.256 6.409 4.285 1.00 . A A . 48 GLY N 1 1 12 11405 1 1 48 GLY O O 7.281 9.575 2.961 1.00 . A A . 48 GLY O 1 1 12 11406 1 1 49 ALA C C 5.377 8.531 0.645 1.00 . A A . 49 ALA C 1 1 12 11407 1 1 49 ALA CA C 6.809 8.014 0.724 1.00 . A A . 49 ALA CA 1 1 12 11408 1 1 49 ALA CB C 7.034 6.919 -0.308 1.00 . A A . 49 ALA CB 1 1 12 11409 1 1 49 ALA H H 7.160 6.553 2.215 1.00 . A A . 49 ALA H 1 1 12 11410 1 1 49 ALA HA H 7.487 8.826 0.505 1.00 . A A . 49 ALA HA 1 1 12 11411 1 1 49 ALA HB1 H 6.167 6.276 -0.344 1.00 . A A . 49 ALA HB1 1 1 12 11412 1 1 49 ALA HB2 H 7.901 6.339 -0.031 1.00 . A A . 49 ALA HB2 1 1 12 11413 1 1 49 ALA HB3 H 7.192 7.364 -1.278 1.00 . A A . 49 ALA HB3 1 1 12 11414 1 1 49 ALA N N 7.113 7.521 2.061 1.00 . A A . 49 ALA N 1 1 12 11415 1 1 49 ALA O O 5.133 9.646 0.182 1.00 . A A . 49 ALA O 1 1 12 11416 1 1 50 LEU C C 2.618 8.728 2.409 1.00 . A A . 50 LEU C 1 1 12 11417 1 1 50 LEU CA C 3.025 8.089 1.085 1.00 . A A . 50 LEU CA 1 1 12 11418 1 1 50 LEU CB C 2.153 6.862 0.807 1.00 . A A . 50 LEU CB 1 1 12 11419 1 1 50 LEU CD1 C 1.272 5.216 -0.866 1.00 . A A . 50 LEU CD1 1 1 12 11420 1 1 50 LEU CD2 C 0.880 7.663 -1.196 1.00 . A A . 50 LEU CD2 1 1 12 11421 1 1 50 LEU CG C 1.844 6.611 -0.670 1.00 . A A . 50 LEU CG 1 1 12 11422 1 1 50 LEU H H 4.691 6.839 1.460 1.00 . A A . 50 LEU H 1 1 12 11423 1 1 50 LEU HA H 2.881 8.809 0.294 1.00 . A A . 50 LEU HA 1 1 12 11424 1 1 50 LEU HB2 H 2.656 5.992 1.203 1.00 . A A . 50 LEU HB2 1 1 12 11425 1 1 50 LEU HB3 H 1.217 6.985 1.331 1.00 . A A . 50 LEU HB3 1 1 12 11426 1 1 50 LEU HD11 H 1.581 4.831 -1.827 1.00 . A A . 50 LEU HD11 1 1 12 11427 1 1 50 LEU HD12 H 0.193 5.260 -0.826 1.00 . A A . 50 LEU HD12 1 1 12 11428 1 1 50 LEU HD13 H 1.634 4.565 -0.084 1.00 . A A . 50 LEU HD13 1 1 12 11429 1 1 50 LEU HD21 H 1.201 8.641 -0.871 1.00 . A A . 50 LEU HD21 1 1 12 11430 1 1 50 LEU HD22 H -0.112 7.465 -0.819 1.00 . A A . 50 LEU HD22 1 1 12 11431 1 1 50 LEU HD23 H 0.866 7.630 -2.277 1.00 . A A . 50 LEU HD23 1 1 12 11432 1 1 50 LEU HG H 2.759 6.679 -1.239 1.00 . A A . 50 LEU HG 1 1 12 11433 1 1 50 LEU N N 4.434 7.715 1.102 1.00 . A A . 50 LEU N 1 1 12 11434 1 1 50 LEU O O 2.647 8.082 3.458 1.00 . A A . 50 LEU O 1 1 12 11435 1 1 51 LYS C C 0.391 10.397 3.925 1.00 . A A . 51 LYS C 1 1 12 11436 1 1 51 LYS CA C 1.832 10.728 3.552 1.00 . A A . 51 LYS CA 1 1 12 11437 1 1 51 LYS CB C 1.981 12.235 3.336 1.00 . A A . 51 LYS CB 1 1 12 11438 1 1 51 LYS CD C 0.810 14.159 2.219 1.00 . A A . 51 LYS CD 1 1 12 11439 1 1 51 LYS CE C 1.921 15.175 2.008 1.00 . A A . 51 LYS CE 1 1 12 11440 1 1 51 LYS CG C 1.320 12.735 2.061 1.00 . A A . 51 LYS CG 1 1 12 11441 1 1 51 LYS H H 2.241 10.463 1.492 1.00 . A A . 51 LYS H 1 1 12 11442 1 1 51 LYS HA H 2.479 10.425 4.361 1.00 . A A . 51 LYS HA 1 1 12 11443 1 1 51 LYS HB2 H 1.538 12.754 4.172 1.00 . A A . 51 LYS HB2 1 1 12 11444 1 1 51 LYS HB3 H 3.033 12.478 3.288 1.00 . A A . 51 LYS HB3 1 1 12 11445 1 1 51 LYS HD2 H 0.032 14.336 1.492 1.00 . A A . 51 LYS HD2 1 1 12 11446 1 1 51 LYS HD3 H 0.408 14.278 3.214 1.00 . A A . 51 LYS HD3 1 1 12 11447 1 1 51 LYS HE2 H 2.555 14.835 1.202 1.00 . A A . 51 LYS HE2 1 1 12 11448 1 1 51 LYS HE3 H 1.479 16.123 1.742 1.00 . A A . 51 LYS HE3 1 1 12 11449 1 1 51 LYS HG2 H 2.042 12.709 1.258 1.00 . A A . 51 LYS HG2 1 1 12 11450 1 1 51 LYS HG3 H 0.489 12.089 1.821 1.00 . A A . 51 LYS HG3 1 1 12 11451 1 1 51 LYS HZ1 H 3.477 16.080 3.068 1.00 . A A . 51 LYS HZ1 1 1 12 11452 1 1 51 LYS HZ2 H 3.220 14.460 3.480 1.00 . A A . 51 LYS HZ2 1 1 12 11453 1 1 51 LYS HZ3 H 2.150 15.650 4.028 1.00 . A A . 51 LYS HZ3 1 1 12 11454 1 1 51 LYS N N 2.242 10.001 2.356 1.00 . A A . 51 LYS N 1 1 12 11455 1 1 51 LYS NZ N 2.750 15.354 3.232 1.00 . A A . 51 LYS NZ 1 1 12 11456 1 1 51 LYS O O -0.521 10.549 3.113 1.00 . A A . 51 LYS O 1 1 12 11457 1 1 52 TYR C C -2.027 10.832 5.728 1.00 . A A . 52 TYR C 1 1 12 11458 1 1 52 TYR CA C -1.138 9.595 5.641 1.00 . A A . 52 TYR CA 1 1 12 11459 1 1 52 TYR CB C -1.046 8.922 7.012 1.00 . A A . 52 TYR CB 1 1 12 11460 1 1 52 TYR CD1 C -3.405 8.788 7.902 1.00 . A A . 52 TYR CD1 1 1 12 11461 1 1 52 TYR CD2 C -2.336 6.764 7.233 1.00 . A A . 52 TYR CD2 1 1 12 11462 1 1 52 TYR CE1 C -4.538 8.079 8.248 1.00 . A A . 52 TYR CE1 1 1 12 11463 1 1 52 TYR CE2 C -3.467 6.050 7.578 1.00 . A A . 52 TYR CE2 1 1 12 11464 1 1 52 TYR CG C -2.286 8.144 7.389 1.00 . A A . 52 TYR CG 1 1 12 11465 1 1 52 TYR CZ C -4.564 6.712 8.084 1.00 . A A . 52 TYR CZ 1 1 12 11466 1 1 52 TYR H H 0.961 9.849 5.761 1.00 . A A . 52 TYR H 1 1 12 11467 1 1 52 TYR HA H -1.572 8.901 4.938 1.00 . A A . 52 TYR HA 1 1 12 11468 1 1 52 TYR HB2 H -0.211 8.236 7.014 1.00 . A A . 52 TYR HB2 1 1 12 11469 1 1 52 TYR HB3 H -0.884 9.678 7.767 1.00 . A A . 52 TYR HB3 1 1 12 11470 1 1 52 TYR HD1 H -3.382 9.860 8.028 1.00 . A A . 52 TYR HD1 1 1 12 11471 1 1 52 TYR HD2 H -1.475 6.248 6.836 1.00 . A A . 52 TYR HD2 1 1 12 11472 1 1 52 TYR HE1 H -5.398 8.598 8.645 1.00 . A A . 52 TYR HE1 1 1 12 11473 1 1 52 TYR HE2 H -3.488 4.978 7.449 1.00 . A A . 52 TYR HE2 1 1 12 11474 1 1 52 TYR HH H -6.230 5.859 7.645 1.00 . A A . 52 TYR HH 1 1 12 11475 1 1 52 TYR N N 0.193 9.947 5.160 1.00 . A A . 52 TYR N 1 1 12 11476 1 1 52 TYR O O -1.546 11.940 5.962 1.00 . A A . 52 TYR O 1 1 12 11477 1 1 52 TYR OH O -5.691 6.003 8.428 1.00 . A A . 52 TYR OH 1 1 12 11478 1 1 53 GLN C C -5.607 11.269 6.203 1.00 . A A . 53 GLN C 1 1 12 11479 1 1 53 GLN CA C -4.286 11.731 5.597 1.00 . A A . 53 GLN CA 1 1 12 11480 1 1 53 GLN CB C -4.522 12.302 4.197 1.00 . A A . 53 GLN CB 1 1 12 11481 1 1 53 GLN CD C -3.437 13.298 2.145 1.00 . A A . 53 GLN CD 1 1 12 11482 1 1 53 GLN CG C -3.327 13.055 3.638 1.00 . A A . 53 GLN CG 1 1 12 11483 1 1 53 GLN H H -3.651 9.726 5.357 1.00 . A A . 53 GLN H 1 1 12 11484 1 1 53 GLN HA H -3.866 12.503 6.224 1.00 . A A . 53 GLN HA 1 1 12 11485 1 1 53 GLN HB2 H -4.756 11.490 3.525 1.00 . A A . 53 GLN HB2 1 1 12 11486 1 1 53 GLN HB3 H -5.363 12.979 4.235 1.00 . A A . 53 GLN HB3 1 1 12 11487 1 1 53 GLN HE21 H -2.244 11.750 1.781 1.00 . A A . 53 GLN HE21 1 1 12 11488 1 1 53 GLN HE22 H -2.819 12.598 0.390 1.00 . A A . 53 GLN HE22 1 1 12 11489 1 1 53 GLN HG2 H -3.254 14.010 4.136 1.00 . A A . 53 GLN HG2 1 1 12 11490 1 1 53 GLN HG3 H -2.433 12.481 3.830 1.00 . A A . 53 GLN HG3 1 1 12 11491 1 1 53 GLN N N -3.328 10.633 5.540 1.00 . A A . 53 GLN N 1 1 12 11492 1 1 53 GLN NE2 N -2.766 12.464 1.359 1.00 . A A . 53 GLN NE2 1 1 12 11493 1 1 53 GLN O O -6.359 10.520 5.578 1.00 . A A . 53 GLN O 1 1 12 11494 1 1 53 GLN OE1 O -4.119 14.224 1.704 1.00 . A A . 53 GLN OE1 1 1 12 11495 1 1 54 GLU C C -8.352 11.843 7.364 1.00 . A A . 54 GLU C 1 1 12 11496 1 1 54 GLU CA C -7.113 11.356 8.117 1.00 . A A . 54 GLU CA 1 1 12 11497 1 1 54 GLU CB C -7.109 11.932 9.535 1.00 . A A . 54 GLU CB 1 1 12 11498 1 1 54 GLU CD C -8.308 13.998 10.362 1.00 . A A . 54 GLU CD 1 1 12 11499 1 1 54 GLU CG C -7.132 13.452 9.573 1.00 . A A . 54 GLU CG 1 1 12 11500 1 1 54 GLU H H -5.242 12.316 7.865 1.00 . A A . 54 GLU H 1 1 12 11501 1 1 54 GLU HA H -7.148 10.279 8.180 1.00 . A A . 54 GLU HA 1 1 12 11502 1 1 54 GLU HB2 H -7.977 11.565 10.062 1.00 . A A . 54 GLU HB2 1 1 12 11503 1 1 54 GLU HB3 H -6.218 11.594 10.045 1.00 . A A . 54 GLU HB3 1 1 12 11504 1 1 54 GLU HG2 H -6.220 13.802 10.033 1.00 . A A . 54 GLU HG2 1 1 12 11505 1 1 54 GLU HG3 H -7.192 13.825 8.562 1.00 . A A . 54 GLU HG3 1 1 12 11506 1 1 54 GLU N N -5.883 11.721 7.421 1.00 . A A . 54 GLU N 1 1 12 11507 1 1 54 GLU O O -9.467 11.402 7.643 1.00 . A A . 54 GLU O 1 1 12 11508 1 1 54 GLU OE1 O -8.819 13.277 11.243 1.00 . A A . 54 GLU OE1 1 1 12 11509 1 1 54 GLU OE2 O -8.719 15.148 10.094 1.00 . A A . 54 GLU OE2 1 1 12 11510 1 1 55 ASN C C -10.200 12.205 5.146 1.00 . A A . 55 ASN C 1 1 12 11511 1 1 55 ASN CA C -9.259 13.305 5.633 1.00 . A A . 55 ASN CA 1 1 12 11512 1 1 55 ASN CB C -8.718 14.097 4.439 1.00 . A A . 55 ASN CB 1 1 12 11513 1 1 55 ASN CG C -9.232 15.524 4.410 1.00 . A A . 55 ASN CG 1 1 12 11514 1 1 55 ASN H H -7.245 13.078 6.242 1.00 . A A . 55 ASN H 1 1 12 11515 1 1 55 ASN HA H -9.813 13.975 6.273 1.00 . A A . 55 ASN HA 1 1 12 11516 1 1 55 ASN HB2 H -7.640 14.124 4.492 1.00 . A A . 55 ASN HB2 1 1 12 11517 1 1 55 ASN HB3 H -9.017 13.608 3.523 1.00 . A A . 55 ASN HB3 1 1 12 11518 1 1 55 ASN HD21 H -10.790 14.965 3.317 1.00 . A A . 55 ASN HD21 1 1 12 11519 1 1 55 ASN HD22 H -10.710 16.645 3.710 1.00 . A A . 55 ASN HD22 1 1 12 11520 1 1 55 ASN N N -8.154 12.758 6.416 1.00 . A A . 55 ASN N 1 1 12 11521 1 1 55 ASN ND2 N -10.360 15.732 3.746 1.00 . A A . 55 ASN ND2 1 1 12 11522 1 1 55 ASN O O -11.410 12.275 5.356 1.00 . A A . 55 ASN O 1 1 12 11523 1 1 55 ASN OD1 O -8.618 16.428 4.979 1.00 . A A . 55 ASN OD1 1 1 12 11524 1 1 56 ALA C C -10.790 9.099 5.089 1.00 . A A . 56 ALA C 1 1 12 11525 1 1 56 ALA CA C -10.420 10.083 3.980 1.00 . A A . 56 ALA CA 1 1 12 11526 1 1 56 ALA CB C -9.676 9.369 2.867 1.00 . A A . 56 ALA CB 1 1 12 11527 1 1 56 ALA H H -8.668 11.194 4.356 1.00 . A A . 56 ALA H 1 1 12 11528 1 1 56 ALA HA H -11.330 10.489 3.560 1.00 . A A . 56 ALA HA 1 1 12 11529 1 1 56 ALA HB1 H -9.202 8.483 3.264 1.00 . A A . 56 ALA HB1 1 1 12 11530 1 1 56 ALA HB2 H -8.924 10.029 2.462 1.00 . A A . 56 ALA HB2 1 1 12 11531 1 1 56 ALA HB3 H -10.360 9.087 2.087 1.00 . A A . 56 ALA HB3 1 1 12 11532 1 1 56 ALA N N -9.638 11.193 4.495 1.00 . A A . 56 ALA N 1 1 12 11533 1 1 56 ALA O O -11.770 8.366 4.983 1.00 . A A . 56 ALA O 1 1 12 11534 1 1 57 TYR C C -10.800 8.954 8.469 1.00 . A A . 57 TYR C 1 1 12 11535 1 1 57 TYR CA C -10.230 8.191 7.278 1.00 . A A . 57 TYR CA 1 1 12 11536 1 1 57 TYR CB C -8.934 7.492 7.687 1.00 . A A . 57 TYR CB 1 1 12 11537 1 1 57 TYR CD1 C -8.279 6.208 5.614 1.00 . A A . 57 TYR CD1 1 1 12 11538 1 1 57 TYR CD2 C -6.847 7.968 6.345 1.00 . A A . 57 TYR CD2 1 1 12 11539 1 1 57 TYR CE1 C -7.432 5.956 4.551 1.00 . A A . 57 TYR CE1 1 1 12 11540 1 1 57 TYR CE2 C -5.995 7.723 5.286 1.00 . A A . 57 TYR CE2 1 1 12 11541 1 1 57 TYR CG C -8.002 7.216 6.528 1.00 . A A . 57 TYR CG 1 1 12 11542 1 1 57 TYR CZ C -6.292 6.716 4.392 1.00 . A A . 57 TYR CZ 1 1 12 11543 1 1 57 TYR H H -9.225 9.693 6.179 1.00 . A A . 57 TYR H 1 1 12 11544 1 1 57 TYR HA H -10.940 7.445 6.965 1.00 . A A . 57 TYR HA 1 1 12 11545 1 1 57 TYR HB2 H -8.405 8.113 8.394 1.00 . A A . 57 TYR HB2 1 1 12 11546 1 1 57 TYR HB3 H -9.173 6.547 8.152 1.00 . A A . 57 TYR HB3 1 1 12 11547 1 1 57 TYR HD1 H -9.172 5.616 5.740 1.00 . A A . 57 TYR HD1 1 1 12 11548 1 1 57 TYR HD2 H -6.617 8.757 7.047 1.00 . A A . 57 TYR HD2 1 1 12 11549 1 1 57 TYR HE1 H -7.665 5.169 3.851 1.00 . A A . 57 TYR HE1 1 1 12 11550 1 1 57 TYR HE2 H -5.102 8.316 5.161 1.00 . A A . 57 TYR HE2 1 1 12 11551 1 1 57 TYR HH H -5.496 5.542 3.090 1.00 . A A . 57 TYR HH 1 1 12 11552 1 1 57 TYR N N -9.995 9.088 6.152 1.00 . A A . 57 TYR N 1 1 12 11553 1 1 57 TYR O O -10.460 8.680 9.618 1.00 . A A . 57 TYR O 1 1 12 11554 1 1 57 TYR OH O -5.445 6.469 3.333 1.00 . A A . 57 TYR OH 1 1 12 11555 1 1 58 ARG C C -13.740 10.286 9.474 1.00 . A A . 58 ARG C 1 1 12 11556 1 1 58 ARG CA C -12.300 10.717 9.233 1.00 . A A . 58 ARG CA 1 1 12 11557 1 1 58 ARG CB C -12.250 12.203 8.865 1.00 . A A . 58 ARG CB 1 1 12 11558 1 1 58 ARG CD C -14.400 13.033 7.863 1.00 . A A . 58 ARG CD 1 1 12 11559 1 1 58 ARG CG C -12.990 12.537 7.581 1.00 . A A . 58 ARG CG 1 1 12 11560 1 1 58 ARG CZ C -15.030 14.208 5.789 1.00 . A A . 58 ARG CZ 1 1 12 11561 1 1 58 ARG H H -11.910 10.087 7.249 1.00 . A A . 58 ARG H 1 1 12 11562 1 1 58 ARG HA H -11.730 10.564 10.141 1.00 . A A . 58 ARG HA 1 1 12 11563 1 1 58 ARG HB2 H -12.690 12.774 9.669 1.00 . A A . 58 ARG HB2 1 1 12 11564 1 1 58 ARG HB3 H -11.220 12.499 8.749 1.00 . A A . 58 ARG HB3 1 1 12 11565 1 1 58 ARG HD2 H -14.900 12.320 8.503 1.00 . A A . 58 ARG HD2 1 1 12 11566 1 1 58 ARG HD3 H -14.340 13.987 8.366 1.00 . A A . 58 ARG HD3 1 1 12 11567 1 1 58 ARG HE H -15.850 12.507 6.433 1.00 . A A . 58 ARG HE 1 1 12 11568 1 1 58 ARG HG2 H -12.450 13.310 7.056 1.00 . A A . 58 ARG HG2 1 1 12 11569 1 1 58 ARG HG3 H -13.040 11.652 6.966 1.00 . A A . 58 ARG HG3 1 1 12 11570 1 1 58 ARG HH11 H -13.560 15.112 6.855 1.00 . A A . 58 ARG HH11 1 1 12 11571 1 1 58 ARG HH12 H -14.020 15.917 5.392 1.00 . A A . 58 ARG HH12 1 1 12 11572 1 1 58 ARG HH21 H -16.450 13.562 4.508 1.00 . A A . 58 ARG HH21 1 1 12 11573 1 1 58 ARG HH22 H -15.660 15.038 4.059 1.00 . A A . 58 ARG HH22 1 1 12 11574 1 1 58 ARG N N -11.680 9.915 8.185 1.00 . A A . 58 ARG N 1 1 12 11575 1 1 58 ARG NE N -15.180 13.192 6.637 1.00 . A A . 58 ARG NE 1 1 12 11576 1 1 58 ARG NH1 N -14.130 15.156 6.032 1.00 . A A . 58 ARG NH1 1 1 12 11577 1 1 58 ARG NH2 N -15.770 14.275 4.696 1.00 . A A . 58 ARG NH2 1 1 12 11578 1 1 58 ARG O O -14.210 10.255 10.611 1.00 . A A . 58 ARG O 1 1 12 11579 1 1 59 GLN C C -15.980 8.054 8.098 1.00 . A A . 59 GLN C 1 1 12 11580 1 1 59 GLN CA C -15.830 9.521 8.491 1.00 . A A . 59 GLN CA 1 1 12 11581 1 1 59 GLN CB C -16.720 10.390 7.599 1.00 . A A . 59 GLN CB 1 1 12 11582 1 1 59 GLN CD C -18.830 10.390 8.980 1.00 . A A . 59 GLN CD 1 1 12 11583 1 1 59 GLN CG C -18.190 10.018 7.657 1.00 . A A . 59 GLN CG 1 1 12 11584 1 1 59 GLN H H -14.010 9.995 7.514 1.00 . A A . 59 GLN H 1 1 12 11585 1 1 59 GLN HA H -16.140 9.639 9.518 1.00 . A A . 59 GLN HA 1 1 12 11586 1 1 59 GLN HB2 H -16.620 11.421 7.905 1.00 . A A . 59 GLN HB2 1 1 12 11587 1 1 59 GLN HB3 H -16.380 10.293 6.575 1.00 . A A . 59 GLN HB3 1 1 12 11588 1 1 59 GLN HE21 H -20.030 11.689 8.061 1.00 . A A . 59 GLN HE21 1 1 12 11589 1 1 59 GLN HE22 H -20.220 11.567 9.774 1.00 . A A . 59 GLN HE22 1 1 12 11590 1 1 59 GLN HG2 H -18.710 10.534 6.864 1.00 . A A . 59 GLN HG2 1 1 12 11591 1 1 59 GLN HG3 H -18.290 8.951 7.515 1.00 . A A . 59 GLN HG3 1 1 12 11592 1 1 59 GLN N N -14.440 9.952 8.395 1.00 . A A . 59 GLN N 1 1 12 11593 1 1 59 GLN NE2 N -19.790 11.308 8.934 1.00 . A A . 59 GLN NE2 1 1 12 11594 1 1 59 GLN O O -16.770 7.320 8.685 1.00 . A A . 59 GLN O 1 1 12 11595 1 1 59 GLN OE1 O -18.470 9.859 10.029 1.00 . A A . 59 GLN OE1 1 1 12 11596 1 1 60 ALA C C -14.820 5.286 7.736 1.00 . A A . 60 ALA C 1 1 12 11597 1 1 60 ALA CA C -15.240 6.255 6.634 1.00 . A A . 60 ALA CA 1 1 12 11598 1 1 60 ALA CB C -14.350 6.084 5.414 1.00 . A A . 60 ALA CB 1 1 12 11599 1 1 60 ALA H H -14.590 8.265 6.676 1.00 . A A . 60 ALA H 1 1 12 11600 1 1 60 ALA HA H -16.260 6.033 6.341 1.00 . A A . 60 ALA HA 1 1 12 11601 1 1 60 ALA HB1 H -14.570 5.142 4.936 1.00 . A A . 60 ALA HB1 1 1 12 11602 1 1 60 ALA HB2 H -13.310 6.100 5.723 1.00 . A A . 60 ALA HB2 1 1 12 11603 1 1 60 ALA HB3 H -14.530 6.891 4.720 1.00 . A A . 60 ALA HB3 1 1 12 11604 1 1 60 ALA N N -15.200 7.634 7.104 1.00 . A A . 60 ALA N 1 1 12 11605 1 1 60 ALA O O -14.230 5.688 8.736 1.00 . A A . 60 ALA O 1 1 12 11606 1 1 61 ALA C C -14.140 1.785 7.851 1.00 . A A . 61 ALA C 1 1 12 11607 1 1 61 ALA CA C -14.800 2.986 8.524 1.00 . A A . 61 ALA CA 1 1 12 11608 1 1 61 ALA CB C -16.040 2.547 9.286 1.00 . A A . 61 ALA CB 1 1 12 11609 1 1 61 ALA H H -15.610 3.751 6.728 1.00 . A A . 61 ALA H 1 1 12 11610 1 1 61 ALA HA H -14.100 3.416 9.229 1.00 . A A . 61 ALA HA 1 1 12 11611 1 1 61 ALA HB1 H -16.600 1.838 8.692 1.00 . A A . 61 ALA HB1 1 1 12 11612 1 1 61 ALA HB2 H -16.660 3.409 9.491 1.00 . A A . 61 ALA HB2 1 1 12 11613 1 1 61 ALA HB3 H -15.750 2.087 10.218 1.00 . A A . 61 ALA HB3 1 1 12 11614 1 1 61 ALA N N -15.140 4.011 7.546 1.00 . A A . 61 ALA N 1 1 12 11615 1 1 61 ALA O O -14.670 1.322 6.820 1.00 . A A . 61 ALA O 1 1 12 11616 1 1 61 ALA OXT O -13.100 1.321 8.363 1.00 . A A . 61 ALA OXT 1 1 13 11617 1 1 1 MET C C -5.162 6.536 -0.868 1.00 . A A . 1 MET C 1 1 13 11618 1 1 1 MET CA C -4.402 7.355 0.172 1.00 . A A . 1 MET CA 1 1 13 11619 1 1 1 MET CB C -2.903 7.343 -0.133 1.00 . A A . 1 MET CB 1 1 13 11620 1 1 1 MET CE C -0.996 6.313 2.145 1.00 . A A . 1 MET CE 1 1 13 11621 1 1 1 MET CG C -2.316 5.945 -0.264 1.00 . A A . 1 MET CG 1 1 13 11622 1 1 1 MET H1 H -4.390 5.798 1.517 1.00 . A A . 1 MET H1 1 1 13 11623 1 1 1 MET H2 H -5.607 6.975 1.795 1.00 . A A . 1 MET H2 1 1 13 11624 1 1 1 MET H3 H -3.973 7.320 2.184 1.00 . A A . 1 MET H3 1 1 13 11625 1 1 1 MET HA H -4.761 8.373 0.148 1.00 . A A . 1 MET HA 1 1 13 11626 1 1 1 MET HB2 H -2.732 7.869 -1.060 1.00 . A A . 1 MET HB2 1 1 13 11627 1 1 1 MET HB3 H -2.382 7.856 0.662 1.00 . A A . 1 MET HB3 1 1 13 11628 1 1 1 MET HE1 H -2.028 6.621 2.236 1.00 . A A . 1 MET HE1 1 1 13 11629 1 1 1 MET HE2 H -0.350 7.139 2.408 1.00 . A A . 1 MET HE2 1 1 13 11630 1 1 1 MET HE3 H -0.808 5.483 2.811 1.00 . A A . 1 MET HE3 1 1 13 11631 1 1 1 MET HG2 H -2.969 5.247 0.238 1.00 . A A . 1 MET HG2 1 1 13 11632 1 1 1 MET HG3 H -2.256 5.691 -1.312 1.00 . A A . 1 MET HG3 1 1 13 11633 1 1 1 MET N N -4.611 6.813 1.541 1.00 . A A . 1 MET N 1 1 13 11634 1 1 1 MET O O -5.985 5.687 -0.525 1.00 . A A . 1 MET O 1 1 13 11635 1 1 1 MET SD S -0.668 5.813 0.458 1.00 . A A . 1 MET SD 1 1 13 11636 1 1 2 TYR C C -4.838 4.755 -3.506 1.00 . A A . 2 TYR C 1 1 13 11637 1 1 2 TYR CA C -5.532 6.085 -3.230 1.00 . A A . 2 TYR CA 1 1 13 11638 1 1 2 TYR CB C -5.539 6.943 -4.497 1.00 . A A . 2 TYR CB 1 1 13 11639 1 1 2 TYR CD1 C -7.698 8.070 -3.830 1.00 . A A . 2 TYR CD1 1 1 13 11640 1 1 2 TYR CD2 C -6.018 9.393 -4.883 1.00 . A A . 2 TYR CD2 1 1 13 11641 1 1 2 TYR CE1 C -8.520 9.178 -3.741 1.00 . A A . 2 TYR CE1 1 1 13 11642 1 1 2 TYR CE2 C -6.835 10.505 -4.798 1.00 . A A . 2 TYR CE2 1 1 13 11643 1 1 2 TYR CG C -6.436 8.159 -4.401 1.00 . A A . 2 TYR CG 1 1 13 11644 1 1 2 TYR CZ C -8.083 10.393 -4.226 1.00 . A A . 2 TYR CZ 1 1 13 11645 1 1 2 TYR H H -4.212 7.485 -2.350 1.00 . A A . 2 TYR H 1 1 13 11646 1 1 2 TYR HA H -6.552 5.890 -2.934 1.00 . A A . 2 TYR HA 1 1 13 11647 1 1 2 TYR HB2 H -4.535 7.288 -4.696 1.00 . A A . 2 TYR HB2 1 1 13 11648 1 1 2 TYR HB3 H -5.880 6.343 -5.327 1.00 . A A . 2 TYR HB3 1 1 13 11649 1 1 2 TYR HD1 H -8.037 7.118 -3.449 1.00 . A A . 2 TYR HD1 1 1 13 11650 1 1 2 TYR HD2 H -5.038 9.478 -5.331 1.00 . A A . 2 TYR HD2 1 1 13 11651 1 1 2 TYR HE1 H -9.499 9.089 -3.292 1.00 . A A . 2 TYR HE1 1 1 13 11652 1 1 2 TYR HE2 H -6.492 11.455 -5.178 1.00 . A A . 2 TYR HE2 1 1 13 11653 1 1 2 TYR HH H -9.157 11.635 -3.225 1.00 . A A . 2 TYR HH 1 1 13 11654 1 1 2 TYR N N -4.877 6.798 -2.140 1.00 . A A . 2 TYR N 1 1 13 11655 1 1 2 TYR O O -3.610 4.679 -3.539 1.00 . A A . 2 TYR O 1 1 13 11656 1 1 2 TYR OH O -8.899 11.497 -4.140 1.00 . A A . 2 TYR OH 1 1 13 11657 1 1 3 LYS C C -4.204 2.393 -5.216 1.00 . A A . 3 LYS C 1 1 13 11658 1 1 3 LYS CA C -5.100 2.381 -3.981 1.00 . A A . 3 LYS CA 1 1 13 11659 1 1 3 LYS CB C -6.242 1.383 -4.178 1.00 . A A . 3 LYS CB 1 1 13 11660 1 1 3 LYS CD C -6.629 -0.819 -5.330 1.00 . A A . 3 LYS CD 1 1 13 11661 1 1 3 LYS CE C -6.567 -2.320 -5.090 1.00 . A A . 3 LYS CE 1 1 13 11662 1 1 3 LYS CG C -5.776 -0.056 -4.328 1.00 . A A . 3 LYS CG 1 1 13 11663 1 1 3 LYS H H -6.606 3.836 -3.668 1.00 . A A . 3 LYS H 1 1 13 11664 1 1 3 LYS HA H -4.513 2.078 -3.127 1.00 . A A . 3 LYS HA 1 1 13 11665 1 1 3 LYS HB2 H -6.903 1.436 -3.326 1.00 . A A . 3 LYS HB2 1 1 13 11666 1 1 3 LYS HB3 H -6.793 1.655 -5.066 1.00 . A A . 3 LYS HB3 1 1 13 11667 1 1 3 LYS HD2 H -7.654 -0.491 -5.236 1.00 . A A . 3 LYS HD2 1 1 13 11668 1 1 3 LYS HD3 H -6.271 -0.607 -6.326 1.00 . A A . 3 LYS HD3 1 1 13 11669 1 1 3 LYS HE2 H -6.232 -2.802 -5.995 1.00 . A A . 3 LYS HE2 1 1 13 11670 1 1 3 LYS HE3 H -5.862 -2.516 -4.295 1.00 . A A . 3 LYS HE3 1 1 13 11671 1 1 3 LYS HG2 H -4.751 -0.058 -4.669 1.00 . A A . 3 LYS HG2 1 1 13 11672 1 1 3 LYS HG3 H -5.839 -0.547 -3.368 1.00 . A A . 3 LYS HG3 1 1 13 11673 1 1 3 LYS HZ1 H -7.777 -3.618 -3.987 1.00 . A A . 3 LYS HZ1 1 1 13 11674 1 1 3 LYS HZ2 H -8.362 -3.289 -5.541 1.00 . A A . 3 LYS HZ2 1 1 13 11675 1 1 3 LYS HZ3 H -8.501 -2.124 -4.323 1.00 . A A . 3 LYS HZ3 1 1 13 11676 1 1 3 LYS N N -5.635 3.710 -3.707 1.00 . A A . 3 LYS N 1 1 13 11677 1 1 3 LYS NZ N -7.895 -2.877 -4.708 1.00 . A A . 3 LYS NZ 1 1 13 11678 1 1 3 LYS O O -3.282 1.587 -5.334 1.00 . A A . 3 LYS O 1 1 13 11679 1 1 4 LYS C C -2.238 3.737 -7.052 1.00 . A A . 4 LYS C 1 1 13 11680 1 1 4 LYS CA C -3.701 3.432 -7.360 1.00 . A A . 4 LYS CA 1 1 13 11681 1 1 4 LYS CB C -4.283 4.525 -8.258 1.00 . A A . 4 LYS CB 1 1 13 11682 1 1 4 LYS CD C -4.201 3.459 -10.535 1.00 . A A . 4 LYS CD 1 1 13 11683 1 1 4 LYS CE C -4.669 3.999 -11.878 1.00 . A A . 4 LYS CE 1 1 13 11684 1 1 4 LYS CG C -3.662 4.568 -9.644 1.00 . A A . 4 LYS CG 1 1 13 11685 1 1 4 LYS H H -5.230 3.929 -5.984 1.00 . A A . 4 LYS H 1 1 13 11686 1 1 4 LYS HA H -3.756 2.486 -7.879 1.00 . A A . 4 LYS HA 1 1 13 11687 1 1 4 LYS HB2 H -5.344 4.356 -8.367 1.00 . A A . 4 LYS HB2 1 1 13 11688 1 1 4 LYS HB3 H -4.127 5.483 -7.785 1.00 . A A . 4 LYS HB3 1 1 13 11689 1 1 4 LYS HD2 H -3.420 2.734 -10.703 1.00 . A A . 4 LYS HD2 1 1 13 11690 1 1 4 LYS HD3 H -5.035 2.985 -10.039 1.00 . A A . 4 LYS HD3 1 1 13 11691 1 1 4 LYS HE2 H -3.977 4.760 -12.206 1.00 . A A . 4 LYS HE2 1 1 13 11692 1 1 4 LYS HE3 H -4.676 3.189 -12.594 1.00 . A A . 4 LYS HE3 1 1 13 11693 1 1 4 LYS HG2 H -3.887 5.522 -10.098 1.00 . A A . 4 LYS HG2 1 1 13 11694 1 1 4 LYS HG3 H -2.592 4.456 -9.552 1.00 . A A . 4 LYS HG3 1 1 13 11695 1 1 4 LYS HZ1 H -6.553 4.176 -10.994 1.00 . A A . 4 LYS HZ1 1 1 13 11696 1 1 4 LYS HZ2 H -6.559 4.394 -12.671 1.00 . A A . 4 LYS HZ2 1 1 13 11697 1 1 4 LYS HZ3 H -5.970 5.617 -11.662 1.00 . A A . 4 LYS HZ3 1 1 13 11698 1 1 4 LYS N N -4.481 3.314 -6.134 1.00 . A A . 4 LYS N 1 1 13 11699 1 1 4 LYS NZ N -6.033 4.588 -11.796 1.00 . A A . 4 LYS NZ 1 1 13 11700 1 1 4 LYS O O -1.335 3.080 -7.568 1.00 . A A . 4 LYS O 1 1 13 11701 1 1 5 ASP C C 0.091 3.972 -5.189 1.00 . A A . 5 ASP C 1 1 13 11702 1 1 5 ASP CA C -0.659 5.135 -5.834 1.00 . A A . 5 ASP CA 1 1 13 11703 1 1 5 ASP CB C -0.698 6.328 -4.877 1.00 . A A . 5 ASP CB 1 1 13 11704 1 1 5 ASP CG C 0.303 7.402 -5.250 1.00 . A A . 5 ASP CG 1 1 13 11705 1 1 5 ASP H H -2.775 5.227 -5.830 1.00 . A A . 5 ASP H 1 1 13 11706 1 1 5 ASP HA H -0.139 5.424 -6.733 1.00 . A A . 5 ASP HA 1 1 13 11707 1 1 5 ASP HB2 H -1.687 6.762 -4.894 1.00 . A A . 5 ASP HB2 1 1 13 11708 1 1 5 ASP HB3 H -0.478 5.987 -3.874 1.00 . A A . 5 ASP HB3 1 1 13 11709 1 1 5 ASP N N -2.012 4.741 -6.208 1.00 . A A . 5 ASP N 1 1 13 11710 1 1 5 ASP O O 1.236 3.689 -5.537 1.00 . A A . 5 ASP O 1 1 13 11711 1 1 5 ASP OD1 O 0.369 7.764 -6.444 1.00 . A A . 5 ASP OD1 1 1 13 11712 1 1 5 ASP OD2 O 1.022 7.883 -4.349 1.00 . A A . 5 ASP OD2 1 1 13 11713 1 1 6 VAL C C 0.501 1.106 -4.535 1.00 . A A . 6 VAL C 1 1 13 11714 1 1 6 VAL CA C 0.029 2.174 -3.553 1.00 . A A . 6 VAL CA 1 1 13 11715 1 1 6 VAL CB C -0.970 1.544 -2.566 1.00 . A A . 6 VAL CB 1 1 13 11716 1 1 6 VAL CG1 C -0.234 0.691 -1.559 1.00 . A A . 6 VAL CG1 1 1 13 11717 1 1 6 VAL CG2 C -1.791 2.613 -1.857 1.00 . A A . 6 VAL CG2 1 1 13 11718 1 1 6 VAL H H -1.473 3.569 -4.008 1.00 . A A . 6 VAL H 1 1 13 11719 1 1 6 VAL HA H 0.879 2.535 -2.992 1.00 . A A . 6 VAL HA 1 1 13 11720 1 1 6 VAL HB H -1.645 0.909 -3.121 1.00 . A A . 6 VAL HB 1 1 13 11721 1 1 6 VAL HG11 H 0.494 1.299 -1.047 1.00 . A A . 6 VAL HG11 1 1 13 11722 1 1 6 VAL HG12 H 0.263 -0.117 -2.071 1.00 . A A . 6 VAL HG12 1 1 13 11723 1 1 6 VAL HG13 H -0.937 0.291 -0.846 1.00 . A A . 6 VAL HG13 1 1 13 11724 1 1 6 VAL HG21 H -2.175 2.216 -0.928 1.00 . A A . 6 VAL HG21 1 1 13 11725 1 1 6 VAL HG22 H -2.615 2.913 -2.488 1.00 . A A . 6 VAL HG22 1 1 13 11726 1 1 6 VAL HG23 H -1.167 3.470 -1.651 1.00 . A A . 6 VAL HG23 1 1 13 11727 1 1 6 VAL N N -0.565 3.301 -4.246 1.00 . A A . 6 VAL N 1 1 13 11728 1 1 6 VAL O O 1.666 0.709 -4.526 1.00 . A A . 6 VAL O 1 1 13 11729 1 1 7 ILE C C 1.018 0.099 -7.308 1.00 . A A . 7 ILE C 1 1 13 11730 1 1 7 ILE CA C -0.095 -0.372 -6.376 1.00 . A A . 7 ILE CA 1 1 13 11731 1 1 7 ILE CB C -1.340 -0.745 -7.210 1.00 . A A . 7 ILE CB 1 1 13 11732 1 1 7 ILE CD1 C -3.664 -1.774 -7.059 1.00 . A A . 7 ILE CD1 1 1 13 11733 1 1 7 ILE CG1 C -2.409 -1.374 -6.315 1.00 . A A . 7 ILE CG1 1 1 13 11734 1 1 7 ILE CG2 C -0.964 -1.693 -8.341 1.00 . A A . 7 ILE CG2 1 1 13 11735 1 1 7 ILE H H -1.325 1.004 -5.342 1.00 . A A . 7 ILE H 1 1 13 11736 1 1 7 ILE HA H 0.237 -1.256 -5.850 1.00 . A A . 7 ILE HA 1 1 13 11737 1 1 7 ILE HB H -1.734 0.159 -7.648 1.00 . A A . 7 ILE HB 1 1 13 11738 1 1 7 ILE HD11 H -3.417 -2.506 -7.815 1.00 . A A . 7 ILE HD11 1 1 13 11739 1 1 7 ILE HD12 H -4.097 -0.904 -7.530 1.00 . A A . 7 ILE HD12 1 1 13 11740 1 1 7 ILE HD13 H -4.375 -2.200 -6.366 1.00 . A A . 7 ILE HD13 1 1 13 11741 1 1 7 ILE HG12 H -2.005 -2.260 -5.849 1.00 . A A . 7 ILE HG12 1 1 13 11742 1 1 7 ILE HG13 H -2.689 -0.666 -5.549 1.00 . A A . 7 ILE HG13 1 1 13 11743 1 1 7 ILE HG21 H -0.264 -1.203 -9.002 1.00 . A A . 7 ILE HG21 1 1 13 11744 1 1 7 ILE HG22 H -1.853 -1.964 -8.894 1.00 . A A . 7 ILE HG22 1 1 13 11745 1 1 7 ILE HG23 H -0.512 -2.583 -7.930 1.00 . A A . 7 ILE HG23 1 1 13 11746 1 1 7 ILE N N -0.414 0.648 -5.383 1.00 . A A . 7 ILE N 1 1 13 11747 1 1 7 ILE O O 1.817 -0.702 -7.791 1.00 . A A . 7 ILE O 1 1 13 11748 1 1 8 ASP C C 3.414 2.078 -7.697 1.00 . A A . 8 ASP C 1 1 13 11749 1 1 8 ASP CA C 2.079 1.982 -8.425 1.00 . A A . 8 ASP CA 1 1 13 11750 1 1 8 ASP CB C 1.638 3.367 -8.905 1.00 . A A . 8 ASP CB 1 1 13 11751 1 1 8 ASP CG C 1.331 3.393 -10.389 1.00 . A A . 8 ASP CG 1 1 13 11752 1 1 8 ASP H H 0.403 1.990 -7.138 1.00 . A A . 8 ASP H 1 1 13 11753 1 1 8 ASP HA H 2.193 1.332 -9.279 1.00 . A A . 8 ASP HA 1 1 13 11754 1 1 8 ASP HB2 H 0.749 3.660 -8.367 1.00 . A A . 8 ASP HB2 1 1 13 11755 1 1 8 ASP HB3 H 2.425 4.080 -8.704 1.00 . A A . 8 ASP HB3 1 1 13 11756 1 1 8 ASP N N 1.063 1.402 -7.554 1.00 . A A . 8 ASP N 1 1 13 11757 1 1 8 ASP O O 4.474 2.100 -8.322 1.00 . A A . 8 ASP O 1 1 13 11758 1 1 8 ASP OD1 O 2.275 3.235 -11.192 1.00 . A A . 8 ASP OD1 1 1 13 11759 1 1 8 ASP OD2 O 0.149 3.573 -10.748 1.00 . A A . 8 ASP OD2 1 1 13 11760 1 1 9 HIS C C 5.143 0.834 -5.312 1.00 . A A . 9 HIS C 1 1 13 11761 1 1 9 HIS CA C 4.558 2.221 -5.558 1.00 . A A . 9 HIS CA 1 1 13 11762 1 1 9 HIS CB C 4.249 2.909 -4.224 1.00 . A A . 9 HIS CB 1 1 13 11763 1 1 9 HIS CD2 C 5.886 1.995 -2.433 1.00 . A A . 9 HIS CD2 1 1 13 11764 1 1 9 HIS CE1 C 7.150 3.773 -2.216 1.00 . A A . 9 HIS CE1 1 1 13 11765 1 1 9 HIS CG C 5.407 2.940 -3.276 1.00 . A A . 9 HIS CG 1 1 13 11766 1 1 9 HIS H H 2.483 2.108 -5.927 1.00 . A A . 9 HIS H 1 1 13 11767 1 1 9 HIS HA H 5.277 2.813 -6.102 1.00 . A A . 9 HIS HA 1 1 13 11768 1 1 9 HIS HB2 H 3.950 3.929 -4.416 1.00 . A A . 9 HIS HB2 1 1 13 11769 1 1 9 HIS HB3 H 3.435 2.388 -3.741 1.00 . A A . 9 HIS HB3 1 1 13 11770 1 1 9 HIS HD1 H 6.130 4.895 -3.591 1.00 . A A . 9 HIS HD1 1 1 13 11771 1 1 9 HIS HD2 H 5.490 0.999 -2.293 1.00 . A A . 9 HIS HD2 1 1 13 11772 1 1 9 HIS HE1 H 7.923 4.450 -1.885 1.00 . A A . 9 HIS HE1 1 1 13 11773 1 1 9 HIS HE2 H 7.467 2.116 -1.056 1.00 . A A . 9 HIS HE2 1 1 13 11774 1 1 9 HIS N N 3.355 2.132 -6.370 1.00 . A A . 9 HIS N 1 1 13 11775 1 1 9 HIS ND1 N 6.220 4.042 -3.116 1.00 . A A . 9 HIS ND1 1 1 13 11776 1 1 9 HIS NE2 N 6.969 2.539 -1.785 1.00 . A A . 9 HIS NE2 1 1 13 11777 1 1 9 HIS O O 6.356 0.672 -5.193 1.00 . A A . 9 HIS O 1 1 13 11778 1 1 10 PHE C C 4.894 -2.278 -6.319 1.00 . A A . 10 PHE C 1 1 13 11779 1 1 10 PHE CA C 4.686 -1.538 -5.002 1.00 . A A . 10 PHE CA 1 1 13 11780 1 1 10 PHE CB C 3.644 -2.263 -4.154 1.00 . A A . 10 PHE CB 1 1 13 11781 1 1 10 PHE CD1 C 4.638 -2.734 -1.907 1.00 . A A . 10 PHE CD1 1 1 13 11782 1 1 10 PHE CD2 C 3.057 -0.963 -2.095 1.00 . A A . 10 PHE CD2 1 1 13 11783 1 1 10 PHE CE1 C 4.771 -2.477 -0.555 1.00 . A A . 10 PHE CE1 1 1 13 11784 1 1 10 PHE CE2 C 3.184 -0.698 -0.745 1.00 . A A . 10 PHE CE2 1 1 13 11785 1 1 10 PHE CG C 3.780 -1.982 -2.688 1.00 . A A . 10 PHE CG 1 1 13 11786 1 1 10 PHE CZ C 4.043 -1.458 0.027 1.00 . A A . 10 PHE CZ 1 1 13 11787 1 1 10 PHE H H 3.312 0.034 -5.336 1.00 . A A . 10 PHE H 1 1 13 11788 1 1 10 PHE HA H 5.619 -1.514 -4.460 1.00 . A A . 10 PHE HA 1 1 13 11789 1 1 10 PHE HB2 H 2.657 -1.955 -4.463 1.00 . A A . 10 PHE HB2 1 1 13 11790 1 1 10 PHE HB3 H 3.747 -3.329 -4.301 1.00 . A A . 10 PHE HB3 1 1 13 11791 1 1 10 PHE HD1 H 5.207 -3.529 -2.364 1.00 . A A . 10 PHE HD1 1 1 13 11792 1 1 10 PHE HD2 H 2.385 -0.369 -2.699 1.00 . A A . 10 PHE HD2 1 1 13 11793 1 1 10 PHE HE1 H 5.442 -3.072 0.044 1.00 . A A . 10 PHE HE1 1 1 13 11794 1 1 10 PHE HE2 H 2.614 0.100 -0.295 1.00 . A A . 10 PHE HE2 1 1 13 11795 1 1 10 PHE HZ H 4.144 -1.255 1.083 1.00 . A A . 10 PHE HZ 1 1 13 11796 1 1 10 PHE N N 4.266 -0.161 -5.236 1.00 . A A . 10 PHE N 1 1 13 11797 1 1 10 PHE O O 5.788 -3.117 -6.436 1.00 . A A . 10 PHE O 1 1 13 11798 1 1 11 GLY C C 3.282 -3.841 -8.702 1.00 . A A . 11 GLY C 1 1 13 11799 1 1 11 GLY CA C 4.169 -2.616 -8.599 1.00 . A A . 11 GLY CA 1 1 13 11800 1 1 11 GLY H H 3.366 -1.293 -7.154 1.00 . A A . 11 GLY H 1 1 13 11801 1 1 11 GLY HA2 H 3.886 -1.912 -9.368 1.00 . A A . 11 GLY HA2 1 1 13 11802 1 1 11 GLY HA3 H 5.195 -2.913 -8.757 1.00 . A A . 11 GLY HA3 1 1 13 11803 1 1 11 GLY N N 4.061 -1.968 -7.305 1.00 . A A . 11 GLY N 1 1 13 11804 1 1 11 GLY O O 2.576 -4.023 -9.695 1.00 . A A . 11 GLY O 1 1 13 11805 1 1 12 THR C C 1.741 -6.002 -6.335 1.00 . A A . 12 THR C 1 1 13 11806 1 1 12 THR CA C 2.510 -5.894 -7.647 1.00 . A A . 12 THR CA 1 1 13 11807 1 1 12 THR CB C 3.396 -7.126 -7.836 1.00 . A A . 12 THR CB 1 1 13 11808 1 1 12 THR CG2 C 4.066 -7.179 -9.191 1.00 . A A . 12 THR CG2 1 1 13 11809 1 1 12 THR H H 3.900 -4.479 -6.912 1.00 . A A . 12 THR H 1 1 13 11810 1 1 12 THR HA H 1.803 -5.841 -8.462 1.00 . A A . 12 THR HA 1 1 13 11811 1 1 12 THR HB H 2.788 -8.015 -7.733 1.00 . A A . 12 THR HB 1 1 13 11812 1 1 12 THR HG1 H 4.850 -6.314 -6.805 1.00 . A A . 12 THR HG1 1 1 13 11813 1 1 12 THR HG21 H 3.418 -7.680 -9.895 1.00 . A A . 12 THR HG21 1 1 13 11814 1 1 12 THR HG22 H 4.997 -7.721 -9.113 1.00 . A A . 12 THR HG22 1 1 13 11815 1 1 12 THR HG23 H 4.262 -6.175 -9.535 1.00 . A A . 12 THR HG23 1 1 13 11816 1 1 12 THR N N 3.318 -4.681 -7.673 1.00 . A A . 12 THR N 1 1 13 11817 1 1 12 THR O O 2.215 -5.558 -5.288 1.00 . A A . 12 THR O 1 1 13 11818 1 1 12 THR OG1 O 4.413 -7.169 -6.852 1.00 . A A . 12 THR OG1 1 1 13 11819 1 1 13 GLN C C 0.449 -7.549 -4.133 1.00 . A A . 13 GLN C 1 1 13 11820 1 1 13 GLN CA C -0.283 -6.756 -5.212 1.00 . A A . 13 GLN CA 1 1 13 11821 1 1 13 GLN CB C -1.592 -7.457 -5.578 1.00 . A A . 13 GLN CB 1 1 13 11822 1 1 13 GLN CD C -4.031 -6.939 -5.982 1.00 . A A . 13 GLN CD 1 1 13 11823 1 1 13 GLN CG C -2.595 -6.548 -6.270 1.00 . A A . 13 GLN CG 1 1 13 11824 1 1 13 GLN H H 0.228 -6.925 -7.259 1.00 . A A . 13 GLN H 1 1 13 11825 1 1 13 GLN HA H -0.508 -5.772 -4.827 1.00 . A A . 13 GLN HA 1 1 13 11826 1 1 13 GLN HB2 H -1.373 -8.282 -6.238 1.00 . A A . 13 GLN HB2 1 1 13 11827 1 1 13 GLN HB3 H -2.047 -7.837 -4.677 1.00 . A A . 13 GLN HB3 1 1 13 11828 1 1 13 GLN HE21 H -3.574 -8.864 -6.184 1.00 . A A . 13 GLN HE21 1 1 13 11829 1 1 13 GLN HE22 H -5.225 -8.520 -5.811 1.00 . A A . 13 GLN HE22 1 1 13 11830 1 1 13 GLN HG2 H -2.439 -5.535 -5.929 1.00 . A A . 13 GLN HG2 1 1 13 11831 1 1 13 GLN HG3 H -2.431 -6.597 -7.337 1.00 . A A . 13 GLN HG3 1 1 13 11832 1 1 13 GLN N N 0.553 -6.592 -6.397 1.00 . A A . 13 GLN N 1 1 13 11833 1 1 13 GLN NE2 N -4.304 -8.238 -5.993 1.00 . A A . 13 GLN NE2 1 1 13 11834 1 1 13 GLN O O 0.592 -7.089 -3.001 1.00 . A A . 13 GLN O 1 1 13 11835 1 1 13 GLN OE1 O -4.885 -6.083 -5.752 1.00 . A A . 13 GLN OE1 1 1 13 11836 1 1 14 ARG C C 2.677 -8.831 -2.776 1.00 . A A . 14 ARG C 1 1 13 11837 1 1 14 ARG CA C 1.628 -9.612 -3.565 1.00 . A A . 14 ARG CA 1 1 13 11838 1 1 14 ARG CB C 2.299 -10.759 -4.323 1.00 . A A . 14 ARG CB 1 1 13 11839 1 1 14 ARG CD C 1.303 -12.921 -3.519 1.00 . A A . 14 ARG CD 1 1 13 11840 1 1 14 ARG CG C 2.513 -12.004 -3.476 1.00 . A A . 14 ARG CG 1 1 13 11841 1 1 14 ARG CZ C 0.799 -15.263 -2.939 1.00 . A A . 14 ARG CZ 1 1 13 11842 1 1 14 ARG H H 0.762 -9.051 -5.415 1.00 . A A . 14 ARG H 1 1 13 11843 1 1 14 ARG HA H 0.908 -10.023 -2.874 1.00 . A A . 14 ARG HA 1 1 13 11844 1 1 14 ARG HB2 H 1.681 -11.027 -5.167 1.00 . A A . 14 ARG HB2 1 1 13 11845 1 1 14 ARG HB3 H 3.260 -10.424 -4.683 1.00 . A A . 14 ARG HB3 1 1 13 11846 1 1 14 ARG HD2 H 0.460 -12.405 -3.085 1.00 . A A . 14 ARG HD2 1 1 13 11847 1 1 14 ARG HD3 H 1.085 -13.162 -4.549 1.00 . A A . 14 ARG HD3 1 1 13 11848 1 1 14 ARG HE H 2.266 -14.175 -2.133 1.00 . A A . 14 ARG HE 1 1 13 11849 1 1 14 ARG HG2 H 3.371 -12.540 -3.853 1.00 . A A . 14 ARG HG2 1 1 13 11850 1 1 14 ARG HG3 H 2.692 -11.705 -2.454 1.00 . A A . 14 ARG HG3 1 1 13 11851 1 1 14 ARG HH11 H -0.415 -14.468 -4.348 1.00 . A A . 14 ARG HH11 1 1 13 11852 1 1 14 ARG HH12 H -0.749 -16.113 -3.922 1.00 . A A . 14 ARG HH12 1 1 13 11853 1 1 14 ARG HH21 H 1.829 -16.339 -1.572 1.00 . A A . 14 ARG HH21 1 1 13 11854 1 1 14 ARG HH22 H 0.524 -17.175 -2.346 1.00 . A A . 14 ARG HH22 1 1 13 11855 1 1 14 ARG N N 0.910 -8.744 -4.497 1.00 . A A . 14 ARG N 1 1 13 11856 1 1 14 ARG NE N 1.530 -14.162 -2.781 1.00 . A A . 14 ARG NE 1 1 13 11857 1 1 14 ARG NH1 N -0.204 -15.283 -3.808 1.00 . A A . 14 ARG NH1 1 1 13 11858 1 1 14 ARG NH2 N 1.074 -16.347 -2.227 1.00 . A A . 14 ARG NH2 1 1 13 11859 1 1 14 ARG O O 2.953 -9.142 -1.616 1.00 . A A . 14 ARG O 1 1 13 11860 1 1 15 ALA C C 3.688 -6.274 -1.547 1.00 . A A . 15 ALA C 1 1 13 11861 1 1 15 ALA CA C 4.267 -6.991 -2.762 1.00 . A A . 15 ALA CA 1 1 13 11862 1 1 15 ALA CB C 4.840 -5.986 -3.749 1.00 . A A . 15 ALA CB 1 1 13 11863 1 1 15 ALA H H 2.991 -7.613 -4.331 1.00 . A A . 15 ALA H 1 1 13 11864 1 1 15 ALA HA H 5.067 -7.640 -2.438 1.00 . A A . 15 ALA HA 1 1 13 11865 1 1 15 ALA HB1 H 5.650 -5.445 -3.283 1.00 . A A . 15 ALA HB1 1 1 13 11866 1 1 15 ALA HB2 H 4.067 -5.292 -4.046 1.00 . A A . 15 ALA HB2 1 1 13 11867 1 1 15 ALA HB3 H 5.210 -6.508 -4.621 1.00 . A A . 15 ALA HB3 1 1 13 11868 1 1 15 ALA N N 3.254 -7.815 -3.409 1.00 . A A . 15 ALA N 1 1 13 11869 1 1 15 ALA O O 4.214 -6.382 -0.439 1.00 . A A . 15 ALA O 1 1 13 11870 1 1 16 VAL C C 1.530 -5.739 0.439 1.00 . A A . 16 VAL C 1 1 13 11871 1 1 16 VAL CA C 1.944 -4.806 -0.694 1.00 . A A . 16 VAL CA 1 1 13 11872 1 1 16 VAL CB C 0.695 -4.050 -1.197 1.00 . A A . 16 VAL CB 1 1 13 11873 1 1 16 VAL CG1 C 0.483 -2.799 -0.371 1.00 . A A . 16 VAL CG1 1 1 13 11874 1 1 16 VAL CG2 C 0.813 -3.693 -2.674 1.00 . A A . 16 VAL CG2 1 1 13 11875 1 1 16 VAL H H 2.229 -5.493 -2.666 1.00 . A A . 16 VAL H 1 1 13 11876 1 1 16 VAL HA H 2.647 -4.081 -0.309 1.00 . A A . 16 VAL HA 1 1 13 11877 1 1 16 VAL HB H -0.165 -4.690 -1.069 1.00 . A A . 16 VAL HB 1 1 13 11878 1 1 16 VAL HG11 H -0.114 -2.096 -0.930 1.00 . A A . 16 VAL HG11 1 1 13 11879 1 1 16 VAL HG12 H 1.441 -2.360 -0.144 1.00 . A A . 16 VAL HG12 1 1 13 11880 1 1 16 VAL HG13 H -0.024 -3.056 0.546 1.00 . A A . 16 VAL HG13 1 1 13 11881 1 1 16 VAL HG21 H 1.852 -3.542 -2.925 1.00 . A A . 16 VAL HG21 1 1 13 11882 1 1 16 VAL HG22 H 0.259 -2.787 -2.870 1.00 . A A . 16 VAL HG22 1 1 13 11883 1 1 16 VAL HG23 H 0.412 -4.498 -3.270 1.00 . A A . 16 VAL HG23 1 1 13 11884 1 1 16 VAL N N 2.600 -5.541 -1.765 1.00 . A A . 16 VAL N 1 1 13 11885 1 1 16 VAL O O 1.652 -5.398 1.615 1.00 . A A . 16 VAL O 1 1 13 11886 1 1 17 ALA C C 1.788 -8.460 1.842 1.00 . A A . 17 ALA C 1 1 13 11887 1 1 17 ALA CA C 0.604 -7.903 1.060 1.00 . A A . 17 ALA CA 1 1 13 11888 1 1 17 ALA CB C -0.157 -9.031 0.377 1.00 . A A . 17 ALA CB 1 1 13 11889 1 1 17 ALA H H 0.965 -7.134 -0.879 1.00 . A A . 17 ALA H 1 1 13 11890 1 1 17 ALA HA H -0.069 -7.411 1.747 1.00 . A A . 17 ALA HA 1 1 13 11891 1 1 17 ALA HB1 H -0.481 -8.705 -0.600 1.00 . A A . 17 ALA HB1 1 1 13 11892 1 1 17 ALA HB2 H -1.017 -9.296 0.972 1.00 . A A . 17 ALA HB2 1 1 13 11893 1 1 17 ALA HB3 H 0.489 -9.891 0.274 1.00 . A A . 17 ALA HB3 1 1 13 11894 1 1 17 ALA N N 1.039 -6.920 0.075 1.00 . A A . 17 ALA N 1 1 13 11895 1 1 17 ALA O O 1.657 -8.825 3.011 1.00 . A A . 17 ALA O 1 1 13 11896 1 1 18 LYS C C 4.791 -7.984 2.722 1.00 . A A . 18 LYS C 1 1 13 11897 1 1 18 LYS CA C 4.152 -9.040 1.826 1.00 . A A . 18 LYS CA 1 1 13 11898 1 1 18 LYS CB C 5.154 -9.499 0.767 1.00 . A A . 18 LYS CB 1 1 13 11899 1 1 18 LYS CD C 6.272 -11.626 0.029 1.00 . A A . 18 LYS CD 1 1 13 11900 1 1 18 LYS CE C 7.450 -12.543 0.318 1.00 . A A . 18 LYS CE 1 1 13 11901 1 1 18 LYS CG C 5.990 -10.694 1.196 1.00 . A A . 18 LYS CG 1 1 13 11902 1 1 18 LYS H H 2.987 -8.221 0.260 1.00 . A A . 18 LYS H 1 1 13 11903 1 1 18 LYS HA H 3.872 -9.887 2.433 1.00 . A A . 18 LYS HA 1 1 13 11904 1 1 18 LYS HB2 H 4.614 -9.768 -0.130 1.00 . A A . 18 LYS HB2 1 1 13 11905 1 1 18 LYS HB3 H 5.823 -8.681 0.542 1.00 . A A . 18 LYS HB3 1 1 13 11906 1 1 18 LYS HD2 H 5.396 -12.230 -0.156 1.00 . A A . 18 LYS HD2 1 1 13 11907 1 1 18 LYS HD3 H 6.494 -11.033 -0.847 1.00 . A A . 18 LYS HD3 1 1 13 11908 1 1 18 LYS HE2 H 8.024 -12.666 -0.587 1.00 . A A . 18 LYS HE2 1 1 13 11909 1 1 18 LYS HE3 H 8.070 -12.082 1.075 1.00 . A A . 18 LYS HE3 1 1 13 11910 1 1 18 LYS HG2 H 6.929 -10.339 1.594 1.00 . A A . 18 LYS HG2 1 1 13 11911 1 1 18 LYS HG3 H 5.456 -11.239 1.960 1.00 . A A . 18 LYS HG3 1 1 13 11912 1 1 18 LYS HZ1 H 6.506 -13.785 1.706 1.00 . A A . 18 LYS HZ1 1 1 13 11913 1 1 18 LYS HZ2 H 7.832 -14.500 0.937 1.00 . A A . 18 LYS HZ2 1 1 13 11914 1 1 18 LYS HZ3 H 6.370 -14.316 0.105 1.00 . A A . 18 LYS HZ3 1 1 13 11915 1 1 18 LYS N N 2.945 -8.525 1.191 1.00 . A A . 18 LYS N 1 1 13 11916 1 1 18 LYS NZ N 7.009 -13.880 0.800 1.00 . A A . 18 LYS NZ 1 1 13 11917 1 1 18 LYS O O 5.320 -8.298 3.789 1.00 . A A . 18 LYS O 1 1 13 11918 1 1 19 ALA C C 4.446 -5.280 4.248 1.00 . A A . 19 ALA C 1 1 13 11919 1 1 19 ALA CA C 5.314 -5.630 3.043 1.00 . A A . 19 ALA CA 1 1 13 11920 1 1 19 ALA CB C 5.495 -4.411 2.152 1.00 . A A . 19 ALA CB 1 1 13 11921 1 1 19 ALA H H 4.304 -6.543 1.424 1.00 . A A . 19 ALA H 1 1 13 11922 1 1 19 ALA HA H 6.288 -5.939 3.392 1.00 . A A . 19 ALA HA 1 1 13 11923 1 1 19 ALA HB1 H 5.928 -4.715 1.211 1.00 . A A . 19 ALA HB1 1 1 13 11924 1 1 19 ALA HB2 H 6.152 -3.704 2.637 1.00 . A A . 19 ALA HB2 1 1 13 11925 1 1 19 ALA HB3 H 4.536 -3.948 1.975 1.00 . A A . 19 ALA HB3 1 1 13 11926 1 1 19 ALA N N 4.739 -6.730 2.282 1.00 . A A . 19 ALA N 1 1 13 11927 1 1 19 ALA O O 4.954 -5.029 5.340 1.00 . A A . 19 ALA O 1 1 13 11928 1 1 20 LEU C C 1.963 -6.158 6.011 1.00 . A A . 20 LEU C 1 1 13 11929 1 1 20 LEU CA C 2.194 -4.950 5.110 1.00 . A A . 20 LEU CA 1 1 13 11930 1 1 20 LEU CB C 0.863 -4.474 4.523 1.00 . A A . 20 LEU CB 1 1 13 11931 1 1 20 LEU CD1 C -0.469 -2.718 3.331 1.00 . A A . 20 LEU CD1 1 1 13 11932 1 1 20 LEU CD2 C 1.257 -2.048 5.013 1.00 . A A . 20 LEU CD2 1 1 13 11933 1 1 20 LEU CG C 0.881 -3.061 3.940 1.00 . A A . 20 LEU CG 1 1 13 11934 1 1 20 LEU H H 2.789 -5.477 3.148 1.00 . A A . 20 LEU H 1 1 13 11935 1 1 20 LEU HA H 2.622 -4.153 5.699 1.00 . A A . 20 LEU HA 1 1 13 11936 1 1 20 LEU HB2 H 0.575 -5.161 3.741 1.00 . A A . 20 LEU HB2 1 1 13 11937 1 1 20 LEU HB3 H 0.118 -4.509 5.303 1.00 . A A . 20 LEU HB3 1 1 13 11938 1 1 20 LEU HD11 H -0.493 -1.668 3.074 1.00 . A A . 20 LEU HD11 1 1 13 11939 1 1 20 LEU HD12 H -1.251 -2.931 4.045 1.00 . A A . 20 LEU HD12 1 1 13 11940 1 1 20 LEU HD13 H -0.623 -3.309 2.440 1.00 . A A . 20 LEU HD13 1 1 13 11941 1 1 20 LEU HD21 H 2.331 -2.009 5.110 1.00 . A A . 20 LEU HD21 1 1 13 11942 1 1 20 LEU HD22 H 0.820 -2.343 5.955 1.00 . A A . 20 LEU HD22 1 1 13 11943 1 1 20 LEU HD23 H 0.885 -1.073 4.734 1.00 . A A . 20 LEU HD23 1 1 13 11944 1 1 20 LEU HG H 1.623 -3.011 3.157 1.00 . A A . 20 LEU HG 1 1 13 11945 1 1 20 LEU N N 3.134 -5.268 4.040 1.00 . A A . 20 LEU N 1 1 13 11946 1 1 20 LEU O O 1.760 -6.015 7.216 1.00 . A A . 20 LEU O 1 1 13 11947 1 1 21 GLY C C 0.382 -9.108 6.032 1.00 . A A . 21 GLY C 1 1 13 11948 1 1 21 GLY CA C 1.788 -8.563 6.181 1.00 . A A . 21 GLY CA 1 1 13 11949 1 1 21 GLY H H 2.162 -7.397 4.453 1.00 . A A . 21 GLY H 1 1 13 11950 1 1 21 GLY HA2 H 2.492 -9.311 5.844 1.00 . A A . 21 GLY HA2 1 1 13 11951 1 1 21 GLY HA3 H 1.973 -8.356 7.225 1.00 . A A . 21 GLY HA3 1 1 13 11952 1 1 21 GLY N N 1.996 -7.346 5.417 1.00 . A A . 21 GLY N 1 1 13 11953 1 1 21 GLY O O -0.126 -9.787 6.925 1.00 . A A . 21 GLY O 1 1 13 11954 1 1 22 ILE C C -1.638 -10.214 3.430 1.00 . A A . 22 ILE C 1 1 13 11955 1 1 22 ILE CA C -1.605 -9.281 4.635 1.00 . A A . 22 ILE CA 1 1 13 11956 1 1 22 ILE CB C -2.567 -8.103 4.386 1.00 . A A . 22 ILE CB 1 1 13 11957 1 1 22 ILE CD1 C -3.012 -6.122 2.850 1.00 . A A . 22 ILE CD1 1 1 13 11958 1 1 22 ILE CG1 C -2.075 -7.254 3.212 1.00 . A A . 22 ILE CG1 1 1 13 11959 1 1 22 ILE CG2 C -2.700 -7.253 5.640 1.00 . A A . 22 ILE CG2 1 1 13 11960 1 1 22 ILE H H 0.209 -8.269 4.225 1.00 . A A . 22 ILE H 1 1 13 11961 1 1 22 ILE HA H -1.948 -9.820 5.506 1.00 . A A . 22 ILE HA 1 1 13 11962 1 1 22 ILE HB H -3.539 -8.505 4.148 1.00 . A A . 22 ILE HB 1 1 13 11963 1 1 22 ILE HD11 H -3.591 -5.844 3.718 1.00 . A A . 22 ILE HD11 1 1 13 11964 1 1 22 ILE HD12 H -3.674 -6.442 2.059 1.00 . A A . 22 ILE HD12 1 1 13 11965 1 1 22 ILE HD13 H -2.435 -5.272 2.516 1.00 . A A . 22 ILE HD13 1 1 13 11966 1 1 22 ILE HG12 H -1.117 -6.825 3.462 1.00 . A A . 22 ILE HG12 1 1 13 11967 1 1 22 ILE HG13 H -1.965 -7.885 2.341 1.00 . A A . 22 ILE HG13 1 1 13 11968 1 1 22 ILE HG21 H -3.560 -7.580 6.206 1.00 . A A . 22 ILE HG21 1 1 13 11969 1 1 22 ILE HG22 H -2.825 -6.217 5.362 1.00 . A A . 22 ILE HG22 1 1 13 11970 1 1 22 ILE HG23 H -1.812 -7.360 6.244 1.00 . A A . 22 ILE HG23 1 1 13 11971 1 1 22 ILE N N -0.248 -8.814 4.900 1.00 . A A . 22 ILE N 1 1 13 11972 1 1 22 ILE O O -0.606 -10.497 2.823 1.00 . A A . 22 ILE O 1 1 13 11973 1 1 23 SER C C -3.251 -10.806 0.670 1.00 . A A . 23 SER C 1 1 13 11974 1 1 23 SER CA C -3.000 -11.589 1.954 1.00 . A A . 23 SER CA 1 1 13 11975 1 1 23 SER CB C -4.158 -12.556 2.210 1.00 . A A . 23 SER CB 1 1 13 11976 1 1 23 SER H H -3.618 -10.426 3.611 1.00 . A A . 23 SER H 1 1 13 11977 1 1 23 SER HA H -2.087 -12.155 1.844 1.00 . A A . 23 SER HA 1 1 13 11978 1 1 23 SER HB2 H -3.906 -13.205 3.035 1.00 . A A . 23 SER HB2 1 1 13 11979 1 1 23 SER HB3 H -5.046 -11.992 2.454 1.00 . A A . 23 SER HB3 1 1 13 11980 1 1 23 SER HG H -5.084 -14.011 1.282 1.00 . A A . 23 SER HG 1 1 13 11981 1 1 23 SER N N -2.832 -10.688 3.089 1.00 . A A . 23 SER N 1 1 13 11982 1 1 23 SER O O -3.639 -9.638 0.710 1.00 . A A . 23 SER O 1 1 13 11983 1 1 23 SER OG O -4.421 -13.351 1.067 1.00 . A A . 23 SER OG 1 1 13 11984 1 1 24 ASP C C -4.680 -10.381 -1.932 1.00 . A A . 24 ASP C 1 1 13 11985 1 1 24 ASP CA C -3.230 -10.820 -1.764 1.00 . A A . 24 ASP CA 1 1 13 11986 1 1 24 ASP CB C -2.841 -11.778 -2.891 1.00 . A A . 24 ASP CB 1 1 13 11987 1 1 24 ASP CG C -2.522 -11.051 -4.182 1.00 . A A . 24 ASP CG 1 1 13 11988 1 1 24 ASP H H -2.720 -12.386 -0.433 1.00 . A A . 24 ASP H 1 1 13 11989 1 1 24 ASP HA H -2.594 -9.948 -1.809 1.00 . A A . 24 ASP HA 1 1 13 11990 1 1 24 ASP HB2 H -1.969 -12.340 -2.593 1.00 . A A . 24 ASP HB2 1 1 13 11991 1 1 24 ASP HB3 H -3.659 -12.460 -3.075 1.00 . A A . 24 ASP HB3 1 1 13 11992 1 1 24 ASP N N -3.027 -11.456 -0.467 1.00 . A A . 24 ASP N 1 1 13 11993 1 1 24 ASP O O -4.966 -9.386 -2.597 1.00 . A A . 24 ASP O 1 1 13 11994 1 1 24 ASP OD1 O -1.849 -10.001 -4.122 1.00 . A A . 24 ASP OD1 1 1 13 11995 1 1 24 ASP OD2 O -2.947 -11.531 -5.254 1.00 . A A . 24 ASP OD2 1 1 13 11996 1 1 25 ALA C C -7.332 -9.501 -0.709 1.00 . A A . 25 ALA C 1 1 13 11997 1 1 25 ALA CA C -7.017 -10.820 -1.407 1.00 . A A . 25 ALA CA 1 1 13 11998 1 1 25 ALA CB C -7.840 -11.947 -0.802 1.00 . A A . 25 ALA CB 1 1 13 11999 1 1 25 ALA H H -5.305 -11.913 -0.808 1.00 . A A . 25 ALA H 1 1 13 12000 1 1 25 ALA HA H -7.280 -10.735 -2.450 1.00 . A A . 25 ALA HA 1 1 13 12001 1 1 25 ALA HB1 H -8.813 -11.572 -0.522 1.00 . A A . 25 ALA HB1 1 1 13 12002 1 1 25 ALA HB2 H -7.337 -12.333 0.072 1.00 . A A . 25 ALA HB2 1 1 13 12003 1 1 25 ALA HB3 H -7.955 -12.738 -1.530 1.00 . A A . 25 ALA HB3 1 1 13 12004 1 1 25 ALA N N -5.595 -11.131 -1.325 1.00 . A A . 25 ALA N 1 1 13 12005 1 1 25 ALA O O -8.100 -8.685 -1.219 1.00 . A A . 25 ALA O 1 1 13 12006 1 1 26 ALA C C -6.535 -6.847 0.429 1.00 . A A . 26 ALA C 1 1 13 12007 1 1 26 ALA CA C -6.950 -8.077 1.228 1.00 . A A . 26 ALA CA 1 1 13 12008 1 1 26 ALA CB C -6.186 -8.138 2.541 1.00 . A A . 26 ALA CB 1 1 13 12009 1 1 26 ALA H H -6.132 -9.986 0.816 1.00 . A A . 26 ALA H 1 1 13 12010 1 1 26 ALA HA H -8.004 -8.009 1.455 1.00 . A A . 26 ALA HA 1 1 13 12011 1 1 26 ALA HB1 H -6.780 -7.692 3.325 1.00 . A A . 26 ALA HB1 1 1 13 12012 1 1 26 ALA HB2 H -5.256 -7.597 2.443 1.00 . A A . 26 ALA HB2 1 1 13 12013 1 1 26 ALA HB3 H -5.978 -9.168 2.791 1.00 . A A . 26 ALA HB3 1 1 13 12014 1 1 26 ALA N N -6.734 -9.298 0.461 1.00 . A A . 26 ALA N 1 1 13 12015 1 1 26 ALA O O -7.107 -5.768 0.589 1.00 . A A . 26 ALA O 1 1 13 12016 1 1 27 VAL C C -6.004 -5.625 -2.407 1.00 . A A . 27 VAL C 1 1 13 12017 1 1 27 VAL CA C -5.046 -5.921 -1.258 1.00 . A A . 27 VAL CA 1 1 13 12018 1 1 27 VAL CB C -3.651 -6.234 -1.833 1.00 . A A . 27 VAL CB 1 1 13 12019 1 1 27 VAL CG1 C -3.106 -5.039 -2.603 1.00 . A A . 27 VAL CG1 1 1 13 12020 1 1 27 VAL CG2 C -2.694 -6.641 -0.723 1.00 . A A . 27 VAL CG2 1 1 13 12021 1 1 27 VAL H H -5.123 -7.900 -0.515 1.00 . A A . 27 VAL H 1 1 13 12022 1 1 27 VAL HA H -4.966 -5.042 -0.632 1.00 . A A . 27 VAL HA 1 1 13 12023 1 1 27 VAL HB H -3.745 -7.062 -2.519 1.00 . A A . 27 VAL HB 1 1 13 12024 1 1 27 VAL HG11 H -2.104 -5.256 -2.941 1.00 . A A . 27 VAL HG11 1 1 13 12025 1 1 27 VAL HG12 H -3.089 -4.173 -1.958 1.00 . A A . 27 VAL HG12 1 1 13 12026 1 1 27 VAL HG13 H -3.740 -4.842 -3.456 1.00 . A A . 27 VAL HG13 1 1 13 12027 1 1 27 VAL HG21 H -1.726 -6.862 -1.144 1.00 . A A . 27 VAL HG21 1 1 13 12028 1 1 27 VAL HG22 H -3.078 -7.517 -0.220 1.00 . A A . 27 VAL HG22 1 1 13 12029 1 1 27 VAL HG23 H -2.601 -5.831 -0.012 1.00 . A A . 27 VAL HG23 1 1 13 12030 1 1 27 VAL N N -5.538 -7.016 -0.432 1.00 . A A . 27 VAL N 1 1 13 12031 1 1 27 VAL O O -6.340 -4.470 -2.666 1.00 . A A . 27 VAL O 1 1 13 12032 1 1 28 SER C C -8.721 -6.029 -3.743 1.00 . A A . 28 SER C 1 1 13 12033 1 1 28 SER CA C -7.358 -6.528 -4.215 1.00 . A A . 28 SER CA 1 1 13 12034 1 1 28 SER CB C -7.515 -7.860 -4.951 1.00 . A A . 28 SER CB 1 1 13 12035 1 1 28 SER H H -6.136 -7.572 -2.838 1.00 . A A . 28 SER H 1 1 13 12036 1 1 28 SER HA H -6.939 -5.800 -4.893 1.00 . A A . 28 SER HA 1 1 13 12037 1 1 28 SER HB2 H -6.785 -8.563 -4.578 1.00 . A A . 28 SER HB2 1 1 13 12038 1 1 28 SER HB3 H -8.509 -8.250 -4.783 1.00 . A A . 28 SER HB3 1 1 13 12039 1 1 28 SER HG H -7.989 -8.193 -6.822 1.00 . A A . 28 SER HG 1 1 13 12040 1 1 28 SER N N -6.440 -6.676 -3.093 1.00 . A A . 28 SER N 1 1 13 12041 1 1 28 SER O O -9.365 -5.222 -4.413 1.00 . A A . 28 SER O 1 1 13 12042 1 1 28 SER OG O -7.318 -7.699 -6.346 1.00 . A A . 28 SER OG 1 1 13 12043 1 1 29 GLN C C -10.490 -4.616 -1.766 1.00 . A A . 29 GLN C 1 1 13 12044 1 1 29 GLN CA C -10.440 -6.120 -2.020 1.00 . A A . 29 GLN CA 1 1 13 12045 1 1 29 GLN CB C -10.690 -6.877 -0.715 1.00 . A A . 29 GLN CB 1 1 13 12046 1 1 29 GLN CD C -11.530 -8.998 0.369 1.00 . A A . 29 GLN CD 1 1 13 12047 1 1 29 GLN CG C -11.440 -8.189 -0.909 1.00 . A A . 29 GLN CG 1 1 13 12048 1 1 29 GLN H H -8.595 -7.156 -2.096 1.00 . A A . 29 GLN H 1 1 13 12049 1 1 29 GLN HA H -11.200 -6.381 -2.732 1.00 . A A . 29 GLN HA 1 1 13 12050 1 1 29 GLN HB2 H -9.752 -7.092 -0.243 1.00 . A A . 29 GLN HB2 1 1 13 12051 1 1 29 GLN HB3 H -11.280 -6.250 -0.059 1.00 . A A . 29 GLN HB3 1 1 13 12052 1 1 29 GLN HE21 H -10.510 -10.483 -0.463 1.00 . A A . 29 GLN HE21 1 1 13 12053 1 1 29 GLN HE22 H -11.010 -10.737 1.171 1.00 . A A . 29 GLN HE22 1 1 13 12054 1 1 29 GLN HG2 H -12.440 -7.974 -1.258 1.00 . A A . 29 GLN HG2 1 1 13 12055 1 1 29 GLN HG3 H -10.920 -8.775 -1.652 1.00 . A A . 29 GLN HG3 1 1 13 12056 1 1 29 GLN N N -9.154 -6.515 -2.584 1.00 . A A . 29 GLN N 1 1 13 12057 1 1 29 GLN NE2 N -10.960 -10.194 0.359 1.00 . A A . 29 GLN NE2 1 1 13 12058 1 1 29 GLN O O -11.570 -4.038 -1.644 1.00 . A A . 29 GLN O 1 1 13 12059 1 1 29 GLN OE1 O -12.120 -8.553 1.355 1.00 . A A . 29 GLN OE1 1 1 13 12060 1 1 30 TRP C C -10.090 -1.766 -2.435 1.00 . A A . 30 TRP C 1 1 13 12061 1 1 30 TRP CA C -9.246 -2.547 -1.437 1.00 . A A . 30 TRP CA 1 1 13 12062 1 1 30 TRP CB C -7.793 -2.076 -1.516 1.00 . A A . 30 TRP CB 1 1 13 12063 1 1 30 TRP CD1 C -7.406 -3.053 0.824 1.00 . A A . 30 TRP CD1 1 1 13 12064 1 1 30 TRP CD2 C -5.540 -2.375 -0.210 1.00 . A A . 30 TRP CD2 1 1 13 12065 1 1 30 TRP CE2 C -5.192 -2.886 1.054 1.00 . A A . 30 TRP CE2 1 1 13 12066 1 1 30 TRP CE3 C -4.527 -1.889 -1.042 1.00 . A A . 30 TRP CE3 1 1 13 12067 1 1 30 TRP CG C -6.962 -2.492 -0.339 1.00 . A A . 30 TRP CG 1 1 13 12068 1 1 30 TRP CH2 C -2.905 -2.441 0.670 1.00 . A A . 30 TRP CH2 1 1 13 12069 1 1 30 TRP CZ2 C -3.875 -2.924 1.505 1.00 . A A . 30 TRP CZ2 1 1 13 12070 1 1 30 TRP CZ3 C -3.221 -1.927 -0.593 1.00 . A A . 30 TRP CZ3 1 1 13 12071 1 1 30 TRP H H -8.498 -4.496 -1.783 1.00 . A A . 30 TRP H 1 1 13 12072 1 1 30 TRP HA H -9.621 -2.361 -0.441 1.00 . A A . 30 TRP HA 1 1 13 12073 1 1 30 TRP HB2 H -7.337 -2.485 -2.406 1.00 . A A . 30 TRP HB2 1 1 13 12074 1 1 30 TRP HB3 H -7.774 -0.996 -1.574 1.00 . A A . 30 TRP HB3 1 1 13 12075 1 1 30 TRP HD1 H -8.443 -3.271 1.037 1.00 . A A . 30 TRP HD1 1 1 13 12076 1 1 30 TRP HE1 H -6.412 -3.692 2.560 1.00 . A A . 30 TRP HE1 1 1 13 12077 1 1 30 TRP HE3 H -4.751 -1.488 -2.019 1.00 . A A . 30 TRP HE3 1 1 13 12078 1 1 30 TRP HH2 H -1.870 -2.451 0.980 1.00 . A A . 30 TRP HH2 1 1 13 12079 1 1 30 TRP HZ2 H -3.614 -3.318 2.477 1.00 . A A . 30 TRP HZ2 1 1 13 12080 1 1 30 TRP HZ3 H -2.425 -1.555 -1.222 1.00 . A A . 30 TRP HZ3 1 1 13 12081 1 1 30 TRP N N -9.326 -3.984 -1.682 1.00 . A A . 30 TRP N 1 1 13 12082 1 1 30 TRP NE1 N -6.349 -3.294 1.667 1.00 . A A . 30 TRP NE1 1 1 13 12083 1 1 30 TRP O O -10.400 -2.257 -3.521 1.00 . A A . 30 TRP O 1 1 13 12084 1 1 31 LYS C C -10.540 1.602 -3.243 1.00 . A A . 31 LYS C 1 1 13 12085 1 1 31 LYS CA C -11.280 0.307 -2.913 1.00 . A A . 31 LYS CA 1 1 13 12086 1 1 31 LYS CB C -12.620 0.616 -2.234 1.00 . A A . 31 LYS CB 1 1 13 12087 1 1 31 LYS CD C -13.490 1.117 0.069 1.00 . A A . 31 LYS CD 1 1 13 12088 1 1 31 LYS CE C -13.640 2.210 1.114 1.00 . A A . 31 LYS CE 1 1 13 12089 1 1 31 LYS CG C -12.490 1.505 -1.007 1.00 . A A . 31 LYS CG 1 1 13 12090 1 1 31 LYS H H -10.190 -0.215 -1.180 1.00 . A A . 31 LYS H 1 1 13 12091 1 1 31 LYS HA H -11.470 -0.227 -3.833 1.00 . A A . 31 LYS HA 1 1 13 12092 1 1 31 LYS HB2 H -13.260 1.108 -2.943 1.00 . A A . 31 LYS HB2 1 1 13 12093 1 1 31 LYS HB3 H -13.070 -0.314 -1.929 1.00 . A A . 31 LYS HB3 1 1 13 12094 1 1 31 LYS HD2 H -14.450 0.943 -0.392 1.00 . A A . 31 LYS HD2 1 1 13 12095 1 1 31 LYS HD3 H -13.150 0.212 0.551 1.00 . A A . 31 LYS HD3 1 1 13 12096 1 1 31 LYS HE2 H -13.000 1.974 1.956 1.00 . A A . 31 LYS HE2 1 1 13 12097 1 1 31 LYS HE3 H -13.320 3.149 0.682 1.00 . A A . 31 LYS HE3 1 1 13 12098 1 1 31 LYS HG2 H -11.490 1.411 -0.607 1.00 . A A . 31 LYS HG2 1 1 13 12099 1 1 31 LYS HG3 H -12.660 2.531 -1.298 1.00 . A A . 31 LYS HG3 1 1 13 12100 1 1 31 LYS HZ1 H -15.110 3.105 2.291 1.00 . A A . 31 LYS HZ1 1 1 13 12101 1 1 31 LYS HZ2 H -15.350 1.451 2.030 1.00 . A A . 31 LYS HZ2 1 1 13 12102 1 1 31 LYS HZ3 H -15.670 2.558 0.791 1.00 . A A . 31 LYS HZ3 1 1 13 12103 1 1 31 LYS N N -10.470 -0.548 -2.058 1.00 . A A . 31 LYS N 1 1 13 12104 1 1 31 LYS NZ N -15.040 2.340 1.591 1.00 . A A . 31 LYS NZ 1 1 13 12105 1 1 31 LYS O O -9.325 1.689 -3.070 1.00 . A A . 31 LYS O 1 1 13 12106 1 1 32 GLU C C -9.740 4.387 -2.973 1.00 . A A . 32 GLU C 1 1 13 12107 1 1 32 GLU CA C -10.680 3.894 -4.068 1.00 . A A . 32 GLU CA 1 1 13 12108 1 1 32 GLU CB C -11.780 4.932 -4.318 1.00 . A A . 32 GLU CB 1 1 13 12109 1 1 32 GLU CD C -12.910 6.378 -6.052 1.00 . A A . 32 GLU CD 1 1 13 12110 1 1 32 GLU CG C -11.640 5.653 -5.648 1.00 . A A . 32 GLU CG 1 1 13 12111 1 1 32 GLU H H -12.230 2.477 -3.834 1.00 . A A . 32 GLU H 1 1 13 12112 1 1 32 GLU HA H -10.110 3.758 -4.978 1.00 . A A . 32 GLU HA 1 1 13 12113 1 1 32 GLU HB2 H -12.740 4.434 -4.300 1.00 . A A . 32 GLU HB2 1 1 13 12114 1 1 32 GLU HB3 H -11.750 5.668 -3.529 1.00 . A A . 32 GLU HB3 1 1 13 12115 1 1 32 GLU HG2 H -10.840 6.373 -5.571 1.00 . A A . 32 GLU HG2 1 1 13 12116 1 1 32 GLU HG3 H -11.400 4.928 -6.412 1.00 . A A . 32 GLU HG3 1 1 13 12117 1 1 32 GLU N N -11.270 2.605 -3.716 1.00 . A A . 32 GLU N 1 1 13 12118 1 1 32 GLU O O -8.700 4.981 -3.258 1.00 . A A . 32 GLU O 1 1 13 12119 1 1 32 GLU OE1 O -13.210 7.427 -5.445 1.00 . A A . 32 GLU OE1 1 1 13 12120 1 1 32 GLU OE2 O -13.600 5.898 -6.974 1.00 . A A . 32 GLU OE2 1 1 13 12121 1 1 33 VAL C C -8.915 3.346 0.278 1.00 . A A . 33 VAL C 1 1 13 12122 1 1 33 VAL CA C -9.292 4.543 -0.586 1.00 . A A . 33 VAL CA 1 1 13 12123 1 1 33 VAL CB C -10.020 5.583 0.286 1.00 . A A . 33 VAL CB 1 1 13 12124 1 1 33 VAL CG1 C -9.094 6.124 1.362 1.00 . A A . 33 VAL CG1 1 1 13 12125 1 1 33 VAL CG2 C -10.570 6.711 -0.574 1.00 . A A . 33 VAL CG2 1 1 13 12126 1 1 33 VAL H H -10.940 3.651 -1.559 1.00 . A A . 33 VAL H 1 1 13 12127 1 1 33 VAL HA H -8.389 4.996 -0.970 1.00 . A A . 33 VAL HA 1 1 13 12128 1 1 33 VAL HB H -10.850 5.093 0.772 1.00 . A A . 33 VAL HB 1 1 13 12129 1 1 33 VAL HG11 H -9.680 6.558 2.159 1.00 . A A . 33 VAL HG11 1 1 13 12130 1 1 33 VAL HG12 H -8.452 6.880 0.935 1.00 . A A . 33 VAL HG12 1 1 13 12131 1 1 33 VAL HG13 H -8.491 5.320 1.756 1.00 . A A . 33 VAL HG13 1 1 13 12132 1 1 33 VAL HG21 H -11.250 7.307 0.009 1.00 . A A . 33 VAL HG21 1 1 13 12133 1 1 33 VAL HG22 H -11.080 6.297 -1.426 1.00 . A A . 33 VAL HG22 1 1 13 12134 1 1 33 VAL HG23 H -9.755 7.333 -0.914 1.00 . A A . 33 VAL HG23 1 1 13 12135 1 1 33 VAL N N -10.100 4.130 -1.721 1.00 . A A . 33 VAL N 1 1 13 12136 1 1 33 VAL O O -9.781 2.677 0.842 1.00 . A A . 33 VAL O 1 1 13 12137 1 1 34 ILE C C -7.621 2.034 2.610 1.00 . A A . 34 ILE C 1 1 13 12138 1 1 34 ILE CA C -7.124 1.955 1.168 1.00 . A A . 34 ILE CA 1 1 13 12139 1 1 34 ILE CB C -5.583 1.896 1.173 1.00 . A A . 34 ILE CB 1 1 13 12140 1 1 34 ILE CD1 C -3.508 3.279 1.673 1.00 . A A . 34 ILE CD1 1 1 13 12141 1 1 34 ILE CG1 C -4.991 3.291 1.376 1.00 . A A . 34 ILE CG1 1 1 13 12142 1 1 34 ILE CG2 C -5.073 1.284 -0.124 1.00 . A A . 34 ILE CG2 1 1 13 12143 1 1 34 ILE H H -6.976 3.645 -0.102 1.00 . A A . 34 ILE H 1 1 13 12144 1 1 34 ILE HA H -7.495 1.044 0.721 1.00 . A A . 34 ILE HA 1 1 13 12145 1 1 34 ILE HB H -5.274 1.259 1.986 1.00 . A A . 34 ILE HB 1 1 13 12146 1 1 34 ILE HD11 H -3.290 2.493 2.381 1.00 . A A . 34 ILE HD11 1 1 13 12147 1 1 34 ILE HD12 H -3.215 4.231 2.086 1.00 . A A . 34 ILE HD12 1 1 13 12148 1 1 34 ILE HD13 H -2.960 3.100 0.759 1.00 . A A . 34 ILE HD13 1 1 13 12149 1 1 34 ILE HG12 H -5.143 3.876 0.481 1.00 . A A . 34 ILE HG12 1 1 13 12150 1 1 34 ILE HG13 H -5.492 3.772 2.203 1.00 . A A . 34 ILE HG13 1 1 13 12151 1 1 34 ILE HG21 H -5.746 0.500 -0.440 1.00 . A A . 34 ILE HG21 1 1 13 12152 1 1 34 ILE HG22 H -4.089 0.869 0.038 1.00 . A A . 34 ILE HG22 1 1 13 12153 1 1 34 ILE HG23 H -5.022 2.045 -0.886 1.00 . A A . 34 ILE HG23 1 1 13 12154 1 1 34 ILE N N -7.617 3.077 0.375 1.00 . A A . 34 ILE N 1 1 13 12155 1 1 34 ILE O O -8.009 3.101 3.086 1.00 . A A . 34 ILE O 1 1 13 12156 1 1 35 PRO C C -7.376 1.867 5.604 1.00 . A A . 35 PRO C 1 1 13 12157 1 1 35 PRO CA C -8.073 0.837 4.721 1.00 . A A . 35 PRO CA 1 1 13 12158 1 1 35 PRO CB C -7.706 -0.583 5.159 1.00 . A A . 35 PRO CB 1 1 13 12159 1 1 35 PRO CD C -7.173 -0.422 2.836 1.00 . A A . 35 PRO CD 1 1 13 12160 1 1 35 PRO CG C -7.663 -1.369 3.895 1.00 . A A . 35 PRO CG 1 1 13 12161 1 1 35 PRO HA H -9.142 0.974 4.791 1.00 . A A . 35 PRO HA 1 1 13 12162 1 1 35 PRO HB2 H -6.747 -0.573 5.653 1.00 . A A . 35 PRO HB2 1 1 13 12163 1 1 35 PRO HB3 H -8.462 -0.960 5.831 1.00 . A A . 35 PRO HB3 1 1 13 12164 1 1 35 PRO HD2 H -6.096 -0.463 2.762 1.00 . A A . 35 PRO HD2 1 1 13 12165 1 1 35 PRO HD3 H -7.627 -0.650 1.884 1.00 . A A . 35 PRO HD3 1 1 13 12166 1 1 35 PRO HG2 H -6.980 -2.199 4.001 1.00 . A A . 35 PRO HG2 1 1 13 12167 1 1 35 PRO HG3 H -8.653 -1.725 3.648 1.00 . A A . 35 PRO HG3 1 1 13 12168 1 1 35 PRO N N -7.618 0.896 3.327 1.00 . A A . 35 PRO N 1 1 13 12169 1 1 35 PRO O O -6.289 2.346 5.282 1.00 . A A . 35 PRO O 1 1 13 12170 1 1 36 GLU C C -6.218 2.653 8.352 1.00 . A A . 36 GLU C 1 1 13 12171 1 1 36 GLU CA C -7.471 3.183 7.654 1.00 . A A . 36 GLU CA 1 1 13 12172 1 1 36 GLU CB C -8.527 3.551 8.698 1.00 . A A . 36 GLU CB 1 1 13 12173 1 1 36 GLU CD C -9.505 5.344 10.183 1.00 . A A . 36 GLU CD 1 1 13 12174 1 1 36 GLU CG C -8.548 5.029 9.049 1.00 . A A . 36 GLU CG 1 1 13 12175 1 1 36 GLU H H -8.881 1.790 6.915 1.00 . A A . 36 GLU H 1 1 13 12176 1 1 36 GLU HA H -7.209 4.067 7.095 1.00 . A A . 36 GLU HA 1 1 13 12177 1 1 36 GLU HB2 H -9.501 3.280 8.317 1.00 . A A . 36 GLU HB2 1 1 13 12178 1 1 36 GLU HB3 H -8.337 2.990 9.601 1.00 . A A . 36 GLU HB3 1 1 13 12179 1 1 36 GLU HG2 H -7.554 5.329 9.344 1.00 . A A . 36 GLU HG2 1 1 13 12180 1 1 36 GLU HG3 H -8.848 5.586 8.176 1.00 . A A . 36 GLU HG3 1 1 13 12181 1 1 36 GLU N N -8.015 2.205 6.719 1.00 . A A . 36 GLU N 1 1 13 12182 1 1 36 GLU O O -5.315 3.420 8.687 1.00 . A A . 36 GLU O 1 1 13 12183 1 1 36 GLU OE1 O -10.550 4.672 10.279 1.00 . A A . 36 GLU OE1 1 1 13 12184 1 1 36 GLU OE2 O -9.206 6.263 10.974 1.00 . A A . 36 GLU OE2 1 1 13 12185 1 1 37 LYS C C -3.967 0.285 8.266 1.00 . A A . 37 LYS C 1 1 13 12186 1 1 37 LYS CA C -5.039 0.726 9.257 1.00 . A A . 37 LYS CA 1 1 13 12187 1 1 37 LYS CB C -5.504 -0.472 10.088 1.00 . A A . 37 LYS CB 1 1 13 12188 1 1 37 LYS CD C -6.430 -2.808 10.103 1.00 . A A . 37 LYS CD 1 1 13 12189 1 1 37 LYS CE C -6.960 -3.952 9.253 1.00 . A A . 37 LYS CE 1 1 13 12190 1 1 37 LYS CG C -6.144 -1.574 9.260 1.00 . A A . 37 LYS CG 1 1 13 12191 1 1 37 LYS H H -6.932 0.785 8.304 1.00 . A A . 37 LYS H 1 1 13 12192 1 1 37 LYS HA H -4.611 1.463 9.918 1.00 . A A . 37 LYS HA 1 1 13 12193 1 1 37 LYS HB2 H -4.652 -0.888 10.606 1.00 . A A . 37 LYS HB2 1 1 13 12194 1 1 37 LYS HB3 H -6.226 -0.132 10.815 1.00 . A A . 37 LYS HB3 1 1 13 12195 1 1 37 LYS HD2 H -5.518 -3.122 10.584 1.00 . A A . 37 LYS HD2 1 1 13 12196 1 1 37 LYS HD3 H -7.167 -2.555 10.851 1.00 . A A . 37 LYS HD3 1 1 13 12197 1 1 37 LYS HE2 H -7.372 -3.546 8.342 1.00 . A A . 37 LYS HE2 1 1 13 12198 1 1 37 LYS HE3 H -6.142 -4.613 9.014 1.00 . A A . 37 LYS HE3 1 1 13 12199 1 1 37 LYS HG2 H -7.072 -1.210 8.848 1.00 . A A . 37 LYS HG2 1 1 13 12200 1 1 37 LYS HG3 H -5.473 -1.845 8.459 1.00 . A A . 37 LYS HG3 1 1 13 12201 1 1 37 LYS HZ1 H -7.590 -5.490 10.519 1.00 . A A . 37 LYS HZ1 1 1 13 12202 1 1 37 LYS HZ2 H -8.678 -5.141 9.271 1.00 . A A . 37 LYS HZ2 1 1 13 12203 1 1 37 LYS HZ3 H -8.553 -4.099 10.597 1.00 . A A . 37 LYS HZ3 1 1 13 12204 1 1 37 LYS N N -6.177 1.345 8.584 1.00 . A A . 37 LYS N 1 1 13 12205 1 1 37 LYS NZ N -8.019 -4.724 9.960 1.00 . A A . 37 LYS NZ 1 1 13 12206 1 1 37 LYS O O -2.801 0.140 8.630 1.00 . A A . 37 LYS O 1 1 13 12207 1 1 38 ASP C C -2.612 0.841 5.476 1.00 . A A . 38 ASP C 1 1 13 12208 1 1 38 ASP CA C -3.410 -0.349 5.992 1.00 . A A . 38 ASP CA 1 1 13 12209 1 1 38 ASP CB C -4.141 -1.034 4.834 1.00 . A A . 38 ASP CB 1 1 13 12210 1 1 38 ASP CG C -4.477 -2.482 5.135 1.00 . A A . 38 ASP CG 1 1 13 12211 1 1 38 ASP H H -5.299 0.204 6.775 1.00 . A A . 38 ASP H 1 1 13 12212 1 1 38 ASP HA H -2.728 -1.053 6.444 1.00 . A A . 38 ASP HA 1 1 13 12213 1 1 38 ASP HB2 H -5.058 -0.505 4.632 1.00 . A A . 38 ASP HB2 1 1 13 12214 1 1 38 ASP HB3 H -3.513 -1.005 3.955 1.00 . A A . 38 ASP HB3 1 1 13 12215 1 1 38 ASP N N -4.358 0.074 7.015 1.00 . A A . 38 ASP N 1 1 13 12216 1 1 38 ASP O O -1.405 0.743 5.253 1.00 . A A . 38 ASP O 1 1 13 12217 1 1 38 ASP OD1 O -4.230 -2.924 6.277 1.00 . A A . 38 ASP OD1 1 1 13 12218 1 1 38 ASP OD2 O -4.989 -3.173 4.230 1.00 . A A . 38 ASP OD2 1 1 13 12219 1 1 39 ALA C C -1.622 3.686 5.826 1.00 . A A . 39 ALA C 1 1 13 12220 1 1 39 ALA CA C -2.644 3.180 4.815 1.00 . A A . 39 ALA CA 1 1 13 12221 1 1 39 ALA CB C -3.680 4.254 4.526 1.00 . A A . 39 ALA CB 1 1 13 12222 1 1 39 ALA H H -4.251 1.985 5.496 1.00 . A A . 39 ALA H 1 1 13 12223 1 1 39 ALA HA H -2.136 2.943 3.893 1.00 . A A . 39 ALA HA 1 1 13 12224 1 1 39 ALA HB1 H -4.483 3.831 3.938 1.00 . A A . 39 ALA HB1 1 1 13 12225 1 1 39 ALA HB2 H -3.218 5.061 3.976 1.00 . A A . 39 ALA HB2 1 1 13 12226 1 1 39 ALA HB3 H -4.075 4.633 5.457 1.00 . A A . 39 ALA HB3 1 1 13 12227 1 1 39 ALA N N -3.292 1.968 5.296 1.00 . A A . 39 ALA N 1 1 13 12228 1 1 39 ALA O O -0.643 4.336 5.460 1.00 . A A . 39 ALA O 1 1 13 12229 1 1 40 TYR C C 0.391 3.094 8.055 1.00 . A A . 40 TYR C 1 1 13 12230 1 1 40 TYR CA C -0.953 3.810 8.162 1.00 . A A . 40 TYR CA 1 1 13 12231 1 1 40 TYR CB C -1.581 3.543 9.530 1.00 . A A . 40 TYR CB 1 1 13 12232 1 1 40 TYR CD1 C -0.486 5.279 10.998 1.00 . A A . 40 TYR CD1 1 1 13 12233 1 1 40 TYR CD2 C -0.069 2.979 11.469 1.00 . A A . 40 TYR CD2 1 1 13 12234 1 1 40 TYR CE1 C 0.324 5.647 12.055 1.00 . A A . 40 TYR CE1 1 1 13 12235 1 1 40 TYR CE2 C 0.743 3.340 12.529 1.00 . A A . 40 TYR CE2 1 1 13 12236 1 1 40 TYR CG C -0.696 3.941 10.688 1.00 . A A . 40 TYR CG 1 1 13 12237 1 1 40 TYR CZ C 0.936 4.675 12.817 1.00 . A A . 40 TYR CZ 1 1 13 12238 1 1 40 TYR H H -2.655 2.862 7.332 1.00 . A A . 40 TYR H 1 1 13 12239 1 1 40 TYR HA H -0.790 4.872 8.052 1.00 . A A . 40 TYR HA 1 1 13 12240 1 1 40 TYR HB2 H -2.504 4.101 9.611 1.00 . A A . 40 TYR HB2 1 1 13 12241 1 1 40 TYR HB3 H -1.792 2.485 9.621 1.00 . A A . 40 TYR HB3 1 1 13 12242 1 1 40 TYR HD1 H -0.968 6.038 10.400 1.00 . A A . 40 TYR HD1 1 1 13 12243 1 1 40 TYR HD2 H -0.223 1.935 11.240 1.00 . A A . 40 TYR HD2 1 1 13 12244 1 1 40 TYR HE1 H 0.475 6.694 12.279 1.00 . A A . 40 TYR HE1 1 1 13 12245 1 1 40 TYR HE2 H 1.223 2.578 13.125 1.00 . A A . 40 TYR HE2 1 1 13 12246 1 1 40 TYR HH H 1.231 5.038 14.683 1.00 . A A . 40 TYR HH 1 1 13 12247 1 1 40 TYR N N -1.855 3.384 7.101 1.00 . A A . 40 TYR N 1 1 13 12248 1 1 40 TYR O O 1.438 3.730 7.949 1.00 . A A . 40 TYR O 1 1 13 12249 1 1 40 TYR OH O 1.744 5.038 13.870 1.00 . A A . 40 TYR OH 1 1 13 12250 1 1 41 ARG C C 2.271 1.187 6.662 1.00 . A A . 41 ARG C 1 1 13 12251 1 1 41 ARG CA C 1.564 0.962 7.995 1.00 . A A . 41 ARG CA 1 1 13 12252 1 1 41 ARG CB C 1.232 -0.522 8.162 1.00 . A A . 41 ARG CB 1 1 13 12253 1 1 41 ARG CD C -0.277 -2.164 9.325 1.00 . A A . 41 ARG CD 1 1 13 12254 1 1 41 ARG CG C 0.451 -0.832 9.429 1.00 . A A . 41 ARG CG 1 1 13 12255 1 1 41 ARG CZ C -0.124 -3.150 11.578 1.00 . A A . 41 ARG CZ 1 1 13 12256 1 1 41 ARG H H -0.515 1.316 8.173 1.00 . A A . 41 ARG H 1 1 13 12257 1 1 41 ARG HA H 2.224 1.266 8.793 1.00 . A A . 41 ARG HA 1 1 13 12258 1 1 41 ARG HB2 H 0.644 -0.845 7.315 1.00 . A A . 41 ARG HB2 1 1 13 12259 1 1 41 ARG HB3 H 2.153 -1.085 8.187 1.00 . A A . 41 ARG HB3 1 1 13 12260 1 1 41 ARG HD2 H -1.328 -2.001 9.506 1.00 . A A . 41 ARG HD2 1 1 13 12261 1 1 41 ARG HD3 H -0.141 -2.560 8.329 1.00 . A A . 41 ARG HD3 1 1 13 12262 1 1 41 ARG HE H 0.846 -3.821 9.969 1.00 . A A . 41 ARG HE 1 1 13 12263 1 1 41 ARG HG2 H 1.137 -0.874 10.262 1.00 . A A . 41 ARG HG2 1 1 13 12264 1 1 41 ARG HG3 H -0.274 -0.049 9.596 1.00 . A A . 41 ARG HG3 1 1 13 12265 1 1 41 ARG HH11 H -1.343 -1.542 11.448 1.00 . A A . 41 ARG HH11 1 1 13 12266 1 1 41 ARG HH12 H -1.221 -2.255 13.021 1.00 . A A . 41 ARG HH12 1 1 13 12267 1 1 41 ARG HH21 H 1.010 -4.761 12.036 1.00 . A A . 41 ARG HH21 1 1 13 12268 1 1 41 ARG HH22 H 0.115 -4.084 13.355 1.00 . A A . 41 ARG HH22 1 1 13 12269 1 1 41 ARG N N 0.350 1.766 8.085 1.00 . A A . 41 ARG N 1 1 13 12270 1 1 41 ARG NE N 0.223 -3.139 10.293 1.00 . A A . 41 ARG NE 1 1 13 12271 1 1 41 ARG NH1 N -0.965 -2.241 12.055 1.00 . A A . 41 ARG NH1 1 1 13 12272 1 1 41 ARG NH2 N 0.374 -4.074 12.390 1.00 . A A . 41 ARG NH2 1 1 13 12273 1 1 41 ARG O O 3.493 1.072 6.568 1.00 . A A . 41 ARG O 1 1 13 12274 1 1 42 LEU C C 3.091 2.855 4.331 1.00 . A A . 42 LEU C 1 1 13 12275 1 1 42 LEU CA C 2.045 1.743 4.301 1.00 . A A . 42 LEU CA 1 1 13 12276 1 1 42 LEU CB C 0.930 2.103 3.320 1.00 . A A . 42 LEU CB 1 1 13 12277 1 1 42 LEU CD1 C -1.011 1.374 1.910 1.00 . A A . 42 LEU CD1 1 1 13 12278 1 1 42 LEU CD2 C 1.151 0.123 1.800 1.00 . A A . 42 LEU CD2 1 1 13 12279 1 1 42 LEU CG C 0.207 0.910 2.693 1.00 . A A . 42 LEU CG 1 1 13 12280 1 1 42 LEU H H 0.526 1.580 5.766 1.00 . A A . 42 LEU H 1 1 13 12281 1 1 42 LEU HA H 2.520 0.829 3.971 1.00 . A A . 42 LEU HA 1 1 13 12282 1 1 42 LEU HB2 H 0.200 2.707 3.843 1.00 . A A . 42 LEU HB2 1 1 13 12283 1 1 42 LEU HB3 H 1.356 2.695 2.524 1.00 . A A . 42 LEU HB3 1 1 13 12284 1 1 42 LEU HD11 H -0.796 1.333 0.852 1.00 . A A . 42 LEU HD11 1 1 13 12285 1 1 42 LEU HD12 H -1.254 2.390 2.187 1.00 . A A . 42 LEU HD12 1 1 13 12286 1 1 42 LEU HD13 H -1.850 0.731 2.132 1.00 . A A . 42 LEU HD13 1 1 13 12287 1 1 42 LEU HD21 H 2.174 0.370 2.049 1.00 . A A . 42 LEU HD21 1 1 13 12288 1 1 42 LEU HD22 H 0.964 0.374 0.767 1.00 . A A . 42 LEU HD22 1 1 13 12289 1 1 42 LEU HD23 H 0.992 -0.935 1.948 1.00 . A A . 42 LEU HD23 1 1 13 12290 1 1 42 LEU HG H -0.136 0.253 3.480 1.00 . A A . 42 LEU HG 1 1 13 12291 1 1 42 LEU N N 1.494 1.505 5.630 1.00 . A A . 42 LEU N 1 1 13 12292 1 1 42 LEU O O 4.201 2.687 3.830 1.00 . A A . 42 LEU O 1 1 13 12293 1 1 43 GLU C C 4.978 4.718 5.602 1.00 . A A . 43 GLU C 1 1 13 12294 1 1 43 GLU CA C 3.633 5.130 5.010 1.00 . A A . 43 GLU CA 1 1 13 12295 1 1 43 GLU CB C 3.007 6.239 5.858 1.00 . A A . 43 GLU CB 1 1 13 12296 1 1 43 GLU CD C 3.827 8.567 6.404 1.00 . A A . 43 GLU CD 1 1 13 12297 1 1 43 GLU CG C 3.286 7.639 5.334 1.00 . A A . 43 GLU CG 1 1 13 12298 1 1 43 GLU H H 1.826 4.064 5.298 1.00 . A A . 43 GLU H 1 1 13 12299 1 1 43 GLU HA H 3.794 5.505 4.009 1.00 . A A . 43 GLU HA 1 1 13 12300 1 1 43 GLU HB2 H 1.936 6.095 5.885 1.00 . A A . 43 GLU HB2 1 1 13 12301 1 1 43 GLU HB3 H 3.395 6.169 6.864 1.00 . A A . 43 GLU HB3 1 1 13 12302 1 1 43 GLU HG2 H 4.012 7.572 4.537 1.00 . A A . 43 GLU HG2 1 1 13 12303 1 1 43 GLU HG3 H 2.367 8.054 4.948 1.00 . A A . 43 GLU HG3 1 1 13 12304 1 1 43 GLU N N 2.726 3.990 4.918 1.00 . A A . 43 GLU N 1 1 13 12305 1 1 43 GLU O O 6.033 5.072 5.077 1.00 . A A . 43 GLU O 1 1 13 12306 1 1 43 GLU OE1 O 3.158 8.722 7.448 1.00 . A A . 43 GLU OE1 1 1 13 12307 1 1 43 GLU OE2 O 4.918 9.140 6.198 1.00 . A A . 43 GLU OE2 1 1 13 12308 1 1 44 ILE C C 6.860 2.442 6.540 1.00 . A A . 44 ILE C 1 1 13 12309 1 1 44 ILE CA C 6.146 3.513 7.363 1.00 . A A . 44 ILE CA 1 1 13 12310 1 1 44 ILE CB C 5.839 2.950 8.763 1.00 . A A . 44 ILE CB 1 1 13 12311 1 1 44 ILE CD1 C 5.212 3.901 11.057 1.00 . A A . 44 ILE CD1 1 1 13 12312 1 1 44 ILE CG1 C 5.000 3.960 9.559 1.00 . A A . 44 ILE CG1 1 1 13 12313 1 1 44 ILE CG2 C 7.137 2.611 9.489 1.00 . A A . 44 ILE CG2 1 1 13 12314 1 1 44 ILE H H 4.060 3.722 7.072 1.00 . A A . 44 ILE H 1 1 13 12315 1 1 44 ILE HA H 6.803 4.363 7.478 1.00 . A A . 44 ILE HA 1 1 13 12316 1 1 44 ILE HB H 5.275 2.038 8.644 1.00 . A A . 44 ILE HB 1 1 13 12317 1 1 44 ILE HD11 H 6.249 4.100 11.280 1.00 . A A . 44 ILE HD11 1 1 13 12318 1 1 44 ILE HD12 H 4.947 2.919 11.421 1.00 . A A . 44 ILE HD12 1 1 13 12319 1 1 44 ILE HD13 H 4.591 4.642 11.539 1.00 . A A . 44 ILE HD13 1 1 13 12320 1 1 44 ILE HG12 H 5.248 4.959 9.233 1.00 . A A . 44 ILE HG12 1 1 13 12321 1 1 44 ILE HG13 H 3.953 3.774 9.366 1.00 . A A . 44 ILE HG13 1 1 13 12322 1 1 44 ILE HG21 H 7.712 3.513 9.637 1.00 . A A . 44 ILE HG21 1 1 13 12323 1 1 44 ILE HG22 H 7.708 1.913 8.895 1.00 . A A . 44 ILE HG22 1 1 13 12324 1 1 44 ILE HG23 H 6.908 2.168 10.446 1.00 . A A . 44 ILE HG23 1 1 13 12325 1 1 44 ILE N N 4.932 3.970 6.699 1.00 . A A . 44 ILE N 1 1 13 12326 1 1 44 ILE O O 8.080 2.478 6.382 1.00 . A A . 44 ILE O 1 1 13 12327 1 1 45 VAL C C 7.344 0.937 3.972 1.00 . A A . 45 VAL C 1 1 13 12328 1 1 45 VAL CA C 6.648 0.405 5.224 1.00 . A A . 45 VAL CA 1 1 13 12329 1 1 45 VAL CB C 5.551 -0.613 4.826 1.00 . A A . 45 VAL CB 1 1 13 12330 1 1 45 VAL CG1 C 5.068 -0.395 3.396 1.00 . A A . 45 VAL CG1 1 1 13 12331 1 1 45 VAL CG2 C 6.054 -2.038 5.011 1.00 . A A . 45 VAL CG2 1 1 13 12332 1 1 45 VAL H H 5.125 1.513 6.189 1.00 . A A . 45 VAL H 1 1 13 12333 1 1 45 VAL HA H 7.378 -0.109 5.831 1.00 . A A . 45 VAL HA 1 1 13 12334 1 1 45 VAL HB H 4.709 -0.468 5.483 1.00 . A A . 45 VAL HB 1 1 13 12335 1 1 45 VAL HG11 H 5.844 -0.691 2.705 1.00 . A A . 45 VAL HG11 1 1 13 12336 1 1 45 VAL HG12 H 4.836 0.648 3.250 1.00 . A A . 45 VAL HG12 1 1 13 12337 1 1 45 VAL HG13 H 4.184 -0.989 3.221 1.00 . A A . 45 VAL HG13 1 1 13 12338 1 1 45 VAL HG21 H 6.643 -2.096 5.915 1.00 . A A . 45 VAL HG21 1 1 13 12339 1 1 45 VAL HG22 H 6.665 -2.317 4.165 1.00 . A A . 45 VAL HG22 1 1 13 12340 1 1 45 VAL HG23 H 5.212 -2.709 5.086 1.00 . A A . 45 VAL HG23 1 1 13 12341 1 1 45 VAL N N 6.091 1.489 6.025 1.00 . A A . 45 VAL N 1 1 13 12342 1 1 45 VAL O O 8.371 0.409 3.549 1.00 . A A . 45 VAL O 1 1 13 12343 1 1 46 THR C C 8.347 3.663 2.497 1.00 . A A . 46 THR C 1 1 13 12344 1 1 46 THR CA C 7.320 2.577 2.173 1.00 . A A . 46 THR CA 1 1 13 12345 1 1 46 THR CB C 6.190 3.165 1.330 1.00 . A A . 46 THR CB 1 1 13 12346 1 1 46 THR CG2 C 5.299 2.113 0.706 1.00 . A A . 46 THR CG2 1 1 13 12347 1 1 46 THR H H 5.945 2.350 3.757 1.00 . A A . 46 THR H 1 1 13 12348 1 1 46 THR HA H 7.805 1.795 1.608 1.00 . A A . 46 THR HA 1 1 13 12349 1 1 46 THR HB H 6.620 3.748 0.537 1.00 . A A . 46 THR HB 1 1 13 12350 1 1 46 THR HG1 H 4.968 4.679 1.548 1.00 . A A . 46 THR HG1 1 1 13 12351 1 1 46 THR HG21 H 4.871 2.501 -0.208 1.00 . A A . 46 THR HG21 1 1 13 12352 1 1 46 THR HG22 H 4.506 1.859 1.394 1.00 . A A . 46 THR HG22 1 1 13 12353 1 1 46 THR HG23 H 5.882 1.231 0.486 1.00 . A A . 46 THR HG23 1 1 13 12354 1 1 46 THR N N 6.768 1.979 3.380 1.00 . A A . 46 THR N 1 1 13 12355 1 1 46 THR O O 8.417 4.683 1.812 1.00 . A A . 46 THR O 1 1 13 12356 1 1 46 THR OG1 O 5.372 4.015 2.112 1.00 . A A . 46 THR OG1 1 1 13 12357 1 1 47 ALA C C 9.627 5.818 3.998 1.00 . A A . 47 ALA C 1 1 13 12358 1 1 47 ALA CA C 10.173 4.393 3.942 1.00 . A A . 47 ALA CA 1 1 13 12359 1 1 47 ALA CB C 11.359 4.321 2.993 1.00 . A A . 47 ALA CB 1 1 13 12360 1 1 47 ALA H H 9.048 2.604 4.042 1.00 . A A . 47 ALA H 1 1 13 12361 1 1 47 ALA HA H 10.516 4.113 4.927 1.00 . A A . 47 ALA HA 1 1 13 12362 1 1 47 ALA HB1 H 11.283 5.110 2.259 1.00 . A A . 47 ALA HB1 1 1 13 12363 1 1 47 ALA HB2 H 11.362 3.363 2.491 1.00 . A A . 47 ALA HB2 1 1 13 12364 1 1 47 ALA HB3 H 12.275 4.437 3.552 1.00 . A A . 47 ALA HB3 1 1 13 12365 1 1 47 ALA N N 9.145 3.436 3.537 1.00 . A A . 47 ALA N 1 1 13 12366 1 1 47 ALA O O 10.365 6.783 3.797 1.00 . A A . 47 ALA O 1 1 13 12367 1 1 48 GLY C C 7.607 7.929 3.000 1.00 . A A . 48 GLY C 1 1 13 12368 1 1 48 GLY CA C 7.719 7.257 4.354 1.00 . A A . 48 GLY CA 1 1 13 12369 1 1 48 GLY H H 7.794 5.141 4.428 1.00 . A A . 48 GLY H 1 1 13 12370 1 1 48 GLY HA2 H 6.729 7.154 4.774 1.00 . A A . 48 GLY HA2 1 1 13 12371 1 1 48 GLY HA3 H 8.311 7.880 5.005 1.00 . A A . 48 GLY HA3 1 1 13 12372 1 1 48 GLY N N 8.333 5.945 4.274 1.00 . A A . 48 GLY N 1 1 13 12373 1 1 48 GLY O O 7.675 9.154 2.901 1.00 . A A . 48 GLY O 1 1 13 12374 1 1 49 ALA C C 6.003 8.419 0.424 1.00 . A A . 49 ALA C 1 1 13 12375 1 1 49 ALA CA C 7.312 7.658 0.599 1.00 . A A . 49 ALA CA 1 1 13 12376 1 1 49 ALA CB C 7.412 6.531 -0.419 1.00 . A A . 49 ALA CB 1 1 13 12377 1 1 49 ALA H H 7.388 6.160 2.093 1.00 . A A . 49 ALA H 1 1 13 12378 1 1 49 ALA HA H 8.136 8.337 0.431 1.00 . A A . 49 ALA HA 1 1 13 12379 1 1 49 ALA HB1 H 8.446 6.387 -0.697 1.00 . A A . 49 ALA HB1 1 1 13 12380 1 1 49 ALA HB2 H 6.836 6.788 -1.295 1.00 . A A . 49 ALA HB2 1 1 13 12381 1 1 49 ALA HB3 H 7.025 5.620 0.015 1.00 . A A . 49 ALA HB3 1 1 13 12382 1 1 49 ALA N N 7.435 7.128 1.953 1.00 . A A . 49 ALA N 1 1 13 12383 1 1 49 ALA O O 5.981 9.515 -0.137 1.00 . A A . 49 ALA O 1 1 13 12384 1 1 50 LEU C C 3.275 9.243 2.072 1.00 . A A . 50 LEU C 1 1 13 12385 1 1 50 LEU CA C 3.599 8.452 0.808 1.00 . A A . 50 LEU CA 1 1 13 12386 1 1 50 LEU CB C 2.526 7.388 0.568 1.00 . A A . 50 LEU CB 1 1 13 12387 1 1 50 LEU CD1 C 2.300 5.312 -0.825 1.00 . A A . 50 LEU CD1 1 1 13 12388 1 1 50 LEU CD2 C 1.370 7.482 -1.655 1.00 . A A . 50 LEU CD2 1 1 13 12389 1 1 50 LEU CG C 2.484 6.823 -0.854 1.00 . A A . 50 LEU CG 1 1 13 12390 1 1 50 LEU H H 4.998 6.958 1.347 1.00 . A A . 50 LEU H 1 1 13 12391 1 1 50 LEU HA H 3.617 9.131 -0.032 1.00 . A A . 50 LEU HA 1 1 13 12392 1 1 50 LEU HB2 H 2.700 6.573 1.255 1.00 . A A . 50 LEU HB2 1 1 13 12393 1 1 50 LEU HB3 H 1.563 7.822 0.788 1.00 . A A . 50 LEU HB3 1 1 13 12394 1 1 50 LEU HD11 H 1.641 5.013 -1.626 1.00 . A A . 50 LEU HD11 1 1 13 12395 1 1 50 LEU HD12 H 1.871 5.020 0.123 1.00 . A A . 50 LEU HD12 1 1 13 12396 1 1 50 LEU HD13 H 3.259 4.830 -0.948 1.00 . A A . 50 LEU HD13 1 1 13 12397 1 1 50 LEU HD21 H 0.996 6.786 -2.392 1.00 . A A . 50 LEU HD21 1 1 13 12398 1 1 50 LEU HD22 H 1.755 8.359 -2.155 1.00 . A A . 50 LEU HD22 1 1 13 12399 1 1 50 LEU HD23 H 0.568 7.768 -0.991 1.00 . A A . 50 LEU HD23 1 1 13 12400 1 1 50 LEU HG H 3.422 7.035 -1.347 1.00 . A A . 50 LEU HG 1 1 13 12401 1 1 50 LEU N N 4.914 7.831 0.909 1.00 . A A . 50 LEU N 1 1 13 12402 1 1 50 LEU O O 4.047 9.244 3.030 1.00 . A A . 50 LEU O 1 1 13 12403 1 1 51 LYS C C 0.302 10.313 3.665 1.00 . A A . 51 LYS C 1 1 13 12404 1 1 51 LYS CA C 1.704 10.712 3.213 1.00 . A A . 51 LYS CA 1 1 13 12405 1 1 51 LYS CB C 1.736 12.200 2.868 1.00 . A A . 51 LYS CB 1 1 13 12406 1 1 51 LYS CD C 0.604 14.014 1.550 1.00 . A A . 51 LYS CD 1 1 13 12407 1 1 51 LYS CE C -0.633 14.283 2.393 1.00 . A A . 51 LYS CE 1 1 13 12408 1 1 51 LYS CG C 0.994 12.545 1.588 1.00 . A A . 51 LYS CG 1 1 13 12409 1 1 51 LYS H H 1.554 9.878 1.273 1.00 . A A . 51 LYS H 1 1 13 12410 1 1 51 LYS HA H 2.396 10.523 4.020 1.00 . A A . 51 LYS HA 1 1 13 12411 1 1 51 LYS HB2 H 1.289 12.757 3.679 1.00 . A A . 51 LYS HB2 1 1 13 12412 1 1 51 LYS HB3 H 2.765 12.510 2.757 1.00 . A A . 51 LYS HB3 1 1 13 12413 1 1 51 LYS HD2 H 1.422 14.605 1.933 1.00 . A A . 51 LYS HD2 1 1 13 12414 1 1 51 LYS HD3 H 0.400 14.297 0.527 1.00 . A A . 51 LYS HD3 1 1 13 12415 1 1 51 LYS HE2 H -1.509 14.166 1.771 1.00 . A A . 51 LYS HE2 1 1 13 12416 1 1 51 LYS HE3 H -0.666 13.565 3.199 1.00 . A A . 51 LYS HE3 1 1 13 12417 1 1 51 LYS HG2 H 1.633 12.333 0.743 1.00 . A A . 51 LYS HG2 1 1 13 12418 1 1 51 LYS HG3 H 0.101 11.942 1.527 1.00 . A A . 51 LYS HG3 1 1 13 12419 1 1 51 LYS HZ1 H 0.270 15.833 3.462 1.00 . A A . 51 LYS HZ1 1 1 13 12420 1 1 51 LYS HZ2 H -1.410 15.765 3.641 1.00 . A A . 51 LYS HZ2 1 1 13 12421 1 1 51 LYS HZ3 H -0.738 16.361 2.209 1.00 . A A . 51 LYS HZ3 1 1 13 12422 1 1 51 LYS N N 2.129 9.916 2.067 1.00 . A A . 51 LYS N 1 1 13 12423 1 1 51 LYS NZ N -0.628 15.657 2.966 1.00 . A A . 51 LYS NZ 1 1 13 12424 1 1 51 LYS O O -0.639 10.308 2.871 1.00 . A A . 51 LYS O 1 1 13 12425 1 1 52 TYR C C -1.941 10.797 5.900 1.00 . A A . 52 TYR C 1 1 13 12426 1 1 52 TYR CA C -1.117 9.578 5.501 1.00 . A A . 52 TYR CA 1 1 13 12427 1 1 52 TYR CB C -0.913 8.669 6.716 1.00 . A A . 52 TYR CB 1 1 13 12428 1 1 52 TYR CD1 C -3.219 8.721 7.745 1.00 . A A . 52 TYR CD1 1 1 13 12429 1 1 52 TYR CD2 C -2.341 6.616 7.054 1.00 . A A . 52 TYR CD2 1 1 13 12430 1 1 52 TYR CE1 C -4.378 8.103 8.171 1.00 . A A . 52 TYR CE1 1 1 13 12431 1 1 52 TYR CE2 C -3.498 5.989 7.477 1.00 . A A . 52 TYR CE2 1 1 13 12432 1 1 52 TYR CG C -2.182 7.989 7.180 1.00 . A A . 52 TYR CG 1 1 13 12433 1 1 52 TYR CZ C -4.513 6.737 8.035 1.00 . A A . 52 TYR CZ 1 1 13 12434 1 1 52 TYR H H 0.958 10.001 5.528 1.00 . A A . 52 TYR H 1 1 13 12435 1 1 52 TYR HA H -1.651 9.032 4.740 1.00 . A A . 52 TYR HA 1 1 13 12436 1 1 52 TYR HB2 H -0.197 7.900 6.465 1.00 . A A . 52 TYR HB2 1 1 13 12437 1 1 52 TYR HB3 H -0.530 9.257 7.537 1.00 . A A . 52 TYR HB3 1 1 13 12438 1 1 52 TYR HD1 H -3.112 9.789 7.849 1.00 . A A . 52 TYR HD1 1 1 13 12439 1 1 52 TYR HD2 H -1.544 6.032 6.617 1.00 . A A . 52 TYR HD2 1 1 13 12440 1 1 52 TYR HE1 H -5.173 8.690 8.606 1.00 . A A . 52 TYR HE1 1 1 13 12441 1 1 52 TYR HE2 H -3.603 4.920 7.370 1.00 . A A . 52 TYR HE2 1 1 13 12442 1 1 52 TYR HH H -6.390 6.746 8.466 1.00 . A A . 52 TYR HH 1 1 13 12443 1 1 52 TYR N N 0.172 9.978 4.945 1.00 . A A . 52 TYR N 1 1 13 12444 1 1 52 TYR O O -1.565 11.547 6.801 1.00 . A A . 52 TYR O 1 1 13 12445 1 1 52 TYR OH O -5.667 6.115 8.458 1.00 . A A . 52 TYR OH 1 1 13 12446 1 1 53 GLN C C -5.230 11.631 6.191 1.00 . A A . 53 GLN C 1 1 13 12447 1 1 53 GLN CA C -3.953 12.111 5.512 1.00 . A A . 53 GLN CA 1 1 13 12448 1 1 53 GLN CB C -4.295 12.862 4.224 1.00 . A A . 53 GLN CB 1 1 13 12449 1 1 53 GLN CD C -4.534 12.241 1.787 1.00 . A A . 53 GLN CD 1 1 13 12450 1 1 53 GLN CG C -5.031 12.012 3.201 1.00 . A A . 53 GLN CG 1 1 13 12451 1 1 53 GLN H H -3.318 10.352 4.521 1.00 . A A . 53 GLN H 1 1 13 12452 1 1 53 GLN HA H -3.433 12.779 6.183 1.00 . A A . 53 GLN HA 1 1 13 12453 1 1 53 GLN HB2 H -4.918 13.710 4.471 1.00 . A A . 53 GLN HB2 1 1 13 12454 1 1 53 GLN HB3 H -3.380 13.216 3.775 1.00 . A A . 53 GLN HB3 1 1 13 12455 1 1 53 GLN HE21 H -6.266 13.080 1.286 1.00 . A A . 53 GLN HE21 1 1 13 12456 1 1 53 GLN HE22 H -5.084 12.990 0.029 1.00 . A A . 53 GLN HE22 1 1 13 12457 1 1 53 GLN HG2 H -4.893 10.971 3.450 1.00 . A A . 53 GLN HG2 1 1 13 12458 1 1 53 GLN HG3 H -6.083 12.254 3.241 1.00 . A A . 53 GLN HG3 1 1 13 12459 1 1 53 GLN N N -3.070 10.987 5.226 1.00 . A A . 53 GLN N 1 1 13 12460 1 1 53 GLN NE2 N -5.380 12.831 0.950 1.00 . A A . 53 GLN NE2 1 1 13 12461 1 1 53 GLN O O -5.798 10.607 5.811 1.00 . A A . 53 GLN O 1 1 13 12462 1 1 53 GLN OE1 O -3.401 11.894 1.451 1.00 . A A . 53 GLN OE1 1 1 13 12463 1 1 54 GLU C C -8.124 12.650 7.305 1.00 . A A . 54 GLU C 1 1 13 12464 1 1 54 GLU CA C -6.885 12.016 7.935 1.00 . A A . 54 GLU CA 1 1 13 12465 1 1 54 GLU CB C -6.755 12.444 9.400 1.00 . A A . 54 GLU CB 1 1 13 12466 1 1 54 GLU CD C -6.623 11.712 11.816 1.00 . A A . 54 GLU CD 1 1 13 12467 1 1 54 GLU CG C -6.631 11.275 10.364 1.00 . A A . 54 GLU CG 1 1 13 12468 1 1 54 GLU H H -5.179 13.176 7.459 1.00 . A A . 54 GLU H 1 1 13 12469 1 1 54 GLU HA H -6.989 10.943 7.894 1.00 . A A . 54 GLU HA 1 1 13 12470 1 1 54 GLU HB2 H -5.877 13.063 9.506 1.00 . A A . 54 GLU HB2 1 1 13 12471 1 1 54 GLU HB3 H -7.626 13.019 9.680 1.00 . A A . 54 GLU HB3 1 1 13 12472 1 1 54 GLU HG2 H -7.465 10.607 10.211 1.00 . A A . 54 GLU HG2 1 1 13 12473 1 1 54 GLU HG3 H -5.709 10.751 10.157 1.00 . A A . 54 GLU HG3 1 1 13 12474 1 1 54 GLU N N -5.677 12.373 7.200 1.00 . A A . 54 GLU N 1 1 13 12475 1 1 54 GLU O O -8.985 13.187 8.004 1.00 . A A . 54 GLU O 1 1 13 12476 1 1 54 GLU OE1 O -7.718 11.911 12.382 1.00 . A A . 54 GLU OE1 1 1 13 12477 1 1 54 GLU OE2 O -5.521 11.859 12.386 1.00 . A A . 54 GLU OE2 1 1 13 12478 1 1 55 ASN C C -10.450 12.102 5.108 1.00 . A A . 55 ASN C 1 1 13 12479 1 1 55 ASN CA C -9.352 13.141 5.264 1.00 . A A . 55 ASN CA 1 1 13 12480 1 1 55 ASN CB C -8.916 13.652 3.889 1.00 . A A . 55 ASN CB 1 1 13 12481 1 1 55 ASN CG C -8.135 14.948 3.975 1.00 . A A . 55 ASN CG 1 1 13 12482 1 1 55 ASN H H -7.503 12.135 5.475 1.00 . A A . 55 ASN H 1 1 13 12483 1 1 55 ASN HA H -9.731 13.968 5.842 1.00 . A A . 55 ASN HA 1 1 13 12484 1 1 55 ASN HB2 H -8.293 12.908 3.416 1.00 . A A . 55 ASN HB2 1 1 13 12485 1 1 55 ASN HB3 H -9.793 13.821 3.280 1.00 . A A . 55 ASN HB3 1 1 13 12486 1 1 55 ASN HD21 H -6.639 14.143 2.940 1.00 . A A . 55 ASN HD21 1 1 13 12487 1 1 55 ASN HD22 H -6.415 15.784 3.430 1.00 . A A . 55 ASN HD22 1 1 13 12488 1 1 55 ASN N N -8.215 12.580 5.980 1.00 . A A . 55 ASN N 1 1 13 12489 1 1 55 ASN ND2 N -6.943 14.960 3.389 1.00 . A A . 55 ASN ND2 1 1 13 12490 1 1 55 ASN O O -11.470 12.156 5.797 1.00 . A A . 55 ASN O 1 1 13 12491 1 1 55 ASN OD1 O -8.596 15.926 4.561 1.00 . A A . 55 ASN OD1 1 1 13 12492 1 1 56 ALA C C -11.330 9.159 5.163 1.00 . A A . 56 ALA C 1 1 13 12493 1 1 56 ALA CA C -11.220 10.095 3.961 1.00 . A A . 56 ALA CA 1 1 13 12494 1 1 56 ALA CB C -10.850 9.309 2.712 1.00 . A A . 56 ALA CB 1 1 13 12495 1 1 56 ALA H H -9.414 11.159 3.687 1.00 . A A . 56 ALA H 1 1 13 12496 1 1 56 ALA HA H -12.180 10.561 3.793 1.00 . A A . 56 ALA HA 1 1 13 12497 1 1 56 ALA HB1 H -9.777 9.299 2.601 1.00 . A A . 56 ALA HB1 1 1 13 12498 1 1 56 ALA HB2 H -11.290 9.779 1.847 1.00 . A A . 56 ALA HB2 1 1 13 12499 1 1 56 ALA HB3 H -11.210 8.298 2.801 1.00 . A A . 56 ALA HB3 1 1 13 12500 1 1 56 ALA N N -10.240 11.152 4.203 1.00 . A A . 56 ALA N 1 1 13 12501 1 1 56 ALA O O -12.260 8.366 5.259 1.00 . A A . 56 ALA O 1 1 13 12502 1 1 57 TYR C C -11.120 9.076 8.419 1.00 . A A . 57 TYR C 1 1 13 12503 1 1 57 TYR CA C -10.350 8.419 7.272 1.00 . A A . 57 TYR CA 1 1 13 12504 1 1 57 TYR CB C -8.918 8.143 7.704 1.00 . A A . 57 TYR CB 1 1 13 12505 1 1 57 TYR CD1 C -8.559 6.454 5.863 1.00 . A A . 57 TYR CD1 1 1 13 12506 1 1 57 TYR CD2 C -6.796 7.982 6.348 1.00 . A A . 57 TYR CD2 1 1 13 12507 1 1 57 TYR CE1 C -7.792 5.878 4.868 1.00 . A A . 57 TYR CE1 1 1 13 12508 1 1 57 TYR CE2 C -6.023 7.413 5.354 1.00 . A A . 57 TYR CE2 1 1 13 12509 1 1 57 TYR CG C -8.074 7.514 6.619 1.00 . A A . 57 TYR CG 1 1 13 12510 1 1 57 TYR CZ C -6.525 6.361 4.618 1.00 . A A . 57 TYR CZ 1 1 13 12511 1 1 57 TYR H H -9.649 9.905 5.949 1.00 . A A . 57 TYR H 1 1 13 12512 1 1 57 TYR HA H -10.830 7.480 7.025 1.00 . A A . 57 TYR HA 1 1 13 12513 1 1 57 TYR HB2 H -8.451 9.075 7.988 1.00 . A A . 57 TYR HB2 1 1 13 12514 1 1 57 TYR HB3 H -8.924 7.476 8.552 1.00 . A A . 57 TYR HB3 1 1 13 12515 1 1 57 TYR HD1 H -9.551 6.080 6.061 1.00 . A A . 57 TYR HD1 1 1 13 12516 1 1 57 TYR HD2 H -6.405 8.808 6.927 1.00 . A A . 57 TYR HD2 1 1 13 12517 1 1 57 TYR HE1 H -8.186 5.055 4.292 1.00 . A A . 57 TYR HE1 1 1 13 12518 1 1 57 TYR HE2 H -5.029 7.790 5.158 1.00 . A A . 57 TYR HE2 1 1 13 12519 1 1 57 TYR HH H -6.326 5.491 2.914 1.00 . A A . 57 TYR HH 1 1 13 12520 1 1 57 TYR N N -10.360 9.256 6.078 1.00 . A A . 57 TYR N 1 1 13 12521 1 1 57 TYR O O -11.030 8.637 9.567 1.00 . A A . 57 TYR O 1 1 13 12522 1 1 57 TYR OH O -5.758 5.790 3.627 1.00 . A A . 57 TYR OH 1 1 13 12523 1 1 58 ARG C C -14.130 10.856 8.759 1.00 . A A . 58 ARG C 1 1 13 12524 1 1 58 ARG CA C -12.650 10.838 9.122 1.00 . A A . 58 ARG CA 1 1 13 12525 1 1 58 ARG CB C -12.130 12.270 9.278 1.00 . A A . 58 ARG CB 1 1 13 12526 1 1 58 ARG CD C -11.020 11.755 11.472 1.00 . A A . 58 ARG CD 1 1 13 12527 1 1 58 ARG CG C -11.950 12.697 10.726 1.00 . A A . 58 ARG CG 1 1 13 12528 1 1 58 ARG CZ C -12.380 10.985 13.382 1.00 . A A . 58 ARG CZ 1 1 13 12529 1 1 58 ARG H H -11.910 10.438 7.182 1.00 . A A . 58 ARG H 1 1 13 12530 1 1 58 ARG HA H -12.530 10.315 10.058 1.00 . A A . 58 ARG HA 1 1 13 12531 1 1 58 ARG HB2 H -11.170 12.349 8.781 1.00 . A A . 58 ARG HB2 1 1 13 12532 1 1 58 ARG HB3 H -12.830 12.947 8.808 1.00 . A A . 58 ARG HB3 1 1 13 12533 1 1 58 ARG HD2 H -10.380 11.261 10.758 1.00 . A A . 58 ARG HD2 1 1 13 12534 1 1 58 ARG HD3 H -10.420 12.334 12.156 1.00 . A A . 58 ARG HD3 1 1 13 12535 1 1 58 ARG HE H -11.790 9.837 11.857 1.00 . A A . 58 ARG HE 1 1 13 12536 1 1 58 ARG HG2 H -11.530 13.691 10.747 1.00 . A A . 58 ARG HG2 1 1 13 12537 1 1 58 ARG HG3 H -12.920 12.698 11.211 1.00 . A A . 58 ARG HG3 1 1 13 12538 1 1 58 ARG HH11 H -11.870 12.941 13.451 1.00 . A A . 58 ARG HH11 1 1 13 12539 1 1 58 ARG HH12 H -12.820 12.374 14.782 1.00 . A A . 58 ARG HH12 1 1 13 12540 1 1 58 ARG HH21 H -13.040 9.091 13.607 1.00 . A A . 58 ARG HH21 1 1 13 12541 1 1 58 ARG HH22 H -13.490 10.189 14.871 1.00 . A A . 58 ARG HH22 1 1 13 12542 1 1 58 ARG N N -11.870 10.128 8.110 1.00 . A A . 58 ARG N 1 1 13 12543 1 1 58 ARG NE N -11.760 10.744 12.229 1.00 . A A . 58 ARG NE 1 1 13 12544 1 1 58 ARG NH1 N -12.350 12.200 13.915 1.00 . A A . 58 ARG NH1 1 1 13 12545 1 1 58 ARG NH2 N -13.020 10.008 14.005 1.00 . A A . 58 ARG NH2 1 1 13 12546 1 1 58 ARG O O -14.590 11.716 8.005 1.00 . A A . 58 ARG O 1 1 13 12547 1 1 59 GLN C C -17.100 10.635 10.044 1.00 . A A . 59 GLN C 1 1 13 12548 1 1 59 GLN CA C -16.310 9.807 9.037 1.00 . A A . 59 GLN CA 1 1 13 12549 1 1 59 GLN CB C -16.760 8.347 9.083 1.00 . A A . 59 GLN CB 1 1 13 12550 1 1 59 GLN CD C -17.390 6.721 10.909 1.00 . A A . 59 GLN CD 1 1 13 12551 1 1 59 GLN CG C -16.310 7.608 10.331 1.00 . A A . 59 GLN CG 1 1 13 12552 1 1 59 GLN H H -14.460 9.244 9.896 1.00 . A A . 59 GLN H 1 1 13 12553 1 1 59 GLN HA H -16.490 10.200 8.047 1.00 . A A . 59 GLN HA 1 1 13 12554 1 1 59 GLN HB2 H -17.840 8.315 9.043 1.00 . A A . 59 GLN HB2 1 1 13 12555 1 1 59 GLN HB3 H -16.370 7.832 8.220 1.00 . A A . 59 GLN HB3 1 1 13 12556 1 1 59 GLN HE21 H -16.220 6.232 12.435 1.00 . A A . 59 GLN HE21 1 1 13 12557 1 1 59 GLN HE22 H -17.790 5.510 12.438 1.00 . A A . 59 GLN HE22 1 1 13 12558 1 1 59 GLN HG2 H -15.460 6.992 10.081 1.00 . A A . 59 GLN HG2 1 1 13 12559 1 1 59 GLN HG3 H -16.020 8.333 11.078 1.00 . A A . 59 GLN HG3 1 1 13 12560 1 1 59 GLN N N -14.880 9.901 9.302 1.00 . A A . 59 GLN N 1 1 13 12561 1 1 59 GLN NE2 N -17.100 6.091 12.042 1.00 . A A . 59 GLN NE2 1 1 13 12562 1 1 59 GLN O O -17.930 10.104 10.784 1.00 . A A . 59 GLN O 1 1 13 12563 1 1 59 GLN OE1 O -18.480 6.602 10.345 1.00 . A A . 59 GLN OE1 1 1 13 12564 1 1 60 ALA C C -18.610 13.635 10.259 1.00 . A A . 60 ALA C 1 1 13 12565 1 1 60 ALA CA C -17.530 12.838 10.983 1.00 . A A . 60 ALA CA 1 1 13 12566 1 1 60 ALA CB C -16.540 13.776 11.649 1.00 . A A . 60 ALA CB 1 1 13 12567 1 1 60 ALA H H -16.170 12.301 9.453 1.00 . A A . 60 ALA H 1 1 13 12568 1 1 60 ALA HA H -18.000 12.239 11.753 1.00 . A A . 60 ALA HA 1 1 13 12569 1 1 60 ALA HB1 H -16.580 14.743 11.167 1.00 . A A . 60 ALA HB1 1 1 13 12570 1 1 60 ALA HB2 H -15.540 13.369 11.555 1.00 . A A . 60 ALA HB2 1 1 13 12571 1 1 60 ALA HB3 H -16.790 13.883 12.694 1.00 . A A . 60 ALA HB3 1 1 13 12572 1 1 60 ALA N N -16.840 11.938 10.068 1.00 . A A . 60 ALA N 1 1 13 12573 1 1 60 ALA O O -18.900 14.776 10.620 1.00 . A A . 60 ALA O 1 1 13 12574 1 1 61 ALA C C -21.250 12.661 7.918 1.00 . A A . 61 ALA C 1 1 13 12575 1 1 61 ALA CA C -20.260 13.679 8.464 1.00 . A A . 61 ALA CA 1 1 13 12576 1 1 61 ALA CB C -19.650 14.488 7.327 1.00 . A A . 61 ALA CB 1 1 13 12577 1 1 61 ALA H H -18.930 12.116 8.997 1.00 . A A . 61 ALA H 1 1 13 12578 1 1 61 ALA HA H -20.780 14.361 9.120 1.00 . A A . 61 ALA HA 1 1 13 12579 1 1 61 ALA HB1 H -18.600 14.661 7.530 1.00 . A A . 61 ALA HB1 1 1 13 12580 1 1 61 ALA HB2 H -20.160 15.436 7.246 1.00 . A A . 61 ALA HB2 1 1 13 12581 1 1 61 ALA HB3 H -19.750 13.944 6.401 1.00 . A A . 61 ALA HB3 1 1 13 12582 1 1 61 ALA N N -19.210 13.026 9.238 1.00 . A A . 61 ALA N 1 1 13 12583 1 1 61 ALA O O -20.820 11.534 7.589 1.00 . A A . 61 ALA O 1 1 13 12584 1 1 61 ALA OXT O -22.450 12.998 7.823 1.00 . A A . 61 ALA OXT 1 1 14 12585 1 1 1 MET C C -5.202 6.121 -0.589 1.00 . A A . 1 MET C 1 1 14 12586 1 1 1 MET CA C -4.452 6.973 0.430 1.00 . A A . 1 MET CA 1 1 14 12587 1 1 1 MET CB C -3.689 6.080 1.412 1.00 . A A . 1 MET CB 1 1 14 12588 1 1 1 MET CE C 0.051 6.559 2.897 1.00 . A A . 1 MET CE 1 1 14 12589 1 1 1 MET CG C -2.179 6.197 1.292 1.00 . A A . 1 MET CG 1 1 14 12590 1 1 1 MET H1 H -5.910 7.220 1.861 1.00 . A A . 1 MET H1 1 1 14 12591 1 1 1 MET H2 H -6.028 8.291 0.524 1.00 . A A . 1 MET H2 1 1 14 12592 1 1 1 MET H3 H -4.819 8.534 1.718 1.00 . A A . 1 MET H3 1 1 14 12593 1 1 1 MET HA H -3.752 7.608 -0.089 1.00 . A A . 1 MET HA 1 1 14 12594 1 1 1 MET HB2 H -3.970 6.348 2.419 1.00 . A A . 1 MET HB2 1 1 14 12595 1 1 1 MET HB3 H -3.963 5.049 1.234 1.00 . A A . 1 MET HB3 1 1 14 12596 1 1 1 MET HE1 H 0.140 6.514 3.972 1.00 . A A . 1 MET HE1 1 1 14 12597 1 1 1 MET HE2 H 0.884 7.112 2.490 1.00 . A A . 1 MET HE2 1 1 14 12598 1 1 1 MET HE3 H 0.050 5.558 2.491 1.00 . A A . 1 MET HE3 1 1 14 12599 1 1 1 MET HG2 H -1.739 5.228 1.477 1.00 . A A . 1 MET HG2 1 1 14 12600 1 1 1 MET HG3 H -1.935 6.516 0.289 1.00 . A A . 1 MET HG3 1 1 14 12601 1 1 1 MET N N -5.386 7.832 1.203 1.00 . A A . 1 MET N 1 1 14 12602 1 1 1 MET O O -6.039 5.294 -0.226 1.00 . A A . 1 MET O 1 1 14 12603 1 1 1 MET SD S -1.481 7.381 2.460 1.00 . A A . 1 MET SD 1 1 14 12604 1 1 2 TYR C C -4.782 4.296 -3.240 1.00 . A A . 2 TYR C 1 1 14 12605 1 1 2 TYR CA C -5.542 5.581 -2.937 1.00 . A A . 2 TYR CA 1 1 14 12606 1 1 2 TYR CB C -5.642 6.439 -4.200 1.00 . A A . 2 TYR CB 1 1 14 12607 1 1 2 TYR CD1 C -7.354 7.974 -3.158 1.00 . A A . 2 TYR CD1 1 1 14 12608 1 1 2 TYR CD2 C -7.641 7.351 -5.441 1.00 . A A . 2 TYR CD2 1 1 14 12609 1 1 2 TYR CE1 C -8.507 8.733 -3.217 1.00 . A A . 2 TYR CE1 1 1 14 12610 1 1 2 TYR CE2 C -8.794 8.110 -5.508 1.00 . A A . 2 TYR CE2 1 1 14 12611 1 1 2 TYR CG C -6.903 7.271 -4.268 1.00 . A A . 2 TYR CG 1 1 14 12612 1 1 2 TYR CZ C -9.224 8.798 -4.394 1.00 . A A . 2 TYR CZ 1 1 14 12613 1 1 2 TYR H H -4.221 7.003 -2.092 1.00 . A A . 2 TYR H 1 1 14 12614 1 1 2 TYR HA H -6.539 5.326 -2.608 1.00 . A A . 2 TYR HA 1 1 14 12615 1 1 2 TYR HB2 H -4.799 7.113 -4.235 1.00 . A A . 2 TYR HB2 1 1 14 12616 1 1 2 TYR HB3 H -5.619 5.795 -5.066 1.00 . A A . 2 TYR HB3 1 1 14 12617 1 1 2 TYR HD1 H -6.793 7.921 -2.237 1.00 . A A . 2 TYR HD1 1 1 14 12618 1 1 2 TYR HD2 H -7.303 6.811 -6.314 1.00 . A A . 2 TYR HD2 1 1 14 12619 1 1 2 TYR HE1 H -8.843 9.273 -2.343 1.00 . A A . 2 TYR HE1 1 1 14 12620 1 1 2 TYR HE2 H -9.355 8.161 -6.430 1.00 . A A . 2 TYR HE2 1 1 14 12621 1 1 2 TYR HH H -10.860 9.458 -3.637 1.00 . A A . 2 TYR HH 1 1 14 12622 1 1 2 TYR N N -4.897 6.329 -1.866 1.00 . A A . 2 TYR N 1 1 14 12623 1 1 2 TYR O O -3.554 4.252 -3.156 1.00 . A A . 2 TYR O 1 1 14 12624 1 1 2 TYR OH O -10.370 9.555 -4.455 1.00 . A A . 2 TYR OH 1 1 14 12625 1 1 3 LYS C C -3.987 2.064 -5.106 1.00 . A A . 3 LYS C 1 1 14 12626 1 1 3 LYS CA C -4.920 1.957 -3.902 1.00 . A A . 3 LYS CA 1 1 14 12627 1 1 3 LYS CB C -6.013 0.922 -4.180 1.00 . A A . 3 LYS CB 1 1 14 12628 1 1 3 LYS CD C -6.309 -1.158 -5.558 1.00 . A A . 3 LYS CD 1 1 14 12629 1 1 3 LYS CE C -6.067 -2.660 -5.563 1.00 . A A . 3 LYS CE 1 1 14 12630 1 1 3 LYS CG C -5.475 -0.464 -4.493 1.00 . A A . 3 LYS CG 1 1 14 12631 1 1 3 LYS H H -6.495 3.346 -3.636 1.00 . A A . 3 LYS H 1 1 14 12632 1 1 3 LYS HA H -4.348 1.641 -3.045 1.00 . A A . 3 LYS HA 1 1 14 12633 1 1 3 LYS HB2 H -6.651 0.848 -3.311 1.00 . A A . 3 LYS HB2 1 1 14 12634 1 1 3 LYS HB3 H -6.603 1.255 -5.021 1.00 . A A . 3 LYS HB3 1 1 14 12635 1 1 3 LYS HD2 H -7.354 -0.973 -5.359 1.00 . A A . 3 LYS HD2 1 1 14 12636 1 1 3 LYS HD3 H -6.048 -0.757 -6.526 1.00 . A A . 3 LYS HD3 1 1 14 12637 1 1 3 LYS HE2 H -5.603 -2.941 -4.630 1.00 . A A . 3 LYS HE2 1 1 14 12638 1 1 3 LYS HE3 H -7.019 -3.163 -5.655 1.00 . A A . 3 LYS HE3 1 1 14 12639 1 1 3 LYS HG2 H -4.460 -0.373 -4.849 1.00 . A A . 3 LYS HG2 1 1 14 12640 1 1 3 LYS HG3 H -5.491 -1.058 -3.592 1.00 . A A . 3 LYS HG3 1 1 14 12641 1 1 3 LYS HZ1 H -5.626 -3.860 -7.215 1.00 . A A . 3 LYS HZ1 1 1 14 12642 1 1 3 LYS HZ2 H -4.267 -3.398 -6.322 1.00 . A A . 3 LYS HZ2 1 1 14 12643 1 1 3 LYS HZ3 H -5.029 -2.282 -7.337 1.00 . A A . 3 LYS HZ3 1 1 14 12644 1 1 3 LYS N N -5.521 3.248 -3.589 1.00 . A A . 3 LYS N 1 1 14 12645 1 1 3 LYS NZ N -5.186 -3.078 -6.689 1.00 . A A . 3 LYS NZ 1 1 14 12646 1 1 3 LYS O O -2.894 1.498 -5.107 1.00 . A A . 3 LYS O 1 1 14 12647 1 1 4 LYS C C -2.232 3.491 -7.017 1.00 . A A . 4 LYS C 1 1 14 12648 1 1 4 LYS CA C -3.631 2.970 -7.341 1.00 . A A . 4 LYS CA 1 1 14 12649 1 1 4 LYS CB C -4.335 3.935 -8.297 1.00 . A A . 4 LYS CB 1 1 14 12650 1 1 4 LYS CD C -4.695 4.649 -10.679 1.00 . A A . 4 LYS CD 1 1 14 12651 1 1 4 LYS CE C -4.837 3.926 -12.008 1.00 . A A . 4 LYS CE 1 1 14 12652 1 1 4 LYS CG C -3.801 3.880 -9.720 1.00 . A A . 4 LYS CG 1 1 14 12653 1 1 4 LYS H H -5.306 3.216 -6.069 1.00 . A A . 4 LYS H 1 1 14 12654 1 1 4 LYS HA H -3.540 2.007 -7.820 1.00 . A A . 4 LYS HA 1 1 14 12655 1 1 4 LYS HB2 H -5.387 3.694 -8.322 1.00 . A A . 4 LYS HB2 1 1 14 12656 1 1 4 LYS HB3 H -4.214 4.942 -7.928 1.00 . A A . 4 LYS HB3 1 1 14 12657 1 1 4 LYS HD2 H -5.674 4.758 -10.235 1.00 . A A . 4 LYS HD2 1 1 14 12658 1 1 4 LYS HD3 H -4.266 5.625 -10.852 1.00 . A A . 4 LYS HD3 1 1 14 12659 1 1 4 LYS HE2 H -4.812 2.861 -11.829 1.00 . A A . 4 LYS HE2 1 1 14 12660 1 1 4 LYS HE3 H -5.786 4.194 -12.450 1.00 . A A . 4 LYS HE3 1 1 14 12661 1 1 4 LYS HG2 H -2.814 4.314 -9.739 1.00 . A A . 4 LYS HG2 1 1 14 12662 1 1 4 LYS HG3 H -3.751 2.849 -10.037 1.00 . A A . 4 LYS HG3 1 1 14 12663 1 1 4 LYS HZ1 H -2.860 3.812 -12.673 1.00 . A A . 4 LYS HZ1 1 1 14 12664 1 1 4 LYS HZ2 H -3.590 5.312 -12.951 1.00 . A A . 4 LYS HZ2 1 1 14 12665 1 1 4 LYS HZ3 H -3.993 3.985 -13.918 1.00 . A A . 4 LYS HZ3 1 1 14 12666 1 1 4 LYS N N -4.425 2.790 -6.128 1.00 . A A . 4 LYS N 1 1 14 12667 1 1 4 LYS NZ N -3.743 4.285 -12.954 1.00 . A A . 4 LYS NZ 1 1 14 12668 1 1 4 LYS O O -1.288 3.275 -7.779 1.00 . A A . 4 LYS O 1 1 14 12669 1 1 5 ASP C C 0.093 3.637 -4.915 1.00 . A A . 5 ASP C 1 1 14 12670 1 1 5 ASP CA C -0.819 4.728 -5.469 1.00 . A A . 5 ASP CA 1 1 14 12671 1 1 5 ASP CB C -1.027 5.816 -4.413 1.00 . A A . 5 ASP CB 1 1 14 12672 1 1 5 ASP CG C -1.761 7.024 -4.963 1.00 . A A . 5 ASP CG 1 1 14 12673 1 1 5 ASP H H -2.891 4.318 -5.320 1.00 . A A . 5 ASP H 1 1 14 12674 1 1 5 ASP HA H -0.349 5.167 -6.335 1.00 . A A . 5 ASP HA 1 1 14 12675 1 1 5 ASP HB2 H -1.604 5.411 -3.595 1.00 . A A . 5 ASP HB2 1 1 14 12676 1 1 5 ASP HB3 H -0.064 6.140 -4.043 1.00 . A A . 5 ASP HB3 1 1 14 12677 1 1 5 ASP N N -2.104 4.177 -5.885 1.00 . A A . 5 ASP N 1 1 14 12678 1 1 5 ASP O O 1.263 3.547 -5.285 1.00 . A A . 5 ASP O 1 1 14 12679 1 1 5 ASP OD1 O -2.690 6.835 -5.776 1.00 . A A . 5 ASP OD1 1 1 14 12680 1 1 5 ASP OD2 O -1.407 8.160 -4.580 1.00 . A A . 5 ASP OD2 1 1 14 12681 1 1 6 VAL C C 0.924 0.823 -4.477 1.00 . A A . 6 VAL C 1 1 14 12682 1 1 6 VAL CA C 0.304 1.731 -3.419 1.00 . A A . 6 VAL CA 1 1 14 12683 1 1 6 VAL CB C -0.590 0.887 -2.492 1.00 . A A . 6 VAL CB 1 1 14 12684 1 1 6 VAL CG1 C 0.265 0.081 -1.544 1.00 . A A . 6 VAL CG1 1 1 14 12685 1 1 6 VAL CG2 C -1.561 1.767 -1.716 1.00 . A A . 6 VAL CG2 1 1 14 12686 1 1 6 VAL H H -1.383 2.931 -3.768 1.00 . A A . 6 VAL H 1 1 14 12687 1 1 6 VAL HA H 1.094 2.167 -2.823 1.00 . A A . 6 VAL HA 1 1 14 12688 1 1 6 VAL HB H -1.162 0.204 -3.102 1.00 . A A . 6 VAL HB 1 1 14 12689 1 1 6 VAL HG11 H 1.044 0.711 -1.148 1.00 . A A . 6 VAL HG11 1 1 14 12690 1 1 6 VAL HG12 H 0.703 -0.749 -2.075 1.00 . A A . 6 VAL HG12 1 1 14 12691 1 1 6 VAL HG13 H -0.347 -0.289 -0.736 1.00 . A A . 6 VAL HG13 1 1 14 12692 1 1 6 VAL HG21 H -1.893 1.243 -0.832 1.00 . A A . 6 VAL HG21 1 1 14 12693 1 1 6 VAL HG22 H -2.413 1.998 -2.337 1.00 . A A . 6 VAL HG22 1 1 14 12694 1 1 6 VAL HG23 H -1.065 2.683 -1.429 1.00 . A A . 6 VAL HG23 1 1 14 12695 1 1 6 VAL N N -0.450 2.812 -4.026 1.00 . A A . 6 VAL N 1 1 14 12696 1 1 6 VAL O O 2.139 0.626 -4.504 1.00 . A A . 6 VAL O 1 1 14 12697 1 1 7 ILE C C 1.542 0.109 -7.323 1.00 . A A . 7 ILE C 1 1 14 12698 1 1 7 ILE CA C 0.550 -0.609 -6.408 1.00 . A A . 7 ILE CA 1 1 14 12699 1 1 7 ILE CB C -0.631 -1.152 -7.247 1.00 . A A . 7 ILE CB 1 1 14 12700 1 1 7 ILE CD1 C -2.330 -1.544 -5.392 1.00 . A A . 7 ILE CD1 1 1 14 12701 1 1 7 ILE CG1 C -1.432 -2.172 -6.435 1.00 . A A . 7 ILE CG1 1 1 14 12702 1 1 7 ILE CG2 C -0.135 -1.780 -8.544 1.00 . A A . 7 ILE CG2 1 1 14 12703 1 1 7 ILE H H -0.875 0.472 -5.277 1.00 . A A . 7 ILE H 1 1 14 12704 1 1 7 ILE HA H 1.048 -1.448 -5.943 1.00 . A A . 7 ILE HA 1 1 14 12705 1 1 7 ILE HB H -1.272 -0.322 -7.501 1.00 . A A . 7 ILE HB 1 1 14 12706 1 1 7 ILE HD11 H -2.729 -0.617 -5.774 1.00 . A A . 7 ILE HD11 1 1 14 12707 1 1 7 ILE HD12 H -1.760 -1.350 -4.495 1.00 . A A . 7 ILE HD12 1 1 14 12708 1 1 7 ILE HD13 H -3.143 -2.218 -5.164 1.00 . A A . 7 ILE HD13 1 1 14 12709 1 1 7 ILE HG12 H -2.054 -2.747 -7.104 1.00 . A A . 7 ILE HG12 1 1 14 12710 1 1 7 ILE HG13 H -0.747 -2.835 -5.926 1.00 . A A . 7 ILE HG13 1 1 14 12711 1 1 7 ILE HG21 H -0.967 -2.228 -9.067 1.00 . A A . 7 ILE HG21 1 1 14 12712 1 1 7 ILE HG22 H 0.600 -2.538 -8.319 1.00 . A A . 7 ILE HG22 1 1 14 12713 1 1 7 ILE HG23 H 0.312 -1.017 -9.165 1.00 . A A . 7 ILE HG23 1 1 14 12714 1 1 7 ILE N N 0.083 0.276 -5.349 1.00 . A A . 7 ILE N 1 1 14 12715 1 1 7 ILE O O 2.384 -0.527 -7.959 1.00 . A A . 7 ILE O 1 1 14 12716 1 1 8 ASP C C 3.704 2.345 -7.540 1.00 . A A . 8 ASP C 1 1 14 12717 1 1 8 ASP CA C 2.340 2.228 -8.205 1.00 . A A . 8 ASP CA 1 1 14 12718 1 1 8 ASP CB C 1.747 3.621 -8.444 1.00 . A A . 8 ASP CB 1 1 14 12719 1 1 8 ASP CG C 1.287 3.814 -9.876 1.00 . A A . 8 ASP CG 1 1 14 12720 1 1 8 ASP H H 0.764 1.885 -6.843 1.00 . A A . 8 ASP H 1 1 14 12721 1 1 8 ASP HA H 2.454 1.724 -9.154 1.00 . A A . 8 ASP HA 1 1 14 12722 1 1 8 ASP HB2 H 0.898 3.760 -7.792 1.00 . A A . 8 ASP HB2 1 1 14 12723 1 1 8 ASP HB3 H 2.495 4.368 -8.221 1.00 . A A . 8 ASP HB3 1 1 14 12724 1 1 8 ASP N N 1.445 1.432 -7.377 1.00 . A A . 8 ASP N 1 1 14 12725 1 1 8 ASP O O 4.727 2.488 -8.211 1.00 . A A . 8 ASP O 1 1 14 12726 1 1 8 ASP OD1 O 0.670 2.882 -10.432 1.00 . A A . 8 ASP OD1 1 1 14 12727 1 1 8 ASP OD2 O 1.544 4.899 -10.440 1.00 . A A . 8 ASP OD2 1 1 14 12728 1 1 9 HIS C C 5.545 0.977 -5.241 1.00 . A A . 9 HIS C 1 1 14 12729 1 1 9 HIS CA C 4.943 2.365 -5.448 1.00 . A A . 9 HIS CA 1 1 14 12730 1 1 9 HIS CB C 4.678 3.038 -4.094 1.00 . A A . 9 HIS CB 1 1 14 12731 1 1 9 HIS CD2 C 6.405 1.827 -2.575 1.00 . A A . 9 HIS CD2 1 1 14 12732 1 1 9 HIS CE1 C 7.393 3.594 -1.736 1.00 . A A . 9 HIS CE1 1 1 14 12733 1 1 9 HIS CG C 5.810 2.919 -3.114 1.00 . A A . 9 HIS CG 1 1 14 12734 1 1 9 HIS H H 2.861 2.156 -5.738 1.00 . A A . 9 HIS H 1 1 14 12735 1 1 9 HIS HA H 5.633 2.967 -6.013 1.00 . A A . 9 HIS HA 1 1 14 12736 1 1 9 HIS HB2 H 4.493 4.089 -4.256 1.00 . A A . 9 HIS HB2 1 1 14 12737 1 1 9 HIS HB3 H 3.803 2.591 -3.646 1.00 . A A . 9 HIS HB3 1 1 14 12738 1 1 9 HIS HD1 H 6.249 4.950 -2.761 1.00 . A A . 9 HIS HD1 1 1 14 12739 1 1 9 HIS HD2 H 6.157 0.795 -2.781 1.00 . A A . 9 HIS HD2 1 1 14 12740 1 1 9 HIS HE1 H 8.052 4.227 -1.162 1.00 . A A . 9 HIS HE1 1 1 14 12741 1 1 9 HIS HE2 H 7.915 1.714 -1.121 1.00 . A A . 9 HIS HE2 1 1 14 12742 1 1 9 HIS N N 3.709 2.275 -6.214 1.00 . A A . 9 HIS N 1 1 14 12743 1 1 9 HIS ND1 N 6.452 4.009 -2.568 1.00 . A A . 9 HIS ND1 1 1 14 12744 1 1 9 HIS NE2 N 7.384 2.276 -1.723 1.00 . A A . 9 HIS NE2 1 1 14 12745 1 1 9 HIS O O 6.761 0.830 -5.118 1.00 . A A . 9 HIS O 1 1 14 12746 1 1 10 PHE C C 5.383 -2.106 -6.324 1.00 . A A . 10 PHE C 1 1 14 12747 1 1 10 PHE CA C 5.135 -1.406 -4.991 1.00 . A A . 10 PHE CA 1 1 14 12748 1 1 10 PHE CB C 4.104 -2.188 -4.172 1.00 . A A . 10 PHE CB 1 1 14 12749 1 1 10 PHE CD1 C 4.058 -0.465 -2.350 1.00 . A A . 10 PHE CD1 1 1 14 12750 1 1 10 PHE CD2 C 4.076 -2.766 -1.729 1.00 . A A . 10 PHE CD2 1 1 14 12751 1 1 10 PHE CE1 C 4.034 -0.100 -1.019 1.00 . A A . 10 PHE CE1 1 1 14 12752 1 1 10 PHE CE2 C 4.052 -2.408 -0.394 1.00 . A A . 10 PHE CE2 1 1 14 12753 1 1 10 PHE CG C 4.078 -1.800 -2.721 1.00 . A A . 10 PHE CG 1 1 14 12754 1 1 10 PHE CZ C 4.032 -1.073 -0.038 1.00 . A A . 10 PHE CZ 1 1 14 12755 1 1 10 PHE H H 3.728 0.144 -5.291 1.00 . A A . 10 PHE H 1 1 14 12756 1 1 10 PHE HA H 6.060 -1.368 -4.439 1.00 . A A . 10 PHE HA 1 1 14 12757 1 1 10 PHE HB2 H 3.121 -2.012 -4.581 1.00 . A A . 10 PHE HB2 1 1 14 12758 1 1 10 PHE HB3 H 4.333 -3.242 -4.231 1.00 . A A . 10 PHE HB3 1 1 14 12759 1 1 10 PHE HD1 H 4.060 0.296 -3.114 1.00 . A A . 10 PHE HD1 1 1 14 12760 1 1 10 PHE HD2 H 4.092 -3.810 -2.005 1.00 . A A . 10 PHE HD2 1 1 14 12761 1 1 10 PHE HE1 H 4.018 0.943 -0.745 1.00 . A A . 10 PHE HE1 1 1 14 12762 1 1 10 PHE HE2 H 4.051 -3.171 0.371 1.00 . A A . 10 PHE HE2 1 1 14 12763 1 1 10 PHE HZ H 4.014 -0.789 1.004 1.00 . A A . 10 PHE HZ 1 1 14 12764 1 1 10 PHE N N 4.686 -0.036 -5.194 1.00 . A A . 10 PHE N 1 1 14 12765 1 1 10 PHE O O 6.407 -2.762 -6.511 1.00 . A A . 10 PHE O 1 1 14 12766 1 1 11 GLY C C 3.651 -3.771 -8.727 1.00 . A A . 11 GLY C 1 1 14 12767 1 1 11 GLY CA C 4.574 -2.580 -8.552 1.00 . A A . 11 GLY CA 1 1 14 12768 1 1 11 GLY H H 3.644 -1.424 -7.041 1.00 . A A . 11 GLY H 1 1 14 12769 1 1 11 GLY HA2 H 4.346 -1.849 -9.312 1.00 . A A . 11 GLY HA2 1 1 14 12770 1 1 11 GLY HA3 H 5.596 -2.909 -8.676 1.00 . A A . 11 GLY HA3 1 1 14 12771 1 1 11 GLY N N 4.439 -1.960 -7.248 1.00 . A A . 11 GLY N 1 1 14 12772 1 1 11 GLY O O 3.067 -3.960 -9.795 1.00 . A A . 11 GLY O 1 1 14 12773 1 1 12 THR C C 1.667 -5.749 -6.566 1.00 . A A . 12 THR C 1 1 14 12774 1 1 12 THR CA C 2.661 -5.755 -7.722 1.00 . A A . 12 THR CA 1 1 14 12775 1 1 12 THR CB C 3.508 -7.028 -7.674 1.00 . A A . 12 THR CB 1 1 14 12776 1 1 12 THR CG2 C 4.201 -7.336 -8.983 1.00 . A A . 12 THR CG2 1 1 14 12777 1 1 12 THR H H 4.011 -4.373 -6.855 1.00 . A A . 12 THR H 1 1 14 12778 1 1 12 THR HA H 2.115 -5.732 -8.653 1.00 . A A . 12 THR HA 1 1 14 12779 1 1 12 THR HB H 2.868 -7.865 -7.433 1.00 . A A . 12 THR HB 1 1 14 12780 1 1 12 THR HG1 H 5.009 -7.745 -6.640 1.00 . A A . 12 THR HG1 1 1 14 12781 1 1 12 THR HG21 H 5.194 -7.713 -8.785 1.00 . A A . 12 THR HG21 1 1 14 12782 1 1 12 THR HG22 H 4.269 -6.435 -9.575 1.00 . A A . 12 THR HG22 1 1 14 12783 1 1 12 THR HG23 H 3.635 -8.080 -9.524 1.00 . A A . 12 THR HG23 1 1 14 12784 1 1 12 THR N N 3.520 -4.576 -7.678 1.00 . A A . 12 THR N 1 1 14 12785 1 1 12 THR O O 1.709 -4.873 -5.703 1.00 . A A . 12 THR O 1 1 14 12786 1 1 12 THR OG1 O 4.506 -6.928 -6.672 1.00 . A A . 12 THR OG1 1 1 14 12787 1 1 13 GLN C C 0.298 -7.645 -4.327 1.00 . A A . 13 GLN C 1 1 14 12788 1 1 13 GLN CA C -0.234 -6.840 -5.508 1.00 . A A . 13 GLN CA 1 1 14 12789 1 1 13 GLN CB C -1.504 -7.493 -6.054 1.00 . A A . 13 GLN CB 1 1 14 12790 1 1 13 GLN CD C -3.664 -7.098 -7.303 1.00 . A A . 13 GLN CD 1 1 14 12791 1 1 13 GLN CG C -2.237 -6.640 -7.076 1.00 . A A . 13 GLN CG 1 1 14 12792 1 1 13 GLN H H 0.789 -7.400 -7.274 1.00 . A A . 13 GLN H 1 1 14 12793 1 1 13 GLN HA H -0.470 -5.841 -5.170 1.00 . A A . 13 GLN HA 1 1 14 12794 1 1 13 GLN HB2 H -1.240 -8.430 -6.523 1.00 . A A . 13 GLN HB2 1 1 14 12795 1 1 13 GLN HB3 H -2.176 -7.690 -5.233 1.00 . A A . 13 GLN HB3 1 1 14 12796 1 1 13 GLN HE21 H -4.185 -6.451 -5.498 1.00 . A A . 13 GLN HE21 1 1 14 12797 1 1 13 GLN HE22 H -5.448 -7.173 -6.429 1.00 . A A . 13 GLN HE22 1 1 14 12798 1 1 13 GLN HG2 H -2.255 -5.618 -6.725 1.00 . A A . 13 GLN HG2 1 1 14 12799 1 1 13 GLN HG3 H -1.705 -6.688 -8.015 1.00 . A A . 13 GLN HG3 1 1 14 12800 1 1 13 GLN N N 0.772 -6.731 -6.558 1.00 . A A . 13 GLN N 1 1 14 12801 1 1 13 GLN NE2 N -4.519 -6.886 -6.310 1.00 . A A . 13 GLN NE2 1 1 14 12802 1 1 13 GLN O O 0.217 -7.210 -3.178 1.00 . A A . 13 GLN O 1 1 14 12803 1 1 13 GLN OE1 O -3.995 -7.639 -8.360 1.00 . A A . 13 GLN OE1 1 1 14 12804 1 1 14 ARG C C 2.422 -8.947 -2.734 1.00 . A A . 14 ARG C 1 1 14 12805 1 1 14 ARG CA C 1.392 -9.690 -3.580 1.00 . A A . 14 ARG CA 1 1 14 12806 1 1 14 ARG CB C 2.030 -10.930 -4.207 1.00 . A A . 14 ARG CB 1 1 14 12807 1 1 14 ARG CD C 1.507 -13.391 -4.167 1.00 . A A . 14 ARG CD 1 1 14 12808 1 1 14 ARG CG C 1.910 -12.177 -3.344 1.00 . A A . 14 ARG CG 1 1 14 12809 1 1 14 ARG CZ C 1.390 -15.833 -3.859 1.00 . A A . 14 ARG CZ 1 1 14 12810 1 1 14 ARG H H 0.881 -9.114 -5.552 1.00 . A A . 14 ARG H 1 1 14 12811 1 1 14 ARG HA H 0.577 -9.999 -2.943 1.00 . A A . 14 ARG HA 1 1 14 12812 1 1 14 ARG HB2 H 1.550 -11.127 -5.155 1.00 . A A . 14 ARG HB2 1 1 14 12813 1 1 14 ARG HB3 H 3.079 -10.735 -4.378 1.00 . A A . 14 ARG HB3 1 1 14 12814 1 1 14 ARG HD2 H 0.539 -13.206 -4.607 1.00 . A A . 14 ARG HD2 1 1 14 12815 1 1 14 ARG HD3 H 2.236 -13.537 -4.950 1.00 . A A . 14 ARG HD3 1 1 14 12816 1 1 14 ARG HE H 1.416 -14.493 -2.380 1.00 . A A . 14 ARG HE 1 1 14 12817 1 1 14 ARG HG2 H 2.863 -12.372 -2.877 1.00 . A A . 14 ARG HG2 1 1 14 12818 1 1 14 ARG HG3 H 1.164 -12.005 -2.583 1.00 . A A . 14 ARG HG3 1 1 14 12819 1 1 14 ARG HH11 H 1.459 -15.235 -5.790 1.00 . A A . 14 ARG HH11 1 1 14 12820 1 1 14 ARG HH12 H 1.376 -16.947 -5.547 1.00 . A A . 14 ARG HH12 1 1 14 12821 1 1 14 ARG HH21 H 1.309 -16.744 -2.057 1.00 . A A . 14 ARG HH21 1 1 14 12822 1 1 14 ARG HH22 H 1.293 -17.804 -3.427 1.00 . A A . 14 ARG HH22 1 1 14 12823 1 1 14 ARG N N 0.845 -8.822 -4.617 1.00 . A A . 14 ARG N 1 1 14 12824 1 1 14 ARG NE N 1.434 -14.603 -3.353 1.00 . A A . 14 ARG NE 1 1 14 12825 1 1 14 ARG NH1 N 1.411 -16.020 -5.173 1.00 . A A . 14 ARG NH1 1 1 14 12826 1 1 14 ARG NH2 N 1.325 -16.881 -3.048 1.00 . A A . 14 ARG NH2 1 1 14 12827 1 1 14 ARG O O 2.590 -9.234 -1.547 1.00 . A A . 14 ARG O 1 1 14 12828 1 1 15 ALA C C 3.496 -6.416 -1.504 1.00 . A A . 15 ALA C 1 1 14 12829 1 1 15 ALA CA C 4.118 -7.204 -2.652 1.00 . A A . 15 ALA CA 1 1 14 12830 1 1 15 ALA CB C 4.820 -6.264 -3.620 1.00 . A A . 15 ALA CB 1 1 14 12831 1 1 15 ALA H H 2.929 -7.805 -4.297 1.00 . A A . 15 ALA H 1 1 14 12832 1 1 15 ALA HA H 4.852 -7.887 -2.251 1.00 . A A . 15 ALA HA 1 1 14 12833 1 1 15 ALA HB1 H 4.155 -5.458 -3.886 1.00 . A A . 15 ALA HB1 1 1 14 12834 1 1 15 ALA HB2 H 5.101 -6.809 -4.510 1.00 . A A . 15 ALA HB2 1 1 14 12835 1 1 15 ALA HB3 H 5.706 -5.861 -3.151 1.00 . A A . 15 ALA HB3 1 1 14 12836 1 1 15 ALA N N 3.108 -7.989 -3.349 1.00 . A A . 15 ALA N 1 1 14 12837 1 1 15 ALA O O 4.029 -6.392 -0.394 1.00 . A A . 15 ALA O 1 1 14 12838 1 1 16 VAL C C 1.255 -5.855 0.407 1.00 . A A . 16 VAL C 1 1 14 12839 1 1 16 VAL CA C 1.671 -4.985 -0.773 1.00 . A A . 16 VAL CA 1 1 14 12840 1 1 16 VAL CB C 0.416 -4.289 -1.348 1.00 . A A . 16 VAL CB 1 1 14 12841 1 1 16 VAL CG1 C 0.209 -2.955 -0.666 1.00 . A A . 16 VAL CG1 1 1 14 12842 1 1 16 VAL CG2 C 0.521 -4.098 -2.857 1.00 . A A . 16 VAL CG2 1 1 14 12843 1 1 16 VAL H H 1.992 -5.831 -2.679 1.00 . A A . 16 VAL H 1 1 14 12844 1 1 16 VAL HA H 2.350 -4.222 -0.422 1.00 . A A . 16 VAL HA 1 1 14 12845 1 1 16 VAL HB H -0.444 -4.911 -1.143 1.00 . A A . 16 VAL HB 1 1 14 12846 1 1 16 VAL HG11 H -0.376 -2.313 -1.304 1.00 . A A . 16 VAL HG11 1 1 14 12847 1 1 16 VAL HG12 H 1.169 -2.499 -0.478 1.00 . A A . 16 VAL HG12 1 1 14 12848 1 1 16 VAL HG13 H -0.310 -3.105 0.268 1.00 . A A . 16 VAL HG13 1 1 14 12849 1 1 16 VAL HG21 H 1.554 -3.939 -3.128 1.00 . A A . 16 VAL HG21 1 1 14 12850 1 1 16 VAL HG22 H -0.065 -3.239 -3.151 1.00 . A A . 16 VAL HG22 1 1 14 12851 1 1 16 VAL HG23 H 0.148 -4.978 -3.357 1.00 . A A . 16 VAL HG23 1 1 14 12852 1 1 16 VAL N N 2.367 -5.774 -1.779 1.00 . A A . 16 VAL N 1 1 14 12853 1 1 16 VAL O O 1.337 -5.433 1.561 1.00 . A A . 16 VAL O 1 1 14 12854 1 1 17 ALA C C 1.551 -8.407 2.040 1.00 . A A . 17 ALA C 1 1 14 12855 1 1 17 ALA CA C 0.381 -8.002 1.147 1.00 . A A . 17 ALA CA 1 1 14 12856 1 1 17 ALA CB C -0.260 -9.231 0.519 1.00 . A A . 17 ALA CB 1 1 14 12857 1 1 17 ALA H H 0.768 -7.350 -0.828 1.00 . A A . 17 ALA H 1 1 14 12858 1 1 17 ALA HA H -0.364 -7.506 1.752 1.00 . A A . 17 ALA HA 1 1 14 12859 1 1 17 ALA HB1 H -0.461 -9.038 -0.524 1.00 . A A . 17 ALA HB1 1 1 14 12860 1 1 17 ALA HB2 H -1.187 -9.454 1.028 1.00 . A A . 17 ALA HB2 1 1 14 12861 1 1 17 ALA HB3 H 0.411 -10.073 0.606 1.00 . A A . 17 ALA HB3 1 1 14 12862 1 1 17 ALA N N 0.810 -7.071 0.110 1.00 . A A . 17 ALA N 1 1 14 12863 1 1 17 ALA O O 1.365 -8.729 3.213 1.00 . A A . 17 ALA O 1 1 14 12864 1 1 18 LYS C C 4.583 -7.538 2.899 1.00 . A A . 18 LYS C 1 1 14 12865 1 1 18 LYS CA C 3.955 -8.755 2.220 1.00 . A A . 18 LYS CA 1 1 14 12866 1 1 18 LYS CB C 4.974 -9.412 1.287 1.00 . A A . 18 LYS CB 1 1 14 12867 1 1 18 LYS CD C 5.768 -11.647 2.119 1.00 . A A . 18 LYS CD 1 1 14 12868 1 1 18 LYS CE C 5.883 -13.120 1.763 1.00 . A A . 18 LYS CE 1 1 14 12869 1 1 18 LYS CG C 4.818 -10.920 1.180 1.00 . A A . 18 LYS CG 1 1 14 12870 1 1 18 LYS H H 2.838 -8.124 0.535 1.00 . A A . 18 LYS H 1 1 14 12871 1 1 18 LYS HA H 3.668 -9.466 2.979 1.00 . A A . 18 LYS HA 1 1 14 12872 1 1 18 LYS HB2 H 4.866 -8.990 0.299 1.00 . A A . 18 LYS HB2 1 1 14 12873 1 1 18 LYS HB3 H 5.969 -9.199 1.653 1.00 . A A . 18 LYS HB3 1 1 14 12874 1 1 18 LYS HD2 H 6.745 -11.192 2.050 1.00 . A A . 18 LYS HD2 1 1 14 12875 1 1 18 LYS HD3 H 5.397 -11.557 3.130 1.00 . A A . 18 LYS HD3 1 1 14 12876 1 1 18 LYS HE2 H 5.185 -13.679 2.367 1.00 . A A . 18 LYS HE2 1 1 14 12877 1 1 18 LYS HE3 H 5.636 -13.246 0.719 1.00 . A A . 18 LYS HE3 1 1 14 12878 1 1 18 LYS HG2 H 3.803 -11.187 1.435 1.00 . A A . 18 LYS HG2 1 1 14 12879 1 1 18 LYS HG3 H 5.028 -11.223 0.165 1.00 . A A . 18 LYS HG3 1 1 14 12880 1 1 18 LYS HZ1 H 7.210 -14.620 2.354 1.00 . A A . 18 LYS HZ1 1 1 14 12881 1 1 18 LYS HZ2 H 7.745 -13.055 2.709 1.00 . A A . 18 LYS HZ2 1 1 14 12882 1 1 18 LYS HZ3 H 7.804 -13.627 1.118 1.00 . A A . 18 LYS HZ3 1 1 14 12883 1 1 18 LYS N N 2.755 -8.390 1.474 1.00 . A A . 18 LYS N 1 1 14 12884 1 1 18 LYS NZ N 7.256 -13.642 2.002 1.00 . A A . 18 LYS NZ 1 1 14 12885 1 1 18 LYS O O 5.741 -7.582 3.315 1.00 . A A . 18 LYS O 1 1 14 12886 1 1 19 ALA C C 3.600 -4.977 4.966 1.00 . A A . 19 ALA C 1 1 14 12887 1 1 19 ALA CA C 4.310 -5.236 3.641 1.00 . A A . 19 ALA CA 1 1 14 12888 1 1 19 ALA CB C 4.134 -4.050 2.706 1.00 . A A . 19 ALA CB 1 1 14 12889 1 1 19 ALA H H 2.903 -6.475 2.664 1.00 . A A . 19 ALA H 1 1 14 12890 1 1 19 ALA HA H 5.367 -5.361 3.830 1.00 . A A . 19 ALA HA 1 1 14 12891 1 1 19 ALA HB1 H 4.017 -3.147 3.286 1.00 . A A . 19 ALA HB1 1 1 14 12892 1 1 19 ALA HB2 H 3.256 -4.201 2.095 1.00 . A A . 19 ALA HB2 1 1 14 12893 1 1 19 ALA HB3 H 5.003 -3.959 2.071 1.00 . A A . 19 ALA HB3 1 1 14 12894 1 1 19 ALA N N 3.818 -6.454 3.012 1.00 . A A . 19 ALA N 1 1 14 12895 1 1 19 ALA O O 4.227 -4.596 5.955 1.00 . A A . 19 ALA O 1 1 14 12896 1 1 20 LEU C C 1.252 -6.293 6.913 1.00 . A A . 20 LEU C 1 1 14 12897 1 1 20 LEU CA C 1.490 -4.977 6.180 1.00 . A A . 20 LEU CA 1 1 14 12898 1 1 20 LEU CB C 0.151 -4.328 5.823 1.00 . A A . 20 LEU CB 1 1 14 12899 1 1 20 LEU CD1 C -0.322 -3.731 3.432 1.00 . A A . 20 LEU CD1 1 1 14 12900 1 1 20 LEU CD2 C -0.525 -1.988 5.214 1.00 . A A . 20 LEU CD2 1 1 14 12901 1 1 20 LEU CG C 0.229 -3.230 4.758 1.00 . A A . 20 LEU CG 1 1 14 12902 1 1 20 LEU H H 1.845 -5.490 4.158 1.00 . A A . 20 LEU H 1 1 14 12903 1 1 20 LEU HA H 2.039 -4.312 6.830 1.00 . A A . 20 LEU HA 1 1 14 12904 1 1 20 LEU HB2 H -0.514 -5.101 5.469 1.00 . A A . 20 LEU HB2 1 1 14 12905 1 1 20 LEU HB3 H -0.267 -3.900 6.721 1.00 . A A . 20 LEU HB3 1 1 14 12906 1 1 20 LEU HD11 H 0.072 -3.127 2.627 1.00 . A A . 20 LEU HD11 1 1 14 12907 1 1 20 LEU HD12 H -1.399 -3.661 3.439 1.00 . A A . 20 LEU HD12 1 1 14 12908 1 1 20 LEU HD13 H -0.029 -4.760 3.286 1.00 . A A . 20 LEU HD13 1 1 14 12909 1 1 20 LEU HD21 H 0.007 -1.105 4.887 1.00 . A A . 20 LEU HD21 1 1 14 12910 1 1 20 LEU HD22 H -0.598 -1.986 6.291 1.00 . A A . 20 LEU HD22 1 1 14 12911 1 1 20 LEU HD23 H -1.515 -1.990 4.785 1.00 . A A . 20 LEU HD23 1 1 14 12912 1 1 20 LEU HG H 1.263 -2.957 4.607 1.00 . A A . 20 LEU HG 1 1 14 12913 1 1 20 LEU N N 2.288 -5.187 4.978 1.00 . A A . 20 LEU N 1 1 14 12914 1 1 20 LEU O O 1.112 -6.318 8.136 1.00 . A A . 20 LEU O 1 1 14 12915 1 1 21 GLY C C -0.355 -9.287 6.351 1.00 . A A . 21 GLY C 1 1 14 12916 1 1 21 GLY CA C 0.980 -8.690 6.750 1.00 . A A . 21 GLY CA 1 1 14 12917 1 1 21 GLY H H 1.320 -7.303 5.187 1.00 . A A . 21 GLY H 1 1 14 12918 1 1 21 GLY HA2 H 1.769 -9.357 6.434 1.00 . A A . 21 GLY HA2 1 1 14 12919 1 1 21 GLY HA3 H 1.012 -8.595 7.826 1.00 . A A . 21 GLY HA3 1 1 14 12920 1 1 21 GLY N N 1.203 -7.385 6.157 1.00 . A A . 21 GLY N 1 1 14 12921 1 1 21 GLY O O -0.937 -10.075 7.096 1.00 . A A . 21 GLY O 1 1 14 12922 1 1 22 ILE C C -1.918 -10.270 3.428 1.00 . A A . 22 ILE C 1 1 14 12923 1 1 22 ILE CA C -2.114 -9.414 4.674 1.00 . A A . 22 ILE CA 1 1 14 12924 1 1 22 ILE CB C -3.083 -8.262 4.344 1.00 . A A . 22 ILE CB 1 1 14 12925 1 1 22 ILE CD1 C -3.373 -6.190 2.893 1.00 . A A . 22 ILE CD1 1 1 14 12926 1 1 22 ILE CG1 C -2.458 -7.323 3.309 1.00 . A A . 22 ILE CG1 1 1 14 12927 1 1 22 ILE CG2 C -3.449 -7.498 5.607 1.00 . A A . 22 ILE CG2 1 1 14 12928 1 1 22 ILE H H -0.328 -8.280 4.624 1.00 . A A . 22 ILE H 1 1 14 12929 1 1 22 ILE HA H -2.561 -10.020 5.449 1.00 . A A . 22 ILE HA 1 1 14 12930 1 1 22 ILE HB H -3.987 -8.688 3.934 1.00 . A A . 22 ILE HB 1 1 14 12931 1 1 22 ILE HD11 H -4.091 -6.001 3.676 1.00 . A A . 22 ILE HD11 1 1 14 12932 1 1 22 ILE HD12 H -3.892 -6.461 1.986 1.00 . A A . 22 ILE HD12 1 1 14 12933 1 1 22 ILE HD13 H -2.785 -5.300 2.720 1.00 . A A . 22 ILE HD13 1 1 14 12934 1 1 22 ILE HG12 H -1.560 -6.889 3.721 1.00 . A A . 22 ILE HG12 1 1 14 12935 1 1 22 ILE HG13 H -2.207 -7.890 2.423 1.00 . A A . 22 ILE HG13 1 1 14 12936 1 1 22 ILE HG21 H -4.373 -7.887 6.007 1.00 . A A . 22 ILE HG21 1 1 14 12937 1 1 22 ILE HG22 H -3.570 -6.451 5.373 1.00 . A A . 22 ILE HG22 1 1 14 12938 1 1 22 ILE HG23 H -2.663 -7.616 6.339 1.00 . A A . 22 ILE HG23 1 1 14 12939 1 1 22 ILE N N -0.841 -8.911 5.172 1.00 . A A . 22 ILE N 1 1 14 12940 1 1 22 ILE O O -0.791 -10.481 2.979 1.00 . A A . 22 ILE O 1 1 14 12941 1 1 23 SER C C -3.243 -10.772 0.427 1.00 . A A . 23 SER C 1 1 14 12942 1 1 23 SER CA C -2.970 -11.597 1.679 1.00 . A A . 23 SER CA 1 1 14 12943 1 1 23 SER CB C -3.985 -12.737 1.784 1.00 . A A . 23 SER CB 1 1 14 12944 1 1 23 SER H H -3.890 -10.561 3.279 1.00 . A A . 23 SER H 1 1 14 12945 1 1 23 SER HA H -1.978 -12.017 1.610 1.00 . A A . 23 SER HA 1 1 14 12946 1 1 23 SER HB2 H -4.124 -13.184 0.810 1.00 . A A . 23 SER HB2 1 1 14 12947 1 1 23 SER HB3 H -3.617 -13.482 2.473 1.00 . A A . 23 SER HB3 1 1 14 12948 1 1 23 SER HG H -5.784 -13.008 2.511 1.00 . A A . 23 SER HG 1 1 14 12949 1 1 23 SER N N -3.021 -10.764 2.875 1.00 . A A . 23 SER N 1 1 14 12950 1 1 23 SER O O -3.728 -9.643 0.509 1.00 . A A . 23 SER O 1 1 14 12951 1 1 23 SER OG O -5.237 -12.263 2.250 1.00 . A A . 23 SER OG 1 1 14 12952 1 1 24 ASP C C -4.614 -10.319 -2.201 1.00 . A A . 24 ASP C 1 1 14 12953 1 1 24 ASP CA C -3.139 -10.657 -2.003 1.00 . A A . 24 ASP CA 1 1 14 12954 1 1 24 ASP CB C -2.642 -11.525 -3.161 1.00 . A A . 24 ASP CB 1 1 14 12955 1 1 24 ASP CG C -3.147 -12.951 -3.073 1.00 . A A . 24 ASP CG 1 1 14 12956 1 1 24 ASP H H -2.545 -12.243 -0.732 1.00 . A A . 24 ASP H 1 1 14 12957 1 1 24 ASP HA H -2.571 -9.738 -1.983 1.00 . A A . 24 ASP HA 1 1 14 12958 1 1 24 ASP HB2 H -2.983 -11.098 -4.093 1.00 . A A . 24 ASP HB2 1 1 14 12959 1 1 24 ASP HB3 H -1.562 -11.541 -3.152 1.00 . A A . 24 ASP HB3 1 1 14 12960 1 1 24 ASP N N -2.927 -11.341 -0.733 1.00 . A A . 24 ASP N 1 1 14 12961 1 1 24 ASP O O -4.951 -9.321 -2.836 1.00 . A A . 24 ASP O 1 1 14 12962 1 1 24 ASP OD1 O -2.656 -13.702 -2.205 1.00 . A A . 24 ASP OD1 1 1 14 12963 1 1 24 ASP OD2 O -4.033 -13.317 -3.873 1.00 . A A . 24 ASP OD2 1 1 14 12964 1 1 25 ALA C C -7.340 -9.623 -1.134 1.00 . A A . 25 ALA C 1 1 14 12965 1 1 25 ALA CA C -6.925 -10.947 -1.767 1.00 . A A . 25 ALA CA 1 1 14 12966 1 1 25 ALA CB C -7.680 -12.101 -1.124 1.00 . A A . 25 ALA CB 1 1 14 12967 1 1 25 ALA H H -5.156 -11.935 -1.155 1.00 . A A . 25 ALA H 1 1 14 12968 1 1 25 ALA HA H -7.175 -10.926 -2.818 1.00 . A A . 25 ALA HA 1 1 14 12969 1 1 25 ALA HB1 H -7.973 -11.825 -0.122 1.00 . A A . 25 ALA HB1 1 1 14 12970 1 1 25 ALA HB2 H -7.041 -12.972 -1.083 1.00 . A A . 25 ALA HB2 1 1 14 12971 1 1 25 ALA HB3 H -8.558 -12.327 -1.708 1.00 . A A . 25 ALA HB3 1 1 14 12972 1 1 25 ALA N N -5.486 -11.157 -1.650 1.00 . A A . 25 ALA N 1 1 14 12973 1 1 25 ALA O O -8.100 -8.854 -1.722 1.00 . A A . 25 ALA O 1 1 14 12974 1 1 26 ALA C C -6.739 -6.907 -0.026 1.00 . A A . 26 ALA C 1 1 14 12975 1 1 26 ALA CA C -7.155 -8.132 0.780 1.00 . A A . 26 ALA CA 1 1 14 12976 1 1 26 ALA CB C -6.479 -8.122 2.144 1.00 . A A . 26 ALA CB 1 1 14 12977 1 1 26 ALA H H -6.235 -10.015 0.486 1.00 . A A . 26 ALA H 1 1 14 12978 1 1 26 ALA HA H -8.224 -8.103 0.935 1.00 . A A . 26 ALA HA 1 1 14 12979 1 1 26 ALA HB1 H -7.151 -8.535 2.882 1.00 . A A . 26 ALA HB1 1 1 14 12980 1 1 26 ALA HB2 H -6.228 -7.107 2.414 1.00 . A A . 26 ALA HB2 1 1 14 12981 1 1 26 ALA HB3 H -5.580 -8.718 2.104 1.00 . A A . 26 ALA HB3 1 1 14 12982 1 1 26 ALA N N -6.836 -9.363 0.068 1.00 . A A . 26 ALA N 1 1 14 12983 1 1 26 ALA O O -7.428 -5.888 -0.026 1.00 . A A . 26 ALA O 1 1 14 12984 1 1 27 VAL C C -5.963 -5.704 -2.766 1.00 . A A . 27 VAL C 1 1 14 12985 1 1 27 VAL CA C -5.098 -5.916 -1.526 1.00 . A A . 27 VAL CA 1 1 14 12986 1 1 27 VAL CB C -3.643 -6.168 -1.964 1.00 . A A . 27 VAL CB 1 1 14 12987 1 1 27 VAL CG1 C -3.114 -4.997 -2.778 1.00 . A A . 27 VAL CG1 1 1 14 12988 1 1 27 VAL CG2 C -2.760 -6.428 -0.754 1.00 . A A . 27 VAL CG2 1 1 14 12989 1 1 27 VAL H H -5.103 -7.853 -0.675 1.00 . A A . 27 VAL H 1 1 14 12990 1 1 27 VAL HA H -5.122 -5.018 -0.926 1.00 . A A . 27 VAL HA 1 1 14 12991 1 1 27 VAL HB H -3.625 -7.049 -2.591 1.00 . A A . 27 VAL HB 1 1 14 12992 1 1 27 VAL HG11 H -3.110 -4.106 -2.167 1.00 . A A . 27 VAL HG11 1 1 14 12993 1 1 27 VAL HG12 H -3.749 -4.840 -3.638 1.00 . A A . 27 VAL HG12 1 1 14 12994 1 1 27 VAL HG13 H -2.109 -5.211 -3.107 1.00 . A A . 27 VAL HG13 1 1 14 12995 1 1 27 VAL HG21 H -1.729 -6.495 -1.068 1.00 . A A . 27 VAL HG21 1 1 14 12996 1 1 27 VAL HG22 H -3.054 -7.354 -0.285 1.00 . A A . 27 VAL HG22 1 1 14 12997 1 1 27 VAL HG23 H -2.868 -5.617 -0.048 1.00 . A A . 27 VAL HG23 1 1 14 12998 1 1 27 VAL N N -5.608 -7.014 -0.714 1.00 . A A . 27 VAL N 1 1 14 12999 1 1 27 VAL O O -6.209 -4.570 -3.177 1.00 . A A . 27 VAL O 1 1 14 13000 1 1 28 SER C C -8.628 -6.164 -4.228 1.00 . A A . 28 SER C 1 1 14 13001 1 1 28 SER CA C -7.250 -6.734 -4.554 1.00 . A A . 28 SER CA 1 1 14 13002 1 1 28 SER CB C -7.394 -8.122 -5.179 1.00 . A A . 28 SER CB 1 1 14 13003 1 1 28 SER H H -6.185 -7.678 -2.987 1.00 . A A . 28 SER H 1 1 14 13004 1 1 28 SER HA H -6.761 -6.080 -5.260 1.00 . A A . 28 SER HA 1 1 14 13005 1 1 28 SER HB2 H -7.958 -8.758 -4.514 1.00 . A A . 28 SER HB2 1 1 14 13006 1 1 28 SER HB3 H -7.914 -8.038 -6.122 1.00 . A A . 28 SER HB3 1 1 14 13007 1 1 28 SER HG H -5.637 -8.749 -4.583 1.00 . A A . 28 SER HG 1 1 14 13008 1 1 28 SER N N -6.417 -6.801 -3.359 1.00 . A A . 28 SER N 1 1 14 13009 1 1 28 SER O O -9.272 -5.546 -5.078 1.00 . A A . 28 SER O 1 1 14 13010 1 1 28 SER OG O -6.127 -8.713 -5.408 1.00 . A A . 28 SER OG 1 1 14 13011 1 1 29 GLN C C -10.330 -4.397 -2.225 1.00 . A A . 29 GLN C 1 1 14 13012 1 1 29 GLN CA C -10.380 -5.886 -2.560 1.00 . A A . 29 GLN CA 1 1 14 13013 1 1 29 GLN CB C -10.860 -6.681 -1.345 1.00 . A A . 29 GLN CB 1 1 14 13014 1 1 29 GLN CD C -11.880 -8.934 -0.832 1.00 . A A . 29 GLN CD 1 1 14 13015 1 1 29 GLN CG C -11.970 -7.674 -1.671 1.00 . A A . 29 GLN CG 1 1 14 13016 1 1 29 GLN H H -8.521 -6.878 -2.364 1.00 . A A . 29 GLN H 1 1 14 13017 1 1 29 GLN HA H -11.070 -6.034 -3.374 1.00 . A A . 29 GLN HA 1 1 14 13018 1 1 29 GLN HB2 H -10.030 -7.227 -0.930 1.00 . A A . 29 GLN HB2 1 1 14 13019 1 1 29 GLN HB3 H -11.240 -5.992 -0.602 1.00 . A A . 29 GLN HB3 1 1 14 13020 1 1 29 GLN HE21 H -11.250 -9.970 -2.407 1.00 . A A . 29 GLN HE21 1 1 14 13021 1 1 29 GLN HE22 H -11.410 -10.862 -0.936 1.00 . A A . 29 GLN HE22 1 1 14 13022 1 1 29 GLN HG2 H -12.920 -7.204 -1.491 1.00 . A A . 29 GLN HG2 1 1 14 13023 1 1 29 GLN HG3 H -11.890 -7.947 -2.713 1.00 . A A . 29 GLN HG3 1 1 14 13024 1 1 29 GLN N N -9.078 -6.377 -2.996 1.00 . A A . 29 GLN N 1 1 14 13025 1 1 29 GLN NE2 N -11.470 -10.033 -1.454 1.00 . A A . 29 GLN NE2 1 1 14 13026 1 1 29 GLN O O -11.360 -3.737 -2.140 1.00 . A A . 29 GLN O 1 1 14 13027 1 1 29 GLN OE1 O -12.180 -8.921 0.362 1.00 . A A . 29 GLN OE1 1 1 14 13028 1 1 30 TRP C C -9.665 -1.564 -2.710 1.00 . A A . 30 TRP C 1 1 14 13029 1 1 30 TRP CA C -8.948 -2.458 -1.701 1.00 . A A . 30 TRP CA 1 1 14 13030 1 1 30 TRP CB C -7.460 -2.101 -1.662 1.00 . A A . 30 TRP CB 1 1 14 13031 1 1 30 TRP CD1 C -7.362 -3.043 0.722 1.00 . A A . 30 TRP CD1 1 1 14 13032 1 1 30 TRP CD2 C -5.380 -2.410 -0.101 1.00 . A A . 30 TRP CD2 1 1 14 13033 1 1 30 TRP CE2 C -5.187 -2.903 1.203 1.00 . A A . 30 TRP CE2 1 1 14 13034 1 1 30 TRP CE3 C -4.271 -1.952 -0.819 1.00 . A A . 30 TRP CE3 1 1 14 13035 1 1 30 TRP CG C -6.778 -2.508 -0.390 1.00 . A A . 30 TRP CG 1 1 14 13036 1 1 30 TRP CH2 C -2.864 -2.499 1.075 1.00 . A A . 30 TRP CH2 1 1 14 13037 1 1 30 TRP CZ2 C -3.930 -2.954 1.802 1.00 . A A . 30 TRP CZ2 1 1 14 13038 1 1 30 TRP CZ3 C -3.024 -2.002 -0.225 1.00 . A A . 30 TRP CZ3 1 1 14 13039 1 1 30 TRP H H -8.333 -4.442 -2.109 1.00 . A A . 30 TRP H 1 1 14 13040 1 1 30 TRP HA H -9.375 -2.290 -0.724 1.00 . A A . 30 TRP HA 1 1 14 13041 1 1 30 TRP HB2 H -6.958 -2.594 -2.480 1.00 . A A . 30 TRP HB2 1 1 14 13042 1 1 30 TRP HB3 H -7.352 -1.032 -1.770 1.00 . A A . 30 TRP HB3 1 1 14 13043 1 1 30 TRP HD1 H -8.419 -3.243 0.819 1.00 . A A . 30 TRP HD1 1 1 14 13044 1 1 30 TRP HE1 H -6.583 -3.665 2.572 1.00 . A A . 30 TRP HE1 1 1 14 13045 1 1 30 TRP HE3 H -4.376 -1.566 -1.823 1.00 . A A . 30 TRP HE3 1 1 14 13046 1 1 30 TRP HH2 H -1.871 -2.519 1.501 1.00 . A A . 30 TRP HH2 1 1 14 13047 1 1 30 TRP HZ2 H -3.789 -3.334 2.803 1.00 . A A . 30 TRP HZ2 1 1 14 13048 1 1 30 TRP HZ3 H -2.158 -1.652 -0.764 1.00 . A A . 30 TRP HZ3 1 1 14 13049 1 1 30 TRP N N -9.123 -3.869 -2.031 1.00 . A A . 30 TRP N 1 1 14 13050 1 1 30 TRP NE1 N -6.412 -3.284 1.685 1.00 . A A . 30 TRP NE1 1 1 14 13051 1 1 30 TRP O O -9.432 -1.659 -3.913 1.00 . A A . 30 TRP O 1 1 14 13052 1 1 31 LYS C C -10.500 1.503 -3.297 1.00 . A A . 31 LYS C 1 1 14 13053 1 1 31 LYS CA C -11.280 0.216 -3.060 1.00 . A A . 31 LYS CA 1 1 14 13054 1 1 31 LYS CB C -12.640 0.531 -2.429 1.00 . A A . 31 LYS CB 1 1 14 13055 1 1 31 LYS CD C -13.630 0.984 -0.162 1.00 . A A . 31 LYS CD 1 1 14 13056 1 1 31 LYS CE C -13.500 1.776 1.127 1.00 . A A . 31 LYS CE 1 1 14 13057 1 1 31 LYS CG C -12.550 1.367 -1.163 1.00 . A A . 31 LYS CG 1 1 14 13058 1 1 31 LYS H H -10.670 -0.669 -1.237 1.00 . A A . 31 LYS H 1 1 14 13059 1 1 31 LYS HA H -11.440 -0.274 -4.009 1.00 . A A . 31 LYS HA 1 1 14 13060 1 1 31 LYS HB2 H -13.240 1.068 -3.146 1.00 . A A . 31 LYS HB2 1 1 14 13061 1 1 31 LYS HB3 H -13.140 -0.399 -2.184 1.00 . A A . 31 LYS HB3 1 1 14 13062 1 1 31 LYS HD2 H -14.600 1.183 -0.598 1.00 . A A . 31 LYS HD2 1 1 14 13063 1 1 31 LYS HD3 H -13.540 -0.070 0.061 1.00 . A A . 31 LYS HD3 1 1 14 13064 1 1 31 LYS HE2 H -13.160 2.773 0.891 1.00 . A A . 31 LYS HE2 1 1 14 13065 1 1 31 LYS HE3 H -14.470 1.830 1.602 1.00 . A A . 31 LYS HE3 1 1 14 13066 1 1 31 LYS HG2 H -11.580 1.212 -0.710 1.00 . A A . 31 LYS HG2 1 1 14 13067 1 1 31 LYS HG3 H -12.670 2.409 -1.422 1.00 . A A . 31 LYS HG3 1 1 14 13068 1 1 31 LYS HZ1 H -11.620 0.983 1.591 1.00 . A A . 31 LYS HZ1 1 1 14 13069 1 1 31 LYS HZ2 H -12.900 0.238 2.409 1.00 . A A . 31 LYS HZ2 1 1 14 13070 1 1 31 LYS HZ3 H -12.370 1.771 2.887 1.00 . A A . 31 LYS HZ3 1 1 14 13071 1 1 31 LYS N N -10.530 -0.698 -2.206 1.00 . A A . 31 LYS N 1 1 14 13072 1 1 31 LYS NZ N -12.530 1.148 2.070 1.00 . A A . 31 LYS NZ 1 1 14 13073 1 1 31 LYS O O -9.293 1.554 -3.057 1.00 . A A . 31 LYS O 1 1 14 13074 1 1 32 GLU C C -9.704 4.284 -2.851 1.00 . A A . 32 GLU C 1 1 14 13075 1 1 32 GLU CA C -10.540 3.826 -4.040 1.00 . A A . 32 GLU CA 1 1 14 13076 1 1 32 GLU CB C -11.600 4.883 -4.374 1.00 . A A . 32 GLU CB 1 1 14 13077 1 1 32 GLU CD C -12.670 6.321 -6.153 1.00 . A A . 32 GLU CD 1 1 14 13078 1 1 32 GLU CG C -11.540 5.362 -5.815 1.00 . A A . 32 GLU CG 1 1 14 13079 1 1 32 GLU H H -12.140 2.440 -3.945 1.00 . A A . 32 GLU H 1 1 14 13080 1 1 32 GLU HA H -9.898 3.698 -4.895 1.00 . A A . 32 GLU HA 1 1 14 13081 1 1 32 GLU HB2 H -12.580 4.465 -4.192 1.00 . A A . 32 GLU HB2 1 1 14 13082 1 1 32 GLU HB3 H -11.460 5.737 -3.729 1.00 . A A . 32 GLU HB3 1 1 14 13083 1 1 32 GLU HG2 H -10.600 5.864 -5.980 1.00 . A A . 32 GLU HG2 1 1 14 13084 1 1 32 GLU HG3 H -11.610 4.504 -6.469 1.00 . A A . 32 GLU HG3 1 1 14 13085 1 1 32 GLU N N -11.180 2.541 -3.771 1.00 . A A . 32 GLU N 1 1 14 13086 1 1 32 GLU O O -8.723 5.008 -3.015 1.00 . A A . 32 GLU O 1 1 14 13087 1 1 32 GLU OE1 O -13.850 5.950 -5.956 1.00 . A A . 32 GLU OE1 1 1 14 13088 1 1 32 GLU OE2 O -12.370 7.443 -6.616 1.00 . A A . 32 GLU OE2 1 1 14 13089 1 1 33 VAL C C -9.090 2.995 0.421 1.00 . A A . 33 VAL C 1 1 14 13090 1 1 33 VAL CA C -9.375 4.221 -0.440 1.00 . A A . 33 VAL CA 1 1 14 13091 1 1 33 VAL CB C -10.160 5.246 0.395 1.00 . A A . 33 VAL CB 1 1 14 13092 1 1 33 VAL CG1 C -9.321 5.763 1.549 1.00 . A A . 33 VAL CG1 1 1 14 13093 1 1 33 VAL CG2 C -10.640 6.395 -0.483 1.00 . A A . 33 VAL CG2 1 1 14 13094 1 1 33 VAL H H -10.880 3.280 -1.586 1.00 . A A . 33 VAL H 1 1 14 13095 1 1 33 VAL HA H -8.438 4.672 -0.730 1.00 . A A . 33 VAL HA 1 1 14 13096 1 1 33 VAL HB H -11.030 4.752 0.807 1.00 . A A . 33 VAL HB 1 1 14 13097 1 1 33 VAL HG11 H -9.171 4.971 2.269 1.00 . A A . 33 VAL HG11 1 1 14 13098 1 1 33 VAL HG12 H -9.827 6.590 2.023 1.00 . A A . 33 VAL HG12 1 1 14 13099 1 1 33 VAL HG13 H -8.364 6.096 1.174 1.00 . A A . 33 VAL HG13 1 1 14 13100 1 1 33 VAL HG21 H -11.250 7.065 0.104 1.00 . A A . 33 VAL HG21 1 1 14 13101 1 1 33 VAL HG22 H -11.220 6.002 -1.303 1.00 . A A . 33 VAL HG22 1 1 14 13102 1 1 33 VAL HG23 H -9.790 6.929 -0.871 1.00 . A A . 33 VAL HG23 1 1 14 13103 1 1 33 VAL N N -10.090 3.855 -1.654 1.00 . A A . 33 VAL N 1 1 14 13104 1 1 33 VAL O O -10.000 2.296 0.847 1.00 . A A . 33 VAL O 1 1 14 13105 1 1 34 ILE C C -7.766 1.804 2.951 1.00 . A A . 34 ILE C 1 1 14 13106 1 1 34 ILE CA C -7.404 1.596 1.482 1.00 . A A . 34 ILE CA 1 1 14 13107 1 1 34 ILE CB C -5.890 1.332 1.370 1.00 . A A . 34 ILE CB 1 1 14 13108 1 1 34 ILE CD1 C -3.614 2.388 1.785 1.00 . A A . 34 ILE CD1 1 1 14 13109 1 1 34 ILE CG1 C -5.099 2.619 1.613 1.00 . A A . 34 ILE CG1 1 1 14 13110 1 1 34 ILE CG2 C -5.554 0.749 0.006 1.00 . A A . 34 ILE CG2 1 1 14 13111 1 1 34 ILE H H -7.122 3.334 0.305 1.00 . A A . 34 ILE H 1 1 14 13112 1 1 34 ILE HA H -7.928 0.725 1.114 1.00 . A A . 34 ILE HA 1 1 14 13113 1 1 34 ILE HB H -5.617 0.604 2.119 1.00 . A A . 34 ILE HB 1 1 14 13114 1 1 34 ILE HD11 H -3.444 1.777 2.659 1.00 . A A . 34 ILE HD11 1 1 14 13115 1 1 34 ILE HD12 H -3.114 3.338 1.909 1.00 . A A . 34 ILE HD12 1 1 14 13116 1 1 34 ILE HD13 H -3.224 1.886 0.913 1.00 . A A . 34 ILE HD13 1 1 14 13117 1 1 34 ILE HG12 H -5.235 3.283 0.772 1.00 . A A . 34 ILE HG12 1 1 14 13118 1 1 34 ILE HG13 H -5.469 3.097 2.508 1.00 . A A . 34 ILE HG13 1 1 14 13119 1 1 34 ILE HG21 H -4.538 0.385 0.011 1.00 . A A . 34 ILE HG21 1 1 14 13120 1 1 34 ILE HG22 H -5.657 1.517 -0.749 1.00 . A A . 34 ILE HG22 1 1 14 13121 1 1 34 ILE HG23 H -6.227 -0.066 -0.214 1.00 . A A . 34 ILE HG23 1 1 14 13122 1 1 34 ILE N N -7.809 2.740 0.672 1.00 . A A . 34 ILE N 1 1 14 13123 1 1 34 ILE O O -7.980 2.934 3.391 1.00 . A A . 34 ILE O 1 1 14 13124 1 1 35 PRO C C -7.361 1.817 5.909 1.00 . A A . 35 PRO C 1 1 14 13125 1 1 35 PRO CA C -8.184 0.776 5.155 1.00 . A A . 35 PRO CA 1 1 14 13126 1 1 35 PRO CB C -7.863 -0.630 5.660 1.00 . A A . 35 PRO CB 1 1 14 13127 1 1 35 PRO CD C -7.607 -0.676 3.284 1.00 . A A . 35 PRO CD 1 1 14 13128 1 1 35 PRO CG C -8.036 -1.502 4.466 1.00 . A A . 35 PRO CG 1 1 14 13129 1 1 35 PRO HA H -9.236 0.981 5.300 1.00 . A A . 35 PRO HA 1 1 14 13130 1 1 35 PRO HB2 H -6.848 -0.660 6.030 1.00 . A A . 35 PRO HB2 1 1 14 13131 1 1 35 PRO HB3 H -8.549 -0.900 6.448 1.00 . A A . 35 PRO HB3 1 1 14 13132 1 1 35 PRO HD2 H -6.561 -0.839 3.070 1.00 . A A . 35 PRO HD2 1 1 14 13133 1 1 35 PRO HD3 H -8.211 -0.911 2.420 1.00 . A A . 35 PRO HD3 1 1 14 13134 1 1 35 PRO HG2 H -7.412 -2.379 4.558 1.00 . A A . 35 PRO HG2 1 1 14 13135 1 1 35 PRO HG3 H -9.072 -1.788 4.367 1.00 . A A . 35 PRO HG3 1 1 14 13136 1 1 35 PRO N N -7.843 0.711 3.730 1.00 . A A . 35 PRO N 1 1 14 13137 1 1 35 PRO O O -6.283 2.212 5.465 1.00 . A A . 35 PRO O 1 1 14 13138 1 1 36 GLU C C -5.932 2.682 8.498 1.00 . A A . 36 GLU C 1 1 14 13139 1 1 36 GLU CA C -7.202 3.256 7.870 1.00 . A A . 36 GLU CA 1 1 14 13140 1 1 36 GLU CB C -8.143 3.762 8.966 1.00 . A A . 36 GLU CB 1 1 14 13141 1 1 36 GLU CD C -8.278 4.921 11.207 1.00 . A A . 36 GLU CD 1 1 14 13142 1 1 36 GLU CG C -7.502 4.763 9.915 1.00 . A A . 36 GLU CG 1 1 14 13143 1 1 36 GLU H H -8.745 1.906 7.347 1.00 . A A . 36 GLU H 1 1 14 13144 1 1 36 GLU HA H -6.932 4.081 7.231 1.00 . A A . 36 GLU HA 1 1 14 13145 1 1 36 GLU HB2 H -8.995 4.235 8.500 1.00 . A A . 36 GLU HB2 1 1 14 13146 1 1 36 GLU HB3 H -8.486 2.917 9.547 1.00 . A A . 36 GLU HB3 1 1 14 13147 1 1 36 GLU HG2 H -6.504 4.428 10.152 1.00 . A A . 36 GLU HG2 1 1 14 13148 1 1 36 GLU HG3 H -7.451 5.723 9.424 1.00 . A A . 36 GLU HG3 1 1 14 13149 1 1 36 GLU N N -7.881 2.258 7.050 1.00 . A A . 36 GLU N 1 1 14 13150 1 1 36 GLU O O -4.979 3.414 8.764 1.00 . A A . 36 GLU O 1 1 14 13151 1 1 36 GLU OE1 O -8.427 3.918 11.937 1.00 . A A . 36 GLU OE1 1 1 14 13152 1 1 36 GLU OE2 O -8.738 6.047 11.489 1.00 . A A . 36 GLU OE2 1 1 14 13153 1 1 37 LYS C C -3.791 0.230 8.285 1.00 . A A . 37 LYS C 1 1 14 13154 1 1 37 LYS CA C -4.777 0.715 9.343 1.00 . A A . 37 LYS CA 1 1 14 13155 1 1 37 LYS CB C -5.233 -0.461 10.207 1.00 . A A . 37 LYS CB 1 1 14 13156 1 1 37 LYS CD C -7.586 -0.185 11.045 1.00 . A A . 37 LYS CD 1 1 14 13157 1 1 37 LYS CE C -7.989 -1.641 10.875 1.00 . A A . 37 LYS CE 1 1 14 13158 1 1 37 LYS CG C -6.109 -0.051 11.380 1.00 . A A . 37 LYS CG 1 1 14 13159 1 1 37 LYS H H -6.720 0.845 8.509 1.00 . A A . 37 LYS H 1 1 14 13160 1 1 37 LYS HA H -4.276 1.436 9.971 1.00 . A A . 37 LYS HA 1 1 14 13161 1 1 37 LYS HB2 H -5.793 -1.150 9.591 1.00 . A A . 37 LYS HB2 1 1 14 13162 1 1 37 LYS HB3 H -4.361 -0.968 10.596 1.00 . A A . 37 LYS HB3 1 1 14 13163 1 1 37 LYS HD2 H -8.166 0.247 11.848 1.00 . A A . 37 LYS HD2 1 1 14 13164 1 1 37 LYS HD3 H -7.786 0.346 10.126 1.00 . A A . 37 LYS HD3 1 1 14 13165 1 1 37 LYS HE2 H -8.684 -1.714 10.052 1.00 . A A . 37 LYS HE2 1 1 14 13166 1 1 37 LYS HE3 H -7.106 -2.221 10.653 1.00 . A A . 37 LYS HE3 1 1 14 13167 1 1 37 LYS HG2 H -5.882 -0.684 12.225 1.00 . A A . 37 LYS HG2 1 1 14 13168 1 1 37 LYS HG3 H -5.896 0.978 11.632 1.00 . A A . 37 LYS HG3 1 1 14 13169 1 1 37 LYS HZ1 H -8.361 -3.182 12.235 1.00 . A A . 37 LYS HZ1 1 1 14 13170 1 1 37 LYS HZ2 H -9.666 -2.129 12.019 1.00 . A A . 37 LYS HZ2 1 1 14 13171 1 1 37 LYS HZ3 H -8.332 -1.642 12.936 1.00 . A A . 37 LYS HZ3 1 1 14 13172 1 1 37 LYS N N -5.929 1.375 8.738 1.00 . A A . 37 LYS N 1 1 14 13173 1 1 37 LYS NZ N -8.633 -2.186 12.103 1.00 . A A . 37 LYS NZ 1 1 14 13174 1 1 37 LYS O O -2.609 0.037 8.570 1.00 . A A . 37 LYS O 1 1 14 13175 1 1 38 ASP C C -2.612 0.734 5.405 1.00 . A A . 38 ASP C 1 1 14 13176 1 1 38 ASP CA C -3.421 -0.423 5.975 1.00 . A A . 38 ASP CA 1 1 14 13177 1 1 38 ASP CB C -4.260 -1.072 4.873 1.00 . A A . 38 ASP CB 1 1 14 13178 1 1 38 ASP CG C -4.437 -2.564 5.082 1.00 . A A . 38 ASP CG 1 1 14 13179 1 1 38 ASP H H -5.224 0.206 6.888 1.00 . A A . 38 ASP H 1 1 14 13180 1 1 38 ASP HA H -2.740 -1.159 6.379 1.00 . A A . 38 ASP HA 1 1 14 13181 1 1 38 ASP HB2 H -5.237 -0.611 4.855 1.00 . A A . 38 ASP HB2 1 1 14 13182 1 1 38 ASP HB3 H -3.776 -0.915 3.920 1.00 . A A . 38 ASP HB3 1 1 14 13183 1 1 38 ASP N N -4.276 0.037 7.063 1.00 . A A . 38 ASP N 1 1 14 13184 1 1 38 ASP O O -1.411 0.607 5.167 1.00 . A A . 38 ASP O 1 1 14 13185 1 1 38 ASP OD1 O -3.694 -3.142 5.901 1.00 . A A . 38 ASP OD1 1 1 14 13186 1 1 38 ASP OD2 O -5.322 -3.154 4.425 1.00 . A A . 38 ASP OD2 1 1 14 13187 1 1 39 ALA C C -1.578 3.581 5.647 1.00 . A A . 39 ALA C 1 1 14 13188 1 1 39 ALA CA C -2.613 3.048 4.662 1.00 . A A . 39 ALA CA 1 1 14 13189 1 1 39 ALA CB C -3.637 4.123 4.333 1.00 . A A . 39 ALA CB 1 1 14 13190 1 1 39 ALA H H -4.230 1.907 5.410 1.00 . A A . 39 ALA H 1 1 14 13191 1 1 39 ALA HA H -2.113 2.767 3.747 1.00 . A A . 39 ALA HA 1 1 14 13192 1 1 39 ALA HB1 H -3.361 4.614 3.412 1.00 . A A . 39 ALA HB1 1 1 14 13193 1 1 39 ALA HB2 H -3.667 4.849 5.132 1.00 . A A . 39 ALA HB2 1 1 14 13194 1 1 39 ALA HB3 H -4.612 3.671 4.221 1.00 . A A . 39 ALA HB3 1 1 14 13195 1 1 39 ALA N N -3.274 1.864 5.195 1.00 . A A . 39 ALA N 1 1 14 13196 1 1 39 ALA O O -0.625 4.255 5.255 1.00 . A A . 39 ALA O 1 1 14 13197 1 1 40 TYR C C 0.512 3.060 7.813 1.00 . A A . 40 TYR C 1 1 14 13198 1 1 40 TYR CA C -0.851 3.726 7.967 1.00 . A A . 40 TYR CA 1 1 14 13199 1 1 40 TYR CB C -1.429 3.421 9.349 1.00 . A A . 40 TYR CB 1 1 14 13200 1 1 40 TYR CD1 C -0.282 5.174 10.755 1.00 . A A . 40 TYR CD1 1 1 14 13201 1 1 40 TYR CD2 C 0.086 2.881 11.294 1.00 . A A . 40 TYR CD2 1 1 14 13202 1 1 40 TYR CE1 C 0.545 5.556 11.793 1.00 . A A . 40 TYR CE1 1 1 14 13203 1 1 40 TYR CE2 C 0.914 3.254 12.335 1.00 . A A . 40 TYR CE2 1 1 14 13204 1 1 40 TYR CG C -0.524 3.834 10.488 1.00 . A A . 40 TYR CG 1 1 14 13205 1 1 40 TYR CZ C 1.140 4.593 12.581 1.00 . A A . 40 TYR CZ 1 1 14 13206 1 1 40 TYR H H -2.549 2.736 7.182 1.00 . A A . 40 TYR H 1 1 14 13207 1 1 40 TYR HA H -0.731 4.794 7.866 1.00 . A A . 40 TYR HA 1 1 14 13208 1 1 40 TYR HB2 H -2.367 3.946 9.464 1.00 . A A . 40 TYR HB2 1 1 14 13209 1 1 40 TYR HB3 H -1.604 2.355 9.432 1.00 . A A . 40 TYR HB3 1 1 14 13210 1 1 40 TYR HD1 H -0.750 5.926 10.137 1.00 . A A . 40 TYR HD1 1 1 14 13211 1 1 40 TYR HD2 H -0.094 1.834 11.097 1.00 . A A . 40 TYR HD2 1 1 14 13212 1 1 40 TYR HE1 H 0.722 6.604 11.985 1.00 . A A . 40 TYR HE1 1 1 14 13213 1 1 40 TYR HE2 H 1.381 2.499 12.951 1.00 . A A . 40 TYR HE2 1 1 14 13214 1 1 40 TYR HH H 1.570 5.706 14.088 1.00 . A A . 40 TYR HH 1 1 14 13215 1 1 40 TYR N N -1.771 3.276 6.928 1.00 . A A . 40 TYR N 1 1 14 13216 1 1 40 TYR O O 1.530 3.736 7.658 1.00 . A A . 40 TYR O 1 1 14 13217 1 1 40 TYR OH O 1.965 4.969 13.617 1.00 . A A . 40 TYR OH 1 1 14 13218 1 1 41 ARG C C 2.466 1.298 6.411 1.00 . A A . 41 ARG C 1 1 14 13219 1 1 41 ARG CA C 1.767 0.973 7.726 1.00 . A A . 41 ARG CA 1 1 14 13220 1 1 41 ARG CB C 1.484 -0.528 7.808 1.00 . A A . 41 ARG CB 1 1 14 13221 1 1 41 ARG CD C 0.191 -2.347 8.958 1.00 . A A . 41 ARG CD 1 1 14 13222 1 1 41 ARG CG C 0.766 -0.944 9.079 1.00 . A A . 41 ARG CG 1 1 14 13223 1 1 41 ARG CZ C -2.005 -3.426 8.662 1.00 . A A . 41 ARG CZ 1 1 14 13224 1 1 41 ARG H H -0.316 1.249 7.986 1.00 . A A . 41 ARG H 1 1 14 13225 1 1 41 ARG HA H 2.415 1.254 8.543 1.00 . A A . 41 ARG HA 1 1 14 13226 1 1 41 ARG HB2 H 0.874 -0.812 6.964 1.00 . A A . 41 ARG HB2 1 1 14 13227 1 1 41 ARG HB3 H 2.422 -1.061 7.759 1.00 . A A . 41 ARG HB3 1 1 14 13228 1 1 41 ARG HD2 H 0.668 -2.849 8.131 1.00 . A A . 41 ARG HD2 1 1 14 13229 1 1 41 ARG HD3 H 0.398 -2.886 9.872 1.00 . A A . 41 ARG HD3 1 1 14 13230 1 1 41 ARG HE H -1.686 -1.457 8.632 1.00 . A A . 41 ARG HE 1 1 14 13231 1 1 41 ARG HG2 H 1.464 -0.922 9.902 1.00 . A A . 41 ARG HG2 1 1 14 13232 1 1 41 ARG HG3 H -0.040 -0.251 9.270 1.00 . A A . 41 ARG HG3 1 1 14 13233 1 1 41 ARG HH11 H -0.471 -4.713 8.949 1.00 . A A . 41 ARG HH11 1 1 14 13234 1 1 41 ARG HH12 H -2.026 -5.447 8.740 1.00 . A A . 41 ARG HH12 1 1 14 13235 1 1 41 ARG HH21 H -3.731 -2.420 8.358 1.00 . A A . 41 ARG HH21 1 1 14 13236 1 1 41 ARG HH22 H -3.876 -4.146 8.405 1.00 . A A . 41 ARG HH22 1 1 14 13237 1 1 41 ARG N N 0.527 1.731 7.859 1.00 . A A . 41 ARG N 1 1 14 13238 1 1 41 ARG NE N -1.253 -2.330 8.735 1.00 . A A . 41 ARG NE 1 1 14 13239 1 1 41 ARG NH1 N -1.455 -4.628 8.794 1.00 . A A . 41 ARG NH1 1 1 14 13240 1 1 41 ARG NH2 N -3.311 -3.322 8.459 1.00 . A A . 41 ARG NH2 1 1 14 13241 1 1 41 ARG O O 3.694 1.369 6.349 1.00 . A A . 41 ARG O 1 1 14 13242 1 1 42 LEU C C 3.147 3.013 4.101 1.00 . A A . 42 LEU C 1 1 14 13243 1 1 42 LEU CA C 2.218 1.805 4.039 1.00 . A A . 42 LEU CA 1 1 14 13244 1 1 42 LEU CB C 1.082 2.072 3.051 1.00 . A A . 42 LEU CB 1 1 14 13245 1 1 42 LEU CD1 C -0.737 1.195 1.567 1.00 . A A . 42 LEU CD1 1 1 14 13246 1 1 42 LEU CD2 C 1.499 0.077 1.593 1.00 . A A . 42 LEU CD2 1 1 14 13247 1 1 42 LEU CG C 0.464 0.823 2.421 1.00 . A A . 42 LEU CG 1 1 14 13248 1 1 42 LEU H H 0.705 1.419 5.471 1.00 . A A . 42 LEU H 1 1 14 13249 1 1 42 LEU HA H 2.782 0.948 3.702 1.00 . A A . 42 LEU HA 1 1 14 13250 1 1 42 LEU HB2 H 0.303 2.613 3.569 1.00 . A A . 42 LEU HB2 1 1 14 13251 1 1 42 LEU HB3 H 1.463 2.696 2.257 1.00 . A A . 42 LEU HB3 1 1 14 13252 1 1 42 LEU HD11 H -0.434 1.273 0.534 1.00 . A A . 42 LEU HD11 1 1 14 13253 1 1 42 LEU HD12 H -1.134 2.144 1.897 1.00 . A A . 42 LEU HD12 1 1 14 13254 1 1 42 LEU HD13 H -1.496 0.434 1.662 1.00 . A A . 42 LEU HD13 1 1 14 13255 1 1 42 LEU HD21 H 2.005 0.771 0.938 1.00 . A A . 42 LEU HD21 1 1 14 13256 1 1 42 LEU HD22 H 1.009 -0.683 1.003 1.00 . A A . 42 LEU HD22 1 1 14 13257 1 1 42 LEU HD23 H 2.220 -0.386 2.251 1.00 . A A . 42 LEU HD23 1 1 14 13258 1 1 42 LEU HG H 0.124 0.163 3.206 1.00 . A A . 42 LEU HG 1 1 14 13259 1 1 42 LEU N N 1.677 1.491 5.358 1.00 . A A . 42 LEU N 1 1 14 13260 1 1 42 LEU O O 4.285 2.956 3.635 1.00 . A A . 42 LEU O 1 1 14 13261 1 1 43 GLU C C 4.820 5.044 5.395 1.00 . A A . 43 GLU C 1 1 14 13262 1 1 43 GLU CA C 3.442 5.330 4.804 1.00 . A A . 43 GLU CA 1 1 14 13263 1 1 43 GLU CB C 2.703 6.348 5.675 1.00 . A A . 43 GLU CB 1 1 14 13264 1 1 43 GLU CD C 2.726 8.633 6.753 1.00 . A A . 43 GLU CD 1 1 14 13265 1 1 43 GLU CG C 3.437 7.670 5.820 1.00 . A A . 43 GLU CG 1 1 14 13266 1 1 43 GLU H H 1.742 4.088 5.033 1.00 . A A . 43 GLU H 1 1 14 13267 1 1 43 GLU HA H 3.568 5.743 3.814 1.00 . A A . 43 GLU HA 1 1 14 13268 1 1 43 GLU HB2 H 1.735 6.545 5.235 1.00 . A A . 43 GLU HB2 1 1 14 13269 1 1 43 GLU HB3 H 2.565 5.928 6.660 1.00 . A A . 43 GLU HB3 1 1 14 13270 1 1 43 GLU HG2 H 4.425 7.480 6.210 1.00 . A A . 43 GLU HG2 1 1 14 13271 1 1 43 GLU HG3 H 3.518 8.132 4.846 1.00 . A A . 43 GLU HG3 1 1 14 13272 1 1 43 GLU N N 2.657 4.106 4.680 1.00 . A A . 43 GLU N 1 1 14 13273 1 1 43 GLU O O 5.792 5.739 5.095 1.00 . A A . 43 GLU O 1 1 14 13274 1 1 43 GLU OE1 O 2.213 8.176 7.796 1.00 . A A . 43 GLU OE1 1 1 14 13275 1 1 43 GLU OE2 O 2.683 9.840 6.440 1.00 . A A . 43 GLU OE2 1 1 14 13276 1 1 44 ILE C C 6.923 2.646 5.998 1.00 . A A . 44 ILE C 1 1 14 13277 1 1 44 ILE CA C 6.155 3.637 6.865 1.00 . A A . 44 ILE CA 1 1 14 13278 1 1 44 ILE CB C 5.919 3.017 8.254 1.00 . A A . 44 ILE CB 1 1 14 13279 1 1 44 ILE CD1 C 5.272 3.850 10.588 1.00 . A A . 44 ILE CD1 1 1 14 13280 1 1 44 ILE CG1 C 5.034 3.948 9.096 1.00 . A A . 44 ILE CG1 1 1 14 13281 1 1 44 ILE CG2 C 7.253 2.749 8.942 1.00 . A A . 44 ILE CG2 1 1 14 13282 1 1 44 ILE H H 4.088 3.501 6.432 1.00 . A A . 44 ILE H 1 1 14 13283 1 1 44 ILE HA H 6.749 4.531 6.990 1.00 . A A . 44 ILE HA 1 1 14 13284 1 1 44 ILE HB H 5.414 2.074 8.121 1.00 . A A . 44 ILE HB 1 1 14 13285 1 1 44 ILE HD11 H 6.297 4.112 10.804 1.00 . A A . 44 ILE HD11 1 1 14 13286 1 1 44 ILE HD12 H 5.083 2.839 10.917 1.00 . A A . 44 ILE HD12 1 1 14 13287 1 1 44 ILE HD13 H 4.609 4.528 11.104 1.00 . A A . 44 ILE HD13 1 1 14 13288 1 1 44 ILE HG12 H 5.217 4.969 8.801 1.00 . A A . 44 ILE HG12 1 1 14 13289 1 1 44 ILE HG13 H 3.996 3.707 8.909 1.00 . A A . 44 ILE HG13 1 1 14 13290 1 1 44 ILE HG21 H 7.856 2.108 8.317 1.00 . A A . 44 ILE HG21 1 1 14 13291 1 1 44 ILE HG22 H 7.076 2.265 9.890 1.00 . A A . 44 ILE HG22 1 1 14 13292 1 1 44 ILE HG23 H 7.769 3.682 9.105 1.00 . A A . 44 ILE HG23 1 1 14 13293 1 1 44 ILE N N 4.897 4.017 6.233 1.00 . A A . 44 ILE N 1 1 14 13294 1 1 44 ILE O O 8.135 2.772 5.816 1.00 . A A . 44 ILE O 1 1 14 13295 1 1 45 VAL C C 7.351 1.236 3.320 1.00 . A A . 45 VAL C 1 1 14 13296 1 1 45 VAL CA C 6.821 0.640 4.621 1.00 . A A . 45 VAL CA 1 1 14 13297 1 1 45 VAL CB C 5.829 -0.476 4.287 1.00 . A A . 45 VAL CB 1 1 14 13298 1 1 45 VAL CG1 C 6.526 -1.615 3.556 1.00 . A A . 45 VAL CG1 1 1 14 13299 1 1 45 VAL CG2 C 5.138 -0.979 5.548 1.00 . A A . 45 VAL CG2 1 1 14 13300 1 1 45 VAL H H 5.251 1.610 5.652 1.00 . A A . 45 VAL H 1 1 14 13301 1 1 45 VAL HA H 7.635 0.205 5.160 1.00 . A A . 45 VAL HA 1 1 14 13302 1 1 45 VAL HB H 5.087 -0.067 3.636 1.00 . A A . 45 VAL HB 1 1 14 13303 1 1 45 VAL HG11 H 6.741 -1.311 2.543 1.00 . A A . 45 VAL HG11 1 1 14 13304 1 1 45 VAL HG12 H 5.883 -2.482 3.544 1.00 . A A . 45 VAL HG12 1 1 14 13305 1 1 45 VAL HG13 H 7.448 -1.856 4.063 1.00 . A A . 45 VAL HG13 1 1 14 13306 1 1 45 VAL HG21 H 5.193 -2.057 5.585 1.00 . A A . 45 VAL HG21 1 1 14 13307 1 1 45 VAL HG22 H 4.103 -0.674 5.536 1.00 . A A . 45 VAL HG22 1 1 14 13308 1 1 45 VAL HG23 H 5.627 -0.564 6.417 1.00 . A A . 45 VAL HG23 1 1 14 13309 1 1 45 VAL N N 6.212 1.657 5.468 1.00 . A A . 45 VAL N 1 1 14 13310 1 1 45 VAL O O 8.212 0.649 2.666 1.00 . A A . 45 VAL O 1 1 14 13311 1 1 46 THR C C 8.388 4.052 1.987 1.00 . A A . 46 THR C 1 1 14 13312 1 1 46 THR CA C 7.248 3.068 1.722 1.00 . A A . 46 THR CA 1 1 14 13313 1 1 46 THR CB C 6.062 3.801 1.102 1.00 . A A . 46 THR CB 1 1 14 13314 1 1 46 THR CG2 C 5.077 2.876 0.418 1.00 . A A . 46 THR CG2 1 1 14 13315 1 1 46 THR H H 6.144 2.823 3.501 1.00 . A A . 46 THR H 1 1 14 13316 1 1 46 THR HA H 7.593 2.313 1.033 1.00 . A A . 46 THR HA 1 1 14 13317 1 1 46 THR HB H 6.429 4.495 0.367 1.00 . A A . 46 THR HB 1 1 14 13318 1 1 46 THR HG1 H 4.677 5.066 1.664 1.00 . A A . 46 THR HG1 1 1 14 13319 1 1 46 THR HG21 H 4.070 3.199 0.636 1.00 . A A . 46 THR HG21 1 1 14 13320 1 1 46 THR HG22 H 5.217 1.868 0.781 1.00 . A A . 46 THR HG22 1 1 14 13321 1 1 46 THR HG23 H 5.240 2.901 -0.649 1.00 . A A . 46 THR HG23 1 1 14 13322 1 1 46 THR N N 6.831 2.401 2.946 1.00 . A A . 46 THR N 1 1 14 13323 1 1 46 THR O O 8.587 5.000 1.227 1.00 . A A . 46 THR O 1 1 14 13324 1 1 46 THR OG1 O 5.355 4.533 2.086 1.00 . A A . 46 THR OG1 1 1 14 13325 1 1 47 ALA C C 9.792 6.139 3.572 1.00 . A A . 47 ALA C 1 1 14 13326 1 1 47 ALA CA C 10.249 4.692 3.421 1.00 . A A . 47 ALA CA 1 1 14 13327 1 1 47 ALA CB C 11.350 4.591 2.377 1.00 . A A . 47 ALA CB 1 1 14 13328 1 1 47 ALA H H 8.930 3.054 3.633 1.00 . A A . 47 ALA H 1 1 14 13329 1 1 47 ALA HA H 10.648 4.351 4.365 1.00 . A A . 47 ALA HA 1 1 14 13330 1 1 47 ALA HB1 H 11.998 5.452 2.452 1.00 . A A . 47 ALA HB1 1 1 14 13331 1 1 47 ALA HB2 H 10.910 4.558 1.391 1.00 . A A . 47 ALA HB2 1 1 14 13332 1 1 47 ALA HB3 H 11.924 3.693 2.544 1.00 . A A . 47 ALA HB3 1 1 14 13333 1 1 47 ALA N N 9.133 3.824 3.065 1.00 . A A . 47 ALA N 1 1 14 13334 1 1 47 ALA O O 10.552 7.072 3.309 1.00 . A A . 47 ALA O 1 1 14 13335 1 1 48 GLY C C 7.762 8.362 2.856 1.00 . A A . 48 GLY C 1 1 14 13336 1 1 48 GLY CA C 8.010 7.656 4.175 1.00 . A A . 48 GLY CA 1 1 14 13337 1 1 48 GLY H H 7.986 5.538 4.191 1.00 . A A . 48 GLY H 1 1 14 13338 1 1 48 GLY HA2 H 7.077 7.588 4.716 1.00 . A A . 48 GLY HA2 1 1 14 13339 1 1 48 GLY HA3 H 8.709 8.238 4.757 1.00 . A A . 48 GLY HA3 1 1 14 13340 1 1 48 GLY N N 8.546 6.320 3.998 1.00 . A A . 48 GLY N 1 1 14 13341 1 1 48 GLY O O 7.769 9.591 2.793 1.00 . A A . 48 GLY O 1 1 14 13342 1 1 49 ALA C C 5.895 8.755 0.401 1.00 . A A . 49 ALA C 1 1 14 13343 1 1 49 ALA CA C 7.289 8.142 0.479 1.00 . A A . 49 ALA CA 1 1 14 13344 1 1 49 ALA CB C 7.459 7.072 -0.587 1.00 . A A . 49 ALA CB 1 1 14 13345 1 1 49 ALA H H 7.548 6.611 1.916 1.00 . A A . 49 ALA H 1 1 14 13346 1 1 49 ALA HA H 8.022 8.916 0.298 1.00 . A A . 49 ALA HA 1 1 14 13347 1 1 49 ALA HB1 H 6.652 6.357 -0.511 1.00 . A A . 49 ALA HB1 1 1 14 13348 1 1 49 ALA HB2 H 8.402 6.565 -0.443 1.00 . A A . 49 ALA HB2 1 1 14 13349 1 1 49 ALA HB3 H 7.442 7.529 -1.565 1.00 . A A . 49 ALA HB3 1 1 14 13350 1 1 49 ALA N N 7.541 7.584 1.802 1.00 . A A . 49 ALA N 1 1 14 13351 1 1 49 ALA O O 5.738 9.921 0.037 1.00 . A A . 49 ALA O 1 1 14 13352 1 1 50 LEU C C 3.182 9.247 1.959 1.00 . A A . 50 LEU C 1 1 14 13353 1 1 50 LEU CA C 3.504 8.425 0.716 1.00 . A A . 50 LEU CA 1 1 14 13354 1 1 50 LEU CB C 2.548 7.233 0.614 1.00 . A A . 50 LEU CB 1 1 14 13355 1 1 50 LEU CD1 C 1.939 5.071 -0.499 1.00 . A A . 50 LEU CD1 1 1 14 13356 1 1 50 LEU CD2 C 2.262 7.136 -1.873 1.00 . A A . 50 LEU CD2 1 1 14 13357 1 1 50 LEU CG C 2.715 6.372 -0.638 1.00 . A A . 50 LEU CG 1 1 14 13358 1 1 50 LEU H H 5.077 7.041 1.027 1.00 . A A . 50 LEU H 1 1 14 13359 1 1 50 LEU HA H 3.382 9.048 -0.157 1.00 . A A . 50 LEU HA 1 1 14 13360 1 1 50 LEU HB2 H 2.696 6.605 1.481 1.00 . A A . 50 LEU HB2 1 1 14 13361 1 1 50 LEU HB3 H 1.536 7.610 0.632 1.00 . A A . 50 LEU HB3 1 1 14 13362 1 1 50 LEU HD11 H 1.662 4.711 -1.479 1.00 . A A . 50 LEU HD11 1 1 14 13363 1 1 50 LEU HD12 H 1.047 5.246 0.086 1.00 . A A . 50 LEU HD12 1 1 14 13364 1 1 50 LEU HD13 H 2.555 4.335 -0.006 1.00 . A A . 50 LEU HD13 1 1 14 13365 1 1 50 LEU HD21 H 1.240 6.877 -2.103 1.00 . A A . 50 LEU HD21 1 1 14 13366 1 1 50 LEU HD22 H 2.896 6.876 -2.710 1.00 . A A . 50 LEU HD22 1 1 14 13367 1 1 50 LEU HD23 H 2.333 8.198 -1.686 1.00 . A A . 50 LEU HD23 1 1 14 13368 1 1 50 LEU HG H 3.760 6.125 -0.760 1.00 . A A . 50 LEU HG 1 1 14 13369 1 1 50 LEU N N 4.887 7.961 0.745 1.00 . A A . 50 LEU N 1 1 14 13370 1 1 50 LEU O O 3.926 9.227 2.939 1.00 . A A . 50 LEU O 1 1 14 13371 1 1 51 LYS C C 0.245 10.419 3.499 1.00 . A A . 51 LYS C 1 1 14 13372 1 1 51 LYS CA C 1.646 10.800 3.035 1.00 . A A . 51 LYS CA 1 1 14 13373 1 1 51 LYS CB C 1.683 12.279 2.646 1.00 . A A . 51 LYS CB 1 1 14 13374 1 1 51 LYS CD C 2.804 13.208 4.694 1.00 . A A . 51 LYS CD 1 1 14 13375 1 1 51 LYS CE C 2.558 13.861 6.045 1.00 . A A . 51 LYS CE 1 1 14 13376 1 1 51 LYS CG C 1.553 13.222 3.831 1.00 . A A . 51 LYS CG 1 1 14 13377 1 1 51 LYS H H 1.514 9.944 1.103 1.00 . A A . 51 LYS H 1 1 14 13378 1 1 51 LYS HA H 2.338 10.634 3.848 1.00 . A A . 51 LYS HA 1 1 14 13379 1 1 51 LYS HB2 H 2.619 12.486 2.150 1.00 . A A . 51 LYS HB2 1 1 14 13380 1 1 51 LYS HB3 H 0.871 12.480 1.963 1.00 . A A . 51 LYS HB3 1 1 14 13381 1 1 51 LYS HD2 H 3.110 12.183 4.852 1.00 . A A . 51 LYS HD2 1 1 14 13382 1 1 51 LYS HD3 H 3.589 13.744 4.182 1.00 . A A . 51 LYS HD3 1 1 14 13383 1 1 51 LYS HE2 H 1.677 14.481 5.975 1.00 . A A . 51 LYS HE2 1 1 14 13384 1 1 51 LYS HE3 H 2.396 13.088 6.781 1.00 . A A . 51 LYS HE3 1 1 14 13385 1 1 51 LYS HG2 H 1.393 14.224 3.464 1.00 . A A . 51 LYS HG2 1 1 14 13386 1 1 51 LYS HG3 H 0.708 12.917 4.431 1.00 . A A . 51 LYS HG3 1 1 14 13387 1 1 51 LYS HZ1 H 4.207 15.078 5.638 1.00 . A A . 51 LYS HZ1 1 1 14 13388 1 1 51 LYS HZ2 H 4.374 14.141 7.036 1.00 . A A . 51 LYS HZ2 1 1 14 13389 1 1 51 LYS HZ3 H 3.371 15.503 7.047 1.00 . A A . 51 LYS HZ3 1 1 14 13390 1 1 51 LYS N N 2.067 9.970 1.913 1.00 . A A . 51 LYS N 1 1 14 13391 1 1 51 LYS NZ N 3.708 14.704 6.472 1.00 . A A . 51 LYS NZ 1 1 14 13392 1 1 51 LYS O O -0.716 10.490 2.732 1.00 . A A . 51 LYS O 1 1 14 13393 1 1 52 TYR C C -1.982 10.841 5.699 1.00 . A A . 52 TYR C 1 1 14 13394 1 1 52 TYR CA C -1.152 9.618 5.325 1.00 . A A . 52 TYR CA 1 1 14 13395 1 1 52 TYR CB C -0.941 8.736 6.558 1.00 . A A . 52 TYR CB 1 1 14 13396 1 1 52 TYR CD1 C -3.282 8.702 7.505 1.00 . A A . 52 TYR CD1 1 1 14 13397 1 1 52 TYR CD2 C -2.271 6.623 6.926 1.00 . A A . 52 TYR CD2 1 1 14 13398 1 1 52 TYR CE1 C -4.421 8.039 7.917 1.00 . A A . 52 TYR CE1 1 1 14 13399 1 1 52 TYR CE2 C -3.407 5.952 7.336 1.00 . A A . 52 TYR CE2 1 1 14 13400 1 1 52 TYR CG C -2.189 8.008 7.004 1.00 . A A . 52 TYR CG 1 1 14 13401 1 1 52 TYR CZ C -4.479 6.664 7.829 1.00 . A A . 52 TYR CZ 1 1 14 13402 1 1 52 TYR H H 0.934 9.975 5.323 1.00 . A A . 52 TYR H 1 1 14 13403 1 1 52 TYR HA H -1.685 9.052 4.576 1.00 . A A . 52 TYR HA 1 1 14 13404 1 1 52 TYR HB2 H -0.186 7.997 6.338 1.00 . A A . 52 TYR HB2 1 1 14 13405 1 1 52 TYR HB3 H -0.604 9.354 7.380 1.00 . A A . 52 TYR HB3 1 1 14 13406 1 1 52 TYR HD1 H -3.237 9.779 7.572 1.00 . A A . 52 TYR HD1 1 1 14 13407 1 1 52 TYR HD2 H -1.429 6.069 6.539 1.00 . A A . 52 TYR HD2 1 1 14 13408 1 1 52 TYR HE1 H -5.260 8.597 8.304 1.00 . A A . 52 TYR HE1 1 1 14 13409 1 1 52 TYR HE2 H -3.452 4.876 7.267 1.00 . A A . 52 TYR HE2 1 1 14 13410 1 1 52 TYR HH H -5.362 5.190 8.690 1.00 . A A . 52 TYR HH 1 1 14 13411 1 1 52 TYR N N 0.133 10.011 4.760 1.00 . A A . 52 TYR N 1 1 14 13412 1 1 52 TYR O O -1.554 11.674 6.499 1.00 . A A . 52 TYR O 1 1 14 13413 1 1 52 TYR OH O -5.611 6.000 8.237 1.00 . A A . 52 TYR OH 1 1 14 13414 1 1 53 GLN C C -5.305 11.588 6.149 1.00 . A A . 53 GLN C 1 1 14 13415 1 1 53 GLN CA C -4.067 12.059 5.395 1.00 . A A . 53 GLN CA 1 1 14 13416 1 1 53 GLN CB C -4.480 12.745 4.091 1.00 . A A . 53 GLN CB 1 1 14 13417 1 1 53 GLN CD C -3.003 14.465 2.976 1.00 . A A . 53 GLN CD 1 1 14 13418 1 1 53 GLN CG C -3.320 12.992 3.138 1.00 . A A . 53 GLN CG 1 1 14 13419 1 1 53 GLN H H -3.460 10.242 4.494 1.00 . A A . 53 GLN H 1 1 14 13420 1 1 53 GLN HA H -3.533 12.767 6.009 1.00 . A A . 53 GLN HA 1 1 14 13421 1 1 53 GLN HB2 H -5.206 12.124 3.585 1.00 . A A . 53 GLN HB2 1 1 14 13422 1 1 53 GLN HB3 H -4.935 13.695 4.326 1.00 . A A . 53 GLN HB3 1 1 14 13423 1 1 53 GLN HE21 H -1.262 14.219 3.905 1.00 . A A . 53 GLN HE21 1 1 14 13424 1 1 53 GLN HE22 H -1.610 15.827 3.377 1.00 . A A . 53 GLN HE22 1 1 14 13425 1 1 53 GLN HG2 H -2.444 12.492 3.522 1.00 . A A . 53 GLN HG2 1 1 14 13426 1 1 53 GLN HG3 H -3.574 12.584 2.171 1.00 . A A . 53 GLN HG3 1 1 14 13427 1 1 53 GLN N N -3.174 10.940 5.120 1.00 . A A . 53 GLN N 1 1 14 13428 1 1 53 GLN NE2 N -1.841 14.878 3.468 1.00 . A A . 53 GLN NE2 1 1 14 13429 1 1 53 GLN O O -5.971 10.640 5.735 1.00 . A A . 53 GLN O 1 1 14 13430 1 1 53 GLN OE1 O -3.792 15.224 2.413 1.00 . A A . 53 GLN OE1 1 1 14 13431 1 1 54 GLU C C -8.010 12.661 7.634 1.00 . A A . 54 GLU C 1 1 14 13432 1 1 54 GLU CA C -6.763 11.896 8.076 1.00 . A A . 54 GLU CA 1 1 14 13433 1 1 54 GLU CB C -6.472 12.174 9.555 1.00 . A A . 54 GLU CB 1 1 14 13434 1 1 54 GLU CD C -5.213 11.216 11.523 1.00 . A A . 54 GLU CD 1 1 14 13435 1 1 54 GLU CG C -6.129 10.926 10.351 1.00 . A A . 54 GLU CG 1 1 14 13436 1 1 54 GLU H H -5.035 12.998 7.542 1.00 . A A . 54 GLU H 1 1 14 13437 1 1 54 GLU HA H -6.942 10.839 7.950 1.00 . A A . 54 GLU HA 1 1 14 13438 1 1 54 GLU HB2 H -5.639 12.857 9.622 1.00 . A A . 54 GLU HB2 1 1 14 13439 1 1 54 GLU HB3 H -7.341 12.634 10.004 1.00 . A A . 54 GLU HB3 1 1 14 13440 1 1 54 GLU HG2 H -7.044 10.491 10.727 1.00 . A A . 54 GLU HG2 1 1 14 13441 1 1 54 GLU HG3 H -5.639 10.220 9.696 1.00 . A A . 54 GLU HG3 1 1 14 13442 1 1 54 GLU N N -5.605 12.252 7.261 1.00 . A A . 54 GLU N 1 1 14 13443 1 1 54 GLU O O -8.830 13.060 8.460 1.00 . A A . 54 GLU O 1 1 14 13444 1 1 54 GLU OE1 O -5.156 12.387 11.957 1.00 . A A . 54 GLU OE1 1 1 14 13445 1 1 54 GLU OE2 O -4.553 10.274 12.009 1.00 . A A . 54 GLU OE2 1 1 14 13446 1 1 55 ASN C C -10.430 12.598 5.471 1.00 . A A . 55 ASN C 1 1 14 13447 1 1 55 ASN CA C -9.300 13.568 5.783 1.00 . A A . 55 ASN CA 1 1 14 13448 1 1 55 ASN CB C -8.905 14.332 4.519 1.00 . A A . 55 ASN CB 1 1 14 13449 1 1 55 ASN CG C -8.386 13.415 3.429 1.00 . A A . 55 ASN CG 1 1 14 13450 1 1 55 ASN H H -7.469 12.514 5.714 1.00 . A A . 55 ASN H 1 1 14 13451 1 1 55 ASN HA H -9.639 14.270 6.528 1.00 . A A . 55 ASN HA 1 1 14 13452 1 1 55 ASN HB2 H -9.767 14.859 4.139 1.00 . A A . 55 ASN HB2 1 1 14 13453 1 1 55 ASN HB3 H -8.131 15.044 4.763 1.00 . A A . 55 ASN HB3 1 1 14 13454 1 1 55 ASN HD21 H -10.240 12.982 2.872 1.00 . A A . 55 ASN HD21 1 1 14 13455 1 1 55 ASN HD22 H -8.993 12.208 1.969 1.00 . A A . 55 ASN HD22 1 1 14 13456 1 1 55 ASN N N -8.150 12.857 6.326 1.00 . A A . 55 ASN N 1 1 14 13457 1 1 55 ASN ND2 N -9.300 12.808 2.681 1.00 . A A . 55 ASN ND2 1 1 14 13458 1 1 55 ASN O O -11.610 12.944 5.578 1.00 . A A . 55 ASN O 1 1 14 13459 1 1 55 ASN OD1 O -7.177 13.254 3.259 1.00 . A A . 55 ASN OD1 1 1 14 13460 1 1 56 ALA C C -11.200 9.350 5.902 1.00 . A A . 56 ALA C 1 1 14 13461 1 1 56 ALA CA C -11.050 10.353 4.761 1.00 . A A . 56 ALA CA 1 1 14 13462 1 1 56 ALA CB C -10.660 9.640 3.475 1.00 . A A . 56 ALA CB 1 1 14 13463 1 1 56 ALA H H -9.117 11.163 5.024 1.00 . A A . 56 ALA H 1 1 14 13464 1 1 56 ALA HA H -12.000 10.842 4.601 1.00 . A A . 56 ALA HA 1 1 14 13465 1 1 56 ALA HB1 H -10.100 10.315 2.843 1.00 . A A . 56 ALA HB1 1 1 14 13466 1 1 56 ALA HB2 H -11.550 9.316 2.959 1.00 . A A . 56 ALA HB2 1 1 14 13467 1 1 56 ALA HB3 H -10.050 8.781 3.711 1.00 . A A . 56 ALA HB3 1 1 14 13468 1 1 56 ALA N N -10.070 11.379 5.088 1.00 . A A . 56 ALA N 1 1 14 13469 1 1 56 ALA O O -12.230 8.690 6.030 1.00 . A A . 56 ALA O 1 1 14 13470 1 1 57 TYR C C -10.640 9.014 9.134 1.00 . A A . 57 TYR C 1 1 14 13471 1 1 57 TYR CA C -10.180 8.316 7.859 1.00 . A A . 57 TYR CA 1 1 14 13472 1 1 57 TYR CB C -8.791 7.719 8.078 1.00 . A A . 57 TYR CB 1 1 14 13473 1 1 57 TYR CD1 C -8.488 6.276 6.029 1.00 . A A . 57 TYR CD1 1 1 14 13474 1 1 57 TYR CD2 C -6.975 8.088 6.361 1.00 . A A . 57 TYR CD2 1 1 14 13475 1 1 57 TYR CE1 C -7.834 5.938 4.860 1.00 . A A . 57 TYR CE1 1 1 14 13476 1 1 57 TYR CE2 C -6.315 7.757 5.193 1.00 . A A . 57 TYR CE2 1 1 14 13477 1 1 57 TYR CG C -8.071 7.355 6.799 1.00 . A A . 57 TYR CG 1 1 14 13478 1 1 57 TYR CZ C -6.749 6.682 4.446 1.00 . A A . 57 TYR CZ 1 1 14 13479 1 1 57 TYR H H -9.370 9.792 6.576 1.00 . A A . 57 TYR H 1 1 14 13480 1 1 57 TYR HA H -10.870 7.520 7.625 1.00 . A A . 57 TYR HA 1 1 14 13481 1 1 57 TYR HB2 H -8.179 8.433 8.609 1.00 . A A . 57 TYR HB2 1 1 14 13482 1 1 57 TYR HB3 H -8.885 6.823 8.673 1.00 . A A . 57 TYR HB3 1 1 14 13483 1 1 57 TYR HD1 H -9.340 5.695 6.355 1.00 . A A . 57 TYR HD1 1 1 14 13484 1 1 57 TYR HD2 H -6.638 8.929 6.950 1.00 . A A . 57 TYR HD2 1 1 14 13485 1 1 57 TYR HE1 H -8.173 5.096 4.275 1.00 . A A . 57 TYR HE1 1 1 14 13486 1 1 57 TYR HE2 H -5.465 8.339 4.870 1.00 . A A . 57 TYR HE2 1 1 14 13487 1 1 57 TYR HH H -5.931 5.402 3.267 1.00 . A A . 57 TYR HH 1 1 14 13488 1 1 57 TYR N N -10.160 9.240 6.728 1.00 . A A . 57 TYR N 1 1 14 13489 1 1 57 TYR O O -10.410 8.520 10.239 1.00 . A A . 57 TYR O 1 1 14 13490 1 1 57 TYR OH O -6.093 6.348 3.283 1.00 . A A . 57 TYR OH 1 1 14 13491 1 1 58 ARG C C -13.280 10.630 10.367 1.00 . A A . 58 ARG C 1 1 14 13492 1 1 58 ARG CA C -11.800 10.916 10.126 1.00 . A A . 58 ARG CA 1 1 14 13493 1 1 58 ARG CB C -11.580 12.415 9.905 1.00 . A A . 58 ARG CB 1 1 14 13494 1 1 58 ARG CD C -12.950 14.129 8.663 1.00 . A A . 58 ARG CD 1 1 14 13495 1 1 58 ARG CG C -12.060 12.903 8.543 1.00 . A A . 58 ARG CG 1 1 14 13496 1 1 58 ARG CZ C -15.190 14.854 7.926 1.00 . A A . 58 ARG CZ 1 1 14 13497 1 1 58 ARG H H -11.460 10.506 8.078 1.00 . A A . 58 ARG H 1 1 14 13498 1 1 58 ARG HA H -11.240 10.606 10.994 1.00 . A A . 58 ARG HA 1 1 14 13499 1 1 58 ARG HB2 H -12.120 12.958 10.668 1.00 . A A . 58 ARG HB2 1 1 14 13500 1 1 58 ARG HB3 H -10.530 12.632 9.995 1.00 . A A . 58 ARG HB3 1 1 14 13501 1 1 58 ARG HD2 H -13.060 14.381 9.707 1.00 . A A . 58 ARG HD2 1 1 14 13502 1 1 58 ARG HD3 H -12.480 14.952 8.145 1.00 . A A . 58 ARG HD3 1 1 14 13503 1 1 58 ARG HE H -14.490 12.989 7.803 1.00 . A A . 58 ARG HE 1 1 14 13504 1 1 58 ARG HG2 H -11.200 13.156 7.944 1.00 . A A . 58 ARG HG2 1 1 14 13505 1 1 58 ARG HG3 H -12.610 12.111 8.063 1.00 . A A . 58 ARG HG3 1 1 14 13506 1 1 58 ARG HH11 H -14.040 16.330 8.702 1.00 . A A . 58 ARG HH11 1 1 14 13507 1 1 58 ARG HH12 H -15.620 16.813 8.175 1.00 . A A . 58 ARG HH12 1 1 14 13508 1 1 58 ARG HH21 H -16.560 13.622 7.109 1.00 . A A . 58 ARG HH21 1 1 14 13509 1 1 58 ARG HH22 H -17.050 15.276 7.271 1.00 . A A . 58 ARG HH22 1 1 14 13510 1 1 58 ARG N N -11.300 10.159 8.980 1.00 . A A . 58 ARG N 1 1 14 13511 1 1 58 ARG NE N -14.270 13.901 8.087 1.00 . A A . 58 ARG NE 1 1 14 13512 1 1 58 ARG NH1 N -14.930 16.102 8.298 1.00 . A A . 58 ARG NH1 1 1 14 13513 1 1 58 ARG NH2 N -16.360 14.561 7.392 1.00 . A A . 58 ARG NH2 1 1 14 13514 1 1 58 ARG O O -14.070 11.545 10.578 1.00 . A A . 58 ARG O 1 1 14 13515 1 1 59 GLN C C -15.120 7.922 11.677 1.00 . A A . 59 GLN C 1 1 14 13516 1 1 59 GLN CA C -15.020 8.941 10.546 1.00 . A A . 59 GLN CA 1 1 14 13517 1 1 59 GLN CB C -15.600 8.350 9.260 1.00 . A A . 59 GLN CB 1 1 14 13518 1 1 59 GLN CD C -17.710 8.396 7.876 1.00 . A A . 59 GLN CD 1 1 14 13519 1 1 59 GLN CG C -17.120 8.259 9.264 1.00 . A A . 59 GLN CG 1 1 14 13520 1 1 59 GLN H H -12.960 8.667 10.158 1.00 . A A . 59 GLN H 1 1 14 13521 1 1 59 GLN HA H -15.590 9.817 10.818 1.00 . A A . 59 GLN HA 1 1 14 13522 1 1 59 GLN HB2 H -15.300 8.969 8.427 1.00 . A A . 59 GLN HB2 1 1 14 13523 1 1 59 GLN HB3 H -15.200 7.357 9.121 1.00 . A A . 59 GLN HB3 1 1 14 13524 1 1 59 GLN HE21 H -16.610 6.878 7.224 1.00 . A A . 59 GLN HE21 1 1 14 13525 1 1 59 GLN HE22 H -17.650 7.606 6.053 1.00 . A A . 59 GLN HE22 1 1 14 13526 1 1 59 GLN HG2 H -17.410 7.300 9.670 1.00 . A A . 59 GLN HG2 1 1 14 13527 1 1 59 GLN HG3 H -17.510 9.047 9.890 1.00 . A A . 59 GLN HG3 1 1 14 13528 1 1 59 GLN N N -13.640 9.350 10.332 1.00 . A A . 59 GLN N 1 1 14 13529 1 1 59 GLN NE2 N -17.280 7.541 6.959 1.00 . A A . 59 GLN NE2 1 1 14 13530 1 1 59 GLN O O -15.980 7.042 11.660 1.00 . A A . 59 GLN O 1 1 14 13531 1 1 59 GLN OE1 O -18.560 9.260 7.632 1.00 . A A . 59 GLN OE1 1 1 14 13532 1 1 60 ALA C C -13.810 7.863 15.074 1.00 . A A . 60 ALA C 1 1 14 13533 1 1 60 ALA CA C -14.220 7.138 13.797 1.00 . A A . 60 ALA CA 1 1 14 13534 1 1 60 ALA CB C -13.280 5.970 13.529 1.00 . A A . 60 ALA CB 1 1 14 13535 1 1 60 ALA H H -13.570 8.770 12.616 1.00 . A A . 60 ALA H 1 1 14 13536 1 1 60 ALA HA H -15.220 6.744 13.921 1.00 . A A . 60 ALA HA 1 1 14 13537 1 1 60 ALA HB1 H -13.130 5.866 12.464 1.00 . A A . 60 ALA HB1 1 1 14 13538 1 1 60 ALA HB2 H -13.710 5.063 13.921 1.00 . A A . 60 ALA HB2 1 1 14 13539 1 1 60 ALA HB3 H -12.330 6.153 14.010 1.00 . A A . 60 ALA HB3 1 1 14 13540 1 1 60 ALA N N -14.230 8.048 12.659 1.00 . A A . 60 ALA N 1 1 14 13541 1 1 60 ALA O O -13.170 7.282 15.954 1.00 . A A . 60 ALA O 1 1 14 13542 1 1 61 ALA C C -14.950 10.966 16.624 1.00 . A A . 61 ALA C 1 1 14 13543 1 1 61 ALA CA C -13.860 9.940 16.342 1.00 . A A . 61 ALA CA 1 1 14 13544 1 1 61 ALA CB C -12.520 10.633 16.148 1.00 . A A . 61 ALA CB 1 1 14 13545 1 1 61 ALA H H -14.690 9.543 14.438 1.00 . A A . 61 ALA H 1 1 14 13546 1 1 61 ALA HA H -13.770 9.275 17.189 1.00 . A A . 61 ALA HA 1 1 14 13547 1 1 61 ALA HB1 H -12.440 11.461 16.836 1.00 . A A . 61 ALA HB1 1 1 14 13548 1 1 61 ALA HB2 H -12.440 10.998 15.135 1.00 . A A . 61 ALA HB2 1 1 14 13549 1 1 61 ALA HB3 H -11.720 9.931 16.335 1.00 . A A . 61 ALA HB3 1 1 14 13550 1 1 61 ALA N N -14.180 9.135 15.171 1.00 . A A . 61 ALA N 1 1 14 13551 1 1 61 ALA O O -15.510 11.510 15.653 1.00 . A A . 61 ALA O 1 1 14 13552 1 1 61 ALA OXT O -15.230 11.216 17.816 1.00 . A A . 61 ALA OXT 1 1 15 13553 1 1 1 MET C C -4.963 5.987 -0.873 1.00 . A A . 1 MET C 1 1 15 13554 1 1 1 MET CA C -4.282 6.797 0.224 1.00 . A A . 1 MET CA 1 1 15 13555 1 1 1 MET CB C -3.484 5.870 1.142 1.00 . A A . 1 MET CB 1 1 15 13556 1 1 1 MET CE C -0.034 7.112 2.603 1.00 . A A . 1 MET CE 1 1 15 13557 1 1 1 MET CG C -2.734 6.598 2.246 1.00 . A A . 1 MET CG 1 1 15 13558 1 1 1 MET H1 H -5.836 6.839 1.571 1.00 . A A . 1 MET H1 1 1 15 13559 1 1 1 MET H2 H -5.878 8.084 0.392 1.00 . A A . 1 MET H2 1 1 15 13560 1 1 1 MET H3 H -4.756 8.165 1.688 1.00 . A A . 1 MET H3 1 1 15 13561 1 1 1 MET HA H -3.611 7.511 -0.228 1.00 . A A . 1 MET HA 1 1 15 13562 1 1 1 MET HB2 H -4.162 5.167 1.602 1.00 . A A . 1 MET HB2 1 1 15 13563 1 1 1 MET HB3 H -2.765 5.326 0.548 1.00 . A A . 1 MET HB3 1 1 15 13564 1 1 1 MET HE1 H 0.618 7.950 2.802 1.00 . A A . 1 MET HE1 1 1 15 13565 1 1 1 MET HE2 H 0.511 6.350 2.066 1.00 . A A . 1 MET HE2 1 1 15 13566 1 1 1 MET HE3 H -0.397 6.707 3.536 1.00 . A A . 1 MET HE3 1 1 15 13567 1 1 1 MET HG2 H -3.434 7.206 2.798 1.00 . A A . 1 MET HG2 1 1 15 13568 1 1 1 MET HG3 H -2.296 5.865 2.909 1.00 . A A . 1 MET HG3 1 1 15 13569 1 1 1 MET N N -5.278 7.537 1.043 1.00 . A A . 1 MET N 1 1 15 13570 1 1 1 MET O O -5.540 4.931 -0.611 1.00 . A A . 1 MET O 1 1 15 13571 1 1 1 MET SD S -1.422 7.660 1.611 1.00 . A A . 1 MET SD 1 1 15 13572 1 1 2 TYR C C -4.691 4.569 -3.621 1.00 . A A . 2 TYR C 1 1 15 13573 1 1 2 TYR CA C -5.498 5.804 -3.237 1.00 . A A . 2 TYR CA 1 1 15 13574 1 1 2 TYR CB C -5.602 6.754 -4.434 1.00 . A A . 2 TYR CB 1 1 15 13575 1 1 2 TYR CD1 C -7.564 8.027 -3.487 1.00 . A A . 2 TYR CD1 1 1 15 13576 1 1 2 TYR CD2 C -7.636 7.396 -5.784 1.00 . A A . 2 TYR CD2 1 1 15 13577 1 1 2 TYR CE1 C -8.806 8.623 -3.607 1.00 . A A . 2 TYR CE1 1 1 15 13578 1 1 2 TYR CE2 C -8.878 7.990 -5.913 1.00 . A A . 2 TYR CE2 1 1 15 13579 1 1 2 TYR CG C -6.959 7.405 -4.571 1.00 . A A . 2 TYR CG 1 1 15 13580 1 1 2 TYR CZ C -9.458 8.601 -4.821 1.00 . A A . 2 TYR CZ 1 1 15 13581 1 1 2 TYR H H -4.414 7.331 -2.249 1.00 . A A . 2 TYR H 1 1 15 13582 1 1 2 TYR HA H -6.490 5.496 -2.946 1.00 . A A . 2 TYR HA 1 1 15 13583 1 1 2 TYR HB2 H -4.868 7.538 -4.328 1.00 . A A . 2 TYR HB2 1 1 15 13584 1 1 2 TYR HB3 H -5.405 6.201 -5.342 1.00 . A A . 2 TYR HB3 1 1 15 13585 1 1 2 TYR HD1 H -7.052 8.043 -2.537 1.00 . A A . 2 TYR HD1 1 1 15 13586 1 1 2 TYR HD2 H -7.180 6.916 -6.637 1.00 . A A . 2 TYR HD2 1 1 15 13587 1 1 2 TYR HE1 H -9.261 9.101 -2.753 1.00 . A A . 2 TYR HE1 1 1 15 13588 1 1 2 TYR HE2 H -9.388 7.973 -6.865 1.00 . A A . 2 TYR HE2 1 1 15 13589 1 1 2 TYR HH H -10.750 9.642 -5.792 1.00 . A A . 2 TYR HH 1 1 15 13590 1 1 2 TYR N N -4.889 6.486 -2.101 1.00 . A A . 2 TYR N 1 1 15 13591 1 1 2 TYR O O -3.486 4.651 -3.863 1.00 . A A . 2 TYR O 1 1 15 13592 1 1 2 TYR OH O -10.690 9.193 -4.946 1.00 . A A . 2 TYR OH 1 1 15 13593 1 1 3 LYS C C -3.950 2.293 -5.346 1.00 . A A . 3 LYS C 1 1 15 13594 1 1 3 LYS CA C -4.710 2.166 -4.026 1.00 . A A . 3 LYS CA 1 1 15 13595 1 1 3 LYS CB C -5.742 1.042 -4.125 1.00 . A A . 3 LYS CB 1 1 15 13596 1 1 3 LYS CD C -6.132 -1.441 -4.089 1.00 . A A . 3 LYS CD 1 1 15 13597 1 1 3 LYS CE C -6.738 -1.967 -5.382 1.00 . A A . 3 LYS CE 1 1 15 13598 1 1 3 LYS CG C -5.128 -0.330 -4.354 1.00 . A A . 3 LYS CG 1 1 15 13599 1 1 3 LYS H H -6.321 3.420 -3.469 1.00 . A A . 3 LYS H 1 1 15 13600 1 1 3 LYS HA H -4.004 1.928 -3.241 1.00 . A A . 3 LYS HA 1 1 15 13601 1 1 3 LYS HB2 H -6.310 1.009 -3.206 1.00 . A A . 3 LYS HB2 1 1 15 13602 1 1 3 LYS HB3 H -6.411 1.253 -4.945 1.00 . A A . 3 LYS HB3 1 1 15 13603 1 1 3 LYS HD2 H -5.632 -2.253 -3.584 1.00 . A A . 3 LYS HD2 1 1 15 13604 1 1 3 LYS HD3 H -6.923 -1.056 -3.462 1.00 . A A . 3 LYS HD3 1 1 15 13605 1 1 3 LYS HE2 H -7.058 -1.126 -5.980 1.00 . A A . 3 LYS HE2 1 1 15 13606 1 1 3 LYS HE3 H -5.984 -2.522 -5.917 1.00 . A A . 3 LYS HE3 1 1 15 13607 1 1 3 LYS HG2 H -4.793 -0.398 -5.378 1.00 . A A . 3 LYS HG2 1 1 15 13608 1 1 3 LYS HG3 H -4.285 -0.453 -3.688 1.00 . A A . 3 LYS HG3 1 1 15 13609 1 1 3 LYS HZ1 H -7.584 -3.825 -4.949 1.00 . A A . 3 LYS HZ1 1 1 15 13610 1 1 3 LYS HZ2 H -8.539 -2.856 -5.954 1.00 . A A . 3 LYS HZ2 1 1 15 13611 1 1 3 LYS HZ3 H -8.438 -2.517 -4.299 1.00 . A A . 3 LYS HZ3 1 1 15 13612 1 1 3 LYS N N -5.363 3.422 -3.673 1.00 . A A . 3 LYS N 1 1 15 13613 1 1 3 LYS NZ N -7.906 -2.853 -5.129 1.00 . A A . 3 LYS NZ 1 1 15 13614 1 1 3 LYS O O -2.959 1.600 -5.573 1.00 . A A . 3 LYS O 1 1 15 13615 1 1 4 LYS C C -2.324 3.797 -7.333 1.00 . A A . 4 LYS C 1 1 15 13616 1 1 4 LYS CA C -3.790 3.406 -7.505 1.00 . A A . 4 LYS CA 1 1 15 13617 1 1 4 LYS CB C -4.531 4.496 -8.282 1.00 . A A . 4 LYS CB 1 1 15 13618 1 1 4 LYS CD C -5.262 5.176 -10.590 1.00 . A A . 4 LYS CD 1 1 15 13619 1 1 4 LYS CE C -4.772 6.384 -11.373 1.00 . A A . 4 LYS CE 1 1 15 13620 1 1 4 LYS CG C -4.151 4.563 -9.752 1.00 . A A . 4 LYS CG 1 1 15 13621 1 1 4 LYS H H -5.217 3.711 -5.973 1.00 . A A . 4 LYS H 1 1 15 13622 1 1 4 LYS HA H -3.840 2.482 -8.062 1.00 . A A . 4 LYS HA 1 1 15 13623 1 1 4 LYS HB2 H -5.594 4.308 -8.217 1.00 . A A . 4 LYS HB2 1 1 15 13624 1 1 4 LYS HB3 H -4.315 5.453 -7.832 1.00 . A A . 4 LYS HB3 1 1 15 13625 1 1 4 LYS HD2 H -5.625 4.434 -11.287 1.00 . A A . 4 LYS HD2 1 1 15 13626 1 1 4 LYS HD3 H -6.066 5.482 -9.938 1.00 . A A . 4 LYS HD3 1 1 15 13627 1 1 4 LYS HE2 H -5.600 7.062 -11.521 1.00 . A A . 4 LYS HE2 1 1 15 13628 1 1 4 LYS HE3 H -4.001 6.880 -10.799 1.00 . A A . 4 LYS HE3 1 1 15 13629 1 1 4 LYS HG2 H -3.260 5.165 -9.856 1.00 . A A . 4 LYS HG2 1 1 15 13630 1 1 4 LYS HG3 H -3.953 3.562 -10.108 1.00 . A A . 4 LYS HG3 1 1 15 13631 1 1 4 LYS HZ1 H -3.748 6.818 -13.141 1.00 . A A . 4 LYS HZ1 1 1 15 13632 1 1 4 LYS HZ2 H -4.982 5.675 -13.326 1.00 . A A . 4 LYS HZ2 1 1 15 13633 1 1 4 LYS HZ3 H -3.524 5.233 -12.590 1.00 . A A . 4 LYS HZ3 1 1 15 13634 1 1 4 LYS N N -4.424 3.186 -6.211 1.00 . A A . 4 LYS N 1 1 15 13635 1 1 4 LYS NZ N -4.218 6.001 -12.701 1.00 . A A . 4 LYS NZ 1 1 15 13636 1 1 4 LYS O O -1.448 3.286 -8.031 1.00 . A A . 4 LYS O 1 1 15 13637 1 1 5 ASP C C 0.113 4.056 -5.473 1.00 . A A . 5 ASP C 1 1 15 13638 1 1 5 ASP CA C -0.707 5.160 -6.128 1.00 . A A . 5 ASP CA 1 1 15 13639 1 1 5 ASP CB C -0.730 6.398 -5.230 1.00 . A A . 5 ASP CB 1 1 15 13640 1 1 5 ASP CG C 0.379 7.375 -5.563 1.00 . A A . 5 ASP CG 1 1 15 13641 1 1 5 ASP H H -2.808 5.072 -5.871 1.00 . A A . 5 ASP H 1 1 15 13642 1 1 5 ASP HA H -0.253 5.419 -7.073 1.00 . A A . 5 ASP HA 1 1 15 13643 1 1 5 ASP HB2 H -1.678 6.904 -5.349 1.00 . A A . 5 ASP HB2 1 1 15 13644 1 1 5 ASP HB3 H -0.619 6.090 -4.200 1.00 . A A . 5 ASP HB3 1 1 15 13645 1 1 5 ASP N N -2.066 4.704 -6.395 1.00 . A A . 5 ASP N 1 1 15 13646 1 1 5 ASP O O 1.258 3.809 -5.854 1.00 . A A . 5 ASP O 1 1 15 13647 1 1 5 ASP OD1 O 0.747 7.475 -6.752 1.00 . A A . 5 ASP OD1 1 1 15 13648 1 1 5 ASP OD2 O 0.881 8.043 -4.633 1.00 . A A . 5 ASP OD2 1 1 15 13649 1 1 6 VAL C C 0.630 1.221 -4.741 1.00 . A A . 6 VAL C 1 1 15 13650 1 1 6 VAL CA C 0.187 2.316 -3.778 1.00 . A A . 6 VAL CA 1 1 15 13651 1 1 6 VAL CB C -0.737 1.701 -2.710 1.00 . A A . 6 VAL CB 1 1 15 13652 1 1 6 VAL CG1 C 0.082 0.938 -1.697 1.00 . A A . 6 VAL CG1 1 1 15 13653 1 1 6 VAL CG2 C -1.570 2.774 -2.020 1.00 . A A . 6 VAL CG2 1 1 15 13654 1 1 6 VAL H H -1.389 3.629 -4.226 1.00 . A A . 6 VAL H 1 1 15 13655 1 1 6 VAL HA H 1.055 2.726 -3.283 1.00 . A A . 6 VAL HA 1 1 15 13656 1 1 6 VAL HB H -1.408 1.010 -3.196 1.00 . A A . 6 VAL HB 1 1 15 13657 1 1 6 VAL HG11 H 0.999 1.472 -1.510 1.00 . A A . 6 VAL HG11 1 1 15 13658 1 1 6 VAL HG12 H 0.305 -0.043 -2.084 1.00 . A A . 6 VAL HG12 1 1 15 13659 1 1 6 VAL HG13 H -0.477 0.848 -0.779 1.00 . A A . 6 VAL HG13 1 1 15 13660 1 1 6 VAL HG21 H -1.908 2.404 -1.062 1.00 . A A . 6 VAL HG21 1 1 15 13661 1 1 6 VAL HG22 H -2.423 3.018 -2.633 1.00 . A A . 6 VAL HG22 1 1 15 13662 1 1 6 VAL HG23 H -0.967 3.658 -1.873 1.00 . A A . 6 VAL HG23 1 1 15 13663 1 1 6 VAL N N -0.479 3.392 -4.485 1.00 . A A . 6 VAL N 1 1 15 13664 1 1 6 VAL O O 1.797 0.829 -4.757 1.00 . A A . 6 VAL O 1 1 15 13665 1 1 7 ILE C C 1.116 0.102 -7.453 1.00 . A A . 7 ILE C 1 1 15 13666 1 1 7 ILE CA C -0.019 -0.314 -6.518 1.00 . A A . 7 ILE CA 1 1 15 13667 1 1 7 ILE CB C -1.271 -0.661 -7.354 1.00 . A A . 7 ILE CB 1 1 15 13668 1 1 7 ILE CD1 C -3.610 -1.655 -7.202 1.00 . A A . 7 ILE CD1 1 1 15 13669 1 1 7 ILE CG1 C -2.340 -1.295 -6.462 1.00 . A A . 7 ILE CG1 1 1 15 13670 1 1 7 ILE CG2 C -0.914 -1.592 -8.504 1.00 . A A . 7 ILE CG2 1 1 15 13671 1 1 7 ILE H H -1.219 1.090 -5.487 1.00 . A A . 7 ILE H 1 1 15 13672 1 1 7 ILE HA H 0.281 -1.199 -5.975 1.00 . A A . 7 ILE HA 1 1 15 13673 1 1 7 ILE HB H -1.661 0.254 -7.772 1.00 . A A . 7 ILE HB 1 1 15 13674 1 1 7 ILE HD11 H -4.126 -2.441 -6.670 1.00 . A A . 7 ILE HD11 1 1 15 13675 1 1 7 ILE HD12 H -3.363 -1.997 -8.197 1.00 . A A . 7 ILE HD12 1 1 15 13676 1 1 7 ILE HD13 H -4.248 -0.786 -7.268 1.00 . A A . 7 ILE HD13 1 1 15 13677 1 1 7 ILE HG12 H -1.946 -2.200 -6.025 1.00 . A A . 7 ILE HG12 1 1 15 13678 1 1 7 ILE HG13 H -2.599 -0.603 -5.674 1.00 . A A . 7 ILE HG13 1 1 15 13679 1 1 7 ILE HG21 H -0.429 -2.476 -8.113 1.00 . A A . 7 ILE HG21 1 1 15 13680 1 1 7 ILE HG22 H -0.245 -1.084 -9.181 1.00 . A A . 7 ILE HG22 1 1 15 13681 1 1 7 ILE HG23 H -1.812 -1.876 -9.031 1.00 . A A . 7 ILE HG23 1 1 15 13682 1 1 7 ILE N N -0.308 0.733 -5.546 1.00 . A A . 7 ILE N 1 1 15 13683 1 1 7 ILE O O 1.866 -0.741 -7.948 1.00 . A A . 7 ILE O 1 1 15 13684 1 1 8 ASP C C 3.618 1.956 -7.816 1.00 . A A . 8 ASP C 1 1 15 13685 1 1 8 ASP CA C 2.285 1.930 -8.551 1.00 . A A . 8 ASP CA 1 1 15 13686 1 1 8 ASP CB C 1.920 3.337 -9.031 1.00 . A A . 8 ASP CB 1 1 15 13687 1 1 8 ASP CG C 2.055 3.488 -10.534 1.00 . A A . 8 ASP CG 1 1 15 13688 1 1 8 ASP H H 0.618 2.027 -7.257 1.00 . A A . 8 ASP H 1 1 15 13689 1 1 8 ASP HA H 2.368 1.276 -9.405 1.00 . A A . 8 ASP HA 1 1 15 13690 1 1 8 ASP HB2 H 0.898 3.551 -8.757 1.00 . A A . 8 ASP HB2 1 1 15 13691 1 1 8 ASP HB3 H 2.573 4.055 -8.556 1.00 . A A . 8 ASP HB3 1 1 15 13692 1 1 8 ASP N N 1.239 1.405 -7.683 1.00 . A A . 8 ASP N 1 1 15 13693 1 1 8 ASP O O 4.679 1.825 -8.425 1.00 . A A . 8 ASP O 1 1 15 13694 1 1 8 ASP OD1 O 3.165 3.819 -11.000 1.00 . A A . 8 ASP OD1 1 1 15 13695 1 1 8 ASP OD2 O 1.050 3.274 -11.244 1.00 . A A . 8 ASP OD2 1 1 15 13696 1 1 9 HIS C C 5.197 0.732 -5.325 1.00 . A A . 9 HIS C 1 1 15 13697 1 1 9 HIS CA C 4.751 2.150 -5.673 1.00 . A A . 9 HIS CA 1 1 15 13698 1 1 9 HIS CB C 4.494 2.955 -4.395 1.00 . A A . 9 HIS CB 1 1 15 13699 1 1 9 HIS CD2 C 5.832 2.107 -2.339 1.00 . A A . 9 HIS CD2 1 1 15 13700 1 1 9 HIS CE1 C 7.534 3.484 -2.473 1.00 . A A . 9 HIS CE1 1 1 15 13701 1 1 9 HIS CG C 5.624 2.908 -3.411 1.00 . A A . 9 HIS CG 1 1 15 13702 1 1 9 HIS H H 2.678 2.208 -6.069 1.00 . A A . 9 HIS H 1 1 15 13703 1 1 9 HIS HA H 5.528 2.631 -6.244 1.00 . A A . 9 HIS HA 1 1 15 13704 1 1 9 HIS HB2 H 4.327 3.988 -4.658 1.00 . A A . 9 HIS HB2 1 1 15 13705 1 1 9 HIS HB3 H 3.612 2.565 -3.906 1.00 . A A . 9 HIS HB3 1 1 15 13706 1 1 9 HIS HD1 H 6.852 4.460 -4.137 1.00 . A A . 9 HIS HD1 1 1 15 13707 1 1 9 HIS HD2 H 5.180 1.318 -1.993 1.00 . A A . 9 HIS HD2 1 1 15 13708 1 1 9 HIS HE1 H 8.465 3.989 -2.266 1.00 . A A . 9 HIS HE1 1 1 15 13709 1 1 9 HIS HE2 H 7.475 2.028 -1.034 1.00 . A A . 9 HIS HE2 1 1 15 13710 1 1 9 HIS N N 3.552 2.116 -6.497 1.00 . A A . 9 HIS N 1 1 15 13711 1 1 9 HIS ND1 N 6.709 3.759 -3.468 1.00 . A A . 9 HIS ND1 1 1 15 13712 1 1 9 HIS NE2 N 7.025 2.486 -1.774 1.00 . A A . 9 HIS NE2 1 1 15 13713 1 1 9 HIS O O 6.388 0.463 -5.167 1.00 . A A . 9 HIS O 1 1 15 13714 1 1 10 PHE C C 4.708 -2.390 -6.142 1.00 . A A . 10 PHE C 1 1 15 13715 1 1 10 PHE CA C 4.506 -1.559 -4.877 1.00 . A A . 10 PHE CA 1 1 15 13716 1 1 10 PHE CB C 3.364 -2.140 -4.046 1.00 . A A . 10 PHE CB 1 1 15 13717 1 1 10 PHE CD1 C 4.217 -2.541 -1.728 1.00 . A A . 10 PHE CD1 1 1 15 13718 1 1 10 PHE CD2 C 2.771 -0.683 -2.095 1.00 . A A . 10 PHE CD2 1 1 15 13719 1 1 10 PHE CE1 C 4.305 -2.213 -0.388 1.00 . A A . 10 PHE CE1 1 1 15 13720 1 1 10 PHE CE2 C 2.854 -0.349 -0.756 1.00 . A A . 10 PHE CE2 1 1 15 13721 1 1 10 PHE CG C 3.451 -1.781 -2.593 1.00 . A A . 10 PHE CG 1 1 15 13722 1 1 10 PHE CZ C 3.621 -1.116 0.098 1.00 . A A . 10 PHE CZ 1 1 15 13723 1 1 10 PHE H H 3.298 0.111 -5.343 1.00 . A A . 10 PHE H 1 1 15 13724 1 1 10 PHE HA H 5.413 -1.588 -4.292 1.00 . A A . 10 PHE HA 1 1 15 13725 1 1 10 PHE HB2 H 2.424 -1.768 -4.426 1.00 . A A . 10 PHE HB2 1 1 15 13726 1 1 10 PHE HB3 H 3.379 -3.217 -4.126 1.00 . A A . 10 PHE HB3 1 1 15 13727 1 1 10 PHE HD1 H 4.751 -3.399 -2.110 1.00 . A A . 10 PHE HD1 1 1 15 13728 1 1 10 PHE HD2 H 2.172 -0.083 -2.763 1.00 . A A . 10 PHE HD2 1 1 15 13729 1 1 10 PHE HE1 H 4.907 -2.815 0.276 1.00 . A A . 10 PHE HE1 1 1 15 13730 1 1 10 PHE HE2 H 2.317 0.509 -0.379 1.00 . A A . 10 PHE HE2 1 1 15 13731 1 1 10 PHE HZ H 3.687 -0.858 1.144 1.00 . A A . 10 PHE HZ 1 1 15 13732 1 1 10 PHE N N 4.227 -0.167 -5.206 1.00 . A A . 10 PHE N 1 1 15 13733 1 1 10 PHE O O 5.433 -3.384 -6.134 1.00 . A A . 10 PHE O 1 1 15 13734 1 1 11 GLY C C 3.087 -3.729 -8.660 1.00 . A A . 11 GLY C 1 1 15 13735 1 1 11 GLY CA C 4.179 -2.694 -8.480 1.00 . A A . 11 GLY CA 1 1 15 13736 1 1 11 GLY H H 3.494 -1.178 -7.173 1.00 . A A . 11 GLY H 1 1 15 13737 1 1 11 GLY HA2 H 4.127 -1.986 -9.295 1.00 . A A . 11 GLY HA2 1 1 15 13738 1 1 11 GLY HA3 H 5.138 -3.190 -8.509 1.00 . A A . 11 GLY HA3 1 1 15 13739 1 1 11 GLY N N 4.059 -1.976 -7.226 1.00 . A A . 11 GLY N 1 1 15 13740 1 1 11 GLY O O 2.488 -3.831 -9.730 1.00 . A A . 11 GLY O 1 1 15 13741 1 1 12 THR C C 1.110 -5.660 -6.293 1.00 . A A . 12 THR C 1 1 15 13742 1 1 12 THR CA C 1.798 -5.530 -7.648 1.00 . A A . 12 THR CA 1 1 15 13743 1 1 12 THR CB C 2.408 -6.872 -8.056 1.00 . A A . 12 THR CB 1 1 15 13744 1 1 12 THR CG2 C 2.348 -7.128 -9.546 1.00 . A A . 12 THR CG2 1 1 15 13745 1 1 12 THR H H 3.339 -4.367 -6.782 1.00 . A A . 12 THR H 1 1 15 13746 1 1 12 THR HA H 1.065 -5.239 -8.386 1.00 . A A . 12 THR HA 1 1 15 13747 1 1 12 THR HB H 1.868 -7.667 -7.561 1.00 . A A . 12 THR HB 1 1 15 13748 1 1 12 THR HG1 H 4.284 -6.322 -8.179 1.00 . A A . 12 THR HG1 1 1 15 13749 1 1 12 THR HG21 H 2.604 -8.159 -9.745 1.00 . A A . 12 THR HG21 1 1 15 13750 1 1 12 THR HG22 H 3.047 -6.479 -10.051 1.00 . A A . 12 THR HG22 1 1 15 13751 1 1 12 THR HG23 H 1.348 -6.930 -9.905 1.00 . A A . 12 THR HG23 1 1 15 13752 1 1 12 THR N N 2.826 -4.498 -7.607 1.00 . A A . 12 THR N 1 1 15 13753 1 1 12 THR O O 1.412 -4.918 -5.359 1.00 . A A . 12 THR O 1 1 15 13754 1 1 12 THR OG1 O 3.767 -6.945 -7.662 1.00 . A A . 12 THR OG1 1 1 15 13755 1 1 13 GLN C C 0.332 -7.545 -3.927 1.00 . A A . 13 GLN C 1 1 15 13756 1 1 13 GLN CA C -0.546 -6.831 -4.950 1.00 . A A . 13 GLN CA 1 1 15 13757 1 1 13 GLN CB C -1.809 -7.652 -5.216 1.00 . A A . 13 GLN CB 1 1 15 13758 1 1 13 GLN CD C -3.875 -7.858 -6.654 1.00 . A A . 13 GLN CD 1 1 15 13759 1 1 13 GLN CG C -2.844 -6.922 -6.055 1.00 . A A . 13 GLN CG 1 1 15 13760 1 1 13 GLN H H -0.015 -7.168 -6.971 1.00 . A A . 13 GLN H 1 1 15 13761 1 1 13 GLN HA H -0.830 -5.868 -4.554 1.00 . A A . 13 GLN HA 1 1 15 13762 1 1 13 GLN HB2 H -1.533 -8.559 -5.733 1.00 . A A . 13 GLN HB2 1 1 15 13763 1 1 13 GLN HB3 H -2.261 -7.912 -4.270 1.00 . A A . 13 GLN HB3 1 1 15 13764 1 1 13 GLN HE21 H -5.191 -6.373 -6.780 1.00 . A A . 13 GLN HE21 1 1 15 13765 1 1 13 GLN HE22 H -5.739 -7.911 -7.346 1.00 . A A . 13 GLN HE22 1 1 15 13766 1 1 13 GLN HG2 H -3.354 -6.203 -5.430 1.00 . A A . 13 GLN HG2 1 1 15 13767 1 1 13 GLN HG3 H -2.340 -6.404 -6.858 1.00 . A A . 13 GLN HG3 1 1 15 13768 1 1 13 GLN N N 0.183 -6.607 -6.193 1.00 . A A . 13 GLN N 1 1 15 13769 1 1 13 GLN NE2 N -5.054 -7.326 -6.957 1.00 . A A . 13 GLN NE2 1 1 15 13770 1 1 13 GLN O O 0.343 -7.191 -2.748 1.00 . A A . 13 GLN O 1 1 15 13771 1 1 13 GLN OE1 O -3.616 -9.047 -6.842 1.00 . A A . 13 GLN OE1 1 1 15 13772 1 1 14 ARG C C 2.944 -8.413 -2.803 1.00 . A A . 14 ARG C 1 1 15 13773 1 1 14 ARG CA C 1.947 -9.323 -3.513 1.00 . A A . 14 ARG CA 1 1 15 13774 1 1 14 ARG CB C 2.693 -10.387 -4.317 1.00 . A A . 14 ARG CB 1 1 15 13775 1 1 14 ARG CD C 4.500 -11.374 -2.874 1.00 . A A . 14 ARG CD 1 1 15 13776 1 1 14 ARG CG C 3.124 -11.587 -3.487 1.00 . A A . 14 ARG CG 1 1 15 13777 1 1 14 ARG CZ C 6.623 -12.602 -2.631 1.00 . A A . 14 ARG CZ 1 1 15 13778 1 1 14 ARG H H 1.012 -8.790 -5.336 1.00 . A A . 14 ARG H 1 1 15 13779 1 1 14 ARG HA H 1.332 -9.811 -2.770 1.00 . A A . 14 ARG HA 1 1 15 13780 1 1 14 ARG HB2 H 2.051 -10.740 -5.111 1.00 . A A . 14 ARG HB2 1 1 15 13781 1 1 14 ARG HB3 H 3.575 -9.942 -4.752 1.00 . A A . 14 ARG HB3 1 1 15 13782 1 1 14 ARG HD2 H 4.983 -10.552 -3.381 1.00 . A A . 14 ARG HD2 1 1 15 13783 1 1 14 ARG HD3 H 4.379 -11.131 -1.828 1.00 . A A . 14 ARG HD3 1 1 15 13784 1 1 14 ARG HE H 4.931 -13.375 -3.355 1.00 . A A . 14 ARG HE 1 1 15 13785 1 1 14 ARG HG2 H 2.408 -11.740 -2.695 1.00 . A A . 14 ARG HG2 1 1 15 13786 1 1 14 ARG HG3 H 3.155 -12.460 -4.123 1.00 . A A . 14 ARG HG3 1 1 15 13787 1 1 14 ARG HH11 H 6.695 -10.673 -2.026 1.00 . A A . 14 ARG HH11 1 1 15 13788 1 1 14 ARG HH12 H 8.175 -11.558 -1.866 1.00 . A A . 14 ARG HH12 1 1 15 13789 1 1 14 ARG HH21 H 6.878 -14.539 -3.147 1.00 . A A . 14 ARG HH21 1 1 15 13790 1 1 14 ARG HH22 H 8.280 -13.753 -2.502 1.00 . A A . 14 ARG HH22 1 1 15 13791 1 1 14 ARG N N 1.065 -8.555 -4.386 1.00 . A A . 14 ARG N 1 1 15 13792 1 1 14 ARG NE N 5.341 -12.563 -2.990 1.00 . A A . 14 ARG NE 1 1 15 13793 1 1 14 ARG NH1 N 7.213 -11.522 -2.133 1.00 . A A . 14 ARG NH1 1 1 15 13794 1 1 14 ARG NH2 N 7.316 -13.723 -2.772 1.00 . A A . 14 ARG NH2 1 1 15 13795 1 1 14 ARG O O 3.265 -8.620 -1.632 1.00 . A A . 14 ARG O 1 1 15 13796 1 1 15 ALA C C 3.813 -5.752 -1.737 1.00 . A A . 15 ALA C 1 1 15 13797 1 1 15 ALA CA C 4.393 -6.464 -2.954 1.00 . A A . 15 ALA CA 1 1 15 13798 1 1 15 ALA CB C 4.823 -5.454 -4.008 1.00 . A A . 15 ALA CB 1 1 15 13799 1 1 15 ALA H H 3.140 -7.291 -4.446 1.00 . A A . 15 ALA H 1 1 15 13800 1 1 15 ALA HA H 5.266 -7.024 -2.648 1.00 . A A . 15 ALA HA 1 1 15 13801 1 1 15 ALA HB1 H 3.950 -5.077 -4.521 1.00 . A A . 15 ALA HB1 1 1 15 13802 1 1 15 ALA HB2 H 5.479 -5.934 -4.719 1.00 . A A . 15 ALA HB2 1 1 15 13803 1 1 15 ALA HB3 H 5.343 -4.637 -3.533 1.00 . A A . 15 ALA HB3 1 1 15 13804 1 1 15 ALA N N 3.433 -7.405 -3.518 1.00 . A A . 15 ALA N 1 1 15 13805 1 1 15 ALA O O 4.512 -5.518 -0.751 1.00 . A A . 15 ALA O 1 1 15 13806 1 1 16 VAL C C 1.495 -5.708 0.398 1.00 . A A . 16 VAL C 1 1 15 13807 1 1 16 VAL CA C 1.854 -4.728 -0.715 1.00 . A A . 16 VAL CA 1 1 15 13808 1 1 16 VAL CB C 0.564 -4.004 -1.178 1.00 . A A . 16 VAL CB 1 1 15 13809 1 1 16 VAL CG1 C 0.548 -2.577 -0.660 1.00 . A A . 16 VAL CG1 1 1 15 13810 1 1 16 VAL CG2 C 0.423 -4.016 -2.695 1.00 . A A . 16 VAL CG2 1 1 15 13811 1 1 16 VAL H H 2.029 -5.625 -2.621 1.00 . A A . 16 VAL H 1 1 15 13812 1 1 16 VAL HA H 2.535 -3.987 -0.319 1.00 . A A . 16 VAL HA 1 1 15 13813 1 1 16 VAL HB H -0.286 -4.523 -0.756 1.00 . A A . 16 VAL HB 1 1 15 13814 1 1 16 VAL HG11 H 1.339 -2.448 0.063 1.00 . A A . 16 VAL HG11 1 1 15 13815 1 1 16 VAL HG12 H -0.405 -2.374 -0.193 1.00 . A A . 16 VAL HG12 1 1 15 13816 1 1 16 VAL HG13 H 0.698 -1.896 -1.483 1.00 . A A . 16 VAL HG13 1 1 15 13817 1 1 16 VAL HG21 H 1.383 -3.817 -3.149 1.00 . A A . 16 VAL HG21 1 1 15 13818 1 1 16 VAL HG22 H -0.283 -3.257 -2.997 1.00 . A A . 16 VAL HG22 1 1 15 13819 1 1 16 VAL HG23 H 0.068 -4.984 -3.016 1.00 . A A . 16 VAL HG23 1 1 15 13820 1 1 16 VAL N N 2.530 -5.410 -1.812 1.00 . A A . 16 VAL N 1 1 15 13821 1 1 16 VAL O O 1.652 -5.402 1.581 1.00 . A A . 16 VAL O 1 1 15 13822 1 1 17 ALA C C 1.779 -8.239 1.921 1.00 . A A . 17 ALA C 1 1 15 13823 1 1 17 ALA CA C 0.627 -7.908 0.977 1.00 . A A . 17 ALA CA 1 1 15 13824 1 1 17 ALA CB C 0.156 -9.163 0.252 1.00 . A A . 17 ALA CB 1 1 15 13825 1 1 17 ALA H H 0.908 -7.066 -0.945 1.00 . A A . 17 ALA H 1 1 15 13826 1 1 17 ALA HA H -0.201 -7.526 1.556 1.00 . A A . 17 ALA HA 1 1 15 13827 1 1 17 ALA HB1 H 0.440 -9.103 -0.788 1.00 . A A . 17 ALA HB1 1 1 15 13828 1 1 17 ALA HB2 H -0.918 -9.240 0.327 1.00 . A A . 17 ALA HB2 1 1 15 13829 1 1 17 ALA HB3 H 0.613 -10.033 0.702 1.00 . A A . 17 ALA HB3 1 1 15 13830 1 1 17 ALA N N 1.010 -6.884 0.012 1.00 . A A . 17 ALA N 1 1 15 13831 1 1 17 ALA O O 1.567 -8.500 3.106 1.00 . A A . 17 ALA O 1 1 15 13832 1 1 18 LYS C C 4.566 -7.330 3.060 1.00 . A A . 18 LYS C 1 1 15 13833 1 1 18 LYS CA C 4.181 -8.522 2.189 1.00 . A A . 18 LYS CA 1 1 15 13834 1 1 18 LYS CB C 5.352 -8.903 1.280 1.00 . A A . 18 LYS CB 1 1 15 13835 1 1 18 LYS CD C 7.316 -7.744 0.225 1.00 . A A . 18 LYS CD 1 1 15 13836 1 1 18 LYS CE C 7.824 -6.326 0.017 1.00 . A A . 18 LYS CE 1 1 15 13837 1 1 18 LYS CG C 5.802 -7.776 0.363 1.00 . A A . 18 LYS CG 1 1 15 13838 1 1 18 LYS H H 3.101 -8.009 0.441 1.00 . A A . 18 LYS H 1 1 15 13839 1 1 18 LYS HA H 3.946 -9.360 2.828 1.00 . A A . 18 LYS HA 1 1 15 13840 1 1 18 LYS HB2 H 6.189 -9.196 1.895 1.00 . A A . 18 LYS HB2 1 1 15 13841 1 1 18 LYS HB3 H 5.057 -9.742 0.666 1.00 . A A . 18 LYS HB3 1 1 15 13842 1 1 18 LYS HD2 H 7.760 -8.145 1.123 1.00 . A A . 18 LYS HD2 1 1 15 13843 1 1 18 LYS HD3 H 7.604 -8.348 -0.624 1.00 . A A . 18 LYS HD3 1 1 15 13844 1 1 18 LYS HE2 H 7.737 -6.075 -1.030 1.00 . A A . 18 LYS HE2 1 1 15 13845 1 1 18 LYS HE3 H 7.216 -5.650 0.599 1.00 . A A . 18 LYS HE3 1 1 15 13846 1 1 18 LYS HG2 H 5.365 -7.923 -0.612 1.00 . A A . 18 LYS HG2 1 1 15 13847 1 1 18 LYS HG3 H 5.467 -6.836 0.774 1.00 . A A . 18 LYS HG3 1 1 15 13848 1 1 18 LYS HZ1 H 9.841 -6.861 -0.083 1.00 . A A . 18 LYS HZ1 1 1 15 13849 1 1 18 LYS HZ2 H 9.342 -6.353 1.451 1.00 . A A . 18 LYS HZ2 1 1 15 13850 1 1 18 LYS HZ3 H 9.583 -5.216 0.222 1.00 . A A . 18 LYS HZ3 1 1 15 13851 1 1 18 LYS N N 2.996 -8.225 1.391 1.00 . A A . 18 LYS N 1 1 15 13852 1 1 18 LYS NZ N 9.246 -6.179 0.430 1.00 . A A . 18 LYS NZ 1 1 15 13853 1 1 18 LYS O O 5.182 -7.493 4.114 1.00 . A A . 18 LYS O 1 1 15 13854 1 1 19 ALA C C 3.710 -4.834 4.647 1.00 . A A . 19 ALA C 1 1 15 13855 1 1 19 ALA CA C 4.510 -4.914 3.351 1.00 . A A . 19 ALA CA 1 1 15 13856 1 1 19 ALA CB C 4.240 -3.692 2.486 1.00 . A A . 19 ALA CB 1 1 15 13857 1 1 19 ALA H H 3.714 -6.066 1.766 1.00 . A A . 19 ALA H 1 1 15 13858 1 1 19 ALA HA H 5.564 -4.929 3.591 1.00 . A A . 19 ALA HA 1 1 15 13859 1 1 19 ALA HB1 H 3.714 -3.995 1.592 1.00 . A A . 19 ALA HB1 1 1 15 13860 1 1 19 ALA HB2 H 5.177 -3.230 2.212 1.00 . A A . 19 ALA HB2 1 1 15 13861 1 1 19 ALA HB3 H 3.638 -2.984 3.036 1.00 . A A . 19 ALA HB3 1 1 15 13862 1 1 19 ALA N N 4.201 -6.132 2.613 1.00 . A A . 19 ALA N 1 1 15 13863 1 1 19 ALA O O 4.279 -4.756 5.736 1.00 . A A . 19 ALA O 1 1 15 13864 1 1 20 LEU C C 1.384 -6.131 6.367 1.00 . A A . 20 LEU C 1 1 15 13865 1 1 20 LEU CA C 1.509 -4.774 5.681 1.00 . A A . 20 LEU CA 1 1 15 13866 1 1 20 LEU CB C 0.126 -4.268 5.264 1.00 . A A . 20 LEU CB 1 1 15 13867 1 1 20 LEU CD1 C -1.234 -2.897 3.665 1.00 . A A . 20 LEU CD1 1 1 15 13868 1 1 20 LEU CD2 C 0.579 -1.816 5.003 1.00 . A A . 20 LEU CD2 1 1 15 13869 1 1 20 LEU CG C 0.138 -3.086 4.292 1.00 . A A . 20 LEU CG 1 1 15 13870 1 1 20 LEU H H 1.993 -4.907 3.625 1.00 . A A . 20 LEU H 1 1 15 13871 1 1 20 LEU HA H 1.942 -4.071 6.378 1.00 . A A . 20 LEU HA 1 1 15 13872 1 1 20 LEU HB2 H -0.409 -5.084 4.802 1.00 . A A . 20 LEU HB2 1 1 15 13873 1 1 20 LEU HB3 H -0.407 -3.967 6.153 1.00 . A A . 20 LEU HB3 1 1 15 13874 1 1 20 LEU HD11 H -1.996 -3.199 4.369 1.00 . A A . 20 LEU HD11 1 1 15 13875 1 1 20 LEU HD12 H -1.309 -3.501 2.773 1.00 . A A . 20 LEU HD12 1 1 15 13876 1 1 20 LEU HD13 H -1.372 -1.858 3.408 1.00 . A A . 20 LEU HD13 1 1 15 13877 1 1 20 LEU HD21 H 1.006 -1.132 4.283 1.00 . A A . 20 LEU HD21 1 1 15 13878 1 1 20 LEU HD22 H 1.321 -2.061 5.750 1.00 . A A . 20 LEU HD22 1 1 15 13879 1 1 20 LEU HD23 H -0.272 -1.355 5.479 1.00 . A A . 20 LEU HD23 1 1 15 13880 1 1 20 LEU HG H 0.842 -3.288 3.498 1.00 . A A . 20 LEU HG 1 1 15 13881 1 1 20 LEU N N 2.387 -4.849 4.520 1.00 . A A . 20 LEU N 1 1 15 13882 1 1 20 LEU O O 1.078 -6.211 7.557 1.00 . A A . 20 LEU O 1 1 15 13883 1 1 21 GLY C C 0.199 -9.195 5.893 1.00 . A A . 21 GLY C 1 1 15 13884 1 1 21 GLY CA C 1.536 -8.535 6.170 1.00 . A A . 21 GLY CA 1 1 15 13885 1 1 21 GLY H H 1.866 -7.080 4.669 1.00 . A A . 21 GLY H 1 1 15 13886 1 1 21 GLY HA2 H 2.319 -9.145 5.744 1.00 . A A . 21 GLY HA2 1 1 15 13887 1 1 21 GLY HA3 H 1.681 -8.478 7.238 1.00 . A A . 21 GLY HA3 1 1 15 13888 1 1 21 GLY N N 1.625 -7.199 5.611 1.00 . A A . 21 GLY N 1 1 15 13889 1 1 21 GLY O O -0.257 -10.038 6.665 1.00 . A A . 21 GLY O 1 1 15 13890 1 1 22 ILE C C -1.601 -10.241 3.166 1.00 . A A . 22 ILE C 1 1 15 13891 1 1 22 ILE CA C -1.723 -9.371 4.411 1.00 . A A . 22 ILE CA 1 1 15 13892 1 1 22 ILE CB C -2.762 -8.264 4.152 1.00 . A A . 22 ILE CB 1 1 15 13893 1 1 22 ILE CD1 C -3.250 -6.217 2.719 1.00 . A A . 22 ILE CD1 1 1 15 13894 1 1 22 ILE CG1 C -2.264 -7.313 3.061 1.00 . A A . 22 ILE CG1 1 1 15 13895 1 1 22 ILE CG2 C -3.057 -7.502 5.433 1.00 . A A . 22 ILE CG2 1 1 15 13896 1 1 22 ILE H H -0.016 -8.135 4.212 1.00 . A A . 22 ILE H 1 1 15 13897 1 1 22 ILE HA H -2.074 -9.980 5.232 1.00 . A A . 22 ILE HA 1 1 15 13898 1 1 22 ILE HB H -3.677 -8.732 3.820 1.00 . A A . 22 ILE HB 1 1 15 13899 1 1 22 ILE HD11 H -2.751 -5.260 2.752 1.00 . A A . 22 ILE HD11 1 1 15 13900 1 1 22 ILE HD12 H -4.059 -6.225 3.435 1.00 . A A . 22 ILE HD12 1 1 15 13901 1 1 22 ILE HD13 H -3.644 -6.383 1.728 1.00 . A A . 22 ILE HD13 1 1 15 13902 1 1 22 ILE HG12 H -1.350 -6.844 3.391 1.00 . A A . 22 ILE HG12 1 1 15 13903 1 1 22 ILE HG13 H -2.070 -7.878 2.161 1.00 . A A . 22 ILE HG13 1 1 15 13904 1 1 22 ILE HG21 H -3.940 -7.913 5.901 1.00 . A A . 22 ILE HG21 1 1 15 13905 1 1 22 ILE HG22 H -3.224 -6.460 5.203 1.00 . A A . 22 ILE HG22 1 1 15 13906 1 1 22 ILE HG23 H -2.218 -7.592 6.107 1.00 . A A . 22 ILE HG23 1 1 15 13907 1 1 22 ILE N N -0.432 -8.811 4.788 1.00 . A A . 22 ILE N 1 1 15 13908 1 1 22 ILE O O -0.514 -10.396 2.610 1.00 . A A . 22 ILE O 1 1 15 13909 1 1 23 SER C C -3.139 -10.864 0.312 1.00 . A A . 23 SER C 1 1 15 13910 1 1 23 SER CA C -2.739 -11.659 1.550 1.00 . A A . 23 SER CA 1 1 15 13911 1 1 23 SER CB C -3.705 -12.828 1.754 1.00 . A A . 23 SER CB 1 1 15 13912 1 1 23 SER H H -3.558 -10.644 3.217 1.00 . A A . 23 SER H 1 1 15 13913 1 1 23 SER HA H -1.742 -12.047 1.407 1.00 . A A . 23 SER HA 1 1 15 13914 1 1 23 SER HB2 H -4.681 -12.446 2.008 1.00 . A A . 23 SER HB2 1 1 15 13915 1 1 23 SER HB3 H -3.768 -13.402 0.840 1.00 . A A . 23 SER HB3 1 1 15 13916 1 1 23 SER HG H -3.908 -13.678 3.507 1.00 . A A . 23 SER HG 1 1 15 13917 1 1 23 SER N N -2.722 -10.804 2.731 1.00 . A A . 23 SER N 1 1 15 13918 1 1 23 SER O O -3.595 -9.724 0.412 1.00 . A A . 23 SER O 1 1 15 13919 1 1 23 SER OG O -3.262 -13.679 2.797 1.00 . A A . 23 SER OG 1 1 15 13920 1 1 24 ASP C C -4.781 -10.423 -2.143 1.00 . A A . 24 ASP C 1 1 15 13921 1 1 24 ASP CA C -3.308 -10.819 -2.117 1.00 . A A . 24 ASP CA 1 1 15 13922 1 1 24 ASP CB C -2.993 -11.744 -3.296 1.00 . A A . 24 ASP CB 1 1 15 13923 1 1 24 ASP CG C -1.703 -11.368 -3.997 1.00 . A A . 24 ASP CG 1 1 15 13924 1 1 24 ASP H H -2.597 -12.380 -0.874 1.00 . A A . 24 ASP H 1 1 15 13925 1 1 24 ASP HA H -2.706 -9.927 -2.202 1.00 . A A . 24 ASP HA 1 1 15 13926 1 1 24 ASP HB2 H -2.901 -12.758 -2.935 1.00 . A A . 24 ASP HB2 1 1 15 13927 1 1 24 ASP HB3 H -3.800 -11.693 -4.013 1.00 . A A . 24 ASP HB3 1 1 15 13928 1 1 24 ASP N N -2.965 -11.471 -0.858 1.00 . A A . 24 ASP N 1 1 15 13929 1 1 24 ASP O O -5.158 -9.436 -2.774 1.00 . A A . 24 ASP O 1 1 15 13930 1 1 24 ASP OD1 O -0.790 -10.847 -3.322 1.00 . A A . 24 ASP OD1 1 1 15 13931 1 1 24 ASP OD2 O -1.605 -11.593 -5.222 1.00 . A A . 24 ASP OD2 1 1 15 13932 1 1 25 ALA C C -7.320 -9.602 -0.695 1.00 . A A . 25 ALA C 1 1 15 13933 1 1 25 ALA CA C -7.041 -10.929 -1.393 1.00 . A A . 25 ALA CA 1 1 15 13934 1 1 25 ALA CB C -7.764 -12.063 -0.684 1.00 . A A . 25 ALA CB 1 1 15 13935 1 1 25 ALA H H -5.250 -11.971 -0.967 1.00 . A A . 25 ALA H 1 1 15 13936 1 1 25 ALA HA H -7.411 -10.874 -2.407 1.00 . A A . 25 ALA HA 1 1 15 13937 1 1 25 ALA HB1 H -7.410 -12.136 0.333 1.00 . A A . 25 ALA HB1 1 1 15 13938 1 1 25 ALA HB2 H -7.572 -12.992 -1.200 1.00 . A A . 25 ALA HB2 1 1 15 13939 1 1 25 ALA HB3 H -8.826 -11.867 -0.682 1.00 . A A . 25 ALA HB3 1 1 15 13940 1 1 25 ALA N N -5.609 -11.199 -1.450 1.00 . A A . 25 ALA N 1 1 15 13941 1 1 25 ALA O O -8.134 -8.804 -1.159 1.00 . A A . 25 ALA O 1 1 15 13942 1 1 26 ALA C C -6.515 -6.917 0.330 1.00 . A A . 26 ALA C 1 1 15 13943 1 1 26 ALA CA C -6.815 -8.143 1.187 1.00 . A A . 26 ALA CA 1 1 15 13944 1 1 26 ALA CB C -5.924 -8.156 2.421 1.00 . A A . 26 ALA CB 1 1 15 13945 1 1 26 ALA H H -6.004 -10.047 0.744 1.00 . A A . 26 ALA H 1 1 15 13946 1 1 26 ALA HA H -7.842 -8.097 1.515 1.00 . A A . 26 ALA HA 1 1 15 13947 1 1 26 ALA HB1 H -6.451 -8.624 3.239 1.00 . A A . 26 ALA HB1 1 1 15 13948 1 1 26 ALA HB2 H -5.668 -7.143 2.692 1.00 . A A . 26 ALA HB2 1 1 15 13949 1 1 26 ALA HB3 H -5.022 -8.712 2.209 1.00 . A A . 26 ALA HB3 1 1 15 13950 1 1 26 ALA N N -6.639 -9.373 0.424 1.00 . A A . 26 ALA N 1 1 15 13951 1 1 26 ALA O O -7.275 -5.949 0.326 1.00 . A A . 26 ALA O 1 1 15 13952 1 1 27 VAL C C -5.958 -5.719 -2.441 1.00 . A A . 27 VAL C 1 1 15 13953 1 1 27 VAL CA C -5.004 -5.863 -1.260 1.00 . A A . 27 VAL CA 1 1 15 13954 1 1 27 VAL CB C -3.569 -6.055 -1.790 1.00 . A A . 27 VAL CB 1 1 15 13955 1 1 27 VAL CG1 C -3.158 -4.886 -2.673 1.00 . A A . 27 VAL CG1 1 1 15 13956 1 1 27 VAL CG2 C -2.594 -6.229 -0.635 1.00 . A A . 27 VAL CG2 1 1 15 13957 1 1 27 VAL H H -4.840 -7.769 -0.353 1.00 . A A . 27 VAL H 1 1 15 13958 1 1 27 VAL HA H -5.031 -4.956 -0.674 1.00 . A A . 27 VAL HA 1 1 15 13959 1 1 27 VAL HB H -3.546 -6.954 -2.390 1.00 . A A . 27 VAL HB 1 1 15 13960 1 1 27 VAL HG11 H -3.149 -3.978 -2.087 1.00 . A A . 27 VAL HG11 1 1 15 13961 1 1 27 VAL HG12 H -3.864 -4.783 -3.485 1.00 . A A . 27 VAL HG12 1 1 15 13962 1 1 27 VAL HG13 H -2.172 -5.065 -3.075 1.00 . A A . 27 VAL HG13 1 1 15 13963 1 1 27 VAL HG21 H -2.731 -5.426 0.075 1.00 . A A . 27 VAL HG21 1 1 15 13964 1 1 27 VAL HG22 H -1.582 -6.207 -1.013 1.00 . A A . 27 VAL HG22 1 1 15 13965 1 1 27 VAL HG23 H -2.777 -7.176 -0.149 1.00 . A A . 27 VAL HG23 1 1 15 13966 1 1 27 VAL N N -5.404 -6.968 -0.397 1.00 . A A . 27 VAL N 1 1 15 13967 1 1 27 VAL O O -6.262 -4.608 -2.875 1.00 . A A . 27 VAL O 1 1 15 13968 1 1 28 SER C C -8.732 -6.383 -3.665 1.00 . A A . 28 SER C 1 1 15 13969 1 1 28 SER CA C -7.344 -6.847 -4.092 1.00 . A A . 28 SER CA 1 1 15 13970 1 1 28 SER CB C -7.427 -8.243 -4.711 1.00 . A A . 28 SER CB 1 1 15 13971 1 1 28 SER H H -6.146 -7.705 -2.571 1.00 . A A . 28 SER H 1 1 15 13972 1 1 28 SER HA H -6.957 -6.158 -4.828 1.00 . A A . 28 SER HA 1 1 15 13973 1 1 28 SER HB2 H -6.432 -8.595 -4.938 1.00 . A A . 28 SER HB2 1 1 15 13974 1 1 28 SER HB3 H -7.896 -8.918 -4.010 1.00 . A A . 28 SER HB3 1 1 15 13975 1 1 28 SER HG H -7.599 -8.272 -6.663 1.00 . A A . 28 SER HG 1 1 15 13976 1 1 28 SER N N -6.425 -6.850 -2.959 1.00 . A A . 28 SER N 1 1 15 13977 1 1 28 SER O O -9.437 -5.720 -4.424 1.00 . A A . 28 SER O 1 1 15 13978 1 1 28 SER OG O -8.188 -8.226 -5.906 1.00 . A A . 28 SER OG 1 1 15 13979 1 1 29 GLN C C -10.500 -4.848 -1.676 1.00 . A A . 29 GLN C 1 1 15 13980 1 1 29 GLN CA C -10.420 -6.355 -1.911 1.00 . A A . 29 GLN CA 1 1 15 13981 1 1 29 GLN CB C -10.700 -7.099 -0.604 1.00 . A A . 29 GLN CB 1 1 15 13982 1 1 29 GLN CD C -12.400 -8.708 0.340 1.00 . A A . 29 GLN CD 1 1 15 13983 1 1 29 GLN CG C -12.170 -7.388 -0.371 1.00 . A A . 29 GLN CG 1 1 15 13984 1 1 29 GLN H H -8.510 -7.264 -1.883 1.00 . A A . 29 GLN H 1 1 15 13985 1 1 29 GLN HA H -11.160 -6.633 -2.639 1.00 . A A . 29 GLN HA 1 1 15 13986 1 1 29 GLN HB2 H -10.160 -8.039 -0.619 1.00 . A A . 29 GLN HB2 1 1 15 13987 1 1 29 GLN HB3 H -10.330 -6.504 0.220 1.00 . A A . 29 GLN HB3 1 1 15 13988 1 1 29 GLN HE21 H -13.120 -7.754 1.928 1.00 . A A . 29 GLN HE21 1 1 15 13989 1 1 29 GLN HE22 H -13.080 -9.476 2.043 1.00 . A A . 29 GLN HE22 1 1 15 13990 1 1 29 GLN HG2 H -12.590 -6.595 0.230 1.00 . A A . 29 GLN HG2 1 1 15 13991 1 1 29 GLN HG3 H -12.670 -7.418 -1.327 1.00 . A A . 29 GLN HG3 1 1 15 13992 1 1 29 GLN N N -9.117 -6.736 -2.441 1.00 . A A . 29 GLN N 1 1 15 13993 1 1 29 GLN NE2 N -12.920 -8.638 1.561 1.00 . A A . 29 GLN NE2 1 1 15 13994 1 1 29 GLN O O -11.590 -4.288 -1.559 1.00 . A A . 29 GLN O 1 1 15 13995 1 1 29 GLN OE1 O -12.110 -9.777 -0.200 1.00 . A A . 29 GLN OE1 1 1 15 13996 1 1 30 TRP C C -10.150 -2.006 -2.391 1.00 . A A . 30 TRP C 1 1 15 13997 1 1 30 TRP CA C -9.291 -2.754 -1.380 1.00 . A A . 30 TRP CA 1 1 15 13998 1 1 30 TRP CB C -7.845 -2.258 -1.468 1.00 . A A . 30 TRP CB 1 1 15 13999 1 1 30 TRP CD1 C -7.505 -3.004 0.963 1.00 . A A . 30 TRP CD1 1 1 15 14000 1 1 30 TRP CD2 C -5.639 -2.300 -0.057 1.00 . A A . 30 TRP CD2 1 1 15 14001 1 1 30 TRP CE2 C -5.316 -2.679 1.260 1.00 . A A . 30 TRP CE2 1 1 15 14002 1 1 30 TRP CE3 C -4.623 -1.827 -0.892 1.00 . A A . 30 TRP CE3 1 1 15 14003 1 1 30 TRP CG C -7.044 -2.518 -0.227 1.00 . A A . 30 TRP CG 1 1 15 14004 1 1 30 TRP CH2 C -3.044 -2.128 0.922 1.00 . A A . 30 TRP CH2 1 1 15 14005 1 1 30 TRP CZ2 C -4.018 -2.595 1.759 1.00 . A A . 30 TRP CZ2 1 1 15 14006 1 1 30 TRP CZ3 C -3.336 -1.745 -0.393 1.00 . A A . 30 TRP CZ3 1 1 15 14007 1 1 30 TRP H H -8.507 -4.693 -1.702 1.00 . A A . 30 TRP H 1 1 15 14008 1 1 30 TRP HA H -9.668 -2.559 -0.388 1.00 . A A . 30 TRP HA 1 1 15 14009 1 1 30 TRP HB2 H -7.353 -2.752 -2.291 1.00 . A A . 30 TRP HB2 1 1 15 14010 1 1 30 TRP HB3 H -7.849 -1.192 -1.645 1.00 . A A . 30 TRP HB3 1 1 15 14011 1 1 30 TRP HD1 H -8.534 -3.266 1.155 1.00 . A A . 30 TRP HD1 1 1 15 14012 1 1 30 TRP HE1 H -6.549 -3.427 2.784 1.00 . A A . 30 TRP HE1 1 1 15 14013 1 1 30 TRP HE3 H -4.829 -1.526 -1.908 1.00 . A A . 30 TRP HE3 1 1 15 14014 1 1 30 TRP HH2 H -2.024 -2.045 1.269 1.00 . A A . 30 TRP HH2 1 1 15 14015 1 1 30 TRP HZ2 H -3.776 -2.888 2.772 1.00 . A A . 30 TRP HZ2 1 1 15 14016 1 1 30 TRP HZ3 H -2.539 -1.379 -1.023 1.00 . A A . 30 TRP HZ3 1 1 15 14017 1 1 30 TRP N N -9.345 -4.195 -1.604 1.00 . A A . 30 TRP N 1 1 15 14018 1 1 30 TRP NE1 N -6.470 -3.104 1.862 1.00 . A A . 30 TRP NE1 1 1 15 14019 1 1 30 TRP O O -10.810 -2.615 -3.235 1.00 . A A . 30 TRP O 1 1 15 14020 1 1 31 LYS C C -10.210 1.480 -3.458 1.00 . A A . 31 LYS C 1 1 15 14021 1 1 31 LYS CA C -10.920 0.157 -3.200 1.00 . A A . 31 LYS CA 1 1 15 14022 1 1 31 LYS CB C -12.320 0.411 -2.614 1.00 . A A . 31 LYS CB 1 1 15 14023 1 1 31 LYS CD C -14.300 -0.511 -1.386 1.00 . A A . 31 LYS CD 1 1 15 14024 1 1 31 LYS CE C -14.850 -1.700 -0.608 1.00 . A A . 31 LYS CE 1 1 15 14025 1 1 31 LYS CG C -12.970 -0.834 -2.035 1.00 . A A . 31 LYS CG 1 1 15 14026 1 1 31 LYS H H -9.602 -0.254 -1.603 1.00 . A A . 31 LYS H 1 1 15 14027 1 1 31 LYS HA H -11.030 -0.371 -4.137 1.00 . A A . 31 LYS HA 1 1 15 14028 1 1 31 LYS HB2 H -12.230 1.148 -1.828 1.00 . A A . 31 LYS HB2 1 1 15 14029 1 1 31 LYS HB3 H -12.960 0.798 -3.393 1.00 . A A . 31 LYS HB3 1 1 15 14030 1 1 31 LYS HD2 H -14.170 0.319 -0.708 1.00 . A A . 31 LYS HD2 1 1 15 14031 1 1 31 LYS HD3 H -15.010 -0.242 -2.156 1.00 . A A . 31 LYS HD3 1 1 15 14032 1 1 31 LYS HE2 H -14.020 -2.263 -0.211 1.00 . A A . 31 LYS HE2 1 1 15 14033 1 1 31 LYS HE3 H -15.450 -1.334 0.207 1.00 . A A . 31 LYS HE3 1 1 15 14034 1 1 31 LYS HG2 H -13.130 -1.546 -2.829 1.00 . A A . 31 LYS HG2 1 1 15 14035 1 1 31 LYS HG3 H -12.310 -1.262 -1.292 1.00 . A A . 31 LYS HG3 1 1 15 14036 1 1 31 LYS HZ1 H -15.520 -3.587 -1.193 1.00 . A A . 31 LYS HZ1 1 1 15 14037 1 1 31 LYS HZ2 H -15.410 -2.476 -2.462 1.00 . A A . 31 LYS HZ2 1 1 15 14038 1 1 31 LYS HZ3 H -16.680 -2.364 -1.354 1.00 . A A . 31 LYS HZ3 1 1 15 14039 1 1 31 LYS N N -10.140 -0.681 -2.297 1.00 . A A . 31 LYS N 1 1 15 14040 1 1 31 LYS NZ N -15.670 -2.596 -1.464 1.00 . A A . 31 LYS NZ 1 1 15 14041 1 1 31 LYS O O -9.016 1.609 -3.202 1.00 . A A . 31 LYS O 1 1 15 14042 1 1 32 GLU C C -9.600 4.316 -3.063 1.00 . A A . 32 GLU C 1 1 15 14043 1 1 32 GLU CA C -10.380 3.777 -4.257 1.00 . A A . 32 GLU CA 1 1 15 14044 1 1 32 GLU CB C -11.490 4.759 -4.642 1.00 . A A . 32 GLU CB 1 1 15 14045 1 1 32 GLU CD C -12.430 6.291 -6.420 1.00 . A A . 32 GLU CD 1 1 15 14046 1 1 32 GLU CG C -11.460 5.162 -6.107 1.00 . A A . 32 GLU CG 1 1 15 14047 1 1 32 GLU H H -11.900 2.301 -4.150 1.00 . A A . 32 GLU H 1 1 15 14048 1 1 32 GLU HA H -9.712 3.667 -5.094 1.00 . A A . 32 GLU HA 1 1 15 14049 1 1 32 GLU HB2 H -12.450 4.302 -4.435 1.00 . A A . 32 GLU HB2 1 1 15 14050 1 1 32 GLU HB3 H -11.390 5.652 -4.044 1.00 . A A . 32 GLU HB3 1 1 15 14051 1 1 32 GLU HG2 H -10.460 5.483 -6.362 1.00 . A A . 32 GLU HG2 1 1 15 14052 1 1 32 GLU HG3 H -11.730 4.305 -6.709 1.00 . A A . 32 GLU HG3 1 1 15 14053 1 1 32 GLU N N -10.950 2.462 -3.966 1.00 . A A . 32 GLU N 1 1 15 14054 1 1 32 GLU O O -8.675 5.113 -3.225 1.00 . A A . 32 GLU O 1 1 15 14055 1 1 32 GLU OE1 O -13.640 6.023 -6.520 1.00 . A A . 32 GLU OE1 1 1 15 14056 1 1 32 GLU OE2 O -11.960 7.442 -6.566 1.00 . A A . 32 GLU OE2 1 1 15 14057 1 1 33 VAL C C -9.048 3.144 0.294 1.00 . A A . 33 VAL C 1 1 15 14058 1 1 33 VAL CA C -9.302 4.319 -0.646 1.00 . A A . 33 VAL CA 1 1 15 14059 1 1 33 VAL CB C -10.120 5.389 0.099 1.00 . A A . 33 VAL CB 1 1 15 14060 1 1 33 VAL CG1 C -9.260 6.127 1.108 1.00 . A A . 33 VAL CG1 1 1 15 14061 1 1 33 VAL CG2 C -10.750 6.364 -0.884 1.00 . A A . 33 VAL CG2 1 1 15 14062 1 1 33 VAL H H -10.710 3.246 -1.796 1.00 . A A . 33 VAL H 1 1 15 14063 1 1 33 VAL HA H -8.354 4.755 -0.927 1.00 . A A . 33 VAL HA 1 1 15 14064 1 1 33 VAL HB H -10.920 4.892 0.638 1.00 . A A . 33 VAL HB 1 1 15 14065 1 1 33 VAL HG11 H -8.368 5.551 1.305 1.00 . A A . 33 VAL HG11 1 1 15 14066 1 1 33 VAL HG12 H -9.812 6.264 2.026 1.00 . A A . 33 VAL HG12 1 1 15 14067 1 1 33 VAL HG13 H -8.984 7.092 0.707 1.00 . A A . 33 VAL HG13 1 1 15 14068 1 1 33 VAL HG21 H -9.984 6.819 -1.486 1.00 . A A . 33 VAL HG21 1 1 15 14069 1 1 33 VAL HG22 H -11.280 7.132 -0.341 1.00 . A A . 33 VAL HG22 1 1 15 14070 1 1 33 VAL HG23 H -11.440 5.835 -1.525 1.00 . A A . 33 VAL HG23 1 1 15 14071 1 1 33 VAL N N -9.975 3.878 -1.863 1.00 . A A . 33 VAL N 1 1 15 14072 1 1 33 VAL O O -9.986 2.531 0.804 1.00 . A A . 33 VAL O 1 1 15 14073 1 1 34 ILE C C -7.812 1.999 2.837 1.00 . A A . 34 ILE C 1 1 15 14074 1 1 34 ILE CA C -7.398 1.728 1.393 1.00 . A A . 34 ILE CA 1 1 15 14075 1 1 34 ILE CB C -5.878 1.467 1.349 1.00 . A A . 34 ILE CB 1 1 15 14076 1 1 34 ILE CD1 C -3.614 2.475 1.903 1.00 . A A . 34 ILE CD1 1 1 15 14077 1 1 34 ILE CG1 C -5.109 2.693 1.837 1.00 . A A . 34 ILE CG1 1 1 15 14078 1 1 34 ILE CG2 C -5.443 1.094 -0.059 1.00 . A A . 34 ILE CG2 1 1 15 14079 1 1 34 ILE H H -7.071 3.357 0.079 1.00 . A A . 34 ILE H 1 1 15 14080 1 1 34 ILE HA H -7.904 0.838 1.044 1.00 . A A . 34 ILE HA 1 1 15 14081 1 1 34 ILE HB H -5.660 0.633 1.998 1.00 . A A . 34 ILE HB 1 1 15 14082 1 1 34 ILE HD11 H -3.372 1.904 2.788 1.00 . A A . 34 ILE HD11 1 1 15 14083 1 1 34 ILE HD12 H -3.112 3.431 1.944 1.00 . A A . 34 ILE HD12 1 1 15 14084 1 1 34 ILE HD13 H -3.289 1.936 1.025 1.00 . A A . 34 ILE HD13 1 1 15 14085 1 1 34 ILE HG12 H -5.294 3.519 1.167 1.00 . A A . 34 ILE HG12 1 1 15 14086 1 1 34 ILE HG13 H -5.452 2.955 2.828 1.00 . A A . 34 ILE HG13 1 1 15 14087 1 1 34 ILE HG21 H -5.268 1.992 -0.630 1.00 . A A . 34 ILE HG21 1 1 15 14088 1 1 34 ILE HG22 H -6.218 0.509 -0.533 1.00 . A A . 34 ILE HG22 1 1 15 14089 1 1 34 ILE HG23 H -4.533 0.515 -0.010 1.00 . A A . 34 ILE HG23 1 1 15 14090 1 1 34 ILE N N -7.774 2.833 0.517 1.00 . A A . 34 ILE N 1 1 15 14091 1 1 34 ILE O O -8.058 3.143 3.216 1.00 . A A . 34 ILE O 1 1 15 14092 1 1 35 PRO C C -7.432 2.116 5.811 1.00 . A A . 35 PRO C 1 1 15 14093 1 1 35 PRO CA C -8.276 1.079 5.078 1.00 . A A . 35 PRO CA 1 1 15 14094 1 1 35 PRO CB C -8.023 -0.319 5.651 1.00 . A A . 35 PRO CB 1 1 15 14095 1 1 35 PRO CD C -7.612 -0.457 3.303 1.00 . A A . 35 PRO CD 1 1 15 14096 1 1 35 PRO CG C -8.134 -1.232 4.481 1.00 . A A . 35 PRO CG 1 1 15 14097 1 1 35 PRO HA H -9.321 1.328 5.180 1.00 . A A . 35 PRO HA 1 1 15 14098 1 1 35 PRO HB2 H -7.036 -0.356 6.091 1.00 . A A . 35 PRO HB2 1 1 15 14099 1 1 35 PRO HB3 H -8.767 -0.544 6.400 1.00 . A A . 35 PRO HB3 1 1 15 14100 1 1 35 PRO HD2 H -6.552 -0.623 3.185 1.00 . A A . 35 PRO HD2 1 1 15 14101 1 1 35 PRO HD3 H -8.143 -0.734 2.404 1.00 . A A . 35 PRO HD3 1 1 15 14102 1 1 35 PRO HG2 H -7.533 -2.115 4.646 1.00 . A A . 35 PRO HG2 1 1 15 14103 1 1 35 PRO HG3 H -9.167 -1.503 4.325 1.00 . A A . 35 PRO HG3 1 1 15 14104 1 1 35 PRO N N -7.892 0.944 3.668 1.00 . A A . 35 PRO N 1 1 15 14105 1 1 35 PRO O O -6.365 2.511 5.338 1.00 . A A . 35 PRO O 1 1 15 14106 1 1 36 GLU C C -5.975 2.940 8.433 1.00 . A A . 36 GLU C 1 1 15 14107 1 1 36 GLU CA C -7.207 3.549 7.767 1.00 . A A . 36 GLU CA 1 1 15 14108 1 1 36 GLU CB C -8.137 4.135 8.830 1.00 . A A . 36 GLU CB 1 1 15 14109 1 1 36 GLU CD C -8.099 5.310 11.066 1.00 . A A . 36 GLU CD 1 1 15 14110 1 1 36 GLU CG C -7.486 5.212 9.682 1.00 . A A . 36 GLU CG 1 1 15 14111 1 1 36 GLU H H -8.771 2.204 7.293 1.00 . A A . 36 GLU H 1 1 15 14112 1 1 36 GLU HA H -6.889 4.340 7.104 1.00 . A A . 36 GLU HA 1 1 15 14113 1 1 36 GLU HB2 H -8.998 4.567 8.340 1.00 . A A . 36 GLU HB2 1 1 15 14114 1 1 36 GLU HB3 H -8.467 3.340 9.481 1.00 . A A . 36 GLU HB3 1 1 15 14115 1 1 36 GLU HG2 H -6.435 4.983 9.788 1.00 . A A . 36 GLU HG2 1 1 15 14116 1 1 36 GLU HG3 H -7.599 6.164 9.187 1.00 . A A . 36 GLU HG3 1 1 15 14117 1 1 36 GLU N N -7.916 2.555 6.969 1.00 . A A . 36 GLU N 1 1 15 14118 1 1 36 GLU O O -4.982 3.629 8.666 1.00 . A A . 36 GLU O 1 1 15 14119 1 1 36 GLU OE1 O -9.260 4.879 11.233 1.00 . A A . 36 GLU OE1 1 1 15 14120 1 1 36 GLU OE2 O -7.419 5.817 11.983 1.00 . A A . 36 GLU OE2 1 1 15 14121 1 1 37 LYS C C -3.925 0.464 8.355 1.00 . A A . 37 LYS C 1 1 15 14122 1 1 37 LYS CA C -4.938 0.955 9.383 1.00 . A A . 37 LYS CA 1 1 15 14123 1 1 37 LYS CB C -5.455 -0.223 10.211 1.00 . A A . 37 LYS CB 1 1 15 14124 1 1 37 LYS CD C -6.626 -0.915 12.323 1.00 . A A . 37 LYS CD 1 1 15 14125 1 1 37 LYS CE C -7.566 -0.292 13.343 1.00 . A A . 37 LYS CE 1 1 15 14126 1 1 37 LYS CG C -5.753 0.135 11.659 1.00 . A A . 37 LYS CG 1 1 15 14127 1 1 37 LYS H H -6.868 1.153 8.533 1.00 . A A . 37 LYS H 1 1 15 14128 1 1 37 LYS HA H -4.446 1.657 10.038 1.00 . A A . 37 LYS HA 1 1 15 14129 1 1 37 LYS HB2 H -6.363 -0.595 9.762 1.00 . A A . 37 LYS HB2 1 1 15 14130 1 1 37 LYS HB3 H -4.712 -1.008 10.204 1.00 . A A . 37 LYS HB3 1 1 15 14131 1 1 37 LYS HD2 H -7.212 -1.414 11.567 1.00 . A A . 37 LYS HD2 1 1 15 14132 1 1 37 LYS HD3 H -5.992 -1.633 12.823 1.00 . A A . 37 LYS HD3 1 1 15 14133 1 1 37 LYS HE2 H -8.247 -1.053 13.697 1.00 . A A . 37 LYS HE2 1 1 15 14134 1 1 37 LYS HE3 H -6.982 0.080 14.171 1.00 . A A . 37 LYS HE3 1 1 15 14135 1 1 37 LYS HG2 H -4.820 0.209 12.200 1.00 . A A . 37 LYS HG2 1 1 15 14136 1 1 37 LYS HG3 H -6.263 1.087 11.686 1.00 . A A . 37 LYS HG3 1 1 15 14137 1 1 37 LYS HZ1 H -7.884 1.735 12.956 1.00 . A A . 37 LYS HZ1 1 1 15 14138 1 1 37 LYS HZ2 H -9.307 0.849 13.175 1.00 . A A . 37 LYS HZ2 1 1 15 14139 1 1 37 LYS HZ3 H -8.439 0.708 11.730 1.00 . A A . 37 LYS HZ3 1 1 15 14140 1 1 37 LYS N N -6.048 1.649 8.740 1.00 . A A . 37 LYS N 1 1 15 14141 1 1 37 LYS NZ N -8.354 0.827 12.760 1.00 . A A . 37 LYS NZ 1 1 15 14142 1 1 37 LYS O O -2.755 0.258 8.677 1.00 . A A . 37 LYS O 1 1 15 14143 1 1 38 ASP C C -2.662 0.993 5.529 1.00 . A A . 38 ASP C 1 1 15 14144 1 1 38 ASP CA C -3.492 -0.170 6.053 1.00 . A A . 38 ASP CA 1 1 15 14145 1 1 38 ASP CB C -4.302 -0.794 4.914 1.00 . A A . 38 ASP CB 1 1 15 14146 1 1 38 ASP CG C -4.983 -2.084 5.328 1.00 . A A . 38 ASP CG 1 1 15 14147 1 1 38 ASP H H -5.315 0.470 6.916 1.00 . A A . 38 ASP H 1 1 15 14148 1 1 38 ASP HA H -2.829 -0.916 6.468 1.00 . A A . 38 ASP HA 1 1 15 14149 1 1 38 ASP HB2 H -5.062 -0.094 4.597 1.00 . A A . 38 ASP HB2 1 1 15 14150 1 1 38 ASP HB3 H -3.643 -1.004 4.086 1.00 . A A . 38 ASP HB3 1 1 15 14151 1 1 38 ASP N N -4.375 0.286 7.118 1.00 . A A . 38 ASP N 1 1 15 14152 1 1 38 ASP O O -1.446 0.882 5.373 1.00 . A A . 38 ASP O 1 1 15 14153 1 1 38 ASP OD1 O -5.195 -2.281 6.543 1.00 . A A . 38 ASP OD1 1 1 15 14154 1 1 38 ASP OD2 O -5.305 -2.897 4.435 1.00 . A A . 38 ASP OD2 1 1 15 14155 1 1 39 ALA C C -1.608 3.792 5.785 1.00 . A A . 39 ALA C 1 1 15 14156 1 1 39 ALA CA C -2.653 3.306 4.785 1.00 . A A . 39 ALA CA 1 1 15 14157 1 1 39 ALA CB C -3.665 4.406 4.503 1.00 . A A . 39 ALA CB 1 1 15 14158 1 1 39 ALA H H -4.295 2.140 5.428 1.00 . A A . 39 ALA H 1 1 15 14159 1 1 39 ALA HA H -2.162 3.054 3.858 1.00 . A A . 39 ALA HA 1 1 15 14160 1 1 39 ALA HB1 H -3.961 4.365 3.466 1.00 . A A . 39 ALA HB1 1 1 15 14161 1 1 39 ALA HB2 H -3.221 5.367 4.715 1.00 . A A . 39 ALA HB2 1 1 15 14162 1 1 39 ALA HB3 H -4.533 4.265 5.130 1.00 . A A . 39 ALA HB3 1 1 15 14163 1 1 39 ALA N N -3.327 2.113 5.275 1.00 . A A . 39 ALA N 1 1 15 14164 1 1 39 ALA O O -0.651 4.472 5.414 1.00 . A A . 39 ALA O 1 1 15 14165 1 1 40 TYR C C 0.476 3.156 7.950 1.00 . A A . 40 TYR C 1 1 15 14166 1 1 40 TYR CA C -0.875 3.850 8.107 1.00 . A A . 40 TYR CA 1 1 15 14167 1 1 40 TYR CB C -1.469 3.531 9.481 1.00 . A A . 40 TYR CB 1 1 15 14168 1 1 40 TYR CD1 C 0.106 5.072 10.710 1.00 . A A . 40 TYR CD1 1 1 15 14169 1 1 40 TYR CD2 C -0.311 2.917 11.638 1.00 . A A . 40 TYR CD2 1 1 15 14170 1 1 40 TYR CE1 C 0.956 5.365 11.758 1.00 . A A . 40 TYR CE1 1 1 15 14171 1 1 40 TYR CE2 C 0.537 3.202 12.691 1.00 . A A . 40 TYR CE2 1 1 15 14172 1 1 40 TYR CG C -0.541 3.847 10.632 1.00 . A A . 40 TYR CG 1 1 15 14173 1 1 40 TYR CZ C 1.167 4.428 12.747 1.00 . A A . 40 TYR CZ 1 1 15 14174 1 1 40 TYR H H -2.585 2.903 7.294 1.00 . A A . 40 TYR H 1 1 15 14175 1 1 40 TYR HA H -0.730 4.916 8.027 1.00 . A A . 40 TYR HA 1 1 15 14176 1 1 40 TYR HB2 H -2.372 4.110 9.617 1.00 . A A . 40 TYR HB2 1 1 15 14177 1 1 40 TYR HB3 H -1.710 2.476 9.526 1.00 . A A . 40 TYR HB3 1 1 15 14178 1 1 40 TYR HD1 H -0.063 5.804 9.934 1.00 . A A . 40 TYR HD1 1 1 15 14179 1 1 40 TYR HD2 H -0.807 1.958 11.589 1.00 . A A . 40 TYR HD2 1 1 15 14180 1 1 40 TYR HE1 H 1.449 6.325 11.800 1.00 . A A . 40 TYR HE1 1 1 15 14181 1 1 40 TYR HE2 H 0.701 2.467 13.465 1.00 . A A . 40 TYR HE2 1 1 15 14182 1 1 40 TYR HH H 2.769 5.209 13.470 1.00 . A A . 40 TYR HH 1 1 15 14183 1 1 40 TYR N N -1.801 3.444 7.056 1.00 . A A . 40 TYR N 1 1 15 14184 1 1 40 TYR O O 1.515 3.810 7.872 1.00 . A A . 40 TYR O 1 1 15 14185 1 1 40 TYR OH O 2.012 4.716 13.795 1.00 . A A . 40 TYR OH 1 1 15 14186 1 1 41 ARG C C 2.467 1.449 6.528 1.00 . A A . 41 ARG C 1 1 15 14187 1 1 41 ARG CA C 1.677 1.043 7.772 1.00 . A A . 41 ARG CA 1 1 15 14188 1 1 41 ARG CB C 1.343 -0.450 7.713 1.00 . A A . 41 ARG CB 1 1 15 14189 1 1 41 ARG CD C -0.075 -1.945 9.156 1.00 . A A . 41 ARG CD 1 1 15 14190 1 1 41 ARG CG C 1.183 -1.092 9.082 1.00 . A A . 41 ARG CG 1 1 15 14191 1 1 41 ARG CZ C -0.020 -2.791 11.470 1.00 . A A . 41 ARG CZ 1 1 15 14192 1 1 41 ARG H H -0.405 1.362 7.983 1.00 . A A . 41 ARG H 1 1 15 14193 1 1 41 ARG HA H 2.288 1.228 8.644 1.00 . A A . 41 ARG HA 1 1 15 14194 1 1 41 ARG HB2 H 0.421 -0.577 7.167 1.00 . A A . 41 ARG HB2 1 1 15 14195 1 1 41 ARG HB3 H 2.136 -0.962 7.189 1.00 . A A . 41 ARG HB3 1 1 15 14196 1 1 41 ARG HD2 H -0.910 -1.310 9.412 1.00 . A A . 41 ARG HD2 1 1 15 14197 1 1 41 ARG HD3 H -0.247 -2.394 8.189 1.00 . A A . 41 ARG HD3 1 1 15 14198 1 1 41 ARG HE H 0.169 -3.919 9.834 1.00 . A A . 41 ARG HE 1 1 15 14199 1 1 41 ARG HG2 H 2.041 -1.717 9.278 1.00 . A A . 41 ARG HG2 1 1 15 14200 1 1 41 ARG HG3 H 1.124 -0.314 9.829 1.00 . A A . 41 ARG HG3 1 1 15 14201 1 1 41 ARG HH11 H -0.278 -0.791 11.315 1.00 . A A . 41 ARG HH11 1 1 15 14202 1 1 41 ARG HH12 H -0.236 -1.411 12.932 1.00 . A A . 41 ARG HH12 1 1 15 14203 1 1 41 ARG HH21 H 0.223 -4.736 11.959 1.00 . A A . 41 ARG HH21 1 1 15 14204 1 1 41 ARG HH22 H 0.048 -3.651 13.298 1.00 . A A . 41 ARG HH22 1 1 15 14205 1 1 41 ARG N N 0.455 1.827 7.911 1.00 . A A . 41 ARG N 1 1 15 14206 1 1 41 ARG NE N 0.040 -3.002 10.157 1.00 . A A . 41 ARG NE 1 1 15 14207 1 1 41 ARG NH1 N -0.192 -1.563 11.943 1.00 . A A . 41 ARG NH1 1 1 15 14208 1 1 41 ARG NH2 N 0.093 -3.810 12.312 1.00 . A A . 41 ARG NH2 1 1 15 14209 1 1 41 ARG O O 3.673 1.212 6.445 1.00 . A A . 41 ARG O 1 1 15 14210 1 1 42 LEU C C 3.663 3.345 4.608 1.00 . A A . 42 LEU C 1 1 15 14211 1 1 42 LEU CA C 2.432 2.486 4.323 1.00 . A A . 42 LEU CA 1 1 15 14212 1 1 42 LEU CB C 1.448 3.272 3.453 1.00 . A A . 42 LEU CB 1 1 15 14213 1 1 42 LEU CD1 C -0.565 3.312 1.962 1.00 . A A . 42 LEU CD1 1 1 15 14214 1 1 42 LEU CD2 C 0.731 1.191 2.252 1.00 . A A . 42 LEU CD2 1 1 15 14215 1 1 42 LEU CG C 0.256 2.469 2.927 1.00 . A A . 42 LEU CG 1 1 15 14216 1 1 42 LEU H H 0.826 2.216 5.678 1.00 . A A . 42 LEU H 1 1 15 14217 1 1 42 LEU HA H 2.742 1.601 3.788 1.00 . A A . 42 LEU HA 1 1 15 14218 1 1 42 LEU HB2 H 1.069 4.100 4.035 1.00 . A A . 42 LEU HB2 1 1 15 14219 1 1 42 LEU HB3 H 1.988 3.668 2.606 1.00 . A A . 42 LEU HB3 1 1 15 14220 1 1 42 LEU HD11 H -1.207 2.669 1.379 1.00 . A A . 42 LEU HD11 1 1 15 14221 1 1 42 LEU HD12 H 0.098 3.853 1.303 1.00 . A A . 42 LEU HD12 1 1 15 14222 1 1 42 LEU HD13 H -1.169 4.013 2.520 1.00 . A A . 42 LEU HD13 1 1 15 14223 1 1 42 LEU HD21 H -0.025 0.846 1.561 1.00 . A A . 42 LEU HD21 1 1 15 14224 1 1 42 LEU HD22 H 0.907 0.431 3.000 1.00 . A A . 42 LEU HD22 1 1 15 14225 1 1 42 LEU HD23 H 1.647 1.385 1.714 1.00 . A A . 42 LEU HD23 1 1 15 14226 1 1 42 LEU HG H -0.379 2.196 3.756 1.00 . A A . 42 LEU HG 1 1 15 14227 1 1 42 LEU N N 1.786 2.056 5.560 1.00 . A A . 42 LEU N 1 1 15 14228 1 1 42 LEU O O 4.770 3.021 4.180 1.00 . A A . 42 LEU O 1 1 15 14229 1 1 43 GLU C C 5.704 4.624 6.341 1.00 . A A . 43 GLU C 1 1 15 14230 1 1 43 GLU CA C 4.548 5.356 5.663 1.00 . A A . 43 GLU CA 1 1 15 14231 1 1 43 GLU CB C 4.038 6.476 6.572 1.00 . A A . 43 GLU CB 1 1 15 14232 1 1 43 GLU CD C 3.770 8.949 6.123 1.00 . A A . 43 GLU CD 1 1 15 14233 1 1 43 GLU CG C 3.259 7.551 5.832 1.00 . A A . 43 GLU CG 1 1 15 14234 1 1 43 GLU H H 2.551 4.650 5.635 1.00 . A A . 43 GLU H 1 1 15 14235 1 1 43 GLU HA H 4.907 5.791 4.743 1.00 . A A . 43 GLU HA 1 1 15 14236 1 1 43 GLU HB2 H 3.393 6.048 7.325 1.00 . A A . 43 GLU HB2 1 1 15 14237 1 1 43 GLU HB3 H 4.883 6.942 7.057 1.00 . A A . 43 GLU HB3 1 1 15 14238 1 1 43 GLU HG2 H 3.338 7.371 4.771 1.00 . A A . 43 GLU HG2 1 1 15 14239 1 1 43 GLU HG3 H 2.221 7.495 6.129 1.00 . A A . 43 GLU HG3 1 1 15 14240 1 1 43 GLU N N 3.458 4.444 5.326 1.00 . A A . 43 GLU N 1 1 15 14241 1 1 43 GLU O O 6.844 5.088 6.312 1.00 . A A . 43 GLU O 1 1 15 14242 1 1 43 GLU OE1 O 5.004 9.147 6.103 1.00 . A A . 43 GLU OE1 1 1 15 14243 1 1 43 GLU OE2 O 2.938 9.846 6.372 1.00 . A A . 43 GLU OE2 1 1 15 14244 1 1 44 ILE C C 7.147 1.758 6.676 1.00 . A A . 44 ILE C 1 1 15 14245 1 1 44 ILE CA C 6.430 2.699 7.639 1.00 . A A . 44 ILE CA 1 1 15 14246 1 1 44 ILE CB C 5.828 1.875 8.790 1.00 . A A . 44 ILE CB 1 1 15 14247 1 1 44 ILE CD1 C 4.878 2.331 11.122 1.00 . A A . 44 ILE CD1 1 1 15 14248 1 1 44 ILE CG1 C 4.957 2.775 9.677 1.00 . A A . 44 ILE CG1 1 1 15 14249 1 1 44 ILE CG2 C 6.938 1.210 9.595 1.00 . A A . 44 ILE CG2 1 1 15 14250 1 1 44 ILE H H 4.482 3.160 6.949 1.00 . A A . 44 ILE H 1 1 15 14251 1 1 44 ILE HA H 7.148 3.386 8.060 1.00 . A A . 44 ILE HA 1 1 15 14252 1 1 44 ILE HB H 5.211 1.098 8.363 1.00 . A A . 44 ILE HB 1 1 15 14253 1 1 44 ILE HD11 H 5.867 2.337 11.552 1.00 . A A . 44 ILE HD11 1 1 15 14254 1 1 44 ILE HD12 H 4.471 1.332 11.169 1.00 . A A . 44 ILE HD12 1 1 15 14255 1 1 44 ILE HD13 H 4.241 3.007 11.673 1.00 . A A . 44 ILE HD13 1 1 15 14256 1 1 44 ILE HG12 H 5.361 3.776 9.664 1.00 . A A . 44 ILE HG12 1 1 15 14257 1 1 44 ILE HG13 H 3.953 2.794 9.279 1.00 . A A . 44 ILE HG13 1 1 15 14258 1 1 44 ILE HG21 H 6.518 0.423 10.207 1.00 . A A . 44 ILE HG21 1 1 15 14259 1 1 44 ILE HG22 H 7.413 1.943 10.228 1.00 . A A . 44 ILE HG22 1 1 15 14260 1 1 44 ILE HG23 H 7.668 0.788 8.920 1.00 . A A . 44 ILE HG23 1 1 15 14261 1 1 44 ILE N N 5.408 3.482 6.954 1.00 . A A . 44 ILE N 1 1 15 14262 1 1 44 ILE O O 8.378 1.722 6.630 1.00 . A A . 44 ILE O 1 1 15 14263 1 1 45 VAL C C 7.548 0.758 3.762 1.00 . A A . 45 VAL C 1 1 15 14264 1 1 45 VAL CA C 6.931 0.045 4.961 1.00 . A A . 45 VAL CA 1 1 15 14265 1 1 45 VAL CB C 5.855 -0.954 4.479 1.00 . A A . 45 VAL CB 1 1 15 14266 1 1 45 VAL CG1 C 5.110 -0.438 3.254 1.00 . A A . 45 VAL CG1 1 1 15 14267 1 1 45 VAL CG2 C 6.477 -2.313 4.200 1.00 . A A . 45 VAL CG2 1 1 15 14268 1 1 45 VAL H H 5.402 1.061 6.002 1.00 . A A . 45 VAL H 1 1 15 14269 1 1 45 VAL HA H 7.703 -0.512 5.468 1.00 . A A . 45 VAL HA 1 1 15 14270 1 1 45 VAL HB H 5.135 -1.072 5.273 1.00 . A A . 45 VAL HB 1 1 15 14271 1 1 45 VAL HG11 H 5.793 -0.366 2.420 1.00 . A A . 45 VAL HG11 1 1 15 14272 1 1 45 VAL HG12 H 4.697 0.537 3.467 1.00 . A A . 45 VAL HG12 1 1 15 14273 1 1 45 VAL HG13 H 4.310 -1.118 3.005 1.00 . A A . 45 VAL HG13 1 1 15 14274 1 1 45 VAL HG21 H 5.776 -3.092 4.462 1.00 . A A . 45 VAL HG21 1 1 15 14275 1 1 45 VAL HG22 H 7.375 -2.426 4.790 1.00 . A A . 45 VAL HG22 1 1 15 14276 1 1 45 VAL HG23 H 6.724 -2.388 3.152 1.00 . A A . 45 VAL HG23 1 1 15 14277 1 1 45 VAL N N 6.372 0.993 5.916 1.00 . A A . 45 VAL N 1 1 15 14278 1 1 45 VAL O O 8.628 0.396 3.295 1.00 . A A . 45 VAL O 1 1 15 14279 1 1 46 THR C C 8.356 3.576 2.511 1.00 . A A . 46 THR C 1 1 15 14280 1 1 46 THR CA C 7.304 2.536 2.119 1.00 . A A . 46 THR CA 1 1 15 14281 1 1 46 THR CB C 6.113 3.227 1.459 1.00 . A A . 46 THR CB 1 1 15 14282 1 1 46 THR CG2 C 4.933 2.306 1.237 1.00 . A A . 46 THR CG2 1 1 15 14283 1 1 46 THR H H 5.989 1.999 3.678 1.00 . A A . 46 THR H 1 1 15 14284 1 1 46 THR HA H 7.740 1.846 1.413 1.00 . A A . 46 THR HA 1 1 15 14285 1 1 46 THR HB H 6.421 3.603 0.502 1.00 . A A . 46 THR HB 1 1 15 14286 1 1 46 THR HG1 H 5.622 4.054 3.165 1.00 . A A . 46 THR HG1 1 1 15 14287 1 1 46 THR HG21 H 4.289 2.332 2.104 1.00 . A A . 46 THR HG21 1 1 15 14288 1 1 46 THR HG22 H 5.286 1.298 1.081 1.00 . A A . 46 THR HG22 1 1 15 14289 1 1 46 THR HG23 H 4.379 2.634 0.370 1.00 . A A . 46 THR HG23 1 1 15 14290 1 1 46 THR N N 6.845 1.769 3.267 1.00 . A A . 46 THR N 1 1 15 14291 1 1 46 THR O O 8.802 4.358 1.672 1.00 . A A . 46 THR O 1 1 15 14292 1 1 46 THR OG1 O 5.668 4.319 2.244 1.00 . A A . 46 THR OG1 1 1 15 14293 1 1 47 ALA C C 9.259 5.965 4.130 1.00 . A A . 47 ALA C 1 1 15 14294 1 1 47 ALA CA C 9.753 4.529 4.261 1.00 . A A . 47 ALA CA 1 1 15 14295 1 1 47 ALA CB C 11.058 4.347 3.502 1.00 . A A . 47 ALA CB 1 1 15 14296 1 1 47 ALA H H 8.368 2.937 4.409 1.00 . A A . 47 ALA H 1 1 15 14297 1 1 47 ALA HA H 9.940 4.316 5.304 1.00 . A A . 47 ALA HA 1 1 15 14298 1 1 47 ALA HB1 H 11.671 3.614 4.007 1.00 . A A . 47 ALA HB1 1 1 15 14299 1 1 47 ALA HB2 H 11.585 5.289 3.460 1.00 . A A . 47 ALA HB2 1 1 15 14300 1 1 47 ALA HB3 H 10.848 4.008 2.498 1.00 . A A . 47 ALA HB3 1 1 15 14301 1 1 47 ALA N N 8.754 3.581 3.782 1.00 . A A . 47 ALA N 1 1 15 14302 1 1 47 ALA O O 10.049 6.888 3.941 1.00 . A A . 47 ALA O 1 1 15 14303 1 1 48 GLY C C 7.213 7.919 2.685 1.00 . A A . 48 GLY C 1 1 15 14304 1 1 48 GLY CA C 7.369 7.470 4.124 1.00 . A A . 48 GLY CA 1 1 15 14305 1 1 48 GLY H H 7.364 5.370 4.384 1.00 . A A . 48 GLY H 1 1 15 14306 1 1 48 GLY HA2 H 6.399 7.469 4.597 1.00 . A A . 48 GLY HA2 1 1 15 14307 1 1 48 GLY HA3 H 8.008 8.172 4.640 1.00 . A A . 48 GLY HA3 1 1 15 14308 1 1 48 GLY N N 7.947 6.144 4.233 1.00 . A A . 48 GLY N 1 1 15 14309 1 1 48 GLY O O 7.219 9.116 2.397 1.00 . A A . 48 GLY O 1 1 15 14310 1 1 49 ALA C C 5.673 8.126 0.128 1.00 . A A . 49 ALA C 1 1 15 14311 1 1 49 ALA CA C 6.908 7.263 0.362 1.00 . A A . 49 ALA CA 1 1 15 14312 1 1 49 ALA CB C 6.820 5.978 -0.449 1.00 . A A . 49 ALA CB 1 1 15 14313 1 1 49 ALA H H 7.070 6.021 2.068 1.00 . A A . 49 ALA H 1 1 15 14314 1 1 49 ALA HA H 7.782 7.808 0.037 1.00 . A A . 49 ALA HA 1 1 15 14315 1 1 49 ALA HB1 H 6.761 6.219 -1.499 1.00 . A A . 49 ALA HB1 1 1 15 14316 1 1 49 ALA HB2 H 5.939 5.428 -0.155 1.00 . A A . 49 ALA HB2 1 1 15 14317 1 1 49 ALA HB3 H 7.698 5.377 -0.266 1.00 . A A . 49 ALA HB3 1 1 15 14318 1 1 49 ALA N N 7.068 6.957 1.778 1.00 . A A . 49 ALA N 1 1 15 14319 1 1 49 ALA O O 5.744 9.165 -0.527 1.00 . A A . 49 ALA O 1 1 15 14320 1 1 50 LEU C C 3.003 9.256 1.764 1.00 . A A . 50 LEU C 1 1 15 14321 1 1 50 LEU CA C 3.289 8.419 0.521 1.00 . A A . 50 LEU CA 1 1 15 14322 1 1 50 LEU CB C 2.134 7.448 0.267 1.00 . A A . 50 LEU CB 1 1 15 14323 1 1 50 LEU CD1 C 2.620 5.677 -1.445 1.00 . A A . 50 LEU CD1 1 1 15 14324 1 1 50 LEU CD2 C 0.477 6.963 -1.554 1.00 . A A . 50 LEU CD2 1 1 15 14325 1 1 50 LEU CG C 1.954 7.023 -1.192 1.00 . A A . 50 LEU CG 1 1 15 14326 1 1 50 LEU H H 4.549 6.851 1.181 1.00 . A A . 50 LEU H 1 1 15 14327 1 1 50 LEU HA H 3.389 9.078 -0.327 1.00 . A A . 50 LEU HA 1 1 15 14328 1 1 50 LEU HB2 H 2.298 6.562 0.863 1.00 . A A . 50 LEU HB2 1 1 15 14329 1 1 50 LEU HB3 H 1.219 7.919 0.597 1.00 . A A . 50 LEU HB3 1 1 15 14330 1 1 50 LEU HD11 H 1.867 4.905 -1.491 1.00 . A A . 50 LEU HD11 1 1 15 14331 1 1 50 LEU HD12 H 3.310 5.461 -0.641 1.00 . A A . 50 LEU HD12 1 1 15 14332 1 1 50 LEU HD13 H 3.158 5.712 -2.381 1.00 . A A . 50 LEU HD13 1 1 15 14333 1 1 50 LEU HD21 H 0.357 6.442 -2.492 1.00 . A A . 50 LEU HD21 1 1 15 14334 1 1 50 LEU HD22 H 0.090 7.967 -1.648 1.00 . A A . 50 LEU HD22 1 1 15 14335 1 1 50 LEU HD23 H -0.063 6.441 -0.779 1.00 . A A . 50 LEU HD23 1 1 15 14336 1 1 50 LEU HG H 2.428 7.753 -1.833 1.00 . A A . 50 LEU HG 1 1 15 14337 1 1 50 LEU N N 4.541 7.687 0.668 1.00 . A A . 50 LEU N 1 1 15 14338 1 1 50 LEU O O 3.800 9.280 2.702 1.00 . A A . 50 LEU O 1 1 15 14339 1 1 51 LYS C C 0.161 10.301 3.500 1.00 . A A . 51 LYS C 1 1 15 14340 1 1 51 LYS CA C 1.478 10.778 2.894 1.00 . A A . 51 LYS CA 1 1 15 14341 1 1 51 LYS CB C 1.352 12.238 2.454 1.00 . A A . 51 LYS CB 1 1 15 14342 1 1 51 LYS CD C 1.259 12.946 0.041 1.00 . A A . 51 LYS CD 1 1 15 14343 1 1 51 LYS CE C 1.329 14.464 0.034 1.00 . A A . 51 LYS CE 1 1 15 14344 1 1 51 LYS CG C 0.466 12.431 1.232 1.00 . A A . 51 LYS CG 1 1 15 14345 1 1 51 LYS H H 1.271 9.881 0.986 1.00 . A A . 51 LYS H 1 1 15 14346 1 1 51 LYS HA H 2.252 10.703 3.642 1.00 . A A . 51 LYS HA 1 1 15 14347 1 1 51 LYS HB2 H 0.934 12.811 3.268 1.00 . A A . 51 LYS HB2 1 1 15 14348 1 1 51 LYS HB3 H 2.336 12.617 2.224 1.00 . A A . 51 LYS HB3 1 1 15 14349 1 1 51 LYS HD2 H 2.263 12.550 0.090 1.00 . A A . 51 LYS HD2 1 1 15 14350 1 1 51 LYS HD3 H 0.783 12.610 -0.869 1.00 . A A . 51 LYS HD3 1 1 15 14351 1 1 51 LYS HE2 H 1.617 14.803 1.017 1.00 . A A . 51 LYS HE2 1 1 15 14352 1 1 51 LYS HE3 H 2.073 14.774 -0.686 1.00 . A A . 51 LYS HE3 1 1 15 14353 1 1 51 LYS HG2 H 0.020 11.482 0.971 1.00 . A A . 51 LYS HG2 1 1 15 14354 1 1 51 LYS HG3 H -0.310 13.141 1.471 1.00 . A A . 51 LYS HG3 1 1 15 14355 1 1 51 LYS HZ1 H 0.036 16.097 -0.119 1.00 . A A . 51 LYS HZ1 1 1 15 14356 1 1 51 LYS HZ2 H -0.745 14.636 0.221 1.00 . A A . 51 LYS HZ2 1 1 15 14357 1 1 51 LYS HZ3 H -0.171 14.944 -1.339 1.00 . A A . 51 LYS HZ3 1 1 15 14358 1 1 51 LYS N N 1.864 9.940 1.764 1.00 . A A . 51 LYS N 1 1 15 14359 1 1 51 LYS NZ N 0.021 15.079 -0.326 1.00 . A A . 51 LYS NZ 1 1 15 14360 1 1 51 LYS O O -0.911 10.539 2.944 1.00 . A A . 51 LYS O 1 1 15 14361 1 1 52 TYR C C -1.734 10.263 5.945 1.00 . A A . 52 TYR C 1 1 15 14362 1 1 52 TYR CA C -0.933 9.123 5.326 1.00 . A A . 52 TYR CA 1 1 15 14363 1 1 52 TYR CB C -0.530 8.114 6.409 1.00 . A A . 52 TYR CB 1 1 15 14364 1 1 52 TYR CD1 C -2.963 7.538 6.816 1.00 . A A . 52 TYR CD1 1 1 15 14365 1 1 52 TYR CD2 C -1.450 7.423 8.656 1.00 . A A . 52 TYR CD2 1 1 15 14366 1 1 52 TYR CE1 C -3.999 7.145 7.640 1.00 . A A . 52 TYR CE1 1 1 15 14367 1 1 52 TYR CE2 C -2.481 7.028 9.484 1.00 . A A . 52 TYR CE2 1 1 15 14368 1 1 52 TYR CG C -1.669 7.685 7.310 1.00 . A A . 52 TYR CG 1 1 15 14369 1 1 52 TYR CZ C -3.753 6.890 8.972 1.00 . A A . 52 TYR CZ 1 1 15 14370 1 1 52 TYR H H 1.135 9.474 5.038 1.00 . A A . 52 TYR H 1 1 15 14371 1 1 52 TYR HA H -1.548 8.622 4.594 1.00 . A A . 52 TYR HA 1 1 15 14372 1 1 52 TYR HB2 H -0.133 7.229 5.935 1.00 . A A . 52 TYR HB2 1 1 15 14373 1 1 52 TYR HB3 H 0.236 8.555 7.031 1.00 . A A . 52 TYR HB3 1 1 15 14374 1 1 52 TYR HD1 H -3.155 7.739 5.773 1.00 . A A . 52 TYR HD1 1 1 15 14375 1 1 52 TYR HD2 H -0.452 7.533 9.054 1.00 . A A . 52 TYR HD2 1 1 15 14376 1 1 52 TYR HE1 H -4.993 7.035 7.238 1.00 . A A . 52 TYR HE1 1 1 15 14377 1 1 52 TYR HE2 H -2.289 6.829 10.528 1.00 . A A . 52 TYR HE2 1 1 15 14378 1 1 52 TYR HH H -5.452 7.186 9.822 1.00 . A A . 52 TYR HH 1 1 15 14379 1 1 52 TYR N N 0.251 9.630 4.643 1.00 . A A . 52 TYR N 1 1 15 14380 1 1 52 TYR O O -1.258 10.952 6.849 1.00 . A A . 52 TYR O 1 1 15 14381 1 1 52 TYR OH O -4.784 6.498 9.795 1.00 . A A . 52 TYR OH 1 1 15 14382 1 1 53 GLN C C -5.149 10.932 6.435 1.00 . A A . 53 GLN C 1 1 15 14383 1 1 53 GLN CA C -3.823 11.510 5.961 1.00 . A A . 53 GLN CA 1 1 15 14384 1 1 53 GLN CB C -4.066 12.564 4.880 1.00 . A A . 53 GLN CB 1 1 15 14385 1 1 53 GLN CD C -3.294 14.710 3.792 1.00 . A A . 53 GLN CD 1 1 15 14386 1 1 53 GLN CG C -3.060 13.704 4.901 1.00 . A A . 53 GLN CG 1 1 15 14387 1 1 53 GLN H H -3.277 9.873 4.737 1.00 . A A . 53 GLN H 1 1 15 14388 1 1 53 GLN HA H -3.327 11.974 6.799 1.00 . A A . 53 GLN HA 1 1 15 14389 1 1 53 GLN HB2 H -4.018 12.088 3.911 1.00 . A A . 53 GLN HB2 1 1 15 14390 1 1 53 GLN HB3 H -5.054 12.982 5.016 1.00 . A A . 53 GLN HB3 1 1 15 14391 1 1 53 GLN HE21 H -1.527 14.274 2.990 1.00 . A A . 53 GLN HE21 1 1 15 14392 1 1 53 GLN HE22 H -2.451 15.476 2.162 1.00 . A A . 53 GLN HE22 1 1 15 14393 1 1 53 GLN HG2 H -3.134 14.214 5.850 1.00 . A A . 53 GLN HG2 1 1 15 14394 1 1 53 GLN HG3 H -2.068 13.291 4.791 1.00 . A A . 53 GLN HG3 1 1 15 14395 1 1 53 GLN N N -2.952 10.455 5.454 1.00 . A A . 53 GLN N 1 1 15 14396 1 1 53 GLN NE2 N -2.326 14.832 2.891 1.00 . A A . 53 GLN NE2 1 1 15 14397 1 1 53 GLN O O -5.769 10.126 5.742 1.00 . A A . 53 GLN O 1 1 15 14398 1 1 53 GLN OE1 O -4.332 15.369 3.744 1.00 . A A . 53 GLN OE1 1 1 15 14399 1 1 54 GLU C C -8.010 11.758 7.783 1.00 . A A . 54 GLU C 1 1 15 14400 1 1 54 GLU CA C -6.836 10.868 8.191 1.00 . A A . 54 GLU CA 1 1 15 14401 1 1 54 GLU CB C -6.737 10.810 9.717 1.00 . A A . 54 GLU CB 1 1 15 14402 1 1 54 GLU CD C -6.505 12.195 11.816 1.00 . A A . 54 GLU CD 1 1 15 14403 1 1 54 GLU CG C -6.183 12.081 10.340 1.00 . A A . 54 GLU CG 1 1 15 14404 1 1 54 GLU H H -5.041 11.992 8.127 1.00 . A A . 54 GLU H 1 1 15 14405 1 1 54 GLU HA H -7.008 9.873 7.815 1.00 . A A . 54 GLU HA 1 1 15 14406 1 1 54 GLU HB2 H -7.721 10.634 10.123 1.00 . A A . 54 GLU HB2 1 1 15 14407 1 1 54 GLU HB3 H -6.090 9.989 9.992 1.00 . A A . 54 GLU HB3 1 1 15 14408 1 1 54 GLU HG2 H -5.110 12.088 10.221 1.00 . A A . 54 GLU HG2 1 1 15 14409 1 1 54 GLU HG3 H -6.606 12.932 9.827 1.00 . A A . 54 GLU HG3 1 1 15 14410 1 1 54 GLU N N -5.581 11.348 7.621 1.00 . A A . 54 GLU N 1 1 15 14411 1 1 54 GLU O O -9.016 11.827 8.487 1.00 . A A . 54 GLU O 1 1 15 14412 1 1 54 GLU OE1 O -6.313 11.198 12.544 1.00 . A A . 54 GLU OE1 1 1 15 14413 1 1 54 GLU OE2 O -6.951 13.280 12.245 1.00 . A A . 54 GLU OE2 1 1 15 14414 1 1 55 ASN C C -10.110 12.486 5.634 1.00 . A A . 55 ASN C 1 1 15 14415 1 1 55 ASN CA C -8.938 13.305 6.151 1.00 . A A . 55 ASN CA 1 1 15 14416 1 1 55 ASN CB C -8.406 14.214 5.042 1.00 . A A . 55 ASN CB 1 1 15 14417 1 1 55 ASN CG C -7.632 15.397 5.588 1.00 . A A . 55 ASN CG 1 1 15 14418 1 1 55 ASN H H -7.060 12.335 6.118 1.00 . A A . 55 ASN H 1 1 15 14419 1 1 55 ASN HA H -9.273 13.913 6.976 1.00 . A A . 55 ASN HA 1 1 15 14420 1 1 55 ASN HB2 H -7.752 13.644 4.400 1.00 . A A . 55 ASN HB2 1 1 15 14421 1 1 55 ASN HB3 H -9.237 14.587 4.462 1.00 . A A . 55 ASN HB3 1 1 15 14422 1 1 55 ASN HD21 H -9.093 16.634 5.053 1.00 . A A . 55 ASN HD21 1 1 15 14423 1 1 55 ASN HD22 H -7.732 17.370 5.821 1.00 . A A . 55 ASN HD22 1 1 15 14424 1 1 55 ASN N N -7.880 12.429 6.641 1.00 . A A . 55 ASN N 1 1 15 14425 1 1 55 ASN ND2 N -8.211 16.587 5.476 1.00 . A A . 55 ASN ND2 1 1 15 14426 1 1 55 ASN O O -11.150 12.388 6.291 1.00 . A A . 55 ASN O 1 1 15 14427 1 1 55 ASN OD1 O -6.525 15.244 6.106 1.00 . A A . 55 ASN OD1 1 1 15 14428 1 1 56 ALA C C -11.310 9.865 4.739 1.00 . A A . 56 ALA C 1 1 15 14429 1 1 56 ALA CA C -10.990 11.072 3.860 1.00 . A A . 56 ALA CA 1 1 15 14430 1 1 56 ALA CB C -10.570 10.618 2.470 1.00 . A A . 56 ALA CB 1 1 15 14431 1 1 56 ALA H H -9.095 12.001 3.985 1.00 . A A . 56 ALA H 1 1 15 14432 1 1 56 ALA HA H -11.880 11.681 3.764 1.00 . A A . 56 ALA HA 1 1 15 14433 1 1 56 ALA HB1 H -10.980 9.637 2.274 1.00 . A A . 56 ALA HB1 1 1 15 14434 1 1 56 ALA HB2 H -9.498 10.580 2.410 1.00 . A A . 56 ALA HB2 1 1 15 14435 1 1 56 ALA HB3 H -10.950 11.316 1.735 1.00 . A A . 56 ALA HB3 1 1 15 14436 1 1 56 ALA N N -9.946 11.892 4.459 1.00 . A A . 56 ALA N 1 1 15 14437 1 1 56 ALA O O -12.360 9.246 4.601 1.00 . A A . 56 ALA O 1 1 15 14438 1 1 57 TYR C C -11.490 8.771 7.717 1.00 . A A . 57 TYR C 1 1 15 14439 1 1 57 TYR CA C -10.570 8.406 6.547 1.00 . A A . 57 TYR CA 1 1 15 14440 1 1 57 TYR CB C -9.222 7.927 7.070 1.00 . A A . 57 TYR CB 1 1 15 14441 1 1 57 TYR CD1 C -8.849 6.499 5.024 1.00 . A A . 57 TYR CD1 1 1 15 14442 1 1 57 TYR CD2 C -6.976 7.649 5.947 1.00 . A A . 57 TYR CD2 1 1 15 14443 1 1 57 TYR CE1 C -8.042 5.966 4.038 1.00 . A A . 57 TYR CE1 1 1 15 14444 1 1 57 TYR CE2 C -6.163 7.119 4.963 1.00 . A A . 57 TYR CE2 1 1 15 14445 1 1 57 TYR CG C -8.332 7.347 5.995 1.00 . A A . 57 TYR CG 1 1 15 14446 1 1 57 TYR CZ C -6.701 6.279 4.011 1.00 . A A . 57 TYR CZ 1 1 15 14447 1 1 57 TYR H H -9.573 10.066 5.710 1.00 . A A . 57 TYR H 1 1 15 14448 1 1 57 TYR HA H -11.030 7.607 5.984 1.00 . A A . 57 TYR HA 1 1 15 14449 1 1 57 TYR HB2 H -8.703 8.759 7.518 1.00 . A A . 57 TYR HB2 1 1 15 14450 1 1 57 TYR HB3 H -9.382 7.162 7.818 1.00 . A A . 57 TYR HB3 1 1 15 14451 1 1 57 TYR HD1 H -9.902 6.256 5.047 1.00 . A A . 57 TYR HD1 1 1 15 14452 1 1 57 TYR HD2 H -6.555 8.305 6.693 1.00 . A A . 57 TYR HD2 1 1 15 14453 1 1 57 TYR HE1 H -8.464 5.309 3.292 1.00 . A A . 57 TYR HE1 1 1 15 14454 1 1 57 TYR HE2 H -5.111 7.364 4.942 1.00 . A A . 57 TYR HE2 1 1 15 14455 1 1 57 TYR HH H -4.989 6.034 3.164 1.00 . A A . 57 TYR HH 1 1 15 14456 1 1 57 TYR N N -10.390 9.537 5.646 1.00 . A A . 57 TYR N 1 1 15 14457 1 1 57 TYR O O -11.970 7.893 8.430 1.00 . A A . 57 TYR O 1 1 15 14458 1 1 57 TYR OH O -5.895 5.747 3.028 1.00 . A A . 57 TYR OH 1 1 15 14459 1 1 58 ARG C C -14.040 10.402 8.613 1.00 . A A . 58 ARG C 1 1 15 14460 1 1 58 ARG CA C -12.570 10.536 8.992 1.00 . A A . 58 ARG CA 1 1 15 14461 1 1 58 ARG CB C -12.250 11.993 9.334 1.00 . A A . 58 ARG CB 1 1 15 14462 1 1 58 ARG CD C -11.050 13.609 10.836 1.00 . A A . 58 ARG CD 1 1 15 14463 1 1 58 ARG CG C -11.340 12.147 10.541 1.00 . A A . 58 ARG CG 1 1 15 14464 1 1 58 ARG CZ C -12.190 15.496 11.941 1.00 . A A . 58 ARG CZ 1 1 15 14465 1 1 58 ARG H H -11.300 10.723 7.311 1.00 . A A . 58 ARG H 1 1 15 14466 1 1 58 ARG HA H -12.380 9.920 9.859 1.00 . A A . 58 ARG HA 1 1 15 14467 1 1 58 ARG HB2 H -11.770 12.450 8.483 1.00 . A A . 58 ARG HB2 1 1 15 14468 1 1 58 ARG HB3 H -13.170 12.519 9.535 1.00 . A A . 58 ARG HB3 1 1 15 14469 1 1 58 ARG HD2 H -10.070 13.687 11.280 1.00 . A A . 58 ARG HD2 1 1 15 14470 1 1 58 ARG HD3 H -11.070 14.162 9.909 1.00 . A A . 58 ARG HD3 1 1 15 14471 1 1 58 ARG HE H -12.600 13.569 12.259 1.00 . A A . 58 ARG HE 1 1 15 14472 1 1 58 ARG HG2 H -11.820 11.706 11.400 1.00 . A A . 58 ARG HG2 1 1 15 14473 1 1 58 ARG HG3 H -10.410 11.636 10.344 1.00 . A A . 58 ARG HG3 1 1 15 14474 1 1 58 ARG HH11 H -10.750 16.038 10.630 1.00 . A A . 58 ARG HH11 1 1 15 14475 1 1 58 ARG HH12 H -11.560 17.346 11.419 1.00 . A A . 58 ARG HH12 1 1 15 14476 1 1 58 ARG HH21 H -13.670 15.288 13.297 1.00 . A A . 58 ARG HH21 1 1 15 14477 1 1 58 ARG HH22 H -13.220 16.920 12.933 1.00 . A A . 58 ARG HH22 1 1 15 14478 1 1 58 ARG N N -11.720 10.068 7.910 1.00 . A A . 58 ARG N 1 1 15 14479 1 1 58 ARG NE N -12.030 14.187 11.754 1.00 . A A . 58 ARG NE 1 1 15 14480 1 1 58 ARG NH1 N -11.440 16.364 11.275 1.00 . A A . 58 ARG NH1 1 1 15 14481 1 1 58 ARG NH2 N -13.100 15.937 12.793 1.00 . A A . 58 ARG NH2 1 1 15 14482 1 1 58 ARG O O -14.380 9.855 7.561 1.00 . A A . 58 ARG O 1 1 15 14483 1 1 59 GLN C C -16.880 12.166 8.683 1.00 . A A . 59 GLN C 1 1 15 14484 1 1 59 GLN CA C -16.360 10.840 9.229 1.00 . A A . 59 GLN CA 1 1 15 14485 1 1 59 GLN CB C -17.100 10.477 10.516 1.00 . A A . 59 GLN CB 1 1 15 14486 1 1 59 GLN CD C -18.340 8.436 11.340 1.00 . A A . 59 GLN CD 1 1 15 14487 1 1 59 GLN CG C -17.010 9.002 10.872 1.00 . A A . 59 GLN CG 1 1 15 14488 1 1 59 GLN H H -14.600 11.329 10.297 1.00 . A A . 59 GLN H 1 1 15 14489 1 1 59 GLN HA H -16.530 10.069 8.495 1.00 . A A . 59 GLN HA 1 1 15 14490 1 1 59 GLN HB2 H -16.680 11.048 11.332 1.00 . A A . 59 GLN HB2 1 1 15 14491 1 1 59 GLN HB3 H -18.140 10.737 10.402 1.00 . A A . 59 GLN HB3 1 1 15 14492 1 1 59 GLN HE21 H -18.370 9.700 12.873 1.00 . A A . 59 GLN HE21 1 1 15 14493 1 1 59 GLN HE22 H -19.720 8.630 12.760 1.00 . A A . 59 GLN HE22 1 1 15 14494 1 1 59 GLN HG2 H -16.690 8.452 10.000 1.00 . A A . 59 GLN HG2 1 1 15 14495 1 1 59 GLN HG3 H -16.290 8.878 11.662 1.00 . A A . 59 GLN HG3 1 1 15 14496 1 1 59 GLN N N -14.920 10.905 9.475 1.00 . A A . 59 GLN N 1 1 15 14497 1 1 59 GLN NE2 N -18.860 8.976 12.435 1.00 . A A . 59 GLN NE2 1 1 15 14498 1 1 59 GLN O O -16.190 13.185 8.739 1.00 . A A . 59 GLN O 1 1 15 14499 1 1 59 GLN OE1 O -18.890 7.524 10.724 1.00 . A A . 59 GLN OE1 1 1 15 14500 1 1 60 ALA C C -17.950 13.833 6.372 1.00 . A A . 60 ALA C 1 1 15 14501 1 1 60 ALA CA C -18.720 13.342 7.597 1.00 . A A . 60 ALA CA 1 1 15 14502 1 1 60 ALA CB C -18.800 14.437 8.652 1.00 . A A . 60 ALA CB 1 1 15 14503 1 1 60 ALA H H -18.600 11.299 8.140 1.00 . A A . 60 ALA H 1 1 15 14504 1 1 60 ALA HA H -19.720 13.088 7.301 1.00 . A A . 60 ALA HA 1 1 15 14505 1 1 60 ALA HB1 H -18.280 15.317 8.299 1.00 . A A . 60 ALA HB1 1 1 15 14506 1 1 60 ALA HB2 H -18.340 14.090 9.566 1.00 . A A . 60 ALA HB2 1 1 15 14507 1 1 60 ALA HB3 H -19.830 14.680 8.841 1.00 . A A . 60 ALA HB3 1 1 15 14508 1 1 60 ALA N N -18.100 12.142 8.155 1.00 . A A . 60 ALA N 1 1 15 14509 1 1 60 ALA O O -18.370 13.604 5.236 1.00 . A A . 60 ALA O 1 1 15 14510 1 1 61 ALA C C -15.090 13.951 4.961 1.00 . A A . 61 ALA C 1 1 15 14511 1 1 61 ALA CA C -16.010 15.030 5.522 1.00 . A A . 61 ALA CA 1 1 15 14512 1 1 61 ALA CB C -15.200 16.223 6.004 1.00 . A A . 61 ALA CB 1 1 15 14513 1 1 61 ALA H H -16.550 14.658 7.535 1.00 . A A . 61 ALA H 1 1 15 14514 1 1 61 ALA HA H -16.670 15.370 4.739 1.00 . A A . 61 ALA HA 1 1 15 14515 1 1 61 ALA HB1 H -15.020 16.129 7.064 1.00 . A A . 61 ALA HB1 1 1 15 14516 1 1 61 ALA HB2 H -15.750 17.134 5.814 1.00 . A A . 61 ALA HB2 1 1 15 14517 1 1 61 ALA HB3 H -14.260 16.253 5.477 1.00 . A A . 61 ALA HB3 1 1 15 14518 1 1 61 ALA N N -16.830 14.508 6.608 1.00 . A A . 61 ALA N 1 1 15 14519 1 1 61 ALA O O -14.210 14.293 4.150 1.00 . A A . 61 ALA O 1 1 15 14520 1 1 61 ALA OXT O -15.270 12.773 5.338 1.00 . A A . 61 ALA OXT 1 1 16 14521 1 1 1 MET C C -5.159 6.117 -0.719 1.00 . A A . 1 MET C 1 1 16 14522 1 1 1 MET CA C -4.373 7.086 0.158 1.00 . A A . 1 MET CA 1 1 16 14523 1 1 1 MET CB C -2.869 6.899 -0.061 1.00 . A A . 1 MET CB 1 1 16 14524 1 1 1 MET CE C -1.340 6.304 2.561 1.00 . A A . 1 MET CE 1 1 16 14525 1 1 1 MET CG C -2.394 5.467 0.136 1.00 . A A . 1 MET CG 1 1 16 14526 1 1 1 MET H1 H -5.699 6.740 1.692 1.00 . A A . 1 MET H1 1 1 16 14527 1 1 1 MET H2 H -4.359 7.724 2.114 1.00 . A A . 1 MET H2 1 1 16 14528 1 1 1 MET H3 H -4.155 6.033 1.913 1.00 . A A . 1 MET H3 1 1 16 14529 1 1 1 MET HA H -4.645 8.098 -0.105 1.00 . A A . 1 MET HA 1 1 16 14530 1 1 1 MET HB2 H -2.624 7.200 -1.068 1.00 . A A . 1 MET HB2 1 1 16 14531 1 1 1 MET HB3 H -2.336 7.533 0.633 1.00 . A A . 1 MET HB3 1 1 16 14532 1 1 1 MET HE1 H -2.342 6.686 2.439 1.00 . A A . 1 MET HE1 1 1 16 14533 1 1 1 MET HE2 H -0.653 7.127 2.689 1.00 . A A . 1 MET HE2 1 1 16 14534 1 1 1 MET HE3 H -1.302 5.665 3.432 1.00 . A A . 1 MET HE3 1 1 16 14535 1 1 1 MET HG2 H -3.167 4.912 0.643 1.00 . A A . 1 MET HG2 1 1 16 14536 1 1 1 MET HG3 H -2.214 5.027 -0.833 1.00 . A A . 1 MET HG3 1 1 16 14537 1 1 1 MET N N -4.673 6.876 1.599 1.00 . A A . 1 MET N 1 1 16 14538 1 1 1 MET O O -5.761 5.163 -0.225 1.00 . A A . 1 MET O 1 1 16 14539 1 1 1 MET SD S -0.878 5.363 1.109 1.00 . A A . 1 MET SD 1 1 16 14540 1 1 2 TYR C C -5.091 4.225 -3.224 1.00 . A A . 2 TYR C 1 1 16 14541 1 1 2 TYR CA C -5.859 5.518 -2.973 1.00 . A A . 2 TYR CA 1 1 16 14542 1 1 2 TYR CB C -6.077 6.260 -4.291 1.00 . A A . 2 TYR CB 1 1 16 14543 1 1 2 TYR CD1 C -7.733 7.929 -3.372 1.00 . A A . 2 TYR CD1 1 1 16 14544 1 1 2 TYR CD2 C -8.279 6.803 -5.401 1.00 . A A . 2 TYR CD2 1 1 16 14545 1 1 2 TYR CE1 C -8.930 8.617 -3.427 1.00 . A A . 2 TYR CE1 1 1 16 14546 1 1 2 TYR CE2 C -9.478 7.488 -5.463 1.00 . A A . 2 TYR CE2 1 1 16 14547 1 1 2 TYR CG C -7.387 7.011 -4.357 1.00 . A A . 2 TYR CG 1 1 16 14548 1 1 2 TYR CZ C -9.799 8.393 -4.475 1.00 . A A . 2 TYR CZ 1 1 16 14549 1 1 2 TYR H H -4.650 7.143 -2.358 1.00 . A A . 2 TYR H 1 1 16 14550 1 1 2 TYR HA H -6.820 5.275 -2.543 1.00 . A A . 2 TYR HA 1 1 16 14551 1 1 2 TYR HB2 H -5.280 6.975 -4.432 1.00 . A A . 2 TYR HB2 1 1 16 14552 1 1 2 TYR HB3 H -6.061 5.548 -5.105 1.00 . A A . 2 TYR HB3 1 1 16 14553 1 1 2 TYR HD1 H -7.051 8.103 -2.553 1.00 . A A . 2 TYR HD1 1 1 16 14554 1 1 2 TYR HD2 H -8.026 6.093 -6.173 1.00 . A A . 2 TYR HD2 1 1 16 14555 1 1 2 TYR HE1 H -9.180 9.328 -2.652 1.00 . A A . 2 TYR HE1 1 1 16 14556 1 1 2 TYR HE2 H -10.150 7.312 -6.282 1.00 . A A . 2 TYR HE2 1 1 16 14557 1 1 2 TYR HH H -10.850 9.986 -4.262 1.00 . A A . 2 TYR HH 1 1 16 14558 1 1 2 TYR N N -5.148 6.368 -2.024 1.00 . A A . 2 TYR N 1 1 16 14559 1 1 2 TYR O O -3.885 4.151 -2.988 1.00 . A A . 2 TYR O 1 1 16 14560 1 1 2 TYR OH O -10.990 9.077 -4.533 1.00 . A A . 2 TYR OH 1 1 16 14561 1 1 3 LYS C C -4.275 2.002 -5.211 1.00 . A A . 3 LYS C 1 1 16 14562 1 1 3 LYS CA C -5.183 1.916 -3.988 1.00 . A A . 3 LYS CA 1 1 16 14563 1 1 3 LYS CB C -6.264 0.855 -4.215 1.00 . A A . 3 LYS CB 1 1 16 14564 1 1 3 LYS CD C -6.556 -1.266 -5.531 1.00 . A A . 3 LYS CD 1 1 16 14565 1 1 3 LYS CE C -6.496 -2.771 -5.323 1.00 . A A . 3 LYS CE 1 1 16 14566 1 1 3 LYS CG C -5.707 -0.530 -4.508 1.00 . A A . 3 LYS CG 1 1 16 14567 1 1 3 LYS H H -6.756 3.327 -3.871 1.00 . A A . 3 LYS H 1 1 16 14568 1 1 3 LYS HA H -4.590 1.635 -3.133 1.00 . A A . 3 LYS HA 1 1 16 14569 1 1 3 LYS HB2 H -6.880 0.791 -3.330 1.00 . A A . 3 LYS HB2 1 1 16 14570 1 1 3 LYS HB3 H -6.878 1.156 -5.051 1.00 . A A . 3 LYS HB3 1 1 16 14571 1 1 3 LYS HD2 H -7.581 -0.941 -5.436 1.00 . A A . 3 LYS HD2 1 1 16 14572 1 1 3 LYS HD3 H -6.194 -1.034 -6.521 1.00 . A A . 3 LYS HD3 1 1 16 14573 1 1 3 LYS HE2 H -5.516 -3.032 -4.952 1.00 . A A . 3 LYS HE2 1 1 16 14574 1 1 3 LYS HE3 H -7.242 -3.052 -4.593 1.00 . A A . 3 LYS HE3 1 1 16 14575 1 1 3 LYS HG2 H -4.704 -0.429 -4.894 1.00 . A A . 3 LYS HG2 1 1 16 14576 1 1 3 LYS HG3 H -5.686 -1.100 -3.592 1.00 . A A . 3 LYS HG3 1 1 16 14577 1 1 3 LYS HZ1 H -5.851 -3.846 -6.996 1.00 . A A . 3 LYS HZ1 1 1 16 14578 1 1 3 LYS HZ2 H -7.227 -2.902 -7.277 1.00 . A A . 3 LYS HZ2 1 1 16 14579 1 1 3 LYS HZ3 H -7.355 -4.342 -6.401 1.00 . A A . 3 LYS HZ3 1 1 16 14580 1 1 3 LYS N N -5.798 3.207 -3.704 1.00 . A A . 3 LYS N 1 1 16 14581 1 1 3 LYS NZ N -6.750 -3.517 -6.588 1.00 . A A . 3 LYS NZ 1 1 16 14582 1 1 3 LYS O O -3.285 1.278 -5.313 1.00 . A A . 3 LYS O 1 1 16 14583 1 1 4 LYS C C -2.406 3.502 -7.025 1.00 . A A . 4 LYS C 1 1 16 14584 1 1 4 LYS CA C -3.833 3.071 -7.353 1.00 . A A . 4 LYS CA 1 1 16 14585 1 1 4 LYS CB C -4.495 4.108 -8.261 1.00 . A A . 4 LYS CB 1 1 16 14586 1 1 4 LYS CD C -4.478 5.273 -10.488 1.00 . A A . 4 LYS CD 1 1 16 14587 1 1 4 LYS CE C -5.726 4.941 -11.289 1.00 . A A . 4 LYS CE 1 1 16 14588 1 1 4 LYS CG C -3.989 4.072 -9.694 1.00 . A A . 4 LYS CG 1 1 16 14589 1 1 4 LYS H H -5.419 3.440 -6.000 1.00 . A A . 4 LYS H 1 1 16 14590 1 1 4 LYS HA H -3.800 2.124 -7.868 1.00 . A A . 4 LYS HA 1 1 16 14591 1 1 4 LYS HB2 H -5.560 3.933 -8.274 1.00 . A A . 4 LYS HB2 1 1 16 14592 1 1 4 LYS HB3 H -4.306 5.093 -7.862 1.00 . A A . 4 LYS HB3 1 1 16 14593 1 1 4 LYS HD2 H -4.705 6.076 -9.802 1.00 . A A . 4 LYS HD2 1 1 16 14594 1 1 4 LYS HD3 H -3.697 5.585 -11.166 1.00 . A A . 4 LYS HD3 1 1 16 14595 1 1 4 LYS HE2 H -5.427 4.515 -12.236 1.00 . A A . 4 LYS HE2 1 1 16 14596 1 1 4 LYS HE3 H -6.311 4.220 -10.738 1.00 . A A . 4 LYS HE3 1 1 16 14597 1 1 4 LYS HG2 H -2.909 4.075 -9.686 1.00 . A A . 4 LYS HG2 1 1 16 14598 1 1 4 LYS HG3 H -4.346 3.169 -10.169 1.00 . A A . 4 LYS HG3 1 1 16 14599 1 1 4 LYS HZ1 H -6.385 6.866 -10.813 1.00 . A A . 4 LYS HZ1 1 1 16 14600 1 1 4 LYS HZ2 H -7.568 5.896 -11.533 1.00 . A A . 4 LYS HZ2 1 1 16 14601 1 1 4 LYS HZ3 H -6.327 6.553 -12.475 1.00 . A A . 4 LYS HZ3 1 1 16 14602 1 1 4 LYS N N -4.617 2.892 -6.137 1.00 . A A . 4 LYS N 1 1 16 14603 1 1 4 LYS NZ N -6.558 6.148 -11.546 1.00 . A A . 4 LYS NZ 1 1 16 14604 1 1 4 LYS O O -1.446 2.993 -7.604 1.00 . A A . 4 LYS O 1 1 16 14605 1 1 5 ASP C C -0.112 3.831 -5.109 1.00 . A A . 5 ASP C 1 1 16 14606 1 1 5 ASP CA C -0.966 4.947 -5.698 1.00 . A A . 5 ASP CA 1 1 16 14607 1 1 5 ASP CB C -1.118 6.082 -4.683 1.00 . A A . 5 ASP CB 1 1 16 14608 1 1 5 ASP CG C -0.945 7.448 -5.313 1.00 . A A . 5 ASP CG 1 1 16 14609 1 1 5 ASP H H -3.078 4.815 -5.675 1.00 . A A . 5 ASP H 1 1 16 14610 1 1 5 ASP HA H -0.475 5.329 -6.580 1.00 . A A . 5 ASP HA 1 1 16 14611 1 1 5 ASP HB2 H -2.104 6.032 -4.242 1.00 . A A . 5 ASP HB2 1 1 16 14612 1 1 5 ASP HB3 H -0.376 5.966 -3.905 1.00 . A A . 5 ASP HB3 1 1 16 14613 1 1 5 ASP N N -2.276 4.447 -6.099 1.00 . A A . 5 ASP N 1 1 16 14614 1 1 5 ASP O O 1.026 3.618 -5.531 1.00 . A A . 5 ASP O 1 1 16 14615 1 1 5 ASP OD1 O -1.906 7.938 -5.943 1.00 . A A . 5 ASP OD1 1 1 16 14616 1 1 5 ASP OD2 O 0.152 8.029 -5.180 1.00 . A A . 5 ASP OD2 1 1 16 14617 1 1 6 VAL C C 0.551 1.016 -4.510 1.00 . A A . 6 VAL C 1 1 16 14618 1 1 6 VAL CA C 0.040 2.025 -3.487 1.00 . A A . 6 VAL CA 1 1 16 14619 1 1 6 VAL CB C -0.868 1.302 -2.479 1.00 . A A . 6 VAL CB 1 1 16 14620 1 1 6 VAL CG1 C -0.032 0.468 -1.536 1.00 . A A . 6 VAL CG1 1 1 16 14621 1 1 6 VAL CG2 C -1.722 2.292 -1.698 1.00 . A A . 6 VAL CG2 1 1 16 14622 1 1 6 VAL H H -1.569 3.329 -3.837 1.00 . A A . 6 VAL H 1 1 16 14623 1 1 6 VAL HA H 0.881 2.441 -2.951 1.00 . A A . 6 VAL HA 1 1 16 14624 1 1 6 VAL HB H -1.527 0.642 -3.024 1.00 . A A . 6 VAL HB 1 1 16 14625 1 1 6 VAL HG11 H 0.454 -0.318 -2.089 1.00 . A A . 6 VAL HG11 1 1 16 14626 1 1 6 VAL HG12 H -0.668 0.040 -0.777 1.00 . A A . 6 VAL HG12 1 1 16 14627 1 1 6 VAL HG13 H 0.710 1.098 -1.073 1.00 . A A . 6 VAL HG13 1 1 16 14628 1 1 6 VAL HG21 H -1.204 3.239 -1.632 1.00 . A A . 6 VAL HG21 1 1 16 14629 1 1 6 VAL HG22 H -1.898 1.911 -0.703 1.00 . A A . 6 VAL HG22 1 1 16 14630 1 1 6 VAL HG23 H -2.665 2.432 -2.203 1.00 . A A . 6 VAL HG23 1 1 16 14631 1 1 6 VAL N N -0.665 3.117 -4.134 1.00 . A A . 6 VAL N 1 1 16 14632 1 1 6 VAL O O 1.737 0.689 -4.536 1.00 . A A . 6 VAL O 1 1 16 14633 1 1 7 ILE C C 1.089 0.105 -7.300 1.00 . A A . 7 ILE C 1 1 16 14634 1 1 7 ILE CA C 0.003 -0.442 -6.378 1.00 . A A . 7 ILE CA 1 1 16 14635 1 1 7 ILE CB C -1.228 -0.843 -7.218 1.00 . A A . 7 ILE CB 1 1 16 14636 1 1 7 ILE CD1 C -3.453 -2.079 -7.110 1.00 . A A . 7 ILE CD1 1 1 16 14637 1 1 7 ILE CG1 C -2.235 -1.602 -6.351 1.00 . A A . 7 ILE CG1 1 1 16 14638 1 1 7 ILE CG2 C -0.812 -1.685 -8.416 1.00 . A A . 7 ILE CG2 1 1 16 14639 1 1 7 ILE H H -1.283 0.830 -5.281 1.00 . A A . 7 ILE H 1 1 16 14640 1 1 7 ILE HA H 0.378 -1.327 -5.882 1.00 . A A . 7 ILE HA 1 1 16 14641 1 1 7 ILE HB H -1.691 0.058 -7.588 1.00 . A A . 7 ILE HB 1 1 16 14642 1 1 7 ILE HD11 H -3.475 -1.615 -8.086 1.00 . A A . 7 ILE HD11 1 1 16 14643 1 1 7 ILE HD12 H -4.346 -1.812 -6.564 1.00 . A A . 7 ILE HD12 1 1 16 14644 1 1 7 ILE HD13 H -3.408 -3.153 -7.225 1.00 . A A . 7 ILE HD13 1 1 16 14645 1 1 7 ILE HG12 H -1.753 -2.466 -5.923 1.00 . A A . 7 ILE HG12 1 1 16 14646 1 1 7 ILE HG13 H -2.573 -0.953 -5.555 1.00 . A A . 7 ILE HG13 1 1 16 14647 1 1 7 ILE HG21 H -1.691 -2.019 -8.947 1.00 . A A . 7 ILE HG21 1 1 16 14648 1 1 7 ILE HG22 H -0.249 -2.544 -8.077 1.00 . A A . 7 ILE HG22 1 1 16 14649 1 1 7 ILE HG23 H -0.198 -1.091 -9.077 1.00 . A A . 7 ILE HG23 1 1 16 14650 1 1 7 ILE N N -0.352 0.529 -5.351 1.00 . A A . 7 ILE N 1 1 16 14651 1 1 7 ILE O O 1.892 -0.651 -7.847 1.00 . A A . 7 ILE O 1 1 16 14652 1 1 8 ASP C C 3.448 2.139 -7.604 1.00 . A A . 8 ASP C 1 1 16 14653 1 1 8 ASP CA C 2.105 2.067 -8.317 1.00 . A A . 8 ASP CA 1 1 16 14654 1 1 8 ASP CB C 1.637 3.472 -8.708 1.00 . A A . 8 ASP CB 1 1 16 14655 1 1 8 ASP CG C 1.529 3.649 -10.210 1.00 . A A . 8 ASP CG 1 1 16 14656 1 1 8 ASP H H 0.454 1.975 -7.002 1.00 . A A . 8 ASP H 1 1 16 14657 1 1 8 ASP HA H 2.214 1.471 -9.210 1.00 . A A . 8 ASP HA 1 1 16 14658 1 1 8 ASP HB2 H 0.666 3.656 -8.273 1.00 . A A . 8 ASP HB2 1 1 16 14659 1 1 8 ASP HB3 H 2.341 4.199 -8.328 1.00 . A A . 8 ASP HB3 1 1 16 14660 1 1 8 ASP N N 1.114 1.424 -7.466 1.00 . A A . 8 ASP N 1 1 16 14661 1 1 8 ASP O O 4.501 2.167 -8.241 1.00 . A A . 8 ASP O 1 1 16 14662 1 1 8 ASP OD1 O 2.544 4.019 -10.838 1.00 . A A . 8 ASP OD1 1 1 16 14663 1 1 8 ASP OD2 O 0.432 3.416 -10.757 1.00 . A A . 8 ASP OD2 1 1 16 14664 1 1 9 HIS C C 5.176 0.832 -5.231 1.00 . A A . 9 HIS C 1 1 16 14665 1 1 9 HIS CA C 4.613 2.231 -5.472 1.00 . A A . 9 HIS CA 1 1 16 14666 1 1 9 HIS CB C 4.323 2.923 -4.135 1.00 . A A . 9 HIS CB 1 1 16 14667 1 1 9 HIS CD2 C 5.932 1.904 -2.372 1.00 . A A . 9 HIS CD2 1 1 16 14668 1 1 9 HIS CE1 C 7.210 3.657 -2.053 1.00 . A A . 9 HIS CE1 1 1 16 14669 1 1 9 HIS CG C 5.472 2.894 -3.174 1.00 . A A . 9 HIS CG 1 1 16 14670 1 1 9 HIS H H 2.533 2.141 -5.826 1.00 . A A . 9 HIS H 1 1 16 14671 1 1 9 HIS HA H 5.338 2.810 -6.018 1.00 . A A . 9 HIS HA 1 1 16 14672 1 1 9 HIS HB2 H 4.074 3.955 -4.322 1.00 . A A . 9 HIS HB2 1 1 16 14673 1 1 9 HIS HB3 H 3.482 2.435 -3.663 1.00 . A A . 9 HIS HB3 1 1 16 14674 1 1 9 HIS HD1 H 6.220 4.853 -3.384 1.00 . A A . 9 HIS HD1 1 1 16 14675 1 1 9 HIS HD2 H 5.522 0.907 -2.286 1.00 . A A . 9 HIS HD2 1 1 16 14676 1 1 9 HIS HE1 H 7.987 4.307 -1.682 1.00 . A A . 9 HIS HE1 1 1 16 14677 1 1 9 HIS HE2 H 7.490 1.944 -0.965 1.00 . A A . 9 HIS HE2 1 1 16 14678 1 1 9 HIS N N 3.403 2.167 -6.276 1.00 . A A . 9 HIS N 1 1 16 14679 1 1 9 HIS ND1 N 6.296 3.978 -2.950 1.00 . A A . 9 HIS ND1 1 1 16 14680 1 1 9 HIS NE2 N 7.010 2.404 -1.686 1.00 . A A . 9 HIS NE2 1 1 16 14681 1 1 9 HIS O O 6.386 0.653 -5.096 1.00 . A A . 9 HIS O 1 1 16 14682 1 1 10 PHE C C 4.872 -2.281 -6.262 1.00 . A A . 10 PHE C 1 1 16 14683 1 1 10 PHE CA C 4.686 -1.536 -4.945 1.00 . A A . 10 PHE CA 1 1 16 14684 1 1 10 PHE CB C 3.641 -2.247 -4.089 1.00 . A A . 10 PHE CB 1 1 16 14685 1 1 10 PHE CD1 C 4.631 -2.676 -1.831 1.00 . A A . 10 PHE CD1 1 1 16 14686 1 1 10 PHE CD2 C 3.038 -0.919 -2.051 1.00 . A A . 10 PHE CD2 1 1 16 14687 1 1 10 PHE CE1 C 4.760 -2.397 -0.483 1.00 . A A . 10 PHE CE1 1 1 16 14688 1 1 10 PHE CE2 C 3.161 -0.632 -0.706 1.00 . A A . 10 PHE CE2 1 1 16 14689 1 1 10 PHE CG C 3.771 -1.942 -2.626 1.00 . A A . 10 PHE CG 1 1 16 14690 1 1 10 PHE CZ C 4.024 -1.371 0.081 1.00 . A A . 10 PHE CZ 1 1 16 14691 1 1 10 PHE H H 3.334 0.056 -5.285 1.00 . A A . 10 PHE H 1 1 16 14692 1 1 10 PHE HA H 5.625 -1.528 -4.412 1.00 . A A . 10 PHE HA 1 1 16 14693 1 1 10 PHE HB2 H 2.654 -1.943 -4.405 1.00 . A A . 10 PHE HB2 1 1 16 14694 1 1 10 PHE HB3 H 3.742 -3.315 -4.218 1.00 . A A . 10 PHE HB3 1 1 16 14695 1 1 10 PHE HD1 H 5.206 -3.476 -2.273 1.00 . A A . 10 PHE HD1 1 1 16 14696 1 1 10 PHE HD2 H 2.364 -0.341 -2.665 1.00 . A A . 10 PHE HD2 1 1 16 14697 1 1 10 PHE HE1 H 5.435 -2.975 0.127 1.00 . A A . 10 PHE HE1 1 1 16 14698 1 1 10 PHE HE2 H 2.585 0.170 -0.270 1.00 . A A . 10 PHE HE2 1 1 16 14699 1 1 10 PHE HZ H 4.122 -1.150 1.133 1.00 . A A . 10 PHE HZ 1 1 16 14700 1 1 10 PHE N N 4.285 -0.154 -5.173 1.00 . A A . 10 PHE N 1 1 16 14701 1 1 10 PHE O O 5.737 -3.151 -6.378 1.00 . A A . 10 PHE O 1 1 16 14702 1 1 11 GLY C C 3.213 -3.793 -8.643 1.00 . A A . 11 GLY C 1 1 16 14703 1 1 11 GLY CA C 4.137 -2.596 -8.543 1.00 . A A . 11 GLY CA 1 1 16 14704 1 1 11 GLY H H 3.376 -1.247 -7.099 1.00 . A A . 11 GLY H 1 1 16 14705 1 1 11 GLY HA2 H 3.874 -1.885 -9.313 1.00 . A A . 11 GLY HA2 1 1 16 14706 1 1 11 GLY HA3 H 5.153 -2.926 -8.701 1.00 . A A . 11 GLY HA3 1 1 16 14707 1 1 11 GLY N N 4.050 -1.943 -7.250 1.00 . A A . 11 GLY N 1 1 16 14708 1 1 11 GLY O O 2.501 -3.956 -9.633 1.00 . A A . 11 GLY O 1 1 16 14709 1 1 12 THR C C 1.660 -5.918 -6.227 1.00 . A A . 12 THR C 1 1 16 14710 1 1 12 THR CA C 2.376 -5.813 -7.570 1.00 . A A . 12 THR CA 1 1 16 14711 1 1 12 THR CB C 3.211 -7.070 -7.820 1.00 . A A . 12 THR CB 1 1 16 14712 1 1 12 THR CG2 C 4.031 -7.002 -9.090 1.00 . A A . 12 THR CG2 1 1 16 14713 1 1 12 THR H H 3.808 -4.437 -6.846 1.00 . A A . 12 THR H 1 1 16 14714 1 1 12 THR HA H 1.637 -5.721 -8.353 1.00 . A A . 12 THR HA 1 1 16 14715 1 1 12 THR HB H 2.549 -7.920 -7.898 1.00 . A A . 12 THR HB 1 1 16 14716 1 1 12 THR HG1 H 4.539 -6.477 -6.507 1.00 . A A . 12 THR HG1 1 1 16 14717 1 1 12 THR HG21 H 5.052 -6.750 -8.847 1.00 . A A . 12 THR HG21 1 1 16 14718 1 1 12 THR HG22 H 3.621 -6.247 -9.744 1.00 . A A . 12 THR HG22 1 1 16 14719 1 1 12 THR HG23 H 4.005 -7.960 -9.587 1.00 . A A . 12 THR HG23 1 1 16 14720 1 1 12 THR N N 3.221 -4.627 -7.607 1.00 . A A . 12 THR N 1 1 16 14721 1 1 12 THR O O 2.255 -5.677 -5.177 1.00 . A A . 12 THR O 1 1 16 14722 1 1 12 THR OG1 O 4.105 -7.301 -6.745 1.00 . A A . 12 THR OG1 1 1 16 14723 1 1 13 GLN C C 0.290 -7.285 -4.021 1.00 . A A . 13 GLN C 1 1 16 14724 1 1 13 GLN CA C -0.416 -6.409 -5.053 1.00 . A A . 13 GLN CA 1 1 16 14725 1 1 13 GLN CB C -1.791 -6.996 -5.381 1.00 . A A . 13 GLN CB 1 1 16 14726 1 1 13 GLN CD C -2.852 -8.292 -7.271 1.00 . A A . 13 GLN CD 1 1 16 14727 1 1 13 GLN CG C -1.730 -8.240 -6.252 1.00 . A A . 13 GLN CG 1 1 16 14728 1 1 13 GLN H H -0.039 -6.451 -7.136 1.00 . A A . 13 GLN H 1 1 16 14729 1 1 13 GLN HA H -0.549 -5.422 -4.636 1.00 . A A . 13 GLN HA 1 1 16 14730 1 1 13 GLN HB2 H -2.287 -7.253 -4.458 1.00 . A A . 13 GLN HB2 1 1 16 14731 1 1 13 GLN HB3 H -2.375 -6.248 -5.897 1.00 . A A . 13 GLN HB3 1 1 16 14732 1 1 13 GLN HE21 H -4.200 -7.990 -5.839 1.00 . A A . 13 GLN HE21 1 1 16 14733 1 1 13 GLN HE22 H -4.829 -8.161 -7.438 1.00 . A A . 13 GLN HE22 1 1 16 14734 1 1 13 GLN HG2 H -0.788 -8.251 -6.778 1.00 . A A . 13 GLN HG2 1 1 16 14735 1 1 13 GLN HG3 H -1.797 -9.111 -5.617 1.00 . A A . 13 GLN HG3 1 1 16 14736 1 1 13 GLN N N 0.381 -6.277 -6.269 1.00 . A A . 13 GLN N 1 1 16 14737 1 1 13 GLN NE2 N -4.084 -8.132 -6.801 1.00 . A A . 13 GLN NE2 1 1 16 14738 1 1 13 GLN O O 0.442 -6.895 -2.863 1.00 . A A . 13 GLN O 1 1 16 14739 1 1 13 GLN OE1 O -2.615 -8.476 -8.464 1.00 . A A . 13 GLN OE1 1 1 16 14740 1 1 14 ARG C C 2.501 -8.705 -2.758 1.00 . A A . 14 ARG C 1 1 16 14741 1 1 14 ARG CA C 1.411 -9.406 -3.566 1.00 . A A . 14 ARG CA 1 1 16 14742 1 1 14 ARG CB C 2.016 -10.552 -4.380 1.00 . A A . 14 ARG CB 1 1 16 14743 1 1 14 ARG CD C 0.322 -12.407 -4.398 1.00 . A A . 14 ARG CD 1 1 16 14744 1 1 14 ARG CG C 1.657 -11.930 -3.849 1.00 . A A . 14 ARG CG 1 1 16 14745 1 1 14 ARG CZ C -0.565 -13.403 -6.470 1.00 . A A . 14 ARG CZ 1 1 16 14746 1 1 14 ARG H H 0.569 -8.720 -5.385 1.00 . A A . 14 ARG H 1 1 16 14747 1 1 14 ARG HA H 0.680 -9.811 -2.882 1.00 . A A . 14 ARG HA 1 1 16 14748 1 1 14 ARG HB2 H 1.663 -10.479 -5.398 1.00 . A A . 14 ARG HB2 1 1 16 14749 1 1 14 ARG HB3 H 3.093 -10.456 -4.374 1.00 . A A . 14 ARG HB3 1 1 16 14750 1 1 14 ARG HD2 H -0.108 -13.111 -3.701 1.00 . A A . 14 ARG HD2 1 1 16 14751 1 1 14 ARG HD3 H -0.336 -11.556 -4.497 1.00 . A A . 14 ARG HD3 1 1 16 14752 1 1 14 ARG HE H 1.371 -13.236 -6.018 1.00 . A A . 14 ARG HE 1 1 16 14753 1 1 14 ARG HG2 H 2.425 -12.629 -4.143 1.00 . A A . 14 ARG HG2 1 1 16 14754 1 1 14 ARG HG3 H 1.598 -11.885 -2.772 1.00 . A A . 14 ARG HG3 1 1 16 14755 1 1 14 ARG HH11 H -1.981 -12.731 -5.190 1.00 . A A . 14 ARG HH11 1 1 16 14756 1 1 14 ARG HH12 H -2.577 -13.437 -6.655 1.00 . A A . 14 ARG HH12 1 1 16 14757 1 1 14 ARG HH21 H 0.589 -14.163 -7.943 1.00 . A A . 14 ARG HH21 1 1 16 14758 1 1 14 ARG HH22 H -1.120 -14.249 -8.219 1.00 . A A . 14 ARG HH22 1 1 16 14759 1 1 14 ARG N N 0.720 -8.469 -4.450 1.00 . A A . 14 ARG N 1 1 16 14760 1 1 14 ARG NE N 0.463 -13.052 -5.700 1.00 . A A . 14 ARG NE 1 1 16 14761 1 1 14 ARG NH1 N -1.811 -13.172 -6.072 1.00 . A A . 14 ARG NH1 1 1 16 14762 1 1 14 ARG NH2 N -0.348 -13.986 -7.640 1.00 . A A . 14 ARG NH2 1 1 16 14763 1 1 14 ARG O O 2.757 -9.059 -1.608 1.00 . A A . 14 ARG O 1 1 16 14764 1 1 15 ALA C C 3.656 -6.214 -1.486 1.00 . A A . 15 ALA C 1 1 16 14765 1 1 15 ALA CA C 4.196 -6.961 -2.701 1.00 . A A . 15 ALA CA 1 1 16 14766 1 1 15 ALA CB C 4.850 -5.992 -3.674 1.00 . A A . 15 ALA CB 1 1 16 14767 1 1 15 ALA H H 2.888 -7.473 -4.285 1.00 . A A . 15 ALA H 1 1 16 14768 1 1 15 ALA HA H 4.947 -7.665 -2.373 1.00 . A A . 15 ALA HA 1 1 16 14769 1 1 15 ALA HB1 H 4.122 -5.262 -3.998 1.00 . A A . 15 ALA HB1 1 1 16 14770 1 1 15 ALA HB2 H 5.220 -6.535 -4.530 1.00 . A A . 15 ALA HB2 1 1 16 14771 1 1 15 ALA HB3 H 5.669 -5.488 -3.185 1.00 . A A . 15 ALA HB3 1 1 16 14772 1 1 15 ALA N N 3.138 -7.710 -3.367 1.00 . A A . 15 ALA N 1 1 16 14773 1 1 15 ALA O O 4.198 -6.320 -0.387 1.00 . A A . 15 ALA O 1 1 16 14774 1 1 16 VAL C C 1.606 -5.585 0.560 1.00 . A A . 16 VAL C 1 1 16 14775 1 1 16 VAL CA C 1.964 -4.689 -0.622 1.00 . A A . 16 VAL CA 1 1 16 14776 1 1 16 VAL CB C 0.687 -3.957 -1.095 1.00 . A A . 16 VAL CB 1 1 16 14777 1 1 16 VAL CG1 C 0.541 -2.639 -0.363 1.00 . A A . 16 VAL CG1 1 1 16 14778 1 1 16 VAL CG2 C 0.697 -3.724 -2.600 1.00 . A A . 16 VAL CG2 1 1 16 14779 1 1 16 VAL H H 2.200 -5.412 -2.592 1.00 . A A . 16 VAL H 1 1 16 14780 1 1 16 VAL HA H 2.675 -3.947 -0.293 1.00 . A A . 16 VAL HA 1 1 16 14781 1 1 16 VAL HB H -0.168 -4.573 -0.853 1.00 . A A . 16 VAL HB 1 1 16 14782 1 1 16 VAL HG11 H 1.018 -1.860 -0.936 1.00 . A A . 16 VAL HG11 1 1 16 14783 1 1 16 VAL HG12 H 1.012 -2.715 0.605 1.00 . A A . 16 VAL HG12 1 1 16 14784 1 1 16 VAL HG13 H -0.504 -2.409 -0.241 1.00 . A A . 16 VAL HG13 1 1 16 14785 1 1 16 VAL HG21 H 0.434 -4.640 -3.107 1.00 . A A . 16 VAL HG21 1 1 16 14786 1 1 16 VAL HG22 H 1.684 -3.413 -2.910 1.00 . A A . 16 VAL HG22 1 1 16 14787 1 1 16 VAL HG23 H -0.017 -2.955 -2.850 1.00 . A A . 16 VAL HG23 1 1 16 14788 1 1 16 VAL N N 2.583 -5.456 -1.696 1.00 . A A . 16 VAL N 1 1 16 14789 1 1 16 VAL O O 1.836 -5.229 1.714 1.00 . A A . 16 VAL O 1 1 16 14790 1 1 17 ALA C C 1.854 -8.129 2.131 1.00 . A A . 17 ALA C 1 1 16 14791 1 1 17 ALA CA C 0.651 -7.700 1.297 1.00 . A A . 17 ALA CA 1 1 16 14792 1 1 17 ALA CB C -0.024 -8.913 0.672 1.00 . A A . 17 ALA CB 1 1 16 14793 1 1 17 ALA H H 0.883 -6.979 -0.679 1.00 . A A . 17 ALA H 1 1 16 14794 1 1 17 ALA HA H -0.066 -7.212 1.941 1.00 . A A . 17 ALA HA 1 1 16 14795 1 1 17 ALA HB1 H 0.194 -8.941 -0.386 1.00 . A A . 17 ALA HB1 1 1 16 14796 1 1 17 ALA HB2 H -1.091 -8.844 0.817 1.00 . A A . 17 ALA HB2 1 1 16 14797 1 1 17 ALA HB3 H 0.345 -9.813 1.139 1.00 . A A . 17 ALA HB3 1 1 16 14798 1 1 17 ALA N N 1.041 -6.751 0.261 1.00 . A A . 17 ALA N 1 1 16 14799 1 1 17 ALA O O 1.715 -8.473 3.305 1.00 . A A . 17 ALA O 1 1 16 14800 1 1 18 LYS C C 4.697 -7.422 3.195 1.00 . A A . 18 LYS C 1 1 16 14801 1 1 18 LYS CA C 4.258 -8.500 2.207 1.00 . A A . 18 LYS CA 1 1 16 14802 1 1 18 LYS CB C 5.373 -8.768 1.194 1.00 . A A . 18 LYS CB 1 1 16 14803 1 1 18 LYS CD C 5.324 -11.267 1.458 1.00 . A A . 18 LYS CD 1 1 16 14804 1 1 18 LYS CE C 5.505 -12.024 0.152 1.00 . A A . 18 LYS CE 1 1 16 14805 1 1 18 LYS CG C 6.186 -10.014 1.500 1.00 . A A . 18 LYS CG 1 1 16 14806 1 1 18 LYS H H 3.080 -7.828 0.583 1.00 . A A . 18 LYS H 1 1 16 14807 1 1 18 LYS HA H 4.055 -9.408 2.754 1.00 . A A . 18 LYS HA 1 1 16 14808 1 1 18 LYS HB2 H 4.933 -8.883 0.215 1.00 . A A . 18 LYS HB2 1 1 16 14809 1 1 18 LYS HB3 H 6.044 -7.921 1.180 1.00 . A A . 18 LYS HB3 1 1 16 14810 1 1 18 LYS HD2 H 5.602 -11.912 2.278 1.00 . A A . 18 LYS HD2 1 1 16 14811 1 1 18 LYS HD3 H 4.287 -10.983 1.558 1.00 . A A . 18 LYS HD3 1 1 16 14812 1 1 18 LYS HE2 H 4.647 -12.660 -0.003 1.00 . A A . 18 LYS HE2 1 1 16 14813 1 1 18 LYS HE3 H 5.574 -11.311 -0.656 1.00 . A A . 18 LYS HE3 1 1 16 14814 1 1 18 LYS HG2 H 6.974 -10.108 0.768 1.00 . A A . 18 LYS HG2 1 1 16 14815 1 1 18 LYS HG3 H 6.617 -9.918 2.486 1.00 . A A . 18 LYS HG3 1 1 16 14816 1 1 18 LYS HZ1 H 6.516 -13.810 0.540 1.00 . A A . 18 LYS HZ1 1 1 16 14817 1 1 18 LYS HZ2 H 7.462 -12.426 0.760 1.00 . A A . 18 LYS HZ2 1 1 16 14818 1 1 18 LYS HZ3 H 7.106 -12.966 -0.802 1.00 . A A . 18 LYS HZ3 1 1 16 14819 1 1 18 LYS N N 3.033 -8.110 1.518 1.00 . A A . 18 LYS N 1 1 16 14820 1 1 18 LYS NZ N 6.733 -12.865 0.163 1.00 . A A . 18 LYS NZ 1 1 16 14821 1 1 18 LYS O O 5.302 -7.719 4.225 1.00 . A A . 18 LYS O 1 1 16 14822 1 1 19 ALA C C 3.782 -4.912 4.898 1.00 . A A . 19 ALA C 1 1 16 14823 1 1 19 ALA CA C 4.753 -5.050 3.731 1.00 . A A . 19 ALA CA 1 1 16 14824 1 1 19 ALA CB C 4.798 -3.761 2.924 1.00 . A A . 19 ALA CB 1 1 16 14825 1 1 19 ALA H H 3.906 -5.995 2.038 1.00 . A A . 19 ALA H 1 1 16 14826 1 1 19 ALA HA H 5.744 -5.236 4.120 1.00 . A A . 19 ALA HA 1 1 16 14827 1 1 19 ALA HB1 H 4.122 -3.837 2.086 1.00 . A A . 19 ALA HB1 1 1 16 14828 1 1 19 ALA HB2 H 5.801 -3.596 2.562 1.00 . A A . 19 ALA HB2 1 1 16 14829 1 1 19 ALA HB3 H 4.500 -2.933 3.551 1.00 . A A . 19 ALA HB3 1 1 16 14830 1 1 19 ALA N N 4.390 -6.170 2.873 1.00 . A A . 19 ALA N 1 1 16 14831 1 1 19 ALA O O 4.177 -4.559 6.009 1.00 . A A . 19 ALA O 1 1 16 14832 1 1 20 LEU C C 1.331 -6.420 6.411 1.00 . A A . 20 LEU C 1 1 16 14833 1 1 20 LEU CA C 1.480 -5.096 5.668 1.00 . A A . 20 LEU CA 1 1 16 14834 1 1 20 LEU CB C 0.141 -4.697 5.045 1.00 . A A . 20 LEU CB 1 1 16 14835 1 1 20 LEU CD1 C -0.900 -3.129 3.390 1.00 . A A . 20 LEU CD1 1 1 16 14836 1 1 20 LEU CD2 C -0.391 -2.340 5.706 1.00 . A A . 20 LEU CD2 1 1 16 14837 1 1 20 LEU CG C 0.053 -3.247 4.569 1.00 . A A . 20 LEU CG 1 1 16 14838 1 1 20 LEU H H 2.255 -5.465 3.734 1.00 . A A . 20 LEU H 1 1 16 14839 1 1 20 LEU HA H 1.781 -4.334 6.370 1.00 . A A . 20 LEU HA 1 1 16 14840 1 1 20 LEU HB2 H -0.046 -5.344 4.200 1.00 . A A . 20 LEU HB2 1 1 16 14841 1 1 20 LEU HB3 H -0.636 -4.858 5.778 1.00 . A A . 20 LEU HB3 1 1 16 14842 1 1 20 LEU HD11 H -1.350 -2.148 3.388 1.00 . A A . 20 LEU HD11 1 1 16 14843 1 1 20 LEU HD12 H -1.670 -3.881 3.474 1.00 . A A . 20 LEU HD12 1 1 16 14844 1 1 20 LEU HD13 H -0.352 -3.276 2.470 1.00 . A A . 20 LEU HD13 1 1 16 14845 1 1 20 LEU HD21 H -0.142 -1.315 5.467 1.00 . A A . 20 LEU HD21 1 1 16 14846 1 1 20 LEU HD22 H 0.113 -2.630 6.616 1.00 . A A . 20 LEU HD22 1 1 16 14847 1 1 20 LEU HD23 H -1.459 -2.428 5.841 1.00 . A A . 20 LEU HD23 1 1 16 14848 1 1 20 LEU HG H 1.030 -2.923 4.242 1.00 . A A . 20 LEU HG 1 1 16 14849 1 1 20 LEU N N 2.508 -5.190 4.639 1.00 . A A . 20 LEU N 1 1 16 14850 1 1 20 LEU O O 0.993 -6.443 7.596 1.00 . A A . 20 LEU O 1 1 16 14851 1 1 21 GLY C C 0.091 -9.443 6.111 1.00 . A A . 21 GLY C 1 1 16 14852 1 1 21 GLY CA C 1.464 -8.831 6.316 1.00 . A A . 21 GLY CA 1 1 16 14853 1 1 21 GLY H H 1.842 -7.438 4.768 1.00 . A A . 21 GLY H 1 1 16 14854 1 1 21 GLY HA2 H 2.207 -9.484 5.883 1.00 . A A . 21 GLY HA2 1 1 16 14855 1 1 21 GLY HA3 H 1.651 -8.742 7.377 1.00 . A A . 21 GLY HA3 1 1 16 14856 1 1 21 GLY N N 1.580 -7.518 5.708 1.00 . A A . 21 GLY N 1 1 16 14857 1 1 21 GLY O O -0.357 -10.262 6.913 1.00 . A A . 21 GLY O 1 1 16 14858 1 1 22 ILE C C -1.882 -10.413 3.464 1.00 . A A . 22 ILE C 1 1 16 14859 1 1 22 ILE CA C -1.906 -9.554 4.724 1.00 . A A . 22 ILE CA 1 1 16 14860 1 1 22 ILE CB C -2.916 -8.406 4.528 1.00 . A A . 22 ILE CB 1 1 16 14861 1 1 22 ILE CD1 C -3.453 -6.388 3.072 1.00 . A A . 22 ILE CD1 1 1 16 14862 1 1 22 ILE CG1 C -2.458 -7.478 3.402 1.00 . A A . 22 ILE CG1 1 1 16 14863 1 1 22 ILE CG2 C -3.092 -7.629 5.823 1.00 . A A . 22 ILE CG2 1 1 16 14864 1 1 22 ILE H H -0.165 -8.385 4.433 1.00 . A A . 22 ILE H 1 1 16 14865 1 1 22 ILE HA H -2.235 -10.158 5.556 1.00 . A A . 22 ILE HA 1 1 16 14866 1 1 22 ILE HB H -3.869 -8.836 4.262 1.00 . A A . 22 ILE HB 1 1 16 14867 1 1 22 ILE HD11 H -3.109 -5.449 3.480 1.00 . A A . 22 ILE HD11 1 1 16 14868 1 1 22 ILE HD12 H -4.413 -6.636 3.500 1.00 . A A . 22 ILE HD12 1 1 16 14869 1 1 22 ILE HD13 H -3.550 -6.301 2.000 1.00 . A A . 22 ILE HD13 1 1 16 14870 1 1 22 ILE HG12 H -1.530 -7.004 3.690 1.00 . A A . 22 ILE HG12 1 1 16 14871 1 1 22 ILE HG13 H -2.294 -8.061 2.507 1.00 . A A . 22 ILE HG13 1 1 16 14872 1 1 22 ILE HG21 H -3.415 -6.622 5.598 1.00 . A A . 22 ILE HG21 1 1 16 14873 1 1 22 ILE HG22 H -2.153 -7.596 6.353 1.00 . A A . 22 ILE HG22 1 1 16 14874 1 1 22 ILE HG23 H -3.836 -8.116 6.437 1.00 . A A . 22 ILE HG23 1 1 16 14875 1 1 22 ILE N N -0.577 -9.042 5.034 1.00 . A A . 22 ILE N 1 1 16 14876 1 1 22 ILE O O -0.828 -10.627 2.867 1.00 . A A . 22 ILE O 1 1 16 14877 1 1 23 SER C C -3.292 -10.875 0.619 1.00 . A A . 23 SER C 1 1 16 14878 1 1 23 SER CA C -3.166 -11.734 1.873 1.00 . A A . 23 SER CA 1 1 16 14879 1 1 23 SER CB C -4.371 -12.668 1.991 1.00 . A A . 23 SER CB 1 1 16 14880 1 1 23 SER H H -3.859 -10.692 3.580 1.00 . A A . 23 SER H 1 1 16 14881 1 1 23 SER HA H -2.267 -12.327 1.800 1.00 . A A . 23 SER HA 1 1 16 14882 1 1 23 SER HB2 H -4.539 -13.158 1.043 1.00 . A A . 23 SER HB2 1 1 16 14883 1 1 23 SER HB3 H -4.175 -13.411 2.750 1.00 . A A . 23 SER HB3 1 1 16 14884 1 1 23 SER HG H -6.282 -12.273 1.829 1.00 . A A . 23 SER HG 1 1 16 14885 1 1 23 SER N N -3.053 -10.900 3.064 1.00 . A A . 23 SER N 1 1 16 14886 1 1 23 SER O O -3.623 -9.692 0.696 1.00 . A A . 23 SER O 1 1 16 14887 1 1 23 SER OG O -5.540 -11.950 2.345 1.00 . A A . 23 SER OG 1 1 16 14888 1 1 24 ASP C C -4.545 -10.351 -2.105 1.00 . A A . 24 ASP C 1 1 16 14889 1 1 24 ASP CA C -3.107 -10.766 -1.805 1.00 . A A . 24 ASP CA 1 1 16 14890 1 1 24 ASP CB C -2.571 -11.642 -2.940 1.00 . A A . 24 ASP CB 1 1 16 14891 1 1 24 ASP CG C -3.325 -12.950 -3.070 1.00 . A A . 24 ASP CG 1 1 16 14892 1 1 24 ASP H H -2.765 -12.423 -0.532 1.00 . A A . 24 ASP H 1 1 16 14893 1 1 24 ASP HA H -2.498 -9.879 -1.729 1.00 . A A . 24 ASP HA 1 1 16 14894 1 1 24 ASP HB2 H -2.657 -11.104 -3.872 1.00 . A A . 24 ASP HB2 1 1 16 14895 1 1 24 ASP HB3 H -1.530 -11.864 -2.751 1.00 . A A . 24 ASP HB3 1 1 16 14896 1 1 24 ASP N N -3.025 -11.478 -0.535 1.00 . A A . 24 ASP N 1 1 16 14897 1 1 24 ASP O O -4.784 -9.317 -2.728 1.00 . A A . 24 ASP O 1 1 16 14898 1 1 24 ASP OD1 O -4.489 -12.922 -3.522 1.00 . A A . 24 ASP OD1 1 1 16 14899 1 1 24 ASP OD2 O -2.752 -14.003 -2.720 1.00 . A A . 24 ASP OD2 1 1 16 14900 1 1 25 ALA C C -7.314 -9.563 -1.233 1.00 . A A . 25 ALA C 1 1 16 14901 1 1 25 ALA CA C -6.908 -10.883 -1.883 1.00 . A A . 25 ALA CA 1 1 16 14902 1 1 25 ALA CB C -7.764 -12.021 -1.348 1.00 . A A . 25 ALA CB 1 1 16 14903 1 1 25 ALA H H -5.241 -11.976 -1.171 1.00 . A A . 25 ALA H 1 1 16 14904 1 1 25 ALA HA H -7.071 -10.812 -2.949 1.00 . A A . 25 ALA HA 1 1 16 14905 1 1 25 ALA HB1 H -8.704 -11.628 -0.988 1.00 . A A . 25 ALA HB1 1 1 16 14906 1 1 25 ALA HB2 H -7.246 -12.512 -0.538 1.00 . A A . 25 ALA HB2 1 1 16 14907 1 1 25 ALA HB3 H -7.951 -12.732 -2.139 1.00 . A A . 25 ALA HB3 1 1 16 14908 1 1 25 ALA N N -5.496 -11.165 -1.661 1.00 . A A . 25 ALA N 1 1 16 14909 1 1 25 ALA O O -8.029 -8.759 -1.831 1.00 . A A . 25 ALA O 1 1 16 14910 1 1 26 ALA C C -6.679 -6.894 -0.026 1.00 . A A . 26 ALA C 1 1 16 14911 1 1 26 ALA CA C -7.170 -8.127 0.726 1.00 . A A . 26 ALA CA 1 1 16 14912 1 1 26 ALA CB C -6.562 -8.174 2.120 1.00 . A A . 26 ALA CB 1 1 16 14913 1 1 26 ALA H H -6.289 -10.027 0.420 1.00 . A A . 26 ALA H 1 1 16 14914 1 1 26 ALA HA H -8.244 -8.069 0.830 1.00 . A A . 26 ALA HA 1 1 16 14915 1 1 26 ALA HB1 H -6.368 -9.201 2.392 1.00 . A A . 26 ALA HB1 1 1 16 14916 1 1 26 ALA HB2 H -7.251 -7.738 2.828 1.00 . A A . 26 ALA HB2 1 1 16 14917 1 1 26 ALA HB3 H -5.637 -7.618 2.129 1.00 . A A . 26 ALA HB3 1 1 16 14918 1 1 26 ALA N N -6.855 -9.348 -0.005 1.00 . A A . 26 ALA N 1 1 16 14919 1 1 26 ALA O O -7.294 -5.829 0.039 1.00 . A A . 26 ALA O 1 1 16 14920 1 1 27 VAL C C -5.833 -5.639 -2.740 1.00 . A A . 27 VAL C 1 1 16 14921 1 1 27 VAL CA C -4.995 -5.943 -1.502 1.00 . A A . 27 VAL CA 1 1 16 14922 1 1 27 VAL CB C -3.549 -6.254 -1.937 1.00 . A A . 27 VAL CB 1 1 16 14923 1 1 27 VAL CG1 C -2.940 -5.068 -2.670 1.00 . A A . 27 VAL CG1 1 1 16 14924 1 1 27 VAL CG2 C -2.701 -6.636 -0.734 1.00 . A A . 27 VAL CG2 1 1 16 14925 1 1 27 VAL H H -5.123 -7.917 -0.751 1.00 . A A . 27 VAL H 1 1 16 14926 1 1 27 VAL HA H -4.978 -5.070 -0.868 1.00 . A A . 27 VAL HA 1 1 16 14927 1 1 27 VAL HB H -3.572 -7.093 -2.616 1.00 . A A . 27 VAL HB 1 1 16 14928 1 1 27 VAL HG11 H -1.960 -5.335 -3.037 1.00 . A A . 27 VAL HG11 1 1 16 14929 1 1 27 VAL HG12 H -2.855 -4.230 -1.993 1.00 . A A . 27 VAL HG12 1 1 16 14930 1 1 27 VAL HG13 H -3.575 -4.794 -3.502 1.00 . A A . 27 VAL HG13 1 1 16 14931 1 1 27 VAL HG21 H -2.727 -5.838 -0.006 1.00 . A A . 27 VAL HG21 1 1 16 14932 1 1 27 VAL HG22 H -1.682 -6.804 -1.049 1.00 . A A . 27 VAL HG22 1 1 16 14933 1 1 27 VAL HG23 H -3.094 -7.540 -0.289 1.00 . A A . 27 VAL HG23 1 1 16 14934 1 1 27 VAL N N -5.568 -7.045 -0.738 1.00 . A A . 27 VAL N 1 1 16 14935 1 1 27 VAL O O -6.083 -4.477 -3.061 1.00 . A A . 27 VAL O 1 1 16 14936 1 1 28 SER C C -8.476 -6.043 -4.287 1.00 . A A . 28 SER C 1 1 16 14937 1 1 28 SER CA C -7.072 -6.530 -4.634 1.00 . A A . 28 SER CA 1 1 16 14938 1 1 28 SER CB C -7.154 -7.855 -5.397 1.00 . A A . 28 SER CB 1 1 16 14939 1 1 28 SER H H -6.031 -7.590 -3.126 1.00 . A A . 28 SER H 1 1 16 14940 1 1 28 SER HA H -6.593 -5.793 -5.259 1.00 . A A . 28 SER HA 1 1 16 14941 1 1 28 SER HB2 H -6.227 -8.395 -5.274 1.00 . A A . 28 SER HB2 1 1 16 14942 1 1 28 SER HB3 H -7.969 -8.442 -5.004 1.00 . A A . 28 SER HB3 1 1 16 14943 1 1 28 SER HG H -6.749 -6.980 -7.102 1.00 . A A . 28 SER HG 1 1 16 14944 1 1 28 SER N N -6.264 -6.688 -3.431 1.00 . A A . 28 SER N 1 1 16 14945 1 1 28 SER O O -9.111 -5.339 -5.073 1.00 . A A . 28 SER O 1 1 16 14946 1 1 28 SER OG O -7.373 -7.633 -6.780 1.00 . A A . 28 SER OG 1 1 16 14947 1 1 29 GLN C C -10.320 -4.546 -2.273 1.00 . A A . 29 GLN C 1 1 16 14948 1 1 29 GLN CA C -10.280 -6.024 -2.656 1.00 . A A . 29 GLN CA 1 1 16 14949 1 1 29 GLN CB C -10.710 -6.882 -1.464 1.00 . A A . 29 GLN CB 1 1 16 14950 1 1 29 GLN CD C -11.550 -9.144 -0.718 1.00 . A A . 29 GLN CD 1 1 16 14951 1 1 29 GLN CG C -11.430 -8.160 -1.863 1.00 . A A . 29 GLN CG 1 1 16 14952 1 1 29 GLN H H -8.402 -6.984 -2.525 1.00 . A A . 29 GLN H 1 1 16 14953 1 1 29 GLN HA H -10.970 -6.189 -3.472 1.00 . A A . 29 GLN HA 1 1 16 14954 1 1 29 GLN HB2 H -9.843 -7.149 -0.892 1.00 . A A . 29 GLN HB2 1 1 16 14955 1 1 29 GLN HB3 H -11.380 -6.300 -0.840 1.00 . A A . 29 GLN HB3 1 1 16 14956 1 1 29 GLN HE21 H -13.530 -9.027 -0.784 1.00 . A A . 29 GLN HE21 1 1 16 14957 1 1 29 GLN HE22 H -12.880 -10.084 0.419 1.00 . A A . 29 GLN HE22 1 1 16 14958 1 1 29 GLN HG2 H -12.430 -7.907 -2.205 1.00 . A A . 29 GLN HG2 1 1 16 14959 1 1 29 GLN HG3 H -10.880 -8.629 -2.667 1.00 . A A . 29 GLN HG3 1 1 16 14960 1 1 29 GLN N N -8.955 -6.422 -3.106 1.00 . A A . 29 GLN N 1 1 16 14961 1 1 29 GLN NE2 N -12.780 -9.449 -0.321 1.00 . A A . 29 GLN NE2 1 1 16 14962 1 1 29 GLN O O -11.390 -3.967 -2.112 1.00 . A A . 29 GLN O 1 1 16 14963 1 1 29 GLN OE1 O -10.540 -9.627 -0.193 1.00 . A A . 29 GLN OE1 1 1 16 14964 1 1 30 TRP C C -9.845 -1.654 -2.726 1.00 . A A . 30 TRP C 1 1 16 14965 1 1 30 TRP CA C -9.055 -2.529 -1.757 1.00 . A A . 30 TRP CA 1 1 16 14966 1 1 30 TRP CB C -7.592 -2.079 -1.735 1.00 . A A . 30 TRP CB 1 1 16 14967 1 1 30 TRP CD1 C -7.422 -2.881 0.697 1.00 . A A . 30 TRP CD1 1 1 16 14968 1 1 30 TRP CD2 C -5.452 -2.438 -0.269 1.00 . A A . 30 TRP CD2 1 1 16 14969 1 1 30 TRP CE2 C -5.218 -2.864 1.051 1.00 . A A . 30 TRP CE2 1 1 16 14970 1 1 30 TRP CE3 C -4.358 -2.103 -1.072 1.00 . A A . 30 TRP CE3 1 1 16 14971 1 1 30 TRP CG C -6.868 -2.456 -0.476 1.00 . A A . 30 TRP CG 1 1 16 14972 1 1 30 TRP CH2 C -2.884 -2.629 0.777 1.00 . A A . 30 TRP CH2 1 1 16 14973 1 1 30 TRP CZ2 C -3.935 -2.965 1.586 1.00 . A A . 30 TRP CZ2 1 1 16 14974 1 1 30 TRP CZ3 C -3.087 -2.203 -0.541 1.00 . A A . 30 TRP CZ3 1 1 16 14975 1 1 30 TRP H H -8.322 -4.448 -2.263 1.00 . A A . 30 TRP H 1 1 16 14976 1 1 30 TRP HA H -9.471 -2.416 -0.767 1.00 . A A . 30 TRP HA 1 1 16 14977 1 1 30 TRP HB2 H -7.071 -2.532 -2.565 1.00 . A A . 30 TRP HB2 1 1 16 14978 1 1 30 TRP HB3 H -7.551 -1.005 -1.835 1.00 . A A . 30 TRP HB3 1 1 16 14979 1 1 30 TRP HD1 H -8.482 -3.000 0.862 1.00 . A A . 30 TRP HD1 1 1 16 14980 1 1 30 TRP HE1 H -6.580 -3.442 2.539 1.00 . A A . 30 TRP HE1 1 1 16 14981 1 1 30 TRP HE3 H -4.494 -1.772 -2.091 1.00 . A A . 30 TRP HE3 1 1 16 14982 1 1 30 TRP HH2 H -1.874 -2.693 1.149 1.00 . A A . 30 TRP HH2 1 1 16 14983 1 1 30 TRP HZ2 H -3.762 -3.293 2.598 1.00 . A A . 30 TRP HZ2 1 1 16 14984 1 1 30 TRP HZ3 H -2.229 -1.948 -1.148 1.00 . A A . 30 TRP HZ3 1 1 16 14985 1 1 30 TRP N N -9.147 -3.937 -2.124 1.00 . A A . 30 TRP N 1 1 16 14986 1 1 30 TRP NE1 N -6.435 -3.128 1.622 1.00 . A A . 30 TRP NE1 1 1 16 14987 1 1 30 TRP O O -9.690 -1.758 -3.943 1.00 . A A . 30 TRP O 1 1 16 14988 1 1 31 LYS C C -10.700 1.348 -3.378 1.00 . A A . 31 LYS C 1 1 16 14989 1 1 31 LYS CA C -11.500 0.109 -2.986 1.00 . A A . 31 LYS CA 1 1 16 14990 1 1 31 LYS CB C -12.760 0.512 -2.218 1.00 . A A . 31 LYS CB 1 1 16 14991 1 1 31 LYS CD C -15.270 0.515 -2.115 1.00 . A A . 31 LYS CD 1 1 16 14992 1 1 31 LYS CE C -16.440 0.752 -3.063 1.00 . A A . 31 LYS CE 1 1 16 14993 1 1 31 LYS CG C -14.050 0.005 -2.854 1.00 . A A . 31 LYS CG 1 1 16 14994 1 1 31 LYS H H -10.760 -0.752 -1.198 1.00 . A A . 31 LYS H 1 1 16 14995 1 1 31 LYS HA H -11.790 -0.420 -3.882 1.00 . A A . 31 LYS HA 1 1 16 14996 1 1 31 LYS HB2 H -12.700 0.113 -1.217 1.00 . A A . 31 LYS HB2 1 1 16 14997 1 1 31 LYS HB3 H -12.810 1.589 -2.164 1.00 . A A . 31 LYS HB3 1 1 16 14998 1 1 31 LYS HD2 H -15.570 -0.217 -1.377 1.00 . A A . 31 LYS HD2 1 1 16 14999 1 1 31 LYS HD3 H -15.020 1.443 -1.623 1.00 . A A . 31 LYS HD3 1 1 16 15000 1 1 31 LYS HE2 H -16.260 0.207 -3.977 1.00 . A A . 31 LYS HE2 1 1 16 15001 1 1 31 LYS HE3 H -17.340 0.389 -2.599 1.00 . A A . 31 LYS HE3 1 1 16 15002 1 1 31 LYS HG2 H -14.090 0.345 -3.877 1.00 . A A . 31 LYS HG2 1 1 16 15003 1 1 31 LYS HG3 H -14.050 -1.074 -2.832 1.00 . A A . 31 LYS HG3 1 1 16 15004 1 1 31 LYS HZ1 H -16.400 2.776 -2.549 1.00 . A A . 31 LYS HZ1 1 1 16 15005 1 1 31 LYS HZ2 H -17.580 2.383 -3.690 1.00 . A A . 31 LYS HZ2 1 1 16 15006 1 1 31 LYS HZ3 H -15.960 2.468 -4.154 1.00 . A A . 31 LYS HZ3 1 1 16 15007 1 1 31 LYS N N -10.690 -0.788 -2.175 1.00 . A A . 31 LYS N 1 1 16 15008 1 1 31 LYS NZ N -16.610 2.196 -3.385 1.00 . A A . 31 LYS NZ 1 1 16 15009 1 1 31 LYS O O -9.481 1.370 -3.257 1.00 . A A . 31 LYS O 1 1 16 15010 1 1 32 GLU C C -9.758 4.097 -3.196 1.00 . A A . 32 GLU C 1 1 16 15011 1 1 32 GLU CA C -10.750 3.624 -4.256 1.00 . A A . 32 GLU CA 1 1 16 15012 1 1 32 GLU CB C -11.790 4.710 -4.516 1.00 . A A . 32 GLU CB 1 1 16 15013 1 1 32 GLU CD C -13.090 6.042 -6.224 1.00 . A A . 32 GLU CD 1 1 16 15014 1 1 32 GLU CG C -12.080 4.942 -5.991 1.00 . A A . 32 GLU CG 1 1 16 15015 1 1 32 GLU H H -12.370 2.307 -3.922 1.00 . A A . 32 GLU H 1 1 16 15016 1 1 32 GLU HA H -10.210 3.429 -5.173 1.00 . A A . 32 GLU HA 1 1 16 15017 1 1 32 GLU HB2 H -12.720 4.425 -4.034 1.00 . A A . 32 GLU HB2 1 1 16 15018 1 1 32 GLU HB3 H -11.450 5.639 -4.087 1.00 . A A . 32 GLU HB3 1 1 16 15019 1 1 32 GLU HG2 H -11.160 5.216 -6.482 1.00 . A A . 32 GLU HG2 1 1 16 15020 1 1 32 GLU HG3 H -12.450 4.026 -6.421 1.00 . A A . 32 GLU HG3 1 1 16 15021 1 1 32 GLU N N -11.400 2.381 -3.848 1.00 . A A . 32 GLU N 1 1 16 15022 1 1 32 GLU O O -8.765 4.752 -3.511 1.00 . A A . 32 GLU O 1 1 16 15023 1 1 32 GLU OE1 O -14.090 6.095 -5.476 1.00 . A A . 32 GLU OE1 1 1 16 15024 1 1 32 GLU OE2 O -12.890 6.848 -7.156 1.00 . A A . 32 GLU OE2 1 1 16 15025 1 1 33 VAL C C -8.907 2.953 0.089 1.00 . A A . 33 VAL C 1 1 16 15026 1 1 33 VAL CA C -9.164 4.138 -0.833 1.00 . A A . 33 VAL CA 1 1 16 15027 1 1 33 VAL CB C -9.775 5.289 -0.012 1.00 . A A . 33 VAL CB 1 1 16 15028 1 1 33 VAL CG1 C -8.778 5.802 1.014 1.00 . A A . 33 VAL CG1 1 1 16 15029 1 1 33 VAL CG2 C -10.230 6.413 -0.930 1.00 . A A . 33 VAL CG2 1 1 16 15030 1 1 33 VAL H H -10.830 3.230 -1.754 1.00 . A A . 33 VAL H 1 1 16 15031 1 1 33 VAL HA H -8.225 4.474 -1.246 1.00 . A A . 33 VAL HA 1 1 16 15032 1 1 33 VAL HB H -10.630 4.911 0.515 1.00 . A A . 33 VAL HB 1 1 16 15033 1 1 33 VAL HG11 H -8.904 6.868 1.138 1.00 . A A . 33 VAL HG11 1 1 16 15034 1 1 33 VAL HG12 H -7.774 5.596 0.675 1.00 . A A . 33 VAL HG12 1 1 16 15035 1 1 33 VAL HG13 H -8.948 5.307 1.959 1.00 . A A . 33 VAL HG13 1 1 16 15036 1 1 33 VAL HG21 H -9.443 6.655 -1.625 1.00 . A A . 33 VAL HG21 1 1 16 15037 1 1 33 VAL HG22 H -10.470 7.285 -0.339 1.00 . A A . 33 VAL HG22 1 1 16 15038 1 1 33 VAL HG23 H -11.100 6.098 -1.477 1.00 . A A . 33 VAL HG23 1 1 16 15039 1 1 33 VAL N N -10.030 3.756 -1.941 1.00 . A A . 33 VAL N 1 1 16 15040 1 1 33 VAL O O -9.844 2.329 0.588 1.00 . A A . 33 VAL O 1 1 16 15041 1 1 34 ILE C C -7.698 1.775 2.618 1.00 . A A . 34 ILE C 1 1 16 15042 1 1 34 ILE CA C -7.260 1.527 1.176 1.00 . A A . 34 ILE CA 1 1 16 15043 1 1 34 ILE CB C -5.742 1.271 1.149 1.00 . A A . 34 ILE CB 1 1 16 15044 1 1 34 ILE CD1 C -3.488 2.299 1.723 1.00 . A A . 34 ILE CD1 1 1 16 15045 1 1 34 ILE CG1 C -4.979 2.519 1.595 1.00 . A A . 34 ILE CG1 1 1 16 15046 1 1 34 ILE CG2 C -5.303 0.845 -0.244 1.00 . A A . 34 ILE CG2 1 1 16 15047 1 1 34 ILE H H -6.928 3.176 -0.113 1.00 . A A . 34 ILE H 1 1 16 15048 1 1 34 ILE HA H -7.760 0.642 0.809 1.00 . A A . 34 ILE HA 1 1 16 15049 1 1 34 ILE HB H -5.524 0.462 1.830 1.00 . A A . 34 ILE HB 1 1 16 15050 1 1 34 ILE HD11 H -3.279 1.785 2.649 1.00 . A A . 34 ILE HD11 1 1 16 15051 1 1 34 ILE HD12 H -2.981 3.252 1.718 1.00 . A A . 34 ILE HD12 1 1 16 15052 1 1 34 ILE HD13 H -3.140 1.702 0.893 1.00 . A A . 34 ILE HD13 1 1 16 15053 1 1 34 ILE HG12 H -5.137 3.307 0.874 1.00 . A A . 34 ILE HG12 1 1 16 15054 1 1 34 ILE HG13 H -5.354 2.838 2.557 1.00 . A A . 34 ILE HG13 1 1 16 15055 1 1 34 ILE HG21 H -5.966 0.076 -0.610 1.00 . A A . 34 ILE HG21 1 1 16 15056 1 1 34 ILE HG22 H -4.294 0.461 -0.201 1.00 . A A . 34 ILE HG22 1 1 16 15057 1 1 34 ILE HG23 H -5.336 1.697 -0.908 1.00 . A A . 34 ILE HG23 1 1 16 15058 1 1 34 ILE N N -7.633 2.643 0.313 1.00 . A A . 34 ILE N 1 1 16 15059 1 1 34 ILE O O -7.918 2.917 3.021 1.00 . A A . 34 ILE O 1 1 16 15060 1 1 35 PRO C C -7.430 1.821 5.600 1.00 . A A . 35 PRO C 1 1 16 15061 1 1 35 PRO CA C -8.251 0.803 4.817 1.00 . A A . 35 PRO CA 1 1 16 15062 1 1 35 PRO CB C -8.015 -0.607 5.360 1.00 . A A . 35 PRO CB 1 1 16 15063 1 1 35 PRO CD C -7.596 -0.699 3.011 1.00 . A A . 35 PRO CD 1 1 16 15064 1 1 35 PRO CG C -8.135 -1.492 4.169 1.00 . A A . 35 PRO CG 1 1 16 15065 1 1 35 PRO HA H -9.300 1.051 4.898 1.00 . A A . 35 PRO HA 1 1 16 15066 1 1 35 PRO HB2 H -7.031 -0.666 5.801 1.00 . A A . 35 PRO HB2 1 1 16 15067 1 1 35 PRO HB3 H -8.764 -0.842 6.101 1.00 . A A . 35 PRO HB3 1 1 16 15068 1 1 35 PRO HD2 H -6.540 -0.888 2.880 1.00 . A A . 35 PRO HD2 1 1 16 15069 1 1 35 PRO HD3 H -8.138 -0.935 2.106 1.00 . A A . 35 PRO HD3 1 1 16 15070 1 1 35 PRO HG2 H -7.549 -2.387 4.315 1.00 . A A . 35 PRO HG2 1 1 16 15071 1 1 35 PRO HG3 H -9.171 -1.743 4.000 1.00 . A A . 35 PRO HG3 1 1 16 15072 1 1 35 PRO N N -7.834 0.700 3.414 1.00 . A A . 35 PRO N 1 1 16 15073 1 1 35 PRO O O -6.403 2.307 5.123 1.00 . A A . 35 PRO O 1 1 16 15074 1 1 36 GLU C C -5.863 2.569 8.135 1.00 . A A . 36 GLU C 1 1 16 15075 1 1 36 GLU CA C -7.212 3.104 7.659 1.00 . A A . 36 GLU CA 1 1 16 15076 1 1 36 GLU CB C -8.087 3.442 8.867 1.00 . A A . 36 GLU CB 1 1 16 15077 1 1 36 GLU CD C -9.191 5.378 10.053 1.00 . A A . 36 GLU CD 1 1 16 15078 1 1 36 GLU CG C -7.955 4.883 9.329 1.00 . A A . 36 GLU CG 1 1 16 15079 1 1 36 GLU H H -8.717 1.721 7.123 1.00 . A A . 36 GLU H 1 1 16 15080 1 1 36 GLU HA H -7.047 4.002 7.084 1.00 . A A . 36 GLU HA 1 1 16 15081 1 1 36 GLU HB2 H -9.121 3.264 8.609 1.00 . A A . 36 GLU HB2 1 1 16 15082 1 1 36 GLU HB3 H -7.813 2.796 9.688 1.00 . A A . 36 GLU HB3 1 1 16 15083 1 1 36 GLU HG2 H -7.111 4.955 10.000 1.00 . A A . 36 GLU HG2 1 1 16 15084 1 1 36 GLU HG3 H -7.785 5.509 8.468 1.00 . A A . 36 GLU HG3 1 1 16 15085 1 1 36 GLU N N -7.892 2.141 6.802 1.00 . A A . 36 GLU N 1 1 16 15086 1 1 36 GLU O O -4.822 3.180 7.891 1.00 . A A . 36 GLU O 1 1 16 15087 1 1 36 GLU OE1 O -10.260 5.433 9.422 1.00 . A A . 36 GLU OE1 1 1 16 15088 1 1 36 GLU OE2 O -9.085 5.712 11.253 1.00 . A A . 36 GLU OE2 1 1 16 15089 1 1 37 LYS C C -3.749 0.354 8.225 1.00 . A A . 37 LYS C 1 1 16 15090 1 1 37 LYS CA C -4.674 0.823 9.346 1.00 . A A . 37 LYS CA 1 1 16 15091 1 1 37 LYS CB C -5.023 -0.355 10.259 1.00 . A A . 37 LYS CB 1 1 16 15092 1 1 37 LYS CD C -6.532 -0.437 12.270 1.00 . A A . 37 LYS CD 1 1 16 15093 1 1 37 LYS CE C -6.996 0.431 13.429 1.00 . A A . 37 LYS CE 1 1 16 15094 1 1 37 LYS CG C -5.197 0.038 11.719 1.00 . A A . 37 LYS CG 1 1 16 15095 1 1 37 LYS H H -6.755 0.999 8.992 1.00 . A A . 37 LYS H 1 1 16 15096 1 1 37 LYS HA H -4.156 1.571 9.925 1.00 . A A . 37 LYS HA 1 1 16 15097 1 1 37 LYS HB2 H -5.944 -0.802 9.915 1.00 . A A . 37 LYS HB2 1 1 16 15098 1 1 37 LYS HB3 H -4.234 -1.089 10.199 1.00 . A A . 37 LYS HB3 1 1 16 15099 1 1 37 LYS HD2 H -7.272 -0.395 11.485 1.00 . A A . 37 LYS HD2 1 1 16 15100 1 1 37 LYS HD3 H -6.427 -1.455 12.615 1.00 . A A . 37 LYS HD3 1 1 16 15101 1 1 37 LYS HE2 H -6.404 0.194 14.300 1.00 . A A . 37 LYS HE2 1 1 16 15102 1 1 37 LYS HE3 H -6.849 1.469 13.166 1.00 . A A . 37 LYS HE3 1 1 16 15103 1 1 37 LYS HG2 H -4.403 -0.407 12.297 1.00 . A A . 37 LYS HG2 1 1 16 15104 1 1 37 LYS HG3 H -5.146 1.114 11.800 1.00 . A A . 37 LYS HG3 1 1 16 15105 1 1 37 LYS HZ1 H -9.018 0.932 13.277 1.00 . A A . 37 LYS HZ1 1 1 16 15106 1 1 37 LYS HZ2 H -8.586 0.274 14.775 1.00 . A A . 37 LYS HZ2 1 1 16 15107 1 1 37 LYS HZ3 H -8.732 -0.731 13.422 1.00 . A A . 37 LYS HZ3 1 1 16 15108 1 1 37 LYS N N -5.893 1.434 8.823 1.00 . A A . 37 LYS N 1 1 16 15109 1 1 37 LYS NZ N -8.433 0.211 13.748 1.00 . A A . 37 LYS NZ 1 1 16 15110 1 1 37 LYS O O -2.572 0.086 8.459 1.00 . A A . 37 LYS O 1 1 16 15111 1 1 38 ASP C C -2.626 0.967 5.344 1.00 . A A . 38 ASP C 1 1 16 15112 1 1 38 ASP CA C -3.478 -0.180 5.874 1.00 . A A . 38 ASP CA 1 1 16 15113 1 1 38 ASP CB C -4.379 -0.721 4.761 1.00 . A A . 38 ASP CB 1 1 16 15114 1 1 38 ASP CG C -4.583 -2.222 4.857 1.00 . A A . 38 ASP CG 1 1 16 15115 1 1 38 ASP H H -5.222 0.483 6.873 1.00 . A A . 38 ASP H 1 1 16 15116 1 1 38 ASP HA H -2.825 -0.969 6.214 1.00 . A A . 38 ASP HA 1 1 16 15117 1 1 38 ASP HB2 H -5.345 -0.242 4.824 1.00 . A A . 38 ASP HB2 1 1 16 15118 1 1 38 ASP HB3 H -3.932 -0.496 3.803 1.00 . A A . 38 ASP HB3 1 1 16 15119 1 1 38 ASP N N -4.278 0.257 7.009 1.00 . A A . 38 ASP N 1 1 16 15120 1 1 38 ASP O O -1.408 0.840 5.213 1.00 . A A . 38 ASP O 1 1 16 15121 1 1 38 ASP OD1 O -3.955 -2.852 5.732 1.00 . A A . 38 ASP OD1 1 1 16 15122 1 1 38 ASP OD2 O -5.370 -2.764 4.053 1.00 . A A . 38 ASP OD2 1 1 16 15123 1 1 39 ALA C C -1.560 3.773 5.571 1.00 . A A . 39 ALA C 1 1 16 15124 1 1 39 ALA CA C -2.568 3.260 4.546 1.00 . A A . 39 ALA CA 1 1 16 15125 1 1 39 ALA CB C -3.561 4.355 4.181 1.00 . A A . 39 ALA CB 1 1 16 15126 1 1 39 ALA H H -4.242 2.133 5.182 1.00 . A A . 39 ALA H 1 1 16 15127 1 1 39 ALA HA H -2.039 2.971 3.649 1.00 . A A . 39 ALA HA 1 1 16 15128 1 1 39 ALA HB1 H -3.309 5.263 4.705 1.00 . A A . 39 ALA HB1 1 1 16 15129 1 1 39 ALA HB2 H -4.558 4.044 4.461 1.00 . A A . 39 ALA HB2 1 1 16 15130 1 1 39 ALA HB3 H -3.526 4.532 3.116 1.00 . A A . 39 ALA HB3 1 1 16 15131 1 1 39 ALA N N -3.271 2.089 5.050 1.00 . A A . 39 ALA N 1 1 16 15132 1 1 39 ALA O O -0.604 4.465 5.222 1.00 . A A . 39 ALA O 1 1 16 15133 1 1 40 TYR C C 0.427 3.099 7.867 1.00 . A A . 40 TYR C 1 1 16 15134 1 1 40 TYR CA C -0.896 3.858 7.913 1.00 . A A . 40 TYR CA 1 1 16 15135 1 1 40 TYR CB C -1.575 3.648 9.266 1.00 . A A . 40 TYR CB 1 1 16 15136 1 1 40 TYR CD1 C -0.412 5.346 10.725 1.00 . A A . 40 TYR CD1 1 1 16 15137 1 1 40 TYR CD2 C -0.174 3.038 11.272 1.00 . A A . 40 TYR CD2 1 1 16 15138 1 1 40 TYR CE1 C 0.387 5.688 11.799 1.00 . A A . 40 TYR CE1 1 1 16 15139 1 1 40 TYR CE2 C 0.624 3.372 12.351 1.00 . A A . 40 TYR CE2 1 1 16 15140 1 1 40 TYR CG C -0.705 4.018 10.444 1.00 . A A . 40 TYR CG 1 1 16 15141 1 1 40 TYR CZ C 0.902 4.699 12.609 1.00 . A A . 40 TYR CZ 1 1 16 15142 1 1 40 TYR H H -2.564 2.878 7.058 1.00 . A A . 40 TYR H 1 1 16 15143 1 1 40 TYR HA H -0.697 4.910 7.779 1.00 . A A . 40 TYR HA 1 1 16 15144 1 1 40 TYR HB2 H -2.469 4.257 9.312 1.00 . A A . 40 TYR HB2 1 1 16 15145 1 1 40 TYR HB3 H -1.847 2.605 9.367 1.00 . A A . 40 TYR HB3 1 1 16 15146 1 1 40 TYR HD1 H -0.816 6.118 10.089 1.00 . A A . 40 TYR HD1 1 1 16 15147 1 1 40 TYR HD2 H -0.393 1.999 11.065 1.00 . A A . 40 TYR HD2 1 1 16 15148 1 1 40 TYR HE1 H 0.602 6.727 12.000 1.00 . A A . 40 TYR HE1 1 1 16 15149 1 1 40 TYR HE2 H 1.028 2.596 12.985 1.00 . A A . 40 TYR HE2 1 1 16 15150 1 1 40 TYR HH H 2.530 4.567 13.622 1.00 . A A . 40 TYR HH 1 1 16 15151 1 1 40 TYR N N -1.782 3.430 6.838 1.00 . A A . 40 TYR N 1 1 16 15152 1 1 40 TYR O O 1.487 3.689 7.664 1.00 . A A . 40 TYR O 1 1 16 15153 1 1 40 TYR OH O 1.695 5.037 13.681 1.00 . A A . 40 TYR OH 1 1 16 15154 1 1 41 ARG C C 2.305 1.073 6.728 1.00 . A A . 41 ARG C 1 1 16 15155 1 1 41 ARG CA C 1.544 0.942 8.047 1.00 . A A . 41 ARG CA 1 1 16 15156 1 1 41 ARG CB C 1.155 -0.520 8.279 1.00 . A A . 41 ARG CB 1 1 16 15157 1 1 41 ARG CD C -0.326 -2.092 9.567 1.00 . A A . 41 ARG CD 1 1 16 15158 1 1 41 ARG CG C 0.388 -0.749 9.573 1.00 . A A . 41 ARG CG 1 1 16 15159 1 1 41 ARG CZ C 0.120 -3.072 11.783 1.00 . A A . 41 ARG CZ 1 1 16 15160 1 1 41 ARG H H -0.521 1.374 8.221 1.00 . A A . 41 ARG H 1 1 16 15161 1 1 41 ARG HA H 2.186 1.263 8.852 1.00 . A A . 41 ARG HA 1 1 16 15162 1 1 41 ARG HB2 H 0.539 -0.850 7.458 1.00 . A A . 41 ARG HB2 1 1 16 15163 1 1 41 ARG HB3 H 2.053 -1.119 8.307 1.00 . A A . 41 ARG HB3 1 1 16 15164 1 1 41 ARG HD2 H -1.349 -1.943 9.879 1.00 . A A . 41 ARG HD2 1 1 16 15165 1 1 41 ARG HD3 H -0.312 -2.489 8.563 1.00 . A A . 41 ARG HD3 1 1 16 15166 1 1 41 ARG HE H 0.904 -3.721 10.066 1.00 . A A . 41 ARG HE 1 1 16 15167 1 1 41 ARG HG2 H 1.083 -0.726 10.399 1.00 . A A . 41 ARG HG2 1 1 16 15168 1 1 41 ARG HG3 H -0.343 0.038 9.691 1.00 . A A . 41 ARG HG3 1 1 16 15169 1 1 41 ARG HH11 H -1.143 -1.494 11.805 1.00 . A A . 41 ARG HH11 1 1 16 15170 1 1 41 ARG HH12 H -0.814 -2.203 13.351 1.00 . A A . 41 ARG HH12 1 1 16 15171 1 1 41 ARG HH21 H 1.336 -4.655 12.097 1.00 . A A . 41 ARG HH21 1 1 16 15172 1 1 41 ARG HH22 H 0.593 -3.997 13.516 1.00 . A A . 41 ARG HH22 1 1 16 15173 1 1 41 ARG N N 0.355 1.786 8.062 1.00 . A A . 41 ARG N 1 1 16 15174 1 1 41 ARG NE N 0.307 -3.053 10.466 1.00 . A A . 41 ARG NE 1 1 16 15175 1 1 41 ARG NH1 N -0.679 -2.183 12.360 1.00 . A A . 41 ARG NH1 1 1 16 15176 1 1 41 ARG NH2 N 0.734 -3.984 12.527 1.00 . A A . 41 ARG NH2 1 1 16 15177 1 1 41 ARG O O 3.492 0.759 6.652 1.00 . A A . 41 ARG O 1 1 16 15178 1 1 42 LEU C C 3.321 2.745 4.388 1.00 . A A . 42 LEU C 1 1 16 15179 1 1 42 LEU CA C 2.220 1.688 4.372 1.00 . A A . 42 LEU CA 1 1 16 15180 1 1 42 LEU CB C 1.156 2.061 3.338 1.00 . A A . 42 LEU CB 1 1 16 15181 1 1 42 LEU CD1 C -0.645 1.365 1.740 1.00 . A A . 42 LEU CD1 1 1 16 15182 1 1 42 LEU CD2 C 1.412 -0.034 1.990 1.00 . A A . 42 LEU CD2 1 1 16 15183 1 1 42 LEU CG C 0.425 0.878 2.704 1.00 . A A . 42 LEU CG 1 1 16 15184 1 1 42 LEU H H 0.665 1.755 5.805 1.00 . A A . 42 LEU H 1 1 16 15185 1 1 42 LEU HA H 2.657 0.741 4.097 1.00 . A A . 42 LEU HA 1 1 16 15186 1 1 42 LEU HB2 H 0.424 2.695 3.819 1.00 . A A . 42 LEU HB2 1 1 16 15187 1 1 42 LEU HB3 H 1.633 2.625 2.550 1.00 . A A . 42 LEU HB3 1 1 16 15188 1 1 42 LEU HD11 H -0.224 1.454 0.749 1.00 . A A . 42 LEU HD11 1 1 16 15189 1 1 42 LEU HD12 H -1.008 2.330 2.064 1.00 . A A . 42 LEU HD12 1 1 16 15190 1 1 42 LEU HD13 H -1.462 0.659 1.722 1.00 . A A . 42 LEU HD13 1 1 16 15191 1 1 42 LEU HD21 H 2.271 0.541 1.675 1.00 . A A . 42 LEU HD21 1 1 16 15192 1 1 42 LEU HD22 H 0.937 -0.473 1.126 1.00 . A A . 42 LEU HD22 1 1 16 15193 1 1 42 LEU HD23 H 1.731 -0.817 2.661 1.00 . A A . 42 LEU HD23 1 1 16 15194 1 1 42 LEU HG H -0.060 0.304 3.480 1.00 . A A . 42 LEU HG 1 1 16 15195 1 1 42 LEU N N 1.611 1.528 5.688 1.00 . A A . 42 LEU N 1 1 16 15196 1 1 42 LEU O O 4.367 2.572 3.763 1.00 . A A . 42 LEU O 1 1 16 15197 1 1 43 GLU C C 5.412 4.396 5.664 1.00 . A A . 43 GLU C 1 1 16 15198 1 1 43 GLU CA C 4.060 4.919 5.181 1.00 . A A . 43 GLU CA 1 1 16 15199 1 1 43 GLU CB C 3.560 6.017 6.124 1.00 . A A . 43 GLU CB 1 1 16 15200 1 1 43 GLU CD C 3.791 8.404 6.913 1.00 . A A . 43 GLU CD 1 1 16 15201 1 1 43 GLU CG C 4.298 7.335 5.965 1.00 . A A . 43 GLU CG 1 1 16 15202 1 1 43 GLU H H 2.230 3.929 5.573 1.00 . A A . 43 GLU H 1 1 16 15203 1 1 43 GLU HA H 4.181 5.333 4.193 1.00 . A A . 43 GLU HA 1 1 16 15204 1 1 43 GLU HB2 H 2.511 6.190 5.930 1.00 . A A . 43 GLU HB2 1 1 16 15205 1 1 43 GLU HB3 H 3.679 5.681 7.144 1.00 . A A . 43 GLU HB3 1 1 16 15206 1 1 43 GLU HG2 H 5.347 7.172 6.161 1.00 . A A . 43 GLU HG2 1 1 16 15207 1 1 43 GLU HG3 H 4.172 7.685 4.951 1.00 . A A . 43 GLU HG3 1 1 16 15208 1 1 43 GLU N N 3.082 3.841 5.098 1.00 . A A . 43 GLU N 1 1 16 15209 1 1 43 GLU O O 6.442 4.639 5.040 1.00 . A A . 43 GLU O 1 1 16 15210 1 1 43 GLU OE1 O 2.750 9.025 6.608 1.00 . A A . 43 GLU OE1 1 1 16 15211 1 1 43 GLU OE2 O 4.435 8.623 7.960 1.00 . A A . 43 GLU OE2 1 1 16 15212 1 1 44 ILE C C 7.342 2.195 6.404 1.00 . A A . 44 ILE C 1 1 16 15213 1 1 44 ILE CA C 6.613 3.133 7.365 1.00 . A A . 44 ILE CA 1 1 16 15214 1 1 44 ILE CB C 6.305 2.377 8.666 1.00 . A A . 44 ILE CB 1 1 16 15215 1 1 44 ILE CD1 C 3.952 2.894 9.469 1.00 . A A . 44 ILE CD1 1 1 16 15216 1 1 44 ILE CG1 C 5.419 3.231 9.572 1.00 . A A . 44 ILE CG1 1 1 16 15217 1 1 44 ILE CG2 C 7.595 1.997 9.378 1.00 . A A . 44 ILE CG2 1 1 16 15218 1 1 44 ILE H H 4.544 3.532 7.242 1.00 . A A . 44 ILE H 1 1 16 15219 1 1 44 ILE HA H 7.263 3.959 7.608 1.00 . A A . 44 ILE HA 1 1 16 15220 1 1 44 ILE HB H 5.781 1.468 8.414 1.00 . A A . 44 ILE HB 1 1 16 15221 1 1 44 ILE HD11 H 3.375 3.805 9.423 1.00 . A A . 44 ILE HD11 1 1 16 15222 1 1 44 ILE HD12 H 3.651 2.319 10.333 1.00 . A A . 44 ILE HD12 1 1 16 15223 1 1 44 ILE HD13 H 3.781 2.315 8.574 1.00 . A A . 44 ILE HD13 1 1 16 15224 1 1 44 ILE HG12 H 5.718 3.091 10.593 1.00 . A A . 44 ILE HG12 1 1 16 15225 1 1 44 ILE HG13 H 5.540 4.272 9.306 1.00 . A A . 44 ILE HG13 1 1 16 15226 1 1 44 ILE HG21 H 8.258 2.850 9.402 1.00 . A A . 44 ILE HG21 1 1 16 15227 1 1 44 ILE HG22 H 8.072 1.185 8.849 1.00 . A A . 44 ILE HG22 1 1 16 15228 1 1 44 ILE HG23 H 7.372 1.686 10.387 1.00 . A A . 44 ILE HG23 1 1 16 15229 1 1 44 ILE N N 5.396 3.684 6.784 1.00 . A A . 44 ILE N 1 1 16 15230 1 1 44 ILE O O 8.558 2.297 6.234 1.00 . A A . 44 ILE O 1 1 16 15231 1 1 45 VAL C C 7.798 1.015 3.643 1.00 . A A . 45 VAL C 1 1 16 15232 1 1 45 VAL CA C 7.207 0.318 4.861 1.00 . A A . 45 VAL CA 1 1 16 15233 1 1 45 VAL CB C 6.192 -0.734 4.382 1.00 . A A . 45 VAL CB 1 1 16 15234 1 1 45 VAL CG1 C 5.864 -1.711 5.500 1.00 . A A . 45 VAL CG1 1 1 16 15235 1 1 45 VAL CG2 C 4.932 -0.067 3.860 1.00 . A A . 45 VAL CG2 1 1 16 15236 1 1 45 VAL H H 5.641 1.230 5.965 1.00 . A A . 45 VAL H 1 1 16 15237 1 1 45 VAL HA H 7.999 -0.194 5.386 1.00 . A A . 45 VAL HA 1 1 16 15238 1 1 45 VAL HB H 6.641 -1.286 3.571 1.00 . A A . 45 VAL HB 1 1 16 15239 1 1 45 VAL HG11 H 4.822 -1.990 5.441 1.00 . A A . 45 VAL HG11 1 1 16 15240 1 1 45 VAL HG12 H 6.059 -1.246 6.454 1.00 . A A . 45 VAL HG12 1 1 16 15241 1 1 45 VAL HG13 H 6.478 -2.594 5.399 1.00 . A A . 45 VAL HG13 1 1 16 15242 1 1 45 VAL HG21 H 5.188 0.603 3.052 1.00 . A A . 45 VAL HG21 1 1 16 15243 1 1 45 VAL HG22 H 4.463 0.491 4.655 1.00 . A A . 45 VAL HG22 1 1 16 15244 1 1 45 VAL HG23 H 4.249 -0.821 3.497 1.00 . A A . 45 VAL HG23 1 1 16 15245 1 1 45 VAL N N 6.606 1.274 5.787 1.00 . A A . 45 VAL N 1 1 16 15246 1 1 45 VAL O O 8.878 0.658 3.171 1.00 . A A . 45 VAL O 1 1 16 15247 1 1 46 THR C C 8.562 3.810 2.319 1.00 . A A . 46 THR C 1 1 16 15248 1 1 46 THR CA C 7.518 2.750 1.960 1.00 . A A . 46 THR CA 1 1 16 15249 1 1 46 THR CB C 6.313 3.410 1.295 1.00 . A A . 46 THR CB 1 1 16 15250 1 1 46 THR CG2 C 5.244 2.422 0.876 1.00 . A A . 46 THR CG2 1 1 16 15251 1 1 46 THR H H 6.223 2.235 3.541 1.00 . A A . 46 THR H 1 1 16 15252 1 1 46 THR HA H 7.959 2.049 1.267 1.00 . A A . 46 THR HA 1 1 16 15253 1 1 46 THR HB H 6.646 3.928 0.414 1.00 . A A . 46 THR HB 1 1 16 15254 1 1 46 THR HG1 H 5.308 3.893 2.904 1.00 . A A . 46 THR HG1 1 1 16 15255 1 1 46 THR HG21 H 4.365 2.564 1.488 1.00 . A A . 46 THR HG21 1 1 16 15256 1 1 46 THR HG22 H 5.615 1.416 1.005 1.00 . A A . 46 THR HG22 1 1 16 15257 1 1 46 THR HG23 H 4.992 2.584 -0.162 1.00 . A A . 46 THR HG23 1 1 16 15258 1 1 46 THR N N 7.078 2.005 3.130 1.00 . A A . 46 THR N 1 1 16 15259 1 1 46 THR O O 8.953 4.612 1.470 1.00 . A A . 46 THR O 1 1 16 15260 1 1 46 THR OG1 O 5.711 4.351 2.164 1.00 . A A . 46 THR OG1 1 1 16 15261 1 1 47 ALA C C 9.470 6.204 3.948 1.00 . A A . 47 ALA C 1 1 16 15262 1 1 47 ALA CA C 10.009 4.780 4.022 1.00 . A A . 47 ALA CA 1 1 16 15263 1 1 47 ALA CB C 11.282 4.653 3.197 1.00 . A A . 47 ALA CB 1 1 16 15264 1 1 47 ALA H H 8.669 3.157 4.209 1.00 . A A . 47 ALA H 1 1 16 15265 1 1 47 ALA HA H 10.252 4.553 5.051 1.00 . A A . 47 ALA HA 1 1 16 15266 1 1 47 ALA HB1 H 11.036 4.288 2.211 1.00 . A A . 47 ALA HB1 1 1 16 15267 1 1 47 ALA HB2 H 11.955 3.960 3.680 1.00 . A A . 47 ALA HB2 1 1 16 15268 1 1 47 ALA HB3 H 11.756 5.619 3.115 1.00 . A A . 47 ALA HB3 1 1 16 15269 1 1 47 ALA N N 9.012 3.815 3.572 1.00 . A A . 47 ALA N 1 1 16 15270 1 1 47 ALA O O 10.207 7.145 3.649 1.00 . A A . 47 ALA O 1 1 16 15271 1 1 48 GLY C C 7.300 8.147 2.770 1.00 . A A . 48 GLY C 1 1 16 15272 1 1 48 GLY CA C 7.563 7.669 4.184 1.00 . A A . 48 GLY CA 1 1 16 15273 1 1 48 GLY H H 7.642 5.571 4.455 1.00 . A A . 48 GLY H 1 1 16 15274 1 1 48 GLY HA2 H 6.625 7.629 4.718 1.00 . A A . 48 GLY HA2 1 1 16 15275 1 1 48 GLY HA3 H 8.215 8.375 4.675 1.00 . A A . 48 GLY HA3 1 1 16 15276 1 1 48 GLY N N 8.179 6.356 4.223 1.00 . A A . 48 GLY N 1 1 16 15277 1 1 48 GLY O O 7.248 9.351 2.515 1.00 . A A . 48 GLY O 1 1 16 15278 1 1 49 ALA C C 5.581 8.348 0.320 1.00 . A A . 49 ALA C 1 1 16 15279 1 1 49 ALA CA C 6.868 7.542 0.453 1.00 . A A . 49 ALA CA 1 1 16 15280 1 1 49 ALA CB C 6.792 6.278 -0.389 1.00 . A A . 49 ALA CB 1 1 16 15281 1 1 49 ALA H H 7.180 6.263 2.111 1.00 . A A . 49 ALA H 1 1 16 15282 1 1 49 ALA HA H 7.693 8.139 0.093 1.00 . A A . 49 ALA HA 1 1 16 15283 1 1 49 ALA HB1 H 7.665 5.669 -0.206 1.00 . A A . 49 ALA HB1 1 1 16 15284 1 1 49 ALA HB2 H 6.752 6.545 -1.435 1.00 . A A . 49 ALA HB2 1 1 16 15285 1 1 49 ALA HB3 H 5.905 5.722 -0.126 1.00 . A A . 49 ALA HB3 1 1 16 15286 1 1 49 ALA N N 7.130 7.205 1.847 1.00 . A A . 49 ALA N 1 1 16 15287 1 1 49 ALA O O 5.583 9.460 -0.210 1.00 . A A . 49 ALA O 1 1 16 15288 1 1 50 LEU C C 2.876 9.134 2.079 1.00 . A A . 50 LEU C 1 1 16 15289 1 1 50 LEU CA C 3.187 8.452 0.752 1.00 . A A . 50 LEU CA 1 1 16 15290 1 1 50 LEU CB C 2.085 7.447 0.406 1.00 . A A . 50 LEU CB 1 1 16 15291 1 1 50 LEU CD1 C 1.831 5.438 -1.076 1.00 . A A . 50 LEU CD1 1 1 16 15292 1 1 50 LEU CD2 C 1.093 7.686 -1.887 1.00 . A A . 50 LEU CD2 1 1 16 15293 1 1 50 LEU CG C 2.107 6.933 -1.037 1.00 . A A . 50 LEU CG 1 1 16 15294 1 1 50 LEU H H 4.544 6.897 1.223 1.00 . A A . 50 LEU H 1 1 16 15295 1 1 50 LEU HA H 3.235 9.202 -0.023 1.00 . A A . 50 LEU HA 1 1 16 15296 1 1 50 LEU HB2 H 2.179 6.601 1.071 1.00 . A A . 50 LEU HB2 1 1 16 15297 1 1 50 LEU HB3 H 1.129 7.918 0.583 1.00 . A A . 50 LEU HB3 1 1 16 15298 1 1 50 LEU HD11 H 2.199 5.029 -2.006 1.00 . A A . 50 LEU HD11 1 1 16 15299 1 1 50 LEU HD12 H 0.767 5.265 -1.004 1.00 . A A . 50 LEU HD12 1 1 16 15300 1 1 50 LEU HD13 H 2.331 4.957 -0.248 1.00 . A A . 50 LEU HD13 1 1 16 15301 1 1 50 LEU HD21 H 0.187 7.104 -1.967 1.00 . A A . 50 LEU HD21 1 1 16 15302 1 1 50 LEU HD22 H 1.504 7.851 -2.872 1.00 . A A . 50 LEU HD22 1 1 16 15303 1 1 50 LEU HD23 H 0.871 8.636 -1.425 1.00 . A A . 50 LEU HD23 1 1 16 15304 1 1 50 LEU HG H 3.087 7.103 -1.456 1.00 . A A . 50 LEU HG 1 1 16 15305 1 1 50 LEU N N 4.482 7.784 0.809 1.00 . A A . 50 LEU N 1 1 16 15306 1 1 50 LEU O O 3.236 8.633 3.145 1.00 . A A . 50 LEU O 1 1 16 15307 1 1 51 LYS C C 0.417 10.760 3.632 1.00 . A A . 51 LYS C 1 1 16 15308 1 1 51 LYS CA C 1.859 11.032 3.212 1.00 . A A . 51 LYS CA 1 1 16 15309 1 1 51 LYS CB C 2.058 12.531 2.980 1.00 . A A . 51 LYS CB 1 1 16 15310 1 1 51 LYS CD C 1.845 14.194 1.110 1.00 . A A . 51 LYS CD 1 1 16 15311 1 1 51 LYS CE C 1.461 15.581 1.599 1.00 . A A . 51 LYS CE 1 1 16 15312 1 1 51 LYS CG C 1.146 13.108 1.910 1.00 . A A . 51 LYS CG 1 1 16 15313 1 1 51 LYS H H 1.952 10.636 1.135 1.00 . A A . 51 LYS H 1 1 16 15314 1 1 51 LYS HA H 2.517 10.712 4.006 1.00 . A A . 51 LYS HA 1 1 16 15315 1 1 51 LYS HB2 H 1.869 13.056 3.906 1.00 . A A . 51 LYS HB2 1 1 16 15316 1 1 51 LYS HB3 H 3.082 12.704 2.682 1.00 . A A . 51 LYS HB3 1 1 16 15317 1 1 51 LYS HD2 H 2.912 14.072 1.208 1.00 . A A . 51 LYS HD2 1 1 16 15318 1 1 51 LYS HD3 H 1.563 14.098 0.070 1.00 . A A . 51 LYS HD3 1 1 16 15319 1 1 51 LYS HE2 H 1.808 16.311 0.884 1.00 . A A . 51 LYS HE2 1 1 16 15320 1 1 51 LYS HE3 H 0.384 15.637 1.675 1.00 . A A . 51 LYS HE3 1 1 16 15321 1 1 51 LYS HG2 H 0.847 12.316 1.241 1.00 . A A . 51 LYS HG2 1 1 16 15322 1 1 51 LYS HG3 H 0.272 13.528 2.385 1.00 . A A . 51 LYS HG3 1 1 16 15323 1 1 51 LYS HZ1 H 2.939 16.423 2.810 1.00 . A A . 51 LYS HZ1 1 1 16 15324 1 1 51 LYS HZ2 H 2.268 15.002 3.436 1.00 . A A . 51 LYS HZ2 1 1 16 15325 1 1 51 LYS HZ3 H 1.393 16.448 3.498 1.00 . A A . 51 LYS HZ3 1 1 16 15326 1 1 51 LYS N N 2.209 10.283 2.011 1.00 . A A . 51 LYS N 1 1 16 15327 1 1 51 LYS NZ N 2.057 15.885 2.929 1.00 . A A . 51 LYS NZ 1 1 16 15328 1 1 51 LYS O O -0.526 11.149 2.943 1.00 . A A . 51 LYS O 1 1 16 15329 1 1 52 TYR C C -1.806 11.034 5.722 1.00 . A A . 52 TYR C 1 1 16 15330 1 1 52 TYR CA C -1.068 9.771 5.289 1.00 . A A . 52 TYR CA 1 1 16 15331 1 1 52 TYR CB C -0.950 8.808 6.472 1.00 . A A . 52 TYR CB 1 1 16 15332 1 1 52 TYR CD1 C -3.375 8.781 7.194 1.00 . A A . 52 TYR CD1 1 1 16 15333 1 1 52 TYR CD2 C -2.305 6.698 6.753 1.00 . A A . 52 TYR CD2 1 1 16 15334 1 1 52 TYR CE1 C -4.544 8.118 7.512 1.00 . A A . 52 TYR CE1 1 1 16 15335 1 1 52 TYR CE2 C -3.473 6.028 7.068 1.00 . A A . 52 TYR CE2 1 1 16 15336 1 1 52 TYR CG C -2.236 8.083 6.810 1.00 . A A . 52 TYR CG 1 1 16 15337 1 1 52 TYR CZ C -4.588 6.742 7.447 1.00 . A A . 52 TYR CZ 1 1 16 15338 1 1 52 TYR H H 1.048 9.813 5.276 1.00 . A A . 52 TYR H 1 1 16 15339 1 1 52 TYR HA H -1.629 9.292 4.500 1.00 . A A . 52 TYR HA 1 1 16 15340 1 1 52 TYR HB2 H -0.202 8.063 6.247 1.00 . A A . 52 TYR HB2 1 1 16 15341 1 1 52 TYR HB3 H -0.643 9.363 7.347 1.00 . A A . 52 TYR HB3 1 1 16 15342 1 1 52 TYR HD1 H -3.342 9.858 7.243 1.00 . A A . 52 TYR HD1 1 1 16 15343 1 1 52 TYR HD2 H -1.430 6.141 6.455 1.00 . A A . 52 TYR HD2 1 1 16 15344 1 1 52 TYR HE1 H -5.419 8.678 7.809 1.00 . A A . 52 TYR HE1 1 1 16 15345 1 1 52 TYR HE2 H -3.507 4.951 7.017 1.00 . A A . 52 TYR HE2 1 1 16 15346 1 1 52 TYR HH H -5.914 6.155 8.707 1.00 . A A . 52 TYR HH 1 1 16 15347 1 1 52 TYR N N 0.256 10.094 4.771 1.00 . A A . 52 TYR N 1 1 16 15348 1 1 52 TYR O O -1.255 11.874 6.435 1.00 . A A . 52 TYR O 1 1 16 15349 1 1 52 TYR OH O -5.749 6.078 7.765 1.00 . A A . 52 TYR OH 1 1 16 15350 1 1 53 GLN C C -5.093 11.880 6.447 1.00 . A A . 53 GLN C 1 1 16 15351 1 1 53 GLN CA C -3.874 12.314 5.640 1.00 . A A . 53 GLN CA 1 1 16 15352 1 1 53 GLN CB C -4.318 13.053 4.376 1.00 . A A . 53 GLN CB 1 1 16 15353 1 1 53 GLN CD C -3.397 14.598 2.604 1.00 . A A . 53 GLN CD 1 1 16 15354 1 1 53 GLN CG C -3.505 14.305 4.087 1.00 . A A . 53 GLN CG 1 1 16 15355 1 1 53 GLN H H -3.441 10.452 4.734 1.00 . A A . 53 GLN H 1 1 16 15356 1 1 53 GLN HA H -3.273 12.977 6.246 1.00 . A A . 53 GLN HA 1 1 16 15357 1 1 53 GLN HB2 H -4.223 12.387 3.532 1.00 . A A . 53 GLN HB2 1 1 16 15358 1 1 53 GLN HB3 H -5.353 13.340 4.484 1.00 . A A . 53 GLN HB3 1 1 16 15359 1 1 53 GLN HE21 H -2.151 16.104 2.967 1.00 . A A . 53 GLN HE21 1 1 16 15360 1 1 53 GLN HE22 H -2.524 15.823 1.303 1.00 . A A . 53 GLN HE22 1 1 16 15361 1 1 53 GLN HG2 H -3.978 15.146 4.572 1.00 . A A . 53 GLN HG2 1 1 16 15362 1 1 53 GLN HG3 H -2.509 14.173 4.486 1.00 . A A . 53 GLN HG3 1 1 16 15363 1 1 53 GLN N N -3.056 11.159 5.293 1.00 . A A . 53 GLN N 1 1 16 15364 1 1 53 GLN NE2 N -2.611 15.611 2.256 1.00 . A A . 53 GLN NE2 1 1 16 15365 1 1 53 GLN O O -5.658 10.817 6.204 1.00 . A A . 53 GLN O 1 1 16 15366 1 1 53 GLN OE1 O -4.013 13.924 1.779 1.00 . A A . 53 GLN OE1 1 1 16 15367 1 1 54 GLU C C -7.938 12.944 7.648 1.00 . A A . 54 GLU C 1 1 16 15368 1 1 54 GLU CA C -6.647 12.391 8.248 1.00 . A A . 54 GLU CA 1 1 16 15369 1 1 54 GLU CB C -6.440 12.950 9.658 1.00 . A A . 54 GLU CB 1 1 16 15370 1 1 54 GLU CD C -5.951 12.429 12.081 1.00 . A A . 54 GLU CD 1 1 16 15371 1 1 54 GLU CG C -5.935 11.918 10.653 1.00 . A A . 54 GLU CG 1 1 16 15372 1 1 54 GLU H H -5.002 13.537 7.561 1.00 . A A . 54 GLU H 1 1 16 15373 1 1 54 GLU HA H -6.727 11.316 8.308 1.00 . A A . 54 GLU HA 1 1 16 15374 1 1 54 GLU HB2 H -5.722 13.755 9.612 1.00 . A A . 54 GLU HB2 1 1 16 15375 1 1 54 GLU HB3 H -7.379 13.339 10.023 1.00 . A A . 54 GLU HB3 1 1 16 15376 1 1 54 GLU HG2 H -6.564 11.042 10.594 1.00 . A A . 54 GLU HG2 1 1 16 15377 1 1 54 GLU HG3 H -4.921 11.653 10.392 1.00 . A A . 54 GLU HG3 1 1 16 15378 1 1 54 GLU N N -5.493 12.703 7.410 1.00 . A A . 54 GLU N 1 1 16 15379 1 1 54 GLU O O -8.815 13.418 8.369 1.00 . A A . 54 GLU O 1 1 16 15380 1 1 54 GLU OE1 O -7.011 12.921 12.524 1.00 . A A . 54 GLU OE1 1 1 16 15381 1 1 54 GLU OE2 O -4.903 12.338 12.756 1.00 . A A . 54 GLU OE2 1 1 16 15382 1 1 55 ASN C C -10.280 12.274 5.491 1.00 . A A . 55 ASN C 1 1 16 15383 1 1 55 ASN CA C -9.243 13.374 5.640 1.00 . A A . 55 ASN CA 1 1 16 15384 1 1 55 ASN CB C -8.871 13.940 4.266 1.00 . A A . 55 ASN CB 1 1 16 15385 1 1 55 ASN CG C -9.302 15.385 4.101 1.00 . A A . 55 ASN CG 1 1 16 15386 1 1 55 ASN H H -7.327 12.491 5.797 1.00 . A A . 55 ASN H 1 1 16 15387 1 1 55 ASN HA H -9.659 14.165 6.243 1.00 . A A . 55 ASN HA 1 1 16 15388 1 1 55 ASN HB2 H -7.802 13.888 4.140 1.00 . A A . 55 ASN HB2 1 1 16 15389 1 1 55 ASN HB3 H -9.349 13.352 3.497 1.00 . A A . 55 ASN HB3 1 1 16 15390 1 1 55 ASN HD21 H -8.232 15.535 2.431 1.00 . A A . 55 ASN HD21 1 1 16 15391 1 1 55 ASN HD22 H -9.087 16.959 2.905 1.00 . A A . 55 ASN HD22 1 1 16 15392 1 1 55 ASN N N -8.054 12.880 6.324 1.00 . A A . 55 ASN N 1 1 16 15393 1 1 55 ASN ND2 N -8.826 16.025 3.038 1.00 . A A . 55 ASN ND2 1 1 16 15394 1 1 55 ASN O O -11.270 12.241 6.223 1.00 . A A . 55 ASN O 1 1 16 15395 1 1 55 ASN OD1 O -10.050 15.919 4.917 1.00 . A A . 55 ASN OD1 1 1 16 15396 1 1 56 ALA C C -10.930 9.240 5.421 1.00 . A A . 56 ALA C 1 1 16 15397 1 1 56 ALA CA C -10.980 10.272 4.297 1.00 . A A . 56 ALA CA 1 1 16 15398 1 1 56 ALA CB C -10.680 9.612 2.960 1.00 . A A . 56 ALA CB 1 1 16 15399 1 1 56 ALA H H -9.257 11.450 3.990 1.00 . A A . 56 ALA H 1 1 16 15400 1 1 56 ALA HA H -11.980 10.681 4.247 1.00 . A A . 56 ALA HA 1 1 16 15401 1 1 56 ALA HB1 H -10.570 10.372 2.201 1.00 . A A . 56 ALA HB1 1 1 16 15402 1 1 56 ALA HB2 H -11.490 8.948 2.691 1.00 . A A . 56 ALA HB2 1 1 16 15403 1 1 56 ALA HB3 H -9.764 9.048 3.039 1.00 . A A . 56 ALA HB3 1 1 16 15404 1 1 56 ALA N N -10.060 11.373 4.540 1.00 . A A . 56 ALA N 1 1 16 15405 1 1 56 ALA O O -11.800 8.372 5.521 1.00 . A A . 56 ALA O 1 1 16 15406 1 1 57 TYR C C -10.270 9.021 8.676 1.00 . A A . 57 TYR C 1 1 16 15407 1 1 57 TYR CA C -9.748 8.416 7.380 1.00 . A A . 57 TYR CA 1 1 16 15408 1 1 57 TYR CB C -8.274 8.047 7.539 1.00 . A A . 57 TYR CB 1 1 16 15409 1 1 57 TYR CD1 C -8.096 6.018 6.049 1.00 . A A . 57 TYR CD1 1 1 16 15410 1 1 57 TYR CD2 C -6.769 7.925 5.518 1.00 . A A . 57 TYR CD2 1 1 16 15411 1 1 57 TYR CE1 C -7.575 5.347 4.960 1.00 . A A . 57 TYR CE1 1 1 16 15412 1 1 57 TYR CE2 C -6.244 7.261 4.425 1.00 . A A . 57 TYR CE2 1 1 16 15413 1 1 57 TYR CG C -7.702 7.316 6.346 1.00 . A A . 57 TYR CG 1 1 16 15414 1 1 57 TYR CZ C -6.649 5.972 4.151 1.00 . A A . 57 TYR CZ 1 1 16 15415 1 1 57 TYR H H -9.251 10.050 6.137 1.00 . A A . 57 TYR H 1 1 16 15416 1 1 57 TYR HA H -10.310 7.520 7.156 1.00 . A A . 57 TYR HA 1 1 16 15417 1 1 57 TYR HB2 H -7.698 8.949 7.682 1.00 . A A . 57 TYR HB2 1 1 16 15418 1 1 57 TYR HB3 H -8.160 7.412 8.405 1.00 . A A . 57 TYR HB3 1 1 16 15419 1 1 57 TYR HD1 H -8.822 5.532 6.684 1.00 . A A . 57 TYR HD1 1 1 16 15420 1 1 57 TYR HD2 H -6.454 8.935 5.736 1.00 . A A . 57 TYR HD2 1 1 16 15421 1 1 57 TYR HE1 H -7.894 4.337 4.745 1.00 . A A . 57 TYR HE1 1 1 16 15422 1 1 57 TYR HE2 H -5.519 7.753 3.793 1.00 . A A . 57 TYR HE2 1 1 16 15423 1 1 57 TYR HH H -6.843 5.027 2.488 1.00 . A A . 57 TYR HH 1 1 16 15424 1 1 57 TYR N N -9.911 9.339 6.265 1.00 . A A . 57 TYR N 1 1 16 15425 1 1 57 TYR O O -9.827 8.667 9.766 1.00 . A A . 57 TYR O 1 1 16 15426 1 1 57 TYR OH O -6.129 5.307 3.065 1.00 . A A . 57 TYR OH 1 1 16 15427 1 1 58 ARG C C -13.130 9.923 10.102 1.00 . A A . 58 ARG C 1 1 16 15428 1 1 58 ARG CA C -11.820 10.589 9.714 1.00 . A A . 58 ARG CA 1 1 16 15429 1 1 58 ARG CB C -12.040 12.077 9.428 1.00 . A A . 58 ARG CB 1 1 16 15430 1 1 58 ARG CD C -12.500 14.010 10.971 1.00 . A A . 58 ARG CD 1 1 16 15431 1 1 58 ARG CG C -11.470 12.992 10.504 1.00 . A A . 58 ARG CG 1 1 16 15432 1 1 58 ARG CZ C -12.560 16.022 12.395 1.00 . A A . 58 ARG CZ 1 1 16 15433 1 1 58 ARG H H -11.550 10.177 7.657 1.00 . A A . 58 ARG H 1 1 16 15434 1 1 58 ARG HA H -11.120 10.489 10.536 1.00 . A A . 58 ARG HA 1 1 16 15435 1 1 58 ARG HB2 H -11.560 12.325 8.490 1.00 . A A . 58 ARG HB2 1 1 16 15436 1 1 58 ARG HB3 H -13.100 12.266 9.342 1.00 . A A . 58 ARG HB3 1 1 16 15437 1 1 58 ARG HD2 H -12.810 14.606 10.125 1.00 . A A . 58 ARG HD2 1 1 16 15438 1 1 58 ARG HD3 H -13.360 13.482 11.369 1.00 . A A . 58 ARG HD3 1 1 16 15439 1 1 58 ARG HE H -11.120 14.634 12.429 1.00 . A A . 58 ARG HE 1 1 16 15440 1 1 58 ARG HG2 H -11.170 12.392 11.347 1.00 . A A . 58 ARG HG2 1 1 16 15441 1 1 58 ARG HG3 H -10.620 13.516 10.103 1.00 . A A . 58 ARG HG3 1 1 16 15442 1 1 58 ARG HH11 H -14.120 15.847 11.127 1.00 . A A . 58 ARG HH11 1 1 16 15443 1 1 58 ARG HH12 H -14.140 17.252 12.139 1.00 . A A . 58 ARG HH12 1 1 16 15444 1 1 58 ARG HH21 H -11.140 16.481 13.761 1.00 . A A . 58 ARG HH21 1 1 16 15445 1 1 58 ARG HH22 H -12.440 17.613 13.634 1.00 . A A . 58 ARG HH22 1 1 16 15446 1 1 58 ARG N N -11.230 9.935 8.552 1.00 . A A . 58 ARG N 1 1 16 15447 1 1 58 ARG NE N -11.970 14.894 12.004 1.00 . A A . 58 ARG NE 1 1 16 15448 1 1 58 ARG NH1 N -13.700 16.405 11.841 1.00 . A A . 58 ARG NH1 1 1 16 15449 1 1 58 ARG NH2 N -12.000 16.767 13.342 1.00 . A A . 58 ARG NH2 1 1 16 15450 1 1 58 ARG O O -14.210 10.409 9.764 1.00 . A A . 58 ARG O 1 1 16 15451 1 1 59 GLN C C -14.360 8.104 12.764 1.00 . A A . 59 GLN C 1 1 16 15452 1 1 59 GLN CA C -14.220 8.065 11.245 1.00 . A A . 59 GLN CA 1 1 16 15453 1 1 59 GLN CB C -14.140 6.614 10.762 1.00 . A A . 59 GLN CB 1 1 16 15454 1 1 59 GLN CD C -15.580 4.587 10.301 1.00 . A A . 59 GLN CD 1 1 16 15455 1 1 59 GLN CG C -15.460 6.094 10.198 1.00 . A A . 59 GLN CG 1 1 16 15456 1 1 59 GLN H H -12.150 8.463 11.048 1.00 . A A . 59 GLN H 1 1 16 15457 1 1 59 GLN HA H -15.080 8.538 10.806 1.00 . A A . 59 GLN HA 1 1 16 15458 1 1 59 GLN HB2 H -13.390 6.541 9.992 1.00 . A A . 59 GLN HB2 1 1 16 15459 1 1 59 GLN HB3 H -13.860 5.984 11.593 1.00 . A A . 59 GLN HB3 1 1 16 15460 1 1 59 GLN HE21 H -15.200 4.661 12.251 1.00 . A A . 59 GLN HE21 1 1 16 15461 1 1 59 GLN HE22 H -15.470 3.085 11.601 1.00 . A A . 59 GLN HE22 1 1 16 15462 1 1 59 GLN HG2 H -16.270 6.543 10.744 1.00 . A A . 59 GLN HG2 1 1 16 15463 1 1 59 GLN HG3 H -15.520 6.375 9.157 1.00 . A A . 59 GLN HG3 1 1 16 15464 1 1 59 GLN N N -13.030 8.803 10.812 1.00 . A A . 59 GLN N 1 1 16 15465 1 1 59 GLN NE2 N -15.400 4.058 11.506 1.00 . A A . 59 GLN NE2 1 1 16 15466 1 1 59 GLN O O -13.530 8.697 13.458 1.00 . A A . 59 GLN O 1 1 16 15467 1 1 59 GLN OE1 O -15.830 3.904 9.309 1.00 . A A . 59 GLN OE1 1 1 16 15468 1 1 60 ALA C C -16.550 6.252 15.081 1.00 . A A . 60 ALA C 1 1 16 15469 1 1 60 ALA CA C -15.650 7.430 14.710 1.00 . A A . 60 ALA CA 1 1 16 15470 1 1 60 ALA CB C -16.280 8.737 15.172 1.00 . A A . 60 ALA CB 1 1 16 15471 1 1 60 ALA H H -16.030 7.014 12.669 1.00 . A A . 60 ALA H 1 1 16 15472 1 1 60 ALA HA H -14.700 7.319 15.209 1.00 . A A . 60 ALA HA 1 1 16 15473 1 1 60 ALA HB1 H -15.850 9.024 16.122 1.00 . A A . 60 ALA HB1 1 1 16 15474 1 1 60 ALA HB2 H -17.350 8.605 15.280 1.00 . A A . 60 ALA HB2 1 1 16 15475 1 1 60 ALA HB3 H -16.080 9.508 14.442 1.00 . A A . 60 ALA HB3 1 1 16 15476 1 1 60 ALA N N -15.410 7.469 13.273 1.00 . A A . 60 ALA N 1 1 16 15477 1 1 60 ALA O O -17.370 5.812 14.284 1.00 . A A . 60 ALA O 1 1 16 15478 1 1 61 ALA C C -18.540 5.076 17.246 1.00 . A A . 61 ALA C 1 1 16 15479 1 1 61 ALA CA C -17.160 4.618 16.774 1.00 . A A . 61 ALA CA 1 1 16 15480 1 1 61 ALA CB C -16.430 3.895 17.896 1.00 . A A . 61 ALA CB 1 1 16 15481 1 1 61 ALA H H -15.700 6.138 16.888 1.00 . A A . 61 ALA H 1 1 16 15482 1 1 61 ALA HA H -17.290 3.927 15.952 1.00 . A A . 61 ALA HA 1 1 16 15483 1 1 61 ALA HB1 H -16.470 4.495 18.794 1.00 . A A . 61 ALA HB1 1 1 16 15484 1 1 61 ALA HB2 H -15.400 3.738 17.610 1.00 . A A . 61 ALA HB2 1 1 16 15485 1 1 61 ALA HB3 H -16.910 2.943 18.079 1.00 . A A . 61 ALA HB3 1 1 16 15486 1 1 61 ALA N N -16.370 5.744 16.298 1.00 . A A . 61 ALA N 1 1 16 15487 1 1 61 ALA O O -19.200 4.309 17.979 1.00 . A A . 61 ALA O 1 1 16 15488 1 1 61 ALA OXT O -18.950 6.199 16.879 1.00 . A A . 61 ALA OXT 1 1 17 15489 1 1 1 MET C C -5.348 6.678 -1.138 1.00 . A A . 1 MET C 1 1 17 15490 1 1 1 MET CA C -4.578 7.632 -0.232 1.00 . A A . 1 MET CA 1 1 17 15491 1 1 1 MET CB C -3.830 6.846 0.848 1.00 . A A . 1 MET CB 1 1 17 15492 1 1 1 MET CE C -0.051 6.343 1.984 1.00 . A A . 1 MET CE 1 1 17 15493 1 1 1 MET CG C -2.473 7.435 1.200 1.00 . A A . 1 MET CG 1 1 17 15494 1 1 1 MET H1 H -5.853 9.245 -0.295 1.00 . A A . 1 MET H1 1 1 17 15495 1 1 1 MET H2 H -4.943 9.109 1.153 1.00 . A A . 1 MET H2 1 1 17 15496 1 1 1 MET H3 H -6.266 8.054 0.867 1.00 . A A . 1 MET H3 1 1 17 15497 1 1 1 MET HA H -3.867 8.186 -0.826 1.00 . A A . 1 MET HA 1 1 17 15498 1 1 1 MET HB2 H -4.433 6.826 1.743 1.00 . A A . 1 MET HB2 1 1 17 15499 1 1 1 MET HB3 H -3.681 5.834 0.501 1.00 . A A . 1 MET HB3 1 1 17 15500 1 1 1 MET HE1 H -0.661 6.177 2.860 1.00 . A A . 1 MET HE1 1 1 17 15501 1 1 1 MET HE2 H 0.507 7.260 2.105 1.00 . A A . 1 MET HE2 1 1 17 15502 1 1 1 MET HE3 H 0.635 5.518 1.860 1.00 . A A . 1 MET HE3 1 1 17 15503 1 1 1 MET HG2 H -2.417 8.435 0.798 1.00 . A A . 1 MET HG2 1 1 17 15504 1 1 1 MET HG3 H -2.384 7.473 2.275 1.00 . A A . 1 MET HG3 1 1 17 15505 1 1 1 MET N N -5.493 8.597 0.432 1.00 . A A . 1 MET N 1 1 17 15506 1 1 1 MET O O -6.159 5.880 -0.670 1.00 . A A . 1 MET O 1 1 17 15507 1 1 1 MET SD S -1.102 6.468 0.540 1.00 . A A . 1 MET SD 1 1 17 15508 1 1 2 TYR C C -4.946 4.640 -3.661 1.00 . A A . 2 TYR C 1 1 17 15509 1 1 2 TYR CA C -5.757 5.909 -3.410 1.00 . A A . 2 TYR CA 1 1 17 15510 1 1 2 TYR CB C -5.970 6.661 -4.723 1.00 . A A . 2 TYR CB 1 1 17 15511 1 1 2 TYR CD1 C -7.590 8.260 -3.630 1.00 . A A . 2 TYR CD1 1 1 17 15512 1 1 2 TYR CD2 C -8.037 7.559 -5.864 1.00 . A A . 2 TYR CD2 1 1 17 15513 1 1 2 TYR CE1 C -8.734 9.037 -3.639 1.00 . A A . 2 TYR CE1 1 1 17 15514 1 1 2 TYR CE2 C -9.182 8.332 -5.881 1.00 . A A . 2 TYR CE2 1 1 17 15515 1 1 2 TYR CG C -7.223 7.509 -4.739 1.00 . A A . 2 TYR CG 1 1 17 15516 1 1 2 TYR CZ C -9.526 9.069 -4.768 1.00 . A A . 2 TYR CZ 1 1 17 15517 1 1 2 TYR H H -4.431 7.421 -2.752 1.00 . A A . 2 TYR H 1 1 17 15518 1 1 2 TYR HA H -6.717 5.632 -3.003 1.00 . A A . 2 TYR HA 1 1 17 15519 1 1 2 TYR HB2 H -5.128 7.312 -4.899 1.00 . A A . 2 TYR HB2 1 1 17 15520 1 1 2 TYR HB3 H -6.042 5.948 -5.532 1.00 . A A . 2 TYR HB3 1 1 17 15521 1 1 2 TYR HD1 H -6.967 8.233 -2.748 1.00 . A A . 2 TYR HD1 1 1 17 15522 1 1 2 TYR HD2 H -7.766 6.981 -6.734 1.00 . A A . 2 TYR HD2 1 1 17 15523 1 1 2 TYR HE1 H -9.002 9.614 -2.766 1.00 . A A . 2 TYR HE1 1 1 17 15524 1 1 2 TYR HE2 H -9.803 8.358 -6.765 1.00 . A A . 2 TYR HE2 1 1 17 15525 1 1 2 TYR HH H -11.170 9.678 -3.982 1.00 . A A . 2 TYR HH 1 1 17 15526 1 1 2 TYR N N -5.088 6.765 -2.439 1.00 . A A . 2 TYR N 1 1 17 15527 1 1 2 TYR O O -3.716 4.670 -3.676 1.00 . A A . 2 TYR O 1 1 17 15528 1 1 2 TYR OH O -10.660 9.841 -4.782 1.00 . A A . 2 TYR OH 1 1 17 15529 1 1 3 LYS C C -4.070 2.328 -5.321 1.00 . A A . 3 LYS C 1 1 17 15530 1 1 3 LYS CA C -4.993 2.246 -4.108 1.00 . A A . 3 LYS CA 1 1 17 15531 1 1 3 LYS CB C -6.040 1.152 -4.322 1.00 . A A . 3 LYS CB 1 1 17 15532 1 1 3 LYS CD C -5.452 -1.163 -5.113 1.00 . A A . 3 LYS CD 1 1 17 15533 1 1 3 LYS CE C -6.672 -2.063 -5.237 1.00 . A A . 3 LYS CE 1 1 17 15534 1 1 3 LYS CG C -5.564 -0.235 -3.914 1.00 . A A . 3 LYS CG 1 1 17 15535 1 1 3 LYS H H -6.624 3.567 -3.833 1.00 . A A . 3 LYS H 1 1 17 15536 1 1 3 LYS HA H -4.402 2.001 -3.237 1.00 . A A . 3 LYS HA 1 1 17 15537 1 1 3 LYS HB2 H -6.918 1.392 -3.740 1.00 . A A . 3 LYS HB2 1 1 17 15538 1 1 3 LYS HB3 H -6.308 1.126 -5.368 1.00 . A A . 3 LYS HB3 1 1 17 15539 1 1 3 LYS HD2 H -5.366 -0.568 -6.010 1.00 . A A . 3 LYS HD2 1 1 17 15540 1 1 3 LYS HD3 H -4.572 -1.778 -5.000 1.00 . A A . 3 LYS HD3 1 1 17 15541 1 1 3 LYS HE2 H -6.830 -2.564 -4.293 1.00 . A A . 3 LYS HE2 1 1 17 15542 1 1 3 LYS HE3 H -7.532 -1.451 -5.466 1.00 . A A . 3 LYS HE3 1 1 17 15543 1 1 3 LYS HG2 H -4.594 -0.148 -3.449 1.00 . A A . 3 LYS HG2 1 1 17 15544 1 1 3 LYS HG3 H -6.268 -0.654 -3.209 1.00 . A A . 3 LYS HG3 1 1 17 15545 1 1 3 LYS HZ1 H -7.430 -3.351 -6.695 1.00 . A A . 3 LYS HZ1 1 1 17 15546 1 1 3 LYS HZ2 H -6.042 -3.933 -5.921 1.00 . A A . 3 LYS HZ2 1 1 17 15547 1 1 3 LYS HZ3 H -5.914 -2.702 -7.075 1.00 . A A . 3 LYS HZ3 1 1 17 15548 1 1 3 LYS N N -5.645 3.528 -3.858 1.00 . A A . 3 LYS N 1 1 17 15549 1 1 3 LYS NZ N -6.502 -3.084 -6.306 1.00 . A A . 3 LYS NZ 1 1 17 15550 1 1 3 LYS O O -3.090 1.589 -5.418 1.00 . A A . 3 LYS O 1 1 17 15551 1 1 4 LYS C C -2.151 3.779 -7.102 1.00 . A A . 4 LYS C 1 1 17 15552 1 1 4 LYS CA C -3.588 3.406 -7.451 1.00 . A A . 4 LYS CA 1 1 17 15553 1 1 4 LYS CB C -4.205 4.485 -8.342 1.00 . A A . 4 LYS CB 1 1 17 15554 1 1 4 LYS CD C -4.536 5.007 -10.779 1.00 . A A . 4 LYS CD 1 1 17 15555 1 1 4 LYS CE C -4.095 4.533 -12.155 1.00 . A A . 4 LYS CE 1 1 17 15556 1 1 4 LYS CG C -3.540 4.601 -9.704 1.00 . A A . 4 LYS CG 1 1 17 15557 1 1 4 LYS H H -5.182 3.789 -6.112 1.00 . A A . 4 LYS H 1 1 17 15558 1 1 4 LYS HA H -3.585 2.469 -7.984 1.00 . A A . 4 LYS HA 1 1 17 15559 1 1 4 LYS HB2 H -5.249 4.257 -8.495 1.00 . A A . 4 LYS HB2 1 1 17 15560 1 1 4 LYS HB3 H -4.123 5.439 -7.843 1.00 . A A . 4 LYS HB3 1 1 17 15561 1 1 4 LYS HD2 H -5.496 4.570 -10.549 1.00 . A A . 4 LYS HD2 1 1 17 15562 1 1 4 LYS HD3 H -4.621 6.084 -10.788 1.00 . A A . 4 LYS HD3 1 1 17 15563 1 1 4 LYS HE2 H -4.416 5.256 -12.889 1.00 . A A . 4 LYS HE2 1 1 17 15564 1 1 4 LYS HE3 H -3.018 4.460 -12.168 1.00 . A A . 4 LYS HE3 1 1 17 15565 1 1 4 LYS HG2 H -2.760 5.347 -9.651 1.00 . A A . 4 LYS HG2 1 1 17 15566 1 1 4 LYS HG3 H -3.109 3.646 -9.967 1.00 . A A . 4 LYS HG3 1 1 17 15567 1 1 4 LYS HZ1 H -4.536 3.004 -13.507 1.00 . A A . 4 LYS HZ1 1 1 17 15568 1 1 4 LYS HZ2 H -5.696 3.197 -12.292 1.00 . A A . 4 LYS HZ2 1 1 17 15569 1 1 4 LYS HZ3 H -4.215 2.459 -11.937 1.00 . A A . 4 LYS HZ3 1 1 17 15570 1 1 4 LYS N N -4.389 3.230 -6.244 1.00 . A A . 4 LYS N 1 1 17 15571 1 1 4 LYS NZ N -4.676 3.206 -12.496 1.00 . A A . 4 LYS NZ 1 1 17 15572 1 1 4 LYS O O -1.204 3.169 -7.598 1.00 . A A . 4 LYS O 1 1 17 15573 1 1 5 ASP C C 0.113 4.104 -5.181 1.00 . A A . 5 ASP C 1 1 17 15574 1 1 5 ASP CA C -0.673 5.238 -5.830 1.00 . A A . 5 ASP CA 1 1 17 15575 1 1 5 ASP CB C -0.797 6.410 -4.855 1.00 . A A . 5 ASP CB 1 1 17 15576 1 1 5 ASP CG C -0.929 7.742 -5.567 1.00 . A A . 5 ASP CG 1 1 17 15577 1 1 5 ASP H H -2.790 5.230 -5.883 1.00 . A A . 5 ASP H 1 1 17 15578 1 1 5 ASP HA H -0.144 5.568 -6.712 1.00 . A A . 5 ASP HA 1 1 17 15579 1 1 5 ASP HB2 H -1.670 6.265 -4.236 1.00 . A A . 5 ASP HB2 1 1 17 15580 1 1 5 ASP HB3 H 0.083 6.444 -4.229 1.00 . A A . 5 ASP HB3 1 1 17 15581 1 1 5 ASP N N -1.996 4.784 -6.245 1.00 . A A . 5 ASP N 1 1 17 15582 1 1 5 ASP O O 1.282 3.884 -5.497 1.00 . A A . 5 ASP O 1 1 17 15583 1 1 5 ASP OD1 O 0.110 8.307 -5.969 1.00 . A A . 5 ASP OD1 1 1 17 15584 1 1 5 ASP OD2 O -2.073 8.221 -5.723 1.00 . A A . 5 ASP OD2 1 1 17 15585 1 1 6 VAL C C 0.603 1.231 -4.557 1.00 . A A . 6 VAL C 1 1 17 15586 1 1 6 VAL CA C 0.091 2.279 -3.574 1.00 . A A . 6 VAL CA 1 1 17 15587 1 1 6 VAL CB C -0.896 1.613 -2.596 1.00 . A A . 6 VAL CB 1 1 17 15588 1 1 6 VAL CG1 C -0.139 0.813 -1.563 1.00 . A A . 6 VAL CG1 1 1 17 15589 1 1 6 VAL CG2 C -1.783 2.649 -1.918 1.00 . A A . 6 VAL CG2 1 1 17 15590 1 1 6 VAL H H -1.462 3.606 -4.057 1.00 . A A . 6 VAL H 1 1 17 15591 1 1 6 VAL HA H 0.923 2.668 -3.006 1.00 . A A . 6 VAL HA 1 1 17 15592 1 1 6 VAL HB H -1.526 0.939 -3.155 1.00 . A A . 6 VAL HB 1 1 17 15593 1 1 6 VAL HG11 H 0.017 -0.189 -1.928 1.00 . A A . 6 VAL HG11 1 1 17 15594 1 1 6 VAL HG12 H -0.709 0.782 -0.648 1.00 . A A . 6 VAL HG12 1 1 17 15595 1 1 6 VAL HG13 H 0.813 1.284 -1.380 1.00 . A A . 6 VAL HG13 1 1 17 15596 1 1 6 VAL HG21 H -2.658 2.824 -2.525 1.00 . A A . 6 VAL HG21 1 1 17 15597 1 1 6 VAL HG22 H -1.235 3.572 -1.803 1.00 . A A . 6 VAL HG22 1 1 17 15598 1 1 6 VAL HG23 H -2.086 2.285 -0.949 1.00 . A A . 6 VAL HG23 1 1 17 15599 1 1 6 VAL N N -0.536 3.386 -4.268 1.00 . A A . 6 VAL N 1 1 17 15600 1 1 6 VAL O O 1.764 0.825 -4.500 1.00 . A A . 6 VAL O 1 1 17 15601 1 1 7 ILE C C 1.229 0.287 -7.342 1.00 . A A . 7 ILE C 1 1 17 15602 1 1 7 ILE CA C 0.087 -0.203 -6.455 1.00 . A A . 7 ILE CA 1 1 17 15603 1 1 7 ILE CB C -1.125 -0.567 -7.340 1.00 . A A . 7 ILE CB 1 1 17 15604 1 1 7 ILE CD1 C -3.407 -1.697 -7.311 1.00 . A A . 7 ILE CD1 1 1 17 15605 1 1 7 ILE CG1 C -2.192 -1.284 -6.510 1.00 . A A . 7 ILE CG1 1 1 17 15606 1 1 7 ILE CG2 C -0.692 -1.432 -8.515 1.00 . A A . 7 ILE CG2 1 1 17 15607 1 1 7 ILE H H -1.183 1.159 -5.452 1.00 . A A . 7 ILE H 1 1 17 15608 1 1 7 ILE HA H 0.407 -1.094 -5.933 1.00 . A A . 7 ILE HA 1 1 17 15609 1 1 7 ILE HB H -1.541 0.346 -7.734 1.00 . A A . 7 ILE HB 1 1 17 15610 1 1 7 ILE HD11 H -4.041 -0.837 -7.471 1.00 . A A . 7 ILE HD11 1 1 17 15611 1 1 7 ILE HD12 H -3.956 -2.454 -6.771 1.00 . A A . 7 ILE HD12 1 1 17 15612 1 1 7 ILE HD13 H -3.092 -2.094 -8.265 1.00 . A A . 7 ILE HD13 1 1 17 15613 1 1 7 ILE HG12 H -1.764 -2.175 -6.076 1.00 . A A . 7 ILE HG12 1 1 17 15614 1 1 7 ILE HG13 H -2.523 -0.628 -5.718 1.00 . A A . 7 ILE HG13 1 1 17 15615 1 1 7 ILE HG21 H -0.157 -2.295 -8.150 1.00 . A A . 7 ILE HG21 1 1 17 15616 1 1 7 ILE HG22 H -0.049 -0.857 -9.164 1.00 . A A . 7 ILE HG22 1 1 17 15617 1 1 7 ILE HG23 H -1.564 -1.755 -9.065 1.00 . A A . 7 ILE HG23 1 1 17 15618 1 1 7 ILE N N -0.273 0.797 -5.458 1.00 . A A . 7 ILE N 1 1 17 15619 1 1 7 ILE O O 2.006 -0.510 -7.866 1.00 . A A . 7 ILE O 1 1 17 15620 1 1 8 ASP C C 3.701 2.188 -7.583 1.00 . A A . 8 ASP C 1 1 17 15621 1 1 8 ASP CA C 2.371 2.195 -8.325 1.00 . A A . 8 ASP CA 1 1 17 15622 1 1 8 ASP CB C 1.993 3.627 -8.715 1.00 . A A . 8 ASP CB 1 1 17 15623 1 1 8 ASP CG C 1.954 3.826 -10.218 1.00 . A A . 8 ASP CG 1 1 17 15624 1 1 8 ASP H H 0.681 2.185 -7.060 1.00 . A A . 8 ASP H 1 1 17 15625 1 1 8 ASP HA H 2.468 1.601 -9.220 1.00 . A A . 8 ASP HA 1 1 17 15626 1 1 8 ASP HB2 H 1.014 3.854 -8.317 1.00 . A A . 8 ASP HB2 1 1 17 15627 1 1 8 ASP HB3 H 2.714 4.313 -8.297 1.00 . A A . 8 ASP HB3 1 1 17 15628 1 1 8 ASP N N 1.326 1.601 -7.505 1.00 . A A . 8 ASP N 1 1 17 15629 1 1 8 ASP O O 4.768 2.174 -8.199 1.00 . A A . 8 ASP O 1 1 17 15630 1 1 8 ASP OD1 O 0.912 3.514 -10.832 1.00 . A A . 8 ASP OD1 1 1 17 15631 1 1 8 ASP OD2 O 2.967 4.293 -10.781 1.00 . A A . 8 ASP OD2 1 1 17 15632 1 1 9 HIS C C 5.310 0.757 -5.196 1.00 . A A . 9 HIS C 1 1 17 15633 1 1 9 HIS CA C 4.829 2.186 -5.433 1.00 . A A . 9 HIS CA 1 1 17 15634 1 1 9 HIS CB C 4.560 2.881 -4.094 1.00 . A A . 9 HIS CB 1 1 17 15635 1 1 9 HIS CD2 C 6.068 1.803 -2.278 1.00 . A A . 9 HIS CD2 1 1 17 15636 1 1 9 HIS CE1 C 7.511 3.438 -2.046 1.00 . A A . 9 HIS CE1 1 1 17 15637 1 1 9 HIS CG C 5.703 2.792 -3.128 1.00 . A A . 9 HIS CG 1 1 17 15638 1 1 9 HIS H H 2.752 2.204 -5.823 1.00 . A A . 9 HIS H 1 1 17 15639 1 1 9 HIS HA H 5.592 2.728 -5.964 1.00 . A A . 9 HIS HA 1 1 17 15640 1 1 9 HIS HB2 H 4.359 3.926 -4.274 1.00 . A A . 9 HIS HB2 1 1 17 15641 1 1 9 HIS HB3 H 3.695 2.429 -3.630 1.00 . A A . 9 HIS HB3 1 1 17 15642 1 1 9 HIS HD1 H 6.634 4.658 -3.436 1.00 . A A . 9 HIS HD1 1 1 17 15643 1 1 9 HIS HD2 H 5.566 0.855 -2.144 1.00 . A A . 9 HIS HD2 1 1 17 15644 1 1 9 HIS HE1 H 8.350 4.027 -1.707 1.00 . A A . 9 HIS HE1 1 1 17 15645 1 1 9 HIS HE2 H 7.633 1.760 -0.879 1.00 . A A . 9 HIS HE2 1 1 17 15646 1 1 9 HIS N N 3.630 2.195 -6.257 1.00 . A A . 9 HIS N 1 1 17 15647 1 1 9 HIS ND1 N 6.627 3.802 -2.958 1.00 . A A . 9 HIS ND1 1 1 17 15648 1 1 9 HIS NE2 N 7.194 2.230 -1.618 1.00 . A A . 9 HIS NE2 1 1 17 15649 1 1 9 HIS O O 6.510 0.506 -5.078 1.00 . A A . 9 HIS O 1 1 17 15650 1 1 10 PHE C C 4.853 -2.320 -6.228 1.00 . A A . 10 PHE C 1 1 17 15651 1 1 10 PHE CA C 4.686 -1.580 -4.905 1.00 . A A . 10 PHE CA 1 1 17 15652 1 1 10 PHE CB C 3.591 -2.244 -4.070 1.00 . A A . 10 PHE CB 1 1 17 15653 1 1 10 PHE CD1 C 4.525 -2.716 -1.796 1.00 . A A . 10 PHE CD1 1 1 17 15654 1 1 10 PHE CD2 C 2.990 -0.909 -2.034 1.00 . A A . 10 PHE CD2 1 1 17 15655 1 1 10 PHE CE1 C 4.636 -2.449 -0.444 1.00 . A A . 10 PHE CE1 1 1 17 15656 1 1 10 PHE CE2 C 3.095 -0.635 -0.685 1.00 . A A . 10 PHE CE2 1 1 17 15657 1 1 10 PHE CG C 3.703 -1.950 -2.604 1.00 . A A . 10 PHE CG 1 1 17 15658 1 1 10 PHE CZ C 3.919 -1.407 0.113 1.00 . A A . 10 PHE CZ 1 1 17 15659 1 1 10 PHE H H 3.426 0.090 -5.229 1.00 . A A . 10 PHE H 1 1 17 15660 1 1 10 PHE HA H 5.617 -1.625 -4.358 1.00 . A A . 10 PHE HA 1 1 17 15661 1 1 10 PHE HB2 H 2.628 -1.893 -4.408 1.00 . A A . 10 PHE HB2 1 1 17 15662 1 1 10 PHE HB3 H 3.645 -3.313 -4.203 1.00 . A A . 10 PHE HB3 1 1 17 15663 1 1 10 PHE HD1 H 5.085 -3.529 -2.233 1.00 . A A . 10 PHE HD1 1 1 17 15664 1 1 10 PHE HD2 H 2.344 -0.306 -2.656 1.00 . A A . 10 PHE HD2 1 1 17 15665 1 1 10 PHE HE1 H 5.280 -3.054 0.176 1.00 . A A . 10 PHE HE1 1 1 17 15666 1 1 10 PHE HE2 H 2.533 0.180 -0.253 1.00 . A A . 10 PHE HE2 1 1 17 15667 1 1 10 PHE HZ H 4.003 -1.194 1.168 1.00 . A A . 10 PHE HZ 1 1 17 15668 1 1 10 PHE N N 4.365 -0.174 -5.129 1.00 . A A . 10 PHE N 1 1 17 15669 1 1 10 PHE O O 5.653 -3.248 -6.334 1.00 . A A . 10 PHE O 1 1 17 15670 1 1 11 GLY C C 3.158 -3.669 -8.677 1.00 . A A . 11 GLY C 1 1 17 15671 1 1 11 GLY CA C 4.161 -2.542 -8.533 1.00 . A A . 11 GLY CA 1 1 17 15672 1 1 11 GLY H H 3.464 -1.162 -7.086 1.00 . A A . 11 GLY H 1 1 17 15673 1 1 11 GLY HA2 H 3.968 -1.802 -9.296 1.00 . A A . 11 GLY HA2 1 1 17 15674 1 1 11 GLY HA3 H 5.155 -2.939 -8.672 1.00 . A A . 11 GLY HA3 1 1 17 15675 1 1 11 GLY N N 4.087 -1.905 -7.231 1.00 . A A . 11 GLY N 1 1 17 15676 1 1 11 GLY O O 2.453 -3.760 -9.682 1.00 . A A . 11 GLY O 1 1 17 15677 1 1 12 THR C C 1.453 -5.774 -6.331 1.00 . A A . 12 THR C 1 1 17 15678 1 1 12 THR CA C 2.168 -5.654 -7.674 1.00 . A A . 12 THR CA 1 1 17 15679 1 1 12 THR CB C 2.913 -6.953 -7.987 1.00 . A A . 12 THR CB 1 1 17 15680 1 1 12 THR CG2 C 2.969 -7.270 -9.466 1.00 . A A . 12 THR CG2 1 1 17 15681 1 1 12 THR H H 3.679 -4.399 -6.890 1.00 . A A . 12 THR H 1 1 17 15682 1 1 12 THR HA H 1.433 -5.476 -8.445 1.00 . A A . 12 THR HA 1 1 17 15683 1 1 12 THR HB H 2.413 -7.772 -7.491 1.00 . A A . 12 THR HB 1 1 17 15684 1 1 12 THR HG1 H 4.262 -7.111 -6.576 1.00 . A A . 12 THR HG1 1 1 17 15685 1 1 12 THR HG21 H 3.897 -7.771 -9.691 1.00 . A A . 12 THR HG21 1 1 17 15686 1 1 12 THR HG22 H 2.908 -6.353 -10.032 1.00 . A A . 12 THR HG22 1 1 17 15687 1 1 12 THR HG23 H 2.140 -7.910 -9.728 1.00 . A A . 12 THR HG23 1 1 17 15688 1 1 12 THR N N 3.093 -4.528 -7.666 1.00 . A A . 12 THR N 1 1 17 15689 1 1 12 THR O O 2.011 -5.433 -5.289 1.00 . A A . 12 THR O 1 1 17 15690 1 1 12 THR OG1 O 4.245 -6.893 -7.510 1.00 . A A . 12 THR OG1 1 1 17 15691 1 1 13 GLN C C 0.156 -7.286 -4.130 1.00 . A A . 13 GLN C 1 1 17 15692 1 1 13 GLN CA C -0.575 -6.416 -5.150 1.00 . A A . 13 GLN CA 1 1 17 15693 1 1 13 GLN CB C -1.936 -7.032 -5.479 1.00 . A A . 13 GLN CB 1 1 17 15694 1 1 13 GLN CD C -4.117 -6.701 -6.710 1.00 . A A . 13 GLN CD 1 1 17 15695 1 1 13 GLN CG C -2.642 -6.359 -6.645 1.00 . A A . 13 GLN CG 1 1 17 15696 1 1 13 GLN H H -0.177 -6.509 -7.226 1.00 . A A . 13 GLN H 1 1 17 15697 1 1 13 GLN HA H -0.729 -5.436 -4.724 1.00 . A A . 13 GLN HA 1 1 17 15698 1 1 13 GLN HB2 H -1.796 -8.074 -5.725 1.00 . A A . 13 GLN HB2 1 1 17 15699 1 1 13 GLN HB3 H -2.573 -6.958 -4.610 1.00 . A A . 13 GLN HB3 1 1 17 15700 1 1 13 GLN HE21 H -3.684 -8.618 -7.006 1.00 . A A . 13 GLN HE21 1 1 17 15701 1 1 13 GLN HE22 H -5.366 -8.228 -6.958 1.00 . A A . 13 GLN HE22 1 1 17 15702 1 1 13 GLN HG2 H -2.541 -5.289 -6.540 1.00 . A A . 13 GLN HG2 1 1 17 15703 1 1 13 GLN HG3 H -2.172 -6.674 -7.566 1.00 . A A . 13 GLN HG3 1 1 17 15704 1 1 13 GLN N N 0.216 -6.256 -6.365 1.00 . A A . 13 GLN N 1 1 17 15705 1 1 13 GLN NE2 N -4.420 -7.978 -6.912 1.00 . A A . 13 GLN NE2 1 1 17 15706 1 1 13 GLN O O 0.312 -6.902 -2.970 1.00 . A A . 13 GLN O 1 1 17 15707 1 1 13 GLN OE1 O -4.976 -5.828 -6.580 1.00 . A A . 13 GLN OE1 1 1 17 15708 1 1 14 ARG C C 2.382 -8.680 -2.876 1.00 . A A . 14 ARG C 1 1 17 15709 1 1 14 ARG CA C 1.316 -9.394 -3.705 1.00 . A A . 14 ARG CA 1 1 17 15710 1 1 14 ARG CB C 1.959 -10.504 -4.542 1.00 . A A . 14 ARG CB 1 1 17 15711 1 1 14 ARG CD C 0.410 -12.427 -5.034 1.00 . A A . 14 ARG CD 1 1 17 15712 1 1 14 ARG CG C 1.523 -11.903 -4.137 1.00 . A A . 14 ARG CG 1 1 17 15713 1 1 14 ARG CZ C 0.618 -11.690 -7.382 1.00 . A A . 14 ARG CZ 1 1 17 15714 1 1 14 ARG H H 0.444 -8.705 -5.508 1.00 . A A . 14 ARG H 1 1 17 15715 1 1 14 ARG HA H 0.595 -9.837 -3.034 1.00 . A A . 14 ARG HA 1 1 17 15716 1 1 14 ARG HB2 H 1.695 -10.355 -5.578 1.00 . A A . 14 ARG HB2 1 1 17 15717 1 1 14 ARG HB3 H 3.032 -10.442 -4.442 1.00 . A A . 14 ARG HB3 1 1 17 15718 1 1 14 ARG HD2 H 0.091 -13.387 -4.659 1.00 . A A . 14 ARG HD2 1 1 17 15719 1 1 14 ARG HD3 H -0.418 -11.737 -4.999 1.00 . A A . 14 ARG HD3 1 1 17 15720 1 1 14 ARG HE H 1.339 -13.399 -6.647 1.00 . A A . 14 ARG HE 1 1 17 15721 1 1 14 ARG HG2 H 2.370 -12.568 -4.208 1.00 . A A . 14 ARG HG2 1 1 17 15722 1 1 14 ARG HG3 H 1.170 -11.877 -3.117 1.00 . A A . 14 ARG HG3 1 1 17 15723 1 1 14 ARG HH11 H -0.365 -10.379 -6.195 1.00 . A A . 14 ARG HH11 1 1 17 15724 1 1 14 ARG HH12 H -0.206 -9.904 -7.851 1.00 . A A . 14 ARG HH12 1 1 17 15725 1 1 14 ARG HH21 H 1.547 -12.766 -8.819 1.00 . A A . 14 ARG HH21 1 1 17 15726 1 1 14 ARG HH22 H 0.878 -11.255 -9.339 1.00 . A A . 14 ARG HH22 1 1 17 15727 1 1 14 ARG N N 0.601 -8.460 -4.573 1.00 . A A . 14 ARG N 1 1 17 15728 1 1 14 ARG NE N 0.848 -12.582 -6.420 1.00 . A A . 14 ARG NE 1 1 17 15729 1 1 14 ARG NH1 N -0.039 -10.566 -7.119 1.00 . A A . 14 ARG NH1 1 1 17 15730 1 1 14 ARG NH2 N 1.050 -11.922 -8.614 1.00 . A A . 14 ARG NH2 1 1 17 15731 1 1 14 ARG O O 2.583 -8.993 -1.702 1.00 . A A . 14 ARG O 1 1 17 15732 1 1 15 ALA C C 3.544 -6.228 -1.600 1.00 . A A . 15 ALA C 1 1 17 15733 1 1 15 ALA CA C 4.106 -6.965 -2.813 1.00 . A A . 15 ALA CA 1 1 17 15734 1 1 15 ALA CB C 4.759 -5.981 -3.774 1.00 . A A . 15 ALA CB 1 1 17 15735 1 1 15 ALA H H 2.859 -7.516 -4.430 1.00 . A A . 15 ALA H 1 1 17 15736 1 1 15 ALA HA H 4.861 -7.662 -2.481 1.00 . A A . 15 ALA HA 1 1 17 15737 1 1 15 ALA HB1 H 5.833 -6.061 -3.695 1.00 . A A . 15 ALA HB1 1 1 17 15738 1 1 15 ALA HB2 H 4.454 -4.976 -3.524 1.00 . A A . 15 ALA HB2 1 1 17 15739 1 1 15 ALA HB3 H 4.454 -6.209 -4.784 1.00 . A A . 15 ALA HB3 1 1 17 15740 1 1 15 ALA N N 3.063 -7.721 -3.494 1.00 . A A . 15 ALA N 1 1 17 15741 1 1 15 ALA O O 4.076 -6.334 -0.495 1.00 . A A . 15 ALA O 1 1 17 15742 1 1 16 VAL C C 1.447 -5.636 0.418 1.00 . A A . 16 VAL C 1 1 17 15743 1 1 16 VAL CA C 1.826 -4.728 -0.748 1.00 . A A . 16 VAL CA 1 1 17 15744 1 1 16 VAL CB C 0.560 -3.991 -1.239 1.00 . A A . 16 VAL CB 1 1 17 15745 1 1 16 VAL CG1 C 0.387 -2.693 -0.479 1.00 . A A . 16 VAL CG1 1 1 17 15746 1 1 16 VAL CG2 C 0.613 -3.722 -2.736 1.00 . A A . 16 VAL CG2 1 1 17 15747 1 1 16 VAL H H 2.092 -5.439 -2.718 1.00 . A A . 16 VAL H 1 1 17 15748 1 1 16 VAL HA H 2.533 -3.988 -0.398 1.00 . A A . 16 VAL HA 1 1 17 15749 1 1 16 VAL HB H -0.298 -4.616 -1.036 1.00 . A A . 16 VAL HB 1 1 17 15750 1 1 16 VAL HG11 H -0.651 -2.402 -0.494 1.00 . A A . 16 VAL HG11 1 1 17 15751 1 1 16 VAL HG12 H 0.986 -1.927 -0.946 1.00 . A A . 16 VAL HG12 1 1 17 15752 1 1 16 VAL HG13 H 0.709 -2.830 0.542 1.00 . A A . 16 VAL HG13 1 1 17 15753 1 1 16 VAL HG21 H 0.357 -4.623 -3.274 1.00 . A A . 16 VAL HG21 1 1 17 15754 1 1 16 VAL HG22 H 1.609 -3.409 -3.011 1.00 . A A . 16 VAL HG22 1 1 17 15755 1 1 16 VAL HG23 H -0.090 -2.941 -2.987 1.00 . A A . 16 VAL HG23 1 1 17 15756 1 1 16 VAL N N 2.466 -5.483 -1.817 1.00 . A A . 16 VAL N 1 1 17 15757 1 1 16 VAL O O 1.675 -5.299 1.580 1.00 . A A . 16 VAL O 1 1 17 15758 1 1 17 ALA C C 1.664 -8.320 1.852 1.00 . A A . 17 ALA C 1 1 17 15759 1 1 17 ALA CA C 0.456 -7.744 1.120 1.00 . A A . 17 ALA CA 1 1 17 15760 1 1 17 ALA CB C -0.368 -8.861 0.496 1.00 . A A . 17 ALA CB 1 1 17 15761 1 1 17 ALA H H 0.710 -7.000 -0.844 1.00 . A A . 17 ALA H 1 1 17 15762 1 1 17 ALA HA H -0.169 -7.224 1.831 1.00 . A A . 17 ALA HA 1 1 17 15763 1 1 17 ALA HB1 H -1.175 -9.127 1.162 1.00 . A A . 17 ALA HB1 1 1 17 15764 1 1 17 ALA HB2 H 0.262 -9.722 0.330 1.00 . A A . 17 ALA HB2 1 1 17 15765 1 1 17 ALA HB3 H -0.775 -8.525 -0.447 1.00 . A A . 17 ALA HB3 1 1 17 15766 1 1 17 ALA N N 0.866 -6.788 0.099 1.00 . A A . 17 ALA N 1 1 17 15767 1 1 17 ALA O O 1.572 -8.693 3.020 1.00 . A A . 17 ALA O 1 1 17 15768 1 1 18 LYS C C 4.847 -7.816 2.399 1.00 . A A . 18 LYS C 1 1 17 15769 1 1 18 LYS CA C 4.022 -8.921 1.739 1.00 . A A . 18 LYS CA 1 1 17 15770 1 1 18 LYS CB C 4.855 -9.627 0.666 1.00 . A A . 18 LYS CB 1 1 17 15771 1 1 18 LYS CD C 5.963 -11.490 1.943 1.00 . A A . 18 LYS CD 1 1 17 15772 1 1 18 LYS CE C 7.170 -12.207 1.362 1.00 . A A . 18 LYS CE 1 1 17 15773 1 1 18 LYS CG C 4.952 -11.131 0.864 1.00 . A A . 18 LYS CG 1 1 17 15774 1 1 18 LYS H H 2.804 -8.078 0.227 1.00 . A A . 18 LYS H 1 1 17 15775 1 1 18 LYS HA H 3.743 -9.641 2.494 1.00 . A A . 18 LYS HA 1 1 17 15776 1 1 18 LYS HB2 H 4.408 -9.440 -0.299 1.00 . A A . 18 LYS HB2 1 1 17 15777 1 1 18 LYS HB3 H 5.856 -9.221 0.674 1.00 . A A . 18 LYS HB3 1 1 17 15778 1 1 18 LYS HD2 H 6.293 -10.585 2.429 1.00 . A A . 18 LYS HD2 1 1 17 15779 1 1 18 LYS HD3 H 5.485 -12.136 2.668 1.00 . A A . 18 LYS HD3 1 1 17 15780 1 1 18 LYS HE2 H 6.889 -12.654 0.420 1.00 . A A . 18 LYS HE2 1 1 17 15781 1 1 18 LYS HE3 H 7.956 -11.485 1.196 1.00 . A A . 18 LYS HE3 1 1 17 15782 1 1 18 LYS HG2 H 3.982 -11.509 1.153 1.00 . A A . 18 LYS HG2 1 1 17 15783 1 1 18 LYS HG3 H 5.254 -11.588 -0.067 1.00 . A A . 18 LYS HG3 1 1 17 15784 1 1 18 LYS HZ1 H 8.696 -13.407 2.133 1.00 . A A . 18 LYS HZ1 1 1 17 15785 1 1 18 LYS HZ2 H 7.189 -14.171 2.074 1.00 . A A . 18 LYS HZ2 1 1 17 15786 1 1 18 LYS HZ3 H 7.502 -13.009 3.262 1.00 . A A . 18 LYS HZ3 1 1 17 15787 1 1 18 LYS N N 2.795 -8.389 1.156 1.00 . A A . 18 LYS N 1 1 17 15788 1 1 18 LYS NZ N 7.675 -13.273 2.272 1.00 . A A . 18 LYS NZ 1 1 17 15789 1 1 18 LYS O O 6.057 -7.959 2.575 1.00 . A A . 18 LYS O 1 1 17 15790 1 1 19 ALA C C 4.118 -5.130 4.641 1.00 . A A . 19 ALA C 1 1 17 15791 1 1 19 ALA CA C 4.874 -5.599 3.403 1.00 . A A . 19 ALA CA 1 1 17 15792 1 1 19 ALA CB C 5.040 -4.451 2.417 1.00 . A A . 19 ALA CB 1 1 17 15793 1 1 19 ALA H H 3.228 -6.656 2.602 1.00 . A A . 19 ALA H 1 1 17 15794 1 1 19 ALA HA H 5.858 -5.933 3.699 1.00 . A A . 19 ALA HA 1 1 17 15795 1 1 19 ALA HB1 H 4.249 -4.490 1.683 1.00 . A A . 19 ALA HB1 1 1 17 15796 1 1 19 ALA HB2 H 5.996 -4.538 1.922 1.00 . A A . 19 ALA HB2 1 1 17 15797 1 1 19 ALA HB3 H 4.994 -3.511 2.948 1.00 . A A . 19 ALA HB3 1 1 17 15798 1 1 19 ALA N N 4.192 -6.717 2.764 1.00 . A A . 19 ALA N 1 1 17 15799 1 1 19 ALA O O 4.713 -4.910 5.696 1.00 . A A . 19 ALA O 1 1 17 15800 1 1 20 LEU C C 1.654 -5.691 6.555 1.00 . A A . 20 LEU C 1 1 17 15801 1 1 20 LEU CA C 1.968 -4.533 5.612 1.00 . A A . 20 LEU CA 1 1 17 15802 1 1 20 LEU CB C 0.669 -3.923 5.084 1.00 . A A . 20 LEU CB 1 1 17 15803 1 1 20 LEU CD1 C -0.411 -2.569 3.272 1.00 . A A . 20 LEU CD1 1 1 17 15804 1 1 20 LEU CD2 C 1.207 -1.487 4.842 1.00 . A A . 20 LEU CD2 1 1 17 15805 1 1 20 LEU CG C 0.850 -2.767 4.100 1.00 . A A . 20 LEU CG 1 1 17 15806 1 1 20 LEU H H 2.390 -5.169 3.638 1.00 . A A . 20 LEU H 1 1 17 15807 1 1 20 LEU HA H 2.514 -3.779 6.159 1.00 . A A . 20 LEU HA 1 1 17 15808 1 1 20 LEU HB2 H 0.104 -4.703 4.594 1.00 . A A . 20 LEU HB2 1 1 17 15809 1 1 20 LEU HB3 H 0.095 -3.563 5.927 1.00 . A A . 20 LEU HB3 1 1 17 15810 1 1 20 LEU HD11 H -0.536 -1.520 3.051 1.00 . A A . 20 LEU HD11 1 1 17 15811 1 1 20 LEU HD12 H -1.266 -2.925 3.825 1.00 . A A . 20 LEU HD12 1 1 17 15812 1 1 20 LEU HD13 H -0.324 -3.123 2.349 1.00 . A A . 20 LEU HD13 1 1 17 15813 1 1 20 LEU HD21 H 0.355 -1.153 5.415 1.00 . A A . 20 LEU HD21 1 1 17 15814 1 1 20 LEU HD22 H 1.486 -0.725 4.131 1.00 . A A . 20 LEU HD22 1 1 17 15815 1 1 20 LEU HD23 H 2.035 -1.678 5.508 1.00 . A A . 20 LEU HD23 1 1 17 15816 1 1 20 LEU HG H 1.659 -3.001 3.425 1.00 . A A . 20 LEU HG 1 1 17 15817 1 1 20 LEU N N 2.805 -4.977 4.505 1.00 . A A . 20 LEU N 1 1 17 15818 1 1 20 LEU O O 1.483 -5.496 7.759 1.00 . A A . 20 LEU O 1 1 17 15819 1 1 21 GLY C C -0.103 -8.620 6.546 1.00 . A A . 21 GLY C 1 1 17 15820 1 1 21 GLY CA C 1.284 -8.067 6.807 1.00 . A A . 21 GLY CA 1 1 17 15821 1 1 21 GLY H H 1.722 -6.992 5.036 1.00 . A A . 21 GLY H 1 1 17 15822 1 1 21 GLY HA2 H 2.012 -8.834 6.586 1.00 . A A . 21 GLY HA2 1 1 17 15823 1 1 21 GLY HA3 H 1.363 -7.801 7.851 1.00 . A A . 21 GLY HA3 1 1 17 15824 1 1 21 GLY N N 1.577 -6.897 6.001 1.00 . A A . 21 GLY N 1 1 17 15825 1 1 21 GLY O O -0.712 -9.228 7.426 1.00 . A A . 21 GLY O 1 1 17 15826 1 1 22 ILE C C -1.839 -9.912 3.832 1.00 . A A . 22 ILE C 1 1 17 15827 1 1 22 ILE CA C -1.929 -8.888 4.958 1.00 . A A . 22 ILE CA 1 1 17 15828 1 1 22 ILE CB C -2.841 -7.730 4.511 1.00 . A A . 22 ILE CB 1 1 17 15829 1 1 22 ILE CD1 C -3.105 -5.905 2.757 1.00 . A A . 22 ILE CD1 1 1 17 15830 1 1 22 ILE CG1 C -2.208 -6.975 3.341 1.00 . A A . 22 ILE CG1 1 1 17 15831 1 1 22 ILE CG2 C -3.110 -6.788 5.675 1.00 . A A . 22 ILE CG2 1 1 17 15832 1 1 22 ILE H H -0.070 -7.916 4.674 1.00 . A A . 22 ILE H 1 1 17 15833 1 1 22 ILE HA H -2.373 -9.356 5.825 1.00 . A A . 22 ILE HA 1 1 17 15834 1 1 22 ILE HB H -3.784 -8.147 4.193 1.00 . A A . 22 ILE HB 1 1 17 15835 1 1 22 ILE HD11 H -3.611 -6.295 1.887 1.00 . A A . 22 ILE HD11 1 1 17 15836 1 1 22 ILE HD12 H -2.507 -5.050 2.474 1.00 . A A . 22 ILE HD12 1 1 17 15837 1 1 22 ILE HD13 H -3.834 -5.605 3.494 1.00 . A A . 22 ILE HD13 1 1 17 15838 1 1 22 ILE HG12 H -1.300 -6.498 3.679 1.00 . A A . 22 ILE HG12 1 1 17 15839 1 1 22 ILE HG13 H -1.971 -7.676 2.554 1.00 . A A . 22 ILE HG13 1 1 17 15840 1 1 22 ILE HG21 H -4.039 -7.061 6.151 1.00 . A A . 22 ILE HG21 1 1 17 15841 1 1 22 ILE HG22 H -3.176 -5.775 5.309 1.00 . A A . 22 ILE HG22 1 1 17 15842 1 1 22 ILE HG23 H -2.305 -6.860 6.390 1.00 . A A . 22 ILE HG23 1 1 17 15843 1 1 22 ILE N N -0.604 -8.407 5.333 1.00 . A A . 22 ILE N 1 1 17 15844 1 1 22 ILE O O -0.749 -10.248 3.370 1.00 . A A . 22 ILE O 1 1 17 15845 1 1 23 SER C C -3.146 -10.712 0.961 1.00 . A A . 23 SER C 1 1 17 15846 1 1 23 SER CA C -3.045 -11.394 2.323 1.00 . A A . 23 SER CA 1 1 17 15847 1 1 23 SER CB C -4.232 -12.336 2.523 1.00 . A A . 23 SER CB 1 1 17 15848 1 1 23 SER H H -3.831 -10.101 3.803 1.00 . A A . 23 SER H 1 1 17 15849 1 1 23 SER HA H -2.131 -11.968 2.357 1.00 . A A . 23 SER HA 1 1 17 15850 1 1 23 SER HB2 H -4.340 -12.557 3.574 1.00 . A A . 23 SER HB2 1 1 17 15851 1 1 23 SER HB3 H -5.131 -11.861 2.159 1.00 . A A . 23 SER HB3 1 1 17 15852 1 1 23 SER HG H -4.058 -13.382 0.875 1.00 . A A . 23 SER HG 1 1 17 15853 1 1 23 SER N N -2.993 -10.407 3.395 1.00 . A A . 23 SER N 1 1 17 15854 1 1 23 SER O O -3.513 -9.541 0.869 1.00 . A A . 23 SER O 1 1 17 15855 1 1 23 SER OG O -4.043 -13.553 1.819 1.00 . A A . 23 SER OG 1 1 17 15856 1 1 24 ASP C C -4.284 -10.464 -1.797 1.00 . A A . 24 ASP C 1 1 17 15857 1 1 24 ASP CA C -2.871 -10.919 -1.447 1.00 . A A . 24 ASP CA 1 1 17 15858 1 1 24 ASP CB C -2.398 -11.972 -2.452 1.00 . A A . 24 ASP CB 1 1 17 15859 1 1 24 ASP CG C -1.090 -12.618 -2.038 1.00 . A A . 24 ASP CG 1 1 17 15860 1 1 24 ASP H H -2.531 -12.380 0.047 1.00 . A A . 24 ASP H 1 1 17 15861 1 1 24 ASP HA H -2.210 -10.066 -1.495 1.00 . A A . 24 ASP HA 1 1 17 15862 1 1 24 ASP HB2 H -3.148 -12.743 -2.537 1.00 . A A . 24 ASP HB2 1 1 17 15863 1 1 24 ASP HB3 H -2.258 -11.503 -3.416 1.00 . A A . 24 ASP HB3 1 1 17 15864 1 1 24 ASP N N -2.816 -11.452 -0.092 1.00 . A A . 24 ASP N 1 1 17 15865 1 1 24 ASP O O -4.472 -9.529 -2.575 1.00 . A A . 24 ASP O 1 1 17 15866 1 1 24 ASP OD1 O -0.363 -12.015 -1.221 1.00 . A A . 24 ASP OD1 1 1 17 15867 1 1 24 ASP OD2 O -0.794 -13.726 -2.531 1.00 . A A . 24 ASP OD2 1 1 17 15868 1 1 25 ALA C C -7.043 -9.467 -0.811 1.00 . A A . 25 ALA C 1 1 17 15869 1 1 25 ALA CA C -6.673 -10.795 -1.466 1.00 . A A . 25 ALA CA 1 1 17 15870 1 1 25 ALA CB C -7.580 -11.909 -0.962 1.00 . A A . 25 ALA CB 1 1 17 15871 1 1 25 ALA H H -5.064 -11.868 -0.605 1.00 . A A . 25 ALA H 1 1 17 15872 1 1 25 ALA HA H -6.807 -10.708 -2.534 1.00 . A A . 25 ALA HA 1 1 17 15873 1 1 25 ALA HB1 H -6.978 -12.709 -0.559 1.00 . A A . 25 ALA HB1 1 1 17 15874 1 1 25 ALA HB2 H -8.176 -12.285 -1.782 1.00 . A A . 25 ALA HB2 1 1 17 15875 1 1 25 ALA HB3 H -8.232 -11.524 -0.191 1.00 . A A . 25 ALA HB3 1 1 17 15876 1 1 25 ALA N N -5.277 -11.132 -1.216 1.00 . A A . 25 ALA N 1 1 17 15877 1 1 25 ALA O O -7.865 -8.716 -1.333 1.00 . A A . 25 ALA O 1 1 17 15878 1 1 26 ALA C C -6.369 -6.732 0.202 1.00 . A A . 26 ALA C 1 1 17 15879 1 1 26 ALA CA C -6.692 -7.950 1.059 1.00 . A A . 26 ALA CA 1 1 17 15880 1 1 26 ALA CB C -5.890 -7.916 2.351 1.00 . A A . 26 ALA CB 1 1 17 15881 1 1 26 ALA H H -5.781 -9.827 0.698 1.00 . A A . 26 ALA H 1 1 17 15882 1 1 26 ALA HA H -7.742 -7.931 1.313 1.00 . A A . 26 ALA HA 1 1 17 15883 1 1 26 ALA HB1 H -6.095 -8.807 2.926 1.00 . A A . 26 ALA HB1 1 1 17 15884 1 1 26 ALA HB2 H -6.170 -7.045 2.925 1.00 . A A . 26 ALA HB2 1 1 17 15885 1 1 26 ALA HB3 H -4.836 -7.870 2.120 1.00 . A A . 26 ALA HB3 1 1 17 15886 1 1 26 ALA N N -6.427 -9.187 0.333 1.00 . A A . 26 ALA N 1 1 17 15887 1 1 26 ALA O O -7.131 -5.765 0.168 1.00 . A A . 26 ALA O 1 1 17 15888 1 1 27 VAL C C -5.758 -5.517 -2.532 1.00 . A A . 27 VAL C 1 1 17 15889 1 1 27 VAL CA C -4.811 -5.685 -1.348 1.00 . A A . 27 VAL CA 1 1 17 15890 1 1 27 VAL CB C -3.380 -5.906 -1.874 1.00 . A A . 27 VAL CB 1 1 17 15891 1 1 27 VAL CG1 C -2.910 -4.702 -2.678 1.00 . A A . 27 VAL CG1 1 1 17 15892 1 1 27 VAL CG2 C -2.428 -6.189 -0.722 1.00 . A A . 27 VAL CG2 1 1 17 15893 1 1 27 VAL H H -4.671 -7.582 -0.421 1.00 . A A . 27 VAL H 1 1 17 15894 1 1 27 VAL HA H -4.821 -4.779 -0.760 1.00 . A A . 27 VAL HA 1 1 17 15895 1 1 27 VAL HB H -3.386 -6.767 -2.527 1.00 . A A . 27 VAL HB 1 1 17 15896 1 1 27 VAL HG11 H -1.905 -4.877 -3.032 1.00 . A A . 27 VAL HG11 1 1 17 15897 1 1 27 VAL HG12 H -2.922 -3.823 -2.051 1.00 . A A . 27 VAL HG12 1 1 17 15898 1 1 27 VAL HG13 H -3.568 -4.554 -3.521 1.00 . A A . 27 VAL HG13 1 1 17 15899 1 1 27 VAL HG21 H -2.484 -5.387 -0.002 1.00 . A A . 27 VAL HG21 1 1 17 15900 1 1 27 VAL HG22 H -1.419 -6.266 -1.099 1.00 . A A . 27 VAL HG22 1 1 17 15901 1 1 27 VAL HG23 H -2.706 -7.120 -0.247 1.00 . A A . 27 VAL HG23 1 1 17 15902 1 1 27 VAL N N -5.235 -6.784 -0.490 1.00 . A A . 27 VAL N 1 1 17 15903 1 1 27 VAL O O -6.197 -4.407 -2.836 1.00 . A A . 27 VAL O 1 1 17 15904 1 1 28 SER C C -8.385 -6.229 -3.922 1.00 . A A . 28 SER C 1 1 17 15905 1 1 28 SER CA C -6.967 -6.597 -4.346 1.00 . A A . 28 SER CA 1 1 17 15906 1 1 28 SER CB C -6.968 -7.957 -5.048 1.00 . A A . 28 SER CB 1 1 17 15907 1 1 28 SER H H -5.691 -7.480 -2.907 1.00 . A A . 28 SER H 1 1 17 15908 1 1 28 SER HA H -6.603 -5.849 -5.032 1.00 . A A . 28 SER HA 1 1 17 15909 1 1 28 SER HB2 H -7.316 -7.835 -6.063 1.00 . A A . 28 SER HB2 1 1 17 15910 1 1 28 SER HB3 H -5.965 -8.355 -5.057 1.00 . A A . 28 SER HB3 1 1 17 15911 1 1 28 SER HG H -7.670 -8.821 -3.436 1.00 . A A . 28 SER HG 1 1 17 15912 1 1 28 SER N N -6.070 -6.624 -3.196 1.00 . A A . 28 SER N 1 1 17 15913 1 1 28 SER O O -9.142 -5.644 -4.697 1.00 . A A . 28 SER O 1 1 17 15914 1 1 28 SER OG O -7.819 -8.874 -4.383 1.00 . A A . 28 SER OG 1 1 17 15915 1 1 29 GLN C C -10.220 -4.791 -1.862 1.00 . A A . 29 GLN C 1 1 17 15916 1 1 29 GLN CA C -10.060 -6.280 -2.163 1.00 . A A . 29 GLN CA 1 1 17 15917 1 1 29 GLN CB C -10.320 -7.098 -0.897 1.00 . A A . 29 GLN CB 1 1 17 15918 1 1 29 GLN CD C -10.950 -9.350 0.062 1.00 . A A . 29 GLN CD 1 1 17 15919 1 1 29 GLN CG C -10.920 -8.469 -1.172 1.00 . A A . 29 GLN CG 1 1 17 15920 1 1 29 GLN H H -8.093 -7.040 -2.119 1.00 . A A . 29 GLN H 1 1 17 15921 1 1 29 GLN HA H -10.790 -6.560 -2.915 1.00 . A A . 29 GLN HA 1 1 17 15922 1 1 29 GLN HB2 H -9.395 -7.236 -0.371 1.00 . A A . 29 GLN HB2 1 1 17 15923 1 1 29 GLN HB3 H -11.010 -6.551 -0.264 1.00 . A A . 29 GLN HB3 1 1 17 15924 1 1 29 GLN HE21 H -12.610 -10.236 -0.578 1.00 . A A . 29 GLN HE21 1 1 17 15925 1 1 29 GLN HE22 H -12.000 -10.798 0.935 1.00 . A A . 29 GLN HE22 1 1 17 15926 1 1 29 GLN HG2 H -11.930 -8.340 -1.527 1.00 . A A . 29 GLN HG2 1 1 17 15927 1 1 29 GLN HG3 H -10.340 -8.959 -1.933 1.00 . A A . 29 GLN HG3 1 1 17 15928 1 1 29 GLN N N -8.740 -6.575 -2.690 1.00 . A A . 29 GLN N 1 1 17 15929 1 1 29 GLN NE2 N -11.960 -10.215 0.149 1.00 . A A . 29 GLN NE2 1 1 17 15930 1 1 29 GLN O O -11.340 -4.290 -1.750 1.00 . A A . 29 GLN O 1 1 17 15931 1 1 29 GLN OE1 O -10.080 -9.255 0.927 1.00 . A A . 29 GLN OE1 1 1 17 15932 1 1 30 TRP C C -10.000 -1.908 -2.431 1.00 . A A . 30 TRP C 1 1 17 15933 1 1 30 TRP CA C -9.127 -2.657 -1.436 1.00 . A A . 30 TRP CA 1 1 17 15934 1 1 30 TRP CB C -7.709 -2.084 -1.469 1.00 . A A . 30 TRP CB 1 1 17 15935 1 1 30 TRP CD1 C -7.357 -2.906 0.935 1.00 . A A . 30 TRP CD1 1 1 17 15936 1 1 30 TRP CD2 C -5.475 -2.302 -0.117 1.00 . A A . 30 TRP CD2 1 1 17 15937 1 1 30 TRP CE2 C -5.143 -2.732 1.181 1.00 . A A . 30 TRP CE2 1 1 17 15938 1 1 30 TRP CE3 C -4.451 -1.874 -0.967 1.00 . A A . 30 TRP CE3 1 1 17 15939 1 1 30 TRP CG C -6.895 -2.424 -0.256 1.00 . A A . 30 TRP CG 1 1 17 15940 1 1 30 TRP CH2 C -2.850 -2.321 0.796 1.00 . A A . 30 TRP CH2 1 1 17 15941 1 1 30 TRP CZ2 C -3.832 -2.745 1.650 1.00 . A A . 30 TRP CZ2 1 1 17 15942 1 1 30 TRP CZ3 C -3.150 -1.888 -0.501 1.00 . A A . 30 TRP CZ3 1 1 17 15943 1 1 30 TRP H H -8.240 -4.540 -1.824 1.00 . A A . 30 TRP H 1 1 17 15944 1 1 30 TRP HA H -9.535 -2.528 -0.445 1.00 . A A . 30 TRP HA 1 1 17 15945 1 1 30 TRP HB2 H -7.193 -2.469 -2.334 1.00 . A A . 30 TRP HB2 1 1 17 15946 1 1 30 TRP HB3 H -7.766 -1.007 -1.541 1.00 . A A . 30 TRP HB3 1 1 17 15947 1 1 30 TRP HD1 H -8.396 -3.106 1.150 1.00 . A A . 30 TRP HD1 1 1 17 15948 1 1 30 TRP HE1 H -6.385 -3.434 2.722 1.00 . A A . 30 TRP HE1 1 1 17 15949 1 1 30 TRP HE3 H -4.662 -1.536 -1.970 1.00 . A A . 30 TRP HE3 1 1 17 15950 1 1 30 TRP HH2 H -1.820 -2.314 1.118 1.00 . A A . 30 TRP HH2 1 1 17 15951 1 1 30 TRP HZ2 H -3.584 -3.078 2.646 1.00 . A A . 30 TRP HZ2 1 1 17 15952 1 1 30 TRP HZ3 H -2.345 -1.560 -1.143 1.00 . A A . 30 TRP HZ3 1 1 17 15953 1 1 30 TRP N N -9.104 -4.088 -1.728 1.00 . A A . 30 TRP N 1 1 17 15954 1 1 30 TRP NE1 N -6.309 -3.095 1.806 1.00 . A A . 30 TRP NE1 1 1 17 15955 1 1 30 TRP O O -10.230 -2.371 -3.549 1.00 . A A . 30 TRP O 1 1 17 15956 1 1 31 LYS C C -10.600 1.306 -3.357 1.00 . A A . 31 LYS C 1 1 17 15957 1 1 31 LYS CA C -11.350 0.072 -2.867 1.00 . A A . 31 LYS CA 1 1 17 15958 1 1 31 LYS CB C -12.610 0.490 -2.102 1.00 . A A . 31 LYS CB 1 1 17 15959 1 1 31 LYS CD C -14.730 0.319 -3.438 1.00 . A A . 31 LYS CD 1 1 17 15960 1 1 31 LYS CE C -15.920 -0.563 -3.809 1.00 . A A . 31 LYS CE 1 1 17 15961 1 1 31 LYS CG C -13.830 -0.361 -2.425 1.00 . A A . 31 LYS CG 1 1 17 15962 1 1 31 LYS H H -10.280 -0.431 -1.115 1.00 . A A . 31 LYS H 1 1 17 15963 1 1 31 LYS HA H -11.640 -0.523 -3.720 1.00 . A A . 31 LYS HA 1 1 17 15964 1 1 31 LYS HB2 H -12.420 0.414 -1.043 1.00 . A A . 31 LYS HB2 1 1 17 15965 1 1 31 LYS HB3 H -12.840 1.516 -2.343 1.00 . A A . 31 LYS HB3 1 1 17 15966 1 1 31 LYS HD2 H -15.100 1.240 -3.013 1.00 . A A . 31 LYS HD2 1 1 17 15967 1 1 31 LYS HD3 H -14.160 0.535 -4.329 1.00 . A A . 31 LYS HD3 1 1 17 15968 1 1 31 LYS HE2 H -16.400 -0.149 -4.684 1.00 . A A . 31 LYS HE2 1 1 17 15969 1 1 31 LYS HE3 H -15.550 -1.554 -4.034 1.00 . A A . 31 LYS HE3 1 1 17 15970 1 1 31 LYS HG2 H -13.500 -1.306 -2.830 1.00 . A A . 31 LYS HG2 1 1 17 15971 1 1 31 LYS HG3 H -14.390 -0.534 -1.515 1.00 . A A . 31 LYS HG3 1 1 17 15972 1 1 31 LYS HZ1 H -16.580 -1.313 -1.978 1.00 . A A . 31 LYS HZ1 1 1 17 15973 1 1 31 LYS HZ2 H -17.820 -0.985 -3.076 1.00 . A A . 31 LYS HZ2 1 1 17 15974 1 1 31 LYS HZ3 H -17.050 0.285 -2.274 1.00 . A A . 31 LYS HZ3 1 1 17 15975 1 1 31 LYS N N -10.500 -0.746 -2.016 1.00 . A A . 31 LYS N 1 1 17 15976 1 1 31 LYS NZ N -16.910 -0.651 -2.707 1.00 . A A . 31 LYS NZ 1 1 17 15977 1 1 31 LYS O O -9.394 1.420 -3.167 1.00 . A A . 31 LYS O 1 1 17 15978 1 1 32 GLU C C -9.835 4.114 -3.442 1.00 . A A . 32 GLU C 1 1 17 15979 1 1 32 GLU CA C -10.720 3.457 -4.497 1.00 . A A . 32 GLU CA 1 1 17 15980 1 1 32 GLU CB C -11.810 4.435 -4.949 1.00 . A A . 32 GLU CB 1 1 17 15981 1 1 32 GLU CD C -13.030 5.094 -7.061 1.00 . A A . 32 GLU CD 1 1 17 15982 1 1 32 GLU CG C -11.680 4.856 -6.404 1.00 . A A . 32 GLU CG 1 1 17 15983 1 1 32 GLU H H -12.280 2.085 -4.106 1.00 . A A . 32 GLU H 1 1 17 15984 1 1 32 GLU HA H -10.110 3.195 -5.349 1.00 . A A . 32 GLU HA 1 1 17 15985 1 1 32 GLU HB2 H -12.770 3.966 -4.816 1.00 . A A . 32 GLU HB2 1 1 17 15986 1 1 32 GLU HB3 H -11.760 5.321 -4.334 1.00 . A A . 32 GLU HB3 1 1 17 15987 1 1 32 GLU HG2 H -11.110 5.768 -6.453 1.00 . A A . 32 GLU HG2 1 1 17 15988 1 1 32 GLU HG3 H -11.170 4.077 -6.946 1.00 . A A . 32 GLU HG3 1 1 17 15989 1 1 32 GLU N N -11.320 2.230 -3.984 1.00 . A A . 32 GLU N 1 1 17 15990 1 1 32 GLU O O -8.868 4.800 -3.770 1.00 . A A . 32 GLU O 1 1 17 15991 1 1 32 GLU OE1 O -13.740 6.019 -6.626 1.00 . A A . 32 GLU OE1 1 1 17 15992 1 1 32 GLU OE2 O -13.360 4.356 -8.012 1.00 . A A . 32 GLU OE2 1 1 17 15993 1 1 33 VAL C C -8.987 3.368 -0.085 1.00 . A A . 33 VAL C 1 1 17 15994 1 1 33 VAL CA C -9.402 4.457 -1.071 1.00 . A A . 33 VAL CA 1 1 17 15995 1 1 33 VAL CB C -10.200 5.535 -0.319 1.00 . A A . 33 VAL CB 1 1 17 15996 1 1 33 VAL CG1 C -9.340 6.216 0.730 1.00 . A A . 33 VAL CG1 1 1 17 15997 1 1 33 VAL CG2 C -10.770 6.557 -1.294 1.00 . A A . 33 VAL CG2 1 1 17 15998 1 1 33 VAL H H -10.950 3.335 -1.976 1.00 . A A . 33 VAL H 1 1 17 15999 1 1 33 VAL HA H -8.516 4.917 -1.481 1.00 . A A . 33 VAL HA 1 1 17 16000 1 1 33 VAL HB H -11.030 5.054 0.186 1.00 . A A . 33 VAL HB 1 1 17 16001 1 1 33 VAL HG11 H -8.500 5.582 0.969 1.00 . A A . 33 VAL HG11 1 1 17 16002 1 1 33 VAL HG12 H -9.926 6.391 1.621 1.00 . A A . 33 VAL HG12 1 1 17 16003 1 1 33 VAL HG13 H -8.982 7.159 0.343 1.00 . A A . 33 VAL HG13 1 1 17 16004 1 1 33 VAL HG21 H -10.770 6.141 -2.291 1.00 . A A . 33 VAL HG21 1 1 17 16005 1 1 33 VAL HG22 H -10.160 7.449 -1.277 1.00 . A A . 33 VAL HG22 1 1 17 16006 1 1 33 VAL HG23 H -11.780 6.805 -1.007 1.00 . A A . 33 VAL HG23 1 1 17 16007 1 1 33 VAL N N -10.170 3.893 -2.175 1.00 . A A . 33 VAL N 1 1 17 16008 1 1 33 VAL O O -9.832 2.690 0.498 1.00 . A A . 33 VAL O 1 1 17 16009 1 1 34 ILE C C -7.718 2.376 2.415 1.00 . A A . 34 ILE C 1 1 17 16010 1 1 34 ILE CA C -7.152 2.198 1.009 1.00 . A A . 34 ILE CA 1 1 17 16011 1 1 34 ILE CB C -5.615 2.253 1.083 1.00 . A A . 34 ILE CB 1 1 17 16012 1 1 34 ILE CD1 C -3.668 3.710 1.818 1.00 . A A . 34 ILE CD1 1 1 17 16013 1 1 34 ILE CG1 C -5.155 3.633 1.551 1.00 . A A . 34 ILE CG1 1 1 17 16014 1 1 34 ILE CG2 C -5.003 1.917 -0.266 1.00 . A A . 34 ILE CG2 1 1 17 16015 1 1 34 ILE H H -7.055 3.777 -0.399 1.00 . A A . 34 ILE H 1 1 17 16016 1 1 34 ILE HA H -7.440 1.226 0.635 1.00 . A A . 34 ILE HA 1 1 17 16017 1 1 34 ILE HB H -5.284 1.512 1.794 1.00 . A A . 34 ILE HB 1 1 17 16018 1 1 34 ILE HD11 H -3.127 3.458 0.919 1.00 . A A . 34 ILE HD11 1 1 17 16019 1 1 34 ILE HD12 H -3.409 3.016 2.601 1.00 . A A . 34 ILE HD12 1 1 17 16020 1 1 34 ILE HD13 H -3.409 4.714 2.125 1.00 . A A . 34 ILE HD13 1 1 17 16021 1 1 34 ILE HG12 H -5.394 4.363 0.793 1.00 . A A . 34 ILE HG12 1 1 17 16022 1 1 34 ILE HG13 H -5.670 3.886 2.466 1.00 . A A . 34 ILE HG13 1 1 17 16023 1 1 34 ILE HG21 H -4.813 0.855 -0.321 1.00 . A A . 34 ILE HG21 1 1 17 16024 1 1 34 ILE HG22 H -4.074 2.456 -0.384 1.00 . A A . 34 ILE HG22 1 1 17 16025 1 1 34 ILE HG23 H -5.686 2.202 -1.053 1.00 . A A . 34 ILE HG23 1 1 17 16026 1 1 34 ILE N N -7.681 3.207 0.095 1.00 . A A . 34 ILE N 1 1 17 16027 1 1 34 ILE O O -8.151 3.468 2.786 1.00 . A A . 34 ILE O 1 1 17 16028 1 1 35 PRO C C -7.587 2.458 5.416 1.00 . A A . 35 PRO C 1 1 17 16029 1 1 35 PRO CA C -8.231 1.346 4.596 1.00 . A A . 35 PRO CA 1 1 17 16030 1 1 35 PRO CB C -7.855 -0.025 5.163 1.00 . A A . 35 PRO CB 1 1 17 16031 1 1 35 PRO CD C -7.217 -0.039 2.863 1.00 . A A . 35 PRO CD 1 1 17 16032 1 1 35 PRO CG C -7.741 -0.909 3.971 1.00 . A A . 35 PRO CG 1 1 17 16033 1 1 35 PRO HA H -9.305 1.463 4.612 1.00 . A A . 35 PRO HA 1 1 17 16034 1 1 35 PRO HB2 H -6.917 0.047 5.693 1.00 . A A . 35 PRO HB2 1 1 17 16035 1 1 35 PRO HB3 H -8.629 -0.365 5.834 1.00 . A A . 35 PRO HB3 1 1 17 16036 1 1 35 PRO HD2 H -6.138 -0.056 2.847 1.00 . A A . 35 PRO HD2 1 1 17 16037 1 1 35 PRO HD3 H -7.618 -0.356 1.911 1.00 . A A . 35 PRO HD3 1 1 17 16038 1 1 35 PRO HG2 H -7.052 -1.714 4.174 1.00 . A A . 35 PRO HG2 1 1 17 16039 1 1 35 PRO HG3 H -8.714 -1.301 3.711 1.00 . A A . 35 PRO HG3 1 1 17 16040 1 1 35 PRO N N -7.718 1.300 3.223 1.00 . A A . 35 PRO N 1 1 17 16041 1 1 35 PRO O O -6.808 3.255 4.894 1.00 . A A . 35 PRO O 1 1 17 16042 1 1 36 GLU C C -6.080 3.048 8.246 1.00 . A A . 36 GLU C 1 1 17 16043 1 1 36 GLU CA C -7.375 3.523 7.595 1.00 . A A . 36 GLU CA 1 1 17 16044 1 1 36 GLU CB C -8.399 3.884 8.673 1.00 . A A . 36 GLU CB 1 1 17 16045 1 1 36 GLU CD C -8.986 5.399 10.608 1.00 . A A . 36 GLU CD 1 1 17 16046 1 1 36 GLU CG C -7.897 4.917 9.670 1.00 . A A . 36 GLU CG 1 1 17 16047 1 1 36 GLU H H -8.547 1.845 7.059 1.00 . A A . 36 GLU H 1 1 17 16048 1 1 36 GLU HA H -7.164 4.404 7.004 1.00 . A A . 36 GLU HA 1 1 17 16049 1 1 36 GLU HB2 H -9.284 4.277 8.196 1.00 . A A . 36 GLU HB2 1 1 17 16050 1 1 36 GLU HB3 H -8.662 2.989 9.217 1.00 . A A . 36 GLU HB3 1 1 17 16051 1 1 36 GLU HG2 H -7.106 4.476 10.259 1.00 . A A . 36 GLU HG2 1 1 17 16052 1 1 36 GLU HG3 H -7.510 5.766 9.126 1.00 . A A . 36 GLU HG3 1 1 17 16053 1 1 36 GLU N N -7.919 2.507 6.701 1.00 . A A . 36 GLU N 1 1 17 16054 1 1 36 GLU O O -5.126 3.814 8.386 1.00 . A A . 36 GLU O 1 1 17 16055 1 1 36 GLU OE1 O -10.170 5.240 10.267 1.00 . A A . 36 GLU OE1 1 1 17 16056 1 1 36 GLU OE2 O -8.649 5.935 11.685 1.00 . A A . 36 GLU OE2 1 1 17 16057 1 1 37 LYS C C -3.827 0.787 8.273 1.00 . A A . 37 LYS C 1 1 17 16058 1 1 37 LYS CA C -4.875 1.211 9.297 1.00 . A A . 37 LYS CA 1 1 17 16059 1 1 37 LYS CB C -5.271 0.014 10.162 1.00 . A A . 37 LYS CB 1 1 17 16060 1 1 37 LYS CD C -6.158 -0.745 12.388 1.00 . A A . 37 LYS CD 1 1 17 16061 1 1 37 LYS CE C -4.815 -0.958 13.068 1.00 . A A . 37 LYS CE 1 1 17 16062 1 1 37 LYS CG C -6.100 0.392 11.380 1.00 . A A . 37 LYS CG 1 1 17 16063 1 1 37 LYS H H -6.845 1.220 8.519 1.00 . A A . 37 LYS H 1 1 17 16064 1 1 37 LYS HA H -4.446 1.974 9.928 1.00 . A A . 37 LYS HA 1 1 17 16065 1 1 37 LYS HB2 H -5.845 -0.676 9.563 1.00 . A A . 37 LYS HB2 1 1 17 16066 1 1 37 LYS HB3 H -4.374 -0.479 10.506 1.00 . A A . 37 LYS HB3 1 1 17 16067 1 1 37 LYS HD2 H -6.896 -0.508 13.140 1.00 . A A . 37 LYS HD2 1 1 17 16068 1 1 37 LYS HD3 H -6.442 -1.652 11.876 1.00 . A A . 37 LYS HD3 1 1 17 16069 1 1 37 LYS HE2 H -4.460 -1.951 12.830 1.00 . A A . 37 LYS HE2 1 1 17 16070 1 1 37 LYS HE3 H -4.113 -0.227 12.692 1.00 . A A . 37 LYS HE3 1 1 17 16071 1 1 37 LYS HG2 H -5.657 1.256 11.851 1.00 . A A . 37 LYS HG2 1 1 17 16072 1 1 37 LYS HG3 H -7.105 0.629 11.059 1.00 . A A . 37 LYS HG3 1 1 17 16073 1 1 37 LYS HZ1 H -5.887 -1.004 14.859 1.00 . A A . 37 LYS HZ1 1 1 17 16074 1 1 37 LYS HZ2 H -4.641 0.139 14.836 1.00 . A A . 37 LYS HZ2 1 1 17 16075 1 1 37 LYS HZ3 H -4.279 -1.504 15.011 1.00 . A A . 37 LYS HZ3 1 1 17 16076 1 1 37 LYS N N -6.054 1.782 8.651 1.00 . A A . 37 LYS N 1 1 17 16077 1 1 37 LYS NZ N -4.912 -0.823 14.546 1.00 . A A . 37 LYS NZ 1 1 17 16078 1 1 37 LYS O O -2.659 0.603 8.612 1.00 . A A . 37 LYS O 1 1 17 16079 1 1 38 ASP C C -2.508 1.451 5.501 1.00 . A A . 38 ASP C 1 1 17 16080 1 1 38 ASP CA C -3.319 0.247 5.962 1.00 . A A . 38 ASP CA 1 1 17 16081 1 1 38 ASP CB C -4.081 -0.364 4.785 1.00 . A A . 38 ASP CB 1 1 17 16082 1 1 38 ASP CG C -4.020 -1.879 4.783 1.00 . A A . 38 ASP CG 1 1 17 16083 1 1 38 ASP H H -5.181 0.804 6.798 1.00 . A A . 38 ASP H 1 1 17 16084 1 1 38 ASP HA H -2.644 -0.491 6.370 1.00 . A A . 38 ASP HA 1 1 17 16085 1 1 38 ASP HB2 H -5.116 -0.064 4.839 1.00 . A A . 38 ASP HB2 1 1 17 16086 1 1 38 ASP HB3 H -3.653 -0.003 3.860 1.00 . A A . 38 ASP HB3 1 1 17 16087 1 1 38 ASP N N -4.241 0.642 7.018 1.00 . A A . 38 ASP N 1 1 17 16088 1 1 38 ASP O O -1.283 1.383 5.392 1.00 . A A . 38 ASP O 1 1 17 16089 1 1 38 ASP OD1 O -3.012 -2.432 5.272 1.00 . A A . 38 ASP OD1 1 1 17 16090 1 1 38 ASP OD2 O -4.979 -2.511 4.294 1.00 . A A . 38 ASP OD2 1 1 17 16091 1 1 39 ALA C C -1.484 4.218 5.823 1.00 . A A . 39 ALA C 1 1 17 16092 1 1 39 ALA CA C -2.540 3.783 4.813 1.00 . A A . 39 ALA CA 1 1 17 16093 1 1 39 ALA CB C -3.566 4.889 4.610 1.00 . A A . 39 ALA CB 1 1 17 16094 1 1 39 ALA H H -4.170 2.553 5.360 1.00 . A A . 39 ALA H 1 1 17 16095 1 1 39 ALA HA H -2.060 3.591 3.866 1.00 . A A . 39 ALA HA 1 1 17 16096 1 1 39 ALA HB1 H -3.116 5.700 4.057 1.00 . A A . 39 ALA HB1 1 1 17 16097 1 1 39 ALA HB2 H -3.900 5.250 5.571 1.00 . A A . 39 ALA HB2 1 1 17 16098 1 1 39 ALA HB3 H -4.409 4.501 4.059 1.00 . A A . 39 ALA HB3 1 1 17 16099 1 1 39 ALA N N -3.198 2.558 5.246 1.00 . A A . 39 ALA N 1 1 17 16100 1 1 39 ALA O O -0.519 4.898 5.474 1.00 . A A . 39 ALA O 1 1 17 16101 1 1 40 TYR C C 0.536 3.315 8.041 1.00 . A A . 40 TYR C 1 1 17 16102 1 1 40 TYR CA C -0.729 4.163 8.136 1.00 . A A . 40 TYR CA 1 1 17 16103 1 1 40 TYR CB C -1.382 3.975 9.507 1.00 . A A . 40 TYR CB 1 1 17 16104 1 1 40 TYR CD1 C 0.060 5.566 10.831 1.00 . A A . 40 TYR CD1 1 1 17 16105 1 1 40 TYR CD2 C -0.110 3.311 11.583 1.00 . A A . 40 TYR CD2 1 1 17 16106 1 1 40 TYR CE1 C 0.904 5.858 11.884 1.00 . A A . 40 TYR CE1 1 1 17 16107 1 1 40 TYR CE2 C 0.733 3.595 12.640 1.00 . A A . 40 TYR CE2 1 1 17 16108 1 1 40 TYR CG C -0.461 4.290 10.663 1.00 . A A . 40 TYR CG 1 1 17 16109 1 1 40 TYR CZ C 1.238 4.870 12.785 1.00 . A A . 40 TYR CZ 1 1 17 16110 1 1 40 TYR H H -2.457 3.274 7.301 1.00 . A A . 40 TYR H 1 1 17 16111 1 1 40 TYR HA H -0.460 5.202 8.014 1.00 . A A . 40 TYR HA 1 1 17 16112 1 1 40 TYR HB2 H -2.241 4.627 9.582 1.00 . A A . 40 TYR HB2 1 1 17 16113 1 1 40 TYR HB3 H -1.702 2.947 9.607 1.00 . A A . 40 TYR HB3 1 1 17 16114 1 1 40 TYR HD1 H -0.204 6.336 10.124 1.00 . A A . 40 TYR HD1 1 1 17 16115 1 1 40 TYR HD2 H -0.506 2.312 11.463 1.00 . A A . 40 TYR HD2 1 1 17 16116 1 1 40 TYR HE1 H 1.299 6.857 11.996 1.00 . A A . 40 TYR HE1 1 1 17 16117 1 1 40 TYR HE2 H 0.995 2.820 13.345 1.00 . A A . 40 TYR HE2 1 1 17 16118 1 1 40 TYR HH H 1.566 5.244 14.644 1.00 . A A . 40 TYR HH 1 1 17 16119 1 1 40 TYR N N -1.669 3.817 7.079 1.00 . A A . 40 TYR N 1 1 17 16120 1 1 40 TYR O O 1.650 3.835 8.073 1.00 . A A . 40 TYR O 1 1 17 16121 1 1 40 TYR OH O 2.079 5.157 13.837 1.00 . A A . 40 TYR OH 1 1 17 16122 1 1 41 ARG C C 2.231 1.266 6.515 1.00 . A A . 41 ARG C 1 1 17 16123 1 1 41 ARG CA C 1.479 1.079 7.828 1.00 . A A . 41 ARG CA 1 1 17 16124 1 1 41 ARG CB C 0.990 -0.366 7.946 1.00 . A A . 41 ARG CB 1 1 17 16125 1 1 41 ARG CD C -0.342 -1.728 9.587 1.00 . A A . 41 ARG CD 1 1 17 16126 1 1 41 ARG CG C 0.889 -0.859 9.381 1.00 . A A . 41 ARG CG 1 1 17 16127 1 1 41 ARG CZ C -0.972 -1.177 11.904 1.00 . A A . 41 ARG CZ 1 1 17 16128 1 1 41 ARG H H -0.558 1.648 7.908 1.00 . A A . 41 ARG H 1 1 17 16129 1 1 41 ARG HA H 2.151 1.289 8.647 1.00 . A A . 41 ARG HA 1 1 17 16130 1 1 41 ARG HB2 H 0.012 -0.439 7.494 1.00 . A A . 41 ARG HB2 1 1 17 16131 1 1 41 ARG HB3 H 1.673 -1.011 7.413 1.00 . A A . 41 ARG HB3 1 1 17 16132 1 1 41 ARG HD2 H -1.207 -1.198 9.219 1.00 . A A . 41 ARG HD2 1 1 17 16133 1 1 41 ARG HD3 H -0.216 -2.645 9.030 1.00 . A A . 41 ARG HD3 1 1 17 16134 1 1 41 ARG HE H -0.369 -2.974 11.278 1.00 . A A . 41 ARG HE 1 1 17 16135 1 1 41 ARG HG2 H 1.769 -1.438 9.614 1.00 . A A . 41 ARG HG2 1 1 17 16136 1 1 41 ARG HG3 H 0.833 -0.006 10.041 1.00 . A A . 41 ARG HG3 1 1 17 16137 1 1 41 ARG HH11 H -1.108 0.370 10.610 1.00 . A A . 41 ARG HH11 1 1 17 16138 1 1 41 ARG HH12 H -1.546 0.731 12.244 1.00 . A A . 41 ARG HH12 1 1 17 16139 1 1 41 ARG HH21 H -0.944 -2.502 13.431 1.00 . A A . 41 ARG HH21 1 1 17 16140 1 1 41 ARG HH22 H -1.450 -0.899 13.848 1.00 . A A . 41 ARG HH22 1 1 17 16141 1 1 41 ARG N N 0.354 2.002 7.926 1.00 . A A . 41 ARG N 1 1 17 16142 1 1 41 ARG NE N -0.551 -2.054 10.995 1.00 . A A . 41 ARG NE 1 1 17 16143 1 1 41 ARG NH1 N -1.229 0.077 11.557 1.00 . A A . 41 ARG NH1 1 1 17 16144 1 1 41 ARG NH2 N -1.136 -1.558 13.165 1.00 . A A . 41 ARG NH2 1 1 17 16145 1 1 41 ARG O O 3.440 1.044 6.443 1.00 . A A . 41 ARG O 1 1 17 16146 1 1 42 LEU C C 3.230 2.925 4.237 1.00 . A A . 42 LEU C 1 1 17 16147 1 1 42 LEU CA C 2.111 1.890 4.165 1.00 . A A . 42 LEU CA 1 1 17 16148 1 1 42 LEU CB C 1.050 2.342 3.161 1.00 . A A . 42 LEU CB 1 1 17 16149 1 1 42 LEU CD1 C -1.255 1.863 2.298 1.00 . A A . 42 LEU CD1 1 1 17 16150 1 1 42 LEU CD2 C 0.671 0.439 1.576 1.00 . A A . 42 LEU CD2 1 1 17 16151 1 1 42 LEU CG C 0.075 1.252 2.714 1.00 . A A . 42 LEU CG 1 1 17 16152 1 1 42 LEU H H 0.551 1.834 5.594 1.00 . A A . 42 LEU H 1 1 17 16153 1 1 42 LEU HA H 2.527 0.950 3.834 1.00 . A A . 42 LEU HA 1 1 17 16154 1 1 42 LEU HB2 H 0.480 3.144 3.609 1.00 . A A . 42 LEU HB2 1 1 17 16155 1 1 42 LEU HB3 H 1.550 2.726 2.285 1.00 . A A . 42 LEU HB3 1 1 17 16156 1 1 42 LEU HD11 H -1.118 2.913 2.082 1.00 . A A . 42 LEU HD11 1 1 17 16157 1 1 42 LEU HD12 H -1.969 1.753 3.101 1.00 . A A . 42 LEU HD12 1 1 17 16158 1 1 42 LEU HD13 H -1.624 1.361 1.416 1.00 . A A . 42 LEU HD13 1 1 17 16159 1 1 42 LEU HD21 H 1.163 1.102 0.880 1.00 . A A . 42 LEU HD21 1 1 17 16160 1 1 42 LEU HD22 H -0.114 -0.099 1.066 1.00 . A A . 42 LEU HD22 1 1 17 16161 1 1 42 LEU HD23 H 1.390 -0.264 1.973 1.00 . A A . 42 LEU HD23 1 1 17 16162 1 1 42 LEU HG H -0.112 0.583 3.542 1.00 . A A . 42 LEU HG 1 1 17 16163 1 1 42 LEU N N 1.509 1.675 5.476 1.00 . A A . 42 LEU N 1 1 17 16164 1 1 42 LEU O O 4.264 2.780 3.587 1.00 . A A . 42 LEU O 1 1 17 16165 1 1 43 GLU C C 5.257 4.521 5.886 1.00 . A A . 43 GLU C 1 1 17 16166 1 1 43 GLU CA C 4.001 5.032 5.183 1.00 . A A . 43 GLU CA 1 1 17 16167 1 1 43 GLU CB C 3.402 6.205 5.961 1.00 . A A . 43 GLU CB 1 1 17 16168 1 1 43 GLU CD C 4.076 8.638 6.101 1.00 . A A . 43 GLU CD 1 1 17 16169 1 1 43 GLU CG C 3.508 7.535 5.231 1.00 . A A . 43 GLU CG 1 1 17 16170 1 1 43 GLU H H 2.166 4.031 5.518 1.00 . A A . 43 GLU H 1 1 17 16171 1 1 43 GLU HA H 4.275 5.371 4.194 1.00 . A A . 43 GLU HA 1 1 17 16172 1 1 43 GLU HB2 H 2.358 6.004 6.146 1.00 . A A . 43 GLU HB2 1 1 17 16173 1 1 43 GLU HB3 H 3.915 6.298 6.906 1.00 . A A . 43 GLU HB3 1 1 17 16174 1 1 43 GLU HG2 H 4.150 7.410 4.372 1.00 . A A . 43 GLU HG2 1 1 17 16175 1 1 43 GLU HG3 H 2.521 7.829 4.900 1.00 . A A . 43 GLU HG3 1 1 17 16176 1 1 43 GLU N N 3.012 3.970 5.029 1.00 . A A . 43 GLU N 1 1 17 16177 1 1 43 GLU O O 6.312 5.153 5.823 1.00 . A A . 43 GLU O 1 1 17 16178 1 1 43 GLU OE1 O 4.883 8.327 7.002 1.00 . A A . 43 GLU OE1 1 1 17 16179 1 1 43 GLU OE2 O 3.713 9.813 5.883 1.00 . A A . 43 GLU OE2 1 1 17 16180 1 1 44 ILE C C 7.044 1.834 6.367 1.00 . A A . 44 ILE C 1 1 17 16181 1 1 44 ILE CA C 6.277 2.797 7.264 1.00 . A A . 44 ILE CA 1 1 17 16182 1 1 44 ILE CB C 5.827 2.053 8.534 1.00 . A A . 44 ILE CB 1 1 17 16183 1 1 44 ILE CD1 C 4.944 2.679 10.853 1.00 . A A . 44 ILE CD1 1 1 17 16184 1 1 44 ILE CG1 C 4.898 2.949 9.364 1.00 . A A . 44 ILE CG1 1 1 17 16185 1 1 44 ILE CG2 C 7.041 1.611 9.341 1.00 . A A . 44 ILE CG2 1 1 17 16186 1 1 44 ILE H H 4.281 2.916 6.576 1.00 . A A . 44 ILE H 1 1 17 16187 1 1 44 ILE HA H 6.935 3.601 7.562 1.00 . A A . 44 ILE HA 1 1 17 16188 1 1 44 ILE HB H 5.285 1.168 8.232 1.00 . A A . 44 ILE HB 1 1 17 16189 1 1 44 ILE HD11 H 5.945 2.852 11.216 1.00 . A A . 44 ILE HD11 1 1 17 16190 1 1 44 ILE HD12 H 4.664 1.652 11.041 1.00 . A A . 44 ILE HD12 1 1 17 16191 1 1 44 ILE HD13 H 4.255 3.339 11.359 1.00 . A A . 44 ILE HD13 1 1 17 16192 1 1 44 ILE HG12 H 5.176 3.981 9.210 1.00 . A A . 44 ILE HG12 1 1 17 16193 1 1 44 ILE HG13 H 3.881 2.805 9.031 1.00 . A A . 44 ILE HG13 1 1 17 16194 1 1 44 ILE HG21 H 6.757 0.816 10.014 1.00 . A A . 44 ILE HG21 1 1 17 16195 1 1 44 ILE HG22 H 7.418 2.447 9.912 1.00 . A A . 44 ILE HG22 1 1 17 16196 1 1 44 ILE HG23 H 7.810 1.257 8.670 1.00 . A A . 44 ILE HG23 1 1 17 16197 1 1 44 ILE N N 5.143 3.379 6.557 1.00 . A A . 44 ILE N 1 1 17 16198 1 1 44 ILE O O 8.271 1.895 6.272 1.00 . A A . 44 ILE O 1 1 17 16199 1 1 45 VAL C C 7.639 0.637 3.658 1.00 . A A . 45 VAL C 1 1 17 16200 1 1 45 VAL CA C 6.912 -0.040 4.813 1.00 . A A . 45 VAL CA 1 1 17 16201 1 1 45 VAL CB C 5.852 -0.995 4.235 1.00 . A A . 45 VAL CB 1 1 17 16202 1 1 45 VAL CG1 C 5.304 -1.909 5.321 1.00 . A A . 45 VAL CG1 1 1 17 16203 1 1 45 VAL CG2 C 4.729 -0.215 3.565 1.00 . A A . 45 VAL CG2 1 1 17 16204 1 1 45 VAL H H 5.339 0.947 5.828 1.00 . A A . 45 VAL H 1 1 17 16205 1 1 45 VAL HA H 7.621 -0.622 5.383 1.00 . A A . 45 VAL HA 1 1 17 16206 1 1 45 VAL HB H 6.327 -1.609 3.485 1.00 . A A . 45 VAL HB 1 1 17 16207 1 1 45 VAL HG11 H 5.395 -1.422 6.281 1.00 . A A . 45 VAL HG11 1 1 17 16208 1 1 45 VAL HG12 H 5.865 -2.832 5.332 1.00 . A A . 45 VAL HG12 1 1 17 16209 1 1 45 VAL HG13 H 4.264 -2.121 5.122 1.00 . A A . 45 VAL HG13 1 1 17 16210 1 1 45 VAL HG21 H 3.874 -0.858 3.434 1.00 . A A . 45 VAL HG21 1 1 17 16211 1 1 45 VAL HG22 H 5.065 0.142 2.603 1.00 . A A . 45 VAL HG22 1 1 17 16212 1 1 45 VAL HG23 H 4.456 0.626 4.185 1.00 . A A . 45 VAL HG23 1 1 17 16213 1 1 45 VAL N N 6.311 0.943 5.709 1.00 . A A . 45 VAL N 1 1 17 16214 1 1 45 VAL O O 8.740 0.238 3.283 1.00 . A A . 45 VAL O 1 1 17 16215 1 1 46 THR C C 8.623 3.410 2.432 1.00 . A A . 46 THR C 1 1 17 16216 1 1 46 THR CA C 7.575 2.392 1.974 1.00 . A A . 46 THR CA 1 1 17 16217 1 1 46 THR CB C 6.462 3.103 1.210 1.00 . A A . 46 THR CB 1 1 17 16218 1 1 46 THR CG2 C 5.433 2.154 0.631 1.00 . A A . 46 THR CG2 1 1 17 16219 1 1 46 THR H H 6.128 1.921 3.430 1.00 . A A . 46 THR H 1 1 17 16220 1 1 46 THR HA H 8.047 1.679 1.317 1.00 . A A . 46 THR HA 1 1 17 16221 1 1 46 THR HB H 6.897 3.654 0.397 1.00 . A A . 46 THR HB 1 1 17 16222 1 1 46 THR HG1 H 5.078 4.447 1.556 1.00 . A A . 46 THR HG1 1 1 17 16223 1 1 46 THR HG21 H 5.935 1.319 0.166 1.00 . A A . 46 THR HG21 1 1 17 16224 1 1 46 THR HG22 H 4.840 2.673 -0.108 1.00 . A A . 46 THR HG22 1 1 17 16225 1 1 46 THR HG23 H 4.790 1.793 1.420 1.00 . A A . 46 THR HG23 1 1 17 16226 1 1 46 THR N N 7.006 1.659 3.093 1.00 . A A . 46 THR N 1 1 17 16227 1 1 46 THR O O 9.148 4.174 1.622 1.00 . A A . 46 THR O 1 1 17 16228 1 1 46 THR OG1 O 5.778 4.015 2.052 1.00 . A A . 46 THR OG1 1 1 17 16229 1 1 47 ALA C C 9.440 5.784 4.170 1.00 . A A . 47 ALA C 1 1 17 16230 1 1 47 ALA CA C 9.919 4.341 4.274 1.00 . A A . 47 ALA CA 1 1 17 16231 1 1 47 ALA CB C 11.253 4.172 3.562 1.00 . A A . 47 ALA CB 1 1 17 16232 1 1 47 ALA H H 8.487 2.787 4.331 1.00 . A A . 47 ALA H 1 1 17 16233 1 1 47 ALA HA H 10.062 4.096 5.316 1.00 . A A . 47 ALA HA 1 1 17 16234 1 1 47 ALA HB1 H 11.304 3.186 3.123 1.00 . A A . 47 ALA HB1 1 1 17 16235 1 1 47 ALA HB2 H 12.059 4.292 4.271 1.00 . A A . 47 ALA HB2 1 1 17 16236 1 1 47 ALA HB3 H 11.344 4.917 2.785 1.00 . A A . 47 ALA HB3 1 1 17 16237 1 1 47 ALA N N 8.932 3.416 3.729 1.00 . A A . 47 ALA N 1 1 17 16238 1 1 47 ALA O O 10.244 6.708 4.036 1.00 . A A . 47 ALA O 1 1 17 16239 1 1 48 GLY C C 7.461 7.807 2.721 1.00 . A A . 48 GLY C 1 1 17 16240 1 1 48 GLY CA C 7.563 7.306 4.149 1.00 . A A . 48 GLY CA 1 1 17 16241 1 1 48 GLY H H 7.535 5.198 4.344 1.00 . A A . 48 GLY H 1 1 17 16242 1 1 48 GLY HA2 H 6.575 7.296 4.585 1.00 . A A . 48 GLY HA2 1 1 17 16243 1 1 48 GLY HA3 H 8.187 7.986 4.711 1.00 . A A . 48 GLY HA3 1 1 17 16244 1 1 48 GLY N N 8.126 5.973 4.234 1.00 . A A . 48 GLY N 1 1 17 16245 1 1 48 GLY O O 7.486 9.012 2.476 1.00 . A A . 48 GLY O 1 1 17 16246 1 1 49 ALA C C 5.907 7.921 0.077 1.00 . A A . 49 ALA C 1 1 17 16247 1 1 49 ALA CA C 7.237 7.235 0.367 1.00 . A A . 49 ALA CA 1 1 17 16248 1 1 49 ALA CB C 7.394 5.996 -0.504 1.00 . A A . 49 ALA CB 1 1 17 16249 1 1 49 ALA H H 7.329 5.933 2.033 1.00 . A A . 49 ALA H 1 1 17 16250 1 1 49 ALA HA H 8.042 7.916 0.133 1.00 . A A . 49 ALA HA 1 1 17 16251 1 1 49 ALA HB1 H 8.004 5.269 0.013 1.00 . A A . 49 ALA HB1 1 1 17 16252 1 1 49 ALA HB2 H 7.871 6.270 -1.435 1.00 . A A . 49 ALA HB2 1 1 17 16253 1 1 49 ALA HB3 H 6.422 5.574 -0.707 1.00 . A A . 49 ALA HB3 1 1 17 16254 1 1 49 ALA N N 7.344 6.879 1.776 1.00 . A A . 49 ALA N 1 1 17 16255 1 1 49 ALA O O 5.838 8.845 -0.733 1.00 . A A . 49 ALA O 1 1 17 16256 1 1 50 LEU C C 3.172 8.970 1.722 1.00 . A A . 50 LEU C 1 1 17 16257 1 1 50 LEU CA C 3.525 8.040 0.565 1.00 . A A . 50 LEU CA 1 1 17 16258 1 1 50 LEU CB C 2.480 6.928 0.450 1.00 . A A . 50 LEU CB 1 1 17 16259 1 1 50 LEU CD1 C 1.933 4.661 -0.470 1.00 . A A . 50 LEU CD1 1 1 17 16260 1 1 50 LEU CD2 C 2.285 6.588 -2.026 1.00 . A A . 50 LEU CD2 1 1 17 16261 1 1 50 LEU CG C 2.700 5.951 -0.707 1.00 . A A . 50 LEU CG 1 1 17 16262 1 1 50 LEU H H 4.973 6.730 1.383 1.00 . A A . 50 LEU H 1 1 17 16263 1 1 50 LEU HA H 3.535 8.611 -0.350 1.00 . A A . 50 LEU HA 1 1 17 16264 1 1 50 LEU HB2 H 2.477 6.368 1.373 1.00 . A A . 50 LEU HB2 1 1 17 16265 1 1 50 LEU HB3 H 1.511 7.387 0.324 1.00 . A A . 50 LEU HB3 1 1 17 16266 1 1 50 LEU HD11 H 2.509 4.011 0.169 1.00 . A A . 50 LEU HD11 1 1 17 16267 1 1 50 LEU HD12 H 1.755 4.170 -1.416 1.00 . A A . 50 LEU HD12 1 1 17 16268 1 1 50 LEU HD13 H 0.988 4.885 0.002 1.00 . A A . 50 LEU HD13 1 1 17 16269 1 1 50 LEU HD21 H 2.354 5.855 -2.816 1.00 . A A . 50 LEU HD21 1 1 17 16270 1 1 50 LEU HD22 H 2.939 7.419 -2.247 1.00 . A A . 50 LEU HD22 1 1 17 16271 1 1 50 LEU HD23 H 1.266 6.940 -1.950 1.00 . A A . 50 LEU HD23 1 1 17 16272 1 1 50 LEU HG H 3.752 5.709 -0.769 1.00 . A A . 50 LEU HG 1 1 17 16273 1 1 50 LEU N N 4.854 7.467 0.749 1.00 . A A . 50 LEU N 1 1 17 16274 1 1 50 LEU O O 3.988 9.205 2.612 1.00 . A A . 50 LEU O 1 1 17 16275 1 1 51 LYS C C 0.155 9.943 3.316 1.00 . A A . 51 LYS C 1 1 17 16276 1 1 51 LYS CA C 1.493 10.403 2.747 1.00 . A A . 51 LYS CA 1 1 17 16277 1 1 51 LYS CB C 1.371 11.827 2.198 1.00 . A A . 51 LYS CB 1 1 17 16278 1 1 51 LYS CD C 2.076 12.954 4.331 1.00 . A A . 51 LYS CD 1 1 17 16279 1 1 51 LYS CE C 2.488 14.327 4.838 1.00 . A A . 51 LYS CE 1 1 17 16280 1 1 51 LYS CG C 2.335 12.811 2.840 1.00 . A A . 51 LYS CG 1 1 17 16281 1 1 51 LYS H H 1.347 9.273 0.963 1.00 . A A . 51 LYS H 1 1 17 16282 1 1 51 LYS HA H 2.229 10.394 3.537 1.00 . A A . 51 LYS HA 1 1 17 16283 1 1 51 LYS HB2 H 1.564 11.809 1.135 1.00 . A A . 51 LYS HB2 1 1 17 16284 1 1 51 LYS HB3 H 0.364 12.183 2.365 1.00 . A A . 51 LYS HB3 1 1 17 16285 1 1 51 LYS HD2 H 1.023 12.811 4.520 1.00 . A A . 51 LYS HD2 1 1 17 16286 1 1 51 LYS HD3 H 2.644 12.200 4.859 1.00 . A A . 51 LYS HD3 1 1 17 16287 1 1 51 LYS HE2 H 3.248 14.725 4.185 1.00 . A A . 51 LYS HE2 1 1 17 16288 1 1 51 LYS HE3 H 1.623 14.975 4.821 1.00 . A A . 51 LYS HE3 1 1 17 16289 1 1 51 LYS HG2 H 3.346 12.459 2.692 1.00 . A A . 51 LYS HG2 1 1 17 16290 1 1 51 LYS HG3 H 2.216 13.775 2.369 1.00 . A A . 51 LYS HG3 1 1 17 16291 1 1 51 LYS HZ1 H 2.301 13.892 6.873 1.00 . A A . 51 LYS HZ1 1 1 17 16292 1 1 51 LYS HZ2 H 3.295 15.221 6.545 1.00 . A A . 51 LYS HZ2 1 1 17 16293 1 1 51 LYS HZ3 H 3.859 13.651 6.262 1.00 . A A . 51 LYS HZ3 1 1 17 16294 1 1 51 LYS N N 1.952 9.497 1.700 1.00 . A A . 51 LYS N 1 1 17 16295 1 1 51 LYS NZ N 3.023 14.269 6.227 1.00 . A A . 51 LYS NZ 1 1 17 16296 1 1 51 LYS O O -0.882 10.055 2.660 1.00 . A A . 51 LYS O 1 1 17 16297 1 1 52 TYR C C -1.885 10.122 5.668 1.00 . A A . 52 TYR C 1 1 17 16298 1 1 52 TYR CA C -1.028 8.952 5.197 1.00 . A A . 52 TYR CA 1 1 17 16299 1 1 52 TYR CB C -0.672 8.053 6.384 1.00 . A A . 52 TYR CB 1 1 17 16300 1 1 52 TYR CD1 C -3.082 7.331 6.665 1.00 . A A . 52 TYR CD1 1 1 17 16301 1 1 52 TYR CD2 C -1.755 7.624 8.624 1.00 . A A . 52 TYR CD2 1 1 17 16302 1 1 52 TYR CE1 C -4.163 6.972 7.446 1.00 . A A . 52 TYR CE1 1 1 17 16303 1 1 52 TYR CE2 C -2.832 7.265 9.411 1.00 . A A . 52 TYR CE2 1 1 17 16304 1 1 52 TYR CG C -1.858 7.662 7.240 1.00 . A A . 52 TYR CG 1 1 17 16305 1 1 52 TYR CZ C -4.033 6.939 8.818 1.00 . A A . 52 TYR CZ 1 1 17 16306 1 1 52 TYR H H 1.039 9.365 5.012 1.00 . A A . 52 TYR H 1 1 17 16307 1 1 52 TYR HA H -1.591 8.376 4.478 1.00 . A A . 52 TYR HA 1 1 17 16308 1 1 52 TYR HB2 H -0.219 7.145 6.016 1.00 . A A . 52 TYR HB2 1 1 17 16309 1 1 52 TYR HB3 H 0.037 8.569 7.017 1.00 . A A . 52 TYR HB3 1 1 17 16310 1 1 52 TYR HD1 H -3.185 7.357 5.591 1.00 . A A . 52 TYR HD1 1 1 17 16311 1 1 52 TYR HD2 H -0.813 7.879 9.087 1.00 . A A . 52 TYR HD2 1 1 17 16312 1 1 52 TYR HE1 H -5.100 6.716 6.981 1.00 . A A . 52 TYR HE1 1 1 17 16313 1 1 52 TYR HE2 H -2.731 7.241 10.486 1.00 . A A . 52 TYR HE2 1 1 17 16314 1 1 52 TYR HH H -5.470 5.749 9.285 1.00 . A A . 52 TYR HH 1 1 17 16315 1 1 52 TYR N N 0.183 9.427 4.540 1.00 . A A . 52 TYR N 1 1 17 16316 1 1 52 TYR O O -1.411 11.004 6.385 1.00 . A A . 52 TYR O 1 1 17 16317 1 1 52 TYR OH O -5.108 6.582 9.598 1.00 . A A . 52 TYR OH 1 1 17 16318 1 1 53 GLN C C -5.349 10.578 6.242 1.00 . A A . 53 GLN C 1 1 17 16319 1 1 53 GLN CA C -4.077 11.173 5.651 1.00 . A A . 53 GLN CA 1 1 17 16320 1 1 53 GLN CB C -4.421 12.050 4.446 1.00 . A A . 53 GLN CB 1 1 17 16321 1 1 53 GLN CD C -3.558 13.971 3.052 1.00 . A A . 53 GLN CD 1 1 17 16322 1 1 53 GLN CG C -3.208 12.702 3.803 1.00 . A A . 53 GLN CG 1 1 17 16323 1 1 53 GLN H H -3.470 9.385 4.700 1.00 . A A . 53 GLN H 1 1 17 16324 1 1 53 GLN HA H -3.595 11.780 6.404 1.00 . A A . 53 GLN HA 1 1 17 16325 1 1 53 GLN HB2 H -4.912 11.442 3.701 1.00 . A A . 53 GLN HB2 1 1 17 16326 1 1 53 GLN HB3 H -5.096 12.831 4.763 1.00 . A A . 53 GLN HB3 1 1 17 16327 1 1 53 GLN HE21 H -2.230 13.531 1.639 1.00 . A A . 53 GLN HE21 1 1 17 16328 1 1 53 GLN HE22 H -3.104 15.005 1.416 1.00 . A A . 53 GLN HE22 1 1 17 16329 1 1 53 GLN HG2 H -2.494 12.947 4.577 1.00 . A A . 53 GLN HG2 1 1 17 16330 1 1 53 GLN HG3 H -2.763 12.004 3.112 1.00 . A A . 53 GLN HG3 1 1 17 16331 1 1 53 GLN N N -3.150 10.118 5.265 1.00 . A A . 53 GLN N 1 1 17 16332 1 1 53 GLN NE2 N -2.897 14.192 1.922 1.00 . A A . 53 GLN NE2 1 1 17 16333 1 1 53 GLN O O -6.047 9.808 5.585 1.00 . A A . 53 GLN O 1 1 17 16334 1 1 53 GLN OE1 O -4.413 14.745 3.482 1.00 . A A . 53 GLN OE1 1 1 17 16335 1 1 54 GLU C C -8.064 11.270 7.846 1.00 . A A . 54 GLU C 1 1 17 16336 1 1 54 GLU CA C -6.826 10.434 8.171 1.00 . A A . 54 GLU CA 1 1 17 16337 1 1 54 GLU CB C -6.596 10.418 9.683 1.00 . A A . 54 GLU CB 1 1 17 16338 1 1 54 GLU CD C -6.218 11.771 11.781 1.00 . A A . 54 GLU CD 1 1 17 16339 1 1 54 GLU CG C -6.286 11.785 10.268 1.00 . A A . 54 GLU CG 1 1 17 16340 1 1 54 GLU H H -5.043 11.554 7.961 1.00 . A A . 54 GLU H 1 1 17 16341 1 1 54 GLU HA H -6.995 9.423 7.834 1.00 . A A . 54 GLU HA 1 1 17 16342 1 1 54 GLU HB2 H -7.484 10.037 10.168 1.00 . A A . 54 GLU HB2 1 1 17 16343 1 1 54 GLU HB3 H -5.768 9.760 9.903 1.00 . A A . 54 GLU HB3 1 1 17 16344 1 1 54 GLU HG2 H -5.334 12.120 9.882 1.00 . A A . 54 GLU HG2 1 1 17 16345 1 1 54 GLU HG3 H -7.059 12.476 9.964 1.00 . A A . 54 GLU HG3 1 1 17 16346 1 1 54 GLU N N -5.640 10.938 7.488 1.00 . A A . 54 GLU N 1 1 17 16347 1 1 54 GLU O O -9.056 11.225 8.572 1.00 . A A . 54 GLU O 1 1 17 16348 1 1 54 GLU OE1 O -7.258 11.509 12.420 1.00 . A A . 54 GLU OE1 1 1 17 16349 1 1 54 GLU OE2 O -5.123 12.021 12.329 1.00 . A A . 54 GLU OE2 1 1 17 16350 1 1 55 ASN C C -10.350 11.995 6.068 1.00 . A A . 55 ASN C 1 1 17 16351 1 1 55 ASN CA C -9.134 12.858 6.350 1.00 . A A . 55 ASN CA 1 1 17 16352 1 1 55 ASN CB C -8.776 13.685 5.114 1.00 . A A . 55 ASN CB 1 1 17 16353 1 1 55 ASN CG C -9.365 15.082 5.166 1.00 . A A . 55 ASN CG 1 1 17 16354 1 1 55 ASN H H -7.196 12.028 6.207 1.00 . A A . 55 ASN H 1 1 17 16355 1 1 55 ASN HA H -9.360 13.524 7.168 1.00 . A A . 55 ASN HA 1 1 17 16356 1 1 55 ASN HB2 H -7.702 13.770 5.043 1.00 . A A . 55 ASN HB2 1 1 17 16357 1 1 55 ASN HB3 H -9.154 13.187 4.233 1.00 . A A . 55 ASN HB3 1 1 17 16358 1 1 55 ASN HD21 H -8.517 15.401 6.936 1.00 . A A . 55 ASN HD21 1 1 17 16359 1 1 55 ASN HD22 H -9.449 16.711 6.303 1.00 . A A . 55 ASN HD22 1 1 17 16360 1 1 55 ASN N N -8.007 12.028 6.753 1.00 . A A . 55 ASN N 1 1 17 16361 1 1 55 ASN ND2 N -9.081 15.804 6.244 1.00 . A A . 55 ASN ND2 1 1 17 16362 1 1 55 ASN O O -11.330 12.024 6.814 1.00 . A A . 55 ASN O 1 1 17 16363 1 1 55 ASN OD1 O -10.060 15.507 4.246 1.00 . A A . 55 ASN OD1 1 1 17 16364 1 1 56 ALA C C -11.500 9.172 5.603 1.00 . A A . 56 ALA C 1 1 17 16365 1 1 56 ALA CA C -11.380 10.337 4.621 1.00 . A A . 56 ALA CA 1 1 17 16366 1 1 56 ALA CB C -11.190 9.820 3.204 1.00 . A A . 56 ALA CB 1 1 17 16367 1 1 56 ALA H H -9.481 11.233 4.441 1.00 . A A . 56 ALA H 1 1 17 16368 1 1 56 ALA HA H -12.300 10.912 4.649 1.00 . A A . 56 ALA HA 1 1 17 16369 1 1 56 ALA HB1 H -10.520 10.477 2.670 1.00 . A A . 56 ALA HB1 1 1 17 16370 1 1 56 ALA HB2 H -12.140 9.789 2.698 1.00 . A A . 56 ALA HB2 1 1 17 16371 1 1 56 ALA HB3 H -10.770 8.826 3.238 1.00 . A A . 56 ALA HB3 1 1 17 16372 1 1 56 ALA N N -10.290 11.219 4.992 1.00 . A A . 56 ALA N 1 1 17 16373 1 1 56 ALA O O -12.500 8.452 5.609 1.00 . A A . 56 ALA O 1 1 17 16374 1 1 57 TYR C C -10.900 8.429 8.787 1.00 . A A . 57 TYR C 1 1 17 16375 1 1 57 TYR CA C -10.460 7.919 7.417 1.00 . A A . 57 TYR CA 1 1 17 16376 1 1 57 TYR CB C -9.066 7.310 7.508 1.00 . A A . 57 TYR CB 1 1 17 16377 1 1 57 TYR CD1 C -9.212 6.218 5.241 1.00 . A A . 57 TYR CD1 1 1 17 16378 1 1 57 TYR CD2 C -7.190 7.343 5.815 1.00 . A A . 57 TYR CD2 1 1 17 16379 1 1 57 TYR CE1 C -8.683 5.885 4.009 1.00 . A A . 57 TYR CE1 1 1 17 16380 1 1 57 TYR CE2 C -6.653 7.014 4.584 1.00 . A A . 57 TYR CE2 1 1 17 16381 1 1 57 TYR CG C -8.477 6.950 6.163 1.00 . A A . 57 TYR CG 1 1 17 16382 1 1 57 TYR CZ C -7.403 6.286 3.685 1.00 . A A . 57 TYR CZ 1 1 17 16383 1 1 57 TYR H H -9.711 9.599 6.380 1.00 . A A . 57 TYR H 1 1 17 16384 1 1 57 TYR HA H -11.150 7.159 7.089 1.00 . A A . 57 TYR HA 1 1 17 16385 1 1 57 TYR HB2 H -8.403 8.017 7.984 1.00 . A A . 57 TYR HB2 1 1 17 16386 1 1 57 TYR HB3 H -9.112 6.410 8.103 1.00 . A A . 57 TYR HB3 1 1 17 16387 1 1 57 TYR HD1 H -10.210 5.906 5.497 1.00 . A A . 57 TYR HD1 1 1 17 16388 1 1 57 TYR HD2 H -6.602 7.913 6.521 1.00 . A A . 57 TYR HD2 1 1 17 16389 1 1 57 TYR HE1 H -9.270 5.315 3.305 1.00 . A A . 57 TYR HE1 1 1 17 16390 1 1 57 TYR HE2 H -5.651 7.328 4.331 1.00 . A A . 57 TYR HE2 1 1 17 16391 1 1 57 TYR HH H -5.926 5.829 2.543 1.00 . A A . 57 TYR HH 1 1 17 16392 1 1 57 TYR N N -10.470 8.993 6.432 1.00 . A A . 57 TYR N 1 1 17 16393 1 1 57 TYR O O -10.520 7.872 9.817 1.00 . A A . 57 TYR O 1 1 17 16394 1 1 57 TYR OH O -6.873 5.957 2.459 1.00 . A A . 57 TYR OH 1 1 17 16395 1 1 58 ARG C C -13.630 9.652 10.307 1.00 . A A . 58 ARG C 1 1 17 16396 1 1 58 ARG CA C -12.190 10.069 10.040 1.00 . A A . 58 ARG CA 1 1 17 16397 1 1 58 ARG CB C -12.090 11.595 9.990 1.00 . A A . 58 ARG CB 1 1 17 16398 1 1 58 ARG CD C -12.210 13.757 11.266 1.00 . A A . 58 ARG CD 1 1 17 16399 1 1 58 ARG CG C -12.060 12.248 11.362 1.00 . A A . 58 ARG CG 1 1 17 16400 1 1 58 ARG CZ C -14.190 14.282 12.643 1.00 . A A . 58 ARG CZ 1 1 17 16401 1 1 58 ARG H H -11.970 9.889 7.943 1.00 . A A . 58 ARG H 1 1 17 16402 1 1 58 ARG HA H -11.570 9.703 10.843 1.00 . A A . 58 ARG HA 1 1 17 16403 1 1 58 ARG HB2 H -11.180 11.868 9.467 1.00 . A A . 58 ARG HB2 1 1 17 16404 1 1 58 ARG HB3 H -12.940 11.982 9.449 1.00 . A A . 58 ARG HB3 1 1 17 16405 1 1 58 ARG HD2 H -11.600 14.217 12.026 1.00 . A A . 58 ARG HD2 1 1 17 16406 1 1 58 ARG HD3 H -11.880 14.078 10.290 1.00 . A A . 58 ARG HD3 1 1 17 16407 1 1 58 ARG HE H -14.120 14.402 10.653 1.00 . A A . 58 ARG HE 1 1 17 16408 1 1 58 ARG HG2 H -12.870 11.852 11.955 1.00 . A A . 58 ARG HG2 1 1 17 16409 1 1 58 ARG HG3 H -11.120 12.019 11.840 1.00 . A A . 58 ARG HG3 1 1 17 16410 1 1 58 ARG HH11 H -12.560 13.697 13.697 1.00 . A A . 58 ARG HH11 1 1 17 16411 1 1 58 ARG HH12 H -13.960 14.072 14.642 1.00 . A A . 58 ARG HH12 1 1 17 16412 1 1 58 ARG HH21 H -15.960 14.895 11.894 1.00 . A A . 58 ARG HH21 1 1 17 16413 1 1 58 ARG HH22 H -15.890 14.751 13.619 1.00 . A A . 58 ARG HH22 1 1 17 16414 1 1 58 ARG N N -11.700 9.488 8.794 1.00 . A A . 58 ARG N 1 1 17 16415 1 1 58 ARG NE N -13.600 14.181 11.455 1.00 . A A . 58 ARG NE 1 1 17 16416 1 1 58 ARG NH1 N -13.510 13.993 13.752 1.00 . A A . 58 ARG NH1 1 1 17 16417 1 1 58 ARG NH2 N -15.450 14.675 12.726 1.00 . A A . 58 ARG NH2 1 1 17 16418 1 1 58 ARG O O -13.940 9.062 11.344 1.00 . A A . 58 ARG O 1 1 17 16419 1 1 59 GLN C C -16.310 8.508 8.525 1.00 . A A . 59 GLN C 1 1 17 16420 1 1 59 GLN CA C -15.920 9.619 9.498 1.00 . A A . 59 GLN CA 1 1 17 16421 1 1 59 GLN CB C -16.800 10.851 9.251 1.00 . A A . 59 GLN CB 1 1 17 16422 1 1 59 GLN CD C -17.940 11.982 11.201 1.00 . A A . 59 GLN CD 1 1 17 16423 1 1 59 GLN CG C -18.030 10.910 10.131 1.00 . A A . 59 GLN CG 1 1 17 16424 1 1 59 GLN H H -14.210 10.432 8.561 1.00 . A A . 59 GLN H 1 1 17 16425 1 1 59 GLN HA H -16.090 9.271 10.507 1.00 . A A . 59 GLN HA 1 1 17 16426 1 1 59 GLN HB2 H -16.210 11.738 9.435 1.00 . A A . 59 GLN HB2 1 1 17 16427 1 1 59 GLN HB3 H -17.120 10.851 8.218 1.00 . A A . 59 GLN HB3 1 1 17 16428 1 1 59 GLN HE21 H -17.990 13.406 9.814 1.00 . A A . 59 GLN HE21 1 1 17 16429 1 1 59 GLN HE22 H -17.870 13.954 11.448 1.00 . A A . 59 GLN HE22 1 1 17 16430 1 1 59 GLN HG2 H -18.890 11.117 9.512 1.00 . A A . 59 GLN HG2 1 1 17 16431 1 1 59 GLN HG3 H -18.160 9.952 10.614 1.00 . A A . 59 GLN HG3 1 1 17 16432 1 1 59 GLN N N -14.510 9.962 9.364 1.00 . A A . 59 GLN N 1 1 17 16433 1 1 59 GLN NE2 N -17.930 13.241 10.778 1.00 . A A . 59 GLN NE2 1 1 17 16434 1 1 59 GLN O O -15.860 8.493 7.378 1.00 . A A . 59 GLN O 1 1 17 16435 1 1 59 GLN OE1 O -17.880 11.681 12.393 1.00 . A A . 59 GLN OE1 1 1 17 16436 1 1 60 ALA C C -19.060 6.170 8.380 1.00 . A A . 60 ALA C 1 1 17 16437 1 1 60 ALA CA C -17.580 6.463 8.163 1.00 . A A . 60 ALA CA 1 1 17 16438 1 1 60 ALA CB C -16.740 5.225 8.457 1.00 . A A . 60 ALA CB 1 1 17 16439 1 1 60 ALA H H -17.460 7.644 9.917 1.00 . A A . 60 ALA H 1 1 17 16440 1 1 60 ALA HA H -17.420 6.735 7.129 1.00 . A A . 60 ALA HA 1 1 17 16441 1 1 60 ALA HB1 H -15.760 5.523 8.778 1.00 . A A . 60 ALA HB1 1 1 17 16442 1 1 60 ALA HB2 H -16.670 4.623 7.563 1.00 . A A . 60 ALA HB2 1 1 17 16443 1 1 60 ALA HB3 H -17.220 4.649 9.238 1.00 . A A . 60 ALA HB3 1 1 17 16444 1 1 60 ALA N N -17.140 7.578 8.992 1.00 . A A . 60 ALA N 1 1 17 16445 1 1 60 ALA O O -19.820 6.014 7.422 1.00 . A A . 60 ALA O 1 1 17 16446 1 1 61 ALA C C -21.710 7.087 9.865 1.00 . A A . 61 ALA C 1 1 17 16447 1 1 61 ALA CA C -20.850 5.828 9.986 1.00 . A A . 61 ALA CA 1 1 17 16448 1 1 61 ALA CB C -20.950 5.259 11.394 1.00 . A A . 61 ALA CB 1 1 17 16449 1 1 61 ALA H H -18.810 6.235 10.362 1.00 . A A . 61 ALA H 1 1 17 16450 1 1 61 ALA HA H -21.230 5.085 9.297 1.00 . A A . 61 ALA HA 1 1 17 16451 1 1 61 ALA HB1 H -20.800 4.190 11.361 1.00 . A A . 61 ALA HB1 1 1 17 16452 1 1 61 ALA HB2 H -21.920 5.472 11.804 1.00 . A A . 61 ALA HB2 1 1 17 16453 1 1 61 ALA HB3 H -20.190 5.710 12.016 1.00 . A A . 61 ALA HB3 1 1 17 16454 1 1 61 ALA N N -19.460 6.101 9.644 1.00 . A A . 61 ALA N 1 1 17 16455 1 1 61 ALA O O -21.120 8.189 9.779 1.00 . A A . 61 ALA O 1 1 17 16456 1 1 61 ALA OXT O -22.950 6.961 9.857 1.00 . A A . 61 ALA OXT 1 1 18 16457 1 1 1 MET C C -5.207 6.571 -1.023 1.00 . A A . 1 MET C 1 1 18 16458 1 1 1 MET CA C -4.551 7.557 -0.063 1.00 . A A . 1 MET CA 1 1 18 16459 1 1 1 MET CB C -3.035 7.351 -0.048 1.00 . A A . 1 MET CB 1 1 18 16460 1 1 1 MET CE C -0.354 6.170 2.323 1.00 . A A . 1 MET CE 1 1 18 16461 1 1 1 MET CG C -2.598 6.103 0.700 1.00 . A A . 1 MET CG 1 1 18 16462 1 1 1 MET H1 H -4.539 8.033 1.939 1.00 . A A . 1 MET H1 1 1 18 16463 1 1 1 MET H2 H -4.907 6.392 1.594 1.00 . A A . 1 MET H2 1 1 18 16464 1 1 1 MET H3 H -6.079 7.614 1.313 1.00 . A A . 1 MET H3 1 1 18 16465 1 1 1 MET HA H -4.770 8.564 -0.387 1.00 . A A . 1 MET HA 1 1 18 16466 1 1 1 MET HB2 H -2.685 7.276 -1.067 1.00 . A A . 1 MET HB2 1 1 18 16467 1 1 1 MET HB3 H -2.572 8.207 0.421 1.00 . A A . 1 MET HB3 1 1 18 16468 1 1 1 MET HE1 H -0.277 7.237 2.474 1.00 . A A . 1 MET HE1 1 1 18 16469 1 1 1 MET HE2 H 0.600 5.707 2.535 1.00 . A A . 1 MET HE2 1 1 18 16470 1 1 1 MET HE3 H -1.105 5.768 2.987 1.00 . A A . 1 MET HE3 1 1 18 16471 1 1 1 MET HG2 H -2.890 6.198 1.735 1.00 . A A . 1 MET HG2 1 1 18 16472 1 1 1 MET HG3 H -3.094 5.246 0.265 1.00 . A A . 1 MET HG3 1 1 18 16473 1 1 1 MET N N -5.066 7.383 1.320 1.00 . A A . 1 MET N 1 1 18 16474 1 1 1 MET O O -5.840 5.603 -0.599 1.00 . A A . 1 MET O 1 1 18 16475 1 1 1 MET SD S -0.816 5.838 0.626 1.00 . A A . 1 MET SD 1 1 18 16476 1 1 2 TYR C C -4.735 4.761 -3.613 1.00 . A A . 2 TYR C 1 1 18 16477 1 1 2 TYR CA C -5.635 5.961 -3.340 1.00 . A A . 2 TYR CA 1 1 18 16478 1 1 2 TYR CB C -5.865 6.748 -4.633 1.00 . A A . 2 TYR CB 1 1 18 16479 1 1 2 TYR CD1 C -7.849 8.021 -3.730 1.00 . A A . 2 TYR CD1 1 1 18 16480 1 1 2 TYR CD2 C -8.010 7.093 -5.920 1.00 . A A . 2 TYR CD2 1 1 18 16481 1 1 2 TYR CE1 C -9.131 8.524 -3.845 1.00 . A A . 2 TYR CE1 1 1 18 16482 1 1 2 TYR CE2 C -9.292 7.594 -6.044 1.00 . A A . 2 TYR CE2 1 1 18 16483 1 1 2 TYR CG C -7.268 7.298 -4.763 1.00 . A A . 2 TYR CG 1 1 18 16484 1 1 2 TYR CZ C -9.848 8.310 -5.003 1.00 . A A . 2 TYR CZ 1 1 18 16485 1 1 2 TYR H H -4.542 7.614 -2.594 1.00 . A A . 2 TYR H 1 1 18 16486 1 1 2 TYR HA H -6.585 5.606 -2.971 1.00 . A A . 2 TYR HA 1 1 18 16487 1 1 2 TYR HB2 H -5.179 7.580 -4.667 1.00 . A A . 2 TYR HB2 1 1 18 16488 1 1 2 TYR HB3 H -5.681 6.100 -5.478 1.00 . A A . 2 TYR HB3 1 1 18 16489 1 1 2 TYR HD1 H -7.286 8.190 -2.825 1.00 . A A . 2 TYR HD1 1 1 18 16490 1 1 2 TYR HD2 H -7.571 6.532 -6.732 1.00 . A A . 2 TYR HD2 1 1 18 16491 1 1 2 TYR HE1 H -9.565 9.084 -3.031 1.00 . A A . 2 TYR HE1 1 1 18 16492 1 1 2 TYR HE2 H -9.853 7.423 -6.950 1.00 . A A . 2 TYR HE2 1 1 18 16493 1 1 2 TYR HH H -11.670 8.445 -4.426 1.00 . A A . 2 TYR HH 1 1 18 16494 1 1 2 TYR N N -5.055 6.827 -2.319 1.00 . A A . 2 TYR N 1 1 18 16495 1 1 2 TYR O O -3.512 4.885 -3.660 1.00 . A A . 2 TYR O 1 1 18 16496 1 1 2 TYR OH O -11.120 8.808 -5.121 1.00 . A A . 2 TYR OH 1 1 18 16497 1 1 3 LYS C C -3.775 2.502 -5.333 1.00 . A A . 3 LYS C 1 1 18 16498 1 1 3 LYS CA C -4.610 2.371 -4.062 1.00 . A A . 3 LYS CA 1 1 18 16499 1 1 3 LYS CB C -5.571 1.187 -4.190 1.00 . A A . 3 LYS CB 1 1 18 16500 1 1 3 LYS CD C -5.873 -1.237 -4.775 1.00 . A A . 3 LYS CD 1 1 18 16501 1 1 3 LYS CE C -5.247 -2.616 -4.632 1.00 . A A . 3 LYS CE 1 1 18 16502 1 1 3 LYS CG C -4.874 -0.136 -4.459 1.00 . A A . 3 LYS CG 1 1 18 16503 1 1 3 LYS H H -6.329 3.562 -3.743 1.00 . A A . 3 LYS H 1 1 18 16504 1 1 3 LYS HA H -3.948 2.195 -3.228 1.00 . A A . 3 LYS HA 1 1 18 16505 1 1 3 LYS HB2 H -6.132 1.094 -3.272 1.00 . A A . 3 LYS HB2 1 1 18 16506 1 1 3 LYS HB3 H -6.256 1.381 -5.002 1.00 . A A . 3 LYS HB3 1 1 18 16507 1 1 3 LYS HD2 H -6.709 -1.160 -4.094 1.00 . A A . 3 LYS HD2 1 1 18 16508 1 1 3 LYS HD3 H -6.221 -1.114 -5.790 1.00 . A A . 3 LYS HD3 1 1 18 16509 1 1 3 LYS HE2 H -4.189 -2.538 -4.827 1.00 . A A . 3 LYS HE2 1 1 18 16510 1 1 3 LYS HE3 H -5.400 -2.962 -3.620 1.00 . A A . 3 LYS HE3 1 1 18 16511 1 1 3 LYS HG2 H -4.207 -0.017 -5.299 1.00 . A A . 3 LYS HG2 1 1 18 16512 1 1 3 LYS HG3 H -4.308 -0.417 -3.583 1.00 . A A . 3 LYS HG3 1 1 18 16513 1 1 3 LYS HZ1 H -6.002 -3.152 -6.504 1.00 . A A . 3 LYS HZ1 1 1 18 16514 1 1 3 LYS HZ2 H -6.754 -3.941 -5.211 1.00 . A A . 3 LYS HZ2 1 1 18 16515 1 1 3 LYS HZ3 H -5.205 -4.410 -5.700 1.00 . A A . 3 LYS HZ3 1 1 18 16516 1 1 3 LYS N N -5.351 3.598 -3.793 1.00 . A A . 3 LYS N 1 1 18 16517 1 1 3 LYS NZ N -5.844 -3.598 -5.578 1.00 . A A . 3 LYS NZ 1 1 18 16518 1 1 3 LYS O O -2.773 1.807 -5.503 1.00 . A A . 3 LYS O 1 1 18 16519 1 1 4 LYS C C -2.010 3.940 -7.229 1.00 . A A . 4 LYS C 1 1 18 16520 1 1 4 LYS CA C -3.480 3.616 -7.481 1.00 . A A . 4 LYS CA 1 1 18 16521 1 1 4 LYS CB C -4.134 4.752 -8.271 1.00 . A A . 4 LYS CB 1 1 18 16522 1 1 4 LYS CD C -4.822 4.409 -10.668 1.00 . A A . 4 LYS CD 1 1 18 16523 1 1 4 LYS CE C -5.427 5.619 -11.363 1.00 . A A . 4 LYS CE 1 1 18 16524 1 1 4 LYS CG C -3.697 4.810 -9.727 1.00 . A A . 4 LYS CG 1 1 18 16525 1 1 4 LYS H H -4.997 3.922 -6.036 1.00 . A A . 4 LYS H 1 1 18 16526 1 1 4 LYS HA H -3.541 2.706 -8.059 1.00 . A A . 4 LYS HA 1 1 18 16527 1 1 4 LYS HB2 H -5.206 4.623 -8.243 1.00 . A A . 4 LYS HB2 1 1 18 16528 1 1 4 LYS HB3 H -3.881 5.691 -7.804 1.00 . A A . 4 LYS HB3 1 1 18 16529 1 1 4 LYS HD2 H -4.430 3.737 -11.415 1.00 . A A . 4 LYS HD2 1 1 18 16530 1 1 4 LYS HD3 H -5.592 3.909 -10.100 1.00 . A A . 4 LYS HD3 1 1 18 16531 1 1 4 LYS HE2 H -6.308 5.306 -11.900 1.00 . A A . 4 LYS HE2 1 1 18 16532 1 1 4 LYS HE3 H -5.702 6.347 -10.614 1.00 . A A . 4 LYS HE3 1 1 18 16533 1 1 4 LYS HG2 H -3.388 5.819 -9.959 1.00 . A A . 4 LYS HG2 1 1 18 16534 1 1 4 LYS HG3 H -2.864 4.137 -9.868 1.00 . A A . 4 LYS HG3 1 1 18 16535 1 1 4 LYS HZ1 H -4.086 5.523 -12.962 1.00 . A A . 4 LYS HZ1 1 1 18 16536 1 1 4 LYS HZ2 H -3.688 6.690 -11.803 1.00 . A A . 4 LYS HZ2 1 1 18 16537 1 1 4 LYS HZ3 H -4.957 6.971 -12.884 1.00 . A A . 4 LYS HZ3 1 1 18 16538 1 1 4 LYS N N -4.191 3.397 -6.225 1.00 . A A . 4 LYS N 1 1 18 16539 1 1 4 LYS NZ N -4.472 6.244 -12.320 1.00 . A A . 4 LYS NZ 1 1 18 16540 1 1 4 LYS O O -1.131 3.497 -7.969 1.00 . A A . 4 LYS O 1 1 18 16541 1 1 5 ASP C C 0.373 3.910 -5.238 1.00 . A A . 5 ASP C 1 1 18 16542 1 1 5 ASP CA C -0.387 5.094 -5.829 1.00 . A A . 5 ASP CA 1 1 18 16543 1 1 5 ASP CB C -0.400 6.257 -4.836 1.00 . A A . 5 ASP CB 1 1 18 16544 1 1 5 ASP CG C -0.167 7.594 -5.511 1.00 . A A . 5 ASP CG 1 1 18 16545 1 1 5 ASP H H -2.493 5.031 -5.626 1.00 . A A . 5 ASP H 1 1 18 16546 1 1 5 ASP HA H 0.110 5.408 -6.734 1.00 . A A . 5 ASP HA 1 1 18 16547 1 1 5 ASP HB2 H -1.358 6.288 -4.340 1.00 . A A . 5 ASP HB2 1 1 18 16548 1 1 5 ASP HB3 H 0.376 6.104 -4.101 1.00 . A A . 5 ASP HB3 1 1 18 16549 1 1 5 ASP N N -1.751 4.712 -6.178 1.00 . A A . 5 ASP N 1 1 18 16550 1 1 5 ASP O O 1.496 3.615 -5.647 1.00 . A A . 5 ASP O 1 1 18 16551 1 1 5 ASP OD1 O 0.987 7.870 -5.902 1.00 . A A . 5 ASP OD1 1 1 18 16552 1 1 5 ASP OD2 O -1.140 8.366 -5.650 1.00 . A A . 5 ASP OD2 1 1 18 16553 1 1 6 VAL C C 0.793 1.046 -4.652 1.00 . A A . 6 VAL C 1 1 18 16554 1 1 6 VAL CA C 0.362 2.090 -3.626 1.00 . A A . 6 VAL CA 1 1 18 16555 1 1 6 VAL CB C -0.612 1.441 -2.626 1.00 . A A . 6 VAL CB 1 1 18 16556 1 1 6 VAL CG1 C 0.148 0.557 -1.666 1.00 . A A . 6 VAL CG1 1 1 18 16557 1 1 6 VAL CG2 C -1.401 2.498 -1.863 1.00 . A A . 6 VAL CG2 1 1 18 16558 1 1 6 VAL H H -1.138 3.515 -3.990 1.00 . A A . 6 VAL H 1 1 18 16559 1 1 6 VAL HA H 1.230 2.433 -3.084 1.00 . A A . 6 VAL HA 1 1 18 16560 1 1 6 VAL HB H -1.309 0.827 -3.175 1.00 . A A . 6 VAL HB 1 1 18 16561 1 1 6 VAL HG11 H -0.521 0.207 -0.894 1.00 . A A . 6 VAL HG11 1 1 18 16562 1 1 6 VAL HG12 H 0.947 1.129 -1.219 1.00 . A A . 6 VAL HG12 1 1 18 16563 1 1 6 VAL HG13 H 0.558 -0.284 -2.200 1.00 . A A . 6 VAL HG13 1 1 18 16564 1 1 6 VAL HG21 H -2.224 2.841 -2.473 1.00 . A A . 6 VAL HG21 1 1 18 16565 1 1 6 VAL HG22 H -0.755 3.330 -1.629 1.00 . A A . 6 VAL HG22 1 1 18 16566 1 1 6 VAL HG23 H -1.784 2.071 -0.949 1.00 . A A . 6 VAL HG23 1 1 18 16567 1 1 6 VAL N N -0.246 3.236 -4.274 1.00 . A A . 6 VAL N 1 1 18 16568 1 1 6 VAL O O 1.963 0.670 -4.715 1.00 . A A . 6 VAL O 1 1 18 16569 1 1 7 ILE C C 1.212 0.068 -7.434 1.00 . A A . 7 ILE C 1 1 18 16570 1 1 7 ILE CA C 0.120 -0.414 -6.481 1.00 . A A . 7 ILE CA 1 1 18 16571 1 1 7 ILE CB C -1.153 -0.760 -7.285 1.00 . A A . 7 ILE CB 1 1 18 16572 1 1 7 ILE CD1 C -3.406 -1.943 -7.125 1.00 . A A . 7 ILE CD1 1 1 18 16573 1 1 7 ILE CG1 C -2.146 -1.518 -6.401 1.00 . A A . 7 ILE CG1 1 1 18 16574 1 1 7 ILE CG2 C -0.806 -1.578 -8.522 1.00 . A A . 7 ILE CG2 1 1 18 16575 1 1 7 ILE H H -1.074 0.925 -5.358 1.00 . A A . 7 ILE H 1 1 18 16576 1 1 7 ILE HA H 0.460 -1.312 -5.984 1.00 . A A . 7 ILE HA 1 1 18 16577 1 1 7 ILE HB H -1.607 0.163 -7.612 1.00 . A A . 7 ILE HB 1 1 18 16578 1 1 7 ILE HD11 H -3.626 -2.973 -6.890 1.00 . A A . 7 ILE HD11 1 1 18 16579 1 1 7 ILE HD12 H -3.260 -1.841 -8.191 1.00 . A A . 7 ILE HD12 1 1 18 16580 1 1 7 ILE HD13 H -4.229 -1.318 -6.813 1.00 . A A . 7 ILE HD13 1 1 18 16581 1 1 7 ILE HG12 H -1.671 -2.408 -6.017 1.00 . A A . 7 ILE HG12 1 1 18 16582 1 1 7 ILE HG13 H -2.436 -0.887 -5.573 1.00 . A A . 7 ILE HG13 1 1 18 16583 1 1 7 ILE HG21 H -1.714 -1.886 -9.018 1.00 . A A . 7 ILE HG21 1 1 18 16584 1 1 7 ILE HG22 H -0.240 -2.451 -8.229 1.00 . A A . 7 ILE HG22 1 1 18 16585 1 1 7 ILE HG23 H -0.213 -0.976 -9.196 1.00 . A A . 7 ILE HG23 1 1 18 16586 1 1 7 ILE N N -0.161 0.585 -5.455 1.00 . A A . 7 ILE N 1 1 18 16587 1 1 7 ILE O O 1.932 -0.739 -8.024 1.00 . A A . 7 ILE O 1 1 18 16588 1 1 8 ASP C C 3.712 1.930 -7.775 1.00 . A A . 8 ASP C 1 1 18 16589 1 1 8 ASP CA C 2.345 1.964 -8.448 1.00 . A A . 8 ASP CA 1 1 18 16590 1 1 8 ASP CB C 1.972 3.404 -8.811 1.00 . A A . 8 ASP CB 1 1 18 16591 1 1 8 ASP CG C 1.713 3.580 -10.294 1.00 . A A . 8 ASP CG 1 1 18 16592 1 1 8 ASP H H 0.741 1.975 -7.075 1.00 . A A . 8 ASP H 1 1 18 16593 1 1 8 ASP HA H 2.386 1.373 -9.351 1.00 . A A . 8 ASP HA 1 1 18 16594 1 1 8 ASP HB2 H 1.078 3.683 -8.273 1.00 . A A . 8 ASP HB2 1 1 18 16595 1 1 8 ASP HB3 H 2.778 4.064 -8.525 1.00 . A A . 8 ASP HB3 1 1 18 16596 1 1 8 ASP N N 1.336 1.383 -7.574 1.00 . A A . 8 ASP N 1 1 18 16597 1 1 8 ASP O O 4.745 1.875 -8.441 1.00 . A A . 8 ASP O 1 1 18 16598 1 1 8 ASP OD1 O 2.529 3.089 -11.102 1.00 . A A . 8 ASP OD1 1 1 18 16599 1 1 8 ASP OD2 O 0.691 4.206 -10.648 1.00 . A A . 8 ASP OD2 1 1 18 16600 1 1 9 HIS C C 5.377 0.488 -5.415 1.00 . A A . 9 HIS C 1 1 18 16601 1 1 9 HIS CA C 4.941 1.927 -5.677 1.00 . A A . 9 HIS CA 1 1 18 16602 1 1 9 HIS CB C 4.758 2.676 -4.352 1.00 . A A . 9 HIS CB 1 1 18 16603 1 1 9 HIS CD2 C 6.316 1.507 -2.638 1.00 . A A . 9 HIS CD2 1 1 18 16604 1 1 9 HIS CE1 C 7.735 3.147 -2.323 1.00 . A A . 9 HIS CE1 1 1 18 16605 1 1 9 HIS CG C 5.919 2.543 -3.415 1.00 . A A . 9 HIS CG 1 1 18 16606 1 1 9 HIS H H 2.850 2.001 -5.972 1.00 . A A . 9 HIS H 1 1 18 16607 1 1 9 HIS HA H 5.700 2.422 -6.258 1.00 . A A . 9 HIS HA 1 1 18 16608 1 1 9 HIS HB2 H 4.619 3.726 -4.558 1.00 . A A . 9 HIS HB2 1 1 18 16609 1 1 9 HIS HB3 H 3.880 2.294 -3.850 1.00 . A A . 9 HIS HB3 1 1 18 16610 1 1 9 HIS HD1 H 6.815 4.441 -3.614 1.00 . A A . 9 HIS HD1 1 1 18 16611 1 1 9 HIS HD2 H 5.831 0.545 -2.556 1.00 . A A . 9 HIS HD2 1 1 18 16612 1 1 9 HIS HE1 H 8.571 3.730 -1.960 1.00 . A A . 9 HIS HE1 1 1 18 16613 1 1 9 HIS HE2 H 8.001 1.341 -1.397 1.00 . A A . 9 HIS HE2 1 1 18 16614 1 1 9 HIS N N 3.706 1.959 -6.446 1.00 . A A . 9 HIS N 1 1 18 16615 1 1 9 HIS ND1 N 6.830 3.555 -3.195 1.00 . A A . 9 HIS ND1 1 1 18 16616 1 1 9 HIS NE2 N 7.446 1.909 -1.971 1.00 . A A . 9 HIS NE2 1 1 18 16617 1 1 9 HIS O O 6.567 0.203 -5.277 1.00 . A A . 9 HIS O 1 1 18 16618 1 1 10 PHE C C 4.735 -2.613 -6.402 1.00 . A A . 10 PHE C 1 1 18 16619 1 1 10 PHE CA C 4.682 -1.826 -5.096 1.00 . A A . 10 PHE CA 1 1 18 16620 1 1 10 PHE CB C 3.615 -2.415 -4.175 1.00 . A A . 10 PHE CB 1 1 18 16621 1 1 10 PHE CD1 C 4.640 -2.782 -1.920 1.00 . A A . 10 PHE CD1 1 1 18 16622 1 1 10 PHE CD2 C 3.154 -0.941 -2.199 1.00 . A A . 10 PHE CD2 1 1 18 16623 1 1 10 PHE CE1 C 4.823 -2.438 -0.594 1.00 . A A . 10 PHE CE1 1 1 18 16624 1 1 10 PHE CE2 C 3.332 -0.591 -0.875 1.00 . A A . 10 PHE CE2 1 1 18 16625 1 1 10 PHE CG C 3.805 -2.040 -2.735 1.00 . A A . 10 PHE CG 1 1 18 16626 1 1 10 PHE CZ C 4.168 -1.341 -0.071 1.00 . A A . 10 PHE CZ 1 1 18 16627 1 1 10 PHE H H 3.474 -0.126 -5.460 1.00 . A A . 10 PHE H 1 1 18 16628 1 1 10 PHE HA H 5.642 -1.896 -4.606 1.00 . A A . 10 PHE HA 1 1 18 16629 1 1 10 PHE HB2 H 2.643 -2.062 -4.486 1.00 . A A . 10 PHE HB2 1 1 18 16630 1 1 10 PHE HB3 H 3.641 -3.493 -4.244 1.00 . A A . 10 PHE HB3 1 1 18 16631 1 1 10 PHE HD1 H 5.151 -3.641 -2.331 1.00 . A A . 10 PHE HD1 1 1 18 16632 1 1 10 PHE HD2 H 2.498 -0.357 -2.827 1.00 . A A . 10 PHE HD2 1 1 18 16633 1 1 10 PHE HE1 H 5.478 -3.028 0.031 1.00 . A A . 10 PHE HE1 1 1 18 16634 1 1 10 PHE HE2 H 2.818 0.268 -0.470 1.00 . A A . 10 PHE HE2 1 1 18 16635 1 1 10 PHE HZ H 4.309 -1.069 0.966 1.00 . A A . 10 PHE HZ 1 1 18 16636 1 1 10 PHE N N 4.404 -0.415 -5.343 1.00 . A A . 10 PHE N 1 1 18 16637 1 1 10 PHE O O 5.409 -3.640 -6.491 1.00 . A A . 10 PHE O 1 1 18 16638 1 1 11 GLY C C 2.849 -3.793 -8.801 1.00 . A A . 11 GLY C 1 1 18 16639 1 1 11 GLY CA C 3.994 -2.806 -8.695 1.00 . A A . 11 GLY CA 1 1 18 16640 1 1 11 GLY H H 3.495 -1.311 -7.281 1.00 . A A . 11 GLY H 1 1 18 16641 1 1 11 GLY HA2 H 3.892 -2.068 -9.476 1.00 . A A . 11 GLY HA2 1 1 18 16642 1 1 11 GLY HA3 H 4.926 -3.334 -8.829 1.00 . A A . 11 GLY HA3 1 1 18 16643 1 1 11 GLY N N 4.016 -2.130 -7.410 1.00 . A A . 11 GLY N 1 1 18 16644 1 1 11 GLY O O 2.119 -3.806 -9.791 1.00 . A A . 11 GLY O 1 1 18 16645 1 1 12 THR C C 1.065 -5.759 -6.336 1.00 . A A . 12 THR C 1 1 18 16646 1 1 12 THR CA C 1.628 -5.618 -7.746 1.00 . A A . 12 THR CA 1 1 18 16647 1 1 12 THR CB C 2.150 -6.969 -8.239 1.00 . A A . 12 THR CB 1 1 18 16648 1 1 12 THR CG2 C 2.322 -7.031 -9.741 1.00 . A A . 12 THR CG2 1 1 18 16649 1 1 12 THR H H 3.306 -4.559 -7.013 1.00 . A A . 12 THR H 1 1 18 16650 1 1 12 THR HA H 0.842 -5.281 -8.404 1.00 . A A . 12 THR HA 1 1 18 16651 1 1 12 THR HB H 1.447 -7.739 -7.954 1.00 . A A . 12 THR HB 1 1 18 16652 1 1 12 THR HG1 H 3.317 -7.255 -6.693 1.00 . A A . 12 THR HG1 1 1 18 16653 1 1 12 THR HG21 H 2.311 -8.062 -10.062 1.00 . A A . 12 THR HG21 1 1 18 16654 1 1 12 THR HG22 H 3.264 -6.580 -10.014 1.00 . A A . 12 THR HG22 1 1 18 16655 1 1 12 THR HG23 H 1.516 -6.496 -10.219 1.00 . A A . 12 THR HG23 1 1 18 16656 1 1 12 THR N N 2.691 -4.622 -7.774 1.00 . A A . 12 THR N 1 1 18 16657 1 1 12 THR O O 1.740 -5.451 -5.354 1.00 . A A . 12 THR O 1 1 18 16658 1 1 12 THR OG1 O 3.402 -7.269 -7.649 1.00 . A A . 12 THR OG1 1 1 18 16659 1 1 13 GLN C C 0.014 -7.280 -4.026 1.00 . A A . 13 GLN C 1 1 18 16660 1 1 13 GLN CA C -0.828 -6.401 -4.947 1.00 . A A . 13 GLN CA 1 1 18 16661 1 1 13 GLN CB C -2.217 -7.017 -5.131 1.00 . A A . 13 GLN CB 1 1 18 16662 1 1 13 GLN CD C -3.475 -8.391 -6.836 1.00 . A A . 13 GLN CD 1 1 18 16663 1 1 13 GLN CG C -2.221 -8.269 -5.992 1.00 . A A . 13 GLN CG 1 1 18 16664 1 1 13 GLN H H -0.666 -6.450 -7.058 1.00 . A A . 13 GLN H 1 1 18 16665 1 1 13 GLN HA H -0.935 -5.427 -4.496 1.00 . A A . 13 GLN HA 1 1 18 16666 1 1 13 GLN HB2 H -2.615 -7.272 -4.160 1.00 . A A . 13 GLN HB2 1 1 18 16667 1 1 13 GLN HB3 H -2.863 -6.286 -5.594 1.00 . A A . 13 GLN HB3 1 1 18 16668 1 1 13 GLN HE21 H -4.610 -8.270 -5.208 1.00 . A A . 13 GLN HE21 1 1 18 16669 1 1 13 GLN HE22 H -5.458 -8.443 -6.704 1.00 . A A . 13 GLN HE22 1 1 18 16670 1 1 13 GLN HG2 H -1.365 -8.243 -6.649 1.00 . A A . 13 GLN HG2 1 1 18 16671 1 1 13 GLN HG3 H -2.152 -9.134 -5.348 1.00 . A A . 13 GLN HG3 1 1 18 16672 1 1 13 GLN N N -0.176 -6.224 -6.241 1.00 . A A . 13 GLN N 1 1 18 16673 1 1 13 GLN NE2 N -4.631 -8.365 -6.184 1.00 . A A . 13 GLN NE2 1 1 18 16674 1 1 13 GLN O O 0.285 -6.914 -2.880 1.00 . A A . 13 GLN O 1 1 18 16675 1 1 13 GLN OE1 O -3.405 -8.506 -8.059 1.00 . A A . 13 GLN OE1 1 1 18 16676 1 1 14 ARG C C 2.367 -8.665 -3.021 1.00 . A A . 14 ARG C 1 1 18 16677 1 1 14 ARG CA C 1.241 -9.378 -3.765 1.00 . A A . 14 ARG CA 1 1 18 16678 1 1 14 ARG CB C 1.825 -10.448 -4.689 1.00 . A A . 14 ARG CB 1 1 18 16679 1 1 14 ARG CD C 1.852 -12.955 -4.859 1.00 . A A . 14 ARG CD 1 1 18 16680 1 1 14 ARG CG C 2.152 -11.753 -3.980 1.00 . A A . 14 ARG CG 1 1 18 16681 1 1 14 ARG CZ C 3.133 -14.809 -3.861 1.00 . A A . 14 ARG CZ 1 1 18 16682 1 1 14 ARG H H 0.179 -8.668 -5.455 1.00 . A A . 14 ARG H 1 1 18 16683 1 1 14 ARG HA H 0.596 -9.855 -3.043 1.00 . A A . 14 ARG HA 1 1 18 16684 1 1 14 ARG HB2 H 1.112 -10.657 -5.473 1.00 . A A . 14 ARG HB2 1 1 18 16685 1 1 14 ARG HB3 H 2.733 -10.067 -5.133 1.00 . A A . 14 ARG HB3 1 1 18 16686 1 1 14 ARG HD2 H 0.844 -12.866 -5.238 1.00 . A A . 14 ARG HD2 1 1 18 16687 1 1 14 ARG HD3 H 2.548 -12.964 -5.686 1.00 . A A . 14 ARG HD3 1 1 18 16688 1 1 14 ARG HE H 1.143 -14.637 -3.816 1.00 . A A . 14 ARG HE 1 1 18 16689 1 1 14 ARG HG2 H 3.201 -11.761 -3.726 1.00 . A A . 14 ARG HG2 1 1 18 16690 1 1 14 ARG HG3 H 1.559 -11.819 -3.079 1.00 . A A . 14 ARG HG3 1 1 18 16691 1 1 14 ARG HH11 H 4.266 -13.404 -4.773 1.00 . A A . 14 ARG HH11 1 1 18 16692 1 1 14 ARG HH12 H 5.142 -14.718 -4.065 1.00 . A A . 14 ARG HH12 1 1 18 16693 1 1 14 ARG HH21 H 2.295 -16.367 -2.883 1.00 . A A . 14 ARG HH21 1 1 18 16694 1 1 14 ARG HH22 H 4.024 -16.400 -2.988 1.00 . A A . 14 ARG HH22 1 1 18 16695 1 1 14 ARG N N 0.427 -8.437 -4.535 1.00 . A A . 14 ARG N 1 1 18 16696 1 1 14 ARG NE N 1.972 -14.213 -4.127 1.00 . A A . 14 ARG NE 1 1 18 16697 1 1 14 ARG NH1 N 4.274 -14.266 -4.267 1.00 . A A . 14 ARG NH1 1 1 18 16698 1 1 14 ARG NH2 N 3.152 -15.952 -3.189 1.00 . A A . 14 ARG NH2 1 1 18 16699 1 1 14 ARG O O 2.670 -8.992 -1.874 1.00 . A A . 14 ARG O 1 1 18 16700 1 1 15 ALA C C 3.611 -6.210 -1.822 1.00 . A A . 15 ALA C 1 1 18 16701 1 1 15 ALA CA C 4.075 -6.935 -3.080 1.00 . A A . 15 ALA CA 1 1 18 16702 1 1 15 ALA CB C 4.646 -5.944 -4.083 1.00 . A A . 15 ALA CB 1 1 18 16703 1 1 15 ALA H H 2.698 -7.475 -4.594 1.00 . A A . 15 ALA H 1 1 18 16704 1 1 15 ALA HA H 4.856 -7.632 -2.814 1.00 . A A . 15 ALA HA 1 1 18 16705 1 1 15 ALA HB1 H 5.242 -5.208 -3.562 1.00 . A A . 15 ALA HB1 1 1 18 16706 1 1 15 ALA HB2 H 3.839 -5.450 -4.602 1.00 . A A . 15 ALA HB2 1 1 18 16707 1 1 15 ALA HB3 H 5.264 -6.469 -4.795 1.00 . A A . 15 ALA HB3 1 1 18 16708 1 1 15 ALA N N 2.984 -7.690 -3.682 1.00 . A A . 15 ALA N 1 1 18 16709 1 1 15 ALA O O 4.232 -6.319 -0.764 1.00 . A A . 15 ALA O 1 1 18 16710 1 1 16 VAL C C 1.677 -5.644 0.365 1.00 . A A . 16 VAL C 1 1 18 16711 1 1 16 VAL CA C 1.960 -4.725 -0.819 1.00 . A A . 16 VAL CA 1 1 18 16712 1 1 16 VAL CB C 0.658 -3.987 -1.200 1.00 . A A . 16 VAL CB 1 1 18 16713 1 1 16 VAL CG1 C 0.530 -2.714 -0.391 1.00 . A A . 16 VAL CG1 1 1 18 16714 1 1 16 VAL CG2 C 0.606 -3.672 -2.689 1.00 . A A . 16 VAL CG2 1 1 18 16715 1 1 16 VAL H H 2.064 -5.421 -2.808 1.00 . A A . 16 VAL H 1 1 18 16716 1 1 16 VAL HA H 2.692 -3.988 -0.520 1.00 . A A . 16 VAL HA 1 1 18 16717 1 1 16 VAL HB H -0.179 -4.626 -0.958 1.00 . A A . 16 VAL HB 1 1 18 16718 1 1 16 VAL HG11 H -0.445 -2.281 -0.552 1.00 . A A . 16 VAL HG11 1 1 18 16719 1 1 16 VAL HG12 H 1.291 -2.016 -0.706 1.00 . A A . 16 VAL HG12 1 1 18 16720 1 1 16 VAL HG13 H 0.658 -2.940 0.656 1.00 . A A . 16 VAL HG13 1 1 18 16721 1 1 16 VAL HG21 H 1.578 -3.338 -3.021 1.00 . A A . 16 VAL HG21 1 1 18 16722 1 1 16 VAL HG22 H -0.121 -2.893 -2.868 1.00 . A A . 16 VAL HG22 1 1 18 16723 1 1 16 VAL HG23 H 0.324 -4.559 -3.235 1.00 . A A . 16 VAL HG23 1 1 18 16724 1 1 16 VAL N N 2.513 -5.469 -1.943 1.00 . A A . 16 VAL N 1 1 18 16725 1 1 16 VAL O O 1.929 -5.286 1.515 1.00 . A A . 16 VAL O 1 1 18 16726 1 1 17 ALA C C 2.077 -8.212 1.888 1.00 . A A . 17 ALA C 1 1 18 16727 1 1 17 ALA CA C 0.828 -7.799 1.115 1.00 . A A . 17 ALA CA 1 1 18 16728 1 1 17 ALA CB C 0.154 -9.019 0.506 1.00 . A A . 17 ALA CB 1 1 18 16729 1 1 17 ALA H H 0.969 -7.055 -0.862 1.00 . A A . 17 ALA H 1 1 18 16730 1 1 17 ALA HA H 0.131 -7.336 1.798 1.00 . A A . 17 ALA HA 1 1 18 16731 1 1 17 ALA HB1 H 0.359 -9.051 -0.554 1.00 . A A . 17 ALA HB1 1 1 18 16732 1 1 17 ALA HB2 H -0.913 -8.957 0.664 1.00 . A A . 17 ALA HB2 1 1 18 16733 1 1 17 ALA HB3 H 0.536 -9.914 0.974 1.00 . A A . 17 ALA HB3 1 1 18 16734 1 1 17 ALA N N 1.149 -6.828 0.076 1.00 . A A . 17 ALA N 1 1 18 16735 1 1 17 ALA O O 2.003 -8.549 3.070 1.00 . A A . 17 ALA O 1 1 18 16736 1 1 18 LYS C C 4.995 -7.452 2.754 1.00 . A A . 18 LYS C 1 1 18 16737 1 1 18 LYS CA C 4.485 -8.563 1.840 1.00 . A A . 18 LYS CA 1 1 18 16738 1 1 18 LYS CB C 5.532 -8.878 0.771 1.00 . A A . 18 LYS CB 1 1 18 16739 1 1 18 LYS CD C 5.869 -11.364 0.917 1.00 . A A . 18 LYS CD 1 1 18 16740 1 1 18 LYS CE C 6.362 -12.502 0.038 1.00 . A A . 18 LYS CE 1 1 18 16741 1 1 18 LYS CG C 5.318 -10.218 0.086 1.00 . A A . 18 LYS CG 1 1 18 16742 1 1 18 LYS H H 3.218 -7.912 0.274 1.00 . A A . 18 LYS H 1 1 18 16743 1 1 18 LYS HA H 4.311 -9.448 2.433 1.00 . A A . 18 LYS HA 1 1 18 16744 1 1 18 LYS HB2 H 5.506 -8.105 0.018 1.00 . A A . 18 LYS HB2 1 1 18 16745 1 1 18 LYS HB3 H 6.509 -8.887 1.232 1.00 . A A . 18 LYS HB3 1 1 18 16746 1 1 18 LYS HD2 H 6.693 -11.001 1.512 1.00 . A A . 18 LYS HD2 1 1 18 16747 1 1 18 LYS HD3 H 5.089 -11.734 1.566 1.00 . A A . 18 LYS HD3 1 1 18 16748 1 1 18 LYS HE2 H 6.849 -13.238 0.661 1.00 . A A . 18 LYS HE2 1 1 18 16749 1 1 18 LYS HE3 H 5.511 -12.953 -0.454 1.00 . A A . 18 LYS HE3 1 1 18 16750 1 1 18 LYS HG2 H 4.260 -10.370 -0.062 1.00 . A A . 18 LYS HG2 1 1 18 16751 1 1 18 LYS HG3 H 5.819 -10.205 -0.872 1.00 . A A . 18 LYS HG3 1 1 18 16752 1 1 18 LYS HZ1 H 8.093 -12.721 -1.111 1.00 . A A . 18 LYS HZ1 1 1 18 16753 1 1 18 LYS HZ2 H 7.735 -11.118 -0.712 1.00 . A A . 18 LYS HZ2 1 1 18 16754 1 1 18 LYS HZ3 H 6.839 -11.911 -1.908 1.00 . A A . 18 LYS HZ3 1 1 18 16755 1 1 18 LYS N N 3.222 -8.187 1.215 1.00 . A A . 18 LYS N 1 1 18 16756 1 1 18 LYS NZ N 7.324 -12.030 -0.996 1.00 . A A . 18 LYS NZ 1 1 18 16757 1 1 18 LYS O O 5.662 -7.716 3.754 1.00 . A A . 18 LYS O 1 1 18 16758 1 1 19 ALA C C 4.266 -4.915 4.454 1.00 . A A . 19 ALA C 1 1 18 16759 1 1 19 ALA CA C 5.106 -5.061 3.191 1.00 . A A . 19 ALA CA 1 1 18 16760 1 1 19 ALA CB C 5.032 -3.792 2.354 1.00 . A A . 19 ALA CB 1 1 18 16761 1 1 19 ALA H H 4.147 -6.063 1.593 1.00 . A A . 19 ALA H 1 1 18 16762 1 1 19 ALA HA H 6.138 -5.216 3.473 1.00 . A A . 19 ALA HA 1 1 18 16763 1 1 19 ALA HB1 H 4.325 -3.933 1.550 1.00 . A A . 19 ALA HB1 1 1 18 16764 1 1 19 ALA HB2 H 6.007 -3.575 1.942 1.00 . A A . 19 ALA HB2 1 1 18 16765 1 1 19 ALA HB3 H 4.712 -2.969 2.975 1.00 . A A . 19 ALA HB3 1 1 18 16766 1 1 19 ALA N N 4.679 -6.211 2.402 1.00 . A A . 19 ALA N 1 1 18 16767 1 1 19 ALA O O 4.798 -4.763 5.553 1.00 . A A . 19 ALA O 1 1 18 16768 1 1 20 LEU C C 1.907 -6.151 6.173 1.00 . A A . 20 LEU C 1 1 18 16769 1 1 20 LEU CA C 2.031 -4.832 5.418 1.00 . A A . 20 LEU CA 1 1 18 16770 1 1 20 LEU CB C 0.654 -4.376 4.932 1.00 . A A . 20 LEU CB 1 1 18 16771 1 1 20 LEU CD1 C -0.712 -3.035 3.314 1.00 . A A . 20 LEU CD1 1 1 18 16772 1 1 20 LEU CD2 C 1.177 -1.955 4.548 1.00 . A A . 20 LEU CD2 1 1 18 16773 1 1 20 LEU CG C 0.672 -3.240 3.908 1.00 . A A . 20 LEU CG 1 1 18 16774 1 1 20 LEU H H 2.581 -5.081 3.389 1.00 . A A . 20 LEU H 1 1 18 16775 1 1 20 LEU HA H 2.433 -4.085 6.086 1.00 . A A . 20 LEU HA 1 1 18 16776 1 1 20 LEU HB2 H 0.153 -5.225 4.490 1.00 . A A . 20 LEU HB2 1 1 18 16777 1 1 20 LEU HB3 H 0.084 -4.049 5.788 1.00 . A A . 20 LEU HB3 1 1 18 16778 1 1 20 LEU HD11 H -0.823 -3.654 2.437 1.00 . A A . 20 LEU HD11 1 1 18 16779 1 1 20 LEU HD12 H -0.836 -1.998 3.041 1.00 . A A . 20 LEU HD12 1 1 18 16780 1 1 20 LEU HD13 H -1.462 -3.306 4.043 1.00 . A A . 20 LEU HD13 1 1 18 16781 1 1 20 LEU HD21 H 0.336 -1.350 4.852 1.00 . A A . 20 LEU HD21 1 1 18 16782 1 1 20 LEU HD22 H 1.774 -1.409 3.834 1.00 . A A . 20 LEU HD22 1 1 18 16783 1 1 20 LEU HD23 H 1.778 -2.196 5.411 1.00 . A A . 20 LEU HD23 1 1 18 16784 1 1 20 LEU HG H 1.343 -3.501 3.103 1.00 . A A . 20 LEU HG 1 1 18 16785 1 1 20 LEU N N 2.948 -4.960 4.290 1.00 . A A . 20 LEU N 1 1 18 16786 1 1 20 LEU O O 1.663 -6.166 7.379 1.00 . A A . 20 LEU O 1 1 18 16787 1 1 21 GLY C C 0.585 -9.153 5.969 1.00 . A A . 21 GLY C 1 1 18 16788 1 1 21 GLY CA C 1.977 -8.565 6.077 1.00 . A A . 21 GLY CA 1 1 18 16789 1 1 21 GLY H H 2.268 -7.184 4.498 1.00 . A A . 21 GLY H 1 1 18 16790 1 1 21 GLY HA2 H 2.677 -9.233 5.596 1.00 . A A . 21 GLY HA2 1 1 18 16791 1 1 21 GLY HA3 H 2.240 -8.477 7.121 1.00 . A A . 21 GLY HA3 1 1 18 16792 1 1 21 GLY N N 2.076 -7.256 5.456 1.00 . A A . 21 GLY N 1 1 18 16793 1 1 21 GLY O O 0.170 -9.943 6.818 1.00 . A A . 21 GLY O 1 1 18 16794 1 1 22 ILE C C -1.552 -10.196 3.507 1.00 . A A . 22 ILE C 1 1 18 16795 1 1 22 ILE CA C -1.494 -9.259 4.708 1.00 . A A . 22 ILE CA 1 1 18 16796 1 1 22 ILE CB C -2.485 -8.099 4.488 1.00 . A A . 22 ILE CB 1 1 18 16797 1 1 22 ILE CD1 C -2.993 -6.102 2.997 1.00 . A A . 22 ILE CD1 1 1 18 16798 1 1 22 ILE CG1 C -2.044 -7.238 3.304 1.00 . A A . 22 ILE CG1 1 1 18 16799 1 1 22 ILE CG2 C -2.600 -7.257 5.750 1.00 . A A . 22 ILE CG2 1 1 18 16800 1 1 22 ILE H H 0.247 -8.133 4.283 1.00 . A A . 22 ILE H 1 1 18 16801 1 1 22 ILE HA H -1.796 -9.802 5.592 1.00 . A A . 22 ILE HA 1 1 18 16802 1 1 22 ILE HB H -3.455 -8.520 4.276 1.00 . A A . 22 ILE HB 1 1 18 16803 1 1 22 ILE HD11 H -3.750 -6.441 2.305 1.00 . A A . 22 ILE HD11 1 1 18 16804 1 1 22 ILE HD12 H -2.445 -5.283 2.556 1.00 . A A . 22 ILE HD12 1 1 18 16805 1 1 22 ILE HD13 H -3.465 -5.769 3.909 1.00 . A A . 22 ILE HD13 1 1 18 16806 1 1 22 ILE HG12 H -1.075 -6.810 3.519 1.00 . A A . 22 ILE HG12 1 1 18 16807 1 1 22 ILE HG13 H -1.971 -7.859 2.423 1.00 . A A . 22 ILE HG13 1 1 18 16808 1 1 22 ILE HG21 H -2.963 -6.271 5.493 1.00 . A A . 22 ILE HG21 1 1 18 16809 1 1 22 ILE HG22 H -1.631 -7.173 6.218 1.00 . A A . 22 ILE HG22 1 1 18 16810 1 1 22 ILE HG23 H -3.290 -7.727 6.435 1.00 . A A . 22 ILE HG23 1 1 18 16811 1 1 22 ILE N N -0.139 -8.766 4.925 1.00 . A A . 22 ILE N 1 1 18 16812 1 1 22 ILE O O -0.537 -10.458 2.862 1.00 . A A . 22 ILE O 1 1 18 16813 1 1 23 SER C C -3.236 -10.837 0.808 1.00 . A A . 23 SER C 1 1 18 16814 1 1 23 SER CA C -2.936 -11.609 2.087 1.00 . A A . 23 SER CA 1 1 18 16815 1 1 23 SER CB C -4.073 -12.588 2.386 1.00 . A A . 23 SER CB 1 1 18 16816 1 1 23 SER H H -3.519 -10.453 3.764 1.00 . A A . 23 SER H 1 1 18 16817 1 1 23 SER HA H -2.021 -12.164 1.953 1.00 . A A . 23 SER HA 1 1 18 16818 1 1 23 SER HB2 H -4.121 -13.330 1.602 1.00 . A A . 23 SER HB2 1 1 18 16819 1 1 23 SER HB3 H -3.889 -13.075 3.331 1.00 . A A . 23 SER HB3 1 1 18 16820 1 1 23 SER HG H -5.243 -11.153 3.027 1.00 . A A . 23 SER HG 1 1 18 16821 1 1 23 SER N N -2.747 -10.699 3.212 1.00 . A A . 23 SER N 1 1 18 16822 1 1 23 SER O O -3.624 -9.669 0.851 1.00 . A A . 23 SER O 1 1 18 16823 1 1 23 SER OG O -5.319 -11.918 2.452 1.00 . A A . 23 SER OG 1 1 18 16824 1 1 24 ASP C C -4.776 -10.494 -1.770 1.00 . A A . 24 ASP C 1 1 18 16825 1 1 24 ASP CA C -3.308 -10.873 -1.625 1.00 . A A . 24 ASP CA 1 1 18 16826 1 1 24 ASP CB C -2.900 -11.816 -2.758 1.00 . A A . 24 ASP CB 1 1 18 16827 1 1 24 ASP CG C -1.426 -12.175 -2.711 1.00 . A A . 24 ASP CG 1 1 18 16828 1 1 24 ASP H H -2.745 -12.426 -0.302 1.00 . A A . 24 ASP H 1 1 18 16829 1 1 24 ASP HA H -2.709 -9.977 -1.683 1.00 . A A . 24 ASP HA 1 1 18 16830 1 1 24 ASP HB2 H -3.475 -12.727 -2.685 1.00 . A A . 24 ASP HB2 1 1 18 16831 1 1 24 ASP HB3 H -3.104 -11.340 -3.706 1.00 . A A . 24 ASP HB3 1 1 18 16832 1 1 24 ASP N N -3.056 -11.497 -0.331 1.00 . A A . 24 ASP N 1 1 18 16833 1 1 24 ASP O O -5.114 -9.513 -2.434 1.00 . A A . 24 ASP O 1 1 18 16834 1 1 24 ASP OD1 O -0.960 -12.622 -1.641 1.00 . A A . 24 ASP OD1 1 1 18 16835 1 1 24 ASP OD2 O -0.741 -12.010 -3.740 1.00 . A A . 24 ASP OD2 1 1 18 16836 1 1 25 ALA C C -7.427 -9.673 -0.578 1.00 . A A . 25 ALA C 1 1 18 16837 1 1 25 ALA CA C -7.084 -11.023 -1.199 1.00 . A A . 25 ALA CA 1 1 18 16838 1 1 25 ALA CB C -7.844 -12.138 -0.498 1.00 . A A . 25 ALA CB 1 1 18 16839 1 1 25 ALA H H -5.320 -12.043 -0.627 1.00 . A A . 25 ALA H 1 1 18 16840 1 1 25 ALA HA H -7.379 -11.015 -2.239 1.00 . A A . 25 ALA HA 1 1 18 16841 1 1 25 ALA HB1 H -7.226 -13.021 -0.452 1.00 . A A . 25 ALA HB1 1 1 18 16842 1 1 25 ALA HB2 H -8.747 -12.360 -1.049 1.00 . A A . 25 ALA HB2 1 1 18 16843 1 1 25 ALA HB3 H -8.102 -11.825 0.502 1.00 . A A . 25 ALA HB3 1 1 18 16844 1 1 25 ALA N N -5.649 -11.276 -1.141 1.00 . A A . 25 ALA N 1 1 18 16845 1 1 25 ALA O O -8.222 -8.910 -1.128 1.00 . A A . 25 ALA O 1 1 18 16846 1 1 26 ALA C C -6.694 -6.935 0.397 1.00 . A A . 26 ALA C 1 1 18 16847 1 1 26 ALA CA C -7.070 -8.128 1.269 1.00 . A A . 26 ALA CA 1 1 18 16848 1 1 26 ALA CB C -6.294 -8.093 2.577 1.00 . A A . 26 ALA CB 1 1 18 16849 1 1 26 ALA H H -6.203 -10.035 0.961 1.00 . A A . 26 ALA H 1 1 18 16850 1 1 26 ALA HA H -8.123 -8.076 1.500 1.00 . A A . 26 ALA HA 1 1 18 16851 1 1 26 ALA HB1 H -6.501 -7.167 3.092 1.00 . A A . 26 ALA HB1 1 1 18 16852 1 1 26 ALA HB2 H -5.236 -8.161 2.371 1.00 . A A . 26 ALA HB2 1 1 18 16853 1 1 26 ALA HB3 H -6.594 -8.924 3.196 1.00 . A A . 26 ALA HB3 1 1 18 16854 1 1 26 ALA N N -6.826 -9.386 0.571 1.00 . A A . 26 ALA N 1 1 18 16855 1 1 26 ALA O O -7.421 -5.943 0.338 1.00 . A A . 26 ALA O 1 1 18 16856 1 1 27 VAL C C -6.079 -5.693 -2.274 1.00 . A A . 27 VAL C 1 1 18 16857 1 1 27 VAL CA C -5.085 -5.967 -1.151 1.00 . A A . 27 VAL CA 1 1 18 16858 1 1 27 VAL CB C -3.714 -6.305 -1.765 1.00 . A A . 27 VAL CB 1 1 18 16859 1 1 27 VAL CG1 C -3.168 -5.116 -2.544 1.00 . A A . 27 VAL CG1 1 1 18 16860 1 1 27 VAL CG2 C -2.735 -6.738 -0.684 1.00 . A A . 27 VAL CG2 1 1 18 16861 1 1 27 VAL H H -5.020 -7.853 -0.195 1.00 . A A . 27 VAL H 1 1 18 16862 1 1 27 VAL HA H -4.979 -5.073 -0.552 1.00 . A A . 27 VAL HA 1 1 18 16863 1 1 27 VAL HB H -3.842 -7.127 -2.454 1.00 . A A . 27 VAL HB 1 1 18 16864 1 1 27 VAL HG11 H -3.252 -4.223 -1.944 1.00 . A A . 27 VAL HG11 1 1 18 16865 1 1 27 VAL HG12 H -3.734 -4.992 -3.456 1.00 . A A . 27 VAL HG12 1 1 18 16866 1 1 27 VAL HG13 H -2.129 -5.290 -2.786 1.00 . A A . 27 VAL HG13 1 1 18 16867 1 1 27 VAL HG21 H -2.986 -7.733 -0.350 1.00 . A A . 27 VAL HG21 1 1 18 16868 1 1 27 VAL HG22 H -2.794 -6.052 0.149 1.00 . A A . 27 VAL HG22 1 1 18 16869 1 1 27 VAL HG23 H -1.733 -6.734 -1.083 1.00 . A A . 27 VAL HG23 1 1 18 16870 1 1 27 VAL N N -5.556 -7.037 -0.281 1.00 . A A . 27 VAL N 1 1 18 16871 1 1 27 VAL O O -6.494 -4.555 -2.487 1.00 . A A . 27 VAL O 1 1 18 16872 1 1 28 SER C C -8.763 -6.140 -3.596 1.00 . A A . 28 SER C 1 1 18 16873 1 1 28 SER CA C -7.402 -6.619 -4.095 1.00 . A A . 28 SER CA 1 1 18 16874 1 1 28 SER CB C -7.554 -7.957 -4.821 1.00 . A A . 28 SER CB 1 1 18 16875 1 1 28 SER H H -6.091 -7.628 -2.775 1.00 . A A . 28 SER H 1 1 18 16876 1 1 28 SER HA H -7.006 -5.889 -4.785 1.00 . A A . 28 SER HA 1 1 18 16877 1 1 28 SER HB2 H -6.590 -8.436 -4.894 1.00 . A A . 28 SER HB2 1 1 18 16878 1 1 28 SER HB3 H -8.229 -8.591 -4.264 1.00 . A A . 28 SER HB3 1 1 18 16879 1 1 28 SER HG H -7.503 -8.213 -6.763 1.00 . A A . 28 SER HG 1 1 18 16880 1 1 28 SER N N -6.457 -6.747 -2.992 1.00 . A A . 28 SER N 1 1 18 16881 1 1 28 SER O O -9.446 -5.369 -4.271 1.00 . A A . 28 SER O 1 1 18 16882 1 1 28 SER OG O -8.073 -7.774 -6.126 1.00 . A A . 28 SER OG 1 1 18 16883 1 1 29 GLN C C -10.500 -4.716 -1.582 1.00 . A A . 29 GLN C 1 1 18 16884 1 1 29 GLN CA C -10.420 -6.224 -1.823 1.00 . A A . 29 GLN CA 1 1 18 16885 1 1 29 GLN CB C -10.650 -6.975 -0.507 1.00 . A A . 29 GLN CB 1 1 18 16886 1 1 29 GLN CD C -11.800 -8.920 0.621 1.00 . A A . 29 GLN CD 1 1 18 16887 1 1 29 GLN CG C -11.800 -7.968 -0.560 1.00 . A A . 29 GLN CG 1 1 18 16888 1 1 29 GLN H H -8.562 -7.216 -1.923 1.00 . A A . 29 GLN H 1 1 18 16889 1 1 29 GLN HA H -11.200 -6.501 -2.518 1.00 . A A . 29 GLN HA 1 1 18 16890 1 1 29 GLN HB2 H -9.748 -7.517 -0.261 1.00 . A A . 29 GLN HB2 1 1 18 16891 1 1 29 GLN HB3 H -10.850 -6.261 0.276 1.00 . A A . 29 GLN HB3 1 1 18 16892 1 1 29 GLN HE21 H -13.770 -8.759 0.778 1.00 . A A . 29 GLN HE21 1 1 18 16893 1 1 29 GLN HE22 H -13.010 -9.798 1.928 1.00 . A A . 29 GLN HE22 1 1 18 16894 1 1 29 GLN HG2 H -12.730 -7.419 -0.562 1.00 . A A . 29 GLN HG2 1 1 18 16895 1 1 29 GLN HG3 H -11.720 -8.545 -1.469 1.00 . A A . 29 GLN HG3 1 1 18 16896 1 1 29 GLN N N -9.150 -6.603 -2.413 1.00 . A A . 29 GLN N 1 1 18 16897 1 1 29 GLN NE2 N -12.980 -9.185 1.163 1.00 . A A . 29 GLN NE2 1 1 18 16898 1 1 29 GLN O O -11.580 -4.157 -1.429 1.00 . A A . 29 GLN O 1 1 18 16899 1 1 29 GLN OE1 O -10.750 -9.411 1.038 1.00 . A A . 29 GLN OE1 1 1 18 16900 1 1 30 TRP C C -10.160 -1.870 -2.315 1.00 . A A . 30 TRP C 1 1 18 16901 1 1 30 TRP CA C -9.282 -2.622 -1.322 1.00 . A A . 30 TRP CA 1 1 18 16902 1 1 30 TRP CB C -7.839 -2.127 -1.430 1.00 . A A . 30 TRP CB 1 1 18 16903 1 1 30 TRP CD1 C -7.383 -3.099 0.900 1.00 . A A . 30 TRP CD1 1 1 18 16904 1 1 30 TRP CD2 C -5.546 -2.456 -0.205 1.00 . A A . 30 TRP CD2 1 1 18 16905 1 1 30 TRP CE2 C -5.159 -2.967 1.048 1.00 . A A . 30 TRP CE2 1 1 18 16906 1 1 30 TRP CE3 C -4.556 -1.991 -1.076 1.00 . A A . 30 TRP CE3 1 1 18 16907 1 1 30 TRP CG C -6.972 -2.550 -0.282 1.00 . A A . 30 TRP CG 1 1 18 16908 1 1 30 TRP CH2 C -2.880 -2.562 0.577 1.00 . A A . 30 TRP CH2 1 1 18 16909 1 1 30 TRP CZ2 C -3.827 -3.024 1.451 1.00 . A A . 30 TRP CZ2 1 1 18 16910 1 1 30 TRP CZ3 C -3.234 -2.049 -0.675 1.00 . A A . 30 TRP CZ3 1 1 18 16911 1 1 30 TRP H H -8.509 -4.561 -1.672 1.00 . A A . 30 TRP H 1 1 18 16912 1 1 30 TRP HA H -9.645 -2.429 -0.322 1.00 . A A . 30 TRP HA 1 1 18 16913 1 1 30 TRP HB2 H -7.400 -2.513 -2.337 1.00 . A A . 30 TRP HB2 1 1 18 16914 1 1 30 TRP HB3 H -7.838 -1.047 -1.467 1.00 . A A . 30 TRP HB3 1 1 18 16915 1 1 30 TRP HD1 H -8.414 -3.299 1.151 1.00 . A A . 30 TRP HD1 1 1 18 16916 1 1 30 TRP HE1 H -6.335 -3.747 2.601 1.00 . A A . 30 TRP HE1 1 1 18 16917 1 1 30 TRP HE3 H -4.810 -1.591 -2.047 1.00 . A A . 30 TRP HE3 1 1 18 16918 1 1 30 TRP HH2 H -1.835 -2.587 0.850 1.00 . A A . 30 TRP HH2 1 1 18 16919 1 1 30 TRP HZ2 H -3.538 -3.419 2.414 1.00 . A A . 30 TRP HZ2 1 1 18 16920 1 1 30 TRP HZ3 H -2.457 -1.692 -1.334 1.00 . A A . 30 TRP HZ3 1 1 18 16921 1 1 30 TRP N N -9.343 -4.063 -1.547 1.00 . A A . 30 TRP N 1 1 18 16922 1 1 30 TRP NE1 N -6.299 -3.353 1.704 1.00 . A A . 30 TRP NE1 1 1 18 16923 1 1 30 TRP O O -10.610 -2.435 -3.311 1.00 . A A . 30 TRP O 1 1 18 16924 1 1 31 LYS C C -10.460 1.515 -3.292 1.00 . A A . 31 LYS C 1 1 18 16925 1 1 31 LYS CA C -11.220 0.245 -2.901 1.00 . A A . 31 LYS CA 1 1 18 16926 1 1 31 LYS CB C -12.530 0.596 -2.196 1.00 . A A . 31 LYS CB 1 1 18 16927 1 1 31 LYS CD C -13.670 1.331 -0.081 1.00 . A A . 31 LYS CD 1 1 18 16928 1 1 31 LYS CE C -13.630 2.491 0.902 1.00 . A A . 31 LYS CE 1 1 18 16929 1 1 31 LYS CG C -12.340 1.172 -0.802 1.00 . A A . 31 LYS CG 1 1 18 16930 1 1 31 LYS H H -10.000 -0.202 -1.228 1.00 . A A . 31 LYS H 1 1 18 16931 1 1 31 LYS HA H -11.440 -0.318 -3.797 1.00 . A A . 31 LYS HA 1 1 18 16932 1 1 31 LYS HB2 H -13.070 1.318 -2.791 1.00 . A A . 31 LYS HB2 1 1 18 16933 1 1 31 LYS HB3 H -13.130 -0.299 -2.112 1.00 . A A . 31 LYS HB3 1 1 18 16934 1 1 31 LYS HD2 H -14.440 1.514 -0.810 1.00 . A A . 31 LYS HD2 1 1 18 16935 1 1 31 LYS HD3 H -13.890 0.422 0.458 1.00 . A A . 31 LYS HD3 1 1 18 16936 1 1 31 LYS HE2 H -13.470 2.101 1.895 1.00 . A A . 31 LYS HE2 1 1 18 16937 1 1 31 LYS HE3 H -12.820 3.148 0.635 1.00 . A A . 31 LYS HE3 1 1 18 16938 1 1 31 LYS HG2 H -11.710 0.508 -0.231 1.00 . A A . 31 LYS HG2 1 1 18 16939 1 1 31 LYS HG3 H -11.870 2.140 -0.885 1.00 . A A . 31 LYS HG3 1 1 18 16940 1 1 31 LYS HZ1 H -15.130 3.586 1.854 1.00 . A A . 31 LYS HZ1 1 1 18 16941 1 1 31 LYS HZ2 H -15.680 2.675 0.539 1.00 . A A . 31 LYS HZ2 1 1 18 16942 1 1 31 LYS HZ3 H -14.810 4.100 0.275 1.00 . A A . 31 LYS HZ3 1 1 18 16943 1 1 31 LYS N N -10.390 -0.593 -2.036 1.00 . A A . 31 LYS N 1 1 18 16944 1 1 31 LYS NZ N -14.900 3.267 0.893 1.00 . A A . 31 LYS NZ 1 1 18 16945 1 1 31 LYS O O -9.257 1.609 -3.096 1.00 . A A . 31 LYS O 1 1 18 16946 1 1 32 GLU C C -9.620 4.288 -3.209 1.00 . A A . 32 GLU C 1 1 18 16947 1 1 32 GLU CA C -10.580 3.755 -4.266 1.00 . A A . 32 GLU CA 1 1 18 16948 1 1 32 GLU CB C -11.670 4.793 -4.548 1.00 . A A . 32 GLU CB 1 1 18 16949 1 1 32 GLU CD C -13.040 6.014 -6.287 1.00 . A A . 32 GLU CD 1 1 18 16950 1 1 32 GLU CG C -11.900 5.048 -6.029 1.00 . A A . 32 GLU CG 1 1 18 16951 1 1 32 GLU H H -12.150 2.357 -3.978 1.00 . A A . 32 GLU H 1 1 18 16952 1 1 32 GLU HA H -10.030 3.571 -5.176 1.00 . A A . 32 GLU HA 1 1 18 16953 1 1 32 GLU HB2 H -12.600 4.447 -4.119 1.00 . A A . 32 GLU HB2 1 1 18 16954 1 1 32 GLU HB3 H -11.400 5.726 -4.082 1.00 . A A . 32 GLU HB3 1 1 18 16955 1 1 32 GLU HG2 H -10.990 5.460 -6.452 1.00 . A A . 32 GLU HG2 1 1 18 16956 1 1 32 GLU HG3 H -12.120 4.108 -6.512 1.00 . A A . 32 GLU HG3 1 1 18 16957 1 1 32 GLU N N -11.190 2.490 -3.845 1.00 . A A . 32 GLU N 1 1 18 16958 1 1 32 GLU O O -8.634 4.949 -3.533 1.00 . A A . 32 GLU O 1 1 18 16959 1 1 32 GLU OE1 O -14.200 5.653 -5.997 1.00 . A A . 32 GLU OE1 1 1 18 16960 1 1 32 GLU OE2 O -12.770 7.131 -6.777 1.00 . A A . 32 GLU OE2 1 1 18 16961 1 1 33 VAL C C -8.738 3.274 0.090 1.00 . A A . 33 VAL C 1 1 18 16962 1 1 33 VAL CA C -9.066 4.435 -0.842 1.00 . A A . 33 VAL CA 1 1 18 16963 1 1 33 VAL CB C -9.742 5.557 -0.031 1.00 . A A . 33 VAL CB 1 1 18 16964 1 1 33 VAL CG1 C -8.789 6.109 1.019 1.00 . A A . 33 VAL CG1 1 1 18 16965 1 1 33 VAL CG2 C -10.230 6.663 -0.953 1.00 . A A . 33 VAL CG2 1 1 18 16966 1 1 33 VAL H H -10.700 3.460 -1.752 1.00 . A A . 33 VAL H 1 1 18 16967 1 1 33 VAL HA H -8.147 4.823 -1.259 1.00 . A A . 33 VAL HA 1 1 18 16968 1 1 33 VAL HB H -10.590 5.139 0.480 1.00 . A A . 33 VAL HB 1 1 18 16969 1 1 33 VAL HG11 H -8.084 6.779 0.548 1.00 . A A . 33 VAL HG11 1 1 18 16970 1 1 33 VAL HG12 H -8.254 5.295 1.485 1.00 . A A . 33 VAL HG12 1 1 18 16971 1 1 33 VAL HG13 H -9.350 6.647 1.768 1.00 . A A . 33 VAL HG13 1 1 18 16972 1 1 33 VAL HG21 H -9.409 7.323 -1.191 1.00 . A A . 33 VAL HG21 1 1 18 16973 1 1 33 VAL HG22 H -11.010 7.224 -0.461 1.00 . A A . 33 VAL HG22 1 1 18 16974 1 1 33 VAL HG23 H -10.610 6.228 -1.862 1.00 . A A . 33 VAL HG23 1 1 18 16975 1 1 33 VAL N N -9.910 3.992 -1.946 1.00 . A A . 33 VAL N 1 1 18 16976 1 1 33 VAL O O -9.633 2.647 0.656 1.00 . A A . 33 VAL O 1 1 18 16977 1 1 34 ILE C C -7.569 2.049 2.520 1.00 . A A . 34 ILE C 1 1 18 16978 1 1 34 ILE CA C -7.003 1.901 1.108 1.00 . A A . 34 ILE CA 1 1 18 16979 1 1 34 ILE CB C -5.465 1.830 1.188 1.00 . A A . 34 ILE CB 1 1 18 16980 1 1 34 ILE CD1 C -3.392 3.202 1.724 1.00 . A A . 34 ILE CD1 1 1 18 16981 1 1 34 ILE CG1 C -4.873 3.222 1.421 1.00 . A A . 34 ILE CG1 1 1 18 16982 1 1 34 ILE CG2 C -4.898 1.214 -0.080 1.00 . A A . 34 ILE CG2 1 1 18 16983 1 1 34 ILE H H -6.781 3.527 -0.233 1.00 . A A . 34 ILE H 1 1 18 16984 1 1 34 ILE HA H -7.363 0.975 0.684 1.00 . A A . 34 ILE HA 1 1 18 16985 1 1 34 ILE HB H -5.201 1.192 2.018 1.00 . A A . 34 ILE HB 1 1 18 16986 1 1 34 ILE HD11 H -3.101 4.145 2.164 1.00 . A A . 34 ILE HD11 1 1 18 16987 1 1 34 ILE HD12 H -2.838 3.047 0.809 1.00 . A A . 34 ILE HD12 1 1 18 16988 1 1 34 ILE HD13 H -3.178 2.400 2.415 1.00 . A A . 34 ILE HD13 1 1 18 16989 1 1 34 ILE HG12 H -5.022 3.822 0.535 1.00 . A A . 34 ILE HG12 1 1 18 16990 1 1 34 ILE HG13 H -5.378 3.687 2.254 1.00 . A A . 34 ILE HG13 1 1 18 16991 1 1 34 ILE HG21 H -5.603 0.500 -0.481 1.00 . A A . 34 ILE HG21 1 1 18 16992 1 1 34 ILE HG22 H -3.968 0.712 0.148 1.00 . A A . 34 ILE HG22 1 1 18 16993 1 1 34 ILE HG23 H -4.718 1.991 -0.810 1.00 . A A . 34 ILE HG23 1 1 18 16994 1 1 34 ILE N N -7.447 2.992 0.245 1.00 . A A . 34 ILE N 1 1 18 16995 1 1 34 ILE O O -7.946 3.144 2.934 1.00 . A A . 34 ILE O 1 1 18 16996 1 1 35 PRO C C -7.518 2.027 5.510 1.00 . A A . 35 PRO C 1 1 18 16997 1 1 35 PRO CA C -8.166 0.951 4.646 1.00 . A A . 35 PRO CA 1 1 18 16998 1 1 35 PRO CB C -7.818 -0.442 5.171 1.00 . A A . 35 PRO CB 1 1 18 16999 1 1 35 PRO CD C -7.214 -0.408 2.858 1.00 . A A . 35 PRO CD 1 1 18 17000 1 1 35 PRO CG C -7.737 -1.296 3.954 1.00 . A A . 35 PRO CG 1 1 18 17001 1 1 35 PRO HA H -9.238 1.083 4.653 1.00 . A A . 35 PRO HA 1 1 18 17002 1 1 35 PRO HB2 H -6.873 -0.408 5.695 1.00 . A A . 35 PRO HB2 1 1 18 17003 1 1 35 PRO HB3 H -8.594 -0.783 5.840 1.00 . A A . 35 PRO HB3 1 1 18 17004 1 1 35 PRO HD2 H -6.137 -0.474 2.803 1.00 . A A . 35 PRO HD2 1 1 18 17005 1 1 35 PRO HD3 H -7.658 -0.676 1.911 1.00 . A A . 35 PRO HD3 1 1 18 17006 1 1 35 PRO HG2 H -7.060 -2.119 4.126 1.00 . A A . 35 PRO HG2 1 1 18 17007 1 1 35 PRO HG3 H -8.720 -1.666 3.700 1.00 . A A . 35 PRO HG3 1 1 18 17008 1 1 35 PRO N N -7.639 0.940 3.277 1.00 . A A . 35 PRO N 1 1 18 17009 1 1 35 PRO O O -6.550 2.667 5.102 1.00 . A A . 35 PRO O 1 1 18 17010 1 1 36 GLU C C -6.280 2.730 8.327 1.00 . A A . 36 GLU C 1 1 18 17011 1 1 36 GLU CA C -7.548 3.221 7.632 1.00 . A A . 36 GLU CA 1 1 18 17012 1 1 36 GLU CB C -8.611 3.569 8.676 1.00 . A A . 36 GLU CB 1 1 18 17013 1 1 36 GLU CD C -7.530 4.835 10.576 1.00 . A A . 36 GLU CD 1 1 18 17014 1 1 36 GLU CG C -8.399 4.921 9.337 1.00 . A A . 36 GLU CG 1 1 18 17015 1 1 36 GLU H H -8.836 1.680 6.972 1.00 . A A . 36 GLU H 1 1 18 17016 1 1 36 GLU HA H -7.311 4.109 7.063 1.00 . A A . 36 GLU HA 1 1 18 17017 1 1 36 GLU HB2 H -9.579 3.574 8.198 1.00 . A A . 36 GLU HB2 1 1 18 17018 1 1 36 GLU HB3 H -8.604 2.812 9.445 1.00 . A A . 36 GLU HB3 1 1 18 17019 1 1 36 GLU HG2 H -7.925 5.583 8.628 1.00 . A A . 36 GLU HG2 1 1 18 17020 1 1 36 GLU HG3 H -9.361 5.326 9.617 1.00 . A A . 36 GLU HG3 1 1 18 17021 1 1 36 GLU N N -8.063 2.221 6.706 1.00 . A A . 36 GLU N 1 1 18 17022 1 1 36 GLU O O -5.390 3.520 8.643 1.00 . A A . 36 GLU O 1 1 18 17023 1 1 36 GLU OE1 O -8.079 4.585 11.670 1.00 . A A . 36 GLU OE1 1 1 18 17024 1 1 36 GLU OE2 O -6.301 5.013 10.453 1.00 . A A . 36 GLU OE2 1 1 18 17025 1 1 37 LYS C C -3.982 0.407 8.236 1.00 . A A . 37 LYS C 1 1 18 17026 1 1 37 LYS CA C -5.051 0.836 9.237 1.00 . A A . 37 LYS CA 1 1 18 17027 1 1 37 LYS CB C -5.481 -0.362 10.087 1.00 . A A . 37 LYS CB 1 1 18 17028 1 1 37 LYS CD C -5.940 -0.865 12.506 1.00 . A A . 37 LYS CD 1 1 18 17029 1 1 37 LYS CE C -7.170 -1.181 13.342 1.00 . A A . 37 LYS CE 1 1 18 17030 1 1 37 LYS CG C -6.283 0.021 11.319 1.00 . A A . 37 LYS CG 1 1 18 17031 1 1 37 LYS H H -6.952 0.846 8.301 1.00 . A A . 37 LYS H 1 1 18 17032 1 1 37 LYS HA H -4.628 1.589 9.886 1.00 . A A . 37 LYS HA 1 1 18 17033 1 1 37 LYS HB2 H -6.086 -1.020 9.479 1.00 . A A . 37 LYS HB2 1 1 18 17034 1 1 37 LYS HB3 H -4.597 -0.895 10.409 1.00 . A A . 37 LYS HB3 1 1 18 17035 1 1 37 LYS HD2 H -5.518 -1.790 12.143 1.00 . A A . 37 LYS HD2 1 1 18 17036 1 1 37 LYS HD3 H -5.216 -0.356 13.125 1.00 . A A . 37 LYS HD3 1 1 18 17037 1 1 37 LYS HE2 H -6.914 -1.088 14.386 1.00 . A A . 37 LYS HE2 1 1 18 17038 1 1 37 LYS HE3 H -7.947 -0.471 13.099 1.00 . A A . 37 LYS HE3 1 1 18 17039 1 1 37 LYS HG2 H -6.066 1.048 11.574 1.00 . A A . 37 LYS HG2 1 1 18 17040 1 1 37 LYS HG3 H -7.336 -0.081 11.097 1.00 . A A . 37 LYS HG3 1 1 18 17041 1 1 37 LYS HZ1 H -8.713 -2.549 13.004 1.00 . A A . 37 LYS HZ1 1 1 18 17042 1 1 37 LYS HZ2 H -7.412 -3.186 13.877 1.00 . A A . 37 LYS HZ2 1 1 18 17043 1 1 37 LYS HZ3 H -7.269 -2.936 12.211 1.00 . A A . 37 LYS HZ3 1 1 18 17044 1 1 37 LYS N N -6.207 1.426 8.571 1.00 . A A . 37 LYS N 1 1 18 17045 1 1 37 LYS NZ N -7.676 -2.559 13.091 1.00 . A A . 37 LYS NZ 1 1 18 17046 1 1 37 LYS O O -2.818 0.238 8.597 1.00 . A A . 37 LYS O 1 1 18 17047 1 1 38 ASP C C -2.620 1.018 5.460 1.00 . A A . 38 ASP C 1 1 18 17048 1 1 38 ASP CA C -3.433 -0.176 5.943 1.00 . A A . 38 ASP CA 1 1 18 17049 1 1 38 ASP CB C -4.173 -0.816 4.767 1.00 . A A . 38 ASP CB 1 1 18 17050 1 1 38 ASP CG C -4.299 -2.322 4.909 1.00 . A A . 38 ASP CG 1 1 18 17051 1 1 38 ASP H H -5.315 0.380 6.741 1.00 . A A . 38 ASP H 1 1 18 17052 1 1 38 ASP HA H -2.761 -0.903 6.375 1.00 . A A . 38 ASP HA 1 1 18 17053 1 1 38 ASP HB2 H -5.165 -0.396 4.701 1.00 . A A . 38 ASP HB2 1 1 18 17054 1 1 38 ASP HB3 H -3.635 -0.603 3.853 1.00 . A A . 38 ASP HB3 1 1 18 17055 1 1 38 ASP N N -4.376 0.232 6.979 1.00 . A A . 38 ASP N 1 1 18 17056 1 1 38 ASP O O -1.414 0.910 5.233 1.00 . A A . 38 ASP O 1 1 18 17057 1 1 38 ASP OD1 O -3.715 -2.878 5.863 1.00 . A A . 38 ASP OD1 1 1 18 17058 1 1 38 ASP OD2 O -4.979 -2.942 4.066 1.00 . A A . 38 ASP OD2 1 1 18 17059 1 1 39 ALA C C -1.558 3.810 5.871 1.00 . A A . 39 ALA C 1 1 18 17060 1 1 39 ALA CA C -2.621 3.376 4.867 1.00 . A A . 39 ALA CA 1 1 18 17061 1 1 39 ALA CB C -3.638 4.486 4.660 1.00 . A A . 39 ALA CB 1 1 18 17062 1 1 39 ALA H H -4.244 2.182 5.516 1.00 . A A . 39 ALA H 1 1 18 17063 1 1 39 ALA HA H -2.146 3.170 3.920 1.00 . A A . 39 ALA HA 1 1 18 17064 1 1 39 ALA HB1 H -3.124 5.422 4.502 1.00 . A A . 39 ALA HB1 1 1 18 17065 1 1 39 ALA HB2 H -4.269 4.567 5.533 1.00 . A A . 39 ALA HB2 1 1 18 17066 1 1 39 ALA HB3 H -4.247 4.260 3.797 1.00 . A A . 39 ALA HB3 1 1 18 17067 1 1 39 ALA N N -3.286 2.158 5.313 1.00 . A A . 39 ALA N 1 1 18 17068 1 1 39 ALA O O -0.584 4.472 5.510 1.00 . A A . 39 ALA O 1 1 18 17069 1 1 40 TYR C C 0.459 2.947 8.085 1.00 . A A . 40 TYR C 1 1 18 17070 1 1 40 TYR CA C -0.810 3.786 8.187 1.00 . A A . 40 TYR CA 1 1 18 17071 1 1 40 TYR CB C -1.457 3.592 9.558 1.00 . A A . 40 TYR CB 1 1 18 17072 1 1 40 TYR CD1 C -0.485 5.251 11.193 1.00 . A A . 40 TYR CD1 1 1 18 17073 1 1 40 TYR CD2 C 0.241 2.984 11.322 1.00 . A A . 40 TYR CD2 1 1 18 17074 1 1 40 TYR CE1 C 0.343 5.582 12.248 1.00 . A A . 40 TYR CE1 1 1 18 17075 1 1 40 TYR CE2 C 1.072 3.305 12.378 1.00 . A A . 40 TYR CE2 1 1 18 17076 1 1 40 TYR CG C -0.550 3.949 10.712 1.00 . A A . 40 TYR CG 1 1 18 17077 1 1 40 TYR CZ C 1.119 4.606 12.837 1.00 . A A . 40 TYR CZ 1 1 18 17078 1 1 40 TYR H H -2.548 2.909 7.361 1.00 . A A . 40 TYR H 1 1 18 17079 1 1 40 TYR HA H -0.549 4.828 8.066 1.00 . A A . 40 TYR HA 1 1 18 17080 1 1 40 TYR HB2 H -2.338 4.216 9.625 1.00 . A A . 40 TYR HB2 1 1 18 17081 1 1 40 TYR HB3 H -1.745 2.555 9.668 1.00 . A A . 40 TYR HB3 1 1 18 17082 1 1 40 TYR HD1 H -1.097 6.012 10.730 1.00 . A A . 40 TYR HD1 1 1 18 17083 1 1 40 TYR HD2 H 0.202 1.967 10.959 1.00 . A A . 40 TYR HD2 1 1 18 17084 1 1 40 TYR HE1 H 0.379 6.600 12.607 1.00 . A A . 40 TYR HE1 1 1 18 17085 1 1 40 TYR HE2 H 1.680 2.542 12.839 1.00 . A A . 40 TYR HE2 1 1 18 17086 1 1 40 TYR HH H 1.620 4.518 14.692 1.00 . A A . 40 TYR HH 1 1 18 17087 1 1 40 TYR N N -1.751 3.436 7.132 1.00 . A A . 40 TYR N 1 1 18 17088 1 1 40 TYR O O 1.569 3.480 8.077 1.00 . A A . 40 TYR O 1 1 18 17089 1 1 40 TYR OH O 1.945 4.931 13.888 1.00 . A A . 40 TYR OH 1 1 18 17090 1 1 41 ARG C C 2.164 0.904 6.591 1.00 . A A . 41 ARG C 1 1 18 17091 1 1 41 ARG CA C 1.418 0.716 7.911 1.00 . A A . 41 ARG CA 1 1 18 17092 1 1 41 ARG CB C 0.939 -0.732 8.031 1.00 . A A . 41 ARG CB 1 1 18 17093 1 1 41 ARG CD C -0.494 -2.400 9.253 1.00 . A A . 41 ARG CD 1 1 18 17094 1 1 41 ARG CG C 0.074 -0.988 9.255 1.00 . A A . 41 ARG CG 1 1 18 17095 1 1 41 ARG CZ C -2.693 -3.510 9.293 1.00 . A A . 41 ARG CZ 1 1 18 17096 1 1 41 ARG H H -0.622 1.268 8.022 1.00 . A A . 41 ARG H 1 1 18 17097 1 1 41 ARG HA H 2.091 0.932 8.726 1.00 . A A . 41 ARG HA 1 1 18 17098 1 1 41 ARG HB2 H 0.364 -0.983 7.153 1.00 . A A . 41 ARG HB2 1 1 18 17099 1 1 41 ARG HB3 H 1.801 -1.380 8.085 1.00 . A A . 41 ARG HB3 1 1 18 17100 1 1 41 ARG HD2 H -0.147 -2.914 8.369 1.00 . A A . 41 ARG HD2 1 1 18 17101 1 1 41 ARG HD3 H -0.139 -2.918 10.131 1.00 . A A . 41 ARG HD3 1 1 18 17102 1 1 41 ARG HE H -2.410 -1.535 9.234 1.00 . A A . 41 ARG HE 1 1 18 17103 1 1 41 ARG HG2 H 0.674 -0.856 10.143 1.00 . A A . 41 ARG HG2 1 1 18 17104 1 1 41 ARG HG3 H -0.741 -0.281 9.262 1.00 . A A . 41 ARG HG3 1 1 18 17105 1 1 41 ARG HH11 H -1.115 -4.775 9.325 1.00 . A A . 41 ARG HH11 1 1 18 17106 1 1 41 ARG HH12 H -2.672 -5.530 9.352 1.00 . A A . 41 ARG HH12 1 1 18 17107 1 1 41 ARG HH21 H -4.459 -2.528 9.270 1.00 . A A . 41 ARG HH21 1 1 18 17108 1 1 41 ARG HH22 H -4.571 -4.256 9.321 1.00 . A A . 41 ARG HH22 1 1 18 17109 1 1 41 ARG N N 0.287 1.632 8.010 1.00 . A A . 41 ARG N 1 1 18 17110 1 1 41 ARG NE N -1.955 -2.403 9.258 1.00 . A A . 41 ARG NE 1 1 18 17111 1 1 41 ARG NH1 N -2.113 -4.703 9.326 1.00 . A A . 41 ARG NH1 1 1 18 17112 1 1 41 ARG NH2 N -4.016 -3.424 9.295 1.00 . A A . 41 ARG NH2 1 1 18 17113 1 1 41 ARG O O 3.347 0.575 6.484 1.00 . A A . 41 ARG O 1 1 18 17114 1 1 42 LEU C C 3.144 2.721 4.334 1.00 . A A . 42 LEU C 1 1 18 17115 1 1 42 LEU CA C 2.061 1.650 4.277 1.00 . A A . 42 LEU CA 1 1 18 17116 1 1 42 LEU CB C 0.984 2.048 3.266 1.00 . A A . 42 LEU CB 1 1 18 17117 1 1 42 LEU CD1 C -0.989 1.320 1.898 1.00 . A A . 42 LEU CD1 1 1 18 17118 1 1 42 LEU CD2 C 1.265 0.319 1.473 1.00 . A A . 42 LEU CD2 1 1 18 17119 1 1 42 LEU CG C 0.325 0.881 2.529 1.00 . A A . 42 LEU CG 1 1 18 17120 1 1 42 LEU H H 0.527 1.665 5.732 1.00 . A A . 42 LEU H 1 1 18 17121 1 1 42 LEU HA H 2.510 0.722 3.960 1.00 . A A . 42 LEU HA 1 1 18 17122 1 1 42 LEU HB2 H 0.215 2.599 3.788 1.00 . A A . 42 LEU HB2 1 1 18 17123 1 1 42 LEU HB3 H 1.432 2.700 2.531 1.00 . A A . 42 LEU HB3 1 1 18 17124 1 1 42 LEU HD11 H -1.022 2.398 1.847 1.00 . A A . 42 LEU HD11 1 1 18 17125 1 1 42 LEU HD12 H -1.813 0.963 2.498 1.00 . A A . 42 LEU HD12 1 1 18 17126 1 1 42 LEU HD13 H -1.065 0.910 0.901 1.00 . A A . 42 LEU HD13 1 1 18 17127 1 1 42 LEU HD21 H 1.914 -0.417 1.926 1.00 . A A . 42 LEU HD21 1 1 18 17128 1 1 42 LEU HD22 H 1.862 1.119 1.060 1.00 . A A . 42 LEU HD22 1 1 18 17129 1 1 42 LEU HD23 H 0.688 -0.144 0.687 1.00 . A A . 42 LEU HD23 1 1 18 17130 1 1 42 LEU HG H 0.107 0.095 3.237 1.00 . A A . 42 LEU HG 1 1 18 17131 1 1 42 LEU N N 1.465 1.427 5.589 1.00 . A A . 42 LEU N 1 1 18 17132 1 1 42 LEU O O 4.143 2.646 3.618 1.00 . A A . 42 LEU O 1 1 18 17133 1 1 43 GLU C C 5.275 4.263 5.742 1.00 . A A . 43 GLU C 1 1 18 17134 1 1 43 GLU CA C 3.908 4.802 5.330 1.00 . A A . 43 GLU CA 1 1 18 17135 1 1 43 GLU CB C 3.413 5.815 6.361 1.00 . A A . 43 GLU CB 1 1 18 17136 1 1 43 GLU CD C 5.174 7.271 7.442 1.00 . A A . 43 GLU CD 1 1 18 17137 1 1 43 GLU CG C 4.160 7.139 6.321 1.00 . A A . 43 GLU CG 1 1 18 17138 1 1 43 GLU H H 2.128 3.728 5.730 1.00 . A A . 43 GLU H 1 1 18 17139 1 1 43 GLU HA H 4.002 5.292 4.371 1.00 . A A . 43 GLU HA 1 1 18 17140 1 1 43 GLU HB2 H 2.367 6.013 6.182 1.00 . A A . 43 GLU HB2 1 1 18 17141 1 1 43 GLU HB3 H 3.529 5.392 7.349 1.00 . A A . 43 GLU HB3 1 1 18 17142 1 1 43 GLU HG2 H 4.677 7.219 5.378 1.00 . A A . 43 GLU HG2 1 1 18 17143 1 1 43 GLU HG3 H 3.444 7.944 6.406 1.00 . A A . 43 GLU HG3 1 1 18 17144 1 1 43 GLU N N 2.944 3.719 5.185 1.00 . A A . 43 GLU N 1 1 18 17145 1 1 43 GLU O O 6.292 4.582 5.129 1.00 . A A . 43 GLU O 1 1 18 17146 1 1 43 GLU OE1 O 6.308 6.776 7.276 1.00 . A A . 43 GLU OE1 1 1 18 17147 1 1 43 GLU OE2 O 4.831 7.867 8.485 1.00 . A A . 43 GLU OE2 1 1 18 17148 1 1 44 ILE C C 7.224 1.991 6.277 1.00 . A A . 44 ILE C 1 1 18 17149 1 1 44 ILE CA C 6.523 2.875 7.307 1.00 . A A . 44 ILE CA 1 1 18 17150 1 1 44 ILE CB C 6.255 2.045 8.573 1.00 . A A . 44 ILE CB 1 1 18 17151 1 1 44 ILE CD1 C 3.914 2.503 9.450 1.00 . A A . 44 ILE CD1 1 1 18 17152 1 1 44 ILE CG1 C 5.384 2.839 9.545 1.00 . A A . 44 ILE CG1 1 1 18 17153 1 1 44 ILE CG2 C 7.566 1.639 9.229 1.00 . A A . 44 ILE CG2 1 1 18 17154 1 1 44 ILE H H 4.447 3.244 7.248 1.00 . A A . 44 ILE H 1 1 18 17155 1 1 44 ILE HA H 7.179 3.687 7.577 1.00 . A A . 44 ILE HA 1 1 18 17156 1 1 44 ILE HB H 5.732 1.146 8.283 1.00 . A A . 44 ILE HB 1 1 18 17157 1 1 44 ILE HD11 H 3.627 1.899 10.297 1.00 . A A . 44 ILE HD11 1 1 18 17158 1 1 44 ILE HD12 H 3.732 1.954 8.538 1.00 . A A . 44 ILE HD12 1 1 18 17159 1 1 44 ILE HD13 H 3.337 3.415 9.443 1.00 . A A . 44 ILE HD13 1 1 18 17160 1 1 44 ILE HG12 H 5.702 2.637 10.550 1.00 . A A . 44 ILE HG12 1 1 18 17161 1 1 44 ILE HG13 H 5.497 3.893 9.341 1.00 . A A . 44 ILE HG13 1 1 18 17162 1 1 44 ILE HG21 H 7.363 1.165 10.177 1.00 . A A . 44 ILE HG21 1 1 18 17163 1 1 44 ILE HG22 H 8.175 2.517 9.386 1.00 . A A . 44 ILE HG22 1 1 18 17164 1 1 44 ILE HG23 H 8.089 0.949 8.585 1.00 . A A . 44 ILE HG23 1 1 18 17165 1 1 44 ILE N N 5.288 3.452 6.795 1.00 . A A . 44 ILE N 1 1 18 17166 1 1 44 ILE O O 8.435 2.097 6.083 1.00 . A A . 44 ILE O 1 1 18 17167 1 1 45 VAL C C 7.662 0.962 3.472 1.00 . A A . 45 VAL C 1 1 18 17168 1 1 45 VAL CA C 7.040 0.203 4.636 1.00 . A A . 45 VAL CA 1 1 18 17169 1 1 45 VAL CB C 5.986 -0.772 4.079 1.00 . A A . 45 VAL CB 1 1 18 17170 1 1 45 VAL CG1 C 5.588 -1.791 5.134 1.00 . A A . 45 VAL CG1 1 1 18 17171 1 1 45 VAL CG2 C 4.773 -0.013 3.573 1.00 . A A . 45 VAL CG2 1 1 18 17172 1 1 45 VAL H H 5.507 1.060 5.831 1.00 . A A . 45 VAL H 1 1 18 17173 1 1 45 VAL HA H 7.809 -0.378 5.122 1.00 . A A . 45 VAL HA 1 1 18 17174 1 1 45 VAL HB H 6.424 -1.299 3.245 1.00 . A A . 45 VAL HB 1 1 18 17175 1 1 45 VAL HG11 H 4.670 -2.277 4.838 1.00 . A A . 45 VAL HG11 1 1 18 17176 1 1 45 VAL HG12 H 5.441 -1.292 6.080 1.00 . A A . 45 VAL HG12 1 1 18 17177 1 1 45 VAL HG13 H 6.369 -2.529 5.235 1.00 . A A . 45 VAL HG13 1 1 18 17178 1 1 45 VAL HG21 H 5.070 0.651 2.774 1.00 . A A . 45 VAL HG21 1 1 18 17179 1 1 45 VAL HG22 H 4.347 0.562 4.380 1.00 . A A . 45 VAL HG22 1 1 18 17180 1 1 45 VAL HG23 H 4.038 -0.714 3.204 1.00 . A A . 45 VAL HG23 1 1 18 17181 1 1 45 VAL N N 6.467 1.109 5.630 1.00 . A A . 45 VAL N 1 1 18 17182 1 1 45 VAL O O 8.741 0.612 2.994 1.00 . A A . 45 VAL O 1 1 18 17183 1 1 46 THR C C 8.508 3.816 2.339 1.00 . A A . 46 THR C 1 1 18 17184 1 1 46 THR CA C 7.448 2.803 1.898 1.00 . A A . 46 THR CA 1 1 18 17185 1 1 46 THR CB C 6.272 3.533 1.252 1.00 . A A . 46 THR CB 1 1 18 17186 1 1 46 THR CG2 C 5.350 2.614 0.480 1.00 . A A . 46 THR CG2 1 1 18 17187 1 1 46 THR H H 6.115 2.221 3.428 1.00 . A A . 46 THR H 1 1 18 17188 1 1 46 THR HA H 7.886 2.137 1.172 1.00 . A A . 46 THR HA 1 1 18 17189 1 1 46 THR HB H 6.654 4.270 0.569 1.00 . A A . 46 THR HB 1 1 18 17190 1 1 46 THR HG1 H 4.880 4.796 1.803 1.00 . A A . 46 THR HG1 1 1 18 17191 1 1 46 THR HG21 H 5.581 2.677 -0.573 1.00 . A A . 46 THR HG21 1 1 18 17192 1 1 46 THR HG22 H 4.325 2.913 0.643 1.00 . A A . 46 THR HG22 1 1 18 17193 1 1 46 THR HG23 H 5.487 1.598 0.816 1.00 . A A . 46 THR HG23 1 1 18 17194 1 1 46 THR N N 6.971 1.998 3.013 1.00 . A A . 46 THR N 1 1 18 17195 1 1 46 THR O O 8.936 4.656 1.548 1.00 . A A . 46 THR O 1 1 18 17196 1 1 46 THR OG1 O 5.493 4.197 2.233 1.00 . A A . 46 THR OG1 1 1 18 17197 1 1 47 ALA C C 9.426 6.079 4.153 1.00 . A A . 47 ALA C 1 1 18 17198 1 1 47 ALA CA C 9.942 4.646 4.126 1.00 . A A . 47 ALA CA 1 1 18 17199 1 1 47 ALA CB C 11.218 4.558 3.301 1.00 . A A . 47 ALA CB 1 1 18 17200 1 1 47 ALA H H 8.561 3.049 4.189 1.00 . A A . 47 ALA H 1 1 18 17201 1 1 47 ALA HA H 10.173 4.338 5.135 1.00 . A A . 47 ALA HA 1 1 18 17202 1 1 47 ALA HB1 H 11.545 3.530 3.251 1.00 . A A . 47 ALA HB1 1 1 18 17203 1 1 47 ALA HB2 H 11.987 5.157 3.763 1.00 . A A . 47 ALA HB2 1 1 18 17204 1 1 47 ALA HB3 H 11.028 4.925 2.303 1.00 . A A . 47 ALA HB3 1 1 18 17205 1 1 47 ALA N N 8.933 3.734 3.600 1.00 . A A . 47 ALA N 1 1 18 17206 1 1 47 ALA O O 10.193 7.030 3.994 1.00 . A A . 47 ALA O 1 1 18 17207 1 1 48 GLY C C 7.292 8.138 3.030 1.00 . A A . 48 GLY C 1 1 18 17208 1 1 48 GLY CA C 7.527 7.551 4.409 1.00 . A A . 48 GLY CA 1 1 18 17209 1 1 48 GLY H H 7.560 5.434 4.483 1.00 . A A . 48 GLY H 1 1 18 17210 1 1 48 GLY HA2 H 6.582 7.488 4.927 1.00 . A A . 48 GLY HA2 1 1 18 17211 1 1 48 GLY HA3 H 8.183 8.208 4.961 1.00 . A A . 48 GLY HA3 1 1 18 17212 1 1 48 GLY N N 8.123 6.229 4.360 1.00 . A A . 48 GLY N 1 1 18 17213 1 1 48 GLY O O 7.256 9.358 2.867 1.00 . A A . 48 GLY O 1 1 18 17214 1 1 49 ALA C C 5.503 8.318 0.521 1.00 . A A . 49 ALA C 1 1 18 17215 1 1 49 ALA CA C 6.895 7.716 0.668 1.00 . A A . 49 ALA CA 1 1 18 17216 1 1 49 ALA CB C 7.077 6.560 -0.302 1.00 . A A . 49 ALA CB 1 1 18 17217 1 1 49 ALA H H 7.167 6.310 2.227 1.00 . A A . 49 ALA H 1 1 18 17218 1 1 49 ALA HA H 7.631 8.472 0.433 1.00 . A A . 49 ALA HA 1 1 18 17219 1 1 49 ALA HB1 H 6.169 5.976 -0.342 1.00 . A A . 49 ALA HB1 1 1 18 17220 1 1 49 ALA HB2 H 7.893 5.935 0.030 1.00 . A A . 49 ALA HB2 1 1 18 17221 1 1 49 ALA HB3 H 7.298 6.946 -1.287 1.00 . A A . 49 ALA HB3 1 1 18 17222 1 1 49 ALA N N 7.130 7.272 2.036 1.00 . A A . 49 ALA N 1 1 18 17223 1 1 49 ALA O O 5.291 9.235 -0.273 1.00 . A A . 49 ALA O 1 1 18 17224 1 1 50 LEU C C 2.769 8.849 2.615 1.00 . A A . 50 LEU C 1 1 18 17225 1 1 50 LEU CA C 3.182 8.286 1.258 1.00 . A A . 50 LEU CA 1 1 18 17226 1 1 50 LEU CB C 2.232 7.160 0.848 1.00 . A A . 50 LEU CB 1 1 18 17227 1 1 50 LEU CD1 C 2.289 5.018 -0.458 1.00 . A A . 50 LEU CD1 1 1 18 17228 1 1 50 LEU CD2 C 1.694 7.164 -1.600 1.00 . A A . 50 LEU CD2 1 1 18 17229 1 1 50 LEU CG C 2.535 6.520 -0.509 1.00 . A A . 50 LEU CG 1 1 18 17230 1 1 50 LEU H H 4.788 7.073 1.912 1.00 . A A . 50 LEU H 1 1 18 17231 1 1 50 LEU HA H 3.130 9.077 0.523 1.00 . A A . 50 LEU HA 1 1 18 17232 1 1 50 LEU HB2 H 2.272 6.390 1.606 1.00 . A A . 50 LEU HB2 1 1 18 17233 1 1 50 LEU HB3 H 1.228 7.557 0.817 1.00 . A A . 50 LEU HB3 1 1 18 17234 1 1 50 LEU HD11 H 1.836 4.696 -1.384 1.00 . A A . 50 LEU HD11 1 1 18 17235 1 1 50 LEU HD12 H 1.630 4.788 0.364 1.00 . A A . 50 LEU HD12 1 1 18 17236 1 1 50 LEU HD13 H 3.230 4.504 -0.320 1.00 . A A . 50 LEU HD13 1 1 18 17237 1 1 50 LEU HD21 H 0.649 6.965 -1.414 1.00 . A A . 50 LEU HD21 1 1 18 17238 1 1 50 LEU HD22 H 1.973 6.753 -2.559 1.00 . A A . 50 LEU HD22 1 1 18 17239 1 1 50 LEU HD23 H 1.863 8.231 -1.603 1.00 . A A . 50 LEU HD23 1 1 18 17240 1 1 50 LEU HG H 3.576 6.678 -0.750 1.00 . A A . 50 LEU HG 1 1 18 17241 1 1 50 LEU N N 4.556 7.801 1.297 1.00 . A A . 50 LEU N 1 1 18 17242 1 1 50 LEU O O 2.742 8.130 3.614 1.00 . A A . 50 LEU O 1 1 18 17243 1 1 51 LYS C C 0.579 10.509 4.197 1.00 . A A . 51 LYS C 1 1 18 17244 1 1 51 LYS CA C 2.042 10.798 3.881 1.00 . A A . 51 LYS CA 1 1 18 17245 1 1 51 LYS CB C 2.264 12.307 3.775 1.00 . A A . 51 LYS CB 1 1 18 17246 1 1 51 LYS CD C 2.325 14.479 5.038 1.00 . A A . 51 LYS CD 1 1 18 17247 1 1 51 LYS CE C 0.853 14.840 5.158 1.00 . A A . 51 LYS CE 1 1 18 17248 1 1 51 LYS CG C 2.538 12.976 5.111 1.00 . A A . 51 LYS CG 1 1 18 17249 1 1 51 LYS H H 2.495 10.661 1.816 1.00 . A A . 51 LYS H 1 1 18 17250 1 1 51 LYS HA H 2.655 10.408 4.680 1.00 . A A . 51 LYS HA 1 1 18 17251 1 1 51 LYS HB2 H 3.108 12.492 3.125 1.00 . A A . 51 LYS HB2 1 1 18 17252 1 1 51 LYS HB3 H 1.384 12.761 3.344 1.00 . A A . 51 LYS HB3 1 1 18 17253 1 1 51 LYS HD2 H 2.868 14.950 5.845 1.00 . A A . 51 LYS HD2 1 1 18 17254 1 1 51 LYS HD3 H 2.700 14.839 4.091 1.00 . A A . 51 LYS HD3 1 1 18 17255 1 1 51 LYS HE2 H 0.696 15.810 4.707 1.00 . A A . 51 LYS HE2 1 1 18 17256 1 1 51 LYS HE3 H 0.270 14.100 4.628 1.00 . A A . 51 LYS HE3 1 1 18 17257 1 1 51 LYS HG2 H 1.868 12.564 5.852 1.00 . A A . 51 LYS HG2 1 1 18 17258 1 1 51 LYS HG3 H 3.560 12.779 5.399 1.00 . A A . 51 LYS HG3 1 1 18 17259 1 1 51 LYS HZ1 H -0.583 15.205 6.630 1.00 . A A . 51 LYS HZ1 1 1 18 17260 1 1 51 LYS HZ2 H 1.000 15.546 7.119 1.00 . A A . 51 LYS HZ2 1 1 18 17261 1 1 51 LYS HZ3 H 0.479 13.941 7.006 1.00 . A A . 51 LYS HZ3 1 1 18 17262 1 1 51 LYS N N 2.452 10.139 2.645 1.00 . A A . 51 LYS N 1 1 18 17263 1 1 51 LYS NZ N 0.406 14.886 6.578 1.00 . A A . 51 LYS NZ 1 1 18 17264 1 1 51 LYS O O -0.314 10.843 3.418 1.00 . A A . 51 LYS O 1 1 18 17265 1 1 52 TYR C C -1.858 10.807 5.947 1.00 . A A . 52 TYR C 1 1 18 17266 1 1 52 TYR CA C -1.013 9.550 5.771 1.00 . A A . 52 TYR CA 1 1 18 17267 1 1 52 TYR CB C -0.975 8.762 7.081 1.00 . A A . 52 TYR CB 1 1 18 17268 1 1 52 TYR CD1 C -3.385 8.683 7.838 1.00 . A A . 52 TYR CD1 1 1 18 17269 1 1 52 TYR CD2 C -2.333 6.638 7.210 1.00 . A A . 52 TYR CD2 1 1 18 17270 1 1 52 TYR CE1 C -4.554 8.001 8.116 1.00 . A A . 52 TYR CE1 1 1 18 17271 1 1 52 TYR CE2 C -3.499 5.949 7.485 1.00 . A A . 52 TYR CE2 1 1 18 17272 1 1 52 TYR CG C -2.256 8.014 7.381 1.00 . A A . 52 TYR CG 1 1 18 17273 1 1 52 TYR CZ C -4.606 6.636 7.938 1.00 . A A . 52 TYR CZ 1 1 18 17274 1 1 52 TYR H H 1.096 9.645 5.925 1.00 . A A . 52 TYR H 1 1 18 17275 1 1 52 TYR HA H -1.459 8.935 5.004 1.00 . A A . 52 TYR HA 1 1 18 17276 1 1 52 TYR HB2 H -0.174 8.039 7.035 1.00 . A A . 52 TYR HB2 1 1 18 17277 1 1 52 TYR HB3 H -0.791 9.444 7.898 1.00 . A A . 52 TYR HB3 1 1 18 17278 1 1 52 TYR HD1 H -3.345 9.753 7.975 1.00 . A A . 52 TYR HD1 1 1 18 17279 1 1 52 TYR HD2 H -1.465 6.104 6.854 1.00 . A A . 52 TYR HD2 1 1 18 17280 1 1 52 TYR HE1 H -5.420 8.539 8.471 1.00 . A A . 52 TYR HE1 1 1 18 17281 1 1 52 TYR HE2 H -3.540 4.880 7.344 1.00 . A A . 52 TYR HE2 1 1 18 17282 1 1 52 TYR HH H -6.088 6.205 9.083 1.00 . A A . 52 TYR HH 1 1 18 17283 1 1 52 TYR N N 0.341 9.885 5.347 1.00 . A A . 52 TYR N 1 1 18 17284 1 1 52 TYR O O -1.382 11.820 6.463 1.00 . A A . 52 TYR O 1 1 18 17285 1 1 52 TYR OH O -5.767 5.953 8.213 1.00 . A A . 52 TYR OH 1 1 18 17286 1 1 53 GLN C C -5.378 11.406 6.179 1.00 . A A . 53 GLN C 1 1 18 17287 1 1 53 GLN CA C -4.030 11.861 5.634 1.00 . A A . 53 GLN CA 1 1 18 17288 1 1 53 GLN CB C -4.217 12.534 4.273 1.00 . A A . 53 GLN CB 1 1 18 17289 1 1 53 GLN CD C -3.359 14.805 4.970 1.00 . A A . 53 GLN CD 1 1 18 17290 1 1 53 GLN CG C -3.219 13.647 4.001 1.00 . A A . 53 GLN CG 1 1 18 17291 1 1 53 GLN H H -3.434 9.896 5.122 1.00 . A A . 53 GLN H 1 1 18 17292 1 1 53 GLN HA H -3.597 12.573 6.321 1.00 . A A . 53 GLN HA 1 1 18 17293 1 1 53 GLN HB2 H -4.113 11.789 3.498 1.00 . A A . 53 GLN HB2 1 1 18 17294 1 1 53 GLN HB3 H -5.212 12.953 4.225 1.00 . A A . 53 GLN HB3 1 1 18 17295 1 1 53 GLN HE21 H -1.656 15.593 4.313 1.00 . A A . 53 GLN HE21 1 1 18 17296 1 1 53 GLN HE22 H -2.459 16.476 5.561 1.00 . A A . 53 GLN HE22 1 1 18 17297 1 1 53 GLN HG2 H -2.220 13.246 4.086 1.00 . A A . 53 GLN HG2 1 1 18 17298 1 1 53 GLN HG3 H -3.373 14.016 2.997 1.00 . A A . 53 GLN HG3 1 1 18 17299 1 1 53 GLN N N -3.113 10.733 5.520 1.00 . A A . 53 GLN N 1 1 18 17300 1 1 53 GLN NE2 N -2.393 15.716 4.945 1.00 . A A . 53 GLN NE2 1 1 18 17301 1 1 53 GLN O O -5.996 10.488 5.643 1.00 . A A . 53 GLN O 1 1 18 17302 1 1 53 GLN OE1 O -4.323 14.879 5.731 1.00 . A A . 53 GLN OE1 1 1 18 17303 1 1 54 GLU C C -8.252 12.496 7.247 1.00 . A A . 54 GLU C 1 1 18 17304 1 1 54 GLU CA C -7.104 11.706 7.870 1.00 . A A . 54 GLU CA 1 1 18 17305 1 1 54 GLU CB C -7.047 11.965 9.377 1.00 . A A . 54 GLU CB 1 1 18 17306 1 1 54 GLU CD C -6.727 13.649 11.232 1.00 . A A . 54 GLU CD 1 1 18 17307 1 1 54 GLU CG C -6.808 13.423 9.735 1.00 . A A . 54 GLU CG 1 1 18 17308 1 1 54 GLU H H -5.291 12.774 7.636 1.00 . A A . 54 GLU H 1 1 18 17309 1 1 54 GLU HA H -7.277 10.653 7.703 1.00 . A A . 54 GLU HA 1 1 18 17310 1 1 54 GLU HB2 H -7.983 11.657 9.819 1.00 . A A . 54 GLU HB2 1 1 18 17311 1 1 54 GLU HB3 H -6.247 11.377 9.802 1.00 . A A . 54 GLU HB3 1 1 18 17312 1 1 54 GLU HG2 H -5.880 13.744 9.287 1.00 . A A . 54 GLU HG2 1 1 18 17313 1 1 54 GLU HG3 H -7.620 14.016 9.340 1.00 . A A . 54 GLU HG3 1 1 18 17314 1 1 54 GLU N N -5.829 12.052 7.251 1.00 . A A . 54 GLU N 1 1 18 17315 1 1 54 GLU O O -9.100 13.040 7.955 1.00 . A A . 54 GLU O 1 1 18 17316 1 1 54 GLU OE1 O -6.071 12.839 11.920 1.00 . A A . 54 GLU OE1 1 1 18 17317 1 1 54 GLU OE2 O -7.316 14.638 11.717 1.00 . A A . 54 GLU OE2 1 1 18 17318 1 1 55 ASN C C -10.500 12.347 4.907 1.00 . A A . 55 ASN C 1 1 18 17319 1 1 55 ASN CA C -9.328 13.269 5.206 1.00 . A A . 55 ASN CA 1 1 18 17320 1 1 55 ASN CB C -8.780 13.858 3.904 1.00 . A A . 55 ASN CB 1 1 18 17321 1 1 55 ASN CG C -7.654 14.844 4.144 1.00 . A A . 55 ASN CG 1 1 18 17322 1 1 55 ASN H H -7.580 12.095 5.407 1.00 . A A . 55 ASN H 1 1 18 17323 1 1 55 ASN HA H -9.668 14.073 5.841 1.00 . A A . 55 ASN HA 1 1 18 17324 1 1 55 ASN HB2 H -8.406 13.058 3.284 1.00 . A A . 55 ASN HB2 1 1 18 17325 1 1 55 ASN HB3 H -9.577 14.369 3.384 1.00 . A A . 55 ASN HB3 1 1 18 17326 1 1 55 ASN HD21 H -8.775 15.845 5.446 1.00 . A A . 55 ASN HD21 1 1 18 17327 1 1 55 ASN HD22 H -7.186 16.471 5.188 1.00 . A A . 55 ASN HD22 1 1 18 17328 1 1 55 ASN N N -8.278 12.551 5.918 1.00 . A A . 55 ASN N 1 1 18 17329 1 1 55 ASN ND2 N -7.896 15.818 5.013 1.00 . A A . 55 ASN ND2 1 1 18 17330 1 1 55 ASN O O -11.640 12.639 5.263 1.00 . A A . 55 ASN O 1 1 18 17331 1 1 55 ASN OD1 O -6.579 14.733 3.554 1.00 . A A . 55 ASN OD1 1 1 18 17332 1 1 56 ALA C C -11.440 9.236 5.023 1.00 . A A . 56 ALA C 1 1 18 17333 1 1 56 ALA CA C -11.240 10.255 3.902 1.00 . A A . 56 ALA CA 1 1 18 17334 1 1 56 ALA CB C -10.880 9.550 2.603 1.00 . A A . 56 ALA CB 1 1 18 17335 1 1 56 ALA H H -9.285 11.050 3.995 1.00 . A A . 56 ALA H 1 1 18 17336 1 1 56 ALA HA H -12.170 10.791 3.749 1.00 . A A . 56 ALA HA 1 1 18 17337 1 1 56 ALA HB1 H -10.130 8.794 2.799 1.00 . A A . 56 ALA HB1 1 1 18 17338 1 1 56 ALA HB2 H -10.490 10.271 1.901 1.00 . A A . 56 ALA HB2 1 1 18 17339 1 1 56 ALA HB3 H -11.760 9.086 2.189 1.00 . A A . 56 ALA HB3 1 1 18 17340 1 1 56 ALA N N -10.210 11.228 4.251 1.00 . A A . 56 ALA N 1 1 18 17341 1 1 56 ALA O O -12.460 8.560 5.083 1.00 . A A . 56 ALA O 1 1 18 17342 1 1 57 TYR C C -11.380 8.764 8.159 1.00 . A A . 57 TYR C 1 1 18 17343 1 1 57 TYR CA C -10.520 8.201 7.028 1.00 . A A . 57 TYR CA 1 1 18 17344 1 1 57 TYR CB C -9.117 7.894 7.547 1.00 . A A . 57 TYR CB 1 1 18 17345 1 1 57 TYR CD1 C -8.524 6.367 5.626 1.00 . A A . 57 TYR CD1 1 1 18 17346 1 1 57 TYR CD2 C -6.921 7.996 6.304 1.00 . A A . 57 TYR CD2 1 1 18 17347 1 1 57 TYR CE1 C -7.662 5.922 4.643 1.00 . A A . 57 TYR CE1 1 1 18 17348 1 1 57 TYR CE2 C -6.052 7.557 5.322 1.00 . A A . 57 TYR CE2 1 1 18 17349 1 1 57 TYR CG C -8.170 7.410 6.472 1.00 . A A . 57 TYR CG 1 1 18 17350 1 1 57 TYR CZ C -6.426 6.520 4.494 1.00 . A A . 57 TYR CZ 1 1 18 17351 1 1 57 TYR H H -9.661 9.701 5.812 1.00 . A A . 57 TYR H 1 1 18 17352 1 1 57 TYR HA H -10.970 7.287 6.670 1.00 . A A . 57 TYR HA 1 1 18 17353 1 1 57 TYR HB2 H -8.697 8.788 7.981 1.00 . A A . 57 TYR HB2 1 1 18 17354 1 1 57 TYR HB3 H -9.180 7.126 8.305 1.00 . A A . 57 TYR HB3 1 1 18 17355 1 1 57 TYR HD1 H -9.490 5.902 5.743 1.00 . A A . 57 TYR HD1 1 1 18 17356 1 1 57 TYR HD2 H -6.628 8.808 6.954 1.00 . A A . 57 TYR HD2 1 1 18 17357 1 1 57 TYR HE1 H -7.956 5.110 3.995 1.00 . A A . 57 TYR HE1 1 1 18 17358 1 1 57 TYR HE2 H -5.086 8.025 5.209 1.00 . A A . 57 TYR HE2 1 1 18 17359 1 1 57 TYR HH H -6.010 5.448 2.949 1.00 . A A . 57 TYR HH 1 1 18 17360 1 1 57 TYR N N -10.450 9.135 5.911 1.00 . A A . 57 TYR N 1 1 18 17361 1 1 57 TYR O O -11.920 8.013 8.970 1.00 . A A . 57 TYR O 1 1 18 17362 1 1 57 TYR OH O -5.562 6.080 3.517 1.00 . A A . 57 TYR OH 1 1 18 17363 1 1 58 ARG C C -13.770 10.697 8.892 1.00 . A A . 58 ARG C 1 1 18 17364 1 1 58 ARG CA C -12.290 10.748 9.235 1.00 . A A . 58 ARG CA 1 1 18 17365 1 1 58 ARG CB C -11.840 12.201 9.398 1.00 . A A . 58 ARG CB 1 1 18 17366 1 1 58 ARG CD C -12.070 12.671 11.854 1.00 . A A . 58 ARG CD 1 1 18 17367 1 1 58 ARG CG C -12.610 12.964 10.463 1.00 . A A . 58 ARG CG 1 1 18 17368 1 1 58 ARG CZ C -11.890 10.719 13.345 1.00 . A A . 58 ARG CZ 1 1 18 17369 1 1 58 ARG H H -11.040 10.634 7.530 1.00 . A A . 58 ARG H 1 1 18 17370 1 1 58 ARG HA H -12.130 10.223 10.165 1.00 . A A . 58 ARG HA 1 1 18 17371 1 1 58 ARG HB2 H -10.790 12.216 9.664 1.00 . A A . 58 ARG HB2 1 1 18 17372 1 1 58 ARG HB3 H -11.970 12.714 8.456 1.00 . A A . 58 ARG HB3 1 1 18 17373 1 1 58 ARG HD2 H -11.000 12.730 11.831 1.00 . A A . 58 ARG HD2 1 1 18 17374 1 1 58 ARG HD3 H -12.460 13.414 12.538 1.00 . A A . 58 ARG HD3 1 1 18 17375 1 1 58 ARG HE H -13.200 10.896 11.856 1.00 . A A . 58 ARG HE 1 1 18 17376 1 1 58 ARG HG2 H -12.520 14.022 10.270 1.00 . A A . 58 ARG HG2 1 1 18 17377 1 1 58 ARG HG3 H -13.650 12.673 10.417 1.00 . A A . 58 ARG HG3 1 1 18 17378 1 1 58 ARG HH11 H -10.560 12.201 13.734 1.00 . A A . 58 ARG HH11 1 1 18 17379 1 1 58 ARG HH12 H -10.450 10.818 14.769 1.00 . A A . 58 ARG HH12 1 1 18 17380 1 1 58 ARG HH21 H -13.060 9.076 13.215 1.00 . A A . 58 ARG HH21 1 1 18 17381 1 1 58 ARG HH22 H -11.870 9.042 14.474 1.00 . A A . 58 ARG HH22 1 1 18 17382 1 1 58 ARG N N -11.500 10.088 8.205 1.00 . A A . 58 ARG N 1 1 18 17383 1 1 58 ARG NE N -12.470 11.346 12.325 1.00 . A A . 58 ARG NE 1 1 18 17384 1 1 58 ARG NH1 N -10.890 11.293 14.002 1.00 . A A . 58 ARG NH1 1 1 18 17385 1 1 58 ARG NH2 N -12.300 9.513 13.708 1.00 . A A . 58 ARG NH2 1 1 18 17386 1 1 58 ARG O O -14.560 10.042 9.579 1.00 . A A . 58 ARG O 1 1 18 17387 1 1 59 GLN C C -15.670 10.956 5.944 1.00 . A A . 59 GLN C 1 1 18 17388 1 1 59 GLN CA C -15.540 11.427 7.390 1.00 . A A . 59 GLN CA 1 1 18 17389 1 1 59 GLN CB C -16.110 12.842 7.528 1.00 . A A . 59 GLN CB 1 1 18 17390 1 1 59 GLN CD C -18.310 12.993 8.760 1.00 . A A . 59 GLN CD 1 1 18 17391 1 1 59 GLN CG C -17.620 12.908 7.411 1.00 . A A . 59 GLN CG 1 1 18 17392 1 1 59 GLN H H -13.480 11.896 7.319 1.00 . A A . 59 GLN H 1 1 18 17393 1 1 59 GLN HA H -16.110 10.760 8.025 1.00 . A A . 59 GLN HA 1 1 18 17394 1 1 59 GLN HB2 H -15.830 13.236 8.495 1.00 . A A . 59 GLN HB2 1 1 18 17395 1 1 59 GLN HB3 H -15.680 13.465 6.757 1.00 . A A . 59 GLN HB3 1 1 18 17396 1 1 59 GLN HE21 H -17.900 11.082 9.117 1.00 . A A . 59 GLN HE21 1 1 18 17397 1 1 59 GLN HE22 H -18.760 11.909 10.363 1.00 . A A . 59 GLN HE22 1 1 18 17398 1 1 59 GLN HG2 H -17.890 13.782 6.834 1.00 . A A . 59 GLN HG2 1 1 18 17399 1 1 59 GLN HG3 H -17.970 12.022 6.901 1.00 . A A . 59 GLN HG3 1 1 18 17400 1 1 59 GLN N N -14.150 11.393 7.826 1.00 . A A . 59 GLN N 1 1 18 17401 1 1 59 GLN NE2 N -18.330 11.882 9.486 1.00 . A A . 59 GLN NE2 1 1 18 17402 1 1 59 GLN O O -15.390 11.707 5.009 1.00 . A A . 59 GLN O 1 1 18 17403 1 1 59 GLN OE1 O -18.820 14.045 9.144 1.00 . A A . 59 GLN OE1 1 1 18 17404 1 1 60 ALA C C -16.990 7.799 4.504 1.00 . A A . 60 ALA C 1 1 18 17405 1 1 60 ALA CA C -16.260 9.135 4.440 1.00 . A A . 60 ALA CA 1 1 18 17406 1 1 60 ALA CB C -14.900 8.966 3.768 1.00 . A A . 60 ALA CB 1 1 18 17407 1 1 60 ALA H H -16.300 9.159 6.554 1.00 . A A . 60 ALA H 1 1 18 17408 1 1 60 ALA HA H -16.840 9.827 3.849 1.00 . A A . 60 ALA HA 1 1 18 17409 1 1 60 ALA HB1 H -15.010 9.086 2.700 1.00 . A A . 60 ALA HB1 1 1 18 17410 1 1 60 ALA HB2 H -14.510 7.981 3.982 1.00 . A A . 60 ALA HB2 1 1 18 17411 1 1 60 ALA HB3 H -14.220 9.712 4.146 1.00 . A A . 60 ALA HB3 1 1 18 17412 1 1 60 ALA N N -16.090 9.707 5.770 1.00 . A A . 60 ALA N 1 1 18 17413 1 1 60 ALA O O -16.520 6.852 5.132 1.00 . A A . 60 ALA O 1 1 18 17414 1 1 61 ALA C C -19.050 5.946 2.421 1.00 . A A . 61 ALA C 1 1 18 17415 1 1 61 ALA CA C -18.940 6.511 3.834 1.00 . A A . 61 ALA CA 1 1 18 17416 1 1 61 ALA CB C -20.330 6.777 4.405 1.00 . A A . 61 ALA CB 1 1 18 17417 1 1 61 ALA H H -18.470 8.521 3.368 1.00 . A A . 61 ALA H 1 1 18 17418 1 1 61 ALA HA H -18.450 5.784 4.464 1.00 . A A . 61 ALA HA 1 1 18 17419 1 1 61 ALA HB1 H -20.910 7.324 3.683 1.00 . A A . 61 ALA HB1 1 1 18 17420 1 1 61 ALA HB2 H -20.230 7.359 5.309 1.00 . A A . 61 ALA HB2 1 1 18 17421 1 1 61 ALA HB3 H -20.810 5.838 4.627 1.00 . A A . 61 ALA HB3 1 1 18 17422 1 1 61 ALA N N -18.140 7.731 3.851 1.00 . A A . 61 ALA N 1 1 18 17423 1 1 61 ALA O O -18.660 4.777 2.221 1.00 . A A . 61 ALA O 1 1 18 17424 1 1 61 ALA OXT O -19.530 6.677 1.527 1.00 . A A . 61 ALA OXT 1 1 19 17425 1 1 1 MET C C -5.251 6.600 -1.390 1.00 . A A . 1 MET C 1 1 19 17426 1 1 1 MET CA C -4.499 7.632 -0.555 1.00 . A A . 1 MET CA 1 1 19 17427 1 1 1 MET CB C -3.792 6.952 0.618 1.00 . A A . 1 MET CB 1 1 19 17428 1 1 1 MET CE C -0.726 6.937 2.792 1.00 . A A . 1 MET CE 1 1 19 17429 1 1 1 MET CG C -2.277 6.948 0.496 1.00 . A A . 1 MET CG 1 1 19 17430 1 1 1 MET H1 H -4.851 9.462 0.320 1.00 . A A . 1 MET H1 1 1 19 17431 1 1 1 MET H2 H -5.962 8.229 0.764 1.00 . A A . 1 MET H2 1 1 19 17432 1 1 1 MET H3 H -6.058 8.956 -0.788 1.00 . A A . 1 MET H3 1 1 19 17433 1 1 1 MET HA H -3.766 8.122 -1.178 1.00 . A A . 1 MET HA 1 1 19 17434 1 1 1 MET HB2 H -4.057 7.466 1.529 1.00 . A A . 1 MET HB2 1 1 19 17435 1 1 1 MET HB3 H -4.128 5.929 0.684 1.00 . A A . 1 MET HB3 1 1 19 17436 1 1 1 MET HE1 H -0.199 6.173 2.241 1.00 . A A . 1 MET HE1 1 1 19 17437 1 1 1 MET HE2 H -1.494 6.480 3.399 1.00 . A A . 1 MET HE2 1 1 19 17438 1 1 1 MET HE3 H -0.032 7.467 3.428 1.00 . A A . 1 MET HE3 1 1 19 17439 1 1 1 MET HG2 H -1.915 5.950 0.694 1.00 . A A . 1 MET HG2 1 1 19 17440 1 1 1 MET HG3 H -2.010 7.231 -0.513 1.00 . A A . 1 MET HG3 1 1 19 17441 1 1 1 MET N N -5.425 8.662 -0.016 1.00 . A A . 1 MET N 1 1 19 17442 1 1 1 MET O O -5.959 5.748 -0.853 1.00 . A A . 1 MET O 1 1 19 17443 1 1 1 MET SD S -1.480 8.087 1.644 1.00 . A A . 1 MET SD 1 1 19 17444 1 1 2 TYR C C -4.895 4.519 -3.857 1.00 . A A . 2 TYR C 1 1 19 17445 1 1 2 TYR CA C -5.755 5.756 -3.615 1.00 . A A . 2 TYR CA 1 1 19 17446 1 1 2 TYR CB C -6.060 6.448 -4.946 1.00 . A A . 2 TYR CB 1 1 19 17447 1 1 2 TYR CD1 C -7.680 8.039 -3.843 1.00 . A A . 2 TYR CD1 1 1 19 17448 1 1 2 TYR CD2 C -8.221 7.206 -6.010 1.00 . A A . 2 TYR CD2 1 1 19 17449 1 1 2 TYR CE1 C -8.853 8.770 -3.827 1.00 . A A . 2 TYR CE1 1 1 19 17450 1 1 2 TYR CE2 C -9.395 7.934 -6.001 1.00 . A A . 2 TYR CE2 1 1 19 17451 1 1 2 TYR CG C -7.345 7.246 -4.933 1.00 . A A . 2 TYR CG 1 1 19 17452 1 1 2 TYR CZ C -9.706 8.714 -4.909 1.00 . A A . 2 TYR CZ 1 1 19 17453 1 1 2 TYR H H -4.516 7.384 -3.075 1.00 . A A . 2 TYR H 1 1 19 17454 1 1 2 TYR HA H -6.684 5.451 -3.158 1.00 . A A . 2 TYR HA 1 1 19 17455 1 1 2 TYR HB2 H -5.254 7.123 -5.187 1.00 . A A . 2 TYR HB2 1 1 19 17456 1 1 2 TYR HB3 H -6.141 5.700 -5.723 1.00 . A A . 2 TYR HB3 1 1 19 17457 1 1 2 TYR HD1 H -7.009 8.082 -2.998 1.00 . A A . 2 TYR HD1 1 1 19 17458 1 1 2 TYR HD2 H -7.975 6.593 -6.865 1.00 . A A . 2 TYR HD2 1 1 19 17459 1 1 2 TYR HE1 H -9.096 9.382 -2.971 1.00 . A A . 2 TYR HE1 1 1 19 17460 1 1 2 TYR HE2 H -10.060 7.889 -6.848 1.00 . A A . 2 TYR HE2 1 1 19 17461 1 1 2 TYR HH H -10.680 10.352 -4.667 1.00 . A A . 2 TYR HH 1 1 19 17462 1 1 2 TYR N N -5.091 6.682 -2.707 1.00 . A A . 2 TYR N 1 1 19 17463 1 1 2 TYR O O -3.668 4.595 -3.862 1.00 . A A . 2 TYR O 1 1 19 17464 1 1 2 TYR OH O -10.870 9.441 -4.896 1.00 . A A . 2 TYR OH 1 1 19 17465 1 1 3 LYS C C -3.927 2.237 -5.511 1.00 . A A . 3 LYS C 1 1 19 17466 1 1 3 LYS CA C -4.851 2.124 -4.301 1.00 . A A . 3 LYS CA 1 1 19 17467 1 1 3 LYS CB C -5.857 0.991 -4.517 1.00 . A A . 3 LYS CB 1 1 19 17468 1 1 3 LYS CD C -5.879 -1.507 -4.800 1.00 . A A . 3 LYS CD 1 1 19 17469 1 1 3 LYS CE C -4.986 -2.724 -4.628 1.00 . A A . 3 LYS CE 1 1 19 17470 1 1 3 LYS CG C -5.405 -0.343 -3.945 1.00 . A A . 3 LYS CG 1 1 19 17471 1 1 3 LYS H H -6.532 3.385 -4.042 1.00 . A A . 3 LYS H 1 1 19 17472 1 1 3 LYS HA H -4.256 1.903 -3.428 1.00 . A A . 3 LYS HA 1 1 19 17473 1 1 3 LYS HB2 H -6.791 1.260 -4.049 1.00 . A A . 3 LYS HB2 1 1 19 17474 1 1 3 LYS HB3 H -6.018 0.867 -5.579 1.00 . A A . 3 LYS HB3 1 1 19 17475 1 1 3 LYS HD2 H -6.886 -1.767 -4.509 1.00 . A A . 3 LYS HD2 1 1 19 17476 1 1 3 LYS HD3 H -5.869 -1.206 -5.837 1.00 . A A . 3 LYS HD3 1 1 19 17477 1 1 3 LYS HE2 H -3.990 -2.476 -4.960 1.00 . A A . 3 LYS HE2 1 1 19 17478 1 1 3 LYS HE3 H -4.959 -2.992 -3.582 1.00 . A A . 3 LYS HE3 1 1 19 17479 1 1 3 LYS HG2 H -4.325 -0.358 -3.901 1.00 . A A . 3 LYS HG2 1 1 19 17480 1 1 3 LYS HG3 H -5.807 -0.450 -2.949 1.00 . A A . 3 LYS HG3 1 1 19 17481 1 1 3 LYS HZ1 H -6.489 -4.053 -5.215 1.00 . A A . 3 LYS HZ1 1 1 19 17482 1 1 3 LYS HZ2 H -4.946 -4.746 -5.158 1.00 . A A . 3 LYS HZ2 1 1 19 17483 1 1 3 LYS HZ3 H -5.361 -3.712 -6.430 1.00 . A A . 3 LYS HZ3 1 1 19 17484 1 1 3 LYS N N -5.552 3.379 -4.058 1.00 . A A . 3 LYS N 1 1 19 17485 1 1 3 LYS NZ N -5.481 -3.891 -5.413 1.00 . A A . 3 LYS NZ 1 1 19 17486 1 1 3 LYS O O -2.922 1.533 -5.604 1.00 . A A . 3 LYS O 1 1 19 17487 1 1 4 LYS C C -2.044 3.717 -7.287 1.00 . A A . 4 LYS C 1 1 19 17488 1 1 4 LYS CA C -3.476 3.330 -7.640 1.00 . A A . 4 LYS CA 1 1 19 17489 1 1 4 LYS CB C -4.106 4.413 -8.518 1.00 . A A . 4 LYS CB 1 1 19 17490 1 1 4 LYS CD C -4.394 3.817 -10.943 1.00 . A A . 4 LYS CD 1 1 19 17491 1 1 4 LYS CE C -5.337 4.810 -11.603 1.00 . A A . 4 LYS CE 1 1 19 17492 1 1 4 LYS CG C -3.504 4.493 -9.912 1.00 . A A . 4 LYS CG 1 1 19 17493 1 1 4 LYS H H -5.087 3.658 -6.308 1.00 . A A . 4 LYS H 1 1 19 17494 1 1 4 LYS HA H -3.460 2.400 -8.188 1.00 . A A . 4 LYS HA 1 1 19 17495 1 1 4 LYS HB2 H -5.163 4.212 -8.614 1.00 . A A . 4 LYS HB2 1 1 19 17496 1 1 4 LYS HB3 H -3.975 5.371 -8.037 1.00 . A A . 4 LYS HB3 1 1 19 17497 1 1 4 LYS HD2 H -3.772 3.369 -11.703 1.00 . A A . 4 LYS HD2 1 1 19 17498 1 1 4 LYS HD3 H -4.976 3.050 -10.453 1.00 . A A . 4 LYS HD3 1 1 19 17499 1 1 4 LYS HE2 H -5.428 5.677 -10.967 1.00 . A A . 4 LYS HE2 1 1 19 17500 1 1 4 LYS HE3 H -4.921 5.105 -12.554 1.00 . A A . 4 LYS HE3 1 1 19 17501 1 1 4 LYS HG2 H -3.383 5.532 -10.181 1.00 . A A . 4 LYS HG2 1 1 19 17502 1 1 4 LYS HG3 H -2.541 4.007 -9.905 1.00 . A A . 4 LYS HG3 1 1 19 17503 1 1 4 LYS HZ1 H -7.337 4.530 -11.066 1.00 . A A . 4 LYS HZ1 1 1 19 17504 1 1 4 LYS HZ2 H -6.638 3.190 -11.827 1.00 . A A . 4 LYS HZ2 1 1 19 17505 1 1 4 LYS HZ3 H -7.072 4.548 -12.738 1.00 . A A . 4 LYS HZ3 1 1 19 17506 1 1 4 LYS N N -4.275 3.126 -6.436 1.00 . A A . 4 LYS N 1 1 19 17507 1 1 4 LYS NZ N -6.691 4.228 -11.824 1.00 . A A . 4 LYS NZ 1 1 19 17508 1 1 4 LYS O O -1.089 3.151 -7.817 1.00 . A A . 4 LYS O 1 1 19 17509 1 1 5 ASP C C 0.208 4.016 -5.317 1.00 . A A . 5 ASP C 1 1 19 17510 1 1 5 ASP CA C -0.585 5.148 -5.964 1.00 . A A . 5 ASP CA 1 1 19 17511 1 1 5 ASP CB C -0.720 6.317 -4.987 1.00 . A A . 5 ASP CB 1 1 19 17512 1 1 5 ASP CG C -1.218 7.580 -5.662 1.00 . A A . 5 ASP CG 1 1 19 17513 1 1 5 ASP H H -2.701 5.098 -6.000 1.00 . A A . 5 ASP H 1 1 19 17514 1 1 5 ASP HA H -0.055 5.484 -6.843 1.00 . A A . 5 ASP HA 1 1 19 17515 1 1 5 ASP HB2 H -1.419 6.048 -4.209 1.00 . A A . 5 ASP HB2 1 1 19 17516 1 1 5 ASP HB3 H 0.244 6.522 -4.544 1.00 . A A . 5 ASP HB3 1 1 19 17517 1 1 5 ASP N N -1.902 4.686 -6.388 1.00 . A A . 5 ASP N 1 1 19 17518 1 1 5 ASP O O 1.348 3.751 -5.694 1.00 . A A . 5 ASP O 1 1 19 17519 1 1 5 ASP OD1 O -2.074 7.473 -6.566 1.00 . A A . 5 ASP OD1 1 1 19 17520 1 1 5 ASP OD2 O -0.753 8.676 -5.287 1.00 . A A . 5 ASP OD2 1 1 19 17521 1 1 6 VAL C C 0.718 1.190 -4.618 1.00 . A A . 6 VAL C 1 1 19 17522 1 1 6 VAL CA C 0.232 2.255 -3.642 1.00 . A A . 6 VAL CA 1 1 19 17523 1 1 6 VAL CB C -0.734 1.607 -2.633 1.00 . A A . 6 VAL CB 1 1 19 17524 1 1 6 VAL CG1 C 0.041 0.793 -1.625 1.00 . A A . 6 VAL CG1 1 1 19 17525 1 1 6 VAL CG2 C -1.580 2.659 -1.929 1.00 . A A . 6 VAL CG2 1 1 19 17526 1 1 6 VAL H H -1.312 3.607 -4.083 1.00 . A A . 6 VAL H 1 1 19 17527 1 1 6 VAL HA H 1.078 2.648 -3.098 1.00 . A A . 6 VAL HA 1 1 19 17528 1 1 6 VAL HB H -1.394 0.943 -3.171 1.00 . A A . 6 VAL HB 1 1 19 17529 1 1 6 VAL HG11 H -0.566 0.640 -0.747 1.00 . A A . 6 VAL HG11 1 1 19 17530 1 1 6 VAL HG12 H 0.939 1.326 -1.356 1.00 . A A . 6 VAL HG12 1 1 19 17531 1 1 6 VAL HG13 H 0.301 -0.160 -2.057 1.00 . A A . 6 VAL HG13 1 1 19 17532 1 1 6 VAL HG21 H -2.418 2.927 -2.556 1.00 . A A . 6 VAL HG21 1 1 19 17533 1 1 6 VAL HG22 H -0.980 3.536 -1.737 1.00 . A A . 6 VAL HG22 1 1 19 17534 1 1 6 VAL HG23 H -1.945 2.260 -0.993 1.00 . A A . 6 VAL HG23 1 1 19 17535 1 1 6 VAL N N -0.406 3.354 -4.341 1.00 . A A . 6 VAL N 1 1 19 17536 1 1 6 VAL O O 1.884 0.795 -4.595 1.00 . A A . 6 VAL O 1 1 19 17537 1 1 7 ILE C C 1.298 0.174 -7.365 1.00 . A A . 7 ILE C 1 1 19 17538 1 1 7 ILE CA C 0.147 -0.283 -6.470 1.00 . A A . 7 ILE CA 1 1 19 17539 1 1 7 ILE CB C -1.079 -0.630 -7.343 1.00 . A A . 7 ILE CB 1 1 19 17540 1 1 7 ILE CD1 C -3.380 -1.724 -7.278 1.00 . A A . 7 ILE CD1 1 1 19 17541 1 1 7 ILE CG1 C -2.146 -1.329 -6.497 1.00 . A A . 7 ILE CG1 1 1 19 17542 1 1 7 ILE CG2 C -0.674 -1.503 -8.521 1.00 . A A . 7 ILE CG2 1 1 19 17543 1 1 7 ILE H H -1.096 1.090 -5.449 1.00 . A A . 7 ILE H 1 1 19 17544 1 1 7 ILE HA H 0.450 -1.177 -5.942 1.00 . A A . 7 ILE HA 1 1 19 17545 1 1 7 ILE HB H -1.487 0.290 -7.732 1.00 . A A . 7 ILE HB 1 1 19 17546 1 1 7 ILE HD11 H -4.157 -0.991 -7.120 1.00 . A A . 7 ILE HD11 1 1 19 17547 1 1 7 ILE HD12 H -3.724 -2.691 -6.942 1.00 . A A . 7 ILE HD12 1 1 19 17548 1 1 7 ILE HD13 H -3.140 -1.772 -8.331 1.00 . A A . 7 ILE HD13 1 1 19 17549 1 1 7 ILE HG12 H -1.726 -2.226 -6.067 1.00 . A A . 7 ILE HG12 1 1 19 17550 1 1 7 ILE HG13 H -2.455 -0.665 -5.701 1.00 . A A . 7 ILE HG13 1 1 19 17551 1 1 7 ILE HG21 H -0.020 -0.942 -9.173 1.00 . A A . 7 ILE HG21 1 1 19 17552 1 1 7 ILE HG22 H -1.555 -1.806 -9.067 1.00 . A A . 7 ILE HG22 1 1 19 17553 1 1 7 ILE HG23 H -0.155 -2.379 -8.160 1.00 . A A . 7 ILE HG23 1 1 19 17554 1 1 7 ILE N N -0.184 0.733 -5.480 1.00 . A A . 7 ILE N 1 1 19 17555 1 1 7 ILE O O 2.055 -0.647 -7.885 1.00 . A A . 7 ILE O 1 1 19 17556 1 1 8 ASP C C 3.813 2.026 -7.610 1.00 . A A . 8 ASP C 1 1 19 17557 1 1 8 ASP CA C 2.489 2.045 -8.362 1.00 . A A . 8 ASP CA 1 1 19 17558 1 1 8 ASP CB C 2.141 3.477 -8.777 1.00 . A A . 8 ASP CB 1 1 19 17559 1 1 8 ASP CG C 2.279 3.695 -10.271 1.00 . A A . 8 ASP CG 1 1 19 17560 1 1 8 ASP H H 0.800 2.089 -7.095 1.00 . A A . 8 ASP H 1 1 19 17561 1 1 8 ASP HA H 2.581 1.433 -9.248 1.00 . A A . 8 ASP HA 1 1 19 17562 1 1 8 ASP HB2 H 1.119 3.688 -8.496 1.00 . A A . 8 ASP HB2 1 1 19 17563 1 1 8 ASP HB3 H 2.799 4.165 -8.268 1.00 . A A . 8 ASP HB3 1 1 19 17564 1 1 8 ASP N N 1.427 1.485 -7.537 1.00 . A A . 8 ASP N 1 1 19 17565 1 1 8 ASP O O 4.882 1.945 -8.212 1.00 . A A . 8 ASP O 1 1 19 17566 1 1 8 ASP OD1 O 3.406 3.985 -10.727 1.00 . A A . 8 ASP OD1 1 1 19 17567 1 1 8 ASP OD2 O 1.262 3.576 -10.986 1.00 . A A . 8 ASP OD2 1 1 19 17568 1 1 9 HIS C C 5.356 0.646 -5.160 1.00 . A A . 9 HIS C 1 1 19 17569 1 1 9 HIS CA C 4.916 2.081 -5.444 1.00 . A A . 9 HIS CA 1 1 19 17570 1 1 9 HIS CB C 4.644 2.823 -4.131 1.00 . A A . 9 HIS CB 1 1 19 17571 1 1 9 HIS CD2 C 6.050 1.579 -2.339 1.00 . A A . 9 HIS CD2 1 1 19 17572 1 1 9 HIS CE1 C 7.424 3.207 -1.819 1.00 . A A . 9 HIS CE1 1 1 19 17573 1 1 9 HIS CG C 5.718 2.649 -3.101 1.00 . A A . 9 HIS CG 1 1 19 17574 1 1 9 HIS H H 2.846 2.154 -5.863 1.00 . A A . 9 HIS H 1 1 19 17575 1 1 9 HIS HA H 5.701 2.587 -5.980 1.00 . A A . 9 HIS HA 1 1 19 17576 1 1 9 HIS HB2 H 4.554 3.879 -4.337 1.00 . A A . 9 HIS HB2 1 1 19 17577 1 1 9 HIS HB3 H 3.717 2.464 -3.710 1.00 . A A . 9 HIS HB3 1 1 19 17578 1 1 9 HIS HD1 H 6.614 4.557 -3.126 1.00 . A A . 9 HIS HD1 1 1 19 17579 1 1 9 HIS HD2 H 5.567 0.612 -2.348 1.00 . A A . 9 HIS HD2 1 1 19 17580 1 1 9 HIS HE1 H 8.217 3.772 -1.355 1.00 . A A . 9 HIS HE1 1 1 19 17581 1 1 9 HIS HE2 H 7.514 1.407 -0.844 1.00 . A A . 9 HIS HE2 1 1 19 17582 1 1 9 HIS N N 3.729 2.094 -6.285 1.00 . A A . 9 HIS N 1 1 19 17583 1 1 9 HIS ND1 N 6.598 3.653 -2.749 1.00 . A A . 9 HIS ND1 1 1 19 17584 1 1 9 HIS NE2 N 7.111 1.952 -1.553 1.00 . A A . 9 HIS NE2 1 1 19 17585 1 1 9 HIS O O 6.542 0.372 -4.979 1.00 . A A . 9 HIS O 1 1 19 17586 1 1 10 PHE C C 4.824 -2.453 -6.156 1.00 . A A . 10 PHE C 1 1 19 17587 1 1 10 PHE CA C 4.666 -1.669 -4.856 1.00 . A A . 10 PHE CA 1 1 19 17588 1 1 10 PHE CB C 3.545 -2.276 -4.013 1.00 . A A . 10 PHE CB 1 1 19 17589 1 1 10 PHE CD1 C 4.436 -2.699 -1.712 1.00 . A A . 10 PHE CD1 1 1 19 17590 1 1 10 PHE CD2 C 2.976 -0.843 -2.036 1.00 . A A . 10 PHE CD2 1 1 19 17591 1 1 10 PHE CE1 C 4.543 -2.385 -0.371 1.00 . A A . 10 PHE CE1 1 1 19 17592 1 1 10 PHE CE2 C 3.080 -0.524 -0.696 1.00 . A A . 10 PHE CE2 1 1 19 17593 1 1 10 PHE CG C 3.653 -1.933 -2.557 1.00 . A A . 10 PHE CG 1 1 19 17594 1 1 10 PHE CZ C 3.864 -1.295 0.139 1.00 . A A . 10 PHE CZ 1 1 19 17595 1 1 10 PHE H H 3.462 0.018 -5.270 1.00 . A A . 10 PHE H 1 1 19 17596 1 1 10 PHE HA H 5.589 -1.728 -4.298 1.00 . A A . 10 PHE HA 1 1 19 17597 1 1 10 PHE HB2 H 2.593 -1.910 -4.373 1.00 . A A . 10 PHE HB2 1 1 19 17598 1 1 10 PHE HB3 H 3.572 -3.351 -4.107 1.00 . A A . 10 PHE HB3 1 1 19 17599 1 1 10 PHE HD1 H 4.967 -3.549 -2.112 1.00 . A A . 10 PHE HD1 1 1 19 17600 1 1 10 PHE HD2 H 2.362 -0.240 -2.687 1.00 . A A . 10 PHE HD2 1 1 19 17601 1 1 10 PHE HE1 H 5.158 -2.991 0.278 1.00 . A A . 10 PHE HE1 1 1 19 17602 1 1 10 PHE HE2 H 2.547 0.331 -0.301 1.00 . A A . 10 PHE HE2 1 1 19 17603 1 1 10 PHE HZ H 3.947 -1.047 1.187 1.00 . A A . 10 PHE HZ 1 1 19 17604 1 1 10 PHE N N 4.387 -0.264 -5.120 1.00 . A A . 10 PHE N 1 1 19 17605 1 1 10 PHE O O 5.525 -3.464 -6.200 1.00 . A A . 10 PHE O 1 1 19 17606 1 1 11 GLY C C 3.196 -3.732 -8.648 1.00 . A A . 11 GLY C 1 1 19 17607 1 1 11 GLY CA C 4.250 -2.653 -8.495 1.00 . A A . 11 GLY CA 1 1 19 17608 1 1 11 GLY H H 3.624 -1.172 -7.118 1.00 . A A . 11 GLY H 1 1 19 17609 1 1 11 GLY HA2 H 4.120 -1.922 -9.280 1.00 . A A . 11 GLY HA2 1 1 19 17610 1 1 11 GLY HA3 H 5.227 -3.101 -8.593 1.00 . A A . 11 GLY HA3 1 1 19 17611 1 1 11 GLY N N 4.168 -1.982 -7.211 1.00 . A A . 11 GLY N 1 1 19 17612 1 1 11 GLY O O 2.448 -3.745 -9.624 1.00 . A A . 11 GLY O 1 1 19 17613 1 1 12 THR C C 1.421 -5.804 -6.369 1.00 . A A . 12 THR C 1 1 19 17614 1 1 12 THR CA C 2.167 -5.721 -7.696 1.00 . A A . 12 THR CA 1 1 19 17615 1 1 12 THR CB C 2.863 -7.051 -7.989 1.00 . A A . 12 THR CB 1 1 19 17616 1 1 12 THR CG2 C 2.955 -7.367 -9.466 1.00 . A A . 12 THR CG2 1 1 19 17617 1 1 12 THR H H 3.760 -4.566 -6.922 1.00 . A A . 12 THR H 1 1 19 17618 1 1 12 THR HA H 1.456 -5.516 -8.483 1.00 . A A . 12 THR HA 1 1 19 17619 1 1 12 THR HB H 2.310 -7.849 -7.514 1.00 . A A . 12 THR HB 1 1 19 17620 1 1 12 THR HG1 H 4.427 -7.948 -7.223 1.00 . A A . 12 THR HG1 1 1 19 17621 1 1 12 THR HG21 H 2.996 -8.437 -9.604 1.00 . A A . 12 THR HG21 1 1 19 17622 1 1 12 THR HG22 H 3.849 -6.917 -9.875 1.00 . A A . 12 THR HG22 1 1 19 17623 1 1 12 THR HG23 H 2.089 -6.971 -9.974 1.00 . A A . 12 THR HG23 1 1 19 17624 1 1 12 THR N N 3.136 -4.634 -7.674 1.00 . A A . 12 THR N 1 1 19 17625 1 1 12 THR O O 1.975 -5.490 -5.315 1.00 . A A . 12 THR O 1 1 19 17626 1 1 12 THR OG1 O 4.181 -7.053 -7.466 1.00 . A A . 12 THR OG1 1 1 19 17627 1 1 13 GLN C C 0.009 -7.259 -4.197 1.00 . A A . 13 GLN C 1 1 19 17628 1 1 13 GLN CA C -0.656 -6.346 -5.224 1.00 . A A . 13 GLN CA 1 1 19 17629 1 1 13 GLN CB C -2.044 -6.886 -5.580 1.00 . A A . 13 GLN CB 1 1 19 17630 1 1 13 GLN CD C -4.013 -6.726 -7.155 1.00 . A A . 13 GLN CD 1 1 19 17631 1 1 13 GLN CG C -2.783 -6.034 -6.600 1.00 . A A . 13 GLN CG 1 1 19 17632 1 1 13 GLN H H -0.225 -6.460 -7.294 1.00 . A A . 13 GLN H 1 1 19 17633 1 1 13 GLN HA H -0.762 -5.362 -4.795 1.00 . A A . 13 GLN HA 1 1 19 17634 1 1 13 GLN HB2 H -1.938 -7.882 -5.983 1.00 . A A . 13 GLN HB2 1 1 19 17635 1 1 13 GLN HB3 H -2.641 -6.931 -4.681 1.00 . A A . 13 GLN HB3 1 1 19 17636 1 1 13 GLN HE21 H -4.853 -6.734 -5.353 1.00 . A A . 13 GLN HE21 1 1 19 17637 1 1 13 GLN HE22 H -5.790 -7.442 -6.621 1.00 . A A . 13 GLN HE22 1 1 19 17638 1 1 13 GLN HG2 H -3.091 -5.114 -6.126 1.00 . A A . 13 GLN HG2 1 1 19 17639 1 1 13 GLN HG3 H -2.112 -5.811 -7.417 1.00 . A A . 13 GLN HG3 1 1 19 17640 1 1 13 GLN N N 0.163 -6.226 -6.424 1.00 . A A . 13 GLN N 1 1 19 17641 1 1 13 GLN NE2 N -4.983 -6.994 -6.289 1.00 . A A . 13 GLN NE2 1 1 19 17642 1 1 13 GLN O O 0.205 -6.874 -3.044 1.00 . A A . 13 GLN O 1 1 19 17643 1 1 13 GLN OE1 O -4.088 -7.018 -8.348 1.00 . A A . 13 GLN OE1 1 1 19 17644 1 1 14 ARG C C 2.145 -8.809 -2.964 1.00 . A A . 14 ARG C 1 1 19 17645 1 1 14 ARG CA C 1.000 -9.443 -3.747 1.00 . A A . 14 ARG CA 1 1 19 17646 1 1 14 ARG CB C 1.521 -10.628 -4.562 1.00 . A A . 14 ARG CB 1 1 19 17647 1 1 14 ARG CD C 2.516 -12.919 -4.260 1.00 . A A . 14 ARG CD 1 1 19 17648 1 1 14 ARG CG C 1.413 -11.961 -3.839 1.00 . A A . 14 ARG CG 1 1 19 17649 1 1 14 ARG CZ C 1.429 -14.399 -5.902 1.00 . A A . 14 ARG CZ 1 1 19 17650 1 1 14 ARG H H 0.172 -8.717 -5.556 1.00 . A A . 14 ARG H 1 1 19 17651 1 1 14 ARG HA H 0.257 -9.800 -3.049 1.00 . A A . 14 ARG HA 1 1 19 17652 1 1 14 ARG HB2 H 0.958 -10.696 -5.480 1.00 . A A . 14 ARG HB2 1 1 19 17653 1 1 14 ARG HB3 H 2.560 -10.457 -4.801 1.00 . A A . 14 ARG HB3 1 1 19 17654 1 1 14 ARG HD2 H 3.077 -12.473 -5.067 1.00 . A A . 14 ARG HD2 1 1 19 17655 1 1 14 ARG HD3 H 3.170 -13.086 -3.416 1.00 . A A . 14 ARG HD3 1 1 19 17656 1 1 14 ARG HE H 2.043 -14.959 -4.087 1.00 . A A . 14 ARG HE 1 1 19 17657 1 1 14 ARG HG2 H 1.487 -11.788 -2.776 1.00 . A A . 14 ARG HG2 1 1 19 17658 1 1 14 ARG HG3 H 0.455 -12.406 -4.066 1.00 . A A . 14 ARG HG3 1 1 19 17659 1 1 14 ARG HH11 H 1.675 -12.492 -6.528 1.00 . A A . 14 ARG HH11 1 1 19 17660 1 1 14 ARG HH12 H 0.914 -13.553 -7.664 1.00 . A A . 14 ARG HH12 1 1 19 17661 1 1 14 ARG HH21 H 1.042 -16.357 -5.581 1.00 . A A . 14 ARG HH21 1 1 19 17662 1 1 14 ARG HH22 H 0.553 -15.746 -7.128 1.00 . A A . 14 ARG HH22 1 1 19 17663 1 1 14 ARG N N 0.355 -8.470 -4.626 1.00 . A A . 14 ARG N 1 1 19 17664 1 1 14 ARG NE N 1.984 -14.204 -4.709 1.00 . A A . 14 ARG NE 1 1 19 17665 1 1 14 ARG NH1 N 1.332 -13.399 -6.769 1.00 . A A . 14 ARG NH1 1 1 19 17666 1 1 14 ARG NH2 N 0.970 -15.599 -6.231 1.00 . A A . 14 ARG NH2 1 1 19 17667 1 1 14 ARG O O 2.428 -9.200 -1.831 1.00 . A A . 14 ARG O 1 1 19 17668 1 1 15 ALA C C 3.449 -6.435 -1.654 1.00 . A A . 15 ALA C 1 1 19 17669 1 1 15 ALA CA C 3.910 -7.136 -2.927 1.00 . A A . 15 ALA CA 1 1 19 17670 1 1 15 ALA CB C 4.540 -6.136 -3.884 1.00 . A A . 15 ALA CB 1 1 19 17671 1 1 15 ALA H H 2.528 -7.554 -4.475 1.00 . A A . 15 ALA H 1 1 19 17672 1 1 15 ALA HA H 4.657 -7.873 -2.670 1.00 . A A . 15 ALA HA 1 1 19 17673 1 1 15 ALA HB1 H 3.839 -5.339 -4.085 1.00 . A A . 15 ALA HB1 1 1 19 17674 1 1 15 ALA HB2 H 4.795 -6.633 -4.808 1.00 . A A . 15 ALA HB2 1 1 19 17675 1 1 15 ALA HB3 H 5.434 -5.724 -3.439 1.00 . A A . 15 ALA HB3 1 1 19 17676 1 1 15 ALA N N 2.800 -7.824 -3.572 1.00 . A A . 15 ALA N 1 1 19 17677 1 1 15 ALA O O 4.011 -6.644 -0.580 1.00 . A A . 15 ALA O 1 1 19 17678 1 1 16 VAL C C 1.477 -5.825 0.477 1.00 . A A . 16 VAL C 1 1 19 17679 1 1 16 VAL CA C 1.875 -4.874 -0.648 1.00 . A A . 16 VAL CA 1 1 19 17680 1 1 16 VAL CB C 0.647 -4.028 -1.042 1.00 . A A . 16 VAL CB 1 1 19 17681 1 1 16 VAL CG1 C 0.559 -2.803 -0.160 1.00 . A A . 16 VAL CG1 1 1 19 17682 1 1 16 VAL CG2 C 0.694 -3.620 -2.509 1.00 . A A . 16 VAL CG2 1 1 19 17683 1 1 16 VAL H H 2.013 -5.482 -2.662 1.00 . A A . 16 VAL H 1 1 19 17684 1 1 16 VAL HA H 2.643 -4.206 -0.285 1.00 . A A . 16 VAL HA 1 1 19 17685 1 1 16 VAL HB H -0.242 -4.622 -0.883 1.00 . A A . 16 VAL HB 1 1 19 17686 1 1 16 VAL HG11 H 1.539 -2.363 -0.069 1.00 . A A . 16 VAL HG11 1 1 19 17687 1 1 16 VAL HG12 H 0.200 -3.088 0.817 1.00 . A A . 16 VAL HG12 1 1 19 17688 1 1 16 VAL HG13 H -0.119 -2.090 -0.601 1.00 . A A . 16 VAL HG13 1 1 19 17689 1 1 16 VAL HG21 H 1.723 -3.512 -2.820 1.00 . A A . 16 VAL HG21 1 1 19 17690 1 1 16 VAL HG22 H 0.178 -2.679 -2.638 1.00 . A A . 16 VAL HG22 1 1 19 17691 1 1 16 VAL HG23 H 0.214 -4.379 -3.110 1.00 . A A . 16 VAL HG23 1 1 19 17692 1 1 16 VAL N N 2.418 -5.605 -1.784 1.00 . A A . 16 VAL N 1 1 19 17693 1 1 16 VAL O O 1.710 -5.543 1.653 1.00 . A A . 16 VAL O 1 1 19 17694 1 1 17 ALA C C 1.628 -8.489 1.870 1.00 . A A . 17 ALA C 1 1 19 17695 1 1 17 ALA CA C 0.443 -7.942 1.082 1.00 . A A . 17 ALA CA 1 1 19 17696 1 1 17 ALA CB C -0.301 -9.074 0.391 1.00 . A A . 17 ALA CB 1 1 19 17697 1 1 17 ALA H H 0.718 -7.117 -0.847 1.00 . A A . 17 ALA H 1 1 19 17698 1 1 17 ALA HA H -0.239 -7.460 1.768 1.00 . A A . 17 ALA HA 1 1 19 17699 1 1 17 ALA HB1 H -1.359 -8.859 0.385 1.00 . A A . 17 ALA HB1 1 1 19 17700 1 1 17 ALA HB2 H -0.125 -9.998 0.921 1.00 . A A . 17 ALA HB2 1 1 19 17701 1 1 17 ALA HB3 H 0.053 -9.170 -0.625 1.00 . A A . 17 ALA HB3 1 1 19 17702 1 1 17 ALA N N 0.875 -6.950 0.107 1.00 . A A . 17 ALA N 1 1 19 17703 1 1 17 ALA O O 1.522 -8.752 3.068 1.00 . A A . 17 ALA O 1 1 19 17704 1 1 18 LYS C C 4.828 -8.045 2.388 1.00 . A A . 18 LYS C 1 1 19 17705 1 1 18 LYS CA C 3.967 -9.175 1.824 1.00 . A A . 18 LYS CA 1 1 19 17706 1 1 18 LYS CB C 4.779 -10.001 0.824 1.00 . A A . 18 LYS CB 1 1 19 17707 1 1 18 LYS CD C 6.590 -9.803 -0.904 1.00 . A A . 18 LYS CD 1 1 19 17708 1 1 18 LYS CE C 6.307 -10.611 -2.160 1.00 . A A . 18 LYS CE 1 1 19 17709 1 1 18 LYS CG C 5.321 -9.188 -0.339 1.00 . A A . 18 LYS CG 1 1 19 17710 1 1 18 LYS H H 2.779 -8.430 0.237 1.00 . A A . 18 LYS H 1 1 19 17711 1 1 18 LYS HA H 3.661 -9.816 2.638 1.00 . A A . 18 LYS HA 1 1 19 17712 1 1 18 LYS HB2 H 5.613 -10.450 1.341 1.00 . A A . 18 LYS HB2 1 1 19 17713 1 1 18 LYS HB3 H 4.150 -10.783 0.427 1.00 . A A . 18 LYS HB3 1 1 19 17714 1 1 18 LYS HD2 H 7.285 -9.012 -1.147 1.00 . A A . 18 LYS HD2 1 1 19 17715 1 1 18 LYS HD3 H 7.027 -10.453 -0.159 1.00 . A A . 18 LYS HD3 1 1 19 17716 1 1 18 LYS HE2 H 5.647 -10.041 -2.799 1.00 . A A . 18 LYS HE2 1 1 19 17717 1 1 18 LYS HE3 H 7.239 -10.791 -2.676 1.00 . A A . 18 LYS HE3 1 1 19 17718 1 1 18 LYS HG2 H 4.575 -9.148 -1.117 1.00 . A A . 18 LYS HG2 1 1 19 17719 1 1 18 LYS HG3 H 5.538 -8.187 0.004 1.00 . A A . 18 LYS HG3 1 1 19 17720 1 1 18 LYS HZ1 H 5.050 -12.211 -2.632 1.00 . A A . 18 LYS HZ1 1 1 19 17721 1 1 18 LYS HZ2 H 5.093 -11.837 -0.984 1.00 . A A . 18 LYS HZ2 1 1 19 17722 1 1 18 LYS HZ3 H 6.393 -12.647 -1.702 1.00 . A A . 18 LYS HZ3 1 1 19 17723 1 1 18 LYS N N 2.757 -8.659 1.189 1.00 . A A . 18 LYS N 1 1 19 17724 1 1 18 LYS NZ N 5.666 -11.918 -1.848 1.00 . A A . 18 LYS NZ 1 1 19 17725 1 1 18 LYS O O 6.031 -8.212 2.582 1.00 . A A . 18 LYS O 1 1 19 17726 1 1 19 ALA C C 4.271 -5.240 4.466 1.00 . A A . 19 ALA C 1 1 19 17727 1 1 19 ALA CA C 4.928 -5.748 3.186 1.00 . A A . 19 ALA CA 1 1 19 17728 1 1 19 ALA CB C 4.999 -4.636 2.151 1.00 . A A . 19 ALA CB 1 1 19 17729 1 1 19 ALA H H 3.250 -6.816 2.473 1.00 . A A . 19 ALA H 1 1 19 17730 1 1 19 ALA HA H 5.937 -6.062 3.411 1.00 . A A . 19 ALA HA 1 1 19 17731 1 1 19 ALA HB1 H 4.138 -3.992 2.254 1.00 . A A . 19 ALA HB1 1 1 19 17732 1 1 19 ALA HB2 H 5.007 -5.067 1.160 1.00 . A A . 19 ALA HB2 1 1 19 17733 1 1 19 ALA HB3 H 5.900 -4.061 2.301 1.00 . A A . 19 ALA HB3 1 1 19 17734 1 1 19 ALA N N 4.209 -6.895 2.647 1.00 . A A . 19 ALA N 1 1 19 17735 1 1 19 ALA O O 4.942 -5.021 5.475 1.00 . A A . 19 ALA O 1 1 19 17736 1 1 20 LEU C C 1.938 -5.706 6.557 1.00 . A A . 20 LEU C 1 1 19 17737 1 1 20 LEU CA C 2.209 -4.572 5.574 1.00 . A A . 20 LEU CA 1 1 19 17738 1 1 20 LEU CB C 0.888 -3.944 5.127 1.00 . A A . 20 LEU CB 1 1 19 17739 1 1 20 LEU CD1 C -0.406 -2.756 3.339 1.00 . A A . 20 LEU CD1 1 1 19 17740 1 1 20 LEU CD2 C 1.698 -1.746 4.239 1.00 . A A . 20 LEU CD2 1 1 19 17741 1 1 20 LEU CG C 0.981 -3.043 3.896 1.00 . A A . 20 LEU CG 1 1 19 17742 1 1 20 LEU H H 2.477 -5.246 3.584 1.00 . A A . 20 LEU H 1 1 19 17743 1 1 20 LEU HA H 2.808 -3.821 6.065 1.00 . A A . 20 LEU HA 1 1 19 17744 1 1 20 LEU HB2 H 0.188 -4.739 4.914 1.00 . A A . 20 LEU HB2 1 1 19 17745 1 1 20 LEU HB3 H 0.499 -3.357 5.946 1.00 . A A . 20 LEU HB3 1 1 19 17746 1 1 20 LEU HD11 H -0.646 -3.487 2.579 1.00 . A A . 20 LEU HD11 1 1 19 17747 1 1 20 LEU HD12 H -0.423 -1.767 2.905 1.00 . A A . 20 LEU HD12 1 1 19 17748 1 1 20 LEU HD13 H -1.133 -2.812 4.136 1.00 . A A . 20 LEU HD13 1 1 19 17749 1 1 20 LEU HD21 H 1.617 -1.559 5.299 1.00 . A A . 20 LEU HD21 1 1 19 17750 1 1 20 LEU HD22 H 1.248 -0.929 3.693 1.00 . A A . 20 LEU HD22 1 1 19 17751 1 1 20 LEU HD23 H 2.740 -1.828 3.968 1.00 . A A . 20 LEU HD23 1 1 19 17752 1 1 20 LEU HG H 1.550 -3.549 3.129 1.00 . A A . 20 LEU HG 1 1 19 17753 1 1 20 LEU N N 2.956 -5.054 4.417 1.00 . A A . 20 LEU N 1 1 19 17754 1 1 20 LEU O O 1.856 -5.488 7.764 1.00 . A A . 20 LEU O 1 1 19 17755 1 1 21 GLY C C 0.161 -8.657 6.643 1.00 . A A . 21 GLY C 1 1 19 17756 1 1 21 GLY CA C 1.539 -8.070 6.874 1.00 . A A . 21 GLY CA 1 1 19 17757 1 1 21 GLY H H 1.877 -7.033 5.060 1.00 . A A . 21 GLY H 1 1 19 17758 1 1 21 GLY HA2 H 2.280 -8.828 6.668 1.00 . A A . 21 GLY HA2 1 1 19 17759 1 1 21 GLY HA3 H 1.623 -7.771 7.908 1.00 . A A . 21 GLY HA3 1 1 19 17760 1 1 21 GLY N N 1.801 -6.918 6.029 1.00 . A A . 21 GLY N 1 1 19 17761 1 1 21 GLY O O -0.425 -9.257 7.545 1.00 . A A . 21 GLY O 1 1 19 17762 1 1 22 ILE C C -1.598 -9.948 3.894 1.00 . A A . 22 ILE C 1 1 19 17763 1 1 22 ILE CA C -1.678 -8.999 5.085 1.00 . A A . 22 ILE CA 1 1 19 17764 1 1 22 ILE CB C -2.658 -7.858 4.751 1.00 . A A . 22 ILE CB 1 1 19 17765 1 1 22 ILE CD1 C -3.040 -5.884 3.188 1.00 . A A . 22 ILE CD1 1 1 19 17766 1 1 22 ILE CG1 C -2.117 -7.012 3.597 1.00 . A A . 22 ILE CG1 1 1 19 17767 1 1 22 ILE CG2 C -2.902 -6.995 5.981 1.00 . A A . 22 ILE CG2 1 1 19 17768 1 1 22 ILE H H 0.156 -7.996 4.756 1.00 . A A . 22 ILE H 1 1 19 17769 1 1 22 ILE HA H -2.061 -9.537 5.938 1.00 . A A . 22 ILE HA 1 1 19 17770 1 1 22 ILE HB H -3.599 -8.295 4.458 1.00 . A A . 22 ILE HB 1 1 19 17771 1 1 22 ILE HD11 H -2.465 -4.981 3.051 1.00 . A A . 22 ILE HD11 1 1 19 17772 1 1 22 ILE HD12 H -3.779 -5.727 3.961 1.00 . A A . 22 ILE HD12 1 1 19 17773 1 1 22 ILE HD13 H -3.533 -6.142 2.264 1.00 . A A . 22 ILE HD13 1 1 19 17774 1 1 22 ILE HG12 H -1.172 -6.577 3.889 1.00 . A A . 22 ILE HG12 1 1 19 17775 1 1 22 ILE HG13 H -1.965 -7.646 2.736 1.00 . A A . 22 ILE HG13 1 1 19 17776 1 1 22 ILE HG21 H -2.078 -7.108 6.668 1.00 . A A . 22 ILE HG21 1 1 19 17777 1 1 22 ILE HG22 H -3.818 -7.304 6.461 1.00 . A A . 22 ILE HG22 1 1 19 17778 1 1 22 ILE HG23 H -2.983 -5.960 5.684 1.00 . A A . 22 ILE HG23 1 1 19 17779 1 1 22 ILE N N -0.358 -8.483 5.432 1.00 . A A . 22 ILE N 1 1 19 17780 1 1 22 ILE O O -0.518 -10.210 3.367 1.00 . A A . 22 ILE O 1 1 19 17781 1 1 23 SER C C -3.099 -10.633 1.050 1.00 . A A . 23 SER C 1 1 19 17782 1 1 23 SER CA C -2.813 -11.382 2.348 1.00 . A A . 23 SER CA 1 1 19 17783 1 1 23 SER CB C -3.888 -12.443 2.586 1.00 . A A . 23 SER CB 1 1 19 17784 1 1 23 SER H H -3.580 -10.214 3.937 1.00 . A A . 23 SER H 1 1 19 17785 1 1 23 SER HA H -1.853 -11.869 2.264 1.00 . A A . 23 SER HA 1 1 19 17786 1 1 23 SER HB2 H -3.777 -13.235 1.860 1.00 . A A . 23 SER HB2 1 1 19 17787 1 1 23 SER HB3 H -3.778 -12.848 3.581 1.00 . A A . 23 SER HB3 1 1 19 17788 1 1 23 SER HG H -5.338 -11.632 1.547 1.00 . A A . 23 SER HG 1 1 19 17789 1 1 23 SER N N -2.751 -10.462 3.476 1.00 . A A . 23 SER N 1 1 19 17790 1 1 23 SER O O -3.557 -9.490 1.069 1.00 . A A . 23 SER O 1 1 19 17791 1 1 23 SER OG O -5.187 -11.890 2.459 1.00 . A A . 23 SER OG 1 1 19 17792 1 1 24 ASP C C -4.527 -10.316 -1.564 1.00 . A A . 24 ASP C 1 1 19 17793 1 1 24 ASP CA C -3.056 -10.680 -1.384 1.00 . A A . 24 ASP CA 1 1 19 17794 1 1 24 ASP CB C -2.614 -11.634 -2.494 1.00 . A A . 24 ASP CB 1 1 19 17795 1 1 24 ASP CG C -3.233 -13.012 -2.354 1.00 . A A . 24 ASP CG 1 1 19 17796 1 1 24 ASP H H -2.463 -12.193 -0.027 1.00 . A A . 24 ASP H 1 1 19 17797 1 1 24 ASP HA H -2.464 -9.778 -1.440 1.00 . A A . 24 ASP HA 1 1 19 17798 1 1 24 ASP HB2 H -2.906 -11.226 -3.450 1.00 . A A . 24 ASP HB2 1 1 19 17799 1 1 24 ASP HB3 H -1.539 -11.738 -2.464 1.00 . A A . 24 ASP HB3 1 1 19 17800 1 1 24 ASP N N -2.827 -11.284 -0.077 1.00 . A A . 24 ASP N 1 1 19 17801 1 1 24 ASP O O -4.855 -9.342 -2.241 1.00 . A A . 24 ASP O 1 1 19 17802 1 1 24 ASP OD1 O -2.720 -13.814 -1.545 1.00 . A A . 24 ASP OD1 1 1 19 17803 1 1 24 ASP OD2 O -4.230 -13.287 -3.052 1.00 . A A . 24 ASP OD2 1 1 19 17804 1 1 25 ALA C C -7.208 -9.508 -0.464 1.00 . A A . 25 ALA C 1 1 19 17805 1 1 25 ALA CA C -6.839 -10.866 -1.049 1.00 . A A . 25 ALA CA 1 1 19 17806 1 1 25 ALA CB C -7.606 -11.974 -0.341 1.00 . A A . 25 ALA CB 1 1 19 17807 1 1 25 ALA H H -5.081 -11.867 -0.430 1.00 . A A . 25 ALA H 1 1 19 17808 1 1 25 ALA HA H -7.112 -10.883 -2.094 1.00 . A A . 25 ALA HA 1 1 19 17809 1 1 25 ALA HB1 H -8.497 -12.213 -0.905 1.00 . A A . 25 ALA HB1 1 1 19 17810 1 1 25 ALA HB2 H -7.885 -11.642 0.647 1.00 . A A . 25 ALA HB2 1 1 19 17811 1 1 25 ALA HB3 H -6.982 -12.852 -0.263 1.00 . A A . 25 ALA HB3 1 1 19 17812 1 1 25 ALA N N -5.405 -11.106 -0.956 1.00 . A A . 25 ALA N 1 1 19 17813 1 1 25 ALA O O -8.066 -8.804 -0.996 1.00 . A A . 25 ALA O 1 1 19 17814 1 1 26 ALA C C -6.469 -6.701 0.375 1.00 . A A . 26 ALA C 1 1 19 17815 1 1 26 ALA CA C -6.812 -7.870 1.291 1.00 . A A . 26 ALA CA 1 1 19 17816 1 1 26 ALA CB C -6.022 -7.775 2.588 1.00 . A A . 26 ALA CB 1 1 19 17817 1 1 26 ALA H H -5.881 -9.750 1.012 1.00 . A A . 26 ALA H 1 1 19 17818 1 1 26 ALA HA H -7.864 -7.827 1.535 1.00 . A A . 26 ALA HA 1 1 19 17819 1 1 26 ALA HB1 H -6.281 -8.605 3.229 1.00 . A A . 26 ALA HB1 1 1 19 17820 1 1 26 ALA HB2 H -6.262 -6.848 3.089 1.00 . A A . 26 ALA HB2 1 1 19 17821 1 1 26 ALA HB3 H -4.965 -7.804 2.370 1.00 . A A . 26 ALA HB3 1 1 19 17822 1 1 26 ALA N N -6.554 -9.145 0.635 1.00 . A A . 26 ALA N 1 1 19 17823 1 1 26 ALA O O -7.167 -5.688 0.354 1.00 . A A . 26 ALA O 1 1 19 17824 1 1 27 VAL C C -5.944 -5.638 -2.453 1.00 . A A . 27 VAL C 1 1 19 17825 1 1 27 VAL CA C -4.953 -5.807 -1.307 1.00 . A A . 27 VAL CA 1 1 19 17826 1 1 27 VAL CB C -3.560 -6.116 -1.888 1.00 . A A . 27 VAL CB 1 1 19 17827 1 1 27 VAL CG1 C -3.061 -4.954 -2.732 1.00 . A A . 27 VAL CG1 1 1 19 17828 1 1 27 VAL CG2 C -2.576 -6.436 -0.773 1.00 . A A . 27 VAL CG2 1 1 19 17829 1 1 27 VAL H H -4.873 -7.681 -0.327 1.00 . A A . 27 VAL H 1 1 19 17830 1 1 27 VAL HA H -4.893 -4.880 -0.757 1.00 . A A . 27 VAL HA 1 1 19 17831 1 1 27 VAL HB H -3.643 -6.985 -2.526 1.00 . A A . 27 VAL HB 1 1 19 17832 1 1 27 VAL HG11 H -2.032 -5.127 -3.011 1.00 . A A . 27 VAL HG11 1 1 19 17833 1 1 27 VAL HG12 H -3.129 -4.040 -2.163 1.00 . A A . 27 VAL HG12 1 1 19 17834 1 1 27 VAL HG13 H -3.665 -4.870 -3.623 1.00 . A A . 27 VAL HG13 1 1 19 17835 1 1 27 VAL HG21 H -2.580 -5.637 -0.049 1.00 . A A . 27 VAL HG21 1 1 19 17836 1 1 27 VAL HG22 H -1.584 -6.542 -1.189 1.00 . A A . 27 VAL HG22 1 1 19 17837 1 1 27 VAL HG23 H -2.866 -7.360 -0.292 1.00 . A A . 27 VAL HG23 1 1 19 17838 1 1 27 VAL N N -5.388 -6.850 -0.387 1.00 . A A . 27 VAL N 1 1 19 17839 1 1 27 VAL O O -6.384 -4.528 -2.749 1.00 . A A . 27 VAL O 1 1 19 17840 1 1 28 SER C C -8.596 -6.207 -3.764 1.00 . A A . 28 SER C 1 1 19 17841 1 1 28 SER CA C -7.231 -6.722 -4.212 1.00 . A A . 28 SER CA 1 1 19 17842 1 1 28 SER CB C -7.376 -8.120 -4.816 1.00 . A A . 28 SER CB 1 1 19 17843 1 1 28 SER H H -5.908 -7.605 -2.815 1.00 . A A . 28 SER H 1 1 19 17844 1 1 28 SER HA H -6.834 -6.054 -4.961 1.00 . A A . 28 SER HA 1 1 19 17845 1 1 28 SER HB2 H -8.079 -8.692 -4.231 1.00 . A A . 28 SER HB2 1 1 19 17846 1 1 28 SER HB3 H -7.734 -8.035 -5.831 1.00 . A A . 28 SER HB3 1 1 19 17847 1 1 28 SER HG H -6.157 -9.503 -5.482 1.00 . A A . 28 SER HG 1 1 19 17848 1 1 28 SER N N -6.292 -6.749 -3.096 1.00 . A A . 28 SER N 1 1 19 17849 1 1 28 SER O O -9.331 -5.605 -4.547 1.00 . A A . 28 SER O 1 1 19 17850 1 1 28 SER OG O -6.134 -8.802 -4.826 1.00 . A A . 28 SER OG 1 1 19 17851 1 1 29 GLN C C -10.230 -4.494 -1.755 1.00 . A A . 29 GLN C 1 1 19 17852 1 1 29 GLN CA C -10.200 -6.010 -1.947 1.00 . A A . 29 GLN CA 1 1 19 17853 1 1 29 GLN CB C -10.470 -6.712 -0.613 1.00 . A A . 29 GLN CB 1 1 19 17854 1 1 29 GLN CD C -11.340 -9.049 -1.021 1.00 . A A . 29 GLN CD 1 1 19 17855 1 1 29 GLN CG C -11.680 -7.624 -0.639 1.00 . A A . 29 GLN CG 1 1 19 17856 1 1 29 GLN H H -8.302 -6.934 -1.924 1.00 . A A . 29 GLN H 1 1 19 17857 1 1 29 GLN HA H -10.980 -6.285 -2.648 1.00 . A A . 29 GLN HA 1 1 19 17858 1 1 29 GLN HB2 H -9.610 -7.307 -0.354 1.00 . A A . 29 GLN HB2 1 1 19 17859 1 1 29 GLN HB3 H -10.620 -5.965 0.152 1.00 . A A . 29 GLN HB3 1 1 19 17860 1 1 29 GLN HE21 H -10.910 -9.475 0.874 1.00 . A A . 29 GLN HE21 1 1 19 17861 1 1 29 GLN HE22 H -10.710 -10.773 -0.250 1.00 . A A . 29 GLN HE22 1 1 19 17862 1 1 29 GLN HG2 H -12.140 -7.630 0.341 1.00 . A A . 29 GLN HG2 1 1 19 17863 1 1 29 GLN HG3 H -12.390 -7.237 -1.359 1.00 . A A . 29 GLN HG3 1 1 19 17864 1 1 29 GLN N N -8.929 -6.448 -2.500 1.00 . A A . 29 GLN N 1 1 19 17865 1 1 29 GLN NE2 N -10.950 -9.846 -0.033 1.00 . A A . 29 GLN NE2 1 1 19 17866 1 1 29 GLN O O -11.300 -3.889 -1.692 1.00 . A A . 29 GLN O 1 1 19 17867 1 1 29 GLN OE1 O -11.420 -9.430 -2.188 1.00 . A A . 29 GLN OE1 1 1 19 17868 1 1 30 TRP C C -9.740 -1.692 -2.543 1.00 . A A . 30 TRP C 1 1 19 17869 1 1 30 TRP CA C -8.949 -2.443 -1.474 1.00 . A A . 30 TRP CA 1 1 19 17870 1 1 30 TRP CB C -7.484 -2.004 -1.513 1.00 . A A . 30 TRP CB 1 1 19 17871 1 1 30 TRP CD1 C -7.183 -2.986 0.838 1.00 . A A . 30 TRP CD1 1 1 19 17872 1 1 30 TRP CD2 C -5.279 -2.328 -0.138 1.00 . A A . 30 TRP CD2 1 1 19 17873 1 1 30 TRP CE2 C -4.975 -2.843 1.137 1.00 . A A . 30 TRP CE2 1 1 19 17874 1 1 30 TRP CE3 C -4.236 -1.854 -0.938 1.00 . A A . 30 TRP CE3 1 1 19 17875 1 1 30 TRP CG C -6.697 -2.430 -0.310 1.00 . A A . 30 TRP CG 1 1 19 17876 1 1 30 TRP CH2 C -2.672 -2.425 0.822 1.00 . A A . 30 TRP CH2 1 1 19 17877 1 1 30 TRP CZ2 C -3.672 -2.895 1.627 1.00 . A A . 30 TRP CZ2 1 1 19 17878 1 1 30 TRP CZ3 C -2.944 -1.905 -0.450 1.00 . A A . 30 TRP CZ3 1 1 19 17879 1 1 30 TRP H H -8.234 -4.420 -1.717 1.00 . A A . 30 TRP H 1 1 19 17880 1 1 30 TRP HA H -9.361 -2.204 -0.505 1.00 . A A . 30 TRP HA 1 1 19 17881 1 1 30 TRP HB2 H -7.012 -2.428 -2.387 1.00 . A A . 30 TRP HB2 1 1 19 17882 1 1 30 TRP HB3 H -7.441 -0.926 -1.577 1.00 . A A . 30 TRP HB3 1 1 19 17883 1 1 30 TRP HD1 H -8.228 -3.191 1.019 1.00 . A A . 30 TRP HD1 1 1 19 17884 1 1 30 TRP HE1 H -6.248 -3.635 2.604 1.00 . A A . 30 TRP HE1 1 1 19 17885 1 1 30 TRP HE3 H -4.426 -1.451 -1.923 1.00 . A A . 30 TRP HE3 1 1 19 17886 1 1 30 TRP HH2 H -1.648 -2.444 1.163 1.00 . A A . 30 TRP HH2 1 1 19 17887 1 1 30 TRP HZ2 H -3.445 -3.292 2.606 1.00 . A A . 30 TRP HZ2 1 1 19 17888 1 1 30 TRP HZ3 H -2.126 -1.543 -1.054 1.00 . A A . 30 TRP HZ3 1 1 19 17889 1 1 30 TRP N N -9.054 -3.886 -1.661 1.00 . A A . 30 TRP N 1 1 19 17890 1 1 30 TRP NE1 N -6.154 -3.237 1.713 1.00 . A A . 30 TRP NE1 1 1 19 17891 1 1 30 TRP O O -9.541 -1.902 -3.739 1.00 . A A . 30 TRP O 1 1 19 17892 1 1 31 LYS C C -10.660 1.157 -3.564 1.00 . A A . 31 LYS C 1 1 19 17893 1 1 31 LYS CA C -11.450 -0.028 -3.018 1.00 . A A . 31 LYS CA 1 1 19 17894 1 1 31 LYS CB C -12.710 0.462 -2.312 1.00 . A A . 31 LYS CB 1 1 19 17895 1 1 31 LYS CD C -14.740 -0.132 -0.957 1.00 . A A . 31 LYS CD 1 1 19 17896 1 1 31 LYS CE C -14.650 0.345 0.485 1.00 . A A . 31 LYS CE 1 1 19 17897 1 1 31 LYS CG C -13.400 -0.607 -1.474 1.00 . A A . 31 LYS CG 1 1 19 17898 1 1 31 LYS H H -10.740 -0.689 -1.136 1.00 . A A . 31 LYS H 1 1 19 17899 1 1 31 LYS HA H -11.730 -0.667 -3.842 1.00 . A A . 31 LYS HA 1 1 19 17900 1 1 31 LYS HB2 H -12.450 1.286 -1.662 1.00 . A A . 31 LYS HB2 1 1 19 17901 1 1 31 LYS HB3 H -13.420 0.809 -3.055 1.00 . A A . 31 LYS HB3 1 1 19 17902 1 1 31 LYS HD2 H -15.090 0.685 -1.573 1.00 . A A . 31 LYS HD2 1 1 19 17903 1 1 31 LYS HD3 H -15.450 -0.948 -1.011 1.00 . A A . 31 LYS HD3 1 1 19 17904 1 1 31 LYS HE2 H -13.620 0.584 0.706 1.00 . A A . 31 LYS HE2 1 1 19 17905 1 1 31 LYS HE3 H -15.260 1.232 0.596 1.00 . A A . 31 LYS HE3 1 1 19 17906 1 1 31 LYS HG2 H -13.550 -1.486 -2.083 1.00 . A A . 31 LYS HG2 1 1 19 17907 1 1 31 LYS HG3 H -12.760 -0.851 -0.634 1.00 . A A . 31 LYS HG3 1 1 19 17908 1 1 31 LYS HZ1 H -16.150 -0.612 1.576 1.00 . A A . 31 LYS HZ1 1 1 19 17909 1 1 31 LYS HZ2 H -14.660 -0.566 2.364 1.00 . A A . 31 LYS HZ2 1 1 19 17910 1 1 31 LYS HZ3 H -14.900 -1.640 1.082 1.00 . A A . 31 LYS HZ3 1 1 19 17911 1 1 31 LYS N N -10.630 -0.814 -2.101 1.00 . A A . 31 LYS N 1 1 19 17912 1 1 31 LYS NZ N -15.130 -0.690 1.444 1.00 . A A . 31 LYS NZ 1 1 19 17913 1 1 31 LYS O O -9.435 1.190 -3.473 1.00 . A A . 31 LYS O 1 1 19 17914 1 1 32 GLU C C -9.740 3.929 -3.697 1.00 . A A . 32 GLU C 1 1 19 17915 1 1 32 GLU CA C -10.720 3.320 -4.689 1.00 . A A . 32 GLU CA 1 1 19 17916 1 1 32 GLU CB C -11.780 4.358 -5.078 1.00 . A A . 32 GLU CB 1 1 19 17917 1 1 32 GLU CD C -12.370 6.132 -6.775 1.00 . A A . 32 GLU CD 1 1 19 17918 1 1 32 GLU CG C -11.690 4.799 -6.529 1.00 . A A . 32 GLU CG 1 1 19 17919 1 1 32 GLU H H -12.340 2.051 -4.174 1.00 . A A . 32 GLU H 1 1 19 17920 1 1 32 GLU HA H -10.190 3.019 -5.575 1.00 . A A . 32 GLU HA 1 1 19 17921 1 1 32 GLU HB2 H -12.760 3.935 -4.912 1.00 . A A . 32 GLU HB2 1 1 19 17922 1 1 32 GLU HB3 H -11.670 5.230 -4.451 1.00 . A A . 32 GLU HB3 1 1 19 17923 1 1 32 GLU HG2 H -10.650 4.886 -6.804 1.00 . A A . 32 GLU HG2 1 1 19 17924 1 1 32 GLU HG3 H -12.170 4.051 -7.149 1.00 . A A . 32 GLU HG3 1 1 19 17925 1 1 32 GLU N N -11.360 2.132 -4.130 1.00 . A A . 32 GLU N 1 1 19 17926 1 1 32 GLU O O -8.760 4.563 -4.091 1.00 . A A . 32 GLU O 1 1 19 17927 1 1 32 GLU OE1 O -12.470 6.931 -5.821 1.00 . A A . 32 GLU OE1 1 1 19 17928 1 1 32 GLU OE2 O -12.800 6.378 -7.922 1.00 . A A . 32 GLU OE2 1 1 19 17929 1 1 33 VAL C C -8.729 3.158 -0.385 1.00 . A A . 33 VAL C 1 1 19 17930 1 1 33 VAL CA C -9.135 4.257 -1.361 1.00 . A A . 33 VAL CA 1 1 19 17931 1 1 33 VAL CB C -9.821 5.393 -0.580 1.00 . A A . 33 VAL CB 1 1 19 17932 1 1 33 VAL CG1 C -8.826 6.092 0.333 1.00 . A A . 33 VAL CG1 1 1 19 17933 1 1 33 VAL CG2 C -10.460 6.387 -1.536 1.00 . A A . 33 VAL CG2 1 1 19 17934 1 1 33 VAL H H -10.790 3.216 -2.157 1.00 . A A . 33 VAL H 1 1 19 17935 1 1 33 VAL HA H -8.247 4.654 -1.831 1.00 . A A . 33 VAL HA 1 1 19 17936 1 1 33 VAL HB H -10.590 4.962 0.035 1.00 . A A . 33 VAL HB 1 1 19 17937 1 1 33 VAL HG11 H -9.347 6.504 1.185 1.00 . A A . 33 VAL HG11 1 1 19 17938 1 1 33 VAL HG12 H -8.338 6.888 -0.208 1.00 . A A . 33 VAL HG12 1 1 19 17939 1 1 33 VAL HG13 H -8.088 5.380 0.672 1.00 . A A . 33 VAL HG13 1 1 19 17940 1 1 33 VAL HG21 H -11.500 6.119 -1.687 1.00 . A A . 33 VAL HG21 1 1 19 17941 1 1 33 VAL HG22 H -9.948 6.365 -2.482 1.00 . A A . 33 VAL HG22 1 1 19 17942 1 1 33 VAL HG23 H -10.400 7.380 -1.116 1.00 . A A . 33 VAL HG23 1 1 19 17943 1 1 33 VAL N N -10.000 3.730 -2.409 1.00 . A A . 33 VAL N 1 1 19 17944 1 1 33 VAL O O -9.578 2.449 0.156 1.00 . A A . 33 VAL O 1 1 19 17945 1 1 34 ILE C C -7.493 2.160 2.147 1.00 . A A . 34 ILE C 1 1 19 17946 1 1 34 ILE CA C -6.906 2.004 0.748 1.00 . A A . 34 ILE CA 1 1 19 17947 1 1 34 ILE CB C -5.370 2.060 0.845 1.00 . A A . 34 ILE CB 1 1 19 17948 1 1 34 ILE CD1 C -3.542 3.652 1.616 1.00 . A A . 34 ILE CD1 1 1 19 17949 1 1 34 ILE CG1 C -4.888 3.509 0.943 1.00 . A A . 34 ILE CG1 1 1 19 17950 1 1 34 ILE CG2 C -4.735 1.366 -0.348 1.00 . A A . 34 ILE CG2 1 1 19 17951 1 1 34 ILE H H -6.798 3.613 -0.626 1.00 . A A . 34 ILE H 1 1 19 17952 1 1 34 ILE HA H -7.184 1.035 0.359 1.00 . A A . 34 ILE HA 1 1 19 17953 1 1 34 ILE HB H -5.069 1.529 1.738 1.00 . A A . 34 ILE HB 1 1 19 17954 1 1 34 ILE HD11 H -2.758 3.452 0.900 1.00 . A A . 34 ILE HD11 1 1 19 17955 1 1 34 ILE HD12 H -3.472 2.948 2.432 1.00 . A A . 34 ILE HD12 1 1 19 17956 1 1 34 ILE HD13 H -3.432 4.655 1.998 1.00 . A A . 34 ILE HD13 1 1 19 17957 1 1 34 ILE HG12 H -4.808 3.924 -0.050 1.00 . A A . 34 ILE HG12 1 1 19 17958 1 1 34 ILE HG13 H -5.607 4.082 1.511 1.00 . A A . 34 ILE HG13 1 1 19 17959 1 1 34 ILE HG21 H -3.763 0.986 -0.067 1.00 . A A . 34 ILE HG21 1 1 19 17960 1 1 34 ILE HG22 H -4.625 2.072 -1.159 1.00 . A A . 34 ILE HG22 1 1 19 17961 1 1 34 ILE HG23 H -5.364 0.548 -0.666 1.00 . A A . 34 ILE HG23 1 1 19 17962 1 1 34 ILE N N -7.425 3.020 -0.164 1.00 . A A . 34 ILE N 1 1 19 17963 1 1 34 ILE O O -7.897 3.255 2.541 1.00 . A A . 34 ILE O 1 1 19 17964 1 1 35 PRO C C -7.382 2.120 5.166 1.00 . A A . 35 PRO C 1 1 19 17965 1 1 35 PRO CA C -8.080 1.087 4.288 1.00 . A A . 35 PRO CA 1 1 19 17966 1 1 35 PRO CB C -7.810 -0.329 4.806 1.00 . A A . 35 PRO CB 1 1 19 17967 1 1 35 PRO CD C -7.081 -0.280 2.535 1.00 . A A . 35 PRO CD 1 1 19 17968 1 1 35 PRO CG C -7.692 -1.168 3.582 1.00 . A A . 35 PRO CG 1 1 19 17969 1 1 35 PRO HA H -9.144 1.276 4.290 1.00 . A A . 35 PRO HA 1 1 19 17970 1 1 35 PRO HB2 H -6.895 -0.334 5.380 1.00 . A A . 35 PRO HB2 1 1 19 17971 1 1 35 PRO HB3 H -8.632 -0.652 5.428 1.00 . A A . 35 PRO HB3 1 1 19 17972 1 1 35 PRO HD2 H -6.004 -0.344 2.568 1.00 . A A . 35 PRO HD2 1 1 19 17973 1 1 35 PRO HD3 H -7.447 -0.545 1.554 1.00 . A A . 35 PRO HD3 1 1 19 17974 1 1 35 PRO HG2 H -7.053 -2.015 3.776 1.00 . A A . 35 PRO HG2 1 1 19 17975 1 1 35 PRO HG3 H -8.672 -1.498 3.267 1.00 . A A . 35 PRO HG3 1 1 19 17976 1 1 35 PRO N N -7.543 1.064 2.923 1.00 . A A . 35 PRO N 1 1 19 17977 1 1 35 PRO O O -6.296 2.596 4.835 1.00 . A A . 35 PRO O 1 1 19 17978 1 1 36 GLU C C -6.179 2.927 7.858 1.00 . A A . 36 GLU C 1 1 19 17979 1 1 36 GLU CA C -7.458 3.444 7.206 1.00 . A A . 36 GLU CA 1 1 19 17980 1 1 36 GLU CB C -8.484 3.796 8.286 1.00 . A A . 36 GLU CB 1 1 19 17981 1 1 36 GLU CD C -7.515 4.445 10.525 1.00 . A A . 36 GLU CD 1 1 19 17982 1 1 36 GLU CG C -8.047 4.934 9.193 1.00 . A A . 36 GLU CG 1 1 19 17983 1 1 36 GLU H H -8.878 2.052 6.487 1.00 . A A . 36 GLU H 1 1 19 17984 1 1 36 GLU HA H -7.224 4.335 6.643 1.00 . A A . 36 GLU HA 1 1 19 17985 1 1 36 GLU HB2 H -9.410 4.081 7.807 1.00 . A A . 36 GLU HB2 1 1 19 17986 1 1 36 GLU HB3 H -8.660 2.924 8.897 1.00 . A A . 36 GLU HB3 1 1 19 17987 1 1 36 GLU HG2 H -7.270 5.495 8.696 1.00 . A A . 36 GLU HG2 1 1 19 17988 1 1 36 GLU HG3 H -8.895 5.579 9.374 1.00 . A A . 36 GLU HG3 1 1 19 17989 1 1 36 GLU N N -8.014 2.463 6.281 1.00 . A A . 36 GLU N 1 1 19 17990 1 1 36 GLU O O -5.139 3.585 7.817 1.00 . A A . 36 GLU O 1 1 19 17991 1 1 36 GLU OE1 O -6.585 3.610 10.523 1.00 . A A . 36 GLU OE1 1 1 19 17992 1 1 36 GLU OE2 O -8.028 4.897 11.571 1.00 . A A . 36 GLU OE2 1 1 19 17993 1 1 37 LYS C C -4.045 0.714 8.136 1.00 . A A . 37 LYS C 1 1 19 17994 1 1 37 LYS CA C -5.113 1.149 9.137 1.00 . A A . 37 LYS CA 1 1 19 17995 1 1 37 LYS CB C -5.553 -0.047 9.983 1.00 . A A . 37 LYS CB 1 1 19 17996 1 1 37 LYS CD C -5.637 -2.484 9.341 1.00 . A A . 37 LYS CD 1 1 19 17997 1 1 37 LYS CE C -6.580 -3.483 9.993 1.00 . A A . 37 LYS CE 1 1 19 17998 1 1 37 LYS CG C -6.288 -1.117 9.188 1.00 . A A . 37 LYS CG 1 1 19 17999 1 1 37 LYS H H -7.119 1.273 8.473 1.00 . A A . 37 LYS H 1 1 19 18000 1 1 37 LYS HA H -4.686 1.898 9.787 1.00 . A A . 37 LYS HA 1 1 19 18001 1 1 37 LYS HB2 H -4.680 -0.495 10.431 1.00 . A A . 37 LYS HB2 1 1 19 18002 1 1 37 LYS HB3 H -6.209 0.304 10.766 1.00 . A A . 37 LYS HB3 1 1 19 18003 1 1 37 LYS HD2 H -5.360 -2.851 8.365 1.00 . A A . 37 LYS HD2 1 1 19 18004 1 1 37 LYS HD3 H -4.753 -2.385 9.954 1.00 . A A . 37 LYS HD3 1 1 19 18005 1 1 37 LYS HE2 H -6.061 -4.422 10.117 1.00 . A A . 37 LYS HE2 1 1 19 18006 1 1 37 LYS HE3 H -6.872 -3.104 10.962 1.00 . A A . 37 LYS HE3 1 1 19 18007 1 1 37 LYS HG2 H -7.308 -1.173 9.539 1.00 . A A . 37 LYS HG2 1 1 19 18008 1 1 37 LYS HG3 H -6.282 -0.841 8.143 1.00 . A A . 37 LYS HG3 1 1 19 18009 1 1 37 LYS HZ1 H -8.547 -3.039 9.447 1.00 . A A . 37 LYS HZ1 1 1 19 18010 1 1 37 LYS HZ2 H -8.153 -4.678 9.316 1.00 . A A . 37 LYS HZ2 1 1 19 18011 1 1 37 LYS HZ3 H -7.585 -3.577 8.165 1.00 . A A . 37 LYS HZ3 1 1 19 18012 1 1 37 LYS N N -6.262 1.749 8.468 1.00 . A A . 37 LYS N 1 1 19 18013 1 1 37 LYS NZ N -7.802 -3.710 9.173 1.00 . A A . 37 LYS NZ 1 1 19 18014 1 1 37 LYS O O -2.884 0.526 8.502 1.00 . A A . 37 LYS O 1 1 19 18015 1 1 38 ASP C C -2.666 1.348 5.380 1.00 . A A . 38 ASP C 1 1 19 18016 1 1 38 ASP CA C -3.494 0.154 5.839 1.00 . A A . 38 ASP CA 1 1 19 18017 1 1 38 ASP CB C -4.241 -0.456 4.651 1.00 . A A . 38 ASP CB 1 1 19 18018 1 1 38 ASP CG C -4.898 -1.778 5.001 1.00 . A A . 38 ASP CG 1 1 19 18019 1 1 38 ASP H H -5.370 0.727 6.637 1.00 . A A . 38 ASP H 1 1 19 18020 1 1 38 ASP HA H -2.835 -0.589 6.262 1.00 . A A . 38 ASP HA 1 1 19 18021 1 1 38 ASP HB2 H -5.009 0.229 4.324 1.00 . A A . 38 ASP HB2 1 1 19 18022 1 1 38 ASP HB3 H -3.544 -0.623 3.843 1.00 . A A . 38 ASP HB3 1 1 19 18023 1 1 38 ASP N N -4.434 0.560 6.876 1.00 . A A . 38 ASP N 1 1 19 18024 1 1 38 ASP O O -1.446 1.255 5.244 1.00 . A A . 38 ASP O 1 1 19 18025 1 1 38 ASP OD1 O -5.367 -1.922 6.150 1.00 . A A . 38 ASP OD1 1 1 19 18026 1 1 38 ASP OD2 O -4.944 -2.668 4.126 1.00 . A A . 38 ASP OD2 1 1 19 18027 1 1 39 ALA C C -1.637 4.141 5.747 1.00 . A A . 39 ALA C 1 1 19 18028 1 1 39 ALA CA C -2.668 3.687 4.717 1.00 . A A . 39 ALA CA 1 1 19 18029 1 1 39 ALA CB C -3.686 4.788 4.465 1.00 . A A . 39 ALA CB 1 1 19 18030 1 1 39 ALA H H -4.309 2.481 5.281 1.00 . A A . 39 ALA H 1 1 19 18031 1 1 39 ALA HA H -2.162 3.477 3.787 1.00 . A A . 39 ALA HA 1 1 19 18032 1 1 39 ALA HB1 H -3.204 5.619 3.971 1.00 . A A . 39 ALA HB1 1 1 19 18033 1 1 39 ALA HB2 H -4.097 5.120 5.407 1.00 . A A . 39 ALA HB2 1 1 19 18034 1 1 39 ALA HB3 H -4.480 4.408 3.840 1.00 . A A . 39 ALA HB3 1 1 19 18035 1 1 39 ALA N N -3.338 2.469 5.151 1.00 . A A . 39 ALA N 1 1 19 18036 1 1 39 ALA O O -0.643 4.781 5.403 1.00 . A A . 39 ALA O 1 1 19 18037 1 1 40 TYR C C 0.298 3.333 8.054 1.00 . A A . 40 TYR C 1 1 19 18038 1 1 40 TYR CA C -0.968 4.186 8.086 1.00 . A A . 40 TYR CA 1 1 19 18039 1 1 40 TYR CB C -1.659 4.043 9.445 1.00 . A A . 40 TYR CB 1 1 19 18040 1 1 40 TYR CD1 C -0.437 5.656 10.958 1.00 . A A . 40 TYR CD1 1 1 19 18041 1 1 40 TYR CD2 C -0.221 3.321 11.392 1.00 . A A . 40 TYR CD2 1 1 19 18042 1 1 40 TYR CE1 C 0.389 5.934 12.031 1.00 . A A . 40 TYR CE1 1 1 19 18043 1 1 40 TYR CE2 C 0.604 3.592 12.466 1.00 . A A . 40 TYR CE2 1 1 19 18044 1 1 40 TYR CG C -0.756 4.346 10.622 1.00 . A A . 40 TYR CG 1 1 19 18045 1 1 40 TYR CZ C 0.907 4.900 12.781 1.00 . A A . 40 TYR CZ 1 1 19 18046 1 1 40 TYR H H -2.689 3.297 7.231 1.00 . A A . 40 TYR H 1 1 19 18047 1 1 40 TYR HA H -0.694 5.220 7.940 1.00 . A A . 40 TYR HA 1 1 19 18048 1 1 40 TYR HB2 H -2.496 4.726 9.489 1.00 . A A . 40 TYR HB2 1 1 19 18049 1 1 40 TYR HB3 H -2.018 3.029 9.553 1.00 . A A . 40 TYR HB3 1 1 19 18050 1 1 40 TYR HD1 H -0.844 6.464 10.369 1.00 . A A . 40 TYR HD1 1 1 19 18051 1 1 40 TYR HD2 H -0.460 2.297 11.142 1.00 . A A . 40 TYR HD2 1 1 19 18052 1 1 40 TYR HE1 H 0.626 6.959 12.277 1.00 . A A . 40 TYR HE1 1 1 19 18053 1 1 40 TYR HE2 H 1.010 2.781 13.054 1.00 . A A . 40 TYR HE2 1 1 19 18054 1 1 40 TYR HH H 1.299 4.906 14.663 1.00 . A A . 40 TYR HH 1 1 19 18055 1 1 40 TYR N N -1.879 3.809 7.012 1.00 . A A . 40 TYR N 1 1 19 18056 1 1 40 TYR O O 1.409 3.848 8.178 1.00 . A A . 40 TYR O 1 1 19 18057 1 1 40 TYR OH O 1.730 5.174 13.849 1.00 . A A . 40 TYR OH 1 1 19 18058 1 1 41 ARG C C 2.042 1.265 6.551 1.00 . A A . 41 ARG C 1 1 19 18059 1 1 41 ARG CA C 1.248 1.102 7.843 1.00 . A A . 41 ARG CA 1 1 19 18060 1 1 41 ARG CB C 0.755 -0.339 7.971 1.00 . A A . 41 ARG CB 1 1 19 18061 1 1 41 ARG CD C 0.433 -2.193 9.639 1.00 . A A . 41 ARG CD 1 1 19 18062 1 1 41 ARG CG C 0.295 -0.702 9.374 1.00 . A A . 41 ARG CG 1 1 19 18063 1 1 41 ARG CZ C 2.507 -2.388 10.958 1.00 . A A . 41 ARG CZ 1 1 19 18064 1 1 41 ARG H H -0.789 1.675 7.797 1.00 . A A . 41 ARG H 1 1 19 18065 1 1 41 ARG HA H 1.894 1.328 8.678 1.00 . A A . 41 ARG HA 1 1 19 18066 1 1 41 ARG HB2 H -0.074 -0.487 7.294 1.00 . A A . 41 ARG HB2 1 1 19 18067 1 1 41 ARG HB3 H 1.557 -1.009 7.695 1.00 . A A . 41 ARG HB3 1 1 19 18068 1 1 41 ARG HD2 H -0.553 -2.623 9.730 1.00 . A A . 41 ARG HD2 1 1 19 18069 1 1 41 ARG HD3 H 0.947 -2.650 8.807 1.00 . A A . 41 ARG HD3 1 1 19 18070 1 1 41 ARG HE H 0.669 -2.717 11.662 1.00 . A A . 41 ARG HE 1 1 19 18071 1 1 41 ARG HG2 H 0.895 -0.164 10.090 1.00 . A A . 41 ARG HG2 1 1 19 18072 1 1 41 ARG HG3 H -0.742 -0.420 9.486 1.00 . A A . 41 ARG HG3 1 1 19 18073 1 1 41 ARG HH11 H 2.788 -1.851 9.028 1.00 . A A . 41 ARG HH11 1 1 19 18074 1 1 41 ARG HH12 H 4.231 -1.995 9.976 1.00 . A A . 41 ARG HH12 1 1 19 18075 1 1 41 ARG HH21 H 2.563 -2.906 12.910 1.00 . A A . 41 ARG HH21 1 1 19 18076 1 1 41 ARG HH22 H 4.103 -2.594 12.181 1.00 . A A . 41 ARG HH22 1 1 19 18077 1 1 41 ARG N N 0.121 2.027 7.888 1.00 . A A . 41 ARG N 1 1 19 18078 1 1 41 ARG NE N 1.181 -2.465 10.866 1.00 . A A . 41 ARG NE 1 1 19 18079 1 1 41 ARG NH1 N 3.235 -2.051 9.900 1.00 . A A . 41 ARG NH1 1 1 19 18080 1 1 41 ARG NH2 N 3.106 -2.651 12.111 1.00 . A A . 41 ARG NH2 1 1 19 18081 1 1 41 ARG O O 3.251 1.030 6.520 1.00 . A A . 41 ARG O 1 1 19 18082 1 1 42 LEU C C 3.125 2.878 4.278 1.00 . A A . 42 LEU C 1 1 19 18083 1 1 42 LEU CA C 2.000 1.852 4.188 1.00 . A A . 42 LEU CA 1 1 19 18084 1 1 42 LEU CB C 0.973 2.295 3.145 1.00 . A A . 42 LEU CB 1 1 19 18085 1 1 42 LEU CD1 C -1.291 1.774 2.207 1.00 . A A . 42 LEU CD1 1 1 19 18086 1 1 42 LEU CD2 C 0.696 0.429 1.495 1.00 . A A . 42 LEU CD2 1 1 19 18087 1 1 42 LEU CG C 0.045 1.190 2.640 1.00 . A A . 42 LEU CG 1 1 19 18088 1 1 42 LEU H H 0.395 1.833 5.569 1.00 . A A . 42 LEU H 1 1 19 18089 1 1 42 LEU HA H 2.419 0.905 3.888 1.00 . A A . 42 LEU HA 1 1 19 18090 1 1 42 LEU HB2 H 0.366 3.078 3.577 1.00 . A A . 42 LEU HB2 1 1 19 18091 1 1 42 LEU HB3 H 1.505 2.702 2.297 1.00 . A A . 42 LEU HB3 1 1 19 18092 1 1 42 LEU HD11 H -1.172 2.826 1.991 1.00 . A A . 42 LEU HD11 1 1 19 18093 1 1 42 LEU HD12 H -2.013 1.651 3.001 1.00 . A A . 42 LEU HD12 1 1 19 18094 1 1 42 LEU HD13 H -1.639 1.261 1.321 1.00 . A A . 42 LEU HD13 1 1 19 18095 1 1 42 LEU HD21 H -0.031 -0.230 1.042 1.00 . A A . 42 LEU HD21 1 1 19 18096 1 1 42 LEU HD22 H 1.523 -0.152 1.873 1.00 . A A . 42 LEU HD22 1 1 19 18097 1 1 42 LEU HD23 H 1.055 1.130 0.757 1.00 . A A . 42 LEU HD23 1 1 19 18098 1 1 42 LEU HG H -0.142 0.492 3.443 1.00 . A A . 42 LEU HG 1 1 19 18099 1 1 42 LEU N N 1.357 1.664 5.484 1.00 . A A . 42 LEU N 1 1 19 18100 1 1 42 LEU O O 4.206 2.674 3.726 1.00 . A A . 42 LEU O 1 1 19 18101 1 1 43 GLU C C 5.206 4.451 5.579 1.00 . A A . 43 GLU C 1 1 19 18102 1 1 43 GLU CA C 3.866 5.034 5.138 1.00 . A A . 43 GLU CA 1 1 19 18103 1 1 43 GLU CB C 3.385 6.067 6.159 1.00 . A A . 43 GLU CB 1 1 19 18104 1 1 43 GLU CD C 3.620 8.405 7.086 1.00 . A A . 43 GLU CD 1 1 19 18105 1 1 43 GLU CG C 4.142 7.384 6.093 1.00 . A A . 43 GLU CG 1 1 19 18106 1 1 43 GLU H H 1.989 4.085 5.397 1.00 . A A . 43 GLU H 1 1 19 18107 1 1 43 GLU HA H 3.995 5.517 4.182 1.00 . A A . 43 GLU HA 1 1 19 18108 1 1 43 GLU HB2 H 2.339 6.269 5.984 1.00 . A A . 43 GLU HB2 1 1 19 18109 1 1 43 GLU HB3 H 3.504 5.657 7.151 1.00 . A A . 43 GLU HB3 1 1 19 18110 1 1 43 GLU HG2 H 5.183 7.199 6.307 1.00 . A A . 43 GLU HG2 1 1 19 18111 1 1 43 GLU HG3 H 4.045 7.791 5.097 1.00 . A A . 43 GLU HG3 1 1 19 18112 1 1 43 GLU N N 2.869 3.978 4.978 1.00 . A A . 43 GLU N 1 1 19 18113 1 1 43 GLU O O 6.214 4.588 4.886 1.00 . A A . 43 GLU O 1 1 19 18114 1 1 43 GLU OE1 O 2.471 8.250 7.549 1.00 . A A . 43 GLU OE1 1 1 19 18115 1 1 43 GLU OE2 O 4.362 9.360 7.401 1.00 . A A . 43 GLU OE2 1 1 19 18116 1 1 44 ILE C C 7.031 2.206 6.288 1.00 . A A . 44 ILE C 1 1 19 18117 1 1 44 ILE CA C 6.412 3.190 7.275 1.00 . A A . 44 ILE CA 1 1 19 18118 1 1 44 ILE CB C 6.115 2.456 8.593 1.00 . A A . 44 ILE CB 1 1 19 18119 1 1 44 ILE CD1 C 3.828 3.109 9.489 1.00 . A A . 44 ILE CD1 1 1 19 18120 1 1 44 ILE CG1 C 5.317 3.364 9.529 1.00 . A A . 44 ILE CG1 1 1 19 18121 1 1 44 ILE CG2 C 7.409 2.004 9.252 1.00 . A A . 44 ILE CG2 1 1 19 18122 1 1 44 ILE H H 4.370 3.723 7.243 1.00 . A A . 44 ILE H 1 1 19 18123 1 1 44 ILE HA H 7.118 3.977 7.480 1.00 . A A . 44 ILE HA 1 1 19 18124 1 1 44 ILE HB H 5.528 1.579 8.366 1.00 . A A . 44 ILE HB 1 1 19 18125 1 1 44 ILE HD11 H 3.590 2.521 8.616 1.00 . A A . 44 ILE HD11 1 1 19 18126 1 1 44 ILE HD12 H 3.305 4.053 9.443 1.00 . A A . 44 ILE HD12 1 1 19 18127 1 1 44 ILE HD13 H 3.531 2.574 10.378 1.00 . A A . 44 ILE HD13 1 1 19 18128 1 1 44 ILE HG12 H 5.651 3.210 10.538 1.00 . A A . 44 ILE HG12 1 1 19 18129 1 1 44 ILE HG13 H 5.486 4.394 9.251 1.00 . A A . 44 ILE HG13 1 1 19 18130 1 1 44 ILE HG21 H 7.190 1.575 10.218 1.00 . A A . 44 ILE HG21 1 1 19 18131 1 1 44 ILE HG22 H 8.067 2.850 9.373 1.00 . A A . 44 ILE HG22 1 1 19 18132 1 1 44 ILE HG23 H 7.888 1.261 8.630 1.00 . A A . 44 ILE HG23 1 1 19 18133 1 1 44 ILE N N 5.206 3.798 6.736 1.00 . A A . 44 ILE N 1 1 19 18134 1 1 44 ILE O O 8.239 2.218 6.059 1.00 . A A . 44 ILE O 1 1 19 18135 1 1 45 VAL C C 7.243 1.011 3.503 1.00 . A A . 45 VAL C 1 1 19 18136 1 1 45 VAL CA C 6.656 0.355 4.749 1.00 . A A . 45 VAL CA 1 1 19 18137 1 1 45 VAL CB C 5.523 -0.587 4.329 1.00 . A A . 45 VAL CB 1 1 19 18138 1 1 45 VAL CG1 C 6.066 -1.744 3.506 1.00 . A A . 45 VAL CG1 1 1 19 18139 1 1 45 VAL CG2 C 4.760 -1.092 5.547 1.00 . A A . 45 VAL CG2 1 1 19 18140 1 1 45 VAL H H 5.240 1.389 5.935 1.00 . A A . 45 VAL H 1 1 19 18141 1 1 45 VAL HA H 7.413 -0.234 5.221 1.00 . A A . 45 VAL HA 1 1 19 18142 1 1 45 VAL HB H 4.849 -0.028 3.716 1.00 . A A . 45 VAL HB 1 1 19 18143 1 1 45 VAL HG11 H 6.882 -2.211 4.037 1.00 . A A . 45 VAL HG11 1 1 19 18144 1 1 45 VAL HG12 H 6.420 -1.375 2.554 1.00 . A A . 45 VAL HG12 1 1 19 18145 1 1 45 VAL HG13 H 5.281 -2.467 3.342 1.00 . A A . 45 VAL HG13 1 1 19 18146 1 1 45 VAL HG21 H 5.133 -0.604 6.434 1.00 . A A . 45 VAL HG21 1 1 19 18147 1 1 45 VAL HG22 H 4.895 -2.161 5.638 1.00 . A A . 45 VAL HG22 1 1 19 18148 1 1 45 VAL HG23 H 3.710 -0.870 5.428 1.00 . A A . 45 VAL HG23 1 1 19 18149 1 1 45 VAL N N 6.192 1.350 5.709 1.00 . A A . 45 VAL N 1 1 19 18150 1 1 45 VAL O O 8.204 0.507 2.922 1.00 . A A . 45 VAL O 1 1 19 18151 1 1 46 THR C C 8.228 3.845 2.264 1.00 . A A . 46 THR C 1 1 19 18152 1 1 46 THR CA C 7.119 2.849 1.920 1.00 . A A . 46 THR CA 1 1 19 18153 1 1 46 THR CB C 5.945 3.583 1.277 1.00 . A A . 46 THR CB 1 1 19 18154 1 1 46 THR CG2 C 4.868 2.654 0.758 1.00 . A A . 46 THR CG2 1 1 19 18155 1 1 46 THR H H 5.896 2.483 3.594 1.00 . A A . 46 THR H 1 1 19 18156 1 1 46 THR HA H 7.505 2.126 1.218 1.00 . A A . 46 THR HA 1 1 19 18157 1 1 46 THR HB H 6.311 4.159 0.447 1.00 . A A . 46 THR HB 1 1 19 18158 1 1 46 THR HG1 H 4.846 3.972 2.852 1.00 . A A . 46 THR HG1 1 1 19 18159 1 1 46 THR HG21 H 3.896 3.059 0.999 1.00 . A A . 46 THR HG21 1 1 19 18160 1 1 46 THR HG22 H 4.977 1.683 1.219 1.00 . A A . 46 THR HG22 1 1 19 18161 1 1 46 THR HG23 H 4.963 2.556 -0.314 1.00 . A A . 46 THR HG23 1 1 19 18162 1 1 46 THR N N 6.658 2.131 3.096 1.00 . A A . 46 THR N 1 1 19 18163 1 1 46 THR O O 8.592 4.686 1.442 1.00 . A A . 46 THR O 1 1 19 18164 1 1 46 THR OG1 O 5.341 4.473 2.199 1.00 . A A . 46 THR OG1 1 1 19 18165 1 1 47 ALA C C 9.365 6.095 3.905 1.00 . A A . 47 ALA C 1 1 19 18166 1 1 47 ALA CA C 9.830 4.642 3.914 1.00 . A A . 47 ALA CA 1 1 19 18167 1 1 47 ALA CB C 11.056 4.471 3.031 1.00 . A A . 47 ALA CB 1 1 19 18168 1 1 47 ALA H H 8.439 3.059 4.094 1.00 . A A . 47 ALA H 1 1 19 18169 1 1 47 ALA HA H 10.102 4.368 4.923 1.00 . A A . 47 ALA HA 1 1 19 18170 1 1 47 ALA HB1 H 11.762 5.262 3.238 1.00 . A A . 47 ALA HB1 1 1 19 18171 1 1 47 ALA HB2 H 10.761 4.515 1.993 1.00 . A A . 47 ALA HB2 1 1 19 18172 1 1 47 ALA HB3 H 11.516 3.515 3.235 1.00 . A A . 47 ALA HB3 1 1 19 18173 1 1 47 ALA N N 8.765 3.746 3.477 1.00 . A A . 47 ALA N 1 1 19 18174 1 1 47 ALA O O 10.169 7.011 3.730 1.00 . A A . 47 ALA O 1 1 19 18175 1 1 48 GLY C C 7.237 8.169 2.712 1.00 . A A . 48 GLY C 1 1 19 18176 1 1 48 GLY CA C 7.520 7.642 4.105 1.00 . A A . 48 GLY CA 1 1 19 18177 1 1 48 GLY H H 7.473 5.529 4.230 1.00 . A A . 48 GLY H 1 1 19 18178 1 1 48 GLY HA2 H 6.600 7.640 4.671 1.00 . A A . 48 GLY HA2 1 1 19 18179 1 1 48 GLY HA3 H 8.225 8.301 4.591 1.00 . A A . 48 GLY HA3 1 1 19 18180 1 1 48 GLY N N 8.066 6.298 4.094 1.00 . A A . 48 GLY N 1 1 19 18181 1 1 48 GLY O O 7.301 9.375 2.474 1.00 . A A . 48 GLY O 1 1 19 18182 1 1 49 ALA C C 5.226 8.239 0.302 1.00 . A A . 49 ALA C 1 1 19 18183 1 1 49 ALA CA C 6.627 7.649 0.415 1.00 . A A . 49 ALA CA 1 1 19 18184 1 1 49 ALA CB C 6.774 6.453 -0.513 1.00 . A A . 49 ALA CB 1 1 19 18185 1 1 49 ALA H H 6.885 6.318 2.040 1.00 . A A . 49 ALA H 1 1 19 18186 1 1 49 ALA HA H 7.347 8.397 0.115 1.00 . A A . 49 ALA HA 1 1 19 18187 1 1 49 ALA HB1 H 6.943 6.798 -1.522 1.00 . A A . 49 ALA HB1 1 1 19 18188 1 1 49 ALA HB2 H 5.871 5.860 -0.481 1.00 . A A . 49 ALA HB2 1 1 19 18189 1 1 49 ALA HB3 H 7.611 5.850 -0.192 1.00 . A A . 49 ALA HB3 1 1 19 18190 1 1 49 ALA N N 6.922 7.265 1.789 1.00 . A A . 49 ALA N 1 1 19 18191 1 1 49 ALA O O 5.015 9.237 -0.388 1.00 . A A . 49 ALA O 1 1 19 18192 1 1 50 LEU C C 2.508 8.708 2.299 1.00 . A A . 50 LEU C 1 1 19 18193 1 1 50 LEU CA C 2.889 8.079 0.963 1.00 . A A . 50 LEU CA 1 1 19 18194 1 1 50 LEU CB C 1.945 6.917 0.644 1.00 . A A . 50 LEU CB 1 1 19 18195 1 1 50 LEU CD1 C 0.923 5.357 -1.032 1.00 . A A . 50 LEU CD1 1 1 19 18196 1 1 50 LEU CD2 C 1.488 7.704 -1.692 1.00 . A A . 50 LEU CD2 1 1 19 18197 1 1 50 LEU CG C 1.889 6.515 -0.831 1.00 . A A . 50 LEU CG 1 1 19 18198 1 1 50 LEU H H 4.502 6.826 1.516 1.00 . A A . 50 LEU H 1 1 19 18199 1 1 50 LEU HA H 2.801 8.826 0.188 1.00 . A A . 50 LEU HA 1 1 19 18200 1 1 50 LEU HB2 H 2.259 6.059 1.218 1.00 . A A . 50 LEU HB2 1 1 19 18201 1 1 50 LEU HB3 H 0.949 7.194 0.955 1.00 . A A . 50 LEU HB3 1 1 19 18202 1 1 50 LEU HD11 H 1.466 4.425 -0.992 1.00 . A A . 50 LEU HD11 1 1 19 18203 1 1 50 LEU HD12 H 0.442 5.454 -1.994 1.00 . A A . 50 LEU HD12 1 1 19 18204 1 1 50 LEU HD13 H 0.176 5.373 -0.252 1.00 . A A . 50 LEU HD13 1 1 19 18205 1 1 50 LEU HD21 H 2.374 8.213 -2.038 1.00 . A A . 50 LEU HD21 1 1 19 18206 1 1 50 LEU HD22 H 0.886 8.384 -1.107 1.00 . A A . 50 LEU HD22 1 1 19 18207 1 1 50 LEU HD23 H 0.916 7.356 -2.540 1.00 . A A . 50 LEU HD23 1 1 19 18208 1 1 50 LEU HG H 2.870 6.189 -1.146 1.00 . A A . 50 LEU HG 1 1 19 18209 1 1 50 LEU N N 4.272 7.616 0.983 1.00 . A A . 50 LEU N 1 1 19 18210 1 1 50 LEU O O 2.656 8.089 3.352 1.00 . A A . 50 LEU O 1 1 19 18211 1 1 51 LYS C C 0.218 10.245 3.897 1.00 . A A . 51 LYS C 1 1 19 18212 1 1 51 LYS CA C 1.620 10.656 3.456 1.00 . A A . 51 LYS CA 1 1 19 18213 1 1 51 LYS CB C 1.671 12.167 3.223 1.00 . A A . 51 LYS CB 1 1 19 18214 1 1 51 LYS CD C 1.986 12.867 0.831 1.00 . A A . 51 LYS CD 1 1 19 18215 1 1 51 LYS CE C 1.589 14.068 -0.013 1.00 . A A . 51 LYS CE 1 1 19 18216 1 1 51 LYS CG C 0.984 12.612 1.943 1.00 . A A . 51 LYS CG 1 1 19 18217 1 1 51 LYS H H 1.926 10.384 1.379 1.00 . A A . 51 LYS H 1 1 19 18218 1 1 51 LYS HA H 2.318 10.397 4.237 1.00 . A A . 51 LYS HA 1 1 19 18219 1 1 51 LYS HB2 H 1.193 12.663 4.055 1.00 . A A . 51 LYS HB2 1 1 19 18220 1 1 51 LYS HB3 H 2.705 12.476 3.179 1.00 . A A . 51 LYS HB3 1 1 19 18221 1 1 51 LYS HD2 H 2.956 13.054 1.269 1.00 . A A . 51 LYS HD2 1 1 19 18222 1 1 51 LYS HD3 H 2.039 11.994 0.197 1.00 . A A . 51 LYS HD3 1 1 19 18223 1 1 51 LYS HE2 H 0.896 13.743 -0.775 1.00 . A A . 51 LYS HE2 1 1 19 18224 1 1 51 LYS HE3 H 1.107 14.795 0.624 1.00 . A A . 51 LYS HE3 1 1 19 18225 1 1 51 LYS HG2 H 0.299 11.839 1.627 1.00 . A A . 51 LYS HG2 1 1 19 18226 1 1 51 LYS HG3 H 0.436 13.523 2.140 1.00 . A A . 51 LYS HG3 1 1 19 18227 1 1 51 LYS HZ1 H 3.094 15.514 -0.110 1.00 . A A . 51 LYS HZ1 1 1 19 18228 1 1 51 LYS HZ2 H 2.511 15.030 -1.622 1.00 . A A . 51 LYS HZ2 1 1 19 18229 1 1 51 LYS HZ3 H 3.544 14.013 -0.750 1.00 . A A . 51 LYS HZ3 1 1 19 18230 1 1 51 LYS N N 2.018 9.942 2.248 1.00 . A A . 51 LYS N 1 1 19 18231 1 1 51 LYS NZ N 2.766 14.702 -0.670 1.00 . A A . 51 LYS NZ 1 1 19 18232 1 1 51 LYS O O -0.776 10.641 3.287 1.00 . A A . 51 LYS O 1 1 19 18233 1 1 52 TYR C C -1.946 10.162 6.029 1.00 . A A . 52 TYR C 1 1 19 18234 1 1 52 TYR CA C -1.132 8.990 5.488 1.00 . A A . 52 TYR CA 1 1 19 18235 1 1 52 TYR CB C -0.902 7.951 6.590 1.00 . A A . 52 TYR CB 1 1 19 18236 1 1 52 TYR CD1 C -3.266 7.067 6.751 1.00 . A A . 52 TYR CD1 1 1 19 18237 1 1 52 TYR CD2 C -2.195 7.797 8.752 1.00 . A A . 52 TYR CD2 1 1 19 18238 1 1 52 TYR CE1 C -4.398 6.741 7.470 1.00 . A A . 52 TYR CE1 1 1 19 18239 1 1 52 TYR CE2 C -3.325 7.475 9.478 1.00 . A A . 52 TYR CE2 1 1 19 18240 1 1 52 TYR CG C -2.146 7.600 7.378 1.00 . A A . 52 TYR CG 1 1 19 18241 1 1 52 TYR CZ C -4.424 6.948 8.833 1.00 . A A . 52 TYR CZ 1 1 19 18242 1 1 52 TYR H H 0.976 9.173 5.404 1.00 . A A . 52 TYR H 1 1 19 18243 1 1 52 TYR HA H -1.677 8.529 4.678 1.00 . A A . 52 TYR HA 1 1 19 18244 1 1 52 TYR HB2 H -0.528 7.043 6.144 1.00 . A A . 52 TYR HB2 1 1 19 18245 1 1 52 TYR HB3 H -0.167 8.333 7.283 1.00 . A A . 52 TYR HB3 1 1 19 18246 1 1 52 TYR HD1 H -3.246 6.911 5.684 1.00 . A A . 52 TYR HD1 1 1 19 18247 1 1 52 TYR HD2 H -1.335 8.211 9.254 1.00 . A A . 52 TYR HD2 1 1 19 18248 1 1 52 TYR HE1 H -5.256 6.327 6.964 1.00 . A A . 52 TYR HE1 1 1 19 18249 1 1 52 TYR HE2 H -3.346 7.638 10.545 1.00 . A A . 52 TYR HE2 1 1 19 18250 1 1 52 TYR HH H -5.449 5.745 9.927 1.00 . A A . 52 TYR HH 1 1 19 18251 1 1 52 TYR N N 0.147 9.452 4.960 1.00 . A A . 52 TYR N 1 1 19 18252 1 1 52 TYR O O -1.420 11.023 6.734 1.00 . A A . 52 TYR O 1 1 19 18253 1 1 52 TYR OH O -5.550 6.624 9.554 1.00 . A A . 52 TYR OH 1 1 19 18254 1 1 53 GLN C C -5.397 10.686 6.743 1.00 . A A . 53 GLN C 1 1 19 18255 1 1 53 GLN CA C -4.115 11.255 6.145 1.00 . A A . 53 GLN CA 1 1 19 18256 1 1 53 GLN CB C -4.455 12.194 4.985 1.00 . A A . 53 GLN CB 1 1 19 18257 1 1 53 GLN CD C -2.871 14.093 4.472 1.00 . A A . 53 GLN CD 1 1 19 18258 1 1 53 GLN CG C -3.241 12.651 4.194 1.00 . A A . 53 GLN CG 1 1 19 18259 1 1 53 GLN H H -3.594 9.474 5.127 1.00 . A A . 53 GLN H 1 1 19 18260 1 1 53 GLN HA H -3.595 11.814 6.907 1.00 . A A . 53 GLN HA 1 1 19 18261 1 1 53 GLN HB2 H -5.126 11.684 4.310 1.00 . A A . 53 GLN HB2 1 1 19 18262 1 1 53 GLN HB3 H -4.951 13.069 5.379 1.00 . A A . 53 GLN HB3 1 1 19 18263 1 1 53 GLN HE21 H -2.571 14.418 2.533 1.00 . A A . 53 GLN HE21 1 1 19 18264 1 1 53 GLN HE22 H -2.309 15.774 3.571 1.00 . A A . 53 GLN HE22 1 1 19 18265 1 1 53 GLN HG2 H -2.400 12.024 4.454 1.00 . A A . 53 GLN HG2 1 1 19 18266 1 1 53 GLN HG3 H -3.452 12.546 3.140 1.00 . A A . 53 GLN HG3 1 1 19 18267 1 1 53 GLN N N -3.231 10.189 5.692 1.00 . A A . 53 GLN N 1 1 19 18268 1 1 53 GLN NE2 N -2.551 14.837 3.419 1.00 . A A . 53 GLN NE2 1 1 19 18269 1 1 53 GLN O O -6.299 10.264 6.019 1.00 . A A . 53 GLN O 1 1 19 18270 1 1 53 GLN OE1 O -2.873 14.537 5.621 1.00 . A A . 53 GLN OE1 1 1 19 18271 1 1 54 GLU C C -7.900 10.945 8.372 1.00 . A A . 54 GLU C 1 1 19 18272 1 1 54 GLU CA C -6.646 10.168 8.767 1.00 . A A . 54 GLU CA 1 1 19 18273 1 1 54 GLU CB C -6.437 10.245 10.282 1.00 . A A . 54 GLU CB 1 1 19 18274 1 1 54 GLU CD C -6.545 8.907 12.422 1.00 . A A . 54 GLU CD 1 1 19 18275 1 1 54 GLU CG C -6.241 8.887 10.937 1.00 . A A . 54 GLU CG 1 1 19 18276 1 1 54 GLU H H -4.723 11.035 8.593 1.00 . A A . 54 GLU H 1 1 19 18277 1 1 54 GLU HA H -6.774 9.135 8.482 1.00 . A A . 54 GLU HA 1 1 19 18278 1 1 54 GLU HB2 H -5.564 10.846 10.483 1.00 . A A . 54 GLU HB2 1 1 19 18279 1 1 54 GLU HB3 H -7.300 10.716 10.732 1.00 . A A . 54 GLU HB3 1 1 19 18280 1 1 54 GLU HG2 H -6.896 8.175 10.461 1.00 . A A . 54 GLU HG2 1 1 19 18281 1 1 54 GLU HG3 H -5.215 8.580 10.799 1.00 . A A . 54 GLU HG3 1 1 19 18282 1 1 54 GLU N N -5.473 10.682 8.070 1.00 . A A . 54 GLU N 1 1 19 18283 1 1 54 GLU O O -9.017 10.443 8.502 1.00 . A A . 54 GLU O 1 1 19 18284 1 1 54 GLU OE1 O -5.867 9.655 13.157 1.00 . A A . 54 GLU OE1 1 1 19 18285 1 1 54 GLU OE2 O -7.461 8.173 12.849 1.00 . A A . 54 GLU OE2 1 1 19 18286 1 1 55 ASN C C -9.665 12.313 6.408 1.00 . A A . 55 ASN C 1 1 19 18287 1 1 55 ASN CA C -8.832 13.009 7.478 1.00 . A A . 55 ASN CA 1 1 19 18288 1 1 55 ASN CB C -8.327 14.356 6.955 1.00 . A A . 55 ASN CB 1 1 19 18289 1 1 55 ASN CG C -7.163 14.209 5.994 1.00 . A A . 55 ASN CG 1 1 19 18290 1 1 55 ASN H H -6.798 12.520 7.809 1.00 . A A . 55 ASN H 1 1 19 18291 1 1 55 ASN HA H -9.450 13.178 8.344 1.00 . A A . 55 ASN HA 1 1 19 18292 1 1 55 ASN HB2 H -9.132 14.860 6.441 1.00 . A A . 55 ASN HB2 1 1 19 18293 1 1 55 ASN HB3 H -8.006 14.961 7.791 1.00 . A A . 55 ASN HB3 1 1 19 18294 1 1 55 ASN HD21 H -6.229 15.741 6.855 1.00 . A A . 55 ASN HD21 1 1 19 18295 1 1 55 ASN HD22 H -5.396 14.997 5.536 1.00 . A A . 55 ASN HD22 1 1 19 18296 1 1 55 ASN N N -7.710 12.171 7.889 1.00 . A A . 55 ASN N 1 1 19 18297 1 1 55 ASN ND2 N -6.162 15.069 6.143 1.00 . A A . 55 ASN ND2 1 1 19 18298 1 1 55 ASN O O -10.880 12.458 6.369 1.00 . A A . 55 ASN O 1 1 19 18299 1 1 55 ASN OD1 O -7.165 13.335 5.129 1.00 . A A . 55 ASN OD1 1 1 19 18300 1 1 56 ALA C C -10.040 9.415 4.923 1.00 . A A . 56 ALA C 1 1 19 18301 1 1 56 ALA CA C -9.683 10.831 4.481 1.00 . A A . 56 ALA CA 1 1 19 18302 1 1 56 ALA CB C -8.817 10.787 3.231 1.00 . A A . 56 ALA CB 1 1 19 18303 1 1 56 ALA H H -8.026 11.474 5.629 1.00 . A A . 56 ALA H 1 1 19 18304 1 1 56 ALA HA H -10.590 11.366 4.243 1.00 . A A . 56 ALA HA 1 1 19 18305 1 1 56 ALA HB1 H -9.068 11.621 2.591 1.00 . A A . 56 ALA HB1 1 1 19 18306 1 1 56 ALA HB2 H -8.993 9.862 2.703 1.00 . A A . 56 ALA HB2 1 1 19 18307 1 1 56 ALA HB3 H -7.777 10.849 3.512 1.00 . A A . 56 ALA HB3 1 1 19 18308 1 1 56 ALA N N -9.001 11.554 5.545 1.00 . A A . 56 ALA N 1 1 19 18309 1 1 56 ALA O O -10.400 8.571 4.100 1.00 . A A . 56 ALA O 1 1 19 18310 1 1 57 TYR C C -11.030 7.971 8.095 1.00 . A A . 57 TYR C 1 1 19 18311 1 1 57 TYR CA C -10.270 7.846 6.773 1.00 . A A . 57 TYR CA 1 1 19 18312 1 1 57 TYR CB C -8.998 7.036 6.975 1.00 . A A . 57 TYR CB 1 1 19 18313 1 1 57 TYR CD1 C -8.652 6.136 4.646 1.00 . A A . 57 TYR CD1 1 1 19 18314 1 1 57 TYR CD2 C -6.933 7.489 5.592 1.00 . A A . 57 TYR CD2 1 1 19 18315 1 1 57 TYR CE1 C -7.910 5.994 3.489 1.00 . A A . 57 TYR CE1 1 1 19 18316 1 1 57 TYR CE2 C -6.184 7.351 4.438 1.00 . A A . 57 TYR CE2 1 1 19 18317 1 1 57 TYR CG C -8.179 6.885 5.714 1.00 . A A . 57 TYR CG 1 1 19 18318 1 1 57 TYR CZ C -6.678 6.603 3.391 1.00 . A A . 57 TYR CZ 1 1 19 18319 1 1 57 TYR H H -9.669 9.868 6.836 1.00 . A A . 57 TYR H 1 1 19 18320 1 1 57 TYR HA H -10.900 7.336 6.060 1.00 . A A . 57 TYR HA 1 1 19 18321 1 1 57 TYR HB2 H -8.382 7.525 7.715 1.00 . A A . 57 TYR HB2 1 1 19 18322 1 1 57 TYR HB3 H -9.256 6.047 7.324 1.00 . A A . 57 TYR HB3 1 1 19 18323 1 1 57 TYR HD1 H -9.618 5.661 4.725 1.00 . A A . 57 TYR HD1 1 1 19 18324 1 1 57 TYR HD2 H -6.548 8.075 6.414 1.00 . A A . 57 TYR HD2 1 1 19 18325 1 1 57 TYR HE1 H -8.297 5.407 2.669 1.00 . A A . 57 TYR HE1 1 1 19 18326 1 1 57 TYR HE2 H -5.219 7.828 4.361 1.00 . A A . 57 TYR HE2 1 1 19 18327 1 1 57 TYR HH H -5.224 5.836 2.394 1.00 . A A . 57 TYR HH 1 1 19 18328 1 1 57 TYR N N -9.958 9.159 6.227 1.00 . A A . 57 TYR N 1 1 19 18329 1 1 57 TYR O O -11.020 7.054 8.917 1.00 . A A . 57 TYR O 1 1 19 18330 1 1 57 TYR OH O -5.936 6.462 2.241 1.00 . A A . 57 TYR OH 1 1 19 18331 1 1 58 ARG C C -13.860 9.828 9.193 1.00 . A A . 58 ARG C 1 1 19 18332 1 1 58 ARG CA C -12.440 9.354 9.517 1.00 . A A . 58 ARG CA 1 1 19 18333 1 1 58 ARG CB C -11.730 10.393 10.387 1.00 . A A . 58 ARG CB 1 1 19 18334 1 1 58 ARG CD C -10.710 10.626 12.671 1.00 . A A . 58 ARG CD 1 1 19 18335 1 1 58 ARG CG C -10.780 9.784 11.408 1.00 . A A . 58 ARG CG 1 1 19 18336 1 1 58 ARG CZ C -9.204 10.843 14.605 1.00 . A A . 58 ARG CZ 1 1 19 18337 1 1 58 ARG H H -11.660 9.805 7.605 1.00 . A A . 58 ARG H 1 1 19 18338 1 1 58 ARG HA H -12.500 8.424 10.060 1.00 . A A . 58 ARG HA 1 1 19 18339 1 1 58 ARG HB2 H -11.160 11.050 9.747 1.00 . A A . 58 ARG HB2 1 1 19 18340 1 1 58 ARG HB3 H -12.470 10.973 10.915 1.00 . A A . 58 ARG HB3 1 1 19 18341 1 1 58 ARG HD2 H -10.460 11.640 12.400 1.00 . A A . 58 ARG HD2 1 1 19 18342 1 1 58 ARG HD3 H -11.680 10.614 13.153 1.00 . A A . 58 ARG HD3 1 1 19 18343 1 1 58 ARG HE H -9.408 9.201 13.491 1.00 . A A . 58 ARG HE 1 1 19 18344 1 1 58 ARG HG2 H -11.130 8.796 11.667 1.00 . A A . 58 ARG HG2 1 1 19 18345 1 1 58 ARG HG3 H -9.800 9.716 10.976 1.00 . A A . 58 ARG HG3 1 1 19 18346 1 1 58 ARG HH11 H -10.280 12.505 14.194 1.00 . A A . 58 ARG HH11 1 1 19 18347 1 1 58 ARG HH12 H -9.209 12.632 15.548 1.00 . A A . 58 ARG HH12 1 1 19 18348 1 1 58 ARG HH21 H -7.998 9.365 15.272 1.00 . A A . 58 ARG HH21 1 1 19 18349 1 1 58 ARG HH22 H -7.912 10.849 16.159 1.00 . A A . 58 ARG HH22 1 1 19 18350 1 1 58 ARG N N -11.680 9.111 8.295 1.00 . A A . 58 ARG N 1 1 19 18351 1 1 58 ARG NE N -9.715 10.123 13.610 1.00 . A A . 58 ARG NE 1 1 19 18352 1 1 58 ARG NH1 N -9.597 12.097 14.798 1.00 . A A . 58 ARG NH1 1 1 19 18353 1 1 58 ARG NH2 N -8.296 10.308 15.412 1.00 . A A . 58 ARG NH2 1 1 19 18354 1 1 58 ARG O O -14.460 10.580 9.958 1.00 . A A . 58 ARG O 1 1 19 18355 1 1 59 GLN C C -16.630 8.536 7.535 1.00 . A A . 59 GLN C 1 1 19 18356 1 1 59 GLN CA C -15.720 9.759 7.632 1.00 . A A . 59 GLN CA 1 1 19 18357 1 1 59 GLN CB C -15.670 10.480 6.282 1.00 . A A . 59 GLN CB 1 1 19 18358 1 1 59 GLN CD C -14.380 12.594 5.775 1.00 . A A . 59 GLN CD 1 1 19 18359 1 1 59 GLN CG C -15.620 11.995 6.402 1.00 . A A . 59 GLN CG 1 1 19 18360 1 1 59 GLN H H -13.850 8.783 7.488 1.00 . A A . 59 GLN H 1 1 19 18361 1 1 59 GLN HA H -16.130 10.434 8.372 1.00 . A A . 59 GLN HA 1 1 19 18362 1 1 59 GLN HB2 H -14.790 10.154 5.748 1.00 . A A . 59 GLN HB2 1 1 19 18363 1 1 59 GLN HB3 H -16.540 10.212 5.709 1.00 . A A . 59 GLN HB3 1 1 19 18364 1 1 59 GLN HE21 H -13.740 13.192 7.559 1.00 . A A . 59 GLN HE21 1 1 19 18365 1 1 59 GLN HE22 H -12.710 13.574 6.226 1.00 . A A . 59 GLN HE22 1 1 19 18366 1 1 59 GLN HG2 H -16.490 12.408 5.908 1.00 . A A . 59 GLN HG2 1 1 19 18367 1 1 59 GLN HG3 H -15.640 12.261 7.447 1.00 . A A . 59 GLN HG3 1 1 19 18368 1 1 59 GLN N N -14.380 9.381 8.056 1.00 . A A . 59 GLN N 1 1 19 18369 1 1 59 GLN NE2 N -13.520 13.179 6.604 1.00 . A A . 59 GLN NE2 1 1 19 18370 1 1 59 GLN O O -16.940 8.066 6.441 1.00 . A A . 59 GLN O 1 1 19 18371 1 1 59 GLN OE1 O -14.190 12.531 4.561 1.00 . A A . 59 GLN OE1 1 1 19 18372 1 1 60 ALA C C -19.310 7.230 9.232 1.00 . A A . 60 ALA C 1 1 19 18373 1 1 60 ALA CA C -17.920 6.857 8.733 1.00 . A A . 60 ALA CA 1 1 19 18374 1 1 60 ALA CB C -17.310 5.780 9.619 1.00 . A A . 60 ALA CB 1 1 19 18375 1 1 60 ALA H H -16.770 8.445 9.527 1.00 . A A . 60 ALA H 1 1 19 18376 1 1 60 ALA HA H -18.000 6.462 7.731 1.00 . A A . 60 ALA HA 1 1 19 18377 1 1 60 ALA HB1 H -16.680 6.240 10.365 1.00 . A A . 60 ALA HB1 1 1 19 18378 1 1 60 ALA HB2 H -16.720 5.108 9.014 1.00 . A A . 60 ALA HB2 1 1 19 18379 1 1 60 ALA HB3 H -18.100 5.225 10.106 1.00 . A A . 60 ALA HB3 1 1 19 18380 1 1 60 ALA N N -17.050 8.025 8.688 1.00 . A A . 60 ALA N 1 1 19 18381 1 1 60 ALA O O -20.310 6.638 8.819 1.00 . A A . 60 ALA O 1 1 19 18382 1 1 61 ALA C C -20.950 10.092 10.243 1.00 . A A . 61 ALA C 1 1 19 18383 1 1 61 ALA CA C -20.640 8.665 10.679 1.00 . A A . 61 ALA CA 1 1 19 18384 1 1 61 ALA CB C -20.620 8.569 12.197 1.00 . A A . 61 ALA CB 1 1 19 18385 1 1 61 ALA H H -18.540 8.647 10.414 1.00 . A A . 61 ALA H 1 1 19 18386 1 1 61 ALA HA H -21.420 8.008 10.313 1.00 . A A . 61 ALA HA 1 1 19 18387 1 1 61 ALA HB1 H -20.390 9.538 12.615 1.00 . A A . 61 ALA HB1 1 1 19 18388 1 1 61 ALA HB2 H -19.860 7.860 12.501 1.00 . A A . 61 ALA HB2 1 1 19 18389 1 1 61 ALA HB3 H -21.580 8.240 12.551 1.00 . A A . 61 ALA HB3 1 1 19 18390 1 1 61 ALA N N -19.370 8.213 10.124 1.00 . A A . 61 ALA N 1 1 19 18391 1 1 61 ALA O O -22.100 10.344 9.827 1.00 . A A . 61 ALA O 1 1 19 18392 1 1 61 ALA OXT O -20.040 10.946 10.321 1.00 . A A . 61 ALA OXT 1 1 20 18393 1 1 1 MET C C -5.038 6.728 -0.906 1.00 . A A . 1 MET C 1 1 20 18394 1 1 1 MET CA C -4.292 7.732 -0.032 1.00 . A A . 1 MET CA 1 1 20 18395 1 1 1 MET CB C -2.780 7.545 -0.183 1.00 . A A . 1 MET CB 1 1 20 18396 1 1 1 MET CE C -0.235 6.065 2.515 1.00 . A A . 1 MET CE 1 1 20 18397 1 1 1 MET CG C -2.223 6.372 0.606 1.00 . A A . 1 MET CG 1 1 20 18398 1 1 1 MET H1 H -4.075 8.236 1.952 1.00 . A A . 1 MET H1 1 1 20 18399 1 1 1 MET H2 H -4.451 6.584 1.670 1.00 . A A . 1 MET H2 1 1 20 18400 1 1 1 MET H3 H -5.665 7.785 1.500 1.00 . A A . 1 MET H3 1 1 20 18401 1 1 1 MET HA H -4.558 8.732 -0.340 1.00 . A A . 1 MET HA 1 1 20 18402 1 1 1 MET HB2 H -2.551 7.389 -1.227 1.00 . A A . 1 MET HB2 1 1 20 18403 1 1 1 MET HB3 H -2.283 8.445 0.152 1.00 . A A . 1 MET HB3 1 1 20 18404 1 1 1 MET HE1 H -0.210 5.483 3.423 1.00 . A A . 1 MET HE1 1 1 20 18405 1 1 1 MET HE2 H 0.509 6.845 2.565 1.00 . A A . 1 MET HE2 1 1 20 18406 1 1 1 MET HE3 H -0.026 5.423 1.670 1.00 . A A . 1 MET HE3 1 1 20 18407 1 1 1 MET HG2 H -2.950 5.574 0.597 1.00 . A A . 1 MET HG2 1 1 20 18408 1 1 1 MET HG3 H -1.314 6.033 0.131 1.00 . A A . 1 MET HG3 1 1 20 18409 1 1 1 MET N N -4.653 7.569 1.401 1.00 . A A . 1 MET N 1 1 20 18410 1 1 1 MET O O -5.703 5.822 -0.403 1.00 . A A . 1 MET O 1 1 20 18411 1 1 1 MET SD S -1.857 6.798 2.319 1.00 . A A . 1 MET SD 1 1 20 18412 1 1 2 TYR C C -4.858 4.678 -3.277 1.00 . A A . 2 TYR C 1 1 20 18413 1 1 2 TYR CA C -5.590 6.013 -3.167 1.00 . A A . 2 TYR CA 1 1 20 18414 1 1 2 TYR CB C -5.680 6.675 -4.543 1.00 . A A . 2 TYR CB 1 1 20 18415 1 1 2 TYR CD1 C -7.626 8.112 -3.816 1.00 . A A . 2 TYR CD1 1 1 20 18416 1 1 2 TYR CD2 C -7.653 7.219 -6.026 1.00 . A A . 2 TYR CD2 1 1 20 18417 1 1 2 TYR CE1 C -8.842 8.726 -4.044 1.00 . A A . 2 TYR CE1 1 1 20 18418 1 1 2 TYR CE2 C -8.868 7.831 -6.263 1.00 . A A . 2 TYR CE2 1 1 20 18419 1 1 2 TYR CG C -7.011 7.349 -4.800 1.00 . A A . 2 TYR CG 1 1 20 18420 1 1 2 TYR CZ C -9.459 8.584 -5.269 1.00 . A A . 2 TYR CZ 1 1 20 18421 1 1 2 TYR H H -4.380 7.641 -2.561 1.00 . A A . 2 TYR H 1 1 20 18422 1 1 2 TYR HA H -6.588 5.830 -2.800 1.00 . A A . 2 TYR HA 1 1 20 18423 1 1 2 TYR HB2 H -4.910 7.426 -4.625 1.00 . A A . 2 TYR HB2 1 1 20 18424 1 1 2 TYR HB3 H -5.534 5.927 -5.308 1.00 . A A . 2 TYR HB3 1 1 20 18425 1 1 2 TYR HD1 H -7.140 8.222 -2.857 1.00 . A A . 2 TYR HD1 1 1 20 18426 1 1 2 TYR HD2 H -7.187 6.630 -6.801 1.00 . A A . 2 TYR HD2 1 1 20 18427 1 1 2 TYR HE1 H -9.304 9.315 -3.266 1.00 . A A . 2 TYR HE1 1 1 20 18428 1 1 2 TYR HE2 H -9.351 7.719 -7.223 1.00 . A A . 2 TYR HE2 1 1 20 18429 1 1 2 TYR HH H -11.350 8.526 -5.611 1.00 . A A . 2 TYR HH 1 1 20 18430 1 1 2 TYR N N -4.923 6.899 -2.219 1.00 . A A . 2 TYR N 1 1 20 18431 1 1 2 TYR O O -3.638 4.610 -3.126 1.00 . A A . 2 TYR O 1 1 20 18432 1 1 2 TYR OH O -10.670 9.194 -5.502 1.00 . A A . 2 TYR OH 1 1 20 18433 1 1 3 LYS C C -4.229 2.154 -4.946 1.00 . A A . 3 LYS C 1 1 20 18434 1 1 3 LYS CA C -5.052 2.281 -3.670 1.00 . A A . 3 LYS CA 1 1 20 18435 1 1 3 LYS CB C -6.171 1.239 -3.667 1.00 . A A . 3 LYS CB 1 1 20 18436 1 1 3 LYS CD C -6.549 -1.103 -4.491 1.00 . A A . 3 LYS CD 1 1 20 18437 1 1 3 LYS CE C -6.310 -0.895 -5.977 1.00 . A A . 3 LYS CE 1 1 20 18438 1 1 3 LYS CG C -5.668 -0.194 -3.652 1.00 . A A . 3 LYS CG 1 1 20 18439 1 1 3 LYS H H -6.583 3.741 -3.646 1.00 . A A . 3 LYS H 1 1 20 18440 1 1 3 LYS HA H -4.408 2.108 -2.821 1.00 . A A . 3 LYS HA 1 1 20 18441 1 1 3 LYS HB2 H -6.787 1.392 -2.793 1.00 . A A . 3 LYS HB2 1 1 20 18442 1 1 3 LYS HB3 H -6.776 1.376 -4.552 1.00 . A A . 3 LYS HB3 1 1 20 18443 1 1 3 LYS HD2 H -6.329 -2.132 -4.244 1.00 . A A . 3 LYS HD2 1 1 20 18444 1 1 3 LYS HD3 H -7.584 -0.891 -4.270 1.00 . A A . 3 LYS HD3 1 1 20 18445 1 1 3 LYS HE2 H -5.280 -0.606 -6.127 1.00 . A A . 3 LYS HE2 1 1 20 18446 1 1 3 LYS HE3 H -6.501 -1.825 -6.493 1.00 . A A . 3 LYS HE3 1 1 20 18447 1 1 3 LYS HG2 H -4.663 -0.218 -4.045 1.00 . A A . 3 LYS HG2 1 1 20 18448 1 1 3 LYS HG3 H -5.667 -0.551 -2.633 1.00 . A A . 3 LYS HG3 1 1 20 18449 1 1 3 LYS HZ1 H -7.488 -0.094 -7.504 1.00 . A A . 3 LYS HZ1 1 1 20 18450 1 1 3 LYS HZ2 H -6.692 1.071 -6.572 1.00 . A A . 3 LYS HZ2 1 1 20 18451 1 1 3 LYS HZ3 H -8.045 0.269 -5.949 1.00 . A A . 3 LYS HZ3 1 1 20 18452 1 1 3 LYS N N -5.616 3.619 -3.539 1.00 . A A . 3 LYS N 1 1 20 18453 1 1 3 LYS NZ N -7.195 0.162 -6.541 1.00 . A A . 3 LYS NZ 1 1 20 18454 1 1 3 LYS O O -3.243 1.417 -4.992 1.00 . A A . 3 LYS O 1 1 20 18455 1 1 4 LYS C C -2.493 3.281 -7.125 1.00 . A A . 4 LYS C 1 1 20 18456 1 1 4 LYS CA C -3.948 2.840 -7.266 1.00 . A A . 4 LYS CA 1 1 20 18457 1 1 4 LYS CB C -4.666 3.733 -8.280 1.00 . A A . 4 LYS CB 1 1 20 18458 1 1 4 LYS CD C -5.117 4.252 -10.697 1.00 . A A . 4 LYS CD 1 1 20 18459 1 1 4 LYS CE C -4.433 5.525 -11.165 1.00 . A A . 4 LYS CE 1 1 20 18460 1 1 4 LYS CG C -4.248 3.479 -9.718 1.00 . A A . 4 LYS CG 1 1 20 18461 1 1 4 LYS H H -5.437 3.439 -5.887 1.00 . A A . 4 LYS H 1 1 20 18462 1 1 4 LYS HA H -3.968 1.822 -7.625 1.00 . A A . 4 LYS HA 1 1 20 18463 1 1 4 LYS HB2 H -5.730 3.563 -8.202 1.00 . A A . 4 LYS HB2 1 1 20 18464 1 1 4 LYS HB3 H -4.457 4.766 -8.044 1.00 . A A . 4 LYS HB3 1 1 20 18465 1 1 4 LYS HD2 H -5.320 3.628 -11.554 1.00 . A A . 4 LYS HD2 1 1 20 18466 1 1 4 LYS HD3 H -6.046 4.512 -10.210 1.00 . A A . 4 LYS HD3 1 1 20 18467 1 1 4 LYS HE2 H -5.177 6.187 -11.582 1.00 . A A . 4 LYS HE2 1 1 20 18468 1 1 4 LYS HE3 H -3.964 6.000 -10.317 1.00 . A A . 4 LYS HE3 1 1 20 18469 1 1 4 LYS HG2 H -3.220 3.787 -9.845 1.00 . A A . 4 LYS HG2 1 1 20 18470 1 1 4 LYS HG3 H -4.336 2.424 -9.928 1.00 . A A . 4 LYS HG3 1 1 20 18471 1 1 4 LYS HZ1 H -2.456 5.191 -11.757 1.00 . A A . 4 LYS HZ1 1 1 20 18472 1 1 4 LYS HZ2 H -3.387 6.012 -12.907 1.00 . A A . 4 LYS HZ2 1 1 20 18473 1 1 4 LYS HZ3 H -3.600 4.350 -12.679 1.00 . A A . 4 LYS HZ3 1 1 20 18474 1 1 4 LYS N N -4.643 2.874 -5.985 1.00 . A A . 4 LYS N 1 1 20 18475 1 1 4 LYS NZ N -3.397 5.251 -12.199 1.00 . A A . 4 LYS NZ 1 1 20 18476 1 1 4 LYS O O -1.664 2.985 -7.983 1.00 . A A . 4 LYS O 1 1 20 18477 1 1 5 ASP C C 0.024 3.406 -5.126 1.00 . A A . 5 ASP C 1 1 20 18478 1 1 5 ASP CA C -0.831 4.475 -5.803 1.00 . A A . 5 ASP CA 1 1 20 18479 1 1 5 ASP CB C -0.862 5.742 -4.944 1.00 . A A . 5 ASP CB 1 1 20 18480 1 1 5 ASP CG C -0.653 7.000 -5.764 1.00 . A A . 5 ASP CG 1 1 20 18481 1 1 5 ASP H H -2.890 4.204 -5.393 1.00 . A A . 5 ASP H 1 1 20 18482 1 1 5 ASP HA H -0.391 4.713 -6.761 1.00 . A A . 5 ASP HA 1 1 20 18483 1 1 5 ASP HB2 H -1.820 5.811 -4.452 1.00 . A A . 5 ASP HB2 1 1 20 18484 1 1 5 ASP HB3 H -0.082 5.685 -4.199 1.00 . A A . 5 ASP HB3 1 1 20 18485 1 1 5 ASP N N -2.188 3.994 -6.042 1.00 . A A . 5 ASP N 1 1 20 18486 1 1 5 ASP O O 1.149 3.139 -5.550 1.00 . A A . 5 ASP O 1 1 20 18487 1 1 5 ASP OD1 O -1.245 7.100 -6.859 1.00 . A A . 5 ASP OD1 1 1 20 18488 1 1 5 ASP OD2 O 0.103 7.885 -5.311 1.00 . A A . 5 ASP OD2 1 1 20 18489 1 1 6 VAL C C 0.676 0.657 -4.267 1.00 . A A . 6 VAL C 1 1 20 18490 1 1 6 VAL CA C 0.201 1.769 -3.336 1.00 . A A . 6 VAL CA 1 1 20 18491 1 1 6 VAL CB C -0.689 1.156 -2.238 1.00 . A A . 6 VAL CB 1 1 20 18492 1 1 6 VAL CG1 C 0.165 0.432 -1.224 1.00 . A A . 6 VAL CG1 1 1 20 18493 1 1 6 VAL CG2 C -1.533 2.222 -1.554 1.00 . A A . 6 VAL CG2 1 1 20 18494 1 1 6 VAL H H -1.406 3.049 -3.773 1.00 . A A . 6 VAL H 1 1 20 18495 1 1 6 VAL HA H 1.058 2.225 -2.863 1.00 . A A . 6 VAL HA 1 1 20 18496 1 1 6 VAL HB H -1.352 0.439 -2.699 1.00 . A A . 6 VAL HB 1 1 20 18497 1 1 6 VAL HG11 H 0.866 -0.205 -1.740 1.00 . A A . 6 VAL HG11 1 1 20 18498 1 1 6 VAL HG12 H -0.465 -0.164 -0.584 1.00 . A A . 6 VAL HG12 1 1 20 18499 1 1 6 VAL HG13 H 0.703 1.157 -0.634 1.00 . A A . 6 VAL HG13 1 1 20 18500 1 1 6 VAL HG21 H -1.779 1.899 -0.555 1.00 . A A . 6 VAL HG21 1 1 20 18501 1 1 6 VAL HG22 H -2.442 2.376 -2.116 1.00 . A A . 6 VAL HG22 1 1 20 18502 1 1 6 VAL HG23 H -0.978 3.148 -1.508 1.00 . A A . 6 VAL HG23 1 1 20 18503 1 1 6 VAL N N -0.512 2.799 -4.070 1.00 . A A . 6 VAL N 1 1 20 18504 1 1 6 VAL O O 1.816 0.204 -4.178 1.00 . A A . 6 VAL O 1 1 20 18505 1 1 7 ILE C C 1.112 -0.335 -7.156 1.00 . A A . 7 ILE C 1 1 20 18506 1 1 7 ILE CA C 0.116 -0.829 -6.110 1.00 . A A . 7 ILE CA 1 1 20 18507 1 1 7 ILE CB C -1.154 -1.348 -6.818 1.00 . A A . 7 ILE CB 1 1 20 18508 1 1 7 ILE CD1 C -3.454 -2.347 -6.384 1.00 . A A . 7 ILE CD1 1 1 20 18509 1 1 7 ILE CG1 C -2.108 -1.977 -5.801 1.00 . A A . 7 ILE CG1 1 1 20 18510 1 1 7 ILE CG2 C -0.794 -2.352 -7.904 1.00 . A A . 7 ILE CG2 1 1 20 18511 1 1 7 ILE H H -1.101 0.630 -5.180 1.00 . A A . 7 ILE H 1 1 20 18512 1 1 7 ILE HA H 0.559 -1.648 -5.562 1.00 . A A . 7 ILE HA 1 1 20 18513 1 1 7 ILE HB H -1.644 -0.509 -7.287 1.00 . A A . 7 ILE HB 1 1 20 18514 1 1 7 ILE HD11 H -4.207 -2.299 -5.610 1.00 . A A . 7 ILE HD11 1 1 20 18515 1 1 7 ILE HD12 H -3.411 -3.350 -6.782 1.00 . A A . 7 ILE HD12 1 1 20 18516 1 1 7 ILE HD13 H -3.708 -1.656 -7.174 1.00 . A A . 7 ILE HD13 1 1 20 18517 1 1 7 ILE HG12 H -1.661 -2.876 -5.405 1.00 . A A . 7 ILE HG12 1 1 20 18518 1 1 7 ILE HG13 H -2.275 -1.279 -4.994 1.00 . A A . 7 ILE HG13 1 1 20 18519 1 1 7 ILE HG21 H -0.251 -3.177 -7.466 1.00 . A A . 7 ILE HG21 1 1 20 18520 1 1 7 ILE HG22 H -0.178 -1.869 -8.649 1.00 . A A . 7 ILE HG22 1 1 20 18521 1 1 7 ILE HG23 H -1.696 -2.721 -8.368 1.00 . A A . 7 ILE HG23 1 1 20 18522 1 1 7 ILE N N -0.208 0.226 -5.159 1.00 . A A . 7 ILE N 1 1 20 18523 1 1 7 ILE O O 1.950 -1.096 -7.639 1.00 . A A . 7 ILE O 1 1 20 18524 1 1 8 ASP C C 3.270 1.833 -7.858 1.00 . A A . 8 ASP C 1 1 20 18525 1 1 8 ASP CA C 1.909 1.547 -8.477 1.00 . A A . 8 ASP CA 1 1 20 18526 1 1 8 ASP CB C 1.300 2.840 -9.025 1.00 . A A . 8 ASP CB 1 1 20 18527 1 1 8 ASP CG C 0.766 2.676 -10.436 1.00 . A A . 8 ASP CG 1 1 20 18528 1 1 8 ASP H H 0.332 1.502 -7.072 1.00 . A A . 8 ASP H 1 1 20 18529 1 1 8 ASP HA H 2.033 0.845 -9.288 1.00 . A A . 8 ASP HA 1 1 20 18530 1 1 8 ASP HB2 H 0.484 3.145 -8.387 1.00 . A A . 8 ASP HB2 1 1 20 18531 1 1 8 ASP HB3 H 2.053 3.615 -9.033 1.00 . A A . 8 ASP HB3 1 1 20 18532 1 1 8 ASP N N 1.016 0.945 -7.496 1.00 . A A . 8 ASP N 1 1 20 18533 1 1 8 ASP O O 4.283 1.892 -8.557 1.00 . A A . 8 ASP O 1 1 20 18534 1 1 8 ASP OD1 O 1.550 2.281 -11.324 1.00 . A A . 8 ASP OD1 1 1 20 18535 1 1 8 ASP OD2 O -0.434 2.942 -10.651 1.00 . A A . 8 ASP OD2 1 1 20 18536 1 1 9 HIS C C 5.263 0.989 -5.504 1.00 . A A . 9 HIS C 1 1 20 18537 1 1 9 HIS CA C 4.523 2.285 -5.825 1.00 . A A . 9 HIS CA 1 1 20 18538 1 1 9 HIS CB C 4.223 3.062 -4.538 1.00 . A A . 9 HIS CB 1 1 20 18539 1 1 9 HIS CD2 C 5.463 3.032 -2.260 1.00 . A A . 9 HIS CD2 1 1 20 18540 1 1 9 HIS CE1 C 7.483 3.476 -2.985 1.00 . A A . 9 HIS CE1 1 1 20 18541 1 1 9 HIS CG C 5.391 3.170 -3.605 1.00 . A A . 9 HIS CG 1 1 20 18542 1 1 9 HIS H H 2.450 1.948 -6.039 1.00 . A A . 9 HIS H 1 1 20 18543 1 1 9 HIS HA H 5.141 2.891 -6.465 1.00 . A A . 9 HIS HA 1 1 20 18544 1 1 9 HIS HB2 H 3.914 4.064 -4.797 1.00 . A A . 9 HIS HB2 1 1 20 18545 1 1 9 HIS HB3 H 3.419 2.570 -4.009 1.00 . A A . 9 HIS HB3 1 1 20 18546 1 1 9 HIS HD1 H 6.949 3.602 -4.956 1.00 . A A . 9 HIS HD1 1 1 20 18547 1 1 9 HIS HD2 H 4.642 2.809 -1.595 1.00 . A A . 9 HIS HD2 1 1 20 18548 1 1 9 HIS HE1 H 8.546 3.669 -3.014 1.00 . A A . 9 HIS HE1 1 1 20 18549 1 1 9 HIS HE2 H 7.145 3.078 -1.006 1.00 . A A . 9 HIS HE2 1 1 20 18550 1 1 9 HIS N N 3.288 2.008 -6.541 1.00 . A A . 9 HIS N 1 1 20 18551 1 1 9 HIS ND1 N 6.674 3.449 -4.030 1.00 . A A . 9 HIS ND1 1 1 20 18552 1 1 9 HIS NE2 N 6.773 3.227 -1.900 1.00 . A A . 9 HIS NE2 1 1 20 18553 1 1 9 HIS O O 6.487 0.979 -5.373 1.00 . A A . 9 HIS O 1 1 20 18554 1 1 10 PHE C C 5.432 -2.164 -6.348 1.00 . A A . 10 PHE C 1 1 20 18555 1 1 10 PHE CA C 5.101 -1.399 -5.070 1.00 . A A . 10 PHE CA 1 1 20 18556 1 1 10 PHE CB C 4.149 -2.224 -4.204 1.00 . A A . 10 PHE CB 1 1 20 18557 1 1 10 PHE CD1 C 4.060 -0.509 -2.378 1.00 . A A . 10 PHE CD1 1 1 20 18558 1 1 10 PHE CD2 C 4.310 -2.801 -1.767 1.00 . A A . 10 PHE CD2 1 1 20 18559 1 1 10 PHE CE1 C 4.081 -0.149 -1.044 1.00 . A A . 10 PHE CE1 1 1 20 18560 1 1 10 PHE CE2 C 4.332 -2.446 -0.432 1.00 . A A . 10 PHE CE2 1 1 20 18561 1 1 10 PHE CG C 4.174 -1.837 -2.754 1.00 . A A . 10 PHE CG 1 1 20 18562 1 1 10 PHE CZ C 4.217 -1.119 -0.070 1.00 . A A . 10 PHE CZ 1 1 20 18563 1 1 10 PHE H H 3.542 -0.031 -5.490 1.00 . A A . 10 PHE H 1 1 20 18564 1 1 10 PHE HA H 6.013 -1.226 -4.521 1.00 . A A . 10 PHE HA 1 1 20 18565 1 1 10 PHE HB2 H 3.140 -2.095 -4.565 1.00 . A A . 10 PHE HB2 1 1 20 18566 1 1 10 PHE HB3 H 4.422 -3.267 -4.275 1.00 . A A . 10 PHE HB3 1 1 20 18567 1 1 10 PHE HD1 H 3.954 0.249 -3.138 1.00 . A A . 10 PHE HD1 1 1 20 18568 1 1 10 PHE HD2 H 4.401 -3.839 -2.050 1.00 . A A . 10 PHE HD2 1 1 20 18569 1 1 10 PHE HE1 H 3.990 0.891 -0.764 1.00 . A A . 10 PHE HE1 1 1 20 18570 1 1 10 PHE HE2 H 4.439 -3.207 0.327 1.00 . A A . 10 PHE HE2 1 1 20 18571 1 1 10 PHE HZ H 4.234 -0.840 0.973 1.00 . A A . 10 PHE HZ 1 1 20 18572 1 1 10 PHE N N 4.512 -0.101 -5.376 1.00 . A A . 10 PHE N 1 1 20 18573 1 1 10 PHE O O 6.545 -2.665 -6.513 1.00 . A A . 10 PHE O 1 1 20 18574 1 1 11 GLY C C 3.686 -4.097 -8.688 1.00 . A A . 11 GLY C 1 1 20 18575 1 1 11 GLY CA C 4.664 -2.955 -8.500 1.00 . A A . 11 GLY CA 1 1 20 18576 1 1 11 GLY H H 3.593 -1.829 -7.061 1.00 . A A . 11 GLY H 1 1 20 18577 1 1 11 GLY HA2 H 4.548 -2.257 -9.316 1.00 . A A . 11 GLY HA2 1 1 20 18578 1 1 11 GLY HA3 H 5.669 -3.349 -8.519 1.00 . A A . 11 GLY HA3 1 1 20 18579 1 1 11 GLY N N 4.459 -2.249 -7.249 1.00 . A A . 11 GLY N 1 1 20 18580 1 1 11 GLY O O 3.340 -4.449 -9.816 1.00 . A A . 11 GLY O 1 1 20 18581 1 1 12 THR C C 1.439 -5.827 -6.359 1.00 . A A . 12 THR C 1 1 20 18582 1 1 12 THR CA C 2.291 -5.786 -7.625 1.00 . A A . 12 THR CA 1 1 20 18583 1 1 12 THR CB C 3.035 -7.112 -7.796 1.00 . A A . 12 THR CB 1 1 20 18584 1 1 12 THR CG2 C 3.200 -7.522 -9.244 1.00 . A A . 12 THR CG2 1 1 20 18585 1 1 12 THR H H 3.549 -4.350 -6.709 1.00 . A A . 12 THR H 1 1 20 18586 1 1 12 THR HA H 1.643 -5.635 -8.476 1.00 . A A . 12 THR HA 1 1 20 18587 1 1 12 THR HB H 2.483 -7.891 -7.292 1.00 . A A . 12 THR HB 1 1 20 18588 1 1 12 THR HG1 H 4.875 -6.444 -7.737 1.00 . A A . 12 THR HG1 1 1 20 18589 1 1 12 THR HG21 H 2.242 -7.820 -9.645 1.00 . A A . 12 THR HG21 1 1 20 18590 1 1 12 THR HG22 H 3.890 -8.351 -9.306 1.00 . A A . 12 THR HG22 1 1 20 18591 1 1 12 THR HG23 H 3.586 -6.689 -9.813 1.00 . A A . 12 THR HG23 1 1 20 18592 1 1 12 THR N N 3.237 -4.677 -7.579 1.00 . A A . 12 THR N 1 1 20 18593 1 1 12 THR O O 1.605 -5.001 -5.461 1.00 . A A . 12 THR O 1 1 20 18594 1 1 12 THR OG1 O 4.328 -7.039 -7.220 1.00 . A A . 12 THR OG1 1 1 20 18595 1 1 13 GLN C C 0.330 -7.737 -4.037 1.00 . A A . 13 GLN C 1 1 20 18596 1 1 13 GLN CA C -0.353 -6.937 -5.141 1.00 . A A . 13 GLN CA 1 1 20 18597 1 1 13 GLN CB C -1.658 -7.619 -5.551 1.00 . A A . 13 GLN CB 1 1 20 18598 1 1 13 GLN CD C -3.591 -7.598 -7.176 1.00 . A A . 13 GLN CD 1 1 20 18599 1 1 13 GLN CG C -2.516 -6.782 -6.484 1.00 . A A . 13 GLN CG 1 1 20 18600 1 1 13 GLN H H 0.440 -7.418 -7.044 1.00 . A A . 13 GLN H 1 1 20 18601 1 1 13 GLN HA H -0.575 -5.948 -4.767 1.00 . A A . 13 GLN HA 1 1 20 18602 1 1 13 GLN HB2 H -1.425 -8.549 -6.046 1.00 . A A . 13 GLN HB2 1 1 20 18603 1 1 13 GLN HB3 H -2.234 -7.831 -4.661 1.00 . A A . 13 GLN HB3 1 1 20 18604 1 1 13 GLN HE21 H -3.963 -8.584 -5.489 1.00 . A A . 13 GLN HE21 1 1 20 18605 1 1 13 GLN HE22 H -4.922 -9.039 -6.853 1.00 . A A . 13 GLN HE22 1 1 20 18606 1 1 13 GLN HG2 H -2.992 -6.001 -5.912 1.00 . A A . 13 GLN HG2 1 1 20 18607 1 1 13 GLN HG3 H -1.880 -6.340 -7.238 1.00 . A A . 13 GLN HG3 1 1 20 18608 1 1 13 GLN N N 0.525 -6.790 -6.296 1.00 . A A . 13 GLN N 1 1 20 18609 1 1 13 GLN NE2 N -4.223 -8.497 -6.431 1.00 . A A . 13 GLN NE2 1 1 20 18610 1 1 13 GLN O O 0.267 -7.371 -2.863 1.00 . A A . 13 GLN O 1 1 20 18611 1 1 13 GLN OE1 O -3.852 -7.420 -8.366 1.00 . A A . 13 GLN OE1 1 1 20 18612 1 1 14 ARG C C 2.747 -8.902 -2.712 1.00 . A A . 14 ARG C 1 1 20 18613 1 1 14 ARG CA C 1.673 -9.685 -3.462 1.00 . A A . 14 ARG CA 1 1 20 18614 1 1 14 ARG CB C 2.302 -10.881 -4.177 1.00 . A A . 14 ARG CB 1 1 20 18615 1 1 14 ARG CD C 3.893 -12.817 -3.976 1.00 . A A . 14 ARG CD 1 1 20 18616 1 1 14 ARG CG C 2.953 -11.882 -3.235 1.00 . A A . 14 ARG CG 1 1 20 18617 1 1 14 ARG CZ C 3.788 -15.075 -4.959 1.00 . A A . 14 ARG CZ 1 1 20 18618 1 1 14 ARG H H 0.992 -9.070 -5.370 1.00 . A A . 14 ARG H 1 1 20 18619 1 1 14 ARG HA H 0.944 -10.044 -2.751 1.00 . A A . 14 ARG HA 1 1 20 18620 1 1 14 ARG HB2 H 1.536 -11.394 -4.738 1.00 . A A . 14 ARG HB2 1 1 20 18621 1 1 14 ARG HB3 H 3.058 -10.521 -4.860 1.00 . A A . 14 ARG HB3 1 1 20 18622 1 1 14 ARG HD2 H 4.067 -12.424 -4.967 1.00 . A A . 14 ARG HD2 1 1 20 18623 1 1 14 ARG HD3 H 4.829 -12.865 -3.441 1.00 . A A . 14 ARG HD3 1 1 20 18624 1 1 14 ARG HE H 2.608 -14.410 -3.495 1.00 . A A . 14 ARG HE 1 1 20 18625 1 1 14 ARG HG2 H 3.513 -11.344 -2.485 1.00 . A A . 14 ARG HG2 1 1 20 18626 1 1 14 ARG HG3 H 2.178 -12.467 -2.758 1.00 . A A . 14 ARG HG3 1 1 20 18627 1 1 14 ARG HH11 H 5.206 -13.876 -5.764 1.00 . A A . 14 ARG HH11 1 1 20 18628 1 1 14 ARG HH12 H 5.114 -15.469 -6.436 1.00 . A A . 14 ARG HH12 1 1 20 18629 1 1 14 ARG HH21 H 2.485 -16.507 -4.377 1.00 . A A . 14 ARG HH21 1 1 20 18630 1 1 14 ARG HH22 H 3.570 -16.962 -5.649 1.00 . A A . 14 ARG HH22 1 1 20 18631 1 1 14 ARG N N 0.980 -8.832 -4.420 1.00 . A A . 14 ARG N 1 1 20 18632 1 1 14 ARG NE N 3.344 -14.168 -4.093 1.00 . A A . 14 ARG NE 1 1 20 18633 1 1 14 ARG NH1 N 4.784 -14.783 -5.787 1.00 . A A . 14 ARG NH1 1 1 20 18634 1 1 14 ARG NH2 N 3.235 -16.280 -4.999 1.00 . A A . 14 ARG NH2 1 1 20 18635 1 1 14 ARG O O 3.047 -9.192 -1.554 1.00 . A A . 14 ARG O 1 1 20 18636 1 1 15 ALA C C 3.806 -6.251 -1.628 1.00 . A A . 15 ALA C 1 1 20 18637 1 1 15 ALA CA C 4.364 -7.082 -2.778 1.00 . A A . 15 ALA CA 1 1 20 18638 1 1 15 ALA CB C 4.995 -6.180 -3.828 1.00 . A A . 15 ALA CB 1 1 20 18639 1 1 15 ALA H H 3.042 -7.724 -4.301 1.00 . A A . 15 ALA H 1 1 20 18640 1 1 15 ALA HA H 5.130 -7.741 -2.394 1.00 . A A . 15 ALA HA 1 1 20 18641 1 1 15 ALA HB1 H 5.573 -5.410 -3.339 1.00 . A A . 15 ALA HB1 1 1 20 18642 1 1 15 ALA HB2 H 4.219 -5.723 -4.423 1.00 . A A . 15 ALA HB2 1 1 20 18643 1 1 15 ALA HB3 H 5.640 -6.766 -4.463 1.00 . A A . 15 ALA HB3 1 1 20 18644 1 1 15 ALA N N 3.324 -7.908 -3.381 1.00 . A A . 15 ALA N 1 1 20 18645 1 1 15 ALA O O 4.489 -6.016 -0.630 1.00 . A A . 15 ALA O 1 1 20 18646 1 1 16 VAL C C 1.334 -5.890 0.354 1.00 . A A . 16 VAL C 1 1 20 18647 1 1 16 VAL CA C 1.910 -5.005 -0.746 1.00 . A A . 16 VAL CA 1 1 20 18648 1 1 16 VAL CB C 0.777 -4.116 -1.321 1.00 . A A . 16 VAL CB 1 1 20 18649 1 1 16 VAL CG1 C 0.970 -2.674 -0.891 1.00 . A A . 16 VAL CG1 1 1 20 18650 1 1 16 VAL CG2 C 0.704 -4.208 -2.840 1.00 . A A . 16 VAL CG2 1 1 20 18651 1 1 16 VAL H H 2.071 -6.031 -2.589 1.00 . A A . 16 VAL H 1 1 20 18652 1 1 16 VAL HA H 2.659 -4.358 -0.312 1.00 . A A . 16 VAL HA 1 1 20 18653 1 1 16 VAL HB H -0.164 -4.462 -0.917 1.00 . A A . 16 VAL HB 1 1 20 18654 1 1 16 VAL HG11 H 0.936 -2.612 0.186 1.00 . A A . 16 VAL HG11 1 1 20 18655 1 1 16 VAL HG12 H 0.186 -2.064 -1.313 1.00 . A A . 16 VAL HG12 1 1 20 18656 1 1 16 VAL HG13 H 1.930 -2.324 -1.242 1.00 . A A . 16 VAL HG13 1 1 20 18657 1 1 16 VAL HG21 H 0.244 -5.144 -3.122 1.00 . A A . 16 VAL HG21 1 1 20 18658 1 1 16 VAL HG22 H 1.700 -4.158 -3.252 1.00 . A A . 16 VAL HG22 1 1 20 18659 1 1 16 VAL HG23 H 0.113 -3.388 -3.223 1.00 . A A . 16 VAL HG23 1 1 20 18660 1 1 16 VAL N N 2.561 -5.809 -1.774 1.00 . A A . 16 VAL N 1 1 20 18661 1 1 16 VAL O O 1.340 -5.522 1.528 1.00 . A A . 16 VAL O 1 1 20 18662 1 1 17 ALA C C 1.317 -8.578 1.840 1.00 . A A . 17 ALA C 1 1 20 18663 1 1 17 ALA CA C 0.252 -7.996 0.916 1.00 . A A . 17 ALA CA 1 1 20 18664 1 1 17 ALA CB C -0.475 -9.111 0.178 1.00 . A A . 17 ALA CB 1 1 20 18665 1 1 17 ALA H H 0.857 -7.294 -0.987 1.00 . A A . 17 ALA H 1 1 20 18666 1 1 17 ALA HA H -0.471 -7.460 1.511 1.00 . A A . 17 ALA HA 1 1 20 18667 1 1 17 ALA HB1 H -0.714 -8.783 -0.823 1.00 . A A . 17 ALA HB1 1 1 20 18668 1 1 17 ALA HB2 H -1.386 -9.355 0.704 1.00 . A A . 17 ALA HB2 1 1 20 18669 1 1 17 ALA HB3 H 0.159 -9.984 0.131 1.00 . A A . 17 ALA HB3 1 1 20 18670 1 1 17 ALA N N 0.834 -7.057 -0.036 1.00 . A A . 17 ALA N 1 1 20 18671 1 1 17 ALA O O 1.027 -8.963 2.972 1.00 . A A . 17 ALA O 1 1 20 18672 1 1 18 LYS C C 4.271 -8.099 3.023 1.00 . A A . 18 LYS C 1 1 20 18673 1 1 18 LYS CA C 3.658 -9.177 2.136 1.00 . A A . 18 LYS CA 1 1 20 18674 1 1 18 LYS CB C 4.728 -9.764 1.214 1.00 . A A . 18 LYS CB 1 1 20 18675 1 1 18 LYS CD C 5.198 -12.130 1.921 1.00 . A A . 18 LYS CD 1 1 20 18676 1 1 18 LYS CE C 4.203 -12.680 2.930 1.00 . A A . 18 LYS CE 1 1 20 18677 1 1 18 LYS CG C 4.517 -11.236 0.896 1.00 . A A . 18 LYS CG 1 1 20 18678 1 1 18 LYS H H 2.723 -8.319 0.441 1.00 . A A . 18 LYS H 1 1 20 18679 1 1 18 LYS HA H 3.267 -9.963 2.764 1.00 . A A . 18 LYS HA 1 1 20 18680 1 1 18 LYS HB2 H 4.727 -9.214 0.284 1.00 . A A . 18 LYS HB2 1 1 20 18681 1 1 18 LYS HB3 H 5.693 -9.655 1.686 1.00 . A A . 18 LYS HB3 1 1 20 18682 1 1 18 LYS HD2 H 5.667 -12.956 1.406 1.00 . A A . 18 LYS HD2 1 1 20 18683 1 1 18 LYS HD3 H 5.948 -11.555 2.444 1.00 . A A . 18 LYS HD3 1 1 20 18684 1 1 18 LYS HE2 H 4.731 -12.928 3.838 1.00 . A A . 18 LYS HE2 1 1 20 18685 1 1 18 LYS HE3 H 3.465 -11.920 3.140 1.00 . A A . 18 LYS HE3 1 1 20 18686 1 1 18 LYS HG2 H 3.458 -11.446 0.896 1.00 . A A . 18 LYS HG2 1 1 20 18687 1 1 18 LYS HG3 H 4.927 -11.446 -0.081 1.00 . A A . 18 LYS HG3 1 1 20 18688 1 1 18 LYS HZ1 H 3.466 -13.876 1.384 1.00 . A A . 18 LYS HZ1 1 1 20 18689 1 1 18 LYS HZ2 H 2.545 -13.944 2.800 1.00 . A A . 18 LYS HZ2 1 1 20 18690 1 1 18 LYS HZ3 H 4.029 -14.750 2.719 1.00 . A A . 18 LYS HZ3 1 1 20 18691 1 1 18 LYS N N 2.552 -8.639 1.351 1.00 . A A . 18 LYS N 1 1 20 18692 1 1 18 LYS NZ N 3.512 -13.898 2.423 1.00 . A A . 18 LYS NZ 1 1 20 18693 1 1 18 LYS O O 4.775 -8.386 4.108 1.00 . A A . 18 LYS O 1 1 20 18694 1 1 19 ALA C C 3.958 -5.460 4.564 1.00 . A A . 19 ALA C 1 1 20 18695 1 1 19 ALA CA C 4.776 -5.735 3.305 1.00 . A A . 19 ALA CA 1 1 20 18696 1 1 19 ALA CB C 4.834 -4.492 2.430 1.00 . A A . 19 ALA CB 1 1 20 18697 1 1 19 ALA H H 3.809 -6.689 1.681 1.00 . A A . 19 ALA H 1 1 20 18698 1 1 19 ALA HA H 5.785 -5.991 3.593 1.00 . A A . 19 ALA HA 1 1 20 18699 1 1 19 ALA HB1 H 4.865 -3.612 3.056 1.00 . A A . 19 ALA HB1 1 1 20 18700 1 1 19 ALA HB2 H 3.957 -4.454 1.800 1.00 . A A . 19 ALA HB2 1 1 20 18701 1 1 19 ALA HB3 H 5.720 -4.526 1.813 1.00 . A A . 19 ALA HB3 1 1 20 18702 1 1 19 ALA N N 4.225 -6.855 2.554 1.00 . A A . 19 ALA N 1 1 20 18703 1 1 19 ALA O O 4.509 -5.334 5.658 1.00 . A A . 19 ALA O 1 1 20 18704 1 1 20 LEU C C 1.488 -6.383 6.317 1.00 . A A . 20 LEU C 1 1 20 18705 1 1 20 LEU CA C 1.751 -5.107 5.526 1.00 . A A . 20 LEU CA 1 1 20 18706 1 1 20 LEU CB C 0.428 -4.518 5.030 1.00 . A A . 20 LEU CB 1 1 20 18707 1 1 20 LEU CD1 C -0.781 -3.028 3.419 1.00 . A A . 20 LEU CD1 1 1 20 18708 1 1 20 LEU CD2 C 1.154 -2.139 4.729 1.00 . A A . 20 LEU CD2 1 1 20 18709 1 1 20 LEU CG C 0.566 -3.361 4.041 1.00 . A A . 20 LEU CG 1 1 20 18710 1 1 20 LEU H H 2.262 -5.476 3.504 1.00 . A A . 20 LEU H 1 1 20 18711 1 1 20 LEU HA H 2.235 -4.391 6.172 1.00 . A A . 20 LEU HA 1 1 20 18712 1 1 20 LEU HB2 H -0.137 -5.307 4.556 1.00 . A A . 20 LEU HB2 1 1 20 18713 1 1 20 LEU HB3 H -0.127 -4.166 5.886 1.00 . A A . 20 LEU HB3 1 1 20 18714 1 1 20 LEU HD11 H -1.145 -3.882 2.869 1.00 . A A . 20 LEU HD11 1 1 20 18715 1 1 20 LEU HD12 H -0.672 -2.188 2.749 1.00 . A A . 20 LEU HD12 1 1 20 18716 1 1 20 LEU HD13 H -1.485 -2.777 4.199 1.00 . A A . 20 LEU HD13 1 1 20 18717 1 1 20 LEU HD21 H 0.357 -1.473 5.023 1.00 . A A . 20 LEU HD21 1 1 20 18718 1 1 20 LEU HD22 H 1.819 -1.626 4.049 1.00 . A A . 20 LEU HD22 1 1 20 18719 1 1 20 LEU HD23 H 1.704 -2.449 5.605 1.00 . A A . 20 LEU HD23 1 1 20 18720 1 1 20 LEU HG H 1.237 -3.653 3.245 1.00 . A A . 20 LEU HG 1 1 20 18721 1 1 20 LEU N N 2.643 -5.367 4.401 1.00 . A A . 20 LEU N 1 1 20 18722 1 1 20 LEU O O 1.324 -6.347 7.537 1.00 . A A . 20 LEU O 1 1 20 18723 1 1 21 GLY C C -0.187 -9.319 6.005 1.00 . A A . 21 GLY C 1 1 20 18724 1 1 21 GLY CA C 1.206 -8.784 6.270 1.00 . A A . 21 GLY CA 1 1 20 18725 1 1 21 GLY H H 1.588 -7.479 4.646 1.00 . A A . 21 GLY H 1 1 20 18726 1 1 21 GLY HA2 H 1.931 -9.503 5.915 1.00 . A A . 21 GLY HA2 1 1 20 18727 1 1 21 GLY HA3 H 1.335 -8.658 7.336 1.00 . A A . 21 GLY HA3 1 1 20 18728 1 1 21 GLY N N 1.450 -7.511 5.616 1.00 . A A . 21 GLY N 1 1 20 18729 1 1 21 GLY O O -0.738 -10.062 6.814 1.00 . A A . 21 GLY O 1 1 20 18730 1 1 22 ILE C C -2.046 -10.316 3.287 1.00 . A A . 22 ILE C 1 1 20 18731 1 1 22 ILE CA C -2.094 -9.387 4.495 1.00 . A A . 22 ILE CA 1 1 20 18732 1 1 22 ILE CB C -3.019 -8.198 4.176 1.00 . A A . 22 ILE CB 1 1 20 18733 1 1 22 ILE CD1 C -3.263 -6.135 2.702 1.00 . A A . 22 ILE CD1 1 1 20 18734 1 1 22 ILE CG1 C -2.412 -7.332 3.069 1.00 . A A . 22 ILE CG1 1 1 20 18735 1 1 22 ILE CG2 C -3.269 -7.371 5.428 1.00 . A A . 22 ILE CG2 1 1 20 18736 1 1 22 ILE H H -0.267 -8.345 4.259 1.00 . A A . 22 ILE H 1 1 20 18737 1 1 22 ILE HA H -2.510 -9.925 5.334 1.00 . A A . 22 ILE HA 1 1 20 18738 1 1 22 ILE HB H -3.967 -8.587 3.837 1.00 . A A . 22 ILE HB 1 1 20 18739 1 1 22 ILE HD11 H -2.627 -5.276 2.544 1.00 . A A . 22 ILE HD11 1 1 20 18740 1 1 22 ILE HD12 H -3.956 -5.927 3.503 1.00 . A A . 22 ILE HD12 1 1 20 18741 1 1 22 ILE HD13 H -3.811 -6.348 1.796 1.00 . A A . 22 ILE HD13 1 1 20 18742 1 1 22 ILE HG12 H -1.450 -6.967 3.394 1.00 . A A . 22 ILE HG12 1 1 20 18743 1 1 22 ILE HG13 H -2.282 -7.933 2.182 1.00 . A A . 22 ILE HG13 1 1 20 18744 1 1 22 ILE HG21 H -3.099 -7.981 6.302 1.00 . A A . 22 ILE HG21 1 1 20 18745 1 1 22 ILE HG22 H -4.289 -7.017 5.429 1.00 . A A . 22 ILE HG22 1 1 20 18746 1 1 22 ILE HG23 H -2.594 -6.527 5.443 1.00 . A A . 22 ILE HG23 1 1 20 18747 1 1 22 ILE N N -0.757 -8.939 4.865 1.00 . A A . 22 ILE N 1 1 20 18748 1 1 22 ILE O O -0.975 -10.599 2.751 1.00 . A A . 22 ILE O 1 1 20 18749 1 1 23 SER C C -3.450 -10.894 0.420 1.00 . A A . 23 SER C 1 1 20 18750 1 1 23 SER CA C -3.306 -11.682 1.717 1.00 . A A . 23 SER CA 1 1 20 18751 1 1 23 SER CB C -4.493 -12.634 1.884 1.00 . A A . 23 SER CB 1 1 20 18752 1 1 23 SER H H -4.033 -10.521 3.332 1.00 . A A . 23 SER H 1 1 20 18753 1 1 23 SER HA H -2.395 -12.260 1.675 1.00 . A A . 23 SER HA 1 1 20 18754 1 1 23 SER HB2 H -4.690 -12.779 2.936 1.00 . A A . 23 SER HB2 1 1 20 18755 1 1 23 SER HB3 H -5.364 -12.207 1.410 1.00 . A A . 23 SER HB3 1 1 20 18756 1 1 23 SER HG H -5.007 -14.445 1.343 1.00 . A A . 23 SER HG 1 1 20 18757 1 1 23 SER N N -3.214 -10.785 2.863 1.00 . A A . 23 SER N 1 1 20 18758 1 1 23 SER O O -3.810 -9.718 0.433 1.00 . A A . 23 SER O 1 1 20 18759 1 1 23 SER OG O -4.222 -13.894 1.293 1.00 . A A . 23 SER OG 1 1 20 18760 1 1 24 ASP C C -4.676 -10.406 -2.266 1.00 . A A . 24 ASP C 1 1 20 18761 1 1 24 ASP CA C -3.260 -10.912 -2.008 1.00 . A A . 24 ASP CA 1 1 20 18762 1 1 24 ASP CB C -2.849 -11.892 -3.108 1.00 . A A . 24 ASP CB 1 1 20 18763 1 1 24 ASP CG C -1.344 -11.995 -3.260 1.00 . A A . 24 ASP CG 1 1 20 18764 1 1 24 ASP H H -2.882 -12.488 -0.646 1.00 . A A . 24 ASP H 1 1 20 18765 1 1 24 ASP HA H -2.582 -10.071 -2.016 1.00 . A A . 24 ASP HA 1 1 20 18766 1 1 24 ASP HB2 H -3.236 -12.872 -2.872 1.00 . A A . 24 ASP HB2 1 1 20 18767 1 1 24 ASP HB3 H -3.266 -11.563 -4.048 1.00 . A A . 24 ASP HB3 1 1 20 18768 1 1 24 ASP N N -3.164 -11.551 -0.700 1.00 . A A . 24 ASP N 1 1 20 18769 1 1 24 ASP O O -4.872 -9.404 -2.953 1.00 . A A . 24 ASP O 1 1 20 18770 1 1 24 ASP OD1 O -0.633 -11.819 -2.248 1.00 . A A . 24 ASP OD1 1 1 20 18771 1 1 24 ASP OD2 O -0.878 -12.250 -4.389 1.00 . A A . 24 ASP OD2 1 1 20 18772 1 1 25 ALA C C -7.349 -9.386 -1.215 1.00 . A A . 25 ALA C 1 1 20 18773 1 1 25 ALA CA C -7.058 -10.729 -1.879 1.00 . A A . 25 ALA CA 1 1 20 18774 1 1 25 ALA CB C -7.967 -11.811 -1.316 1.00 . A A . 25 ALA CB 1 1 20 18775 1 1 25 ALA H H -5.439 -11.895 -1.172 1.00 . A A . 25 ALA H 1 1 20 18776 1 1 25 ALA HA H -7.252 -10.643 -2.939 1.00 . A A . 25 ALA HA 1 1 20 18777 1 1 25 ALA HB1 H -8.518 -11.419 -0.474 1.00 . A A . 25 ALA HB1 1 1 20 18778 1 1 25 ALA HB2 H -7.370 -12.651 -0.995 1.00 . A A . 25 ALA HB2 1 1 20 18779 1 1 25 ALA HB3 H -8.660 -12.131 -2.080 1.00 . A A . 25 ALA HB3 1 1 20 18780 1 1 25 ALA N N -5.659 -11.105 -1.709 1.00 . A A . 25 ALA N 1 1 20 18781 1 1 25 ALA O O -8.065 -8.552 -1.769 1.00 . A A . 25 ALA O 1 1 20 18782 1 1 26 ALA C C -6.553 -6.738 -0.107 1.00 . A A . 26 ALA C 1 1 20 18783 1 1 26 ALA CA C -6.992 -7.946 0.715 1.00 . A A . 26 ALA CA 1 1 20 18784 1 1 26 ALA CB C -6.237 -7.989 2.035 1.00 . A A . 26 ALA CB 1 1 20 18785 1 1 26 ALA H H -6.231 -9.888 0.365 1.00 . A A . 26 ALA H 1 1 20 18786 1 1 26 ALA HA H -8.047 -7.855 0.934 1.00 . A A . 26 ALA HA 1 1 20 18787 1 1 26 ALA HB1 H -5.261 -8.426 1.876 1.00 . A A . 26 ALA HB1 1 1 20 18788 1 1 26 ALA HB2 H -6.788 -8.589 2.744 1.00 . A A . 26 ALA HB2 1 1 20 18789 1 1 26 ALA HB3 H -6.125 -6.987 2.421 1.00 . A A . 26 ALA HB3 1 1 20 18790 1 1 26 ALA N N -6.791 -9.186 -0.025 1.00 . A A . 26 ALA N 1 1 20 18791 1 1 26 ALA O O -7.256 -5.729 -0.171 1.00 . A A . 26 ALA O 1 1 20 18792 1 1 27 VAL C C -5.772 -5.483 -2.743 1.00 . A A . 27 VAL C 1 1 20 18793 1 1 27 VAL CA C -4.856 -5.768 -1.557 1.00 . A A . 27 VAL CA 1 1 20 18794 1 1 27 VAL CB C -3.444 -6.100 -2.078 1.00 . A A . 27 VAL CB 1 1 20 18795 1 1 27 VAL CG1 C -2.881 -4.941 -2.884 1.00 . A A . 27 VAL CG1 1 1 20 18796 1 1 27 VAL CG2 C -2.521 -6.453 -0.922 1.00 . A A . 27 VAL CG2 1 1 20 18797 1 1 27 VAL H H -4.874 -7.679 -0.648 1.00 . A A . 27 VAL H 1 1 20 18798 1 1 27 VAL HA H -4.793 -4.883 -0.942 1.00 . A A . 27 VAL HA 1 1 20 18799 1 1 27 VAL HB H -3.516 -6.960 -2.727 1.00 . A A . 27 VAL HB 1 1 20 18800 1 1 27 VAL HG11 H -2.826 -4.060 -2.260 1.00 . A A . 27 VAL HG11 1 1 20 18801 1 1 27 VAL HG12 H -3.526 -4.742 -3.728 1.00 . A A . 27 VAL HG12 1 1 20 18802 1 1 27 VAL HG13 H -1.893 -5.194 -3.239 1.00 . A A . 27 VAL HG13 1 1 20 18803 1 1 27 VAL HG21 H -2.609 -5.704 -0.149 1.00 . A A . 27 VAL HG21 1 1 20 18804 1 1 27 VAL HG22 H -1.501 -6.488 -1.274 1.00 . A A . 27 VAL HG22 1 1 20 18805 1 1 27 VAL HG23 H -2.796 -7.418 -0.522 1.00 . A A . 27 VAL HG23 1 1 20 18806 1 1 27 VAL N N -5.388 -6.849 -0.736 1.00 . A A . 27 VAL N 1 1 20 18807 1 1 27 VAL O O -6.020 -4.326 -3.086 1.00 . A A . 27 VAL O 1 1 20 18808 1 1 28 SER C C -8.531 -5.899 -4.086 1.00 . A A . 28 SER C 1 1 20 18809 1 1 28 SER CA C -7.158 -6.406 -4.515 1.00 . A A . 28 SER CA 1 1 20 18810 1 1 28 SER CB C -7.301 -7.748 -5.238 1.00 . A A . 28 SER CB 1 1 20 18811 1 1 28 SER H H -6.037 -7.440 -3.048 1.00 . A A . 28 SER H 1 1 20 18812 1 1 28 SER HA H -6.716 -5.690 -5.190 1.00 . A A . 28 SER HA 1 1 20 18813 1 1 28 SER HB2 H -7.806 -7.595 -6.182 1.00 . A A . 28 SER HB2 1 1 20 18814 1 1 28 SER HB3 H -6.320 -8.164 -5.419 1.00 . A A . 28 SER HB3 1 1 20 18815 1 1 28 SER HG H -8.257 -9.441 -4.995 1.00 . A A . 28 SER HG 1 1 20 18816 1 1 28 SER N N -6.270 -6.544 -3.367 1.00 . A A . 28 SER N 1 1 20 18817 1 1 28 SER O O -9.208 -5.199 -4.839 1.00 . A A . 28 SER O 1 1 20 18818 1 1 28 SER OG O -8.052 -8.667 -4.466 1.00 . A A . 28 SER OG 1 1 20 18819 1 1 29 GLN C C -10.200 -4.366 -1.916 1.00 . A A . 29 GLN C 1 1 20 18820 1 1 29 GLN CA C -10.220 -5.836 -2.340 1.00 . A A . 29 GLN CA 1 1 20 18821 1 1 29 GLN CB C -10.620 -6.718 -1.153 1.00 . A A . 29 GLN CB 1 1 20 18822 1 1 29 GLN CD C -11.630 -8.825 -2.105 1.00 . A A . 29 GLN CD 1 1 20 18823 1 1 29 GLN CG C -11.890 -7.514 -1.390 1.00 . A A . 29 GLN CG 1 1 20 18824 1 1 29 GLN H H -8.349 -6.813 -2.317 1.00 . A A . 29 GLN H 1 1 20 18825 1 1 29 GLN HA H -10.950 -5.958 -3.124 1.00 . A A . 29 GLN HA 1 1 20 18826 1 1 29 GLN HB2 H -9.822 -7.413 -0.952 1.00 . A A . 29 GLN HB2 1 1 20 18827 1 1 29 GLN HB3 H -10.770 -6.092 -0.284 1.00 . A A . 29 GLN HB3 1 1 20 18828 1 1 29 GLN HE21 H -12.140 -9.843 -0.473 1.00 . A A . 29 GLN HE21 1 1 20 18829 1 1 29 GLN HE22 H -11.680 -10.795 -1.840 1.00 . A A . 29 GLN HE22 1 1 20 18830 1 1 29 GLN HG2 H -12.350 -7.725 -0.436 1.00 . A A . 29 GLN HG2 1 1 20 18831 1 1 29 GLN HG3 H -12.570 -6.918 -1.989 1.00 . A A . 29 GLN HG3 1 1 20 18832 1 1 29 GLN N N -8.934 -6.256 -2.870 1.00 . A A . 29 GLN N 1 1 20 18833 1 1 29 GLN NE2 N -11.840 -9.933 -1.402 1.00 . A A . 29 GLN NE2 1 1 20 18834 1 1 29 GLN O O -11.240 -3.783 -1.628 1.00 . A A . 29 GLN O 1 1 20 18835 1 1 29 GLN OE1 O -11.260 -8.843 -3.278 1.00 . A A . 29 GLN OE1 1 1 20 18836 1 1 30 TRP C C -9.690 -1.470 -2.411 1.00 . A A . 30 TRP C 1 1 20 18837 1 1 30 TRP CA C -8.872 -2.373 -1.491 1.00 . A A . 30 TRP CA 1 1 20 18838 1 1 30 TRP CB C -7.399 -1.958 -1.527 1.00 . A A . 30 TRP CB 1 1 20 18839 1 1 30 TRP CD1 C -7.129 -2.821 0.873 1.00 . A A . 30 TRP CD1 1 1 20 18840 1 1 30 TRP CD2 C -5.196 -2.411 -0.179 1.00 . A A . 30 TRP CD2 1 1 20 18841 1 1 30 TRP CE2 C -4.910 -2.873 1.121 1.00 . A A . 30 TRP CE2 1 1 20 18842 1 1 30 TRP CE3 C -4.132 -2.089 -1.026 1.00 . A A . 30 TRP CE3 1 1 20 18843 1 1 30 TRP CG C -6.623 -2.384 -0.316 1.00 . A A . 30 TRP CG 1 1 20 18844 1 1 30 TRP CH2 C -2.585 -2.698 0.737 1.00 . A A . 30 TRP CH2 1 1 20 18845 1 1 30 TRP CZ2 C -3.606 -3.022 1.589 1.00 . A A . 30 TRP CZ2 1 1 20 18846 1 1 30 TRP CZ3 C -2.840 -2.234 -0.560 1.00 . A A . 30 TRP CZ3 1 1 20 18847 1 1 30 TRP H H -8.213 -4.283 -2.121 1.00 . A A . 30 TRP H 1 1 20 18848 1 1 30 TRP HA H -9.242 -2.270 -0.482 1.00 . A A . 30 TRP HA 1 1 20 18849 1 1 30 TRP HB2 H -6.930 -2.400 -2.394 1.00 . A A . 30 TRP HB2 1 1 20 18850 1 1 30 TRP HB3 H -7.338 -0.883 -1.603 1.00 . A A . 30 TRP HB3 1 1 20 18851 1 1 30 TRP HD1 H -8.184 -2.915 1.089 1.00 . A A . 30 TRP HD1 1 1 20 18852 1 1 30 TRP HE1 H -6.214 -3.449 2.659 1.00 . A A . 30 TRP HE1 1 1 20 18853 1 1 30 TRP HE3 H -4.305 -1.732 -2.030 1.00 . A A . 30 TRP HE3 1 1 20 18854 1 1 30 TRP HH2 H -1.559 -2.796 1.059 1.00 . A A . 30 TRP HH2 1 1 20 18855 1 1 30 TRP HZ2 H -3.394 -3.377 2.585 1.00 . A A . 30 TRP HZ2 1 1 20 18856 1 1 30 TRP HZ3 H -2.004 -1.989 -1.201 1.00 . A A . 30 TRP HZ3 1 1 20 18857 1 1 30 TRP N N -9.015 -3.772 -1.881 1.00 . A A . 30 TRP N 1 1 20 18858 1 1 30 TRP NE1 N -6.105 -3.118 1.744 1.00 . A A . 30 TRP NE1 1 1 20 18859 1 1 30 TRP O O -9.598 -1.569 -3.635 1.00 . A A . 30 TRP O 1 1 20 18860 1 1 31 LYS C C -10.500 1.538 -3.043 1.00 . A A . 31 LYS C 1 1 20 18861 1 1 31 LYS CA C -11.320 0.331 -2.583 1.00 . A A . 31 LYS CA 1 1 20 18862 1 1 31 LYS CB C -12.510 0.789 -1.745 1.00 . A A . 31 LYS CB 1 1 20 18863 1 1 31 LYS CD C -14.800 -0.123 -1.266 1.00 . A A . 31 LYS CD 1 1 20 18864 1 1 31 LYS CE C -15.240 1.103 -0.483 1.00 . A A . 31 LYS CE 1 1 20 18865 1 1 31 LYS CG C -13.310 -0.358 -1.142 1.00 . A A . 31 LYS CG 1 1 20 18866 1 1 31 LYS H H -10.510 -0.558 -0.837 1.00 . A A . 31 LYS H 1 1 20 18867 1 1 31 LYS HA H -11.680 -0.197 -3.453 1.00 . A A . 31 LYS HA 1 1 20 18868 1 1 31 LYS HB2 H -12.150 1.412 -0.939 1.00 . A A . 31 LYS HB2 1 1 20 18869 1 1 31 LYS HB3 H -13.170 1.370 -2.371 1.00 . A A . 31 LYS HB3 1 1 20 18870 1 1 31 LYS HD2 H -15.050 0.020 -2.307 1.00 . A A . 31 LYS HD2 1 1 20 18871 1 1 31 LYS HD3 H -15.330 -0.989 -0.885 1.00 . A A . 31 LYS HD3 1 1 20 18872 1 1 31 LYS HE2 H -14.720 1.965 -0.866 1.00 . A A . 31 LYS HE2 1 1 20 18873 1 1 31 LYS HE3 H -16.310 1.242 -0.619 1.00 . A A . 31 LYS HE3 1 1 20 18874 1 1 31 LYS HG2 H -13.050 -1.271 -1.659 1.00 . A A . 31 LYS HG2 1 1 20 18875 1 1 31 LYS HG3 H -13.050 -0.450 -0.097 1.00 . A A . 31 LYS HG3 1 1 20 18876 1 1 31 LYS HZ1 H -14.050 1.430 1.201 1.00 . A A . 31 LYS HZ1 1 1 20 18877 1 1 31 LYS HZ2 H -14.890 -0.038 1.230 1.00 . A A . 31 LYS HZ2 1 1 20 18878 1 1 31 LYS HZ3 H -15.710 1.413 1.529 1.00 . A A . 31 LYS HZ3 1 1 20 18879 1 1 31 LYS N N -10.480 -0.590 -1.815 1.00 . A A . 31 LYS N 1 1 20 18880 1 1 31 LYS NZ N -14.950 0.968 0.971 1.00 . A A . 31 LYS NZ 1 1 20 18881 1 1 31 LYS O O -9.281 1.543 -2.946 1.00 . A A . 31 LYS O 1 1 20 18882 1 1 32 GLU C C -9.523 4.275 -2.990 1.00 . A A . 32 GLU C 1 1 20 18883 1 1 32 GLU CA C -10.530 3.775 -4.015 1.00 . A A . 32 GLU CA 1 1 20 18884 1 1 32 GLU CB C -11.570 4.865 -4.308 1.00 . A A . 32 GLU CB 1 1 20 18885 1 1 32 GLU CD C -12.780 6.174 -6.097 1.00 . A A . 32 GLU CD 1 1 20 18886 1 1 32 GLU CG C -11.560 5.337 -5.752 1.00 . A A . 32 GLU CG 1 1 20 18887 1 1 32 GLU H H -12.170 2.499 -3.595 1.00 . A A . 32 GLU H 1 1 20 18888 1 1 32 GLU HA H -10.010 3.532 -4.931 1.00 . A A . 32 GLU HA 1 1 20 18889 1 1 32 GLU HB2 H -12.550 4.479 -4.083 1.00 . A A . 32 GLU HB2 1 1 20 18890 1 1 32 GLU HB3 H -11.370 5.715 -3.672 1.00 . A A . 32 GLU HB3 1 1 20 18891 1 1 32 GLU HG2 H -10.670 5.930 -5.920 1.00 . A A . 32 GLU HG2 1 1 20 18892 1 1 32 GLU HG3 H -11.540 4.472 -6.400 1.00 . A A . 32 GLU HG3 1 1 20 18893 1 1 32 GLU N N -11.190 2.561 -3.543 1.00 . A A . 32 GLU N 1 1 20 18894 1 1 32 GLU O O -8.446 4.752 -3.347 1.00 . A A . 32 GLU O 1 1 20 18895 1 1 32 GLU OE1 O -13.870 5.592 -6.278 1.00 . A A . 32 GLU OE1 1 1 20 18896 1 1 32 GLU OE2 O -12.640 7.413 -6.186 1.00 . A A . 32 GLU OE2 1 1 20 18897 1 1 33 VAL C C -8.619 3.401 0.251 1.00 . A A . 33 VAL C 1 1 20 18898 1 1 33 VAL CA C -9.001 4.583 -0.632 1.00 . A A . 33 VAL CA 1 1 20 18899 1 1 33 VAL CB C -9.666 5.668 0.238 1.00 . A A . 33 VAL CB 1 1 20 18900 1 1 33 VAL CG1 C -8.676 6.221 1.252 1.00 . A A . 33 VAL CG1 1 1 20 18901 1 1 33 VAL CG2 C -10.220 6.781 -0.635 1.00 . A A . 33 VAL CG2 1 1 20 18902 1 1 33 VAL H H -10.740 3.760 -1.496 1.00 . A A . 33 VAL H 1 1 20 18903 1 1 33 VAL HA H -8.103 5.000 -1.069 1.00 . A A . 33 VAL HA 1 1 20 18904 1 1 33 VAL HB H -10.480 5.215 0.777 1.00 . A A . 33 VAL HB 1 1 20 18905 1 1 33 VAL HG11 H -8.480 5.475 2.007 1.00 . A A . 33 VAL HG11 1 1 20 18906 1 1 33 VAL HG12 H -9.094 7.103 1.717 1.00 . A A . 33 VAL HG12 1 1 20 18907 1 1 33 VAL HG13 H -7.755 6.480 0.753 1.00 . A A . 33 VAL HG13 1 1 20 18908 1 1 33 VAL HG21 H -9.418 7.401 -0.991 1.00 . A A . 33 VAL HG21 1 1 20 18909 1 1 33 VAL HG22 H -10.910 7.380 -0.055 1.00 . A A . 33 VAL HG22 1 1 20 18910 1 1 33 VAL HG23 H -10.740 6.350 -1.477 1.00 . A A . 33 VAL HG23 1 1 20 18911 1 1 33 VAL N N -9.876 4.154 -1.715 1.00 . A A . 33 VAL N 1 1 20 18912 1 1 33 VAL O O -9.486 2.712 0.788 1.00 . A A . 33 VAL O 1 1 20 18913 1 1 34 ILE C C -7.370 2.132 2.632 1.00 . A A . 34 ILE C 1 1 20 18914 1 1 34 ILE CA C -6.831 2.055 1.205 1.00 . A A . 34 ILE CA 1 1 20 18915 1 1 34 ILE CB C -5.292 2.007 1.249 1.00 . A A . 34 ILE CB 1 1 20 18916 1 1 34 ILE CD1 C -3.237 3.405 1.780 1.00 . A A . 34 ILE CD1 1 1 20 18917 1 1 34 ILE CG1 C -4.711 3.409 1.442 1.00 . A A . 34 ILE CG1 1 1 20 18918 1 1 34 ILE CG2 C -4.745 1.376 -0.022 1.00 . A A . 34 ILE CG2 1 1 20 18919 1 1 34 ILE H H -6.674 3.745 -0.065 1.00 . A A . 34 ILE H 1 1 20 18920 1 1 34 ILE HA H -7.181 1.138 0.754 1.00 . A A . 34 ILE HA 1 1 20 18921 1 1 34 ILE HB H -4.998 1.387 2.082 1.00 . A A . 34 ILE HB 1 1 20 18922 1 1 34 ILE HD11 H -3.025 2.588 2.453 1.00 . A A . 34 ILE HD11 1 1 20 18923 1 1 34 ILE HD12 H -2.973 4.340 2.253 1.00 . A A . 34 ILE HD12 1 1 20 18924 1 1 34 ILE HD13 H -2.661 3.286 0.875 1.00 . A A . 34 ILE HD13 1 1 20 18925 1 1 34 ILE HG12 H -4.840 3.976 0.532 1.00 . A A . 34 ILE HG12 1 1 20 18926 1 1 34 ILE HG13 H -5.235 3.903 2.247 1.00 . A A . 34 ILE HG13 1 1 20 18927 1 1 34 ILE HG21 H -5.245 1.803 -0.879 1.00 . A A . 34 ILE HG21 1 1 20 18928 1 1 34 ILE HG22 H -4.919 0.311 0.003 1.00 . A A . 34 ILE HG22 1 1 20 18929 1 1 34 ILE HG23 H -3.686 1.567 -0.091 1.00 . A A . 34 ILE HG23 1 1 20 18930 1 1 34 ILE N N -7.318 3.163 0.391 1.00 . A A . 34 ILE N 1 1 20 18931 1 1 34 ILE O O -7.761 3.201 3.102 1.00 . A A . 34 ILE O 1 1 20 18932 1 1 35 PRO C C -7.298 1.997 5.617 1.00 . A A . 35 PRO C 1 1 20 18933 1 1 35 PRO CA C -7.901 0.922 4.718 1.00 . A A . 35 PRO CA 1 1 20 18934 1 1 35 PRO CB C -7.467 -0.468 5.180 1.00 . A A . 35 PRO CB 1 1 20 18935 1 1 35 PRO CD C -6.960 -0.330 2.849 1.00 . A A . 35 PRO CD 1 1 20 18936 1 1 35 PRO CG C -7.409 -1.275 3.930 1.00 . A A . 35 PRO CG 1 1 20 18937 1 1 35 PRO HA H -8.978 0.993 4.751 1.00 . A A . 35 PRO HA 1 1 20 18938 1 1 35 PRO HB2 H -6.501 -0.408 5.658 1.00 . A A . 35 PRO HB2 1 1 20 18939 1 1 35 PRO HB3 H -8.194 -0.866 5.871 1.00 . A A . 35 PRO HB3 1 1 20 18940 1 1 35 PRO HD2 H -5.885 -0.362 2.743 1.00 . A A . 35 PRO HD2 1 1 20 18941 1 1 35 PRO HD3 H -7.440 -0.573 1.913 1.00 . A A . 35 PRO HD3 1 1 20 18942 1 1 35 PRO HG2 H -6.698 -2.079 4.045 1.00 . A A . 35 PRO HG2 1 1 20 18943 1 1 35 PRO HG3 H -8.388 -1.668 3.700 1.00 . A A . 35 PRO HG3 1 1 20 18944 1 1 35 PRO N N -7.402 0.989 3.340 1.00 . A A . 35 PRO N 1 1 20 18945 1 1 35 PRO O O -6.317 2.647 5.258 1.00 . A A . 35 PRO O 1 1 20 18946 1 1 36 GLU C C -6.148 2.721 8.437 1.00 . A A . 36 GLU C 1 1 20 18947 1 1 36 GLU CA C -7.436 3.171 7.750 1.00 . A A . 36 GLU CA 1 1 20 18948 1 1 36 GLU CB C -8.526 3.431 8.795 1.00 . A A . 36 GLU CB 1 1 20 18949 1 1 36 GLU CD C -7.532 3.659 11.107 1.00 . A A . 36 GLU CD 1 1 20 18950 1 1 36 GLU CG C -8.104 4.383 9.904 1.00 . A A . 36 GLU CG 1 1 20 18951 1 1 36 GLU H H -8.679 1.628 7.013 1.00 . A A . 36 GLU H 1 1 20 18952 1 1 36 GLU HA H -7.241 4.086 7.211 1.00 . A A . 36 GLU HA 1 1 20 18953 1 1 36 GLU HB2 H -9.388 3.853 8.301 1.00 . A A . 36 GLU HB2 1 1 20 18954 1 1 36 GLU HB3 H -8.806 2.489 9.247 1.00 . A A . 36 GLU HB3 1 1 20 18955 1 1 36 GLU HG2 H -7.353 5.053 9.518 1.00 . A A . 36 GLU HG2 1 1 20 18956 1 1 36 GLU HG3 H -8.964 4.952 10.220 1.00 . A A . 36 GLU HG3 1 1 20 18957 1 1 36 GLU N N -7.899 2.177 6.789 1.00 . A A . 36 GLU N 1 1 20 18958 1 1 36 GLU O O -5.274 3.537 8.732 1.00 . A A . 36 GLU O 1 1 20 18959 1 1 36 GLU OE1 O -8.167 2.691 11.575 1.00 . A A . 36 GLU OE1 1 1 20 18960 1 1 36 GLU OE2 O -6.448 4.059 11.582 1.00 . A A . 36 GLU OE2 1 1 20 18961 1 1 37 LYS C C -3.789 0.456 8.358 1.00 . A A . 37 LYS C 1 1 20 18962 1 1 37 LYS CA C -4.860 0.873 9.363 1.00 . A A . 37 LYS CA 1 1 20 18963 1 1 37 LYS CB C -5.251 -0.320 10.238 1.00 . A A . 37 LYS CB 1 1 20 18964 1 1 37 LYS CD C -4.815 -1.200 12.550 1.00 . A A . 37 LYS CD 1 1 20 18965 1 1 37 LYS CE C -5.160 -1.021 14.020 1.00 . A A . 37 LYS CE 1 1 20 18966 1 1 37 LYS CG C -5.264 -0.005 11.724 1.00 . A A . 37 LYS CG 1 1 20 18967 1 1 37 LYS H H -6.771 0.821 8.449 1.00 . A A . 37 LYS H 1 1 20 18968 1 1 37 LYS HA H -4.452 1.648 9.994 1.00 . A A . 37 LYS HA 1 1 20 18969 1 1 37 LYS HB2 H -6.240 -0.651 9.953 1.00 . A A . 37 LYS HB2 1 1 20 18970 1 1 37 LYS HB3 H -4.551 -1.124 10.068 1.00 . A A . 37 LYS HB3 1 1 20 18971 1 1 37 LYS HD2 H -5.307 -2.086 12.180 1.00 . A A . 37 LYS HD2 1 1 20 18972 1 1 37 LYS HD3 H -3.745 -1.311 12.452 1.00 . A A . 37 LYS HD3 1 1 20 18973 1 1 37 LYS HE2 H -4.763 -0.075 14.356 1.00 . A A . 37 LYS HE2 1 1 20 18974 1 1 37 LYS HE3 H -6.235 -1.017 14.125 1.00 . A A . 37 LYS HE3 1 1 20 18975 1 1 37 LYS HG2 H -4.597 0.821 11.913 1.00 . A A . 37 LYS HG2 1 1 20 18976 1 1 37 LYS HG3 H -6.268 0.265 12.016 1.00 . A A . 37 LYS HG3 1 1 20 18977 1 1 37 LYS HZ1 H -3.580 -2.224 14.663 1.00 . A A . 37 LYS HZ1 1 1 20 18978 1 1 37 LYS HZ2 H -5.077 -3.009 14.656 1.00 . A A . 37 LYS HZ2 1 1 20 18979 1 1 37 LYS HZ3 H -4.717 -1.887 15.869 1.00 . A A . 37 LYS HZ3 1 1 20 18980 1 1 37 LYS N N -6.040 1.423 8.699 1.00 . A A . 37 LYS N 1 1 20 18981 1 1 37 LYS NZ N -4.594 -2.111 14.860 1.00 . A A . 37 LYS NZ 1 1 20 18982 1 1 37 LYS O O -2.619 0.314 8.714 1.00 . A A . 37 LYS O 1 1 20 18983 1 1 38 ASP C C -2.456 1.060 5.565 1.00 . A A . 38 ASP C 1 1 20 18984 1 1 38 ASP CA C -3.244 -0.142 6.069 1.00 . A A . 38 ASP CA 1 1 20 18985 1 1 38 ASP CB C -3.979 -0.813 4.907 1.00 . A A . 38 ASP CB 1 1 20 18986 1 1 38 ASP CG C -4.510 -2.187 5.272 1.00 . A A . 38 ASP CG 1 1 20 18987 1 1 38 ASP H H -5.129 0.384 6.873 1.00 . A A . 38 ASP H 1 1 20 18988 1 1 38 ASP HA H -2.555 -0.850 6.506 1.00 . A A . 38 ASP HA 1 1 20 18989 1 1 38 ASP HB2 H -4.813 -0.195 4.611 1.00 . A A . 38 ASP HB2 1 1 20 18990 1 1 38 ASP HB3 H -3.300 -0.919 4.074 1.00 . A A . 38 ASP HB3 1 1 20 18991 1 1 38 ASP N N -4.187 0.259 7.105 1.00 . A A . 38 ASP N 1 1 20 18992 1 1 38 ASP O O -1.248 0.977 5.343 1.00 . A A . 38 ASP O 1 1 20 18993 1 1 38 ASP OD1 O -4.725 -2.439 6.476 1.00 . A A . 38 ASP OD1 1 1 20 18994 1 1 38 ASP OD2 O -4.709 -3.009 4.354 1.00 . A A . 38 ASP OD2 1 1 20 18995 1 1 39 ALA C C -1.491 3.917 5.929 1.00 . A A . 39 ALA C 1 1 20 18996 1 1 39 ALA CA C -2.514 3.404 4.922 1.00 . A A . 39 ALA CA 1 1 20 18997 1 1 39 ALA CB C -3.565 4.469 4.650 1.00 . A A . 39 ALA CB 1 1 20 18998 1 1 39 ALA H H -4.107 2.184 5.590 1.00 . A A . 39 ALA H 1 1 20 18999 1 1 39 ALA HA H -2.010 3.184 3.992 1.00 . A A . 39 ALA HA 1 1 20 19000 1 1 39 ALA HB1 H -4.334 4.061 4.011 1.00 . A A . 39 ALA HB1 1 1 20 19001 1 1 39 ALA HB2 H -3.104 5.315 4.163 1.00 . A A . 39 ALA HB2 1 1 20 19002 1 1 39 ALA HB3 H -4.005 4.787 5.584 1.00 . A A . 39 ALA HB3 1 1 20 19003 1 1 39 ALA N N -3.148 2.180 5.392 1.00 . A A . 39 ALA N 1 1 20 19004 1 1 39 ALA O O -0.559 4.635 5.568 1.00 . A A . 39 ALA O 1 1 20 19005 1 1 40 TYR C C 0.617 3.357 8.084 1.00 . A A . 40 TYR C 1 1 20 19006 1 1 40 TYR CA C -0.765 3.984 8.249 1.00 . A A . 40 TYR CA 1 1 20 19007 1 1 40 TYR CB C -1.338 3.632 9.622 1.00 . A A . 40 TYR CB 1 1 20 19008 1 1 40 TYR CD1 C -0.326 5.391 11.120 1.00 . A A . 40 TYR CD1 1 1 20 19009 1 1 40 TYR CD2 C 0.280 3.115 11.486 1.00 . A A . 40 TYR CD2 1 1 20 19010 1 1 40 TYR CE1 C 0.494 5.782 12.159 1.00 . A A . 40 TYR CE1 1 1 20 19011 1 1 40 TYR CE2 C 1.102 3.499 12.529 1.00 . A A . 40 TYR CE2 1 1 20 19012 1 1 40 TYR CG C -0.447 4.054 10.766 1.00 . A A . 40 TYR CG 1 1 20 19013 1 1 40 TYR CZ C 1.206 4.833 12.862 1.00 . A A . 40 TYR CZ 1 1 20 19014 1 1 40 TYR H H -2.438 2.981 7.427 1.00 . A A . 40 TYR H 1 1 20 19015 1 1 40 TYR HA H -0.666 5.056 8.178 1.00 . A A . 40 TYR HA 1 1 20 19016 1 1 40 TYR HB2 H -2.291 4.127 9.744 1.00 . A A . 40 TYR HB2 1 1 20 19017 1 1 40 TYR HB3 H -1.479 2.561 9.684 1.00 . A A . 40 TYR HB3 1 1 20 19018 1 1 40 TYR HD1 H -0.886 6.131 10.568 1.00 . A A . 40 TYR HD1 1 1 20 19019 1 1 40 TYR HD2 H 0.197 2.071 11.221 1.00 . A A . 40 TYR HD2 1 1 20 19020 1 1 40 TYR HE1 H 0.573 6.828 12.417 1.00 . A A . 40 TYR HE1 1 1 20 19021 1 1 40 TYR HE2 H 1.659 2.754 13.078 1.00 . A A . 40 TYR HE2 1 1 20 19022 1 1 40 TYR HH H 1.550 5.131 14.731 1.00 . A A . 40 TYR HH 1 1 20 19023 1 1 40 TYR N N -1.672 3.550 7.194 1.00 . A A . 40 TYR N 1 1 20 19024 1 1 40 TYR O O 1.565 4.022 7.667 1.00 . A A . 40 TYR O 1 1 20 19025 1 1 40 TYR OH O 2.023 5.219 13.899 1.00 . A A . 40 TYR OH 1 1 20 19026 1 1 41 ARG C C 2.613 1.520 6.929 1.00 . A A . 41 ARG C 1 1 20 19027 1 1 41 ARG CA C 2.000 1.361 8.318 1.00 . A A . 41 ARG CA 1 1 20 19028 1 1 41 ARG CB C 1.808 -0.122 8.639 1.00 . A A . 41 ARG CB 1 1 20 19029 1 1 41 ARG CD C 0.498 -2.230 8.265 1.00 . A A . 41 ARG CD 1 1 20 19030 1 1 41 ARG CG C 0.688 -0.780 7.850 1.00 . A A . 41 ARG CG 1 1 20 19031 1 1 41 ARG CZ C -1.394 -3.786 8.539 1.00 . A A . 41 ARG CZ 1 1 20 19032 1 1 41 ARG H H -0.059 1.598 8.754 1.00 . A A . 41 ARG H 1 1 20 19033 1 1 41 ARG HA H 2.675 1.790 9.043 1.00 . A A . 41 ARG HA 1 1 20 19034 1 1 41 ARG HB2 H 2.726 -0.646 8.423 1.00 . A A . 41 ARG HB2 1 1 20 19035 1 1 41 ARG HB3 H 1.585 -0.224 9.692 1.00 . A A . 41 ARG HB3 1 1 20 19036 1 1 41 ARG HD2 H 1.215 -2.840 7.734 1.00 . A A . 41 ARG HD2 1 1 20 19037 1 1 41 ARG HD3 H 0.673 -2.311 9.328 1.00 . A A . 41 ARG HD3 1 1 20 19038 1 1 41 ARG HE H -1.372 -2.217 7.307 1.00 . A A . 41 ARG HE 1 1 20 19039 1 1 41 ARG HG2 H -0.230 -0.241 8.028 1.00 . A A . 41 ARG HG2 1 1 20 19040 1 1 41 ARG HG3 H 0.933 -0.745 6.798 1.00 . A A . 41 ARG HG3 1 1 20 19041 1 1 41 ARG HH11 H 0.215 -4.215 9.687 1.00 . A A . 41 ARG HH11 1 1 20 19042 1 1 41 ARG HH12 H -1.129 -5.292 9.861 1.00 . A A . 41 ARG HH12 1 1 20 19043 1 1 41 ARG HH21 H -3.141 -3.632 7.535 1.00 . A A . 41 ARG HH21 1 1 20 19044 1 1 41 ARG HH22 H -3.035 -4.962 8.640 1.00 . A A . 41 ARG HH22 1 1 20 19045 1 1 41 ARG N N 0.729 2.075 8.423 1.00 . A A . 41 ARG N 1 1 20 19046 1 1 41 ARG NE N -0.847 -2.715 7.967 1.00 . A A . 41 ARG NE 1 1 20 19047 1 1 41 ARG NH1 N -0.713 -4.488 9.437 1.00 . A A . 41 ARG NH1 1 1 20 19048 1 1 41 ARG NH2 N -2.624 -4.157 8.210 1.00 . A A . 41 ARG NH2 1 1 20 19049 1 1 41 ARG O O 3.830 1.419 6.763 1.00 . A A . 41 ARG O 1 1 20 19050 1 1 42 LEU C C 3.253 3.082 4.474 1.00 . A A . 42 LEU C 1 1 20 19051 1 1 42 LEU CA C 2.235 1.947 4.562 1.00 . A A . 42 LEU CA 1 1 20 19052 1 1 42 LEU CB C 1.054 2.228 3.631 1.00 . A A . 42 LEU CB 1 1 20 19053 1 1 42 LEU CD1 C -0.802 1.352 2.191 1.00 . A A . 42 LEU CD1 1 1 20 19054 1 1 42 LEU CD2 C 1.500 0.397 1.980 1.00 . A A . 42 LEU CD2 1 1 20 19055 1 1 42 LEU CG C 0.476 0.995 2.933 1.00 . A A . 42 LEU CG 1 1 20 19056 1 1 42 LEU H H 0.810 1.844 6.125 1.00 . A A . 42 LEU H 1 1 20 19057 1 1 42 LEU HA H 2.713 1.028 4.257 1.00 . A A . 42 LEU HA 1 1 20 19058 1 1 42 LEU HB2 H 0.268 2.690 4.211 1.00 . A A . 42 LEU HB2 1 1 20 19059 1 1 42 LEU HB3 H 1.376 2.926 2.872 1.00 . A A . 42 LEU HB3 1 1 20 19060 1 1 42 LEU HD11 H -0.770 2.391 1.896 1.00 . A A . 42 LEU HD11 1 1 20 19061 1 1 42 LEU HD12 H -1.652 1.186 2.836 1.00 . A A . 42 LEU HD12 1 1 20 19062 1 1 42 LEU HD13 H -0.892 0.733 1.310 1.00 . A A . 42 LEU HD13 1 1 20 19063 1 1 42 LEU HD21 H 1.927 1.180 1.371 1.00 . A A . 42 LEU HD21 1 1 20 19064 1 1 42 LEU HD22 H 1.017 -0.330 1.342 1.00 . A A . 42 LEU HD22 1 1 20 19065 1 1 42 LEU HD23 H 2.282 -0.084 2.546 1.00 . A A . 42 LEU HD23 1 1 20 19066 1 1 42 LEU HG H 0.234 0.250 3.675 1.00 . A A . 42 LEU HG 1 1 20 19067 1 1 42 LEU N N 1.768 1.773 5.933 1.00 . A A . 42 LEU N 1 1 20 19068 1 1 42 LEU O O 4.222 3.001 3.722 1.00 . A A . 42 LEU O 1 1 20 19069 1 1 43 GLU C C 5.311 4.890 5.762 1.00 . A A . 43 GLU C 1 1 20 19070 1 1 43 GLU CA C 3.926 5.287 5.260 1.00 . A A . 43 GLU CA 1 1 20 19071 1 1 43 GLU CB C 3.353 6.403 6.135 1.00 . A A . 43 GLU CB 1 1 20 19072 1 1 43 GLU CD C 3.722 8.708 7.103 1.00 . A A . 43 GLU CD 1 1 20 19073 1 1 43 GLU CG C 4.120 7.712 6.031 1.00 . A A . 43 GLU CG 1 1 20 19074 1 1 43 GLU H H 2.236 4.145 5.831 1.00 . A A . 43 GLU H 1 1 20 19075 1 1 43 GLU HA H 4.013 5.646 4.246 1.00 . A A . 43 GLU HA 1 1 20 19076 1 1 43 GLU HB2 H 2.330 6.586 5.841 1.00 . A A . 43 GLU HB2 1 1 20 19077 1 1 43 GLU HB3 H 3.371 6.082 7.165 1.00 . A A . 43 GLU HB3 1 1 20 19078 1 1 43 GLU HG2 H 5.175 7.505 6.129 1.00 . A A . 43 GLU HG2 1 1 20 19079 1 1 43 GLU HG3 H 3.927 8.150 5.064 1.00 . A A . 43 GLU HG3 1 1 20 19080 1 1 43 GLU N N 3.027 4.138 5.251 1.00 . A A . 43 GLU N 1 1 20 19081 1 1 43 GLU O O 6.318 5.467 5.354 1.00 . A A . 43 GLU O 1 1 20 19082 1 1 43 GLU OE1 O 2.675 9.369 6.940 1.00 . A A . 43 GLU OE1 1 1 20 19083 1 1 43 GLU OE2 O 4.456 8.826 8.107 1.00 . A A . 43 GLU OE2 1 1 20 19084 1 1 44 ILE C C 7.338 2.506 6.230 1.00 . A A . 44 ILE C 1 1 20 19085 1 1 44 ILE CA C 6.616 3.428 7.206 1.00 . A A . 44 ILE CA 1 1 20 19086 1 1 44 ILE CB C 6.396 2.679 8.534 1.00 . A A . 44 ILE CB 1 1 20 19087 1 1 44 ILE CD1 C 5.761 3.294 10.936 1.00 . A A . 44 ILE CD1 1 1 20 19088 1 1 44 ILE CG1 C 5.497 3.508 9.461 1.00 . A A . 44 ILE CG1 1 1 20 19089 1 1 44 ILE CG2 C 7.738 2.372 9.190 1.00 . A A . 44 ILE CG2 1 1 20 19090 1 1 44 ILE H H 4.516 3.481 6.937 1.00 . A A . 44 ILE H 1 1 20 19091 1 1 44 ILE HA H 7.238 4.289 7.406 1.00 . A A . 44 ILE HA 1 1 20 19092 1 1 44 ILE HB H 5.910 1.741 8.314 1.00 . A A . 44 ILE HB 1 1 20 19093 1 1 44 ILE HD11 H 6.694 3.767 11.204 1.00 . A A . 44 ILE HD11 1 1 20 19094 1 1 44 ILE HD12 H 5.822 2.235 11.141 1.00 . A A . 44 ILE HD12 1 1 20 19095 1 1 44 ILE HD13 H 4.958 3.729 11.513 1.00 . A A . 44 ILE HD13 1 1 20 19096 1 1 44 ILE HG12 H 5.644 4.556 9.249 1.00 . A A . 44 ILE HG12 1 1 20 19097 1 1 44 ILE HG13 H 4.464 3.251 9.269 1.00 . A A . 44 ILE HG13 1 1 20 19098 1 1 44 ILE HG21 H 7.588 1.692 10.014 1.00 . A A . 44 ILE HG21 1 1 20 19099 1 1 44 ILE HG22 H 8.178 3.290 9.555 1.00 . A A . 44 ILE HG22 1 1 20 19100 1 1 44 ILE HG23 H 8.398 1.921 8.465 1.00 . A A . 44 ILE HG23 1 1 20 19101 1 1 44 ILE N N 5.355 3.901 6.649 1.00 . A A . 44 ILE N 1 1 20 19102 1 1 44 ILE O O 8.528 2.676 5.962 1.00 . A A . 44 ILE O 1 1 20 19103 1 1 45 VAL C C 7.696 1.269 3.512 1.00 . A A . 45 VAL C 1 1 20 19104 1 1 45 VAL CA C 7.172 0.569 4.761 1.00 . A A . 45 VAL CA 1 1 20 19105 1 1 45 VAL CB C 6.121 -0.491 4.361 1.00 . A A . 45 VAL CB 1 1 20 19106 1 1 45 VAL CG1 C 5.350 -0.074 3.111 1.00 . A A . 45 VAL CG1 1 1 20 19107 1 1 45 VAL CG2 C 6.781 -1.847 4.162 1.00 . A A . 45 VAL CG2 1 1 20 19108 1 1 45 VAL H H 5.668 1.444 5.964 1.00 . A A . 45 VAL H 1 1 20 19109 1 1 45 VAL HA H 7.993 0.064 5.249 1.00 . A A . 45 VAL HA 1 1 20 19110 1 1 45 VAL HB H 5.414 -0.576 5.168 1.00 . A A . 45 VAL HB 1 1 20 19111 1 1 45 VAL HG11 H 4.541 -0.767 2.941 1.00 . A A . 45 VAL HG11 1 1 20 19112 1 1 45 VAL HG12 H 6.015 -0.081 2.260 1.00 . A A . 45 VAL HG12 1 1 20 19113 1 1 45 VAL HG13 H 4.952 0.919 3.249 1.00 . A A . 45 VAL HG13 1 1 20 19114 1 1 45 VAL HG21 H 7.159 -1.920 3.153 1.00 . A A . 45 VAL HG21 1 1 20 19115 1 1 45 VAL HG22 H 6.055 -2.628 4.334 1.00 . A A . 45 VAL HG22 1 1 20 19116 1 1 45 VAL HG23 H 7.598 -1.954 4.861 1.00 . A A . 45 VAL HG23 1 1 20 19117 1 1 45 VAL N N 6.609 1.527 5.706 1.00 . A A . 45 VAL N 1 1 20 19118 1 1 45 VAL O O 8.736 0.900 2.966 1.00 . A A . 45 VAL O 1 1 20 19119 1 1 46 THR C C 8.355 4.116 2.170 1.00 . A A . 46 THR C 1 1 20 19120 1 1 46 THR CA C 7.318 3.030 1.869 1.00 . A A . 46 THR CA 1 1 20 19121 1 1 46 THR CB C 6.066 3.662 1.270 1.00 . A A . 46 THR CB 1 1 20 19122 1 1 46 THR CG2 C 5.031 2.648 0.836 1.00 . A A . 46 THR CG2 1 1 20 19123 1 1 46 THR H H 6.132 2.507 3.535 1.00 . A A . 46 THR H 1 1 20 19124 1 1 46 THR HA H 7.737 2.339 1.153 1.00 . A A . 46 THR HA 1 1 20 19125 1 1 46 THR HB H 6.349 4.236 0.406 1.00 . A A . 46 THR HB 1 1 20 19126 1 1 46 THR HG1 H 5.771 5.430 2.062 1.00 . A A . 46 THR HG1 1 1 20 19127 1 1 46 THR HG21 H 4.221 3.152 0.330 1.00 . A A . 46 THR HG21 1 1 20 19128 1 1 46 THR HG22 H 4.647 2.132 1.704 1.00 . A A . 46 THR HG22 1 1 20 19129 1 1 46 THR HG23 H 5.486 1.933 0.165 1.00 . A A . 46 THR HG23 1 1 20 19130 1 1 46 THR N N 6.956 2.274 3.060 1.00 . A A . 46 THR N 1 1 20 19131 1 1 46 THR O O 8.424 5.123 1.467 1.00 . A A . 46 THR O 1 1 20 19132 1 1 46 THR OG1 O 5.450 4.536 2.200 1.00 . A A . 46 THR OG1 1 1 20 19133 1 1 47 ALA C C 9.617 6.286 3.698 1.00 . A A . 47 ALA C 1 1 20 19134 1 1 47 ALA CA C 10.189 4.875 3.585 1.00 . A A . 47 ALA CA 1 1 20 19135 1 1 47 ALA CB C 11.328 4.847 2.577 1.00 . A A . 47 ALA CB 1 1 20 19136 1 1 47 ALA H H 9.066 3.090 3.735 1.00 . A A . 47 ALA H 1 1 20 19137 1 1 47 ALA HA H 10.585 4.582 4.547 1.00 . A A . 47 ALA HA 1 1 20 19138 1 1 47 ALA HB1 H 11.828 3.890 2.627 1.00 . A A . 47 ALA HB1 1 1 20 19139 1 1 47 ALA HB2 H 12.032 5.633 2.807 1.00 . A A . 47 ALA HB2 1 1 20 19140 1 1 47 ALA HB3 H 10.933 4.995 1.583 1.00 . A A . 47 ALA HB3 1 1 20 19141 1 1 47 ALA N N 9.160 3.910 3.210 1.00 . A A . 47 ALA N 1 1 20 19142 1 1 47 ALA O O 10.331 7.272 3.511 1.00 . A A . 47 ALA O 1 1 20 19143 1 1 48 GLY C C 7.388 8.313 2.795 1.00 . A A . 48 GLY C 1 1 20 19144 1 1 48 GLY CA C 7.685 7.671 4.136 1.00 . A A . 48 GLY CA 1 1 20 19145 1 1 48 GLY H H 7.807 5.558 4.142 1.00 . A A . 48 GLY H 1 1 20 19146 1 1 48 GLY HA2 H 6.759 7.547 4.675 1.00 . A A . 48 GLY HA2 1 1 20 19147 1 1 48 GLY HA3 H 8.333 8.325 4.700 1.00 . A A . 48 GLY HA3 1 1 20 19148 1 1 48 GLY N N 8.327 6.375 4.005 1.00 . A A . 48 GLY N 1 1 20 19149 1 1 48 GLY O O 7.240 9.532 2.702 1.00 . A A . 48 GLY O 1 1 20 19150 1 1 49 ALA C C 5.651 8.680 0.366 1.00 . A A . 49 ALA C 1 1 20 19151 1 1 49 ALA CA C 7.012 7.995 0.412 1.00 . A A . 49 ALA CA 1 1 20 19152 1 1 49 ALA CB C 7.066 6.860 -0.600 1.00 . A A . 49 ALA CB 1 1 20 19153 1 1 49 ALA H H 7.422 6.532 1.884 1.00 . A A . 49 ALA H 1 1 20 19154 1 1 49 ALA HA H 7.776 8.714 0.154 1.00 . A A . 49 ALA HA 1 1 20 19155 1 1 49 ALA HB1 H 8.060 6.436 -0.611 1.00 . A A . 49 ALA HB1 1 1 20 19156 1 1 49 ALA HB2 H 6.828 7.242 -1.582 1.00 . A A . 49 ALA HB2 1 1 20 19157 1 1 49 ALA HB3 H 6.352 6.099 -0.326 1.00 . A A . 49 ALA HB3 1 1 20 19158 1 1 49 ALA N N 7.297 7.495 1.750 1.00 . A A . 49 ALA N 1 1 20 19159 1 1 49 ALA O O 5.540 9.838 -0.038 1.00 . A A . 49 ALA O 1 1 20 19160 1 1 50 LEU C C 2.994 9.245 2.103 1.00 . A A . 50 LEU C 1 1 20 19161 1 1 50 LEU CA C 3.264 8.496 0.801 1.00 . A A . 50 LEU CA 1 1 20 19162 1 1 50 LEU CB C 2.244 7.369 0.622 1.00 . A A . 50 LEU CB 1 1 20 19163 1 1 50 LEU CD1 C 1.969 5.149 -0.514 1.00 . A A . 50 LEU CD1 1 1 20 19164 1 1 50 LEU CD2 C 1.455 7.259 -1.754 1.00 . A A . 50 LEU CD2 1 1 20 19165 1 1 50 LEU CG C 2.344 6.611 -0.704 1.00 . A A . 50 LEU CG 1 1 20 19166 1 1 50 LEU H H 4.773 7.043 1.102 1.00 . A A . 50 LEU H 1 1 20 19167 1 1 50 LEU HA H 3.174 9.187 -0.022 1.00 . A A . 50 LEU HA 1 1 20 19168 1 1 50 LEU HB2 H 2.376 6.662 1.429 1.00 . A A . 50 LEU HB2 1 1 20 19169 1 1 50 LEU HB3 H 1.254 7.793 0.694 1.00 . A A . 50 LEU HB3 1 1 20 19170 1 1 50 LEU HD11 H 2.739 4.651 0.057 1.00 . A A . 50 LEU HD11 1 1 20 19171 1 1 50 LEU HD12 H 1.874 4.672 -1.479 1.00 . A A . 50 LEU HD12 1 1 20 19172 1 1 50 LEU HD13 H 1.030 5.082 0.013 1.00 . A A . 50 LEU HD13 1 1 20 19173 1 1 50 LEU HD21 H 0.442 7.313 -1.385 1.00 . A A . 50 LEU HD21 1 1 20 19174 1 1 50 LEU HD22 H 1.478 6.669 -2.659 1.00 . A A . 50 LEU HD22 1 1 20 19175 1 1 50 LEU HD23 H 1.814 8.254 -1.965 1.00 . A A . 50 LEU HD23 1 1 20 19176 1 1 50 LEU HG H 3.365 6.651 -1.058 1.00 . A A . 50 LEU HG 1 1 20 19177 1 1 50 LEU N N 4.619 7.959 0.789 1.00 . A A . 50 LEU N 1 1 20 19178 1 1 50 LEU O O 3.762 9.142 3.060 1.00 . A A . 50 LEU O 1 1 20 19179 1 1 51 LYS C C 0.131 10.403 3.792 1.00 . A A . 51 LYS C 1 1 20 19180 1 1 51 LYS CA C 1.535 10.766 3.320 1.00 . A A . 51 LYS CA 1 1 20 19181 1 1 51 LYS CB C 1.614 12.266 3.029 1.00 . A A . 51 LYS CB 1 1 20 19182 1 1 51 LYS CD C 1.924 12.945 0.628 1.00 . A A . 51 LYS CD 1 1 20 19183 1 1 51 LYS CE C 1.244 13.500 -0.613 1.00 . A A . 51 LYS CE 1 1 20 19184 1 1 51 LYS CG C 0.921 12.671 1.738 1.00 . A A . 51 LYS CG 1 1 20 19185 1 1 51 LYS H H 1.328 10.044 1.340 1.00 . A A . 51 LYS H 1 1 20 19186 1 1 51 LYS HA H 2.238 10.523 4.102 1.00 . A A . 51 LYS HA 1 1 20 19187 1 1 51 LYS HB2 H 1.154 12.803 3.844 1.00 . A A . 51 LYS HB2 1 1 20 19188 1 1 51 LYS HB3 H 2.654 12.552 2.961 1.00 . A A . 51 LYS HB3 1 1 20 19189 1 1 51 LYS HD2 H 2.649 13.663 0.981 1.00 . A A . 51 LYS HD2 1 1 20 19190 1 1 51 LYS HD3 H 2.423 12.022 0.372 1.00 . A A . 51 LYS HD3 1 1 20 19191 1 1 51 LYS HE2 H 0.658 14.363 -0.331 1.00 . A A . 51 LYS HE2 1 1 20 19192 1 1 51 LYS HE3 H 2.004 13.799 -1.321 1.00 . A A . 51 LYS HE3 1 1 20 19193 1 1 51 LYS HG2 H 0.265 11.873 1.427 1.00 . A A . 51 LYS HG2 1 1 20 19194 1 1 51 LYS HG3 H 0.343 13.565 1.918 1.00 . A A . 51 LYS HG3 1 1 20 19195 1 1 51 LYS HZ1 H 0.917 11.760 -1.721 1.00 . A A . 51 LYS HZ1 1 1 20 19196 1 1 51 LYS HZ2 H -0.253 12.957 -1.966 1.00 . A A . 51 LYS HZ2 1 1 20 19197 1 1 51 LYS HZ3 H -0.258 12.051 -0.539 1.00 . A A . 51 LYS HZ3 1 1 20 19198 1 1 51 LYS N N 1.900 10.000 2.134 1.00 . A A . 51 LYS N 1 1 20 19199 1 1 51 LYS NZ N 0.350 12.497 -1.254 1.00 . A A . 51 LYS NZ 1 1 20 19200 1 1 51 LYS O O -0.829 10.471 3.025 1.00 . A A . 51 LYS O 1 1 20 19201 1 1 52 TYR C C -2.151 10.867 5.853 1.00 . A A . 52 TYR C 1 1 20 19202 1 1 52 TYR CA C -1.268 9.641 5.631 1.00 . A A . 52 TYR CA 1 1 20 19203 1 1 52 TYR CB C -1.070 8.901 6.956 1.00 . A A . 52 TYR CB 1 1 20 19204 1 1 52 TYR CD1 C -3.386 8.774 7.961 1.00 . A A . 52 TYR CD1 1 1 20 19205 1 1 52 TYR CD2 C -2.344 6.746 7.265 1.00 . A A . 52 TYR CD2 1 1 20 19206 1 1 52 TYR CE1 C -4.498 8.068 8.369 1.00 . A A . 52 TYR CE1 1 1 20 19207 1 1 52 TYR CE2 C -3.456 6.032 7.671 1.00 . A A . 52 TYR CE2 1 1 20 19208 1 1 52 TYR CG C -2.290 8.126 7.402 1.00 . A A . 52 TYR CG 1 1 20 19209 1 1 52 TYR CZ C -4.529 6.698 8.222 1.00 . A A . 52 TYR CZ 1 1 20 19210 1 1 52 TYR H H 0.821 9.981 5.621 1.00 . A A . 52 TYR H 1 1 20 19211 1 1 52 TYR HA H -1.761 8.981 4.933 1.00 . A A . 52 TYR HA 1 1 20 19212 1 1 52 TYR HB2 H -0.253 8.203 6.853 1.00 . A A . 52 TYR HB2 1 1 20 19213 1 1 52 TYR HB3 H -0.829 9.617 7.729 1.00 . A A . 52 TYR HB3 1 1 20 19214 1 1 52 TYR HD1 H -3.362 9.847 8.072 1.00 . A A . 52 TYR HD1 1 1 20 19215 1 1 52 TYR HD2 H -1.501 6.228 6.832 1.00 . A A . 52 TYR HD2 1 1 20 19216 1 1 52 TYR HE1 H -5.341 8.589 8.800 1.00 . A A . 52 TYR HE1 1 1 20 19217 1 1 52 TYR HE2 H -3.480 4.959 7.555 1.00 . A A . 52 TYR HE2 1 1 20 19218 1 1 52 TYR HH H -6.408 6.556 8.607 1.00 . A A . 52 TYR HH 1 1 20 19219 1 1 52 TYR N N 0.019 10.017 5.059 1.00 . A A . 52 TYR N 1 1 20 19220 1 1 52 TYR O O -1.717 11.860 6.437 1.00 . A A . 52 TYR O 1 1 20 19221 1 1 52 TYR OH O -5.635 5.988 8.628 1.00 . A A . 52 TYR OH 1 1 20 19222 1 1 53 GLN C C -5.605 11.389 6.244 1.00 . A A . 53 GLN C 1 1 20 19223 1 1 53 GLN CA C -4.344 11.876 5.539 1.00 . A A . 53 GLN CA 1 1 20 19224 1 1 53 GLN CB C -4.703 12.461 4.172 1.00 . A A . 53 GLN CB 1 1 20 19225 1 1 53 GLN CD C -4.123 14.676 3.100 1.00 . A A . 53 GLN CD 1 1 20 19226 1 1 53 GLN CG C -3.608 13.331 3.576 1.00 . A A . 53 GLN CG 1 1 20 19227 1 1 53 GLN H H -3.677 9.960 4.937 1.00 . A A . 53 GLN H 1 1 20 19228 1 1 53 GLN HA H -3.880 12.642 6.142 1.00 . A A . 53 GLN HA 1 1 20 19229 1 1 53 GLN HB2 H -4.902 11.651 3.486 1.00 . A A . 53 GLN HB2 1 1 20 19230 1 1 53 GLN HB3 H -5.595 13.062 4.274 1.00 . A A . 53 GLN HB3 1 1 20 19231 1 1 53 GLN HE21 H -3.267 14.403 1.326 1.00 . A A . 53 GLN HE21 1 1 20 19232 1 1 53 GLN HE22 H -4.127 15.889 1.524 1.00 . A A . 53 GLN HE22 1 1 20 19233 1 1 53 GLN HG2 H -2.850 13.498 4.327 1.00 . A A . 53 GLN HG2 1 1 20 19234 1 1 53 GLN HG3 H -3.171 12.811 2.735 1.00 . A A . 53 GLN HG3 1 1 20 19235 1 1 53 GLN N N -3.392 10.782 5.389 1.00 . A A . 53 GLN N 1 1 20 19236 1 1 53 GLN NE2 N -3.807 15.025 1.858 1.00 . A A . 53 GLN NE2 1 1 20 19237 1 1 53 GLN O O -6.241 10.434 5.803 1.00 . A A . 53 GLN O 1 1 20 19238 1 1 53 GLN OE1 O -4.796 15.393 3.839 1.00 . A A . 53 GLN OE1 1 1 20 19239 1 1 54 GLU C C -8.399 12.361 7.593 1.00 . A A . 54 GLU C 1 1 20 19240 1 1 54 GLU CA C -7.142 11.668 8.115 1.00 . A A . 54 GLU CA 1 1 20 19241 1 1 54 GLU CB C -6.936 12.003 9.594 1.00 . A A . 54 GLU CB 1 1 20 19242 1 1 54 GLU CD C -7.323 10.603 11.661 1.00 . A A . 54 GLU CD 1 1 20 19243 1 1 54 GLU CG C -6.471 10.818 10.426 1.00 . A A . 54 GLU CG 1 1 20 19244 1 1 54 GLU H H -5.410 12.797 7.651 1.00 . A A . 54 GLU H 1 1 20 19245 1 1 54 GLU HA H -7.270 10.600 8.015 1.00 . A A . 54 GLU HA 1 1 20 19246 1 1 54 GLU HB2 H -6.193 12.783 9.674 1.00 . A A . 54 GLU HB2 1 1 20 19247 1 1 54 GLU HB3 H -7.868 12.362 10.005 1.00 . A A . 54 GLU HB3 1 1 20 19248 1 1 54 GLU HG2 H -6.518 9.927 9.817 1.00 . A A . 54 GLU HG2 1 1 20 19249 1 1 54 GLU HG3 H -5.451 10.990 10.736 1.00 . A A . 54 GLU HG3 1 1 20 19250 1 1 54 GLU N N -5.959 12.046 7.346 1.00 . A A . 54 GLU N 1 1 20 19251 1 1 54 GLU O O -9.335 12.616 8.352 1.00 . A A . 54 GLU O 1 1 20 19252 1 1 54 GLU OE1 O -8.553 10.801 11.577 1.00 . A A . 54 GLU OE1 1 1 20 19253 1 1 54 GLU OE2 O -6.761 10.236 12.715 1.00 . A A . 54 GLU OE2 1 1 20 19254 1 1 55 ASN C C -10.570 12.274 5.182 1.00 . A A . 55 ASN C 1 1 20 19255 1 1 55 ASN CA C -9.578 13.308 5.690 1.00 . A A . 55 ASN CA 1 1 20 19256 1 1 55 ASN CB C -9.132 14.215 4.542 1.00 . A A . 55 ASN CB 1 1 20 19257 1 1 55 ASN CG C -8.482 15.493 5.032 1.00 . A A . 55 ASN CG 1 1 20 19258 1 1 55 ASN H H -7.658 12.424 5.737 1.00 . A A . 55 ASN H 1 1 20 19259 1 1 55 ASN HA H -10.050 13.909 6.449 1.00 . A A . 55 ASN HA 1 1 20 19260 1 1 55 ASN HB2 H -8.420 13.684 3.926 1.00 . A A . 55 ASN HB2 1 1 20 19261 1 1 55 ASN HB3 H -9.993 14.476 3.943 1.00 . A A . 55 ASN HB3 1 1 20 19262 1 1 55 ASN HD21 H -10.170 16.498 4.729 1.00 . A A . 55 ASN HD21 1 1 20 19263 1 1 55 ASN HD22 H -8.849 17.421 5.351 1.00 . A A . 55 ASN HD22 1 1 20 19264 1 1 55 ASN N N -8.425 12.655 6.297 1.00 . A A . 55 ASN N 1 1 20 19265 1 1 55 ASN ND2 N -9.245 16.581 5.038 1.00 . A A . 55 ASN ND2 1 1 20 19266 1 1 55 ASN O O -11.780 12.479 5.252 1.00 . A A . 55 ASN O 1 1 20 19267 1 1 55 ASN OD1 O -7.308 15.504 5.403 1.00 . A A . 55 ASN OD1 1 1 20 19268 1 1 56 ALA C C -11.150 9.023 5.215 1.00 . A A . 56 ALA C 1 1 20 19269 1 1 56 ALA CA C -10.900 10.092 4.154 1.00 . A A . 56 ALA CA 1 1 20 19270 1 1 56 ALA CB C -10.260 9.469 2.919 1.00 . A A . 56 ALA CB 1 1 20 19271 1 1 56 ALA H H -9.085 11.057 4.645 1.00 . A A . 56 ALA H 1 1 20 19272 1 1 56 ALA HA H -11.840 10.523 3.863 1.00 . A A . 56 ALA HA 1 1 20 19273 1 1 56 ALA HB1 H -9.555 10.163 2.494 1.00 . A A . 56 ALA HB1 1 1 20 19274 1 1 56 ALA HB2 H -11.030 9.251 2.191 1.00 . A A . 56 ALA HB2 1 1 20 19275 1 1 56 ALA HB3 H -9.759 8.557 3.196 1.00 . A A . 56 ALA HB3 1 1 20 19276 1 1 56 ALA N N -10.050 11.162 4.672 1.00 . A A . 56 ALA N 1 1 20 19277 1 1 56 ALA O O -12.070 8.209 5.084 1.00 . A A . 56 ALA O 1 1 20 19278 1 1 57 TYR C C -11.320 8.621 8.490 1.00 . A A . 57 TYR C 1 1 20 19279 1 1 57 TYR CA C -10.470 8.056 7.348 1.00 . A A . 57 TYR CA 1 1 20 19280 1 1 57 TYR CB C -9.100 7.648 7.869 1.00 . A A . 57 TYR CB 1 1 20 19281 1 1 57 TYR CD1 C -8.393 6.277 5.871 1.00 . A A . 57 TYR CD1 1 1 20 19282 1 1 57 TYR CD2 C -6.920 7.986 6.641 1.00 . A A . 57 TYR CD2 1 1 20 19283 1 1 57 TYR CE1 C -7.500 5.952 4.869 1.00 . A A . 57 TYR CE1 1 1 20 19284 1 1 57 TYR CE2 C -6.021 7.667 5.641 1.00 . A A . 57 TYR CE2 1 1 20 19285 1 1 57 TYR CG C -8.119 7.297 6.774 1.00 . A A . 57 TYR CG 1 1 20 19286 1 1 57 TYR CZ C -6.316 6.649 4.757 1.00 . A A . 57 TYR CZ 1 1 20 19287 1 1 57 TYR H H -9.627 9.697 6.318 1.00 . A A . 57 TYR H 1 1 20 19288 1 1 57 TYR HA H -10.970 7.184 6.949 1.00 . A A . 57 TYR HA 1 1 20 19289 1 1 57 TYR HB2 H -8.683 8.463 8.440 1.00 . A A . 57 TYR HB2 1 1 20 19290 1 1 57 TYR HB3 H -9.207 6.785 8.509 1.00 . A A . 57 TYR HB3 1 1 20 19291 1 1 57 TYR HD1 H -9.321 5.732 5.960 1.00 . A A . 57 TYR HD1 1 1 20 19292 1 1 57 TYR HD2 H -6.690 8.783 7.335 1.00 . A A . 57 TYR HD2 1 1 20 19293 1 1 57 TYR HE1 H -7.731 5.155 4.177 1.00 . A A . 57 TYR HE1 1 1 20 19294 1 1 57 TYR HE2 H -5.093 8.212 5.554 1.00 . A A . 57 TYR HE2 1 1 20 19295 1 1 57 TYR HH H -5.903 6.117 2.957 1.00 . A A . 57 TYR HH 1 1 20 19296 1 1 57 TYR N N -10.330 9.027 6.267 1.00 . A A . 57 TYR N 1 1 20 19297 1 1 57 TYR O O -11.220 8.159 9.627 1.00 . A A . 57 TYR O 1 1 20 19298 1 1 57 TYR OH O -5.423 6.329 3.760 1.00 . A A . 57 TYR OH 1 1 20 19299 1 1 58 ARG C C -14.460 9.895 8.942 1.00 . A A . 58 ARG C 1 1 20 19300 1 1 58 ARG CA C -12.990 10.244 9.186 1.00 . A A . 58 ARG CA 1 1 20 19301 1 1 58 ARG CB C -12.810 11.764 9.170 1.00 . A A . 58 ARG CB 1 1 20 19302 1 1 58 ARG CD C -11.660 13.777 10.142 1.00 . A A . 58 ARG CD 1 1 20 19303 1 1 58 ARG CG C -11.820 12.267 10.211 1.00 . A A . 58 ARG CG 1 1 20 19304 1 1 58 ARG CZ C -11.130 14.380 12.472 1.00 . A A . 58 ARG CZ 1 1 20 19305 1 1 58 ARG H H -12.170 9.948 7.260 1.00 . A A . 58 ARG H 1 1 20 19306 1 1 58 ARG HA H -12.700 9.865 10.153 1.00 . A A . 58 ARG HA 1 1 20 19307 1 1 58 ARG HB2 H -12.450 12.062 8.194 1.00 . A A . 58 ARG HB2 1 1 20 19308 1 1 58 ARG HB3 H -13.760 12.235 9.353 1.00 . A A . 58 ARG HB3 1 1 20 19309 1 1 58 ARG HD2 H -11.250 14.039 9.180 1.00 . A A . 58 ARG HD2 1 1 20 19310 1 1 58 ARG HD3 H -12.630 14.235 10.250 1.00 . A A . 58 ARG HD3 1 1 20 19311 1 1 58 ARG HE H -9.883 14.565 10.928 1.00 . A A . 58 ARG HE 1 1 20 19312 1 1 58 ARG HG2 H -12.180 11.997 11.192 1.00 . A A . 58 ARG HG2 1 1 20 19313 1 1 58 ARG HG3 H -10.860 11.804 10.036 1.00 . A A . 58 ARG HG3 1 1 20 19314 1 1 58 ARG HH11 H -13.000 13.649 12.200 1.00 . A A . 58 ARG HH11 1 1 20 19315 1 1 58 ARG HH12 H -12.600 14.081 13.829 1.00 . A A . 58 ARG HH12 1 1 20 19316 1 1 58 ARG HH21 H -9.358 15.135 13.070 1.00 . A A . 58 ARG HH21 1 1 20 19317 1 1 58 ARG HH22 H -10.530 14.926 14.323 1.00 . A A . 58 ARG HH22 1 1 20 19318 1 1 58 ARG N N -12.140 9.621 8.183 1.00 . A A . 58 ARG N 1 1 20 19319 1 1 58 ARG NE N -10.780 14.284 11.192 1.00 . A A . 58 ARG NE 1 1 20 19320 1 1 58 ARG NH1 N -12.340 14.007 12.866 1.00 . A A . 58 ARG NH1 1 1 20 19321 1 1 58 ARG NH2 N -10.270 14.853 13.361 1.00 . A A . 58 ARG NH2 1 1 20 19322 1 1 58 ARG O O -14.780 9.106 8.053 1.00 . A A . 58 ARG O 1 1 20 19323 1 1 59 GLN C C -17.580 11.475 9.976 1.00 . A A . 59 GLN C 1 1 20 19324 1 1 59 GLN CA C -16.770 10.235 9.608 1.00 . A A . 59 GLN CA 1 1 20 19325 1 1 59 GLN CB C -17.190 9.060 10.494 1.00 . A A . 59 GLN CB 1 1 20 19326 1 1 59 GLN CD C -18.310 6.801 10.368 1.00 . A A . 59 GLN CD 1 1 20 19327 1 1 59 GLN CG C -18.350 8.251 9.930 1.00 . A A . 59 GLN CG 1 1 20 19328 1 1 59 GLN H H -15.030 11.103 10.430 1.00 . A A . 59 GLN H 1 1 20 19329 1 1 59 GLN HA H -16.970 9.984 8.576 1.00 . A A . 59 GLN HA 1 1 20 19330 1 1 59 GLN HB2 H -16.340 8.401 10.620 1.00 . A A . 59 GLN HB2 1 1 20 19331 1 1 59 GLN HB3 H -17.480 9.441 11.463 1.00 . A A . 59 GLN HB3 1 1 20 19332 1 1 59 GLN HE21 H -20.250 6.856 10.793 1.00 . A A . 59 GLN HE21 1 1 20 19333 1 1 59 GLN HE22 H -19.470 5.345 11.076 1.00 . A A . 59 GLN HE22 1 1 20 19334 1 1 59 GLN HG2 H -19.270 8.690 10.266 1.00 . A A . 59 GLN HG2 1 1 20 19335 1 1 59 GLN HG3 H -18.300 8.288 8.852 1.00 . A A . 59 GLN HG3 1 1 20 19336 1 1 59 GLN N N -15.340 10.485 9.739 1.00 . A A . 59 GLN N 1 1 20 19337 1 1 59 GLN NE2 N -19.460 6.281 10.788 1.00 . A A . 59 GLN NE2 1 1 20 19338 1 1 59 GLN O O -17.350 12.090 11.019 1.00 . A A . 59 GLN O 1 1 20 19339 1 1 59 GLN OE1 O -17.270 6.153 10.327 1.00 . A A . 59 GLN OE1 1 1 20 19340 1 1 60 ALA C C -18.520 14.274 9.469 1.00 . A A . 60 ALA C 1 1 20 19341 1 1 60 ALA CA C -19.370 13.007 9.349 1.00 . A A . 60 ALA CA 1 1 20 19342 1 1 60 ALA CB C -20.210 12.808 10.600 1.00 . A A . 60 ALA CB 1 1 20 19343 1 1 60 ALA H H -18.660 11.310 8.301 1.00 . A A . 60 ALA H 1 1 20 19344 1 1 60 ALA HA H -20.030 13.111 8.506 1.00 . A A . 60 ALA HA 1 1 20 19345 1 1 60 ALA HB1 H -19.560 12.751 11.464 1.00 . A A . 60 ALA HB1 1 1 20 19346 1 1 60 ALA HB2 H -20.770 11.893 10.512 1.00 . A A . 60 ALA HB2 1 1 20 19347 1 1 60 ALA HB3 H -20.890 13.641 10.713 1.00 . A A . 60 ALA HB3 1 1 20 19348 1 1 60 ALA N N -18.520 11.840 9.115 1.00 . A A . 60 ALA N 1 1 20 19349 1 1 60 ALA O O -17.300 14.220 9.443 1.00 . A A . 60 ALA O 1 1 20 19350 1 1 61 ALA C C -19.300 17.656 10.605 1.00 . A A . 61 ALA C 1 1 20 19351 1 1 61 ALA CA C -18.510 16.694 9.730 1.00 . A A . 61 ALA CA 1 1 20 19352 1 1 61 ALA CB C -18.270 17.300 8.355 1.00 . A A . 61 ALA CB 1 1 20 19353 1 1 61 ALA H H -20.180 15.392 9.619 1.00 . A A . 61 ALA H 1 1 20 19354 1 1 61 ALA HA H -17.550 16.513 10.189 1.00 . A A . 61 ALA HA 1 1 20 19355 1 1 61 ALA HB1 H -19.040 18.031 8.146 1.00 . A A . 61 ALA HB1 1 1 20 19356 1 1 61 ALA HB2 H -18.300 16.522 7.608 1.00 . A A . 61 ALA HB2 1 1 20 19357 1 1 61 ALA HB3 H -17.300 17.779 8.337 1.00 . A A . 61 ALA HB3 1 1 20 19358 1 1 61 ALA N N -19.200 15.413 9.603 1.00 . A A . 61 ALA N 1 1 20 19359 1 1 61 ALA O O -20.510 17.399 10.827 1.00 . A A . 61 ALA O 1 1 20 19360 1 1 61 ALA OXT O -18.720 18.659 11.063 1.00 . A A . 61 ALA OXT 1 1 21 19361 1 1 1 MET C C -5.368 6.133 -0.771 1.00 . A A . 1 MET C 1 1 21 19362 1 1 1 MET CA C -4.706 7.034 0.266 1.00 . A A . 1 MET CA 1 1 21 19363 1 1 1 MET CB C -3.782 6.211 1.166 1.00 . A A . 1 MET CB 1 1 21 19364 1 1 1 MET CE C -1.074 7.556 2.090 1.00 . A A . 1 MET CE 1 1 21 19365 1 1 1 MET CG C -2.489 5.791 0.489 1.00 . A A . 1 MET CG 1 1 21 19366 1 1 1 MET H1 H -6.136 8.484 0.562 1.00 . A A . 1 MET H1 1 1 21 19367 1 1 1 MET H2 H -5.236 8.071 1.962 1.00 . A A . 1 MET H2 1 1 21 19368 1 1 1 MET H3 H -6.442 7.004 1.370 1.00 . A A . 1 MET H3 1 1 21 19369 1 1 1 MET HA H -4.127 7.789 -0.244 1.00 . A A . 1 MET HA 1 1 21 19370 1 1 1 MET HB2 H -3.533 6.797 2.038 1.00 . A A . 1 MET HB2 1 1 21 19371 1 1 1 MET HB3 H -4.307 5.320 1.480 1.00 . A A . 1 MET HB3 1 1 21 19372 1 1 1 MET HE1 H -1.516 8.521 2.288 1.00 . A A . 1 MET HE1 1 1 21 19373 1 1 1 MET HE2 H -0.019 7.589 2.317 1.00 . A A . 1 MET HE2 1 1 21 19374 1 1 1 MET HE3 H -1.552 6.809 2.705 1.00 . A A . 1 MET HE3 1 1 21 19375 1 1 1 MET HG2 H -2.042 4.991 1.060 1.00 . A A . 1 MET HG2 1 1 21 19376 1 1 1 MET HG3 H -2.718 5.436 -0.506 1.00 . A A . 1 MET HG3 1 1 21 19377 1 1 1 MET N N -5.720 7.709 1.117 1.00 . A A . 1 MET N 1 1 21 19378 1 1 1 MET O O -6.036 5.159 -0.425 1.00 . A A . 1 MET O 1 1 21 19379 1 1 1 MET SD S -1.300 7.141 0.363 1.00 . A A . 1 MET SD 1 1 21 19380 1 1 2 TYR C C -4.982 4.383 -3.331 1.00 . A A . 2 TYR C 1 1 21 19381 1 1 2 TYR CA C -5.753 5.683 -3.131 1.00 . A A . 2 TYR CA 1 1 21 19382 1 1 2 TYR CB C -5.755 6.497 -4.426 1.00 . A A . 2 TYR CB 1 1 21 19383 1 1 2 TYR CD1 C -7.824 7.764 -3.726 1.00 . A A . 2 TYR CD1 1 1 21 19384 1 1 2 TYR CD2 C -6.116 8.952 -4.891 1.00 . A A . 2 TYR CD2 1 1 21 19385 1 1 2 TYR CE1 C -8.582 8.917 -3.652 1.00 . A A . 2 TYR CE1 1 1 21 19386 1 1 2 TYR CE2 C -6.869 10.110 -4.819 1.00 . A A . 2 TYR CE2 1 1 21 19387 1 1 2 TYR CG C -6.580 7.761 -4.346 1.00 . A A . 2 TYR CG 1 1 21 19388 1 1 2 TYR CZ C -8.099 10.087 -4.200 1.00 . A A . 2 TYR CZ 1 1 21 19389 1 1 2 TYR H H -4.633 7.251 -2.256 1.00 . A A . 2 TYR H 1 1 21 19390 1 1 2 TYR HA H -6.772 5.445 -2.864 1.00 . A A . 2 TYR HA 1 1 21 19391 1 1 2 TYR HB2 H -4.741 6.778 -4.666 1.00 . A A . 2 TYR HB2 1 1 21 19392 1 1 2 TYR HB3 H -6.154 5.889 -5.225 1.00 . A A . 2 TYR HB3 1 1 21 19393 1 1 2 TYR HD1 H -8.198 6.847 -3.297 1.00 . A A . 2 TYR HD1 1 1 21 19394 1 1 2 TYR HD2 H -5.151 8.967 -5.377 1.00 . A A . 2 TYR HD2 1 1 21 19395 1 1 2 TYR HE1 H -9.546 8.899 -3.166 1.00 . A A . 2 TYR HE1 1 1 21 19396 1 1 2 TYR HE2 H -6.491 11.026 -5.249 1.00 . A A . 2 TYR HE2 1 1 21 19397 1 1 2 TYR HH H -9.773 11.029 -4.300 1.00 . A A . 2 TYR HH 1 1 21 19398 1 1 2 TYR N N -5.177 6.464 -2.044 1.00 . A A . 2 TYR N 1 1 21 19399 1 1 2 TYR O O -3.755 4.357 -3.237 1.00 . A A . 2 TYR O 1 1 21 19400 1 1 2 TYR OH O -8.851 11.237 -4.126 1.00 . A A . 2 TYR OH 1 1 21 19401 1 1 3 LYS C C -4.105 2.040 -4.979 1.00 . A A . 3 LYS C 1 1 21 19402 1 1 3 LYS CA C -5.090 1.999 -3.815 1.00 . A A . 3 LYS CA 1 1 21 19403 1 1 3 LYS CB C -6.161 0.938 -4.078 1.00 . A A . 3 LYS CB 1 1 21 19404 1 1 3 LYS CD C -5.080 -1.078 -5.116 1.00 . A A . 3 LYS CD 1 1 21 19405 1 1 3 LYS CE C -6.118 -1.862 -5.904 1.00 . A A . 3 LYS CE 1 1 21 19406 1 1 3 LYS CG C -5.675 -0.484 -3.851 1.00 . A A . 3 LYS CG 1 1 21 19407 1 1 3 LYS H H -6.683 3.386 -3.664 1.00 . A A . 3 LYS H 1 1 21 19408 1 1 3 LYS HA H -4.553 1.738 -2.914 1.00 . A A . 3 LYS HA 1 1 21 19409 1 1 3 LYS HB2 H -6.999 1.119 -3.420 1.00 . A A . 3 LYS HB2 1 1 21 19410 1 1 3 LYS HB3 H -6.492 1.024 -5.102 1.00 . A A . 3 LYS HB3 1 1 21 19411 1 1 3 LYS HD2 H -4.702 -0.279 -5.736 1.00 . A A . 3 LYS HD2 1 1 21 19412 1 1 3 LYS HD3 H -4.272 -1.741 -4.846 1.00 . A A . 3 LYS HD3 1 1 21 19413 1 1 3 LYS HE2 H -5.652 -2.749 -6.306 1.00 . A A . 3 LYS HE2 1 1 21 19414 1 1 3 LYS HE3 H -6.917 -2.148 -5.237 1.00 . A A . 3 LYS HE3 1 1 21 19415 1 1 3 LYS HG2 H -4.919 -0.476 -3.080 1.00 . A A . 3 LYS HG2 1 1 21 19416 1 1 3 LYS HG3 H -6.509 -1.093 -3.534 1.00 . A A . 3 LYS HG3 1 1 21 19417 1 1 3 LYS HZ1 H -6.177 -1.276 -7.908 1.00 . A A . 3 LYS HZ1 1 1 21 19418 1 1 3 LYS HZ2 H -6.594 -0.048 -6.823 1.00 . A A . 3 LYS HZ2 1 1 21 19419 1 1 3 LYS HZ3 H -7.691 -1.292 -7.154 1.00 . A A . 3 LYS HZ3 1 1 21 19420 1 1 3 LYS N N -5.708 3.304 -3.604 1.00 . A A . 3 LYS N 1 1 21 19421 1 1 3 LYS NZ N -6.685 -1.063 -7.026 1.00 . A A . 3 LYS NZ 1 1 21 19422 1 1 3 LYS O O -3.027 1.451 -4.914 1.00 . A A . 3 LYS O 1 1 21 19423 1 1 4 LYS C C -2.238 3.339 -6.857 1.00 . A A . 4 LYS C 1 1 21 19424 1 1 4 LYS CA C -3.639 2.859 -7.226 1.00 . A A . 4 LYS CA 1 1 21 19425 1 1 4 LYS CB C -4.270 3.822 -8.234 1.00 . A A . 4 LYS CB 1 1 21 19426 1 1 4 LYS CD C -3.871 5.195 -10.298 1.00 . A A . 4 LYS CD 1 1 21 19427 1 1 4 LYS CE C -2.969 6.363 -9.937 1.00 . A A . 4 LYS CE 1 1 21 19428 1 1 4 LYS CG C -3.491 3.938 -9.534 1.00 . A A . 4 LYS CG 1 1 21 19429 1 1 4 LYS H H -5.359 3.186 -6.035 1.00 . A A . 4 LYS H 1 1 21 19430 1 1 4 LYS HA H -3.563 1.881 -7.678 1.00 . A A . 4 LYS HA 1 1 21 19431 1 1 4 LYS HB2 H -5.266 3.479 -8.467 1.00 . A A . 4 LYS HB2 1 1 21 19432 1 1 4 LYS HB3 H -4.332 4.803 -7.787 1.00 . A A . 4 LYS HB3 1 1 21 19433 1 1 4 LYS HD2 H -3.784 5.001 -11.358 1.00 . A A . 4 LYS HD2 1 1 21 19434 1 1 4 LYS HD3 H -4.894 5.453 -10.060 1.00 . A A . 4 LYS HD3 1 1 21 19435 1 1 4 LYS HE2 H -3.020 6.523 -8.870 1.00 . A A . 4 LYS HE2 1 1 21 19436 1 1 4 LYS HE3 H -1.954 6.118 -10.215 1.00 . A A . 4 LYS HE3 1 1 21 19437 1 1 4 LYS HG2 H -2.435 3.974 -9.307 1.00 . A A . 4 LYS HG2 1 1 21 19438 1 1 4 LYS HG3 H -3.702 3.075 -10.147 1.00 . A A . 4 LYS HG3 1 1 21 19439 1 1 4 LYS HZ1 H -2.582 8.289 -10.647 1.00 . A A . 4 LYS HZ1 1 1 21 19440 1 1 4 LYS HZ2 H -4.179 8.054 -10.143 1.00 . A A . 4 LYS HZ2 1 1 21 19441 1 1 4 LYS HZ3 H -3.652 7.404 -11.613 1.00 . A A . 4 LYS HZ3 1 1 21 19442 1 1 4 LYS N N -4.486 2.740 -6.043 1.00 . A A . 4 LYS N 1 1 21 19443 1 1 4 LYS NZ N -3.374 7.615 -10.634 1.00 . A A . 4 LYS NZ 1 1 21 19444 1 1 4 LYS O O -1.243 2.852 -7.393 1.00 . A A . 4 LYS O 1 1 21 19445 1 1 5 ASP C C -0.015 3.750 -4.883 1.00 . A A . 5 ASP C 1 1 21 19446 1 1 5 ASP CA C -0.888 4.839 -5.497 1.00 . A A . 5 ASP CA 1 1 21 19447 1 1 5 ASP CB C -1.110 5.966 -4.485 1.00 . A A . 5 ASP CB 1 1 21 19448 1 1 5 ASP CG C -0.284 7.198 -4.799 1.00 . A A . 5 ASP CG 1 1 21 19449 1 1 5 ASP H H -2.996 4.643 -5.545 1.00 . A A . 5 ASP H 1 1 21 19450 1 1 5 ASP HA H -0.384 5.242 -6.364 1.00 . A A . 5 ASP HA 1 1 21 19451 1 1 5 ASP HB2 H -2.154 6.246 -4.490 1.00 . A A . 5 ASP HB2 1 1 21 19452 1 1 5 ASP HB3 H -0.841 5.615 -3.499 1.00 . A A . 5 ASP HB3 1 1 21 19453 1 1 5 ASP N N -2.169 4.296 -5.937 1.00 . A A . 5 ASP N 1 1 21 19454 1 1 5 ASP O O 1.144 3.583 -5.261 1.00 . A A . 5 ASP O 1 1 21 19455 1 1 5 ASP OD1 O 0.787 7.050 -5.426 1.00 . A A . 5 ASP OD1 1 1 21 19456 1 1 5 ASP OD2 O -0.707 8.310 -4.419 1.00 . A A . 5 ASP OD2 1 1 21 19457 1 1 6 VAL C C 0.635 0.903 -4.260 1.00 . A A . 6 VAL C 1 1 21 19458 1 1 6 VAL CA C 0.137 1.943 -3.263 1.00 . A A . 6 VAL CA 1 1 21 19459 1 1 6 VAL CB C -0.756 1.250 -2.220 1.00 . A A . 6 VAL CB 1 1 21 19460 1 1 6 VAL CG1 C 0.099 0.486 -1.236 1.00 . A A . 6 VAL CG1 1 1 21 19461 1 1 6 VAL CG2 C -1.636 2.255 -1.490 1.00 . A A . 6 VAL CG2 1 1 21 19462 1 1 6 VAL H H -1.503 3.191 -3.672 1.00 . A A . 6 VAL H 1 1 21 19463 1 1 6 VAL HA H 0.984 2.377 -2.753 1.00 . A A . 6 VAL HA 1 1 21 19464 1 1 6 VAL HB H -1.395 0.545 -2.731 1.00 . A A . 6 VAL HB 1 1 21 19465 1 1 6 VAL HG11 H -0.493 0.227 -0.373 1.00 . A A . 6 VAL HG11 1 1 21 19466 1 1 6 VAL HG12 H 0.926 1.108 -0.931 1.00 . A A . 6 VAL HG12 1 1 21 19467 1 1 6 VAL HG13 H 0.472 -0.411 -1.703 1.00 . A A . 6 VAL HG13 1 1 21 19468 1 1 6 VAL HG21 H -1.966 1.830 -0.554 1.00 . A A . 6 VAL HG21 1 1 21 19469 1 1 6 VAL HG22 H -2.496 2.490 -2.101 1.00 . A A . 6 VAL HG22 1 1 21 19470 1 1 6 VAL HG23 H -1.073 3.156 -1.300 1.00 . A A . 6 VAL HG23 1 1 21 19471 1 1 6 VAL N N -0.579 3.012 -3.933 1.00 . A A . 6 VAL N 1 1 21 19472 1 1 6 VAL O O 1.759 0.412 -4.151 1.00 . A A . 6 VAL O 1 1 21 19473 1 1 7 ILE C C 1.216 0.115 -7.185 1.00 . A A . 7 ILE C 1 1 21 19474 1 1 7 ILE CA C 0.141 -0.419 -6.243 1.00 . A A . 7 ILE CA 1 1 21 19475 1 1 7 ILE CB C -1.094 -0.836 -7.068 1.00 . A A . 7 ILE CB 1 1 21 19476 1 1 7 ILE CD1 C -1.708 -2.594 -5.333 1.00 . A A . 7 ILE CD1 1 1 21 19477 1 1 7 ILE CG1 C -2.176 -1.411 -6.153 1.00 . A A . 7 ILE CG1 1 1 21 19478 1 1 7 ILE CG2 C -0.706 -1.846 -8.139 1.00 . A A . 7 ILE CG2 1 1 21 19479 1 1 7 ILE H H -1.093 0.992 -5.260 1.00 . A A . 7 ILE H 1 1 21 19480 1 1 7 ILE HA H 0.524 -1.295 -5.737 1.00 . A A . 7 ILE HA 1 1 21 19481 1 1 7 ILE HB H -1.481 0.043 -7.561 1.00 . A A . 7 ILE HB 1 1 21 19482 1 1 7 ILE HD11 H -0.743 -2.921 -5.688 1.00 . A A . 7 ILE HD11 1 1 21 19483 1 1 7 ILE HD12 H -2.419 -3.402 -5.428 1.00 . A A . 7 ILE HD12 1 1 21 19484 1 1 7 ILE HD13 H -1.629 -2.304 -4.296 1.00 . A A . 7 ILE HD13 1 1 21 19485 1 1 7 ILE HG12 H -2.505 -0.644 -5.468 1.00 . A A . 7 ILE HG12 1 1 21 19486 1 1 7 ILE HG13 H -3.012 -1.734 -6.754 1.00 . A A . 7 ILE HG13 1 1 21 19487 1 1 7 ILE HG21 H -1.578 -2.104 -8.722 1.00 . A A . 7 ILE HG21 1 1 21 19488 1 1 7 ILE HG22 H -0.311 -2.734 -7.669 1.00 . A A . 7 ILE HG22 1 1 21 19489 1 1 7 ILE HG23 H 0.045 -1.414 -8.784 1.00 . A A . 7 ILE HG23 1 1 21 19490 1 1 7 ILE N N -0.210 0.567 -5.228 1.00 . A A . 7 ILE N 1 1 21 19491 1 1 7 ILE O O 2.104 -0.623 -7.611 1.00 . A A . 7 ILE O 1 1 21 19492 1 1 8 ASP C C 3.422 2.254 -7.658 1.00 . A A . 8 ASP C 1 1 21 19493 1 1 8 ASP CA C 2.103 2.035 -8.386 1.00 . A A . 8 ASP CA 1 1 21 19494 1 1 8 ASP CB C 1.559 3.369 -8.903 1.00 . A A . 8 ASP CB 1 1 21 19495 1 1 8 ASP CG C 1.566 3.450 -10.417 1.00 . A A . 8 ASP CG 1 1 21 19496 1 1 8 ASP H H 0.410 1.942 -7.126 1.00 . A A . 8 ASP H 1 1 21 19497 1 1 8 ASP HA H 2.269 1.373 -9.223 1.00 . A A . 8 ASP HA 1 1 21 19498 1 1 8 ASP HB2 H 0.543 3.494 -8.560 1.00 . A A . 8 ASP HB2 1 1 21 19499 1 1 8 ASP HB3 H 2.165 4.175 -8.515 1.00 . A A . 8 ASP HB3 1 1 21 19500 1 1 8 ASP N N 1.134 1.403 -7.500 1.00 . A A . 8 ASP N 1 1 21 19501 1 1 8 ASP O O 4.482 2.330 -8.278 1.00 . A A . 8 ASP O 1 1 21 19502 1 1 8 ASP OD1 O 1.333 2.409 -11.068 1.00 . A A . 8 ASP OD1 1 1 21 19503 1 1 8 ASP OD2 O 1.804 4.552 -10.952 1.00 . A A . 8 ASP OD2 1 1 21 19504 1 1 9 HIS C C 5.228 1.223 -5.238 1.00 . A A . 9 HIS C 1 1 21 19505 1 1 9 HIS CA C 4.529 2.552 -5.517 1.00 . A A . 9 HIS CA 1 1 21 19506 1 1 9 HIS CB C 4.153 3.239 -4.201 1.00 . A A . 9 HIS CB 1 1 21 19507 1 1 9 HIS CD2 C 5.976 2.392 -2.559 1.00 . A A . 9 HIS CD2 1 1 21 19508 1 1 9 HIS CE1 C 6.821 4.332 -1.987 1.00 . A A . 9 HIS CE1 1 1 21 19509 1 1 9 HIS CG C 5.290 3.347 -3.230 1.00 . A A . 9 HIS CG 1 1 21 19510 1 1 9 HIS H H 2.473 2.274 -5.898 1.00 . A A . 9 HIS H 1 1 21 19511 1 1 9 HIS HA H 5.200 3.191 -6.069 1.00 . A A . 9 HIS HA 1 1 21 19512 1 1 9 HIS HB2 H 3.803 4.237 -4.411 1.00 . A A . 9 HIS HB2 1 1 21 19513 1 1 9 HIS HB3 H 3.361 2.678 -3.725 1.00 . A A . 9 HIS HB3 1 1 21 19514 1 1 9 HIS HD1 H 5.561 5.436 -3.163 1.00 . A A . 9 HIS HD1 1 1 21 19515 1 1 9 HIS HD2 H 5.810 1.325 -2.615 1.00 . A A . 9 HIS HD2 1 1 21 19516 1 1 9 HIS HE1 H 7.433 5.087 -1.518 1.00 . A A . 9 HIS HE1 1 1 21 19517 1 1 9 HIS HE2 H 7.507 2.598 -1.139 1.00 . A A . 9 HIS HE2 1 1 21 19518 1 1 9 HIS N N 3.346 2.347 -6.335 1.00 . A A . 9 HIS N 1 1 21 19519 1 1 9 HIS ND1 N 5.843 4.551 -2.849 1.00 . A A . 9 HIS ND1 1 1 21 19520 1 1 9 HIS NE2 N 6.920 3.029 -1.793 1.00 . A A . 9 HIS NE2 1 1 21 19521 1 1 9 HIS O O 6.432 1.187 -4.982 1.00 . A A . 9 HIS O 1 1 21 19522 1 1 10 PHE C C 5.320 -1.911 -6.338 1.00 . A A . 10 PHE C 1 1 21 19523 1 1 10 PHE CA C 5.010 -1.191 -5.031 1.00 . A A . 10 PHE CA 1 1 21 19524 1 1 10 PHE CB C 4.030 -2.020 -4.201 1.00 . A A . 10 PHE CB 1 1 21 19525 1 1 10 PHE CD1 C 3.922 -0.311 -2.366 1.00 . A A . 10 PHE CD1 1 1 21 19526 1 1 10 PHE CD2 C 4.046 -2.614 -1.763 1.00 . A A . 10 PHE CD2 1 1 21 19527 1 1 10 PHE CE1 C 3.893 0.042 -1.032 1.00 . A A . 10 PHE CE1 1 1 21 19528 1 1 10 PHE CE2 C 4.019 -2.267 -0.425 1.00 . A A . 10 PHE CE2 1 1 21 19529 1 1 10 PHE CG C 3.999 -1.640 -2.747 1.00 . A A . 10 PHE CG 1 1 21 19530 1 1 10 PHE CZ C 3.941 -0.937 -0.060 1.00 . A A . 10 PHE CZ 1 1 21 19531 1 1 10 PHE H H 3.511 0.228 -5.488 1.00 . A A . 10 PHE H 1 1 21 19532 1 1 10 PHE HA H 5.925 -1.069 -4.472 1.00 . A A . 10 PHE HA 1 1 21 19533 1 1 10 PHE HB2 H 3.033 -1.891 -4.597 1.00 . A A . 10 PHE HB2 1 1 21 19534 1 1 10 PHE HB3 H 4.305 -3.061 -4.267 1.00 . A A . 10 PHE HB3 1 1 21 19535 1 1 10 PHE HD1 H 3.885 0.458 -3.125 1.00 . A A . 10 PHE HD1 1 1 21 19536 1 1 10 PHE HD2 H 4.107 -3.653 -2.048 1.00 . A A . 10 PHE HD2 1 1 21 19537 1 1 10 PHE HE1 H 3.832 1.083 -0.749 1.00 . A A . 10 PHE HE1 1 1 21 19538 1 1 10 PHE HE2 H 4.056 -3.035 0.332 1.00 . A A . 10 PHE HE2 1 1 21 19539 1 1 10 PHE HZ H 3.919 -0.664 0.986 1.00 . A A . 10 PHE HZ 1 1 21 19540 1 1 10 PHE N N 4.464 0.136 -5.283 1.00 . A A . 10 PHE N 1 1 21 19541 1 1 10 PHE O O 6.369 -2.540 -6.480 1.00 . A A . 10 PHE O 1 1 21 19542 1 1 11 GLY C C 3.611 -3.609 -8.792 1.00 . A A . 11 GLY C 1 1 21 19543 1 1 11 GLY CA C 4.586 -2.469 -8.574 1.00 . A A . 11 GLY CA 1 1 21 19544 1 1 11 GLY H H 3.580 -1.306 -7.120 1.00 . A A . 11 GLY H 1 1 21 19545 1 1 11 GLY HA2 H 4.452 -1.739 -9.359 1.00 . A A . 11 GLY HA2 1 1 21 19546 1 1 11 GLY HA3 H 5.594 -2.856 -8.625 1.00 . A A . 11 GLY HA3 1 1 21 19547 1 1 11 GLY N N 4.397 -1.818 -7.291 1.00 . A A . 11 GLY N 1 1 21 19548 1 1 11 GLY O O 3.272 -3.937 -9.929 1.00 . A A . 11 GLY O 1 1 21 19549 1 1 12 THR C C 1.343 -5.374 -6.520 1.00 . A A . 12 THR C 1 1 21 19550 1 1 12 THR CA C 2.216 -5.323 -7.770 1.00 . A A . 12 THR CA 1 1 21 19551 1 1 12 THR CB C 2.966 -6.647 -7.936 1.00 . A A . 12 THR CB 1 1 21 19552 1 1 12 THR CG2 C 3.707 -6.754 -9.252 1.00 . A A . 12 THR CG2 1 1 21 19553 1 1 12 THR H H 3.467 -3.906 -6.820 1.00 . A A . 12 THR H 1 1 21 19554 1 1 12 THR HA H 1.584 -5.166 -8.630 1.00 . A A . 12 THR HA 1 1 21 19555 1 1 12 THR HB H 2.254 -7.459 -7.891 1.00 . A A . 12 THR HB 1 1 21 19556 1 1 12 THR HG1 H 4.403 -6.008 -6.770 1.00 . A A . 12 THR HG1 1 1 21 19557 1 1 12 THR HG21 H 4.384 -5.920 -9.352 1.00 . A A . 12 THR HG21 1 1 21 19558 1 1 12 THR HG22 H 2.997 -6.741 -10.066 1.00 . A A . 12 THR HG22 1 1 21 19559 1 1 12 THR HG23 H 4.266 -7.676 -9.276 1.00 . A A . 12 THR HG23 1 1 21 19560 1 1 12 THR N N 3.159 -4.214 -7.697 1.00 . A A . 12 THR N 1 1 21 19561 1 1 12 THR O O 1.491 -4.555 -5.614 1.00 . A A . 12 THR O 1 1 21 19562 1 1 12 THR OG1 O 3.910 -6.823 -6.897 1.00 . A A . 12 THR OG1 1 1 21 19563 1 1 13 GLN C C 0.158 -7.400 -4.279 1.00 . A A . 13 GLN C 1 1 21 19564 1 1 13 GLN CA C -0.464 -6.497 -5.340 1.00 . A A . 13 GLN CA 1 1 21 19565 1 1 13 GLN CB C -1.806 -7.074 -5.792 1.00 . A A . 13 GLN CB 1 1 21 19566 1 1 13 GLN CD C -3.939 -6.562 -7.046 1.00 . A A . 13 GLN CD 1 1 21 19567 1 1 13 GLN CG C -2.451 -6.295 -6.926 1.00 . A A . 13 GLN CG 1 1 21 19568 1 1 13 GLN H H 0.362 -6.964 -7.232 1.00 . A A . 13 GLN H 1 1 21 19569 1 1 13 GLN HA H -0.627 -5.521 -4.911 1.00 . A A . 13 GLN HA 1 1 21 19570 1 1 13 GLN HB2 H -1.655 -8.091 -6.124 1.00 . A A . 13 GLN HB2 1 1 21 19571 1 1 13 GLN HB3 H -2.487 -7.075 -4.954 1.00 . A A . 13 GLN HB3 1 1 21 19572 1 1 13 GLN HE21 H -3.632 -8.512 -6.811 1.00 . A A . 13 GLN HE21 1 1 21 19573 1 1 13 GLN HE22 H -5.278 -8.030 -7.025 1.00 . A A . 13 GLN HE22 1 1 21 19574 1 1 13 GLN HG2 H -2.303 -5.241 -6.752 1.00 . A A . 13 GLN HG2 1 1 21 19575 1 1 13 GLN HG3 H -1.975 -6.575 -7.855 1.00 . A A . 13 GLN HG3 1 1 21 19576 1 1 13 GLN N N 0.432 -6.341 -6.479 1.00 . A A . 13 GLN N 1 1 21 19577 1 1 13 GLN NE2 N -4.322 -7.829 -6.950 1.00 . A A . 13 GLN NE2 1 1 21 19578 1 1 13 GLN O O 0.220 -7.042 -3.103 1.00 . A A . 13 GLN O 1 1 21 19579 1 1 13 GLN OE1 O -4.734 -5.639 -7.220 1.00 . A A . 13 GLN OE1 1 1 21 19580 1 1 14 ARG C C 2.354 -8.870 -2.981 1.00 . A A . 14 ARG C 1 1 21 19581 1 1 14 ARG CA C 1.241 -9.528 -3.791 1.00 . A A . 14 ARG CA 1 1 21 19582 1 1 14 ARG CB C 1.800 -10.719 -4.572 1.00 . A A . 14 ARG CB 1 1 21 19583 1 1 14 ARG CD C 0.949 -13.065 -4.254 1.00 . A A . 14 ARG CD 1 1 21 19584 1 1 14 ARG CG C 1.904 -11.993 -3.748 1.00 . A A . 14 ARG CG 1 1 21 19585 1 1 14 ARG CZ C 0.282 -13.997 -6.434 1.00 . A A . 14 ARG CZ 1 1 21 19586 1 1 14 ARG H H 0.543 -8.801 -5.653 1.00 . A A . 14 ARG H 1 1 21 19587 1 1 14 ARG HA H 0.478 -9.882 -3.113 1.00 . A A . 14 ARG HA 1 1 21 19588 1 1 14 ARG HB2 H 1.160 -10.912 -5.420 1.00 . A A . 14 ARG HB2 1 1 21 19589 1 1 14 ARG HB3 H 2.787 -10.467 -4.931 1.00 . A A . 14 ARG HB3 1 1 21 19590 1 1 14 ARG HD2 H 1.094 -13.961 -3.670 1.00 . A A . 14 ARG HD2 1 1 21 19591 1 1 14 ARG HD3 H -0.065 -12.714 -4.127 1.00 . A A . 14 ARG HD3 1 1 21 19592 1 1 14 ARG HE H 2.028 -13.109 -6.056 1.00 . A A . 14 ARG HE 1 1 21 19593 1 1 14 ARG HG2 H 2.913 -12.369 -3.810 1.00 . A A . 14 ARG HG2 1 1 21 19594 1 1 14 ARG HG3 H 1.663 -11.765 -2.721 1.00 . A A . 14 ARG HG3 1 1 21 19595 1 1 14 ARG HH11 H -1.109 -14.194 -4.978 1.00 . A A . 14 ARG HH11 1 1 21 19596 1 1 14 ARG HH12 H -1.554 -14.842 -6.521 1.00 . A A . 14 ARG HH12 1 1 21 19597 1 1 14 ARG HH21 H 1.444 -13.960 -8.086 1.00 . A A . 14 ARG HH21 1 1 21 19598 1 1 14 ARG HH22 H -0.104 -14.709 -8.285 1.00 . A A . 14 ARG HH22 1 1 21 19599 1 1 14 ARG N N 0.620 -8.573 -4.703 1.00 . A A . 14 ARG N 1 1 21 19600 1 1 14 ARG NE N 1.171 -13.376 -5.662 1.00 . A A . 14 ARG NE 1 1 21 19601 1 1 14 ARG NH1 N -0.890 -14.376 -5.936 1.00 . A A . 14 ARG NH1 1 1 21 19602 1 1 14 ARG NH2 N 0.563 -14.242 -7.707 1.00 . A A . 14 ARG NH2 1 1 21 19603 1 1 14 ARG O O 2.627 -9.266 -1.848 1.00 . A A . 14 ARG O 1 1 21 19604 1 1 15 ALA C C 3.573 -6.464 -1.633 1.00 . A A . 15 ALA C 1 1 21 19605 1 1 15 ALA CA C 4.072 -7.149 -2.901 1.00 . A A . 15 ALA CA 1 1 21 19606 1 1 15 ALA CB C 4.693 -6.130 -3.844 1.00 . A A . 15 ALA CB 1 1 21 19607 1 1 15 ALA H H 2.726 -7.592 -4.473 1.00 . A A . 15 ALA H 1 1 21 19608 1 1 15 ALA HA H 4.831 -7.868 -2.634 1.00 . A A . 15 ALA HA 1 1 21 19609 1 1 15 ALA HB1 H 3.931 -5.447 -4.188 1.00 . A A . 15 ALA HB1 1 1 21 19610 1 1 15 ALA HB2 H 5.128 -6.641 -4.690 1.00 . A A . 15 ALA HB2 1 1 21 19611 1 1 15 ALA HB3 H 5.461 -5.579 -3.323 1.00 . A A . 15 ALA HB3 1 1 21 19612 1 1 15 ALA N N 2.991 -7.862 -3.569 1.00 . A A . 15 ALA N 1 1 21 19613 1 1 15 ALA O O 4.182 -6.583 -0.570 1.00 . A A . 15 ALA O 1 1 21 19614 1 1 16 VAL C C 1.517 -6.016 0.499 1.00 . A A . 16 VAL C 1 1 21 19615 1 1 16 VAL CA C 1.881 -5.042 -0.616 1.00 . A A . 16 VAL CA 1 1 21 19616 1 1 16 VAL CB C 0.621 -4.237 -1.007 1.00 . A A . 16 VAL CB 1 1 21 19617 1 1 16 VAL CG1 C 0.564 -2.946 -0.217 1.00 . A A . 16 VAL CG1 1 1 21 19618 1 1 16 VAL CG2 C 0.584 -3.940 -2.501 1.00 . A A . 16 VAL CG2 1 1 21 19619 1 1 16 VAL H H 2.021 -5.687 -2.622 1.00 . A A . 16 VAL H 1 1 21 19620 1 1 16 VAL HA H 2.622 -4.350 -0.242 1.00 . A A . 16 VAL HA 1 1 21 19621 1 1 16 VAL HB H -0.251 -4.823 -0.756 1.00 . A A . 16 VAL HB 1 1 21 19622 1 1 16 VAL HG11 H 0.249 -3.156 0.794 1.00 . A A . 16 VAL HG11 1 1 21 19623 1 1 16 VAL HG12 H -0.137 -2.270 -0.682 1.00 . A A . 16 VAL HG12 1 1 21 19624 1 1 16 VAL HG13 H 1.545 -2.496 -0.202 1.00 . A A . 16 VAL HG13 1 1 21 19625 1 1 16 VAL HG21 H 1.585 -3.740 -2.854 1.00 . A A . 16 VAL HG21 1 1 21 19626 1 1 16 VAL HG22 H -0.040 -3.078 -2.682 1.00 . A A . 16 VAL HG22 1 1 21 19627 1 1 16 VAL HG23 H 0.181 -4.794 -3.027 1.00 . A A . 16 VAL HG23 1 1 21 19628 1 1 16 VAL N N 2.461 -5.746 -1.752 1.00 . A A . 16 VAL N 1 1 21 19629 1 1 16 VAL O O 1.581 -5.677 1.681 1.00 . A A . 16 VAL O 1 1 21 19630 1 1 17 ALA C C 1.937 -8.628 1.973 1.00 . A A . 17 ALA C 1 1 21 19631 1 1 17 ALA CA C 0.757 -8.255 1.080 1.00 . A A . 17 ALA CA 1 1 21 19632 1 1 17 ALA CB C 0.226 -9.485 0.360 1.00 . A A . 17 ALA CB 1 1 21 19633 1 1 17 ALA H H 1.103 -7.439 -0.841 1.00 . A A . 17 ALA H 1 1 21 19634 1 1 17 ALA HA H -0.036 -7.857 1.696 1.00 . A A . 17 ALA HA 1 1 21 19635 1 1 17 ALA HB1 H 0.621 -10.376 0.827 1.00 . A A . 17 ALA HB1 1 1 21 19636 1 1 17 ALA HB2 H 0.532 -9.456 -0.675 1.00 . A A . 17 ALA HB2 1 1 21 19637 1 1 17 ALA HB3 H -0.852 -9.498 0.417 1.00 . A A . 17 ALA HB3 1 1 21 19638 1 1 17 ALA N N 1.134 -7.229 0.114 1.00 . A A . 17 ALA N 1 1 21 19639 1 1 17 ALA O O 1.754 -9.021 3.126 1.00 . A A . 17 ALA O 1 1 21 19640 1 1 18 LYS C C 4.682 -7.727 3.192 1.00 . A A . 18 LYS C 1 1 21 19641 1 1 18 LYS CA C 4.354 -8.826 2.187 1.00 . A A . 18 LYS CA 1 1 21 19642 1 1 18 LYS CB C 5.532 -9.034 1.231 1.00 . A A . 18 LYS CB 1 1 21 19643 1 1 18 LYS CD C 6.857 -10.783 0.006 1.00 . A A . 18 LYS CD 1 1 21 19644 1 1 18 LYS CE C 7.471 -12.172 0.075 1.00 . A A . 18 LYS CE 1 1 21 19645 1 1 18 LYS CG C 6.125 -10.432 1.291 1.00 . A A . 18 LYS CG 1 1 21 19646 1 1 18 LYS H H 3.227 -8.184 0.513 1.00 . A A . 18 LYS H 1 1 21 19647 1 1 18 LYS HA H 4.172 -9.745 2.724 1.00 . A A . 18 LYS HA 1 1 21 19648 1 1 18 LYS HB2 H 5.196 -8.853 0.221 1.00 . A A . 18 LYS HB2 1 1 21 19649 1 1 18 LYS HB3 H 6.310 -8.326 1.475 1.00 . A A . 18 LYS HB3 1 1 21 19650 1 1 18 LYS HD2 H 6.159 -10.748 -0.816 1.00 . A A . 18 LYS HD2 1 1 21 19651 1 1 18 LYS HD3 H 7.644 -10.059 -0.157 1.00 . A A . 18 LYS HD3 1 1 21 19652 1 1 18 LYS HE2 H 8.529 -12.077 0.264 1.00 . A A . 18 LYS HE2 1 1 21 19653 1 1 18 LYS HE3 H 7.009 -12.717 0.885 1.00 . A A . 18 LYS HE3 1 1 21 19654 1 1 18 LYS HG2 H 6.819 -10.482 2.116 1.00 . A A . 18 LYS HG2 1 1 21 19655 1 1 18 LYS HG3 H 5.327 -11.144 1.446 1.00 . A A . 18 LYS HG3 1 1 21 19656 1 1 18 LYS HZ1 H 8.008 -12.668 -1.883 1.00 . A A . 18 LYS HZ1 1 1 21 19657 1 1 18 LYS HZ2 H 6.342 -12.711 -1.598 1.00 . A A . 18 LYS HZ2 1 1 21 19658 1 1 18 LYS HZ3 H 7.331 -13.950 -1.013 1.00 . A A . 18 LYS HZ3 1 1 21 19659 1 1 18 LYS N N 3.146 -8.501 1.436 1.00 . A A . 18 LYS N 1 1 21 19660 1 1 18 LYS NZ N 7.275 -12.928 -1.194 1.00 . A A . 18 LYS NZ 1 1 21 19661 1 1 18 LYS O O 4.984 -8.004 4.353 1.00 . A A . 18 LYS O 1 1 21 19662 1 1 19 ALA C C 3.971 -5.298 4.797 1.00 . A A . 19 ALA C 1 1 21 19663 1 1 19 ALA CA C 4.913 -5.338 3.598 1.00 . A A . 19 ALA CA 1 1 21 19664 1 1 19 ALA CB C 4.817 -4.042 2.806 1.00 . A A . 19 ALA CB 1 1 21 19665 1 1 19 ALA H H 4.375 -6.322 1.803 1.00 . A A . 19 ALA H 1 1 21 19666 1 1 19 ALA HA H 5.928 -5.441 3.955 1.00 . A A . 19 ALA HA 1 1 21 19667 1 1 19 ALA HB1 H 5.800 -3.760 2.458 1.00 . A A . 19 ALA HB1 1 1 21 19668 1 1 19 ALA HB2 H 4.422 -3.262 3.439 1.00 . A A . 19 ALA HB2 1 1 21 19669 1 1 19 ALA HB3 H 4.161 -4.186 1.960 1.00 . A A . 19 ALA HB3 1 1 21 19670 1 1 19 ALA N N 4.622 -6.478 2.739 1.00 . A A . 19 ALA N 1 1 21 19671 1 1 19 ALA O O 4.404 -5.120 5.935 1.00 . A A . 19 ALA O 1 1 21 19672 1 1 20 LEU C C 1.539 -6.824 6.235 1.00 . A A . 20 LEU C 1 1 21 19673 1 1 20 LEU CA C 1.674 -5.449 5.591 1.00 . A A . 20 LEU CA 1 1 21 19674 1 1 20 LEU CB C 0.323 -5.002 5.030 1.00 . A A . 20 LEU CB 1 1 21 19675 1 1 20 LEU CD1 C -0.878 -3.141 3.857 1.00 . A A . 20 LEU CD1 1 1 21 19676 1 1 20 LEU CD2 C -0.333 -2.935 6.288 1.00 . A A . 20 LEU CD2 1 1 21 19677 1 1 20 LEU CG C 0.124 -3.488 4.947 1.00 . A A . 20 LEU CG 1 1 21 19678 1 1 20 LEU H H 2.395 -5.603 3.606 1.00 . A A . 20 LEU H 1 1 21 19679 1 1 20 LEU HA H 1.995 -4.742 6.341 1.00 . A A . 20 LEU HA 1 1 21 19680 1 1 20 LEU HB2 H 0.215 -5.414 4.037 1.00 . A A . 20 LEU HB2 1 1 21 19681 1 1 20 LEU HB3 H -0.456 -5.409 5.657 1.00 . A A . 20 LEU HB3 1 1 21 19682 1 1 20 LEU HD11 H -0.903 -2.070 3.717 1.00 . A A . 20 LEU HD11 1 1 21 19683 1 1 20 LEU HD12 H -1.859 -3.490 4.144 1.00 . A A . 20 LEU HD12 1 1 21 19684 1 1 20 LEU HD13 H -0.584 -3.617 2.933 1.00 . A A . 20 LEU HD13 1 1 21 19685 1 1 20 LEU HD21 H -1.128 -3.551 6.679 1.00 . A A . 20 LEU HD21 1 1 21 19686 1 1 20 LEU HD22 H -0.690 -1.924 6.159 1.00 . A A . 20 LEU HD22 1 1 21 19687 1 1 20 LEU HD23 H 0.497 -2.939 6.980 1.00 . A A . 20 LEU HD23 1 1 21 19688 1 1 20 LEU HG H 1.066 -3.021 4.695 1.00 . A A . 20 LEU HG 1 1 21 19689 1 1 20 LEU N N 2.679 -5.466 4.534 1.00 . A A . 20 LEU N 1 1 21 19690 1 1 20 LEU O O 1.227 -6.937 7.421 1.00 . A A . 20 LEU O 1 1 21 19691 1 1 21 GLY C C 0.291 -9.810 5.764 1.00 . A A . 21 GLY C 1 1 21 19692 1 1 21 GLY CA C 1.674 -9.222 5.959 1.00 . A A . 21 GLY CA 1 1 21 19693 1 1 21 GLY H H 2.020 -7.716 4.510 1.00 . A A . 21 GLY H 1 1 21 19694 1 1 21 GLY HA2 H 2.393 -9.843 5.446 1.00 . A A . 21 GLY HA2 1 1 21 19695 1 1 21 GLY HA3 H 1.905 -9.216 7.013 1.00 . A A . 21 GLY HA3 1 1 21 19696 1 1 21 GLY N N 1.776 -7.868 5.447 1.00 . A A . 21 GLY N 1 1 21 19697 1 1 21 GLY O O -0.130 -10.688 6.518 1.00 . A A . 21 GLY O 1 1 21 19698 1 1 22 ILE C C -1.783 -10.630 3.174 1.00 . A A . 22 ILE C 1 1 21 19699 1 1 22 ILE CA C -1.763 -9.808 4.457 1.00 . A A . 22 ILE CA 1 1 21 19700 1 1 22 ILE CB C -2.760 -8.641 4.320 1.00 . A A . 22 ILE CB 1 1 21 19701 1 1 22 ILE CD1 C -3.299 -6.580 2.927 1.00 . A A . 22 ILE CD1 1 1 21 19702 1 1 22 ILE CG1 C -2.291 -7.664 3.240 1.00 . A A . 22 ILE CG1 1 1 21 19703 1 1 22 ILE CG2 C -2.928 -7.927 5.652 1.00 . A A . 22 ILE CG2 1 1 21 19704 1 1 22 ILE H H -0.029 -8.627 4.185 1.00 . A A . 22 ILE H 1 1 21 19705 1 1 22 ILE HA H -2.082 -10.431 5.280 1.00 . A A . 22 ILE HA 1 1 21 19706 1 1 22 ILE HB H -3.719 -9.047 4.035 1.00 . A A . 22 ILE HB 1 1 21 19707 1 1 22 ILE HD11 H -3.840 -6.320 3.825 1.00 . A A . 22 ILE HD11 1 1 21 19708 1 1 22 ILE HD12 H -3.993 -6.939 2.181 1.00 . A A . 22 ILE HD12 1 1 21 19709 1 1 22 ILE HD13 H -2.786 -5.708 2.549 1.00 . A A . 22 ILE HD13 1 1 21 19710 1 1 22 ILE HG12 H -1.381 -7.184 3.569 1.00 . A A . 22 ILE HG12 1 1 21 19711 1 1 22 ILE HG13 H -2.095 -8.211 2.329 1.00 . A A . 22 ILE HG13 1 1 21 19712 1 1 22 ILE HG21 H -3.934 -7.543 5.731 1.00 . A A . 22 ILE HG21 1 1 21 19713 1 1 22 ILE HG22 H -2.224 -7.110 5.713 1.00 . A A . 22 ILE HG22 1 1 21 19714 1 1 22 ILE HG23 H -2.743 -8.622 6.459 1.00 . A A . 22 ILE HG23 1 1 21 19715 1 1 22 ILE N N -0.419 -9.326 4.750 1.00 . A A . 22 ILE N 1 1 21 19716 1 1 22 ILE O O -0.749 -10.834 2.539 1.00 . A A . 22 ILE O 1 1 21 19717 1 1 23 SER C C -3.378 -11.007 0.376 1.00 . A A . 23 SER C 1 1 21 19718 1 1 23 SER CA C -3.123 -11.898 1.586 1.00 . A A . 23 SER CA 1 1 21 19719 1 1 23 SER CB C -4.272 -12.894 1.752 1.00 . A A . 23 SER CB 1 1 21 19720 1 1 23 SER H H -3.757 -10.902 3.343 1.00 . A A . 23 SER H 1 1 21 19721 1 1 23 SER HA H -2.205 -12.443 1.430 1.00 . A A . 23 SER HA 1 1 21 19722 1 1 23 SER HB2 H -4.745 -13.057 0.794 1.00 . A A . 23 SER HB2 1 1 21 19723 1 1 23 SER HB3 H -3.883 -13.831 2.124 1.00 . A A . 23 SER HB3 1 1 21 19724 1 1 23 SER HG H -5.894 -13.093 2.829 1.00 . A A . 23 SER HG 1 1 21 19725 1 1 23 SER N N -2.969 -11.099 2.796 1.00 . A A . 23 SER N 1 1 21 19726 1 1 23 SER O O -3.750 -9.842 0.518 1.00 . A A . 23 SER O 1 1 21 19727 1 1 23 SER OG O -5.242 -12.409 2.663 1.00 . A A . 23 SER OG 1 1 21 19728 1 1 24 ASP C C -4.819 -10.314 -2.152 1.00 . A A . 24 ASP C 1 1 21 19729 1 1 24 ASP CA C -3.381 -10.815 -2.052 1.00 . A A . 24 ASP CA 1 1 21 19730 1 1 24 ASP CB C -3.049 -11.690 -3.261 1.00 . A A . 24 ASP CB 1 1 21 19731 1 1 24 ASP CG C -3.703 -13.056 -3.184 1.00 . A A . 24 ASP CG 1 1 21 19732 1 1 24 ASP H H -2.876 -12.493 -0.863 1.00 . A A . 24 ASP H 1 1 21 19733 1 1 24 ASP HA H -2.716 -9.965 -2.041 1.00 . A A . 24 ASP HA 1 1 21 19734 1 1 24 ASP HB2 H -3.391 -11.198 -4.158 1.00 . A A . 24 ASP HB2 1 1 21 19735 1 1 24 ASP HB3 H -1.979 -11.828 -3.315 1.00 . A A . 24 ASP HB3 1 1 21 19736 1 1 24 ASP N N -3.173 -11.561 -0.815 1.00 . A A . 24 ASP N 1 1 21 19737 1 1 24 ASP O O -5.082 -9.271 -2.748 1.00 . A A . 24 ASP O 1 1 21 19738 1 1 24 ASP OD1 O -4.951 -13.115 -3.173 1.00 . A A . 24 ASP OD1 1 1 21 19739 1 1 24 ASP OD2 O -2.970 -14.066 -3.135 1.00 . A A . 24 ASP OD2 1 1 21 19740 1 1 25 ALA C C -7.393 -9.382 -0.854 1.00 . A A . 25 ALA C 1 1 21 19741 1 1 25 ALA CA C -7.154 -10.698 -1.588 1.00 . A A . 25 ALA CA 1 1 21 19742 1 1 25 ALA CB C -7.998 -11.806 -0.974 1.00 . A A . 25 ALA CB 1 1 21 19743 1 1 25 ALA H H -5.472 -11.887 -1.104 1.00 . A A . 25 ALA H 1 1 21 19744 1 1 25 ALA HA H -7.452 -10.583 -2.619 1.00 . A A . 25 ALA HA 1 1 21 19745 1 1 25 ALA HB1 H -8.316 -12.488 -1.748 1.00 . A A . 25 ALA HB1 1 1 21 19746 1 1 25 ALA HB2 H -8.864 -11.375 -0.495 1.00 . A A . 25 ALA HB2 1 1 21 19747 1 1 25 ALA HB3 H -7.412 -12.341 -0.241 1.00 . A A . 25 ALA HB3 1 1 21 19748 1 1 25 ALA N N -5.744 -11.065 -1.564 1.00 . A A . 25 ALA N 1 1 21 19749 1 1 25 ALA O O -8.106 -8.507 -1.344 1.00 . A A . 25 ALA O 1 1 21 19750 1 1 26 ALA C C -6.467 -6.809 0.352 1.00 . A A . 26 ALA C 1 1 21 19751 1 1 26 ALA CA C -6.935 -8.038 1.123 1.00 . A A . 26 ALA CA 1 1 21 19752 1 1 26 ALA CB C -6.160 -8.173 2.426 1.00 . A A . 26 ALA CB 1 1 21 19753 1 1 26 ALA H H -6.232 -9.981 0.660 1.00 . A A . 26 ALA H 1 1 21 19754 1 1 26 ALA HA H -7.981 -7.924 1.366 1.00 . A A . 26 ALA HA 1 1 21 19755 1 1 26 ALA HB1 H -5.217 -8.666 2.236 1.00 . A A . 26 ALA HB1 1 1 21 19756 1 1 26 ALA HB2 H -6.735 -8.756 3.130 1.00 . A A . 26 ALA HB2 1 1 21 19757 1 1 26 ALA HB3 H -5.976 -7.191 2.837 1.00 . A A . 26 ALA HB3 1 1 21 19758 1 1 26 ALA N N -6.789 -9.248 0.323 1.00 . A A . 26 ALA N 1 1 21 19759 1 1 26 ALA O O -7.054 -5.732 0.469 1.00 . A A . 26 ALA O 1 1 21 19760 1 1 27 VAL C C -5.742 -5.593 -2.442 1.00 . A A . 27 VAL C 1 1 21 19761 1 1 27 VAL CA C -4.866 -5.881 -1.227 1.00 . A A . 27 VAL CA 1 1 21 19762 1 1 27 VAL CB C -3.433 -6.189 -1.700 1.00 . A A . 27 VAL CB 1 1 21 19763 1 1 27 VAL CG1 C -2.846 -5.000 -2.449 1.00 . A A . 27 VAL CG1 1 1 21 19764 1 1 27 VAL CG2 C -2.552 -6.570 -0.519 1.00 . A A . 27 VAL CG2 1 1 21 19765 1 1 27 VAL H H -4.989 -7.860 -0.487 1.00 . A A . 27 VAL H 1 1 21 19766 1 1 27 VAL HA H -4.836 -5.000 -0.601 1.00 . A A . 27 VAL HA 1 1 21 19767 1 1 27 VAL HB H -3.472 -7.028 -2.378 1.00 . A A . 27 VAL HB 1 1 21 19768 1 1 27 VAL HG11 H -1.856 -5.248 -2.801 1.00 . A A . 27 VAL HG11 1 1 21 19769 1 1 27 VAL HG12 H -2.791 -4.150 -1.786 1.00 . A A . 27 VAL HG12 1 1 21 19770 1 1 27 VAL HG13 H -3.479 -4.758 -3.292 1.00 . A A . 27 VAL HG13 1 1 21 19771 1 1 27 VAL HG21 H -2.759 -7.590 -0.233 1.00 . A A . 27 VAL HG21 1 1 21 19772 1 1 27 VAL HG22 H -2.759 -5.913 0.312 1.00 . A A . 27 VAL HG22 1 1 21 19773 1 1 27 VAL HG23 H -1.513 -6.478 -0.800 1.00 . A A . 27 VAL HG23 1 1 21 19774 1 1 27 VAL N N -5.411 -6.977 -0.435 1.00 . A A . 27 VAL N 1 1 21 19775 1 1 27 VAL O O -6.033 -4.438 -2.751 1.00 . A A . 27 VAL O 1 1 21 19776 1 1 28 SER C C -8.398 -6.026 -3.930 1.00 . A A . 28 SER C 1 1 21 19777 1 1 28 SER CA C -7.002 -6.509 -4.312 1.00 . A A . 28 SER CA 1 1 21 19778 1 1 28 SER CB C -7.097 -7.840 -5.058 1.00 . A A . 28 SER CB 1 1 21 19779 1 1 28 SER H H -5.895 -7.547 -2.835 1.00 . A A . 28 SER H 1 1 21 19780 1 1 28 SER HA H -6.543 -5.775 -4.958 1.00 . A A . 28 SER HA 1 1 21 19781 1 1 28 SER HB2 H -6.113 -8.277 -5.139 1.00 . A A . 28 SER HB2 1 1 21 19782 1 1 28 SER HB3 H -7.745 -8.512 -4.512 1.00 . A A . 28 SER HB3 1 1 21 19783 1 1 28 SER HG H -8.527 -7.343 -6.301 1.00 . A A . 28 SER HG 1 1 21 19784 1 1 28 SER N N -6.159 -6.650 -3.129 1.00 . A A . 28 SER N 1 1 21 19785 1 1 28 SER O O -9.056 -5.328 -4.702 1.00 . A A . 28 SER O 1 1 21 19786 1 1 28 SER OG O -7.623 -7.659 -6.362 1.00 . A A . 28 SER OG 1 1 21 19787 1 1 29 GLN C C -10.200 -4.517 -1.912 1.00 . A A . 29 GLN C 1 1 21 19788 1 1 29 GLN CA C -10.160 -6.005 -2.251 1.00 . A A . 29 GLN CA 1 1 21 19789 1 1 29 GLN CB C -10.540 -6.829 -1.019 1.00 . A A . 29 GLN CB 1 1 21 19790 1 1 29 GLN CD C -12.340 -7.340 0.674 1.00 . A A . 29 GLN CD 1 1 21 19791 1 1 29 GLN CG C -12.030 -6.806 -0.709 1.00 . A A . 29 GLN CG 1 1 21 19792 1 1 29 GLN H H -8.271 -6.958 -2.165 1.00 . A A . 29 GLN H 1 1 21 19793 1 1 29 GLN HA H -10.870 -6.202 -3.037 1.00 . A A . 29 GLN HA 1 1 21 19794 1 1 29 GLN HB2 H -10.240 -7.854 -1.181 1.00 . A A . 29 GLN HB2 1 1 21 19795 1 1 29 GLN HB3 H -10.010 -6.441 -0.162 1.00 . A A . 29 GLN HB3 1 1 21 19796 1 1 29 GLN HE21 H -12.530 -9.181 -0.051 1.00 . A A . 29 GLN HE21 1 1 21 19797 1 1 29 GLN HE22 H -12.780 -9.015 1.650 1.00 . A A . 29 GLN HE22 1 1 21 19798 1 1 29 GLN HG2 H -12.380 -5.788 -0.775 1.00 . A A . 29 GLN HG2 1 1 21 19799 1 1 29 GLN HG3 H -12.540 -7.412 -1.440 1.00 . A A . 29 GLN HG3 1 1 21 19800 1 1 29 GLN N N -8.842 -6.402 -2.735 1.00 . A A . 29 GLN N 1 1 21 19801 1 1 29 GLN NE2 N -12.570 -8.644 0.766 1.00 . A A . 29 GLN NE2 1 1 21 19802 1 1 29 GLN O O -11.270 -3.919 -1.839 1.00 . A A . 29 GLN O 1 1 21 19803 1 1 29 GLN OE1 O -12.380 -6.587 1.648 1.00 . A A . 29 GLN OE1 1 1 21 19804 1 1 30 TRP C C -9.701 -1.654 -2.381 1.00 . A A . 30 TRP C 1 1 21 19805 1 1 30 TRP CA C -8.935 -2.505 -1.373 1.00 . A A . 30 TRP CA 1 1 21 19806 1 1 30 TRP CB C -7.470 -2.063 -1.329 1.00 . A A . 30 TRP CB 1 1 21 19807 1 1 30 TRP CD1 C -7.308 -2.964 1.068 1.00 . A A . 30 TRP CD1 1 1 21 19808 1 1 30 TRP CD2 C -5.333 -2.491 0.123 1.00 . A A . 30 TRP CD2 1 1 21 19809 1 1 30 TRP CE2 C -5.104 -2.972 1.427 1.00 . A A . 30 TRP CE2 1 1 21 19810 1 1 30 TRP CE3 C -4.237 -2.131 -0.663 1.00 . A A . 30 TRP CE3 1 1 21 19811 1 1 30 TRP CG C -6.749 -2.493 -0.086 1.00 . A A . 30 TRP CG 1 1 21 19812 1 1 30 TRP CH2 C -2.768 -2.740 1.167 1.00 . A A . 30 TRP CH2 1 1 21 19813 1 1 30 TRP CZ2 C -3.823 -3.100 1.959 1.00 . A A . 30 TRP CZ2 1 1 21 19814 1 1 30 TRP CZ3 C -2.967 -2.257 -0.134 1.00 . A A . 30 TRP CZ3 1 1 21 19815 1 1 30 TRP H H -8.204 -4.450 -1.775 1.00 . A A . 30 TRP H 1 1 21 19816 1 1 30 TRP HA H -9.371 -2.365 -0.396 1.00 . A A . 30 TRP HA 1 1 21 19817 1 1 30 TRP HB2 H -6.950 -2.483 -2.177 1.00 . A A . 30 TRP HB2 1 1 21 19818 1 1 30 TRP HB3 H -7.425 -0.985 -1.384 1.00 . A A . 30 TRP HB3 1 1 21 19819 1 1 30 TRP HD1 H -8.370 -3.083 1.225 1.00 . A A . 30 TRP HD1 1 1 21 19820 1 1 30 TRP HE1 H -6.474 -3.603 2.886 1.00 . A A . 30 TRP HE1 1 1 21 19821 1 1 30 TRP HE3 H -4.368 -1.757 -1.668 1.00 . A A . 30 TRP HE3 1 1 21 19822 1 1 30 TRP HH2 H -1.759 -2.822 1.538 1.00 . A A . 30 TRP HH2 1 1 21 19823 1 1 30 TRP HZ2 H -3.655 -3.471 2.960 1.00 . A A . 30 TRP HZ2 1 1 21 19824 1 1 30 TRP HZ3 H -2.107 -1.983 -0.727 1.00 . A A . 30 TRP HZ3 1 1 21 19825 1 1 30 TRP N N -9.027 -3.923 -1.705 1.00 . A A . 30 TRP N 1 1 21 19826 1 1 30 TRP NE1 N -6.325 -3.254 1.983 1.00 . A A . 30 TRP NE1 1 1 21 19827 1 1 30 TRP O O -9.437 -1.706 -3.581 1.00 . A A . 30 TRP O 1 1 21 19828 1 1 31 LYS C C -10.680 1.270 -3.095 1.00 . A A . 31 LYS C 1 1 21 19829 1 1 31 LYS CA C -11.450 0.001 -2.737 1.00 . A A . 31 LYS CA 1 1 21 19830 1 1 31 LYS CB C -12.760 0.356 -2.041 1.00 . A A . 31 LYS CB 1 1 21 19831 1 1 31 LYS CD C -14.620 0.918 -3.636 1.00 . A A . 31 LYS CD 1 1 21 19832 1 1 31 LYS CE C -16.140 0.864 -3.578 1.00 . A A . 31 LYS CE 1 1 21 19833 1 1 31 LYS CG C -13.990 -0.160 -2.767 1.00 . A A . 31 LYS CG 1 1 21 19834 1 1 31 LYS H H -10.810 -0.865 -0.916 1.00 . A A . 31 LYS H 1 1 21 19835 1 1 31 LYS HA H -11.660 -0.541 -3.647 1.00 . A A . 31 LYS HA 1 1 21 19836 1 1 31 LYS HB2 H -12.750 -0.066 -1.047 1.00 . A A . 31 LYS HB2 1 1 21 19837 1 1 31 LYS HB3 H -12.840 1.431 -1.965 1.00 . A A . 31 LYS HB3 1 1 21 19838 1 1 31 LYS HD2 H -14.290 1.884 -3.288 1.00 . A A . 31 LYS HD2 1 1 21 19839 1 1 31 LYS HD3 H -14.300 0.773 -4.658 1.00 . A A . 31 LYS HD3 1 1 21 19840 1 1 31 LYS HE2 H -16.490 0.186 -4.340 1.00 . A A . 31 LYS HE2 1 1 21 19841 1 1 31 LYS HE3 H -16.440 0.499 -2.606 1.00 . A A . 31 LYS HE3 1 1 21 19842 1 1 31 LYS HG2 H -13.710 -0.992 -3.393 1.00 . A A . 31 LYS HG2 1 1 21 19843 1 1 31 LYS HG3 H -14.720 -0.490 -2.037 1.00 . A A . 31 LYS HG3 1 1 21 19844 1 1 31 LYS HZ1 H -16.210 2.730 -4.516 1.00 . A A . 31 LYS HZ1 1 1 21 19845 1 1 31 LYS HZ2 H -16.750 2.748 -2.914 1.00 . A A . 31 LYS HZ2 1 1 21 19846 1 1 31 LYS HZ3 H -17.730 2.098 -4.132 1.00 . A A . 31 LYS HZ3 1 1 21 19847 1 1 31 LYS N N -10.640 -0.865 -1.883 1.00 . A A . 31 LYS N 1 1 21 19848 1 1 31 LYS NZ N -16.750 2.205 -3.801 1.00 . A A . 31 LYS NZ 1 1 21 19849 1 1 31 LYS O O -9.467 1.343 -2.905 1.00 . A A . 31 LYS O 1 1 21 19850 1 1 32 GLU C C -9.891 4.076 -2.873 1.00 . A A . 32 GLU C 1 1 21 19851 1 1 32 GLU CA C -10.770 3.534 -3.993 1.00 . A A . 32 GLU CA 1 1 21 19852 1 1 32 GLU CB C -11.850 4.561 -4.353 1.00 . A A . 32 GLU CB 1 1 21 19853 1 1 32 GLU CD C -12.610 6.365 -5.949 1.00 . A A . 32 GLU CD 1 1 21 19854 1 1 32 GLU CG C -11.600 5.260 -5.679 1.00 . A A . 32 GLU CG 1 1 21 19855 1 1 32 GLU H H -12.350 2.150 -3.737 1.00 . A A . 32 GLU H 1 1 21 19856 1 1 32 GLU HA H -10.160 3.353 -4.864 1.00 . A A . 32 GLU HA 1 1 21 19857 1 1 32 GLU HB2 H -12.800 4.058 -4.407 1.00 . A A . 32 GLU HB2 1 1 21 19858 1 1 32 GLU HB3 H -11.890 5.310 -3.576 1.00 . A A . 32 GLU HB3 1 1 21 19859 1 1 32 GLU HG2 H -10.610 5.687 -5.667 1.00 . A A . 32 GLU HG2 1 1 21 19860 1 1 32 GLU HG3 H -11.670 4.530 -6.472 1.00 . A A . 32 GLU HG3 1 1 21 19861 1 1 32 GLU N N -11.390 2.267 -3.610 1.00 . A A . 32 GLU N 1 1 21 19862 1 1 32 GLU O O -8.881 4.733 -3.130 1.00 . A A . 32 GLU O 1 1 21 19863 1 1 32 GLU OE1 O -13.820 6.125 -5.772 1.00 . A A . 32 GLU OE1 1 1 21 19864 1 1 32 GLU OE2 O -12.180 7.472 -6.338 1.00 . A A . 32 GLU OE2 1 1 21 19865 1 1 33 VAL C C -9.188 3.095 0.459 1.00 . A A . 33 VAL C 1 1 21 19866 1 1 33 VAL CA C -9.517 4.254 -0.474 1.00 . A A . 33 VAL CA 1 1 21 19867 1 1 33 VAL CB C -10.280 5.331 0.313 1.00 . A A . 33 VAL CB 1 1 21 19868 1 1 33 VAL CG1 C -9.417 5.920 1.412 1.00 . A A . 33 VAL CG1 1 1 21 19869 1 1 33 VAL CG2 C -10.780 6.420 -0.624 1.00 . A A . 33 VAL CG2 1 1 21 19870 1 1 33 VAL H H -11.080 3.268 -1.491 1.00 . A A . 33 VAL H 1 1 21 19871 1 1 33 VAL HA H -8.594 4.690 -0.830 1.00 . A A . 33 VAL HA 1 1 21 19872 1 1 33 VAL HB H -11.140 4.864 0.776 1.00 . A A . 33 VAL HB 1 1 21 19873 1 1 33 VAL HG11 H -8.379 5.834 1.132 1.00 . A A . 33 VAL HG11 1 1 21 19874 1 1 33 VAL HG12 H -9.587 5.382 2.333 1.00 . A A . 33 VAL HG12 1 1 21 19875 1 1 33 VAL HG13 H -9.669 6.961 1.552 1.00 . A A . 33 VAL HG13 1 1 21 19876 1 1 33 VAL HG21 H -10.890 7.346 -0.076 1.00 . A A . 33 VAL HG21 1 1 21 19877 1 1 33 VAL HG22 H -11.740 6.133 -1.034 1.00 . A A . 33 VAL HG22 1 1 21 19878 1 1 33 VAL HG23 H -10.070 6.557 -1.427 1.00 . A A . 33 VAL HG23 1 1 21 19879 1 1 33 VAL N N -10.270 3.797 -1.632 1.00 . A A . 33 VAL N 1 1 21 19880 1 1 33 VAL O O -10.070 2.523 1.092 1.00 . A A . 33 VAL O 1 1 21 19881 1 1 34 ILE C C -7.847 1.912 2.856 1.00 . A A . 34 ILE C 1 1 21 19882 1 1 34 ILE CA C -7.460 1.662 1.401 1.00 . A A . 34 ILE CA 1 1 21 19883 1 1 34 ILE CB C -5.934 1.466 1.316 1.00 . A A . 34 ILE CB 1 1 21 19884 1 1 34 ILE CD1 C -3.701 2.612 1.723 1.00 . A A . 34 ILE CD1 1 1 21 19885 1 1 34 ILE CG1 C -5.206 2.752 1.710 1.00 . A A . 34 ILE CG1 1 1 21 19886 1 1 34 ILE CG2 C -5.531 1.033 -0.084 1.00 . A A . 34 ILE CG2 1 1 21 19887 1 1 34 ILE H H -7.243 3.247 0.015 1.00 . A A . 34 ILE H 1 1 21 19888 1 1 34 ILE HA H -7.937 0.754 1.062 1.00 . A A . 34 ILE HA 1 1 21 19889 1 1 34 ILE HB H -5.655 0.680 2.001 1.00 . A A . 34 ILE HB 1 1 21 19890 1 1 34 ILE HD11 H -3.369 2.203 0.781 1.00 . A A . 34 ILE HD11 1 1 21 19891 1 1 34 ILE HD12 H -3.409 1.950 2.525 1.00 . A A . 34 ILE HD12 1 1 21 19892 1 1 34 ILE HD13 H -3.250 3.582 1.873 1.00 . A A . 34 ILE HD13 1 1 21 19893 1 1 34 ILE HG12 H -5.460 3.531 1.007 1.00 . A A . 34 ILE HG12 1 1 21 19894 1 1 34 ILE HG13 H -5.523 3.048 2.699 1.00 . A A . 34 ILE HG13 1 1 21 19895 1 1 34 ILE HG21 H -5.647 -0.037 -0.177 1.00 . A A . 34 ILE HG21 1 1 21 19896 1 1 34 ILE HG22 H -4.500 1.298 -0.261 1.00 . A A . 34 ILE HG22 1 1 21 19897 1 1 34 ILE HG23 H -6.160 1.528 -0.809 1.00 . A A . 34 ILE HG23 1 1 21 19898 1 1 34 ILE N N -7.905 2.752 0.543 1.00 . A A . 34 ILE N 1 1 21 19899 1 1 34 ILE O O -8.105 3.048 3.251 1.00 . A A . 34 ILE O 1 1 21 19900 1 1 35 PRO C C -7.463 2.047 5.811 1.00 . A A . 35 PRO C 1 1 21 19901 1 1 35 PRO CA C -8.255 0.958 5.094 1.00 . A A . 35 PRO CA 1 1 21 19902 1 1 35 PRO CB C -7.902 -0.420 5.656 1.00 . A A . 35 PRO CB 1 1 21 19903 1 1 35 PRO CD C -7.604 -0.547 3.288 1.00 . A A . 35 PRO CD 1 1 21 19904 1 1 35 PRO CG C -8.024 -1.342 4.494 1.00 . A A . 35 PRO CG 1 1 21 19905 1 1 35 PRO HA H -9.313 1.142 5.219 1.00 . A A . 35 PRO HA 1 1 21 19906 1 1 35 PRO HB2 H -6.896 -0.405 6.049 1.00 . A A . 35 PRO HB2 1 1 21 19907 1 1 35 PRO HB3 H -8.597 -0.681 6.441 1.00 . A A . 35 PRO HB3 1 1 21 19908 1 1 35 PRO HD2 H -6.550 -0.682 3.096 1.00 . A A . 35 PRO HD2 1 1 21 19909 1 1 35 PRO HD3 H -8.185 -0.835 2.424 1.00 . A A . 35 PRO HD3 1 1 21 19910 1 1 35 PRO HG2 H -7.370 -2.191 4.629 1.00 . A A . 35 PRO HG2 1 1 21 19911 1 1 35 PRO HG3 H -9.048 -1.668 4.389 1.00 . A A . 35 PRO HG3 1 1 21 19912 1 1 35 PRO N N -7.895 0.848 3.677 1.00 . A A . 35 PRO N 1 1 21 19913 1 1 35 PRO O O -6.421 2.491 5.330 1.00 . A A . 35 PRO O 1 1 21 19914 1 1 36 GLU C C -6.009 3.007 8.353 1.00 . A A . 36 GLU C 1 1 21 19915 1 1 36 GLU CA C -7.315 3.515 7.749 1.00 . A A . 36 GLU CA 1 1 21 19916 1 1 36 GLU CB C -8.246 4.006 8.858 1.00 . A A . 36 GLU CB 1 1 21 19917 1 1 36 GLU CD C -8.187 5.119 11.125 1.00 . A A . 36 GLU CD 1 1 21 19918 1 1 36 GLU CG C -7.651 5.118 9.707 1.00 . A A . 36 GLU CG 1 1 21 19919 1 1 36 GLU H H -8.806 2.085 7.291 1.00 . A A . 36 GLU H 1 1 21 19920 1 1 36 GLU HA H -7.095 4.340 7.087 1.00 . A A . 36 GLU HA 1 1 21 19921 1 1 36 GLU HB2 H -9.158 4.373 8.411 1.00 . A A . 36 GLU HB2 1 1 21 19922 1 1 36 GLU HB3 H -8.482 3.175 9.507 1.00 . A A . 36 GLU HB3 1 1 21 19923 1 1 36 GLU HG2 H -6.580 4.992 9.745 1.00 . A A . 36 GLU HG2 1 1 21 19924 1 1 36 GLU HG3 H -7.885 6.068 9.248 1.00 . A A . 36 GLU HG3 1 1 21 19925 1 1 36 GLU N N -7.970 2.476 6.963 1.00 . A A . 36 GLU N 1 1 21 19926 1 1 36 GLU O O -5.013 3.730 8.399 1.00 . A A . 36 GLU O 1 1 21 19927 1 1 36 GLU OE1 O -7.786 4.234 11.912 1.00 . A A . 36 GLU OE1 1 1 21 19928 1 1 36 GLU OE2 O -9.007 6.003 11.451 1.00 . A A . 36 GLU OE2 1 1 21 19929 1 1 37 LYS C C -3.885 0.615 8.365 1.00 . A A . 37 LYS C 1 1 21 19930 1 1 37 LYS CA C -4.837 1.166 9.425 1.00 . A A . 37 LYS CA 1 1 21 19931 1 1 37 LYS CB C -5.240 0.051 10.393 1.00 . A A . 37 LYS CB 1 1 21 19932 1 1 37 LYS CD C -4.746 1.112 12.616 1.00 . A A . 37 LYS CD 1 1 21 19933 1 1 37 LYS CE C -5.329 2.035 13.675 1.00 . A A . 37 LYS CE 1 1 21 19934 1 1 37 LYS CG C -5.827 0.564 11.698 1.00 . A A . 37 LYS CG 1 1 21 19935 1 1 37 LYS H H -6.844 1.236 8.758 1.00 . A A . 37 LYS H 1 1 21 19936 1 1 37 LYS HA H -4.323 1.938 9.977 1.00 . A A . 37 LYS HA 1 1 21 19937 1 1 37 LYS HB2 H -5.977 -0.575 9.915 1.00 . A A . 37 LYS HB2 1 1 21 19938 1 1 37 LYS HB3 H -4.369 -0.543 10.624 1.00 . A A . 37 LYS HB3 1 1 21 19939 1 1 37 LYS HD2 H -4.251 0.288 13.106 1.00 . A A . 37 LYS HD2 1 1 21 19940 1 1 37 LYS HD3 H -4.030 1.663 12.025 1.00 . A A . 37 LYS HD3 1 1 21 19941 1 1 37 LYS HE2 H -4.520 2.555 14.166 1.00 . A A . 37 LYS HE2 1 1 21 19942 1 1 37 LYS HE3 H -5.976 2.752 13.191 1.00 . A A . 37 LYS HE3 1 1 21 19943 1 1 37 LYS HG2 H -6.532 1.351 11.481 1.00 . A A . 37 LYS HG2 1 1 21 19944 1 1 37 LYS HG3 H -6.333 -0.249 12.198 1.00 . A A . 37 LYS HG3 1 1 21 19945 1 1 37 LYS HZ1 H -6.863 0.733 14.235 1.00 . A A . 37 LYS HZ1 1 1 21 19946 1 1 37 LYS HZ2 H -6.547 1.948 15.370 1.00 . A A . 37 LYS HZ2 1 1 21 19947 1 1 37 LYS HZ3 H -5.489 0.637 15.218 1.00 . A A . 37 LYS HZ3 1 1 21 19948 1 1 37 LYS N N -6.020 1.764 8.819 1.00 . A A . 37 LYS N 1 1 21 19949 1 1 37 LYS NZ N -6.112 1.286 14.696 1.00 . A A . 37 LYS NZ 1 1 21 19950 1 1 37 LYS O O -2.712 0.371 8.644 1.00 . A A . 37 LYS O 1 1 21 19951 1 1 38 ASP C C -2.717 1.020 5.467 1.00 . A A . 38 ASP C 1 1 21 19952 1 1 38 ASP CA C -3.571 -0.092 6.063 1.00 . A A . 38 ASP CA 1 1 21 19953 1 1 38 ASP CB C -4.453 -0.715 4.980 1.00 . A A . 38 ASP CB 1 1 21 19954 1 1 38 ASP CG C -4.923 -2.110 5.348 1.00 . A A . 38 ASP CG 1 1 21 19955 1 1 38 ASP H H -5.332 0.638 6.982 1.00 . A A . 38 ASP H 1 1 21 19956 1 1 38 ASP HA H -2.920 -0.851 6.471 1.00 . A A . 38 ASP HA 1 1 21 19957 1 1 38 ASP HB2 H -5.321 -0.092 4.827 1.00 . A A . 38 ASP HB2 1 1 21 19958 1 1 38 ASP HB3 H -3.892 -0.776 4.059 1.00 . A A . 38 ASP HB3 1 1 21 19959 1 1 38 ASP N N -4.391 0.424 7.151 1.00 . A A . 38 ASP N 1 1 21 19960 1 1 38 ASP O O -1.508 0.862 5.293 1.00 . A A . 38 ASP O 1 1 21 19961 1 1 38 ASP OD1 O -4.967 -2.422 6.557 1.00 . A A . 38 ASP OD1 1 1 21 19962 1 1 38 ASP OD2 O -5.246 -2.888 4.427 1.00 . A A . 38 ASP OD2 1 1 21 19963 1 1 39 ALA C C -1.561 3.782 5.554 1.00 . A A . 39 ALA C 1 1 21 19964 1 1 39 ALA CA C -2.645 3.291 4.602 1.00 . A A . 39 ALA CA 1 1 21 19965 1 1 39 ALA CB C -3.623 4.413 4.286 1.00 . A A . 39 ALA CB 1 1 21 19966 1 1 39 ALA H H -4.313 2.216 5.336 1.00 . A A . 39 ALA H 1 1 21 19967 1 1 39 ALA HA H -2.184 2.974 3.678 1.00 . A A . 39 ALA HA 1 1 21 19968 1 1 39 ALA HB1 H -3.609 5.138 5.086 1.00 . A A . 39 ALA HB1 1 1 21 19969 1 1 39 ALA HB2 H -4.618 4.005 4.186 1.00 . A A . 39 ALA HB2 1 1 21 19970 1 1 39 ALA HB3 H -3.335 4.892 3.362 1.00 . A A . 39 ALA HB3 1 1 21 19971 1 1 39 ALA N N -3.351 2.148 5.167 1.00 . A A . 39 ALA N 1 1 21 19972 1 1 39 ALA O O -0.557 4.352 5.124 1.00 . A A . 39 ALA O 1 1 21 19973 1 1 40 TYR C C 0.466 3.128 7.783 1.00 . A A . 40 TYR C 1 1 21 19974 1 1 40 TYR CA C -0.802 3.975 7.858 1.00 . A A . 40 TYR CA 1 1 21 19975 1 1 40 TYR CB C -1.416 3.873 9.256 1.00 . A A . 40 TYR CB 1 1 21 19976 1 1 40 TYR CD1 C -0.400 5.614 10.773 1.00 . A A . 40 TYR CD1 1 1 21 19977 1 1 40 TYR CD2 C 0.353 3.361 10.980 1.00 . A A . 40 TYR CD2 1 1 21 19978 1 1 40 TYR CE1 C 0.465 6.000 11.778 1.00 . A A . 40 TYR CE1 1 1 21 19979 1 1 40 TYR CE2 C 1.221 3.739 11.987 1.00 . A A . 40 TYR CE2 1 1 21 19980 1 1 40 TYR CG C -0.471 4.290 10.359 1.00 . A A . 40 TYR CG 1 1 21 19981 1 1 40 TYR CZ C 1.274 5.059 12.382 1.00 . A A . 40 TYR CZ 1 1 21 19982 1 1 40 TYR H H -2.585 3.095 7.134 1.00 . A A . 40 TYR H 1 1 21 19983 1 1 40 TYR HA H -0.544 5.005 7.663 1.00 . A A . 40 TYR HA 1 1 21 19984 1 1 40 TYR HB2 H -2.288 4.511 9.306 1.00 . A A . 40 TYR HB2 1 1 21 19985 1 1 40 TYR HB3 H -1.709 2.847 9.438 1.00 . A A . 40 TYR HB3 1 1 21 19986 1 1 40 TYR HD1 H -1.034 6.347 10.299 1.00 . A A . 40 TYR HD1 1 1 21 19987 1 1 40 TYR HD2 H 0.307 2.328 10.666 1.00 . A A . 40 TYR HD2 1 1 21 19988 1 1 40 TYR HE1 H 0.507 7.034 12.088 1.00 . A A . 40 TYR HE1 1 1 21 19989 1 1 40 TYR HE2 H 1.855 3.002 12.457 1.00 . A A . 40 TYR HE2 1 1 21 19990 1 1 40 TYR HH H 2.662 6.189 13.086 1.00 . A A . 40 TYR HH 1 1 21 19991 1 1 40 TYR N N -1.767 3.556 6.849 1.00 . A A . 40 TYR N 1 1 21 19992 1 1 40 TYR O O 1.571 3.657 7.677 1.00 . A A . 40 TYR O 1 1 21 19993 1 1 40 TYR OH O 2.138 5.441 13.383 1.00 . A A . 40 TYR OH 1 1 21 19994 1 1 41 ARG C C 2.235 1.104 6.498 1.00 . A A . 41 ARG C 1 1 21 19995 1 1 41 ARG CA C 1.423 0.890 7.772 1.00 . A A . 41 ARG CA 1 1 21 19996 1 1 41 ARG CB C 0.926 -0.558 7.842 1.00 . A A . 41 ARG CB 1 1 21 19997 1 1 41 ARG CD C 0.457 -2.240 9.650 1.00 . A A . 41 ARG CD 1 1 21 19998 1 1 41 ARG CG C 1.504 -1.344 9.009 1.00 . A A . 41 ARG CG 1 1 21 19999 1 1 41 ARG CZ C 0.428 -4.362 10.900 1.00 . A A . 41 ARG CZ 1 1 21 20000 1 1 41 ARG H H -0.614 1.450 7.919 1.00 . A A . 41 ARG H 1 1 21 20001 1 1 41 ARG HA H 2.056 1.083 8.625 1.00 . A A . 41 ARG HA 1 1 21 20002 1 1 41 ARG HB2 H -0.149 -0.553 7.936 1.00 . A A . 41 ARG HB2 1 1 21 20003 1 1 41 ARG HB3 H 1.196 -1.065 6.926 1.00 . A A . 41 ARG HB3 1 1 21 20004 1 1 41 ARG HD2 H -0.205 -1.629 10.246 1.00 . A A . 41 ARG HD2 1 1 21 20005 1 1 41 ARG HD3 H -0.109 -2.726 8.869 1.00 . A A . 41 ARG HD3 1 1 21 20006 1 1 41 ARG HE H 1.983 -3.114 10.802 1.00 . A A . 41 ARG HE 1 1 21 20007 1 1 41 ARG HG2 H 2.316 -1.956 8.650 1.00 . A A . 41 ARG HG2 1 1 21 20008 1 1 41 ARG HG3 H 1.874 -0.649 9.749 1.00 . A A . 41 ARG HG3 1 1 21 20009 1 1 41 ARG HH11 H -1.296 -3.938 9.932 1.00 . A A . 41 ARG HH11 1 1 21 20010 1 1 41 ARG HH12 H -1.290 -5.425 10.819 1.00 . A A . 41 ARG HH12 1 1 21 20011 1 1 41 ARG HH21 H 1.992 -5.071 11.967 1.00 . A A . 41 ARG HH21 1 1 21 20012 1 1 41 ARG HH22 H 0.576 -6.069 11.974 1.00 . A A . 41 ARG HH22 1 1 21 20013 1 1 41 ARG N N 0.294 1.812 7.835 1.00 . A A . 41 ARG N 1 1 21 20014 1 1 41 ARG NE N 1.059 -3.260 10.505 1.00 . A A . 41 ARG NE 1 1 21 20015 1 1 41 ARG NH1 N -0.822 -4.594 10.519 1.00 . A A . 41 ARG NH1 1 1 21 20016 1 1 41 ARG NH2 N 1.050 -5.239 11.677 1.00 . A A . 41 ARG NH2 1 1 21 20017 1 1 41 ARG O O 3.431 0.815 6.457 1.00 . A A . 41 ARG O 1 1 21 20018 1 1 42 LEU C C 3.400 2.840 4.354 1.00 . A A . 42 LEU C 1 1 21 20019 1 1 42 LEU CA C 2.242 1.864 4.185 1.00 . A A . 42 LEU CA 1 1 21 20020 1 1 42 LEU CB C 1.243 2.414 3.165 1.00 . A A . 42 LEU CB 1 1 21 20021 1 1 42 LEU CD1 C -0.620 2.022 1.536 1.00 . A A . 42 LEU CD1 1 1 21 20022 1 1 42 LEU CD2 C 1.040 0.208 1.991 1.00 . A A . 42 LEU CD2 1 1 21 20023 1 1 42 LEU CG C 0.275 1.381 2.586 1.00 . A A . 42 LEU CG 1 1 21 20024 1 1 42 LEU H H 0.625 1.821 5.550 1.00 . A A . 42 LEU H 1 1 21 20025 1 1 42 LEU HA H 2.630 0.924 3.823 1.00 . A A . 42 LEU HA 1 1 21 20026 1 1 42 LEU HB2 H 0.665 3.192 3.642 1.00 . A A . 42 LEU HB2 1 1 21 20027 1 1 42 LEU HB3 H 1.798 2.851 2.349 1.00 . A A . 42 LEU HB3 1 1 21 20028 1 1 42 LEU HD11 H -0.961 2.983 1.890 1.00 . A A . 42 LEU HD11 1 1 21 20029 1 1 42 LEU HD12 H -1.472 1.384 1.351 1.00 . A A . 42 LEU HD12 1 1 21 20030 1 1 42 LEU HD13 H -0.064 2.153 0.619 1.00 . A A . 42 LEU HD13 1 1 21 20031 1 1 42 LEU HD21 H 1.801 0.577 1.320 1.00 . A A . 42 LEU HD21 1 1 21 20032 1 1 42 LEU HD22 H 0.358 -0.429 1.448 1.00 . A A . 42 LEU HD22 1 1 21 20033 1 1 42 LEU HD23 H 1.504 -0.357 2.786 1.00 . A A . 42 LEU HD23 1 1 21 20034 1 1 42 LEU HG H -0.356 1.006 3.377 1.00 . A A . 42 LEU HG 1 1 21 20035 1 1 42 LEU N N 1.579 1.612 5.458 1.00 . A A . 42 LEU N 1 1 21 20036 1 1 42 LEU O O 4.484 2.635 3.808 1.00 . A A . 42 LEU O 1 1 21 20037 1 1 43 GLU C C 5.475 4.270 5.886 1.00 . A A . 43 GLU C 1 1 21 20038 1 1 43 GLU CA C 4.194 4.911 5.357 1.00 . A A . 43 GLU CA 1 1 21 20039 1 1 43 GLU CB C 3.683 5.958 6.350 1.00 . A A . 43 GLU CB 1 1 21 20040 1 1 43 GLU CD C 4.959 8.017 7.069 1.00 . A A . 43 GLU CD 1 1 21 20041 1 1 43 GLU CG C 4.092 7.380 6.002 1.00 . A A . 43 GLU CG 1 1 21 20042 1 1 43 GLU H H 2.284 4.015 5.525 1.00 . A A . 43 GLU H 1 1 21 20043 1 1 43 GLU HA H 4.409 5.396 4.416 1.00 . A A . 43 GLU HA 1 1 21 20044 1 1 43 GLU HB2 H 2.604 5.913 6.378 1.00 . A A . 43 GLU HB2 1 1 21 20045 1 1 43 GLU HB3 H 4.070 5.724 7.331 1.00 . A A . 43 GLU HB3 1 1 21 20046 1 1 43 GLU HG2 H 4.643 7.365 5.073 1.00 . A A . 43 GLU HG2 1 1 21 20047 1 1 43 GLU HG3 H 3.199 7.976 5.880 1.00 . A A . 43 GLU HG3 1 1 21 20048 1 1 43 GLU N N 3.166 3.904 5.116 1.00 . A A . 43 GLU N 1 1 21 20049 1 1 43 GLU O O 6.572 4.571 5.416 1.00 . A A . 43 GLU O 1 1 21 20050 1 1 43 GLU OE1 O 4.639 7.862 8.266 1.00 . A A . 43 GLU OE1 1 1 21 20051 1 1 43 GLU OE2 O 5.961 8.672 6.708 1.00 . A A . 43 GLU OE2 1 1 21 20052 1 1 44 ILE C C 7.252 1.898 6.439 1.00 . A A . 44 ILE C 1 1 21 20053 1 1 44 ILE CA C 6.465 2.707 7.467 1.00 . A A . 44 ILE CA 1 1 21 20054 1 1 44 ILE CB C 6.010 1.771 8.594 1.00 . A A . 44 ILE CB 1 1 21 20055 1 1 44 ILE CD1 C 5.370 3.958 9.758 1.00 . A A . 44 ILE CD1 1 1 21 20056 1 1 44 ILE CG1 C 5.040 2.496 9.529 1.00 . A A . 44 ILE CG1 1 1 21 20057 1 1 44 ILE CG2 C 7.213 1.252 9.369 1.00 . A A . 44 ILE CG2 1 1 21 20058 1 1 44 ILE H H 4.426 3.193 7.205 1.00 . A A . 44 ILE H 1 1 21 20059 1 1 44 ILE HA H 7.109 3.455 7.901 1.00 . A A . 44 ILE HA 1 1 21 20060 1 1 44 ILE HB H 5.507 0.926 8.150 1.00 . A A . 44 ILE HB 1 1 21 20061 1 1 44 ILE HD11 H 5.027 4.540 8.915 1.00 . A A . 44 ILE HD11 1 1 21 20062 1 1 44 ILE HD12 H 6.438 4.074 9.865 1.00 . A A . 44 ILE HD12 1 1 21 20063 1 1 44 ILE HD13 H 4.878 4.301 10.657 1.00 . A A . 44 ILE HD13 1 1 21 20064 1 1 44 ILE HG12 H 4.044 2.442 9.119 1.00 . A A . 44 ILE HG12 1 1 21 20065 1 1 44 ILE HG13 H 5.055 2.006 10.482 1.00 . A A . 44 ILE HG13 1 1 21 20066 1 1 44 ILE HG21 H 6.893 0.904 10.339 1.00 . A A . 44 ILE HG21 1 1 21 20067 1 1 44 ILE HG22 H 7.933 2.048 9.490 1.00 . A A . 44 ILE HG22 1 1 21 20068 1 1 44 ILE HG23 H 7.666 0.436 8.825 1.00 . A A . 44 ILE HG23 1 1 21 20069 1 1 44 ILE N N 5.327 3.389 6.868 1.00 . A A . 44 ILE N 1 1 21 20070 1 1 44 ILE O O 8.480 1.980 6.379 1.00 . A A . 44 ILE O 1 1 21 20071 1 1 45 VAL C C 7.757 1.094 3.486 1.00 . A A . 45 VAL C 1 1 21 20072 1 1 45 VAL CA C 7.173 0.268 4.628 1.00 . A A . 45 VAL CA 1 1 21 20073 1 1 45 VAL CB C 6.182 -0.751 4.040 1.00 . A A . 45 VAL CB 1 1 21 20074 1 1 45 VAL CG1 C 5.893 -1.859 5.038 1.00 . A A . 45 VAL CG1 1 1 21 20075 1 1 45 VAL CG2 C 4.897 -0.064 3.604 1.00 . A A . 45 VAL CG2 1 1 21 20076 1 1 45 VAL H H 5.570 1.077 5.746 1.00 . A A . 45 VAL H 1 1 21 20077 1 1 45 VAL HA H 7.971 -0.278 5.105 1.00 . A A . 45 VAL HA 1 1 21 20078 1 1 45 VAL HB H 6.637 -1.192 3.167 1.00 . A A . 45 VAL HB 1 1 21 20079 1 1 45 VAL HG11 H 4.843 -2.108 5.011 1.00 . A A . 45 VAL HG11 1 1 21 20080 1 1 45 VAL HG12 H 6.157 -1.525 6.032 1.00 . A A . 45 VAL HG12 1 1 21 20081 1 1 45 VAL HG13 H 6.477 -2.732 4.787 1.00 . A A . 45 VAL HG13 1 1 21 20082 1 1 45 VAL HG21 H 4.247 -0.784 3.127 1.00 . A A . 45 VAL HG21 1 1 21 20083 1 1 45 VAL HG22 H 5.128 0.728 2.907 1.00 . A A . 45 VAL HG22 1 1 21 20084 1 1 45 VAL HG23 H 4.398 0.351 4.466 1.00 . A A . 45 VAL HG23 1 1 21 20085 1 1 45 VAL N N 6.541 1.106 5.642 1.00 . A A . 45 VAL N 1 1 21 20086 1 1 45 VAL O O 8.835 0.788 2.976 1.00 . A A . 45 VAL O 1 1 21 20087 1 1 46 THR C C 8.511 4.013 2.438 1.00 . A A . 46 THR C 1 1 21 20088 1 1 46 THR CA C 7.467 2.988 1.987 1.00 . A A . 46 THR CA 1 1 21 20089 1 1 46 THR CB C 6.258 3.709 1.393 1.00 . A A . 46 THR CB 1 1 21 20090 1 1 46 THR CG2 C 5.221 2.768 0.820 1.00 . A A . 46 THR CG2 1 1 21 20091 1 1 46 THR H H 6.176 2.312 3.512 1.00 . A A . 46 THR H 1 1 21 20092 1 1 46 THR HA H 7.902 2.359 1.226 1.00 . A A . 46 THR HA 1 1 21 20093 1 1 46 THR HB H 6.596 4.351 0.600 1.00 . A A . 46 THR HB 1 1 21 20094 1 1 46 THR HG1 H 5.176 3.947 3.008 1.00 . A A . 46 THR HG1 1 1 21 20095 1 1 46 THR HG21 H 4.477 3.338 0.283 1.00 . A A . 46 THR HG21 1 1 21 20096 1 1 46 THR HG22 H 4.747 2.222 1.622 1.00 . A A . 46 THR HG22 1 1 21 20097 1 1 46 THR HG23 H 5.699 2.073 0.145 1.00 . A A . 46 THR HG23 1 1 21 20098 1 1 46 THR N N 7.032 2.128 3.080 1.00 . A A . 46 THR N 1 1 21 20099 1 1 46 THR O O 8.788 4.975 1.720 1.00 . A A . 46 THR O 1 1 21 20100 1 1 46 THR OG1 O 5.620 4.511 2.372 1.00 . A A . 46 THR OG1 1 1 21 20101 1 1 47 ALA C C 9.557 6.135 4.270 1.00 . A A . 47 ALA C 1 1 21 20102 1 1 47 ALA CA C 10.105 4.719 4.134 1.00 . A A . 47 ALA CA 1 1 21 20103 1 1 47 ALA CB C 11.330 4.710 3.232 1.00 . A A . 47 ALA CB 1 1 21 20104 1 1 47 ALA H H 8.841 3.026 4.148 1.00 . A A . 47 ALA H 1 1 21 20105 1 1 47 ALA HA H 10.405 4.364 5.110 1.00 . A A . 47 ALA HA 1 1 21 20106 1 1 47 ALA HB1 H 11.382 3.770 2.703 1.00 . A A . 47 ALA HB1 1 1 21 20107 1 1 47 ALA HB2 H 12.220 4.835 3.830 1.00 . A A . 47 ALA HB2 1 1 21 20108 1 1 47 ALA HB3 H 11.258 5.520 2.521 1.00 . A A . 47 ALA HB3 1 1 21 20109 1 1 47 ALA N N 9.092 3.807 3.616 1.00 . A A . 47 ALA N 1 1 21 20110 1 1 47 ALA O O 10.308 7.109 4.211 1.00 . A A . 47 ALA O 1 1 21 20111 1 1 48 GLY C C 7.546 8.302 3.285 1.00 . A A . 48 GLY C 1 1 21 20112 1 1 48 GLY CA C 7.622 7.546 4.596 1.00 . A A . 48 GLY CA 1 1 21 20113 1 1 48 GLY H H 7.697 5.433 4.494 1.00 . A A . 48 GLY H 1 1 21 20114 1 1 48 GLY HA2 H 6.622 7.411 4.979 1.00 . A A . 48 GLY HA2 1 1 21 20115 1 1 48 GLY HA3 H 8.192 8.129 5.304 1.00 . A A . 48 GLY HA3 1 1 21 20116 1 1 48 GLY N N 8.246 6.243 4.454 1.00 . A A . 48 GLY N 1 1 21 20117 1 1 48 GLY O O 7.771 9.512 3.246 1.00 . A A . 48 GLY O 1 1 21 20118 1 1 49 ALA C C 5.731 8.787 0.670 1.00 . A A . 49 ALA C 1 1 21 20119 1 1 49 ALA CA C 7.123 8.205 0.892 1.00 . A A . 49 ALA CA 1 1 21 20120 1 1 49 ALA CB C 7.452 7.191 -0.193 1.00 . A A . 49 ALA CB 1 1 21 20121 1 1 49 ALA H H 7.060 6.629 2.304 1.00 . A A . 49 ALA H 1 1 21 20122 1 1 49 ALA HA H 7.848 9.004 0.836 1.00 . A A . 49 ALA HA 1 1 21 20123 1 1 49 ALA HB1 H 7.804 7.708 -1.074 1.00 . A A . 49 ALA HB1 1 1 21 20124 1 1 49 ALA HB2 H 6.566 6.625 -0.437 1.00 . A A . 49 ALA HB2 1 1 21 20125 1 1 49 ALA HB3 H 8.222 6.521 0.162 1.00 . A A . 49 ALA HB3 1 1 21 20126 1 1 49 ALA N N 7.228 7.591 2.209 1.00 . A A . 49 ALA N 1 1 21 20127 1 1 49 ALA O O 5.584 9.899 0.163 1.00 . A A . 49 ALA O 1 1 21 20128 1 1 50 LEU C C 2.826 9.133 2.176 1.00 . A A . 50 LEU C 1 1 21 20129 1 1 50 LEU CA C 3.328 8.465 0.899 1.00 . A A . 50 LEU CA 1 1 21 20130 1 1 50 LEU CB C 2.431 7.278 0.540 1.00 . A A . 50 LEU CB 1 1 21 20131 1 1 50 LEU CD1 C 2.305 5.019 -0.541 1.00 . A A . 50 LEU CD1 1 1 21 20132 1 1 50 LEU CD2 C 2.685 7.056 -1.943 1.00 . A A . 50 LEU CD2 1 1 21 20133 1 1 50 LEU CG C 2.948 6.396 -0.597 1.00 . A A . 50 LEU CG 1 1 21 20134 1 1 50 LEU H H 4.890 7.148 1.452 1.00 . A A . 50 LEU H 1 1 21 20135 1 1 50 LEU HA H 3.297 9.184 0.095 1.00 . A A . 50 LEU HA 1 1 21 20136 1 1 50 LEU HB2 H 2.313 6.663 1.420 1.00 . A A . 50 LEU HB2 1 1 21 20137 1 1 50 LEU HB3 H 1.461 7.661 0.257 1.00 . A A . 50 LEU HB3 1 1 21 20138 1 1 50 LEU HD11 H 3.033 4.271 -0.819 1.00 . A A . 50 LEU HD11 1 1 21 20139 1 1 50 LEU HD12 H 1.471 4.984 -1.227 1.00 . A A . 50 LEU HD12 1 1 21 20140 1 1 50 LEU HD13 H 1.954 4.827 0.461 1.00 . A A . 50 LEU HD13 1 1 21 20141 1 1 50 LEU HD21 H 2.583 8.123 -1.807 1.00 . A A . 50 LEU HD21 1 1 21 20142 1 1 50 LEU HD22 H 1.775 6.659 -2.366 1.00 . A A . 50 LEU HD22 1 1 21 20143 1 1 50 LEU HD23 H 3.510 6.855 -2.611 1.00 . A A . 50 LEU HD23 1 1 21 20144 1 1 50 LEU HG H 4.016 6.271 -0.490 1.00 . A A . 50 LEU HG 1 1 21 20145 1 1 50 LEU N N 4.711 8.025 1.053 1.00 . A A . 50 LEU N 1 1 21 20146 1 1 50 LEU O O 2.875 8.544 3.256 1.00 . A A . 50 LEU O 1 1 21 20147 1 1 51 LYS C C 0.417 10.694 3.533 1.00 . A A . 51 LYS C 1 1 21 20148 1 1 51 LYS CA C 1.842 11.116 3.187 1.00 . A A . 51 LYS CA 1 1 21 20149 1 1 51 LYS CB C 1.884 12.616 2.897 1.00 . A A . 51 LYS CB 1 1 21 20150 1 1 51 LYS CD C 1.484 14.324 1.099 1.00 . A A . 51 LYS CD 1 1 21 20151 1 1 51 LYS CE C 0.485 14.860 0.087 1.00 . A A . 51 LYS CE 1 1 21 20152 1 1 51 LYS CG C 0.991 13.039 1.742 1.00 . A A . 51 LYS CG 1 1 21 20153 1 1 51 LYS H H 2.339 10.782 1.157 1.00 . A A . 51 LYS H 1 1 21 20154 1 1 51 LYS HA H 2.481 10.903 4.031 1.00 . A A . 51 LYS HA 1 1 21 20155 1 1 51 LYS HB2 H 1.570 13.151 3.783 1.00 . A A . 51 LYS HB2 1 1 21 20156 1 1 51 LYS HB3 H 2.900 12.898 2.660 1.00 . A A . 51 LYS HB3 1 1 21 20157 1 1 51 LYS HD2 H 1.634 15.067 1.867 1.00 . A A . 51 LYS HD2 1 1 21 20158 1 1 51 LYS HD3 H 2.421 14.129 0.597 1.00 . A A . 51 LYS HD3 1 1 21 20159 1 1 51 LYS HE2 H -0.057 14.028 -0.340 1.00 . A A . 51 LYS HE2 1 1 21 20160 1 1 51 LYS HE3 H -0.207 15.515 0.595 1.00 . A A . 51 LYS HE3 1 1 21 20161 1 1 51 LYS HG2 H 0.985 12.256 1.001 1.00 . A A . 51 LYS HG2 1 1 21 20162 1 1 51 LYS HG3 H -0.011 13.194 2.115 1.00 . A A . 51 LYS HG3 1 1 21 20163 1 1 51 LYS HZ1 H 2.021 16.065 -0.654 1.00 . A A . 51 LYS HZ1 1 1 21 20164 1 1 51 LYS HZ2 H 0.518 16.355 -1.372 1.00 . A A . 51 LYS HZ2 1 1 21 20165 1 1 51 LYS HZ3 H 1.400 14.973 -1.788 1.00 . A A . 51 LYS HZ3 1 1 21 20166 1 1 51 LYS N N 2.348 10.365 2.044 1.00 . A A . 51 LYS N 1 1 21 20167 1 1 51 LYS NZ N 1.152 15.616 -1.009 1.00 . A A . 51 LYS NZ 1 1 21 20168 1 1 51 LYS O O -0.518 10.944 2.771 1.00 . A A . 51 LYS O 1 1 21 20169 1 1 52 TYR C C -1.998 10.782 5.335 1.00 . A A . 52 TYR C 1 1 21 20170 1 1 52 TYR CA C -1.052 9.602 5.139 1.00 . A A . 52 TYR CA 1 1 21 20171 1 1 52 TYR CB C -0.919 8.819 6.446 1.00 . A A . 52 TYR CB 1 1 21 20172 1 1 52 TYR CD1 C -3.255 8.975 7.396 1.00 . A A . 52 TYR CD1 1 1 21 20173 1 1 52 TYR CD2 C -2.387 6.814 6.889 1.00 . A A . 52 TYR CD2 1 1 21 20174 1 1 52 TYR CE1 C -4.433 8.403 7.835 1.00 . A A . 52 TYR CE1 1 1 21 20175 1 1 52 TYR CE2 C -3.565 6.235 7.325 1.00 . A A . 52 TYR CE2 1 1 21 20176 1 1 52 TYR CG C -2.212 8.193 6.917 1.00 . A A . 52 TYR CG 1 1 21 20177 1 1 52 TYR CZ C -4.583 7.033 7.796 1.00 . A A . 52 TYR CZ 1 1 21 20178 1 1 52 TYR H H 1.042 9.888 5.252 1.00 . A A . 52 TYR H 1 1 21 20179 1 1 52 TYR HA H -1.459 8.951 4.379 1.00 . A A . 52 TYR HA 1 1 21 20180 1 1 52 TYR HB2 H -0.198 8.026 6.312 1.00 . A A . 52 TYR HB2 1 1 21 20181 1 1 52 TYR HB3 H -0.572 9.486 7.222 1.00 . A A . 52 TYR HB3 1 1 21 20182 1 1 52 TYR HD1 H -3.138 10.048 7.423 1.00 . A A . 52 TYR HD1 1 1 21 20183 1 1 52 TYR HD2 H -1.586 6.191 6.519 1.00 . A A . 52 TYR HD2 1 1 21 20184 1 1 52 TYR HE1 H -5.232 9.030 8.201 1.00 . A A . 52 TYR HE1 1 1 21 20185 1 1 52 TYR HE2 H -3.681 5.161 7.293 1.00 . A A . 52 TYR HE2 1 1 21 20186 1 1 52 TYR HH H -6.227 6.086 7.484 1.00 . A A . 52 TYR HH 1 1 21 20187 1 1 52 TYR N N 0.259 10.055 4.688 1.00 . A A . 52 TYR N 1 1 21 20188 1 1 52 TYR O O -1.752 11.656 6.167 1.00 . A A . 52 TYR O 1 1 21 20189 1 1 52 TYR OH O -5.757 6.461 8.232 1.00 . A A . 52 TYR OH 1 1 21 20190 1 1 53 GLN C C -5.263 11.449 5.490 1.00 . A A . 53 GLN C 1 1 21 20191 1 1 53 GLN CA C -4.061 11.879 4.656 1.00 . A A . 53 GLN CA 1 1 21 20192 1 1 53 GLN CB C -4.520 12.301 3.259 1.00 . A A . 53 GLN CB 1 1 21 20193 1 1 53 GLN CD C -3.831 14.201 1.743 1.00 . A A . 53 GLN CD 1 1 21 20194 1 1 53 GLN CG C -3.414 12.905 2.410 1.00 . A A . 53 GLN CG 1 1 21 20195 1 1 53 GLN H H -3.222 10.080 3.919 1.00 . A A . 53 GLN H 1 1 21 20196 1 1 53 GLN HA H -3.586 12.719 5.138 1.00 . A A . 53 GLN HA 1 1 21 20197 1 1 53 GLN HB2 H -4.907 11.433 2.743 1.00 . A A . 53 GLN HB2 1 1 21 20198 1 1 53 GLN HB3 H -5.309 13.031 3.358 1.00 . A A . 53 GLN HB3 1 1 21 20199 1 1 53 GLN HE21 H -3.108 15.249 3.271 1.00 . A A . 53 GLN HE21 1 1 21 20200 1 1 53 GLN HE22 H -3.815 16.173 1.994 1.00 . A A . 53 GLN HE22 1 1 21 20201 1 1 53 GLN HG2 H -2.559 13.102 3.040 1.00 . A A . 53 GLN HG2 1 1 21 20202 1 1 53 GLN HG3 H -3.137 12.195 1.643 1.00 . A A . 53 GLN HG3 1 1 21 20203 1 1 53 GLN N N -3.080 10.805 4.564 1.00 . A A . 53 GLN N 1 1 21 20204 1 1 53 GLN NE2 N -3.557 15.321 2.402 1.00 . A A . 53 GLN NE2 1 1 21 20205 1 1 53 GLN O O -5.994 10.532 5.115 1.00 . A A . 53 GLN O 1 1 21 20206 1 1 53 GLN OE1 O -4.393 14.197 0.647 1.00 . A A . 53 GLN OE1 1 1 21 20207 1 1 54 GLU C C -7.815 12.623 7.161 1.00 . A A . 54 GLU C 1 1 21 20208 1 1 54 GLU CA C -6.574 11.803 7.512 1.00 . A A . 54 GLU CA 1 1 21 20209 1 1 54 GLU CB C -6.179 12.058 8.967 1.00 . A A . 54 GLU CB 1 1 21 20210 1 1 54 GLU CD C -5.284 13.715 10.651 1.00 . A A . 54 GLU CD 1 1 21 20211 1 1 54 GLU CG C -5.881 13.517 9.270 1.00 . A A . 54 GLU CG 1 1 21 20212 1 1 54 GLU H H -4.843 12.837 6.867 1.00 . A A . 54 GLU H 1 1 21 20213 1 1 54 GLU HA H -6.806 10.756 7.392 1.00 . A A . 54 GLU HA 1 1 21 20214 1 1 54 GLU HB2 H -6.986 11.736 9.608 1.00 . A A . 54 GLU HB2 1 1 21 20215 1 1 54 GLU HB3 H -5.296 11.477 9.195 1.00 . A A . 54 GLU HB3 1 1 21 20216 1 1 54 GLU HG2 H -5.181 13.889 8.537 1.00 . A A . 54 GLU HG2 1 1 21 20217 1 1 54 GLU HG3 H -6.800 14.078 9.207 1.00 . A A . 54 GLU HG3 1 1 21 20218 1 1 54 GLU N N -5.461 12.117 6.622 1.00 . A A . 54 GLU N 1 1 21 20219 1 1 54 GLU O O -8.587 13.001 8.042 1.00 . A A . 54 GLU O 1 1 21 20220 1 1 54 GLU OE1 O -5.915 13.281 11.638 1.00 . A A . 54 GLU OE1 1 1 21 20221 1 1 54 GLU OE2 O -4.188 14.304 10.745 1.00 . A A . 54 GLU OE2 1 1 21 20222 1 1 55 ASN C C -10.340 12.742 5.140 1.00 . A A . 55 ASN C 1 1 21 20223 1 1 55 ASN CA C -9.155 13.661 5.415 1.00 . A A . 55 ASN CA 1 1 21 20224 1 1 55 ASN CB C -8.802 14.451 4.155 1.00 . A A . 55 ASN CB 1 1 21 20225 1 1 55 ASN CG C -9.626 15.717 4.017 1.00 . A A . 55 ASN CG 1 1 21 20226 1 1 55 ASN H H -7.361 12.563 5.214 1.00 . A A . 55 ASN H 1 1 21 20227 1 1 55 ASN HA H -9.425 14.351 6.201 1.00 . A A . 55 ASN HA 1 1 21 20228 1 1 55 ASN HB2 H -7.759 14.726 4.190 1.00 . A A . 55 ASN HB2 1 1 21 20229 1 1 55 ASN HB3 H -8.978 13.832 3.288 1.00 . A A . 55 ASN HB3 1 1 21 20230 1 1 55 ASN HD21 H -8.249 16.751 5.011 1.00 . A A . 55 ASN HD21 1 1 21 20231 1 1 55 ASN HD22 H -9.628 17.649 4.485 1.00 . A A . 55 ASN HD22 1 1 21 20232 1 1 55 ASN N N -8.005 12.891 5.872 1.00 . A A . 55 ASN N 1 1 21 20233 1 1 55 ASN ND2 N -9.117 16.817 4.559 1.00 . A A . 55 ASN ND2 1 1 21 20234 1 1 55 ASN O O -11.460 13.021 5.552 1.00 . A A . 55 ASN O 1 1 21 20235 1 1 55 ASN OD1 O -10.700 15.706 3.428 1.00 . A A . 55 ASN OD1 1 1 21 20236 1 1 56 ALA C C -11.240 9.608 5.203 1.00 . A A . 56 ALA C 1 1 21 20237 1 1 56 ALA CA C -11.110 10.674 4.116 1.00 . A A . 56 ALA CA 1 1 21 20238 1 1 56 ALA CB C -10.820 10.024 2.771 1.00 . A A . 56 ALA CB 1 1 21 20239 1 1 56 ALA H H -9.155 11.473 4.148 1.00 . A A . 56 ALA H 1 1 21 20240 1 1 56 ALA HA H -12.050 11.206 4.036 1.00 . A A . 56 ALA HA 1 1 21 20241 1 1 56 ALA HB1 H -11.750 9.842 2.251 1.00 . A A . 56 ALA HB1 1 1 21 20242 1 1 56 ALA HB2 H -10.300 9.089 2.928 1.00 . A A . 56 ALA HB2 1 1 21 20243 1 1 56 ALA HB3 H -10.200 10.683 2.182 1.00 . A A . 56 ALA HB3 1 1 21 20244 1 1 56 ALA N N -10.070 11.642 4.444 1.00 . A A . 56 ALA N 1 1 21 20245 1 1 56 ALA O O -12.180 8.814 5.196 1.00 . A A . 56 ALA O 1 1 21 20246 1 1 57 TYR C C -11.060 9.158 8.439 1.00 . A A . 57 TYR C 1 1 21 20247 1 1 57 TYR CA C -10.300 8.623 7.227 1.00 . A A . 57 TYR CA 1 1 21 20248 1 1 57 TYR CB C -8.876 8.266 7.628 1.00 . A A . 57 TYR CB 1 1 21 20249 1 1 57 TYR CD1 C -8.581 6.453 5.898 1.00 . A A . 57 TYR CD1 1 1 21 20250 1 1 57 TYR CD2 C -6.855 8.083 6.125 1.00 . A A . 57 TYR CD2 1 1 21 20251 1 1 57 TYR CE1 C -7.865 5.828 4.895 1.00 . A A . 57 TYR CE1 1 1 21 20252 1 1 57 TYR CE2 C -6.133 7.463 5.122 1.00 . A A . 57 TYR CE2 1 1 21 20253 1 1 57 TYR CG C -8.088 7.588 6.531 1.00 . A A . 57 TYR CG 1 1 21 20254 1 1 57 TYR CZ C -6.643 6.337 4.511 1.00 . A A . 57 TYR CZ 1 1 21 20255 1 1 57 TYR H H -9.567 10.248 6.092 1.00 . A A . 57 TYR H 1 1 21 20256 1 1 57 TYR HA H -10.800 7.732 6.870 1.00 . A A . 57 TYR HA 1 1 21 20257 1 1 57 TYR HB2 H -8.349 9.168 7.903 1.00 . A A . 57 TYR HB2 1 1 21 20258 1 1 57 TYR HB3 H -8.903 7.599 8.478 1.00 . A A . 57 TYR HB3 1 1 21 20259 1 1 57 TYR HD1 H -9.538 6.057 6.201 1.00 . A A . 57 TYR HD1 1 1 21 20260 1 1 57 TYR HD2 H -6.459 8.966 6.607 1.00 . A A . 57 TYR HD2 1 1 21 20261 1 1 57 TYR HE1 H -8.264 4.948 4.416 1.00 . A A . 57 TYR HE1 1 1 21 20262 1 1 57 TYR HE2 H -5.175 7.864 4.821 1.00 . A A . 57 TYR HE2 1 1 21 20263 1 1 57 TYR HH H -5.434 6.374 3.015 1.00 . A A . 57 TYR HH 1 1 21 20264 1 1 57 TYR N N -10.290 9.593 6.136 1.00 . A A . 57 TYR N 1 1 21 20265 1 1 57 TYR O O -11.000 8.580 9.524 1.00 . A A . 57 TYR O 1 1 21 20266 1 1 57 TYR OH O -5.928 5.717 3.511 1.00 . A A . 57 TYR OH 1 1 21 20267 1 1 58 ARG C C -13.990 10.385 9.317 1.00 . A A . 58 ARG C 1 1 21 20268 1 1 58 ARG CA C -12.550 10.865 9.340 1.00 . A A . 58 ARG CA 1 1 21 20269 1 1 58 ARG CB C -12.500 12.391 9.237 1.00 . A A . 58 ARG CB 1 1 21 20270 1 1 58 ARG CD C -13.740 13.430 11.164 1.00 . A A . 58 ARG CD 1 1 21 20271 1 1 58 ARG CG C -12.380 13.087 10.583 1.00 . A A . 58 ARG CG 1 1 21 20272 1 1 58 ARG CZ C -15.290 12.494 12.833 1.00 . A A . 58 ARG CZ 1 1 21 20273 1 1 58 ARG H H -11.800 10.682 7.370 1.00 . A A . 58 ARG H 1 1 21 20274 1 1 58 ARG HA H -12.090 10.562 10.271 1.00 . A A . 58 ARG HA 1 1 21 20275 1 1 58 ARG HB2 H -11.650 12.674 8.629 1.00 . A A . 58 ARG HB2 1 1 21 20276 1 1 58 ARG HB3 H -13.410 12.737 8.760 1.00 . A A . 58 ARG HB3 1 1 21 20277 1 1 58 ARG HD2 H -13.730 14.465 11.474 1.00 . A A . 58 ARG HD2 1 1 21 20278 1 1 58 ARG HD3 H -14.490 13.288 10.401 1.00 . A A . 58 ARG HD3 1 1 21 20279 1 1 58 ARG HE H -13.340 12.077 12.723 1.00 . A A . 58 ARG HE 1 1 21 20280 1 1 58 ARG HG2 H -11.860 12.434 11.268 1.00 . A A . 58 ARG HG2 1 1 21 20281 1 1 58 ARG HG3 H -11.810 13.999 10.453 1.00 . A A . 58 ARG HG3 1 1 21 20282 1 1 58 ARG HH11 H -16.140 13.770 11.517 1.00 . A A . 58 ARG HH11 1 1 21 20283 1 1 58 ARG HH12 H -17.210 13.098 12.701 1.00 . A A . 58 ARG HH12 1 1 21 20284 1 1 58 ARG HH21 H -14.750 11.193 14.281 1.00 . A A . 58 ARG HH21 1 1 21 20285 1 1 58 ARG HH22 H -16.420 11.636 14.272 1.00 . A A . 58 ARG HH22 1 1 21 20286 1 1 58 ARG N N -11.780 10.263 8.254 1.00 . A A . 58 ARG N 1 1 21 20287 1 1 58 ARG NE N -14.070 12.593 12.314 1.00 . A A . 58 ARG NE 1 1 21 20288 1 1 58 ARG NH1 N -16.300 13.178 12.307 1.00 . A A . 58 ARG NH1 1 1 21 20289 1 1 58 ARG NH2 N -15.500 11.709 13.882 1.00 . A A . 58 ARG NH2 1 1 21 20290 1 1 58 ARG O O -14.640 10.293 10.359 1.00 . A A . 58 ARG O 1 1 21 20291 1 1 59 GLN C C -15.940 8.492 6.933 1.00 . A A . 59 GLN C 1 1 21 20292 1 1 59 GLN CA C -15.870 9.610 7.969 1.00 . A A . 59 GLN CA 1 1 21 20293 1 1 59 GLN CB C -16.780 10.768 7.560 1.00 . A A . 59 GLN CB 1 1 21 20294 1 1 59 GLN CD C -18.570 12.239 8.574 1.00 . A A . 59 GLN CD 1 1 21 20295 1 1 59 GLN CG C -18.080 10.820 8.346 1.00 . A A . 59 GLN CG 1 1 21 20296 1 1 59 GLN H H -13.930 10.174 7.330 1.00 . A A . 59 GLN H 1 1 21 20297 1 1 59 GLN HA H -16.190 9.223 8.923 1.00 . A A . 59 GLN HA 1 1 21 20298 1 1 59 GLN HB2 H -16.250 11.697 7.714 1.00 . A A . 59 GLN HB2 1 1 21 20299 1 1 59 GLN HB3 H -17.020 10.670 6.512 1.00 . A A . 59 GLN HB3 1 1 21 20300 1 1 59 GLN HE21 H -17.960 12.169 10.465 1.00 . A A . 59 GLN HE21 1 1 21 20301 1 1 59 GLN HE22 H -18.690 13.653 9.967 1.00 . A A . 59 GLN HE22 1 1 21 20302 1 1 59 GLN HG2 H -18.840 10.281 7.798 1.00 . A A . 59 GLN HG2 1 1 21 20303 1 1 59 GLN HG3 H -17.930 10.349 9.305 1.00 . A A . 59 GLN HG3 1 1 21 20304 1 1 59 GLN N N -14.490 10.081 8.125 1.00 . A A . 59 GLN N 1 1 21 20305 1 1 59 GLN NE2 N -18.390 12.737 9.791 1.00 . A A . 59 GLN NE2 1 1 21 20306 1 1 59 GLN O O -15.980 8.749 5.730 1.00 . A A . 59 GLN O 1 1 21 20307 1 1 59 GLN OE1 O -19.090 12.880 7.667 1.00 . A A . 59 GLN OE1 1 1 21 20308 1 1 60 ALA C C -14.850 6.051 5.579 1.00 . A A . 60 ALA C 1 1 21 20309 1 1 60 ALA CA C -16.050 6.095 6.526 1.00 . A A . 60 ALA CA 1 1 21 20310 1 1 60 ALA CB C -17.350 6.117 5.739 1.00 . A A . 60 ALA CB 1 1 21 20311 1 1 60 ALA H H -15.940 7.112 8.380 1.00 . A A . 60 ALA H 1 1 21 20312 1 1 60 ALA HA H -16.040 5.207 7.140 1.00 . A A . 60 ALA HA 1 1 21 20313 1 1 60 ALA HB1 H -17.230 5.548 4.829 1.00 . A A . 60 ALA HB1 1 1 21 20314 1 1 60 ALA HB2 H -17.600 7.137 5.494 1.00 . A A . 60 ALA HB2 1 1 21 20315 1 1 60 ALA HB3 H -18.140 5.682 6.334 1.00 . A A . 60 ALA HB3 1 1 21 20316 1 1 60 ALA N N -15.970 7.253 7.410 1.00 . A A . 60 ALA N 1 1 21 20317 1 1 60 ALA O O -13.960 6.895 5.648 1.00 . A A . 60 ALA O 1 1 21 20318 1 1 61 ALA C C -14.220 4.145 2.495 1.00 . A A . 61 ALA C 1 1 21 20319 1 1 61 ALA CA C -13.760 4.902 3.732 1.00 . A A . 61 ALA CA 1 1 21 20320 1 1 61 ALA CB C -12.580 4.188 4.377 1.00 . A A . 61 ALA CB 1 1 21 20321 1 1 61 ALA H H -15.580 4.416 4.689 1.00 . A A . 61 ALA H 1 1 21 20322 1 1 61 ALA HA H -13.430 5.888 3.436 1.00 . A A . 61 ALA HA 1 1 21 20323 1 1 61 ALA HB1 H -12.070 3.589 3.636 1.00 . A A . 61 ALA HB1 1 1 21 20324 1 1 61 ALA HB2 H -12.940 3.548 5.172 1.00 . A A . 61 ALA HB2 1 1 21 20325 1 1 61 ALA HB3 H -11.890 4.916 4.784 1.00 . A A . 61 ALA HB3 1 1 21 20326 1 1 61 ALA N N -14.840 5.059 4.694 1.00 . A A . 61 ALA N 1 1 21 20327 1 1 61 ALA O O -15.090 3.257 2.638 1.00 . A A . 61 ALA O 1 1 21 20328 1 1 61 ALA OXT O -13.720 4.445 1.392 1.00 . A A . 61 ALA OXT 1 1 stop_ save_
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