NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
628244 | 6cku | 30422 | cing | 4-filtered-FRED | STAR | entry | full | 543 |
data_FRED_restraints_with_modified_coordinates_PDB_code_6cku # This FRED archive file contains, for PDB entry <6cku>: # # - Coordinates and sequence information from the PDB mmCIF file # - NMR restraints from the PDB MR file # # In this file, the coordinates and NMR restraints share the same atom names, # and in this way can differ from the data deposited at the wwPDB. To achieve # this aim, the NMR restraints were parsed from their original format files, and # the coordinates and NMR restraints information were subsequently harmonized. # # Due to the complexity of this harmonization process and the filtering process # used in creating these files, the NMR restraints information in these files # may differ significantly from that in the originally deposited file. Other # modifications could have occurred to the NMR restraints information, or data # could have been lost because of parsing or conversion errors. The PDB file # remains the authoritative reference for the atomic coordinates and the # originally deposited restraints files remain the primary reference for these # data. # # This file is generated at the BioMagResBank (BMRB) in collaboration with the # PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and # the CMBI/IMM group at the Radboud University of Nijmegen. # # Several software packages were used to produce this file: # # - Wattos (BMRB and CMBI/IMM). # - FormatConverter and NMRStarExport (PDBe). # - CCPN framework (http://www.ccpn.ac.uk/). # # More information about this process can be found in the references below. # Please cite the original reference for this PDB entry. # # JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL # Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED # containing converted and filtered sets of experimental NMR restraints and # coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12. # # WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL # Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy: # development of a software pipeline. Proteins 59, 687-696. # # JF Doreleijers, WF Vranken, C Schulte, J Lin, JR Wedell, CJ Penkett, GW Vuister, # G Vriend, JL Markley, and EL Ulrich (2009). The NMR Restraints Grid at BMRB for # 5,266 Protein and Nucleic Acid PDB Entries. J Biomol. NMR 45, 389?396. save_Conversion_project_for_entry_Name_1 _Study_list.Sf_category study_list _Study_list.Entry_ID 1 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project for entry 1" NMR . 1 1 stop_ save_ save_originalConstraints_1 _Entry.PDB_coordinate_file_version . _Entry.Sf_category entry_information _Entry.ID 1 _Entry.Title "Data for entry 1" _Entry.NMR_STAR_version 3.1.0.8 _Entry.Experimental_method NMR _Entry.Details . save_ save_assembly_6cku _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 6cku _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all disulfide bound" _Assembly.Molecular_mass 5681.30 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 $Granulin_AaE A . 1 1 stop_ save_ save_Granulin_AaE _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Granulin AaE" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code DVQCGGGFSCHDGETCCPTSQTTWGCCPSPKAVCCDDMQHCCPAGYKCGPGGTCIS _Entity.Number_of_monomers 56 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 ASP . 1 1 2 VAL . 1 1 3 GLN . 1 1 4 CYS . 1 1 5 GLY . 1 1 6 GLY . 1 1 7 GLY . 1 1 8 PHE . 1 1 9 SER . 1 1 10 CYS . 1 1 11 HIS . 1 1 12 ASP . 1 1 13 GLY . 1 1 14 GLU . 1 1 15 THR . 1 1 16 CYS . 1 1 17 CYS . 1 1 18 PRO . 1 1 19 THR . 1 1 20 SER . 1 1 21 GLN . 1 1 22 THR . 1 1 23 THR . 1 1 24 TRP . 1 1 25 GLY . 1 1 26 CYS . 1 1 27 CYS . 1 1 28 PRO . 1 1 29 SER . 1 1 30 PRO . 1 1 31 LYS . 1 1 32 ALA . 1 1 33 VAL . 1 1 34 CYS . 1 1 35 CYS . 1 1 36 ASP . 1 1 37 ASP . 1 1 38 MET . 1 1 39 GLN . 1 1 40 HIS . 1 1 41 CYS . 1 1 42 CYS . 1 1 43 PRO . 1 1 44 ALA . 1 1 45 GLY . 1 1 46 TYR . 1 1 47 LYS . 1 1 48 CYS . 1 1 49 GLY . 1 1 50 PRO . 1 1 51 GLY . 1 1 52 GLY . 1 1 53 THR . 1 1 54 CYS . 1 1 55 ILE . 1 1 56 SER . 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 ASP 1 1 1 1 VAL 2 2 1 1 GLN 3 3 1 1 CYS 4 4 1 1 GLY 5 5 1 1 GLY 6 6 1 1 GLY 7 7 1 1 PHE 8 8 1 1 SER 9 9 1 1 CYS 10 10 1 1 HIS 11 11 1 1 ASP 12 12 1 1 GLY 13 13 1 1 GLU 14 14 1 1 THR 15 15 1 1 CYS 16 16 1 1 CYS 17 17 1 1 PRO 18 18 1 1 THR 19 19 1 1 SER 20 20 1 1 GLN 21 21 1 1 THR 22 22 1 1 THR 23 23 1 1 TRP 24 24 1 1 GLY 25 25 1 1 CYS 26 26 1 1 CYS 27 27 1 1 PRO 28 28 1 1 SER 29 29 1 1 PRO 30 30 1 1 LYS 31 31 1 1 ALA 32 32 1 1 VAL 33 33 1 1 CYS 34 34 1 1 CYS 35 35 1 1 ASP 36 36 1 1 ASP 37 37 1 1 MET 38 38 1 1 GLN 39 39 1 1 HIS 40 40 1 1 CYS 41 41 1 1 CYS 42 42 1 1 PRO 43 43 1 1 ALA 44 44 1 1 GLY 45 45 1 1 TYR 46 46 1 1 LYS 47 47 1 1 CYS 48 48 1 1 GLY 49 49 1 1 PRO 50 50 1 1 GLY 51 51 1 1 GLY 52 52 1 1 THR 53 53 1 1 CYS 54 54 1 1 ILE 55 55 1 1 SER 56 56 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 2 . OR 1 1 114 2 . 3 . 1 1 114 3 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 2 . OR 1 1 119 2 . 3 . 1 1 119 3 . . . 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 2 . OR 1 1 186 2 . 3 . 1 1 186 3 . . . 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 2 . OR 1 1 201 2 . 3 . 1 1 201 3 . . . 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 2 . OR 1 1 213 2 . 3 . 1 1 213 3 . . . 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 2 . OR 1 1 275 2 . 3 . 1 1 275 3 . . . 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 2 . OR 1 1 336 2 . 3 . 1 1 336 3 . . . 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 2 . OR 1 1 367 2 . 3 . 1 1 367 3 . . . 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 2 . OR 1 1 378 2 . 3 . 1 1 378 3 . 4 . 1 1 378 4 . . . 1 1 379 1 . . . 1 1 380 1 . . . 1 1 381 1 . . . 1 1 382 1 . . . 1 1 383 1 2 . OR 1 1 383 2 . 3 . 1 1 383 3 . . . 1 1 384 1 2 . OR 1 1 384 2 . 3 . 1 1 384 3 . . . 1 1 385 1 . . . 1 1 386 1 . . . 1 1 387 1 2 . OR 1 1 387 2 . 3 . 1 1 387 3 . . . 1 1 388 1 . . . 1 1 389 1 . . . 1 1 390 1 2 . OR 1 1 390 2 . 3 . 1 1 390 3 . 4 . 1 1 390 4 . . . 1 1 391 1 . . . 1 1 392 1 . . . 1 1 393 1 2 . OR 1 1 393 2 . 3 . 1 1 393 3 . . . 1 1 394 1 2 . OR 1 1 394 2 . 3 . 1 1 394 3 . 4 . 1 1 394 4 . . . 1 1 395 1 . . . 1 1 396 1 2 . OR 1 1 396 2 . 3 . 1 1 396 3 . . . 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 2 . OR 1 1 449 2 . 3 . 1 1 449 3 . . . 1 1 450 1 . . . 1 1 451 1 . . . 1 1 452 1 . . . 1 1 453 1 . . . 1 1 454 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 26 CYS QB . 26 . HB2 1 1 1 1 2 1 1 27 CYS H . 27 . HN 1 1 2 1 1 1 1 26 CYS HA . 26 . HA 1 1 2 1 2 1 1 27 CYS H . 27 . HN 1 1 3 1 1 1 1 25 GLY QA . 25 . HA2 1 1 3 1 2 1 1 26 CYS H . 26 . HN 1 1 4 1 1 1 1 15 THR HB . 15 . HB 1 1 4 1 2 1 1 27 CYS H . 27 . HN 1 1 5 1 1 1 1 15 THR MG . 15 . HG21 1 1 5 1 2 1 1 27 CYS H . 27 . HN 1 1 6 1 1 1 1 15 THR HA . 15 . HA 1 1 6 1 2 1 1 16 CYS H . 16 . HN 1 1 7 1 1 1 1 15 THR HB . 15 . HB 1 1 7 1 2 1 1 16 CYS H . 16 . HN 1 1 8 1 1 1 1 15 THR MG . 15 . HG21 1 1 8 1 2 1 1 16 CYS H . 16 . HN 1 1 9 1 1 1 1 16 CYS HA . 16 . HA 1 1 9 1 2 1 1 17 CYS H . 17 . HN 1 1 10 1 1 1 1 16 CYS QB . 16 . HB1 1 1 10 1 2 1 1 17 CYS H . 17 . HN 1 1 11 1 1 1 1 24 TRP QB . 24 . HB2 1 1 11 1 2 1 1 25 GLY H . 25 . HN 1 1 12 1 1 1 1 14 GLU HA . 14 . HA 1 1 12 1 2 1 1 15 THR H . 15 . HN 1 1 13 1 1 1 1 14 GLU QG . 14 . HG2 1 1 13 1 2 1 1 15 THR H . 15 . HN 1 1 14 1 1 1 1 14 GLU QB . 14 . HB2 1 1 14 1 2 1 1 15 THR H . 15 . HN 1 1 15 1 1 1 1 12 ASP HB3 . 12 . HB1 1 1 15 1 2 1 1 13 GLY H . 13 . HN 1 1 16 1 1 1 1 12 ASP HB2 . 12 . HB2 1 1 16 1 2 1 1 13 GLY H . 13 . HN 1 1 17 1 1 1 1 13 GLY HA3 . 13 . HA1 1 1 17 1 2 1 1 14 GLU H . 14 . HN 1 1 18 1 1 1 1 13 GLY HA2 . 13 . HA2 1 1 18 1 2 1 1 14 GLU H . 14 . HN 1 1 19 1 1 1 1 12 ASP HA . 12 . HA 1 1 19 1 2 1 1 14 GLU H . 14 . HN 1 1 20 1 1 1 1 4 CYS H . 4 . HN 1 1 20 1 2 1 1 5 GLY QA . 5 . HA1 1 1 20 1 2 1 1 9 SER QB . 9 . HB1 1 1 20 1 2 1 1 56 SER HB2 . 56 . HB2 1 1 21 1 1 1 1 12 ASP HA . 12 . HA 1 1 21 1 2 1 1 13 GLY H . 13 . HN 1 1 22 1 1 1 1 55 ILE HB . 55 . HB 1 1 22 1 2 1 1 56 SER H . 56 . HN 1 1 23 1 1 1 1 55 ILE MD . 55 . HD11 1 1 23 1 2 1 1 56 SER H . 56 . HN 1 1 24 1 1 1 1 55 ILE MG . 55 . HG21 1 1 24 1 2 1 1 56 SER H . 56 . HN 1 1 25 1 1 1 1 54 CYS QB . 54 . HB2 1 1 25 1 2 1 1 55 ILE H . 55 . HN 1 1 26 1 1 1 1 54 CYS HA . 54 . HA 1 1 26 1 2 1 1 55 ILE H . 55 . HN 1 1 27 1 1 1 1 53 THR HB . 53 . HB 1 1 27 1 2 1 1 54 CYS H . 54 . HN 1 1 28 1 1 1 1 53 THR HA . 53 . HA 1 1 28 1 2 1 1 54 CYS H . 54 . HN 1 1 29 1 1 1 1 53 THR MG . 53 . HG21 1 1 29 1 2 1 1 54 CYS H . 54 . HN 1 1 30 1 1 1 1 52 GLY HA2 . 52 . HA2 1 1 30 1 2 1 1 53 THR H . 53 . HN 1 1 31 1 1 1 1 52 GLY HA3 . 52 . HA1 1 1 31 1 2 1 1 53 THR H . 53 . HN 1 1 32 1 1 1 1 51 GLY QA . 51 . HA2 1 1 32 1 2 1 1 52 GLY H . 52 . HN 1 1 33 1 1 1 1 47 LYS HA . 47 . HA 1 1 33 1 2 1 1 48 CYS H . 48 . HN 1 1 34 1 1 1 1 47 LYS H . 47 . HN 1 1 34 1 2 1 1 55 ILE HB . 55 . HB 1 1 35 1 1 1 1 48 CYS HA . 48 . HA 1 1 35 1 2 1 1 49 GLY H . 49 . HN 1 1 36 1 1 1 1 32 ALA HA . 32 . HA 1 1 36 1 2 1 1 33 VAL H . 33 . HN 1 1 37 1 1 1 1 47 LYS HB2 . 47 . HB2 1 1 37 1 2 1 1 48 CYS H . 48 . HN 1 1 38 1 1 1 1 47 LYS QD . 47 . HD2 1 1 38 1 2 1 1 48 CYS H . 48 . HN 1 1 39 1 1 1 1 49 GLY H . 49 . HN 1 1 39 1 2 1 1 54 CYS HA . 54 . HA 1 1 40 1 1 1 1 49 GLY H . 49 . HN 1 1 40 1 2 1 1 53 THR H . 53 . HN 1 1 41 1 1 1 1 48 CYS HA . 48 . HA 1 1 41 1 2 1 1 55 ILE H . 55 . HN 1 1 42 1 1 1 1 33 VAL MG1 . 33 . HG11 1 1 42 1 2 1 1 34 CYS H . 34 . HN 1 1 43 1 1 1 1 33 VAL MG2 . 33 . HG21 1 1 43 1 2 1 1 45 GLY H . 45 . HN 1 1 44 1 1 1 1 33 VAL MG2 . 33 . HG21 1 1 44 1 2 1 1 34 CYS H . 34 . HN 1 1 45 1 1 1 1 32 ALA MB . 32 . HB1 1 1 45 1 2 1 1 33 VAL H . 33 . HN 1 1 46 1 1 1 1 33 VAL HA . 33 . HA 1 1 46 1 2 1 1 34 CYS H . 34 . HN 1 1 47 1 1 1 1 41 CYS HA . 41 . HA 1 1 47 1 2 1 1 42 CYS H . 42 . HN 1 1 48 1 1 1 1 41 CYS HB2 . 41 . HB2 1 1 48 1 2 1 1 42 CYS H . 42 . HN 1 1 49 1 1 1 1 41 CYS HB3 . 41 . HB1 1 1 49 1 2 1 1 42 CYS H . 42 . HN 1 1 50 1 1 1 1 1 ASP HA . 1 . HA 1 1 50 1 2 1 1 2 VAL H . 2 . HN 1 1 51 1 1 1 1 1 ASP QB . 1 . HB2 1 1 51 1 2 1 1 2 VAL H . 2 . HN 1 1 52 1 1 1 1 2 VAL HA . 2 . HA 1 1 52 1 2 1 1 3 GLN H . 3 . HN 1 1 53 1 1 1 1 36 ASP HA . 36 . HA 1 1 53 1 2 1 1 37 ASP H . 37 . HN 1 1 54 1 1 1 1 2 VAL HB . 2 . HB 1 1 54 1 2 1 1 3 GLN H . 3 . HN 1 1 55 1 1 1 1 11 HIS HB2 . 11 . HB2 1 1 55 1 2 1 1 12 ASP H . 12 . HN 1 1 56 1 1 1 1 11 HIS HB3 . 11 . HB1 1 1 56 1 2 1 1 12 ASP H . 12 . HN 1 1 57 1 1 1 1 11 HIS HA . 11 . HA 1 1 57 1 2 1 1 12 ASP H . 12 . HN 1 1 58 1 1 1 1 2 VAL H . 2 . HN 1 1 58 1 2 1 1 11 HIS HA . 11 . HA 1 1 59 1 1 1 1 2 VAL HB . 2 . HB 1 1 59 1 2 1 1 10 CYS H . 10 . HN 1 1 60 1 1 1 1 10 CYS QB . 10 . HB1 1 1 60 1 2 1 1 11 HIS H . 11 . HN 1 1 61 1 1 1 1 9 SER HA . 9 . HA 1 1 61 1 2 1 1 10 CYS H . 10 . HN 1 1 62 1 1 1 1 15 THR H . 15 . HN 1 1 62 1 2 1 1 27 CYS QB . 27 . HB2 1 1 63 1 1 1 1 3 GLN HA . 3 . HA 1 1 63 1 2 1 1 4 CYS H . 4 . HN 1 1 64 1 1 1 1 8 PHE HA . 8 . HA 1 1 64 1 2 1 1 9 SER H . 9 . HN 1 1 65 1 1 1 1 8 PHE QB . 8 . HB1 1 1 65 1 2 1 1 9 SER H . 9 . HN 1 1 66 1 1 1 1 7 GLY QA . 7 . HA1 1 1 66 1 2 1 1 8 PHE H . 8 . HN 1 1 67 1 1 1 1 46 TYR HB3 . 46 . HB1 1 1 67 1 2 1 1 47 LYS H . 47 . HN 1 1 68 1 1 1 1 46 TYR HA . 46 . HA 1 1 68 1 2 1 1 47 LYS H . 47 . HN 1 1 69 1 1 1 1 45 GLY HA2 . 45 . HA2 1 1 69 1 2 1 1 46 TYR H . 46 . HN 1 1 70 1 1 1 1 45 GLY HA3 . 45 . HA1 1 1 70 1 2 1 1 46 TYR H . 46 . HN 1 1 71 1 1 1 1 44 ALA HA . 44 . HA 1 1 71 1 2 1 1 45 GLY H . 45 . HN 1 1 72 1 1 1 1 44 ALA MB . 44 . HB1 1 1 72 1 2 1 1 45 GLY H . 45 . HN 1 1 73 1 1 1 1 3 GLN HB3 . 3 . HB2 1 1 73 1 1 1 1 18 PRO QG . 18 . HG% 1 1 73 1 1 1 1 38 MET QB . 38 . HB1 1 1 73 1 1 1 1 55 ILE HB . 55 . HB 1 1 73 1 2 1 1 5 GLY H . 5 . HN 1 1 74 1 1 1 1 4 CYS QB . 4 . HB1 1 1 74 1 2 1 1 5 GLY H . 5 . HN 1 1 75 1 1 1 1 4 CYS HA . 4 . HA 1 1 75 1 2 1 1 5 GLY H . 5 . HN 1 1 76 1 1 1 1 6 GLY QA . 6 . HA1 1 1 76 1 2 1 1 7 GLY H . 7 . HN 1 1 77 1 1 1 1 5 GLY QA . 5 . HA1 1 1 77 1 2 1 1 6 GLY H . 6 . HN 1 1 78 1 1 1 1 39 GLN QB . 39 . HB1 1 1 78 1 2 1 1 40 HIS H . 40 . HN 1 1 79 1 1 1 1 39 GLN HG3 . 39 . HG1 1 1 79 1 2 1 1 40 HIS H . 40 . HN 1 1 80 1 1 1 1 39 GLN HG2 . 39 . HG2 1 1 80 1 2 1 1 40 HIS H . 40 . HN 1 1 81 1 1 1 1 40 HIS HA . 40 . HA 1 1 81 1 2 1 1 41 CYS H . 41 . HN 1 1 82 1 1 1 1 33 VAL HB . 33 . HB 1 1 82 1 2 1 1 42 CYS H . 42 . HN 1 1 83 1 1 1 1 32 ALA MB . 32 . HB1 1 1 83 1 2 1 1 42 CYS H . 42 . HN 1 1 84 1 1 1 1 33 VAL MG2 . 33 . HG21 1 1 84 1 2 1 1 42 CYS H . 42 . HN 1 1 85 1 1 1 1 33 VAL MG1 . 33 . HG11 1 1 85 1 2 1 1 42 CYS H . 42 . HN 1 1 86 1 1 1 1 18 PRO HA . 18 . HA 1 1 86 1 1 1 1 23 THR HB . 23 . HB 1 1 86 1 1 1 1 41 CYS HB2 . 41 . HB2 1 1 86 1 2 1 1 19 THR H . 19 . HN 1 1 87 1 1 1 1 20 SER HA . 20 . HA 1 1 87 1 2 1 1 22 THR H . 22 . HN 1 1 88 1 1 1 1 20 SER HB2 . 20 . HB2 1 1 88 1 2 1 1 22 THR H . 22 . HN 1 1 89 1 1 1 1 20 SER HB3 . 20 . HB1 1 1 89 1 2 1 1 22 THR H . 22 . HN 1 1 90 1 1 1 1 18 PRO QB . 18 . HB1 1 1 90 1 2 1 1 19 THR H . 19 . HN 1 1 91 1 1 1 1 48 CYS HB3 . 48 . HB1 1 1 91 1 2 1 1 49 GLY H . 49 . HN 1 1 92 1 1 1 1 35 CYS H . 35 . HN 1 1 92 1 2 1 1 41 CYS HA . 41 . HA 1 1 93 1 1 1 1 35 CYS HA . 35 . HA 1 1 93 1 2 1 1 36 ASP H . 36 . HN 1 1 94 1 1 1 1 35 CYS QB . 35 . HB2 1 1 94 1 2 1 1 36 ASP H . 36 . HN 1 1 95 1 1 1 1 19 THR HB . 19 . HB 1 1 95 1 1 1 1 37 ASP HA . 37 . HA 1 1 95 1 1 1 1 39 GLN HA . 39 . HA 1 1 95 1 2 1 1 38 MET H . 38 . HN 1 1 96 1 1 1 1 37 ASP QB . 37 . HB1 1 1 96 1 2 1 1 38 MET H . 38 . HN 1 1 97 1 1 1 1 35 CYS QB . 35 . HB1 1 1 97 1 2 1 1 38 MET H . 38 . HN 1 1 98 1 1 1 1 35 CYS QB . 35 . HB1 1 1 98 1 2 1 1 37 ASP H . 37 . HN 1 1 99 1 1 1 1 38 MET HA . 38 . HA 1 1 99 1 2 1 1 39 GLN H . 39 . HN 1 1 100 1 1 1 1 24 TRP HA . 24 . HA 1 1 100 1 2 1 1 25 GLY H . 25 . HN 1 1 101 1 1 1 1 23 THR HA . 23 . HA 1 1 101 1 2 1 1 24 TRP H . 24 . HN 1 1 102 1 1 1 1 23 THR HB . 23 . HB 1 1 102 1 2 1 1 24 TRP H . 24 . HN 1 1 103 1 1 1 1 23 THR MG . 23 . HG21 1 1 103 1 2 1 1 24 TRP H . 24 . HN 1 1 104 1 1 1 1 18 PRO HA . 18 . HA 1 1 104 1 2 1 1 25 GLY H . 25 . HN 1 1 105 1 1 1 1 15 THR H . 15 . HN 1 1 105 1 2 1 1 27 CYS H . 27 . HN 1 1 106 1 1 1 1 2 VAL MG1 . 2 . HG11 1 1 106 1 2 1 1 3 GLN H . 3 . HN 1 1 107 1 1 1 1 22 THR HB . 22 . HB 1 1 107 1 2 1 1 23 THR H . 23 . HN 1 1 108 1 1 1 1 22 THR HA . 22 . HA 1 1 108 1 2 1 1 23 THR H . 23 . HN 1 1 109 1 1 1 1 19 THR H . 19 . HN 1 1 109 1 2 1 1 24 TRP HA . 24 . HA 1 1 110 1 1 1 1 34 CYS HA . 34 . HA 1 1 110 1 2 1 1 35 CYS H . 35 . HN 1 1 111 1 1 1 1 43 PRO QB . 43 . HB2 1 1 111 1 2 1 1 44 ALA H . 44 . HN 1 1 112 1 1 1 1 50 PRO HA . 50 . HA 1 1 112 1 2 1 1 51 GLY H . 51 . HN 1 1 113 1 1 1 1 8 PHE QD . 8 . HD2 1 1 113 1 2 1 1 24 TRP HD1 . 24 . HD1 1 1 114 2 1 1 1 6 GLY QA . 6 . HA1 1 1 114 2 1 1 1 23 THR HB . 23 . HB 1 1 114 2 1 1 1 31 LYS HA . 31 . HA 1 1 114 2 2 1 1 8 PHE QD . 8 . HD% 1 1 114 3 1 1 1 21 GLN HE22 . 21 . HE22 1 1 114 3 1 1 1 37 ASP H . 37 . HN 1 1 114 3 2 1 1 23 THR HB . 23 . HB 1 1 115 1 1 1 1 8 PHE HZ . 8 . HZ 1 1 115 1 2 1 1 23 THR HA . 23 . HA 1 1 116 1 1 1 1 2 VAL H . 2 . HN 1 1 116 1 2 1 1 10 CYS QB . 10 . HB2 1 1 117 1 1 1 1 2 VAL H . 2 . HN 1 1 117 1 2 1 1 9 SER QB . 9 . HB1 1 1 118 1 1 1 1 2 VAL H . 2 . HN 1 1 118 1 2 1 1 10 CYS H . 10 . HN 1 1 119 2 1 1 1 28 PRO HD2 . 28 . HD2 1 1 119 2 1 1 1 31 LYS HA . 31 . HA 1 1 119 2 2 1 1 29 SER H . 29 . HN 1 1 119 2 2 1 1 32 ALA H . 32 . HN 1 1 119 3 1 1 1 32 ALA H . 32 . HN 1 1 119 3 2 1 1 41 CYS HB2 . 41 . HB2 1 1 120 1 1 1 1 30 PRO HB2 . 30 . HB2 1 1 120 1 2 1 1 31 LYS H . 31 . HN 1 1 121 1 1 1 1 4 CYS H . 4 . HN 1 1 121 1 2 1 1 9 SER HA . 9 . HA 1 1 122 1 1 1 1 4 CYS H . 4 . HN 1 1 122 1 2 1 1 5 GLY H . 5 . HN 1 1 123 1 1 1 1 7 GLY H . 7 . HN 1 1 123 1 2 1 1 8 PHE H . 8 . HN 1 1 124 1 1 1 1 5 GLY H . 5 . HN 1 1 124 1 2 1 1 8 PHE H . 8 . HN 1 1 125 1 1 1 1 13 GLY H . 13 . HN 1 1 125 1 2 1 1 14 GLU H . 14 . HN 1 1 126 1 1 1 1 2 VAL MG2 . 2 . HG21 1 1 126 1 2 1 1 14 GLU H . 14 . HN 1 1 127 1 1 1 1 16 CYS HA . 16 . HA 1 1 127 1 2 1 1 27 CYS H . 27 . HN 1 1 128 1 1 1 1 17 CYS H . 17 . HN 1 1 128 1 2 1 1 26 CYS HA . 26 . HA 1 1 129 1 1 1 1 20 SER H . 20 . HN 1 1 129 1 2 1 1 23 THR H . 23 . HN 1 1 130 1 1 1 1 22 THR H . 22 . HN 1 1 130 1 2 1 1 23 THR H . 23 . HN 1 1 131 1 1 1 1 20 SER H . 20 . HN 1 1 131 1 2 1 1 22 THR H . 22 . HN 1 1 132 1 1 1 1 31 LYS H . 31 . HN 1 1 132 1 2 1 1 32 ALA H . 32 . HN 1 1 133 1 1 1 1 33 VAL H . 33 . HN 1 1 133 1 2 1 1 43 PRO HA . 43 . HA 1 1 134 1 1 1 1 33 VAL H . 33 . HN 1 1 134 1 2 1 1 42 CYS H . 42 . HN 1 1 135 1 1 1 1 33 VAL H . 33 . HN 1 1 135 1 2 1 1 42 CYS QB . 42 . HB1 1 1 136 1 1 1 1 35 CYS QB . 35 . HB1 1 1 136 1 2 1 1 40 HIS H . 40 . HN 1 1 137 1 1 1 1 36 ASP H . 36 . HN 1 1 137 1 2 1 1 37 ASP H . 37 . HN 1 1 138 1 1 1 1 37 ASP H . 37 . HN 1 1 138 1 2 1 1 38 MET H . 38 . HN 1 1 139 1 1 1 1 38 MET H . 38 . HN 1 1 139 1 2 1 1 39 GLN H . 39 . HN 1 1 140 1 1 1 1 44 ALA HA . 44 . HA 1 1 140 1 2 1 1 46 TYR H . 46 . HN 1 1 141 1 1 1 1 45 GLY H . 45 . HN 1 1 141 1 2 1 1 46 TYR H . 46 . HN 1 1 142 1 1 1 1 47 LYS H . 47 . HN 1 1 142 1 2 1 1 55 ILE H . 55 . HN 1 1 143 1 1 1 1 52 GLY H . 52 . HN 1 1 143 1 2 1 1 53 THR H . 53 . HN 1 1 144 1 1 1 1 46 TYR QD . 46 . HD1 1 1 144 1 2 1 1 47 LYS H . 47 . HN 1 1 145 1 1 1 1 24 TRP HE3 . 24 . HE3 1 1 145 1 2 1 1 25 GLY H . 25 . HN 1 1 146 1 1 1 1 19 THR H . 19 . HN 1 1 146 1 2 1 1 25 GLY H . 25 . HN 1 1 147 1 1 1 1 46 TYR H . 46 . HN 1 1 147 1 1 1 1 56 SER H . 56 . HN 1 1 147 1 2 1 1 47 LYS H . 47 . HN 1 1 148 1 1 1 1 5 GLY QA . 5 . HA2 1 1 148 1 2 1 1 24 TRP HE1 . 24 . HE1 1 1 149 1 1 1 1 18 PRO HA . 18 . HA 1 1 149 1 2 1 1 24 TRP HE1 . 24 . HE1 1 1 150 1 1 1 1 46 TYR HB2 . 46 . HB2 1 1 150 1 2 1 1 55 ILE H . 55 . HN 1 1 151 1 1 1 1 19 THR MG . 19 . HG21 1 1 151 1 2 1 1 25 GLY H . 25 . HN 1 1 152 1 1 1 1 11 HIS H . 11 . HN 1 1 152 1 2 1 1 14 GLU QG . 14 . HG2 1 1 153 1 1 1 1 33 VAL MG1 . 33 . HG11 1 1 153 1 2 1 1 48 CYS H . 48 . HN 1 1 154 1 1 1 1 2 VAL MG2 . 2 . HG21 1 1 154 1 2 1 1 13 GLY H . 13 . HN 1 1 155 1 1 1 1 4 CYS H . 4 . HN 1 1 155 1 2 1 1 8 PHE QB . 8 . HB2 1 1 156 1 1 1 1 3 GLN HG2 . 3 . HG2 1 1 156 1 2 1 1 4 CYS H . 4 . HN 1 1 157 1 1 1 1 33 VAL MG2 . 33 . HG21 1 1 157 1 2 1 1 46 TYR H . 46 . HN 1 1 158 1 1 1 1 44 ALA MB . 44 . HB1 1 1 158 1 2 1 1 46 TYR H . 46 . HN 1 1 159 1 1 1 1 33 VAL HB . 33 . HB 1 1 159 1 2 1 1 46 TYR H . 46 . HN 1 1 160 1 1 1 1 32 ALA MB . 32 . HB1 1 1 160 1 2 1 1 44 ALA H . 44 . HN 1 1 161 1 1 1 1 21 GLN QG . 21 . HG2 1 1 161 1 2 1 1 22 THR H . 22 . HN 1 1 162 1 1 1 1 21 GLN HB3 . 21 . HB1 1 1 162 1 2 1 1 22 THR H . 22 . HN 1 1 163 1 1 1 1 2 VAL MG2 . 2 . HG21 1 1 163 1 2 1 1 10 CYS H . 10 . HN 1 1 164 1 1 1 1 18 PRO QB . 18 . HB1 1 1 164 1 2 1 1 24 TRP HE1 . 24 . HE1 1 1 165 1 1 1 1 46 TYR QD . 46 . HD1 1 1 165 1 2 1 1 55 ILE H . 55 . HN 1 1 166 1 1 1 1 35 CYS H . 35 . HN 1 1 166 1 2 1 1 42 CYS H . 42 . HN 1 1 167 1 1 1 1 47 LYS H . 47 . HN 1 1 167 1 2 1 1 54 CYS HA . 54 . HA 1 1 168 1 1 1 1 2 VAL MG1 . 2 . HG11 1 1 168 1 2 1 1 16 CYS H . 16 . HN 1 1 169 1 1 1 1 39 GLN H . 39 . HN 1 1 169 1 2 1 1 40 HIS HB2 . 40 . HB2 1 1 170 1 1 1 1 35 CYS QB . 35 . HB1 1 1 170 1 2 1 1 39 GLN H . 39 . HN 1 1 171 1 1 1 1 39 GLN H . 39 . HN 1 1 171 1 2 1 1 40 HIS HB3 . 40 . HB1 1 1 172 1 1 1 1 8 PHE QD . 8 . HD2 1 1 172 1 2 1 1 9 SER H . 9 . HN 1 1 173 1 1 1 1 51 GLY H . 51 . HN 1 1 173 1 2 1 1 52 GLY H . 52 . HN 1 1 174 1 1 1 1 4 CYS QB . 4 . HB2 1 1 174 1 2 1 1 8 PHE H . 8 . HN 1 1 175 1 1 1 1 8 PHE H . 8 . HN 1 1 175 1 2 1 1 24 TRP QB . 24 . HB1 1 1 176 1 1 1 1 3 GLN HA . 3 . HA 1 1 176 1 2 1 1 10 CYS H . 10 . HN 1 1 177 1 1 1 1 1 ASP QB . 1 . HB2 1 1 177 1 2 1 1 10 CYS H . 10 . HN 1 1 178 1 1 1 1 11 HIS H . 11 . HN 1 1 178 1 2 1 1 14 GLU QB . 14 . HB1 1 1 179 1 1 1 1 15 THR H . 15 . HN 1 1 179 1 2 1 1 26 CYS HA . 26 . HA 1 1 180 1 1 1 1 47 LYS H . 47 . HN 1 1 180 1 2 1 1 56 SER HA . 56 . HA 1 1 181 1 1 1 1 14 GLU QB . 14 . HB1 1 1 181 1 1 1 1 43 PRO QB . 43 . HB1 1 1 181 1 2 1 1 27 CYS H . 27 . HN 1 1 182 1 1 1 1 27 CYS QB . 27 . HB2 1 1 182 1 2 1 1 29 SER H . 29 . HN 1 1 182 1 2 1 1 32 ALA H . 32 . HN 1 1 183 1 1 1 1 39 GLN H . 39 . HN 1 1 183 1 2 1 1 40 HIS HA . 40 . HA 1 1 184 1 1 1 1 42 CYS QB . 42 . HB1 1 1 184 1 2 1 1 46 TYR H . 46 . HN 1 1 185 1 1 1 1 51 GLY QA . 51 . HA1 1 1 185 1 2 1 1 53 THR H . 53 . HN 1 1 186 2 1 1 1 1 ASP H1 . 1 . HT1 1 1 186 2 1 1 1 56 SER H . 56 . HN 1 1 186 2 2 1 1 55 ILE QG . 55 . HG12 1 1 186 3 1 1 1 31 LYS QG . 31 . HG% 1 1 186 3 1 1 1 44 ALA MB . 44 . HB1 1 1 186 3 1 1 1 47 LYS QG . 47 . HG% 1 1 186 3 2 1 1 56 SER H . 56 . HN 1 1 187 1 1 1 1 8 PHE QD . 8 . HD% 1 1 187 1 1 1 1 21 GLN HE22 . 21 . HE22 1 1 187 1 1 1 1 37 ASP H . 37 . HN 1 1 187 1 2 1 1 24 TRP H . 24 . HN 1 1 188 1 1 1 1 20 SER H . 20 . HN 1 1 188 1 1 1 1 35 CYS H . 35 . HN 1 1 188 1 2 1 1 38 MET QB . 38 . HB2 1 1 188 1 2 1 1 42 CYS QB . 42 . HB1 1 1 189 1 1 1 1 37 ASP QB . 37 . HB1 1 1 189 1 1 1 1 46 TYR HB3 . 46 . HB1 1 1 189 1 2 1 1 55 ILE H . 55 . HN 1 1 190 1 1 1 1 49 GLY H . 49 . HN 1 1 190 1 2 1 1 55 ILE H . 55 . HN 1 1 191 1 1 1 1 48 CYS HA . 48 . HA 1 1 191 1 2 1 1 53 THR H . 53 . HN 1 1 192 1 1 1 1 4 CYS H . 4 . HN 1 1 192 1 2 1 1 8 PHE H . 8 . HN 1 1 193 1 1 1 1 18 PRO QB . 18 . HB2 1 1 193 1 1 1 1 39 GLN QB . 39 . HB2 1 1 193 1 2 1 1 20 SER H . 20 . HN 1 1 193 1 2 1 1 35 CYS H . 35 . HN 1 1 194 1 1 1 1 20 SER H . 20 . HN 1 1 194 1 2 1 1 24 TRP HA . 24 . HA 1 1 195 1 1 1 1 13 GLY HA2 . 13 . HA2 1 1 195 1 1 1 1 20 SER HB2 . 20 . HB2 1 1 195 1 2 1 1 23 THR H . 23 . HN 1 1 196 1 1 1 1 35 CYS HA . 35 . HA 1 1 196 1 2 1 1 37 ASP H . 37 . HN 1 1 197 1 1 1 1 38 MET H . 38 . HN 1 1 197 1 2 1 1 40 HIS H . 40 . HN 1 1 198 1 1 1 1 15 THR HA . 15 . HA 1 1 198 1 2 1 1 53 THR H . 53 . HN 1 1 199 1 1 1 1 15 THR HA . 15 . HA 1 1 199 1 1 1 1 50 PRO HA . 50 . HA 1 1 199 1 2 1 1 32 ALA H . 32 . HN 1 1 199 1 2 1 1 52 GLY H . 52 . HN 1 1 200 1 1 1 1 8 PHE QB . 8 . HB% 1 1 200 1 1 1 1 31 LYS QE . 31 . HE% 1 1 200 1 1 1 1 37 ASP QB . 37 . HB2 1 1 200 1 1 1 1 40 HIS HB3 . 40 . HB1 1 1 200 1 1 1 1 41 CYS HB3 . 41 . HB1 1 1 200 1 2 1 1 38 MET H . 38 . HN 1 1 201 2 1 1 1 11 HIS H . 11 . HN 1 1 201 2 1 1 1 21 GLN H . 21 . HN 1 1 201 2 1 1 1 34 CYS H . 34 . HN 1 1 201 2 1 1 1 41 CYS H . 41 . HN 1 1 201 2 2 1 1 40 HIS HD2 . 40 . HD2 1 1 201 3 1 1 1 21 GLN H . 21 . HN 1 1 201 3 2 1 1 24 TRP HZ2 . 24 . HZ2 1 1 202 1 1 1 1 45 GLY H . 45 . HN 1 1 202 1 1 1 1 48 CYS H . 48 . HN 1 1 202 1 2 1 1 46 TYR QD . 46 . HD1 1 1 203 1 1 1 1 17 CYS H . 17 . HN 1 1 203 1 1 1 1 25 GLY H . 25 . HN 1 1 203 1 2 1 1 27 CYS H . 27 . HN 1 1 204 1 1 1 1 17 CYS QB . 17 . HB1 1 1 204 1 1 1 1 21 GLN QG . 21 . HG% 1 1 204 1 1 1 1 28 PRO QB . 28 . HB2 1 1 204 1 2 1 1 27 CYS H . 27 . HN 1 1 205 1 1 1 1 34 CYS HA . 34 . HA 1 1 205 1 2 1 1 42 CYS H . 42 . HN 1 1 206 1 1 1 1 31 LYS HB3 . 31 . HB1 1 1 206 1 1 1 1 33 VAL HB . 33 . HB 1 1 206 1 1 1 1 43 PRO QB . 43 . HB1 1 1 206 1 1 1 1 47 LYS QB . 47 . HB% 1 1 206 1 2 1 1 55 ILE H . 55 . HN 1 1 207 1 1 1 1 18 PRO QB . 18 . HB1 1 1 207 1 1 1 1 43 PRO QG . 43 . HG1 1 1 207 1 1 1 1 47 LYS QD . 47 . HD% 1 1 207 1 2 1 1 55 ILE H . 55 . HN 1 1 208 1 1 1 1 47 LYS H . 47 . HN 1 1 208 1 2 1 1 54 CYS QB . 54 . HB2 1 1 209 1 1 1 1 9 SER QB . 9 . HB2 1 1 209 1 1 1 1 25 GLY QA . 25 . HA1 1 1 209 1 1 1 1 50 PRO QD . 50 . HD2 1 1 209 1 2 1 1 14 GLU H . 14 . HN 1 1 210 1 1 1 1 11 HIS H . 11 . HN 1 1 210 1 1 1 1 21 GLN H . 21 . HN 1 1 210 1 2 1 1 14 GLU H . 14 . HN 1 1 211 1 1 1 1 10 CYS H . 10 . HN 1 1 211 1 1 1 1 11 HIS H . 11 . HN 1 1 211 1 1 1 1 21 GLN H . 21 . HN 1 1 211 1 1 1 1 33 VAL H . 33 . HN 1 1 211 1 2 1 1 14 GLU H . 14 . HN 1 1 212 1 1 1 1 11 HIS HB3 . 11 . HB1 1 1 212 1 1 1 1 26 CYS QB . 26 . HB2 1 1 212 1 1 1 1 42 CYS QB . 42 . HB2 1 1 212 1 1 1 1 43 PRO HD3 . 43 . HD1 1 1 212 1 2 1 1 14 GLU H . 14 . HN 1 1 213 2 1 1 1 23 THR MG . 23 . HG21 1 1 213 2 1 1 1 33 VAL MG2 . 33 . HG21 1 1 213 2 2 1 1 38 MET QB . 38 . HB2 1 1 213 3 1 1 1 33 VAL MG2 . 33 . HG21 1 1 213 3 2 1 1 42 CYS QB . 42 . HB1 1 1 214 1 1 1 1 17 CYS HA . 17 . HA 1 1 214 1 2 1 1 34 CYS QB . 34 . HB1 1 1 215 1 1 1 1 16 CYS HA . 16 . HA 1 1 215 1 2 1 1 26 CYS HA . 26 . HA 1 1 216 1 1 1 1 48 CYS HA . 48 . HA 1 1 216 1 2 1 1 54 CYS HA . 54 . HA 1 1 217 1 1 1 1 42 CYS QB . 42 . HB1 1 1 217 1 2 1 1 54 CYS HA . 54 . HA 1 1 218 1 1 1 1 42 CYS HA . 42 . HA 1 1 218 1 2 1 1 54 CYS QB . 54 . HB1 1 1 219 1 1 1 1 3 GLN HA . 3 . HA 1 1 219 1 2 1 1 9 SER HA . 9 . HA 1 1 220 1 1 1 1 32 ALA HA . 32 . HA 1 1 220 1 2 1 1 33 VAL MG2 . 33 . HG21 1 1 221 1 1 1 1 4 CYS HA . 4 . HA 1 1 221 1 2 1 1 16 CYS QB . 16 . HB2 1 1 221 1 2 1 1 24 TRP QB . 24 . HB2 1 1 222 1 1 1 1 4 CYS HA . 4 . HA 1 1 222 1 2 1 1 16 CYS QB . 16 . HB1 1 1 223 1 1 1 1 17 CYS HA . 17 . HA 1 1 223 1 2 1 1 18 PRO HD2 . 18 . HD2 1 1 224 1 1 1 1 17 CYS HA . 17 . HA 1 1 224 1 2 1 1 18 PRO HD3 . 18 . HD1 1 1 225 1 1 1 1 42 CYS HA . 42 . HA 1 1 225 1 2 1 1 43 PRO HD2 . 43 . HD2 1 1 226 1 1 1 1 27 CYS HA . 27 . HA 1 1 226 1 2 1 1 28 PRO HD2 . 28 . HD2 1 1 227 1 1 1 1 27 CYS HA . 27 . HA 1 1 227 1 2 1 1 28 PRO HD3 . 28 . HD1 1 1 228 1 1 1 1 10 CYS HA . 10 . HA 1 1 228 1 2 1 1 26 CYS QB . 26 . HB1 1 1 229 1 1 1 1 10 CYS QB . 10 . HB2 1 1 229 1 2 1 1 26 CYS HA . 26 . HA 1 1 230 1 1 1 1 33 VAL MG1 . 33 . HG11 1 1 230 1 2 1 1 42 CYS QB . 42 . HB2 1 1 231 1 1 1 1 33 VAL MG2 . 33 . HG21 1 1 231 1 2 1 1 42 CYS QB . 42 . HB2 1 1 232 1 1 1 1 34 CYS HA . 34 . HA 1 1 232 1 2 1 1 41 CYS HA . 41 . HA 1 1 233 1 1 1 1 34 CYS QB . 34 . HB1 1 1 233 1 2 1 1 41 CYS HA . 41 . HA 1 1 234 1 1 1 1 34 CYS QB . 34 . HB2 1 1 234 1 1 1 1 40 HIS HB2 . 40 . HB2 1 1 234 1 2 1 1 41 CYS HA . 41 . HA 1 1 235 1 1 1 1 18 PRO HA . 18 . HA 1 1 235 1 2 1 1 24 TRP HA . 24 . HA 1 1 236 1 1 1 1 46 TYR HA . 46 . HA 1 1 236 1 2 1 1 56 SER HA . 56 . HA 1 1 237 1 1 1 1 29 SER HA . 29 . HA 1 1 237 1 2 1 1 30 PRO HD2 . 30 . HD2 1 1 238 1 1 1 1 49 GLY HA2 . 49 . HA2 1 1 238 1 2 1 1 50 PRO QD . 50 . HD1 1 1 239 1 1 1 1 15 THR HB . 15 . HB 1 1 239 1 2 1 1 27 CYS QB . 27 . HB1 1 1 240 1 1 1 1 15 THR MG . 15 . HG21 1 1 240 1 2 1 1 27 CYS QB . 27 . HB2 1 1 241 1 1 1 1 32 ALA MB . 32 . HB1 1 1 241 1 2 1 1 41 CYS HB2 . 41 . HB2 1 1 242 1 1 1 1 32 ALA MB . 32 . HB1 1 1 242 1 2 1 1 41 CYS HB3 . 41 . HB1 1 1 243 1 1 1 1 27 CYS QB . 27 . HB2 1 1 243 1 2 1 1 32 ALA MB . 32 . HB1 1 1 244 1 1 1 1 15 THR HB . 15 . HB 1 1 244 1 2 1 1 32 ALA MB . 32 . HB1 1 1 245 1 1 1 1 32 ALA MB . 32 . HB1 1 1 245 1 2 1 1 43 PRO HA . 43 . HA 1 1 246 1 1 1 1 10 CYS QB . 10 . HB2 1 1 246 1 2 1 1 14 GLU QB . 14 . HB2 1 1 247 1 1 1 1 4 CYS QB . 4 . HB2 1 1 247 1 2 1 1 16 CYS HA . 16 . HA 1 1 248 1 1 1 1 4 CYS QB . 4 . HB1 1 1 248 1 2 1 1 16 CYS QB . 16 . HB1 1 1 249 1 1 1 1 4 CYS QB . 4 . HB1 1 1 249 1 1 1 1 14 GLU QB . 14 . HB1 1 1 249 1 2 1 1 16 CYS QB . 16 . HB2 1 1 249 1 2 1 1 24 TRP QB . 24 . HB2 1 1 250 1 1 1 1 3 GLN HB3 . 3 . HB2 1 1 250 1 1 1 1 4 CYS QB . 4 . HB2 1 1 250 1 1 1 1 38 MET QB . 38 . HB1 1 1 250 1 1 1 1 55 ILE HB . 55 . HB 1 1 250 1 2 1 1 24 TRP QB . 24 . HB2 1 1 251 1 1 1 1 10 CYS QB . 10 . HB2 1 1 251 1 2 1 1 26 CYS QB . 26 . HB1 1 1 252 1 1 1 1 17 CYS QB . 17 . HB1 1 1 252 1 2 1 1 34 CYS QB . 34 . HB2 1 1 253 1 1 1 1 27 CYS HA . 27 . HA 1 1 253 1 2 1 1 28 PRO QB . 28 . HB1 1 1 254 1 1 1 1 27 CYS HA . 27 . HA 1 1 254 1 2 1 1 28 PRO HG2 . 28 . HG2 1 1 255 1 1 1 1 27 CYS HA . 27 . HA 1 1 255 1 2 1 1 32 ALA MB . 32 . HB1 1 1 256 1 1 1 1 27 CYS QB . 27 . HB2 1 1 256 1 2 1 1 28 PRO HD3 . 28 . HD1 1 1 257 1 1 1 1 27 CYS QB . 27 . HB1 1 1 257 1 2 1 1 28 PRO HD2 . 28 . HD2 1 1 258 1 1 1 1 27 CYS QB . 27 . HB2 1 1 258 1 2 1 1 41 CYS HB2 . 41 . HB2 1 1 259 1 1 1 1 42 CYS QB . 42 . HB1 1 1 259 1 2 1 1 54 CYS QB . 54 . HB2 1 1 260 1 1 1 1 2 VAL MG2 . 2 . HG21 1 1 260 1 2 1 1 10 CYS QB . 10 . HB2 1 1 261 1 1 1 1 4 CYS QB . 4 . HB2 1 1 261 1 2 1 1 8 PHE QB . 8 . HB2 1 1 262 1 1 1 1 32 ALA HA . 32 . HA 1 1 262 1 2 1 1 43 PRO HA . 43 . HA 1 1 263 1 1 1 1 46 TYR QD . 46 . HD1 1 1 263 1 2 1 1 56 SER HB2 . 56 . HB2 1 1 264 1 1 1 1 46 TYR QE . 46 . HE1 1 1 264 1 2 1 1 56 SER HB2 . 56 . HB2 1 1 265 1 1 1 1 46 TYR QE . 46 . HE1 1 1 265 1 2 1 1 56 SER HB3 . 56 . HB1 1 1 266 1 1 1 1 46 TYR QD . 46 . HD1 1 1 266 1 2 1 1 56 SER HB3 . 56 . HB1 1 1 267 1 1 1 1 46 TYR QD . 46 . HD1 1 1 267 1 2 1 1 56 SER HA . 56 . HA 1 1 268 1 1 1 1 46 TYR QE . 46 . HE1 1 1 268 1 2 1 1 56 SER HA . 56 . HA 1 1 269 1 1 1 1 43 PRO QG . 43 . HG1 1 1 269 1 2 1 1 46 TYR QE . 46 . HE1 1 1 270 1 1 1 1 43 PRO QG . 43 . HG1 1 1 270 1 2 1 1 46 TYR QD . 46 . HD1 1 1 271 1 1 1 1 43 PRO QB . 43 . HB1 1 1 271 1 2 1 1 46 TYR QE . 46 . HE1 1 1 272 1 1 1 1 43 PRO QB . 43 . HB1 1 1 272 1 2 1 1 46 TYR QD . 46 . HD1 1 1 273 1 1 1 1 46 TYR QE . 46 . HE1 1 1 273 1 2 1 1 54 CYS QB . 54 . HB2 1 1 274 1 1 1 1 46 TYR QD . 46 . HD1 1 1 274 1 2 1 1 54 CYS QB . 54 . HB2 1 1 275 2 1 1 1 24 TRP HZ3 . 24 . HZ3 1 1 275 2 1 1 1 46 TYR QD . 46 . HD1 1 1 275 2 2 1 1 55 ILE QG . 55 . HG12 1 1 275 3 1 1 1 44 ALA MB . 44 . HB1 1 1 275 3 1 1 1 47 LYS QG . 47 . HG2 1 1 275 3 2 1 1 46 TYR QD . 46 . HD1 1 1 276 1 1 1 1 18 PRO HG2 . 18 . HG2 1 1 276 1 2 1 1 24 TRP HZ3 . 24 . HZ3 1 1 277 1 1 1 1 18 PRO HG2 . 18 . HG2 1 1 277 1 2 1 1 24 TRP HH2 . 24 . HH2 1 1 278 1 1 1 1 18 PRO QB . 18 . HB2 1 1 278 1 2 1 1 24 TRP HH2 . 24 . HH2 1 1 279 1 1 1 1 18 PRO QB . 18 . HB2 1 1 279 1 2 1 1 24 TRP HD1 . 24 . HD1 1 1 280 1 1 1 1 16 CYS QB . 16 . HB1 1 1 280 1 2 1 1 24 TRP HD1 . 24 . HD1 1 1 281 1 1 1 1 16 CYS QB . 16 . HB1 1 1 281 1 2 1 1 24 TRP HE3 . 24 . HE3 1 1 282 1 1 1 1 18 PRO HD3 . 18 . HD1 1 1 282 1 2 1 1 24 TRP HZ3 . 24 . HZ3 1 1 283 1 1 1 1 18 PRO HD2 . 18 . HD2 1 1 283 1 2 1 1 24 TRP HZ3 . 24 . HZ3 1 1 284 1 1 1 1 18 PRO HD3 . 18 . HD1 1 1 284 1 2 1 1 24 TRP HH2 . 24 . HH2 1 1 285 1 1 1 1 18 PRO HD2 . 18 . HD2 1 1 285 1 2 1 1 24 TRP HH2 . 24 . HH2 1 1 286 1 1 1 1 18 PRO HA . 18 . HA 1 1 286 1 2 1 1 24 TRP HD1 . 24 . HD1 1 1 287 1 1 1 1 18 PRO HA . 18 . HA 1 1 287 1 2 1 1 24 TRP HH2 . 24 . HH2 1 1 288 1 1 1 1 20 SER HA . 20 . HA 1 1 288 1 1 1 1 23 THR HA . 23 . HA 1 1 288 1 2 1 1 24 TRP HE3 . 24 . HE3 1 1 288 1 2 1 1 24 TRP HH2 . 24 . HH2 1 1 289 1 1 1 1 23 THR HA . 23 . HA 1 1 289 1 2 1 1 24 TRP HD1 . 24 . HD1 1 1 290 1 1 1 1 16 CYS HA . 16 . HA 1 1 290 1 2 1 1 24 TRP HE3 . 24 . HE3 1 1 291 1 1 1 1 17 CYS HA . 17 . HA 1 1 291 1 2 1 1 24 TRP HH2 . 24 . HH2 1 1 292 1 1 1 1 17 CYS HA . 17 . HA 1 1 292 1 2 1 1 24 TRP HZ3 . 24 . HZ3 1 1 293 1 1 1 1 6 GLY QA . 6 . HA1 1 1 293 1 1 1 1 23 THR HB . 23 . HB 1 1 293 1 1 1 1 31 LYS HA . 31 . HA 1 1 293 1 2 1 1 8 PHE HZ . 8 . HZ 1 1 294 1 1 1 1 8 PHE HZ . 8 . HZ 1 1 294 1 2 1 1 24 TRP QB . 24 . HB2 1 1 295 1 1 1 1 8 PHE QD . 8 . HD2 1 1 295 1 2 1 1 24 TRP QB . 24 . HB1 1 1 296 1 1 1 1 8 PHE HZ . 8 . HZ 1 1 296 1 2 1 1 22 THR MG . 22 . HG21 1 1 296 1 2 1 1 23 THR MG . 23 . HG21 1 1 296 1 2 1 1 33 VAL MG2 . 33 . HG21 1 1 297 1 1 1 1 17 CYS HA . 17 . HA 1 1 297 1 2 1 1 18 PRO HG2 . 18 . HG2 1 1 298 1 1 1 1 17 CYS HA . 17 . HA 1 1 298 1 2 1 1 18 PRO QB . 18 . HB2 1 1 299 1 1 1 1 15 THR MG . 15 . HG21 1 1 299 1 2 1 1 17 CYS HA . 17 . HA 1 1 300 1 1 1 1 54 CYS HA . 54 . HA 1 1 300 1 2 1 1 55 ILE QG . 55 . HG12 1 1 301 1 1 1 1 32 ALA MB . 32 . HB1 1 1 301 1 2 1 1 41 CYS HA . 41 . HA 1 1 302 1 1 1 1 42 CYS HA . 42 . HA 1 1 302 1 2 1 1 43 PRO QG . 43 . HG1 1 1 303 1 1 1 1 2 VAL MG1 . 2 . HG11 1 1 303 1 1 1 1 55 ILE MD . 55 . HD11 1 1 303 1 2 1 1 9 SER HA . 9 . HA 1 1 303 1 2 1 1 16 CYS HA . 16 . HA 1 1 304 1 1 1 1 15 THR MG . 15 . HG21 1 1 304 1 2 1 1 16 CYS HA . 16 . HA 1 1 305 1 1 1 1 33 VAL MG1 . 33 . HG11 1 1 305 1 2 1 1 35 CYS HA . 35 . HA 1 1 306 1 1 1 1 2 VAL QG . 2 . HG11 1 1 306 1 1 1 1 55 ILE MD . 55 . HD11 1 1 306 1 2 1 1 10 CYS HA . 10 . HA 1 1 307 1 1 1 1 2 VAL HB . 2 . HB 1 1 307 1 2 1 1 10 CYS HA . 10 . HA 1 1 308 1 1 1 1 10 CYS HA . 10 . HA 1 1 308 1 2 1 1 14 GLU QB . 14 . HB1 1 1 309 1 1 1 1 10 CYS HA . 10 . HA 1 1 309 1 2 1 1 14 GLU QG . 14 . HG2 1 1 310 1 1 1 1 14 GLU QG . 14 . HG2 1 1 310 1 1 1 1 28 PRO QB . 28 . HB1 1 1 310 1 1 1 1 30 PRO QB . 30 . HB2 1 1 310 1 2 1 1 29 SER HA . 29 . HA 1 1 311 1 1 1 1 19 THR MG . 19 . HG21 1 1 311 1 2 1 1 24 TRP HA . 24 . HA 1 1 312 1 1 1 1 18 PRO QB . 18 . HB2 1 1 312 1 2 1 1 24 TRP HA . 24 . HA 1 1 313 1 1 1 1 29 SER HA . 29 . HA 1 1 313 1 2 1 1 32 ALA MB . 32 . HB1 1 1 314 1 1 1 1 29 SER HA . 29 . HA 1 1 314 1 2 1 1 30 PRO HG2 . 30 . HG2 1 1 315 1 1 1 1 2 VAL MG2 . 2 . HG21 1 1 315 1 2 1 1 12 ASP HA . 12 . HA 1 1 316 1 1 1 1 17 CYS QB . 17 . HB2 1 1 316 1 2 1 1 18 PRO HD3 . 18 . HD1 1 1 317 1 1 1 1 18 PRO HD3 . 18 . HD1 1 1 317 1 2 1 1 34 CYS QB . 34 . HB2 1 1 318 1 1 1 1 17 CYS QB . 17 . HB2 1 1 318 1 2 1 1 18 PRO HD2 . 18 . HD2 1 1 319 1 1 1 1 18 PRO HD2 . 18 . HD2 1 1 319 1 2 1 1 34 CYS QB . 34 . HB1 1 1 319 1 2 1 1 42 CYS QB . 42 . HB2 1 1 319 1 2 1 1 43 PRO HD3 . 43 . HD1 1 1 320 1 1 1 1 18 PRO HD2 . 18 . HD2 1 1 320 1 2 1 1 34 CYS QB . 34 . HB2 1 1 321 1 1 1 1 2 VAL HB . 2 . HB 1 1 321 1 2 1 1 10 CYS QB . 10 . HB2 1 1 322 1 1 1 1 1 ASP QB . 1 . HB1 1 1 322 1 2 1 1 9 SER QB . 9 . HB1 1 1 323 1 1 1 1 50 PRO QD . 50 . HD1 1 1 323 1 2 1 1 55 ILE MD . 55 . HD11 1 1 324 1 1 1 1 17 CYS QB . 17 . HB2 1 1 324 1 2 1 1 43 PRO QB . 43 . HB2 1 1 325 1 1 1 1 21 GLN QG . 21 . HG2 1 1 325 1 2 1 1 22 THR MG . 22 . HG21 1 1 326 1 1 1 1 21 GLN HB2 . 21 . HB2 1 1 326 1 2 1 1 22 THR MG . 22 . HG21 1 1 327 1 1 1 1 21 GLN HB3 . 21 . HB1 1 1 327 1 2 1 1 22 THR MG . 22 . HG21 1 1 328 1 1 1 1 49 GLY HA2 . 49 . HA2 1 1 328 1 2 1 1 55 ILE MD . 55 . HD11 1 1 329 1 1 1 1 29 SER HB2 . 29 . HB2 1 1 329 1 2 1 1 43 PRO HA . 43 . HA 1 1 330 1 1 1 1 29 SER HB3 . 29 . HB1 1 1 330 1 2 1 1 43 PRO HA . 43 . HA 1 1 331 1 1 1 1 29 SER HB2 . 29 . HB2 1 1 331 1 2 1 1 32 ALA MB . 32 . HB1 1 1 332 1 1 1 1 50 PRO QD . 50 . HD1 1 1 332 1 2 1 1 55 ILE MG . 55 . HG21 1 1 333 1 1 1 1 49 GLY HA3 . 49 . HA1 1 1 333 1 2 1 1 55 ILE MG . 55 . HG21 1 1 334 1 1 1 1 49 GLY HA3 . 49 . HA1 1 1 334 1 2 1 1 55 ILE MD . 55 . HD11 1 1 335 1 1 1 1 19 THR MG . 19 . HG21 1 1 335 1 2 1 1 25 GLY QA . 25 . HA1 1 1 336 2 1 1 1 19 THR MG . 19 . HG21 1 1 336 2 1 1 1 55 ILE QG . 55 . HG11 1 1 336 2 2 1 1 24 TRP HA . 24 . HA 1 1 336 3 1 1 1 29 SER HA . 29 . HA 1 1 336 3 2 1 1 55 ILE QG . 55 . HG11 1 1 337 1 1 1 1 53 THR HB . 53 . HB 1 1 337 1 2 1 1 55 ILE MG . 55 . HG21 1 1 338 1 1 1 1 33 VAL MG2 . 33 . HG21 1 1 338 1 2 1 1 44 ALA HA . 44 . HA 1 1 339 1 1 1 1 2 VAL MG1 . 2 . HG11 1 1 339 1 2 1 1 10 CYS QB . 10 . HB1 1 1 340 1 1 1 1 47 LYS HE2 . 47 . HE2 1 1 340 1 2 1 1 55 ILE MD . 55 . HD11 1 1 341 1 1 1 1 47 LYS HE2 . 47 . HE2 1 1 341 1 2 1 1 55 ILE QG . 55 . HG11 1 1 342 1 1 1 1 47 LYS QD . 47 . HD2 1 1 342 1 2 1 1 55 ILE QG . 55 . HG11 1 1 343 1 1 1 1 19 THR MG . 19 . HG21 1 1 343 1 1 1 1 55 ILE QG . 55 . HG11 1 1 343 1 2 1 1 38 MET QB . 38 . HB2 1 1 344 1 1 1 1 49 GLY HA3 . 49 . HA1 1 1 344 1 2 1 1 55 ILE QG . 55 . HG11 1 1 345 1 1 1 1 28 PRO QB . 28 . HB1 1 1 345 1 2 1 1 29 SER HA . 29 . HA 1 1 346 1 1 1 1 42 CYS QB . 42 . HB1 1 1 346 1 2 1 1 46 TYR HB2 . 46 . HB2 1 1 347 1 1 1 1 8 PHE QB . 8 . HB1 1 1 347 1 2 1 1 24 TRP QB . 24 . HB1 1 1 348 1 1 1 1 43 PRO HD2 . 43 . HD2 1 1 348 1 2 1 1 54 CYS QB . 54 . HB2 1 1 349 1 1 1 1 46 TYR HB2 . 46 . HB2 1 1 349 1 2 1 1 54 CYS QB . 54 . HB2 1 1 350 1 1 1 1 42 CYS HA . 42 . HA 1 1 350 1 2 1 1 46 TYR HB2 . 46 . HB2 1 1 351 1 1 1 1 19 THR MG . 19 . HG21 1 1 351 1 2 1 1 38 MET HA . 38 . HA 1 1 352 1 1 1 1 33 VAL MG1 . 33 . HG11 1 1 352 1 2 1 1 47 LYS HA . 47 . HA 1 1 353 1 1 1 1 47 LYS QD . 47 . HD2 1 1 353 1 2 1 1 55 ILE MD . 55 . HD11 1 1 354 1 1 1 1 47 LYS QD . 47 . HD2 1 1 354 1 2 1 1 55 ILE MG . 55 . HG21 1 1 355 1 1 1 1 1 ASP QB . 1 . HB1 1 1 355 1 1 1 1 12 ASP HB3 . 12 . HB1 1 1 355 1 2 1 1 2 VAL MG2 . 2 . HG21 1 1 356 1 1 1 1 37 ASP HA . 37 . HA 1 1 356 1 2 1 1 38 MET QG . 38 . HG2 1 1 357 1 1 1 1 37 ASP HA . 37 . HA 1 1 357 1 2 1 1 38 MET QB . 38 . HB2 1 1 358 1 1 1 1 2 VAL MG2 . 2 . HG21 1 1 358 1 2 1 1 15 THR HA . 15 . HA 1 1 359 1 1 1 1 49 GLY HA2 . 49 . HA2 1 1 359 1 2 1 1 50 PRO HG2 . 50 . HG2 1 1 360 1 1 1 1 49 GLY HA2 . 49 . HA2 1 1 360 1 2 1 1 55 ILE QG . 55 . HG12 1 1 361 1 1 1 1 35 CYS HA . 35 . HA 1 1 361 1 2 1 1 37 ASP QB . 37 . HB2 1 1 362 1 1 1 1 1 ASP QB . 1 . HB1 1 1 362 1 2 1 1 11 HIS HA . 11 . HA 1 1 363 1 1 1 1 2 VAL MG1 . 2 . HG11 1 1 363 1 2 1 1 4 CYS HA . 4 . HA 1 1 364 1 1 1 1 43 PRO HA . 43 . HA 1 1 364 1 2 1 1 44 ALA MB . 44 . HB1 1 1 365 1 1 1 1 44 ALA MB . 44 . HB1 1 1 365 1 2 1 1 45 GLY HA2 . 45 . HA2 1 1 366 1 1 1 1 32 ALA HA . 32 . HA 1 1 366 1 2 1 1 33 VAL HB . 33 . HB 1 1 367 2 1 1 1 2 VAL MG1 . 2 . HG11 1 1 367 2 1 1 1 55 ILE MD . 55 . HD11 1 1 367 2 2 1 1 3 GLN HA . 3 . HA 1 1 367 3 1 1 1 44 ALA HA . 44 . HA 1 1 367 3 1 1 1 53 THR HB . 53 . HB 1 1 367 3 2 1 1 55 ILE MD . 55 . HD11 1 1 368 1 1 1 1 32 ALA MB . 32 . HB1 1 1 368 1 2 1 1 33 VAL HA . 33 . HA 1 1 369 1 1 1 1 15 THR MG . 15 . HG21 1 1 369 1 2 1 1 31 LYS HA . 31 . HA 1 1 370 1 1 1 1 15 THR HB . 15 . HB 1 1 370 1 2 1 1 27 CYS HA . 27 . HA 1 1 371 1 1 1 1 44 ALA MB . 44 . HB1 1 1 371 1 2 1 1 45 GLY HA3 . 45 . HA1 1 1 372 1 1 1 1 11 HIS HB2 . 11 . HB2 1 1 372 1 2 1 1 14 GLU QG . 14 . HG2 1 1 373 1 1 1 1 11 HIS HB3 . 11 . HB1 1 1 373 1 2 1 1 14 GLU QG . 14 . HG2 1 1 374 1 1 1 1 32 ALA MB . 32 . HB1 1 1 374 1 2 1 1 43 PRO HD3 . 43 . HD1 1 1 375 1 1 1 1 39 GLN QB . 39 . HB1 1 1 375 1 2 1 1 40 HIS HD2 . 40 . HD2 1 1 376 1 1 1 1 4 CYS QB . 4 . HB1 1 1 376 1 1 1 1 14 GLU QB . 14 . HB1 1 1 376 1 2 1 1 24 TRP HE3 . 24 . HE3 1 1 376 1 2 1 1 24 TRP HH2 . 24 . HH2 1 1 377 1 1 1 1 18 PRO HA . 18 . HA 1 1 377 1 2 1 1 24 TRP QB . 24 . HB1 1 1 378 2 1 1 1 11 HIS HB3 . 11 . HB1 1 1 378 2 2 1 1 38 MET QB . 38 . HB2 1 1 378 3 1 1 1 26 CYS QB . 26 . HB2 1 1 378 3 1 1 1 46 TYR HB3 . 46 . HB1 1 1 378 3 2 1 1 42 CYS QB . 42 . HB1 1 1 378 4 1 1 1 43 PRO QB . 43 . HB2 1 1 378 4 2 1 1 46 TYR HB3 . 46 . HB1 1 1 379 1 1 1 1 14 GLU QB . 14 . HB2 1 1 379 1 2 1 1 26 CYS QB . 26 . HB2 1 1 380 1 1 1 1 3 GLN HG3 . 3 . HG1 1 1 380 1 1 1 1 42 CYS QB . 42 . HB1 1 1 380 1 1 1 1 43 PRO QB . 43 . HB2 1 1 380 1 2 1 1 32 ALA MB . 32 . HB1 1 1 381 1 1 1 1 31 LYS HB3 . 31 . HB1 1 1 381 1 1 1 1 33 VAL HB . 33 . HB 1 1 381 1 1 1 1 43 PRO QB . 43 . HB1 1 1 381 1 1 1 1 47 LYS QB . 47 . HB2 1 1 381 1 2 1 1 32 ALA MB . 32 . HB1 1 1 382 1 1 1 1 4 CYS HA . 4 . HA 1 1 382 1 2 1 1 9 SER HA . 9 . HA 1 1 382 1 2 1 1 16 CYS HA . 16 . HA 1 1 383 2 1 1 1 4 CYS HA . 4 . HA 1 1 383 2 2 1 1 24 TRP HZ3 . 24 . HZ3 1 1 383 3 1 1 1 45 GLY HA2 . 45 . HA2 1 1 383 3 2 1 1 46 TYR QD . 46 . HD1 1 1 384 2 1 1 1 4 CYS QB . 4 . HB1 1 1 384 2 1 1 1 14 GLU QB . 14 . HB1 1 1 384 2 2 1 1 24 TRP HD1 . 24 . HD1 1 1 384 3 1 1 1 14 GLU QB . 14 . HB1 1 1 384 3 2 1 1 53 THR H . 53 . HN 1 1 385 1 1 1 1 4 CYS QB . 4 . HB1 1 1 385 1 1 1 1 14 GLU QB . 14 . HB1 1 1 385 1 2 1 1 24 TRP HZ3 . 24 . HZ3 1 1 386 1 1 1 1 5 GLY QA . 5 . HA1 1 1 386 1 1 1 1 9 SER QB . 9 . HB2 1 1 386 1 2 1 1 24 TRP HZ2 . 24 . HZ2 1 1 387 2 1 1 1 2 VAL HA . 2 . HA 1 1 387 2 1 1 1 5 GLY QA . 5 . HA2 1 1 387 2 1 1 1 33 VAL HA . 33 . HA 1 1 387 2 2 1 1 3 GLN HE22 . 3 . HE22 1 1 387 3 1 1 1 5 GLY QA . 5 . HA2 1 1 387 3 2 1 1 24 TRP HZ2 . 24 . HZ2 1 1 388 1 1 1 1 50 PRO QD . 50 . HD1 1 1 388 1 2 1 1 55 ILE QG . 55 . HG11 1 1 388 1 2 1 1 55 ILE MG . 55 . HG21 1 1 389 1 1 1 1 47 LYS QG . 47 . HG2 1 1 389 1 1 1 1 55 ILE QG . 55 . HG12 1 1 389 1 2 1 1 50 PRO QD . 50 . HD1 1 1 390 2 1 1 1 6 GLY QA . 6 . HA2 1 1 390 2 1 1 1 7 GLY QA . 7 . HA2 1 1 390 2 2 1 1 18 PRO QB . 18 . HB1 1 1 390 3 1 1 1 7 GLY QA . 7 . HA2 1 1 390 3 1 1 1 32 ALA HA . 32 . HA 1 1 390 3 2 1 1 43 PRO QG . 43 . HG1 1 1 390 4 1 1 1 32 ALA HA . 32 . HA 1 1 390 4 2 1 1 47 LYS QD . 47 . HD1 1 1 391 1 1 1 1 33 VAL MG1 . 33 . HG11 1 1 391 1 2 1 1 35 CYS HA . 35 . HA 1 1 391 1 2 1 1 40 HIS HA . 40 . HA 1 1 392 1 1 1 1 51 GLY QA . 51 . HA1 1 1 392 1 2 1 1 53 THR MG . 53 . HG21 1 1 393 2 1 1 1 15 THR HA . 15 . HA 1 1 393 2 2 1 1 28 PRO HD2 . 28 . HD2 1 1 393 3 1 1 1 15 THR HA . 15 . HA 1 1 393 3 1 1 1 50 PRO HA . 50 . HA 1 1 393 3 2 1 1 51 GLY QA . 51 . HA1 1 1 394 2 1 1 1 4 CYS QB . 4 . HB1 1 1 394 2 1 1 1 14 GLU QB . 14 . HB1 1 1 394 2 2 1 1 11 HIS HB3 . 11 . HB1 1 1 394 3 1 1 1 14 GLU QB . 14 . HB1 1 1 394 3 2 1 1 26 CYS QB . 26 . HB2 1 1 394 4 1 1 1 43 PRO QB . 43 . HB1 1 1 394 4 2 1 1 46 TYR HB3 . 46 . HB1 1 1 395 1 1 1 1 17 CYS QB . 17 . HB1 1 1 395 1 1 1 1 21 GLN QG . 21 . HG2 1 1 395 1 1 1 1 28 PRO QB . 28 . HB2 1 1 395 1 2 1 1 27 CYS QB . 27 . HB2 1 1 396 2 1 1 1 35 CYS QB . 35 . HB1 1 1 396 2 2 1 1 40 HIS HB3 . 40 . HB1 1 1 396 3 1 1 1 47 LYS QE . 47 . HE2 1 1 396 3 2 1 1 52 GLY HA3 . 52 . HA1 1 1 397 1 1 1 1 9 SER QB . 9 . HB1 1 1 397 1 2 1 1 10 CYS H . 10 . HN 1 1 398 1 1 1 1 2 VAL MG1 . 2 . HG11 1 1 398 1 2 1 1 10 CYS H . 10 . HN 1 1 399 1 1 1 1 43 PRO HA . 43 . HA 1 1 399 1 2 1 1 44 ALA H . 44 . HN 1 1 400 1 1 1 1 2 VAL QG . 2 . HG11 1 1 400 1 1 1 1 55 ILE MD . 55 . HD11 1 1 400 1 2 1 1 16 CYS H . 16 . HN 1 1 401 1 1 1 1 19 THR HB . 19 . HB 1 1 401 1 2 1 1 20 SER H . 20 . HN 1 1 402 1 1 1 1 19 THR MG . 19 . HG21 1 1 402 1 2 1 1 20 SER H . 20 . HN 1 1 403 1 1 1 1 55 ILE HA . 55 . HA 1 1 403 1 2 1 1 56 SER H . 56 . HN 1 1 404 1 1 1 1 55 ILE QG . 55 . HG12 1 1 404 1 2 1 1 56 SER H . 56 . HN 1 1 405 1 1 1 1 46 TYR HB2 . 46 . HB2 1 1 405 1 2 1 1 47 LYS H . 47 . HN 1 1 406 1 1 1 1 47 LYS HG3 . 47 . HG1 1 1 406 1 2 1 1 48 CYS H . 48 . HN 1 1 407 1 1 1 1 37 ASP HA . 37 . HA 1 1 407 1 2 1 1 38 MET H . 38 . HN 1 1 408 1 1 1 1 39 GLN HA . 39 . HA 1 1 408 1 2 1 1 40 HIS H . 40 . HN 1 1 409 1 1 1 1 40 HIS HB2 . 40 . HB2 1 1 409 1 2 1 1 41 CYS H . 41 . HN 1 1 410 1 1 1 1 31 LYS HB2 . 31 . HB2 1 1 410 1 2 1 1 32 ALA H . 32 . HN 1 1 411 1 1 1 1 31 LYS HA . 31 . HA 1 1 411 1 2 1 1 32 ALA H . 32 . HN 1 1 412 1 1 1 1 5 GLY H . 5 . HN 1 1 412 1 2 1 1 8 PHE QB . 8 . HB2 1 1 413 1 1 1 1 8 PHE H . 8 . HN 1 1 413 1 2 1 1 24 TRP HE3 . 24 . HE3 1 1 413 1 2 1 1 24 TRP HH2 . 24 . HH2 1 1 414 1 1 1 1 8 PHE H . 8 . HN 1 1 414 1 2 1 1 24 TRP HD1 . 24 . HD1 1 1 414 1 2 1 1 53 THR H . 53 . HN 1 1 415 1 1 1 1 5 GLY H . 5 . HN 1 1 415 1 1 1 1 24 TRP HH2 . 24 . HH2 1 1 415 1 2 1 1 17 CYS H . 17 . HN 1 1 416 1 1 1 1 18 PRO QB . 18 . HB2 1 1 416 1 1 1 1 39 GLN QB . 39 . HB2 1 1 416 1 2 1 1 19 THR H . 19 . HN 1 1 417 1 1 1 1 21 GLN HA . 21 . HA 1 1 417 1 2 1 1 22 THR H . 22 . HN 1 1 418 1 1 1 1 49 GLY H . 49 . HN 1 1 418 1 2 1 1 55 ILE QG . 55 . HG11 1 1 419 1 1 1 1 47 LYS QD . 47 . HD2 1 1 419 1 2 1 1 55 ILE H . 55 . HN 1 1 420 1 1 1 1 3 GLN HG2 . 3 . HG2 1 1 420 1 1 1 1 14 GLU QG . 14 . HG2 1 1 420 1 1 1 1 38 MET QG . 38 . HG2 1 1 420 1 2 1 1 10 CYS H . 10 . HN 1 1 421 1 1 1 1 12 ASP H . 12 . HN 1 1 421 1 2 1 1 14 GLU QG . 14 . HG1 1 1 421 1 2 1 1 21 GLN HB3 . 21 . HB1 1 1 421 1 2 1 1 30 PRO QB . 30 . HB2 1 1 422 1 1 1 1 11 HIS HB3 . 11 . HB1 1 1 422 1 1 1 1 26 CYS QB . 26 . HB2 1 1 422 1 1 1 1 37 ASP QB . 37 . HB1 1 1 422 1 1 1 1 42 CYS QB . 42 . HB2 1 1 422 1 1 1 1 43 PRO HD3 . 43 . HD1 1 1 422 1 2 1 1 14 GLU H . 14 . HN 1 1 423 1 1 1 1 18 PRO QB . 18 . HB1 1 1 423 1 2 1 1 20 SER H . 20 . HN 1 1 424 1 1 1 1 14 GLU QB . 14 . HB1 1 1 424 1 2 1 1 27 CYS H . 27 . HN 1 1 425 1 1 1 1 33 VAL MG1 . 33 . HG11 1 1 425 1 2 1 1 35 CYS H . 35 . HN 1 1 426 1 1 1 1 10 CYS HA . 10 . HA 1 1 426 1 1 1 1 11 HIS HA . 11 . HA 1 1 426 1 1 1 1 35 CYS HA . 35 . HA 1 1 426 1 1 1 1 40 HIS HA . 40 . HA 1 1 426 1 2 1 1 39 GLN H . 39 . HN 1 1 427 1 1 1 1 34 CYS QB . 34 . HB2 1 1 427 1 1 1 1 35 CYS QB . 35 . HB2 1 1 427 1 1 1 1 40 HIS HB2 . 40 . HB2 1 1 427 1 1 1 1 49 GLY HA3 . 49 . HA1 1 1 427 1 2 1 1 39 GLN H . 39 . HN 1 1 428 1 1 1 1 28 PRO HD3 . 28 . HD1 1 1 428 1 1 1 1 29 SER QB . 29 . HB% 1 1 428 1 1 1 1 30 PRO QD . 30 . HD% 1 1 428 1 2 1 1 44 ALA H . 44 . HN 1 1 429 1 1 1 1 32 ALA MB . 32 . HB1 1 1 429 1 1 1 1 53 THR MG . 53 . HG21 1 1 429 1 2 1 1 44 ALA H . 44 . HN 1 1 430 1 1 1 1 31 LYS HB3 . 31 . HB1 1 1 430 1 1 1 1 33 VAL HB . 33 . HB 1 1 430 1 1 1 1 43 PRO QB . 43 . HB1 1 1 430 1 1 1 1 47 LYS QB . 47 . HB2 1 1 430 1 2 1 1 46 TYR H . 46 . HN 1 1 431 1 1 1 1 31 LYS HG2 . 31 . HG2 1 1 431 1 1 1 1 44 ALA MB . 44 . HB1 1 1 431 1 1 1 1 47 LYS QG . 47 . HG2 1 1 431 1 1 1 1 55 ILE QG . 55 . HG12 1 1 431 1 2 1 1 46 TYR H . 46 . HN 1 1 432 1 1 1 1 47 LYS H . 47 . HN 1 1 432 1 2 1 1 55 ILE QG . 55 . HG11 1 1 433 1 1 1 1 15 THR MG . 15 . HG21 1 1 433 1 2 1 1 17 CYS H . 17 . HN 1 1 434 1 1 1 1 25 GLY H . 25 . HN 1 1 434 1 2 1 1 26 CYS HA . 26 . HA 1 1 435 1 1 1 1 14 GLU QG . 14 . HG2 1 1 435 1 1 1 1 17 CYS QB . 17 . HB1 1 1 435 1 1 1 1 21 GLN QG . 21 . HG% 1 1 435 1 1 1 1 28 PRO QB . 28 . HB2 1 1 435 1 2 1 1 27 CYS H . 27 . HN 1 1 436 1 1 1 1 9 SER H . 9 . HN 1 1 436 1 1 1 1 29 SER H . 29 . HN 1 1 436 1 1 1 1 32 ALA H . 32 . HN 1 1 436 1 2 1 1 27 CYS QB . 27 . HB2 1 1 437 1 1 1 1 35 CYS H . 35 . HN 1 1 437 1 2 1 1 41 CYS HB3 . 41 . HB1 1 1 438 1 1 1 1 18 PRO HA . 18 . HA 1 1 438 1 1 1 1 19 THR HB . 19 . HB 1 1 438 1 1 1 1 41 CYS HB2 . 41 . HB2 1 1 438 1 2 1 1 35 CYS H . 35 . HN 1 1 439 1 1 1 1 35 CYS QB . 35 . HB2 1 1 439 1 1 1 1 50 PRO QD . 50 . HD1 1 1 439 1 1 1 1 56 SER HB3 . 56 . HB1 1 1 439 1 2 1 1 38 MET H . 38 . HN 1 1 440 1 1 1 1 38 MET QG . 38 . HG2 1 1 440 1 2 1 1 39 GLN H . 39 . HN 1 1 441 1 1 1 1 11 HIS HB3 . 11 . HB1 1 1 441 1 1 1 1 34 CYS QB . 34 . HB1 1 1 441 1 1 1 1 42 CYS QB . 42 . HB2 1 1 441 1 1 1 1 43 PRO HD3 . 43 . HD1 1 1 441 1 2 1 1 40 HIS H . 40 . HN 1 1 442 1 1 1 1 42 CYS QB . 42 . HB1 1 1 442 1 1 1 1 43 PRO QB . 43 . HB2 1 1 442 1 2 1 1 46 TYR H . 46 . HN 1 1 443 1 1 1 1 36 ASP HA . 36 . HA 1 1 443 1 1 1 1 37 ASP HA . 37 . HA 1 1 443 1 1 1 1 39 GLN HA . 39 . HA 1 1 443 1 1 1 1 53 THR HA . 53 . HA 1 1 443 1 2 1 1 49 GLY H . 49 . HN 1 1 444 1 1 1 1 49 GLY H . 49 . HN 1 1 444 1 2 1 1 53 THR MG . 53 . HG21 1 1 445 1 1 1 1 50 PRO HA . 50 . HA 1 1 445 1 2 1 1 52 GLY H . 52 . HN 1 1 446 1 1 1 1 19 THR MG . 19 . HG21 1 1 446 1 1 1 1 55 ILE QG . 55 . HG11 1 1 446 1 1 1 1 55 ILE MG . 55 . HG21 1 1 446 1 2 1 1 54 CYS H . 54 . HN 1 1 447 1 1 1 1 17 CYS QB . 17 . HB2 1 1 447 1 1 1 1 46 TYR HB2 . 46 . HB2 1 1 447 1 2 1 1 55 ILE H . 55 . HN 1 1 448 1 1 1 1 20 SER HB2 . 20 . HB2 1 1 448 1 2 1 1 23 THR H . 23 . HN 1 1 449 2 1 1 1 9 SER H . 9 . HN 1 1 449 2 2 1 1 11 HIS H . 11 . HN 1 1 449 3 1 1 1 9 SER H . 9 . HN 1 1 449 3 1 1 1 29 SER H . 29 . HN 1 1 449 3 1 1 1 32 ALA H . 32 . HN 1 1 449 3 2 1 1 33 VAL H . 33 . HN 1 1 450 1 1 1 1 2 VAL H . 2 . HN 1 1 450 1 1 1 1 39 GLN H . 39 . HN 1 1 450 1 2 1 1 37 ASP H . 37 . HN 1 1 451 1 1 1 1 17 CYS H . 17 . HN 1 1 451 1 1 1 1 25 GLY H . 25 . HN 1 1 451 1 2 1 1 19 THR H . 19 . HN 1 1 452 1 1 1 1 46 TYR H . 46 . HN 1 1 452 1 2 1 1 47 LYS H . 47 . HN 1 1 453 1 1 1 1 24 TRP HZ3 . 24 . HZ3 1 1 453 1 1 1 1 46 TYR QD . 46 . HD1 1 1 453 1 2 1 1 55 ILE H . 55 . HN 1 1 454 1 1 1 1 24 TRP HZ3 . 24 . HZ3 1 1 454 1 1 1 1 46 TYR QD . 46 . HD1 1 1 454 1 2 1 1 56 SER H . 56 . 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 5.0 1 1 2 1 . . . . . 3.4 1.8 5.0 1 1 3 1 . . . . . 3.4 1.8 5.0 1 1 4 1 . . . . . 3.4 1.8 5.0 1 1 5 1 . . . . . 3.4 1.8 5.0 1 1 6 1 . . . . . 3.4 1.8 5.0 1 1 7 1 . . . . . 3.4 1.8 5.0 1 1 8 1 . . . . . 3.4 1.8 5.0 1 1 9 1 . . . . . 3.4 1.8 5.0 1 1 10 1 . . . . . 3.4 1.8 5.0 1 1 11 1 . . . . . 3.4 1.8 5.0 1 1 12 1 . . . . . 3.4 1.8 5.0 1 1 13 1 . . . . . 3.4 1.8 5.0 1 1 14 1 . . . . . 3.4 1.8 5.0 1 1 15 1 . . . . . 3.4 1.8 5.0 1 1 16 1 . . . . . 3.4 1.8 5.0 1 1 17 1 . . . . . 3.4 1.8 5.0 1 1 18 1 . . . . . 3.4 1.8 5.0 1 1 19 1 . . . . . 3.4 1.8 5.0 1 1 20 1 . . . . . 3.4 1.8 5.0 1 1 21 1 . . . . . 3.4 1.8 5.0 1 1 22 1 . . . . . 3.4 1.8 5.0 1 1 23 1 . . . . . 3.4 1.8 5.0 1 1 24 1 . . . . . 3.4 1.8 5.0 1 1 25 1 . . . . . 3.4 1.8 5.0 1 1 26 1 . . . . . 3.4 1.8 5.0 1 1 27 1 . . . . . 3.4 1.8 5.0 1 1 28 1 . . . . . 3.4 1.8 5.0 1 1 29 1 . . . . . 3.4 1.8 5.0 1 1 30 1 . . . . . 3.4 1.8 5.0 1 1 31 1 . . . . . 3.4 1.8 5.0 1 1 32 1 . . . . . 3.4 1.8 5.0 1 1 33 1 . . . . . 3.4 1.8 5.0 1 1 34 1 . . . . . 3.4 1.8 5.0 1 1 35 1 . . . . . 3.4 1.8 5.0 1 1 36 1 . . . . . 3.4 1.8 5.0 1 1 37 1 . . . . . 3.4 1.8 5.0 1 1 38 1 . . . . . 3.4 1.8 5.0 1 1 39 1 . . . . . 3.4 1.8 5.0 1 1 40 1 . . . . . 3.4 1.8 5.0 1 1 41 1 . . . . . 3.4 1.8 5.0 1 1 42 1 . . . . . 3.4 1.8 5.0 1 1 43 1 . . . . . 3.4 1.8 5.0 1 1 44 1 . . . . . 3.4 1.8 5.0 1 1 45 1 . . . . . 3.4 1.8 5.0 1 1 46 1 . . . . . 3.4 1.8 5.0 1 1 47 1 . . . . . 3.4 1.8 5.0 1 1 48 1 . . . . . 3.4 1.8 5.0 1 1 49 1 . . . . . 3.4 1.8 5.0 1 1 50 1 . . . . . 3.4 1.8 5.0 1 1 51 1 . . . . . 3.4 1.8 5.0 1 1 52 1 . . . . . 3.4 1.8 5.0 1 1 53 1 . . . . . 3.4 1.8 5.0 1 1 54 1 . . . . . 3.4 1.8 5.0 1 1 55 1 . . . . . 3.4 1.8 5.0 1 1 56 1 . . . . . 3.4 1.8 5.0 1 1 57 1 . . . . . 3.4 1.8 5.0 1 1 58 1 . . . . . 3.4 1.8 5.0 1 1 59 1 . . . . . 3.4 1.8 5.0 1 1 60 1 . . . . . 3.4 1.8 5.0 1 1 61 1 . . . . . 3.4 1.8 5.0 1 1 62 1 . . . . . 3.4 1.8 5.0 1 1 63 1 . . . . . 3.4 1.8 5.0 1 1 64 1 . . . . . 3.4 1.8 5.0 1 1 65 1 . . . . . 3.4 1.8 5.0 1 1 66 1 . . . . . 3.4 1.8 5.0 1 1 67 1 . . . . . 3.4 1.8 5.0 1 1 68 1 . . . . . 3.4 1.8 5.0 1 1 69 1 . . . . . 3.4 1.8 5.0 1 1 70 1 . . . . . 3.4 1.8 5.0 1 1 71 1 . . . . . 3.4 1.8 5.0 1 1 72 1 . . . . . 3.4 1.8 5.0 1 1 73 1 . . . . . 3.4 1.8 5.0 1 1 74 1 . . . . . 3.4 1.8 5.0 1 1 75 1 . . . . . 3.4 1.8 5.0 1 1 76 1 . . . . . 3.4 1.8 5.0 1 1 77 1 . . . . . 3.4 1.8 5.0 1 1 78 1 . . . . . 3.4 1.8 5.0 1 1 79 1 . . . . . 3.4 1.8 5.0 1 1 80 1 . . . . . 3.4 1.8 5.0 1 1 81 1 . . . . . 3.4 1.8 5.0 1 1 82 1 . . . . . 3.4 1.8 5.0 1 1 83 1 . . . . . 3.4 1.8 5.0 1 1 84 1 . . . . . 3.4 1.8 5.0 1 1 85 1 . . . . . 3.4 1.8 5.0 1 1 86 1 . . . . . 3.4 1.8 5.0 1 1 87 1 . . . . . 3.4 1.8 5.0 1 1 88 1 . . . . . 3.4 1.8 5.0 1 1 89 1 . . . . . 3.4 1.8 5.0 1 1 90 1 . . . . . 3.4 1.8 5.0 1 1 91 1 . . . . . 3.4 1.8 5.0 1 1 92 1 . . . . . 3.4 1.8 5.0 1 1 93 1 . . . . . 3.4 1.8 5.0 1 1 94 1 . . . . . 3.4 1.8 5.0 1 1 95 1 . . . . . 3.4 1.8 5.0 1 1 96 1 . . . . . 3.4 1.8 5.0 1 1 97 1 . . . . . 3.4 1.8 5.0 1 1 98 1 . . . . . 3.4 1.8 5.0 1 1 99 1 . . . . . 3.4 1.8 5.0 1 1 100 1 . . . . . 3.4 1.8 5.0 1 1 101 1 . . . . . 3.4 1.8 5.0 1 1 102 1 . . . . . 3.4 1.8 5.0 1 1 103 1 . . . . . 3.4 1.8 5.0 1 1 104 1 . . . . . 3.4 1.8 5.0 1 1 105 1 . . . . . 3.4 1.8 5.0 1 1 106 1 . . . . . 3.4 1.8 5.0 1 1 107 1 . . . . . 3.4 1.8 5.0 1 1 108 1 . . . . . 3.4 1.8 5.0 1 1 109 1 . . . . . 3.4 1.8 5.0 1 1 110 1 . . . . . 3.4 1.8 5.0 1 1 111 1 . . . . . 3.4 1.8 5.0 1 1 112 1 . . . . . 3.4 1.8 5.0 1 1 113 1 . . . . . 3.4 1.8 5.0 1 1 114 2 . . . . . 3.4 1.8 5.0 1 1 114 3 . . . . . 3.4 1.8 5.0 1 1 115 1 . . . . . 3.4 1.8 5.0 1 1 116 1 . . . . . 3.4 1.8 5.0 1 1 117 1 . . . . . 3.4 1.8 5.0 1 1 118 1 . . . . . 3.4 1.8 5.0 1 1 119 2 . . . . . 3.4 1.8 5.0 1 1 119 3 . . . . . 3.4 1.8 5.0 1 1 120 1 . . . . . 3.4 1.8 5.0 1 1 121 1 . . . . . 3.4 1.8 5.0 1 1 122 1 . . . . . 3.4 1.8 5.0 1 1 123 1 . . . . . 3.4 1.8 5.0 1 1 124 1 . . . . . 3.4 1.8 5.0 1 1 125 1 . . . . . 3.4 1.8 5.0 1 1 126 1 . . . . . 3.4 1.8 5.0 1 1 127 1 . . . . . 3.4 1.8 5.0 1 1 128 1 . . . . . 3.4 1.8 5.0 1 1 129 1 . . . . . 3.4 1.8 5.0 1 1 130 1 . . . . . 3.4 1.8 5.0 1 1 131 1 . . . . . 3.4 1.8 5.0 1 1 132 1 . . . . . 3.4 1.8 5.0 1 1 133 1 . . . . . 3.4 1.8 5.0 1 1 134 1 . . . . . 3.4 1.8 5.0 1 1 135 1 . . . . . 3.4 1.8 5.0 1 1 136 1 . . . . . 3.4 1.8 5.0 1 1 137 1 . . . . . 3.4 1.8 5.0 1 1 138 1 . . . . . 3.4 1.8 5.0 1 1 139 1 . . . . . 3.4 1.8 5.0 1 1 140 1 . . . . . 3.4 1.8 5.0 1 1 141 1 . . . . . 3.4 1.8 5.0 1 1 142 1 . . . . . 3.4 1.8 5.0 1 1 143 1 . . . . . 3.4 1.8 5.0 1 1 144 1 . . . . . 3.4 1.8 5.0 1 1 145 1 . . . . . 3.4 1.8 5.0 1 1 146 1 . . . . . 3.4 1.8 5.0 1 1 147 1 . . . . . 3.4 1.8 5.0 1 1 148 1 . . . . . 3.4 1.8 5.0 1 1 149 1 . . . . . 3.4 1.8 5.0 1 1 150 1 . . . . . 3.4 1.8 5.0 1 1 151 1 . . . . . 3.4 1.8 5.0 1 1 152 1 . . . . . 3.4 1.8 5.0 1 1 153 1 . . . . . 3.4 1.8 5.0 1 1 154 1 . . . . . 3.4 1.8 5.0 1 1 155 1 . . . . . 3.4 1.8 5.0 1 1 156 1 . . . . . 3.4 1.8 5.0 1 1 157 1 . . . . . 3.4 1.8 5.0 1 1 158 1 . . . . . 3.4 1.8 5.0 1 1 159 1 . . . . . 3.4 1.8 5.0 1 1 160 1 . . . . . 3.4 1.8 5.0 1 1 161 1 . . . . . 3.4 1.8 5.0 1 1 162 1 . . . . . 3.4 1.8 5.0 1 1 163 1 . . . . . 3.4 1.8 5.0 1 1 164 1 . . . . . 3.4 1.8 5.0 1 1 165 1 . . . . . 3.4 1.8 5.0 1 1 166 1 . . . . . 3.4 1.8 5.0 1 1 167 1 . . . . . 3.4 1.8 5.0 1 1 168 1 . . . . . 3.4 1.8 5.0 1 1 169 1 . . . . . 3.4 1.8 5.0 1 1 170 1 . . . . . 3.4 1.8 5.0 1 1 171 1 . . . . . 3.4 1.8 5.0 1 1 172 1 . . . . . 3.4 1.8 5.0 1 1 173 1 . . . . . 3.4 1.8 5.0 1 1 174 1 . . . . . 3.4 1.8 5.0 1 1 175 1 . . . . . 3.4 1.8 5.0 1 1 176 1 . . . . . 3.4 1.8 5.0 1 1 177 1 . . . . . 3.4 1.8 5.0 1 1 178 1 . . . . . 3.4 1.8 5.0 1 1 179 1 . . . . . 3.4 1.8 5.0 1 1 180 1 . . . . . 3.4 1.8 5.0 1 1 181 1 . . . . . 3.4 1.8 5.0 1 1 182 1 . . . . . 3.4 1.8 5.0 1 1 183 1 . . . . . 3.4 1.8 5.0 1 1 184 1 . . . . . 3.4 1.8 5.0 1 1 185 1 . . . . . 3.4 1.8 5.0 1 1 186 2 . . . . . 3.4 1.8 5.0 1 1 186 3 . . . . . 3.4 1.8 5.0 1 1 187 1 . . . . . 3.4 1.8 5.0 1 1 188 1 . . . . . 3.4 1.8 5.0 1 1 189 1 . . . . . 3.4 1.8 5.0 1 1 190 1 . . . . . 3.4 1.8 5.0 1 1 191 1 . . . . . 3.4 1.8 5.0 1 1 192 1 . . . . . 3.4 1.8 5.0 1 1 193 1 . . . . . 3.4 1.8 5.0 1 1 194 1 . . . . . 3.4 1.8 5.0 1 1 195 1 . . . . . 3.4 1.8 5.0 1 1 196 1 . . . . . 3.4 1.8 5.0 1 1 197 1 . . . . . 3.4 1.8 5.0 1 1 198 1 . . . . . 3.4 1.8 5.0 1 1 199 1 . . . . . 3.4 1.8 5.0 1 1 200 1 . . . . . 3.4 1.8 5.0 1 1 201 2 . . . . . 3.4 1.8 5.0 1 1 201 3 . . . . . 3.4 1.8 5.0 1 1 202 1 . . . . . 3.4 1.8 5.0 1 1 203 1 . . . . . 3.4 1.8 5.0 1 1 204 1 . . . . . 3.4 1.8 5.0 1 1 205 1 . . . . . 3.4 1.8 5.0 1 1 206 1 . . . . . 3.4 1.8 5.0 1 1 207 1 . . . . . 3.4 1.8 5.0 1 1 208 1 . . . . . 3.4 1.8 5.0 1 1 209 1 . . . . . 3.4 1.8 5.0 1 1 210 1 . . . . . 3.4 1.8 5.0 1 1 211 1 . . . . . 3.4 1.8 5.0 1 1 212 1 . . . . . 3.4 1.8 5.0 1 1 213 2 . . . . . 3.4 1.8 5.0 1 1 213 3 . . . . . 3.4 1.8 5.0 1 1 214 1 . . . . . 3.4 1.8 5.0 1 1 215 1 . . . . . 3.4 1.8 5.0 1 1 216 1 . . . . . 3.4 1.8 5.0 1 1 217 1 . . . . . 3.4 1.8 5.0 1 1 218 1 . . . . . 3.4 1.8 5.0 1 1 219 1 . . . . . 3.4 1.8 5.0 1 1 220 1 . . . . . 3.4 1.8 5.0 1 1 221 1 . . . . . 3.4 1.8 5.0 1 1 222 1 . . . . . 3.4 1.8 5.0 1 1 223 1 . . . . . 3.4 1.8 5.0 1 1 224 1 . . . . . 3.4 1.8 5.0 1 1 225 1 . . . . . 3.4 1.8 5.0 1 1 226 1 . . . . . 3.4 1.8 5.0 1 1 227 1 . . . . . 3.4 1.8 5.0 1 1 228 1 . . . . . 3.4 1.8 5.0 1 1 229 1 . . . . . 3.4 1.8 5.0 1 1 230 1 . . . . . 3.4 1.8 5.0 1 1 231 1 . . . . . 3.4 1.8 5.0 1 1 232 1 . . . . . 3.4 1.8 5.0 1 1 233 1 . . . . . 3.4 1.8 5.0 1 1 234 1 . . . . . 3.4 1.8 5.0 1 1 235 1 . . . . . 3.4 1.8 5.0 1 1 236 1 . . . . . 3.4 1.8 5.0 1 1 237 1 . . . . . 3.4 1.8 5.0 1 1 238 1 . . . . . 3.4 1.8 5.0 1 1 239 1 . . . . . 3.4 1.8 5.0 1 1 240 1 . . . . . 3.4 1.8 5.0 1 1 241 1 . . . . . 3.4 1.8 5.0 1 1 242 1 . . . . . 3.4 1.8 5.0 1 1 243 1 . . . . . 3.4 1.8 5.0 1 1 244 1 . . . . . 3.4 1.8 5.0 1 1 245 1 . . . . . 3.4 1.8 5.0 1 1 246 1 . . . . . 3.4 1.8 5.0 1 1 247 1 . . . . . 3.4 1.8 5.0 1 1 248 1 . . . . . 3.4 1.8 5.0 1 1 249 1 . . . . . 3.4 1.8 5.0 1 1 250 1 . . . . . 3.4 1.8 5.0 1 1 251 1 . . . . . 3.4 1.8 5.0 1 1 252 1 . . . . . 3.4 1.8 5.0 1 1 253 1 . . . . . 3.4 1.8 5.0 1 1 254 1 . . . . . 3.4 1.8 5.0 1 1 255 1 . . . . . 3.4 1.8 5.0 1 1 256 1 . . . . . 3.4 1.8 5.0 1 1 257 1 . . . . . 3.4 1.8 5.0 1 1 258 1 . . . . . 3.4 1.8 5.0 1 1 259 1 . . . . . 3.4 1.8 5.0 1 1 260 1 . . . . . 3.4 1.8 5.0 1 1 261 1 . . . . . 3.4 1.8 5.0 1 1 262 1 . . . . . 3.4 1.8 5.0 1 1 263 1 . . . . . 3.4 1.8 5.0 1 1 264 1 . . . . . 3.4 1.8 5.0 1 1 265 1 . . . . . 3.4 1.8 5.0 1 1 266 1 . . . . . 3.4 1.8 5.0 1 1 267 1 . . . . . 3.4 1.8 5.0 1 1 268 1 . . . . . 3.4 1.8 5.0 1 1 269 1 . . . . . 3.4 1.8 5.0 1 1 270 1 . . . . . 3.4 1.8 5.0 1 1 271 1 . . . . . 3.4 1.8 5.0 1 1 272 1 . . . . . 3.4 1.8 5.0 1 1 273 1 . . . . . 3.4 1.8 5.0 1 1 274 1 . . . . . 3.4 1.8 5.0 1 1 275 2 . . . . . 3.4 1.8 5.0 1 1 275 3 . . . . . 3.4 1.8 5.0 1 1 276 1 . . . . . 3.4 1.8 5.0 1 1 277 1 . . . . . 3.4 1.8 5.0 1 1 278 1 . . . . . 3.4 1.8 5.0 1 1 279 1 . . . . . 3.4 1.8 5.0 1 1 280 1 . . . . . 3.4 1.8 5.0 1 1 281 1 . . . . . 3.4 1.8 5.0 1 1 282 1 . . . . . 3.4 1.8 5.0 1 1 283 1 . . . . . 3.4 1.8 5.0 1 1 284 1 . . . . . 3.4 1.8 5.0 1 1 285 1 . . . . . 3.4 1.8 5.0 1 1 286 1 . . . . . 3.4 1.8 5.0 1 1 287 1 . . . . . 3.4 1.8 5.0 1 1 288 1 . . . . . 3.4 1.8 5.0 1 1 289 1 . . . . . 3.4 1.8 5.0 1 1 290 1 . . . . . 3.4 1.8 5.0 1 1 291 1 . . . . . 3.4 1.8 5.0 1 1 292 1 . . . . . 3.4 1.8 5.0 1 1 293 1 . . . . . 3.4 1.8 5.0 1 1 294 1 . . . . . 3.4 1.8 5.0 1 1 295 1 . . . . . 3.4 1.8 5.0 1 1 296 1 . . . . . 3.4 1.8 5.0 1 1 297 1 . . . . . 3.4 1.8 5.0 1 1 298 1 . . . . . 3.4 1.8 5.0 1 1 299 1 . . . . . 3.4 1.8 5.0 1 1 300 1 . . . . . 3.4 1.8 5.0 1 1 301 1 . . . . . 3.4 1.8 5.0 1 1 302 1 . . . . . 3.4 1.8 5.0 1 1 303 1 . . . . . 3.4 1.8 5.0 1 1 304 1 . . . . . 3.4 1.8 5.0 1 1 305 1 . . . . . 3.4 1.8 5.0 1 1 306 1 . . . . . 3.4 1.8 5.0 1 1 307 1 . . . . . 3.4 1.8 5.0 1 1 308 1 . . . . . 3.4 1.8 5.0 1 1 309 1 . . . . . 3.4 1.8 5.0 1 1 310 1 . . . . . 3.4 1.8 5.0 1 1 311 1 . . . . . 3.4 1.8 5.0 1 1 312 1 . . . . . 3.4 1.8 5.0 1 1 313 1 . . . . . 3.4 1.8 5.0 1 1 314 1 . . . . . 3.4 1.8 5.0 1 1 315 1 . . . . . 3.4 1.8 5.0 1 1 316 1 . . . . . 3.4 1.8 5.0 1 1 317 1 . . . . . 3.4 1.8 5.0 1 1 318 1 . . . . . 3.4 1.8 5.0 1 1 319 1 . . . . . 3.4 1.8 5.0 1 1 320 1 . . . . . 3.4 1.8 5.0 1 1 321 1 . . . . . 3.4 1.8 5.0 1 1 322 1 . . . . . 3.4 1.8 5.0 1 1 323 1 . . . . . 3.4 1.8 5.0 1 1 324 1 . . . . . 3.4 1.8 5.0 1 1 325 1 . . . . . 3.4 1.8 5.0 1 1 326 1 . . . . . 3.4 1.8 5.0 1 1 327 1 . . . . . 3.4 1.8 5.0 1 1 328 1 . . . . . 3.4 1.8 5.0 1 1 329 1 . . . . . 3.4 1.8 5.0 1 1 330 1 . . . . . 3.4 1.8 5.0 1 1 331 1 . . . . . 3.4 1.8 5.0 1 1 332 1 . . . . . 3.4 1.8 5.0 1 1 333 1 . . . . . 3.4 1.8 5.0 1 1 334 1 . . . . . 3.4 1.8 5.0 1 1 335 1 . . . . . 3.4 1.8 5.0 1 1 336 2 . . . . . 3.4 1.8 5.0 1 1 336 3 . . . . . 3.4 1.8 5.0 1 1 337 1 . . . . . 3.4 1.8 5.0 1 1 338 1 . . . . . 3.4 1.8 5.0 1 1 339 1 . . . . . 3.4 1.8 5.0 1 1 340 1 . . . . . 3.4 1.8 5.0 1 1 341 1 . . . . . 3.4 1.8 5.0 1 1 342 1 . . . . . 3.4 1.8 5.0 1 1 343 1 . . . . . 3.4 1.8 5.0 1 1 344 1 . . . . . 3.4 1.8 5.0 1 1 345 1 . . . . . 3.4 1.8 5.0 1 1 346 1 . . . . . 3.4 1.8 5.0 1 1 347 1 . . . . . 3.4 1.8 5.0 1 1 348 1 . . . . . 3.4 1.8 5.0 1 1 349 1 . . . . . 3.4 1.8 5.0 1 1 350 1 . . . . . 3.4 1.8 5.0 1 1 351 1 . . . . . 3.4 1.8 5.0 1 1 352 1 . . . . . 3.4 1.8 5.0 1 1 353 1 . . . . . 3.4 1.8 5.0 1 1 354 1 . . . . . 3.4 1.8 5.0 1 1 355 1 . . . . . 3.4 1.8 5.0 1 1 356 1 . . . . . 3.4 1.8 5.0 1 1 357 1 . . . . . 3.4 1.8 5.0 1 1 358 1 . . . . . 3.4 1.8 5.0 1 1 359 1 . . . . . 3.4 1.8 5.0 1 1 360 1 . . . . . 3.4 1.8 5.0 1 1 361 1 . . . . . 3.4 1.8 5.0 1 1 362 1 . . . . . 3.4 1.8 5.0 1 1 363 1 . . . . . 3.4 1.8 5.0 1 1 364 1 . . . . . 3.4 1.8 5.0 1 1 365 1 . . . . . 3.4 1.8 5.0 1 1 366 1 . . . . . 3.4 1.8 5.0 1 1 367 2 . . . . . 3.4 1.8 5.0 1 1 367 3 . . . . . 3.4 1.8 5.0 1 1 368 1 . . . . . 3.4 1.8 5.0 1 1 369 1 . . . . . 3.4 1.8 5.0 1 1 370 1 . . . . . 3.4 1.8 5.0 1 1 371 1 . . . . . 3.4 1.8 5.0 1 1 372 1 . . . . . 3.4 1.8 5.0 1 1 373 1 . . . . . 3.4 1.8 5.0 1 1 374 1 . . . . . 3.4 1.8 5.0 1 1 375 1 . . . . . 3.4 1.8 5.0 1 1 376 1 . . . . . 3.4 1.8 5.0 1 1 377 1 . . . . . 3.4 1.8 5.0 1 1 378 2 . . . . . 3.4 1.8 5.0 1 1 378 3 . . . . . 3.4 1.8 5.0 1 1 378 4 . . . . . 3.4 1.8 5.0 1 1 379 1 . . . . . 3.4 1.8 5.0 1 1 380 1 . . . . . 3.4 1.8 5.0 1 1 381 1 . . . . . 3.4 1.8 5.0 1 1 382 1 . . . . . 3.4 1.8 5.0 1 1 383 2 . . . . . 3.4 1.8 5.0 1 1 383 3 . . . . . 3.4 1.8 5.0 1 1 384 2 . . . . . 3.4 1.8 5.0 1 1 384 3 . . . . . 3.4 1.8 5.0 1 1 385 1 . . . . . 3.4 1.8 5.0 1 1 386 1 . . . . . 3.4 1.8 5.0 1 1 387 2 . . . . . 3.4 1.8 5.0 1 1 387 3 . . . . . 3.4 1.8 5.0 1 1 388 1 . . . . . 3.4 1.8 5.0 1 1 389 1 . . . . . 3.4 1.8 5.0 1 1 390 2 . . . . . 3.4 1.8 5.0 1 1 390 3 . . . . . 3.4 1.8 5.0 1 1 390 4 . . . . . 3.4 1.8 5.0 1 1 391 1 . . . . . 3.4 1.8 5.0 1 1 392 1 . . . . . 3.4 1.8 5.0 1 1 393 2 . . . . . 3.4 1.8 5.0 1 1 393 3 . . . . . 3.4 1.8 5.0 1 1 394 2 . . . . . 3.4 1.8 5.0 1 1 394 3 . . . . . 3.4 1.8 5.0 1 1 394 4 . . . . . 3.4 1.8 5.0 1 1 395 1 . . . . . 3.4 1.8 5.0 1 1 396 2 . . . . . 3.4 1.8 5.0 1 1 396 3 . . . . . 3.4 1.8 5.0 1 1 397 1 . . . . . 3.4 1.8 5.0 1 1 398 1 . . . . . 3.4 1.8 5.0 1 1 399 1 . . . . . 3.4 1.8 5.0 1 1 400 1 . . . . . 3.4 1.8 5.0 1 1 401 1 . . . . . 3.4 1.8 5.0 1 1 402 1 . . . . . 3.4 1.8 5.0 1 1 403 1 . . . . . 3.4 1.8 5.0 1 1 404 1 . . . . . 3.4 1.8 5.0 1 1 405 1 . . . . . 3.4 1.8 5.0 1 1 406 1 . . . . . 3.4 1.8 5.0 1 1 407 1 . . . . . 3.4 1.8 5.0 1 1 408 1 . . . . . 3.4 1.8 5.0 1 1 409 1 . . . . . 3.4 1.8 5.0 1 1 410 1 . . . . . 3.4 1.8 5.0 1 1 411 1 . . . . . 3.4 1.8 5.0 1 1 412 1 . . . . . 3.4 1.8 5.0 1 1 413 1 . . . . . 3.4 1.8 5.0 1 1 414 1 . . . . . 3.4 1.8 5.0 1 1 415 1 . . . . . 3.4 1.8 5.0 1 1 416 1 . . . . . 3.4 1.8 5.0 1 1 417 1 . . . . . 3.4 1.8 5.0 1 1 418 1 . . . . . 3.4 1.8 5.0 1 1 419 1 . . . . . 3.4 1.8 5.0 1 1 420 1 . . . . . 3.4 1.8 5.0 1 1 421 1 . . . . . 3.4 1.8 5.0 1 1 422 1 . . . . . 3.4 1.8 5.0 1 1 423 1 . . . . . 3.4 1.8 5.0 1 1 424 1 . . . . . 3.4 1.8 5.0 1 1 425 1 . . . . . 3.4 1.8 5.0 1 1 426 1 . . . . . 3.4 1.8 5.0 1 1 427 1 . . . . . 3.4 1.8 5.0 1 1 428 1 . . . . . 3.4 1.8 5.0 1 1 429 1 . . . . . 3.4 1.8 5.0 1 1 430 1 . . . . . 3.4 1.8 5.0 1 1 431 1 . . . . . 3.4 1.8 5.0 1 1 432 1 . . . . . 3.4 1.8 5.0 1 1 433 1 . . . . . 3.4 1.8 5.0 1 1 434 1 . . . . . 3.4 1.8 5.0 1 1 435 1 . . . . . 3.4 1.8 5.0 1 1 436 1 . . . . . 3.4 1.8 5.0 1 1 437 1 . . . . . 3.4 1.8 5.0 1 1 438 1 . . . . . 3.4 1.8 5.0 1 1 439 1 . . . . . 3.4 1.8 5.0 1 1 440 1 . . . . . 3.4 1.8 5.0 1 1 441 1 . . . . . 3.4 1.8 5.0 1 1 442 1 . . . . . 3.4 1.8 5.0 1 1 443 1 . . . . . 3.4 1.8 5.0 1 1 444 1 . . . . . 3.4 1.8 5.0 1 1 445 1 . . . . . 3.4 1.8 5.0 1 1 446 1 . . . . . 3.4 1.8 5.0 1 1 447 1 . . . . . 3.4 1.8 5.0 1 1 448 1 . . . . . 3.4 1.8 5.0 1 1 449 2 . . . . . 3.4 1.8 5.0 1 1 449 3 . . . . . 3.4 1.8 5.0 1 1 450 1 . . . . . 3.4 1.8 5.0 1 1 451 1 . . . . . 3.4 1.8 5.0 1 1 452 1 . . . . . 3.4 1.8 5.0 1 1 453 1 . . . . . 3.4 1.8 5.0 1 1 454 1 . . . . . 3.4 1.8 5.0 1 1 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 2 _Distance_constraint_list.Constraint_type "hydrogen bond" _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 2 2 1 . . . 1 2 3 1 . . . 1 2 4 1 . . . 1 2 5 1 . . . 1 2 6 1 . . . 1 2 7 1 . . . 1 2 8 1 . . . 1 2 9 1 . . . 1 2 10 1 . . . 1 2 11 1 . . . 1 2 12 1 . . . 1 2 13 1 . . . 1 2 14 1 . . . 1 2 15 1 . . . 1 2 16 1 . . . 1 2 17 1 . . . 1 2 18 1 . . . 1 2 19 1 . . . 1 2 20 1 . . . 1 2 21 1 . . . 1 2 22 1 . . . 1 2 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 15 THR H . 15 . HN 1 2 1 1 2 1 1 27 CYS O . 27 . O 1 2 2 1 1 1 1 15 THR N . 15 . N 1 2 2 1 2 1 1 27 CYS O . 27 . O 1 2 3 1 1 1 1 15 THR O . 15 . O 1 2 3 1 2 1 1 27 CYS H . 27 . HN 1 2 4 1 1 1 1 15 THR O . 15 . O 1 2 4 1 2 1 1 27 CYS N . 27 . N 1 2 5 1 1 1 1 17 CYS H . 17 . HN 1 2 5 1 2 1 1 25 GLY O . 25 . O 1 2 6 1 1 1 1 17 CYS N . 17 . N 1 2 6 1 2 1 1 25 GLY O . 25 . O 1 2 7 1 1 1 1 17 CYS O . 17 . O 1 2 7 1 2 1 1 25 GLY H . 25 . HN 1 2 8 1 1 1 1 17 CYS O . 17 . O 1 2 8 1 2 1 1 25 GLY N . 25 . N 1 2 9 1 1 1 1 33 VAL H . 33 . HN 1 2 9 1 2 1 1 42 CYS O . 42 . O 1 2 10 1 1 1 1 33 VAL N . 33 . N 1 2 10 1 2 1 1 42 CYS O . 42 . O 1 2 11 1 1 1 1 33 VAL O . 33 . O 1 2 11 1 2 1 1 42 CYS H . 42 . HN 1 2 12 1 1 1 1 33 VAL O . 33 . O 1 2 12 1 2 1 1 42 CYS N . 42 . N 1 2 13 1 1 1 1 35 CYS O . 35 . O 1 2 13 1 2 1 1 40 HIS H . 40 . HN 1 2 14 1 1 1 1 35 CYS O . 35 . O 1 2 14 1 2 1 1 40 HIS N . 40 . N 1 2 15 1 1 1 1 47 LYS H . 47 . HN 1 2 15 1 2 1 1 55 ILE O . 55 . O 1 2 16 1 1 1 1 47 LYS N . 47 . N 1 2 16 1 2 1 1 55 ILE O . 55 . O 1 2 17 1 1 1 1 47 LYS O . 47 . O 1 2 17 1 2 1 1 55 ILE H . 55 . HN 1 2 18 1 1 1 1 47 LYS O . 47 . O 1 2 18 1 2 1 1 55 ILE N . 55 . N 1 2 19 1 1 1 1 11 HIS O . 11 . O 1 2 19 1 2 1 1 14 GLU H . 14 . HN 1 2 20 1 1 1 1 11 HIS O . 11 . O 1 2 20 1 2 1 1 14 GLU N . 14 . N 1 2 21 1 1 1 1 43 PRO O . 43 . O 1 2 21 1 2 1 1 46 TYR H . 46 . HN 1 2 22 1 1 1 1 43 PRO O . 43 . O 1 2 22 1 2 1 1 46 TYR N . 46 . N 1 2 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 1.8 1.8 2.0 1 2 2 1 . . . . . 2.7 2.7 3.0 1 2 3 1 . . . . . 1.8 1.8 2.0 1 2 4 1 . . . . . 2.7 2.7 3.0 1 2 5 1 . . . . . 1.8 1.8 2.0 1 2 6 1 . . . . . 2.7 2.7 3.0 1 2 7 1 . . . . . 1.8 1.8 2.0 1 2 8 1 . . . . . 2.7 2.7 3.0 1 2 9 1 . . . . . 1.8 1.8 2.0 1 2 10 1 . . . . . 2.7 2.7 3.0 1 2 11 1 . . . . . 1.8 1.8 2.0 1 2 12 1 . . . . . 2.7 2.7 3.0 1 2 13 1 . . . . . 1.8 1.8 2.0 1 2 14 1 . . . . . 2.7 2.7 3.0 1 2 15 1 . . . . . 1.8 1.8 2.0 1 2 16 1 . . . . . 2.7 2.7 3.0 1 2 17 1 . . . . . 1.8 1.8 2.0 1 2 18 1 . . . . . 2.7 2.7 3.0 1 2 19 1 . . . . . 1.8 1.8 2.0 1 2 20 1 . . . . . 2.7 2.7 3.0 1 2 21 1 . . . . . 1.8 1.8 2.0 1 2 22 1 . . . . . 2.7 2.7 3.0 1 2 stop_ save_ save_CNS/XPLOR_dihedral_3 _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 1 ASP C 1 1 2 VAL N 1 1 2 VAL CA 1 1 2 VAL C -150.0 -89.99999 . 1 . C . 2 . N . 2 . CA . 2 . C 1 1 2 . 1 1 9 SER C 1 1 10 CYS N 1 1 10 CYS CA 1 1 10 CYS C -150.0 -89.99999 . 9 . C . 10 . N . 10 . CA . 10 . C 1 1 3 . 1 1 11 HIS C 1 1 12 ASP N 1 1 12 ASP CA 1 1 12 ASP C -89.99999 -30.0 . 11 . C . 12 . N . 12 . CA . 12 . C 1 1 4 . 1 1 13 GLY C 1 1 14 GLU N 1 1 14 GLU CA 1 1 14 GLU C -150.0 -89.99999 . 13 . C . 14 . N . 14 . CA . 14 . C 1 1 5 . 1 1 14 GLU C 1 1 15 THR N 1 1 15 THR CA 1 1 15 THR C -150.0 -89.99999 . 14 . C . 15 . N . 15 . CA . 15 . C 1 1 6 . 1 1 15 THR C 1 1 16 CYS N 1 1 16 CYS CA 1 1 16 CYS C -89.99999 -30.0 . 15 . C . 16 . N . 16 . CA . 16 . C 1 1 7 . 1 1 16 CYS C 1 1 17 CYS N 1 1 17 CYS CA 1 1 17 CYS C -150.0 -89.99999 . 16 . C . 17 . N . 17 . CA . 17 . C 1 1 8 . 1 1 18 PRO C 1 1 19 THR N 1 1 19 THR CA 1 1 19 THR C -89.99999 -30.0 . 18 . C . 19 . N . 19 . CA . 19 . C 1 1 9 . 1 1 19 THR C 1 1 20 SER N 1 1 20 SER CA 1 1 20 SER C -150.0 -89.99999 . 19 . C . 20 . N . 20 . CA . 20 . C 1 1 10 . 1 1 21 GLN C 1 1 22 THR N 1 1 22 THR CA 1 1 22 THR C -150.0 -89.99999 . 21 . C . 22 . N . 22 . CA . 22 . C 1 1 11 . 1 1 25 GLY C 1 1 26 CYS N 1 1 26 CYS CA 1 1 26 CYS C -150.0 -89.99999 . 25 . C . 26 . N . 26 . CA . 26 . C 1 1 12 . 1 1 30 PRO C 1 1 31 LYS N 1 1 31 LYS CA 1 1 31 LYS C -89.99999 -30.0 . 30 . C . 31 . N . 31 . CA . 31 . C 1 1 13 . 1 1 33 VAL C 1 1 34 CYS N 1 1 34 CYS CA 1 1 34 CYS C -89.99999 -30.0 . 33 . C . 34 . N . 34 . CA . 34 . C 1 1 14 . 1 1 34 CYS C 1 1 35 CYS N 1 1 35 CYS CA 1 1 35 CYS C -89.99999 -30.0 . 34 . C . 35 . N . 35 . CA . 35 . C 1 1 15 . 1 1 36 ASP C 1 1 37 ASP N 1 1 37 ASP CA 1 1 37 ASP C -89.99999 -30.0 . 36 . C . 37 . N . 37 . CA . 37 . C 1 1 16 . 1 1 37 ASP C 1 1 38 MET N 1 1 38 MET CA 1 1 38 MET C -150.0 -89.99999 . 37 . C . 38 . N . 38 . CA . 38 . C 1 1 17 . 1 1 38 MET C 1 1 39 GLN N 1 1 39 GLN CA 1 1 39 GLN C -150.0 -89.99999 . 38 . C . 39 . N . 39 . CA . 39 . C 1 1 18 . 1 1 41 CYS C 1 1 42 CYS N 1 1 42 CYS CA 1 1 42 CYS C -150.0 -89.99999 . 41 . C . 42 . N . 42 . CA . 42 . C 1 1 19 . 1 1 43 PRO C 1 1 44 ALA N 1 1 44 ALA CA 1 1 44 ALA C -89.99999 -30.0 . 43 . C . 44 . N . 44 . CA . 44 . C 1 1 20 . 1 1 46 TYR C 1 1 47 LYS N 1 1 47 LYS CA 1 1 47 LYS C -150.0 -89.99999 . 46 . C . 47 . N . 47 . CA . 47 . C 1 1 21 . 1 1 47 LYS C 1 1 48 CYS N 1 1 48 CYS CA 1 1 48 CYS C -89.99999 -30.0 . 47 . C . 48 . N . 48 . CA . 48 . C 1 1 22 . 1 1 53 THR C 1 1 54 CYS N 1 1 54 CYS CA 1 1 54 CYS C -150.0 -89.99999 . 53 . C . 54 . N . 54 . CA . 54 . C 1 1 23 . 1 1 54 CYS C 1 1 55 ILE N 1 1 55 ILE CA 1 1 55 ILE C -150.0 -89.99999 . 54 . C . 55 . N . 55 . CA . 55 . C 1 1 stop_ save_ save_CNS/XPLOR_dipolar_coupling_5 _RDC_constraint_list.Sf_category RDC_constraints _RDC_constraint_list.Entry_ID 1 _RDC_constraint_list.ID 1 _RDC_constraint_list.Constraint_file_ID . _RDC_constraint_list.Block_ID . loop_ _RDC_constraint.ID _RDC_constraint.Entity_assembly_ID_1 _RDC_constraint.Entity_ID_1 _RDC_constraint.Comp_index_ID_1 _RDC_constraint.Comp_ID_1 _RDC_constraint.Atom_ID_1 _RDC_constraint.Entity_assembly_ID_2 _RDC_constraint.Entity_ID_2 _RDC_constraint.Comp_index_ID_2 _RDC_constraint.Comp_ID_2 _RDC_constraint.Atom_ID_2 _RDC_constraint.RDC_val _RDC_constraint.RDC_lower_bound _RDC_constraint.RDC_upper_bound _RDC_constraint.RDC_val_err _RDC_constraint.Auth_asym_ID_1 _RDC_constraint.Auth_seq_ID_1 _RDC_constraint.Auth_comp_ID_1 _RDC_constraint.Auth_atom_ID_1 _RDC_constraint.Auth_asym_ID_2 _RDC_constraint.Auth_seq_ID_2 _RDC_constraint.Auth_comp_ID_2 _RDC_constraint.Auth_atom_ID_2 _RDC_constraint.Entry_ID _RDC_constraint.RDC_constraint_list_ID 1 1 1 2 VAL N 1 1 2 VAL H 10.0 . . . . 2 . HN . 2 . N 1 1 2 1 1 3 GLN N 1 1 3 GLN H 14.0 . . . . 3 . HN . 3 . N 1 1 3 1 1 4 CYS N 1 1 4 CYS H -5.1 . . . . 4 . HN . 4 . N 1 1 4 1 1 5 GLY N 1 1 5 GLY H -3.0 . . . . 5 . HN . 5 . N 1 1 5 1 1 6 GLY N 1 1 6 GLY H 7.0 . . . . 6 . HN . 6 . N 1 1 6 1 1 7 GLY N 1 1 7 GLY H 6.1 . . . . 7 . HN . 7 . N 1 1 7 1 1 8 PHE N 1 1 8 PHE H -4.4 . . . . 8 . HN . 8 . N 1 1 8 1 1 10 CYS N 1 1 10 CYS H 12.2 . . . . 10 . HN . 10 . N 1 1 9 1 1 11 HIS N 1 1 11 HIS H 17.7 . . . . 11 . HN . 11 . N 1 1 10 1 1 12 ASP N 1 1 12 ASP H -2.5 . . . . 12 . HN . 12 . N 1 1 11 1 1 13 GLY N 1 1 13 GLY H 3.1 . . . . 13 . HN . 13 . N 1 1 12 1 1 14 GLU N 1 1 14 GLU H 2.4 . . . . 14 . HN . 14 . N 1 1 13 1 1 15 THR N 1 1 15 THR H 13.5 . . . . 15 . HN . 15 . N 1 1 14 1 1 16 CYS N 1 1 16 CYS H 14.4 . . . . 16 . HN . 16 . N 1 1 15 1 1 17 CYS N 1 1 17 CYS H -1.5 . . . . 17 . HN . 17 . N 1 1 16 1 1 19 THR N 1 1 19 THR H -2.5 . . . . 19 . HN . 19 . N 1 1 17 1 1 20 SER N 1 1 20 SER H 18.2 . . . . 20 . HN . 20 . N 1 1 18 1 1 22 THR N 1 1 22 THR H 13.5 . . . . 22 . HN . 22 . N 1 1 19 1 1 23 THR N 1 1 23 THR H -0.81 . . . . 23 . HN . 23 . N 1 1 20 1 1 25 GLY N 1 1 25 GLY H -4.0 . . . . 25 . HN . 25 . N 1 1 21 1 1 26 CYS N 1 1 26 CYS H 5.4 . . . . 26 . HN . 26 . N 1 1 22 1 1 27 CYS N 1 1 27 CYS H 9.9 . . . . 27 . HN . 27 . N 1 1 23 1 1 31 LYS N 1 1 31 LYS H -9.8 . . . . 31 . HN . 31 . N 1 1 24 1 1 33 VAL N 1 1 33 VAL H -4.8 . . . . 33 . HN . 33 . N 1 1 25 1 1 34 CYS N 1 1 34 CYS H 9.6 . . . . 34 . HN . 34 . N 1 1 26 1 1 35 CYS N 1 1 35 CYS H -5.5 . . . . 35 . HN . 35 . N 1 1 27 1 1 36 ASP N 1 1 36 ASP H -9.0 . . . . 36 . HN . 36 . N 1 1 28 1 1 37 ASP N 1 1 37 ASP H -9.8 . . . . 37 . HN . 37 . N 1 1 29 1 1 38 MET N 1 1 38 MET H 2.4 . . . . 38 . HN . 38 . N 1 1 30 1 1 39 GLN N 1 1 39 GLN H -7.6 . . . . 39 . HN . 39 . N 1 1 31 1 1 40 HIS N 1 1 40 HIS H -4.2 . . . . 40 . HN . 40 . N 1 1 32 1 1 41 CYS N 1 1 41 CYS H 0.4 . . . . 41 . HN . 41 . N 1 1 33 1 1 42 CYS N 1 1 42 CYS H 0.6 . . . . 42 . HN . 42 . N 1 1 34 1 1 44 ALA N 1 1 44 ALA H -1.6 . . . . 44 . HN . 44 . N 1 1 35 1 1 45 GLY N 1 1 45 GLY H -10.2 . . . . 45 . HN . 45 . N 1 1 36 1 1 46 TYR N 1 1 46 TYR H -7.5 . . . . 46 . HN . 46 . N 1 1 37 1 1 47 LYS N 1 1 47 LYS H -5.4 . . . . 47 . HN . 47 . N 1 1 38 1 1 48 CYS N 1 1 48 CYS H -1.1 . . . . 48 . HN . 48 . N 1 1 39 1 1 49 GLY N 1 1 49 GLY H -4.5 . . . . 49 . HN . 49 . N 1 1 40 1 1 52 GLY N 1 1 52 GLY H -4.5 . . . . 52 . HN . 52 . N 1 1 41 1 1 53 THR N 1 1 53 THR H 0.2 . . . . 53 . HN . 53 . N 1 1 42 1 1 54 CYS N 1 1 54 CYS H -4.0 . . . . 54 . HN . 54 . N 1 1 43 1 1 55 ILE N 1 1 55 ILE H -9.2 . . . . 55 . HN . 55 . N 1 1 44 1 1 56 SER N 1 1 56 SER H 3.2 . . . . 56 . HN . 56 . N 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 ASP C C 1.805 14.875 -2.465 1.00 . A A . 1 ASP C 1 1 1 2 1 1 1 ASP CA C 2.815 15.183 -3.567 1.00 . A A . 1 ASP CA 1 1 1 3 1 1 1 ASP CB C 4.081 14.344 -3.375 1.00 . A A . 1 ASP CB 1 1 1 4 1 1 1 ASP CG C 5.263 15.174 -2.916 1.00 . A A . 1 ASP CG 1 1 1 5 1 1 1 ASP H1 H 3.545 16.895 -2.621 1.00 . A A . 1 ASP H1 1 1 1 6 1 1 1 ASP H2 H 2.368 17.210 -3.795 1.00 . A A . 1 ASP H2 1 1 1 7 1 1 1 ASP H3 H 3.939 16.797 -4.264 1.00 . A A . 1 ASP H3 1 1 1 8 1 1 1 ASP HA H 2.374 14.948 -4.524 1.00 . A A . 1 ASP HA 1 1 1 9 1 1 1 ASP HB2 H 3.891 13.582 -2.634 1.00 . A A . 1 ASP HB2 1 1 1 10 1 1 1 ASP HB3 H 4.337 13.872 -4.313 1.00 . A A . 1 ASP HB3 1 1 1 11 1 1 1 ASP N N 3.193 16.621 -3.561 1.00 . A A . 1 ASP N 1 1 1 12 1 1 1 ASP O O 1.184 15.781 -1.908 1.00 . A A . 1 ASP O 1 1 1 13 1 1 1 ASP OD1 O 5.536 15.196 -1.697 1.00 . A A . 1 ASP OD1 1 1 1 14 1 1 1 ASP OD2 O 5.917 15.802 -3.775 1.00 . A A . 1 ASP OD2 1 1 1 15 1 1 2 VAL C C 1.454 12.646 0.108 1.00 . A A . 2 VAL C 1 1 1 16 1 1 2 VAL CA C 0.712 13.163 -1.120 1.00 . A A . 2 VAL CA 1 1 1 17 1 1 2 VAL CB C -0.233 12.061 -1.635 1.00 . A A . 2 VAL CB 1 1 1 18 1 1 2 VAL CG1 C -1.448 11.933 -0.729 1.00 . A A . 2 VAL CG1 1 1 1 19 1 1 2 VAL CG2 C -0.656 12.342 -3.069 1.00 . A A . 2 VAL CG2 1 1 1 20 1 1 2 VAL H H 2.170 12.915 -2.633 1.00 . A A . 2 VAL H 1 1 1 21 1 1 2 VAL HA H 0.115 14.017 -0.835 1.00 . A A . 2 VAL HA 1 1 1 22 1 1 2 VAL HB H 0.300 11.121 -1.617 1.00 . A A . 2 VAL HB 1 1 1 23 1 1 2 VAL HG11 H -2.340 12.177 -1.288 1.00 . A A . 2 VAL HG11 1 1 1 24 1 1 2 VAL HG12 H -1.349 12.613 0.104 1.00 . A A . 2 VAL HG12 1 1 1 25 1 1 2 VAL HG13 H -1.519 10.920 -0.362 1.00 . A A . 2 VAL HG13 1 1 1 26 1 1 2 VAL HG21 H -1.620 12.828 -3.072 1.00 . A A . 2 VAL HG21 1 1 1 27 1 1 2 VAL HG22 H -0.720 11.412 -3.614 1.00 . A A . 2 VAL HG22 1 1 1 28 1 1 2 VAL HG23 H 0.073 12.985 -3.540 1.00 . A A . 2 VAL HG23 1 1 1 29 1 1 2 VAL N N 1.646 13.591 -2.155 1.00 . A A . 2 VAL N 1 1 1 30 1 1 2 VAL O O 2.236 11.699 0.019 1.00 . A A . 2 VAL O 1 1 1 31 1 1 3 GLN C C 1.178 11.644 3.097 1.00 . A A . 3 GLN C 1 1 1 32 1 1 3 GLN CA C 1.850 12.877 2.500 1.00 . A A . 3 GLN CA 1 1 1 33 1 1 3 GLN CB C 1.815 14.029 3.505 1.00 . A A . 3 GLN CB 1 1 1 34 1 1 3 GLN CD C 3.145 15.958 4.455 1.00 . A A . 3 GLN CD 1 1 1 35 1 1 3 GLN CG C 2.862 15.099 3.238 1.00 . A A . 3 GLN CG 1 1 1 36 1 1 3 GLN H H 0.571 14.022 1.260 1.00 . A A . 3 GLN H 1 1 1 37 1 1 3 GLN HA H 2.879 12.638 2.277 1.00 . A A . 3 GLN HA 1 1 1 38 1 1 3 GLN HB2 H 0.840 14.492 3.471 1.00 . A A . 3 GLN HB2 1 1 1 39 1 1 3 GLN HB3 H 1.981 13.633 4.495 1.00 . A A . 3 GLN HB3 1 1 1 40 1 1 3 GLN HE21 H 4.627 16.870 3.494 1.00 . A A . 3 GLN HE21 1 1 1 41 1 1 3 GLN HE22 H 4.344 17.400 5.114 1.00 . A A . 3 GLN HE22 1 1 1 42 1 1 3 GLN HG2 H 3.780 14.618 2.936 1.00 . A A . 3 GLN HG2 1 1 1 43 1 1 3 GLN HG3 H 2.511 15.736 2.439 1.00 . A A . 3 GLN HG3 1 1 1 44 1 1 3 GLN N N 1.204 13.273 1.253 1.00 . A A . 3 GLN N 1 1 1 45 1 1 3 GLN NE2 N 4.139 16.831 4.343 1.00 . A A . 3 GLN NE2 1 1 1 46 1 1 3 GLN O O 0.016 11.692 3.502 1.00 . A A . 3 GLN O 1 1 1 47 1 1 3 GLN OE1 O 2.478 15.839 5.483 1.00 . A A . 3 GLN OE1 1 1 1 48 1 1 4 CYS C C 0.929 9.461 5.126 1.00 . A A . 4 CYS C 1 1 1 49 1 1 4 CYS CA C 1.403 9.288 3.687 1.00 . A A . 4 CYS CA 1 1 1 50 1 1 4 CYS CB C 2.479 8.204 3.619 1.00 . A A . 4 CYS CB 1 1 1 51 1 1 4 CYS H H 2.836 10.568 2.802 1.00 . A A . 4 CYS H 1 1 1 52 1 1 4 CYS HA H 0.563 8.985 3.079 1.00 . A A . 4 CYS HA 1 1 1 53 1 1 4 CYS HB2 H 3.420 8.620 3.946 1.00 . A A . 4 CYS HB2 1 1 1 54 1 1 4 CYS HB3 H 2.203 7.390 4.273 1.00 . A A . 4 CYS HB3 1 1 1 55 1 1 4 CYS N N 1.919 10.541 3.145 1.00 . A A . 4 CYS N 1 1 1 56 1 1 4 CYS O O 0.000 8.786 5.569 1.00 . A A . 4 CYS O 1 1 1 57 1 1 4 CYS SG S 2.730 7.515 1.951 1.00 . A A . 4 CYS SG 1 1 1 58 1 1 5 GLY C C 2.396 10.697 8.150 1.00 . A A . 5 GLY C 1 1 1 59 1 1 5 GLY CA C 1.196 10.618 7.229 1.00 . A A . 5 GLY CA 1 1 1 60 1 1 5 GLY H H 2.302 10.882 5.440 1.00 . A A . 5 GLY H 1 1 1 61 1 1 5 GLY HA2 H 0.653 11.549 7.283 1.00 . A A . 5 GLY HA2 1 1 1 62 1 1 5 GLY HA3 H 0.552 9.819 7.564 1.00 . A A . 5 GLY HA3 1 1 1 63 1 1 5 GLY N N 1.570 10.372 5.849 1.00 . A A . 5 GLY N 1 1 1 64 1 1 5 GLY O O 2.610 9.810 8.977 1.00 . A A . 5 GLY O 1 1 1 65 1 1 6 GLY C C 5.312 10.762 8.725 1.00 . A A . 6 GLY C 1 1 1 66 1 1 6 GLY CA C 4.357 11.932 8.838 1.00 . A A . 6 GLY CA 1 1 1 67 1 1 6 GLY H H 2.958 12.435 7.331 1.00 . A A . 6 GLY H 1 1 1 68 1 1 6 GLY HA2 H 4.870 12.833 8.536 1.00 . A A . 6 GLY HA2 1 1 1 69 1 1 6 GLY HA3 H 4.047 12.032 9.867 1.00 . A A . 6 GLY HA3 1 1 1 70 1 1 6 GLY N N 3.180 11.761 8.007 1.00 . A A . 6 GLY N 1 1 1 71 1 1 6 GLY O O 5.462 9.981 9.665 1.00 . A A . 6 GLY O 1 1 1 72 1 1 7 GLY C C 7.205 9.327 5.891 1.00 . A A . 7 GLY C 1 1 1 73 1 1 7 GLY CA C 6.894 9.554 7.358 1.00 . A A . 7 GLY CA 1 1 1 74 1 1 7 GLY H H 5.797 11.294 6.858 1.00 . A A . 7 GLY H 1 1 1 75 1 1 7 GLY HA2 H 7.814 9.780 7.877 1.00 . A A . 7 GLY HA2 1 1 1 76 1 1 7 GLY HA3 H 6.476 8.647 7.769 1.00 . A A . 7 GLY HA3 1 1 1 77 1 1 7 GLY N N 5.958 10.640 7.570 1.00 . A A . 7 GLY N 1 1 1 78 1 1 7 GLY O O 8.209 9.822 5.380 1.00 . A A . 7 GLY O 1 1 1 79 1 1 8 PHE C C 5.783 9.247 2.910 1.00 . A A . 8 PHE C 1 1 1 80 1 1 8 PHE CA C 6.543 8.271 3.800 1.00 . A A . 8 PHE CA 1 1 1 81 1 1 8 PHE CB C 6.089 6.846 3.494 1.00 . A A . 8 PHE CB 1 1 1 82 1 1 8 PHE CD1 C 7.808 5.360 2.425 1.00 . A A . 8 PHE CD1 1 1 1 83 1 1 8 PHE CD2 C 7.607 5.335 4.801 1.00 . A A . 8 PHE CD2 1 1 1 84 1 1 8 PHE CE1 C 8.819 4.420 2.498 1.00 . A A . 8 PHE CE1 1 1 1 85 1 1 8 PHE CE2 C 8.618 4.396 4.880 1.00 . A A . 8 PHE CE2 1 1 1 86 1 1 8 PHE CG C 7.192 5.828 3.574 1.00 . A A . 8 PHE CG 1 1 1 87 1 1 8 PHE CZ C 9.224 3.938 3.727 1.00 . A A . 8 PHE CZ 1 1 1 88 1 1 8 PHE H H 5.566 8.195 5.677 1.00 . A A . 8 PHE H 1 1 1 89 1 1 8 PHE HA H 7.597 8.355 3.585 1.00 . A A . 8 PHE HA 1 1 1 90 1 1 8 PHE HB2 H 5.324 6.560 4.200 1.00 . A A . 8 PHE HB2 1 1 1 91 1 1 8 PHE HB3 H 5.678 6.816 2.496 1.00 . A A . 8 PHE HB3 1 1 1 92 1 1 8 PHE HD1 H 7.493 5.737 1.463 1.00 . A A . 8 PHE HD1 1 1 1 93 1 1 8 PHE HD2 H 7.133 5.693 5.703 1.00 . A A . 8 PHE HD2 1 1 1 94 1 1 8 PHE HE1 H 9.291 4.063 1.594 1.00 . A A . 8 PHE HE1 1 1 1 95 1 1 8 PHE HE2 H 8.932 4.020 5.842 1.00 . A A . 8 PHE HE2 1 1 1 96 1 1 8 PHE HZ H 10.013 3.203 3.786 1.00 . A A . 8 PHE HZ 1 1 1 97 1 1 8 PHE N N 6.346 8.569 5.214 1.00 . A A . 8 PHE N 1 1 1 98 1 1 8 PHE O O 5.168 10.200 3.391 1.00 . A A . 8 PHE O 1 1 1 99 1 1 9 SER C C 5.034 9.094 -0.708 1.00 . A A . 9 SER C 1 1 1 100 1 1 9 SER CA C 5.152 9.827 0.625 1.00 . A A . 9 SER CA 1 1 1 101 1 1 9 SER CB C 5.907 11.144 0.434 1.00 . A A . 9 SER CB 1 1 1 102 1 1 9 SER H H 6.339 8.212 1.297 1.00 . A A . 9 SER H 1 1 1 103 1 1 9 SER HA H 4.161 10.038 0.997 1.00 . A A . 9 SER HA 1 1 1 104 1 1 9 SER HB2 H 5.959 11.377 -0.620 1.00 . A A . 9 SER HB2 1 1 1 105 1 1 9 SER HB3 H 5.384 11.934 0.952 1.00 . A A . 9 SER HB3 1 1 1 106 1 1 9 SER HG H 7.567 10.172 0.802 1.00 . A A . 9 SER HG 1 1 1 107 1 1 9 SER N N 5.831 8.991 1.607 1.00 . A A . 9 SER N 1 1 1 108 1 1 9 SER O O 5.848 8.225 -1.022 1.00 . A A . 9 SER O 1 1 1 109 1 1 9 SER OG O 7.225 11.057 0.947 1.00 . A A . 9 SER OG 1 1 1 110 1 1 10 CYS C C 3.485 9.866 -3.855 1.00 . A A . 10 CYS C 1 1 1 111 1 1 10 CYS CA C 3.805 8.820 -2.790 1.00 . A A . 10 CYS CA 1 1 1 112 1 1 10 CYS CB C 2.678 7.788 -2.703 1.00 . A A . 10 CYS CB 1 1 1 113 1 1 10 CYS H H 3.405 10.149 -1.191 1.00 . A A . 10 CYS H 1 1 1 114 1 1 10 CYS HA H 4.719 8.316 -3.066 1.00 . A A . 10 CYS HA 1 1 1 115 1 1 10 CYS HB2 H 1.973 8.099 -1.947 1.00 . A A . 10 CYS HB2 1 1 1 116 1 1 10 CYS HB3 H 2.176 7.734 -3.657 1.00 . A A . 10 CYS HB3 1 1 1 117 1 1 10 CYS N N 4.020 9.448 -1.491 1.00 . A A . 10 CYS N 1 1 1 118 1 1 10 CYS O O 3.276 11.040 -3.545 1.00 . A A . 10 CYS O 1 1 1 119 1 1 10 CYS SG S 3.241 6.105 -2.276 1.00 . A A . 10 CYS SG 1 1 1 120 1 1 11 HIS C C 1.696 10.517 -6.462 1.00 . A A . 11 HIS C 1 1 1 121 1 1 11 HIS CA C 3.194 10.335 -6.230 1.00 . A A . 11 HIS CA 1 1 1 122 1 1 11 HIS CB C 3.858 9.811 -7.505 1.00 . A A . 11 HIS CB 1 1 1 123 1 1 11 HIS CD2 C 5.016 11.233 -9.340 1.00 . A A . 11 HIS CD2 1 1 1 124 1 1 11 HIS CE1 C 6.606 12.109 -8.110 1.00 . A A . 11 HIS CE1 1 1 1 125 1 1 11 HIS CG C 4.866 10.756 -8.082 1.00 . A A . 11 HIS CG 1 1 1 126 1 1 11 HIS H H 3.659 8.489 -5.289 1.00 . A A . 11 HIS H 1 1 1 127 1 1 11 HIS HA H 3.623 11.295 -5.987 1.00 . A A . 11 HIS HA 1 1 1 128 1 1 11 HIS HB2 H 4.363 8.882 -7.284 1.00 . A A . 11 HIS HB2 1 1 1 129 1 1 11 HIS HB3 H 3.099 9.635 -8.253 1.00 . A A . 11 HIS HB3 1 1 1 130 1 1 11 HIS HD1 H 6.038 11.174 -6.381 1.00 . A A . 11 HIS HD1 1 1 1 131 1 1 11 HIS HD2 H 4.395 10.998 -10.194 1.00 . A A . 11 HIS HD2 1 1 1 132 1 1 11 HIS HE1 H 7.466 12.682 -7.798 1.00 . A A . 11 HIS HE1 1 1 1 133 1 1 11 HIS HE2 H 6.418 12.608 -10.087 1.00 . A A . 11 HIS HE2 1 1 1 134 1 1 11 HIS N N 3.466 9.434 -5.113 1.00 . A A . 11 HIS N 1 1 1 135 1 1 11 HIS ND1 N 5.878 11.323 -7.336 1.00 . A A . 11 HIS ND1 1 1 1 136 1 1 11 HIS NE2 N 6.104 12.071 -9.330 1.00 . A A . 11 HIS NE2 1 1 1 137 1 1 11 HIS O O 0.869 9.793 -5.902 1.00 . A A . 11 HIS O 1 1 1 138 1 1 12 ASP C C -0.720 10.567 -8.216 1.00 . A A . 12 ASP C 1 1 1 139 1 1 12 ASP CA C -0.035 11.788 -7.616 1.00 . A A . 12 ASP CA 1 1 1 140 1 1 12 ASP CB C -0.120 12.967 -8.588 1.00 . A A . 12 ASP CB 1 1 1 141 1 1 12 ASP CG C -0.962 14.104 -8.043 1.00 . A A . 12 ASP CG 1 1 1 142 1 1 12 ASP H H 2.065 12.035 -7.710 1.00 . A A . 12 ASP H 1 1 1 143 1 1 12 ASP HA H -0.537 12.053 -6.698 1.00 . A A . 12 ASP HA 1 1 1 144 1 1 12 ASP HB2 H 0.875 13.341 -8.779 1.00 . A A . 12 ASP HB2 1 1 1 145 1 1 12 ASP HB3 H -0.559 12.631 -9.516 1.00 . A A . 12 ASP HB3 1 1 1 146 1 1 12 ASP N N 1.357 11.496 -7.297 1.00 . A A . 12 ASP N 1 1 1 147 1 1 12 ASP O O -0.187 9.927 -9.124 1.00 . A A . 12 ASP O 1 1 1 148 1 1 12 ASP OD1 O -2.156 13.876 -7.760 1.00 . A A . 12 ASP OD1 1 1 1 149 1 1 12 ASP OD2 O -0.425 15.223 -7.899 1.00 . A A . 12 ASP OD2 1 1 1 150 1 1 13 GLY C C -2.371 7.852 -7.376 1.00 . A A . 13 GLY C 1 1 1 151 1 1 13 GLY CA C -2.637 9.100 -8.193 1.00 . A A . 13 GLY CA 1 1 1 152 1 1 13 GLY H H -2.274 10.793 -6.978 1.00 . A A . 13 GLY H 1 1 1 153 1 1 13 GLY HA2 H -3.694 9.321 -8.159 1.00 . A A . 13 GLY HA2 1 1 1 154 1 1 13 GLY HA3 H -2.351 8.914 -9.218 1.00 . A A . 13 GLY HA3 1 1 1 155 1 1 13 GLY N N -1.901 10.247 -7.701 1.00 . A A . 13 GLY N 1 1 1 156 1 1 13 GLY O O -3.051 6.839 -7.540 1.00 . A A . 13 GLY O 1 1 1 157 1 1 14 GLU C C -1.790 6.849 -4.321 1.00 . A A . 14 GLU C 1 1 1 158 1 1 14 GLU CA C -1.036 6.790 -5.644 1.00 . A A . 14 GLU CA 1 1 1 159 1 1 14 GLU CB C 0.468 6.747 -5.379 1.00 . A A . 14 GLU CB 1 1 1 160 1 1 14 GLU CD C 1.281 5.847 -7.596 1.00 . A A . 14 GLU CD 1 1 1 161 1 1 14 GLU CG C 1.316 7.002 -6.614 1.00 . A A . 14 GLU CG 1 1 1 162 1 1 14 GLU H H -0.875 8.766 -6.402 1.00 . A A . 14 GLU H 1 1 1 163 1 1 14 GLU HA H -1.324 5.890 -6.167 1.00 . A A . 14 GLU HA 1 1 1 164 1 1 14 GLU HB2 H 0.710 7.493 -4.640 1.00 . A A . 14 GLU HB2 1 1 1 165 1 1 14 GLU HB3 H 0.724 5.773 -4.990 1.00 . A A . 14 GLU HB3 1 1 1 166 1 1 14 GLU HG2 H 0.948 7.887 -7.112 1.00 . A A . 14 GLU HG2 1 1 1 167 1 1 14 GLU HG3 H 2.339 7.164 -6.305 1.00 . A A . 14 GLU HG3 1 1 1 168 1 1 14 GLU N N -1.380 7.926 -6.490 1.00 . A A . 14 GLU N 1 1 1 169 1 1 14 GLU O O -2.485 7.823 -4.032 1.00 . A A . 14 GLU O 1 1 1 170 1 1 14 GLU OE1 O 1.178 6.106 -8.813 1.00 . A A . 14 GLU OE1 1 1 1 171 1 1 14 GLU OE2 O 1.357 4.684 -7.146 1.00 . A A . 14 GLU OE2 1 1 1 172 1 1 15 THR C C -1.388 5.165 -1.165 1.00 . A A . 15 THR C 1 1 1 173 1 1 15 THR CA C -2.324 5.709 -2.237 1.00 . A A . 15 THR CA 1 1 1 174 1 1 15 THR CB C -3.569 4.809 -2.320 1.00 . A A . 15 THR CB 1 1 1 175 1 1 15 THR CG2 C -4.507 5.070 -1.151 1.00 . A A . 15 THR CG2 1 1 1 176 1 1 15 THR H H -1.090 5.045 -3.821 1.00 . A A . 15 THR H 1 1 1 177 1 1 15 THR HA H -2.640 6.704 -1.957 1.00 . A A . 15 THR HA 1 1 1 178 1 1 15 THR HB H -3.252 3.775 -2.286 1.00 . A A . 15 THR HB 1 1 1 179 1 1 15 THR HG1 H -3.674 4.846 -4.289 1.00 . A A . 15 THR HG1 1 1 1 180 1 1 15 THR HG21 H -5.429 4.527 -1.301 1.00 . A A . 15 THR HG21 1 1 1 181 1 1 15 THR HG22 H -4.718 6.127 -1.087 1.00 . A A . 15 THR HG22 1 1 1 182 1 1 15 THR HG23 H -4.040 4.740 -0.235 1.00 . A A . 15 THR HG23 1 1 1 183 1 1 15 THR N N -1.653 5.794 -3.527 1.00 . A A . 15 THR N 1 1 1 184 1 1 15 THR O O -0.658 4.202 -1.394 1.00 . A A . 15 THR O 1 1 1 185 1 1 15 THR OG1 O -4.257 5.047 -3.552 1.00 . A A . 15 THR OG1 1 1 1 186 1 1 16 CYS C C -1.278 4.328 1.983 1.00 . A A . 16 CYS C 1 1 1 187 1 1 16 CYS CA C -0.565 5.360 1.113 1.00 . A A . 16 CYS CA 1 1 1 188 1 1 16 CYS CB C -0.148 6.568 1.951 1.00 . A A . 16 CYS CB 1 1 1 189 1 1 16 CYS H H -2.017 6.548 0.133 1.00 . A A . 16 CYS H 1 1 1 190 1 1 16 CYS HA H 0.319 4.905 0.692 1.00 . A A . 16 CYS HA 1 1 1 191 1 1 16 CYS HB2 H -1.032 7.101 2.269 1.00 . A A . 16 CYS HB2 1 1 1 192 1 1 16 CYS HB3 H 0.393 6.224 2.822 1.00 . A A . 16 CYS HB3 1 1 1 193 1 1 16 CYS N N -1.413 5.786 0.008 1.00 . A A . 16 CYS N 1 1 1 194 1 1 16 CYS O O -2.322 4.610 2.571 1.00 . A A . 16 CYS O 1 1 1 195 1 1 16 CYS SG S 0.921 7.745 1.062 1.00 . A A . 16 CYS SG 1 1 1 196 1 1 17 CYS C C -0.323 1.660 3.983 1.00 . A A . 17 CYS C 1 1 1 197 1 1 17 CYS CA C -1.273 2.050 2.854 1.00 . A A . 17 CYS CA 1 1 1 198 1 1 17 CYS CB C -1.559 0.834 1.970 1.00 . A A . 17 CYS CB 1 1 1 199 1 1 17 CYS H H 0.129 2.971 1.567 1.00 . A A . 17 CYS H 1 1 1 200 1 1 17 CYS HA H -2.200 2.402 3.282 1.00 . A A . 17 CYS HA 1 1 1 201 1 1 17 CYS HB2 H -0.724 0.680 1.302 1.00 . A A . 17 CYS HB2 1 1 1 202 1 1 17 CYS HB3 H -1.678 -0.037 2.597 1.00 . A A . 17 CYS HB3 1 1 1 203 1 1 17 CYS N N -0.702 3.131 2.058 1.00 . A A . 17 CYS N 1 1 1 204 1 1 17 CYS O O 0.836 1.328 3.740 1.00 . A A . 17 CYS O 1 1 1 205 1 1 17 CYS SG S -3.059 0.993 0.948 1.00 . A A . 17 CYS SG 1 1 1 206 1 1 18 PRO C C -0.044 -0.121 6.744 1.00 . A A . 18 PRO C 1 1 1 207 1 1 18 PRO CA C 0.016 1.364 6.400 1.00 . A A . 18 PRO CA 1 1 1 208 1 1 18 PRO CB C -0.636 2.195 7.500 1.00 . A A . 18 PRO CB 1 1 1 209 1 1 18 PRO CD C -2.164 2.096 5.632 1.00 . A A . 18 PRO CD 1 1 1 210 1 1 18 PRO CG C -2.085 2.226 7.137 1.00 . A A . 18 PRO CG 1 1 1 211 1 1 18 PRO HA H 1.045 1.669 6.270 1.00 . A A . 18 PRO HA 1 1 1 212 1 1 18 PRO HB2 H -0.475 1.719 8.457 1.00 . A A . 18 PRO HB2 1 1 1 213 1 1 18 PRO HB3 H -0.210 3.187 7.508 1.00 . A A . 18 PRO HB3 1 1 1 214 1 1 18 PRO HD2 H -2.875 1.332 5.356 1.00 . A A . 18 PRO HD2 1 1 1 215 1 1 18 PRO HD3 H -2.436 3.039 5.185 1.00 . A A . 18 PRO HD3 1 1 1 216 1 1 18 PRO HG2 H -2.597 1.400 7.609 1.00 . A A . 18 PRO HG2 1 1 1 217 1 1 18 PRO HG3 H -2.520 3.163 7.453 1.00 . A A . 18 PRO HG3 1 1 1 218 1 1 18 PRO N N -0.798 1.703 5.238 1.00 . A A . 18 PRO N 1 1 1 219 1 1 18 PRO O O -0.598 -0.507 7.774 1.00 . A A . 18 PRO O 1 1 1 220 1 1 19 THR C C 1.569 -2.781 7.157 1.00 . A A . 19 THR C 1 1 1 221 1 1 19 THR CA C 0.538 -2.394 6.100 1.00 . A A . 19 THR CA 1 1 1 222 1 1 19 THR CB C 0.837 -3.160 4.797 1.00 . A A . 19 THR CB 1 1 1 223 1 1 19 THR CG2 C 2.178 -2.739 4.214 1.00 . A A . 19 THR CG2 1 1 1 224 1 1 19 THR H H 0.957 -0.592 5.075 1.00 . A A . 19 THR H 1 1 1 225 1 1 19 THR HA H -0.443 -2.684 6.446 1.00 . A A . 19 THR HA 1 1 1 226 1 1 19 THR HB H 0.063 -2.933 4.078 1.00 . A A . 19 THR HB 1 1 1 227 1 1 19 THR HG1 H 0.297 -4.762 5.813 1.00 . A A . 19 THR HG1 1 1 1 228 1 1 19 THR HG21 H 2.898 -3.531 4.358 1.00 . A A . 19 THR HG21 1 1 1 229 1 1 19 THR HG22 H 2.522 -1.845 4.713 1.00 . A A . 19 THR HG22 1 1 1 230 1 1 19 THR HG23 H 2.065 -2.541 3.158 1.00 . A A . 19 THR HG23 1 1 1 231 1 1 19 THR N N 0.529 -0.952 5.879 1.00 . A A . 19 THR N 1 1 1 232 1 1 19 THR O O 1.804 -3.963 7.407 1.00 . A A . 19 THR O 1 1 1 233 1 1 19 THR OG1 O 0.842 -4.571 5.047 1.00 . A A . 19 THR OG1 1 1 1 234 1 1 20 SER C C 3.009 -0.999 9.952 1.00 . A A . 20 SER C 1 1 1 235 1 1 20 SER CA C 3.177 -2.001 8.813 1.00 . A A . 20 SER CA 1 1 1 236 1 1 20 SER CB C 4.585 -1.894 8.223 1.00 . A A . 20 SER CB 1 1 1 237 1 1 20 SER H H 1.941 -0.853 7.539 1.00 . A A . 20 SER H 1 1 1 238 1 1 20 SER HA H 3.033 -2.998 9.201 1.00 . A A . 20 SER HA 1 1 1 239 1 1 20 SER HB2 H 4.533 -1.408 7.260 1.00 . A A . 20 SER HB2 1 1 1 240 1 1 20 SER HB3 H 5.208 -1.313 8.887 1.00 . A A . 20 SER HB3 1 1 1 241 1 1 20 SER HG H 5.340 -3.563 8.916 1.00 . A A . 20 SER HG 1 1 1 242 1 1 20 SER N N 2.176 -1.774 7.778 1.00 . A A . 20 SER N 1 1 1 243 1 1 20 SER O O 1.957 -0.374 10.088 1.00 . A A . 20 SER O 1 1 1 244 1 1 20 SER OG O 5.167 -3.175 8.055 1.00 . A A . 20 SER OG 1 1 1 245 1 1 21 GLN C C 4.871 1.305 11.616 1.00 . A A . 21 GLN C 1 1 1 246 1 1 21 GLN CA C 4.011 0.076 11.892 1.00 . A A . 21 GLN CA 1 1 1 247 1 1 21 GLN CB C 4.490 -0.618 13.167 1.00 . A A . 21 GLN CB 1 1 1 248 1 1 21 GLN CD C 3.127 -0.613 15.294 1.00 . A A . 21 GLN CD 1 1 1 249 1 1 21 GLN CG C 3.371 -1.281 13.954 1.00 . A A . 21 GLN CG 1 1 1 250 1 1 21 GLN H H 4.860 -1.377 10.608 1.00 . A A . 21 GLN H 1 1 1 251 1 1 21 GLN HA H 2.987 0.392 12.027 1.00 . A A . 21 GLN HA 1 1 1 252 1 1 21 GLN HB2 H 5.211 -1.376 12.900 1.00 . A A . 21 GLN HB2 1 1 1 253 1 1 21 GLN HB3 H 4.966 0.112 13.804 1.00 . A A . 21 GLN HB3 1 1 1 254 1 1 21 GLN HE21 H 2.560 1.062 14.384 1.00 . A A . 21 GLN HE21 1 1 1 255 1 1 21 GLN HE22 H 2.530 1.098 16.111 1.00 . A A . 21 GLN HE22 1 1 1 256 1 1 21 GLN HG2 H 2.461 -1.231 13.375 1.00 . A A . 21 GLN HG2 1 1 1 257 1 1 21 GLN HG3 H 3.632 -2.315 14.126 1.00 . A A . 21 GLN HG3 1 1 1 258 1 1 21 GLN N N 4.048 -0.851 10.766 1.00 . A A . 21 GLN N 1 1 1 259 1 1 21 GLN NE2 N 2.695 0.642 15.260 1.00 . A A . 21 GLN NE2 1 1 1 260 1 1 21 GLN O O 4.590 2.396 12.112 1.00 . A A . 21 GLN O 1 1 1 261 1 1 21 GLN OE1 O 3.325 -1.219 16.347 1.00 . A A . 21 GLN OE1 1 1 1 262 1 1 22 THR C C 7.085 2.253 8.974 1.00 . A A . 22 THR C 1 1 1 263 1 1 22 THR CA C 6.819 2.214 10.475 1.00 . A A . 22 THR CA 1 1 1 264 1 1 22 THR CB C 8.161 2.091 11.223 1.00 . A A . 22 THR CB 1 1 1 265 1 1 22 THR CG2 C 8.882 0.808 10.837 1.00 . A A . 22 THR CG2 1 1 1 266 1 1 22 THR H H 6.088 0.228 10.452 1.00 . A A . 22 THR H 1 1 1 267 1 1 22 THR HA H 6.348 3.140 10.772 1.00 . A A . 22 THR HA 1 1 1 268 1 1 22 THR HB H 7.963 2.069 12.285 1.00 . A A . 22 THR HB 1 1 1 269 1 1 22 THR HG1 H 9.895 3.031 11.198 1.00 . A A . 22 THR HG1 1 1 1 270 1 1 22 THR HG21 H 8.220 0.184 10.255 1.00 . A A . 22 THR HG21 1 1 1 271 1 1 22 THR HG22 H 9.180 0.280 11.731 1.00 . A A . 22 THR HG22 1 1 1 272 1 1 22 THR HG23 H 9.757 1.048 10.252 1.00 . A A . 22 THR HG23 1 1 1 273 1 1 22 THR N N 5.918 1.121 10.819 1.00 . A A . 22 THR N 1 1 1 274 1 1 22 THR O O 7.922 3.023 8.501 1.00 . A A . 22 THR O 1 1 1 275 1 1 22 THR OG1 O 8.994 3.219 10.928 1.00 . A A . 22 THR OG1 1 1 1 276 1 1 23 THR C C 5.242 1.718 6.060 1.00 . A A . 23 THR C 1 1 1 277 1 1 23 THR CA C 6.535 1.349 6.783 1.00 . A A . 23 THR CA 1 1 1 278 1 1 23 THR CB C 6.979 -0.055 6.331 1.00 . A A . 23 THR CB 1 1 1 279 1 1 23 THR CG2 C 7.763 0.019 5.029 1.00 . A A . 23 THR CG2 1 1 1 280 1 1 23 THR H H 5.723 0.821 8.664 1.00 . A A . 23 THR H 1 1 1 281 1 1 23 THR HA H 7.305 2.053 6.503 1.00 . A A . 23 THR HA 1 1 1 282 1 1 23 THR HB H 6.099 -0.660 6.170 1.00 . A A . 23 THR HB 1 1 1 283 1 1 23 THR HG1 H 7.900 -0.051 8.077 1.00 . A A . 23 THR HG1 1 1 1 284 1 1 23 THR HG21 H 7.928 -0.980 4.652 1.00 . A A . 23 THR HG21 1 1 1 285 1 1 23 THR HG22 H 8.714 0.497 5.208 1.00 . A A . 23 THR HG22 1 1 1 286 1 1 23 THR HG23 H 7.203 0.590 4.304 1.00 . A A . 23 THR HG23 1 1 1 287 1 1 23 THR N N 6.371 1.413 8.229 1.00 . A A . 23 THR N 1 1 1 288 1 1 23 THR O O 4.145 1.511 6.579 1.00 . A A . 23 THR O 1 1 1 289 1 1 23 THR OG1 O 7.787 -0.664 7.346 1.00 . A A . 23 THR OG1 1 1 1 290 1 1 24 TRP C C 4.365 2.114 2.629 1.00 . A A . 24 TRP C 1 1 1 291 1 1 24 TRP CA C 4.238 2.664 4.047 1.00 . A A . 24 TRP CA 1 1 1 292 1 1 24 TRP CB C 4.135 4.188 3.993 1.00 . A A . 24 TRP CB 1 1 1 293 1 1 24 TRP CD1 C 4.051 5.300 6.300 1.00 . A A . 24 TRP CD1 1 1 1 294 1 1 24 TRP CD2 C 2.048 4.968 5.363 1.00 . A A . 24 TRP CD2 1 1 1 295 1 1 24 TRP CE2 C 1.859 5.582 6.615 1.00 . A A . 24 TRP CE2 1 1 1 296 1 1 24 TRP CE3 C 0.930 4.662 4.587 1.00 . A A . 24 TRP CE3 1 1 1 297 1 1 24 TRP CG C 3.455 4.795 5.181 1.00 . A A . 24 TRP CG 1 1 1 298 1 1 24 TRP CH2 C -0.483 5.584 6.322 1.00 . A A . 24 TRP CH2 1 1 1 299 1 1 24 TRP CZ2 C 0.594 5.896 7.105 1.00 . A A . 24 TRP CZ2 1 1 1 300 1 1 24 TRP CZ3 C -0.324 4.973 5.074 1.00 . A A . 24 TRP CZ3 1 1 1 301 1 1 24 TRP H H 6.288 2.398 4.499 1.00 . A A . 24 TRP H 1 1 1 302 1 1 24 TRP HA H 3.343 2.262 4.506 1.00 . A A . 24 TRP HA 1 1 1 303 1 1 24 TRP HB2 H 5.128 4.605 3.933 1.00 . A A . 24 TRP HB2 1 1 1 304 1 1 24 TRP HB3 H 3.579 4.471 3.110 1.00 . A A . 24 TRP HB3 1 1 1 305 1 1 24 TRP HD1 H 5.117 5.316 6.464 1.00 . A A . 24 TRP HD1 1 1 1 306 1 1 24 TRP HE1 H 3.275 6.188 8.040 1.00 . A A . 24 TRP HE1 1 1 1 307 1 1 24 TRP HE3 H 1.035 4.192 3.622 1.00 . A A . 24 TRP HE3 1 1 1 308 1 1 24 TRP HH2 H -1.482 5.807 6.660 1.00 . A A . 24 TRP HH2 1 1 1 309 1 1 24 TRP HZ2 H 0.454 6.369 8.066 1.00 . A A . 24 TRP HZ2 1 1 1 310 1 1 24 TRP HZ3 H -1.200 4.742 4.487 1.00 . A A . 24 TRP HZ3 1 1 1 311 1 1 24 TRP N N 5.385 2.263 4.856 1.00 . A A . 24 TRP N 1 1 1 312 1 1 24 TRP NE1 N 3.098 5.776 7.168 1.00 . A A . 24 TRP NE1 1 1 1 313 1 1 24 TRP O O 5.443 2.157 2.035 1.00 . A A . 24 TRP O 1 1 1 314 1 1 25 GLY C C 2.472 1.877 -0.233 1.00 . A A . 25 GLY C 1 1 1 315 1 1 25 GLY CA C 3.286 1.053 0.747 1.00 . A A . 25 GLY CA 1 1 1 316 1 1 25 GLY H H 2.434 1.591 2.609 1.00 . A A . 25 GLY H 1 1 1 317 1 1 25 GLY HA2 H 4.308 1.013 0.403 1.00 . A A . 25 GLY HA2 1 1 1 318 1 1 25 GLY HA3 H 2.887 0.050 0.773 1.00 . A A . 25 GLY HA3 1 1 1 319 1 1 25 GLY N N 3.265 1.600 2.091 1.00 . A A . 25 GLY N 1 1 1 320 1 1 25 GLY O O 1.439 2.444 0.129 1.00 . A A . 25 GLY O 1 1 1 321 1 1 26 CYS C C 1.281 1.780 -3.282 1.00 . A A . 26 CYS C 1 1 1 322 1 1 26 CYS CA C 2.247 2.688 -2.523 1.00 . A A . 26 CYS CA 1 1 1 323 1 1 26 CYS CB C 3.260 3.308 -3.488 1.00 . A A . 26 CYS CB 1 1 1 324 1 1 26 CYS H H 3.761 1.458 -1.703 1.00 . A A . 26 CYS H 1 1 1 325 1 1 26 CYS HA H 1.683 3.477 -2.047 1.00 . A A . 26 CYS HA 1 1 1 326 1 1 26 CYS HB2 H 4.236 3.301 -3.027 1.00 . A A . 26 CYS HB2 1 1 1 327 1 1 26 CYS HB3 H 3.291 2.716 -4.392 1.00 . A A . 26 CYS HB3 1 1 1 328 1 1 26 CYS N N 2.936 1.936 -1.479 1.00 . A A . 26 CYS N 1 1 1 329 1 1 26 CYS O O 1.694 0.801 -3.904 1.00 . A A . 26 CYS O 1 1 1 330 1 1 26 CYS SG S 2.885 5.028 -3.964 1.00 . A A . 26 CYS SG 1 1 1 331 1 1 27 CYS C C -1.920 2.171 -4.768 1.00 . A A . 27 CYS C 1 1 1 332 1 1 27 CYS CA C -1.035 1.307 -3.870 1.00 . A A . 27 CYS CA 1 1 1 333 1 1 27 CYS CB C -1.891 0.605 -2.817 1.00 . A A . 27 CYS CB 1 1 1 334 1 1 27 CYS H H -0.272 2.884 -2.685 1.00 . A A . 27 CYS H 1 1 1 335 1 1 27 CYS HA H -0.543 0.561 -4.476 1.00 . A A . 27 CYS HA 1 1 1 336 1 1 27 CYS HB2 H -1.919 1.212 -1.924 1.00 . A A . 27 CYS HB2 1 1 1 337 1 1 27 CYS HB3 H -2.895 0.489 -3.198 1.00 . A A . 27 CYS HB3 1 1 1 338 1 1 27 CYS N N -0.006 2.102 -3.209 1.00 . A A . 27 CYS N 1 1 1 339 1 1 27 CYS O O -1.980 3.387 -4.602 1.00 . A A . 27 CYS O 1 1 1 340 1 1 27 CYS SG S -1.279 -1.044 -2.345 1.00 . A A . 27 CYS SG 1 1 1 341 1 1 28 PRO C C -4.895 2.503 -6.062 1.00 . A A . 28 PRO C 1 1 1 342 1 1 28 PRO CA C -3.507 2.269 -6.655 1.00 . A A . 28 PRO CA 1 1 1 343 1 1 28 PRO CB C -3.588 1.322 -7.847 1.00 . A A . 28 PRO CB 1 1 1 344 1 1 28 PRO CD C -2.615 0.099 -6.017 1.00 . A A . 28 PRO CD 1 1 1 345 1 1 28 PRO CG C -3.477 -0.040 -7.249 1.00 . A A . 28 PRO CG 1 1 1 346 1 1 28 PRO HA H -3.081 3.211 -6.964 1.00 . A A . 28 PRO HA 1 1 1 347 1 1 28 PRO HB2 H -4.532 1.457 -8.356 1.00 . A A . 28 PRO HB2 1 1 1 348 1 1 28 PRO HB3 H -2.773 1.521 -8.526 1.00 . A A . 28 PRO HB3 1 1 1 349 1 1 28 PRO HD2 H -3.044 -0.454 -5.194 1.00 . A A . 28 PRO HD2 1 1 1 350 1 1 28 PRO HD3 H -1.612 -0.247 -6.219 1.00 . A A . 28 PRO HD3 1 1 1 351 1 1 28 PRO HG2 H -4.458 -0.401 -6.978 1.00 . A A . 28 PRO HG2 1 1 1 352 1 1 28 PRO HG3 H -3.013 -0.713 -7.955 1.00 . A A . 28 PRO HG3 1 1 1 353 1 1 28 PRO N N -2.624 1.550 -5.736 1.00 . A A . 28 PRO N 1 1 1 354 1 1 28 PRO O O -5.225 1.961 -5.007 1.00 . A A . 28 PRO O 1 1 1 355 1 1 29 SER C C -7.036 4.394 -4.976 1.00 . A A . 29 SER C 1 1 1 356 1 1 29 SER CA C -7.056 3.631 -6.303 1.00 . A A . 29 SER CA 1 1 1 357 1 1 29 SER CB C -7.890 2.355 -6.163 1.00 . A A . 29 SER CB 1 1 1 358 1 1 29 SER H H -5.370 3.712 -7.583 1.00 . A A . 29 SER H 1 1 1 359 1 1 29 SER HA H -7.509 4.261 -7.055 1.00 . A A . 29 SER HA 1 1 1 360 1 1 29 SER HB2 H -7.269 1.497 -6.370 1.00 . A A . 29 SER HB2 1 1 1 361 1 1 29 SER HB3 H -8.273 2.286 -5.155 1.00 . A A . 29 SER HB3 1 1 1 362 1 1 29 SER HG H -8.820 1.718 -7.765 1.00 . A A . 29 SER HG 1 1 1 363 1 1 29 SER N N -5.699 3.314 -6.750 1.00 . A A . 29 SER N 1 1 1 364 1 1 29 SER O O -6.481 3.918 -3.987 1.00 . A A . 29 SER O 1 1 1 365 1 1 29 SER OG O -8.981 2.357 -7.067 1.00 . A A . 29 SER OG 1 1 1 366 1 1 30 PRO C C -8.392 5.748 -2.558 1.00 . A A . 30 PRO C 1 1 1 367 1 1 30 PRO CA C -7.684 6.428 -3.728 1.00 . A A . 30 PRO CA 1 1 1 368 1 1 30 PRO CB C -8.462 7.675 -4.168 1.00 . A A . 30 PRO CB 1 1 1 369 1 1 30 PRO CD C -8.331 6.242 -6.069 1.00 . A A . 30 PRO CD 1 1 1 370 1 1 30 PRO CG C -9.200 7.261 -5.394 1.00 . A A . 30 PRO CG 1 1 1 371 1 1 30 PRO HA H -6.690 6.717 -3.420 1.00 . A A . 30 PRO HA 1 1 1 372 1 1 30 PRO HB2 H -9.140 7.975 -3.381 1.00 . A A . 30 PRO HB2 1 1 1 373 1 1 30 PRO HB3 H -7.770 8.478 -4.377 1.00 . A A . 30 PRO HB3 1 1 1 374 1 1 30 PRO HD2 H -8.934 5.530 -6.613 1.00 . A A . 30 PRO HD2 1 1 1 375 1 1 30 PRO HD3 H -7.623 6.723 -6.728 1.00 . A A . 30 PRO HD3 1 1 1 376 1 1 30 PRO HG2 H -10.149 6.824 -5.121 1.00 . A A . 30 PRO HG2 1 1 1 377 1 1 30 PRO HG3 H -9.350 8.114 -6.039 1.00 . A A . 30 PRO HG3 1 1 1 378 1 1 30 PRO N N -7.642 5.596 -4.939 1.00 . A A . 30 PRO N 1 1 1 379 1 1 30 PRO O O -7.817 5.599 -1.479 1.00 . A A . 30 PRO O 1 1 1 380 1 1 31 LYS C C -10.183 3.194 -1.689 1.00 . A A . 31 LYS C 1 1 1 381 1 1 31 LYS CA C -10.426 4.701 -1.719 1.00 . A A . 31 LYS CA 1 1 1 382 1 1 31 LYS CB C -11.917 4.986 -1.915 1.00 . A A . 31 LYS CB 1 1 1 383 1 1 31 LYS CD C -12.921 7.087 -0.969 1.00 . A A . 31 LYS CD 1 1 1 384 1 1 31 LYS CE C -14.383 7.384 -1.261 1.00 . A A . 31 LYS CE 1 1 1 385 1 1 31 LYS CG C -12.231 6.452 -2.165 1.00 . A A . 31 LYS CG 1 1 1 386 1 1 31 LYS H H -10.054 5.504 -3.645 1.00 . A A . 31 LYS H 1 1 1 387 1 1 31 LYS HA H -10.114 5.118 -0.773 1.00 . A A . 31 LYS HA 1 1 1 388 1 1 31 LYS HB2 H -12.272 4.415 -2.760 1.00 . A A . 31 LYS HB2 1 1 1 389 1 1 31 LYS HB3 H -12.450 4.672 -1.029 1.00 . A A . 31 LYS HB3 1 1 1 390 1 1 31 LYS HD2 H -12.863 6.410 -0.130 1.00 . A A . 31 LYS HD2 1 1 1 391 1 1 31 LYS HD3 H -12.418 8.011 -0.724 1.00 . A A . 31 LYS HD3 1 1 1 392 1 1 31 LYS HE2 H -14.472 8.411 -1.582 1.00 . A A . 31 LYS HE2 1 1 1 393 1 1 31 LYS HE3 H -14.719 6.730 -2.052 1.00 . A A . 31 LYS HE3 1 1 1 394 1 1 31 LYS HG2 H -11.309 6.980 -2.357 1.00 . A A . 31 LYS HG2 1 1 1 395 1 1 31 LYS HG3 H -12.878 6.529 -3.026 1.00 . A A . 31 LYS HG3 1 1 1 396 1 1 31 LYS HZ1 H -15.896 7.976 0.053 1.00 . A A . 31 LYS HZ1 1 1 1 397 1 1 31 LYS HZ2 H -14.652 7.099 0.791 1.00 . A A . 31 LYS HZ2 1 1 1 398 1 1 31 LYS HZ3 H -15.796 6.301 -0.167 1.00 . A A . 31 LYS HZ3 1 1 1 399 1 1 31 LYS N N -9.644 5.350 -2.769 1.00 . A A . 31 LYS N 1 1 1 400 1 1 31 LYS NZ N -15.242 7.175 -0.062 1.00 . A A . 31 LYS NZ 1 1 1 401 1 1 31 LYS O O -11.008 2.435 -1.180 1.00 . A A . 31 LYS O 1 1 1 402 1 1 32 ALA C C -8.653 0.769 -0.848 1.00 . A A . 32 ALA C 1 1 1 403 1 1 32 ALA CA C -8.694 1.351 -2.259 1.00 . A A . 32 ALA CA 1 1 1 404 1 1 32 ALA CB C -7.348 1.158 -2.940 1.00 . A A . 32 ALA CB 1 1 1 405 1 1 32 ALA H H -8.426 3.421 -2.618 1.00 . A A . 32 ALA H 1 1 1 406 1 1 32 ALA HA H -9.442 0.827 -2.840 1.00 . A A . 32 ALA HA 1 1 1 407 1 1 32 ALA HB1 H -6.560 1.480 -2.276 1.00 . A A . 32 ALA HB1 1 1 1 408 1 1 32 ALA HB2 H -7.316 1.742 -3.847 1.00 . A A . 32 ALA HB2 1 1 1 409 1 1 32 ALA HB3 H -7.212 0.113 -3.179 1.00 . A A . 32 ALA HB3 1 1 1 410 1 1 32 ALA N N -9.046 2.767 -2.231 1.00 . A A . 32 ALA N 1 1 1 411 1 1 32 ALA O O -8.540 1.504 0.133 1.00 . A A . 32 ALA O 1 1 1 412 1 1 33 VAL C C -7.398 -2.054 0.644 1.00 . A A . 33 VAL C 1 1 1 413 1 1 33 VAL CA C -8.682 -1.240 0.532 1.00 . A A . 33 VAL CA 1 1 1 414 1 1 33 VAL CB C -9.897 -2.169 0.727 1.00 . A A . 33 VAL CB 1 1 1 415 1 1 33 VAL CG1 C -9.796 -2.918 2.048 1.00 . A A . 33 VAL CG1 1 1 1 416 1 1 33 VAL CG2 C -11.191 -1.374 0.657 1.00 . A A . 33 VAL CG2 1 1 1 417 1 1 33 VAL H H -8.803 -1.089 -1.571 1.00 . A A . 33 VAL H 1 1 1 418 1 1 33 VAL HA H -8.693 -0.491 1.311 1.00 . A A . 33 VAL HA 1 1 1 419 1 1 33 VAL HB H -9.902 -2.895 -0.073 1.00 . A A . 33 VAL HB 1 1 1 420 1 1 33 VAL HG11 H -10.034 -3.959 1.890 1.00 . A A . 33 VAL HG11 1 1 1 421 1 1 33 VAL HG12 H -10.493 -2.493 2.756 1.00 . A A . 33 VAL HG12 1 1 1 422 1 1 33 VAL HG13 H -8.792 -2.832 2.435 1.00 . A A . 33 VAL HG13 1 1 1 423 1 1 33 VAL HG21 H -11.615 -1.462 -0.332 1.00 . A A . 33 VAL HG21 1 1 1 424 1 1 33 VAL HG22 H -10.987 -0.336 0.872 1.00 . A A . 33 VAL HG22 1 1 1 425 1 1 33 VAL HG23 H -11.890 -1.761 1.384 1.00 . A A . 33 VAL HG23 1 1 1 426 1 1 33 VAL N N -8.729 -0.556 -0.755 1.00 . A A . 33 VAL N 1 1 1 427 1 1 33 VAL O O -7.226 -3.057 -0.048 1.00 . A A . 33 VAL O 1 1 1 428 1 1 34 CYS C C -5.373 -3.600 2.448 1.00 . A A . 34 CYS C 1 1 1 429 1 1 34 CYS CA C -5.216 -2.283 1.694 1.00 . A A . 34 CYS CA 1 1 1 430 1 1 34 CYS CB C -4.243 -1.367 2.443 1.00 . A A . 34 CYS CB 1 1 1 431 1 1 34 CYS H H -6.684 -0.797 2.024 1.00 . A A . 34 CYS H 1 1 1 432 1 1 34 CYS HA H -4.810 -2.492 0.716 1.00 . A A . 34 CYS HA 1 1 1 433 1 1 34 CYS HB2 H -4.315 -1.563 3.502 1.00 . A A . 34 CYS HB2 1 1 1 434 1 1 34 CYS HB3 H -3.237 -1.575 2.111 1.00 . A A . 34 CYS HB3 1 1 1 435 1 1 34 CYS N N -6.494 -1.608 1.507 1.00 . A A . 34 CYS N 1 1 1 436 1 1 34 CYS O O -5.672 -3.610 3.642 1.00 . A A . 34 CYS O 1 1 1 437 1 1 34 CYS SG S -4.554 0.411 2.191 1.00 . A A . 34 CYS SG 1 1 1 438 1 1 35 CYS C C -4.199 -6.123 3.482 1.00 . A A . 35 CYS C 1 1 1 439 1 1 35 CYS CA C -5.219 -6.030 2.356 1.00 . A A . 35 CYS CA 1 1 1 440 1 1 35 CYS CB C -4.964 -7.122 1.317 1.00 . A A . 35 CYS CB 1 1 1 441 1 1 35 CYS H H -4.880 -4.634 0.807 1.00 . A A . 35 CYS H 1 1 1 442 1 1 35 CYS HA H -6.210 -6.150 2.767 1.00 . A A . 35 CYS HA 1 1 1 443 1 1 35 CYS HB2 H -5.153 -6.723 0.332 1.00 . A A . 35 CYS HB2 1 1 1 444 1 1 35 CYS HB3 H -3.933 -7.436 1.381 1.00 . A A . 35 CYS HB3 1 1 1 445 1 1 35 CYS N N -5.138 -4.710 1.747 1.00 . A A . 35 CYS N 1 1 1 446 1 1 35 CYS O O -2.987 -6.003 3.249 1.00 . A A . 35 CYS O 1 1 1 447 1 1 35 CYS SG S -6.008 -8.601 1.523 1.00 . A A . 35 CYS SG 1 1 1 448 1 1 36 ASP C C -3.598 -7.830 6.327 1.00 . A A . 36 ASP C 1 1 1 449 1 1 36 ASP CA C -3.861 -6.394 5.884 1.00 . A A . 36 ASP CA 1 1 1 450 1 1 36 ASP CB C -4.497 -5.610 7.033 1.00 . A A . 36 ASP CB 1 1 1 451 1 1 36 ASP CG C -6.011 -5.697 7.026 1.00 . A A . 36 ASP CG 1 1 1 452 1 1 36 ASP H H -5.677 -6.398 4.795 1.00 . A A . 36 ASP H 1 1 1 453 1 1 36 ASP HA H -2.915 -5.934 5.640 1.00 . A A . 36 ASP HA 1 1 1 454 1 1 36 ASP HB2 H -4.138 -6.004 7.972 1.00 . A A . 36 ASP HB2 1 1 1 455 1 1 36 ASP HB3 H -4.214 -4.571 6.952 1.00 . A A . 36 ASP HB3 1 1 1 456 1 1 36 ASP N N -4.705 -6.316 4.699 1.00 . A A . 36 ASP N 1 1 1 457 1 1 36 ASP O O -2.757 -8.059 7.197 1.00 . A A . 36 ASP O 1 1 1 458 1 1 36 ASP OD1 O -6.541 -6.807 6.807 1.00 . A A . 36 ASP OD1 1 1 1 459 1 1 36 ASP OD2 O -6.666 -4.656 7.239 1.00 . A A . 36 ASP OD2 1 1 1 460 1 1 37 ASP C C -2.624 -10.564 5.923 1.00 . A A . 37 ASP C 1 1 1 461 1 1 37 ASP CA C -4.088 -10.197 6.106 1.00 . A A . 37 ASP CA 1 1 1 462 1 1 37 ASP CB C -4.968 -11.112 5.252 1.00 . A A . 37 ASP CB 1 1 1 463 1 1 37 ASP CG C -4.938 -12.552 5.726 1.00 . A A . 37 ASP CG 1 1 1 464 1 1 37 ASP H H -4.953 -8.594 5.042 1.00 . A A . 37 ASP H 1 1 1 465 1 1 37 ASP HA H -4.354 -10.314 7.146 1.00 . A A . 37 ASP HA 1 1 1 466 1 1 37 ASP HB2 H -5.988 -10.760 5.293 1.00 . A A . 37 ASP HB2 1 1 1 467 1 1 37 ASP HB3 H -4.622 -11.081 4.230 1.00 . A A . 37 ASP HB3 1 1 1 468 1 1 37 ASP N N -4.296 -8.800 5.739 1.00 . A A . 37 ASP N 1 1 1 469 1 1 37 ASP O O -2.025 -11.238 6.762 1.00 . A A . 37 ASP O 1 1 1 470 1 1 37 ASP OD1 O -5.474 -12.828 6.819 1.00 . A A . 37 ASP OD1 1 1 1 471 1 1 37 ASP OD2 O -4.377 -13.403 5.004 1.00 . A A . 37 ASP OD2 1 1 1 472 1 1 38 MET C C 0.014 -9.034 4.084 1.00 . A A . 38 MET C 1 1 1 473 1 1 38 MET CA C -0.655 -10.338 4.509 1.00 . A A . 38 MET CA 1 1 1 474 1 1 38 MET CB C -0.530 -11.391 3.406 1.00 . A A . 38 MET CB 1 1 1 475 1 1 38 MET CE C 0.263 -14.749 2.431 1.00 . A A . 38 MET CE 1 1 1 476 1 1 38 MET CG C -1.080 -12.752 3.802 1.00 . A A . 38 MET CG 1 1 1 477 1 1 38 MET H H -2.590 -9.553 4.205 1.00 . A A . 38 MET H 1 1 1 478 1 1 38 MET HA H -0.173 -10.702 5.405 1.00 . A A . 38 MET HA 1 1 1 479 1 1 38 MET HB2 H -1.068 -11.048 2.535 1.00 . A A . 38 MET HB2 1 1 1 480 1 1 38 MET HB3 H 0.513 -11.508 3.153 1.00 . A A . 38 MET HB3 1 1 1 481 1 1 38 MET HE1 H -0.148 -15.745 2.494 1.00 . A A . 38 MET HE1 1 1 1 482 1 1 38 MET HE2 H 1.286 -14.802 2.088 1.00 . A A . 38 MET HE2 1 1 1 483 1 1 38 MET HE3 H -0.319 -14.162 1.737 1.00 . A A . 38 MET HE3 1 1 1 484 1 1 38 MET HG2 H -1.636 -12.647 4.721 1.00 . A A . 38 MET HG2 1 1 1 485 1 1 38 MET HG3 H -1.741 -13.098 3.021 1.00 . A A . 38 MET HG3 1 1 1 486 1 1 38 MET N N -2.054 -10.093 4.822 1.00 . A A . 38 MET N 1 1 1 487 1 1 38 MET O O 0.453 -8.251 4.927 1.00 . A A . 38 MET O 1 1 1 488 1 1 38 MET SD S 0.216 -13.981 4.048 1.00 . A A . 38 MET SD 1 1 1 489 1 1 39 GLN C C 0.011 -7.228 0.894 1.00 . A A . 39 GLN C 1 1 1 490 1 1 39 GLN CA C 0.626 -7.553 2.251 1.00 . A A . 39 GLN CA 1 1 1 491 1 1 39 GLN CB C 2.145 -7.683 2.122 1.00 . A A . 39 GLN CB 1 1 1 492 1 1 39 GLN CD C 3.551 -6.090 0.755 1.00 . A A . 39 GLN CD 1 1 1 493 1 1 39 GLN CG C 2.869 -6.347 2.085 1.00 . A A . 39 GLN CG 1 1 1 494 1 1 39 GLN H H -0.354 -9.419 2.152 1.00 . A A . 39 GLN H 1 1 1 495 1 1 39 GLN HA H 0.395 -6.755 2.941 1.00 . A A . 39 GLN HA 1 1 1 496 1 1 39 GLN HB2 H 2.520 -8.248 2.963 1.00 . A A . 39 GLN HB2 1 1 1 497 1 1 39 GLN HB3 H 2.373 -8.216 1.211 1.00 . A A . 39 GLN HB3 1 1 1 498 1 1 39 GLN HE21 H 2.963 -4.192 0.794 1.00 . A A . 39 GLN HE21 1 1 1 499 1 1 39 GLN HE22 H 3.888 -4.663 -0.587 1.00 . A A . 39 GLN HE22 1 1 1 500 1 1 39 GLN HG2 H 2.153 -5.558 2.263 1.00 . A A . 39 GLN HG2 1 1 1 501 1 1 39 GLN HG3 H 3.617 -6.335 2.865 1.00 . A A . 39 GLN HG3 1 1 1 502 1 1 39 GLN N N 0.053 -8.785 2.779 1.00 . A A . 39 GLN N 1 1 1 503 1 1 39 GLN NE2 N 3.458 -4.857 0.272 1.00 . A A . 39 GLN NE2 1 1 1 504 1 1 39 GLN O O 0.586 -7.562 -0.143 1.00 . A A . 39 GLN O 1 1 1 505 1 1 39 GLN OE1 O 4.154 -6.989 0.169 1.00 . A A . 39 GLN OE1 1 1 1 506 1 1 40 HIS C C -2.801 -5.137 -0.296 1.00 . A A . 40 HIS C 1 1 1 507 1 1 40 HIS CA C -1.814 -6.293 -0.387 1.00 . A A . 40 HIS CA 1 1 1 508 1 1 40 HIS CB C -2.521 -7.535 -0.932 1.00 . A A . 40 HIS CB 1 1 1 509 1 1 40 HIS CD2 C -1.319 -8.317 -3.094 1.00 . A A . 40 HIS CD2 1 1 1 510 1 1 40 HIS CE1 C -2.801 -7.623 -4.553 1.00 . A A . 40 HIS CE1 1 1 1 511 1 1 40 HIS CG C -2.329 -7.736 -2.403 1.00 . A A . 40 HIS CG 1 1 1 512 1 1 40 HIS H H -1.603 -6.385 1.746 1.00 . A A . 40 HIS H 1 1 1 513 1 1 40 HIS HA H -1.036 -6.017 -1.082 1.00 . A A . 40 HIS HA 1 1 1 514 1 1 40 HIS HB2 H -2.140 -8.409 -0.425 1.00 . A A . 40 HIS HB2 1 1 1 515 1 1 40 HIS HB3 H -3.581 -7.450 -0.743 1.00 . A A . 40 HIS HB3 1 1 1 516 1 1 40 HIS HD1 H -4.085 -6.850 -3.160 1.00 . A A . 40 HIS HD1 1 1 1 517 1 1 40 HIS HD2 H -0.429 -8.764 -2.674 1.00 . A A . 40 HIS HD2 1 1 1 518 1 1 40 HIS HE1 H -3.307 -7.413 -5.484 1.00 . A A . 40 HIS HE1 1 1 1 519 1 1 40 HIS HE2 H -1.052 -8.492 -5.169 1.00 . A A . 40 HIS HE2 1 1 1 520 1 1 40 HIS N N -1.166 -6.603 0.888 1.00 . A A . 40 HIS N 1 1 1 521 1 1 40 HIS ND1 N -3.241 -7.311 -3.347 1.00 . A A . 40 HIS ND1 1 1 1 522 1 1 40 HIS NE2 N -1.637 -8.233 -4.427 1.00 . A A . 40 HIS NE2 1 1 1 523 1 1 40 HIS O O -2.904 -4.461 0.726 1.00 . A A . 40 HIS O 1 1 1 524 1 1 41 CYS C C -5.352 -4.095 -2.769 1.00 . A A . 41 CYS C 1 1 1 525 1 1 41 CYS CA C -4.504 -3.865 -1.523 1.00 . A A . 41 CYS CA 1 1 1 526 1 1 41 CYS CB C -3.824 -2.499 -1.597 1.00 . A A . 41 CYS CB 1 1 1 527 1 1 41 CYS H H -3.354 -5.506 -2.176 1.00 . A A . 41 CYS H 1 1 1 528 1 1 41 CYS HA H -5.141 -3.900 -0.654 1.00 . A A . 41 CYS HA 1 1 1 529 1 1 41 CYS HB2 H -4.581 -1.731 -1.659 1.00 . A A . 41 CYS HB2 1 1 1 530 1 1 41 CYS HB3 H -3.239 -2.348 -0.701 1.00 . A A . 41 CYS HB3 1 1 1 531 1 1 41 CYS N N -3.510 -4.924 -1.404 1.00 . A A . 41 CYS N 1 1 1 532 1 1 41 CYS O O -4.902 -4.729 -3.724 1.00 . A A . 41 CYS O 1 1 1 533 1 1 41 CYS SG S -2.715 -2.301 -3.026 1.00 . A A . 41 CYS SG 1 1 1 534 1 1 42 CYS C C -8.230 -2.469 -4.207 1.00 . A A . 42 CYS C 1 1 1 535 1 1 42 CYS CA C -7.478 -3.760 -3.895 1.00 . A A . 42 CYS CA 1 1 1 536 1 1 42 CYS CB C -8.469 -4.890 -3.620 1.00 . A A . 42 CYS CB 1 1 1 537 1 1 42 CYS H H -6.891 -3.097 -1.971 1.00 . A A . 42 CYS H 1 1 1 538 1 1 42 CYS HA H -6.877 -4.025 -4.752 1.00 . A A . 42 CYS HA 1 1 1 539 1 1 42 CYS HB2 H -9.016 -4.669 -2.715 1.00 . A A . 42 CYS HB2 1 1 1 540 1 1 42 CYS HB3 H -9.161 -4.962 -4.446 1.00 . A A . 42 CYS HB3 1 1 1 541 1 1 42 CYS N N -6.580 -3.589 -2.759 1.00 . A A . 42 CYS N 1 1 1 542 1 1 42 CYS O O -8.464 -1.649 -3.323 1.00 . A A . 42 CYS O 1 1 1 543 1 1 42 CYS SG S -7.685 -6.520 -3.409 1.00 . A A . 42 CYS SG 1 1 1 544 1 1 43 PRO C C -10.618 -0.819 -5.147 1.00 . A A . 43 PRO C 1 1 1 545 1 1 43 PRO CA C -9.326 -1.066 -5.919 1.00 . A A . 43 PRO CA 1 1 1 546 1 1 43 PRO CB C -9.633 -1.349 -7.391 1.00 . A A . 43 PRO CB 1 1 1 547 1 1 43 PRO CD C -8.355 -3.190 -6.605 1.00 . A A . 43 PRO CD 1 1 1 548 1 1 43 PRO CG C -8.585 -2.318 -7.804 1.00 . A A . 43 PRO CG 1 1 1 549 1 1 43 PRO HA H -8.699 -0.190 -5.847 1.00 . A A . 43 PRO HA 1 1 1 550 1 1 43 PRO HB2 H -10.623 -1.771 -7.483 1.00 . A A . 43 PRO HB2 1 1 1 551 1 1 43 PRO HB3 H -9.569 -0.433 -7.959 1.00 . A A . 43 PRO HB3 1 1 1 552 1 1 43 PRO HD2 H -9.053 -4.015 -6.596 1.00 . A A . 43 PRO HD2 1 1 1 553 1 1 43 PRO HD3 H -7.337 -3.551 -6.587 1.00 . A A . 43 PRO HD3 1 1 1 554 1 1 43 PRO HG2 H -8.932 -2.907 -8.640 1.00 . A A . 43 PRO HG2 1 1 1 555 1 1 43 PRO HG3 H -7.680 -1.789 -8.060 1.00 . A A . 43 PRO HG3 1 1 1 556 1 1 43 PRO N N -8.609 -2.270 -5.481 1.00 . A A . 43 PRO N 1 1 1 557 1 1 43 PRO O O -11.396 -1.744 -4.884 1.00 . A A . 43 PRO O 1 1 1 558 1 1 44 ALA C C -13.261 0.180 -4.565 1.00 . A A . 44 ALA C 1 1 1 559 1 1 44 ALA CA C -12.005 0.864 -4.043 1.00 . A A . 44 ALA CA 1 1 1 560 1 1 44 ALA CB C -12.161 2.373 -4.122 1.00 . A A . 44 ALA CB 1 1 1 561 1 1 44 ALA H H -10.148 1.113 -5.024 1.00 . A A . 44 ALA H 1 1 1 562 1 1 44 ALA HA H -11.862 0.593 -3.007 1.00 . A A . 44 ALA HA 1 1 1 563 1 1 44 ALA HB1 H -12.906 2.620 -4.864 1.00 . A A . 44 ALA HB1 1 1 1 564 1 1 44 ALA HB2 H -11.216 2.818 -4.399 1.00 . A A . 44 ALA HB2 1 1 1 565 1 1 44 ALA HB3 H -12.470 2.754 -3.160 1.00 . A A . 44 ALA HB3 1 1 1 566 1 1 44 ALA N N -10.824 0.444 -4.786 1.00 . A A . 44 ALA N 1 1 1 567 1 1 44 ALA O O -13.677 0.405 -5.702 1.00 . A A . 44 ALA O 1 1 1 568 1 1 45 GLY C C -14.934 -2.855 -4.055 1.00 . A A . 45 GLY C 1 1 1 569 1 1 45 GLY CA C -15.071 -1.347 -4.119 1.00 . A A . 45 GLY CA 1 1 1 570 1 1 45 GLY H H -13.490 -0.783 -2.829 1.00 . A A . 45 GLY H 1 1 1 571 1 1 45 GLY HA2 H -15.876 -1.044 -3.466 1.00 . A A . 45 GLY HA2 1 1 1 572 1 1 45 GLY HA3 H -15.320 -1.063 -5.131 1.00 . A A . 45 GLY HA3 1 1 1 573 1 1 45 GLY N N -13.865 -0.650 -3.725 1.00 . A A . 45 GLY N 1 1 1 574 1 1 45 GLY O O -15.932 -3.571 -4.144 1.00 . A A . 45 GLY O 1 1 1 575 1 1 46 TYR C C -13.146 -5.225 -2.400 1.00 . A A . 46 TYR C 1 1 1 576 1 1 46 TYR CA C -13.483 -4.791 -3.824 1.00 . A A . 46 TYR CA 1 1 1 577 1 1 46 TYR CB C -12.359 -5.211 -4.774 1.00 . A A . 46 TYR CB 1 1 1 578 1 1 46 TYR CD1 C -11.708 -4.293 -7.033 1.00 . A A . 46 TYR CD1 1 1 1 579 1 1 46 TYR CD2 C -13.864 -5.282 -6.803 1.00 . A A . 46 TYR CD2 1 1 1 580 1 1 46 TYR CE1 C -11.967 -4.028 -8.365 1.00 . A A . 46 TYR CE1 1 1 1 581 1 1 46 TYR CE2 C -14.130 -5.021 -8.133 1.00 . A A . 46 TYR CE2 1 1 1 582 1 1 46 TYR CG C -12.650 -4.922 -6.231 1.00 . A A . 46 TYR CG 1 1 1 583 1 1 46 TYR CZ C -13.179 -4.395 -8.910 1.00 . A A . 46 TYR CZ 1 1 1 584 1 1 46 TYR H H -12.934 -2.743 -3.827 1.00 . A A . 46 TYR H 1 1 1 585 1 1 46 TYR HA H -14.396 -5.281 -4.127 1.00 . A A . 46 TYR HA 1 1 1 586 1 1 46 TYR HB2 H -11.455 -4.684 -4.506 1.00 . A A . 46 TYR HB2 1 1 1 587 1 1 46 TYR HB3 H -12.192 -6.273 -4.673 1.00 . A A . 46 TYR HB3 1 1 1 588 1 1 46 TYR HD1 H -10.759 -4.007 -6.603 1.00 . A A . 46 TYR HD1 1 1 1 589 1 1 46 TYR HD2 H -14.608 -5.772 -6.192 1.00 . A A . 46 TYR HD2 1 1 1 590 1 1 46 TYR HE1 H -11.221 -3.538 -8.972 1.00 . A A . 46 TYR HE1 1 1 1 591 1 1 46 TYR HE2 H -15.080 -5.308 -8.560 1.00 . A A . 46 TYR HE2 1 1 1 592 1 1 46 TYR HH H -12.619 -4.151 -10.732 1.00 . A A . 46 TYR HH 1 1 1 593 1 1 46 TYR N N -13.706 -3.350 -3.899 1.00 . A A . 46 TYR N 1 1 1 594 1 1 46 TYR O O -12.860 -4.395 -1.537 1.00 . A A . 46 TYR O 1 1 1 595 1 1 46 TYR OH O -13.440 -4.133 -10.235 1.00 . A A . 46 TYR OH 1 1 1 596 1 1 47 LYS C C -11.868 -8.231 -0.975 1.00 . A A . 47 LYS C 1 1 1 597 1 1 47 LYS CA C -12.877 -7.093 -0.853 1.00 . A A . 47 LYS CA 1 1 1 598 1 1 47 LYS CB C -14.157 -7.599 -0.184 1.00 . A A . 47 LYS CB 1 1 1 599 1 1 47 LYS CD C -14.492 -9.549 1.369 1.00 . A A . 47 LYS CD 1 1 1 600 1 1 47 LYS CE C -16.002 -9.538 1.547 1.00 . A A . 47 LYS CE 1 1 1 601 1 1 47 LYS CG C -13.939 -8.140 1.220 1.00 . A A . 47 LYS CG 1 1 1 602 1 1 47 LYS H H -13.411 -7.143 -2.899 1.00 . A A . 47 LYS H 1 1 1 603 1 1 47 LYS HA H -12.448 -6.308 -0.248 1.00 . A A . 47 LYS HA 1 1 1 604 1 1 47 LYS HB2 H -14.865 -6.786 -0.127 1.00 . A A . 47 LYS HB2 1 1 1 605 1 1 47 LYS HB3 H -14.577 -8.389 -0.789 1.00 . A A . 47 LYS HB3 1 1 1 606 1 1 47 LYS HD2 H -14.248 -10.117 0.484 1.00 . A A . 47 LYS HD2 1 1 1 607 1 1 47 LYS HD3 H -14.039 -10.013 2.233 1.00 . A A . 47 LYS HD3 1 1 1 608 1 1 47 LYS HE2 H -16.239 -9.023 2.466 1.00 . A A . 47 LYS HE2 1 1 1 609 1 1 47 LYS HE3 H -16.446 -9.013 0.715 1.00 . A A . 47 LYS HE3 1 1 1 610 1 1 47 LYS HG2 H -12.879 -8.157 1.428 1.00 . A A . 47 LYS HG2 1 1 1 611 1 1 47 LYS HG3 H -14.436 -7.491 1.927 1.00 . A A . 47 LYS HG3 1 1 1 612 1 1 47 LYS HZ1 H -15.820 -11.614 1.401 1.00 . A A . 47 LYS HZ1 1 1 1 613 1 1 47 LYS HZ2 H -17.325 -11.022 0.907 1.00 . A A . 47 LYS HZ2 1 1 1 614 1 1 47 LYS HZ3 H -16.949 -11.104 2.554 1.00 . A A . 47 LYS HZ3 1 1 1 615 1 1 47 LYS N N -13.180 -6.534 -2.167 1.00 . A A . 47 LYS N 1 1 1 616 1 1 47 LYS NZ N -16.563 -10.916 1.606 1.00 . A A . 47 LYS NZ 1 1 1 617 1 1 47 LYS O O -11.794 -8.895 -2.006 1.00 . A A . 47 LYS O 1 1 1 618 1 1 48 CYS C C -10.702 -10.850 0.473 1.00 . A A . 48 CYS C 1 1 1 619 1 1 48 CYS CA C -10.087 -9.510 0.080 1.00 . A A . 48 CYS CA 1 1 1 620 1 1 48 CYS CB C -8.948 -9.161 1.039 1.00 . A A . 48 CYS CB 1 1 1 621 1 1 48 CYS H H -11.194 -7.888 0.876 1.00 . A A . 48 CYS H 1 1 1 622 1 1 48 CYS HA H -9.690 -9.590 -0.921 1.00 . A A . 48 CYS HA 1 1 1 623 1 1 48 CYS HB2 H -9.332 -8.532 1.828 1.00 . A A . 48 CYS HB2 1 1 1 624 1 1 48 CYS HB3 H -8.558 -10.072 1.469 1.00 . A A . 48 CYS HB3 1 1 1 625 1 1 48 CYS N N -11.091 -8.451 0.081 1.00 . A A . 48 CYS N 1 1 1 626 1 1 48 CYS O O -11.314 -10.976 1.533 1.00 . A A . 48 CYS O 1 1 1 627 1 1 48 CYS SG S -7.560 -8.279 0.256 1.00 . A A . 48 CYS SG 1 1 1 628 1 1 49 GLY C C -10.003 -14.188 0.205 1.00 . A A . 49 GLY C 1 1 1 629 1 1 49 GLY CA C -11.080 -13.167 -0.119 1.00 . A A . 49 GLY CA 1 1 1 630 1 1 49 GLY H H -10.039 -11.690 -1.222 1.00 . A A . 49 GLY H 1 1 1 631 1 1 49 GLY HA2 H -11.759 -13.097 0.718 1.00 . A A . 49 GLY HA2 1 1 1 632 1 1 49 GLY HA3 H -11.629 -13.502 -0.986 1.00 . A A . 49 GLY HA3 1 1 1 633 1 1 49 GLY N N -10.535 -11.849 -0.391 1.00 . A A . 49 GLY N 1 1 1 634 1 1 49 GLY O O -8.814 -13.898 0.076 1.00 . A A . 49 GLY O 1 1 1 635 1 1 50 PRO C C -8.793 -17.091 -0.245 1.00 . A A . 50 PRO C 1 1 1 636 1 1 50 PRO CA C -9.445 -16.467 0.984 1.00 . A A . 50 PRO CA 1 1 1 637 1 1 50 PRO CB C -10.309 -17.511 1.712 1.00 . A A . 50 PRO CB 1 1 1 638 1 1 50 PRO CD C -11.780 -15.838 0.828 1.00 . A A . 50 PRO CD 1 1 1 639 1 1 50 PRO CG C -11.649 -16.875 1.904 1.00 . A A . 50 PRO CG 1 1 1 640 1 1 50 PRO HA H -8.676 -16.106 1.652 1.00 . A A . 50 PRO HA 1 1 1 641 1 1 50 PRO HB2 H -10.383 -18.401 1.105 1.00 . A A . 50 PRO HB2 1 1 1 642 1 1 50 PRO HB3 H -9.853 -17.756 2.659 1.00 . A A . 50 PRO HB3 1 1 1 643 1 1 50 PRO HD2 H -12.178 -16.277 -0.075 1.00 . A A . 50 PRO HD2 1 1 1 644 1 1 50 PRO HD3 H -12.400 -15.020 1.161 1.00 . A A . 50 PRO HD3 1 1 1 645 1 1 50 PRO HG2 H -12.425 -17.618 1.804 1.00 . A A . 50 PRO HG2 1 1 1 646 1 1 50 PRO HG3 H -11.697 -16.411 2.879 1.00 . A A . 50 PRO HG3 1 1 1 647 1 1 50 PRO N N -10.393 -15.403 0.637 1.00 . A A . 50 PRO N 1 1 1 648 1 1 50 PRO O O -7.905 -17.936 -0.126 1.00 . A A . 50 PRO O 1 1 1 649 1 1 51 GLY C C -7.437 -16.475 -3.098 1.00 . A A . 51 GLY C 1 1 1 650 1 1 51 GLY CA C -8.687 -17.207 -2.657 1.00 . A A . 51 GLY CA 1 1 1 651 1 1 51 GLY H H -9.950 -16.000 -1.460 1.00 . A A . 51 GLY H 1 1 1 652 1 1 51 GLY HA2 H -8.445 -18.248 -2.508 1.00 . A A . 51 GLY HA2 1 1 1 653 1 1 51 GLY HA3 H -9.431 -17.129 -3.436 1.00 . A A . 51 GLY HA3 1 1 1 654 1 1 51 GLY N N -9.240 -16.674 -1.425 1.00 . A A . 51 GLY N 1 1 1 655 1 1 51 GLY O O -6.997 -16.615 -4.240 1.00 . A A . 51 GLY O 1 1 1 656 1 1 52 GLY C C -5.941 -13.726 -3.368 1.00 . A A . 52 GLY C 1 1 1 657 1 1 52 GLY CA C -5.661 -14.942 -2.506 1.00 . A A . 52 GLY CA 1 1 1 658 1 1 52 GLY H H -7.263 -15.621 -1.299 1.00 . A A . 52 GLY H 1 1 1 659 1 1 52 GLY HA2 H -5.201 -14.618 -1.584 1.00 . A A . 52 GLY HA2 1 1 1 660 1 1 52 GLY HA3 H -4.974 -15.590 -3.030 1.00 . A A . 52 GLY HA3 1 1 1 661 1 1 52 GLY N N -6.864 -15.692 -2.191 1.00 . A A . 52 GLY N 1 1 1 662 1 1 52 GLY O O -5.107 -12.827 -3.474 1.00 . A A . 52 GLY O 1 1 1 663 1 1 53 THR C C -8.635 -11.778 -4.199 1.00 . A A . 53 THR C 1 1 1 664 1 1 53 THR CA C -7.512 -12.586 -4.839 1.00 . A A . 53 THR CA 1 1 1 665 1 1 53 THR CB C -7.971 -13.076 -6.225 1.00 . A A . 53 THR CB 1 1 1 666 1 1 53 THR CG2 C -6.808 -13.681 -6.997 1.00 . A A . 53 THR CG2 1 1 1 667 1 1 53 THR H H -7.741 -14.444 -3.858 1.00 . A A . 53 THR H 1 1 1 668 1 1 53 THR HA H -6.651 -11.946 -4.972 1.00 . A A . 53 THR HA 1 1 1 669 1 1 53 THR HB H -8.353 -12.232 -6.781 1.00 . A A . 53 THR HB 1 1 1 670 1 1 53 THR HG1 H -9.512 -13.869 -5.280 1.00 . A A . 53 THR HG1 1 1 1 671 1 1 53 THR HG21 H -6.768 -13.249 -7.985 1.00 . A A . 53 THR HG21 1 1 1 672 1 1 53 THR HG22 H -6.946 -14.750 -7.076 1.00 . A A . 53 THR HG22 1 1 1 673 1 1 53 THR HG23 H -5.885 -13.475 -6.476 1.00 . A A . 53 THR HG23 1 1 1 674 1 1 53 THR N N -7.120 -13.698 -3.984 1.00 . A A . 53 THR N 1 1 1 675 1 1 53 THR O O -9.062 -12.070 -3.082 1.00 . A A . 53 THR O 1 1 1 676 1 1 53 THR OG1 O -9.013 -14.050 -6.080 1.00 . A A . 53 THR OG1 1 1 1 677 1 1 54 CYS C C -11.477 -10.137 -5.162 1.00 . A A . 54 CYS C 1 1 1 678 1 1 54 CYS CA C -10.176 -9.909 -4.400 1.00 . A A . 54 CYS CA 1 1 1 679 1 1 54 CYS CB C -9.770 -8.438 -4.485 1.00 . A A . 54 CYS CB 1 1 1 680 1 1 54 CYS H H -8.723 -10.569 -5.791 1.00 . A A . 54 CYS H 1 1 1 681 1 1 54 CYS HA H -10.334 -10.166 -3.364 1.00 . A A . 54 CYS HA 1 1 1 682 1 1 54 CYS HB2 H -8.955 -8.336 -5.186 1.00 . A A . 54 CYS HB2 1 1 1 683 1 1 54 CYS HB3 H -10.612 -7.858 -4.833 1.00 . A A . 54 CYS HB3 1 1 1 684 1 1 54 CYS N N -9.106 -10.758 -4.909 1.00 . A A . 54 CYS N 1 1 1 685 1 1 54 CYS O O -11.469 -10.470 -6.347 1.00 . A A . 54 CYS O 1 1 1 686 1 1 54 CYS SG S -9.225 -7.730 -2.897 1.00 . A A . 54 CYS SG 1 1 1 687 1 1 55 ILE C C -14.703 -8.829 -5.031 1.00 . A A . 55 ILE C 1 1 1 688 1 1 55 ILE CA C -13.914 -10.135 -5.052 1.00 . A A . 55 ILE CA 1 1 1 689 1 1 55 ILE CB C -14.714 -11.214 -4.297 1.00 . A A . 55 ILE CB 1 1 1 690 1 1 55 ILE CD1 C -15.845 -11.682 -2.061 1.00 . A A . 55 ILE CD1 1 1 1 691 1 1 55 ILE CG1 C -14.839 -10.841 -2.817 1.00 . A A . 55 ILE CG1 1 1 1 692 1 1 55 ILE CG2 C -14.048 -12.573 -4.453 1.00 . A A . 55 ILE CG2 1 1 1 693 1 1 55 ILE H H -12.526 -9.690 -3.525 1.00 . A A . 55 ILE H 1 1 1 694 1 1 55 ILE HA H -13.787 -10.455 -6.076 1.00 . A A . 55 ILE HA 1 1 1 695 1 1 55 ILE HB H -15.701 -11.271 -4.732 1.00 . A A . 55 ILE HB 1 1 1 696 1 1 55 ILE HD11 H -16.267 -11.099 -1.255 1.00 . A A . 55 ILE HD11 1 1 1 697 1 1 55 ILE HD12 H -15.353 -12.554 -1.655 1.00 . A A . 55 ILE HD12 1 1 1 698 1 1 55 ILE HD13 H -16.632 -11.992 -2.732 1.00 . A A . 55 ILE HD13 1 1 1 699 1 1 55 ILE HG12 H -13.879 -10.965 -2.339 1.00 . A A . 55 ILE HG12 1 1 1 700 1 1 55 ILE HG13 H -15.144 -9.808 -2.739 1.00 . A A . 55 ILE HG13 1 1 1 701 1 1 55 ILE HG21 H -14.795 -13.314 -4.697 1.00 . A A . 55 ILE HG21 1 1 1 702 1 1 55 ILE HG22 H -13.562 -12.843 -3.528 1.00 . A A . 55 ILE HG22 1 1 1 703 1 1 55 ILE HG23 H -13.316 -12.526 -5.245 1.00 . A A . 55 ILE HG23 1 1 1 704 1 1 55 ILE N N -12.594 -9.954 -4.464 1.00 . A A . 55 ILE N 1 1 1 705 1 1 55 ILE O O -14.181 -7.786 -4.638 1.00 . A A . 55 ILE O 1 1 1 706 1 1 56 SER C C -18.221 -8.056 -4.974 1.00 . A A . 56 SER C 1 1 1 707 1 1 56 SER CA C -16.821 -7.716 -5.475 1.00 . A A . 56 SER CA 1 1 1 708 1 1 56 SER CB C -16.897 -7.138 -6.889 1.00 . A A . 56 SER CB 1 1 1 709 1 1 56 SER H H -16.324 -9.754 -5.752 1.00 . A A . 56 SER H 1 1 1 710 1 1 56 SER HA H -16.387 -6.978 -4.817 1.00 . A A . 56 SER HA 1 1 1 711 1 1 56 SER HB2 H -16.996 -6.064 -6.832 1.00 . A A . 56 SER HB2 1 1 1 712 1 1 56 SER HB3 H -15.994 -7.387 -7.427 1.00 . A A . 56 SER HB3 1 1 1 713 1 1 56 SER HG H -18.572 -6.939 -7.887 1.00 . A A . 56 SER HG 1 1 1 714 1 1 56 SER N N -15.962 -8.894 -5.452 1.00 . A A . 56 SER N 1 1 1 715 1 1 56 SER O O -18.497 -9.255 -4.761 1.00 . A A . 56 SER O 1 1 1 716 1 1 56 SER OXT O -19.030 -7.120 -4.798 1.00 . A A . 56 SER OXT 1 1 1 717 1 1 56 SER OG O -18.009 -7.660 -7.596 1.00 . A A . 56 SER OG 1 1 2 718 1 1 1 ASP C C 3.039 15.212 -2.142 1.00 . A A . 1 ASP C 1 1 2 719 1 1 1 ASP CA C 4.035 15.346 -3.290 1.00 . A A . 1 ASP CA 1 1 2 720 1 1 1 ASP CB C 5.078 14.228 -3.218 1.00 . A A . 1 ASP CB 1 1 2 721 1 1 1 ASP CG C 5.481 13.721 -4.588 1.00 . A A . 1 ASP CG 1 1 2 722 1 1 1 ASP H1 H 4.843 16.966 -2.254 1.00 . A A . 1 ASP H1 1 1 2 723 1 1 1 ASP H2 H 4.198 17.371 -3.765 1.00 . A A . 1 ASP H2 1 1 2 724 1 1 1 ASP H3 H 5.684 16.567 -3.667 1.00 . A A . 1 ASP H3 1 1 2 725 1 1 1 ASP HA H 3.504 15.276 -4.228 1.00 . A A . 1 ASP HA 1 1 2 726 1 1 1 ASP HB2 H 5.960 14.599 -2.717 1.00 . A A . 1 ASP HB2 1 1 2 727 1 1 1 ASP HB3 H 4.671 13.401 -2.654 1.00 . A A . 1 ASP HB3 1 1 2 728 1 1 1 ASP N N 4.739 16.654 -3.240 1.00 . A A . 1 ASP N 1 1 2 729 1 1 1 ASP O O 2.751 16.181 -1.441 1.00 . A A . 1 ASP O 1 1 2 730 1 1 1 ASP OD1 O 5.005 12.636 -4.983 1.00 . A A . 1 ASP OD1 1 1 2 731 1 1 1 ASP OD2 O 6.272 14.409 -5.266 1.00 . A A . 1 ASP OD2 1 1 2 732 1 1 2 VAL C C 2.216 13.030 0.279 1.00 . A A . 2 VAL C 1 1 2 733 1 1 2 VAL CA C 1.552 13.735 -0.898 1.00 . A A . 2 VAL CA 1 1 2 734 1 1 2 VAL CB C 0.382 12.870 -1.407 1.00 . A A . 2 VAL CB 1 1 2 735 1 1 2 VAL CG1 C -0.836 13.032 -0.510 1.00 . A A . 2 VAL CG1 1 1 2 736 1 1 2 VAL CG2 C 0.040 13.221 -2.849 1.00 . A A . 2 VAL CG2 1 1 2 737 1 1 2 VAL H H 2.788 13.272 -2.553 1.00 . A A . 2 VAL H 1 1 2 738 1 1 2 VAL HA H 1.154 14.682 -0.562 1.00 . A A . 2 VAL HA 1 1 2 739 1 1 2 VAL HB H 0.688 11.833 -1.375 1.00 . A A . 2 VAL HB 1 1 2 740 1 1 2 VAL HG11 H -0.809 12.288 0.272 1.00 . A A . 2 VAL HG11 1 1 2 741 1 1 2 VAL HG12 H -1.735 12.908 -1.096 1.00 . A A . 2 VAL HG12 1 1 2 742 1 1 2 VAL HG13 H -0.829 14.018 -0.069 1.00 . A A . 2 VAL HG13 1 1 2 743 1 1 2 VAL HG21 H -1.029 13.156 -2.991 1.00 . A A . 2 VAL HG21 1 1 2 744 1 1 2 VAL HG22 H 0.535 12.530 -3.514 1.00 . A A . 2 VAL HG22 1 1 2 745 1 1 2 VAL HG23 H 0.372 14.226 -3.062 1.00 . A A . 2 VAL HG23 1 1 2 746 1 1 2 VAL N N 2.516 14.003 -1.959 1.00 . A A . 2 VAL N 1 1 2 747 1 1 2 VAL O O 2.893 12.017 0.105 1.00 . A A . 2 VAL O 1 1 2 748 1 1 3 GLN C C 1.707 11.863 3.222 1.00 . A A . 3 GLN C 1 1 2 749 1 1 3 GLN CA C 2.596 12.979 2.685 1.00 . A A . 3 GLN CA 1 1 2 750 1 1 3 GLN CB C 2.813 14.040 3.772 1.00 . A A . 3 GLN CB 1 1 2 751 1 1 3 GLN CD C 3.082 16.310 2.698 1.00 . A A . 3 GLN CD 1 1 2 752 1 1 3 GLN CG C 2.166 15.382 3.472 1.00 . A A . 3 GLN CG 1 1 2 753 1 1 3 GLN H H 1.460 14.371 1.557 1.00 . A A . 3 GLN H 1 1 2 754 1 1 3 GLN HA H 3.552 12.556 2.414 1.00 . A A . 3 GLN HA 1 1 2 755 1 1 3 GLN HB2 H 2.405 13.671 4.701 1.00 . A A . 3 GLN HB2 1 1 2 756 1 1 3 GLN HB3 H 3.875 14.196 3.895 1.00 . A A . 3 GLN HB3 1 1 2 757 1 1 3 GLN HE21 H 2.161 15.841 1.000 1.00 . A A . 3 GLN HE21 1 1 2 758 1 1 3 GLN HE22 H 3.458 16.975 0.862 1.00 . A A . 3 GLN HE22 1 1 2 759 1 1 3 GLN HG2 H 1.274 15.215 2.889 1.00 . A A . 3 GLN HG2 1 1 2 760 1 1 3 GLN HG3 H 1.903 15.857 4.406 1.00 . A A . 3 GLN HG3 1 1 2 761 1 1 3 GLN N N 2.015 13.567 1.481 1.00 . A A . 3 GLN N 1 1 2 762 1 1 3 GLN NE2 N 2.880 16.383 1.388 1.00 . A A . 3 GLN NE2 1 1 2 763 1 1 3 GLN O O 0.567 12.103 3.623 1.00 . A A . 3 GLN O 1 1 2 764 1 1 3 GLN OE1 O 3.962 16.953 3.271 1.00 . A A . 3 GLN OE1 1 1 2 765 1 1 4 CYS C C 0.973 9.693 5.107 1.00 . A A . 4 CYS C 1 1 2 766 1 1 4 CYS CA C 1.495 9.481 3.690 1.00 . A A . 4 CYS CA 1 1 2 767 1 1 4 CYS CB C 2.386 8.238 3.640 1.00 . A A . 4 CYS CB 1 1 2 768 1 1 4 CYS H H 3.145 10.520 2.874 1.00 . A A . 4 CYS H 1 1 2 769 1 1 4 CYS HA H 0.654 9.332 3.031 1.00 . A A . 4 CYS HA 1 1 2 770 1 1 4 CYS HB2 H 3.336 8.465 4.100 1.00 . A A . 4 CYS HB2 1 1 2 771 1 1 4 CYS HB3 H 1.908 7.438 4.188 1.00 . A A . 4 CYS HB3 1 1 2 772 1 1 4 CYS N N 2.235 10.644 3.215 1.00 . A A . 4 CYS N 1 1 2 773 1 1 4 CYS O O -0.186 10.058 5.303 1.00 . A A . 4 CYS O 1 1 2 774 1 1 4 CYS SG S 2.716 7.636 1.955 1.00 . A A . 4 CYS SG 1 1 2 775 1 1 5 GLY C C 2.635 9.765 8.398 1.00 . A A . 5 GLY C 1 1 2 776 1 1 5 GLY CA C 1.442 9.630 7.476 1.00 . A A . 5 GLY CA 1 1 2 777 1 1 5 GLY H H 2.746 9.172 5.874 1.00 . A A . 5 GLY H 1 1 2 778 1 1 5 GLY HA2 H 0.833 10.518 7.561 1.00 . A A . 5 GLY HA2 1 1 2 779 1 1 5 GLY HA3 H 0.860 8.774 7.782 1.00 . A A . 5 GLY HA3 1 1 2 780 1 1 5 GLY N N 1.834 9.461 6.091 1.00 . A A . 5 GLY N 1 1 2 781 1 1 5 GLY O O 2.907 10.849 8.917 1.00 . A A . 5 GLY O 1 1 2 782 1 1 6 GLY C C 5.663 9.467 8.863 1.00 . A A . 6 GLY C 1 1 2 783 1 1 6 GLY CA C 4.513 8.689 9.468 1.00 . A A . 6 GLY CA 1 1 2 784 1 1 6 GLY H H 3.091 7.826 8.166 1.00 . A A . 6 GLY H 1 1 2 785 1 1 6 GLY HA2 H 4.239 9.144 10.409 1.00 . A A . 6 GLY HA2 1 1 2 786 1 1 6 GLY HA3 H 4.835 7.674 9.651 1.00 . A A . 6 GLY HA3 1 1 2 787 1 1 6 GLY N N 3.351 8.664 8.604 1.00 . A A . 6 GLY N 1 1 2 788 1 1 6 GLY O O 6.045 10.519 9.376 1.00 . A A . 6 GLY O 1 1 2 789 1 1 7 GLY C C 7.455 9.294 5.643 1.00 . A A . 7 GLY C 1 1 2 790 1 1 7 GLY CA C 7.329 9.622 7.121 1.00 . A A . 7 GLY CA 1 1 2 791 1 1 7 GLY H H 5.878 8.106 7.408 1.00 . A A . 7 GLY H 1 1 2 792 1 1 7 GLY HA2 H 7.196 10.689 7.227 1.00 . A A . 7 GLY HA2 1 1 2 793 1 1 7 GLY HA3 H 8.244 9.337 7.619 1.00 . A A . 7 GLY HA3 1 1 2 794 1 1 7 GLY N N 6.219 8.949 7.770 1.00 . A A . 7 GLY N 1 1 2 795 1 1 7 GLY O O 8.411 9.717 4.995 1.00 . A A . 7 GLY O 1 1 2 796 1 1 8 PHE C C 5.775 9.179 2.838 1.00 . A A . 8 PHE C 1 1 2 797 1 1 8 PHE CA C 6.540 8.172 3.690 1.00 . A A . 8 PHE CA 1 1 2 798 1 1 8 PHE CB C 5.963 6.771 3.485 1.00 . A A . 8 PHE CB 1 1 2 799 1 1 8 PHE CD1 C 7.302 4.856 2.569 1.00 . A A . 8 PHE CD1 1 1 2 800 1 1 8 PHE CD2 C 7.606 5.457 4.857 1.00 . A A . 8 PHE CD2 1 1 2 801 1 1 8 PHE CE1 C 8.232 3.844 2.708 1.00 . A A . 8 PHE CE1 1 1 2 802 1 1 8 PHE CE2 C 8.538 4.447 5.002 1.00 . A A . 8 PHE CE2 1 1 2 803 1 1 8 PHE CG C 6.978 5.673 3.640 1.00 . A A . 8 PHE CG 1 1 2 804 1 1 8 PHE CZ C 8.852 3.640 3.926 1.00 . A A . 8 PHE CZ 1 1 2 805 1 1 8 PHE H H 5.755 8.222 5.659 1.00 . A A . 8 PHE H 1 1 2 806 1 1 8 PHE HA H 7.574 8.173 3.380 1.00 . A A . 8 PHE HA 1 1 2 807 1 1 8 PHE HB2 H 5.179 6.603 4.208 1.00 . A A . 8 PHE HB2 1 1 2 808 1 1 8 PHE HB3 H 5.548 6.703 2.489 1.00 . A A . 8 PHE HB3 1 1 2 809 1 1 8 PHE HD1 H 6.820 5.016 1.616 1.00 . A A . 8 PHE HD1 1 1 2 810 1 1 8 PHE HD2 H 7.362 6.088 5.699 1.00 . A A . 8 PHE HD2 1 1 2 811 1 1 8 PHE HE1 H 8.475 3.215 1.865 1.00 . A A . 8 PHE HE1 1 1 2 812 1 1 8 PHE HE2 H 9.020 4.290 5.955 1.00 . A A . 8 PHE HE2 1 1 2 813 1 1 8 PHE HZ H 9.580 2.849 4.037 1.00 . A A . 8 PHE HZ 1 1 2 814 1 1 8 PHE N N 6.499 8.539 5.101 1.00 . A A . 8 PHE N 1 1 2 815 1 1 8 PHE O O 5.248 10.167 3.349 1.00 . A A . 8 PHE O 1 1 2 816 1 1 9 SER C C 4.812 9.106 -0.739 1.00 . A A . 9 SER C 1 1 2 817 1 1 9 SER CA C 5.027 9.799 0.602 1.00 . A A . 9 SER CA 1 1 2 818 1 1 9 SER CB C 5.822 11.089 0.397 1.00 . A A . 9 SER CB 1 1 2 819 1 1 9 SER H H 6.166 8.116 1.192 1.00 . A A . 9 SER H 1 1 2 820 1 1 9 SER HA H 4.065 10.042 1.028 1.00 . A A . 9 SER HA 1 1 2 821 1 1 9 SER HB2 H 5.561 11.522 -0.558 1.00 . A A . 9 SER HB2 1 1 2 822 1 1 9 SER HB3 H 5.582 11.787 1.186 1.00 . A A . 9 SER HB3 1 1 2 823 1 1 9 SER HG H 7.642 11.335 -0.284 1.00 . A A . 9 SER HG 1 1 2 824 1 1 9 SER N N 5.723 8.919 1.535 1.00 . A A . 9 SER N 1 1 2 825 1 1 9 SER O O 5.549 8.187 -1.098 1.00 . A A . 9 SER O 1 1 2 826 1 1 9 SER OG O 7.216 10.838 0.418 1.00 . A A . 9 SER OG 1 1 2 827 1 1 10 CYS C C 3.154 10.060 -3.792 1.00 . A A . 10 CYS C 1 1 2 828 1 1 10 CYS CA C 3.491 8.972 -2.776 1.00 . A A . 10 CYS CA 1 1 2 829 1 1 10 CYS CB C 2.330 7.987 -2.656 1.00 . A A . 10 CYS CB 1 1 2 830 1 1 10 CYS H H 3.246 10.286 -1.139 1.00 . A A . 10 CYS H 1 1 2 831 1 1 10 CYS HA H 4.367 8.440 -3.115 1.00 . A A . 10 CYS HA 1 1 2 832 1 1 10 CYS HB2 H 1.655 8.328 -1.884 1.00 . A A . 10 CYS HB2 1 1 2 833 1 1 10 CYS HB3 H 1.804 7.952 -3.596 1.00 . A A . 10 CYS HB3 1 1 2 834 1 1 10 CYS N N 3.799 9.552 -1.476 1.00 . A A . 10 CYS N 1 1 2 835 1 1 10 CYS O O 3.116 11.245 -3.461 1.00 . A A . 10 CYS O 1 1 2 836 1 1 10 CYS SG S 2.834 6.287 -2.238 1.00 . A A . 10 CYS SG 1 1 2 837 1 1 11 HIS C C 1.112 10.910 -6.143 1.00 . A A . 11 HIS C 1 1 2 838 1 1 11 HIS CA C 2.603 10.580 -6.108 1.00 . A A . 11 HIS CA 1 1 2 839 1 1 11 HIS CB C 3.039 10.003 -7.457 1.00 . A A . 11 HIS CB 1 1 2 840 1 1 11 HIS CD2 C 5.587 9.770 -7.016 1.00 . A A . 11 HIS CD2 1 1 2 841 1 1 11 HIS CE1 C 5.837 7.695 -7.675 1.00 . A A . 11 HIS CE1 1 1 2 842 1 1 11 HIS CG C 4.373 9.322 -7.417 1.00 . A A . 11 HIS CG 1 1 2 843 1 1 11 HIS H H 2.982 8.688 -5.232 1.00 . A A . 11 HIS H 1 1 2 844 1 1 11 HIS HA H 3.153 11.490 -5.926 1.00 . A A . 11 HIS HA 1 1 2 845 1 1 11 HIS HB2 H 2.307 9.279 -7.784 1.00 . A A . 11 HIS HB2 1 1 2 846 1 1 11 HIS HB3 H 3.096 10.804 -8.181 1.00 . A A . 11 HIS HB3 1 1 2 847 1 1 11 HIS HD1 H 3.871 7.419 -8.171 1.00 . A A . 11 HIS HD1 1 1 2 848 1 1 11 HIS HD2 H 5.813 10.756 -6.635 1.00 . A A . 11 HIS HD2 1 1 2 849 1 1 11 HIS HE1 H 6.278 6.738 -7.915 1.00 . A A . 11 HIS HE1 1 1 2 850 1 1 11 HIS HE2 H 7.414 8.742 -6.895 1.00 . A A . 11 HIS HE2 1 1 2 851 1 1 11 HIS N N 2.923 9.645 -5.033 1.00 . A A . 11 HIS N 1 1 2 852 1 1 11 HIS ND1 N 4.565 8.018 -7.825 1.00 . A A . 11 HIS ND1 1 1 2 853 1 1 11 HIS NE2 N 6.478 8.740 -7.186 1.00 . A A . 11 HIS NE2 1 1 2 854 1 1 11 HIS O O 0.290 10.210 -5.548 1.00 . A A . 11 HIS O 1 1 2 855 1 1 12 ASP C C -1.468 11.295 -7.568 1.00 . A A . 12 ASP C 1 1 2 856 1 1 12 ASP CA C -0.615 12.411 -6.977 1.00 . A A . 12 ASP CA 1 1 2 857 1 1 12 ASP CB C -0.710 13.662 -7.850 1.00 . A A . 12 ASP CB 1 1 2 858 1 1 12 ASP CG C -0.526 14.941 -7.056 1.00 . A A . 12 ASP CG 1 1 2 859 1 1 12 ASP H H 1.474 12.495 -7.306 1.00 . A A . 12 ASP H 1 1 2 860 1 1 12 ASP HA H -0.981 12.643 -5.987 1.00 . A A . 12 ASP HA 1 1 2 861 1 1 12 ASP HB2 H 0.056 13.622 -8.611 1.00 . A A . 12 ASP HB2 1 1 2 862 1 1 12 ASP HB3 H -1.679 13.690 -8.325 1.00 . A A . 12 ASP HB3 1 1 2 863 1 1 12 ASP N N 0.773 11.982 -6.852 1.00 . A A . 12 ASP N 1 1 2 864 1 1 12 ASP O O -1.088 10.669 -8.559 1.00 . A A . 12 ASP O 1 1 2 865 1 1 12 ASP OD1 O -0.809 16.027 -7.604 1.00 . A A . 12 ASP OD1 1 1 2 866 1 1 12 ASP OD2 O -0.101 14.857 -5.883 1.00 . A A . 12 ASP OD2 1 1 2 867 1 1 13 GLY C C -3.251 8.678 -6.743 1.00 . A A . 13 GLY C 1 1 2 868 1 1 13 GLY CA C -3.504 10.004 -7.432 1.00 . A A . 13 GLY CA 1 1 2 869 1 1 13 GLY H H -2.869 11.579 -6.168 1.00 . A A . 13 GLY H 1 1 2 870 1 1 13 GLY HA2 H -4.526 10.303 -7.253 1.00 . A A . 13 GLY HA2 1 1 2 871 1 1 13 GLY HA3 H -3.356 9.879 -8.495 1.00 . A A . 13 GLY HA3 1 1 2 872 1 1 13 GLY N N -2.619 11.049 -6.954 1.00 . A A . 13 GLY N 1 1 2 873 1 1 13 GLY O O -4.023 7.731 -6.903 1.00 . A A . 13 GLY O 1 1 2 874 1 1 14 GLU C C -2.429 7.403 -3.849 1.00 . A A . 14 GLU C 1 1 2 875 1 1 14 GLU CA C -1.824 7.391 -5.248 1.00 . A A . 14 GLU CA 1 1 2 876 1 1 14 GLU CB C -0.307 7.241 -5.148 1.00 . A A . 14 GLU CB 1 1 2 877 1 1 14 GLU CD C 0.349 6.155 -7.332 1.00 . A A . 14 GLU CD 1 1 2 878 1 1 14 GLU CG C 0.417 7.402 -6.473 1.00 . A A . 14 GLU CG 1 1 2 879 1 1 14 GLU H H -1.597 9.404 -5.879 1.00 . A A . 14 GLU H 1 1 2 880 1 1 14 GLU HA H -2.227 6.553 -5.797 1.00 . A A . 14 GLU HA 1 1 2 881 1 1 14 GLU HB2 H 0.067 7.988 -4.467 1.00 . A A . 14 GLU HB2 1 1 2 882 1 1 14 GLU HB3 H -0.080 6.261 -4.754 1.00 . A A . 14 GLU HB3 1 1 2 883 1 1 14 GLU HG2 H -0.030 8.221 -7.017 1.00 . A A . 14 GLU HG2 1 1 2 884 1 1 14 GLU HG3 H 1.456 7.629 -6.272 1.00 . A A . 14 GLU HG3 1 1 2 885 1 1 14 GLU N N -2.171 8.610 -5.969 1.00 . A A . 14 GLU N 1 1 2 886 1 1 14 GLU O O -2.931 8.429 -3.388 1.00 . A A . 14 GLU O 1 1 2 887 1 1 14 GLU OE1 O -0.629 6.013 -8.095 1.00 . A A . 14 GLU OE1 1 1 2 888 1 1 14 GLU OE2 O 1.273 5.320 -7.242 1.00 . A A . 14 GLU OE2 1 1 2 889 1 1 15 THR C C -1.908 5.473 -0.892 1.00 . A A . 15 THR C 1 1 2 890 1 1 15 THR CA C -2.912 6.141 -1.826 1.00 . A A . 15 THR CA 1 1 2 891 1 1 15 THR CB C -4.223 5.333 -1.811 1.00 . A A . 15 THR CB 1 1 2 892 1 1 15 THR CG2 C -4.809 5.273 -0.408 1.00 . A A . 15 THR CG2 1 1 2 893 1 1 15 THR H H -1.959 5.475 -3.594 1.00 . A A . 15 THR H 1 1 2 894 1 1 15 THR HA H -3.122 7.136 -1.461 1.00 . A A . 15 THR HA 1 1 2 895 1 1 15 THR HB H -4.011 4.326 -2.140 1.00 . A A . 15 THR HB 1 1 2 896 1 1 15 THR HG1 H -6.024 5.490 -2.599 1.00 . A A . 15 THR HG1 1 1 2 897 1 1 15 THR HG21 H -5.587 4.525 -0.375 1.00 . A A . 15 THR HG21 1 1 2 898 1 1 15 THR HG22 H -5.223 6.236 -0.149 1.00 . A A . 15 THR HG22 1 1 2 899 1 1 15 THR HG23 H -4.032 5.015 0.296 1.00 . A A . 15 THR HG23 1 1 2 900 1 1 15 THR N N -2.374 6.258 -3.175 1.00 . A A . 15 THR N 1 1 2 901 1 1 15 THR O O -1.327 4.441 -1.227 1.00 . A A . 15 THR O 1 1 2 902 1 1 15 THR OG1 O -5.175 5.925 -2.703 1.00 . A A . 15 THR OG1 1 1 2 903 1 1 16 CYS C C -1.530 4.554 2.204 1.00 . A A . 16 CYS C 1 1 2 904 1 1 16 CYS CA C -0.800 5.510 1.270 1.00 . A A . 16 CYS CA 1 1 2 905 1 1 16 CYS CB C -0.137 6.634 2.068 1.00 . A A . 16 CYS CB 1 1 2 906 1 1 16 CYS H H -2.227 6.871 0.501 1.00 . A A . 16 CYS H 1 1 2 907 1 1 16 CYS HA H -0.037 4.961 0.739 1.00 . A A . 16 CYS HA 1 1 2 908 1 1 16 CYS HB2 H -0.902 7.236 2.534 1.00 . A A . 16 CYS HB2 1 1 2 909 1 1 16 CYS HB3 H 0.493 6.201 2.835 1.00 . A A . 16 CYS HB3 1 1 2 910 1 1 16 CYS N N -1.721 6.060 0.284 1.00 . A A . 16 CYS N 1 1 2 911 1 1 16 CYS O O -2.507 4.928 2.852 1.00 . A A . 16 CYS O 1 1 2 912 1 1 16 CYS SG S 0.901 7.739 1.058 1.00 . A A . 16 CYS SG 1 1 2 913 1 1 17 CYS C C -0.641 1.698 4.070 1.00 . A A . 17 CYS C 1 1 2 914 1 1 17 CYS CA C -1.667 2.305 3.119 1.00 . A A . 17 CYS CA 1 1 2 915 1 1 17 CYS CB C -2.303 1.207 2.264 1.00 . A A . 17 CYS CB 1 1 2 916 1 1 17 CYS H H -0.272 3.078 1.725 1.00 . A A . 17 CYS H 1 1 2 917 1 1 17 CYS HA H -2.439 2.787 3.699 1.00 . A A . 17 CYS HA 1 1 2 918 1 1 17 CYS HB2 H -1.687 1.039 1.393 1.00 . A A . 17 CYS HB2 1 1 2 919 1 1 17 CYS HB3 H -2.354 0.296 2.843 1.00 . A A . 17 CYS HB3 1 1 2 920 1 1 17 CYS N N -1.053 3.316 2.267 1.00 . A A . 17 CYS N 1 1 2 921 1 1 17 CYS O O 0.369 1.145 3.635 1.00 . A A . 17 CYS O 1 1 2 922 1 1 17 CYS SG S -3.987 1.596 1.687 1.00 . A A . 17 CYS SG 1 1 2 923 1 1 18 PRO C C -0.177 -0.253 6.598 1.00 . A A . 18 PRO C 1 1 2 924 1 1 18 PRO CA C 0.025 1.245 6.395 1.00 . A A . 18 PRO CA 1 1 2 925 1 1 18 PRO CB C -0.363 2.024 7.650 1.00 . A A . 18 PRO CB 1 1 2 926 1 1 18 PRO CD C -2.067 2.427 6.007 1.00 . A A . 18 PRO CD 1 1 2 927 1 1 18 PRO CG C -1.824 2.278 7.489 1.00 . A A . 18 PRO CG 1 1 2 928 1 1 18 PRO HA H 1.058 1.442 6.148 1.00 . A A . 18 PRO HA 1 1 2 929 1 1 18 PRO HB2 H -0.157 1.430 8.528 1.00 . A A . 18 PRO HB2 1 1 2 930 1 1 18 PRO HB3 H 0.194 2.950 7.692 1.00 . A A . 18 PRO HB3 1 1 2 931 1 1 18 PRO HD2 H -2.972 1.912 5.721 1.00 . A A . 18 PRO HD2 1 1 2 932 1 1 18 PRO HD3 H -2.124 3.471 5.738 1.00 . A A . 18 PRO HD3 1 1 2 933 1 1 18 PRO HG2 H -2.385 1.442 7.878 1.00 . A A . 18 PRO HG2 1 1 2 934 1 1 18 PRO HG3 H -2.097 3.186 8.005 1.00 . A A . 18 PRO HG3 1 1 2 935 1 1 18 PRO N N -0.884 1.790 5.390 1.00 . A A . 18 PRO N 1 1 2 936 1 1 18 PRO O O -0.889 -0.678 7.508 1.00 . A A . 18 PRO O 1 1 2 937 1 1 19 THR C C 1.388 -3.085 6.756 1.00 . A A . 19 THR C 1 1 2 938 1 1 19 THR CA C 0.340 -2.502 5.816 1.00 . A A . 19 THR CA 1 1 2 939 1 1 19 THR CB C 0.494 -3.155 4.429 1.00 . A A . 19 THR CB 1 1 2 940 1 1 19 THR CG2 C -0.254 -2.362 3.367 1.00 . A A . 19 THR CG2 1 1 2 941 1 1 19 THR H H 1.006 -0.655 5.031 1.00 . A A . 19 THR H 1 1 2 942 1 1 19 THR HA H -0.643 -2.740 6.196 1.00 . A A . 19 THR HA 1 1 2 943 1 1 19 THR HB H 0.078 -4.152 4.469 1.00 . A A . 19 THR HB 1 1 2 944 1 1 19 THR HG1 H 1.962 -3.547 3.171 1.00 . A A . 19 THR HG1 1 1 2 945 1 1 19 THR HG21 H 0.409 -2.156 2.539 1.00 . A A . 19 THR HG21 1 1 2 946 1 1 19 THR HG22 H -0.600 -1.430 3.792 1.00 . A A . 19 THR HG22 1 1 2 947 1 1 19 THR HG23 H -1.100 -2.934 3.018 1.00 . A A . 19 THR HG23 1 1 2 948 1 1 19 THR N N 0.453 -1.051 5.738 1.00 . A A . 19 THR N 1 1 2 949 1 1 19 THR O O 1.491 -4.302 6.908 1.00 . A A . 19 THR O 1 1 2 950 1 1 19 THR OG1 O 1.879 -3.242 4.077 1.00 . A A . 19 THR OG1 1 1 2 951 1 1 20 SER C C 3.369 -1.622 9.444 1.00 . A A . 20 SER C 1 1 2 952 1 1 20 SER CA C 3.202 -2.635 8.316 1.00 . A A . 20 SER CA 1 1 2 953 1 1 20 SER CB C 4.529 -2.825 7.579 1.00 . A A . 20 SER CB 1 1 2 954 1 1 20 SER H H 2.030 -1.251 7.227 1.00 . A A . 20 SER H 1 1 2 955 1 1 20 SER HA H 2.898 -3.580 8.741 1.00 . A A . 20 SER HA 1 1 2 956 1 1 20 SER HB2 H 4.345 -3.298 6.627 1.00 . A A . 20 SER HB2 1 1 2 957 1 1 20 SER HB3 H 4.991 -1.863 7.420 1.00 . A A . 20 SER HB3 1 1 2 958 1 1 20 SER HG H 6.141 -3.923 7.767 1.00 . A A . 20 SER HG 1 1 2 959 1 1 20 SER N N 2.162 -2.209 7.387 1.00 . A A . 20 SER N 1 1 2 960 1 1 20 SER O O 2.581 -0.684 9.570 1.00 . A A . 20 SER O 1 1 2 961 1 1 20 SER OG O 5.416 -3.640 8.327 1.00 . A A . 20 SER OG 1 1 2 962 1 1 21 GLN C C 5.109 0.450 10.901 1.00 . A A . 21 GLN C 1 1 2 963 1 1 21 GLN CA C 4.664 -0.927 11.385 1.00 . A A . 21 GLN CA 1 1 2 964 1 1 21 GLN CB C 5.731 -1.531 12.300 1.00 . A A . 21 GLN CB 1 1 2 965 1 1 21 GLN CD C 5.090 -0.394 14.462 1.00 . A A . 21 GLN CD 1 1 2 966 1 1 21 GLN CG C 5.269 -1.713 13.735 1.00 . A A . 21 GLN CG 1 1 2 967 1 1 21 GLN H H 4.986 -2.588 10.112 1.00 . A A . 21 GLN H 1 1 2 968 1 1 21 GLN HA H 3.747 -0.818 11.944 1.00 . A A . 21 GLN HA 1 1 2 969 1 1 21 GLN HB2 H 6.016 -2.498 11.911 1.00 . A A . 21 GLN HB2 1 1 2 970 1 1 21 GLN HB3 H 6.596 -0.884 12.302 1.00 . A A . 21 GLN HB3 1 1 2 971 1 1 21 GLN HE21 H 6.935 0.158 13.967 1.00 . A A . 21 GLN HE21 1 1 2 972 1 1 21 GLN HE22 H 6.037 1.298 14.904 1.00 . A A . 21 GLN HE22 1 1 2 973 1 1 21 GLN HG2 H 4.323 -2.236 13.733 1.00 . A A . 21 GLN HG2 1 1 2 974 1 1 21 GLN HG3 H 6.003 -2.303 14.265 1.00 . A A . 21 GLN HG3 1 1 2 975 1 1 21 GLN N N 4.395 -1.820 10.263 1.00 . A A . 21 GLN N 1 1 2 976 1 1 21 GLN NE2 N 6.125 0.438 14.443 1.00 . A A . 21 GLN NE2 1 1 2 977 1 1 21 GLN O O 4.343 1.412 10.949 1.00 . A A . 21 GLN O 1 1 2 978 1 1 21 GLN OE1 O 4.034 -0.126 15.034 1.00 . A A . 21 GLN OE1 1 1 2 979 1 1 22 THR C C 7.064 1.794 8.439 1.00 . A A . 22 THR C 1 1 2 980 1 1 22 THR CA C 6.901 1.803 9.957 1.00 . A A . 22 THR CA 1 1 2 981 1 1 22 THR CB C 8.260 2.109 10.613 1.00 . A A . 22 THR CB 1 1 2 982 1 1 22 THR CG2 C 9.288 1.046 10.251 1.00 . A A . 22 THR CG2 1 1 2 983 1 1 22 THR H H 6.920 -0.260 10.432 1.00 . A A . 22 THR H 1 1 2 984 1 1 22 THR HA H 6.211 2.588 10.229 1.00 . A A . 22 THR HA 1 1 2 985 1 1 22 THR HB H 8.133 2.113 11.686 1.00 . A A . 22 THR HB 1 1 2 986 1 1 22 THR HG1 H 7.995 4.013 10.166 1.00 . A A . 22 THR HG1 1 1 2 987 1 1 22 THR HG21 H 10.158 1.157 10.882 1.00 . A A . 22 THR HG21 1 1 2 988 1 1 22 THR HG22 H 9.576 1.160 9.217 1.00 . A A . 22 THR HG22 1 1 2 989 1 1 22 THR HG23 H 8.859 0.066 10.399 1.00 . A A . 22 THR HG23 1 1 2 990 1 1 22 THR N N 6.354 0.540 10.441 1.00 . A A . 22 THR N 1 1 2 991 1 1 22 THR O O 7.881 2.532 7.889 1.00 . A A . 22 THR O 1 1 2 992 1 1 22 THR OG1 O 8.732 3.396 10.195 1.00 . A A . 22 THR OG1 1 1 2 993 1 1 23 THR C C 5.060 1.420 5.687 1.00 . A A . 23 THR C 1 1 2 994 1 1 23 THR CA C 6.331 0.862 6.314 1.00 . A A . 23 THR CA 1 1 2 995 1 1 23 THR CB C 6.525 -0.594 5.852 1.00 . A A . 23 THR CB 1 1 2 996 1 1 23 THR CG2 C 7.278 -0.647 4.532 1.00 . A A . 23 THR CG2 1 1 2 997 1 1 23 THR H H 5.641 0.400 8.261 1.00 . A A . 23 THR H 1 1 2 998 1 1 23 THR HA H 7.175 1.443 5.972 1.00 . A A . 23 THR HA 1 1 2 999 1 1 23 THR HB H 5.553 -1.045 5.714 1.00 . A A . 23 THR HB 1 1 2 1000 1 1 23 THR HG1 H 7.605 -2.130 6.456 1.00 . A A . 23 THR HG1 1 1 2 1001 1 1 23 THR HG21 H 6.623 -1.020 3.759 1.00 . A A . 23 THR HG21 1 1 2 1002 1 1 23 THR HG22 H 8.130 -1.303 4.629 1.00 . A A . 23 THR HG22 1 1 2 1003 1 1 23 THR HG23 H 7.615 0.345 4.270 1.00 . A A . 23 THR HG23 1 1 2 1004 1 1 23 THR N N 6.278 0.959 7.769 1.00 . A A . 23 THR N 1 1 2 1005 1 1 23 THR O O 4.030 1.539 6.351 1.00 . A A . 23 THR O 1 1 2 1006 1 1 23 THR OG1 O 7.245 -1.332 6.848 1.00 . A A . 23 THR OG1 1 1 2 1007 1 1 24 TRP C C 3.900 1.785 2.275 1.00 . A A . 24 TRP C 1 1 2 1008 1 1 24 TRP CA C 3.989 2.320 3.700 1.00 . A A . 24 TRP CA 1 1 2 1009 1 1 24 TRP CB C 4.071 3.846 3.673 1.00 . A A . 24 TRP CB 1 1 2 1010 1 1 24 TRP CD1 C 4.357 4.874 6.002 1.00 . A A . 24 TRP CD1 1 1 2 1011 1 1 24 TRP CD2 C 2.245 4.807 5.277 1.00 . A A . 24 TRP CD2 1 1 2 1012 1 1 24 TRP CE2 C 2.258 5.386 6.558 1.00 . A A . 24 TRP CE2 1 1 2 1013 1 1 24 TRP CE3 C 1.027 4.660 4.616 1.00 . A A . 24 TRP CE3 1 1 2 1014 1 1 24 TRP CG C 3.595 4.485 4.940 1.00 . A A . 24 TRP CG 1 1 2 1015 1 1 24 TRP CH2 C -0.084 5.658 6.519 1.00 . A A . 24 TRP CH2 1 1 2 1016 1 1 24 TRP CZ2 C 1.096 5.816 7.192 1.00 . A A . 24 TRP CZ2 1 1 2 1017 1 1 24 TRP CZ3 C -0.126 5.086 5.243 1.00 . A A . 24 TRP CZ3 1 1 2 1018 1 1 24 TRP H H 5.986 1.655 3.928 1.00 . A A . 24 TRP H 1 1 2 1019 1 1 24 TRP HA H 3.099 2.028 4.236 1.00 . A A . 24 TRP HA 1 1 2 1020 1 1 24 TRP HB2 H 5.098 4.141 3.516 1.00 . A A . 24 TRP HB2 1 1 2 1021 1 1 24 TRP HB3 H 3.466 4.219 2.862 1.00 . A A . 24 TRP HB3 1 1 2 1022 1 1 24 TRP HD1 H 5.428 4.765 6.051 1.00 . A A . 24 TRP HD1 1 1 2 1023 1 1 24 TRP HE1 H 3.873 5.767 7.841 1.00 . A A . 24 TRP HE1 1 1 2 1024 1 1 24 TRP HE3 H 0.977 4.224 3.631 1.00 . A A . 24 TRP HE3 1 1 2 1025 1 1 24 TRP HH2 H -1.009 5.976 6.970 1.00 . A A . 24 TRP HH2 1 1 2 1026 1 1 24 TRP HZ2 H 1.112 6.260 8.176 1.00 . A A . 24 TRP HZ2 1 1 2 1027 1 1 24 TRP HZ3 H -1.079 4.980 4.747 1.00 . A A . 24 TRP HZ3 1 1 2 1028 1 1 24 TRP N N 5.137 1.767 4.406 1.00 . A A . 24 TRP N 1 1 2 1029 1 1 24 TRP NE1 N 3.560 5.416 6.982 1.00 . A A . 24 TRP NE1 1 1 2 1030 1 1 24 TRP O O 4.877 1.816 1.526 1.00 . A A . 24 TRP O 1 1 2 1031 1 1 25 GLY C C 1.750 1.761 -0.305 1.00 . A A . 25 GLY C 1 1 2 1032 1 1 25 GLY CA C 2.506 0.784 0.571 1.00 . A A . 25 GLY CA 1 1 2 1033 1 1 25 GLY H H 1.975 1.318 2.546 1.00 . A A . 25 GLY H 1 1 2 1034 1 1 25 GLY HA2 H 3.466 0.579 0.119 1.00 . A A . 25 GLY HA2 1 1 2 1035 1 1 25 GLY HA3 H 1.945 -0.134 0.634 1.00 . A A . 25 GLY HA3 1 1 2 1036 1 1 25 GLY N N 2.716 1.307 1.907 1.00 . A A . 25 GLY N 1 1 2 1037 1 1 25 GLY O O 0.819 2.425 0.155 1.00 . A A . 25 GLY O 1 1 2 1038 1 1 26 CYS C C 0.535 2.051 -3.409 1.00 . A A . 26 CYS C 1 1 2 1039 1 1 26 CYS CA C 1.527 2.775 -2.504 1.00 . A A . 26 CYS CA 1 1 2 1040 1 1 26 CYS CB C 2.591 3.473 -3.353 1.00 . A A . 26 CYS CB 1 1 2 1041 1 1 26 CYS H H 2.917 1.313 -1.862 1.00 . A A . 26 CYS H 1 1 2 1042 1 1 26 CYS HA H 0.995 3.520 -1.933 1.00 . A A . 26 CYS HA 1 1 2 1043 1 1 26 CYS HB2 H 3.520 3.498 -2.804 1.00 . A A . 26 CYS HB2 1 1 2 1044 1 1 26 CYS HB3 H 2.734 2.914 -4.267 1.00 . A A . 26 CYS HB3 1 1 2 1045 1 1 26 CYS N N 2.161 1.860 -1.563 1.00 . A A . 26 CYS N 1 1 2 1046 1 1 26 CYS O O 0.901 1.126 -4.136 1.00 . A A . 26 CYS O 1 1 2 1047 1 1 26 CYS SG S 2.172 5.187 -3.810 1.00 . A A . 26 CYS SG 1 1 2 1048 1 1 27 CYS C C -2.235 2.883 -5.254 1.00 . A A . 27 CYS C 1 1 2 1049 1 1 27 CYS CA C -1.771 1.894 -4.184 1.00 . A A . 27 CYS CA 1 1 2 1050 1 1 27 CYS CB C -2.952 1.468 -3.309 1.00 . A A . 27 CYS CB 1 1 2 1051 1 1 27 CYS H H -0.944 3.231 -2.768 1.00 . A A . 27 CYS H 1 1 2 1052 1 1 27 CYS HA H -1.358 1.022 -4.670 1.00 . A A . 27 CYS HA 1 1 2 1053 1 1 27 CYS HB2 H -2.616 1.367 -2.289 1.00 . A A . 27 CYS HB2 1 1 2 1054 1 1 27 CYS HB3 H -3.717 2.229 -3.357 1.00 . A A . 27 CYS HB3 1 1 2 1055 1 1 27 CYS N N -0.720 2.487 -3.364 1.00 . A A . 27 CYS N 1 1 2 1056 1 1 27 CYS O O -2.394 4.073 -4.979 1.00 . A A . 27 CYS O 1 1 2 1057 1 1 27 CYS SG S -3.711 -0.115 -3.801 1.00 . A A . 27 CYS SG 1 1 2 1058 1 1 28 PRO C C -4.353 3.660 -7.508 1.00 . A A . 28 PRO C 1 1 2 1059 1 1 28 PRO CA C -2.883 3.261 -7.605 1.00 . A A . 28 PRO CA 1 1 2 1060 1 1 28 PRO CB C -2.648 2.381 -8.834 1.00 . A A . 28 PRO CB 1 1 2 1061 1 1 28 PRO CD C -2.270 1.002 -6.916 1.00 . A A . 28 PRO CD 1 1 2 1062 1 1 28 PRO CG C -2.791 0.988 -8.328 1.00 . A A . 28 PRO CG 1 1 2 1063 1 1 28 PRO HA H -2.275 4.150 -7.677 1.00 . A A . 28 PRO HA 1 1 2 1064 1 1 28 PRO HB2 H -3.388 2.608 -9.588 1.00 . A A . 28 PRO HB2 1 1 2 1065 1 1 28 PRO HB3 H -1.658 2.560 -9.226 1.00 . A A . 28 PRO HB3 1 1 2 1066 1 1 28 PRO HD2 H -2.850 0.336 -6.294 1.00 . A A . 28 PRO HD2 1 1 2 1067 1 1 28 PRO HD3 H -1.227 0.724 -6.897 1.00 . A A . 28 PRO HD3 1 1 2 1068 1 1 28 PRO HG2 H -3.831 0.698 -8.342 1.00 . A A . 28 PRO HG2 1 1 2 1069 1 1 28 PRO HG3 H -2.204 0.316 -8.937 1.00 . A A . 28 PRO HG3 1 1 2 1070 1 1 28 PRO N N -2.448 2.406 -6.495 1.00 . A A . 28 PRO N 1 1 2 1071 1 1 28 PRO O O -4.784 4.625 -8.140 1.00 . A A . 28 PRO O 1 1 2 1072 1 1 29 SER C C -6.781 4.109 -5.346 1.00 . A A . 29 SER C 1 1 2 1073 1 1 29 SER CA C -6.542 3.196 -6.550 1.00 . A A . 29 SER CA 1 1 2 1074 1 1 29 SER CB C -7.326 1.894 -6.383 1.00 . A A . 29 SER CB 1 1 2 1075 1 1 29 SER H H -4.723 2.155 -6.242 1.00 . A A . 29 SER H 1 1 2 1076 1 1 29 SER HA H -6.887 3.701 -7.441 1.00 . A A . 29 SER HA 1 1 2 1077 1 1 29 SER HB2 H -6.636 1.064 -6.342 1.00 . A A . 29 SER HB2 1 1 2 1078 1 1 29 SER HB3 H -7.896 1.933 -5.467 1.00 . A A . 29 SER HB3 1 1 2 1079 1 1 29 SER HG H -7.760 1.857 -8.294 1.00 . A A . 29 SER HG 1 1 2 1080 1 1 29 SER N N -5.121 2.913 -6.719 1.00 . A A . 29 SER N 1 1 2 1081 1 1 29 SER O O -6.122 3.970 -4.316 1.00 . A A . 29 SER O 1 1 2 1082 1 1 29 SER OG O -8.217 1.691 -7.466 1.00 . A A . 29 SER OG 1 1 2 1083 1 1 30 PRO C C -8.716 5.305 -3.189 1.00 . A A . 30 PRO C 1 1 2 1084 1 1 30 PRO CA C -8.045 5.994 -4.376 1.00 . A A . 30 PRO CA 1 1 2 1085 1 1 30 PRO CB C -9.000 6.996 -5.028 1.00 . A A . 30 PRO CB 1 1 2 1086 1 1 30 PRO CD C -8.560 5.298 -6.658 1.00 . A A . 30 PRO CD 1 1 2 1087 1 1 30 PRO CG C -9.608 6.263 -6.174 1.00 . A A . 30 PRO CG 1 1 2 1088 1 1 30 PRO HA H -7.160 6.510 -4.032 1.00 . A A . 30 PRO HA 1 1 2 1089 1 1 30 PRO HB2 H -9.749 7.300 -4.312 1.00 . A A . 30 PRO HB2 1 1 2 1090 1 1 30 PRO HB3 H -8.445 7.859 -5.364 1.00 . A A . 30 PRO HB3 1 1 2 1091 1 1 30 PRO HD2 H -9.020 4.381 -6.996 1.00 . A A . 30 PRO HD2 1 1 2 1092 1 1 30 PRO HD3 H -7.976 5.742 -7.451 1.00 . A A . 30 PRO HD3 1 1 2 1093 1 1 30 PRO HG2 H -10.485 5.728 -5.842 1.00 . A A . 30 PRO HG2 1 1 2 1094 1 1 30 PRO HG3 H -9.866 6.958 -6.959 1.00 . A A . 30 PRO HG3 1 1 2 1095 1 1 30 PRO N N -7.728 5.059 -5.462 1.00 . A A . 30 PRO N 1 1 2 1096 1 1 30 PRO O O -8.108 5.139 -2.132 1.00 . A A . 30 PRO O 1 1 2 1097 1 1 31 LYS C C -10.295 2.800 -2.128 1.00 . A A . 31 LYS C 1 1 2 1098 1 1 31 LYS CA C -10.733 4.254 -2.309 1.00 . A A . 31 LYS CA 1 1 2 1099 1 1 31 LYS CB C -12.236 4.314 -2.605 1.00 . A A . 31 LYS CB 1 1 2 1100 1 1 31 LYS CD C -12.991 5.339 -4.773 1.00 . A A . 31 LYS CD 1 1 2 1101 1 1 31 LYS CE C -14.399 5.793 -5.127 1.00 . A A . 31 LYS CE 1 1 2 1102 1 1 31 LYS CG C -12.676 5.590 -3.306 1.00 . A A . 31 LYS CG 1 1 2 1103 1 1 31 LYS H H -10.408 5.091 -4.232 1.00 . A A . 31 LYS H 1 1 2 1104 1 1 31 LYS HA H -10.540 4.787 -1.390 1.00 . A A . 31 LYS HA 1 1 2 1105 1 1 31 LYS HB2 H -12.499 3.476 -3.233 1.00 . A A . 31 LYS HB2 1 1 2 1106 1 1 31 LYS HB3 H -12.776 4.237 -1.674 1.00 . A A . 31 LYS HB3 1 1 2 1107 1 1 31 LYS HD2 H -12.285 5.884 -5.381 1.00 . A A . 31 LYS HD2 1 1 2 1108 1 1 31 LYS HD3 H -12.902 4.282 -4.973 1.00 . A A . 31 LYS HD3 1 1 2 1109 1 1 31 LYS HE2 H -14.968 5.908 -4.216 1.00 . A A . 31 LYS HE2 1 1 2 1110 1 1 31 LYS HE3 H -14.339 6.744 -5.636 1.00 . A A . 31 LYS HE3 1 1 2 1111 1 1 31 LYS HG2 H -13.561 5.970 -2.818 1.00 . A A . 31 LYS HG2 1 1 2 1112 1 1 31 LYS HG3 H -11.883 6.320 -3.237 1.00 . A A . 31 LYS HG3 1 1 2 1113 1 1 31 LYS HZ1 H -15.890 4.377 -5.502 1.00 . A A . 31 LYS HZ1 1 1 2 1114 1 1 31 LYS HZ2 H -14.433 4.066 -6.303 1.00 . A A . 31 LYS HZ2 1 1 2 1115 1 1 31 LYS HZ3 H -15.458 5.293 -6.857 1.00 . A A . 31 LYS HZ3 1 1 2 1116 1 1 31 LYS N N -9.977 4.916 -3.370 1.00 . A A . 31 LYS N 1 1 2 1117 1 1 31 LYS NZ N -15.093 4.814 -6.009 1.00 . A A . 31 LYS NZ 1 1 2 1118 1 1 31 LYS O O -11.074 1.963 -1.671 1.00 . A A . 31 LYS O 1 1 2 1119 1 1 32 ALA C C -8.393 0.766 -0.869 1.00 . A A . 32 ALA C 1 1 2 1120 1 1 32 ALA CA C -8.509 1.152 -2.341 1.00 . A A . 32 ALA CA 1 1 2 1121 1 1 32 ALA CB C -7.152 1.049 -3.021 1.00 . A A . 32 ALA CB 1 1 2 1122 1 1 32 ALA H H -8.465 3.211 -2.829 1.00 . A A . 32 ALA H 1 1 2 1123 1 1 32 ALA HA H -9.187 0.469 -2.834 1.00 . A A . 32 ALA HA 1 1 2 1124 1 1 32 ALA HB1 H -6.559 1.918 -2.779 1.00 . A A . 32 ALA HB1 1 1 2 1125 1 1 32 ALA HB2 H -7.289 0.993 -4.091 1.00 . A A . 32 ALA HB2 1 1 2 1126 1 1 32 ALA HB3 H -6.644 0.159 -2.677 1.00 . A A . 32 ALA HB3 1 1 2 1127 1 1 32 ALA N N -9.044 2.504 -2.478 1.00 . A A . 32 ALA N 1 1 2 1128 1 1 32 ALA O O -7.908 1.548 -0.051 1.00 . A A . 32 ALA O 1 1 2 1129 1 1 33 VAL C C -7.410 -1.513 1.154 1.00 . A A . 33 VAL C 1 1 2 1130 1 1 33 VAL CA C -8.781 -0.924 0.841 1.00 . A A . 33 VAL CA 1 1 2 1131 1 1 33 VAL CB C -9.861 -1.989 1.113 1.00 . A A . 33 VAL CB 1 1 2 1132 1 1 33 VAL CG1 C -9.879 -2.373 2.585 1.00 . A A . 33 VAL CG1 1 1 2 1133 1 1 33 VAL CG2 C -11.227 -1.489 0.667 1.00 . A A . 33 VAL CG2 1 1 2 1134 1 1 33 VAL H H -9.215 -1.023 -1.235 1.00 . A A . 33 VAL H 1 1 2 1135 1 1 33 VAL HA H -8.960 -0.084 1.496 1.00 . A A . 33 VAL HA 1 1 2 1136 1 1 33 VAL HB H -9.620 -2.872 0.538 1.00 . A A . 33 VAL HB 1 1 2 1137 1 1 33 VAL HG11 H -10.696 -1.868 3.078 1.00 . A A . 33 VAL HG11 1 1 2 1138 1 1 33 VAL HG12 H -8.945 -2.081 3.043 1.00 . A A . 33 VAL HG12 1 1 2 1139 1 1 33 VAL HG13 H -10.007 -3.441 2.677 1.00 . A A . 33 VAL HG13 1 1 2 1140 1 1 33 VAL HG21 H -11.857 -2.331 0.425 1.00 . A A . 33 VAL HG21 1 1 2 1141 1 1 33 VAL HG22 H -11.115 -0.860 -0.203 1.00 . A A . 33 VAL HG22 1 1 2 1142 1 1 33 VAL HG23 H -11.679 -0.920 1.466 1.00 . A A . 33 VAL HG23 1 1 2 1143 1 1 33 VAL N N -8.838 -0.442 -0.537 1.00 . A A . 33 VAL N 1 1 2 1144 1 1 33 VAL O O -6.905 -2.350 0.416 1.00 . A A . 33 VAL O 1 1 2 1145 1 1 34 CYS C C -5.562 -2.949 3.253 1.00 . A A . 34 CYS C 1 1 2 1146 1 1 34 CYS CA C -5.486 -1.557 2.633 1.00 . A A . 34 CYS CA 1 1 2 1147 1 1 34 CYS CB C -4.819 -0.593 3.614 1.00 . A A . 34 CYS CB 1 1 2 1148 1 1 34 CYS H H -7.249 -0.393 2.803 1.00 . A A . 34 CYS H 1 1 2 1149 1 1 34 CYS HA H -4.883 -1.612 1.738 1.00 . A A . 34 CYS HA 1 1 2 1150 1 1 34 CYS HB2 H -5.163 -0.814 4.612 1.00 . A A . 34 CYS HB2 1 1 2 1151 1 1 34 CYS HB3 H -3.750 -0.733 3.570 1.00 . A A . 34 CYS HB3 1 1 2 1152 1 1 34 CYS N N -6.804 -1.067 2.248 1.00 . A A . 34 CYS N 1 1 2 1153 1 1 34 CYS O O -5.681 -3.086 4.472 1.00 . A A . 34 CYS O 1 1 2 1154 1 1 34 CYS SG S -5.163 1.165 3.284 1.00 . A A . 34 CYS SG 1 1 2 1155 1 1 35 CYS C C -4.456 -5.552 3.978 1.00 . A A . 35 CYS C 1 1 2 1156 1 1 35 CYS CA C -5.502 -5.357 2.886 1.00 . A A . 35 CYS CA 1 1 2 1157 1 1 35 CYS CB C -5.247 -6.326 1.731 1.00 . A A . 35 CYS CB 1 1 2 1158 1 1 35 CYS H H -5.361 -3.804 1.455 1.00 . A A . 35 CYS H 1 1 2 1159 1 1 35 CYS HA H -6.482 -5.545 3.301 1.00 . A A . 35 CYS HA 1 1 2 1160 1 1 35 CYS HB2 H -5.641 -5.901 0.821 1.00 . A A . 35 CYS HB2 1 1 2 1161 1 1 35 CYS HB3 H -4.183 -6.473 1.623 1.00 . A A . 35 CYS HB3 1 1 2 1162 1 1 35 CYS N N -5.469 -3.977 2.413 1.00 . A A . 35 CYS N 1 1 2 1163 1 1 35 CYS O O -3.248 -5.557 3.705 1.00 . A A . 35 CYS O 1 1 2 1164 1 1 35 CYS SG S -6.014 -7.964 1.953 1.00 . A A . 35 CYS SG 1 1 2 1165 1 1 36 ASP C C -3.870 -7.317 6.752 1.00 . A A . 36 ASP C 1 1 2 1166 1 1 36 ASP CA C -4.051 -5.852 6.365 1.00 . A A . 36 ASP CA 1 1 2 1167 1 1 36 ASP CB C -4.590 -5.063 7.559 1.00 . A A . 36 ASP CB 1 1 2 1168 1 1 36 ASP CG C -5.802 -5.719 8.193 1.00 . A A . 36 ASP CG 1 1 2 1169 1 1 36 ASP H H -5.900 -5.659 5.356 1.00 . A A . 36 ASP H 1 1 2 1170 1 1 36 ASP HA H -3.087 -5.449 6.095 1.00 . A A . 36 ASP HA 1 1 2 1171 1 1 36 ASP HB2 H -3.816 -4.983 8.308 1.00 . A A . 36 ASP HB2 1 1 2 1172 1 1 36 ASP HB3 H -4.870 -4.072 7.231 1.00 . A A . 36 ASP HB3 1 1 2 1173 1 1 36 ASP N N -4.932 -5.687 5.215 1.00 . A A . 36 ASP N 1 1 2 1174 1 1 36 ASP O O -2.980 -7.638 7.540 1.00 . A A . 36 ASP O 1 1 2 1175 1 1 36 ASP OD1 O -6.886 -5.684 7.575 1.00 . A A . 36 ASP OD1 1 1 2 1176 1 1 36 ASP OD2 O -5.666 -6.265 9.308 1.00 . A A . 36 ASP OD2 1 1 2 1177 1 1 37 ASP C C -3.142 -10.085 6.267 1.00 . A A . 37 ASP C 1 1 2 1178 1 1 37 ASP CA C -4.573 -9.631 6.511 1.00 . A A . 37 ASP CA 1 1 2 1179 1 1 37 ASP CB C -5.541 -10.453 5.657 1.00 . A A . 37 ASP CB 1 1 2 1180 1 1 37 ASP CG C -6.120 -11.633 6.414 1.00 . A A . 37 ASP CG 1 1 2 1181 1 1 37 ASP H H -5.387 -7.923 5.568 1.00 . A A . 37 ASP H 1 1 2 1182 1 1 37 ASP HA H -4.813 -9.768 7.556 1.00 . A A . 37 ASP HA 1 1 2 1183 1 1 37 ASP HB2 H -6.354 -9.822 5.335 1.00 . A A . 37 ASP HB2 1 1 2 1184 1 1 37 ASP HB3 H -5.015 -10.828 4.791 1.00 . A A . 37 ASP HB3 1 1 2 1185 1 1 37 ASP N N -4.695 -8.210 6.200 1.00 . A A . 37 ASP N 1 1 2 1186 1 1 37 ASP O O -2.569 -10.842 7.051 1.00 . A A . 37 ASP O 1 1 2 1187 1 1 37 ASP OD1 O -5.347 -12.343 7.090 1.00 . A A . 37 ASP OD1 1 1 2 1188 1 1 37 ASP OD2 O -7.348 -11.846 6.331 1.00 . A A . 37 ASP OD2 1 1 2 1189 1 1 38 MET C C -0.406 -8.589 4.704 1.00 . A A . 38 MET C 1 1 2 1190 1 1 38 MET CA C -1.195 -9.890 4.819 1.00 . A A . 38 MET CA 1 1 2 1191 1 1 38 MET CB C -1.145 -10.671 3.503 1.00 . A A . 38 MET CB 1 1 2 1192 1 1 38 MET CE C -3.653 -11.351 1.263 1.00 . A A . 38 MET CE 1 1 2 1193 1 1 38 MET CG C -2.067 -11.878 3.478 1.00 . A A . 38 MET CG 1 1 2 1194 1 1 38 MET H H -3.082 -8.971 4.615 1.00 . A A . 38 MET H 1 1 2 1195 1 1 38 MET HA H -0.767 -10.491 5.608 1.00 . A A . 38 MET HA 1 1 2 1196 1 1 38 MET HB2 H -1.427 -10.012 2.695 1.00 . A A . 38 MET HB2 1 1 2 1197 1 1 38 MET HB3 H -0.134 -11.015 3.340 1.00 . A A . 38 MET HB3 1 1 2 1198 1 1 38 MET HE1 H -3.778 -11.436 0.193 1.00 . A A . 38 MET HE1 1 1 2 1199 1 1 38 MET HE2 H -3.369 -10.340 1.513 1.00 . A A . 38 MET HE2 1 1 2 1200 1 1 38 MET HE3 H -4.583 -11.596 1.754 1.00 . A A . 38 MET HE3 1 1 2 1201 1 1 38 MET HG2 H -1.615 -12.672 4.053 1.00 . A A . 38 MET HG2 1 1 2 1202 1 1 38 MET HG3 H -3.011 -11.603 3.926 1.00 . A A . 38 MET HG3 1 1 2 1203 1 1 38 MET N N -2.569 -9.583 5.181 1.00 . A A . 38 MET N 1 1 2 1204 1 1 38 MET O O -0.077 -7.970 5.716 1.00 . A A . 38 MET O 1 1 2 1205 1 1 38 MET SD S -2.375 -12.483 1.806 1.00 . A A . 38 MET SD 1 1 2 1206 1 1 39 GLN C C 0.184 -6.343 1.860 1.00 . A A . 39 GLN C 1 1 2 1207 1 1 39 GLN CA C 0.525 -6.879 3.248 1.00 . A A . 39 GLN CA 1 1 2 1208 1 1 39 GLN CB C 2.039 -7.056 3.385 1.00 . A A . 39 GLN CB 1 1 2 1209 1 1 39 GLN CD C 4.074 -6.877 4.870 1.00 . A A . 39 GLN CD 1 1 2 1210 1 1 39 GLN CG C 2.565 -6.763 4.781 1.00 . A A . 39 GLN CG 1 1 2 1211 1 1 39 GLN H H -0.508 -8.632 2.702 1.00 . A A . 39 GLN H 1 1 2 1212 1 1 39 GLN HA H 0.181 -6.175 3.991 1.00 . A A . 39 GLN HA 1 1 2 1213 1 1 39 GLN HB2 H 2.295 -8.075 3.134 1.00 . A A . 39 GLN HB2 1 1 2 1214 1 1 39 GLN HB3 H 2.531 -6.391 2.691 1.00 . A A . 39 GLN HB3 1 1 2 1215 1 1 39 GLN HE21 H 3.917 -8.741 5.545 1.00 . A A . 39 GLN HE21 1 1 2 1216 1 1 39 GLN HE22 H 5.526 -8.137 5.375 1.00 . A A . 39 GLN HE22 1 1 2 1217 1 1 39 GLN HG2 H 2.280 -5.758 5.056 1.00 . A A . 39 GLN HG2 1 1 2 1218 1 1 39 GLN HG3 H 2.124 -7.464 5.473 1.00 . A A . 39 GLN HG3 1 1 2 1219 1 1 39 GLN N N -0.158 -8.143 3.476 1.00 . A A . 39 GLN N 1 1 2 1220 1 1 39 GLN NE2 N 4.554 -8.035 5.307 1.00 . A A . 39 GLN NE2 1 1 2 1221 1 1 39 GLN O O 0.966 -6.522 0.926 1.00 . A A . 39 GLN O 1 1 2 1222 1 1 39 GLN OE1 O 4.800 -5.937 4.547 1.00 . A A . 39 GLN OE1 1 1 2 1223 1 1 40 HIS C C -2.614 -4.345 0.407 1.00 . A A . 40 HIS C 1 1 2 1224 1 1 40 HIS CA C -1.360 -5.207 0.379 1.00 . A A . 40 HIS CA 1 1 2 1225 1 1 40 HIS CB C -1.568 -6.380 -0.585 1.00 . A A . 40 HIS CB 1 1 2 1226 1 1 40 HIS CD2 C 0.456 -6.383 -2.210 1.00 . A A . 40 HIS CD2 1 1 2 1227 1 1 40 HIS CE1 C -0.601 -5.791 -4.036 1.00 . A A . 40 HIS CE1 1 1 2 1228 1 1 40 HIS CG C -0.850 -6.218 -1.889 1.00 . A A . 40 HIS CG 1 1 2 1229 1 1 40 HIS H H -1.601 -5.619 2.465 1.00 . A A . 40 HIS H 1 1 2 1230 1 1 40 HIS HA H -0.541 -4.607 0.014 1.00 . A A . 40 HIS HA 1 1 2 1231 1 1 40 HIS HB2 H -1.209 -7.286 -0.120 1.00 . A A . 40 HIS HB2 1 1 2 1232 1 1 40 HIS HB3 H -2.622 -6.481 -0.793 1.00 . A A . 40 HIS HB3 1 1 2 1233 1 1 40 HIS HD1 H -2.440 -5.653 -3.150 1.00 . A A . 40 HIS HD1 1 1 2 1234 1 1 40 HIS HD2 H 1.249 -6.674 -1.536 1.00 . A A . 40 HIS HD2 1 1 2 1235 1 1 40 HIS HE1 H -0.813 -5.527 -5.062 1.00 . A A . 40 HIS HE1 1 1 2 1236 1 1 40 HIS HE2 H 1.389 -6.265 -4.085 1.00 . A A . 40 HIS HE2 1 1 2 1237 1 1 40 HIS N N -0.982 -5.710 1.701 1.00 . A A . 40 HIS N 1 1 2 1238 1 1 40 HIS ND1 N -1.485 -5.846 -3.056 1.00 . A A . 40 HIS ND1 1 1 2 1239 1 1 40 HIS NE2 N 0.583 -6.111 -3.549 1.00 . A A . 40 HIS NE2 1 1 2 1240 1 1 40 HIS O O -3.138 -4.014 1.467 1.00 . A A . 40 HIS O 1 1 2 1241 1 1 41 CYS C C -5.141 -3.711 -2.097 1.00 . A A . 41 CYS C 1 1 2 1242 1 1 41 CYS CA C -4.278 -3.175 -0.955 1.00 . A A . 41 CYS CA 1 1 2 1243 1 1 41 CYS CB C -3.897 -1.717 -1.228 1.00 . A A . 41 CYS CB 1 1 2 1244 1 1 41 CYS H H -2.608 -4.307 -1.589 1.00 . A A . 41 CYS H 1 1 2 1245 1 1 41 CYS HA H -4.843 -3.225 -0.038 1.00 . A A . 41 CYS HA 1 1 2 1246 1 1 41 CYS HB2 H -4.793 -1.151 -1.433 1.00 . A A . 41 CYS HB2 1 1 2 1247 1 1 41 CYS HB3 H -3.413 -1.309 -0.352 1.00 . A A . 41 CYS HB3 1 1 2 1248 1 1 41 CYS N N -3.082 -3.993 -0.791 1.00 . A A . 41 CYS N 1 1 2 1249 1 1 41 CYS O O -4.622 -4.173 -3.113 1.00 . A A . 41 CYS O 1 1 2 1250 1 1 41 CYS SG S -2.769 -1.491 -2.642 1.00 . A A . 41 CYS SG 1 1 2 1251 1 1 42 CYS C C -8.160 -2.945 -3.547 1.00 . A A . 42 CYS C 1 1 2 1252 1 1 42 CYS CA C -7.395 -4.117 -2.934 1.00 . A A . 42 CYS CA 1 1 2 1253 1 1 42 CYS CB C -8.376 -5.121 -2.326 1.00 . A A . 42 CYS CB 1 1 2 1254 1 1 42 CYS H H -6.808 -3.264 -1.097 1.00 . A A . 42 CYS H 1 1 2 1255 1 1 42 CYS HA H -6.825 -4.606 -3.711 1.00 . A A . 42 CYS HA 1 1 2 1256 1 1 42 CYS HB2 H -8.505 -4.895 -1.278 1.00 . A A . 42 CYS HB2 1 1 2 1257 1 1 42 CYS HB3 H -9.330 -5.031 -2.828 1.00 . A A . 42 CYS HB3 1 1 2 1258 1 1 42 CYS N N -6.458 -3.644 -1.923 1.00 . A A . 42 CYS N 1 1 2 1259 1 1 42 CYS O O -8.429 -1.948 -2.872 1.00 . A A . 42 CYS O 1 1 2 1260 1 1 42 CYS SG S -7.843 -6.859 -2.453 1.00 . A A . 42 CYS SG 1 1 2 1261 1 1 43 PRO C C -10.400 -1.410 -4.773 1.00 . A A . 43 PRO C 1 1 2 1262 1 1 43 PRO CA C -9.238 -1.997 -5.564 1.00 . A A . 43 PRO CA 1 1 2 1263 1 1 43 PRO CB C -9.749 -2.723 -6.803 1.00 . A A . 43 PRO CB 1 1 2 1264 1 1 43 PRO CD C -8.218 -4.201 -5.721 1.00 . A A . 43 PRO CD 1 1 2 1265 1 1 43 PRO CG C -8.711 -3.754 -7.071 1.00 . A A . 43 PRO CG 1 1 2 1266 1 1 43 PRO HA H -8.576 -1.199 -5.865 1.00 . A A . 43 PRO HA 1 1 2 1267 1 1 43 PRO HB2 H -10.710 -3.171 -6.593 1.00 . A A . 43 PRO HB2 1 1 2 1268 1 1 43 PRO HB3 H -9.837 -2.028 -7.624 1.00 . A A . 43 PRO HB3 1 1 2 1269 1 1 43 PRO HD2 H -8.755 -5.079 -5.395 1.00 . A A . 43 PRO HD2 1 1 2 1270 1 1 43 PRO HD3 H -7.157 -4.396 -5.754 1.00 . A A . 43 PRO HD3 1 1 2 1271 1 1 43 PRO HG2 H -9.146 -4.584 -7.607 1.00 . A A . 43 PRO HG2 1 1 2 1272 1 1 43 PRO HG3 H -7.903 -3.317 -7.638 1.00 . A A . 43 PRO HG3 1 1 2 1273 1 1 43 PRO N N -8.512 -3.048 -4.844 1.00 . A A . 43 PRO N 1 1 2 1274 1 1 43 PRO O O -11.015 -2.080 -3.937 1.00 . A A . 43 PRO O 1 1 2 1275 1 1 44 ALA C C -13.067 -0.231 -4.439 1.00 . A A . 44 ALA C 1 1 2 1276 1 1 44 ALA CA C -11.771 0.567 -4.394 1.00 . A A . 44 ALA CA 1 1 2 1277 1 1 44 ALA CB C -11.970 1.930 -5.038 1.00 . A A . 44 ALA CB 1 1 2 1278 1 1 44 ALA H H -10.155 0.317 -5.734 1.00 . A A . 44 ALA H 1 1 2 1279 1 1 44 ALA HA H -11.488 0.721 -3.363 1.00 . A A . 44 ALA HA 1 1 2 1280 1 1 44 ALA HB1 H -12.385 1.804 -6.027 1.00 . A A . 44 ALA HB1 1 1 2 1281 1 1 44 ALA HB2 H -11.020 2.437 -5.107 1.00 . A A . 44 ALA HB2 1 1 2 1282 1 1 44 ALA HB3 H -12.648 2.517 -4.436 1.00 . A A . 44 ALA HB3 1 1 2 1283 1 1 44 ALA N N -10.690 -0.145 -5.055 1.00 . A A . 44 ALA N 1 1 2 1284 1 1 44 ALA O O -13.535 -0.616 -5.511 1.00 . A A . 44 ALA O 1 1 2 1285 1 1 45 GLY C C -14.729 -2.699 -3.314 1.00 . A A . 45 GLY C 1 1 2 1286 1 1 45 GLY CA C -14.896 -1.195 -3.190 1.00 . A A . 45 GLY CA 1 1 2 1287 1 1 45 GLY H H -13.236 -0.115 -2.451 1.00 . A A . 45 GLY H 1 1 2 1288 1 1 45 GLY HA2 H -15.364 -0.978 -2.242 1.00 . A A . 45 GLY HA2 1 1 2 1289 1 1 45 GLY HA3 H -15.547 -0.854 -3.982 1.00 . A A . 45 GLY HA3 1 1 2 1290 1 1 45 GLY N N -13.648 -0.462 -3.269 1.00 . A A . 45 GLY N 1 1 2 1291 1 1 45 GLY O O -15.704 -3.408 -3.562 1.00 . A A . 45 GLY O 1 1 2 1292 1 1 46 TYR C C -12.691 -5.161 -1.895 1.00 . A A . 46 TYR C 1 1 2 1293 1 1 46 TYR CA C -13.265 -4.640 -3.210 1.00 . A A . 46 TYR CA 1 1 2 1294 1 1 46 TYR CB C -12.309 -4.959 -4.361 1.00 . A A . 46 TYR CB 1 1 2 1295 1 1 46 TYR CD1 C -13.346 -5.982 -6.424 1.00 . A A . 46 TYR CD1 1 1 2 1296 1 1 46 TYR CD2 C -13.147 -3.609 -6.322 1.00 . A A . 46 TYR CD2 1 1 2 1297 1 1 46 TYR CE1 C -13.928 -5.884 -7.674 1.00 . A A . 46 TYR CE1 1 1 2 1298 1 1 46 TYR CE2 C -13.728 -3.502 -7.571 1.00 . A A . 46 TYR CE2 1 1 2 1299 1 1 46 TYR CG C -12.945 -4.849 -5.728 1.00 . A A . 46 TYR CG 1 1 2 1300 1 1 46 TYR CZ C -14.117 -4.642 -8.242 1.00 . A A . 46 TYR CZ 1 1 2 1301 1 1 46 TYR H H -12.754 -2.609 -2.916 1.00 . A A . 46 TYR H 1 1 2 1302 1 1 46 TYR HA H -14.211 -5.126 -3.393 1.00 . A A . 46 TYR HA 1 1 2 1303 1 1 46 TYR HB2 H -11.474 -4.277 -4.326 1.00 . A A . 46 TYR HB2 1 1 2 1304 1 1 46 TYR HB3 H -11.944 -5.971 -4.245 1.00 . A A . 46 TYR HB3 1 1 2 1305 1 1 46 TYR HD1 H -13.197 -6.953 -5.975 1.00 . A A . 46 TYR HD1 1 1 2 1306 1 1 46 TYR HD2 H -12.841 -2.718 -5.795 1.00 . A A . 46 TYR HD2 1 1 2 1307 1 1 46 TYR HE1 H -14.233 -6.777 -8.199 1.00 . A A . 46 TYR HE1 1 1 2 1308 1 1 46 TYR HE2 H -13.875 -2.529 -8.016 1.00 . A A . 46 TYR HE2 1 1 2 1309 1 1 46 TYR HH H -14.660 -5.389 -9.930 1.00 . A A . 46 TYR HH 1 1 2 1310 1 1 46 TYR N N -13.508 -3.203 -3.127 1.00 . A A . 46 TYR N 1 1 2 1311 1 1 46 TYR O O -12.210 -4.385 -1.069 1.00 . A A . 46 TYR O 1 1 2 1312 1 1 46 TYR OH O -14.696 -4.539 -9.487 1.00 . A A . 46 TYR OH 1 1 2 1313 1 1 47 LYS C C -11.352 -8.295 -0.797 1.00 . A A . 47 LYS C 1 1 2 1314 1 1 47 LYS CA C -12.237 -7.092 -0.481 1.00 . A A . 47 LYS CA 1 1 2 1315 1 1 47 LYS CB C -13.399 -7.518 0.421 1.00 . A A . 47 LYS CB 1 1 2 1316 1 1 47 LYS CD C -13.802 -9.960 0.851 1.00 . A A . 47 LYS CD 1 1 2 1317 1 1 47 LYS CE C -15.012 -10.866 1.015 1.00 . A A . 47 LYS CE 1 1 2 1318 1 1 47 LYS CG C -14.110 -8.777 -0.051 1.00 . A A . 47 LYS CG 1 1 2 1319 1 1 47 LYS H H -13.147 -7.043 -2.394 1.00 . A A . 47 LYS H 1 1 2 1320 1 1 47 LYS HA H -11.646 -6.353 0.038 1.00 . A A . 47 LYS HA 1 1 2 1321 1 1 47 LYS HB2 H -13.020 -7.696 1.416 1.00 . A A . 47 LYS HB2 1 1 2 1322 1 1 47 LYS HB3 H -14.121 -6.715 0.458 1.00 . A A . 47 LYS HB3 1 1 2 1323 1 1 47 LYS HD2 H -12.994 -10.533 0.416 1.00 . A A . 47 LYS HD2 1 1 2 1324 1 1 47 LYS HD3 H -13.503 -9.593 1.821 1.00 . A A . 47 LYS HD3 1 1 2 1325 1 1 47 LYS HE2 H -15.906 -10.285 0.843 1.00 . A A . 47 LYS HE2 1 1 2 1326 1 1 47 LYS HE3 H -14.953 -11.659 0.285 1.00 . A A . 47 LYS HE3 1 1 2 1327 1 1 47 LYS HG2 H -15.175 -8.600 -0.044 1.00 . A A . 47 LYS HG2 1 1 2 1328 1 1 47 LYS HG3 H -13.787 -9.006 -1.056 1.00 . A A . 47 LYS HG3 1 1 2 1329 1 1 47 LYS HZ1 H -14.376 -12.226 2.467 1.00 . A A . 47 LYS HZ1 1 1 2 1330 1 1 47 LYS HZ2 H -16.025 -11.858 2.549 1.00 . A A . 47 LYS HZ2 1 1 2 1331 1 1 47 LYS HZ3 H -14.881 -10.737 3.096 1.00 . A A . 47 LYS HZ3 1 1 2 1332 1 1 47 LYS N N -12.749 -6.476 -1.702 1.00 . A A . 47 LYS N 1 1 2 1333 1 1 47 LYS NZ N -15.078 -11.463 2.377 1.00 . A A . 47 LYS NZ 1 1 2 1334 1 1 47 LYS O O -11.453 -8.889 -1.870 1.00 . A A . 47 LYS O 1 1 2 1335 1 1 48 CYS C C -10.256 -11.085 0.384 1.00 . A A . 48 CYS C 1 1 2 1336 1 1 48 CYS CA C -9.580 -9.779 -0.023 1.00 . A A . 48 CYS CA 1 1 2 1337 1 1 48 CYS CB C -8.309 -9.575 0.804 1.00 . A A . 48 CYS CB 1 1 2 1338 1 1 48 CYS H H -10.456 -8.131 0.981 1.00 . A A . 48 CYS H 1 1 2 1339 1 1 48 CYS HA H -9.315 -9.836 -1.068 1.00 . A A . 48 CYS HA 1 1 2 1340 1 1 48 CYS HB2 H -8.494 -9.894 1.818 1.00 . A A . 48 CYS HB2 1 1 2 1341 1 1 48 CYS HB3 H -7.516 -10.177 0.382 1.00 . A A . 48 CYS HB3 1 1 2 1342 1 1 48 CYS N N -10.486 -8.647 0.149 1.00 . A A . 48 CYS N 1 1 2 1343 1 1 48 CYS O O -10.695 -11.238 1.525 1.00 . A A . 48 CYS O 1 1 2 1344 1 1 48 CYS SG S -7.725 -7.851 0.866 1.00 . A A . 48 CYS SG 1 1 2 1345 1 1 49 GLY C C -10.000 -14.470 -0.497 1.00 . A A . 49 GLY C 1 1 2 1346 1 1 49 GLY CA C -10.951 -13.306 -0.272 1.00 . A A . 49 GLY CA 1 1 2 1347 1 1 49 GLY H H -9.963 -11.850 -1.444 1.00 . A A . 49 GLY H 1 1 2 1348 1 1 49 GLY HA2 H -11.280 -13.319 0.757 1.00 . A A . 49 GLY HA2 1 1 2 1349 1 1 49 GLY HA3 H -11.810 -13.429 -0.915 1.00 . A A . 49 GLY HA3 1 1 2 1350 1 1 49 GLY N N -10.332 -12.025 -0.553 1.00 . A A . 49 GLY N 1 1 2 1351 1 1 49 GLY O O -8.822 -14.259 -0.788 1.00 . A A . 49 GLY O 1 1 2 1352 1 1 50 PRO C C -8.958 -16.928 -1.917 1.00 . A A . 50 PRO C 1 1 2 1353 1 1 50 PRO CA C -9.655 -16.915 -0.561 1.00 . A A . 50 PRO CA 1 1 2 1354 1 1 50 PRO CB C -10.658 -18.068 -0.467 1.00 . A A . 50 PRO CB 1 1 2 1355 1 1 50 PRO CD C -11.876 -16.065 -0.019 1.00 . A A . 50 PRO CD 1 1 2 1356 1 1 50 PRO CG C -11.791 -17.524 0.329 1.00 . A A . 50 PRO CG 1 1 2 1357 1 1 50 PRO HA H -8.916 -17.013 0.221 1.00 . A A . 50 PRO HA 1 1 2 1358 1 1 50 PRO HB2 H -10.973 -18.355 -1.460 1.00 . A A . 50 PRO HB2 1 1 2 1359 1 1 50 PRO HB3 H -10.198 -18.911 0.028 1.00 . A A . 50 PRO HB3 1 1 2 1360 1 1 50 PRO HD2 H -12.534 -15.914 -0.862 1.00 . A A . 50 PRO HD2 1 1 2 1361 1 1 50 PRO HD3 H -12.214 -15.492 0.833 1.00 . A A . 50 PRO HD3 1 1 2 1362 1 1 50 PRO HG2 H -12.708 -18.028 0.058 1.00 . A A . 50 PRO HG2 1 1 2 1363 1 1 50 PRO HG3 H -11.593 -17.647 1.384 1.00 . A A . 50 PRO HG3 1 1 2 1364 1 1 50 PRO N N -10.485 -15.719 -0.367 1.00 . A A . 50 PRO N 1 1 2 1365 1 1 50 PRO O O -9.599 -16.772 -2.958 1.00 . A A . 50 PRO O 1 1 2 1366 1 1 51 GLY C C -5.912 -15.983 -3.244 1.00 . A A . 51 GLY C 1 1 2 1367 1 1 51 GLY CA C -6.876 -17.148 -3.131 1.00 . A A . 51 GLY CA 1 1 2 1368 1 1 51 GLY H H -7.187 -17.235 -1.038 1.00 . A A . 51 GLY H 1 1 2 1369 1 1 51 GLY HA2 H -6.315 -18.070 -3.169 1.00 . A A . 51 GLY HA2 1 1 2 1370 1 1 51 GLY HA3 H -7.558 -17.119 -3.966 1.00 . A A . 51 GLY HA3 1 1 2 1371 1 1 51 GLY N N -7.642 -17.116 -1.898 1.00 . A A . 51 GLY N 1 1 2 1372 1 1 51 GLY O O -4.940 -16.046 -3.996 1.00 . A A . 51 GLY O 1 1 2 1373 1 1 52 GLY C C -5.740 -12.756 -3.595 1.00 . A A . 52 GLY C 1 1 2 1374 1 1 52 GLY CA C -5.325 -13.748 -2.528 1.00 . A A . 52 GLY CA 1 1 2 1375 1 1 52 GLY H H -6.973 -14.927 -1.915 1.00 . A A . 52 GLY H 1 1 2 1376 1 1 52 GLY HA2 H -5.360 -13.262 -1.565 1.00 . A A . 52 GLY HA2 1 1 2 1377 1 1 52 GLY HA3 H -4.311 -14.065 -2.722 1.00 . A A . 52 GLY HA3 1 1 2 1378 1 1 52 GLY N N -6.184 -14.919 -2.495 1.00 . A A . 52 GLY N 1 1 2 1379 1 1 52 GLY O O -4.906 -12.024 -4.130 1.00 . A A . 52 GLY O 1 1 2 1380 1 1 53 THR C C -8.622 -10.899 -4.314 1.00 . A A . 53 THR C 1 1 2 1381 1 1 53 THR CA C -7.561 -11.816 -4.912 1.00 . A A . 53 THR CA 1 1 2 1382 1 1 53 THR CB C -8.170 -12.579 -6.105 1.00 . A A . 53 THR CB 1 1 2 1383 1 1 53 THR CG2 C -7.668 -14.015 -6.151 1.00 . A A . 53 THR CG2 1 1 2 1384 1 1 53 THR H H -7.649 -13.334 -3.440 1.00 . A A . 53 THR H 1 1 2 1385 1 1 53 THR HA H -6.742 -11.212 -5.276 1.00 . A A . 53 THR HA 1 1 2 1386 1 1 53 THR HB H -7.876 -12.082 -7.019 1.00 . A A . 53 THR HB 1 1 2 1387 1 1 53 THR HG1 H -9.932 -11.696 -6.217 1.00 . A A . 53 THR HG1 1 1 2 1388 1 1 53 THR HG21 H -6.597 -14.026 -6.014 1.00 . A A . 53 THR HG21 1 1 2 1389 1 1 53 THR HG22 H -7.913 -14.452 -7.109 1.00 . A A . 53 THR HG22 1 1 2 1390 1 1 53 THR HG23 H -8.138 -14.585 -5.364 1.00 . A A . 53 THR HG23 1 1 2 1391 1 1 53 THR N N -7.033 -12.728 -3.903 1.00 . A A . 53 THR N 1 1 2 1392 1 1 53 THR O O -9.066 -11.103 -3.183 1.00 . A A . 53 THR O 1 1 2 1393 1 1 53 THR OG1 O -9.600 -12.574 -6.014 1.00 . A A . 53 THR OG1 1 1 2 1394 1 1 54 CYS C C -11.369 -9.195 -5.331 1.00 . A A . 54 CYS C 1 1 2 1395 1 1 54 CYS CA C -10.040 -8.947 -4.625 1.00 . A A . 54 CYS CA 1 1 2 1396 1 1 54 CYS CB C -9.572 -7.510 -4.866 1.00 . A A . 54 CYS CB 1 1 2 1397 1 1 54 CYS H H -8.637 -9.783 -5.973 1.00 . A A . 54 CYS H 1 1 2 1398 1 1 54 CYS HA H -10.177 -9.096 -3.565 1.00 . A A . 54 CYS HA 1 1 2 1399 1 1 54 CYS HB2 H -9.707 -7.266 -5.910 1.00 . A A . 54 CYS HB2 1 1 2 1400 1 1 54 CYS HB3 H -10.168 -6.840 -4.265 1.00 . A A . 54 CYS HB3 1 1 2 1401 1 1 54 CYS N N -9.028 -9.892 -5.080 1.00 . A A . 54 CYS N 1 1 2 1402 1 1 54 CYS O O -11.441 -9.199 -6.560 1.00 . A A . 54 CYS O 1 1 2 1403 1 1 54 CYS SG S -7.821 -7.222 -4.452 1.00 . A A . 54 CYS SG 1 1 2 1404 1 1 55 ILE C C -14.763 -8.667 -4.525 1.00 . A A . 55 ILE C 1 1 2 1405 1 1 55 ILE CA C -13.746 -9.658 -5.078 1.00 . A A . 55 ILE CA 1 1 2 1406 1 1 55 ILE CB C -14.217 -11.093 -4.762 1.00 . A A . 55 ILE CB 1 1 2 1407 1 1 55 ILE CD1 C -15.514 -12.158 -2.848 1.00 . A A . 55 ILE CD1 1 1 2 1408 1 1 55 ILE CG1 C -14.337 -11.296 -3.250 1.00 . A A . 55 ILE CG1 1 1 2 1409 1 1 55 ILE CG2 C -13.260 -12.111 -5.364 1.00 . A A . 55 ILE CG2 1 1 2 1410 1 1 55 ILE H H -12.285 -9.389 -3.571 1.00 . A A . 55 ILE H 1 1 2 1411 1 1 55 ILE HA H -13.698 -9.547 -6.152 1.00 . A A . 55 ILE HA 1 1 2 1412 1 1 55 ILE HB H -15.187 -11.237 -5.215 1.00 . A A . 55 ILE HB 1 1 2 1413 1 1 55 ILE HD11 H -15.289 -12.663 -1.921 1.00 . A A . 55 ILE HD11 1 1 2 1414 1 1 55 ILE HD12 H -15.705 -12.890 -3.619 1.00 . A A . 55 ILE HD12 1 1 2 1415 1 1 55 ILE HD13 H -16.388 -11.537 -2.717 1.00 . A A . 55 ILE HD13 1 1 2 1416 1 1 55 ILE HG12 H -13.439 -11.768 -2.884 1.00 . A A . 55 ILE HG12 1 1 2 1417 1 1 55 ILE HG13 H -14.452 -10.333 -2.773 1.00 . A A . 55 ILE HG13 1 1 2 1418 1 1 55 ILE HG21 H -12.247 -11.744 -5.283 1.00 . A A . 55 ILE HG21 1 1 2 1419 1 1 55 ILE HG22 H -13.505 -12.265 -6.405 1.00 . A A . 55 ILE HG22 1 1 2 1420 1 1 55 ILE HG23 H -13.347 -13.046 -4.831 1.00 . A A . 55 ILE HG23 1 1 2 1421 1 1 55 ILE N N -12.416 -9.405 -4.541 1.00 . A A . 55 ILE N 1 1 2 1422 1 1 55 ILE O O -14.413 -7.759 -3.771 1.00 . A A . 55 ILE O 1 1 2 1423 1 1 56 SER C C -18.032 -8.701 -3.492 1.00 . A A . 56 SER C 1 1 2 1424 1 1 56 SER CA C -17.094 -7.968 -4.447 1.00 . A A . 56 SER CA 1 1 2 1425 1 1 56 SER CB C -17.882 -7.428 -5.641 1.00 . A A . 56 SER CB 1 1 2 1426 1 1 56 SER H H -16.241 -9.588 -5.506 1.00 . A A . 56 SER H 1 1 2 1427 1 1 56 SER HA H -16.641 -7.139 -3.922 1.00 . A A . 56 SER HA 1 1 2 1428 1 1 56 SER HB2 H -18.803 -6.987 -5.292 1.00 . A A . 56 SER HB2 1 1 2 1429 1 1 56 SER HB3 H -17.292 -6.680 -6.149 1.00 . A A . 56 SER HB3 1 1 2 1430 1 1 56 SER HG H -18.519 -8.083 -7.374 1.00 . A A . 56 SER HG 1 1 2 1431 1 1 56 SER N N -16.025 -8.846 -4.903 1.00 . A A . 56 SER N 1 1 2 1432 1 1 56 SER O O -17.699 -9.838 -3.094 1.00 . A A . 56 SER O 1 1 2 1433 1 1 56 SER OXT O -19.089 -8.132 -3.149 1.00 . A A . 56 SER OXT 1 1 2 1434 1 1 56 SER OG O -18.191 -8.465 -6.556 1.00 . A A . 56 SER OG 1 1 3 1435 1 1 1 ASP C C 1.692 13.830 -2.562 1.00 . A A . 1 ASP C 1 1 3 1436 1 1 1 ASP CA C 2.864 13.906 -3.534 1.00 . A A . 1 ASP CA 1 1 3 1437 1 1 1 ASP CB C 4.188 13.838 -2.771 1.00 . A A . 1 ASP CB 1 1 3 1438 1 1 1 ASP CG C 5.387 14.075 -3.667 1.00 . A A . 1 ASP CG 1 1 3 1439 1 1 1 ASP H1 H 1.913 15.274 -4.791 1.00 . A A . 1 ASP H1 1 1 3 1440 1 1 1 ASP H2 H 3.584 15.168 -5.033 1.00 . A A . 1 ASP H2 1 1 3 1441 1 1 1 ASP H3 H 2.975 15.985 -3.683 1.00 . A A . 1 ASP H3 1 1 3 1442 1 1 1 ASP HA H 2.806 13.077 -4.222 1.00 . A A . 1 ASP HA 1 1 3 1443 1 1 1 ASP HB2 H 4.188 14.589 -1.995 1.00 . A A . 1 ASP HB2 1 1 3 1444 1 1 1 ASP HB3 H 4.286 12.861 -2.320 1.00 . A A . 1 ASP HB3 1 1 3 1445 1 1 1 ASP N N 2.832 15.172 -4.314 1.00 . A A . 1 ASP N 1 1 3 1446 1 1 1 ASP O O 0.854 14.730 -2.512 1.00 . A A . 1 ASP O 1 1 3 1447 1 1 1 ASP OD1 O 5.844 15.234 -3.753 1.00 . A A . 1 ASP OD1 1 1 3 1448 1 1 1 ASP OD2 O 5.870 13.101 -4.284 1.00 . A A . 1 ASP OD2 1 1 3 1449 1 1 2 VAL C C 1.132 12.128 0.535 1.00 . A A . 2 VAL C 1 1 3 1450 1 1 2 VAL CA C 0.571 12.550 -0.818 1.00 . A A . 2 VAL CA 1 1 3 1451 1 1 2 VAL CB C -0.435 11.482 -1.294 1.00 . A A . 2 VAL CB 1 1 3 1452 1 1 2 VAL CG1 C -1.644 11.438 -0.371 1.00 . A A . 2 VAL CG1 1 1 3 1453 1 1 2 VAL CG2 C -0.862 11.746 -2.730 1.00 . A A . 2 VAL CG2 1 1 3 1454 1 1 2 VAL H H 2.338 12.065 -1.879 1.00 . A A . 2 VAL H 1 1 3 1455 1 1 2 VAL HA H 0.044 13.486 -0.704 1.00 . A A . 2 VAL HA 1 1 3 1456 1 1 2 VAL HB H 0.052 10.517 -1.259 1.00 . A A . 2 VAL HB 1 1 3 1457 1 1 2 VAL HG11 H -1.924 10.411 -0.193 1.00 . A A . 2 VAL HG11 1 1 3 1458 1 1 2 VAL HG12 H -2.469 11.960 -0.833 1.00 . A A . 2 VAL HG12 1 1 3 1459 1 1 2 VAL HG13 H -1.398 11.912 0.567 1.00 . A A . 2 VAL HG13 1 1 3 1460 1 1 2 VAL HG21 H 0.010 11.953 -3.334 1.00 . A A . 2 VAL HG21 1 1 3 1461 1 1 2 VAL HG22 H -1.529 12.596 -2.758 1.00 . A A . 2 VAL HG22 1 1 3 1462 1 1 2 VAL HG23 H -1.371 10.877 -3.120 1.00 . A A . 2 VAL HG23 1 1 3 1463 1 1 2 VAL N N 1.640 12.748 -1.791 1.00 . A A . 2 VAL N 1 1 3 1464 1 1 2 VAL O O 1.789 11.092 0.648 1.00 . A A . 2 VAL O 1 1 3 1465 1 1 3 GLN C C 0.832 11.288 3.380 1.00 . A A . 3 GLN C 1 1 3 1466 1 1 3 GLN CA C 1.346 12.644 2.909 1.00 . A A . 3 GLN CA 1 1 3 1467 1 1 3 GLN CB C 0.903 13.741 3.881 1.00 . A A . 3 GLN CB 1 1 3 1468 1 1 3 GLN CD C 2.263 15.332 5.296 1.00 . A A . 3 GLN CD 1 1 3 1469 1 1 3 GLN CG C 1.828 14.948 3.897 1.00 . A A . 3 GLN CG 1 1 3 1470 1 1 3 GLN H H 0.340 13.747 1.407 1.00 . A A . 3 GLN H 1 1 3 1471 1 1 3 GLN HA H 2.426 12.615 2.878 1.00 . A A . 3 GLN HA 1 1 3 1472 1 1 3 GLN HB2 H -0.085 14.074 3.602 1.00 . A A . 3 GLN HB2 1 1 3 1473 1 1 3 GLN HB3 H 0.868 13.329 4.879 1.00 . A A . 3 GLN HB3 1 1 3 1474 1 1 3 GLN HE21 H 0.369 15.582 5.843 1.00 . A A . 3 GLN HE21 1 1 3 1475 1 1 3 GLN HE22 H 1.549 15.879 7.069 1.00 . A A . 3 GLN HE22 1 1 3 1476 1 1 3 GLN HG2 H 2.708 14.720 3.313 1.00 . A A . 3 GLN HG2 1 1 3 1477 1 1 3 GLN HG3 H 1.311 15.787 3.453 1.00 . A A . 3 GLN HG3 1 1 3 1478 1 1 3 GLN N N 0.869 12.936 1.560 1.00 . A A . 3 GLN N 1 1 3 1479 1 1 3 GLN NE2 N 1.296 15.628 6.157 1.00 . A A . 3 GLN NE2 1 1 3 1480 1 1 3 GLN O O -0.283 11.178 3.891 1.00 . A A . 3 GLN O 1 1 3 1481 1 1 3 GLN OE1 O 3.456 15.362 5.602 1.00 . A A . 3 GLN OE1 1 1 3 1482 1 1 4 CYS C C 0.763 8.844 5.007 1.00 . A A . 4 CYS C 1 1 3 1483 1 1 4 CYS CA C 1.290 8.898 3.580 1.00 . A A . 4 CYS CA 1 1 3 1484 1 1 4 CYS CB C 2.494 7.968 3.441 1.00 . A A . 4 CYS CB 1 1 3 1485 1 1 4 CYS H H 2.521 10.414 2.767 1.00 . A A . 4 CYS H 1 1 3 1486 1 1 4 CYS HA H 0.512 8.562 2.913 1.00 . A A . 4 CYS HA 1 1 3 1487 1 1 4 CYS HB2 H 3.384 8.495 3.750 1.00 . A A . 4 CYS HB2 1 1 3 1488 1 1 4 CYS HB3 H 2.351 7.108 4.079 1.00 . A A . 4 CYS HB3 1 1 3 1489 1 1 4 CYS N N 1.652 10.258 3.191 1.00 . A A . 4 CYS N 1 1 3 1490 1 1 4 CYS O O -0.234 8.178 5.285 1.00 . A A . 4 CYS O 1 1 3 1491 1 1 4 CYS SG S 2.770 7.361 1.746 1.00 . A A . 4 CYS SG 1 1 3 1492 1 1 5 GLY C C 2.175 9.711 8.251 1.00 . A A . 5 GLY C 1 1 3 1493 1 1 5 GLY CA C 1.013 9.558 7.293 1.00 . A A . 5 GLY CA 1 1 3 1494 1 1 5 GLY H H 2.221 10.061 5.630 1.00 . A A . 5 GLY H 1 1 3 1495 1 1 5 GLY HA2 H 0.328 10.379 7.441 1.00 . A A . 5 GLY HA2 1 1 3 1496 1 1 5 GLY HA3 H 0.502 8.631 7.510 1.00 . A A . 5 GLY HA3 1 1 3 1497 1 1 5 GLY N N 1.435 9.546 5.908 1.00 . A A . 5 GLY N 1 1 3 1498 1 1 5 GLY O O 2.417 10.803 8.767 1.00 . A A . 5 GLY O 1 1 3 1499 1 1 6 GLY C C 5.321 9.033 8.750 1.00 . A A . 6 GLY C 1 1 3 1500 1 1 6 GLY CA C 4.010 8.667 9.421 1.00 . A A . 6 GLY CA 1 1 3 1501 1 1 6 GLY H H 2.656 7.764 8.084 1.00 . A A . 6 GLY H 1 1 3 1502 1 1 6 GLY HA2 H 3.799 9.397 10.187 1.00 . A A . 6 GLY HA2 1 1 3 1503 1 1 6 GLY HA3 H 4.118 7.697 9.887 1.00 . A A . 6 GLY HA3 1 1 3 1504 1 1 6 GLY N N 2.890 8.617 8.505 1.00 . A A . 6 GLY N 1 1 3 1505 1 1 6 GLY O O 6.287 8.272 8.810 1.00 . A A . 6 GLY O 1 1 3 1506 1 1 7 GLY C C 6.829 10.117 6.111 1.00 . A A . 7 GLY C 1 1 3 1507 1 1 7 GLY CA C 6.586 10.674 7.505 1.00 . A A . 7 GLY CA 1 1 3 1508 1 1 7 GLY H H 4.578 10.794 8.153 1.00 . A A . 7 GLY H 1 1 3 1509 1 1 7 GLY HA2 H 6.549 11.750 7.436 1.00 . A A . 7 GLY HA2 1 1 3 1510 1 1 7 GLY HA3 H 7.422 10.402 8.134 1.00 . A A . 7 GLY HA3 1 1 3 1511 1 1 7 GLY N N 5.367 10.213 8.142 1.00 . A A . 7 GLY N 1 1 3 1512 1 1 7 GLY O O 7.833 10.459 5.486 1.00 . A A . 7 GLY O 1 1 3 1513 1 1 8 PHE C C 5.405 9.536 3.217 1.00 . A A . 8 PHE C 1 1 3 1514 1 1 8 PHE CA C 6.132 8.710 4.269 1.00 . A A . 8 PHE CA 1 1 3 1515 1 1 8 PHE CB C 5.670 7.257 4.207 1.00 . A A . 8 PHE CB 1 1 3 1516 1 1 8 PHE CD1 C 7.480 5.900 5.293 1.00 . A A . 8 PHE CD1 1 1 3 1517 1 1 8 PHE CD2 C 7.188 5.719 2.933 1.00 . A A . 8 PHE CD2 1 1 3 1518 1 1 8 PHE CE1 C 8.522 4.994 5.238 1.00 . A A . 8 PHE CE1 1 1 3 1519 1 1 8 PHE CE2 C 8.230 4.812 2.871 1.00 . A A . 8 PHE CE2 1 1 3 1520 1 1 8 PHE CG C 6.801 6.272 4.143 1.00 . A A . 8 PHE CG 1 1 3 1521 1 1 8 PHE CZ C 8.898 4.450 4.025 1.00 . A A . 8 PHE CZ 1 1 3 1522 1 1 8 PHE H H 5.141 9.012 6.126 1.00 . A A . 8 PHE H 1 1 3 1523 1 1 8 PHE HA H 7.189 8.745 4.054 1.00 . A A . 8 PHE HA 1 1 3 1524 1 1 8 PHE HB2 H 5.083 7.035 5.082 1.00 . A A . 8 PHE HB2 1 1 3 1525 1 1 8 PHE HB3 H 5.058 7.119 3.327 1.00 . A A . 8 PHE HB3 1 1 3 1526 1 1 8 PHE HD1 H 7.186 6.324 6.241 1.00 . A A . 8 PHE HD1 1 1 3 1527 1 1 8 PHE HD2 H 6.668 6.002 2.030 1.00 . A A . 8 PHE HD2 1 1 3 1528 1 1 8 PHE HE1 H 9.042 4.712 6.141 1.00 . A A . 8 PHE HE1 1 1 3 1529 1 1 8 PHE HE2 H 8.522 4.389 1.921 1.00 . A A . 8 PHE HE2 1 1 3 1530 1 1 8 PHE HZ H 9.711 3.741 3.978 1.00 . A A . 8 PHE HZ 1 1 3 1531 1 1 8 PHE N N 5.937 9.266 5.605 1.00 . A A . 8 PHE N 1 1 3 1532 1 1 8 PHE O O 4.826 10.579 3.518 1.00 . A A . 8 PHE O 1 1 3 1533 1 1 9 SER C C 4.780 8.868 -0.384 1.00 . A A . 9 SER C 1 1 3 1534 1 1 9 SER CA C 4.799 9.745 0.866 1.00 . A A . 9 SER CA 1 1 3 1535 1 1 9 SER CB C 5.520 11.061 0.561 1.00 . A A . 9 SER CB 1 1 3 1536 1 1 9 SER H H 5.927 8.220 1.812 1.00 . A A . 9 SER H 1 1 3 1537 1 1 9 SER HA H 3.782 9.961 1.155 1.00 . A A . 9 SER HA 1 1 3 1538 1 1 9 SER HB2 H 6.539 11.000 0.912 1.00 . A A . 9 SER HB2 1 1 3 1539 1 1 9 SER HB3 H 5.516 11.232 -0.505 1.00 . A A . 9 SER HB3 1 1 3 1540 1 1 9 SER HG H 4.732 12.854 0.563 1.00 . A A . 9 SER HG 1 1 3 1541 1 1 9 SER N N 5.446 9.058 1.979 1.00 . A A . 9 SER N 1 1 3 1542 1 1 9 SER O O 5.606 7.970 -0.538 1.00 . A A . 9 SER O 1 1 3 1543 1 1 9 SER OG O 4.882 12.152 1.201 1.00 . A A . 9 SER OG 1 1 3 1544 1 1 10 CYS C C 3.584 9.355 -3.700 1.00 . A A . 10 CYS C 1 1 3 1545 1 1 10 CYS CA C 3.705 8.396 -2.520 1.00 . A A . 10 CYS CA 1 1 3 1546 1 1 10 CYS CB C 2.485 7.474 -2.466 1.00 . A A . 10 CYS CB 1 1 3 1547 1 1 10 CYS H H 3.212 9.880 -1.098 1.00 . A A . 10 CYS H 1 1 3 1548 1 1 10 CYS HA H 4.596 7.799 -2.644 1.00 . A A . 10 CYS HA 1 1 3 1549 1 1 10 CYS HB2 H 1.639 8.034 -2.097 1.00 . A A . 10 CYS HB2 1 1 3 1550 1 1 10 CYS HB3 H 2.265 7.123 -3.464 1.00 . A A . 10 CYS HB3 1 1 3 1551 1 1 10 CYS N N 3.835 9.146 -1.276 1.00 . A A . 10 CYS N 1 1 3 1552 1 1 10 CYS O O 3.552 10.572 -3.519 1.00 . A A . 10 CYS O 1 1 3 1553 1 1 10 CYS SG S 2.691 6.015 -1.392 1.00 . A A . 10 CYS SG 1 1 3 1554 1 1 11 HIS C C 1.945 9.942 -6.416 1.00 . A A . 11 HIS C 1 1 3 1555 1 1 11 HIS CA C 3.405 9.624 -6.109 1.00 . A A . 11 HIS CA 1 1 3 1556 1 1 11 HIS CB C 4.048 8.914 -7.301 1.00 . A A . 11 HIS CB 1 1 3 1557 1 1 11 HIS CD2 C 6.298 10.014 -7.980 1.00 . A A . 11 HIS CD2 1 1 3 1558 1 1 11 HIS CE1 C 5.566 11.239 -9.643 1.00 . A A . 11 HIS CE1 1 1 3 1559 1 1 11 HIS CG C 4.966 9.793 -8.093 1.00 . A A . 11 HIS CG 1 1 3 1560 1 1 11 HIS H H 3.553 7.829 -4.993 1.00 . A A . 11 HIS H 1 1 3 1561 1 1 11 HIS HA H 3.931 10.550 -5.928 1.00 . A A . 11 HIS HA 1 1 3 1562 1 1 11 HIS HB2 H 4.621 8.072 -6.944 1.00 . A A . 11 HIS HB2 1 1 3 1563 1 1 11 HIS HB3 H 3.271 8.561 -7.963 1.00 . A A . 11 HIS HB3 1 1 3 1564 1 1 11 HIS HD1 H 3.617 10.636 -9.476 1.00 . A A . 11 HIS HD1 1 1 3 1565 1 1 11 HIS HD2 H 6.963 9.564 -7.257 1.00 . A A . 11 HIS HD2 1 1 3 1566 1 1 11 HIS HE1 H 5.530 11.930 -10.473 1.00 . A A . 11 HIS HE1 1 1 3 1567 1 1 11 HIS HE2 H 7.556 11.209 -9.161 1.00 . A A . 11 HIS HE2 1 1 3 1568 1 1 11 HIS N N 3.521 8.805 -4.908 1.00 . A A . 11 HIS N 1 1 3 1569 1 1 11 HIS ND1 N 4.538 10.576 -9.144 1.00 . A A . 11 HIS ND1 1 1 3 1570 1 1 11 HIS NE2 N 6.644 10.917 -8.954 1.00 . A A . 11 HIS NE2 1 1 3 1571 1 1 11 HIS O O 1.033 9.316 -5.873 1.00 . A A . 11 HIS O 1 1 3 1572 1 1 12 ASP C C -0.393 10.138 -8.244 1.00 . A A . 12 ASP C 1 1 3 1573 1 1 12 ASP CA C 0.379 11.320 -7.668 1.00 . A A . 12 ASP CA 1 1 3 1574 1 1 12 ASP CB C 0.428 12.457 -8.691 1.00 . A A . 12 ASP CB 1 1 3 1575 1 1 12 ASP CG C 0.472 13.824 -8.037 1.00 . A A . 12 ASP CG 1 1 3 1576 1 1 12 ASP H H 2.492 11.388 -7.690 1.00 . A A . 12 ASP H 1 1 3 1577 1 1 12 ASP HA H -0.126 11.667 -6.780 1.00 . A A . 12 ASP HA 1 1 3 1578 1 1 12 ASP HB2 H 1.310 12.344 -9.303 1.00 . A A . 12 ASP HB2 1 1 3 1579 1 1 12 ASP HB3 H -0.449 12.406 -9.319 1.00 . A A . 12 ASP HB3 1 1 3 1580 1 1 12 ASP N N 1.729 10.920 -7.289 1.00 . A A . 12 ASP N 1 1 3 1581 1 1 12 ASP O O 0.067 9.476 -9.175 1.00 . A A . 12 ASP O 1 1 3 1582 1 1 12 ASP OD1 O -0.083 14.779 -8.621 1.00 . A A . 12 ASP OD1 1 1 3 1583 1 1 12 ASP OD2 O 1.062 13.941 -6.941 1.00 . A A . 12 ASP OD2 1 1 3 1584 1 1 13 GLY C C -2.250 7.529 -7.331 1.00 . A A . 13 GLY C 1 1 3 1585 1 1 13 GLY CA C -2.396 8.787 -8.166 1.00 . A A . 13 GLY CA 1 1 3 1586 1 1 13 GLY H H -1.894 10.451 -6.957 1.00 . A A . 13 GLY H 1 1 3 1587 1 1 13 GLY HA2 H -3.431 9.097 -8.150 1.00 . A A . 13 GLY HA2 1 1 3 1588 1 1 13 GLY HA3 H -2.117 8.563 -9.185 1.00 . A A . 13 GLY HA3 1 1 3 1589 1 1 13 GLY N N -1.574 9.884 -7.690 1.00 . A A . 13 GLY N 1 1 3 1590 1 1 13 GLY O O -2.991 6.566 -7.527 1.00 . A A . 13 GLY O 1 1 3 1591 1 1 14 GLU C C -1.720 6.548 -4.177 1.00 . A A . 14 GLU C 1 1 3 1592 1 1 14 GLU CA C -1.079 6.363 -5.549 1.00 . A A . 14 GLU CA 1 1 3 1593 1 1 14 GLU CB C 0.414 6.073 -5.388 1.00 . A A . 14 GLU CB 1 1 3 1594 1 1 14 GLU CD C 1.480 5.402 -7.579 1.00 . A A . 14 GLU CD 1 1 3 1595 1 1 14 GLU CG C 1.259 6.515 -6.573 1.00 . A A . 14 GLU CG 1 1 3 1596 1 1 14 GLU H H -0.731 8.324 -6.286 1.00 . A A . 14 GLU H 1 1 3 1597 1 1 14 GLU HA H -1.545 5.516 -6.032 1.00 . A A . 14 GLU HA 1 1 3 1598 1 1 14 GLU HB2 H 0.773 6.582 -4.507 1.00 . A A . 14 GLU HB2 1 1 3 1599 1 1 14 GLU HB3 H 0.548 5.010 -5.256 1.00 . A A . 14 GLU HB3 1 1 3 1600 1 1 14 GLU HG2 H 0.760 7.333 -7.070 1.00 . A A . 14 GLU HG2 1 1 3 1601 1 1 14 GLU HG3 H 2.220 6.847 -6.207 1.00 . A A . 14 GLU HG3 1 1 3 1602 1 1 14 GLU N N -1.297 7.529 -6.401 1.00 . A A . 14 GLU N 1 1 3 1603 1 1 14 GLU O O -2.066 7.662 -3.781 1.00 . A A . 14 GLU O 1 1 3 1604 1 1 14 GLU OE1 O 2.599 4.849 -7.617 1.00 . A A . 14 GLU OE1 1 1 3 1605 1 1 14 GLU OE2 O 0.534 5.084 -8.329 1.00 . A A . 14 GLU OE2 1 1 3 1606 1 1 15 THR C C -1.518 4.883 -1.095 1.00 . A A . 15 THR C 1 1 3 1607 1 1 15 THR CA C -2.476 5.451 -2.135 1.00 . A A . 15 THR CA 1 1 3 1608 1 1 15 THR CB C -3.788 4.645 -2.102 1.00 . A A . 15 THR CB 1 1 3 1609 1 1 15 THR CG2 C -4.400 4.655 -0.706 1.00 . A A . 15 THR CG2 1 1 3 1610 1 1 15 THR H H -1.577 4.591 -3.852 1.00 . A A . 15 THR H 1 1 3 1611 1 1 15 THR HA H -2.701 6.477 -1.880 1.00 . A A . 15 THR HA 1 1 3 1612 1 1 15 THR HB H -3.573 3.623 -2.376 1.00 . A A . 15 THR HB 1 1 3 1613 1 1 15 THR HG1 H -4.244 5.629 -3.747 1.00 . A A . 15 THR HG1 1 1 3 1614 1 1 15 THR HG21 H -3.705 4.218 -0.005 1.00 . A A . 15 THR HG21 1 1 3 1615 1 1 15 THR HG22 H -5.315 4.081 -0.711 1.00 . A A . 15 THR HG22 1 1 3 1616 1 1 15 THR HG23 H -4.614 5.672 -0.415 1.00 . A A . 15 THR HG23 1 1 3 1617 1 1 15 THR N N -1.875 5.439 -3.464 1.00 . A A . 15 THR N 1 1 3 1618 1 1 15 THR O O -0.858 3.872 -1.329 1.00 . A A . 15 THR O 1 1 3 1619 1 1 15 THR OG1 O -4.721 5.194 -3.037 1.00 . A A . 15 THR OG1 1 1 3 1620 1 1 16 CYS C C -1.277 4.148 2.073 1.00 . A A . 16 CYS C 1 1 3 1621 1 1 16 CYS CA C -0.566 5.110 1.128 1.00 . A A . 16 CYS CA 1 1 3 1622 1 1 16 CYS CB C -0.051 6.316 1.905 1.00 . A A . 16 CYS CB 1 1 3 1623 1 1 16 CYS H H -1.996 6.346 0.179 1.00 . A A . 16 CYS H 1 1 3 1624 1 1 16 CYS HA H 0.273 4.599 0.680 1.00 . A A . 16 CYS HA 1 1 3 1625 1 1 16 CYS HB2 H -0.891 6.864 2.307 1.00 . A A . 16 CYS HB2 1 1 3 1626 1 1 16 CYS HB3 H 0.575 5.973 2.719 1.00 . A A . 16 CYS HB3 1 1 3 1627 1 1 16 CYS N N -1.446 5.544 0.053 1.00 . A A . 16 CYS N 1 1 3 1628 1 1 16 CYS O O -2.318 4.475 2.644 1.00 . A A . 16 CYS O 1 1 3 1629 1 1 16 CYS SG S 0.933 7.471 0.902 1.00 . A A . 16 CYS SG 1 1 3 1630 1 1 17 CYS C C -0.206 1.462 4.107 1.00 . A A . 17 CYS C 1 1 3 1631 1 1 17 CYS CA C -1.263 1.947 3.118 1.00 . A A . 17 CYS CA 1 1 3 1632 1 1 17 CYS CB C -1.796 0.767 2.301 1.00 . A A . 17 CYS CB 1 1 3 1633 1 1 17 CYS H H 0.130 2.764 1.759 1.00 . A A . 17 CYS H 1 1 3 1634 1 1 17 CYS HA H -2.078 2.396 3.666 1.00 . A A . 17 CYS HA 1 1 3 1635 1 1 17 CYS HB2 H -1.036 0.449 1.605 1.00 . A A . 17 CYS HB2 1 1 3 1636 1 1 17 CYS HB3 H -2.029 -0.049 2.971 1.00 . A A . 17 CYS HB3 1 1 3 1637 1 1 17 CYS N N -0.700 2.963 2.238 1.00 . A A . 17 CYS N 1 1 3 1638 1 1 17 CYS O O 0.865 1.005 3.705 1.00 . A A . 17 CYS O 1 1 3 1639 1 1 17 CYS SG S -3.300 1.143 1.341 1.00 . A A . 17 CYS SG 1 1 3 1640 1 1 18 PRO C C 0.315 -0.346 6.786 1.00 . A A . 18 PRO C 1 1 3 1641 1 1 18 PRO CA C 0.445 1.138 6.460 1.00 . A A . 18 PRO CA 1 1 3 1642 1 1 18 PRO CB C 0.011 1.989 7.650 1.00 . A A . 18 PRO CB 1 1 3 1643 1 1 18 PRO CD C -1.736 2.099 5.994 1.00 . A A . 18 PRO CD 1 1 3 1644 1 1 18 PRO CG C -1.464 2.136 7.480 1.00 . A A . 18 PRO CG 1 1 3 1645 1 1 18 PRO HA H 1.468 1.367 6.198 1.00 . A A . 18 PRO HA 1 1 3 1646 1 1 18 PRO HB2 H 0.258 1.480 8.570 1.00 . A A . 18 PRO HB2 1 1 3 1647 1 1 18 PRO HB3 H 0.510 2.946 7.614 1.00 . A A . 18 PRO HB3 1 1 3 1648 1 1 18 PRO HD2 H -2.569 1.447 5.781 1.00 . A A . 18 PRO HD2 1 1 3 1649 1 1 18 PRO HD3 H -1.935 3.094 5.623 1.00 . A A . 18 PRO HD3 1 1 3 1650 1 1 18 PRO HG2 H -1.972 1.319 7.972 1.00 . A A . 18 PRO HG2 1 1 3 1651 1 1 18 PRO HG3 H -1.787 3.080 7.896 1.00 . A A . 18 PRO HG3 1 1 3 1652 1 1 18 PRO N N -0.488 1.560 5.419 1.00 . A A . 18 PRO N 1 1 3 1653 1 1 18 PRO O O -0.279 -0.721 7.798 1.00 . A A . 18 PRO O 1 1 3 1654 1 1 19 THR C C 1.839 -3.104 7.133 1.00 . A A . 19 THR C 1 1 3 1655 1 1 19 THR CA C 0.808 -2.632 6.111 1.00 . A A . 19 THR CA 1 1 3 1656 1 1 19 THR CB C 1.039 -3.378 4.784 1.00 . A A . 19 THR CB 1 1 3 1657 1 1 19 THR CG2 C 0.298 -2.694 3.644 1.00 . A A . 19 THR CG2 1 1 3 1658 1 1 19 THR H H 1.324 -0.835 5.127 1.00 . A A . 19 THR H 1 1 3 1659 1 1 19 THR HA H -0.180 -2.880 6.471 1.00 . A A . 19 THR HA 1 1 3 1660 1 1 19 THR HB H 0.665 -4.386 4.884 1.00 . A A . 19 THR HB 1 1 3 1661 1 1 19 THR HG1 H 2.563 -3.635 3.559 1.00 . A A . 19 THR HG1 1 1 3 1662 1 1 19 THR HG21 H 0.923 -1.922 3.219 1.00 . A A . 19 THR HG21 1 1 3 1663 1 1 19 THR HG22 H -0.612 -2.252 4.021 1.00 . A A . 19 THR HG22 1 1 3 1664 1 1 19 THR HG23 H 0.056 -3.422 2.884 1.00 . A A . 19 THR HG23 1 1 3 1665 1 1 19 THR N N 0.868 -1.188 5.920 1.00 . A A . 19 THR N 1 1 3 1666 1 1 19 THR O O 2.075 -4.304 7.279 1.00 . A A . 19 THR O 1 1 3 1667 1 1 19 THR OG1 O 2.440 -3.425 4.487 1.00 . A A . 19 THR OG1 1 1 3 1668 1 1 20 SER C C 3.435 -1.463 9.987 1.00 . A A . 20 SER C 1 1 3 1669 1 1 20 SER CA C 3.454 -2.481 8.844 1.00 . A A . 20 SER CA 1 1 3 1670 1 1 20 SER CB C 4.841 -2.545 8.200 1.00 . A A . 20 SER CB 1 1 3 1671 1 1 20 SER H H 2.220 -1.218 7.677 1.00 . A A . 20 SER H 1 1 3 1672 1 1 20 SER HA H 3.212 -3.455 9.246 1.00 . A A . 20 SER HA 1 1 3 1673 1 1 20 SER HB2 H 4.870 -1.881 7.349 1.00 . A A . 20 SER HB2 1 1 3 1674 1 1 20 SER HB3 H 5.585 -2.240 8.921 1.00 . A A . 20 SER HB3 1 1 3 1675 1 1 20 SER HG H 5.630 -3.820 6.937 1.00 . A A . 20 SER HG 1 1 3 1676 1 1 20 SER N N 2.450 -2.156 7.838 1.00 . A A . 20 SER N 1 1 3 1677 1 1 20 SER O O 2.419 -1.306 10.666 1.00 . A A . 20 SER O 1 1 3 1678 1 1 20 SER OG O 5.141 -3.859 7.763 1.00 . A A . 20 SER OG 1 1 3 1679 1 1 21 GLN C C 5.691 1.283 10.921 1.00 . A A . 21 GLN C 1 1 3 1680 1 1 21 GLN CA C 4.651 0.220 11.262 1.00 . A A . 21 GLN CA 1 1 3 1681 1 1 21 GLN CB C 5.011 -0.455 12.587 1.00 . A A . 21 GLN CB 1 1 3 1682 1 1 21 GLN CD C 3.755 0.666 14.471 1.00 . A A . 21 GLN CD 1 1 3 1683 1 1 21 GLN CG C 3.847 -0.543 13.561 1.00 . A A . 21 GLN CG 1 1 3 1684 1 1 21 GLN H H 5.336 -0.938 9.631 1.00 . A A . 21 GLN H 1 1 3 1685 1 1 21 GLN HA H 3.686 0.694 11.360 1.00 . A A . 21 GLN HA 1 1 3 1686 1 1 21 GLN HB2 H 5.359 -1.456 12.385 1.00 . A A . 21 GLN HB2 1 1 3 1687 1 1 21 GLN HB3 H 5.804 0.106 13.060 1.00 . A A . 21 GLN HB3 1 1 3 1688 1 1 21 GLN HE21 H 3.007 1.756 12.987 1.00 . A A . 21 GLN HE21 1 1 3 1689 1 1 21 GLN HE22 H 3.202 2.575 14.495 1.00 . A A . 21 GLN HE22 1 1 3 1690 1 1 21 GLN HG2 H 2.929 -0.621 12.998 1.00 . A A . 21 GLN HG2 1 1 3 1691 1 1 21 GLN HG3 H 3.971 -1.427 14.170 1.00 . A A . 21 GLN HG3 1 1 3 1692 1 1 21 GLN N N 4.556 -0.774 10.199 1.00 . A A . 21 GLN N 1 1 3 1693 1 1 21 GLN NE2 N 3.273 1.778 13.930 1.00 . A A . 21 GLN NE2 1 1 3 1694 1 1 21 GLN O O 5.607 2.419 11.388 1.00 . A A . 21 GLN O 1 1 3 1695 1 1 21 GLN OE1 O 4.114 0.602 15.646 1.00 . A A . 21 GLN OE1 1 1 3 1696 1 1 22 THR C C 7.854 1.874 8.178 1.00 . A A . 22 THR C 1 1 3 1697 1 1 22 THR CA C 7.727 1.821 9.698 1.00 . A A . 22 THR CA 1 1 3 1698 1 1 22 THR CB C 9.084 1.416 10.306 1.00 . A A . 22 THR CB 1 1 3 1699 1 1 22 THR CG2 C 9.460 -0.001 9.897 1.00 . A A . 22 THR CG2 1 1 3 1700 1 1 22 THR H H 6.678 -0.016 9.765 1.00 . A A . 22 THR H 1 1 3 1701 1 1 22 THR HA H 7.472 2.806 10.063 1.00 . A A . 22 THR HA 1 1 3 1702 1 1 22 THR HB H 9.002 1.452 11.382 1.00 . A A . 22 THR HB 1 1 3 1703 1 1 22 THR HG1 H 10.546 1.976 9.108 1.00 . A A . 22 THR HG1 1 1 3 1704 1 1 22 THR HG21 H 9.783 -0.553 10.767 1.00 . A A . 22 THR HG21 1 1 3 1705 1 1 22 THR HG22 H 10.262 0.035 9.175 1.00 . A A . 22 THR HG22 1 1 3 1706 1 1 22 THR HG23 H 8.602 -0.489 9.459 1.00 . A A . 22 THR HG23 1 1 3 1707 1 1 22 THR N N 6.669 0.904 10.104 1.00 . A A . 22 THR N 1 1 3 1708 1 1 22 THR O O 8.730 2.553 7.641 1.00 . A A . 22 THR O 1 1 3 1709 1 1 22 THR OG1 O 10.105 2.327 9.883 1.00 . A A . 22 THR OG1 1 1 3 1710 1 1 23 THR C C 5.602 1.467 5.473 1.00 . A A . 23 THR C 1 1 3 1711 1 1 23 THR CA C 6.977 1.124 6.033 1.00 . A A . 23 THR CA 1 1 3 1712 1 1 23 THR CB C 7.403 -0.257 5.502 1.00 . A A . 23 THR CB 1 1 3 1713 1 1 23 THR CG2 C 8.768 -0.650 6.047 1.00 . A A . 23 THR CG2 1 1 3 1714 1 1 23 THR H H 6.293 0.641 7.977 1.00 . A A . 23 THR H 1 1 3 1715 1 1 23 THR HA H 7.690 1.857 5.685 1.00 . A A . 23 THR HA 1 1 3 1716 1 1 23 THR HB H 7.465 -0.209 4.424 1.00 . A A . 23 THR HB 1 1 3 1717 1 1 23 THR HG1 H 6.646 -1.590 6.743 1.00 . A A . 23 THR HG1 1 1 3 1718 1 1 23 THR HG21 H 8.747 -1.684 6.359 1.00 . A A . 23 THR HG21 1 1 3 1719 1 1 23 THR HG22 H 9.011 -0.024 6.894 1.00 . A A . 23 THR HG22 1 1 3 1720 1 1 23 THR HG23 H 9.515 -0.521 5.279 1.00 . A A . 23 THR HG23 1 1 3 1721 1 1 23 THR N N 6.970 1.157 7.491 1.00 . A A . 23 THR N 1 1 3 1722 1 1 23 THR O O 4.578 1.109 6.054 1.00 . A A . 23 THR O 1 1 3 1723 1 1 23 THR OG1 O 6.436 -1.246 5.872 1.00 . A A . 23 THR OG1 1 1 3 1724 1 1 24 TRP C C 4.296 2.084 2.254 1.00 . A A . 24 TRP C 1 1 3 1725 1 1 24 TRP CA C 4.336 2.556 3.703 1.00 . A A . 24 TRP CA 1 1 3 1726 1 1 24 TRP CB C 4.168 4.075 3.762 1.00 . A A . 24 TRP CB 1 1 3 1727 1 1 24 TRP CD1 C 4.276 4.857 6.198 1.00 . A A . 24 TRP CD1 1 1 3 1728 1 1 24 TRP CD2 C 2.215 4.789 5.343 1.00 . A A . 24 TRP CD2 1 1 3 1729 1 1 24 TRP CE2 C 2.128 5.227 6.676 1.00 . A A . 24 TRP CE2 1 1 3 1730 1 1 24 TRP CE3 C 1.046 4.667 4.597 1.00 . A A . 24 TRP CE3 1 1 3 1731 1 1 24 TRP CG C 3.592 4.556 5.057 1.00 . A A . 24 TRP CG 1 1 3 1732 1 1 24 TRP CH2 C -0.217 5.414 6.517 1.00 . A A . 24 TRP CH2 1 1 3 1733 1 1 24 TRP CZ2 C 0.913 5.544 7.276 1.00 . A A . 24 TRP CZ2 1 1 3 1734 1 1 24 TRP CZ3 C -0.158 4.981 5.190 1.00 . A A . 24 TRP CZ3 1 1 3 1735 1 1 24 TRP H H 6.436 2.420 3.927 1.00 . A A . 24 TRP H 1 1 3 1736 1 1 24 TRP HA H 3.524 2.092 4.245 1.00 . A A . 24 TRP HA 1 1 3 1737 1 1 24 TRP HB2 H 5.133 4.542 3.631 1.00 . A A . 24 TRP HB2 1 1 3 1738 1 1 24 TRP HB3 H 3.510 4.389 2.965 1.00 . A A . 24 TRP HB3 1 1 3 1739 1 1 24 TRP HD1 H 5.344 4.783 6.300 1.00 . A A . 24 TRP HD1 1 1 3 1740 1 1 24 TRP HE1 H 3.650 5.529 8.089 1.00 . A A . 24 TRP HE1 1 1 3 1741 1 1 24 TRP HE3 H 1.076 4.340 3.571 1.00 . A A . 24 TRP HE3 1 1 3 1742 1 1 24 TRP HH2 H -1.179 5.649 6.938 1.00 . A A . 24 TRP HH2 1 1 3 1743 1 1 24 TRP HZ2 H 0.851 5.880 8.300 1.00 . A A . 24 TRP HZ2 1 1 3 1744 1 1 24 TRP HZ3 H -1.076 4.890 4.626 1.00 . A A . 24 TRP HZ3 1 1 3 1745 1 1 24 TRP N N 5.586 2.163 4.342 1.00 . A A . 24 TRP N 1 1 3 1746 1 1 24 TRP NE1 N 3.402 5.261 7.178 1.00 . A A . 24 TRP NE1 1 1 3 1747 1 1 24 TRP O O 5.281 2.205 1.525 1.00 . A A . 24 TRP O 1 1 3 1748 1 1 25 GLY C C 2.192 1.980 -0.392 1.00 . A A . 25 GLY C 1 1 3 1749 1 1 25 GLY CA C 3.016 1.054 0.483 1.00 . A A . 25 GLY CA 1 1 3 1750 1 1 25 GLY H H 2.403 1.464 2.469 1.00 . A A . 25 GLY H 1 1 3 1751 1 1 25 GLY HA2 H 3.999 0.949 0.049 1.00 . A A . 25 GLY HA2 1 1 3 1752 1 1 25 GLY HA3 H 2.540 0.085 0.507 1.00 . A A . 25 GLY HA3 1 1 3 1753 1 1 25 GLY N N 3.154 1.540 1.843 1.00 . A A . 25 GLY N 1 1 3 1754 1 1 25 GLY O O 1.224 2.586 0.071 1.00 . A A . 25 GLY O 1 1 3 1755 1 1 26 CYS C C 1.031 2.053 -3.560 1.00 . A A . 26 CYS C 1 1 3 1756 1 1 26 CYS CA C 1.864 2.917 -2.619 1.00 . A A . 26 CYS CA 1 1 3 1757 1 1 26 CYS CB C 2.850 3.766 -3.428 1.00 . A A . 26 CYS CB 1 1 3 1758 1 1 26 CYS H H 3.345 1.554 -1.967 1.00 . A A . 26 CYS H 1 1 3 1759 1 1 26 CYS HA H 1.206 3.569 -2.066 1.00 . A A . 26 CYS HA 1 1 3 1760 1 1 26 CYS HB2 H 3.469 3.113 -4.024 1.00 . A A . 26 CYS HB2 1 1 3 1761 1 1 26 CYS HB3 H 2.293 4.420 -4.084 1.00 . A A . 26 CYS HB3 1 1 3 1762 1 1 26 CYS N N 2.574 2.075 -1.663 1.00 . A A . 26 CYS N 1 1 3 1763 1 1 26 CYS O O 1.550 1.133 -4.193 1.00 . A A . 26 CYS O 1 1 3 1764 1 1 26 CYS SG S 3.956 4.805 -2.420 1.00 . A A . 26 CYS SG 1 1 3 1765 1 1 27 CYS C C -1.864 2.485 -5.512 1.00 . A A . 27 CYS C 1 1 3 1766 1 1 27 CYS CA C -1.161 1.580 -4.501 1.00 . A A . 27 CYS CA 1 1 3 1767 1 1 27 CYS CB C -2.199 0.846 -3.653 1.00 . A A . 27 CYS CB 1 1 3 1768 1 1 27 CYS H H -0.622 3.083 -3.111 1.00 . A A . 27 CYS H 1 1 3 1769 1 1 27 CYS HA H -0.569 0.854 -5.036 1.00 . A A . 27 CYS HA 1 1 3 1770 1 1 27 CYS HB2 H -2.140 1.204 -2.636 1.00 . A A . 27 CYS HB2 1 1 3 1771 1 1 27 CYS HB3 H -3.184 1.052 -4.044 1.00 . A A . 27 CYS HB3 1 1 3 1772 1 1 27 CYS N N -0.262 2.344 -3.643 1.00 . A A . 27 CYS N 1 1 3 1773 1 1 27 CYS O O -2.557 3.429 -5.134 1.00 . A A . 27 CYS O 1 1 3 1774 1 1 27 CYS SG S -1.983 -0.963 -3.616 1.00 . A A . 27 CYS SG 1 1 3 1775 1 1 28 PRO C C -3.845 2.782 -7.930 1.00 . A A . 28 PRO C 1 1 3 1776 1 1 28 PRO CA C -2.335 2.995 -7.878 1.00 . A A . 28 PRO CA 1 1 3 1777 1 1 28 PRO CB C -1.675 2.471 -9.155 1.00 . A A . 28 PRO CB 1 1 3 1778 1 1 28 PRO CD C -0.903 1.088 -7.366 1.00 . A A . 28 PRO CD 1 1 3 1779 1 1 28 PRO CG C -1.274 1.076 -8.824 1.00 . A A . 28 PRO CG 1 1 3 1780 1 1 28 PRO HA H -2.124 4.049 -7.765 1.00 . A A . 28 PRO HA 1 1 3 1781 1 1 28 PRO HB2 H -2.386 2.497 -9.969 1.00 . A A . 28 PRO HB2 1 1 3 1782 1 1 28 PRO HB3 H -0.818 3.081 -9.398 1.00 . A A . 28 PRO HB3 1 1 3 1783 1 1 28 PRO HD2 H -1.175 0.153 -6.899 1.00 . A A . 28 PRO HD2 1 1 3 1784 1 1 28 PRO HD3 H 0.153 1.278 -7.246 1.00 . A A . 28 PRO HD3 1 1 3 1785 1 1 28 PRO HG2 H -2.103 0.405 -8.995 1.00 . A A . 28 PRO HG2 1 1 3 1786 1 1 28 PRO HG3 H -0.424 0.785 -9.424 1.00 . A A . 28 PRO HG3 1 1 3 1787 1 1 28 PRO N N -1.703 2.203 -6.819 1.00 . A A . 28 PRO N 1 1 3 1788 1 1 28 PRO O O -4.345 1.996 -8.737 1.00 . A A . 28 PRO O 1 1 3 1789 1 1 29 SER C C -6.616 4.481 -6.142 1.00 . A A . 29 SER C 1 1 3 1790 1 1 29 SER CA C -6.019 3.366 -6.998 1.00 . A A . 29 SER CA 1 1 3 1791 1 1 29 SER CB C -6.414 2.002 -6.425 1.00 . A A . 29 SER CB 1 1 3 1792 1 1 29 SER H H -4.109 4.087 -6.439 1.00 . A A . 29 SER H 1 1 3 1793 1 1 29 SER HA H -6.403 3.451 -8.003 1.00 . A A . 29 SER HA 1 1 3 1794 1 1 29 SER HB2 H -5.523 1.424 -6.231 1.00 . A A . 29 SER HB2 1 1 3 1795 1 1 29 SER HB3 H -6.957 2.147 -5.502 1.00 . A A . 29 SER HB3 1 1 3 1796 1 1 29 SER HG H -7.479 0.442 -6.942 1.00 . A A . 29 SER HG 1 1 3 1797 1 1 29 SER N N -4.566 3.481 -7.059 1.00 . A A . 29 SER N 1 1 3 1798 1 1 29 SER O O -5.924 5.072 -5.314 1.00 . A A . 29 SER O 1 1 3 1799 1 1 29 SER OG O -7.236 1.286 -7.330 1.00 . A A . 29 SER OG 1 1 3 1800 1 1 30 PRO C C -8.745 5.464 -4.082 1.00 . A A . 30 PRO C 1 1 3 1801 1 1 30 PRO CA C -8.592 5.839 -5.558 1.00 . A A . 30 PRO CA 1 1 3 1802 1 1 30 PRO CB C -9.956 5.961 -6.242 1.00 . A A . 30 PRO CB 1 1 3 1803 1 1 30 PRO CD C -8.822 4.139 -7.294 1.00 . A A . 30 PRO CD 1 1 3 1804 1 1 30 PRO CG C -10.180 4.636 -6.886 1.00 . A A . 30 PRO CG 1 1 3 1805 1 1 30 PRO HA H -8.064 6.780 -5.632 1.00 . A A . 30 PRO HA 1 1 3 1806 1 1 30 PRO HB2 H -10.715 6.173 -5.503 1.00 . A A . 30 PRO HB2 1 1 3 1807 1 1 30 PRO HB3 H -9.927 6.753 -6.974 1.00 . A A . 30 PRO HB3 1 1 3 1808 1 1 30 PRO HD2 H -8.772 3.063 -7.207 1.00 . A A . 30 PRO HD2 1 1 3 1809 1 1 30 PRO HD3 H -8.595 4.449 -8.303 1.00 . A A . 30 PRO HD3 1 1 3 1810 1 1 30 PRO HG2 H -10.633 3.956 -6.180 1.00 . A A . 30 PRO HG2 1 1 3 1811 1 1 30 PRO HG3 H -10.811 4.752 -7.754 1.00 . A A . 30 PRO HG3 1 1 3 1812 1 1 30 PRO N N -7.915 4.789 -6.327 1.00 . A A . 30 PRO N 1 1 3 1813 1 1 30 PRO O O -7.755 5.198 -3.399 1.00 . A A . 30 PRO O 1 1 3 1814 1 1 31 LYS C C -10.223 3.594 -1.986 1.00 . A A . 31 LYS C 1 1 3 1815 1 1 31 LYS CA C -10.251 5.107 -2.195 1.00 . A A . 31 LYS CA 1 1 3 1816 1 1 31 LYS CB C -11.608 5.669 -1.766 1.00 . A A . 31 LYS CB 1 1 3 1817 1 1 31 LYS CD C -13.069 6.425 0.133 1.00 . A A . 31 LYS CD 1 1 3 1818 1 1 31 LYS CE C -13.678 5.261 0.898 1.00 . A A . 31 LYS CE 1 1 3 1819 1 1 31 LYS CG C -11.650 6.115 -0.313 1.00 . A A . 31 LYS CG 1 1 3 1820 1 1 31 LYS H H -10.735 5.675 -4.174 1.00 . A A . 31 LYS H 1 1 3 1821 1 1 31 LYS HA H -9.477 5.556 -1.590 1.00 . A A . 31 LYS HA 1 1 3 1822 1 1 31 LYS HB2 H -11.846 6.520 -2.387 1.00 . A A . 31 LYS HB2 1 1 3 1823 1 1 31 LYS HB3 H -12.361 4.909 -1.907 1.00 . A A . 31 LYS HB3 1 1 3 1824 1 1 31 LYS HD2 H -13.052 7.294 0.774 1.00 . A A . 31 LYS HD2 1 1 3 1825 1 1 31 LYS HD3 H -13.674 6.628 -0.738 1.00 . A A . 31 LYS HD3 1 1 3 1826 1 1 31 LYS HE2 H -12.912 4.521 1.072 1.00 . A A . 31 LYS HE2 1 1 3 1827 1 1 31 LYS HE3 H -14.047 5.625 1.846 1.00 . A A . 31 LYS HE3 1 1 3 1828 1 1 31 LYS HG2 H -11.253 5.325 0.307 1.00 . A A . 31 LYS HG2 1 1 3 1829 1 1 31 LYS HG3 H -11.044 7.002 -0.202 1.00 . A A . 31 LYS HG3 1 1 3 1830 1 1 31 LYS HZ1 H -15.688 4.737 0.681 1.00 . A A . 31 LYS HZ1 1 1 3 1831 1 1 31 LYS HZ2 H -14.611 3.619 0.009 1.00 . A A . 31 LYS HZ2 1 1 3 1832 1 1 31 LYS HZ3 H -14.908 5.085 -0.780 1.00 . A A . 31 LYS HZ3 1 1 3 1833 1 1 31 LYS N N -9.984 5.447 -3.590 1.00 . A A . 31 LYS N 1 1 3 1834 1 1 31 LYS NZ N -14.800 4.632 0.149 1.00 . A A . 31 LYS NZ 1 1 3 1835 1 1 31 LYS O O -11.179 3.007 -1.478 1.00 . A A . 31 LYS O 1 1 3 1836 1 1 32 ALA C C -8.845 1.117 -0.783 1.00 . A A . 32 ALA C 1 1 3 1837 1 1 32 ALA CA C -8.958 1.527 -2.249 1.00 . A A . 32 ALA CA 1 1 3 1838 1 1 32 ALA CB C -7.730 1.067 -3.019 1.00 . A A . 32 ALA CB 1 1 3 1839 1 1 32 ALA H H -8.394 3.492 -2.784 1.00 . A A . 32 ALA H 1 1 3 1840 1 1 32 ALA HA H -9.825 1.050 -2.682 1.00 . A A . 32 ALA HA 1 1 3 1841 1 1 32 ALA HB1 H -6.880 1.028 -2.354 1.00 . A A . 32 ALA HB1 1 1 3 1842 1 1 32 ALA HB2 H -7.527 1.760 -3.822 1.00 . A A . 32 ALA HB2 1 1 3 1843 1 1 32 ALA HB3 H -7.910 0.084 -3.430 1.00 . A A . 32 ALA HB3 1 1 3 1844 1 1 32 ALA N N -9.120 2.969 -2.385 1.00 . A A . 32 ALA N 1 1 3 1845 1 1 32 ALA O O -8.472 1.922 0.071 1.00 . A A . 32 ALA O 1 1 3 1846 1 1 33 VAL C C -7.746 -1.394 1.059 1.00 . A A . 33 VAL C 1 1 3 1847 1 1 33 VAL CA C -9.075 -0.676 0.854 1.00 . A A . 33 VAL CA 1 1 3 1848 1 1 33 VAL CB C -10.228 -1.655 1.147 1.00 . A A . 33 VAL CB 1 1 3 1849 1 1 33 VAL CG1 C -10.368 -1.886 2.644 1.00 . A A . 33 VAL CG1 1 1 3 1850 1 1 33 VAL CG2 C -11.531 -1.139 0.556 1.00 . A A . 33 VAL CG2 1 1 3 1851 1 1 33 VAL H H -9.432 -0.744 -1.228 1.00 . A A . 33 VAL H 1 1 3 1852 1 1 33 VAL HA H -9.141 0.153 1.544 1.00 . A A . 33 VAL HA 1 1 3 1853 1 1 33 VAL HB H -9.996 -2.602 0.681 1.00 . A A . 33 VAL HB 1 1 3 1854 1 1 33 VAL HG11 H -9.577 -2.537 2.984 1.00 . A A . 33 VAL HG11 1 1 3 1855 1 1 33 VAL HG12 H -11.324 -2.343 2.849 1.00 . A A . 33 VAL HG12 1 1 3 1856 1 1 33 VAL HG13 H -10.303 -0.940 3.161 1.00 . A A . 33 VAL HG13 1 1 3 1857 1 1 33 VAL HG21 H -11.336 -0.691 -0.408 1.00 . A A . 33 VAL HG21 1 1 3 1858 1 1 33 VAL HG22 H -11.958 -0.400 1.216 1.00 . A A . 33 VAL HG22 1 1 3 1859 1 1 33 VAL HG23 H -12.222 -1.960 0.437 1.00 . A A . 33 VAL HG23 1 1 3 1860 1 1 33 VAL N N -9.155 -0.146 -0.503 1.00 . A A . 33 VAL N 1 1 3 1861 1 1 33 VAL O O -7.424 -2.332 0.335 1.00 . A A . 33 VAL O 1 1 3 1862 1 1 34 CYS C C -5.796 -2.940 2.915 1.00 . A A . 34 CYS C 1 1 3 1863 1 1 34 CYS CA C -5.669 -1.543 2.309 1.00 . A A . 34 CYS CA 1 1 3 1864 1 1 34 CYS CB C -4.855 -0.644 3.244 1.00 . A A . 34 CYS CB 1 1 3 1865 1 1 34 CYS H H -7.272 -0.188 2.582 1.00 . A A . 34 CYS H 1 1 3 1866 1 1 34 CYS HA H -5.145 -1.625 1.368 1.00 . A A . 34 CYS HA 1 1 3 1867 1 1 34 CYS HB2 H -5.290 -0.673 4.232 1.00 . A A . 34 CYS HB2 1 1 3 1868 1 1 34 CYS HB3 H -3.841 -1.013 3.292 1.00 . A A . 34 CYS HB3 1 1 3 1869 1 1 34 CYS N N -6.970 -0.944 2.036 1.00 . A A . 34 CYS N 1 1 3 1870 1 1 34 CYS O O -5.987 -3.084 4.123 1.00 . A A . 34 CYS O 1 1 3 1871 1 1 34 CYS SG S -4.785 1.102 2.725 1.00 . A A . 34 CYS SG 1 1 3 1872 1 1 35 CYS C C -4.709 -5.543 3.668 1.00 . A A . 35 CYS C 1 1 3 1873 1 1 35 CYS CA C -5.715 -5.350 2.539 1.00 . A A . 35 CYS CA 1 1 3 1874 1 1 35 CYS CB C -5.423 -6.322 1.396 1.00 . A A . 35 CYS CB 1 1 3 1875 1 1 35 CYS H H -5.477 -3.787 1.127 1.00 . A A . 35 CYS H 1 1 3 1876 1 1 35 CYS HA H -6.710 -5.531 2.920 1.00 . A A . 35 CYS HA 1 1 3 1877 1 1 35 CYS HB2 H -4.449 -6.101 0.985 1.00 . A A . 35 CYS HB2 1 1 3 1878 1 1 35 CYS HB3 H -5.424 -7.331 1.783 1.00 . A A . 35 CYS HB3 1 1 3 1879 1 1 35 CYS N N -5.653 -3.967 2.074 1.00 . A A . 35 CYS N 1 1 3 1880 1 1 35 CYS O O -3.489 -5.481 3.448 1.00 . A A . 35 CYS O 1 1 3 1881 1 1 35 CYS SG S -6.628 -6.251 0.031 1.00 . A A . 35 CYS SG 1 1 3 1882 1 1 36 ASP C C -4.215 -7.380 6.454 1.00 . A A . 36 ASP C 1 1 3 1883 1 1 36 ASP CA C -4.410 -5.917 6.064 1.00 . A A . 36 ASP CA 1 1 3 1884 1 1 36 ASP CB C -5.025 -5.152 7.236 1.00 . A A . 36 ASP CB 1 1 3 1885 1 1 36 ASP CG C -5.018 -3.652 7.013 1.00 . A A . 36 ASP CG 1 1 3 1886 1 1 36 ASP H H -6.212 -5.779 4.961 1.00 . A A . 36 ASP H 1 1 3 1887 1 1 36 ASP HA H -3.441 -5.492 5.849 1.00 . A A . 36 ASP HA 1 1 3 1888 1 1 36 ASP HB2 H -6.048 -5.472 7.369 1.00 . A A . 36 ASP HB2 1 1 3 1889 1 1 36 ASP HB3 H -4.465 -5.367 8.134 1.00 . A A . 36 ASP HB3 1 1 3 1890 1 1 36 ASP N N -5.236 -5.751 4.875 1.00 . A A . 36 ASP N 1 1 3 1891 1 1 36 ASP O O -3.365 -7.684 7.291 1.00 . A A . 36 ASP O 1 1 3 1892 1 1 36 ASP OD1 O -3.956 -3.113 6.634 1.00 . A A . 36 ASP OD1 1 1 3 1893 1 1 36 ASP OD2 O -6.075 -3.018 7.213 1.00 . A A . 36 ASP OD2 1 1 3 1894 1 1 37 ASP C C -3.400 -10.144 5.978 1.00 . A A . 37 ASP C 1 1 3 1895 1 1 37 ASP CA C -4.845 -9.710 6.177 1.00 . A A . 37 ASP CA 1 1 3 1896 1 1 37 ASP CB C -5.773 -10.551 5.298 1.00 . A A . 37 ASP CB 1 1 3 1897 1 1 37 ASP CG C -6.086 -11.900 5.917 1.00 . A A . 37 ASP CG 1 1 3 1898 1 1 37 ASP H H -5.647 -8.024 5.188 1.00 . A A . 37 ASP H 1 1 3 1899 1 1 37 ASP HA H -5.114 -9.847 7.214 1.00 . A A . 37 ASP HA 1 1 3 1900 1 1 37 ASP HB2 H -6.701 -10.019 5.153 1.00 . A A . 37 ASP HB2 1 1 3 1901 1 1 37 ASP HB3 H -5.301 -10.715 4.341 1.00 . A A . 37 ASP HB3 1 1 3 1902 1 1 37 ASP N N -4.984 -8.292 5.857 1.00 . A A . 37 ASP N 1 1 3 1903 1 1 37 ASP O O -2.837 -10.879 6.789 1.00 . A A . 37 ASP O 1 1 3 1904 1 1 37 ASP OD1 O -6.179 -12.891 5.163 1.00 . A A . 37 ASP OD1 1 1 3 1905 1 1 37 ASP OD2 O -6.237 -11.965 7.155 1.00 . A A . 37 ASP OD2 1 1 3 1906 1 1 38 MET C C -0.671 -8.651 4.300 1.00 . A A . 38 MET C 1 1 3 1907 1 1 38 MET CA C -1.420 -9.952 4.572 1.00 . A A . 38 MET CA 1 1 3 1908 1 1 38 MET CB C -1.339 -10.881 3.357 1.00 . A A . 38 MET CB 1 1 3 1909 1 1 38 MET CE C -1.342 -15.054 3.500 1.00 . A A . 38 MET CE 1 1 3 1910 1 1 38 MET CG C -1.741 -12.314 3.658 1.00 . A A . 38 MET CG 1 1 3 1911 1 1 38 MET H H -3.314 -9.063 4.304 1.00 . A A . 38 MET H 1 1 3 1912 1 1 38 MET HA H -0.974 -10.443 5.425 1.00 . A A . 38 MET HA 1 1 3 1913 1 1 38 MET HB2 H -1.992 -10.501 2.586 1.00 . A A . 38 MET HB2 1 1 3 1914 1 1 38 MET HB3 H -0.324 -10.883 2.988 1.00 . A A . 38 MET HB3 1 1 3 1915 1 1 38 MET HE1 H -0.577 -15.652 3.974 1.00 . A A . 38 MET HE1 1 1 3 1916 1 1 38 MET HE2 H -1.758 -15.598 2.665 1.00 . A A . 38 MET HE2 1 1 3 1917 1 1 38 MET HE3 H -2.123 -14.837 4.214 1.00 . A A . 38 MET HE3 1 1 3 1918 1 1 38 MET HG2 H -1.741 -12.457 4.729 1.00 . A A . 38 MET HG2 1 1 3 1919 1 1 38 MET HG3 H -2.737 -12.483 3.276 1.00 . A A . 38 MET HG3 1 1 3 1920 1 1 38 MET N N -2.806 -9.656 4.897 1.00 . A A . 38 MET N 1 1 3 1921 1 1 38 MET O O -0.273 -7.950 5.232 1.00 . A A . 38 MET O 1 1 3 1922 1 1 38 MET SD S -0.624 -13.520 2.915 1.00 . A A . 38 MET SD 1 1 3 1923 1 1 39 GLN C C -0.353 -6.636 1.257 1.00 . A A . 39 GLN C 1 1 3 1924 1 1 39 GLN CA C 0.135 -7.069 2.636 1.00 . A A . 39 GLN CA 1 1 3 1925 1 1 39 GLN CB C 1.654 -7.251 2.623 1.00 . A A . 39 GLN CB 1 1 3 1926 1 1 39 GLN CD C 3.843 -6.794 3.792 1.00 . A A . 39 GLN CD 1 1 3 1927 1 1 39 GLN CG C 2.376 -6.431 3.679 1.00 . A A . 39 GLN CG 1 1 3 1928 1 1 39 GLN H H -0.899 -8.878 2.323 1.00 . A A . 39 GLN H 1 1 3 1929 1 1 39 GLN HA H -0.127 -6.310 3.358 1.00 . A A . 39 GLN HA 1 1 3 1930 1 1 39 GLN HB2 H 1.881 -8.293 2.788 1.00 . A A . 39 GLN HB2 1 1 3 1931 1 1 39 GLN HB3 H 2.031 -6.960 1.653 1.00 . A A . 39 GLN HB3 1 1 3 1932 1 1 39 GLN HE21 H 3.490 -7.804 5.467 1.00 . A A . 39 GLN HE21 1 1 3 1933 1 1 39 GLN HE22 H 5.133 -7.786 4.933 1.00 . A A . 39 GLN HE22 1 1 3 1934 1 1 39 GLN HG2 H 2.297 -5.386 3.421 1.00 . A A . 39 GLN HG2 1 1 3 1935 1 1 39 GLN HG3 H 1.902 -6.603 4.634 1.00 . A A . 39 GLN HG3 1 1 3 1936 1 1 39 GLN N N -0.519 -8.310 3.025 1.00 . A A . 39 GLN N 1 1 3 1937 1 1 39 GLN NE2 N 4.191 -7.535 4.836 1.00 . A A . 39 GLN NE2 1 1 3 1938 1 1 39 GLN O O 0.301 -6.922 0.254 1.00 . A A . 39 GLN O 1 1 3 1939 1 1 39 GLN OE1 O 4.656 -6.413 2.949 1.00 . A A . 39 GLN OE1 1 1 3 1940 1 1 40 HIS C C -3.111 -4.503 -0.043 1.00 . A A . 40 HIS C 1 1 3 1941 1 1 40 HIS CA C -2.029 -5.572 -0.120 1.00 . A A . 40 HIS CA 1 1 3 1942 1 1 40 HIS CB C -2.572 -6.796 -0.860 1.00 . A A . 40 HIS CB 1 1 3 1943 1 1 40 HIS CD2 C -1.120 -7.528 -2.880 1.00 . A A . 40 HIS CD2 1 1 3 1944 1 1 40 HIS CE1 C -2.202 -6.454 -4.456 1.00 . A A . 40 HIS CE1 1 1 3 1945 1 1 40 HIS CG C -2.145 -6.867 -2.293 1.00 . A A . 40 HIS CG 1 1 3 1946 1 1 40 HIS H H -2.020 -5.795 2.014 1.00 . A A . 40 HIS H 1 1 3 1947 1 1 40 HIS HA H -1.201 -5.176 -0.686 1.00 . A A . 40 HIS HA 1 1 3 1948 1 1 40 HIS HB2 H -2.223 -7.690 -0.365 1.00 . A A . 40 HIS HB2 1 1 3 1949 1 1 40 HIS HB3 H -3.652 -6.774 -0.833 1.00 . A A . 40 HIS HB3 1 1 3 1950 1 1 40 HIS HD1 H -3.595 -5.635 -3.200 1.00 . A A . 40 HIS HD1 1 1 3 1951 1 1 40 HIS HD2 H -0.392 -8.154 -2.384 1.00 . A A . 40 HIS HD2 1 1 3 1952 1 1 40 HIS HE1 H -2.496 -6.067 -5.421 1.00 . A A . 40 HIS HE1 1 1 3 1953 1 1 40 HIS HE2 H -0.538 -7.564 -4.898 1.00 . A A . 40 HIS HE2 1 1 3 1954 1 1 40 HIS N N -1.510 -5.975 1.187 1.00 . A A . 40 HIS N 1 1 3 1955 1 1 40 HIS ND1 N -2.804 -6.203 -3.307 1.00 . A A . 40 HIS ND1 1 1 3 1956 1 1 40 HIS NE2 N -1.178 -7.253 -4.224 1.00 . A A . 40 HIS NE2 1 1 3 1957 1 1 40 HIS O O -3.400 -3.958 1.019 1.00 . A A . 40 HIS O 1 1 3 1958 1 1 41 CYS C C -5.767 -3.694 -2.395 1.00 . A A . 41 CYS C 1 1 3 1959 1 1 41 CYS CA C -4.758 -3.234 -1.344 1.00 . A A . 41 CYS CA 1 1 3 1960 1 1 41 CYS CB C -4.177 -1.874 -1.733 1.00 . A A . 41 CYS CB 1 1 3 1961 1 1 41 CYS H H -3.401 -4.707 -2.006 1.00 . A A . 41 CYS H 1 1 3 1962 1 1 41 CYS HA H -5.259 -3.147 -0.393 1.00 . A A . 41 CYS HA 1 1 3 1963 1 1 41 CYS HB2 H -4.861 -1.097 -1.425 1.00 . A A . 41 CYS HB2 1 1 3 1964 1 1 41 CYS HB3 H -3.233 -1.735 -1.225 1.00 . A A . 41 CYS HB3 1 1 3 1965 1 1 41 CYS N N -3.696 -4.222 -1.207 1.00 . A A . 41 CYS N 1 1 3 1966 1 1 41 CYS O O -5.404 -4.363 -3.364 1.00 . A A . 41 CYS O 1 1 3 1967 1 1 41 CYS SG S -3.880 -1.674 -3.519 1.00 . A A . 41 CYS SG 1 1 3 1968 1 1 42 CYS C C -8.758 -2.483 -3.724 1.00 . A A . 42 CYS C 1 1 3 1969 1 1 42 CYS CA C -8.092 -3.722 -3.125 1.00 . A A . 42 CYS CA 1 1 3 1970 1 1 42 CYS CB C -9.133 -4.579 -2.405 1.00 . A A . 42 CYS CB 1 1 3 1971 1 1 42 CYS H H -7.260 -2.810 -1.410 1.00 . A A . 42 CYS H 1 1 3 1972 1 1 42 CYS HA H -7.646 -4.300 -3.920 1.00 . A A . 42 CYS HA 1 1 3 1973 1 1 42 CYS HB2 H -9.044 -4.417 -1.340 1.00 . A A . 42 CYS HB2 1 1 3 1974 1 1 42 CYS HB3 H -10.118 -4.278 -2.725 1.00 . A A . 42 CYS HB3 1 1 3 1975 1 1 42 CYS N N -7.032 -3.339 -2.198 1.00 . A A . 42 CYS N 1 1 3 1976 1 1 42 CYS O O -9.140 -1.568 -2.996 1.00 . A A . 42 CYS O 1 1 3 1977 1 1 42 CYS SG S -8.973 -6.372 -2.702 1.00 . A A . 42 CYS SG 1 1 3 1978 1 1 43 PRO C C -10.824 -0.843 -5.116 1.00 . A A . 43 PRO C 1 1 3 1979 1 1 43 PRO CA C -9.516 -1.296 -5.756 1.00 . A A . 43 PRO CA 1 1 3 1980 1 1 43 PRO CB C -9.767 -1.841 -7.160 1.00 . A A . 43 PRO CB 1 1 3 1981 1 1 43 PRO CD C -8.466 -3.479 -6.011 1.00 . A A . 43 PRO CD 1 1 3 1982 1 1 43 PRO CG C -8.691 -2.847 -7.358 1.00 . A A . 43 PRO CG 1 1 3 1983 1 1 43 PRO HA H -8.839 -0.456 -5.811 1.00 . A A . 43 PRO HA 1 1 3 1984 1 1 43 PRO HB2 H -10.748 -2.292 -7.206 1.00 . A A . 43 PRO HB2 1 1 3 1985 1 1 43 PRO HB3 H -9.695 -1.040 -7.881 1.00 . A A . 43 PRO HB3 1 1 3 1986 1 1 43 PRO HD2 H -9.071 -4.368 -5.906 1.00 . A A . 43 PRO HD2 1 1 3 1987 1 1 43 PRO HD3 H -7.421 -3.713 -5.873 1.00 . A A . 43 PRO HD3 1 1 3 1988 1 1 43 PRO HG2 H -9.008 -3.591 -8.075 1.00 . A A . 43 PRO HG2 1 1 3 1989 1 1 43 PRO HG3 H -7.789 -2.359 -7.695 1.00 . A A . 43 PRO HG3 1 1 3 1990 1 1 43 PRO N N -8.900 -2.433 -5.064 1.00 . A A . 43 PRO N 1 1 3 1991 1 1 43 PRO O O -11.686 -1.661 -4.784 1.00 . A A . 43 PRO O 1 1 3 1992 1 1 44 ALA C C -13.416 0.447 -4.913 1.00 . A A . 44 ALA C 1 1 3 1993 1 1 44 ALA CA C -12.144 1.065 -4.346 1.00 . A A . 44 ALA CA 1 1 3 1994 1 1 44 ALA CB C -12.149 2.570 -4.566 1.00 . A A . 44 ALA CB 1 1 3 1995 1 1 44 ALA H H -10.220 1.055 -5.228 1.00 . A A . 44 ALA H 1 1 3 1996 1 1 44 ALA HA H -12.109 0.881 -3.282 1.00 . A A . 44 ALA HA 1 1 3 1997 1 1 44 ALA HB1 H -13.139 2.958 -4.378 1.00 . A A . 44 ALA HB1 1 1 3 1998 1 1 44 ALA HB2 H -11.865 2.785 -5.585 1.00 . A A . 44 ALA HB2 1 1 3 1999 1 1 44 ALA HB3 H -11.446 3.035 -3.891 1.00 . A A . 44 ALA HB3 1 1 3 2000 1 1 44 ALA N N -10.954 0.472 -4.946 1.00 . A A . 44 ALA N 1 1 3 2001 1 1 44 ALA O O -13.804 0.730 -6.046 1.00 . A A . 44 ALA O 1 1 3 2002 1 1 45 GLY C C -15.192 -2.554 -4.521 1.00 . A A . 45 GLY C 1 1 3 2003 1 1 45 GLY CA C -15.283 -1.041 -4.552 1.00 . A A . 45 GLY CA 1 1 3 2004 1 1 45 GLY H H -13.704 -0.580 -3.221 1.00 . A A . 45 GLY H 1 1 3 2005 1 1 45 GLY HA2 H -16.091 -0.728 -3.907 1.00 . A A . 45 GLY HA2 1 1 3 2006 1 1 45 GLY HA3 H -15.500 -0.726 -5.562 1.00 . A A . 45 GLY HA3 1 1 3 2007 1 1 45 GLY N N -14.060 -0.397 -4.115 1.00 . A A . 45 GLY N 1 1 3 2008 1 1 45 GLY O O -16.152 -3.243 -4.862 1.00 . A A . 45 GLY O 1 1 3 2009 1 1 46 TYR C C -13.327 -4.918 -2.646 1.00 . A A . 46 TYR C 1 1 3 2010 1 1 46 TYR CA C -13.840 -4.519 -4.028 1.00 . A A . 46 TYR CA 1 1 3 2011 1 1 46 TYR CB C -12.852 -4.978 -5.102 1.00 . A A . 46 TYR CB 1 1 3 2012 1 1 46 TYR CD1 C -13.272 -3.715 -7.248 1.00 . A A . 46 TYR CD1 1 1 3 2013 1 1 46 TYR CD2 C -14.035 -5.969 -7.102 1.00 . A A . 46 TYR CD2 1 1 3 2014 1 1 46 TYR CE1 C -13.767 -3.627 -8.536 1.00 . A A . 46 TYR CE1 1 1 3 2015 1 1 46 TYR CE2 C -14.533 -5.888 -8.389 1.00 . A A . 46 TYR CE2 1 1 3 2016 1 1 46 TYR CG C -13.397 -4.886 -6.511 1.00 . A A . 46 TYR CG 1 1 3 2017 1 1 46 TYR CZ C -14.396 -4.717 -9.101 1.00 . A A . 46 TYR CZ 1 1 3 2018 1 1 46 TYR H H -13.303 -2.485 -3.836 1.00 . A A . 46 TYR H 1 1 3 2019 1 1 46 TYR HA H -14.794 -4.996 -4.198 1.00 . A A . 46 TYR HA 1 1 3 2020 1 1 46 TYR HB2 H -11.965 -4.365 -5.050 1.00 . A A . 46 TYR HB2 1 1 3 2021 1 1 46 TYR HB3 H -12.583 -6.007 -4.916 1.00 . A A . 46 TYR HB3 1 1 3 2022 1 1 46 TYR HD1 H -12.779 -2.863 -6.803 1.00 . A A . 46 TYR HD1 1 1 3 2023 1 1 46 TYR HD2 H -14.140 -6.886 -6.541 1.00 . A A . 46 TYR HD2 1 1 3 2024 1 1 46 TYR HE1 H -13.660 -2.708 -9.093 1.00 . A A . 46 TYR HE1 1 1 3 2025 1 1 46 TYR HE2 H -15.025 -6.742 -8.832 1.00 . A A . 46 TYR HE2 1 1 3 2026 1 1 46 TYR HH H -15.850 -4.618 -10.355 1.00 . A A . 46 TYR HH 1 1 3 2027 1 1 46 TYR N N -14.040 -3.076 -4.106 1.00 . A A . 46 TYR N 1 1 3 2028 1 1 46 TYR O O -12.842 -4.077 -1.889 1.00 . A A . 46 TYR O 1 1 3 2029 1 1 46 TYR OH O -14.890 -4.632 -10.382 1.00 . A A . 46 TYR OH 1 1 3 2030 1 1 47 LYS C C -11.841 -7.714 -1.220 1.00 . A A . 47 LYS C 1 1 3 2031 1 1 47 LYS CA C -12.978 -6.713 -1.036 1.00 . A A . 47 LYS CA 1 1 3 2032 1 1 47 LYS CB C -14.138 -7.371 -0.286 1.00 . A A . 47 LYS CB 1 1 3 2033 1 1 47 LYS CD C -13.478 -8.803 1.671 1.00 . A A . 47 LYS CD 1 1 3 2034 1 1 47 LYS CE C -14.473 -9.434 2.631 1.00 . A A . 47 LYS CE 1 1 3 2035 1 1 47 LYS CG C -13.936 -7.425 1.220 1.00 . A A . 47 LYS CG 1 1 3 2036 1 1 47 LYS H H -13.827 -6.826 -2.972 1.00 . A A . 47 LYS H 1 1 3 2037 1 1 47 LYS HA H -12.614 -5.876 -0.460 1.00 . A A . 47 LYS HA 1 1 3 2038 1 1 47 LYS HB2 H -15.042 -6.816 -0.486 1.00 . A A . 47 LYS HB2 1 1 3 2039 1 1 47 LYS HB3 H -14.259 -8.382 -0.648 1.00 . A A . 47 LYS HB3 1 1 3 2040 1 1 47 LYS HD2 H -13.376 -9.439 0.804 1.00 . A A . 47 LYS HD2 1 1 3 2041 1 1 47 LYS HD3 H -12.523 -8.709 2.165 1.00 . A A . 47 LYS HD3 1 1 3 2042 1 1 47 LYS HE2 H -14.778 -8.692 3.354 1.00 . A A . 47 LYS HE2 1 1 3 2043 1 1 47 LYS HE3 H -15.335 -9.765 2.071 1.00 . A A . 47 LYS HE3 1 1 3 2044 1 1 47 LYS HG2 H -13.188 -6.699 1.499 1.00 . A A . 47 LYS HG2 1 1 3 2045 1 1 47 LYS HG3 H -14.870 -7.188 1.707 1.00 . A A . 47 LYS HG3 1 1 3 2046 1 1 47 LYS HZ1 H -12.851 -10.596 3.253 1.00 . A A . 47 LYS HZ1 1 1 3 2047 1 1 47 LYS HZ2 H -14.259 -11.486 2.960 1.00 . A A . 47 LYS HZ2 1 1 3 2048 1 1 47 LYS HZ3 H -14.128 -10.551 4.362 1.00 . A A . 47 LYS HZ3 1 1 3 2049 1 1 47 LYS N N -13.434 -6.204 -2.327 1.00 . A A . 47 LYS N 1 1 3 2050 1 1 47 LYS NZ N -13.887 -10.598 3.352 1.00 . A A . 47 LYS NZ 1 1 3 2051 1 1 47 LYS O O -11.695 -8.310 -2.286 1.00 . A A . 47 LYS O 1 1 3 2052 1 1 48 CYS C C -10.336 -10.220 0.224 1.00 . A A . 48 CYS C 1 1 3 2053 1 1 48 CYS CA C -9.914 -8.825 -0.231 1.00 . A A . 48 CYS CA 1 1 3 2054 1 1 48 CYS CB C -8.764 -8.319 0.641 1.00 . A A . 48 CYS CB 1 1 3 2055 1 1 48 CYS H H -11.203 -7.391 0.647 1.00 . A A . 48 CYS H 1 1 3 2056 1 1 48 CYS HA H -9.580 -8.880 -1.255 1.00 . A A . 48 CYS HA 1 1 3 2057 1 1 48 CYS HB2 H -9.012 -7.339 1.018 1.00 . A A . 48 CYS HB2 1 1 3 2058 1 1 48 CYS HB3 H -8.627 -8.996 1.472 1.00 . A A . 48 CYS HB3 1 1 3 2059 1 1 48 CYS N N -11.037 -7.895 -0.177 1.00 . A A . 48 CYS N 1 1 3 2060 1 1 48 CYS O O -10.747 -10.412 1.370 1.00 . A A . 48 CYS O 1 1 3 2061 1 1 48 CYS SG S -7.171 -8.188 -0.235 1.00 . A A . 48 CYS SG 1 1 3 2062 1 1 49 GLY C C -9.425 -13.395 0.091 1.00 . A A . 49 GLY C 1 1 3 2063 1 1 49 GLY CA C -10.608 -12.554 -0.356 1.00 . A A . 49 GLY CA 1 1 3 2064 1 1 49 GLY H H -9.900 -10.976 -1.578 1.00 . A A . 49 GLY H 1 1 3 2065 1 1 49 GLY HA2 H -11.340 -12.534 0.438 1.00 . A A . 49 GLY HA2 1 1 3 2066 1 1 49 GLY HA3 H -11.050 -13.011 -1.229 1.00 . A A . 49 GLY HA3 1 1 3 2067 1 1 49 GLY N N -10.232 -11.189 -0.681 1.00 . A A . 49 GLY N 1 1 3 2068 1 1 49 GLY O O -8.306 -12.891 0.187 1.00 . A A . 49 GLY O 1 1 3 2069 1 1 50 PRO C C -7.771 -16.162 -0.345 1.00 . A A . 50 PRO C 1 1 3 2070 1 1 50 PRO CA C -8.582 -15.596 0.817 1.00 . A A . 50 PRO CA 1 1 3 2071 1 1 50 PRO CB C -9.359 -16.707 1.516 1.00 . A A . 50 PRO CB 1 1 3 2072 1 1 50 PRO CD C -10.948 -15.380 0.295 1.00 . A A . 50 PRO CD 1 1 3 2073 1 1 50 PRO CG C -10.650 -16.780 0.773 1.00 . A A . 50 PRO CG 1 1 3 2074 1 1 50 PRO HA H -7.918 -15.117 1.522 1.00 . A A . 50 PRO HA 1 1 3 2075 1 1 50 PRO HB2 H -8.808 -17.634 1.448 1.00 . A A . 50 PRO HB2 1 1 3 2076 1 1 50 PRO HB3 H -9.514 -16.447 2.552 1.00 . A A . 50 PRO HB3 1 1 3 2077 1 1 50 PRO HD2 H -11.310 -15.400 -0.722 1.00 . A A . 50 PRO HD2 1 1 3 2078 1 1 50 PRO HD3 H -11.673 -14.908 0.943 1.00 . A A . 50 PRO HD3 1 1 3 2079 1 1 50 PRO HG2 H -10.549 -17.449 -0.069 1.00 . A A . 50 PRO HG2 1 1 3 2080 1 1 50 PRO HG3 H -11.432 -17.125 1.433 1.00 . A A . 50 PRO HG3 1 1 3 2081 1 1 50 PRO N N -9.644 -14.692 0.375 1.00 . A A . 50 PRO N 1 1 3 2082 1 1 50 PRO O O -7.029 -17.131 -0.181 1.00 . A A . 50 PRO O 1 1 3 2083 1 1 51 GLY C C -6.197 -14.998 -3.200 1.00 . A A . 51 GLY C 1 1 3 2084 1 1 51 GLY CA C -7.195 -16.018 -2.688 1.00 . A A . 51 GLY CA 1 1 3 2085 1 1 51 GLY H H -8.525 -14.788 -1.591 1.00 . A A . 51 GLY H 1 1 3 2086 1 1 51 GLY HA2 H -6.665 -16.923 -2.432 1.00 . A A . 51 GLY HA2 1 1 3 2087 1 1 51 GLY HA3 H -7.903 -16.238 -3.473 1.00 . A A . 51 GLY HA3 1 1 3 2088 1 1 51 GLY N N -7.919 -15.554 -1.519 1.00 . A A . 51 GLY N 1 1 3 2089 1 1 51 GLY O O -5.699 -15.115 -4.319 1.00 . A A . 51 GLY O 1 1 3 2090 1 1 52 GLY C C -5.481 -12.105 -3.905 1.00 . A A . 52 GLY C 1 1 3 2091 1 1 52 GLY CA C -4.962 -12.964 -2.768 1.00 . A A . 52 GLY CA 1 1 3 2092 1 1 52 GLY H H -6.336 -13.957 -1.498 1.00 . A A . 52 GLY H 1 1 3 2093 1 1 52 GLY HA2 H -4.764 -12.332 -1.915 1.00 . A A . 52 GLY HA2 1 1 3 2094 1 1 52 GLY HA3 H -4.041 -13.434 -3.078 1.00 . A A . 52 GLY HA3 1 1 3 2095 1 1 52 GLY N N -5.907 -13.996 -2.377 1.00 . A A . 52 GLY N 1 1 3 2096 1 1 52 GLY O O -4.701 -11.490 -4.632 1.00 . A A . 52 GLY O 1 1 3 2097 1 1 53 THR C C -8.650 -10.529 -4.574 1.00 . A A . 53 THR C 1 1 3 2098 1 1 53 THR CA C -7.429 -11.270 -5.106 1.00 . A A . 53 THR CA 1 1 3 2099 1 1 53 THR CB C -7.856 -12.150 -6.296 1.00 . A A . 53 THR CB 1 1 3 2100 1 1 53 THR CG2 C -6.720 -12.296 -7.298 1.00 . A A . 53 THR CG2 1 1 3 2101 1 1 53 THR H H -7.369 -12.572 -3.440 1.00 . A A . 53 THR H 1 1 3 2102 1 1 53 THR HA H -6.707 -10.548 -5.458 1.00 . A A . 53 THR HA 1 1 3 2103 1 1 53 THR HB H -8.694 -11.679 -6.791 1.00 . A A . 53 THR HB 1 1 3 2104 1 1 53 THR HG1 H -7.488 -14.019 -5.779 1.00 . A A . 53 THR HG1 1 1 3 2105 1 1 53 THR HG21 H -6.754 -11.477 -8.001 1.00 . A A . 53 THR HG21 1 1 3 2106 1 1 53 THR HG22 H -6.827 -13.231 -7.829 1.00 . A A . 53 THR HG22 1 1 3 2107 1 1 53 THR HG23 H -5.776 -12.284 -6.776 1.00 . A A . 53 THR HG23 1 1 3 2108 1 1 53 THR N N -6.802 -12.060 -4.054 1.00 . A A . 53 THR N 1 1 3 2109 1 1 53 THR O O -9.149 -10.835 -3.491 1.00 . A A . 53 THR O 1 1 3 2110 1 1 53 THR OG1 O -8.256 -13.445 -5.830 1.00 . A A . 53 THR OG1 1 1 3 2111 1 1 54 CYS C C -11.570 -9.348 -5.555 1.00 . A A . 54 CYS C 1 1 3 2112 1 1 54 CYS CA C -10.297 -8.776 -4.940 1.00 . A A . 54 CYS CA 1 1 3 2113 1 1 54 CYS CB C -10.129 -7.312 -5.352 1.00 . A A . 54 CYS CB 1 1 3 2114 1 1 54 CYS H H -8.693 -9.358 -6.194 1.00 . A A . 54 CYS H 1 1 3 2115 1 1 54 CYS HA H -10.376 -8.831 -3.865 1.00 . A A . 54 CYS HA 1 1 3 2116 1 1 54 CYS HB2 H -10.090 -7.250 -6.429 1.00 . A A . 54 CYS HB2 1 1 3 2117 1 1 54 CYS HB3 H -10.978 -6.747 -4.994 1.00 . A A . 54 CYS HB3 1 1 3 2118 1 1 54 CYS N N -9.131 -9.555 -5.341 1.00 . A A . 54 CYS N 1 1 3 2119 1 1 54 CYS O O -11.611 -9.661 -6.746 1.00 . A A . 54 CYS O 1 1 3 2120 1 1 54 CYS SG S -8.623 -6.520 -4.698 1.00 . A A . 54 CYS SG 1 1 3 2121 1 1 55 ILE C C -15.032 -9.076 -4.836 1.00 . A A . 55 ILE C 1 1 3 2122 1 1 55 ILE CA C -13.884 -10.016 -5.192 1.00 . A A . 55 ILE CA 1 1 3 2123 1 1 55 ILE CB C -14.165 -11.402 -4.581 1.00 . A A . 55 ILE CB 1 1 3 2124 1 1 55 ILE CD1 C -14.920 -12.303 -2.322 1.00 . A A . 55 ILE CD1 1 1 3 2125 1 1 55 ILE CG1 C -13.998 -11.357 -3.060 1.00 . A A . 55 ILE CG1 1 1 3 2126 1 1 55 ILE CG2 C -13.241 -12.447 -5.189 1.00 . A A . 55 ILE CG2 1 1 3 2127 1 1 55 ILE H H -12.513 -9.214 -3.798 1.00 . A A . 55 ILE H 1 1 3 2128 1 1 55 ILE HA H -13.837 -10.122 -6.266 1.00 . A A . 55 ILE HA 1 1 3 2129 1 1 55 ILE HB H -15.182 -11.677 -4.816 1.00 . A A . 55 ILE HB 1 1 3 2130 1 1 55 ILE HD11 H -14.420 -12.678 -1.441 1.00 . A A . 55 ILE HD11 1 1 3 2131 1 1 55 ILE HD12 H -15.180 -13.129 -2.968 1.00 . A A . 55 ILE HD12 1 1 3 2132 1 1 55 ILE HD13 H -15.817 -11.777 -2.031 1.00 . A A . 55 ILE HD13 1 1 3 2133 1 1 55 ILE HG12 H -12.982 -11.622 -2.807 1.00 . A A . 55 ILE HG12 1 1 3 2134 1 1 55 ILE HG13 H -14.201 -10.355 -2.712 1.00 . A A . 55 ILE HG13 1 1 3 2135 1 1 55 ILE HG21 H -13.679 -12.829 -6.099 1.00 . A A . 55 ILE HG21 1 1 3 2136 1 1 55 ILE HG22 H -13.104 -13.257 -4.487 1.00 . A A . 55 ILE HG22 1 1 3 2137 1 1 55 ILE HG23 H -12.285 -11.996 -5.410 1.00 . A A . 55 ILE HG23 1 1 3 2138 1 1 55 ILE N N -12.608 -9.482 -4.735 1.00 . A A . 55 ILE N 1 1 3 2139 1 1 55 ILE O O -14.876 -8.176 -4.011 1.00 . A A . 55 ILE O 1 1 3 2140 1 1 56 SER C C -17.936 -8.748 -3.829 1.00 . A A . 56 SER C 1 1 3 2141 1 1 56 SER CA C -17.357 -8.465 -5.212 1.00 . A A . 56 SER CA 1 1 3 2142 1 1 56 SER CB C -18.421 -8.712 -6.283 1.00 . A A . 56 SER CB 1 1 3 2143 1 1 56 SER H H -16.245 -10.027 -6.109 1.00 . A A . 56 SER H 1 1 3 2144 1 1 56 SER HA H -17.049 -7.431 -5.255 1.00 . A A . 56 SER HA 1 1 3 2145 1 1 56 SER HB2 H -17.939 -8.872 -7.237 1.00 . A A . 56 SER HB2 1 1 3 2146 1 1 56 SER HB3 H -18.997 -9.587 -6.020 1.00 . A A . 56 SER HB3 1 1 3 2147 1 1 56 SER HG H -18.882 -6.826 -6.018 1.00 . A A . 56 SER HG 1 1 3 2148 1 1 56 SER N N -16.184 -9.292 -5.463 1.00 . A A . 56 SER N 1 1 3 2149 1 1 56 SER O O -18.594 -9.796 -3.666 1.00 . A A . 56 SER O 1 1 3 2150 1 1 56 SER OXT O -17.724 -7.918 -2.919 1.00 . A A . 56 SER OXT 1 1 3 2151 1 1 56 SER OG O -19.298 -7.604 -6.396 1.00 . A A . 56 SER OG 1 1 4 2152 1 1 1 ASP C C 3.312 14.937 -2.847 1.00 . A A . 1 ASP C 1 1 4 2153 1 1 1 ASP CA C 4.339 14.767 -3.962 1.00 . A A . 1 ASP CA 1 1 4 2154 1 1 1 ASP CB C 5.529 13.947 -3.461 1.00 . A A . 1 ASP CB 1 1 4 2155 1 1 1 ASP CG C 6.501 14.775 -2.644 1.00 . A A . 1 ASP CG 1 1 4 2156 1 1 1 ASP H1 H 4.504 16.842 -3.814 1.00 . A A . 1 ASP H1 1 1 4 2157 1 1 1 ASP H2 H 4.490 16.266 -5.405 1.00 . A A . 1 ASP H2 1 1 4 2158 1 1 1 ASP H3 H 5.877 16.088 -4.454 1.00 . A A . 1 ASP H3 1 1 4 2159 1 1 1 ASP HA H 3.876 14.251 -4.791 1.00 . A A . 1 ASP HA 1 1 4 2160 1 1 1 ASP HB2 H 5.168 13.138 -2.844 1.00 . A A . 1 ASP HB2 1 1 4 2161 1 1 1 ASP HB3 H 6.060 13.538 -4.310 1.00 . A A . 1 ASP HB3 1 1 4 2162 1 1 1 ASP N N 4.837 16.082 -4.442 1.00 . A A . 1 ASP N 1 1 4 2163 1 1 1 ASP O O 3.120 16.037 -2.327 1.00 . A A . 1 ASP O 1 1 4 2164 1 1 1 ASP OD1 O 7.698 14.808 -2.997 1.00 . A A . 1 ASP OD1 1 1 4 2165 1 1 1 ASP OD2 O 6.062 15.393 -1.650 1.00 . A A . 1 ASP OD2 1 1 4 2166 1 1 2 VAL C C 2.194 13.259 -0.140 1.00 . A A . 2 VAL C 1 1 4 2167 1 1 2 VAL CA C 1.645 13.860 -1.430 1.00 . A A . 2 VAL CA 1 1 4 2168 1 1 2 VAL CB C 0.378 13.083 -1.844 1.00 . A A . 2 VAL CB 1 1 4 2169 1 1 2 VAL CG1 C -0.853 13.669 -1.171 1.00 . A A . 2 VAL CG1 1 1 4 2170 1 1 2 VAL CG2 C 0.217 13.080 -3.358 1.00 . A A . 2 VAL CG2 1 1 4 2171 1 1 2 VAL H H 2.854 12.993 -2.935 1.00 . A A . 2 VAL H 1 1 4 2172 1 1 2 VAL HA H 1.371 14.889 -1.250 1.00 . A A . 2 VAL HA 1 1 4 2173 1 1 2 VAL HB H 0.486 12.060 -1.514 1.00 . A A . 2 VAL HB 1 1 4 2174 1 1 2 VAL HG11 H -0.912 14.726 -1.386 1.00 . A A . 2 VAL HG11 1 1 4 2175 1 1 2 VAL HG12 H -0.785 13.521 -0.104 1.00 . A A . 2 VAL HG12 1 1 4 2176 1 1 2 VAL HG13 H -1.737 13.176 -1.548 1.00 . A A . 2 VAL HG13 1 1 4 2177 1 1 2 VAL HG21 H -0.159 12.120 -3.678 1.00 . A A . 2 VAL HG21 1 1 4 2178 1 1 2 VAL HG22 H 1.172 13.266 -3.824 1.00 . A A . 2 VAL HG22 1 1 4 2179 1 1 2 VAL HG23 H -0.480 13.852 -3.647 1.00 . A A . 2 VAL HG23 1 1 4 2180 1 1 2 VAL N N 2.655 13.839 -2.484 1.00 . A A . 2 VAL N 1 1 4 2181 1 1 2 VAL O O 2.809 12.194 -0.156 1.00 . A A . 2 VAL O 1 1 4 2182 1 1 3 GLN C C 1.449 12.447 2.855 1.00 . A A . 3 GLN C 1 1 4 2183 1 1 3 GLN CA C 2.426 13.462 2.275 1.00 . A A . 3 GLN CA 1 1 4 2184 1 1 3 GLN CB C 2.599 14.626 3.253 1.00 . A A . 3 GLN CB 1 1 4 2185 1 1 3 GLN CD C 5.060 14.778 2.685 1.00 . A A . 3 GLN CD 1 1 4 2186 1 1 3 GLN CG C 4.016 14.773 3.785 1.00 . A A . 3 GLN CG 1 1 4 2187 1 1 3 GLN H H 1.452 14.778 0.931 1.00 . A A . 3 GLN H 1 1 4 2188 1 1 3 GLN HA H 3.380 12.981 2.128 1.00 . A A . 3 GLN HA 1 1 4 2189 1 1 3 GLN HB2 H 2.327 15.545 2.754 1.00 . A A . 3 GLN HB2 1 1 4 2190 1 1 3 GLN HB3 H 1.937 14.472 4.093 1.00 . A A . 3 GLN HB3 1 1 4 2191 1 1 3 GLN HE21 H 4.861 16.745 2.470 1.00 . A A . 3 GLN HE21 1 1 4 2192 1 1 3 GLN HE22 H 6.011 15.988 1.426 1.00 . A A . 3 GLN HE22 1 1 4 2193 1 1 3 GLN HG2 H 4.087 15.703 4.330 1.00 . A A . 3 GLN HG2 1 1 4 2194 1 1 3 GLN HG3 H 4.222 13.949 4.454 1.00 . A A . 3 GLN HG3 1 1 4 2195 1 1 3 GLN N N 1.959 13.940 0.978 1.00 . A A . 3 GLN N 1 1 4 2196 1 1 3 GLN NE2 N 5.339 15.955 2.138 1.00 . A A . 3 GLN NE2 1 1 4 2197 1 1 3 GLN O O 0.295 12.774 3.136 1.00 . A A . 3 GLN O 1 1 4 2198 1 1 3 GLN OE1 O 5.610 13.735 2.330 1.00 . A A . 3 GLN OE1 1 1 4 2199 1 1 4 CYS C C 0.615 10.482 4.990 1.00 . A A . 4 CYS C 1 1 4 2200 1 1 4 CYS CA C 1.078 10.157 3.575 1.00 . A A . 4 CYS CA 1 1 4 2201 1 1 4 CYS CB C 1.827 8.826 3.599 1.00 . A A . 4 CYS CB 1 1 4 2202 1 1 4 CYS H H 2.843 11.015 2.786 1.00 . A A . 4 CYS H 1 1 4 2203 1 1 4 CYS HA H 0.209 10.053 2.941 1.00 . A A . 4 CYS HA 1 1 4 2204 1 1 4 CYS HB2 H 1.902 8.435 2.596 1.00 . A A . 4 CYS HB2 1 1 4 2205 1 1 4 CYS HB3 H 2.819 8.970 4.001 1.00 . A A . 4 CYS HB3 1 1 4 2206 1 1 4 CYS N N 1.915 11.216 3.031 1.00 . A A . 4 CYS N 1 1 4 2207 1 1 4 CYS O O -0.541 10.843 5.217 1.00 . A A . 4 CYS O 1 1 4 2208 1 1 4 CYS SG S 0.988 7.587 4.620 1.00 . A A . 4 CYS SG 1 1 4 2209 1 1 5 GLY C C 1.876 9.522 8.217 1.00 . A A . 5 GLY C 1 1 4 2210 1 1 5 GLY CA C 1.227 10.564 7.333 1.00 . A A . 5 GLY CA 1 1 4 2211 1 1 5 GLY H H 2.424 10.015 5.684 1.00 . A A . 5 GLY H 1 1 4 2212 1 1 5 GLY HA2 H 1.594 11.540 7.610 1.00 . A A . 5 GLY HA2 1 1 4 2213 1 1 5 GLY HA3 H 0.157 10.532 7.477 1.00 . A A . 5 GLY HA3 1 1 4 2214 1 1 5 GLY N N 1.529 10.322 5.938 1.00 . A A . 5 GLY N 1 1 4 2215 1 1 5 GLY O O 1.197 8.738 8.879 1.00 . A A . 5 GLY O 1 1 4 2216 1 1 6 GLY C C 5.402 8.482 8.565 1.00 . A A . 6 GLY C 1 1 4 2217 1 1 6 GLY CA C 3.954 8.563 9.001 1.00 . A A . 6 GLY CA 1 1 4 2218 1 1 6 GLY H H 3.675 10.172 7.655 1.00 . A A . 6 GLY H 1 1 4 2219 1 1 6 GLY HA2 H 3.915 8.860 10.038 1.00 . A A . 6 GLY HA2 1 1 4 2220 1 1 6 GLY HA3 H 3.502 7.587 8.897 1.00 . A A . 6 GLY HA3 1 1 4 2221 1 1 6 GLY N N 3.203 9.516 8.210 1.00 . A A . 6 GLY N 1 1 4 2222 1 1 6 GLY O O 6.162 7.651 9.063 1.00 . A A . 6 GLY O 1 1 4 2223 1 1 7 GLY C C 7.290 9.059 5.686 1.00 . A A . 7 GLY C 1 1 4 2224 1 1 7 GLY CA C 7.158 9.379 7.164 1.00 . A A . 7 GLY CA 1 1 4 2225 1 1 7 GLY H H 5.143 10.008 7.291 1.00 . A A . 7 GLY H 1 1 4 2226 1 1 7 GLY HA2 H 7.572 10.359 7.342 1.00 . A A . 7 GLY HA2 1 1 4 2227 1 1 7 GLY HA3 H 7.730 8.655 7.727 1.00 . A A . 7 GLY HA3 1 1 4 2228 1 1 7 GLY N N 5.789 9.360 7.640 1.00 . A A . 7 GLY N 1 1 4 2229 1 1 7 GLY O O 8.351 9.276 5.099 1.00 . A A . 7 GLY O 1 1 4 2230 1 1 8 PHE C C 5.420 9.094 2.805 1.00 . A A . 8 PHE C 1 1 4 2231 1 1 8 PHE CA C 6.280 8.172 3.662 1.00 . A A . 8 PHE CA 1 1 4 2232 1 1 8 PHE CB C 5.833 6.729 3.469 1.00 . A A . 8 PHE CB 1 1 4 2233 1 1 8 PHE CD1 C 7.247 5.637 5.238 1.00 . A A . 8 PHE CD1 1 1 4 2234 1 1 8 PHE CD2 C 7.435 4.854 2.992 1.00 . A A . 8 PHE CD2 1 1 4 2235 1 1 8 PHE CE1 C 8.187 4.708 5.644 1.00 . A A . 8 PHE CE1 1 1 4 2236 1 1 8 PHE CE2 C 8.376 3.925 3.393 1.00 . A A . 8 PHE CE2 1 1 4 2237 1 1 8 PHE CG C 6.860 5.720 3.910 1.00 . A A . 8 PHE CG 1 1 4 2238 1 1 8 PHE CZ C 8.752 3.851 4.720 1.00 . A A . 8 PHE CZ 1 1 4 2239 1 1 8 PHE H H 5.409 8.356 5.590 1.00 . A A . 8 PHE H 1 1 4 2240 1 1 8 PHE HA H 7.306 8.261 3.338 1.00 . A A . 8 PHE HA 1 1 4 2241 1 1 8 PHE HB2 H 4.928 6.564 4.041 1.00 . A A . 8 PHE HB2 1 1 4 2242 1 1 8 PHE HB3 H 5.626 6.560 2.422 1.00 . A A . 8 PHE HB3 1 1 4 2243 1 1 8 PHE HD1 H 6.806 6.306 5.961 1.00 . A A . 8 PHE HD1 1 1 4 2244 1 1 8 PHE HD2 H 7.142 4.910 1.955 1.00 . A A . 8 PHE HD2 1 1 4 2245 1 1 8 PHE HE1 H 8.480 4.653 6.682 1.00 . A A . 8 PHE HE1 1 1 4 2246 1 1 8 PHE HE2 H 8.817 3.256 2.668 1.00 . A A . 8 PHE HE2 1 1 4 2247 1 1 8 PHE HZ H 9.486 3.124 5.035 1.00 . A A . 8 PHE HZ 1 1 4 2248 1 1 8 PHE N N 6.230 8.527 5.077 1.00 . A A . 8 PHE N 1 1 4 2249 1 1 8 PHE O O 4.811 10.042 3.303 1.00 . A A . 8 PHE O 1 1 4 2250 1 1 9 SER C C 4.222 8.738 -0.656 1.00 . A A . 9 SER C 1 1 4 2251 1 1 9 SER CA C 4.606 9.586 0.555 1.00 . A A . 9 SER CA 1 1 4 2252 1 1 9 SER CB C 5.410 10.806 0.100 1.00 . A A . 9 SER CB 1 1 4 2253 1 1 9 SER H H 5.893 8.030 1.181 1.00 . A A . 9 SER H 1 1 4 2254 1 1 9 SER HA H 3.706 9.919 1.049 1.00 . A A . 9 SER HA 1 1 4 2255 1 1 9 SER HB2 H 5.491 10.800 -0.977 1.00 . A A . 9 SER HB2 1 1 4 2256 1 1 9 SER HB3 H 4.904 11.707 0.417 1.00 . A A . 9 SER HB3 1 1 4 2257 1 1 9 SER HG H 6.956 11.684 0.921 1.00 . A A . 9 SER HG 1 1 4 2258 1 1 9 SER N N 5.382 8.800 1.508 1.00 . A A . 9 SER N 1 1 4 2259 1 1 9 SER O O 4.848 7.712 -0.930 1.00 . A A . 9 SER O 1 1 4 2260 1 1 9 SER OG O 6.714 10.795 0.654 1.00 . A A . 9 SER OG 1 1 4 2261 1 1 10 CYS C C 2.632 9.388 -3.762 1.00 . A A . 10 CYS C 1 1 4 2262 1 1 10 CYS CA C 2.732 8.451 -2.560 1.00 . A A . 10 CYS CA 1 1 4 2263 1 1 10 CYS CB C 1.371 7.803 -2.289 1.00 . A A . 10 CYS CB 1 1 4 2264 1 1 10 CYS H H 2.734 9.993 -1.113 1.00 . A A . 10 CYS H 1 1 4 2265 1 1 10 CYS HA H 3.451 7.676 -2.781 1.00 . A A . 10 CYS HA 1 1 4 2266 1 1 10 CYS HB2 H 0.874 8.349 -1.501 1.00 . A A . 10 CYS HB2 1 1 4 2267 1 1 10 CYS HB3 H 0.773 7.858 -3.186 1.00 . A A . 10 CYS HB3 1 1 4 2268 1 1 10 CYS N N 3.193 9.170 -1.378 1.00 . A A . 10 CYS N 1 1 4 2269 1 1 10 CYS O O 2.628 10.610 -3.609 1.00 . A A . 10 CYS O 1 1 4 2270 1 1 10 CYS SG S 1.454 6.053 -1.780 1.00 . A A . 10 CYS SG 1 1 4 2271 1 1 11 HIS C C 1.013 9.982 -6.465 1.00 . A A . 11 HIS C 1 1 4 2272 1 1 11 HIS CA C 2.460 9.587 -6.183 1.00 . A A . 11 HIS CA 1 1 4 2273 1 1 11 HIS CB C 3.024 8.789 -7.361 1.00 . A A . 11 HIS CB 1 1 4 2274 1 1 11 HIS CD2 C 3.686 9.453 -9.779 1.00 . A A . 11 HIS CD2 1 1 4 2275 1 1 11 HIS CE1 C 4.669 11.362 -9.332 1.00 . A A . 11 HIS CE1 1 1 4 2276 1 1 11 HIS CG C 3.618 9.641 -8.440 1.00 . A A . 11 HIS CG 1 1 4 2277 1 1 11 HIS H H 2.571 7.828 -5.005 1.00 . A A . 11 HIS H 1 1 4 2278 1 1 11 HIS HA H 3.048 10.484 -6.052 1.00 . A A . 11 HIS HA 1 1 4 2279 1 1 11 HIS HB2 H 3.796 8.127 -6.999 1.00 . A A . 11 HIS HB2 1 1 4 2280 1 1 11 HIS HB3 H 2.230 8.202 -7.800 1.00 . A A . 11 HIS HB3 1 1 4 2281 1 1 11 HIS HD1 H 4.356 11.262 -7.312 1.00 . A A . 11 HIS HD1 1 1 4 2282 1 1 11 HIS HD2 H 3.293 8.609 -10.330 1.00 . A A . 11 HIS HD2 1 1 4 2283 1 1 11 HIS HE1 H 5.196 12.298 -9.445 1.00 . A A . 11 HIS HE1 1 1 4 2284 1 1 11 HIS HE2 H 4.535 10.679 -11.260 1.00 . A A . 11 HIS HE2 1 1 4 2285 1 1 11 HIS N N 2.556 8.806 -4.954 1.00 . A A . 11 HIS N 1 1 4 2286 1 1 11 HIS ND1 N 4.244 10.846 -8.192 1.00 . A A . 11 HIS ND1 1 1 4 2287 1 1 11 HIS NE2 N 4.344 10.536 -10.309 1.00 . A A . 11 HIS NE2 1 1 4 2288 1 1 11 HIS O O 0.088 9.520 -5.794 1.00 . A A . 11 HIS O 1 1 4 2289 1 1 12 ASP C C -1.392 10.127 -8.244 1.00 . A A . 12 ASP C 1 1 4 2290 1 1 12 ASP CA C -0.513 11.299 -7.826 1.00 . A A . 12 ASP CA 1 1 4 2291 1 1 12 ASP CB C -0.433 12.319 -8.962 1.00 . A A . 12 ASP CB 1 1 4 2292 1 1 12 ASP CG C -1.365 13.496 -8.747 1.00 . A A . 12 ASP CG 1 1 4 2293 1 1 12 ASP H H 1.594 11.183 -7.959 1.00 . A A . 12 ASP H 1 1 4 2294 1 1 12 ASP HA H -0.952 11.772 -6.960 1.00 . A A . 12 ASP HA 1 1 4 2295 1 1 12 ASP HB2 H 0.578 12.693 -9.033 1.00 . A A . 12 ASP HB2 1 1 4 2296 1 1 12 ASP HB3 H -0.700 11.837 -9.892 1.00 . A A . 12 ASP HB3 1 1 4 2297 1 1 12 ASP N N 0.822 10.843 -7.460 1.00 . A A . 12 ASP N 1 1 4 2298 1 1 12 ASP O O -1.011 9.324 -9.096 1.00 . A A . 12 ASP O 1 1 4 2299 1 1 12 ASP OD1 O -2.562 13.264 -8.475 1.00 . A A . 12 ASP OD1 1 1 4 2300 1 1 12 ASP OD2 O -0.897 14.650 -8.849 1.00 . A A . 12 ASP OD2 1 1 4 2301 1 1 13 GLY C C -3.326 7.757 -7.060 1.00 . A A . 13 GLY C 1 1 4 2302 1 1 13 GLY CA C -3.490 8.964 -7.962 1.00 . A A . 13 GLY CA 1 1 4 2303 1 1 13 GLY H H -2.821 10.711 -6.971 1.00 . A A . 13 GLY H 1 1 4 2304 1 1 13 GLY HA2 H -4.501 9.334 -7.869 1.00 . A A . 13 GLY HA2 1 1 4 2305 1 1 13 GLY HA3 H -3.323 8.661 -8.985 1.00 . A A . 13 GLY HA3 1 1 4 2306 1 1 13 GLY N N -2.571 10.038 -7.639 1.00 . A A . 13 GLY N 1 1 4 2307 1 1 13 GLY O O -4.152 6.844 -7.088 1.00 . A A . 13 GLY O 1 1 4 2308 1 1 14 GLU C C -2.436 6.972 -3.930 1.00 . A A . 14 GLU C 1 1 4 2309 1 1 14 GLU CA C -2.015 6.625 -5.354 1.00 . A A . 14 GLU CA 1 1 4 2310 1 1 14 GLU CB C -0.537 6.220 -5.374 1.00 . A A . 14 GLU CB 1 1 4 2311 1 1 14 GLU CD C 0.674 5.620 -7.507 1.00 . A A . 14 GLU CD 1 1 4 2312 1 1 14 GLU CG C 0.229 6.733 -6.581 1.00 . A A . 14 GLU CG 1 1 4 2313 1 1 14 GLU H H -1.633 8.497 -6.277 1.00 . A A . 14 GLU H 1 1 4 2314 1 1 14 GLU HA H -2.610 5.790 -5.694 1.00 . A A . 14 GLU HA 1 1 4 2315 1 1 14 GLU HB2 H -0.060 6.603 -4.484 1.00 . A A . 14 GLU HB2 1 1 4 2316 1 1 14 GLU HB3 H -0.473 5.141 -5.369 1.00 . A A . 14 GLU HB3 1 1 4 2317 1 1 14 GLU HG2 H -0.405 7.410 -7.134 1.00 . A A . 14 GLU HG2 1 1 4 2318 1 1 14 GLU HG3 H 1.104 7.266 -6.234 1.00 . A A . 14 GLU HG3 1 1 4 2319 1 1 14 GLU N N -2.263 7.743 -6.259 1.00 . A A . 14 GLU N 1 1 4 2320 1 1 14 GLU O O -2.595 8.143 -3.586 1.00 . A A . 14 GLU O 1 1 4 2321 1 1 14 GLU OE1 O -0.199 4.990 -8.142 1.00 . A A . 14 GLU OE1 1 1 4 2322 1 1 14 GLU OE2 O 1.896 5.377 -7.600 1.00 . A A . 14 GLU OE2 1 1 4 2323 1 1 15 THR C C -2.023 5.408 -0.782 1.00 . A A . 15 THR C 1 1 4 2324 1 1 15 THR CA C -2.994 6.132 -1.709 1.00 . A A . 15 THR CA 1 1 4 2325 1 1 15 THR CB C -4.423 5.617 -1.451 1.00 . A A . 15 THR CB 1 1 4 2326 1 1 15 THR CG2 C -4.909 6.036 -0.072 1.00 . A A . 15 THR CG2 1 1 4 2327 1 1 15 THR H H -2.452 5.031 -3.429 1.00 . A A . 15 THR H 1 1 4 2328 1 1 15 THR HA H -2.966 7.190 -1.492 1.00 . A A . 15 THR HA 1 1 4 2329 1 1 15 THR HB H -4.416 4.536 -1.502 1.00 . A A . 15 THR HB 1 1 4 2330 1 1 15 THR HG1 H -4.823 6.305 -3.255 1.00 . A A . 15 THR HG1 1 1 4 2331 1 1 15 THR HG21 H -5.904 6.447 -0.152 1.00 . A A . 15 THR HG21 1 1 4 2332 1 1 15 THR HG22 H -4.243 6.784 0.332 1.00 . A A . 15 THR HG22 1 1 4 2333 1 1 15 THR HG23 H -4.925 5.177 0.582 1.00 . A A . 15 THR HG23 1 1 4 2334 1 1 15 THR N N -2.604 5.944 -3.102 1.00 . A A . 15 THR N 1 1 4 2335 1 1 15 THR O O -1.578 4.304 -1.083 1.00 . A A . 15 THR O 1 1 4 2336 1 1 15 THR OG1 O -5.314 6.128 -2.449 1.00 . A A . 15 THR OG1 1 1 4 2337 1 1 16 CYS C C -1.480 4.546 2.303 1.00 . A A . 16 CYS C 1 1 4 2338 1 1 16 CYS CA C -0.756 5.424 1.282 1.00 . A A . 16 CYS CA 1 1 4 2339 1 1 16 CYS CB C 0.067 6.510 1.976 1.00 . A A . 16 CYS CB 1 1 4 2340 1 1 16 CYS H H -2.068 6.911 0.536 1.00 . A A . 16 CYS H 1 1 4 2341 1 1 16 CYS HA H -0.083 4.799 0.714 1.00 . A A . 16 CYS HA 1 1 4 2342 1 1 16 CYS HB2 H 1.042 6.113 2.212 1.00 . A A . 16 CYS HB2 1 1 4 2343 1 1 16 CYS HB3 H 0.181 7.347 1.302 1.00 . A A . 16 CYS HB3 1 1 4 2344 1 1 16 CYS N N -1.688 6.030 0.338 1.00 . A A . 16 CYS N 1 1 4 2345 1 1 16 CYS O O -2.417 4.986 2.969 1.00 . A A . 16 CYS O 1 1 4 2346 1 1 16 CYS SG S -0.652 7.143 3.522 1.00 . A A . 16 CYS SG 1 1 4 2347 1 1 17 CYS C C -0.563 1.722 4.237 1.00 . A A . 17 CYS C 1 1 4 2348 1 1 17 CYS CA C -1.634 2.334 3.337 1.00 . A A . 17 CYS CA 1 1 4 2349 1 1 17 CYS CB C -2.368 1.233 2.567 1.00 . A A . 17 CYS CB 1 1 4 2350 1 1 17 CYS H H -0.295 2.997 1.845 1.00 . A A . 17 CYS H 1 1 4 2351 1 1 17 CYS HA H -2.345 2.863 3.957 1.00 . A A . 17 CYS HA 1 1 4 2352 1 1 17 CYS HB2 H -3.310 1.032 3.056 1.00 . A A . 17 CYS HB2 1 1 4 2353 1 1 17 CYS HB3 H -2.559 1.575 1.560 1.00 . A A . 17 CYS HB3 1 1 4 2354 1 1 17 CYS N N -1.038 3.292 2.409 1.00 . A A . 17 CYS N 1 1 4 2355 1 1 17 CYS O O 0.525 1.376 3.775 1.00 . A A . 17 CYS O 1 1 4 2356 1 1 17 CYS SG S -1.460 -0.346 2.454 1.00 . A A . 17 CYS SG 1 1 4 2357 1 1 18 PRO C C 0.003 -0.490 6.583 1.00 . A A . 18 PRO C 1 1 4 2358 1 1 18 PRO CA C 0.086 1.033 6.510 1.00 . A A . 18 PRO CA 1 1 4 2359 1 1 18 PRO CB C -0.386 1.667 7.815 1.00 . A A . 18 PRO CB 1 1 4 2360 1 1 18 PRO CD C -2.123 1.990 6.182 1.00 . A A . 18 PRO CD 1 1 4 2361 1 1 18 PRO CG C -1.866 1.773 7.656 1.00 . A A . 18 PRO CG 1 1 4 2362 1 1 18 PRO HA H 1.102 1.334 6.302 1.00 . A A . 18 PRO HA 1 1 4 2363 1 1 18 PRO HB2 H -0.114 1.036 8.647 1.00 . A A . 18 PRO HB2 1 1 4 2364 1 1 18 PRO HB3 H 0.068 2.640 7.931 1.00 . A A . 18 PRO HB3 1 1 4 2365 1 1 18 PRO HD2 H -2.935 1.365 5.841 1.00 . A A . 18 PRO HD2 1 1 4 2366 1 1 18 PRO HD3 H -2.342 3.028 5.986 1.00 . A A . 18 PRO HD3 1 1 4 2367 1 1 18 PRO HG2 H -2.336 0.858 7.987 1.00 . A A . 18 PRO HG2 1 1 4 2368 1 1 18 PRO HG3 H -2.237 2.611 8.227 1.00 . A A . 18 PRO HG3 1 1 4 2369 1 1 18 PRO N N -0.854 1.592 5.541 1.00 . A A . 18 PRO N 1 1 4 2370 1 1 18 PRO O O -1.024 -1.048 6.969 1.00 . A A . 18 PRO O 1 1 4 2371 1 1 19 THR C C 1.655 -3.147 7.557 1.00 . A A . 19 THR C 1 1 4 2372 1 1 19 THR CA C 1.134 -2.619 6.224 1.00 . A A . 19 THR CA 1 1 4 2373 1 1 19 THR CB C 2.017 -3.167 5.088 1.00 . A A . 19 THR CB 1 1 4 2374 1 1 19 THR CG2 C 1.668 -2.504 3.765 1.00 . A A . 19 THR CG2 1 1 4 2375 1 1 19 THR H H 1.881 -0.666 5.906 1.00 . A A . 19 THR H 1 1 4 2376 1 1 19 THR HA H 0.128 -2.983 6.074 1.00 . A A . 19 THR HA 1 1 4 2377 1 1 19 THR HB H 1.844 -4.230 4.998 1.00 . A A . 19 THR HB 1 1 4 2378 1 1 19 THR HG1 H 3.789 -2.386 4.712 1.00 . A A . 19 THR HG1 1 1 4 2379 1 1 19 THR HG21 H 0.695 -2.842 3.438 1.00 . A A . 19 THR HG21 1 1 4 2380 1 1 19 THR HG22 H 2.407 -2.768 3.023 1.00 . A A . 19 THR HG22 1 1 4 2381 1 1 19 THR HG23 H 1.652 -1.431 3.892 1.00 . A A . 19 THR HG23 1 1 4 2382 1 1 19 THR N N 1.089 -1.160 6.204 1.00 . A A . 19 THR N 1 1 4 2383 1 1 19 THR O O 1.556 -4.341 7.840 1.00 . A A . 19 THR O 1 1 4 2384 1 1 19 THR OG1 O 3.400 -2.942 5.390 1.00 . A A . 19 THR OG1 1 1 4 2385 1 1 20 SER C C 2.646 -1.493 10.675 1.00 . A A . 20 SER C 1 1 4 2386 1 1 20 SER CA C 2.744 -2.645 9.673 1.00 . A A . 20 SER CA 1 1 4 2387 1 1 20 SER CB C 4.195 -3.114 9.532 1.00 . A A . 20 SER CB 1 1 4 2388 1 1 20 SER H H 2.258 -1.317 8.096 1.00 . A A . 20 SER H 1 1 4 2389 1 1 20 SER HA H 2.148 -3.468 10.038 1.00 . A A . 20 SER HA 1 1 4 2390 1 1 20 SER HB2 H 4.846 -2.254 9.469 1.00 . A A . 20 SER HB2 1 1 4 2391 1 1 20 SER HB3 H 4.466 -3.706 10.394 1.00 . A A . 20 SER HB3 1 1 4 2392 1 1 20 SER HG H 4.297 -3.343 7.589 1.00 . A A . 20 SER HG 1 1 4 2393 1 1 20 SER N N 2.210 -2.256 8.373 1.00 . A A . 20 SER N 1 1 4 2394 1 1 20 SER O O 1.560 -1.176 11.159 1.00 . A A . 20 SER O 1 1 4 2395 1 1 20 SER OG O 4.367 -3.902 8.367 1.00 . A A . 20 SER OG 1 1 4 2396 1 1 21 GLN C C 4.797 1.315 11.479 1.00 . A A . 21 GLN C 1 1 4 2397 1 1 21 GLN CA C 3.811 0.243 11.929 1.00 . A A . 21 GLN CA 1 1 4 2398 1 1 21 GLN CB C 4.185 -0.249 13.332 1.00 . A A . 21 GLN CB 1 1 4 2399 1 1 21 GLN CD C 6.153 -1.791 13.702 1.00 . A A . 21 GLN CD 1 1 4 2400 1 1 21 GLN CG C 4.677 -1.689 13.373 1.00 . A A . 21 GLN CG 1 1 4 2401 1 1 21 GLN H H 4.619 -1.164 10.569 1.00 . A A . 21 GLN H 1 1 4 2402 1 1 21 GLN HA H 2.822 0.672 11.962 1.00 . A A . 21 GLN HA 1 1 4 2403 1 1 21 GLN HB2 H 4.966 0.384 13.724 1.00 . A A . 21 GLN HB2 1 1 4 2404 1 1 21 GLN HB3 H 3.317 -0.170 13.969 1.00 . A A . 21 GLN HB3 1 1 4 2405 1 1 21 GLN HE21 H 6.621 -1.618 11.777 1.00 . A A . 21 GLN HE21 1 1 4 2406 1 1 21 GLN HE22 H 7.954 -1.791 12.861 1.00 . A A . 21 GLN HE22 1 1 4 2407 1 1 21 GLN HG2 H 4.119 -2.224 14.126 1.00 . A A . 21 GLN HG2 1 1 4 2408 1 1 21 GLN HG3 H 4.505 -2.142 12.407 1.00 . A A . 21 GLN HG3 1 1 4 2409 1 1 21 GLN N N 3.782 -0.870 10.984 1.00 . A A . 21 GLN N 1 1 4 2410 1 1 21 GLN NE2 N 6.994 -1.727 12.677 1.00 . A A . 21 GLN NE2 1 1 4 2411 1 1 21 GLN O O 4.689 2.476 11.872 1.00 . A A . 21 GLN O 1 1 4 2412 1 1 21 GLN OE1 O 6.534 -1.926 14.865 1.00 . A A . 21 GLN OE1 1 1 4 2413 1 1 22 THR C C 6.911 1.711 8.630 1.00 . A A . 22 THR C 1 1 4 2414 1 1 22 THR CA C 6.762 1.843 10.141 1.00 . A A . 22 THR CA 1 1 4 2415 1 1 22 THR CB C 8.132 1.608 10.804 1.00 . A A . 22 THR CB 1 1 4 2416 1 1 22 THR CG2 C 8.279 2.463 12.053 1.00 . A A . 22 THR CG2 1 1 4 2417 1 1 22 THR H H 5.788 -0.021 10.371 1.00 . A A . 22 THR H 1 1 4 2418 1 1 22 THR HA H 6.440 2.847 10.375 1.00 . A A . 22 THR HA 1 1 4 2419 1 1 22 THR HB H 8.907 1.884 10.104 1.00 . A A . 22 THR HB 1 1 4 2420 1 1 22 THR HG1 H 7.903 -0.320 10.454 1.00 . A A . 22 THR HG1 1 1 4 2421 1 1 22 THR HG21 H 7.747 3.393 11.917 1.00 . A A . 22 THR HG21 1 1 4 2422 1 1 22 THR HG22 H 9.325 2.670 12.227 1.00 . A A . 22 THR HG22 1 1 4 2423 1 1 22 THR HG23 H 7.872 1.934 12.902 1.00 . A A . 22 THR HG23 1 1 4 2424 1 1 22 THR N N 5.757 0.917 10.649 1.00 . A A . 22 THR N 1 1 4 2425 1 1 22 THR O O 7.830 2.275 8.035 1.00 . A A . 22 THR O 1 1 4 2426 1 1 22 THR OG1 O 8.282 0.225 11.147 1.00 . A A . 22 THR OG1 1 1 4 2427 1 1 23 THR C C 4.801 1.384 5.913 1.00 . A A . 23 THR C 1 1 4 2428 1 1 23 THR CA C 6.024 0.763 6.575 1.00 . A A . 23 THR CA 1 1 4 2429 1 1 23 THR CB C 6.082 -0.732 6.214 1.00 . A A . 23 THR CB 1 1 4 2430 1 1 23 THR CG2 C 7.239 -1.014 5.269 1.00 . A A . 23 THR CG2 1 1 4 2431 1 1 23 THR H H 5.288 0.547 8.547 1.00 . A A . 23 THR H 1 1 4 2432 1 1 23 THR HA H 6.912 1.241 6.187 1.00 . A A . 23 THR HA 1 1 4 2433 1 1 23 THR HB H 5.160 -1.002 5.720 1.00 . A A . 23 THR HB 1 1 4 2434 1 1 23 THR HG1 H 5.896 -2.407 7.240 1.00 . A A . 23 THR HG1 1 1 4 2435 1 1 23 THR HG21 H 7.578 -0.089 4.828 1.00 . A A . 23 THR HG21 1 1 4 2436 1 1 23 THR HG22 H 6.912 -1.687 4.490 1.00 . A A . 23 THR HG22 1 1 4 2437 1 1 23 THR HG23 H 8.050 -1.469 5.819 1.00 . A A . 23 THR HG23 1 1 4 2438 1 1 23 THR N N 5.998 0.966 8.017 1.00 . A A . 23 THR N 1 1 4 2439 1 1 23 THR O O 3.725 1.449 6.509 1.00 . A A . 23 THR O 1 1 4 2440 1 1 23 THR OG1 O 6.226 -1.519 7.401 1.00 . A A . 23 THR OG1 1 1 4 2441 1 1 24 TRP C C 3.908 2.011 2.474 1.00 . A A . 24 TRP C 1 1 4 2442 1 1 24 TRP CA C 3.885 2.456 3.933 1.00 . A A . 24 TRP CA 1 1 4 2443 1 1 24 TRP CB C 3.987 3.978 4.017 1.00 . A A . 24 TRP CB 1 1 4 2444 1 1 24 TRP CD1 C 4.125 5.019 6.357 1.00 . A A . 24 TRP CD1 1 1 4 2445 1 1 24 TRP CD2 C 2.047 4.710 5.605 1.00 . A A . 24 TRP CD2 1 1 4 2446 1 1 24 TRP CE2 C 1.976 5.278 6.889 1.00 . A A . 24 TRP CE2 1 1 4 2447 1 1 24 TRP CE3 C 0.866 4.430 4.927 1.00 . A A . 24 TRP CE3 1 1 4 2448 1 1 24 TRP CG C 3.426 4.547 5.285 1.00 . A A . 24 TRP CG 1 1 4 2449 1 1 24 TRP CH2 C -0.381 5.284 6.817 1.00 . A A . 24 TRP CH2 1 1 4 2450 1 1 24 TRP CZ2 C 0.763 5.568 7.509 1.00 . A A . 24 TRP CZ2 1 1 4 2451 1 1 24 TRP CZ3 C -0.337 4.721 5.538 1.00 . A A . 24 TRP CZ3 1 1 4 2452 1 1 24 TRP H H 5.855 1.758 4.258 1.00 . A A . 24 TRP H 1 1 4 2453 1 1 24 TRP HA H 2.955 2.140 4.381 1.00 . A A . 24 TRP HA 1 1 4 2454 1 1 24 TRP HB2 H 5.026 4.264 3.955 1.00 . A A . 24 TRP HB2 1 1 4 2455 1 1 24 TRP HB3 H 3.450 4.415 3.187 1.00 . A A . 24 TRP HB3 1 1 4 2456 1 1 24 TRP HD1 H 5.200 5.038 6.419 1.00 . A A . 24 TRP HD1 1 1 4 2457 1 1 24 TRP HE1 H 3.515 5.835 8.196 1.00 . A A . 24 TRP HE1 1 1 4 2458 1 1 24 TRP HE3 H 0.883 3.999 3.939 1.00 . A A . 24 TRP HE3 1 1 4 2459 1 1 24 TRP HH2 H -1.343 5.494 7.253 1.00 . A A . 24 TRP HH2 1 1 4 2460 1 1 24 TRP HZ2 H 0.713 6.004 8.496 1.00 . A A . 24 TRP HZ2 1 1 4 2461 1 1 24 TRP HZ3 H -1.263 4.518 5.022 1.00 . A A . 24 TRP HZ3 1 1 4 2462 1 1 24 TRP N N 4.974 1.838 4.679 1.00 . A A . 24 TRP N 1 1 4 2463 1 1 24 TRP NE1 N 3.258 5.456 7.331 1.00 . A A . 24 TRP NE1 1 1 4 2464 1 1 24 TRP O O 4.975 1.856 1.881 1.00 . A A . 24 TRP O 1 1 4 2465 1 1 25 GLY C C 1.738 2.279 -0.309 1.00 . A A . 25 GLY C 1 1 4 2466 1 1 25 GLY CA C 2.635 1.380 0.519 1.00 . A A . 25 GLY CA 1 1 4 2467 1 1 25 GLY H H 1.908 1.945 2.427 1.00 . A A . 25 GLY H 1 1 4 2468 1 1 25 GLY HA2 H 3.625 1.383 0.087 1.00 . A A . 25 GLY HA2 1 1 4 2469 1 1 25 GLY HA3 H 2.243 0.374 0.488 1.00 . A A . 25 GLY HA3 1 1 4 2470 1 1 25 GLY N N 2.725 1.806 1.904 1.00 . A A . 25 GLY N 1 1 4 2471 1 1 25 GLY O O 0.918 3.019 0.234 1.00 . A A . 25 GLY O 1 1 4 2472 1 1 26 CYS C C 0.011 2.164 -3.206 1.00 . A A . 26 CYS C 1 1 4 2473 1 1 26 CYS CA C 1.088 3.016 -2.539 1.00 . A A . 26 CYS CA 1 1 4 2474 1 1 26 CYS CB C 1.976 3.665 -3.604 1.00 . A A . 26 CYS CB 1 1 4 2475 1 1 26 CYS H H 2.559 1.592 -1.997 1.00 . A A . 26 CYS H 1 1 4 2476 1 1 26 CYS HA H 0.609 3.791 -1.959 1.00 . A A . 26 CYS HA 1 1 4 2477 1 1 26 CYS HB2 H 2.757 2.973 -3.881 1.00 . A A . 26 CYS HB2 1 1 4 2478 1 1 26 CYS HB3 H 1.375 3.886 -4.475 1.00 . A A . 26 CYS HB3 1 1 4 2479 1 1 26 CYS N N 1.892 2.209 -1.628 1.00 . A A . 26 CYS N 1 1 4 2480 1 1 26 CYS O O 0.295 1.095 -3.746 1.00 . A A . 26 CYS O 1 1 4 2481 1 1 26 CYS SG S 2.779 5.218 -3.076 1.00 . A A . 26 CYS SG 1 1 4 2482 1 1 27 CYS C C -2.833 2.657 -5.009 1.00 . A A . 27 CYS C 1 1 4 2483 1 1 27 CYS CA C -2.353 1.939 -3.752 1.00 . A A . 27 CYS CA 1 1 4 2484 1 1 27 CYS CB C -3.500 1.828 -2.743 1.00 . A A . 27 CYS CB 1 1 4 2485 1 1 27 CYS H H -1.385 3.501 -2.714 1.00 . A A . 27 CYS H 1 1 4 2486 1 1 27 CYS HA H -2.021 0.948 -4.021 1.00 . A A . 27 CYS HA 1 1 4 2487 1 1 27 CYS HB2 H -3.603 2.769 -2.224 1.00 . A A . 27 CYS HB2 1 1 4 2488 1 1 27 CYS HB3 H -4.416 1.614 -3.272 1.00 . A A . 27 CYS HB3 1 1 4 2489 1 1 27 CYS N N -1.226 2.646 -3.161 1.00 . A A . 27 CYS N 1 1 4 2490 1 1 27 CYS O O -2.975 3.880 -5.013 1.00 . A A . 27 CYS O 1 1 4 2491 1 1 27 CYS SG S -3.265 0.529 -1.486 1.00 . A A . 27 CYS SG 1 1 4 2492 1 1 28 PRO C C -5.028 2.839 -7.350 1.00 . A A . 28 PRO C 1 1 4 2493 1 1 28 PRO CA C -3.543 2.483 -7.365 1.00 . A A . 28 PRO CA 1 1 4 2494 1 1 28 PRO CB C -3.273 1.360 -8.366 1.00 . A A . 28 PRO CB 1 1 4 2495 1 1 28 PRO CD C -2.934 0.441 -6.179 1.00 . A A . 28 PRO CD 1 1 4 2496 1 1 28 PRO CG C -3.410 0.109 -7.570 1.00 . A A . 28 PRO CG 1 1 4 2497 1 1 28 PRO HA H -2.967 3.355 -7.636 1.00 . A A . 28 PRO HA 1 1 4 2498 1 1 28 PRO HB2 H -3.999 1.404 -9.166 1.00 . A A . 28 PRO HB2 1 1 4 2499 1 1 28 PRO HB3 H -2.277 1.464 -8.769 1.00 . A A . 28 PRO HB3 1 1 4 2500 1 1 28 PRO HD2 H -3.554 -0.050 -5.443 1.00 . A A . 28 PRO HD2 1 1 4 2501 1 1 28 PRO HD3 H -1.901 0.153 -6.057 1.00 . A A . 28 PRO HD3 1 1 4 2502 1 1 28 PRO HG2 H -4.445 -0.199 -7.547 1.00 . A A . 28 PRO HG2 1 1 4 2503 1 1 28 PRO HG3 H -2.796 -0.668 -7.999 1.00 . A A . 28 PRO HG3 1 1 4 2504 1 1 28 PRO N N -3.085 1.908 -6.098 1.00 . A A . 28 PRO N 1 1 4 2505 1 1 28 PRO O O -5.715 2.714 -8.364 1.00 . A A . 28 PRO O 1 1 4 2506 1 1 29 SER C C -7.134 4.516 -4.808 1.00 . A A . 29 SER C 1 1 4 2507 1 1 29 SER CA C -6.919 3.660 -6.055 1.00 . A A . 29 SER CA 1 1 4 2508 1 1 29 SER CB C -7.797 2.411 -5.985 1.00 . A A . 29 SER CB 1 1 4 2509 1 1 29 SER H H -4.921 3.365 -5.422 1.00 . A A . 29 SER H 1 1 4 2510 1 1 29 SER HA H -7.197 4.235 -6.925 1.00 . A A . 29 SER HA 1 1 4 2511 1 1 29 SER HB2 H -7.176 1.546 -5.803 1.00 . A A . 29 SER HB2 1 1 4 2512 1 1 29 SER HB3 H -8.506 2.520 -5.178 1.00 . A A . 29 SER HB3 1 1 4 2513 1 1 29 SER HG H -9.411 2.523 -7.090 1.00 . A A . 29 SER HG 1 1 4 2514 1 1 29 SER N N -5.516 3.286 -6.196 1.00 . A A . 29 SER N 1 1 4 2515 1 1 29 SER O O -6.578 4.229 -3.748 1.00 . A A . 29 SER O 1 1 4 2516 1 1 29 SER OG O -8.507 2.217 -7.195 1.00 . A A . 29 SER OG 1 1 4 2517 1 1 30 PRO C C -8.838 5.742 -2.599 1.00 . A A . 30 PRO C 1 1 4 2518 1 1 30 PRO CA C -8.233 6.480 -3.789 1.00 . A A . 30 PRO CA 1 1 4 2519 1 1 30 PRO CB C -9.244 7.478 -4.363 1.00 . A A . 30 PRO CB 1 1 4 2520 1 1 30 PRO CD C -8.655 6.000 -6.141 1.00 . A A . 30 PRO CD 1 1 4 2521 1 1 30 PRO CG C -9.055 7.415 -5.839 1.00 . A A . 30 PRO CG 1 1 4 2522 1 1 30 PRO HA H -7.345 7.007 -3.470 1.00 . A A . 30 PRO HA 1 1 4 2523 1 1 30 PRO HB2 H -10.244 7.182 -4.081 1.00 . A A . 30 PRO HB2 1 1 4 2524 1 1 30 PRO HB3 H -9.036 8.466 -3.981 1.00 . A A . 30 PRO HB3 1 1 4 2525 1 1 30 PRO HD2 H -9.528 5.389 -6.312 1.00 . A A . 30 PRO HD2 1 1 4 2526 1 1 30 PRO HD3 H -7.996 5.968 -6.997 1.00 . A A . 30 PRO HD3 1 1 4 2527 1 1 30 PRO HG2 H -9.981 7.658 -6.339 1.00 . A A . 30 PRO HG2 1 1 4 2528 1 1 30 PRO HG3 H -8.275 8.098 -6.139 1.00 . A A . 30 PRO HG3 1 1 4 2529 1 1 30 PRO N N -7.949 5.583 -4.917 1.00 . A A . 30 PRO N 1 1 4 2530 1 1 30 PRO O O -8.200 5.596 -1.555 1.00 . A A . 30 PRO O 1 1 4 2531 1 1 31 LYS C C -10.453 3.072 -1.744 1.00 . A A . 31 LYS C 1 1 4 2532 1 1 31 LYS CA C -10.774 4.564 -1.702 1.00 . A A . 31 LYS CA 1 1 4 2533 1 1 31 LYS CB C -12.284 4.780 -1.824 1.00 . A A . 31 LYS CB 1 1 4 2534 1 1 31 LYS CD C -13.801 6.589 -0.963 1.00 . A A . 31 LYS CD 1 1 4 2535 1 1 31 LYS CE C -13.288 7.391 0.221 1.00 . A A . 31 LYS CE 1 1 4 2536 1 1 31 LYS CG C -12.681 6.244 -1.931 1.00 . A A . 31 LYS CG 1 1 4 2537 1 1 31 LYS H H -10.531 5.436 -3.616 1.00 . A A . 31 LYS H 1 1 4 2538 1 1 31 LYS HA H -10.440 4.964 -0.756 1.00 . A A . 31 LYS HA 1 1 4 2539 1 1 31 LYS HB2 H -12.639 4.267 -2.706 1.00 . A A . 31 LYS HB2 1 1 4 2540 1 1 31 LYS HB3 H -12.768 4.361 -0.955 1.00 . A A . 31 LYS HB3 1 1 4 2541 1 1 31 LYS HD2 H -14.546 7.172 -1.482 1.00 . A A . 31 LYS HD2 1 1 4 2542 1 1 31 LYS HD3 H -14.244 5.673 -0.601 1.00 . A A . 31 LYS HD3 1 1 4 2543 1 1 31 LYS HE2 H -12.370 6.941 0.573 1.00 . A A . 31 LYS HE2 1 1 4 2544 1 1 31 LYS HE3 H -13.090 8.401 -0.103 1.00 . A A . 31 LYS HE3 1 1 4 2545 1 1 31 LYS HG2 H -11.822 6.857 -1.706 1.00 . A A . 31 LYS HG2 1 1 4 2546 1 1 31 LYS HG3 H -13.014 6.444 -2.939 1.00 . A A . 31 LYS HG3 1 1 4 2547 1 1 31 LYS HZ1 H -15.165 7.846 1.015 1.00 . A A . 31 LYS HZ1 1 1 4 2548 1 1 31 LYS HZ2 H -13.898 7.989 2.128 1.00 . A A . 31 LYS HZ2 1 1 4 2549 1 1 31 LYS HZ3 H -14.459 6.458 1.679 1.00 . A A . 31 LYS HZ3 1 1 4 2550 1 1 31 LYS N N -10.075 5.283 -2.762 1.00 . A A . 31 LYS N 1 1 4 2551 1 1 31 LYS NZ N -14.271 7.423 1.338 1.00 . A A . 31 LYS NZ 1 1 4 2552 1 1 31 LYS O O -11.312 2.234 -1.468 1.00 . A A . 31 LYS O 1 1 4 2553 1 1 32 ALA C C -8.788 0.711 -0.773 1.00 . A A . 32 ALA C 1 1 4 2554 1 1 32 ALA CA C -8.769 1.359 -2.154 1.00 . A A . 32 ALA CA 1 1 4 2555 1 1 32 ALA CB C -7.371 1.283 -2.749 1.00 . A A . 32 ALA CB 1 1 4 2556 1 1 32 ALA H H -8.569 3.462 -2.286 1.00 . A A . 32 ALA H 1 1 4 2557 1 1 32 ALA HA H -9.443 0.821 -2.809 1.00 . A A . 32 ALA HA 1 1 4 2558 1 1 32 ALA HB1 H -7.429 0.899 -3.757 1.00 . A A . 32 ALA HB1 1 1 4 2559 1 1 32 ALA HB2 H -6.760 0.625 -2.148 1.00 . A A . 32 ALA HB2 1 1 4 2560 1 1 32 ALA HB3 H -6.932 2.269 -2.763 1.00 . A A . 32 ALA HB3 1 1 4 2561 1 1 32 ALA N N -9.209 2.749 -2.083 1.00 . A A . 32 ALA N 1 1 4 2562 1 1 32 ALA O O -8.784 1.402 0.246 1.00 . A A . 32 ALA O 1 1 4 2563 1 1 33 VAL C C -7.450 -2.063 0.690 1.00 . A A . 33 VAL C 1 1 4 2564 1 1 33 VAL CA C -8.789 -1.360 0.506 1.00 . A A . 33 VAL CA 1 1 4 2565 1 1 33 VAL CB C -9.917 -2.409 0.546 1.00 . A A . 33 VAL CB 1 1 4 2566 1 1 33 VAL CG1 C -10.113 -2.934 1.961 1.00 . A A . 33 VAL CG1 1 1 4 2567 1 1 33 VAL CG2 C -11.214 -1.824 0.003 1.00 . A A . 33 VAL CG2 1 1 4 2568 1 1 33 VAL H H -8.776 -1.113 -1.588 1.00 . A A . 33 VAL H 1 1 4 2569 1 1 33 VAL HA H -8.937 -0.661 1.316 1.00 . A A . 33 VAL HA 1 1 4 2570 1 1 33 VAL HB H -9.632 -3.239 -0.084 1.00 . A A . 33 VAL HB 1 1 4 2571 1 1 33 VAL HG11 H -10.846 -3.727 1.952 1.00 . A A . 33 VAL HG11 1 1 4 2572 1 1 33 VAL HG12 H -10.458 -2.133 2.598 1.00 . A A . 33 VAL HG12 1 1 4 2573 1 1 33 VAL HG13 H -9.175 -3.316 2.336 1.00 . A A . 33 VAL HG13 1 1 4 2574 1 1 33 VAL HG21 H -11.802 -2.609 -0.448 1.00 . A A . 33 VAL HG21 1 1 4 2575 1 1 33 VAL HG22 H -10.987 -1.073 -0.738 1.00 . A A . 33 VAL HG22 1 1 4 2576 1 1 33 VAL HG23 H -11.772 -1.376 0.811 1.00 . A A . 33 VAL HG23 1 1 4 2577 1 1 33 VAL N N -8.790 -0.617 -0.747 1.00 . A A . 33 VAL N 1 1 4 2578 1 1 33 VAL O O -7.197 -3.103 0.083 1.00 . A A . 33 VAL O 1 1 4 2579 1 1 34 CYS C C -5.372 -3.377 2.521 1.00 . A A . 34 CYS C 1 1 4 2580 1 1 34 CYS CA C -5.274 -2.057 1.767 1.00 . A A . 34 CYS CA 1 1 4 2581 1 1 34 CYS CB C -4.406 -1.066 2.546 1.00 . A A . 34 CYS CB 1 1 4 2582 1 1 34 CYS H H -6.845 -0.657 1.976 1.00 . A A . 34 CYS H 1 1 4 2583 1 1 34 CYS HA H -4.813 -2.239 0.810 1.00 . A A . 34 CYS HA 1 1 4 2584 1 1 34 CYS HB2 H -4.203 -0.215 1.918 1.00 . A A . 34 CYS HB2 1 1 4 2585 1 1 34 CYS HB3 H -4.941 -0.738 3.427 1.00 . A A . 34 CYS HB3 1 1 4 2586 1 1 34 CYS N N -6.591 -1.486 1.520 1.00 . A A . 34 CYS N 1 1 4 2587 1 1 34 CYS O O -5.516 -3.395 3.743 1.00 . A A . 34 CYS O 1 1 4 2588 1 1 34 CYS SG S -2.802 -1.737 3.088 1.00 . A A . 34 CYS SG 1 1 4 2589 1 1 35 CYS C C -4.340 -5.891 3.534 1.00 . A A . 35 CYS C 1 1 4 2590 1 1 35 CYS CA C -5.333 -5.810 2.383 1.00 . A A . 35 CYS CA 1 1 4 2591 1 1 35 CYS CB C -5.031 -6.888 1.341 1.00 . A A . 35 CYS CB 1 1 4 2592 1 1 35 CYS H H -5.148 -4.398 0.812 1.00 . A A . 35 CYS H 1 1 4 2593 1 1 35 CYS HA H -6.331 -5.957 2.770 1.00 . A A . 35 CYS HA 1 1 4 2594 1 1 35 CYS HB2 H -4.945 -6.425 0.369 1.00 . A A . 35 CYS HB2 1 1 4 2595 1 1 35 CYS HB3 H -4.095 -7.367 1.590 1.00 . A A . 35 CYS HB3 1 1 4 2596 1 1 35 CYS N N -5.276 -4.482 1.781 1.00 . A A . 35 CYS N 1 1 4 2597 1 1 35 CYS O O -3.123 -5.926 3.319 1.00 . A A . 35 CYS O 1 1 4 2598 1 1 35 CYS SG S -6.306 -8.186 1.224 1.00 . A A . 35 CYS SG 1 1 4 2599 1 1 36 ASP C C -3.818 -7.368 6.444 1.00 . A A . 36 ASP C 1 1 4 2600 1 1 36 ASP CA C -4.049 -5.941 5.955 1.00 . A A . 36 ASP CA 1 1 4 2601 1 1 36 ASP CB C -4.697 -5.111 7.066 1.00 . A A . 36 ASP CB 1 1 4 2602 1 1 36 ASP CG C -5.785 -5.874 7.797 1.00 . A A . 36 ASP CG 1 1 4 2603 1 1 36 ASP H H -5.847 -5.853 4.844 1.00 . A A . 36 ASP H 1 1 4 2604 1 1 36 ASP HA H -3.093 -5.501 5.712 1.00 . A A . 36 ASP HA 1 1 4 2605 1 1 36 ASP HB2 H -3.941 -4.826 7.781 1.00 . A A . 36 ASP HB2 1 1 4 2606 1 1 36 ASP HB3 H -5.133 -4.222 6.634 1.00 . A A . 36 ASP HB3 1 1 4 2607 1 1 36 ASP N N -4.872 -5.896 4.754 1.00 . A A . 36 ASP N 1 1 4 2608 1 1 36 ASP O O -2.892 -7.612 7.218 1.00 . A A . 36 ASP O 1 1 4 2609 1 1 36 ASP OD1 O -5.583 -6.205 8.983 1.00 . A A . 36 ASP OD1 1 1 4 2610 1 1 36 ASP OD2 O -6.839 -6.140 7.182 1.00 . A A . 36 ASP OD2 1 1 4 2611 1 1 37 ASP C C -3.055 -10.149 6.203 1.00 . A A . 37 ASP C 1 1 4 2612 1 1 37 ASP CA C -4.496 -9.704 6.403 1.00 . A A . 37 ASP CA 1 1 4 2613 1 1 37 ASP CB C -5.443 -10.603 5.603 1.00 . A A . 37 ASP CB 1 1 4 2614 1 1 37 ASP CG C -5.107 -10.631 4.124 1.00 . A A . 37 ASP CG 1 1 4 2615 1 1 37 ASP H H -5.370 -8.076 5.374 1.00 . A A . 37 ASP H 1 1 4 2616 1 1 37 ASP HA H -4.743 -9.772 7.452 1.00 . A A . 37 ASP HA 1 1 4 2617 1 1 37 ASP HB2 H -5.379 -11.611 5.986 1.00 . A A . 37 ASP HB2 1 1 4 2618 1 1 37 ASP HB3 H -6.454 -10.242 5.717 1.00 . A A . 37 ASP HB3 1 1 4 2619 1 1 37 ASP N N -4.648 -8.310 5.994 1.00 . A A . 37 ASP N 1 1 4 2620 1 1 37 ASP O O -2.481 -10.846 7.041 1.00 . A A . 37 ASP O 1 1 4 2621 1 1 37 ASP OD1 O -5.081 -11.736 3.542 1.00 . A A . 37 ASP OD1 1 1 4 2622 1 1 37 ASP OD2 O -4.872 -9.549 3.548 1.00 . A A . 37 ASP OD2 1 1 4 2623 1 1 38 MET C C -0.345 -8.780 4.362 1.00 . A A . 38 MET C 1 1 4 2624 1 1 38 MET CA C -1.098 -10.047 4.758 1.00 . A A . 38 MET CA 1 1 4 2625 1 1 38 MET CB C -1.049 -11.078 3.628 1.00 . A A . 38 MET CB 1 1 4 2626 1 1 38 MET CE C -0.906 -15.086 4.066 1.00 . A A . 38 MET CE 1 1 4 2627 1 1 38 MET CG C -1.660 -12.418 4.003 1.00 . A A . 38 MET CG 1 1 4 2628 1 1 38 MET H H -2.992 -9.164 4.470 1.00 . A A . 38 MET H 1 1 4 2629 1 1 38 MET HA H -0.636 -10.467 5.639 1.00 . A A . 38 MET HA 1 1 4 2630 1 1 38 MET HB2 H -1.586 -10.687 2.777 1.00 . A A . 38 MET HB2 1 1 4 2631 1 1 38 MET HB3 H -0.018 -11.242 3.349 1.00 . A A . 38 MET HB3 1 1 4 2632 1 1 38 MET HE1 H -1.586 -15.622 4.710 1.00 . A A . 38 MET HE1 1 1 4 2633 1 1 38 MET HE2 H -0.007 -15.669 3.923 1.00 . A A . 38 MET HE2 1 1 4 2634 1 1 38 MET HE3 H -1.378 -14.912 3.109 1.00 . A A . 38 MET HE3 1 1 4 2635 1 1 38 MET HG2 H -2.489 -12.244 4.673 1.00 . A A . 38 MET HG2 1 1 4 2636 1 1 38 MET HG3 H -2.019 -12.899 3.105 1.00 . A A . 38 MET HG3 1 1 4 2637 1 1 38 MET N N -2.476 -9.723 5.087 1.00 . A A . 38 MET N 1 1 4 2638 1 1 38 MET O O 0.079 -8.007 5.223 1.00 . A A . 38 MET O 1 1 4 2639 1 1 38 MET SD S -0.483 -13.515 4.817 1.00 . A A . 38 MET SD 1 1 4 2640 1 1 39 GLN C C -0.073 -7.043 1.140 1.00 . A A . 39 GLN C 1 1 4 2641 1 1 39 GLN CA C 0.440 -7.347 2.546 1.00 . A A . 39 GLN CA 1 1 4 2642 1 1 39 GLN CB C 1.964 -7.520 2.525 1.00 . A A . 39 GLN CB 1 1 4 2643 1 1 39 GLN CD C 3.932 -9.096 2.719 1.00 . A A . 39 GLN CD 1 1 4 2644 1 1 39 GLN CG C 2.433 -8.925 2.872 1.00 . A A . 39 GLN CG 1 1 4 2645 1 1 39 GLN H H -0.622 -9.162 2.412 1.00 . A A . 39 GLN H 1 1 4 2646 1 1 39 GLN HA H 0.183 -6.525 3.197 1.00 . A A . 39 GLN HA 1 1 4 2647 1 1 39 GLN HB2 H 2.326 -7.278 1.537 1.00 . A A . 39 GLN HB2 1 1 4 2648 1 1 39 GLN HB3 H 2.400 -6.834 3.235 1.00 . A A . 39 GLN HB3 1 1 4 2649 1 1 39 GLN HE21 H 3.680 -9.908 0.921 1.00 . A A . 39 GLN HE21 1 1 4 2650 1 1 39 GLN HE22 H 5.315 -9.770 1.460 1.00 . A A . 39 GLN HE22 1 1 4 2651 1 1 39 GLN HG2 H 2.167 -9.138 3.897 1.00 . A A . 39 GLN HG2 1 1 4 2652 1 1 39 GLN HG3 H 1.937 -9.628 2.219 1.00 . A A . 39 GLN HG3 1 1 4 2653 1 1 39 GLN N N -0.217 -8.547 3.058 1.00 . A A . 39 GLN N 1 1 4 2654 1 1 39 GLN NE2 N 4.351 -9.646 1.585 1.00 . A A . 39 GLN NE2 1 1 4 2655 1 1 39 GLN O O 0.555 -7.441 0.159 1.00 . A A . 39 GLN O 1 1 4 2656 1 1 39 GLN OE1 O 4.704 -8.737 3.608 1.00 . A A . 39 GLN OE1 1 1 4 2657 1 1 40 HIS C C -2.754 -4.931 -0.311 1.00 . A A . 40 HIS C 1 1 4 2658 1 1 40 HIS CA C -1.766 -6.090 -0.301 1.00 . A A . 40 HIS CA 1 1 4 2659 1 1 40 HIS CB C -2.438 -7.345 -0.862 1.00 . A A . 40 HIS CB 1 1 4 2660 1 1 40 HIS CD2 C -0.934 -9.018 -2.154 1.00 . A A . 40 HIS CD2 1 1 4 2661 1 1 40 HIS CE1 C -1.063 -8.097 -4.139 1.00 . A A . 40 HIS CE1 1 1 4 2662 1 1 40 HIS CG C -1.726 -7.926 -2.045 1.00 . A A . 40 HIS CG 1 1 4 2663 1 1 40 HIS H H -1.711 -6.096 1.837 1.00 . A A . 40 HIS H 1 1 4 2664 1 1 40 HIS HA H -0.936 -5.836 -0.942 1.00 . A A . 40 HIS HA 1 1 4 2665 1 1 40 HIS HB2 H -2.473 -8.102 -0.093 1.00 . A A . 40 HIS HB2 1 1 4 2666 1 1 40 HIS HB3 H -3.445 -7.099 -1.167 1.00 . A A . 40 HIS HB3 1 1 4 2667 1 1 40 HIS HD1 H -2.285 -6.564 -3.555 1.00 . A A . 40 HIS HD1 1 1 4 2668 1 1 40 HIS HD2 H -0.667 -9.697 -1.356 1.00 . A A . 40 HIS HD2 1 1 4 2669 1 1 40 HIS HE1 H -0.925 -7.902 -5.192 1.00 . A A . 40 HIS HE1 1 1 4 2670 1 1 40 HIS HE2 H 0.155 -9.709 -3.809 1.00 . A A . 40 HIS HE2 1 1 4 2671 1 1 40 HIS N N -1.221 -6.372 1.026 1.00 . A A . 40 HIS N 1 1 4 2672 1 1 40 HIS ND1 N -1.786 -7.371 -3.306 1.00 . A A . 40 HIS ND1 1 1 4 2673 1 1 40 HIS NE2 N -0.534 -9.102 -3.465 1.00 . A A . 40 HIS NE2 1 1 4 2674 1 1 40 HIS O O -2.946 -4.241 0.688 1.00 . A A . 40 HIS O 1 1 4 2675 1 1 41 CYS C C -5.412 -4.104 -2.678 1.00 . A A . 41 CYS C 1 1 4 2676 1 1 41 CYS CA C -4.346 -3.672 -1.675 1.00 . A A . 41 CYS CA 1 1 4 2677 1 1 41 CYS CB C -3.650 -2.401 -2.165 1.00 . A A . 41 CYS CB 1 1 4 2678 1 1 41 CYS H H -3.157 -5.333 -2.222 1.00 . A A . 41 CYS H 1 1 4 2679 1 1 41 CYS HA H -4.818 -3.473 -0.726 1.00 . A A . 41 CYS HA 1 1 4 2680 1 1 41 CYS HB2 H -2.734 -2.265 -1.609 1.00 . A A . 41 CYS HB2 1 1 4 2681 1 1 41 CYS HB3 H -3.414 -2.512 -3.213 1.00 . A A . 41 CYS HB3 1 1 4 2682 1 1 41 CYS N N -3.370 -4.735 -1.475 1.00 . A A . 41 CYS N 1 1 4 2683 1 1 41 CYS O O -5.151 -4.919 -3.562 1.00 . A A . 41 CYS O 1 1 4 2684 1 1 41 CYS SG S -4.640 -0.884 -1.976 1.00 . A A . 41 CYS SG 1 1 4 2685 1 1 42 CYS C C -8.310 -2.602 -4.032 1.00 . A A . 42 CYS C 1 1 4 2686 1 1 42 CYS CA C -7.720 -3.877 -3.427 1.00 . A A . 42 CYS CA 1 1 4 2687 1 1 42 CYS CB C -8.806 -4.646 -2.668 1.00 . A A . 42 CYS CB 1 1 4 2688 1 1 42 CYS H H -6.757 -2.909 -1.810 1.00 . A A . 42 CYS H 1 1 4 2689 1 1 42 CYS HA H -7.337 -4.498 -4.222 1.00 . A A . 42 CYS HA 1 1 4 2690 1 1 42 CYS HB2 H -8.734 -4.407 -1.617 1.00 . A A . 42 CYS HB2 1 1 4 2691 1 1 42 CYS HB3 H -9.775 -4.337 -3.034 1.00 . A A . 42 CYS HB3 1 1 4 2692 1 1 42 CYS N N -6.613 -3.552 -2.534 1.00 . A A . 42 CYS N 1 1 4 2693 1 1 42 CYS O O -8.509 -1.613 -3.332 1.00 . A A . 42 CYS O 1 1 4 2694 1 1 42 CYS SG S -8.703 -6.460 -2.828 1.00 . A A . 42 CYS SG 1 1 4 2695 1 1 43 PRO C C -10.452 -0.942 -5.411 1.00 . A A . 43 PRO C 1 1 4 2696 1 1 43 PRO CA C -9.147 -1.430 -6.034 1.00 . A A . 43 PRO CA 1 1 4 2697 1 1 43 PRO CB C -9.391 -1.933 -7.457 1.00 . A A . 43 PRO CB 1 1 4 2698 1 1 43 PRO CD C -8.372 -3.727 -6.274 1.00 . A A . 43 PRO CD 1 1 4 2699 1 1 43 PRO CG C -8.436 -3.061 -7.618 1.00 . A A . 43 PRO CG 1 1 4 2700 1 1 43 PRO HA H -8.439 -0.616 -6.057 1.00 . A A . 43 PRO HA 1 1 4 2701 1 1 43 PRO HB2 H -10.414 -2.262 -7.558 1.00 . A A . 43 PRO HB2 1 1 4 2702 1 1 43 PRO HB3 H -9.188 -1.141 -8.163 1.00 . A A . 43 PRO HB3 1 1 4 2703 1 1 43 PRO HD2 H -9.156 -4.465 -6.179 1.00 . A A . 43 PRO HD2 1 1 4 2704 1 1 43 PRO HD3 H -7.404 -4.176 -6.117 1.00 . A A . 43 PRO HD3 1 1 4 2705 1 1 43 PRO HG2 H -8.797 -3.750 -8.367 1.00 . A A . 43 PRO HG2 1 1 4 2706 1 1 43 PRO HG3 H -7.464 -2.678 -7.889 1.00 . A A . 43 PRO HG3 1 1 4 2707 1 1 43 PRO N N -8.589 -2.602 -5.346 1.00 . A A . 43 PRO N 1 1 4 2708 1 1 43 PRO O O -11.358 -1.733 -5.135 1.00 . A A . 43 PRO O 1 1 4 2709 1 1 44 ALA C C -12.990 0.417 -5.182 1.00 . A A . 44 ALA C 1 1 4 2710 1 1 44 ALA CA C -11.707 0.992 -4.598 1.00 . A A . 44 ALA CA 1 1 4 2711 1 1 44 ALA CB C -11.667 2.500 -4.802 1.00 . A A . 44 ALA CB 1 1 4 2712 1 1 44 ALA H H -9.761 0.930 -5.428 1.00 . A A . 44 ALA H 1 1 4 2713 1 1 44 ALA HA H -11.689 0.797 -3.536 1.00 . A A . 44 ALA HA 1 1 4 2714 1 1 44 ALA HB1 H -11.962 2.733 -5.814 1.00 . A A . 44 ALA HB1 1 1 4 2715 1 1 44 ALA HB2 H -10.665 2.861 -4.626 1.00 . A A . 44 ALA HB2 1 1 4 2716 1 1 44 ALA HB3 H -12.349 2.974 -4.110 1.00 . A A . 44 ALA HB3 1 1 4 2717 1 1 44 ALA N N -10.528 0.369 -5.190 1.00 . A A . 44 ALA N 1 1 4 2718 1 1 44 ALA O O -13.242 0.523 -6.382 1.00 . A A . 44 ALA O 1 1 4 2719 1 1 45 GLY C C -15.052 -2.286 -4.684 1.00 . A A . 45 GLY C 1 1 4 2720 1 1 45 GLY CA C -15.049 -0.772 -4.765 1.00 . A A . 45 GLY CA 1 1 4 2721 1 1 45 GLY H H -13.542 -0.236 -3.376 1.00 . A A . 45 GLY H 1 1 4 2722 1 1 45 GLY HA2 H -15.849 -0.390 -4.150 1.00 . A A . 45 GLY HA2 1 1 4 2723 1 1 45 GLY HA3 H -15.225 -0.478 -5.790 1.00 . A A . 45 GLY HA3 1 1 4 2724 1 1 45 GLY N N -13.799 -0.190 -4.322 1.00 . A A . 45 GLY N 1 1 4 2725 1 1 45 GLY O O -16.088 -2.918 -4.890 1.00 . A A . 45 GLY O 1 1 4 2726 1 1 46 TYR C C -13.470 -4.746 -2.844 1.00 . A A . 46 TYR C 1 1 4 2727 1 1 46 TYR CA C -13.787 -4.325 -4.274 1.00 . A A . 46 TYR CA 1 1 4 2728 1 1 46 TYR CB C -12.712 -4.859 -5.224 1.00 . A A . 46 TYR CB 1 1 4 2729 1 1 46 TYR CD1 C -14.258 -5.045 -7.214 1.00 . A A . 46 TYR CD1 1 1 4 2730 1 1 46 TYR CD2 C -12.113 -4.058 -7.541 1.00 . A A . 46 TYR CD2 1 1 4 2731 1 1 46 TYR CE1 C -14.554 -4.855 -8.551 1.00 . A A . 46 TYR CE1 1 1 4 2732 1 1 46 TYR CE2 C -12.402 -3.864 -8.879 1.00 . A A . 46 TYR CE2 1 1 4 2733 1 1 46 TYR CG C -13.034 -4.649 -6.687 1.00 . A A . 46 TYR CG 1 1 4 2734 1 1 46 TYR CZ C -13.622 -4.264 -9.379 1.00 . A A . 46 TYR CZ 1 1 4 2735 1 1 46 TYR H H -13.098 -2.325 -4.223 1.00 . A A . 46 TYR H 1 1 4 2736 1 1 46 TYR HA H -14.741 -4.748 -4.555 1.00 . A A . 46 TYR HA 1 1 4 2737 1 1 46 TYR HB2 H -11.777 -4.360 -5.015 1.00 . A A . 46 TYR HB2 1 1 4 2738 1 1 46 TYR HB3 H -12.593 -5.919 -5.059 1.00 . A A . 46 TYR HB3 1 1 4 2739 1 1 46 TYR HD1 H -14.985 -5.507 -6.563 1.00 . A A . 46 TYR HD1 1 1 4 2740 1 1 46 TYR HD2 H -11.157 -3.746 -7.147 1.00 . A A . 46 TYR HD2 1 1 4 2741 1 1 46 TYR HE1 H -15.510 -5.169 -8.943 1.00 . A A . 46 TYR HE1 1 1 4 2742 1 1 46 TYR HE2 H -11.671 -3.401 -9.527 1.00 . A A . 46 TYR HE2 1 1 4 2743 1 1 46 TYR HH H -14.858 -4.157 -10.848 1.00 . A A . 46 TYR HH 1 1 4 2744 1 1 46 TYR N N -13.895 -2.874 -4.382 1.00 . A A . 46 TYR N 1 1 4 2745 1 1 46 TYR O O -13.179 -3.908 -1.988 1.00 . A A . 46 TYR O 1 1 4 2746 1 1 46 TYR OH O -13.911 -4.073 -10.710 1.00 . A A . 46 TYR OH 1 1 4 2747 1 1 47 LYS C C -12.095 -7.574 -1.300 1.00 . A A . 47 LYS C 1 1 4 2748 1 1 47 LYS CA C -13.258 -6.587 -1.265 1.00 . A A . 47 LYS CA 1 1 4 2749 1 1 47 LYS CB C -14.506 -7.276 -0.711 1.00 . A A . 47 LYS CB 1 1 4 2750 1 1 47 LYS CD C -14.489 -8.446 1.512 1.00 . A A . 47 LYS CD 1 1 4 2751 1 1 47 LYS CE C -15.754 -9.286 1.466 1.00 . A A . 47 LYS CE 1 1 4 2752 1 1 47 LYS CG C -14.672 -7.119 0.790 1.00 . A A . 47 LYS CG 1 1 4 2753 1 1 47 LYS H H -13.775 -6.661 -3.315 1.00 . A A . 47 LYS H 1 1 4 2754 1 1 47 LYS HA H -12.998 -5.763 -0.619 1.00 . A A . 47 LYS HA 1 1 4 2755 1 1 47 LYS HB2 H -15.378 -6.859 -1.193 1.00 . A A . 47 LYS HB2 1 1 4 2756 1 1 47 LYS HB3 H -14.452 -8.331 -0.937 1.00 . A A . 47 LYS HB3 1 1 4 2757 1 1 47 LYS HD2 H -13.688 -8.993 1.038 1.00 . A A . 47 LYS HD2 1 1 4 2758 1 1 47 LYS HD3 H -14.234 -8.250 2.543 1.00 . A A . 47 LYS HD3 1 1 4 2759 1 1 47 LYS HE2 H -16.402 -8.985 2.276 1.00 . A A . 47 LYS HE2 1 1 4 2760 1 1 47 LYS HE3 H -16.253 -9.112 0.524 1.00 . A A . 47 LYS HE3 1 1 4 2761 1 1 47 LYS HG2 H -13.934 -6.419 1.153 1.00 . A A . 47 LYS HG2 1 1 4 2762 1 1 47 LYS HG3 H -15.663 -6.741 0.997 1.00 . A A . 47 LYS HG3 1 1 4 2763 1 1 47 LYS HZ1 H -15.366 -11.172 0.657 1.00 . A A . 47 LYS HZ1 1 1 4 2764 1 1 47 LYS HZ2 H -16.227 -11.216 2.112 1.00 . A A . 47 LYS HZ2 1 1 4 2765 1 1 47 LYS HZ3 H -14.571 -10.879 2.121 1.00 . A A . 47 LYS HZ3 1 1 4 2766 1 1 47 LYS N N -13.532 -6.048 -2.592 1.00 . A A . 47 LYS N 1 1 4 2767 1 1 47 LYS NZ N -15.459 -10.740 1.598 1.00 . A A . 47 LYS NZ 1 1 4 2768 1 1 47 LYS O O -11.811 -8.180 -2.332 1.00 . A A . 47 LYS O 1 1 4 2769 1 1 48 CYS C C -10.773 -10.062 0.237 1.00 . A A . 48 CYS C 1 1 4 2770 1 1 48 CYS CA C -10.293 -8.643 -0.053 1.00 . A A . 48 CYS CA 1 1 4 2771 1 1 48 CYS CB C -9.336 -8.180 1.048 1.00 . A A . 48 CYS CB 1 1 4 2772 1 1 48 CYS H H -11.703 -7.214 0.625 1.00 . A A . 48 CYS H 1 1 4 2773 1 1 48 CYS HA H -9.772 -8.638 -0.998 1.00 . A A . 48 CYS HA 1 1 4 2774 1 1 48 CYS HB2 H -9.876 -7.558 1.746 1.00 . A A . 48 CYS HB2 1 1 4 2775 1 1 48 CYS HB3 H -8.952 -9.045 1.568 1.00 . A A . 48 CYS HB3 1 1 4 2776 1 1 48 CYS N N -11.426 -7.728 -0.160 1.00 . A A . 48 CYS N 1 1 4 2777 1 1 48 CYS O O -11.823 -10.258 0.850 1.00 . A A . 48 CYS O 1 1 4 2778 1 1 48 CYS SG S -7.911 -7.221 0.440 1.00 . A A . 48 CYS SG 1 1 4 2779 1 1 49 GLY C C -9.173 -13.362 0.047 1.00 . A A . 49 GLY C 1 1 4 2780 1 1 49 GLY CA C -10.373 -12.433 0.013 1.00 . A A . 49 GLY CA 1 1 4 2781 1 1 49 GLY H H -9.178 -10.833 -0.693 1.00 . A A . 49 GLY H 1 1 4 2782 1 1 49 GLY HA2 H -10.898 -12.508 0.952 1.00 . A A . 49 GLY HA2 1 1 4 2783 1 1 49 GLY HA3 H -11.033 -12.747 -0.783 1.00 . A A . 49 GLY HA3 1 1 4 2784 1 1 49 GLY N N -10.001 -11.048 -0.209 1.00 . A A . 49 GLY N 1 1 4 2785 1 1 49 GLY O O -8.056 -12.948 -0.265 1.00 . A A . 49 GLY O 1 1 4 2786 1 1 50 PRO C C -7.628 -15.852 -0.855 1.00 . A A . 50 PRO C 1 1 4 2787 1 1 50 PRO CA C -8.294 -15.626 0.497 1.00 . A A . 50 PRO CA 1 1 4 2788 1 1 50 PRO CB C -8.999 -16.908 0.960 1.00 . A A . 50 PRO CB 1 1 4 2789 1 1 50 PRO CD C -10.674 -15.214 0.815 1.00 . A A . 50 PRO CD 1 1 4 2790 1 1 50 PRO CG C -10.284 -16.453 1.563 1.00 . A A . 50 PRO CG 1 1 4 2791 1 1 50 PRO HA H -7.547 -15.342 1.223 1.00 . A A . 50 PRO HA 1 1 4 2792 1 1 50 PRO HB2 H -9.169 -17.553 0.110 1.00 . A A . 50 PRO HB2 1 1 4 2793 1 1 50 PRO HB3 H -8.382 -17.418 1.686 1.00 . A A . 50 PRO HB3 1 1 4 2794 1 1 50 PRO HD2 H -11.262 -15.466 -0.055 1.00 . A A . 50 PRO HD2 1 1 4 2795 1 1 50 PRO HD3 H -11.219 -14.539 1.459 1.00 . A A . 50 PRO HD3 1 1 4 2796 1 1 50 PRO HG2 H -11.037 -17.218 1.442 1.00 . A A . 50 PRO HG2 1 1 4 2797 1 1 50 PRO HG3 H -10.140 -16.231 2.610 1.00 . A A . 50 PRO HG3 1 1 4 2798 1 1 50 PRO N N -9.377 -14.637 0.427 1.00 . A A . 50 PRO N 1 1 4 2799 1 1 50 PRO O O -8.289 -15.831 -1.893 1.00 . A A . 50 PRO O 1 1 4 2800 1 1 51 GLY C C -4.983 -15.033 -2.637 1.00 . A A . 51 GLY C 1 1 4 2801 1 1 51 GLY CA C -5.584 -16.302 -2.066 1.00 . A A . 51 GLY CA 1 1 4 2802 1 1 51 GLY H H -5.845 -16.078 0.024 1.00 . A A . 51 GLY H 1 1 4 2803 1 1 51 GLY HA2 H -4.789 -17.006 -1.869 1.00 . A A . 51 GLY HA2 1 1 4 2804 1 1 51 GLY HA3 H -6.256 -16.730 -2.796 1.00 . A A . 51 GLY HA3 1 1 4 2805 1 1 51 GLY N N -6.317 -16.071 -0.835 1.00 . A A . 51 GLY N 1 1 4 2806 1 1 51 GLY O O -4.587 -14.998 -3.802 1.00 . A A . 51 GLY O 1 1 4 2807 1 1 52 GLY C C -4.980 -12.203 -3.523 1.00 . A A . 52 GLY C 1 1 4 2808 1 1 52 GLY CA C -4.341 -12.728 -2.251 1.00 . A A . 52 GLY CA 1 1 4 2809 1 1 52 GLY H H -5.232 -14.082 -0.891 1.00 . A A . 52 GLY H 1 1 4 2810 1 1 52 GLY HA2 H -4.475 -11.996 -1.468 1.00 . A A . 52 GLY HA2 1 1 4 2811 1 1 52 GLY HA3 H -3.283 -12.861 -2.422 1.00 . A A . 52 GLY HA3 1 1 4 2812 1 1 52 GLY N N -4.907 -13.992 -1.812 1.00 . A A . 52 GLY N 1 1 4 2813 1 1 52 GLY O O -4.282 -11.777 -4.443 1.00 . A A . 52 GLY O 1 1 4 2814 1 1 53 THR C C -8.200 -10.865 -4.356 1.00 . A A . 53 THR C 1 1 4 2815 1 1 53 THR CA C -7.035 -11.764 -4.750 1.00 . A A . 53 THR CA 1 1 4 2816 1 1 53 THR CB C -7.576 -12.938 -5.588 1.00 . A A . 53 THR CB 1 1 4 2817 1 1 53 THR CG2 C -6.446 -13.639 -6.329 1.00 . A A . 53 THR CG2 1 1 4 2818 1 1 53 THR H H -6.808 -12.594 -2.815 1.00 . A A . 53 THR H 1 1 4 2819 1 1 53 THR HA H -6.348 -11.200 -5.363 1.00 . A A . 53 THR HA 1 1 4 2820 1 1 53 THR HB H -8.276 -12.549 -6.315 1.00 . A A . 53 THR HB 1 1 4 2821 1 1 53 THR HG1 H -9.188 -13.887 -4.960 1.00 . A A . 53 THR HG1 1 1 4 2822 1 1 53 THR HG21 H -6.861 -14.345 -7.033 1.00 . A A . 53 THR HG21 1 1 4 2823 1 1 53 THR HG22 H -5.822 -14.163 -5.621 1.00 . A A . 53 THR HG22 1 1 4 2824 1 1 53 THR HG23 H -5.854 -12.907 -6.859 1.00 . A A . 53 THR HG23 1 1 4 2825 1 1 53 THR N N -6.308 -12.238 -3.578 1.00 . A A . 53 THR N 1 1 4 2826 1 1 53 THR O O -8.779 -11.015 -3.280 1.00 . A A . 53 THR O 1 1 4 2827 1 1 53 THR OG1 O -8.253 -13.875 -4.742 1.00 . A A . 53 THR OG1 1 1 4 2828 1 1 54 CYS C C -10.934 -9.557 -5.630 1.00 . A A . 54 CYS C 1 1 4 2829 1 1 54 CYS CA C -9.652 -9.020 -5.000 1.00 . A A . 54 CYS CA 1 1 4 2830 1 1 54 CYS CB C -9.333 -7.632 -5.564 1.00 . A A . 54 CYS CB 1 1 4 2831 1 1 54 CYS H H -8.052 -9.878 -6.088 1.00 . A A . 54 CYS H 1 1 4 2832 1 1 54 CYS HA H -9.792 -8.943 -3.932 1.00 . A A . 54 CYS HA 1 1 4 2833 1 1 54 CYS HB2 H -9.050 -7.730 -6.601 1.00 . A A . 54 CYS HB2 1 1 4 2834 1 1 54 CYS HB3 H -10.217 -7.014 -5.495 1.00 . A A . 54 CYS HB3 1 1 4 2835 1 1 54 CYS N N -8.546 -9.938 -5.243 1.00 . A A . 54 CYS N 1 1 4 2836 1 1 54 CYS O O -10.971 -9.851 -6.825 1.00 . A A . 54 CYS O 1 1 4 2837 1 1 54 CYS SG S -7.981 -6.763 -4.703 1.00 . A A . 54 CYS SG 1 1 4 2838 1 1 55 ILE C C -14.326 -9.106 -5.300 1.00 . A A . 55 ILE C 1 1 4 2839 1 1 55 ILE CA C -13.259 -10.195 -5.304 1.00 . A A . 55 ILE CA 1 1 4 2840 1 1 55 ILE CB C -13.750 -11.380 -4.451 1.00 . A A . 55 ILE CB 1 1 4 2841 1 1 55 ILE CD1 C -14.480 -11.958 -2.079 1.00 . A A . 55 ILE CD1 1 1 4 2842 1 1 55 ILE CG1 C -13.662 -11.038 -2.961 1.00 . A A . 55 ILE CG1 1 1 4 2843 1 1 55 ILE CG2 C -12.938 -12.629 -4.763 1.00 . A A . 55 ILE CG2 1 1 4 2844 1 1 55 ILE H H -11.894 -9.438 -3.878 1.00 . A A . 55 ILE H 1 1 4 2845 1 1 55 ILE HA H -13.118 -10.543 -6.317 1.00 . A A . 55 ILE HA 1 1 4 2846 1 1 55 ILE HB H -14.780 -11.578 -4.707 1.00 . A A . 55 ILE HB 1 1 4 2847 1 1 55 ILE HD11 H -15.160 -11.371 -1.481 1.00 . A A . 55 ILE HD11 1 1 4 2848 1 1 55 ILE HD12 H -13.819 -12.515 -1.431 1.00 . A A . 55 ILE HD12 1 1 4 2849 1 1 55 ILE HD13 H -15.041 -12.644 -2.696 1.00 . A A . 55 ILE HD13 1 1 4 2850 1 1 55 ILE HG12 H -12.633 -11.104 -2.643 1.00 . A A . 55 ILE HG12 1 1 4 2851 1 1 55 ILE HG13 H -14.018 -10.029 -2.809 1.00 . A A . 55 ILE HG13 1 1 4 2852 1 1 55 ILE HG21 H -13.597 -13.482 -4.820 1.00 . A A . 55 ILE HG21 1 1 4 2853 1 1 55 ILE HG22 H -12.208 -12.789 -3.984 1.00 . A A . 55 ILE HG22 1 1 4 2854 1 1 55 ILE HG23 H -12.432 -12.501 -5.709 1.00 . A A . 55 ILE HG23 1 1 4 2855 1 1 55 ILE N N -11.981 -9.687 -4.821 1.00 . A A . 55 ILE N 1 1 4 2856 1 1 55 ILE O O -14.276 -8.180 -4.491 1.00 . A A . 55 ILE O 1 1 4 2857 1 1 56 SER C C -17.459 -8.528 -5.282 1.00 . A A . 56 SER C 1 1 4 2858 1 1 56 SER CA C -16.369 -8.247 -6.311 1.00 . A A . 56 SER CA 1 1 4 2859 1 1 56 SER CB C -16.967 -8.263 -7.721 1.00 . A A . 56 SER CB 1 1 4 2860 1 1 56 SER H H -15.274 -9.983 -6.828 1.00 . A A . 56 SER H 1 1 4 2861 1 1 56 SER HA H -15.951 -7.272 -6.119 1.00 . A A . 56 SER HA 1 1 4 2862 1 1 56 SER HB2 H -17.431 -7.310 -7.922 1.00 . A A . 56 SER HB2 1 1 4 2863 1 1 56 SER HB3 H -16.181 -8.441 -8.441 1.00 . A A . 56 SER HB3 1 1 4 2864 1 1 56 SER HG H -18.358 -9.220 -8.713 1.00 . A A . 56 SER HG 1 1 4 2865 1 1 56 SER N N -15.290 -9.223 -6.209 1.00 . A A . 56 SER N 1 1 4 2866 1 1 56 SER O O -17.667 -9.713 -4.947 1.00 . A A . 56 SER O 1 1 4 2867 1 1 56 SER OXT O -18.096 -7.559 -4.818 1.00 . A A . 56 SER OXT 1 1 4 2868 1 1 56 SER OG O -17.943 -9.282 -7.850 1.00 . A A . 56 SER OG 1 1 5 2869 1 1 1 ASP C C 1.590 13.952 -2.039 1.00 . A A . 1 ASP C 1 1 5 2870 1 1 1 ASP CA C 2.849 14.152 -2.876 1.00 . A A . 1 ASP CA 1 1 5 2871 1 1 1 ASP CB C 4.095 13.904 -2.023 1.00 . A A . 1 ASP CB 1 1 5 2872 1 1 1 ASP CG C 5.356 13.808 -2.859 1.00 . A A . 1 ASP CG 1 1 5 2873 1 1 1 ASP H1 H 2.244 15.637 -4.211 1.00 . A A . 1 ASP H1 1 1 5 2874 1 1 1 ASP H2 H 3.876 15.729 -3.776 1.00 . A A . 1 ASP H2 1 1 5 2875 1 1 1 ASP H3 H 2.682 16.223 -2.685 1.00 . A A . 1 ASP H3 1 1 5 2876 1 1 1 ASP HA H 2.839 13.454 -3.701 1.00 . A A . 1 ASP HA 1 1 5 2877 1 1 1 ASP HB2 H 4.212 14.718 -1.323 1.00 . A A . 1 ASP HB2 1 1 5 2878 1 1 1 ASP HB3 H 3.975 12.979 -1.478 1.00 . A A . 1 ASP HB3 1 1 5 2879 1 1 1 ASP N N 2.918 15.530 -3.425 1.00 . A A . 1 ASP N 1 1 5 2880 1 1 1 ASP O O 0.684 14.786 -2.053 1.00 . A A . 1 ASP O 1 1 5 2881 1 1 1 ASP OD1 O 5.774 12.675 -3.175 1.00 . A A . 1 ASP OD1 1 1 5 2882 1 1 1 ASP OD2 O 5.926 14.867 -3.197 1.00 . A A . 1 ASP OD2 1 1 5 2883 1 1 2 VAL C C 0.844 12.000 0.896 1.00 . A A . 2 VAL C 1 1 5 2884 1 1 2 VAL CA C 0.394 12.530 -0.462 1.00 . A A . 2 VAL CA 1 1 5 2885 1 1 2 VAL CB C -0.536 11.492 -1.125 1.00 . A A . 2 VAL CB 1 1 5 2886 1 1 2 VAL CG1 C -1.845 11.382 -0.357 1.00 . A A . 2 VAL CG1 1 1 5 2887 1 1 2 VAL CG2 C -0.795 11.854 -2.579 1.00 . A A . 2 VAL CG2 1 1 5 2888 1 1 2 VAL H H 2.297 12.219 -1.339 1.00 . A A . 2 VAL H 1 1 5 2889 1 1 2 VAL HA H -0.166 13.442 -0.313 1.00 . A A . 2 VAL HA 1 1 5 2890 1 1 2 VAL HB H -0.047 10.531 -1.097 1.00 . A A . 2 VAL HB 1 1 5 2891 1 1 2 VAL HG11 H -1.731 11.835 0.616 1.00 . A A . 2 VAL HG11 1 1 5 2892 1 1 2 VAL HG12 H -2.107 10.340 -0.241 1.00 . A A . 2 VAL HG12 1 1 5 2893 1 1 2 VAL HG13 H -2.626 11.891 -0.902 1.00 . A A . 2 VAL HG13 1 1 5 2894 1 1 2 VAL HG21 H -1.809 12.210 -2.686 1.00 . A A . 2 VAL HG21 1 1 5 2895 1 1 2 VAL HG22 H -0.654 10.979 -3.197 1.00 . A A . 2 VAL HG22 1 1 5 2896 1 1 2 VAL HG23 H -0.107 12.627 -2.887 1.00 . A A . 2 VAL HG23 1 1 5 2897 1 1 2 VAL N N 1.541 12.841 -1.309 1.00 . A A . 2 VAL N 1 1 5 2898 1 1 2 VAL O O 0.689 10.814 1.188 1.00 . A A . 2 VAL O 1 1 5 2899 1 1 3 GLN C C 1.223 11.326 3.625 1.00 . A A . 3 GLN C 1 1 5 2900 1 1 3 GLN CA C 1.918 12.555 3.043 1.00 . A A . 3 GLN CA 1 1 5 2901 1 1 3 GLN CB C 1.735 13.743 3.990 1.00 . A A . 3 GLN CB 1 1 5 2902 1 1 3 GLN CD C 2.270 16.156 4.497 1.00 . A A . 3 GLN CD 1 1 5 2903 1 1 3 GLN CG C 2.511 14.980 3.572 1.00 . A A . 3 GLN CG 1 1 5 2904 1 1 3 GLN H H 1.522 13.815 1.389 1.00 . A A . 3 GLN H 1 1 5 2905 1 1 3 GLN HA H 2.973 12.345 2.955 1.00 . A A . 3 GLN HA 1 1 5 2906 1 1 3 GLN HB2 H 0.686 13.998 4.029 1.00 . A A . 3 GLN HB2 1 1 5 2907 1 1 3 GLN HB3 H 2.064 13.455 4.978 1.00 . A A . 3 GLN HB3 1 1 5 2908 1 1 3 GLN HE21 H 0.386 16.287 3.876 1.00 . A A . 3 GLN HE21 1 1 5 2909 1 1 3 GLN HE22 H 0.866 17.446 5.064 1.00 . A A . 3 GLN HE22 1 1 5 2910 1 1 3 GLN HG2 H 3.566 14.748 3.578 1.00 . A A . 3 GLN HG2 1 1 5 2911 1 1 3 GLN HG3 H 2.209 15.258 2.572 1.00 . A A . 3 GLN HG3 1 1 5 2912 1 1 3 GLN N N 1.418 12.895 1.708 1.00 . A A . 3 GLN N 1 1 5 2913 1 1 3 GLN NE2 N 1.051 16.683 4.477 1.00 . A A . 3 GLN NE2 1 1 5 2914 1 1 3 GLN O O 0.073 11.396 4.058 1.00 . A A . 3 GLN O 1 1 5 2915 1 1 3 GLN OE1 O 3.167 16.586 5.221 1.00 . A A . 3 GLN OE1 1 1 5 2916 1 1 4 CYS C C 1.108 9.071 5.649 1.00 . A A . 4 CYS C 1 1 5 2917 1 1 4 CYS CA C 1.400 8.954 4.158 1.00 . A A . 4 CYS CA 1 1 5 2918 1 1 4 CYS CB C 2.385 7.811 3.908 1.00 . A A . 4 CYS CB 1 1 5 2919 1 1 4 CYS H H 2.848 10.215 3.272 1.00 . A A . 4 CYS H 1 1 5 2920 1 1 4 CYS HA H 0.477 8.742 3.638 1.00 . A A . 4 CYS HA 1 1 5 2921 1 1 4 CYS HB2 H 3.347 8.079 4.320 1.00 . A A . 4 CYS HB2 1 1 5 2922 1 1 4 CYS HB3 H 2.025 6.921 4.399 1.00 . A A . 4 CYS HB3 1 1 5 2923 1 1 4 CYS N N 1.937 10.203 3.631 1.00 . A A . 4 CYS N 1 1 5 2924 1 1 4 CYS O O 0.194 8.430 6.166 1.00 . A A . 4 CYS O 1 1 5 2925 1 1 4 CYS SG S 2.628 7.416 2.147 1.00 . A A . 4 CYS SG 1 1 5 2926 1 1 5 GLY C C 3.008 10.220 8.515 1.00 . A A . 5 GLY C 1 1 5 2927 1 1 5 GLY CA C 1.699 10.092 7.761 1.00 . A A . 5 GLY CA 1 1 5 2928 1 1 5 GLY H H 2.601 10.388 5.864 1.00 . A A . 5 GLY H 1 1 5 2929 1 1 5 GLY HA2 H 1.118 10.989 7.917 1.00 . A A . 5 GLY HA2 1 1 5 2930 1 1 5 GLY HA3 H 1.151 9.250 8.154 1.00 . A A . 5 GLY HA3 1 1 5 2931 1 1 5 GLY N N 1.890 9.900 6.334 1.00 . A A . 5 GLY N 1 1 5 2932 1 1 5 GLY O O 3.317 9.393 9.374 1.00 . A A . 5 GLY O 1 1 5 2933 1 1 6 GLY C C 6.020 10.323 8.606 1.00 . A A . 6 GLY C 1 1 5 2934 1 1 6 GLY CA C 5.053 11.462 8.854 1.00 . A A . 6 GLY CA 1 1 5 2935 1 1 6 GLY H H 3.481 11.876 7.496 1.00 . A A . 6 GLY H 1 1 5 2936 1 1 6 GLY HA2 H 5.491 12.380 8.489 1.00 . A A . 6 GLY HA2 1 1 5 2937 1 1 6 GLY HA3 H 4.884 11.553 9.917 1.00 . A A . 6 GLY HA3 1 1 5 2938 1 1 6 GLY N N 3.778 11.254 8.191 1.00 . A A . 6 GLY N 1 1 5 2939 1 1 6 GLY O O 6.416 9.622 9.538 1.00 . A A . 6 GLY O 1 1 5 2940 1 1 7 GLY C C 7.479 8.891 5.504 1.00 . A A . 7 GLY C 1 1 5 2941 1 1 7 GLY CA C 7.323 9.071 7.002 1.00 . A A . 7 GLY CA 1 1 5 2942 1 1 7 GLY H H 6.054 10.728 6.647 1.00 . A A . 7 GLY H 1 1 5 2943 1 1 7 GLY HA2 H 8.290 9.295 7.428 1.00 . A A . 7 GLY HA2 1 1 5 2944 1 1 7 GLY HA3 H 6.960 8.146 7.426 1.00 . A A . 7 GLY HA3 1 1 5 2945 1 1 7 GLY N N 6.401 10.137 7.345 1.00 . A A . 7 GLY N 1 1 5 2946 1 1 7 GLY O O 8.460 9.349 4.919 1.00 . A A . 7 GLY O 1 1 5 2947 1 1 8 PHE C C 5.687 8.959 2.684 1.00 . A A . 8 PHE C 1 1 5 2948 1 1 8 PHE CA C 6.559 7.968 3.447 1.00 . A A . 8 PHE CA 1 1 5 2949 1 1 8 PHE CB C 6.100 6.543 3.147 1.00 . A A . 8 PHE CB 1 1 5 2950 1 1 8 PHE CD1 C 7.913 5.126 4.147 1.00 . A A . 8 PHE CD1 1 1 5 2951 1 1 8 PHE CD2 C 7.603 5.064 1.783 1.00 . A A . 8 PHE CD2 1 1 5 2952 1 1 8 PHE CE1 C 8.950 4.219 4.038 1.00 . A A . 8 PHE CE1 1 1 5 2953 1 1 8 PHE CE2 C 8.640 4.157 1.668 1.00 . A A . 8 PHE CE2 1 1 5 2954 1 1 8 PHE CG C 7.229 5.558 3.023 1.00 . A A . 8 PHE CG 1 1 5 2955 1 1 8 PHE CZ C 9.314 3.734 2.797 1.00 . A A . 8 PHE CZ 1 1 5 2956 1 1 8 PHE H H 5.761 7.866 5.407 1.00 . A A . 8 PHE H 1 1 5 2957 1 1 8 PHE HA H 7.582 8.082 3.120 1.00 . A A . 8 PHE HA 1 1 5 2958 1 1 8 PHE HB2 H 5.454 6.208 3.944 1.00 . A A . 8 PHE HB2 1 1 5 2959 1 1 8 PHE HB3 H 5.548 6.543 2.220 1.00 . A A . 8 PHE HB3 1 1 5 2960 1 1 8 PHE HD1 H 7.629 5.504 5.118 1.00 . A A . 8 PHE HD1 1 1 5 2961 1 1 8 PHE HD2 H 7.076 5.394 0.899 1.00 . A A . 8 PHE HD2 1 1 5 2962 1 1 8 PHE HE1 H 9.476 3.890 4.922 1.00 . A A . 8 PHE HE1 1 1 5 2963 1 1 8 PHE HE2 H 8.922 3.779 0.696 1.00 . A A . 8 PHE HE2 1 1 5 2964 1 1 8 PHE HZ H 10.124 3.025 2.709 1.00 . A A . 8 PHE HZ 1 1 5 2965 1 1 8 PHE N N 6.515 8.215 4.885 1.00 . A A . 8 PHE N 1 1 5 2966 1 1 8 PHE O O 5.125 9.887 3.265 1.00 . A A . 8 PHE O 1 1 5 2967 1 1 9 SER C C 4.282 8.847 -0.709 1.00 . A A . 9 SER C 1 1 5 2968 1 1 9 SER CA C 4.781 9.610 0.516 1.00 . A A . 9 SER CA 1 1 5 2969 1 1 9 SER CB C 5.599 10.825 0.074 1.00 . A A . 9 SER CB 1 1 5 2970 1 1 9 SER H H 6.057 7.986 0.980 1.00 . A A . 9 SER H 1 1 5 2971 1 1 9 SER HA H 3.930 9.949 1.086 1.00 . A A . 9 SER HA 1 1 5 2972 1 1 9 SER HB2 H 5.271 11.140 -0.906 1.00 . A A . 9 SER HB2 1 1 5 2973 1 1 9 SER HB3 H 5.455 11.631 0.778 1.00 . A A . 9 SER HB3 1 1 5 2974 1 1 9 SER HG H 7.114 9.754 -0.556 1.00 . A A . 9 SER HG 1 1 5 2975 1 1 9 SER N N 5.583 8.747 1.376 1.00 . A A . 9 SER N 1 1 5 2976 1 1 9 SER O O 4.901 7.874 -1.141 1.00 . A A . 9 SER O 1 1 5 2977 1 1 9 SER OG O 6.981 10.515 0.013 1.00 . A A . 9 SER OG 1 1 5 2978 1 1 10 CYS C C 2.335 9.693 -3.540 1.00 . A A . 10 CYS C 1 1 5 2979 1 1 10 CYS CA C 2.576 8.664 -2.439 1.00 . A A . 10 CYS CA 1 1 5 2980 1 1 10 CYS CB C 1.259 7.972 -2.074 1.00 . A A . 10 CYS CB 1 1 5 2981 1 1 10 CYS H H 2.715 10.077 -0.873 1.00 . A A . 10 CYS H 1 1 5 2982 1 1 10 CYS HA H 3.274 7.925 -2.799 1.00 . A A . 10 CYS HA 1 1 5 2983 1 1 10 CYS HB2 H 0.844 8.450 -1.198 1.00 . A A . 10 CYS HB2 1 1 5 2984 1 1 10 CYS HB3 H 0.567 8.081 -2.895 1.00 . A A . 10 CYS HB3 1 1 5 2985 1 1 10 CYS N N 3.160 9.297 -1.263 1.00 . A A . 10 CYS N 1 1 5 2986 1 1 10 CYS O O 2.018 10.850 -3.265 1.00 . A A . 10 CYS O 1 1 5 2987 1 1 10 CYS SG S 1.411 6.190 -1.708 1.00 . A A . 10 CYS SG 1 1 5 2988 1 1 11 HIS C C 0.821 10.218 -6.313 1.00 . A A . 11 HIS C 1 1 5 2989 1 1 11 HIS CA C 2.297 10.145 -5.933 1.00 . A A . 11 HIS CA 1 1 5 2990 1 1 11 HIS CB C 3.120 9.656 -7.126 1.00 . A A . 11 HIS CB 1 1 5 2991 1 1 11 HIS CD2 C 4.736 11.565 -7.817 1.00 . A A . 11 HIS CD2 1 1 5 2992 1 1 11 HIS CE1 C 3.749 12.161 -9.682 1.00 . A A . 11 HIS CE1 1 1 5 2993 1 1 11 HIS CG C 3.655 10.766 -7.979 1.00 . A A . 11 HIS CG 1 1 5 2994 1 1 11 HIS H H 2.754 8.329 -4.932 1.00 . A A . 11 HIS H 1 1 5 2995 1 1 11 HIS HA H 2.634 11.132 -5.653 1.00 . A A . 11 HIS HA 1 1 5 2996 1 1 11 HIS HB2 H 3.959 9.082 -6.764 1.00 . A A . 11 HIS HB2 1 1 5 2997 1 1 11 HIS HB3 H 2.500 9.026 -7.748 1.00 . A A . 11 HIS HB3 1 1 5 2998 1 1 11 HIS HD1 H 2.249 10.777 -9.548 1.00 . A A . 11 HIS HD1 1 1 5 2999 1 1 11 HIS HD2 H 5.442 11.531 -6.999 1.00 . A A . 11 HIS HD2 1 1 5 3000 1 1 11 HIS HE1 H 3.515 12.676 -10.602 1.00 . A A . 11 HIS HE1 1 1 5 3001 1 1 11 HIS HE2 H 5.372 13.192 -8.979 1.00 . A A . 11 HIS HE2 1 1 5 3002 1 1 11 HIS N N 2.493 9.262 -4.787 1.00 . A A . 11 HIS N 1 1 5 3003 1 1 11 HIS ND1 N 3.058 11.166 -9.156 1.00 . A A . 11 HIS ND1 1 1 5 3004 1 1 11 HIS NE2 N 4.772 12.423 -8.888 1.00 . A A . 11 HIS NE2 1 1 5 3005 1 1 11 HIS O O -0.011 9.521 -5.733 1.00 . A A . 11 HIS O 1 1 5 3006 1 1 12 ASP C C -1.462 9.912 -8.205 1.00 . A A . 12 ASP C 1 1 5 3007 1 1 12 ASP CA C -0.878 11.238 -7.730 1.00 . A A . 12 ASP CA 1 1 5 3008 1 1 12 ASP CB C -0.948 12.271 -8.856 1.00 . A A . 12 ASP CB 1 1 5 3009 1 1 12 ASP CG C -1.224 13.669 -8.340 1.00 . A A . 12 ASP CG 1 1 5 3010 1 1 12 ASP H H 1.203 11.610 -7.703 1.00 . A A . 12 ASP H 1 1 5 3011 1 1 12 ASP HA H -1.458 11.593 -6.892 1.00 . A A . 12 ASP HA 1 1 5 3012 1 1 12 ASP HB2 H -0.007 12.283 -9.385 1.00 . A A . 12 ASP HB2 1 1 5 3013 1 1 12 ASP HB3 H -1.738 11.997 -9.541 1.00 . A A . 12 ASP HB3 1 1 5 3014 1 1 12 ASP N N 0.500 11.072 -7.282 1.00 . A A . 12 ASP N 1 1 5 3015 1 1 12 ASP O O -0.902 9.252 -9.082 1.00 . A A . 12 ASP O 1 1 5 3016 1 1 12 ASP OD1 O -0.383 14.199 -7.584 1.00 . A A . 12 ASP OD1 1 1 5 3017 1 1 12 ASP OD2 O -2.280 14.234 -8.693 1.00 . A A . 12 ASP OD2 1 1 5 3018 1 1 13 GLY C C -2.893 7.146 -7.044 1.00 . A A . 13 GLY C 1 1 5 3019 1 1 13 GLY CA C -3.234 8.278 -7.992 1.00 . A A . 13 GLY CA 1 1 5 3020 1 1 13 GLY H H -2.991 10.091 -6.926 1.00 . A A . 13 GLY H 1 1 5 3021 1 1 13 GLY HA2 H -4.304 8.423 -7.992 1.00 . A A . 13 GLY HA2 1 1 5 3022 1 1 13 GLY HA3 H -2.917 8.006 -8.989 1.00 . A A . 13 GLY HA3 1 1 5 3023 1 1 13 GLY N N -2.591 9.525 -7.619 1.00 . A A . 13 GLY N 1 1 5 3024 1 1 13 GLY O O -3.598 6.138 -6.991 1.00 . A A . 13 GLY O 1 1 5 3025 1 1 14 GLU C C -1.939 6.586 -3.949 1.00 . A A . 14 GLU C 1 1 5 3026 1 1 14 GLU CA C -1.377 6.300 -5.337 1.00 . A A . 14 GLU CA 1 1 5 3027 1 1 14 GLU CB C 0.152 6.234 -5.271 1.00 . A A . 14 GLU CB 1 1 5 3028 1 1 14 GLU CD C 1.734 5.716 -7.171 1.00 . A A . 14 GLU CD 1 1 5 3029 1 1 14 GLU CG C 0.846 6.756 -6.517 1.00 . A A . 14 GLU CG 1 1 5 3030 1 1 14 GLU H H -1.292 8.140 -6.379 1.00 . A A . 14 GLU H 1 1 5 3031 1 1 14 GLU HA H -1.754 5.347 -5.674 1.00 . A A . 14 GLU HA 1 1 5 3032 1 1 14 GLU HB2 H 0.489 6.817 -4.428 1.00 . A A . 14 GLU HB2 1 1 5 3033 1 1 14 GLU HB3 H 0.448 5.205 -5.125 1.00 . A A . 14 GLU HB3 1 1 5 3034 1 1 14 GLU HG2 H 0.095 7.065 -7.230 1.00 . A A . 14 GLU HG2 1 1 5 3035 1 1 14 GLU HG3 H 1.453 7.607 -6.243 1.00 . A A . 14 GLU HG3 1 1 5 3036 1 1 14 GLU N N -1.810 7.315 -6.291 1.00 . A A . 14 GLU N 1 1 5 3037 1 1 14 GLU O O -2.224 7.734 -3.606 1.00 . A A . 14 GLU O 1 1 5 3038 1 1 14 GLU OE1 O 2.592 5.142 -6.468 1.00 . A A . 14 GLU OE1 1 1 5 3039 1 1 14 GLU OE2 O 1.571 5.475 -8.385 1.00 . A A . 14 GLU OE2 1 1 5 3040 1 1 15 THR C C -1.641 5.082 -0.792 1.00 . A A . 15 THR C 1 1 5 3041 1 1 15 THR CA C -2.624 5.649 -1.809 1.00 . A A . 15 THR CA 1 1 5 3042 1 1 15 THR CB C -3.977 4.920 -1.676 1.00 . A A . 15 THR CB 1 1 5 3043 1 1 15 THR CG2 C -4.404 4.812 -0.217 1.00 . A A . 15 THR CG2 1 1 5 3044 1 1 15 THR H H -1.849 4.646 -3.497 1.00 . A A . 15 THR H 1 1 5 3045 1 1 15 THR HA H -2.780 6.697 -1.601 1.00 . A A . 15 THR HA 1 1 5 3046 1 1 15 THR HB H -3.875 3.922 -2.081 1.00 . A A . 15 THR HB 1 1 5 3047 1 1 15 THR HG1 H -4.984 6.547 -2.152 1.00 . A A . 15 THR HG1 1 1 5 3048 1 1 15 THR HG21 H -4.315 5.779 0.256 1.00 . A A . 15 THR HG21 1 1 5 3049 1 1 15 THR HG22 H -3.769 4.102 0.291 1.00 . A A . 15 THR HG22 1 1 5 3050 1 1 15 THR HG23 H -5.430 4.479 -0.167 1.00 . A A . 15 THR HG23 1 1 5 3051 1 1 15 THR N N -2.096 5.531 -3.160 1.00 . A A . 15 THR N 1 1 5 3052 1 1 15 THR O O -0.944 4.104 -1.065 1.00 . A A . 15 THR O 1 1 5 3053 1 1 15 THR OG1 O -4.982 5.624 -2.413 1.00 . A A . 15 THR OG1 1 1 5 3054 1 1 16 CYS C C -1.397 4.220 2.329 1.00 . A A . 16 CYS C 1 1 5 3055 1 1 16 CYS CA C -0.703 5.247 1.441 1.00 . A A . 16 CYS CA 1 1 5 3056 1 1 16 CYS CB C -0.234 6.438 2.276 1.00 . A A . 16 CYS CB 1 1 5 3057 1 1 16 CYS H H -2.180 6.465 0.545 1.00 . A A . 16 CYS H 1 1 5 3058 1 1 16 CYS HA H 0.155 4.784 0.977 1.00 . A A . 16 CYS HA 1 1 5 3059 1 1 16 CYS HB2 H -1.096 6.962 2.661 1.00 . A A . 16 CYS HB2 1 1 5 3060 1 1 16 CYS HB3 H 0.360 6.077 3.103 1.00 . A A . 16 CYS HB3 1 1 5 3061 1 1 16 CYS N N -1.595 5.696 0.383 1.00 . A A . 16 CYS N 1 1 5 3062 1 1 16 CYS O O -2.414 4.515 2.958 1.00 . A A . 16 CYS O 1 1 5 3063 1 1 16 CYS SG S 0.777 7.638 1.351 1.00 . A A . 16 CYS SG 1 1 5 3064 1 1 17 CYS C C -0.381 1.439 4.199 1.00 . A A . 17 CYS C 1 1 5 3065 1 1 17 CYS CA C -1.406 1.940 3.185 1.00 . A A . 17 CYS CA 1 1 5 3066 1 1 17 CYS CB C -1.886 0.790 2.289 1.00 . A A . 17 CYS CB 1 1 5 3067 1 1 17 CYS H H -0.033 2.839 1.855 1.00 . A A . 17 CYS H 1 1 5 3068 1 1 17 CYS HA H -2.253 2.343 3.720 1.00 . A A . 17 CYS HA 1 1 5 3069 1 1 17 CYS HB2 H -2.955 0.691 2.391 1.00 . A A . 17 CYS HB2 1 1 5 3070 1 1 17 CYS HB3 H -1.650 1.025 1.262 1.00 . A A . 17 CYS HB3 1 1 5 3071 1 1 17 CYS N N -0.842 3.013 2.376 1.00 . A A . 17 CYS N 1 1 5 3072 1 1 17 CYS O O 0.732 1.052 3.832 1.00 . A A . 17 CYS O 1 1 5 3073 1 1 17 CYS SG S -1.144 -0.836 2.670 1.00 . A A . 17 CYS SG 1 1 5 3074 1 1 18 PRO C C -0.015 -0.483 6.851 1.00 . A A . 18 PRO C 1 1 5 3075 1 1 18 PRO CA C 0.138 1.007 6.567 1.00 . A A . 18 PRO CA 1 1 5 3076 1 1 18 PRO CB C -0.357 1.833 7.749 1.00 . A A . 18 PRO CB 1 1 5 3077 1 1 18 PRO CD C -2.042 1.911 6.021 1.00 . A A . 18 PRO CD 1 1 5 3078 1 1 18 PRO CG C -1.827 1.971 7.517 1.00 . A A . 18 PRO CG 1 1 5 3079 1 1 18 PRO HA H 1.173 1.238 6.361 1.00 . A A . 18 PRO HA 1 1 5 3080 1 1 18 PRO HB2 H -0.147 1.310 8.671 1.00 . A A . 18 PRO HB2 1 1 5 3081 1 1 18 PRO HB3 H 0.133 2.794 7.752 1.00 . A A . 18 PRO HB3 1 1 5 3082 1 1 18 PRO HD2 H -2.825 1.206 5.778 1.00 . A A . 18 PRO HD2 1 1 5 3083 1 1 18 PRO HD3 H -2.286 2.891 5.637 1.00 . A A . 18 PRO HD3 1 1 5 3084 1 1 18 PRO HG2 H -2.351 1.160 8.000 1.00 . A A . 18 PRO HG2 1 1 5 3085 1 1 18 PRO HG3 H -2.169 2.920 7.904 1.00 . A A . 18 PRO HG3 1 1 5 3086 1 1 18 PRO N N -0.742 1.451 5.494 1.00 . A A . 18 PRO N 1 1 5 3087 1 1 18 PRO O O -0.761 -0.883 7.747 1.00 . A A . 18 PRO O 1 1 5 3088 1 1 19 THR C C 1.618 -3.225 7.308 1.00 . A A . 19 THR C 1 1 5 3089 1 1 19 THR CA C 0.630 -2.749 6.246 1.00 . A A . 19 THR CA 1 1 5 3090 1 1 19 THR CB C 0.919 -3.474 4.915 1.00 . A A . 19 THR CB 1 1 5 3091 1 1 19 THR CG2 C 2.082 -2.822 4.180 1.00 . A A . 19 THR CG2 1 1 5 3092 1 1 19 THR H H 1.267 -0.927 5.384 1.00 . A A . 19 THR H 1 1 5 3093 1 1 19 THR HA H -0.371 -3.005 6.561 1.00 . A A . 19 THR HA 1 1 5 3094 1 1 19 THR HB H 0.039 -3.407 4.290 1.00 . A A . 19 THR HB 1 1 5 3095 1 1 19 THR HG1 H 1.044 -5.362 4.358 1.00 . A A . 19 THR HG1 1 1 5 3096 1 1 19 THR HG21 H 3.004 -3.040 4.701 1.00 . A A . 19 THR HG21 1 1 5 3097 1 1 19 THR HG22 H 1.934 -1.752 4.144 1.00 . A A . 19 THR HG22 1 1 5 3098 1 1 19 THR HG23 H 2.137 -3.212 3.175 1.00 . A A . 19 THR HG23 1 1 5 3099 1 1 19 THR N N 0.691 -1.302 6.081 1.00 . A A . 19 THR N 1 1 5 3100 1 1 19 THR O O 1.707 -4.417 7.600 1.00 . A A . 19 THR O 1 1 5 3101 1 1 19 THR OG1 O 1.214 -4.855 5.155 1.00 . A A . 19 THR OG1 1 1 5 3102 1 1 20 SER C C 3.500 -1.442 9.898 1.00 . A A . 20 SER C 1 1 5 3103 1 1 20 SER CA C 3.325 -2.605 8.928 1.00 . A A . 20 SER CA 1 1 5 3104 1 1 20 SER CB C 4.671 -2.964 8.298 1.00 . A A . 20 SER CB 1 1 5 3105 1 1 20 SER H H 2.226 -1.347 7.628 1.00 . A A . 20 SER H 1 1 5 3106 1 1 20 SER HA H 2.955 -3.460 9.474 1.00 . A A . 20 SER HA 1 1 5 3107 1 1 20 SER HB2 H 5.199 -2.057 8.044 1.00 . A A . 20 SER HB2 1 1 5 3108 1 1 20 SER HB3 H 5.256 -3.534 9.006 1.00 . A A . 20 SER HB3 1 1 5 3109 1 1 20 SER HG H 5.141 -4.447 7.109 1.00 . A A . 20 SER HG 1 1 5 3110 1 1 20 SER N N 2.351 -2.282 7.892 1.00 . A A . 20 SER N 1 1 5 3111 1 1 20 SER O O 4.225 -1.554 10.887 1.00 . A A . 20 SER O 1 1 5 3112 1 1 20 SER OG O 4.497 -3.735 7.123 1.00 . A A . 20 SER OG 1 1 5 3113 1 1 21 GLN C C 4.232 1.607 10.245 1.00 . A A . 21 GLN C 1 1 5 3114 1 1 21 GLN CA C 2.899 0.882 10.426 1.00 . A A . 21 GLN CA 1 1 5 3115 1 1 21 GLN CB C 2.676 0.547 11.905 1.00 . A A . 21 GLN CB 1 1 5 3116 1 1 21 GLN CD C 0.985 0.126 13.735 1.00 . A A . 21 GLN CD 1 1 5 3117 1 1 21 GLN CG C 1.229 0.688 12.348 1.00 . A A . 21 GLN CG 1 1 5 3118 1 1 21 GLN H H 2.277 -0.310 8.790 1.00 . A A . 21 GLN H 1 1 5 3119 1 1 21 GLN HA H 2.108 1.540 10.100 1.00 . A A . 21 GLN HA 1 1 5 3120 1 1 21 GLN HB2 H 2.989 -0.471 12.084 1.00 . A A . 21 GLN HB2 1 1 5 3121 1 1 21 GLN HB3 H 3.280 1.210 12.507 1.00 . A A . 21 GLN HB3 1 1 5 3122 1 1 21 GLN HE21 H 2.107 -1.461 13.317 1.00 . A A . 21 GLN HE21 1 1 5 3123 1 1 21 GLN HE22 H 1.425 -1.422 14.903 1.00 . A A . 21 GLN HE22 1 1 5 3124 1 1 21 GLN HG2 H 0.966 1.735 12.349 1.00 . A A . 21 GLN HG2 1 1 5 3125 1 1 21 GLN HG3 H 0.598 0.160 11.646 1.00 . A A . 21 GLN HG3 1 1 5 3126 1 1 21 GLN N N 2.832 -0.325 9.598 1.00 . A A . 21 GLN N 1 1 5 3127 1 1 21 GLN NE2 N 1.564 -1.037 14.013 1.00 . A A . 21 GLN NE2 1 1 5 3128 1 1 21 GLN O O 4.288 2.836 10.294 1.00 . A A . 21 GLN O 1 1 5 3129 1 1 21 GLN OE1 O 0.284 0.729 14.547 1.00 . A A . 21 GLN OE1 1 1 5 3130 1 1 22 THR C C 6.972 1.503 8.358 1.00 . A A . 22 THR C 1 1 5 3131 1 1 22 THR CA C 6.626 1.423 9.840 1.00 . A A . 22 THR CA 1 1 5 3132 1 1 22 THR CB C 7.707 0.605 10.568 1.00 . A A . 22 THR CB 1 1 5 3133 1 1 22 THR CG2 C 7.504 0.660 12.075 1.00 . A A . 22 THR CG2 1 1 5 3134 1 1 22 THR H H 5.199 -0.126 10.001 1.00 . A A . 22 THR H 1 1 5 3135 1 1 22 THR HA H 6.618 2.422 10.253 1.00 . A A . 22 THR HA 1 1 5 3136 1 1 22 THR HB H 8.675 1.027 10.335 1.00 . A A . 22 THR HB 1 1 5 3137 1 1 22 THR HG1 H 7.389 -0.789 9.209 1.00 . A A . 22 THR HG1 1 1 5 3138 1 1 22 THR HG21 H 8.463 0.624 12.570 1.00 . A A . 22 THR HG21 1 1 5 3139 1 1 22 THR HG22 H 6.905 -0.182 12.389 1.00 . A A . 22 THR HG22 1 1 5 3140 1 1 22 THR HG23 H 6.998 1.578 12.336 1.00 . A A . 22 THR HG23 1 1 5 3141 1 1 22 THR N N 5.302 0.845 10.033 1.00 . A A . 22 THR N 1 1 5 3142 1 1 22 THR O O 7.776 2.336 7.940 1.00 . A A . 22 THR O 1 1 5 3143 1 1 22 THR OG1 O 7.672 -0.757 10.126 1.00 . A A . 22 THR OG1 1 1 5 3144 1 1 23 THR C C 5.302 0.950 5.372 1.00 . A A . 23 THR C 1 1 5 3145 1 1 23 THR CA C 6.581 0.605 6.127 1.00 . A A . 23 THR CA 1 1 5 3146 1 1 23 THR CB C 7.092 -0.770 5.657 1.00 . A A . 23 THR CB 1 1 5 3147 1 1 23 THR CG2 C 8.560 -0.698 5.264 1.00 . A A . 23 THR CG2 1 1 5 3148 1 1 23 THR H H 5.714 0.000 7.960 1.00 . A A . 23 THR H 1 1 5 3149 1 1 23 THR HA H 7.334 1.346 5.896 1.00 . A A . 23 THR HA 1 1 5 3150 1 1 23 THR HB H 6.519 -1.072 4.792 1.00 . A A . 23 THR HB 1 1 5 3151 1 1 23 THR HG1 H 6.267 -1.427 7.323 1.00 . A A . 23 THR HG1 1 1 5 3152 1 1 23 THR HG21 H 8.656 -0.846 4.199 1.00 . A A . 23 THR HG21 1 1 5 3153 1 1 23 THR HG22 H 9.109 -1.467 5.786 1.00 . A A . 23 THR HG22 1 1 5 3154 1 1 23 THR HG23 H 8.956 0.271 5.531 1.00 . A A . 23 THR HG23 1 1 5 3155 1 1 23 THR N N 6.351 0.634 7.566 1.00 . A A . 23 THR N 1 1 5 3156 1 1 23 THR O O 4.360 0.158 5.330 1.00 . A A . 23 THR O 1 1 5 3157 1 1 23 THR OG1 O 6.920 -1.742 6.694 1.00 . A A . 23 THR OG1 1 1 5 3158 1 1 24 TRP C C 4.177 2.169 2.579 1.00 . A A . 24 TRP C 1 1 5 3159 1 1 24 TRP CA C 4.110 2.605 4.041 1.00 . A A . 24 TRP CA 1 1 5 3160 1 1 24 TRP CB C 4.018 4.128 4.121 1.00 . A A . 24 TRP CB 1 1 5 3161 1 1 24 TRP CD1 C 4.016 5.014 6.526 1.00 . A A . 24 TRP CD1 1 1 5 3162 1 1 24 TRP CD2 C 1.985 4.770 5.626 1.00 . A A . 24 TRP CD2 1 1 5 3163 1 1 24 TRP CE2 C 1.836 5.259 6.937 1.00 . A A . 24 TRP CE2 1 1 5 3164 1 1 24 TRP CE3 C 0.843 4.538 4.859 1.00 . A A . 24 TRP CE3 1 1 5 3165 1 1 24 TRP CG C 3.382 4.621 5.383 1.00 . A A . 24 TRP CG 1 1 5 3166 1 1 24 TRP CH2 C -0.514 5.280 6.719 1.00 . A A . 24 TRP CH2 1 1 5 3167 1 1 24 TRP CZ2 C 0.588 5.518 7.496 1.00 . A A . 24 TRP CZ2 1 1 5 3168 1 1 24 TRP CZ3 C -0.394 4.796 5.413 1.00 . A A . 24 TRP CZ3 1 1 5 3169 1 1 24 TRP H H 6.054 2.729 4.864 1.00 . A A . 24 TRP H 1 1 5 3170 1 1 24 TRP HA H 3.228 2.175 4.496 1.00 . A A . 24 TRP HA 1 1 5 3171 1 1 24 TRP HB2 H 5.012 4.545 4.064 1.00 . A A . 24 TRP HB2 1 1 5 3172 1 1 24 TRP HB3 H 3.433 4.491 3.288 1.00 . A A . 24 TRP HB3 1 1 5 3173 1 1 24 TRP HD1 H 5.087 5.017 6.658 1.00 . A A . 24 TRP HD1 1 1 5 3174 1 1 24 TRP HE1 H 3.297 5.724 8.370 1.00 . A A . 24 TRP HE1 1 1 5 3175 1 1 24 TRP HE3 H 0.918 4.167 3.849 1.00 . A A . 24 TRP HE3 1 1 5 3176 1 1 24 TRP HH2 H -1.502 5.465 7.110 1.00 . A A . 24 TRP HH2 1 1 5 3177 1 1 24 TRP HZ2 H 0.478 5.893 8.503 1.00 . A A . 24 TRP HZ2 1 1 5 3178 1 1 24 TRP HZ3 H -1.289 4.621 4.835 1.00 . A A . 24 TRP HZ3 1 1 5 3179 1 1 24 TRP N N 5.274 2.142 4.786 1.00 . A A . 24 TRP N 1 1 5 3180 1 1 24 TRP NE1 N 3.091 5.400 7.467 1.00 . A A . 24 TRP NE1 1 1 5 3181 1 1 24 TRP O O 5.239 2.222 1.957 1.00 . A A . 24 TRP O 1 1 5 3182 1 1 25 GLY C C 2.131 2.196 -0.225 1.00 . A A . 25 GLY C 1 1 5 3183 1 1 25 GLY CA C 3.000 1.307 0.649 1.00 . A A . 25 GLY CA 1 1 5 3184 1 1 25 GLY H H 2.222 1.720 2.581 1.00 . A A . 25 GLY H 1 1 5 3185 1 1 25 GLY HA2 H 4.006 1.311 0.255 1.00 . A A . 25 GLY HA2 1 1 5 3186 1 1 25 GLY HA3 H 2.616 0.298 0.611 1.00 . A A . 25 GLY HA3 1 1 5 3187 1 1 25 GLY N N 3.040 1.741 2.036 1.00 . A A . 25 GLY N 1 1 5 3188 1 1 25 GLY O O 1.133 2.747 0.238 1.00 . A A . 25 GLY O 1 1 5 3189 1 1 26 CYS C C 0.863 2.257 -3.316 1.00 . A A . 26 CYS C 1 1 5 3190 1 1 26 CYS CA C 1.751 3.142 -2.446 1.00 . A A . 26 CYS CA 1 1 5 3191 1 1 26 CYS CB C 2.700 3.957 -3.329 1.00 . A A . 26 CYS CB 1 1 5 3192 1 1 26 CYS H H 3.306 1.852 -1.808 1.00 . A A . 26 CYS H 1 1 5 3193 1 1 26 CYS HA H 1.127 3.817 -1.881 1.00 . A A . 26 CYS HA 1 1 5 3194 1 1 26 CYS HB2 H 3.629 3.418 -3.436 1.00 . A A . 26 CYS HB2 1 1 5 3195 1 1 26 CYS HB3 H 2.251 4.083 -4.304 1.00 . A A . 26 CYS HB3 1 1 5 3196 1 1 26 CYS N N 2.507 2.325 -1.497 1.00 . A A . 26 CYS N 1 1 5 3197 1 1 26 CYS O O 1.327 1.265 -3.879 1.00 . A A . 26 CYS O 1 1 5 3198 1 1 26 CYS SG S 3.099 5.617 -2.683 1.00 . A A . 26 CYS SG 1 1 5 3199 1 1 27 CYS C C -2.149 2.691 -5.178 1.00 . A A . 27 CYS C 1 1 5 3200 1 1 27 CYS CA C -1.365 1.822 -4.194 1.00 . A A . 27 CYS CA 1 1 5 3201 1 1 27 CYS CB C -2.325 1.095 -3.257 1.00 . A A . 27 CYS CB 1 1 5 3202 1 1 27 CYS H H -0.732 3.396 -2.923 1.00 . A A . 27 CYS H 1 1 5 3203 1 1 27 CYS HA H -0.802 1.089 -4.750 1.00 . A A . 27 CYS HA 1 1 5 3204 1 1 27 CYS HB2 H -2.465 1.690 -2.365 1.00 . A A . 27 CYS HB2 1 1 5 3205 1 1 27 CYS HB3 H -3.276 0.969 -3.751 1.00 . A A . 27 CYS HB3 1 1 5 3206 1 1 27 CYS N N -0.416 2.606 -3.407 1.00 . A A . 27 CYS N 1 1 5 3207 1 1 27 CYS O O -2.914 3.563 -4.774 1.00 . A A . 27 CYS O 1 1 5 3208 1 1 27 CYS SG S -1.738 -0.548 -2.738 1.00 . A A . 27 CYS SG 1 1 5 3209 1 1 28 PRO C C -4.186 3.001 -7.511 1.00 . A A . 28 PRO C 1 1 5 3210 1 1 28 PRO CA C -2.675 3.217 -7.537 1.00 . A A . 28 PRO CA 1 1 5 3211 1 1 28 PRO CB C -2.082 2.673 -8.842 1.00 . A A . 28 PRO CB 1 1 5 3212 1 1 28 PRO CD C -1.089 1.424 -7.067 1.00 . A A . 28 PRO CD 1 1 5 3213 1 1 28 PRO CG C -1.556 1.325 -8.490 1.00 . A A . 28 PRO CG 1 1 5 3214 1 1 28 PRO HA H -2.464 4.274 -7.458 1.00 . A A . 28 PRO HA 1 1 5 3215 1 1 28 PRO HB2 H -2.856 2.612 -9.592 1.00 . A A . 28 PRO HB2 1 1 5 3216 1 1 28 PRO HB3 H -1.294 3.327 -9.181 1.00 . A A . 28 PRO HB3 1 1 5 3217 1 1 28 PRO HD2 H -1.218 0.479 -6.560 1.00 . A A . 28 PRO HD2 1 1 5 3218 1 1 28 PRO HD3 H -0.057 1.739 -7.028 1.00 . A A . 28 PRO HD3 1 1 5 3219 1 1 28 PRO HG2 H -2.344 0.590 -8.577 1.00 . A A . 28 PRO HG2 1 1 5 3220 1 1 28 PRO HG3 H -0.731 1.072 -9.139 1.00 . A A . 28 PRO HG3 1 1 5 3221 1 1 28 PRO N N -1.975 2.453 -6.494 1.00 . A A . 28 PRO N 1 1 5 3222 1 1 28 PRO O O -4.725 2.218 -8.294 1.00 . A A . 28 PRO O 1 1 5 3223 1 1 29 SER C C -6.800 4.562 -5.377 1.00 . A A . 29 SER C 1 1 5 3224 1 1 29 SER CA C -6.311 3.615 -6.470 1.00 . A A . 29 SER CA 1 1 5 3225 1 1 29 SER CB C -6.727 2.180 -6.141 1.00 . A A . 29 SER CB 1 1 5 3226 1 1 29 SER H H -4.367 4.320 -6.022 1.00 . A A . 29 SER H 1 1 5 3227 1 1 29 SER HA H -6.755 3.905 -7.411 1.00 . A A . 29 SER HA 1 1 5 3228 1 1 29 SER HB2 H -5.884 1.650 -5.723 1.00 . A A . 29 SER HB2 1 1 5 3229 1 1 29 SER HB3 H -7.533 2.197 -5.422 1.00 . A A . 29 SER HB3 1 1 5 3230 1 1 29 SER HG H -6.869 0.583 -7.268 1.00 . A A . 29 SER HG 1 1 5 3231 1 1 29 SER N N -4.860 3.711 -6.610 1.00 . A A . 29 SER N 1 1 5 3232 1 1 29 SER O O -6.286 4.535 -4.261 1.00 . A A . 29 SER O 1 1 5 3233 1 1 29 SER OG O -7.166 1.495 -7.301 1.00 . A A . 29 SER OG 1 1 5 3234 1 1 30 PRO C C -8.611 5.777 -3.342 1.00 . A A . 30 PRO C 1 1 5 3235 1 1 30 PRO CA C -8.338 6.390 -4.719 1.00 . A A . 30 PRO CA 1 1 5 3236 1 1 30 PRO CB C -9.635 6.844 -5.387 1.00 . A A . 30 PRO CB 1 1 5 3237 1 1 30 PRO CD C -8.455 5.530 -7.001 1.00 . A A . 30 PRO CD 1 1 5 3238 1 1 30 PRO CG C -9.361 6.724 -6.845 1.00 . A A . 30 PRO CG 1 1 5 3239 1 1 30 PRO HA H -7.678 7.237 -4.604 1.00 . A A . 30 PRO HA 1 1 5 3240 1 1 30 PRO HB2 H -10.448 6.200 -5.080 1.00 . A A . 30 PRO HB2 1 1 5 3241 1 1 30 PRO HB3 H -9.851 7.864 -5.108 1.00 . A A . 30 PRO HB3 1 1 5 3242 1 1 30 PRO HD2 H -9.033 4.644 -7.217 1.00 . A A . 30 PRO HD2 1 1 5 3243 1 1 30 PRO HD3 H -7.729 5.708 -7.781 1.00 . A A . 30 PRO HD3 1 1 5 3244 1 1 30 PRO HG2 H -10.285 6.566 -7.381 1.00 . A A . 30 PRO HG2 1 1 5 3245 1 1 30 PRO HG3 H -8.867 7.617 -7.200 1.00 . A A . 30 PRO HG3 1 1 5 3246 1 1 30 PRO N N -7.793 5.422 -5.684 1.00 . A A . 30 PRO N 1 1 5 3247 1 1 30 PRO O O -7.707 5.676 -2.513 1.00 . A A . 30 PRO O 1 1 5 3248 1 1 31 LYS C C -9.953 3.289 -1.803 1.00 . A A . 31 LYS C 1 1 5 3249 1 1 31 LYS CA C -10.228 4.790 -1.812 1.00 . A A . 31 LYS CA 1 1 5 3250 1 1 31 LYS CB C -11.706 5.054 -1.511 1.00 . A A . 31 LYS CB 1 1 5 3251 1 1 31 LYS CD C -13.620 6.645 -1.856 1.00 . A A . 31 LYS CD 1 1 5 3252 1 1 31 LYS CE C -14.116 7.976 -1.315 1.00 . A A . 31 LYS CE 1 1 5 3253 1 1 31 LYS CG C -12.114 6.506 -1.698 1.00 . A A . 31 LYS CG 1 1 5 3254 1 1 31 LYS H H -10.543 5.492 -3.786 1.00 . A A . 31 LYS H 1 1 5 3255 1 1 31 LYS HA H -9.626 5.258 -1.047 1.00 . A A . 31 LYS HA 1 1 5 3256 1 1 31 LYS HB2 H -12.309 4.445 -2.167 1.00 . A A . 31 LYS HB2 1 1 5 3257 1 1 31 LYS HB3 H -11.908 4.775 -0.487 1.00 . A A . 31 LYS HB3 1 1 5 3258 1 1 31 LYS HD2 H -13.870 6.578 -2.905 1.00 . A A . 31 LYS HD2 1 1 5 3259 1 1 31 LYS HD3 H -14.104 5.845 -1.317 1.00 . A A . 31 LYS HD3 1 1 5 3260 1 1 31 LYS HE2 H -13.721 8.771 -1.931 1.00 . A A . 31 LYS HE2 1 1 5 3261 1 1 31 LYS HE3 H -15.194 7.989 -1.358 1.00 . A A . 31 LYS HE3 1 1 5 3262 1 1 31 LYS HG2 H -11.800 7.072 -0.835 1.00 . A A . 31 LYS HG2 1 1 5 3263 1 1 31 LYS HG3 H -11.631 6.895 -2.582 1.00 . A A . 31 LYS HG3 1 1 5 3264 1 1 31 LYS HZ1 H -14.339 8.842 0.572 1.00 . A A . 31 LYS HZ1 1 1 5 3265 1 1 31 LYS HZ2 H -12.729 8.606 0.115 1.00 . A A . 31 LYS HZ2 1 1 5 3266 1 1 31 LYS HZ3 H -13.670 7.289 0.606 1.00 . A A . 31 LYS HZ3 1 1 5 3267 1 1 31 LYS N N -9.858 5.380 -3.095 1.00 . A A . 31 LYS N 1 1 5 3268 1 1 31 LYS NZ N -13.683 8.194 0.093 1.00 . A A . 31 LYS NZ 1 1 5 3269 1 1 31 LYS O O -10.808 2.490 -1.419 1.00 . A A . 31 LYS O 1 1 5 3270 1 1 32 ALA C C -8.460 0.846 -0.917 1.00 . A A . 32 ALA C 1 1 5 3271 1 1 32 ALA CA C -8.354 1.514 -2.285 1.00 . A A . 32 ALA CA 1 1 5 3272 1 1 32 ALA CB C -6.933 1.394 -2.815 1.00 . A A . 32 ALA CB 1 1 5 3273 1 1 32 ALA H H -8.118 3.601 -2.529 1.00 . A A . 32 ALA H 1 1 5 3274 1 1 32 ALA HA H -9.011 1.005 -2.976 1.00 . A A . 32 ALA HA 1 1 5 3275 1 1 32 ALA HB1 H -6.737 0.368 -3.092 1.00 . A A . 32 ALA HB1 1 1 5 3276 1 1 32 ALA HB2 H -6.236 1.699 -2.048 1.00 . A A . 32 ALA HB2 1 1 5 3277 1 1 32 ALA HB3 H -6.817 2.030 -3.680 1.00 . A A . 32 ALA HB3 1 1 5 3278 1 1 32 ALA N N -8.752 2.915 -2.233 1.00 . A A . 32 ALA N 1 1 5 3279 1 1 32 ALA O O -8.519 1.516 0.114 1.00 . A A . 32 ALA O 1 1 5 3280 1 1 33 VAL C C -7.260 -2.070 0.477 1.00 . A A . 33 VAL C 1 1 5 3281 1 1 33 VAL CA C -8.542 -1.266 0.303 1.00 . A A . 33 VAL CA 1 1 5 3282 1 1 33 VAL CB C -9.746 -2.231 0.295 1.00 . A A . 33 VAL CB 1 1 5 3283 1 1 33 VAL CG1 C -10.526 -2.119 1.597 1.00 . A A . 33 VAL CG1 1 1 5 3284 1 1 33 VAL CG2 C -10.650 -1.963 -0.901 1.00 . A A . 33 VAL CG2 1 1 5 3285 1 1 33 VAL H H -8.400 -0.953 -1.777 1.00 . A A . 33 VAL H 1 1 5 3286 1 1 33 VAL HA H -8.649 -0.584 1.134 1.00 . A A . 33 VAL HA 1 1 5 3287 1 1 33 VAL HB H -9.370 -3.240 0.216 1.00 . A A . 33 VAL HB 1 1 5 3288 1 1 33 VAL HG11 H -10.870 -1.103 1.725 1.00 . A A . 33 VAL HG11 1 1 5 3289 1 1 33 VAL HG12 H -9.886 -2.390 2.423 1.00 . A A . 33 VAL HG12 1 1 5 3290 1 1 33 VAL HG13 H -11.376 -2.785 1.566 1.00 . A A . 33 VAL HG13 1 1 5 3291 1 1 33 VAL HG21 H -11.420 -1.259 -0.621 1.00 . A A . 33 VAL HG21 1 1 5 3292 1 1 33 VAL HG22 H -11.108 -2.888 -1.219 1.00 . A A . 33 VAL HG22 1 1 5 3293 1 1 33 VAL HG23 H -10.065 -1.554 -1.710 1.00 . A A . 33 VAL HG23 1 1 5 3294 1 1 33 VAL N N -8.465 -0.483 -0.923 1.00 . A A . 33 VAL N 1 1 5 3295 1 1 33 VAL O O -7.058 -3.087 -0.188 1.00 . A A . 33 VAL O 1 1 5 3296 1 1 34 CYS C C -5.254 -3.511 2.432 1.00 . A A . 34 CYS C 1 1 5 3297 1 1 34 CYS CA C -5.105 -2.240 1.599 1.00 . A A . 34 CYS CA 1 1 5 3298 1 1 34 CYS CB C -4.152 -1.262 2.295 1.00 . A A . 34 CYS CB 1 1 5 3299 1 1 34 CYS H H -6.600 -0.763 1.833 1.00 . A A . 34 CYS H 1 1 5 3300 1 1 34 CYS HA H -4.686 -2.506 0.643 1.00 . A A . 34 CYS HA 1 1 5 3301 1 1 34 CYS HB2 H -3.766 -0.570 1.563 1.00 . A A . 34 CYS HB2 1 1 5 3302 1 1 34 CYS HB3 H -4.700 -0.712 3.048 1.00 . A A . 34 CYS HB3 1 1 5 3303 1 1 34 CYS N N -6.387 -1.590 1.354 1.00 . A A . 34 CYS N 1 1 5 3304 1 1 34 CYS O O -5.524 -3.451 3.631 1.00 . A A . 34 CYS O 1 1 5 3305 1 1 34 CYS SG S -2.725 -2.048 3.112 1.00 . A A . 34 CYS SG 1 1 5 3306 1 1 35 CYS C C -4.061 -5.993 3.573 1.00 . A A . 35 CYS C 1 1 5 3307 1 1 35 CYS CA C -5.124 -5.946 2.484 1.00 . A A . 35 CYS CA 1 1 5 3308 1 1 35 CYS CB C -4.939 -7.107 1.507 1.00 . A A . 35 CYS CB 1 1 5 3309 1 1 35 CYS H H -4.809 -4.647 0.840 1.00 . A A . 35 CYS H 1 1 5 3310 1 1 35 CYS HA H -6.101 -6.015 2.943 1.00 . A A . 35 CYS HA 1 1 5 3311 1 1 35 CYS HB2 H -5.011 -6.733 0.497 1.00 . A A . 35 CYS HB2 1 1 5 3312 1 1 35 CYS HB3 H -3.960 -7.539 1.657 1.00 . A A . 35 CYS HB3 1 1 5 3313 1 1 35 CYS N N -5.044 -4.664 1.791 1.00 . A A . 35 CYS N 1 1 5 3314 1 1 35 CYS O O -2.868 -5.806 3.299 1.00 . A A . 35 CYS O 1 1 5 3315 1 1 35 CYS SG S -6.170 -8.438 1.693 1.00 . A A . 35 CYS SG 1 1 5 3316 1 1 36 ASP C C -3.191 -7.657 6.354 1.00 . A A . 36 ASP C 1 1 5 3317 1 1 36 ASP CA C -3.616 -6.244 5.961 1.00 . A A . 36 ASP CA 1 1 5 3318 1 1 36 ASP CB C -4.282 -5.561 7.156 1.00 . A A . 36 ASP CB 1 1 5 3319 1 1 36 ASP CG C -4.519 -4.083 6.919 1.00 . A A . 36 ASP CG 1 1 5 3320 1 1 36 ASP H H -5.472 -6.338 4.945 1.00 . A A . 36 ASP H 1 1 5 3321 1 1 36 ASP HA H -2.732 -5.684 5.699 1.00 . A A . 36 ASP HA 1 1 5 3322 1 1 36 ASP HB2 H -5.234 -6.033 7.347 1.00 . A A . 36 ASP HB2 1 1 5 3323 1 1 36 ASP HB3 H -3.649 -5.671 8.023 1.00 . A A . 36 ASP HB3 1 1 5 3324 1 1 36 ASP N N -4.511 -6.212 4.809 1.00 . A A . 36 ASP N 1 1 5 3325 1 1 36 ASP O O -2.276 -7.815 7.163 1.00 . A A . 36 ASP O 1 1 5 3326 1 1 36 ASP OD1 O -3.649 -3.431 6.304 1.00 . A A . 36 ASP OD1 1 1 5 3327 1 1 36 ASP OD2 O -5.577 -3.576 7.348 1.00 . A A . 36 ASP OD2 1 1 5 3328 1 1 37 ASP C C -1.974 -10.267 5.965 1.00 . A A . 37 ASP C 1 1 5 3329 1 1 37 ASP CA C -3.473 -10.061 6.133 1.00 . A A . 37 ASP CA 1 1 5 3330 1 1 37 ASP CB C -4.238 -11.045 5.245 1.00 . A A . 37 ASP CB 1 1 5 3331 1 1 37 ASP CG C -5.684 -11.201 5.668 1.00 . A A . 37 ASP CG 1 1 5 3332 1 1 37 ASP H H -4.559 -8.538 5.157 1.00 . A A . 37 ASP H 1 1 5 3333 1 1 37 ASP HA H -3.737 -10.237 7.166 1.00 . A A . 37 ASP HA 1 1 5 3334 1 1 37 ASP HB2 H -4.217 -10.691 4.226 1.00 . A A . 37 ASP HB2 1 1 5 3335 1 1 37 ASP HB3 H -3.759 -12.013 5.296 1.00 . A A . 37 ASP HB3 1 1 5 3336 1 1 37 ASP N N -3.835 -8.685 5.800 1.00 . A A . 37 ASP N 1 1 5 3337 1 1 37 ASP O O -1.317 -10.882 6.805 1.00 . A A . 37 ASP O 1 1 5 3338 1 1 37 ASP OD1 O -5.930 -11.413 6.874 1.00 . A A . 37 ASP OD1 1 1 5 3339 1 1 37 ASP OD2 O -6.571 -11.112 4.793 1.00 . A A . 37 ASP OD2 1 1 5 3340 1 1 38 MET C C 0.498 -8.466 4.117 1.00 . A A . 38 MET C 1 1 5 3341 1 1 38 MET CA C -0.022 -9.822 4.580 1.00 . A A . 38 MET CA 1 1 5 3342 1 1 38 MET CB C 0.238 -10.887 3.511 1.00 . A A . 38 MET CB 1 1 5 3343 1 1 38 MET CE C 3.357 -12.531 3.847 1.00 . A A . 38 MET CE 1 1 5 3344 1 1 38 MET CG C 0.611 -12.245 4.083 1.00 . A A . 38 MET CG 1 1 5 3345 1 1 38 MET H H -2.026 -9.242 4.255 1.00 . A A . 38 MET H 1 1 5 3346 1 1 38 MET HA H 0.489 -10.100 5.490 1.00 . A A . 38 MET HA 1 1 5 3347 1 1 38 MET HB2 H -0.654 -11.005 2.912 1.00 . A A . 38 MET HB2 1 1 5 3348 1 1 38 MET HB3 H 1.045 -10.554 2.876 1.00 . A A . 38 MET HB3 1 1 5 3349 1 1 38 MET HE1 H 3.203 -11.889 2.993 1.00 . A A . 38 MET HE1 1 1 5 3350 1 1 38 MET HE2 H 3.284 -13.564 3.539 1.00 . A A . 38 MET HE2 1 1 5 3351 1 1 38 MET HE3 H 4.336 -12.347 4.263 1.00 . A A . 38 MET HE3 1 1 5 3352 1 1 38 MET HG2 H -0.203 -12.596 4.698 1.00 . A A . 38 MET HG2 1 1 5 3353 1 1 38 MET HG3 H 0.767 -12.934 3.266 1.00 . A A . 38 MET HG3 1 1 5 3354 1 1 38 MET N N -1.443 -9.729 4.875 1.00 . A A . 38 MET N 1 1 5 3355 1 1 38 MET O O 0.890 -7.631 4.933 1.00 . A A . 38 MET O 1 1 5 3356 1 1 38 MET SD S 2.110 -12.188 5.085 1.00 . A A . 38 MET SD 1 1 5 3357 1 1 39 GLN C C 0.182 -6.754 0.894 1.00 . A A . 39 GLN C 1 1 5 3358 1 1 39 GLN CA C 0.873 -6.962 2.238 1.00 . A A . 39 GLN CA 1 1 5 3359 1 1 39 GLN CB C 2.394 -6.921 2.065 1.00 . A A . 39 GLN CB 1 1 5 3360 1 1 39 GLN CD C 4.025 -8.287 0.703 1.00 . A A . 39 GLN CD 1 1 5 3361 1 1 39 GLN CG C 3.021 -8.288 1.839 1.00 . A A . 39 GLN CG 1 1 5 3362 1 1 39 GLN H H 0.080 -8.912 2.209 1.00 . A A . 39 GLN H 1 1 5 3363 1 1 39 GLN HA H 0.570 -6.177 2.915 1.00 . A A . 39 GLN HA 1 1 5 3364 1 1 39 GLN HB2 H 2.630 -6.296 1.216 1.00 . A A . 39 GLN HB2 1 1 5 3365 1 1 39 GLN HB3 H 2.834 -6.488 2.951 1.00 . A A . 39 GLN HB3 1 1 5 3366 1 1 39 GLN HE21 H 2.554 -8.439 -0.626 1.00 . A A . 39 GLN HE21 1 1 5 3367 1 1 39 GLN HE22 H 4.153 -8.380 -1.279 1.00 . A A . 39 GLN HE22 1 1 5 3368 1 1 39 GLN HG2 H 3.525 -8.592 2.743 1.00 . A A . 39 GLN HG2 1 1 5 3369 1 1 39 GLN HG3 H 2.238 -8.995 1.608 1.00 . A A . 39 GLN HG3 1 1 5 3370 1 1 39 GLN N N 0.455 -8.234 2.809 1.00 . A A . 39 GLN N 1 1 5 3371 1 1 39 GLN NE2 N 3.527 -8.377 -0.524 1.00 . A A . 39 GLN NE2 1 1 5 3372 1 1 39 GLN O O 0.760 -7.059 -0.149 1.00 . A A . 39 GLN O 1 1 5 3373 1 1 39 GLN OE1 O 5.233 -8.206 0.926 1.00 . A A . 39 GLN OE1 1 1 5 3374 1 1 40 HIS C C -2.755 -4.916 -0.325 1.00 . A A . 40 HIS C 1 1 5 3375 1 1 40 HIS CA C -1.772 -6.077 -0.359 1.00 . A A . 40 HIS CA 1 1 5 3376 1 1 40 HIS CB C -2.504 -7.363 -0.743 1.00 . A A . 40 HIS CB 1 1 5 3377 1 1 40 HIS CD2 C -1.184 -9.329 -1.801 1.00 . A A . 40 HIS CD2 1 1 5 3378 1 1 40 HIS CE1 C -1.102 -8.586 -3.863 1.00 . A A . 40 HIS CE1 1 1 5 3379 1 1 40 HIS CG C -1.827 -8.137 -1.830 1.00 . A A . 40 HIS CG 1 1 5 3380 1 1 40 HIS H H -1.497 -6.060 1.764 1.00 . A A . 40 HIS H 1 1 5 3381 1 1 40 HIS HA H -1.032 -5.871 -1.118 1.00 . A A . 40 HIS HA 1 1 5 3382 1 1 40 HIS HB2 H -2.572 -8.002 0.126 1.00 . A A . 40 HIS HB2 1 1 5 3383 1 1 40 HIS HB3 H -3.499 -7.116 -1.080 1.00 . A A . 40 HIS HB3 1 1 5 3384 1 1 40 HIS HD1 H -2.133 -6.861 -3.479 1.00 . A A . 40 HIS HD1 1 1 5 3385 1 1 40 HIS HD2 H -1.046 -9.962 -0.937 1.00 . A A . 40 HIS HD2 1 1 5 3386 1 1 40 HIS HE1 H -0.894 -8.508 -4.919 1.00 . A A . 40 HIS HE1 1 1 5 3387 1 1 40 HIS HE2 H -0.190 -10.346 -3.346 1.00 . A A . 40 HIS HE2 1 1 5 3388 1 1 40 HIS N N -1.058 -6.265 0.904 1.00 . A A . 40 HIS N 1 1 5 3389 1 1 40 HIS ND1 N -1.757 -7.698 -3.136 1.00 . A A . 40 HIS ND1 1 1 5 3390 1 1 40 HIS NE2 N -0.744 -9.584 -3.077 1.00 . A A . 40 HIS NE2 1 1 5 3391 1 1 40 HIS O O -2.823 -4.162 0.645 1.00 . A A . 40 HIS O 1 1 5 3392 1 1 41 CYS C C -5.264 -3.912 -2.884 1.00 . A A . 41 CYS C 1 1 5 3393 1 1 41 CYS CA C -4.506 -3.736 -1.572 1.00 . A A . 41 CYS CA 1 1 5 3394 1 1 41 CYS CB C -3.838 -2.361 -1.544 1.00 . A A . 41 CYS CB 1 1 5 3395 1 1 41 CYS H H -3.386 -5.431 -2.148 1.00 . A A . 41 CYS H 1 1 5 3396 1 1 41 CYS HA H -5.203 -3.810 -0.752 1.00 . A A . 41 CYS HA 1 1 5 3397 1 1 41 CYS HB2 H -4.536 -1.637 -1.152 1.00 . A A . 41 CYS HB2 1 1 5 3398 1 1 41 CYS HB3 H -2.971 -2.404 -0.900 1.00 . A A . 41 CYS HB3 1 1 5 3399 1 1 41 CYS N N -3.510 -4.790 -1.418 1.00 . A A . 41 CYS N 1 1 5 3400 1 1 41 CYS O O -4.779 -4.571 -3.804 1.00 . A A . 41 CYS O 1 1 5 3401 1 1 41 CYS SG S -3.288 -1.772 -3.176 1.00 . A A . 41 CYS SG 1 1 5 3402 1 1 42 CYS C C -8.028 -2.133 -4.458 1.00 . A A . 42 CYS C 1 1 5 3403 1 1 42 CYS CA C -7.262 -3.426 -4.184 1.00 . A A . 42 CYS CA 1 1 5 3404 1 1 42 CYS CB C -8.234 -4.600 -4.075 1.00 . A A . 42 CYS CB 1 1 5 3405 1 1 42 CYS H H -6.794 -2.808 -2.207 1.00 . A A . 42 CYS H 1 1 5 3406 1 1 42 CYS HA H -6.590 -3.608 -5.010 1.00 . A A . 42 CYS HA 1 1 5 3407 1 1 42 CYS HB2 H -8.527 -4.723 -3.043 1.00 . A A . 42 CYS HB2 1 1 5 3408 1 1 42 CYS HB3 H -9.110 -4.390 -4.670 1.00 . A A . 42 CYS HB3 1 1 5 3409 1 1 42 CYS N N -6.454 -3.322 -2.971 1.00 . A A . 42 CYS N 1 1 5 3410 1 1 42 CYS O O -8.247 -1.330 -3.555 1.00 . A A . 42 CYS O 1 1 5 3411 1 1 42 CYS SG S -7.538 -6.181 -4.650 1.00 . A A . 42 CYS SG 1 1 5 3412 1 1 43 PRO C C -10.442 -0.477 -5.295 1.00 . A A . 43 PRO C 1 1 5 3413 1 1 43 PRO CA C -9.173 -0.700 -6.114 1.00 . A A . 43 PRO CA 1 1 5 3414 1 1 43 PRO CB C -9.525 -0.957 -7.582 1.00 . A A . 43 PRO CB 1 1 5 3415 1 1 43 PRO CD C -8.208 -2.806 -6.870 1.00 . A A . 43 PRO CD 1 1 5 3416 1 1 43 PRO CG C -8.492 -1.920 -8.049 1.00 . A A . 43 PRO CG 1 1 5 3417 1 1 43 PRO HA H -8.547 0.178 -6.045 1.00 . A A . 43 PRO HA 1 1 5 3418 1 1 43 PRO HB2 H -10.519 -1.377 -7.648 1.00 . A A . 43 PRO HB2 1 1 5 3419 1 1 43 PRO HB3 H -9.481 -0.031 -8.135 1.00 . A A . 43 PRO HB3 1 1 5 3420 1 1 43 PRO HD2 H -8.892 -3.641 -6.852 1.00 . A A . 43 PRO HD2 1 1 5 3421 1 1 43 PRO HD3 H -7.185 -3.151 -6.893 1.00 . A A . 43 PRO HD3 1 1 5 3422 1 1 43 PRO HG2 H -8.875 -2.502 -8.875 1.00 . A A . 43 PRO HG2 1 1 5 3423 1 1 43 PRO HG3 H -7.600 -1.388 -8.340 1.00 . A A . 43 PRO HG3 1 1 5 3424 1 1 43 PRO N N -8.438 -1.909 -5.721 1.00 . A A . 43 PRO N 1 1 5 3425 1 1 43 PRO O O -11.194 -1.416 -5.011 1.00 . A A . 43 PRO O 1 1 5 3426 1 1 44 ALA C C -13.080 0.454 -4.613 1.00 . A A . 44 ALA C 1 1 5 3427 1 1 44 ALA CA C -11.826 1.170 -4.130 1.00 . A A . 44 ALA CA 1 1 5 3428 1 1 44 ALA CB C -12.027 2.677 -4.192 1.00 . A A . 44 ALA CB 1 1 5 3429 1 1 44 ALA H H -10.008 1.468 -5.174 1.00 . A A . 44 ALA H 1 1 5 3430 1 1 44 ALA HA H -11.640 0.897 -3.102 1.00 . A A . 44 ALA HA 1 1 5 3431 1 1 44 ALA HB1 H -12.407 3.028 -3.245 1.00 . A A . 44 ALA HB1 1 1 5 3432 1 1 44 ALA HB2 H -12.733 2.915 -4.975 1.00 . A A . 44 ALA HB2 1 1 5 3433 1 1 44 ALA HB3 H -11.082 3.157 -4.401 1.00 . A A . 44 ALA HB3 1 1 5 3434 1 1 44 ALA N N -10.661 0.783 -4.918 1.00 . A A . 44 ALA N 1 1 5 3435 1 1 44 ALA O O -13.471 0.577 -5.775 1.00 . A A . 44 ALA O 1 1 5 3436 1 1 45 GLY C C -14.735 -2.518 -4.005 1.00 . A A . 45 GLY C 1 1 5 3437 1 1 45 GLY CA C -14.912 -1.014 -4.063 1.00 . A A . 45 GLY CA 1 1 5 3438 1 1 45 GLY H H -13.350 -0.345 -2.802 1.00 . A A . 45 GLY H 1 1 5 3439 1 1 45 GLY HA2 H -15.699 -0.730 -3.379 1.00 . A A . 45 GLY HA2 1 1 5 3440 1 1 45 GLY HA3 H -15.206 -0.736 -5.065 1.00 . A A . 45 GLY HA3 1 1 5 3441 1 1 45 GLY N N -13.707 -0.291 -3.713 1.00 . A A . 45 GLY N 1 1 5 3442 1 1 45 GLY O O -15.718 -3.260 -4.031 1.00 . A A . 45 GLY O 1 1 5 3443 1 1 46 TYR C C -12.982 -4.848 -2.407 1.00 . A A . 46 TYR C 1 1 5 3444 1 1 46 TYR CA C -13.214 -4.411 -3.850 1.00 . A A . 46 TYR CA 1 1 5 3445 1 1 46 TYR CB C -11.991 -4.768 -4.699 1.00 . A A . 46 TYR CB 1 1 5 3446 1 1 46 TYR CD1 C -12.053 -5.889 -6.961 1.00 . A A . 46 TYR CD1 1 1 5 3447 1 1 46 TYR CD2 C -12.684 -3.594 -6.830 1.00 . A A . 46 TYR CD2 1 1 5 3448 1 1 46 TYR CE1 C -12.284 -5.878 -8.324 1.00 . A A . 46 TYR CE1 1 1 5 3449 1 1 46 TYR CE2 C -12.918 -3.576 -8.191 1.00 . A A . 46 TYR CE2 1 1 5 3450 1 1 46 TYR CG C -12.249 -4.749 -6.191 1.00 . A A . 46 TYR CG 1 1 5 3451 1 1 46 TYR CZ C -12.715 -4.720 -8.933 1.00 . A A . 46 TYR CZ 1 1 5 3452 1 1 46 TYR H H -12.731 -2.347 -3.894 1.00 . A A . 46 TYR H 1 1 5 3453 1 1 46 TYR HA H -14.076 -4.932 -4.238 1.00 . A A . 46 TYR HA 1 1 5 3454 1 1 46 TYR HB2 H -11.199 -4.066 -4.492 1.00 . A A . 46 TYR HB2 1 1 5 3455 1 1 46 TYR HB3 H -11.659 -5.762 -4.434 1.00 . A A . 46 TYR HB3 1 1 5 3456 1 1 46 TYR HD1 H -11.716 -6.794 -6.480 1.00 . A A . 46 TYR HD1 1 1 5 3457 1 1 46 TYR HD2 H -12.842 -2.699 -6.245 1.00 . A A . 46 TYR HD2 1 1 5 3458 1 1 46 TYR HE1 H -12.126 -6.774 -8.904 1.00 . A A . 46 TYR HE1 1 1 5 3459 1 1 46 TYR HE2 H -13.256 -2.668 -8.670 1.00 . A A . 46 TYR HE2 1 1 5 3460 1 1 46 TYR HH H -13.643 -4.080 -10.491 1.00 . A A . 46 TYR HH 1 1 5 3461 1 1 46 TYR N N -13.487 -2.977 -3.920 1.00 . A A . 46 TYR N 1 1 5 3462 1 1 46 TYR O O -12.816 -4.015 -1.515 1.00 . A A . 46 TYR O 1 1 5 3463 1 1 46 TYR OH O -12.945 -4.706 -10.290 1.00 . A A . 46 TYR OH 1 1 5 3464 1 1 47 LYS C C -11.689 -7.791 -0.866 1.00 . A A . 47 LYS C 1 1 5 3465 1 1 47 LYS CA C -12.760 -6.704 -0.848 1.00 . A A . 47 LYS CA 1 1 5 3466 1 1 47 LYS CB C -14.068 -7.267 -0.288 1.00 . A A . 47 LYS CB 1 1 5 3467 1 1 47 LYS CD C -14.231 -8.294 2.000 1.00 . A A . 47 LYS CD 1 1 5 3468 1 1 47 LYS CE C -15.599 -8.955 2.037 1.00 . A A . 47 LYS CE 1 1 5 3469 1 1 47 LYS CG C -14.257 -7.004 1.196 1.00 . A A . 47 LYS CG 1 1 5 3470 1 1 47 LYS H H -13.115 -6.770 -2.937 1.00 . A A . 47 LYS H 1 1 5 3471 1 1 47 LYS HA H -12.425 -5.898 -0.212 1.00 . A A . 47 LYS HA 1 1 5 3472 1 1 47 LYS HB2 H -14.895 -6.820 -0.820 1.00 . A A . 47 LYS HB2 1 1 5 3473 1 1 47 LYS HB3 H -14.084 -8.334 -0.448 1.00 . A A . 47 LYS HB3 1 1 5 3474 1 1 47 LYS HD2 H -13.525 -8.974 1.546 1.00 . A A . 47 LYS HD2 1 1 5 3475 1 1 47 LYS HD3 H -13.920 -8.071 3.010 1.00 . A A . 47 LYS HD3 1 1 5 3476 1 1 47 LYS HE2 H -16.108 -8.751 1.107 1.00 . A A . 47 LYS HE2 1 1 5 3477 1 1 47 LYS HE3 H -15.466 -10.022 2.147 1.00 . A A . 47 LYS HE3 1 1 5 3478 1 1 47 LYS HG2 H -13.463 -6.360 1.542 1.00 . A A . 47 LYS HG2 1 1 5 3479 1 1 47 LYS HG3 H -15.210 -6.517 1.346 1.00 . A A . 47 LYS HG3 1 1 5 3480 1 1 47 LYS HZ1 H -16.377 -7.413 3.210 1.00 . A A . 47 LYS HZ1 1 1 5 3481 1 1 47 LYS HZ2 H -16.085 -8.842 4.064 1.00 . A A . 47 LYS HZ2 1 1 5 3482 1 1 47 LYS HZ3 H -17.420 -8.733 3.033 1.00 . A A . 47 LYS HZ3 1 1 5 3483 1 1 47 LYS N N -12.973 -6.157 -2.185 1.00 . A A . 47 LYS N 1 1 5 3484 1 1 47 LYS NZ N -16.429 -8.450 3.165 1.00 . A A . 47 LYS NZ 1 1 5 3485 1 1 47 LYS O O -11.377 -8.348 -1.918 1.00 . A A . 47 LYS O 1 1 5 3486 1 1 48 CYS C C -10.718 -10.496 0.562 1.00 . A A . 48 CYS C 1 1 5 3487 1 1 48 CYS CA C -10.095 -9.111 0.418 1.00 . A A . 48 CYS CA 1 1 5 3488 1 1 48 CYS CB C -9.183 -8.814 1.611 1.00 . A A . 48 CYS CB 1 1 5 3489 1 1 48 CYS H H -11.420 -7.610 1.107 1.00 . A A . 48 CYS H 1 1 5 3490 1 1 48 CYS HA H -9.506 -9.088 -0.487 1.00 . A A . 48 CYS HA 1 1 5 3491 1 1 48 CYS HB2 H -9.788 -8.485 2.444 1.00 . A A . 48 CYS HB2 1 1 5 3492 1 1 48 CYS HB3 H -8.659 -9.716 1.888 1.00 . A A . 48 CYS HB3 1 1 5 3493 1 1 48 CYS N N -11.129 -8.088 0.303 1.00 . A A . 48 CYS N 1 1 5 3494 1 1 48 CYS O O -11.654 -10.686 1.341 1.00 . A A . 48 CYS O 1 1 5 3495 1 1 48 CYS SG S -7.937 -7.522 1.291 1.00 . A A . 48 CYS SG 1 1 5 3496 1 1 49 GLY C C -9.734 -13.807 0.436 1.00 . A A . 49 GLY C 1 1 5 3497 1 1 49 GLY CA C -10.725 -12.811 -0.140 1.00 . A A . 49 GLY CA 1 1 5 3498 1 1 49 GLY H H -9.458 -11.247 -0.800 1.00 . A A . 49 GLY H 1 1 5 3499 1 1 49 GLY HA2 H -11.615 -12.814 0.471 1.00 . A A . 49 GLY HA2 1 1 5 3500 1 1 49 GLY HA3 H -10.990 -13.121 -1.141 1.00 . A A . 49 GLY HA3 1 1 5 3501 1 1 49 GLY N N -10.200 -11.458 -0.195 1.00 . A A . 49 GLY N 1 1 5 3502 1 1 49 GLY O O -8.551 -13.496 0.578 1.00 . A A . 49 GLY O 1 1 5 3503 1 1 50 PRO C C -8.399 -16.683 0.308 1.00 . A A . 50 PRO C 1 1 5 3504 1 1 50 PRO CA C -9.331 -16.065 1.347 1.00 . A A . 50 PRO CA 1 1 5 3505 1 1 50 PRO CB C -10.325 -17.109 1.858 1.00 . A A . 50 PRO CB 1 1 5 3506 1 1 50 PRO CD C -11.594 -15.477 0.647 1.00 . A A . 50 PRO CD 1 1 5 3507 1 1 50 PRO CG C -11.531 -16.938 1.000 1.00 . A A . 50 PRO CG 1 1 5 3508 1 1 50 PRO HA H -8.746 -15.688 2.172 1.00 . A A . 50 PRO HA 1 1 5 3509 1 1 50 PRO HB2 H -9.901 -18.097 1.750 1.00 . A A . 50 PRO HB2 1 1 5 3510 1 1 50 PRO HB3 H -10.550 -16.920 2.896 1.00 . A A . 50 PRO HB3 1 1 5 3511 1 1 50 PRO HD2 H -11.944 -15.348 -0.367 1.00 . A A . 50 PRO HD2 1 1 5 3512 1 1 50 PRO HD3 H -12.234 -14.949 1.338 1.00 . A A . 50 PRO HD3 1 1 5 3513 1 1 50 PRO HG2 H -11.434 -17.536 0.105 1.00 . A A . 50 PRO HG2 1 1 5 3514 1 1 50 PRO HG3 H -12.415 -17.228 1.550 1.00 . A A . 50 PRO HG3 1 1 5 3515 1 1 50 PRO N N -10.194 -15.024 0.780 1.00 . A A . 50 PRO N 1 1 5 3516 1 1 50 PRO O O -7.338 -17.208 0.648 1.00 . A A . 50 PRO O 1 1 5 3517 1 1 51 GLY C C -6.932 -16.222 -2.523 1.00 . A A . 51 GLY C 1 1 5 3518 1 1 51 GLY CA C -7.993 -17.183 -2.024 1.00 . A A . 51 GLY CA 1 1 5 3519 1 1 51 GLY H H -9.659 -16.195 -1.169 1.00 . A A . 51 GLY H 1 1 5 3520 1 1 51 GLY HA2 H -7.509 -18.076 -1.659 1.00 . A A . 51 GLY HA2 1 1 5 3521 1 1 51 GLY HA3 H -8.638 -17.449 -2.848 1.00 . A A . 51 GLY HA3 1 1 5 3522 1 1 51 GLY N N -8.804 -16.622 -0.957 1.00 . A A . 51 GLY N 1 1 5 3523 1 1 51 GLY O O -6.458 -16.344 -3.653 1.00 . A A . 51 GLY O 1 1 5 3524 1 1 52 GLY C C -6.001 -13.388 -3.189 1.00 . A A . 52 GLY C 1 1 5 3525 1 1 52 GLY CA C -5.544 -14.295 -2.062 1.00 . A A . 52 GLY CA 1 1 5 3526 1 1 52 GLY H H -6.966 -15.217 -0.792 1.00 . A A . 52 GLY H 1 1 5 3527 1 1 52 GLY HA2 H -5.301 -13.688 -1.202 1.00 . A A . 52 GLY HA2 1 1 5 3528 1 1 52 GLY HA3 H -4.657 -14.823 -2.378 1.00 . A A . 52 GLY HA3 1 1 5 3529 1 1 52 GLY N N -6.555 -15.264 -1.680 1.00 . A A . 52 GLY N 1 1 5 3530 1 1 52 GLY O O -5.203 -12.638 -3.751 1.00 . A A . 52 GLY O 1 1 5 3531 1 1 53 THR C C -8.891 -11.666 -4.017 1.00 . A A . 53 THR C 1 1 5 3532 1 1 53 THR CA C -7.852 -12.630 -4.577 1.00 . A A . 53 THR CA 1 1 5 3533 1 1 53 THR CB C -8.503 -13.493 -5.674 1.00 . A A . 53 THR CB 1 1 5 3534 1 1 53 THR CG2 C -7.444 -14.237 -6.474 1.00 . A A . 53 THR CG2 1 1 5 3535 1 1 53 THR H H -7.874 -14.069 -3.027 1.00 . A A . 53 THR H 1 1 5 3536 1 1 53 THR HA H -7.048 -12.061 -5.022 1.00 . A A . 53 THR HA 1 1 5 3537 1 1 53 THR HB H -9.050 -12.846 -6.344 1.00 . A A . 53 THR HB 1 1 5 3538 1 1 53 THR HG1 H -9.803 -14.053 -4.299 1.00 . A A . 53 THR HG1 1 1 5 3539 1 1 53 THR HG21 H -7.630 -14.101 -7.530 1.00 . A A . 53 THR HG21 1 1 5 3540 1 1 53 THR HG22 H -7.483 -15.288 -6.235 1.00 . A A . 53 THR HG22 1 1 5 3541 1 1 53 THR HG23 H -6.466 -13.847 -6.229 1.00 . A A . 53 THR HG23 1 1 5 3542 1 1 53 THR N N -7.288 -13.454 -3.515 1.00 . A A . 53 THR N 1 1 5 3543 1 1 53 THR O O -9.366 -11.836 -2.894 1.00 . A A . 53 THR O 1 1 5 3544 1 1 53 THR OG1 O -9.411 -14.434 -5.087 1.00 . A A . 53 THR OG1 1 1 5 3545 1 1 54 CYS C C -11.583 -9.922 -4.984 1.00 . A A . 54 CYS C 1 1 5 3546 1 1 54 CYS CA C -10.214 -9.659 -4.367 1.00 . A A . 54 CYS CA 1 1 5 3547 1 1 54 CYS CB C -9.741 -8.252 -4.723 1.00 . A A . 54 CYS CB 1 1 5 3548 1 1 54 CYS H H -8.820 -10.559 -5.683 1.00 . A A . 54 CYS H 1 1 5 3549 1 1 54 CYS HA H -10.302 -9.735 -3.294 1.00 . A A . 54 CYS HA 1 1 5 3550 1 1 54 CYS HB2 H -9.283 -8.269 -5.701 1.00 . A A . 54 CYS HB2 1 1 5 3551 1 1 54 CYS HB3 H -10.592 -7.587 -4.740 1.00 . A A . 54 CYS HB3 1 1 5 3552 1 1 54 CYS N N -9.236 -10.649 -4.800 1.00 . A A . 54 CYS N 1 1 5 3553 1 1 54 CYS O O -11.691 -10.508 -6.062 1.00 . A A . 54 CYS O 1 1 5 3554 1 1 54 CYS SG S -8.525 -7.568 -3.553 1.00 . A A . 54 CYS SG 1 1 5 3555 1 1 55 ILE C C -14.654 -8.338 -5.069 1.00 . A A . 55 ILE C 1 1 5 3556 1 1 55 ILE CA C -13.994 -9.673 -4.746 1.00 . A A . 55 ILE CA 1 1 5 3557 1 1 55 ILE CB C -14.848 -10.417 -3.700 1.00 . A A . 55 ILE CB 1 1 5 3558 1 1 55 ILE CD1 C -15.212 -10.698 -1.190 1.00 . A A . 55 ILE CD1 1 1 5 3559 1 1 55 ILE CG1 C -14.333 -10.131 -2.285 1.00 . A A . 55 ILE CG1 1 1 5 3560 1 1 55 ILE CG2 C -14.840 -11.914 -3.980 1.00 . A A . 55 ILE CG2 1 1 5 3561 1 1 55 ILE H H -12.462 -9.035 -3.429 1.00 . A A . 55 ILE H 1 1 5 3562 1 1 55 ILE HA H -13.962 -10.272 -5.644 1.00 . A A . 55 ILE HA 1 1 5 3563 1 1 55 ILE HB H -15.865 -10.067 -3.784 1.00 . A A . 55 ILE HB 1 1 5 3564 1 1 55 ILE HD11 H -15.014 -10.178 -0.264 1.00 . A A . 55 ILE HD11 1 1 5 3565 1 1 55 ILE HD12 H -14.997 -11.749 -1.064 1.00 . A A . 55 ILE HD12 1 1 5 3566 1 1 55 ILE HD13 H -16.251 -10.573 -1.459 1.00 . A A . 55 ILE HD13 1 1 5 3567 1 1 55 ILE HG12 H -13.350 -10.559 -2.174 1.00 . A A . 55 ILE HG12 1 1 5 3568 1 1 55 ILE HG13 H -14.273 -9.062 -2.142 1.00 . A A . 55 ILE HG13 1 1 5 3569 1 1 55 ILE HG21 H -15.667 -12.381 -3.466 1.00 . A A . 55 ILE HG21 1 1 5 3570 1 1 55 ILE HG22 H -13.911 -12.340 -3.631 1.00 . A A . 55 ILE HG22 1 1 5 3571 1 1 55 ILE HG23 H -14.936 -12.082 -5.043 1.00 . A A . 55 ILE HG23 1 1 5 3572 1 1 55 ILE N N -12.624 -9.486 -4.284 1.00 . A A . 55 ILE N 1 1 5 3573 1 1 55 ILE O O -14.369 -7.320 -4.436 1.00 . A A . 55 ILE O 1 1 5 3574 1 1 56 SER C C -17.481 -6.919 -5.603 1.00 . A A . 56 SER C 1 1 5 3575 1 1 56 SER CA C -16.251 -7.152 -6.475 1.00 . A A . 56 SER CA 1 1 5 3576 1 1 56 SER CB C -16.667 -7.258 -7.944 1.00 . A A . 56 SER CB 1 1 5 3577 1 1 56 SER H H -15.717 -9.203 -6.518 1.00 . A A . 56 SER H 1 1 5 3578 1 1 56 SER HA H -15.580 -6.315 -6.361 1.00 . A A . 56 SER HA 1 1 5 3579 1 1 56 SER HB2 H -17.708 -6.987 -8.043 1.00 . A A . 56 SER HB2 1 1 5 3580 1 1 56 SER HB3 H -16.064 -6.585 -8.536 1.00 . A A . 56 SER HB3 1 1 5 3581 1 1 56 SER HG H -17.005 -9.187 -7.896 1.00 . A A . 56 SER HG 1 1 5 3582 1 1 56 SER N N -15.540 -8.355 -6.059 1.00 . A A . 56 SER N 1 1 5 3583 1 1 56 SER O O -17.748 -7.765 -4.724 1.00 . A A . 56 SER O 1 1 5 3584 1 1 56 SER OXT O -18.163 -5.894 -5.806 1.00 . A A . 56 SER OXT 1 1 5 3585 1 1 56 SER OG O -16.493 -8.577 -8.431 1.00 . A A . 56 SER OG 1 1 6 3586 1 1 1 ASP C C 2.582 14.303 -2.471 1.00 . A A . 1 ASP C 1 1 6 3587 1 1 1 ASP CA C 3.911 14.571 -3.170 1.00 . A A . 1 ASP CA 1 1 6 3588 1 1 1 ASP CB C 5.075 14.110 -2.291 1.00 . A A . 1 ASP CB 1 1 6 3589 1 1 1 ASP CG C 5.259 14.988 -1.068 1.00 . A A . 1 ASP CG 1 1 6 3590 1 1 1 ASP H1 H 3.248 16.383 -3.965 1.00 . A A . 1 ASP H1 1 1 6 3591 1 1 1 ASP H2 H 4.923 16.167 -4.055 1.00 . A A . 1 ASP H2 1 1 6 3592 1 1 1 ASP H3 H 4.198 16.550 -2.574 1.00 . A A . 1 ASP H3 1 1 6 3593 1 1 1 ASP HA H 3.934 14.028 -4.104 1.00 . A A . 1 ASP HA 1 1 6 3594 1 1 1 ASP HB2 H 4.891 13.099 -1.961 1.00 . A A . 1 ASP HB2 1 1 6 3595 1 1 1 ASP HB3 H 5.986 14.135 -2.870 1.00 . A A . 1 ASP HB3 1 1 6 3596 1 1 1 ASP N N 4.082 16.019 -3.461 1.00 . A A . 1 ASP N 1 1 6 3597 1 1 1 ASP O O 1.779 15.215 -2.276 1.00 . A A . 1 ASP O 1 1 6 3598 1 1 1 ASP OD1 O 4.850 14.564 0.033 1.00 . A A . 1 ASP OD1 1 1 6 3599 1 1 1 ASP OD2 O 5.813 16.098 -1.212 1.00 . A A . 1 ASP OD2 1 1 6 3600 1 1 2 VAL C C 1.411 12.053 -0.052 1.00 . A A . 2 VAL C 1 1 6 3601 1 1 2 VAL CA C 1.121 12.661 -1.421 1.00 . A A . 2 VAL CA 1 1 6 3602 1 1 2 VAL CB C 0.306 11.654 -2.258 1.00 . A A . 2 VAL CB 1 1 6 3603 1 1 2 VAL CG1 C -1.148 11.644 -1.816 1.00 . A A . 2 VAL CG1 1 1 6 3604 1 1 2 VAL CG2 C 0.416 11.976 -3.741 1.00 . A A . 2 VAL CG2 1 1 6 3605 1 1 2 VAL H H 3.032 12.363 -2.282 1.00 . A A . 2 VAL H 1 1 6 3606 1 1 2 VAL HA H 0.524 13.552 -1.287 1.00 . A A . 2 VAL HA 1 1 6 3607 1 1 2 VAL HB H 0.716 10.668 -2.095 1.00 . A A . 2 VAL HB 1 1 6 3608 1 1 2 VAL HG11 H -1.200 11.750 -0.743 1.00 . A A . 2 VAL HG11 1 1 6 3609 1 1 2 VAL HG12 H -1.607 10.710 -2.108 1.00 . A A . 2 VAL HG12 1 1 6 3610 1 1 2 VAL HG13 H -1.673 12.464 -2.284 1.00 . A A . 2 VAL HG13 1 1 6 3611 1 1 2 VAL HG21 H -0.537 12.333 -4.103 1.00 . A A . 2 VAL HG21 1 1 6 3612 1 1 2 VAL HG22 H 0.698 11.087 -4.283 1.00 . A A . 2 VAL HG22 1 1 6 3613 1 1 2 VAL HG23 H 1.165 12.740 -3.889 1.00 . A A . 2 VAL HG23 1 1 6 3614 1 1 2 VAL N N 2.355 13.047 -2.098 1.00 . A A . 2 VAL N 1 1 6 3615 1 1 2 VAL O O 1.126 10.879 0.186 1.00 . A A . 2 VAL O 1 1 6 3616 1 1 3 GLN C C 1.395 11.365 2.715 1.00 . A A . 3 GLN C 1 1 6 3617 1 1 3 GLN CA C 2.348 12.435 2.190 1.00 . A A . 3 GLN CA 1 1 6 3618 1 1 3 GLN CB C 2.359 13.632 3.146 1.00 . A A . 3 GLN CB 1 1 6 3619 1 1 3 GLN CD C 0.523 15.331 3.520 1.00 . A A . 3 GLN CD 1 1 6 3620 1 1 3 GLN CG C 1.639 14.859 2.607 1.00 . A A . 3 GLN CG 1 1 6 3621 1 1 3 GLN H H 2.205 13.782 0.561 1.00 . A A . 3 GLN H 1 1 6 3622 1 1 3 GLN HA H 3.344 12.017 2.148 1.00 . A A . 3 GLN HA 1 1 6 3623 1 1 3 GLN HB2 H 1.885 13.342 4.071 1.00 . A A . 3 GLN HB2 1 1 6 3624 1 1 3 GLN HB3 H 3.384 13.906 3.350 1.00 . A A . 3 GLN HB3 1 1 6 3625 1 1 3 GLN HE21 H 0.937 17.226 3.086 1.00 . A A . 3 GLN HE21 1 1 6 3626 1 1 3 GLN HE22 H -0.368 16.976 4.192 1.00 . A A . 3 GLN HE22 1 1 6 3627 1 1 3 GLN HG2 H 2.353 15.660 2.497 1.00 . A A . 3 GLN HG2 1 1 6 3628 1 1 3 GLN HG3 H 1.217 14.619 1.642 1.00 . A A . 3 GLN HG3 1 1 6 3629 1 1 3 GLN N N 1.994 12.866 0.833 1.00 . A A . 3 GLN N 1 1 6 3630 1 1 3 GLN NE2 N 0.346 16.644 3.608 1.00 . A A . 3 GLN NE2 1 1 6 3631 1 1 3 GLN O O 0.213 11.624 2.940 1.00 . A A . 3 GLN O 1 1 6 3632 1 1 3 GLN OE1 O -0.172 14.524 4.139 1.00 . A A . 3 GLN OE1 1 1 6 3633 1 1 4 CYS C C 0.626 9.293 4.809 1.00 . A A . 4 CYS C 1 1 6 3634 1 1 4 CYS CA C 1.135 9.035 3.396 1.00 . A A . 4 CYS CA 1 1 6 3635 1 1 4 CYS CB C 1.976 7.757 3.374 1.00 . A A . 4 CYS CB 1 1 6 3636 1 1 4 CYS H H 2.873 10.020 2.700 1.00 . A A . 4 CYS H 1 1 6 3637 1 1 4 CYS HA H 0.289 8.910 2.738 1.00 . A A . 4 CYS HA 1 1 6 3638 1 1 4 CYS HB2 H 2.809 7.870 4.052 1.00 . A A . 4 CYS HB2 1 1 6 3639 1 1 4 CYS HB3 H 1.365 6.927 3.697 1.00 . A A . 4 CYS HB3 1 1 6 3640 1 1 4 CYS N N 1.924 10.159 2.903 1.00 . A A . 4 CYS N 1 1 6 3641 1 1 4 CYS O O -0.549 9.599 5.013 1.00 . A A . 4 CYS O 1 1 6 3642 1 1 4 CYS SG S 2.652 7.347 1.736 1.00 . A A . 4 CYS SG 1 1 6 3643 1 1 5 GLY C C 2.380 9.646 8.023 1.00 . A A . 5 GLY C 1 1 6 3644 1 1 5 GLY CA C 1.162 9.384 7.167 1.00 . A A . 5 GLY CA 1 1 6 3645 1 1 5 GLY H H 2.442 8.923 5.554 1.00 . A A . 5 GLY H 1 1 6 3646 1 1 5 GLY HA2 H 0.498 10.233 7.229 1.00 . A A . 5 GLY HA2 1 1 6 3647 1 1 5 GLY HA3 H 0.651 8.509 7.541 1.00 . A A . 5 GLY HA3 1 1 6 3648 1 1 5 GLY N N 1.521 9.166 5.780 1.00 . A A . 5 GLY N 1 1 6 3649 1 1 5 GLY O O 2.595 10.769 8.482 1.00 . A A . 5 GLY O 1 1 6 3650 1 1 6 GLY C C 5.435 9.605 8.323 1.00 . A A . 6 GLY C 1 1 6 3651 1 1 6 GLY CA C 4.391 8.758 9.023 1.00 . A A . 6 GLY CA 1 1 6 3652 1 1 6 GLY H H 2.975 7.739 7.834 1.00 . A A . 6 GLY H 1 1 6 3653 1 1 6 GLY HA2 H 4.135 9.223 9.964 1.00 . A A . 6 GLY HA2 1 1 6 3654 1 1 6 GLY HA3 H 4.807 7.780 9.215 1.00 . A A . 6 GLY HA3 1 1 6 3655 1 1 6 GLY N N 3.189 8.611 8.229 1.00 . A A . 6 GLY N 1 1 6 3656 1 1 6 GLY O O 5.780 10.689 8.795 1.00 . A A . 6 GLY O 1 1 6 3657 1 1 7 GLY C C 7.157 9.352 5.036 1.00 . A A . 7 GLY C 1 1 6 3658 1 1 7 GLY CA C 6.946 9.854 6.455 1.00 . A A . 7 GLY CA 1 1 6 3659 1 1 7 GLY H H 5.635 8.241 6.864 1.00 . A A . 7 GLY H 1 1 6 3660 1 1 7 GLY HA2 H 6.648 10.891 6.413 1.00 . A A . 7 GLY HA2 1 1 6 3661 1 1 7 GLY HA3 H 7.885 9.787 6.988 1.00 . A A . 7 GLY HA3 1 1 6 3662 1 1 7 GLY N N 5.941 9.112 7.193 1.00 . A A . 7 GLY N 1 1 6 3663 1 1 7 GLY O O 8.173 9.665 4.416 1.00 . A A . 7 GLY O 1 1 6 3664 1 1 8 PHE C C 5.664 8.993 2.146 1.00 . A A . 8 PHE C 1 1 6 3665 1 1 8 PHE CA C 6.333 8.059 3.151 1.00 . A A . 8 PHE CA 1 1 6 3666 1 1 8 PHE CB C 5.728 6.659 3.050 1.00 . A A . 8 PHE CB 1 1 6 3667 1 1 8 PHE CD1 C 7.106 4.639 2.493 1.00 . A A . 8 PHE CD1 1 1 6 3668 1 1 8 PHE CD2 C 7.155 5.460 4.732 1.00 . A A . 8 PHE CD2 1 1 6 3669 1 1 8 PHE CE1 C 7.983 3.629 2.841 1.00 . A A . 8 PHE CE1 1 1 6 3670 1 1 8 PHE CE2 C 8.032 4.452 5.085 1.00 . A A . 8 PHE CE2 1 1 6 3671 1 1 8 PHE CG C 6.683 5.564 3.433 1.00 . A A . 8 PHE CG 1 1 6 3672 1 1 8 PHE CZ C 8.447 3.536 4.139 1.00 . A A . 8 PHE CZ 1 1 6 3673 1 1 8 PHE H H 5.410 8.354 5.040 1.00 . A A . 8 PHE H 1 1 6 3674 1 1 8 PHE HA H 7.385 8.000 2.919 1.00 . A A . 8 PHE HA 1 1 6 3675 1 1 8 PHE HB2 H 4.871 6.598 3.701 1.00 . A A . 8 PHE HB2 1 1 6 3676 1 1 8 PHE HB3 H 5.413 6.485 2.031 1.00 . A A . 8 PHE HB3 1 1 6 3677 1 1 8 PHE HD1 H 6.745 4.712 1.477 1.00 . A A . 8 PHE HD1 1 1 6 3678 1 1 8 PHE HD2 H 6.831 6.175 5.473 1.00 . A A . 8 PHE HD2 1 1 6 3679 1 1 8 PHE HE1 H 8.305 2.914 2.099 1.00 . A A . 8 PHE HE1 1 1 6 3680 1 1 8 PHE HE2 H 8.393 4.381 6.101 1.00 . A A . 8 PHE HE2 1 1 6 3681 1 1 8 PHE HZ H 9.132 2.747 4.413 1.00 . A A . 8 PHE HZ 1 1 6 3682 1 1 8 PHE N N 6.206 8.578 4.509 1.00 . A A . 8 PHE N 1 1 6 3683 1 1 8 PHE O O 5.105 10.024 2.519 1.00 . A A . 8 PHE O 1 1 6 3684 1 1 9 SER C C 5.156 8.681 -1.526 1.00 . A A . 9 SER C 1 1 6 3685 1 1 9 SER CA C 5.136 9.430 -0.195 1.00 . A A . 9 SER CA 1 1 6 3686 1 1 9 SER CB C 5.882 10.759 -0.336 1.00 . A A . 9 SER CB 1 1 6 3687 1 1 9 SER H H 6.192 7.791 0.638 1.00 . A A . 9 SER H 1 1 6 3688 1 1 9 SER HA H 4.111 9.631 0.076 1.00 . A A . 9 SER HA 1 1 6 3689 1 1 9 SER HB2 H 6.013 10.986 -1.383 1.00 . A A . 9 SER HB2 1 1 6 3690 1 1 9 SER HB3 H 5.307 11.543 0.133 1.00 . A A . 9 SER HB3 1 1 6 3691 1 1 9 SER HG H 7.797 11.167 -0.262 1.00 . A A . 9 SER HG 1 1 6 3692 1 1 9 SER N N 5.731 8.625 0.869 1.00 . A A . 9 SER N 1 1 6 3693 1 1 9 SER O O 5.941 7.752 -1.714 1.00 . A A . 9 SER O 1 1 6 3694 1 1 9 SER OG O 7.158 10.697 0.279 1.00 . A A . 9 SER OG 1 1 6 3695 1 1 10 CYS C C 3.724 9.453 -4.824 1.00 . A A . 10 CYS C 1 1 6 3696 1 1 10 CYS CA C 4.200 8.461 -3.759 1.00 . A A . 10 CYS CA 1 1 6 3697 1 1 10 CYS CB C 3.294 7.234 -3.713 1.00 . A A . 10 CYS CB 1 1 6 3698 1 1 10 CYS H H 3.686 9.840 -2.236 1.00 . A A . 10 CYS H 1 1 6 3699 1 1 10 CYS HA H 5.198 8.140 -4.022 1.00 . A A . 10 CYS HA 1 1 6 3700 1 1 10 CYS HB2 H 2.844 7.162 -2.734 1.00 . A A . 10 CYS HB2 1 1 6 3701 1 1 10 CYS HB3 H 2.517 7.344 -4.455 1.00 . A A . 10 CYS HB3 1 1 6 3702 1 1 10 CYS N N 4.285 9.092 -2.446 1.00 . A A . 10 CYS N 1 1 6 3703 1 1 10 CYS O O 3.654 10.657 -4.578 1.00 . A A . 10 CYS O 1 1 6 3704 1 1 10 CYS SG S 4.155 5.662 -4.044 1.00 . A A . 10 CYS SG 1 1 6 3705 1 1 11 HIS C C 1.528 10.118 -7.148 1.00 . A A . 11 HIS C 1 1 6 3706 1 1 11 HIS CA C 3.026 9.783 -7.147 1.00 . A A . 11 HIS CA 1 1 6 3707 1 1 11 HIS CB C 3.395 9.102 -8.466 1.00 . A A . 11 HIS CB 1 1 6 3708 1 1 11 HIS CD2 C 5.666 9.143 -9.718 1.00 . A A . 11 HIS CD2 1 1 6 3709 1 1 11 HIS CE1 C 5.873 11.316 -9.934 1.00 . A A . 11 HIS CE1 1 1 6 3710 1 1 11 HIS CG C 4.579 9.715 -9.146 1.00 . A A . 11 HIS CG 1 1 6 3711 1 1 11 HIS H H 3.553 7.977 -6.161 1.00 . A A . 11 HIS H 1 1 6 3712 1 1 11 HIS HA H 3.579 10.707 -7.079 1.00 . A A . 11 HIS HA 1 1 6 3713 1 1 11 HIS HB2 H 3.622 8.064 -8.276 1.00 . A A . 11 HIS HB2 1 1 6 3714 1 1 11 HIS HB3 H 2.554 9.164 -9.142 1.00 . A A . 11 HIS HB3 1 1 6 3715 1 1 11 HIS HD1 H 4.116 11.765 -8.985 1.00 . A A . 11 HIS HD1 1 1 6 3716 1 1 11 HIS HD2 H 5.874 8.085 -9.782 1.00 . A A . 11 HIS HD2 1 1 6 3717 1 1 11 HIS HE1 H 6.259 12.291 -10.192 1.00 . A A . 11 HIS HE1 1 1 6 3718 1 1 11 HIS HE2 H 7.279 10.047 -10.715 1.00 . A A . 11 HIS HE2 1 1 6 3719 1 1 11 HIS N N 3.443 8.941 -6.023 1.00 . A A . 11 HIS N 1 1 6 3720 1 1 11 HIS ND1 N 4.740 11.077 -9.298 1.00 . A A . 11 HIS ND1 1 1 6 3721 1 1 11 HIS NE2 N 6.453 10.160 -10.200 1.00 . A A . 11 HIS NE2 1 1 6 3722 1 1 11 HIS O O 0.685 9.372 -6.638 1.00 . A A . 11 HIS O 1 1 6 3723 1 1 12 ASP C C -1.076 10.648 -8.377 1.00 . A A . 12 ASP C 1 1 6 3724 1 1 12 ASP CA C -0.154 11.748 -7.862 1.00 . A A . 12 ASP CA 1 1 6 3725 1 1 12 ASP CB C -0.219 12.960 -8.794 1.00 . A A . 12 ASP CB 1 1 6 3726 1 1 12 ASP CG C 0.733 14.063 -8.374 1.00 . A A . 12 ASP CG 1 1 6 3727 1 1 12 ASP H H 1.951 11.789 -8.138 1.00 . A A . 12 ASP H 1 1 6 3728 1 1 12 ASP HA H -0.481 12.044 -6.877 1.00 . A A . 12 ASP HA 1 1 6 3729 1 1 12 ASP HB2 H 0.039 12.650 -9.795 1.00 . A A . 12 ASP HB2 1 1 6 3730 1 1 12 ASP HB3 H -1.223 13.355 -8.791 1.00 . A A . 12 ASP HB3 1 1 6 3731 1 1 12 ASP N N 1.220 11.265 -7.751 1.00 . A A . 12 ASP N 1 1 6 3732 1 1 12 ASP O O -0.707 9.881 -9.267 1.00 . A A . 12 ASP O 1 1 6 3733 1 1 12 ASP OD1 O 1.946 13.933 -8.639 1.00 . A A . 12 ASP OD1 1 1 6 3734 1 1 12 ASP OD2 O 0.265 15.058 -7.781 1.00 . A A . 12 ASP OD2 1 1 6 3735 1 1 13 GLY C C -3.088 8.286 -7.394 1.00 . A A . 13 GLY C 1 1 6 3736 1 1 13 GLY CA C -3.224 9.554 -8.213 1.00 . A A . 13 GLY CA 1 1 6 3737 1 1 13 GLY H H -2.509 11.204 -7.096 1.00 . A A . 13 GLY H 1 1 6 3738 1 1 13 GLY HA2 H -4.225 9.942 -8.094 1.00 . A A . 13 GLY HA2 1 1 6 3739 1 1 13 GLY HA3 H -3.059 9.317 -9.253 1.00 . A A . 13 GLY HA3 1 1 6 3740 1 1 13 GLY N N -2.273 10.569 -7.804 1.00 . A A . 13 GLY N 1 1 6 3741 1 1 13 GLY O O -3.870 7.348 -7.549 1.00 . A A . 13 GLY O 1 1 6 3742 1 1 14 GLU C C -2.522 7.261 -4.302 1.00 . A A . 14 GLU C 1 1 6 3743 1 1 14 GLU CA C -1.855 7.102 -5.665 1.00 . A A . 14 GLU CA 1 1 6 3744 1 1 14 GLU CB C -0.357 6.892 -5.458 1.00 . A A . 14 GLU CB 1 1 6 3745 1 1 14 GLU CD C 0.187 7.087 -2.994 1.00 . A A . 14 GLU CD 1 1 6 3746 1 1 14 GLU CG C 0.217 7.763 -4.351 1.00 . A A . 14 GLU CG 1 1 6 3747 1 1 14 GLU H H -1.503 9.054 -6.445 1.00 . A A . 14 GLU H 1 1 6 3748 1 1 14 GLU HA H -2.266 6.236 -6.158 1.00 . A A . 14 GLU HA 1 1 6 3749 1 1 14 GLU HB2 H -0.180 5.858 -5.205 1.00 . A A . 14 GLU HB2 1 1 6 3750 1 1 14 GLU HB3 H 0.159 7.126 -6.377 1.00 . A A . 14 GLU HB3 1 1 6 3751 1 1 14 GLU HG2 H 1.240 8.003 -4.593 1.00 . A A . 14 GLU HG2 1 1 6 3752 1 1 14 GLU HG3 H -0.360 8.675 -4.294 1.00 . A A . 14 GLU HG3 1 1 6 3753 1 1 14 GLU N N -2.089 8.263 -6.516 1.00 . A A . 14 GLU N 1 1 6 3754 1 1 14 GLU O O -3.009 8.336 -3.950 1.00 . A A . 14 GLU O 1 1 6 3755 1 1 14 GLU OE1 O 0.625 5.922 -2.898 1.00 . A A . 14 GLU OE1 1 1 6 3756 1 1 14 GLU OE2 O -0.277 7.725 -2.025 1.00 . A A . 14 GLU OE2 1 1 6 3757 1 1 15 THR C C -2.136 5.344 -1.281 1.00 . A A . 15 THR C 1 1 6 3758 1 1 15 THR CA C -3.048 6.165 -2.184 1.00 . A A . 15 THR CA 1 1 6 3759 1 1 15 THR CB C -4.476 5.584 -2.153 1.00 . A A . 15 THR CB 1 1 6 3760 1 1 15 THR CG2 C -4.921 5.297 -0.724 1.00 . A A . 15 THR CG2 1 1 6 3761 1 1 15 THR H H -2.068 5.364 -3.872 1.00 . A A . 15 THR H 1 1 6 3762 1 1 15 THR HA H -3.081 7.184 -1.823 1.00 . A A . 15 THR HA 1 1 6 3763 1 1 15 THR HB H -4.485 4.659 -2.711 1.00 . A A . 15 THR HB 1 1 6 3764 1 1 15 THR HG1 H -5.123 6.668 -3.669 1.00 . A A . 15 THR HG1 1 1 6 3765 1 1 15 THR HG21 H -4.685 4.275 -0.472 1.00 . A A . 15 THR HG21 1 1 6 3766 1 1 15 THR HG22 H -5.987 5.453 -0.642 1.00 . A A . 15 THR HG22 1 1 6 3767 1 1 15 THR HG23 H -4.407 5.963 -0.047 1.00 . A A . 15 THR HG23 1 1 6 3768 1 1 15 THR N N -2.497 6.179 -3.531 1.00 . A A . 15 THR N 1 1 6 3769 1 1 15 THR O O -1.703 4.256 -1.656 1.00 . A A . 15 THR O 1 1 6 3770 1 1 15 THR OG1 O -5.387 6.507 -2.760 1.00 . A A . 15 THR OG1 1 1 6 3771 1 1 16 CYS C C -1.767 4.267 1.775 1.00 . A A . 16 CYS C 1 1 6 3772 1 1 16 CYS CA C -0.965 5.154 0.834 1.00 . A A . 16 CYS CA 1 1 6 3773 1 1 16 CYS CB C -0.119 6.149 1.626 1.00 . A A . 16 CYS CB 1 1 6 3774 1 1 16 CYS H H -2.212 6.726 0.169 1.00 . A A . 16 CYS H 1 1 6 3775 1 1 16 CYS HA H -0.306 4.527 0.251 1.00 . A A . 16 CYS HA 1 1 6 3776 1 1 16 CYS HB2 H -0.773 6.827 2.154 1.00 . A A . 16 CYS HB2 1 1 6 3777 1 1 16 CYS HB3 H 0.489 5.610 2.341 1.00 . A A . 16 CYS HB3 1 1 6 3778 1 1 16 CYS N N -1.836 5.861 -0.096 1.00 . A A . 16 CYS N 1 1 6 3779 1 1 16 CYS O O -2.831 4.658 2.259 1.00 . A A . 16 CYS O 1 1 6 3780 1 1 16 CYS SG S 0.997 7.148 0.590 1.00 . A A . 16 CYS SG 1 1 6 3781 1 1 17 CYS C C -0.905 1.460 3.849 1.00 . A A . 17 CYS C 1 1 6 3782 1 1 17 CYS CA C -1.914 2.124 2.915 1.00 . A A . 17 CYS CA 1 1 6 3783 1 1 17 CYS CB C -2.649 1.063 2.096 1.00 . A A . 17 CYS CB 1 1 6 3784 1 1 17 CYS H H -0.400 2.819 1.616 1.00 . A A . 17 CYS H 1 1 6 3785 1 1 17 CYS HA H -2.632 2.671 3.507 1.00 . A A . 17 CYS HA 1 1 6 3786 1 1 17 CYS HB2 H -2.194 0.993 1.119 1.00 . A A . 17 CYS HB2 1 1 6 3787 1 1 17 CYS HB3 H -2.563 0.110 2.597 1.00 . A A . 17 CYS HB3 1 1 6 3788 1 1 17 CYS N N -1.250 3.072 2.032 1.00 . A A . 17 CYS N 1 1 6 3789 1 1 17 CYS O O 0.110 0.930 3.400 1.00 . A A . 17 CYS O 1 1 6 3790 1 1 17 CYS SG S -4.421 1.408 1.857 1.00 . A A . 17 CYS SG 1 1 6 3791 1 1 18 PRO C C -0.542 -0.621 6.319 1.00 . A A . 18 PRO C 1 1 6 3792 1 1 18 PRO CA C -0.284 0.875 6.157 1.00 . A A . 18 PRO CA 1 1 6 3793 1 1 18 PRO CB C -0.651 1.634 7.430 1.00 . A A . 18 PRO CB 1 1 6 3794 1 1 18 PRO CD C -2.362 2.082 5.800 1.00 . A A . 18 PRO CD 1 1 6 3795 1 1 18 PRO CG C -2.106 1.926 7.279 1.00 . A A . 18 PRO CG 1 1 6 3796 1 1 18 PRO HA H 0.757 1.042 5.916 1.00 . A A . 18 PRO HA 1 1 6 3797 1 1 18 PRO HB2 H -0.457 1.014 8.294 1.00 . A A . 18 PRO HB2 1 1 6 3798 1 1 18 PRO HB3 H -0.073 2.545 7.492 1.00 . A A . 18 PRO HB3 1 1 6 3799 1 1 18 PRO HD2 H -3.259 1.552 5.514 1.00 . A A . 18 PRO HD2 1 1 6 3800 1 1 18 PRO HD3 H -2.445 3.127 5.540 1.00 . A A . 18 PRO HD3 1 1 6 3801 1 1 18 PRO HG2 H -2.687 1.103 7.673 1.00 . A A . 18 PRO HG2 1 1 6 3802 1 1 18 PRO HG3 H -2.352 2.838 7.801 1.00 . A A . 18 PRO HG3 1 1 6 3803 1 1 18 PRO N N -1.172 1.477 5.167 1.00 . A A . 18 PRO N 1 1 6 3804 1 1 18 PRO O O -1.436 -1.031 7.060 1.00 . A A . 18 PRO O 1 1 6 3805 1 1 19 THR C C 0.849 -3.478 6.849 1.00 . A A . 19 THR C 1 1 6 3806 1 1 19 THR CA C 0.089 -2.881 5.668 1.00 . A A . 19 THR CA 1 1 6 3807 1 1 19 THR CB C 0.585 -3.546 4.371 1.00 . A A . 19 THR CB 1 1 6 3808 1 1 19 THR CG2 C 0.000 -2.852 3.149 1.00 . A A . 19 THR CG2 1 1 6 3809 1 1 19 THR H H 0.932 -1.047 5.035 1.00 . A A . 19 THR H 1 1 6 3810 1 1 19 THR HA H -0.962 -3.104 5.780 1.00 . A A . 19 THR HA 1 1 6 3811 1 1 19 THR HB H 0.267 -4.578 4.366 1.00 . A A . 19 THR HB 1 1 6 3812 1 1 19 THR HG1 H 2.354 -3.054 5.094 1.00 . A A . 19 THR HG1 1 1 6 3813 1 1 19 THR HG21 H 0.629 -3.041 2.292 1.00 . A A . 19 THR HG21 1 1 6 3814 1 1 19 THR HG22 H -0.053 -1.789 3.329 1.00 . A A . 19 THR HG22 1 1 6 3815 1 1 19 THR HG23 H -0.992 -3.235 2.959 1.00 . A A . 19 THR HG23 1 1 6 3816 1 1 19 THR N N 0.240 -1.432 5.612 1.00 . A A . 19 THR N 1 1 6 3817 1 1 19 THR O O 0.861 -4.695 7.038 1.00 . A A . 19 THR O 1 1 6 3818 1 1 19 THR OG1 O 2.016 -3.497 4.312 1.00 . A A . 19 THR OG1 1 1 6 3819 1 1 20 SER C C 2.237 -2.011 9.903 1.00 . A A . 20 SER C 1 1 6 3820 1 1 20 SER CA C 2.240 -3.069 8.801 1.00 . A A . 20 SER CA 1 1 6 3821 1 1 20 SER CB C 3.676 -3.409 8.394 1.00 . A A . 20 SER CB 1 1 6 3822 1 1 20 SER H H 1.434 -1.660 7.441 1.00 . A A . 20 SER H 1 1 6 3823 1 1 20 SER HA H 1.765 -3.962 9.178 1.00 . A A . 20 SER HA 1 1 6 3824 1 1 20 SER HB2 H 3.868 -3.025 7.403 1.00 . A A . 20 SER HB2 1 1 6 3825 1 1 20 SER HB3 H 4.363 -2.958 9.094 1.00 . A A . 20 SER HB3 1 1 6 3826 1 1 20 SER HG H 3.373 -5.209 7.679 1.00 . A A . 20 SER HG 1 1 6 3827 1 1 20 SER N N 1.480 -2.618 7.641 1.00 . A A . 20 SER N 1 1 6 3828 1 1 20 SER O O 1.282 -1.914 10.674 1.00 . A A . 20 SER O 1 1 6 3829 1 1 20 SER OG O 3.886 -4.811 8.387 1.00 . A A . 20 SER OG 1 1 6 3830 1 1 21 GLN C C 4.582 0.761 10.662 1.00 . A A . 21 GLN C 1 1 6 3831 1 1 21 GLN CA C 3.420 -0.174 10.981 1.00 . A A . 21 GLN CA 1 1 6 3832 1 1 21 GLN CB C 3.611 -0.791 12.368 1.00 . A A . 21 GLN CB 1 1 6 3833 1 1 21 GLN CD C 1.367 -1.027 13.504 1.00 . A A . 21 GLN CD 1 1 6 3834 1 1 21 GLN CG C 2.659 -0.238 13.416 1.00 . A A . 21 GLN CG 1 1 6 3835 1 1 21 GLN H H 4.035 -1.345 9.330 1.00 . A A . 21 GLN H 1 1 6 3836 1 1 21 GLN HA H 2.502 0.395 10.973 1.00 . A A . 21 GLN HA 1 1 6 3837 1 1 21 GLN HB2 H 3.455 -1.857 12.299 1.00 . A A . 21 GLN HB2 1 1 6 3838 1 1 21 GLN HB3 H 4.623 -0.605 12.696 1.00 . A A . 21 GLN HB3 1 1 6 3839 1 1 21 GLN HE21 H 2.385 -2.721 13.709 1.00 . A A . 21 GLN HE21 1 1 6 3840 1 1 21 GLN HE22 H 0.665 -2.874 13.721 1.00 . A A . 21 GLN HE22 1 1 6 3841 1 1 21 GLN HG2 H 3.148 -0.269 14.379 1.00 . A A . 21 GLN HG2 1 1 6 3842 1 1 21 GLN HG3 H 2.424 0.785 13.166 1.00 . A A . 21 GLN HG3 1 1 6 3843 1 1 21 GLN N N 3.306 -1.221 9.972 1.00 . A A . 21 GLN N 1 1 6 3844 1 1 21 GLN NE2 N 1.484 -2.340 13.660 1.00 . A A . 21 GLN NE2 1 1 6 3845 1 1 21 GLN O O 4.562 1.938 11.024 1.00 . A A . 21 GLN O 1 1 6 3846 1 1 21 GLN OE1 O 0.275 -0.461 13.433 1.00 . A A . 21 GLN OE1 1 1 6 3847 1 1 22 THR C C 6.904 1.109 8.093 1.00 . A A . 22 THR C 1 1 6 3848 1 1 22 THR CA C 6.763 1.016 9.609 1.00 . A A . 22 THR CA 1 1 6 3849 1 1 22 THR CB C 8.054 0.416 10.198 1.00 . A A . 22 THR CB 1 1 6 3850 1 1 22 THR CG2 C 8.243 -1.022 9.739 1.00 . A A . 22 THR CG2 1 1 6 3851 1 1 22 THR H H 5.547 -0.713 9.718 1.00 . A A . 22 THR H 1 1 6 3852 1 1 22 THR HA H 6.637 2.011 10.010 1.00 . A A . 22 THR HA 1 1 6 3853 1 1 22 THR HB H 7.978 0.427 11.276 1.00 . A A . 22 THR HB 1 1 6 3854 1 1 22 THR HG1 H 9.855 0.628 9.421 1.00 . A A . 22 THR HG1 1 1 6 3855 1 1 22 THR HG21 H 9.017 -1.491 10.330 1.00 . A A . 22 THR HG21 1 1 6 3856 1 1 22 THR HG22 H 8.531 -1.032 8.697 1.00 . A A . 22 THR HG22 1 1 6 3857 1 1 22 THR HG23 H 7.318 -1.564 9.862 1.00 . A A . 22 THR HG23 1 1 6 3858 1 1 22 THR N N 5.591 0.230 9.980 1.00 . A A . 22 THR N 1 1 6 3859 1 1 22 THR O O 7.795 1.787 7.582 1.00 . A A . 22 THR O 1 1 6 3860 1 1 22 THR OG1 O 9.186 1.201 9.802 1.00 . A A . 22 THR OG1 1 1 6 3861 1 1 23 THR C C 4.782 1.088 5.358 1.00 . A A . 23 THR C 1 1 6 3862 1 1 23 THR CA C 6.038 0.433 5.920 1.00 . A A . 23 THR CA 1 1 6 3863 1 1 23 THR CB C 6.157 -0.993 5.352 1.00 . A A . 23 THR CB 1 1 6 3864 1 1 23 THR CG2 C 7.575 -1.267 4.873 1.00 . A A . 23 THR CG2 1 1 6 3865 1 1 23 THR H H 5.326 -0.094 7.843 1.00 . A A . 23 THR H 1 1 6 3866 1 1 23 THR HA H 6.901 0.999 5.603 1.00 . A A . 23 THR HA 1 1 6 3867 1 1 23 THR HB H 5.485 -1.088 4.512 1.00 . A A . 23 THR HB 1 1 6 3868 1 1 23 THR HG1 H 5.001 -1.655 6.808 1.00 . A A . 23 THR HG1 1 1 6 3869 1 1 23 THR HG21 H 7.726 -2.333 4.788 1.00 . A A . 23 THR HG21 1 1 6 3870 1 1 23 THR HG22 H 8.280 -0.859 5.582 1.00 . A A . 23 THR HG22 1 1 6 3871 1 1 23 THR HG23 H 7.725 -0.804 3.910 1.00 . A A . 23 THR HG23 1 1 6 3872 1 1 23 THR N N 6.015 0.426 7.378 1.00 . A A . 23 THR N 1 1 6 3873 1 1 23 THR O O 3.791 1.264 6.067 1.00 . A A . 23 THR O 1 1 6 3874 1 1 23 THR OG1 O 5.793 -1.952 6.353 1.00 . A A . 23 THR OG1 1 1 6 3875 1 1 24 TRP C C 3.597 1.667 1.963 1.00 . A A . 24 TRP C 1 1 6 3876 1 1 24 TRP CA C 3.696 2.092 3.425 1.00 . A A . 24 TRP CA 1 1 6 3877 1 1 24 TRP CB C 3.822 3.614 3.523 1.00 . A A . 24 TRP CB 1 1 6 3878 1 1 24 TRP CD1 C 4.084 4.431 5.937 1.00 . A A . 24 TRP CD1 1 1 6 3879 1 1 24 TRP CD2 C 1.988 4.491 5.168 1.00 . A A . 24 TRP CD2 1 1 6 3880 1 1 24 TRP CE2 C 1.989 4.953 6.496 1.00 . A A . 24 TRP CE2 1 1 6 3881 1 1 24 TRP CE3 C 0.781 4.441 4.473 1.00 . A A . 24 TRP CE3 1 1 6 3882 1 1 24 TRP CG C 3.335 4.159 4.831 1.00 . A A . 24 TRP CG 1 1 6 3883 1 1 24 TRP CH2 C -0.343 5.299 6.436 1.00 . A A . 24 TRP CH2 1 1 6 3884 1 1 24 TRP CZ2 C 0.826 5.360 7.142 1.00 . A A . 24 TRP CZ2 1 1 6 3885 1 1 24 TRP CZ3 C -0.373 4.844 5.112 1.00 . A A . 24 TRP CZ3 1 1 6 3886 1 1 24 TRP H H 5.649 1.287 3.566 1.00 . A A . 24 TRP H 1 1 6 3887 1 1 24 TRP HA H 2.798 1.780 3.940 1.00 . A A . 24 TRP HA 1 1 6 3888 1 1 24 TRP HB2 H 4.858 3.892 3.411 1.00 . A A . 24 TRP HB2 1 1 6 3889 1 1 24 TRP HB3 H 3.242 4.070 2.734 1.00 . A A . 24 TRP HB3 1 1 6 3890 1 1 24 TRP HD1 H 5.150 4.286 5.996 1.00 . A A . 24 TRP HD1 1 1 6 3891 1 1 24 TRP HE1 H 3.586 5.170 7.840 1.00 . A A . 24 TRP HE1 1 1 6 3892 1 1 24 TRP HE3 H 0.744 4.097 3.452 1.00 . A A . 24 TRP HE3 1 1 6 3893 1 1 24 TRP HH2 H -1.269 5.602 6.895 1.00 . A A . 24 TRP HH2 1 1 6 3894 1 1 24 TRP HZ2 H 0.831 5.715 8.163 1.00 . A A . 24 TRP HZ2 1 1 6 3895 1 1 24 TRP HZ3 H -1.318 4.810 4.590 1.00 . A A . 24 TRP HZ3 1 1 6 3896 1 1 24 TRP N N 4.830 1.452 4.080 1.00 . A A . 24 TRP N 1 1 6 3897 1 1 24 TRP NE1 N 3.282 4.907 6.945 1.00 . A A . 24 TRP NE1 1 1 6 3898 1 1 24 TRP O O 4.529 1.865 1.184 1.00 . A A . 24 TRP O 1 1 6 3899 1 1 25 GLY C C 1.462 1.630 -0.589 1.00 . A A . 25 GLY C 1 1 6 3900 1 1 25 GLY CA C 2.256 0.635 0.233 1.00 . A A . 25 GLY CA 1 1 6 3901 1 1 25 GLY H H 1.753 0.950 2.265 1.00 . A A . 25 GLY H 1 1 6 3902 1 1 25 GLY HA2 H 3.219 0.486 -0.232 1.00 . A A . 25 GLY HA2 1 1 6 3903 1 1 25 GLY HA3 H 1.727 -0.306 0.249 1.00 . A A . 25 GLY HA3 1 1 6 3904 1 1 25 GLY N N 2.460 1.081 1.599 1.00 . A A . 25 GLY N 1 1 6 3905 1 1 25 GLY O O 0.548 2.279 -0.078 1.00 . A A . 25 GLY O 1 1 6 3906 1 1 26 CYS C C 0.129 1.943 -3.651 1.00 . A A . 26 CYS C 1 1 6 3907 1 1 26 CYS CA C 1.133 2.677 -2.765 1.00 . A A . 26 CYS CA 1 1 6 3908 1 1 26 CYS CB C 2.153 3.418 -3.631 1.00 . A A . 26 CYS CB 1 1 6 3909 1 1 26 CYS H H 2.554 1.209 -2.210 1.00 . A A . 26 CYS H 1 1 6 3910 1 1 26 CYS HA H 0.601 3.394 -2.159 1.00 . A A . 26 CYS HA 1 1 6 3911 1 1 26 CYS HB2 H 2.695 2.700 -4.230 1.00 . A A . 26 CYS HB2 1 1 6 3912 1 1 26 CYS HB3 H 1.631 4.101 -4.284 1.00 . A A . 26 CYS HB3 1 1 6 3913 1 1 26 CYS N N 1.814 1.752 -1.865 1.00 . A A . 26 CYS N 1 1 6 3914 1 1 26 CYS O O 0.448 0.917 -4.252 1.00 . A A . 26 CYS O 1 1 6 3915 1 1 26 CYS SG S 3.373 4.380 -2.680 1.00 . A A . 26 CYS SG 1 1 6 3916 1 1 27 CYS C C -2.668 2.892 -5.558 1.00 . A A . 27 CYS C 1 1 6 3917 1 1 27 CYS CA C -2.142 1.887 -4.535 1.00 . A A . 27 CYS CA 1 1 6 3918 1 1 27 CYS CB C -3.286 1.402 -3.640 1.00 . A A . 27 CYS CB 1 1 6 3919 1 1 27 CYS H H -1.274 3.298 -3.222 1.00 . A A . 27 CYS H 1 1 6 3920 1 1 27 CYS HA H -1.723 1.041 -5.060 1.00 . A A . 27 CYS HA 1 1 6 3921 1 1 27 CYS HB2 H -3.052 1.632 -2.612 1.00 . A A . 27 CYS HB2 1 1 6 3922 1 1 27 CYS HB3 H -4.195 1.915 -3.921 1.00 . A A . 27 CYS HB3 1 1 6 3923 1 1 27 CYS N N -1.085 2.481 -3.724 1.00 . A A . 27 CYS N 1 1 6 3924 1 1 27 CYS O O -2.805 4.080 -5.257 1.00 . A A . 27 CYS O 1 1 6 3925 1 1 27 CYS SG S -3.605 -0.391 -3.747 1.00 . A A . 27 CYS SG 1 1 6 3926 1 1 28 PRO C C -4.980 3.459 -7.825 1.00 . A A . 28 PRO C 1 1 6 3927 1 1 28 PRO CA C -3.463 3.291 -7.860 1.00 . A A . 28 PRO CA 1 1 6 3928 1 1 28 PRO CB C -3.040 2.533 -9.114 1.00 . A A . 28 PRO CB 1 1 6 3929 1 1 28 PRO CD C -2.817 1.033 -7.242 1.00 . A A . 28 PRO CD 1 1 6 3930 1 1 28 PRO CG C -3.118 1.096 -8.721 1.00 . A A . 28 PRO CG 1 1 6 3931 1 1 28 PRO HA H -2.990 4.263 -7.846 1.00 . A A . 28 PRO HA 1 1 6 3932 1 1 28 PRO HB2 H -3.719 2.762 -9.922 1.00 . A A . 28 PRO HB2 1 1 6 3933 1 1 28 PRO HB3 H -2.034 2.813 -9.388 1.00 . A A . 28 PRO HB3 1 1 6 3934 1 1 28 PRO HD2 H -3.526 0.392 -6.740 1.00 . A A . 28 PRO HD2 1 1 6 3935 1 1 28 PRO HD3 H -1.808 0.679 -7.079 1.00 . A A . 28 PRO HD3 1 1 6 3936 1 1 28 PRO HG2 H -4.110 0.717 -8.916 1.00 . A A . 28 PRO HG2 1 1 6 3937 1 1 28 PRO HG3 H -2.386 0.526 -9.276 1.00 . A A . 28 PRO HG3 1 1 6 3938 1 1 28 PRO N N -2.962 2.432 -6.790 1.00 . A A . 28 PRO N 1 1 6 3939 1 1 28 PRO O O -5.645 3.397 -8.860 1.00 . A A . 28 PRO O 1 1 6 3940 1 1 29 SER C C -7.261 4.783 -5.292 1.00 . A A . 29 SER C 1 1 6 3941 1 1 29 SER CA C -6.963 3.852 -6.466 1.00 . A A . 29 SER CA 1 1 6 3942 1 1 29 SER CB C -7.643 2.500 -6.251 1.00 . A A . 29 SER CB 1 1 6 3943 1 1 29 SER H H -4.943 3.713 -5.842 1.00 . A A . 29 SER H 1 1 6 3944 1 1 29 SER HA H -7.346 4.298 -7.371 1.00 . A A . 29 SER HA 1 1 6 3945 1 1 29 SER HB2 H -7.347 2.098 -5.292 1.00 . A A . 29 SER HB2 1 1 6 3946 1 1 29 SER HB3 H -8.714 2.633 -6.271 1.00 . A A . 29 SER HB3 1 1 6 3947 1 1 29 SER HG H -6.428 1.186 -7.047 1.00 . A A . 29 SER HG 1 1 6 3948 1 1 29 SER N N -5.523 3.673 -6.631 1.00 . A A . 29 SER N 1 1 6 3949 1 1 29 SER O O -6.464 4.885 -4.362 1.00 . A A . 29 SER O 1 1 6 3950 1 1 29 SER OG O -7.278 1.578 -7.262 1.00 . A A . 29 SER OG 1 1 6 3951 1 1 30 PRO C C -8.873 5.744 -2.881 1.00 . A A . 30 PRO C 1 1 6 3952 1 1 30 PRO CA C -8.806 6.415 -4.255 1.00 . A A . 30 PRO CA 1 1 6 3953 1 1 30 PRO CB C -10.192 6.912 -4.692 1.00 . A A . 30 PRO CB 1 1 6 3954 1 1 30 PRO CD C -9.421 5.428 -6.394 1.00 . A A . 30 PRO CD 1 1 6 3955 1 1 30 PRO CG C -10.659 5.931 -5.712 1.00 . A A . 30 PRO CG 1 1 6 3956 1 1 30 PRO HA H -8.125 7.252 -4.204 1.00 . A A . 30 PRO HA 1 1 6 3957 1 1 30 PRO HB2 H -10.852 6.936 -3.837 1.00 . A A . 30 PRO HB2 1 1 6 3958 1 1 30 PRO HB3 H -10.104 7.903 -5.112 1.00 . A A . 30 PRO HB3 1 1 6 3959 1 1 30 PRO HD2 H -9.565 4.415 -6.741 1.00 . A A . 30 PRO HD2 1 1 6 3960 1 1 30 PRO HD3 H -9.149 6.076 -7.214 1.00 . A A . 30 PRO HD3 1 1 6 3961 1 1 30 PRO HG2 H -11.179 5.116 -5.229 1.00 . A A . 30 PRO HG2 1 1 6 3962 1 1 30 PRO HG3 H -11.307 6.421 -6.425 1.00 . A A . 30 PRO HG3 1 1 6 3963 1 1 30 PRO N N -8.414 5.483 -5.323 1.00 . A A . 30 PRO N 1 1 6 3964 1 1 30 PRO O O -7.844 5.535 -2.239 1.00 . A A . 30 PRO O 1 1 6 3965 1 1 31 LYS C C -9.345 3.580 -0.970 1.00 . A A . 31 LYS C 1 1 6 3966 1 1 31 LYS CA C -10.272 4.781 -1.127 1.00 . A A . 31 LYS CA 1 1 6 3967 1 1 31 LYS CB C -11.728 4.339 -0.954 1.00 . A A . 31 LYS CB 1 1 6 3968 1 1 31 LYS CD C -14.123 5.052 -0.709 1.00 . A A . 31 LYS CD 1 1 6 3969 1 1 31 LYS CE C -14.643 4.432 0.578 1.00 . A A . 31 LYS CE 1 1 6 3970 1 1 31 LYS CG C -12.668 5.472 -0.577 1.00 . A A . 31 LYS CG 1 1 6 3971 1 1 31 LYS H H -10.872 5.617 -2.978 1.00 . A A . 31 LYS H 1 1 6 3972 1 1 31 LYS HA H -10.033 5.506 -0.365 1.00 . A A . 31 LYS HA 1 1 6 3973 1 1 31 LYS HB2 H -12.073 3.907 -1.882 1.00 . A A . 31 LYS HB2 1 1 6 3974 1 1 31 LYS HB3 H -11.774 3.588 -0.179 1.00 . A A . 31 LYS HB3 1 1 6 3975 1 1 31 LYS HD2 H -14.719 5.923 -0.944 1.00 . A A . 31 LYS HD2 1 1 6 3976 1 1 31 LYS HD3 H -14.208 4.329 -1.507 1.00 . A A . 31 LYS HD3 1 1 6 3977 1 1 31 LYS HE2 H -15.207 3.545 0.333 1.00 . A A . 31 LYS HE2 1 1 6 3978 1 1 31 LYS HE3 H -13.801 4.162 1.199 1.00 . A A . 31 LYS HE3 1 1 6 3979 1 1 31 LYS HG2 H -12.478 5.759 0.447 1.00 . A A . 31 LYS HG2 1 1 6 3980 1 1 31 LYS HG3 H -12.483 6.312 -1.229 1.00 . A A . 31 LYS HG3 1 1 6 3981 1 1 31 LYS HZ1 H -15.205 6.351 1.185 1.00 . A A . 31 LYS HZ1 1 1 6 3982 1 1 31 LYS HZ2 H -15.484 5.156 2.348 1.00 . A A . 31 LYS HZ2 1 1 6 3983 1 1 31 LYS HZ3 H -16.504 5.281 1.005 1.00 . A A . 31 LYS HZ3 1 1 6 3984 1 1 31 LYS N N -10.086 5.419 -2.429 1.00 . A A . 31 LYS N 1 1 6 3985 1 1 31 LYS NZ N -15.520 5.370 1.331 1.00 . A A . 31 LYS NZ 1 1 6 3986 1 1 31 LYS O O -8.315 3.664 -0.298 1.00 . A A . 31 LYS O 1 1 6 3987 1 1 32 ALA C C -8.893 0.652 -0.142 1.00 . A A . 32 ALA C 1 1 6 3988 1 1 32 ALA CA C -8.930 1.241 -1.548 1.00 . A A . 32 ALA CA 1 1 6 3989 1 1 32 ALA CB C -7.516 1.495 -2.054 1.00 . A A . 32 ALA CB 1 1 6 3990 1 1 32 ALA H H -10.549 2.475 -2.118 1.00 . A A . 32 ALA H 1 1 6 3991 1 1 32 ALA HA H -9.393 0.524 -2.213 1.00 . A A . 32 ALA HA 1 1 6 3992 1 1 32 ALA HB1 H -7.294 0.814 -2.862 1.00 . A A . 32 ALA HB1 1 1 6 3993 1 1 32 ALA HB2 H -6.813 1.339 -1.249 1.00 . A A . 32 ALA HB2 1 1 6 3994 1 1 32 ALA HB3 H -7.437 2.512 -2.408 1.00 . A A . 32 ALA HB3 1 1 6 3995 1 1 32 ALA N N -9.719 2.468 -1.600 1.00 . A A . 32 ALA N 1 1 6 3996 1 1 32 ALA O O -8.789 1.378 0.848 1.00 . A A . 32 ALA O 1 1 6 3997 1 1 33 VAL C C -7.575 -2.042 1.404 1.00 . A A . 33 VAL C 1 1 6 3998 1 1 33 VAL CA C -8.931 -1.373 1.213 1.00 . A A . 33 VAL CA 1 1 6 3999 1 1 33 VAL CB C -10.041 -2.438 1.305 1.00 . A A . 33 VAL CB 1 1 6 4000 1 1 33 VAL CG1 C -10.304 -2.811 2.757 1.00 . A A . 33 VAL CG1 1 1 6 4001 1 1 33 VAL CG2 C -11.314 -1.941 0.635 1.00 . A A . 33 VAL CG2 1 1 6 4002 1 1 33 VAL H H -9.041 -1.196 -0.888 1.00 . A A . 33 VAL H 1 1 6 4003 1 1 33 VAL HA H -9.083 -0.648 1.999 1.00 . A A . 33 VAL HA 1 1 6 4004 1 1 33 VAL HB H -9.708 -3.324 0.784 1.00 . A A . 33 VAL HB 1 1 6 4005 1 1 33 VAL HG11 H -11.067 -3.575 2.799 1.00 . A A . 33 VAL HG11 1 1 6 4006 1 1 33 VAL HG12 H -10.638 -1.939 3.298 1.00 . A A . 33 VAL HG12 1 1 6 4007 1 1 33 VAL HG13 H -9.394 -3.186 3.202 1.00 . A A . 33 VAL HG13 1 1 6 4008 1 1 33 VAL HG21 H -12.064 -1.745 1.388 1.00 . A A . 33 VAL HG21 1 1 6 4009 1 1 33 VAL HG22 H -11.678 -2.693 -0.048 1.00 . A A . 33 VAL HG22 1 1 6 4010 1 1 33 VAL HG23 H -11.104 -1.032 0.089 1.00 . A A . 33 VAL HG23 1 1 6 4011 1 1 33 VAL N N -8.969 -0.673 -0.064 1.00 . A A . 33 VAL N 1 1 6 4012 1 1 33 VAL O O -7.247 -3.009 0.717 1.00 . A A . 33 VAL O 1 1 6 4013 1 1 34 CYS C C -5.531 -3.443 3.223 1.00 . A A . 34 CYS C 1 1 6 4014 1 1 34 CYS CA C -5.458 -2.052 2.601 1.00 . A A . 34 CYS CA 1 1 6 4015 1 1 34 CYS CB C -4.682 -1.107 3.524 1.00 . A A . 34 CYS CB 1 1 6 4016 1 1 34 CYS H H -7.100 -0.742 2.846 1.00 . A A . 34 CYS H 1 1 6 4017 1 1 34 CYS HA H -4.935 -2.122 1.659 1.00 . A A . 34 CYS HA 1 1 6 4018 1 1 34 CYS HB2 H -4.749 -1.467 4.539 1.00 . A A . 34 CYS HB2 1 1 6 4019 1 1 34 CYS HB3 H -3.646 -1.093 3.221 1.00 . A A . 34 CYS HB3 1 1 6 4020 1 1 34 CYS N N -6.786 -1.514 2.332 1.00 . A A . 34 CYS N 1 1 6 4021 1 1 34 CYS O O -5.728 -3.579 4.431 1.00 . A A . 34 CYS O 1 1 6 4022 1 1 34 CYS SG S -5.289 0.612 3.507 1.00 . A A . 34 CYS SG 1 1 6 4023 1 1 35 CYS C C -4.459 -6.013 4.062 1.00 . A A . 35 CYS C 1 1 6 4024 1 1 35 CYS CA C -5.392 -5.854 2.868 1.00 . A A . 35 CYS CA 1 1 6 4025 1 1 35 CYS CB C -4.992 -6.818 1.751 1.00 . A A . 35 CYS CB 1 1 6 4026 1 1 35 CYS H H -5.198 -4.302 1.440 1.00 . A A . 35 CYS H 1 1 6 4027 1 1 35 CYS HA H -6.401 -6.074 3.182 1.00 . A A . 35 CYS HA 1 1 6 4028 1 1 35 CYS HB2 H -3.927 -6.749 1.590 1.00 . A A . 35 CYS HB2 1 1 6 4029 1 1 35 CYS HB3 H -5.240 -7.827 2.049 1.00 . A A . 35 CYS HB3 1 1 6 4030 1 1 35 CYS N N -5.359 -4.474 2.391 1.00 . A A . 35 CYS N 1 1 6 4031 1 1 35 CYS O O -3.230 -5.985 3.916 1.00 . A A . 35 CYS O 1 1 6 4032 1 1 35 CYS SG S -5.814 -6.492 0.157 1.00 . A A . 35 CYS SG 1 1 6 4033 1 1 36 ASP C C -4.001 -7.733 6.835 1.00 . A A . 36 ASP C 1 1 6 4034 1 1 36 ASP CA C -4.313 -6.281 6.488 1.00 . A A . 36 ASP CA 1 1 6 4035 1 1 36 ASP CB C -5.097 -5.639 7.634 1.00 . A A . 36 ASP CB 1 1 6 4036 1 1 36 ASP CG C -4.206 -5.233 8.791 1.00 . A A . 36 ASP CG 1 1 6 4037 1 1 36 ASP H H -6.040 -6.147 5.275 1.00 . A A . 36 ASP H 1 1 6 4038 1 1 36 ASP HA H -3.383 -5.749 6.367 1.00 . A A . 36 ASP HA 1 1 6 4039 1 1 36 ASP HB2 H -5.601 -4.756 7.267 1.00 . A A . 36 ASP HB2 1 1 6 4040 1 1 36 ASP HB3 H -5.832 -6.342 7.998 1.00 . A A . 36 ASP HB3 1 1 6 4041 1 1 36 ASP N N -5.060 -6.151 5.243 1.00 . A A . 36 ASP N 1 1 6 4042 1 1 36 ASP O O -3.132 -7.992 7.669 1.00 . A A . 36 ASP O 1 1 6 4043 1 1 36 ASP OD1 O -3.828 -6.118 9.586 1.00 . A A . 36 ASP OD1 1 1 6 4044 1 1 36 ASP OD2 O -3.886 -4.031 8.902 1.00 . A A . 36 ASP OD2 1 1 6 4045 1 1 37 ASP C C -2.979 -10.418 6.403 1.00 . A A . 37 ASP C 1 1 6 4046 1 1 37 ASP CA C -4.465 -10.097 6.483 1.00 . A A . 37 ASP CA 1 1 6 4047 1 1 37 ASP CB C -5.241 -10.965 5.491 1.00 . A A . 37 ASP CB 1 1 6 4048 1 1 37 ASP CG C -6.724 -10.648 5.479 1.00 . A A . 37 ASP CG 1 1 6 4049 1 1 37 ASP H H -5.385 -8.442 5.552 1.00 . A A . 37 ASP H 1 1 6 4050 1 1 37 ASP HA H -4.814 -10.305 7.483 1.00 . A A . 37 ASP HA 1 1 6 4051 1 1 37 ASP HB2 H -4.851 -10.803 4.497 1.00 . A A . 37 ASP HB2 1 1 6 4052 1 1 37 ASP HB3 H -5.116 -12.005 5.757 1.00 . A A . 37 ASP HB3 1 1 6 4053 1 1 37 ASP N N -4.699 -8.681 6.209 1.00 . A A . 37 ASP N 1 1 6 4054 1 1 37 ASP O O -2.437 -11.132 7.248 1.00 . A A . 37 ASP O 1 1 6 4055 1 1 37 ASP OD1 O -7.443 -11.139 6.374 1.00 . A A . 37 ASP OD1 1 1 6 4056 1 1 37 ASP OD2 O -7.166 -9.908 4.575 1.00 . A A . 37 ASP OD2 1 1 6 4057 1 1 38 MET C C -0.215 -8.739 4.922 1.00 . A A . 38 MET C 1 1 6 4058 1 1 38 MET CA C -0.900 -10.075 5.190 1.00 . A A . 38 MET CA 1 1 6 4059 1 1 38 MET CB C -0.651 -11.045 4.032 1.00 . A A . 38 MET CB 1 1 6 4060 1 1 38 MET CE C -0.685 -14.545 6.127 1.00 . A A . 38 MET CE 1 1 6 4061 1 1 38 MET CG C -0.111 -12.393 4.478 1.00 . A A . 38 MET CG 1 1 6 4062 1 1 38 MET H H -2.817 -9.303 4.756 1.00 . A A . 38 MET H 1 1 6 4063 1 1 38 MET HA H -0.496 -10.497 6.098 1.00 . A A . 38 MET HA 1 1 6 4064 1 1 38 MET HB2 H -1.582 -11.208 3.509 1.00 . A A . 38 MET HB2 1 1 6 4065 1 1 38 MET HB3 H 0.061 -10.602 3.353 1.00 . A A . 38 MET HB3 1 1 6 4066 1 1 38 MET HE1 H -0.097 -15.349 5.712 1.00 . A A . 38 MET HE1 1 1 6 4067 1 1 38 MET HE2 H -1.467 -14.954 6.751 1.00 . A A . 38 MET HE2 1 1 6 4068 1 1 38 MET HE3 H -0.049 -13.904 6.720 1.00 . A A . 38 MET HE3 1 1 6 4069 1 1 38 MET HG2 H 0.533 -12.783 3.704 1.00 . A A . 38 MET HG2 1 1 6 4070 1 1 38 MET HG3 H 0.461 -12.256 5.384 1.00 . A A . 38 MET HG3 1 1 6 4071 1 1 38 MET N N -2.326 -9.871 5.386 1.00 . A A . 38 MET N 1 1 6 4072 1 1 38 MET O O 0.123 -8.010 5.855 1.00 . A A . 38 MET O 1 1 6 4073 1 1 38 MET SD S -1.418 -13.593 4.799 1.00 . A A . 38 MET SD 1 1 6 4074 1 1 39 GLN C C 0.064 -6.740 1.862 1.00 . A A . 39 GLN C 1 1 6 4075 1 1 39 GLN CA C 0.535 -7.125 3.262 1.00 . A A . 39 GLN CA 1 1 6 4076 1 1 39 GLN CB C 2.064 -7.208 3.306 1.00 . A A . 39 GLN CB 1 1 6 4077 1 1 39 GLN CD C 3.977 -8.858 3.286 1.00 . A A . 39 GLN CD 1 1 6 4078 1 1 39 GLN CG C 2.624 -8.489 2.710 1.00 . A A . 39 GLN CG 1 1 6 4079 1 1 39 GLN H H -0.397 -8.985 2.941 1.00 . A A . 39 GLN H 1 1 6 4080 1 1 39 GLN HA H 0.199 -6.376 3.963 1.00 . A A . 39 GLN HA 1 1 6 4081 1 1 39 GLN HB2 H 2.473 -6.372 2.757 1.00 . A A . 39 GLN HB2 1 1 6 4082 1 1 39 GLN HB3 H 2.387 -7.143 4.334 1.00 . A A . 39 GLN HB3 1 1 6 4083 1 1 39 GLN HE21 H 4.800 -8.763 1.479 1.00 . A A . 39 GLN HE21 1 1 6 4084 1 1 39 GLN HE22 H 5.869 -9.180 2.770 1.00 . A A . 39 GLN HE22 1 1 6 4085 1 1 39 GLN HG2 H 1.933 -9.296 2.910 1.00 . A A . 39 GLN HG2 1 1 6 4086 1 1 39 GLN HG3 H 2.726 -8.360 1.643 1.00 . A A . 39 GLN HG3 1 1 6 4087 1 1 39 GLN N N -0.056 -8.398 3.648 1.00 . A A . 39 GLN N 1 1 6 4088 1 1 39 GLN NE2 N 4.983 -8.941 2.425 1.00 . A A . 39 GLN NE2 1 1 6 4089 1 1 39 GLN O O 0.772 -6.985 0.884 1.00 . A A . 39 GLN O 1 1 6 4090 1 1 39 GLN OE1 O 4.115 -9.065 4.492 1.00 . A A . 39 GLN OE1 1 1 6 4091 1 1 40 HIS C C -2.661 -4.668 0.464 1.00 . A A . 40 HIS C 1 1 6 4092 1 1 40 HIS CA C -1.636 -5.796 0.426 1.00 . A A . 40 HIS CA 1 1 6 4093 1 1 40 HIS CB C -2.252 -7.023 -0.251 1.00 . A A . 40 HIS CB 1 1 6 4094 1 1 40 HIS CD2 C -0.498 -7.273 -2.150 1.00 . A A . 40 HIS CD2 1 1 6 4095 1 1 40 HIS CE1 C -0.251 -9.450 -2.068 1.00 . A A . 40 HIS CE1 1 1 6 4096 1 1 40 HIS CG C -1.312 -7.739 -1.172 1.00 . A A . 40 HIS CG 1 1 6 4097 1 1 40 HIS H H -1.677 -6.005 2.555 1.00 . A A . 40 HIS H 1 1 6 4098 1 1 40 HIS HA H -0.794 -5.470 -0.164 1.00 . A A . 40 HIS HA 1 1 6 4099 1 1 40 HIS HB2 H -2.569 -7.723 0.507 1.00 . A A . 40 HIS HB2 1 1 6 4100 1 1 40 HIS HB3 H -3.111 -6.713 -0.828 1.00 . A A . 40 HIS HB3 1 1 6 4101 1 1 40 HIS HD1 H -1.586 -9.732 -0.544 1.00 . A A . 40 HIS HD1 1 1 6 4102 1 1 40 HIS HD2 H -0.380 -6.241 -2.447 1.00 . A A . 40 HIS HD2 1 1 6 4103 1 1 40 HIS HE1 H 0.085 -10.455 -2.278 1.00 . A A . 40 HIS HE1 1 1 6 4104 1 1 40 HIS HE2 H 0.846 -8.320 -3.377 1.00 . A A . 40 HIS HE2 1 1 6 4105 1 1 40 HIS N N -1.130 -6.160 1.749 1.00 . A A . 40 HIS N 1 1 6 4106 1 1 40 HIS ND1 N -1.133 -9.107 -1.148 1.00 . A A . 40 HIS ND1 1 1 6 4107 1 1 40 HIS NE2 N 0.148 -8.357 -2.691 1.00 . A A . 40 HIS NE2 1 1 6 4108 1 1 40 HIS O O -2.928 -4.076 1.510 1.00 . A A . 40 HIS O 1 1 6 4109 1 1 41 CYS C C -5.187 -3.725 -2.008 1.00 . A A . 41 CYS C 1 1 6 4110 1 1 41 CYS CA C -4.232 -3.351 -0.877 1.00 . A A . 41 CYS CA 1 1 6 4111 1 1 41 CYS CB C -3.560 -2.006 -1.174 1.00 . A A . 41 CYS CB 1 1 6 4112 1 1 41 CYS H H -2.955 -4.916 -1.492 1.00 . A A . 41 CYS H 1 1 6 4113 1 1 41 CYS HA H -4.791 -3.274 0.044 1.00 . A A . 41 CYS HA 1 1 6 4114 1 1 41 CYS HB2 H -3.251 -1.554 -0.244 1.00 . A A . 41 CYS HB2 1 1 6 4115 1 1 41 CYS HB3 H -2.690 -2.177 -1.791 1.00 . A A . 41 CYS HB3 1 1 6 4116 1 1 41 CYS N N -3.227 -4.392 -0.709 1.00 . A A . 41 CYS N 1 1 6 4117 1 1 41 CYS O O -4.799 -4.411 -2.954 1.00 . A A . 41 CYS O 1 1 6 4118 1 1 41 CYS SG S -4.628 -0.809 -2.041 1.00 . A A . 41 CYS SG 1 1 6 4119 1 1 42 CYS C C -8.060 -2.285 -3.461 1.00 . A A . 42 CYS C 1 1 6 4120 1 1 42 CYS CA C -7.433 -3.570 -2.929 1.00 . A A . 42 CYS CA 1 1 6 4121 1 1 42 CYS CB C -8.519 -4.483 -2.357 1.00 . A A . 42 CYS CB 1 1 6 4122 1 1 42 CYS H H -6.686 -2.731 -1.134 1.00 . A A . 42 CYS H 1 1 6 4123 1 1 42 CYS HA H -6.937 -4.080 -3.741 1.00 . A A . 42 CYS HA 1 1 6 4124 1 1 42 CYS HB2 H -8.560 -4.355 -1.286 1.00 . A A . 42 CYS HB2 1 1 6 4125 1 1 42 CYS HB3 H -9.472 -4.205 -2.784 1.00 . A A . 42 CYS HB3 1 1 6 4126 1 1 42 CYS N N -6.433 -3.274 -1.908 1.00 . A A . 42 CYS N 1 1 6 4127 1 1 42 CYS O O -8.469 -1.424 -2.687 1.00 . A A . 42 CYS O 1 1 6 4128 1 1 42 CYS SG S -8.255 -6.255 -2.693 1.00 . A A . 42 CYS SG 1 1 6 4129 1 1 43 PRO C C -10.075 -0.556 -4.846 1.00 . A A . 43 PRO C 1 1 6 4130 1 1 43 PRO CA C -8.715 -0.937 -5.424 1.00 . A A . 43 PRO CA 1 1 6 4131 1 1 43 PRO CB C -8.851 -1.345 -6.891 1.00 . A A . 43 PRO CB 1 1 6 4132 1 1 43 PRO CD C -7.666 -3.104 -5.802 1.00 . A A . 43 PRO CD 1 1 6 4133 1 1 43 PRO CG C -7.766 -2.341 -7.095 1.00 . A A . 43 PRO CG 1 1 6 4134 1 1 43 PRO HA H -8.047 -0.092 -5.347 1.00 . A A . 43 PRO HA 1 1 6 4135 1 1 43 PRO HB2 H -9.826 -1.779 -7.060 1.00 . A A . 43 PRO HB2 1 1 6 4136 1 1 43 PRO HB3 H -8.718 -0.482 -7.524 1.00 . A A . 43 PRO HB3 1 1 6 4137 1 1 43 PRO HD2 H -8.305 -3.976 -5.828 1.00 . A A . 43 PRO HD2 1 1 6 4138 1 1 43 PRO HD3 H -6.643 -3.390 -5.611 1.00 . A A . 43 PRO HD3 1 1 6 4139 1 1 43 PRO HG2 H -8.021 -3.006 -7.907 1.00 . A A . 43 PRO HG2 1 1 6 4140 1 1 43 PRO HG3 H -6.836 -1.833 -7.300 1.00 . A A . 43 PRO HG3 1 1 6 4141 1 1 43 PRO N N -8.139 -2.132 -4.797 1.00 . A A . 43 PRO N 1 1 6 4142 1 1 43 PRO O O -10.933 -1.415 -4.624 1.00 . A A . 43 PRO O 1 1 6 4143 1 1 44 ALA C C -12.709 0.631 -4.725 1.00 . A A . 44 ALA C 1 1 6 4144 1 1 44 ALA CA C -11.501 1.263 -4.050 1.00 . A A . 44 ALA CA 1 1 6 4145 1 1 44 ALA CB C -11.549 2.777 -4.196 1.00 . A A . 44 ALA CB 1 1 6 4146 1 1 44 ALA H H -9.526 1.362 -4.798 1.00 . A A . 44 ALA H 1 1 6 4147 1 1 44 ALA HA H -11.524 1.024 -2.995 1.00 . A A . 44 ALA HA 1 1 6 4148 1 1 44 ALA HB1 H -11.127 3.237 -3.315 1.00 . A A . 44 ALA HB1 1 1 6 4149 1 1 44 ALA HB2 H -12.575 3.094 -4.312 1.00 . A A . 44 ALA HB2 1 1 6 4150 1 1 44 ALA HB3 H -10.980 3.073 -5.065 1.00 . A A . 44 ALA HB3 1 1 6 4151 1 1 44 ALA N N -10.256 0.741 -4.602 1.00 . A A . 44 ALA N 1 1 6 4152 1 1 44 ALA O O -12.815 0.624 -5.952 1.00 . A A . 44 ALA O 1 1 6 4153 1 1 45 GLY C C -14.684 -2.047 -4.458 1.00 . A A . 45 GLY C 1 1 6 4154 1 1 45 GLY CA C -14.800 -0.538 -4.449 1.00 . A A . 45 GLY CA 1 1 6 4155 1 1 45 GLY H H -13.471 0.129 -2.946 1.00 . A A . 45 GLY H 1 1 6 4156 1 1 45 GLY HA2 H -15.650 -0.256 -3.846 1.00 . A A . 45 GLY HA2 1 1 6 4157 1 1 45 GLY HA3 H -14.958 -0.194 -5.461 1.00 . A A . 45 GLY HA3 1 1 6 4158 1 1 45 GLY N N -13.614 0.096 -3.916 1.00 . A A . 45 GLY N 1 1 6 4159 1 1 45 GLY O O -15.647 -2.749 -4.770 1.00 . A A . 45 GLY O 1 1 6 4160 1 1 46 TYR C C -12.851 -4.425 -2.664 1.00 . A A . 46 TYR C 1 1 6 4161 1 1 46 TYR CA C -13.266 -3.989 -4.067 1.00 . A A . 46 TYR CA 1 1 6 4162 1 1 46 TYR CB C -12.186 -4.378 -5.078 1.00 . A A . 46 TYR CB 1 1 6 4163 1 1 46 TYR CD1 C -13.444 -5.333 -7.049 1.00 . A A . 46 TYR CD1 1 1 6 4164 1 1 46 TYR CD2 C -12.296 -3.264 -7.342 1.00 . A A . 46 TYR CD2 1 1 6 4165 1 1 46 TYR CE1 C -13.870 -5.286 -8.363 1.00 . A A . 46 TYR CE1 1 1 6 4166 1 1 46 TYR CE2 C -12.718 -3.211 -8.658 1.00 . A A . 46 TYR CE2 1 1 6 4167 1 1 46 TYR CG C -12.651 -4.324 -6.517 1.00 . A A . 46 TYR CG 1 1 6 4168 1 1 46 TYR CZ C -13.505 -4.224 -9.163 1.00 . A A . 46 TYR CZ 1 1 6 4169 1 1 46 TYR H H -12.769 -1.948 -3.859 1.00 . A A . 46 TYR H 1 1 6 4170 1 1 46 TYR HA H -14.189 -4.486 -4.329 1.00 . A A . 46 TYR HA 1 1 6 4171 1 1 46 TYR HB2 H -11.349 -3.704 -4.977 1.00 . A A . 46 TYR HB2 1 1 6 4172 1 1 46 TYR HB3 H -11.857 -5.386 -4.873 1.00 . A A . 46 TYR HB3 1 1 6 4173 1 1 46 TYR HD1 H -13.729 -6.164 -6.421 1.00 . A A . 46 TYR HD1 1 1 6 4174 1 1 46 TYR HD2 H -11.679 -2.472 -6.943 1.00 . A A . 46 TYR HD2 1 1 6 4175 1 1 46 TYR HE1 H -14.487 -6.080 -8.759 1.00 . A A . 46 TYR HE1 1 1 6 4176 1 1 46 TYR HE2 H -12.432 -2.379 -9.283 1.00 . A A . 46 TYR HE2 1 1 6 4177 1 1 46 TYR HH H -14.556 -3.458 -10.578 1.00 . A A . 46 TYR HH 1 1 6 4178 1 1 46 TYR N N -13.502 -2.551 -4.107 1.00 . A A . 46 TYR N 1 1 6 4179 1 1 46 TYR O O -12.516 -3.592 -1.821 1.00 . A A . 46 TYR O 1 1 6 4180 1 1 46 TYR OH O -13.927 -4.175 -10.471 1.00 . A A . 46 TYR OH 1 1 6 4181 1 1 47 LYS C C -11.325 -7.226 -1.233 1.00 . A A . 47 LYS C 1 1 6 4182 1 1 47 LYS CA C -12.508 -6.272 -1.115 1.00 . A A . 47 LYS CA 1 1 6 4183 1 1 47 LYS CB C -13.702 -6.994 -0.486 1.00 . A A . 47 LYS CB 1 1 6 4184 1 1 47 LYS CD C -13.637 -8.518 1.510 1.00 . A A . 47 LYS CD 1 1 6 4185 1 1 47 LYS CE C -15.029 -9.126 1.448 1.00 . A A . 47 LYS CE 1 1 6 4186 1 1 47 LYS CG C -13.634 -7.076 1.030 1.00 . A A . 47 LYS CG 1 1 6 4187 1 1 47 LYS H H -13.160 -6.342 -3.130 1.00 . A A . 47 LYS H 1 1 6 4188 1 1 47 LYS HA H -12.226 -5.444 -0.481 1.00 . A A . 47 LYS HA 1 1 6 4189 1 1 47 LYS HB2 H -14.607 -6.471 -0.757 1.00 . A A . 47 LYS HB2 1 1 6 4190 1 1 47 LYS HB3 H -13.745 -7.999 -0.878 1.00 . A A . 47 LYS HB3 1 1 6 4191 1 1 47 LYS HD2 H -12.974 -9.097 0.884 1.00 . A A . 47 LYS HD2 1 1 6 4192 1 1 47 LYS HD3 H -13.286 -8.548 2.533 1.00 . A A . 47 LYS HD3 1 1 6 4193 1 1 47 LYS HE2 H -15.368 -9.113 0.423 1.00 . A A . 47 LYS HE2 1 1 6 4194 1 1 47 LYS HE3 H -14.979 -10.147 1.796 1.00 . A A . 47 LYS HE3 1 1 6 4195 1 1 47 LYS HG2 H -12.728 -6.597 1.367 1.00 . A A . 47 LYS HG2 1 1 6 4196 1 1 47 LYS HG3 H -14.491 -6.565 1.447 1.00 . A A . 47 LYS HG3 1 1 6 4197 1 1 47 LYS HZ1 H -16.265 -7.484 1.821 1.00 . A A . 47 LYS HZ1 1 1 6 4198 1 1 47 LYS HZ2 H -15.584 -8.157 3.214 1.00 . A A . 47 LYS HZ2 1 1 6 4199 1 1 47 LYS HZ3 H -16.862 -8.944 2.434 1.00 . A A . 47 LYS HZ3 1 1 6 4200 1 1 47 LYS N N -12.879 -5.729 -2.419 1.00 . A A . 47 LYS N 1 1 6 4201 1 1 47 LYS NZ N -16.003 -8.375 2.287 1.00 . A A . 47 LYS NZ 1 1 6 4202 1 1 47 LYS O O -11.085 -7.804 -2.294 1.00 . A A . 47 LYS O 1 1 6 4203 1 1 48 CYS C C -9.859 -9.714 0.167 1.00 . A A . 48 CYS C 1 1 6 4204 1 1 48 CYS CA C -9.433 -8.277 -0.113 1.00 . A A . 48 CYS CA 1 1 6 4205 1 1 48 CYS CB C -8.427 -7.820 0.947 1.00 . A A . 48 CYS CB 1 1 6 4206 1 1 48 CYS H H -10.835 -6.903 0.680 1.00 . A A . 48 CYS H 1 1 6 4207 1 1 48 CYS HA H -8.962 -8.235 -1.084 1.00 . A A . 48 CYS HA 1 1 6 4208 1 1 48 CYS HB2 H -8.910 -7.818 1.913 1.00 . A A . 48 CYS HB2 1 1 6 4209 1 1 48 CYS HB3 H -7.598 -8.512 0.968 1.00 . A A . 48 CYS HB3 1 1 6 4210 1 1 48 CYS N N -10.591 -7.389 -0.135 1.00 . A A . 48 CYS N 1 1 6 4211 1 1 48 CYS O O -10.876 -9.954 0.818 1.00 . A A . 48 CYS O 1 1 6 4212 1 1 48 CYS SG S -7.750 -6.151 0.667 1.00 . A A . 48 CYS SG 1 1 6 4213 1 1 49 GLY C C -8.203 -12.856 0.405 1.00 . A A . 49 GLY C 1 1 6 4214 1 1 49 GLY CA C -9.390 -12.068 -0.120 1.00 . A A . 49 GLY CA 1 1 6 4215 1 1 49 GLY H H -8.277 -10.417 -0.839 1.00 . A A . 49 GLY H 1 1 6 4216 1 1 49 GLY HA2 H -10.200 -12.143 0.590 1.00 . A A . 49 GLY HA2 1 1 6 4217 1 1 49 GLY HA3 H -9.707 -12.498 -1.058 1.00 . A A . 49 GLY HA3 1 1 6 4218 1 1 49 GLY N N -9.076 -10.667 -0.329 1.00 . A A . 49 GLY N 1 1 6 4219 1 1 49 GLY O O -7.110 -12.309 0.547 1.00 . A A . 49 GLY O 1 1 6 4220 1 1 50 PRO C C -6.317 -15.404 0.131 1.00 . A A . 50 PRO C 1 1 6 4221 1 1 50 PRO CA C -7.310 -15.004 1.218 1.00 . A A . 50 PRO CA 1 1 6 4222 1 1 50 PRO CB C -8.053 -16.234 1.741 1.00 . A A . 50 PRO CB 1 1 6 4223 1 1 50 PRO CD C -9.659 -14.894 0.569 1.00 . A A . 50 PRO CD 1 1 6 4224 1 1 50 PRO CG C -9.283 -16.313 0.904 1.00 . A A . 50 PRO CG 1 1 6 4225 1 1 50 PRO HA H -6.782 -14.527 2.030 1.00 . A A . 50 PRO HA 1 1 6 4226 1 1 50 PRO HB2 H -7.434 -17.110 1.620 1.00 . A A . 50 PRO HB2 1 1 6 4227 1 1 50 PRO HB3 H -8.294 -16.096 2.784 1.00 . A A . 50 PRO HB3 1 1 6 4228 1 1 50 PRO HD2 H -10.032 -14.833 -0.443 1.00 . A A . 50 PRO HD2 1 1 6 4229 1 1 50 PRO HD3 H -10.396 -14.525 1.266 1.00 . A A . 50 PRO HD3 1 1 6 4230 1 1 50 PRO HG2 H -9.077 -16.869 0.001 1.00 . A A . 50 PRO HG2 1 1 6 4231 1 1 50 PRO HG3 H -10.076 -16.787 1.463 1.00 . A A . 50 PRO HG3 1 1 6 4232 1 1 50 PRO N N -8.387 -14.154 0.705 1.00 . A A . 50 PRO N 1 1 6 4233 1 1 50 PRO O O -5.164 -15.728 0.419 1.00 . A A . 50 PRO O 1 1 6 4234 1 1 51 GLY C C -5.130 -14.563 -2.772 1.00 . A A . 51 GLY C 1 1 6 4235 1 1 51 GLY CA C -5.913 -15.743 -2.231 1.00 . A A . 51 GLY CA 1 1 6 4236 1 1 51 GLY H H -7.702 -15.115 -1.286 1.00 . A A . 51 GLY H 1 1 6 4237 1 1 51 GLY HA2 H -5.218 -16.500 -1.901 1.00 . A A . 51 GLY HA2 1 1 6 4238 1 1 51 GLY HA3 H -6.523 -16.150 -3.023 1.00 . A A . 51 GLY HA3 1 1 6 4239 1 1 51 GLY N N -6.773 -15.380 -1.118 1.00 . A A . 51 GLY N 1 1 6 4240 1 1 51 GLY O O -4.593 -14.622 -3.878 1.00 . A A . 51 GLY O 1 1 6 4241 1 1 52 GLY C C -4.940 -11.658 -3.642 1.00 . A A . 52 GLY C 1 1 6 4242 1 1 52 GLY CA C -4.337 -12.307 -2.412 1.00 . A A . 52 GLY CA 1 1 6 4243 1 1 52 GLY H H -5.509 -13.503 -1.118 1.00 . A A . 52 GLY H 1 1 6 4244 1 1 52 GLY HA2 H -4.338 -11.589 -1.604 1.00 . A A . 52 GLY HA2 1 1 6 4245 1 1 52 GLY HA3 H -3.315 -12.584 -2.629 1.00 . A A . 52 GLY HA3 1 1 6 4246 1 1 52 GLY N N -5.063 -13.491 -1.990 1.00 . A A . 52 GLY N 1 1 6 4247 1 1 52 GLY O O -4.224 -11.099 -4.472 1.00 . A A . 52 GLY O 1 1 6 4248 1 1 53 THR C C -8.143 -10.299 -4.439 1.00 . A A . 53 THR C 1 1 6 4249 1 1 53 THR CA C -6.964 -11.148 -4.897 1.00 . A A . 53 THR CA 1 1 6 4250 1 1 53 THR CB C -7.474 -12.235 -5.862 1.00 . A A . 53 THR CB 1 1 6 4251 1 1 53 THR CG2 C -6.592 -12.319 -7.099 1.00 . A A . 53 THR CG2 1 1 6 4252 1 1 53 THR H H -6.778 -12.193 -3.065 1.00 . A A . 53 THR H 1 1 6 4253 1 1 53 THR HA H -6.266 -10.520 -5.433 1.00 . A A . 53 THR HA 1 1 6 4254 1 1 53 THR HB H -8.477 -11.980 -6.171 1.00 . A A . 53 THR HB 1 1 6 4255 1 1 53 THR HG1 H -6.652 -13.663 -4.776 1.00 . A A . 53 THR HG1 1 1 6 4256 1 1 53 THR HG21 H -7.100 -11.863 -7.935 1.00 . A A . 53 THR HG21 1 1 6 4257 1 1 53 THR HG22 H -6.386 -13.356 -7.325 1.00 . A A . 53 THR HG22 1 1 6 4258 1 1 53 THR HG23 H -5.663 -11.800 -6.915 1.00 . A A . 53 THR HG23 1 1 6 4259 1 1 53 THR N N -6.262 -11.733 -3.759 1.00 . A A . 53 THR N 1 1 6 4260 1 1 53 THR O O -8.690 -10.509 -3.356 1.00 . A A . 53 THR O 1 1 6 4261 1 1 53 THR OG1 O -7.499 -13.506 -5.201 1.00 . A A . 53 THR OG1 1 1 6 4262 1 1 54 CYS C C -10.936 -8.955 -5.602 1.00 . A A . 54 CYS C 1 1 6 4263 1 1 54 CYS CA C -9.651 -8.457 -4.953 1.00 . A A . 54 CYS CA 1 1 6 4264 1 1 54 CYS CB C -9.350 -7.030 -5.414 1.00 . A A . 54 CYS CB 1 1 6 4265 1 1 54 CYS H H -8.060 -9.220 -6.121 1.00 . A A . 54 CYS H 1 1 6 4266 1 1 54 CYS HA H -9.779 -8.459 -3.880 1.00 . A A . 54 CYS HA 1 1 6 4267 1 1 54 CYS HB2 H -9.227 -7.023 -6.486 1.00 . A A . 54 CYS HB2 1 1 6 4268 1 1 54 CYS HB3 H -10.179 -6.391 -5.148 1.00 . A A . 54 CYS HB3 1 1 6 4269 1 1 54 CYS N N -8.533 -9.338 -5.271 1.00 . A A . 54 CYS N 1 1 6 4270 1 1 54 CYS O O -10.957 -9.282 -6.789 1.00 . A A . 54 CYS O 1 1 6 4271 1 1 54 CYS SG S -7.843 -6.316 -4.679 1.00 . A A . 54 CYS SG 1 1 6 4272 1 1 55 ILE C C -14.363 -8.398 -5.177 1.00 . A A . 55 ILE C 1 1 6 4273 1 1 55 ILE CA C -13.296 -9.478 -5.313 1.00 . A A . 55 ILE CA 1 1 6 4274 1 1 55 ILE CB C -13.766 -10.743 -4.568 1.00 . A A . 55 ILE CB 1 1 6 4275 1 1 55 ILE CD1 C -14.105 -11.662 -2.215 1.00 . A A . 55 ILE CD1 1 1 6 4276 1 1 55 ILE CG1 C -13.367 -10.672 -3.091 1.00 . A A . 55 ILE CG1 1 1 6 4277 1 1 55 ILE CG2 C -13.186 -11.989 -5.221 1.00 . A A . 55 ILE CG2 1 1 6 4278 1 1 55 ILE H H -11.925 -8.742 -3.877 1.00 . A A . 55 ILE H 1 1 6 4279 1 1 55 ILE HA H -13.180 -9.725 -6.358 1.00 . A A . 55 ILE HA 1 1 6 4280 1 1 55 ILE HB H -14.842 -10.797 -4.640 1.00 . A A . 55 ILE HB 1 1 6 4281 1 1 55 ILE HD11 H -14.717 -12.304 -2.833 1.00 . A A . 55 ILE HD11 1 1 6 4282 1 1 55 ILE HD12 H -14.735 -11.128 -1.519 1.00 . A A . 55 ILE HD12 1 1 6 4283 1 1 55 ILE HD13 H -13.392 -12.261 -1.669 1.00 . A A . 55 ILE HD13 1 1 6 4284 1 1 55 ILE HG12 H -12.311 -10.875 -3.000 1.00 . A A . 55 ILE HG12 1 1 6 4285 1 1 55 ILE HG13 H -13.571 -9.680 -2.717 1.00 . A A . 55 ILE HG13 1 1 6 4286 1 1 55 ILE HG21 H -12.130 -11.842 -5.402 1.00 . A A . 55 ILE HG21 1 1 6 4287 1 1 55 ILE HG22 H -13.689 -12.172 -6.158 1.00 . A A . 55 ILE HG22 1 1 6 4288 1 1 55 ILE HG23 H -13.323 -12.836 -4.566 1.00 . A A . 55 ILE HG23 1 1 6 4289 1 1 55 ILE N N -12.006 -9.014 -4.815 1.00 . A A . 55 ILE N 1 1 6 4290 1 1 55 ILE O O -14.234 -7.483 -4.363 1.00 . A A . 55 ILE O 1 1 6 4291 1 1 56 SER C C -17.399 -7.768 -4.731 1.00 . A A . 56 SER C 1 1 6 4292 1 1 56 SER CA C -16.508 -7.543 -5.949 1.00 . A A . 56 SER CA 1 1 6 4293 1 1 56 SER CB C -17.340 -7.641 -7.229 1.00 . A A . 56 SER CB 1 1 6 4294 1 1 56 SER H H -15.460 -9.262 -6.606 1.00 . A A . 56 SER H 1 1 6 4295 1 1 56 SER HA H -16.076 -6.556 -5.886 1.00 . A A . 56 SER HA 1 1 6 4296 1 1 56 SER HB2 H -16.696 -7.908 -8.055 1.00 . A A . 56 SER HB2 1 1 6 4297 1 1 56 SER HB3 H -18.099 -8.401 -7.105 1.00 . A A . 56 SER HB3 1 1 6 4298 1 1 56 SER HG H -17.336 -5.693 -7.440 1.00 . A A . 56 SER HG 1 1 6 4299 1 1 56 SER N N -15.417 -8.509 -5.979 1.00 . A A . 56 SER N 1 1 6 4300 1 1 56 SER O O -17.432 -6.883 -3.852 1.00 . A A . 56 SER O 1 1 6 4301 1 1 56 SER OXT O -18.055 -8.830 -4.669 1.00 . A A . 56 SER OXT 1 1 6 4302 1 1 56 SER OG O -17.972 -6.408 -7.524 1.00 . A A . 56 SER OG 1 1 7 4303 1 1 1 ASP C C 2.237 14.405 -1.845 1.00 . A A . 1 ASP C 1 1 7 4304 1 1 1 ASP CA C 3.409 14.667 -2.786 1.00 . A A . 1 ASP CA 1 1 7 4305 1 1 1 ASP CB C 4.695 14.073 -2.208 1.00 . A A . 1 ASP CB 1 1 7 4306 1 1 1 ASP CG C 5.613 15.130 -1.626 1.00 . A A . 1 ASP CG 1 1 7 4307 1 1 1 ASP H1 H 3.782 16.597 -2.085 1.00 . A A . 1 ASP H1 1 1 7 4308 1 1 1 ASP H2 H 2.768 16.544 -3.437 1.00 . A A . 1 ASP H2 1 1 7 4309 1 1 1 ASP H3 H 4.430 16.286 -3.617 1.00 . A A . 1 ASP H3 1 1 7 4310 1 1 1 ASP HA H 3.203 14.208 -3.741 1.00 . A A . 1 ASP HA 1 1 7 4311 1 1 1 ASP HB2 H 4.441 13.373 -1.425 1.00 . A A . 1 ASP HB2 1 1 7 4312 1 1 1 ASP HB3 H 5.226 13.551 -2.990 1.00 . A A . 1 ASP HB3 1 1 7 4313 1 1 1 ASP N N 3.611 16.124 -2.996 1.00 . A A . 1 ASP N 1 1 7 4314 1 1 1 ASP O O 1.649 15.336 -1.296 1.00 . A A . 1 ASP O 1 1 7 4315 1 1 1 ASP OD1 O 6.659 15.414 -2.246 1.00 . A A . 1 ASP OD1 1 1 7 4316 1 1 1 ASP OD2 O 5.286 15.674 -0.550 1.00 . A A . 1 ASP OD2 1 1 7 4317 1 1 2 VAL C C 1.311 12.265 0.562 1.00 . A A . 2 VAL C 1 1 7 4318 1 1 2 VAL CA C 0.800 12.748 -0.791 1.00 . A A . 2 VAL CA 1 1 7 4319 1 1 2 VAL CB C -0.066 11.637 -1.420 1.00 . A A . 2 VAL CB 1 1 7 4320 1 1 2 VAL CG1 C -1.515 11.772 -0.974 1.00 . A A . 2 VAL CG1 1 1 7 4321 1 1 2 VAL CG2 C 0.037 11.665 -2.937 1.00 . A A . 2 VAL CG2 1 1 7 4322 1 1 2 VAL H H 2.408 12.432 -2.131 1.00 . A A . 2 VAL H 1 1 7 4323 1 1 2 VAL HA H 0.177 13.617 -0.640 1.00 . A A . 2 VAL HA 1 1 7 4324 1 1 2 VAL HB H 0.304 10.683 -1.072 1.00 . A A . 2 VAL HB 1 1 7 4325 1 1 2 VAL HG11 H -2.018 10.824 -1.094 1.00 . A A . 2 VAL HG11 1 1 7 4326 1 1 2 VAL HG12 H -2.008 12.521 -1.577 1.00 . A A . 2 VAL HG12 1 1 7 4327 1 1 2 VAL HG13 H -1.546 12.068 0.063 1.00 . A A . 2 VAL HG13 1 1 7 4328 1 1 2 VAL HG21 H -0.382 12.587 -3.310 1.00 . A A . 2 VAL HG21 1 1 7 4329 1 1 2 VAL HG22 H -0.509 10.829 -3.350 1.00 . A A . 2 VAL HG22 1 1 7 4330 1 1 2 VAL HG23 H 1.074 11.596 -3.229 1.00 . A A . 2 VAL HG23 1 1 7 4331 1 1 2 VAL N N 1.903 13.130 -1.665 1.00 . A A . 2 VAL N 1 1 7 4332 1 1 2 VAL O O 2.001 11.249 0.649 1.00 . A A . 2 VAL O 1 1 7 4333 1 1 3 GLN C C 0.599 11.422 3.463 1.00 . A A . 3 GLN C 1 1 7 4334 1 1 3 GLN CA C 1.380 12.635 2.966 1.00 . A A . 3 GLN CA 1 1 7 4335 1 1 3 GLN CB C 1.179 13.816 3.918 1.00 . A A . 3 GLN CB 1 1 7 4336 1 1 3 GLN CD C 2.390 15.756 4.994 1.00 . A A . 3 GLN CD 1 1 7 4337 1 1 3 GLN CG C 2.466 14.304 4.561 1.00 . A A . 3 GLN CG 1 1 7 4338 1 1 3 GLN H H 0.406 13.791 1.484 1.00 . A A . 3 GLN H 1 1 7 4339 1 1 3 GLN HA H 2.431 12.385 2.933 1.00 . A A . 3 GLN HA 1 1 7 4340 1 1 3 GLN HB2 H 0.744 14.637 3.367 1.00 . A A . 3 GLN HB2 1 1 7 4341 1 1 3 GLN HB3 H 0.499 13.520 4.703 1.00 . A A . 3 GLN HB3 1 1 7 4342 1 1 3 GLN HE21 H 1.976 16.316 3.131 1.00 . A A . 3 GLN HE21 1 1 7 4343 1 1 3 GLN HE22 H 2.060 17.589 4.296 1.00 . A A . 3 GLN HE22 1 1 7 4344 1 1 3 GLN HG2 H 2.672 13.698 5.431 1.00 . A A . 3 GLN HG2 1 1 7 4345 1 1 3 GLN HG3 H 3.272 14.197 3.851 1.00 . A A . 3 GLN HG3 1 1 7 4346 1 1 3 GLN N N 0.962 12.995 1.616 1.00 . A A . 3 GLN N 1 1 7 4347 1 1 3 GLN NE2 N 2.114 16.643 4.045 1.00 . A A . 3 GLN NE2 1 1 7 4348 1 1 3 GLN O O -0.586 11.522 3.781 1.00 . A A . 3 GLN O 1 1 7 4349 1 1 3 GLN OE1 O 2.579 16.078 6.167 1.00 . A A . 3 GLN OE1 1 1 7 4350 1 1 4 CYS C C 0.445 9.025 5.479 1.00 . A A . 4 CYS C 1 1 7 4351 1 1 4 CYS CA C 0.632 9.039 3.964 1.00 . A A . 4 CYS CA 1 1 7 4352 1 1 4 CYS CB C 1.459 7.827 3.530 1.00 . A A . 4 CYS CB 1 1 7 4353 1 1 4 CYS H H 2.210 10.256 3.243 1.00 . A A . 4 CYS H 1 1 7 4354 1 1 4 CYS HA H -0.339 8.982 3.496 1.00 . A A . 4 CYS HA 1 1 7 4355 1 1 4 CYS HB2 H 2.229 7.644 4.263 1.00 . A A . 4 CYS HB2 1 1 7 4356 1 1 4 CYS HB3 H 0.813 6.964 3.470 1.00 . A A . 4 CYS HB3 1 1 7 4357 1 1 4 CYS N N 1.269 10.273 3.517 1.00 . A A . 4 CYS N 1 1 7 4358 1 1 4 CYS O O -0.558 8.520 5.982 1.00 . A A . 4 CYS O 1 1 7 4359 1 1 4 CYS SG S 2.270 8.025 1.912 1.00 . A A . 4 CYS SG 1 1 7 4360 1 1 5 GLY C C 2.663 9.826 8.322 1.00 . A A . 5 GLY C 1 1 7 4361 1 1 5 GLY CA C 1.320 9.617 7.652 1.00 . A A . 5 GLY CA 1 1 7 4362 1 1 5 GLY H H 2.188 9.974 5.751 1.00 . A A . 5 GLY H 1 1 7 4363 1 1 5 GLY HA2 H 0.660 10.423 7.938 1.00 . A A . 5 GLY HA2 1 1 7 4364 1 1 5 GLY HA3 H 0.899 8.684 7.996 1.00 . A A . 5 GLY HA3 1 1 7 4365 1 1 5 GLY N N 1.411 9.582 6.203 1.00 . A A . 5 GLY N 1 1 7 4366 1 1 5 GLY O O 3.081 10.962 8.545 1.00 . A A . 5 GLY O 1 1 7 4367 1 1 6 GLY C C 5.606 9.702 8.568 1.00 . A A . 6 GLY C 1 1 7 4368 1 1 6 GLY CA C 4.631 8.807 9.304 1.00 . A A . 6 GLY CA 1 1 7 4369 1 1 6 GLY H H 2.952 7.845 8.456 1.00 . A A . 6 GLY H 1 1 7 4370 1 1 6 GLY HA2 H 4.493 9.192 10.304 1.00 . A A . 6 GLY HA2 1 1 7 4371 1 1 6 GLY HA3 H 5.052 7.814 9.369 1.00 . A A . 6 GLY HA3 1 1 7 4372 1 1 6 GLY N N 3.337 8.725 8.651 1.00 . A A . 6 GLY N 1 1 7 4373 1 1 6 GLY O O 5.948 10.784 9.049 1.00 . A A . 6 GLY O 1 1 7 4374 1 1 7 GLY C C 7.142 9.561 5.196 1.00 . A A . 7 GLY C 1 1 7 4375 1 1 7 GLY CA C 6.995 10.045 6.626 1.00 . A A . 7 GLY CA 1 1 7 4376 1 1 7 GLY H H 5.752 8.387 7.064 1.00 . A A . 7 GLY H 1 1 7 4377 1 1 7 GLY HA2 H 6.657 11.070 6.612 1.00 . A A . 7 GLY HA2 1 1 7 4378 1 1 7 GLY HA3 H 7.961 10.005 7.108 1.00 . A A . 7 GLY HA3 1 1 7 4379 1 1 7 GLY N N 6.057 9.256 7.400 1.00 . A A . 7 GLY N 1 1 7 4380 1 1 7 GLY O O 8.150 9.840 4.548 1.00 . A A . 7 GLY O 1 1 7 4381 1 1 8 PHE C C 5.419 9.268 2.388 1.00 . A A . 8 PHE C 1 1 7 4382 1 1 8 PHE CA C 6.181 8.343 3.327 1.00 . A A . 8 PHE CA 1 1 7 4383 1 1 8 PHE CB C 5.600 6.932 3.247 1.00 . A A . 8 PHE CB 1 1 7 4384 1 1 8 PHE CD1 C 6.994 5.252 2.009 1.00 . A A . 8 PHE CD1 1 1 7 4385 1 1 8 PHE CD2 C 7.274 5.436 4.371 1.00 . A A . 8 PHE CD2 1 1 7 4386 1 1 8 PHE CE1 C 7.951 4.255 1.970 1.00 . A A . 8 PHE CE1 1 1 7 4387 1 1 8 PHE CE2 C 8.232 4.441 4.338 1.00 . A A . 8 PHE CE2 1 1 7 4388 1 1 8 PHE CG C 6.644 5.853 3.208 1.00 . A A . 8 PHE CG 1 1 7 4389 1 1 8 PHE CZ C 8.572 3.850 3.136 1.00 . A A . 8 PHE CZ 1 1 7 4390 1 1 8 PHE H H 5.350 8.656 5.251 1.00 . A A . 8 PHE H 1 1 7 4391 1 1 8 PHE HA H 7.215 8.313 3.018 1.00 . A A . 8 PHE HA 1 1 7 4392 1 1 8 PHE HB2 H 4.976 6.759 4.108 1.00 . A A . 8 PHE HB2 1 1 7 4393 1 1 8 PHE HB3 H 5.000 6.848 2.353 1.00 . A A . 8 PHE HB3 1 1 7 4394 1 1 8 PHE HD1 H 6.510 5.569 1.098 1.00 . A A . 8 PHE HD1 1 1 7 4395 1 1 8 PHE HD2 H 7.009 5.897 5.310 1.00 . A A . 8 PHE HD2 1 1 7 4396 1 1 8 PHE HE1 H 8.214 3.795 1.029 1.00 . A A . 8 PHE HE1 1 1 7 4397 1 1 8 PHE HE2 H 8.715 4.126 5.251 1.00 . A A . 8 PHE HE2 1 1 7 4398 1 1 8 PHE HZ H 9.319 3.070 3.109 1.00 . A A . 8 PHE HZ 1 1 7 4399 1 1 8 PHE N N 6.138 8.845 4.694 1.00 . A A . 8 PHE N 1 1 7 4400 1 1 8 PHE O O 4.929 10.320 2.798 1.00 . A A . 8 PHE O 1 1 7 4401 1 1 9 SER C C 4.523 8.883 -1.195 1.00 . A A . 9 SER C 1 1 7 4402 1 1 9 SER CA C 4.625 9.652 0.118 1.00 . A A . 9 SER CA 1 1 7 4403 1 1 9 SER CB C 5.347 10.981 -0.116 1.00 . A A . 9 SER CB 1 1 7 4404 1 1 9 SER H H 5.740 8.014 0.870 1.00 . A A . 9 SER H 1 1 7 4405 1 1 9 SER HA H 3.630 9.852 0.486 1.00 . A A . 9 SER HA 1 1 7 4406 1 1 9 SER HB2 H 5.213 11.285 -1.143 1.00 . A A . 9 SER HB2 1 1 7 4407 1 1 9 SER HB3 H 4.931 11.734 0.539 1.00 . A A . 9 SER HB3 1 1 7 4408 1 1 9 SER HG H 7.185 11.658 -0.143 1.00 . A A . 9 SER HG 1 1 7 4409 1 1 9 SER N N 5.326 8.864 1.127 1.00 . A A . 9 SER N 1 1 7 4410 1 1 9 SER O O 5.313 7.975 -1.456 1.00 . A A . 9 SER O 1 1 7 4411 1 1 9 SER OG O 6.734 10.861 0.148 1.00 . A A . 9 SER OG 1 1 7 4412 1 1 10 CYS C C 3.000 9.608 -4.389 1.00 . A A . 10 CYS C 1 1 7 4413 1 1 10 CYS CA C 3.344 8.594 -3.303 1.00 . A A . 10 CYS CA 1 1 7 4414 1 1 10 CYS CB C 2.239 7.543 -3.190 1.00 . A A . 10 CYS CB 1 1 7 4415 1 1 10 CYS H H 2.948 9.980 -1.756 1.00 . A A . 10 CYS H 1 1 7 4416 1 1 10 CYS HA H 4.267 8.101 -3.570 1.00 . A A . 10 CYS HA 1 1 7 4417 1 1 10 CYS HB2 H 2.150 7.233 -2.160 1.00 . A A . 10 CYS HB2 1 1 7 4418 1 1 10 CYS HB3 H 1.306 7.980 -3.511 1.00 . A A . 10 CYS HB3 1 1 7 4419 1 1 10 CYS N N 3.547 9.251 -2.018 1.00 . A A . 10 CYS N 1 1 7 4420 1 1 10 CYS O O 3.018 10.817 -4.155 1.00 . A A . 10 CYS O 1 1 7 4421 1 1 10 CYS SG S 2.529 6.050 -4.194 1.00 . A A . 10 CYS SG 1 1 7 4422 1 1 11 HIS C C 0.907 10.368 -6.708 1.00 . A A . 11 HIS C 1 1 7 4423 1 1 11 HIS CA C 2.378 9.960 -6.718 1.00 . A A . 11 HIS CA 1 1 7 4424 1 1 11 HIS CB C 2.712 9.248 -8.030 1.00 . A A . 11 HIS CB 1 1 7 4425 1 1 11 HIS CD2 C 4.193 9.712 -10.110 1.00 . A A . 11 HIS CD2 1 1 7 4426 1 1 11 HIS CE1 C 5.063 11.620 -9.464 1.00 . A A . 11 HIS CE1 1 1 7 4427 1 1 11 HIS CG C 3.684 9.999 -8.887 1.00 . A A . 11 HIS CG 1 1 7 4428 1 1 11 HIS H H 2.734 8.132 -5.700 1.00 . A A . 11 HIS H 1 1 7 4429 1 1 11 HIS HA H 2.983 10.851 -6.642 1.00 . A A . 11 HIS HA 1 1 7 4430 1 1 11 HIS HB2 H 3.140 8.283 -7.809 1.00 . A A . 11 HIS HB2 1 1 7 4431 1 1 11 HIS HB3 H 1.802 9.112 -8.598 1.00 . A A . 11 HIS HB3 1 1 7 4432 1 1 11 HIS HD1 H 4.080 11.673 -7.670 1.00 . A A . 11 HIS HD1 1 1 7 4433 1 1 11 HIS HD2 H 3.970 8.841 -10.710 1.00 . A A . 11 HIS HD2 1 1 7 4434 1 1 11 HIS HE1 H 5.642 12.530 -9.444 1.00 . A A . 11 HIS HE1 1 1 7 4435 1 1 11 HIS HE2 H 5.491 10.846 -11.311 1.00 . A A . 11 HIS HE2 1 1 7 4436 1 1 11 HIS N N 2.706 9.104 -5.582 1.00 . A A . 11 HIS N 1 1 7 4437 1 1 11 HIS ND1 N 4.249 11.199 -8.511 1.00 . A A . 11 HIS ND1 1 1 7 4438 1 1 11 HIS NE2 N 5.046 10.736 -10.445 1.00 . A A . 11 HIS NE2 1 1 7 4439 1 1 11 HIS O O 0.095 9.815 -5.963 1.00 . A A . 11 HIS O 1 1 7 4440 1 1 12 ASP C C -1.753 10.721 -8.010 1.00 . A A . 12 ASP C 1 1 7 4441 1 1 12 ASP CA C -0.791 11.844 -7.647 1.00 . A A . 12 ASP CA 1 1 7 4442 1 1 12 ASP CB C -0.870 12.960 -8.689 1.00 . A A . 12 ASP CB 1 1 7 4443 1 1 12 ASP CG C 0.072 14.108 -8.382 1.00 . A A . 12 ASP CG 1 1 7 4444 1 1 12 ASP H H 1.271 11.742 -8.110 1.00 . A A . 12 ASP H 1 1 7 4445 1 1 12 ASP HA H -1.070 12.244 -6.684 1.00 . A A . 12 ASP HA 1 1 7 4446 1 1 12 ASP HB2 H -0.612 12.557 -9.659 1.00 . A A . 12 ASP HB2 1 1 7 4447 1 1 12 ASP HB3 H -1.880 13.342 -8.721 1.00 . A A . 12 ASP HB3 1 1 7 4448 1 1 12 ASP N N 0.575 11.346 -7.546 1.00 . A A . 12 ASP N 1 1 7 4449 1 1 12 ASP O O -1.480 9.921 -8.907 1.00 . A A . 12 ASP O 1 1 7 4450 1 1 12 ASP OD1 O 0.429 14.283 -7.198 1.00 . A A . 12 ASP OD1 1 1 7 4451 1 1 12 ASP OD2 O 0.451 14.833 -9.325 1.00 . A A . 12 ASP OD2 1 1 7 4452 1 1 13 GLY C C -3.576 8.352 -6.816 1.00 . A A . 13 GLY C 1 1 7 4453 1 1 13 GLY CA C -3.865 9.633 -7.571 1.00 . A A . 13 GLY CA 1 1 7 4454 1 1 13 GLY H H -3.042 11.329 -6.606 1.00 . A A . 13 GLY H 1 1 7 4455 1 1 13 GLY HA2 H -4.840 9.999 -7.279 1.00 . A A . 13 GLY HA2 1 1 7 4456 1 1 13 GLY HA3 H -3.875 9.421 -8.629 1.00 . A A . 13 GLY HA3 1 1 7 4457 1 1 13 GLY N N -2.879 10.665 -7.309 1.00 . A A . 13 GLY N 1 1 7 4458 1 1 13 GLY O O -4.384 7.423 -6.827 1.00 . A A . 13 GLY O 1 1 7 4459 1 1 14 GLU C C -2.531 7.215 -3.954 1.00 . A A . 14 GLU C 1 1 7 4460 1 1 14 GLU CA C -2.034 7.119 -5.393 1.00 . A A . 14 GLU CA 1 1 7 4461 1 1 14 GLU CB C -0.513 6.958 -5.396 1.00 . A A . 14 GLU CB 1 1 7 4462 1 1 14 GLU CD C -0.127 5.504 -7.427 1.00 . A A . 14 GLU CD 1 1 7 4463 1 1 14 GLU CG C 0.097 6.860 -6.784 1.00 . A A . 14 GLU CG 1 1 7 4464 1 1 14 GLU H H -1.813 9.071 -6.183 1.00 . A A . 14 GLU H 1 1 7 4465 1 1 14 GLU HA H -2.481 6.256 -5.861 1.00 . A A . 14 GLU HA 1 1 7 4466 1 1 14 GLU HB2 H -0.076 7.809 -4.898 1.00 . A A . 14 GLU HB2 1 1 7 4467 1 1 14 GLU HB3 H -0.257 6.062 -4.849 1.00 . A A . 14 GLU HB3 1 1 7 4468 1 1 14 GLU HG2 H -0.345 7.616 -7.413 1.00 . A A . 14 GLU HG2 1 1 7 4469 1 1 14 GLU HG3 H 1.160 7.035 -6.706 1.00 . A A . 14 GLU HG3 1 1 7 4470 1 1 14 GLU N N -2.421 8.300 -6.156 1.00 . A A . 14 GLU N 1 1 7 4471 1 1 14 GLU O O -3.005 8.265 -3.519 1.00 . A A . 14 GLU O 1 1 7 4472 1 1 14 GLU OE1 O -0.704 5.459 -8.533 1.00 . A A . 14 GLU OE1 1 1 7 4473 1 1 14 GLU OE2 O 0.277 4.487 -6.824 1.00 . A A . 14 GLU OE2 1 1 7 4474 1 1 15 THR C C -1.953 5.072 -1.069 1.00 . A A . 15 THR C 1 1 7 4475 1 1 15 THR CA C -2.829 6.055 -1.827 1.00 . A A . 15 THR CA 1 1 7 4476 1 1 15 THR CB C -4.296 5.608 -1.699 1.00 . A A . 15 THR CB 1 1 7 4477 1 1 15 THR CG2 C -4.846 5.947 -0.322 1.00 . A A . 15 THR CG2 1 1 7 4478 1 1 15 THR H H -2.017 5.309 -3.621 1.00 . A A . 15 THR H 1 1 7 4479 1 1 15 THR HA H -2.725 7.040 -1.395 1.00 . A A . 15 THR HA 1 1 7 4480 1 1 15 THR HB H -4.341 4.533 -1.834 1.00 . A A . 15 THR HB 1 1 7 4481 1 1 15 THR HG1 H -5.025 7.194 -2.615 1.00 . A A . 15 THR HG1 1 1 7 4482 1 1 15 THR HG21 H -5.806 5.468 -0.189 1.00 . A A . 15 THR HG21 1 1 7 4483 1 1 15 THR HG22 H -4.964 7.018 -0.235 1.00 . A A . 15 THR HG22 1 1 7 4484 1 1 15 THR HG23 H -4.161 5.597 0.436 1.00 . A A . 15 THR HG23 1 1 7 4485 1 1 15 THR N N -2.408 6.114 -3.222 1.00 . A A . 15 THR N 1 1 7 4486 1 1 15 THR O O -1.894 3.895 -1.422 1.00 . A A . 15 THR O 1 1 7 4487 1 1 15 THR OG1 O -5.094 6.242 -2.705 1.00 . A A . 15 THR OG1 1 1 7 4488 1 1 16 CYS C C -1.186 3.906 1.801 1.00 . A A . 16 CYS C 1 1 7 4489 1 1 16 CYS CA C -0.398 4.662 0.738 1.00 . A A . 16 CYS CA 1 1 7 4490 1 1 16 CYS CB C 0.735 5.467 1.380 1.00 . A A . 16 CYS CB 1 1 7 4491 1 1 16 CYS H H -1.333 6.480 0.228 1.00 . A A . 16 CYS H 1 1 7 4492 1 1 16 CYS HA H 0.031 3.946 0.055 1.00 . A A . 16 CYS HA 1 1 7 4493 1 1 16 CYS HB2 H 0.518 5.620 2.427 1.00 . A A . 16 CYS HB2 1 1 7 4494 1 1 16 CYS HB3 H 1.657 4.910 1.289 1.00 . A A . 16 CYS HB3 1 1 7 4495 1 1 16 CYS N N -1.267 5.538 -0.032 1.00 . A A . 16 CYS N 1 1 7 4496 1 1 16 CYS O O -2.316 4.268 2.131 1.00 . A A . 16 CYS O 1 1 7 4497 1 1 16 CYS SG S 1.003 7.104 0.626 1.00 . A A . 16 CYS SG 1 1 7 4498 1 1 17 CYS C C -0.179 1.580 4.381 1.00 . A A . 17 CYS C 1 1 7 4499 1 1 17 CYS CA C -1.209 2.024 3.350 1.00 . A A . 17 CYS CA 1 1 7 4500 1 1 17 CYS CB C -1.871 0.802 2.712 1.00 . A A . 17 CYS CB 1 1 7 4501 1 1 17 CYS H H 0.319 2.619 2.020 1.00 . A A . 17 CYS H 1 1 7 4502 1 1 17 CYS HA H -1.965 2.618 3.842 1.00 . A A . 17 CYS HA 1 1 7 4503 1 1 17 CYS HB2 H -1.206 0.388 1.968 1.00 . A A . 17 CYS HB2 1 1 7 4504 1 1 17 CYS HB3 H -2.054 0.060 3.476 1.00 . A A . 17 CYS HB3 1 1 7 4505 1 1 17 CYS N N -0.580 2.849 2.328 1.00 . A A . 17 CYS N 1 1 7 4506 1 1 17 CYS O O 0.926 1.170 4.031 1.00 . A A . 17 CYS O 1 1 7 4507 1 1 17 CYS SG S -3.459 1.161 1.894 1.00 . A A . 17 CYS SG 1 1 7 4508 1 1 18 PRO C C 0.360 -0.207 7.037 1.00 . A A . 18 PRO C 1 1 7 4509 1 1 18 PRO CA C 0.387 1.290 6.750 1.00 . A A . 18 PRO CA 1 1 7 4510 1 1 18 PRO CB C -0.158 2.077 7.938 1.00 . A A . 18 PRO CB 1 1 7 4511 1 1 18 PRO CD C -1.813 2.161 6.192 1.00 . A A . 18 PRO CD 1 1 7 4512 1 1 18 PRO CG C -1.628 2.157 7.690 1.00 . A A . 18 PRO CG 1 1 7 4513 1 1 18 PRO HA H 1.404 1.599 6.541 1.00 . A A . 18 PRO HA 1 1 7 4514 1 1 18 PRO HB2 H 0.063 1.551 8.856 1.00 . A A . 18 PRO HB2 1 1 7 4515 1 1 18 PRO HB3 H 0.291 3.059 7.962 1.00 . A A . 18 PRO HB3 1 1 7 4516 1 1 18 PRO HD2 H -2.615 1.498 5.908 1.00 . A A . 18 PRO HD2 1 1 7 4517 1 1 18 PRO HD3 H -2.012 3.161 5.840 1.00 . A A . 18 PRO HD3 1 1 7 4518 1 1 18 PRO HG2 H -2.119 1.298 8.125 1.00 . A A . 18 PRO HG2 1 1 7 4519 1 1 18 PRO HG3 H -2.021 3.068 8.117 1.00 . A A . 18 PRO HG3 1 1 7 4520 1 1 18 PRO N N -0.521 1.671 5.674 1.00 . A A . 18 PRO N 1 1 7 4521 1 1 18 PRO O O -0.037 -0.636 8.122 1.00 . A A . 18 PRO O 1 1 7 4522 1 1 19 THR C C 1.879 -2.883 7.212 1.00 . A A . 19 THR C 1 1 7 4523 1 1 19 THR CA C 0.812 -2.453 6.210 1.00 . A A . 19 THR CA 1 1 7 4524 1 1 19 THR CB C 1.085 -3.150 4.864 1.00 . A A . 19 THR CB 1 1 7 4525 1 1 19 THR CG2 C 0.170 -2.608 3.775 1.00 . A A . 19 THR CG2 1 1 7 4526 1 1 19 THR H H 1.092 -0.610 5.215 1.00 . A A . 19 THR H 1 1 7 4527 1 1 19 THR HA H -0.155 -2.771 6.568 1.00 . A A . 19 THR HA 1 1 7 4528 1 1 19 THR HB H 0.896 -4.208 4.978 1.00 . A A . 19 THR HB 1 1 7 4529 1 1 19 THR HG1 H 2.756 -3.720 3.987 1.00 . A A . 19 THR HG1 1 1 7 4530 1 1 19 THR HG21 H -0.210 -1.641 4.074 1.00 . A A . 19 THR HG21 1 1 7 4531 1 1 19 THR HG22 H -0.655 -3.288 3.625 1.00 . A A . 19 THR HG22 1 1 7 4532 1 1 19 THR HG23 H 0.727 -2.506 2.855 1.00 . A A . 19 THR HG23 1 1 7 4533 1 1 19 THR N N 0.787 -1.002 6.059 1.00 . A A . 19 THR N 1 1 7 4534 1 1 19 THR O O 2.088 -4.075 7.439 1.00 . A A . 19 THR O 1 1 7 4535 1 1 19 THR OG1 O 2.452 -2.959 4.482 1.00 . A A . 19 THR OG1 1 1 7 4536 1 1 20 SER C C 3.663 -1.040 9.811 1.00 . A A . 20 SER C 1 1 7 4537 1 1 20 SER CA C 3.591 -2.173 8.792 1.00 . A A . 20 SER CA 1 1 7 4538 1 1 20 SER CB C 4.943 -2.345 8.097 1.00 . A A . 20 SER CB 1 1 7 4539 1 1 20 SER H H 2.335 -0.974 7.590 1.00 . A A . 20 SER H 1 1 7 4540 1 1 20 SER HA H 3.337 -3.090 9.304 1.00 . A A . 20 SER HA 1 1 7 4541 1 1 20 SER HB2 H 4.941 -1.796 7.168 1.00 . A A . 20 SER HB2 1 1 7 4542 1 1 20 SER HB3 H 5.726 -1.965 8.738 1.00 . A A . 20 SER HB3 1 1 7 4543 1 1 20 SER HG H 6.142 -3.886 7.937 1.00 . A A . 20 SER HG 1 1 7 4544 1 1 20 SER N N 2.548 -1.905 7.811 1.00 . A A . 20 SER N 1 1 7 4545 1 1 20 SER O O 2.689 -0.316 10.014 1.00 . A A . 20 SER O 1 1 7 4546 1 1 20 SER OG O 5.205 -3.710 7.819 1.00 . A A . 20 SER OG 1 1 7 4547 1 1 21 GLN C C 5.929 1.255 10.903 1.00 . A A . 21 GLN C 1 1 7 4548 1 1 21 GLN CA C 5.008 0.163 11.438 1.00 . A A . 21 GLN CA 1 1 7 4549 1 1 21 GLN CB C 5.579 -0.423 12.731 1.00 . A A . 21 GLN CB 1 1 7 4550 1 1 21 GLN CD C 4.700 -1.223 14.964 1.00 . A A . 21 GLN CD 1 1 7 4551 1 1 21 GLN CG C 4.608 -1.343 13.456 1.00 . A A . 21 GLN CG 1 1 7 4552 1 1 21 GLN H H 5.564 -1.492 10.242 1.00 . A A . 21 GLN H 1 1 7 4553 1 1 21 GLN HA H 4.042 0.597 11.647 1.00 . A A . 21 GLN HA 1 1 7 4554 1 1 21 GLN HB2 H 6.469 -0.987 12.495 1.00 . A A . 21 GLN HB2 1 1 7 4555 1 1 21 GLN HB3 H 5.839 0.387 13.396 1.00 . A A . 21 GLN HB3 1 1 7 4556 1 1 21 GLN HE21 H 4.963 0.744 14.818 1.00 . A A . 21 GLN HE21 1 1 7 4557 1 1 21 GLN HE22 H 4.955 0.104 16.424 1.00 . A A . 21 GLN HE22 1 1 7 4558 1 1 21 GLN HG2 H 3.602 -1.095 13.151 1.00 . A A . 21 GLN HG2 1 1 7 4559 1 1 21 GLN HG3 H 4.824 -2.364 13.176 1.00 . A A . 21 GLN HG3 1 1 7 4560 1 1 21 GLN N N 4.820 -0.888 10.446 1.00 . A A . 21 GLN N 1 1 7 4561 1 1 21 GLN NE2 N 4.892 -0.002 15.451 1.00 . A A . 21 GLN NE2 1 1 7 4562 1 1 21 GLN O O 5.870 2.402 11.345 1.00 . A A . 21 GLN O 1 1 7 4563 1 1 21 GLN OE1 O 4.597 -2.215 15.684 1.00 . A A . 21 GLN OE1 1 1 7 4564 1 1 22 THR C C 7.699 1.733 7.824 1.00 . A A . 22 THR C 1 1 7 4565 1 1 22 THR CA C 7.710 1.838 9.345 1.00 . A A . 22 THR CA 1 1 7 4566 1 1 22 THR CB C 9.149 1.614 9.848 1.00 . A A . 22 THR CB 1 1 7 4567 1 1 22 THR CG2 C 9.187 1.520 11.365 1.00 . A A . 22 THR CG2 1 1 7 4568 1 1 22 THR H H 6.777 -0.040 9.636 1.00 . A A . 22 THR H 1 1 7 4569 1 1 22 THR HA H 7.403 2.834 9.630 1.00 . A A . 22 THR HA 1 1 7 4570 1 1 22 THR HB H 9.756 2.453 9.539 1.00 . A A . 22 THR HB 1 1 7 4571 1 1 22 THR HG1 H 9.776 -0.252 9.963 1.00 . A A . 22 THR HG1 1 1 7 4572 1 1 22 THR HG21 H 8.325 0.969 11.713 1.00 . A A . 22 THR HG21 1 1 7 4573 1 1 22 THR HG22 H 9.172 2.514 11.787 1.00 . A A . 22 THR HG22 1 1 7 4574 1 1 22 THR HG23 H 10.087 1.011 11.671 1.00 . A A . 22 THR HG23 1 1 7 4575 1 1 22 THR N N 6.778 0.889 9.946 1.00 . A A . 22 THR N 1 1 7 4576 1 1 22 THR O O 8.516 2.353 7.143 1.00 . A A . 22 THR O 1 1 7 4577 1 1 22 THR OG1 O 9.686 0.414 9.278 1.00 . A A . 22 THR OG1 1 1 7 4578 1 1 23 THR C C 5.277 1.181 5.355 1.00 . A A . 23 THR C 1 1 7 4579 1 1 23 THR CA C 6.655 0.754 5.856 1.00 . A A . 23 THR CA 1 1 7 4580 1 1 23 THR CB C 6.929 -0.718 5.467 1.00 . A A . 23 THR CB 1 1 7 4581 1 1 23 THR CG2 C 5.970 -1.210 4.389 1.00 . A A . 23 THR CG2 1 1 7 4582 1 1 23 THR H H 6.149 0.473 7.891 1.00 . A A . 23 THR H 1 1 7 4583 1 1 23 THR HA H 7.403 1.373 5.381 1.00 . A A . 23 THR HA 1 1 7 4584 1 1 23 THR HB H 6.802 -1.332 6.346 1.00 . A A . 23 THR HB 1 1 7 4585 1 1 23 THR HG1 H 8.295 -0.773 4.044 1.00 . A A . 23 THR HG1 1 1 7 4586 1 1 23 THR HG21 H 6.038 -0.567 3.525 1.00 . A A . 23 THR HG21 1 1 7 4587 1 1 23 THR HG22 H 4.960 -1.193 4.772 1.00 . A A . 23 THR HG22 1 1 7 4588 1 1 23 THR HG23 H 6.230 -2.220 4.108 1.00 . A A . 23 THR HG23 1 1 7 4589 1 1 23 THR N N 6.770 0.943 7.297 1.00 . A A . 23 THR N 1 1 7 4590 1 1 23 THR O O 4.270 0.995 6.040 1.00 . A A . 23 THR O 1 1 7 4591 1 1 23 THR OG1 O 8.277 -0.854 5.001 1.00 . A A . 23 THR OG1 1 1 7 4592 1 1 24 TRP C C 3.856 1.684 2.127 1.00 . A A . 24 TRP C 1 1 7 4593 1 1 24 TRP CA C 3.994 2.207 3.556 1.00 . A A . 24 TRP CA 1 1 7 4594 1 1 24 TRP CB C 3.941 3.735 3.545 1.00 . A A . 24 TRP CB 1 1 7 4595 1 1 24 TRP CD1 C 4.290 4.657 5.907 1.00 . A A . 24 TRP CD1 1 1 7 4596 1 1 24 TRP CD2 C 2.164 4.666 5.220 1.00 . A A . 24 TRP CD2 1 1 7 4597 1 1 24 TRP CE2 C 2.212 5.192 6.524 1.00 . A A . 24 TRP CE2 1 1 7 4598 1 1 24 TRP CE3 C 0.932 4.572 4.577 1.00 . A A . 24 TRP CE3 1 1 7 4599 1 1 24 TRP CG C 3.500 4.329 4.846 1.00 . A A . 24 TRP CG 1 1 7 4600 1 1 24 TRP CH2 C -0.124 5.517 6.534 1.00 . A A . 24 TRP CH2 1 1 7 4601 1 1 24 TRP CZ2 C 1.071 5.623 7.193 1.00 . A A . 24 TRP CZ2 1 1 7 4602 1 1 24 TRP CZ3 C -0.199 4.998 5.239 1.00 . A A . 24 TRP CZ3 1 1 7 4603 1 1 24 TRP H H 6.080 1.871 3.661 1.00 . A A . 24 TRP H 1 1 7 4604 1 1 24 TRP HA H 3.176 1.828 4.155 1.00 . A A . 24 TRP HA 1 1 7 4605 1 1 24 TRP HB2 H 4.923 4.121 3.320 1.00 . A A . 24 TRP HB2 1 1 7 4606 1 1 24 TRP HB3 H 3.248 4.058 2.780 1.00 . A A . 24 TRP HB3 1 1 7 4607 1 1 24 TRP HD1 H 5.357 4.522 5.930 1.00 . A A . 24 TRP HD1 1 1 7 4608 1 1 24 TRP HE1 H 3.861 5.486 7.790 1.00 . A A . 24 TRP HE1 1 1 7 4609 1 1 24 TRP HE3 H 0.856 4.176 3.577 1.00 . A A . 24 TRP HE3 1 1 7 4610 1 1 24 TRP HH2 H -1.035 5.836 7.010 1.00 . A A . 24 TRP HH2 1 1 7 4611 1 1 24 TRP HZ2 H 1.112 6.026 8.193 1.00 . A A . 24 TRP HZ2 1 1 7 4612 1 1 24 TRP HZ3 H -1.163 4.932 4.755 1.00 . A A . 24 TRP HZ3 1 1 7 4613 1 1 24 TRP N N 5.244 1.753 4.156 1.00 . A A . 24 TRP N 1 1 7 4614 1 1 24 TRP NE1 N 3.523 5.177 6.923 1.00 . A A . 24 TRP NE1 1 1 7 4615 1 1 24 TRP O O 4.723 1.921 1.285 1.00 . A A . 24 TRP O 1 1 7 4616 1 1 25 GLY C C 1.726 1.413 -0.336 1.00 . A A . 25 GLY C 1 1 7 4617 1 1 25 GLY CA C 2.527 0.456 0.523 1.00 . A A . 25 GLY CA 1 1 7 4618 1 1 25 GLY H H 2.097 0.834 2.561 1.00 . A A . 25 GLY H 1 1 7 4619 1 1 25 GLY HA2 H 3.481 0.275 0.049 1.00 . A A . 25 GLY HA2 1 1 7 4620 1 1 25 GLY HA3 H 1.992 -0.477 0.599 1.00 . A A . 25 GLY HA3 1 1 7 4621 1 1 25 GLY N N 2.758 0.984 1.855 1.00 . A A . 25 GLY N 1 1 7 4622 1 1 25 GLY O O 0.769 2.024 0.137 1.00 . A A . 25 GLY O 1 1 7 4623 1 1 26 CYS C C 0.375 1.735 -3.333 1.00 . A A . 26 CYS C 1 1 7 4624 1 1 26 CYS CA C 1.449 2.455 -2.520 1.00 . A A . 26 CYS CA 1 1 7 4625 1 1 26 CYS CB C 2.465 3.104 -3.464 1.00 . A A . 26 CYS CB 1 1 7 4626 1 1 26 CYS H H 2.904 1.043 -1.905 1.00 . A A . 26 CYS H 1 1 7 4627 1 1 26 CYS HA H 0.976 3.230 -1.936 1.00 . A A . 26 CYS HA 1 1 7 4628 1 1 26 CYS HB2 H 3.286 2.421 -3.621 1.00 . A A . 26 CYS HB2 1 1 7 4629 1 1 26 CYS HB3 H 1.986 3.309 -4.410 1.00 . A A . 26 CYS HB3 1 1 7 4630 1 1 26 CYS N N 2.127 1.551 -1.595 1.00 . A A . 26 CYS N 1 1 7 4631 1 1 26 CYS O O 0.624 0.686 -3.926 1.00 . A A . 26 CYS O 1 1 7 4632 1 1 26 CYS SG S 3.159 4.671 -2.843 1.00 . A A . 26 CYS SG 1 1 7 4633 1 1 27 CYS C C -2.412 2.717 -5.186 1.00 . A A . 27 CYS C 1 1 7 4634 1 1 27 CYS CA C -1.948 1.756 -4.092 1.00 . A A . 27 CYS CA 1 1 7 4635 1 1 27 CYS CB C -3.115 1.458 -3.146 1.00 . A A . 27 CYS CB 1 1 7 4636 1 1 27 CYS H H -0.945 3.154 -2.861 1.00 . A A . 27 CYS H 1 1 7 4637 1 1 27 CYS HA H -1.620 0.834 -4.550 1.00 . A A . 27 CYS HA 1 1 7 4638 1 1 27 CYS HB2 H -2.753 1.448 -2.129 1.00 . A A . 27 CYS HB2 1 1 7 4639 1 1 27 CYS HB3 H -3.853 2.240 -3.248 1.00 . A A . 27 CYS HB3 1 1 7 4640 1 1 27 CYS N N -0.821 2.319 -3.354 1.00 . A A . 27 CYS N 1 1 7 4641 1 1 27 CYS O O -2.608 3.906 -4.933 1.00 . A A . 27 CYS O 1 1 7 4642 1 1 27 CYS SG S -3.949 -0.134 -3.463 1.00 . A A . 27 CYS SG 1 1 7 4643 1 1 28 PRO C C -4.565 3.113 -7.630 1.00 . A A . 28 PRO C 1 1 7 4644 1 1 28 PRO CA C -3.042 3.025 -7.549 1.00 . A A . 28 PRO CA 1 1 7 4645 1 1 28 PRO CB C -2.482 2.279 -8.768 1.00 . A A . 28 PRO CB 1 1 7 4646 1 1 28 PRO CD C -2.398 0.825 -6.827 1.00 . A A . 28 PRO CD 1 1 7 4647 1 1 28 PRO CG C -1.974 0.955 -8.266 1.00 . A A . 28 PRO CG 1 1 7 4648 1 1 28 PRO HA H -2.626 4.021 -7.509 1.00 . A A . 28 PRO HA 1 1 7 4649 1 1 28 PRO HB2 H -3.268 2.142 -9.496 1.00 . A A . 28 PRO HB2 1 1 7 4650 1 1 28 PRO HB3 H -1.685 2.860 -9.207 1.00 . A A . 28 PRO HB3 1 1 7 4651 1 1 28 PRO HD2 H -3.316 0.262 -6.751 1.00 . A A . 28 PRO HD2 1 1 7 4652 1 1 28 PRO HD3 H -1.616 0.362 -6.243 1.00 . A A . 28 PRO HD3 1 1 7 4653 1 1 28 PRO HG2 H -2.404 0.156 -8.851 1.00 . A A . 28 PRO HG2 1 1 7 4654 1 1 28 PRO HG3 H -0.896 0.929 -8.341 1.00 . A A . 28 PRO HG3 1 1 7 4655 1 1 28 PRO N N -2.599 2.216 -6.421 1.00 . A A . 28 PRO N 1 1 7 4656 1 1 28 PRO O O -5.166 2.732 -8.634 1.00 . A A . 28 PRO O 1 1 7 4657 1 1 29 SER C C -7.037 4.981 -5.705 1.00 . A A . 29 SER C 1 1 7 4658 1 1 29 SER CA C -6.634 3.741 -6.505 1.00 . A A . 29 SER CA 1 1 7 4659 1 1 29 SER CB C -7.246 2.487 -5.876 1.00 . A A . 29 SER CB 1 1 7 4660 1 1 29 SER H H -4.647 3.890 -5.789 1.00 . A A . 29 SER H 1 1 7 4661 1 1 29 SER HA H -6.999 3.842 -7.516 1.00 . A A . 29 SER HA 1 1 7 4662 1 1 29 SER HB2 H -7.574 2.713 -4.873 1.00 . A A . 29 SER HB2 1 1 7 4663 1 1 29 SER HB3 H -8.091 2.167 -6.468 1.00 . A A . 29 SER HB3 1 1 7 4664 1 1 29 SER HG H -5.495 1.746 -5.406 1.00 . A A . 29 SER HG 1 1 7 4665 1 1 29 SER N N -5.181 3.608 -6.561 1.00 . A A . 29 SER N 1 1 7 4666 1 1 29 SER O O -6.229 5.527 -4.955 1.00 . A A . 29 SER O 1 1 7 4667 1 1 29 SER OG O -6.302 1.431 -5.821 1.00 . A A . 29 SER OG 1 1 7 4668 1 1 30 PRO C C -8.753 6.451 -3.623 1.00 . A A . 30 PRO C 1 1 7 4669 1 1 30 PRO CA C -8.783 6.634 -5.137 1.00 . A A . 30 PRO CA 1 1 7 4670 1 1 30 PRO CB C -10.226 6.795 -5.630 1.00 . A A . 30 PRO CB 1 1 7 4671 1 1 30 PRO CD C -9.329 4.872 -6.730 1.00 . A A . 30 PRO CD 1 1 7 4672 1 1 30 PRO CG C -10.600 5.466 -6.190 1.00 . A A . 30 PRO CG 1 1 7 4673 1 1 30 PRO HA H -8.212 7.512 -5.399 1.00 . A A . 30 PRO HA 1 1 7 4674 1 1 30 PRO HB2 H -10.862 7.066 -4.800 1.00 . A A . 30 PRO HB2 1 1 7 4675 1 1 30 PRO HB3 H -10.266 7.565 -6.386 1.00 . A A . 30 PRO HB3 1 1 7 4676 1 1 30 PRO HD2 H -9.350 3.795 -6.645 1.00 . A A . 30 PRO HD2 1 1 7 4677 1 1 30 PRO HD3 H -9.178 5.171 -7.755 1.00 . A A . 30 PRO HD3 1 1 7 4678 1 1 30 PRO HG2 H -11.004 4.839 -5.410 1.00 . A A . 30 PRO HG2 1 1 7 4679 1 1 30 PRO HG3 H -11.320 5.592 -6.984 1.00 . A A . 30 PRO HG3 1 1 7 4680 1 1 30 PRO N N -8.293 5.450 -5.855 1.00 . A A . 30 PRO N 1 1 7 4681 1 1 30 PRO O O -8.000 7.128 -2.923 1.00 . A A . 30 PRO O 1 1 7 4682 1 1 31 LYS C C -8.640 4.127 -1.328 1.00 . A A . 31 LYS C 1 1 7 4683 1 1 31 LYS CA C -9.616 5.243 -1.688 1.00 . A A . 31 LYS CA 1 1 7 4684 1 1 31 LYS CB C -11.034 4.855 -1.265 1.00 . A A . 31 LYS CB 1 1 7 4685 1 1 31 LYS CD C -13.432 5.577 -1.064 1.00 . A A . 31 LYS CD 1 1 7 4686 1 1 31 LYS CE C -14.193 4.427 -1.704 1.00 . A A . 31 LYS CE 1 1 7 4687 1 1 31 LYS CG C -12.101 5.819 -1.758 1.00 . A A . 31 LYS CG 1 1 7 4688 1 1 31 LYS H H -10.129 4.996 -3.726 1.00 . A A . 31 LYS H 1 1 7 4689 1 1 31 LYS HA H -9.325 6.141 -1.165 1.00 . A A . 31 LYS HA 1 1 7 4690 1 1 31 LYS HB2 H -11.258 3.873 -1.655 1.00 . A A . 31 LYS HB2 1 1 7 4691 1 1 31 LYS HB3 H -11.079 4.822 -0.187 1.00 . A A . 31 LYS HB3 1 1 7 4692 1 1 31 LYS HD2 H -13.249 5.340 -0.027 1.00 . A A . 31 LYS HD2 1 1 7 4693 1 1 31 LYS HD3 H -14.030 6.474 -1.129 1.00 . A A . 31 LYS HD3 1 1 7 4694 1 1 31 LYS HE2 H -14.178 4.556 -2.776 1.00 . A A . 31 LYS HE2 1 1 7 4695 1 1 31 LYS HE3 H -13.701 3.501 -1.447 1.00 . A A . 31 LYS HE3 1 1 7 4696 1 1 31 LYS HG2 H -11.779 6.829 -1.555 1.00 . A A . 31 LYS HG2 1 1 7 4697 1 1 31 LYS HG3 H -12.230 5.685 -2.821 1.00 . A A . 31 LYS HG3 1 1 7 4698 1 1 31 LYS HZ1 H -16.221 4.879 -1.913 1.00 . A A . 31 LYS HZ1 1 1 7 4699 1 1 31 LYS HZ2 H -15.697 4.811 -0.306 1.00 . A A . 31 LYS HZ2 1 1 7 4700 1 1 31 LYS HZ3 H -15.924 3.383 -1.181 1.00 . A A . 31 LYS HZ3 1 1 7 4701 1 1 31 LYS N N -9.566 5.523 -3.121 1.00 . A A . 31 LYS N 1 1 7 4702 1 1 31 LYS NZ N -15.607 4.370 -1.243 1.00 . A A . 31 LYS NZ 1 1 7 4703 1 1 31 LYS O O -7.813 4.275 -0.428 1.00 . A A . 31 LYS O 1 1 7 4704 1 1 32 ALA C C -8.129 1.192 -0.490 1.00 . A A . 32 ALA C 1 1 7 4705 1 1 32 ALA CA C -7.886 1.853 -1.844 1.00 . A A . 32 ALA CA 1 1 7 4706 1 1 32 ALA CB C -6.422 2.246 -1.987 1.00 . A A . 32 ALA CB 1 1 7 4707 1 1 32 ALA H H -9.427 2.973 -2.755 1.00 . A A . 32 ALA H 1 1 7 4708 1 1 32 ALA HA H -8.111 1.136 -2.621 1.00 . A A . 32 ALA HA 1 1 7 4709 1 1 32 ALA HB1 H -5.936 1.576 -2.681 1.00 . A A . 32 ALA HB1 1 1 7 4710 1 1 32 ALA HB2 H -5.937 2.181 -1.025 1.00 . A A . 32 ALA HB2 1 1 7 4711 1 1 32 ALA HB3 H -6.356 3.258 -2.357 1.00 . A A . 32 ALA HB3 1 1 7 4712 1 1 32 ALA N N -8.748 3.014 -2.053 1.00 . A A . 32 ALA N 1 1 7 4713 1 1 32 ALA O O -8.138 1.854 0.549 1.00 . A A . 32 ALA O 1 1 7 4714 1 1 33 VAL C C -7.254 -1.686 1.041 1.00 . A A . 33 VAL C 1 1 7 4715 1 1 33 VAL CA C -8.518 -0.906 0.700 1.00 . A A . 33 VAL CA 1 1 7 4716 1 1 33 VAL CB C -9.695 -1.891 0.547 1.00 . A A . 33 VAL CB 1 1 7 4717 1 1 33 VAL CG1 C -10.271 -2.251 1.907 1.00 . A A . 33 VAL CG1 1 1 7 4718 1 1 33 VAL CG2 C -10.773 -1.307 -0.357 1.00 . A A . 33 VAL CG2 1 1 7 4719 1 1 33 VAL H H -8.262 -0.596 -1.372 1.00 . A A . 33 VAL H 1 1 7 4720 1 1 33 VAL HA H -8.742 -0.220 1.506 1.00 . A A . 33 VAL HA 1 1 7 4721 1 1 33 VAL HB H -9.322 -2.795 0.088 1.00 . A A . 33 VAL HB 1 1 7 4722 1 1 33 VAL HG11 H -9.468 -2.354 2.621 1.00 . A A . 33 VAL HG11 1 1 7 4723 1 1 33 VAL HG12 H -10.810 -3.184 1.834 1.00 . A A . 33 VAL HG12 1 1 7 4724 1 1 33 VAL HG13 H -10.944 -1.472 2.230 1.00 . A A . 33 VAL HG13 1 1 7 4725 1 1 33 VAL HG21 H -10.430 -1.320 -1.381 1.00 . A A . 33 VAL HG21 1 1 7 4726 1 1 33 VAL HG22 H -10.981 -0.291 -0.059 1.00 . A A . 33 VAL HG22 1 1 7 4727 1 1 33 VAL HG23 H -11.672 -1.899 -0.272 1.00 . A A . 33 VAL HG23 1 1 7 4728 1 1 33 VAL N N -8.301 -0.128 -0.514 1.00 . A A . 33 VAL N 1 1 7 4729 1 1 33 VAL O O -6.881 -2.617 0.330 1.00 . A A . 33 VAL O 1 1 7 4730 1 1 34 CYS C C -5.590 -3.333 3.103 1.00 . A A . 34 CYS C 1 1 7 4731 1 1 34 CYS CA C -5.350 -1.937 2.533 1.00 . A A . 34 CYS CA 1 1 7 4732 1 1 34 CYS CB C -4.634 -1.071 3.572 1.00 . A A . 34 CYS CB 1 1 7 4733 1 1 34 CYS H H -6.929 -0.534 2.642 1.00 . A A . 34 CYS H 1 1 7 4734 1 1 34 CYS HA H -4.718 -2.025 1.663 1.00 . A A . 34 CYS HA 1 1 7 4735 1 1 34 CYS HB2 H -5.020 -1.307 4.553 1.00 . A A . 34 CYS HB2 1 1 7 4736 1 1 34 CYS HB3 H -3.575 -1.287 3.546 1.00 . A A . 34 CYS HB3 1 1 7 4737 1 1 34 CYS N N -6.588 -1.290 2.118 1.00 . A A . 34 CYS N 1 1 7 4738 1 1 34 CYS O O -5.954 -3.478 4.271 1.00 . A A . 34 CYS O 1 1 7 4739 1 1 34 CYS SG S -4.841 0.720 3.314 1.00 . A A . 34 CYS SG 1 1 7 4740 1 1 35 CYS C C -4.613 -5.968 3.945 1.00 . A A . 35 CYS C 1 1 7 4741 1 1 35 CYS CA C -5.511 -5.740 2.736 1.00 . A A . 35 CYS CA 1 1 7 4742 1 1 35 CYS CB C -5.167 -6.724 1.614 1.00 . A A . 35 CYS CB 1 1 7 4743 1 1 35 CYS H H -5.042 -4.188 1.372 1.00 . A A . 35 CYS H 1 1 7 4744 1 1 35 CYS HA H -6.541 -5.879 3.032 1.00 . A A . 35 CYS HA 1 1 7 4745 1 1 35 CYS HB2 H -5.340 -6.247 0.661 1.00 . A A . 35 CYS HB2 1 1 7 4746 1 1 35 CYS HB3 H -4.124 -6.994 1.691 1.00 . A A . 35 CYS HB3 1 1 7 4747 1 1 35 CYS N N -5.353 -4.361 2.285 1.00 . A A . 35 CYS N 1 1 7 4748 1 1 35 CYS O O -3.382 -5.869 3.846 1.00 . A A . 35 CYS O 1 1 7 4749 1 1 35 CYS SG S -6.144 -8.263 1.649 1.00 . A A . 35 CYS SG 1 1 7 4750 1 1 36 ASP C C -4.245 -7.902 6.646 1.00 . A A . 36 ASP C 1 1 7 4751 1 1 36 ASP CA C -4.522 -6.433 6.340 1.00 . A A . 36 ASP CA 1 1 7 4752 1 1 36 ASP CB C -5.303 -5.808 7.497 1.00 . A A . 36 ASP CB 1 1 7 4753 1 1 36 ASP CG C -6.586 -6.554 7.802 1.00 . A A . 36 ASP CG 1 1 7 4754 1 1 36 ASP H H -6.222 -6.281 5.085 1.00 . A A . 36 ASP H 1 1 7 4755 1 1 36 ASP HA H -3.577 -5.920 6.252 1.00 . A A . 36 ASP HA 1 1 7 4756 1 1 36 ASP HB2 H -4.687 -5.814 8.384 1.00 . A A . 36 ASP HB2 1 1 7 4757 1 1 36 ASP HB3 H -5.552 -4.787 7.244 1.00 . A A . 36 ASP HB3 1 1 7 4758 1 1 36 ASP N N -5.243 -6.236 5.087 1.00 . A A . 36 ASP N 1 1 7 4759 1 1 36 ASP O O -3.442 -8.198 7.531 1.00 . A A . 36 ASP O 1 1 7 4760 1 1 36 ASP OD1 O -6.530 -7.548 8.556 1.00 . A A . 36 ASP OD1 1 1 7 4761 1 1 36 ASP OD2 O -7.649 -6.145 7.286 1.00 . A A . 36 ASP OD2 1 1 7 4762 1 1 37 ASP C C -3.176 -10.549 6.169 1.00 . A A . 37 ASP C 1 1 7 4763 1 1 37 ASP CA C -4.668 -10.246 6.171 1.00 . A A . 37 ASP CA 1 1 7 4764 1 1 37 ASP CB C -5.373 -11.085 5.104 1.00 . A A . 37 ASP CB 1 1 7 4765 1 1 37 ASP CG C -6.764 -11.518 5.530 1.00 . A A . 37 ASP CG 1 1 7 4766 1 1 37 ASP H H -5.523 -8.562 5.228 1.00 . A A . 37 ASP H 1 1 7 4767 1 1 37 ASP HA H -5.074 -10.489 7.141 1.00 . A A . 37 ASP HA 1 1 7 4768 1 1 37 ASP HB2 H -5.460 -10.505 4.197 1.00 . A A . 37 ASP HB2 1 1 7 4769 1 1 37 ASP HB3 H -4.786 -11.971 4.905 1.00 . A A . 37 ASP HB3 1 1 7 4770 1 1 37 ASP N N -4.891 -8.822 5.930 1.00 . A A . 37 ASP N 1 1 7 4771 1 1 37 ASP O O -2.676 -11.293 7.013 1.00 . A A . 37 ASP O 1 1 7 4772 1 1 37 ASP OD1 O -7.105 -11.338 6.718 1.00 . A A . 37 ASP OD1 1 1 7 4773 1 1 37 ASP OD2 O -7.512 -12.035 4.673 1.00 . A A . 37 ASP OD2 1 1 7 4774 1 1 38 MET C C -0.365 -8.768 4.878 1.00 . A A . 38 MET C 1 1 7 4775 1 1 38 MET CA C -1.036 -10.120 5.094 1.00 . A A . 38 MET CA 1 1 7 4776 1 1 38 MET CB C -0.711 -11.067 3.938 1.00 . A A . 38 MET CB 1 1 7 4777 1 1 38 MET CE C 0.314 -14.821 4.837 1.00 . A A . 38 MET CE 1 1 7 4778 1 1 38 MET CG C -1.085 -12.514 4.216 1.00 . A A . 38 MET CG 1 1 7 4779 1 1 38 MET H H -2.938 -9.359 4.586 1.00 . A A . 38 MET H 1 1 7 4780 1 1 38 MET HA H -0.672 -10.548 6.017 1.00 . A A . 38 MET HA 1 1 7 4781 1 1 38 MET HB2 H -1.248 -10.742 3.060 1.00 . A A . 38 MET HB2 1 1 7 4782 1 1 38 MET HB3 H 0.349 -11.024 3.739 1.00 . A A . 38 MET HB3 1 1 7 4783 1 1 38 MET HE1 H 0.136 -15.831 4.498 1.00 . A A . 38 MET HE1 1 1 7 4784 1 1 38 MET HE2 H -0.376 -14.583 5.634 1.00 . A A . 38 MET HE2 1 1 7 4785 1 1 38 MET HE3 H 1.328 -14.737 5.201 1.00 . A A . 38 MET HE3 1 1 7 4786 1 1 38 MET HG2 H -1.098 -12.669 5.285 1.00 . A A . 38 MET HG2 1 1 7 4787 1 1 38 MET HG3 H -2.070 -12.700 3.815 1.00 . A A . 38 MET HG3 1 1 7 4788 1 1 38 MET N N -2.474 -9.947 5.219 1.00 . A A . 38 MET N 1 1 7 4789 1 1 38 MET O O -0.063 -8.056 5.838 1.00 . A A . 38 MET O 1 1 7 4790 1 1 38 MET SD S 0.071 -13.683 3.477 1.00 . A A . 38 MET SD 1 1 7 4791 1 1 39 GLN C C -0.026 -6.708 1.866 1.00 . A A . 39 GLN C 1 1 7 4792 1 1 39 GLN CA C 0.412 -7.109 3.273 1.00 . A A . 39 GLN CA 1 1 7 4793 1 1 39 GLN CB C 1.941 -7.183 3.356 1.00 . A A . 39 GLN CB 1 1 7 4794 1 1 39 GLN CD C 4.017 -6.124 2.384 1.00 . A A . 39 GLN CD 1 1 7 4795 1 1 39 GLN CG C 2.643 -5.888 2.981 1.00 . A A . 39 GLN CG 1 1 7 4796 1 1 39 GLN H H -0.483 -8.975 2.888 1.00 . A A . 39 GLN H 1 1 7 4797 1 1 39 GLN HA H 0.050 -6.375 3.978 1.00 . A A . 39 GLN HA 1 1 7 4798 1 1 39 GLN HB2 H 2.222 -7.438 4.368 1.00 . A A . 39 GLN HB2 1 1 7 4799 1 1 39 GLN HB3 H 2.287 -7.960 2.691 1.00 . A A . 39 GLN HB3 1 1 7 4800 1 1 39 GLN HE21 H 4.856 -5.011 3.803 1.00 . A A . 39 GLN HE21 1 1 7 4801 1 1 39 GLN HE22 H 5.940 -5.687 2.639 1.00 . A A . 39 GLN HE22 1 1 7 4802 1 1 39 GLN HG2 H 2.039 -5.361 2.257 1.00 . A A . 39 GLN HG2 1 1 7 4803 1 1 39 GLN HG3 H 2.751 -5.281 3.869 1.00 . A A . 39 GLN HG3 1 1 7 4804 1 1 39 GLN N N -0.173 -8.397 3.616 1.00 . A A . 39 GLN N 1 1 7 4805 1 1 39 GLN NE2 N 5.041 -5.549 3.005 1.00 . A A . 39 GLN NE2 1 1 7 4806 1 1 39 GLN O O 0.711 -6.929 0.904 1.00 . A A . 39 GLN O 1 1 7 4807 1 1 39 GLN OE1 O 4.157 -6.818 1.376 1.00 . A A . 39 GLN OE1 1 1 7 4808 1 1 40 HIS C C -2.708 -4.623 0.412 1.00 . A A . 40 HIS C 1 1 7 4809 1 1 40 HIS CA C -1.710 -5.774 0.394 1.00 . A A . 40 HIS CA 1 1 7 4810 1 1 40 HIS CB C -2.363 -6.985 -0.281 1.00 . A A . 40 HIS CB 1 1 7 4811 1 1 40 HIS CD2 C -0.918 -9.136 -0.436 1.00 . A A . 40 HIS CD2 1 1 7 4812 1 1 40 HIS CE1 C 0.011 -8.760 -2.385 1.00 . A A . 40 HIS CE1 1 1 7 4813 1 1 40 HIS CG C -1.387 -7.948 -0.887 1.00 . A A . 40 HIS CG 1 1 7 4814 1 1 40 HIS H H -1.800 -6.013 2.520 1.00 . A A . 40 HIS H 1 1 7 4815 1 1 40 HIS HA H -0.855 -5.477 -0.191 1.00 . A A . 40 HIS HA 1 1 7 4816 1 1 40 HIS HB2 H -2.944 -7.524 0.451 1.00 . A A . 40 HIS HB2 1 1 7 4817 1 1 40 HIS HB3 H -3.017 -6.638 -1.066 1.00 . A A . 40 HIS HB3 1 1 7 4818 1 1 40 HIS HD1 H -0.918 -6.962 -2.691 1.00 . A A . 40 HIS HD1 1 1 7 4819 1 1 40 HIS HD2 H -1.177 -9.614 0.499 1.00 . A A . 40 HIS HD2 1 1 7 4820 1 1 40 HIS HE1 H 0.611 -8.871 -3.276 1.00 . A A . 40 HIS HE1 1 1 7 4821 1 1 40 HIS HE2 H 0.386 -10.495 -1.364 1.00 . A A . 40 HIS HE2 1 1 7 4822 1 1 40 HIS N N -1.229 -6.145 1.726 1.00 . A A . 40 HIS N 1 1 7 4823 1 1 40 HIS ND1 N -0.784 -7.740 -2.110 1.00 . A A . 40 HIS ND1 1 1 7 4824 1 1 40 HIS NE2 N -0.051 -9.619 -1.384 1.00 . A A . 40 HIS NE2 1 1 7 4825 1 1 40 HIS O O -2.986 -4.026 1.452 1.00 . A A . 40 HIS O 1 1 7 4826 1 1 41 CYS C C -4.996 -3.568 -2.274 1.00 . A A . 41 CYS C 1 1 7 4827 1 1 41 CYS CA C -4.236 -3.290 -0.977 1.00 . A A . 41 CYS CA 1 1 7 4828 1 1 41 CYS CB C -3.571 -1.909 -1.025 1.00 . A A . 41 CYS CB 1 1 7 4829 1 1 41 CYS H H -2.972 -4.873 -1.549 1.00 . A A . 41 CYS H 1 1 7 4830 1 1 41 CYS HA H -4.932 -3.324 -0.151 1.00 . A A . 41 CYS HA 1 1 7 4831 1 1 41 CYS HB2 H -4.323 -1.152 -0.862 1.00 . A A . 41 CYS HB2 1 1 7 4832 1 1 41 CYS HB3 H -2.833 -1.847 -0.239 1.00 . A A . 41 CYS HB3 1 1 7 4833 1 1 41 CYS N N -3.247 -4.341 -0.773 1.00 . A A . 41 CYS N 1 1 7 4834 1 1 41 CYS O O -4.445 -4.166 -3.199 1.00 . A A . 41 CYS O 1 1 7 4835 1 1 41 CYS SG S -2.738 -1.522 -2.601 1.00 . A A . 41 CYS SG 1 1 7 4836 1 1 42 CYS C C -7.821 -2.135 -3.957 1.00 . A A . 42 CYS C 1 1 7 4837 1 1 42 CYS CA C -7.074 -3.398 -3.528 1.00 . A A . 42 CYS CA 1 1 7 4838 1 1 42 CYS CB C -8.073 -4.527 -3.259 1.00 . A A . 42 CYS CB 1 1 7 4839 1 1 42 CYS H H -6.656 -2.697 -1.572 1.00 . A A . 42 CYS H 1 1 7 4840 1 1 42 CYS HA H -6.413 -3.699 -4.326 1.00 . A A . 42 CYS HA 1 1 7 4841 1 1 42 CYS HB2 H -7.606 -5.267 -2.627 1.00 . A A . 42 CYS HB2 1 1 7 4842 1 1 42 CYS HB3 H -8.936 -4.119 -2.749 1.00 . A A . 42 CYS HB3 1 1 7 4843 1 1 42 CYS N N -6.259 -3.159 -2.338 1.00 . A A . 42 CYS N 1 1 7 4844 1 1 42 CYS O O -8.274 -1.359 -3.117 1.00 . A A . 42 CYS O 1 1 7 4845 1 1 42 CYS SG S -8.665 -5.376 -4.759 1.00 . A A . 42 CYS SG 1 1 7 4846 1 1 43 PRO C C -9.973 -0.443 -5.119 1.00 . A A . 43 PRO C 1 1 7 4847 1 1 43 PRO CA C -8.650 -0.740 -5.823 1.00 . A A . 43 PRO CA 1 1 7 4848 1 1 43 PRO CB C -8.894 -1.129 -7.281 1.00 . A A . 43 PRO CB 1 1 7 4849 1 1 43 PRO CD C -7.440 -2.789 -6.355 1.00 . A A . 43 PRO CD 1 1 7 4850 1 1 43 PRO CG C -7.760 -2.033 -7.617 1.00 . A A . 43 PRO CG 1 1 7 4851 1 1 43 PRO HA H -8.022 0.138 -5.787 1.00 . A A . 43 PRO HA 1 1 7 4852 1 1 43 PRO HB2 H -9.845 -1.633 -7.368 1.00 . A A . 43 PRO HB2 1 1 7 4853 1 1 43 PRO HB3 H -8.889 -0.244 -7.899 1.00 . A A . 43 PRO HB3 1 1 7 4854 1 1 43 PRO HD2 H -7.944 -3.743 -6.350 1.00 . A A . 43 PRO HD2 1 1 7 4855 1 1 43 PRO HD3 H -6.374 -2.925 -6.258 1.00 . A A . 43 PRO HD3 1 1 7 4856 1 1 43 PRO HG2 H -8.057 -2.718 -8.398 1.00 . A A . 43 PRO HG2 1 1 7 4857 1 1 43 PRO HG3 H -6.907 -1.452 -7.932 1.00 . A A . 43 PRO HG3 1 1 7 4858 1 1 43 PRO N N -7.958 -1.913 -5.281 1.00 . A A . 43 PRO N 1 1 7 4859 1 1 43 PRO O O -10.831 -1.320 -4.974 1.00 . A A . 43 PRO O 1 1 7 4860 1 1 44 ALA C C -12.575 0.698 -4.621 1.00 . A A . 44 ALA C 1 1 7 4861 1 1 44 ALA CA C -11.313 1.258 -3.979 1.00 . A A . 44 ALA CA 1 1 7 4862 1 1 44 ALA CB C -11.369 2.776 -3.958 1.00 . A A . 44 ALA CB 1 1 7 4863 1 1 44 ALA H H -9.381 1.439 -4.820 1.00 . A A . 44 ALA H 1 1 7 4864 1 1 44 ALA HA H -11.255 0.909 -2.958 1.00 . A A . 44 ALA HA 1 1 7 4865 1 1 44 ALA HB1 H -11.841 3.106 -3.044 1.00 . A A . 44 ALA HB1 1 1 7 4866 1 1 44 ALA HB2 H -11.940 3.128 -4.804 1.00 . A A . 44 ALA HB2 1 1 7 4867 1 1 44 ALA HB3 H -10.366 3.174 -4.009 1.00 . A A . 44 ALA HB3 1 1 7 4868 1 1 44 ALA N N -10.114 0.807 -4.677 1.00 . A A . 44 ALA N 1 1 7 4869 1 1 44 ALA O O -12.861 0.964 -5.789 1.00 . A A . 44 ALA O 1 1 7 4870 1 1 45 GLY C C -14.474 -2.174 -4.432 1.00 . A A . 45 GLY C 1 1 7 4871 1 1 45 GLY CA C -14.545 -0.664 -4.356 1.00 . A A . 45 GLY CA 1 1 7 4872 1 1 45 GLY H H -13.043 -0.252 -2.928 1.00 . A A . 45 GLY H 1 1 7 4873 1 1 45 GLY HA2 H -15.362 -0.386 -3.706 1.00 . A A . 45 GLY HA2 1 1 7 4874 1 1 45 GLY HA3 H -14.737 -0.274 -5.346 1.00 . A A . 45 GLY HA3 1 1 7 4875 1 1 45 GLY N N -13.323 -0.078 -3.850 1.00 . A A . 45 GLY N 1 1 7 4876 1 1 45 GLY O O -15.483 -2.834 -4.682 1.00 . A A . 45 GLY O 1 1 7 4877 1 1 46 TYR C C -12.951 -4.747 -2.844 1.00 . A A . 46 TYR C 1 1 7 4878 1 1 46 TYR CA C -13.106 -4.177 -4.251 1.00 . A A . 46 TYR CA 1 1 7 4879 1 1 46 TYR CB C -11.884 -4.539 -5.099 1.00 . A A . 46 TYR CB 1 1 7 4880 1 1 46 TYR CD1 C -13.379 -4.591 -7.144 1.00 . A A . 46 TYR CD1 1 1 7 4881 1 1 46 TYR CD2 C -11.059 -4.137 -7.452 1.00 . A A . 46 TYR CD2 1 1 7 4882 1 1 46 TYR CE1 C -13.585 -4.485 -8.506 1.00 . A A . 46 TYR CE1 1 1 7 4883 1 1 46 TYR CE2 C -11.258 -4.028 -8.816 1.00 . A A . 46 TYR CE2 1 1 7 4884 1 1 46 TYR CG C -12.113 -4.420 -6.593 1.00 . A A . 46 TYR CG 1 1 7 4885 1 1 46 TYR CZ C -12.523 -4.203 -9.337 1.00 . A A . 46 TYR CZ 1 1 7 4886 1 1 46 TYR H H -12.507 -2.162 -4.006 1.00 . A A . 46 TYR H 1 1 7 4887 1 1 46 TYR HA H -13.987 -4.606 -4.704 1.00 . A A . 46 TYR HA 1 1 7 4888 1 1 46 TYR HB2 H -11.067 -3.884 -4.838 1.00 . A A . 46 TYR HB2 1 1 7 4889 1 1 46 TYR HB3 H -11.600 -5.560 -4.888 1.00 . A A . 46 TYR HB3 1 1 7 4890 1 1 46 TYR HD1 H -14.209 -4.812 -6.491 1.00 . A A . 46 TYR HD1 1 1 7 4891 1 1 46 TYR HD2 H -10.069 -4.002 -7.042 1.00 . A A . 46 TYR HD2 1 1 7 4892 1 1 46 TYR HE1 H -14.576 -4.620 -8.913 1.00 . A A . 46 TYR HE1 1 1 7 4893 1 1 46 TYR HE2 H -10.424 -3.808 -9.466 1.00 . A A . 46 TYR HE2 1 1 7 4894 1 1 46 TYR HH H -12.602 -4.955 -11.105 1.00 . A A . 46 TYR HH 1 1 7 4895 1 1 46 TYR N N -13.284 -2.730 -4.210 1.00 . A A . 46 TYR N 1 1 7 4896 1 1 46 TYR O O -12.833 -4.004 -1.870 1.00 . A A . 46 TYR O 1 1 7 4897 1 1 46 TYR OH O -12.724 -4.096 -10.694 1.00 . A A . 46 TYR OH 1 1 7 4898 1 1 47 LYS C C -11.749 -7.831 -1.532 1.00 . A A . 47 LYS C 1 1 7 4899 1 1 47 LYS CA C -12.825 -6.752 -1.464 1.00 . A A . 47 LYS CA 1 1 7 4900 1 1 47 LYS CB C -14.164 -7.370 -1.052 1.00 . A A . 47 LYS CB 1 1 7 4901 1 1 47 LYS CD C -14.045 -9.608 0.085 1.00 . A A . 47 LYS CD 1 1 7 4902 1 1 47 LYS CE C -14.825 -10.349 1.160 1.00 . A A . 47 LYS CE 1 1 7 4903 1 1 47 LYS CG C -14.119 -8.102 0.281 1.00 . A A . 47 LYS CG 1 1 7 4904 1 1 47 LYS H H -13.060 -6.607 -3.561 1.00 . A A . 47 LYS H 1 1 7 4905 1 1 47 LYS HA H -12.535 -6.017 -0.728 1.00 . A A . 47 LYS HA 1 1 7 4906 1 1 47 LYS HB2 H -14.901 -6.584 -0.982 1.00 . A A . 47 LYS HB2 1 1 7 4907 1 1 47 LYS HB3 H -14.472 -8.071 -1.813 1.00 . A A . 47 LYS HB3 1 1 7 4908 1 1 47 LYS HD2 H -14.458 -9.857 -0.880 1.00 . A A . 47 LYS HD2 1 1 7 4909 1 1 47 LYS HD3 H -13.010 -9.916 0.127 1.00 . A A . 47 LYS HD3 1 1 7 4910 1 1 47 LYS HE2 H -14.516 -11.384 1.163 1.00 . A A . 47 LYS HE2 1 1 7 4911 1 1 47 LYS HE3 H -14.603 -9.905 2.119 1.00 . A A . 47 LYS HE3 1 1 7 4912 1 1 47 LYS HG2 H -13.249 -7.776 0.831 1.00 . A A . 47 LYS HG2 1 1 7 4913 1 1 47 LYS HG3 H -15.013 -7.864 0.841 1.00 . A A . 47 LYS HG3 1 1 7 4914 1 1 47 LYS HZ1 H -16.654 -9.339 1.163 1.00 . A A . 47 LYS HZ1 1 1 7 4915 1 1 47 LYS HZ2 H -16.782 -10.989 1.515 1.00 . A A . 47 LYS HZ2 1 1 7 4916 1 1 47 LYS HZ3 H -16.505 -10.484 -0.075 1.00 . A A . 47 LYS HZ3 1 1 7 4917 1 1 47 LYS N N -12.959 -6.072 -2.747 1.00 . A A . 47 LYS N 1 1 7 4918 1 1 47 LYS NZ N -16.295 -10.286 0.924 1.00 . A A . 47 LYS NZ 1 1 7 4919 1 1 47 LYS O O -11.536 -8.442 -2.580 1.00 . A A . 47 LYS O 1 1 7 4920 1 1 48 CYS C C -10.632 -10.444 -0.017 1.00 . A A . 48 CYS C 1 1 7 4921 1 1 48 CYS CA C -10.033 -9.076 -0.332 1.00 . A A . 48 CYS CA 1 1 7 4922 1 1 48 CYS CB C -9.008 -8.697 0.740 1.00 . A A . 48 CYS CB 1 1 7 4923 1 1 48 CYS H H -11.301 -7.553 0.400 1.00 . A A . 48 CYS H 1 1 7 4924 1 1 48 CYS HA H -9.542 -9.120 -1.293 1.00 . A A . 48 CYS HA 1 1 7 4925 1 1 48 CYS HB2 H -9.427 -7.927 1.369 1.00 . A A . 48 CYS HB2 1 1 7 4926 1 1 48 CYS HB3 H -8.793 -9.568 1.343 1.00 . A A . 48 CYS HB3 1 1 7 4927 1 1 48 CYS N N -11.081 -8.065 -0.406 1.00 . A A . 48 CYS N 1 1 7 4928 1 1 48 CYS O O -11.081 -10.689 1.103 1.00 . A A . 48 CYS O 1 1 7 4929 1 1 48 CYS SG S -7.427 -8.072 0.084 1.00 . A A . 48 CYS SG 1 1 7 4930 1 1 49 GLY C C -10.185 -13.622 -0.203 1.00 . A A . 49 GLY C 1 1 7 4931 1 1 49 GLY CA C -11.191 -12.659 -0.809 1.00 . A A . 49 GLY CA 1 1 7 4932 1 1 49 GLY H H -10.272 -11.083 -1.883 1.00 . A A . 49 GLY H 1 1 7 4933 1 1 49 GLY HA2 H -12.046 -12.587 -0.153 1.00 . A A . 49 GLY HA2 1 1 7 4934 1 1 49 GLY HA3 H -11.515 -13.049 -1.764 1.00 . A A . 49 GLY HA3 1 1 7 4935 1 1 49 GLY N N -10.639 -11.331 -1.008 1.00 . A A . 49 GLY N 1 1 7 4936 1 1 49 GLY O O -8.987 -13.339 -0.190 1.00 . A A . 49 GLY O 1 1 7 4937 1 1 50 PRO C C -8.745 -16.330 -0.071 1.00 . A A . 50 PRO C 1 1 7 4938 1 1 50 PRO CA C -9.761 -15.776 0.923 1.00 . A A . 50 PRO CA 1 1 7 4939 1 1 50 PRO CB C -10.717 -16.885 1.381 1.00 . A A . 50 PRO CB 1 1 7 4940 1 1 50 PRO CD C -12.054 -15.201 0.343 1.00 . A A . 50 PRO CD 1 1 7 4941 1 1 50 PRO CG C -12.065 -16.250 1.418 1.00 . A A . 50 PRO CG 1 1 7 4942 1 1 50 PRO HA H -9.239 -15.371 1.777 1.00 . A A . 50 PRO HA 1 1 7 4943 1 1 50 PRO HB2 H -10.686 -17.704 0.677 1.00 . A A . 50 PRO HB2 1 1 7 4944 1 1 50 PRO HB3 H -10.421 -17.236 2.359 1.00 . A A . 50 PRO HB3 1 1 7 4945 1 1 50 PRO HD2 H -12.352 -15.627 -0.604 1.00 . A A . 50 PRO HD2 1 1 7 4946 1 1 50 PRO HD3 H -12.700 -14.377 0.610 1.00 . A A . 50 PRO HD3 1 1 7 4947 1 1 50 PRO HG2 H -12.826 -16.989 1.213 1.00 . A A . 50 PRO HG2 1 1 7 4948 1 1 50 PRO HG3 H -12.232 -15.797 2.384 1.00 . A A . 50 PRO HG3 1 1 7 4949 1 1 50 PRO N N -10.645 -14.777 0.312 1.00 . A A . 50 PRO N 1 1 7 4950 1 1 50 PRO O O -9.044 -16.489 -1.254 1.00 . A A . 50 PRO O 1 1 7 4951 1 1 51 GLY C C -5.885 -16.103 -1.330 1.00 . A A . 51 GLY C 1 1 7 4952 1 1 51 GLY CA C -6.503 -17.158 -0.437 1.00 . A A . 51 GLY CA 1 1 7 4953 1 1 51 GLY H H -7.366 -16.476 1.372 1.00 . A A . 51 GLY H 1 1 7 4954 1 1 51 GLY HA2 H -5.731 -17.590 0.181 1.00 . A A . 51 GLY HA2 1 1 7 4955 1 1 51 GLY HA3 H -6.929 -17.933 -1.058 1.00 . A A . 51 GLY HA3 1 1 7 4956 1 1 51 GLY N N -7.545 -16.623 0.420 1.00 . A A . 51 GLY N 1 1 7 4957 1 1 51 GLY O O -5.393 -16.413 -2.415 1.00 . A A . 51 GLY O 1 1 7 4958 1 1 52 GLY C C -6.048 -13.596 -2.991 1.00 . A A . 52 GLY C 1 1 7 4959 1 1 52 GLY CA C -5.347 -13.767 -1.658 1.00 . A A . 52 GLY CA 1 1 7 4960 1 1 52 GLY H H -6.318 -14.666 -0.004 1.00 . A A . 52 GLY H 1 1 7 4961 1 1 52 GLY HA2 H -5.435 -12.848 -1.097 1.00 . A A . 52 GLY HA2 1 1 7 4962 1 1 52 GLY HA3 H -4.301 -13.970 -1.838 1.00 . A A . 52 GLY HA3 1 1 7 4963 1 1 52 GLY N N -5.912 -14.852 -0.877 1.00 . A A . 52 GLY N 1 1 7 4964 1 1 52 GLY O O -5.781 -14.336 -3.938 1.00 . A A . 52 GLY O 1 1 7 4965 1 1 53 THR C C -8.487 -11.051 -4.136 1.00 . A A . 53 THR C 1 1 7 4966 1 1 53 THR CA C -7.697 -12.347 -4.285 1.00 . A A . 53 THR CA 1 1 7 4967 1 1 53 THR CB C -8.671 -13.493 -4.618 1.00 . A A . 53 THR CB 1 1 7 4968 1 1 53 THR CG2 C -8.133 -14.355 -5.749 1.00 . A A . 53 THR CG2 1 1 7 4969 1 1 53 THR H H -7.117 -12.057 -2.280 1.00 . A A . 53 THR H 1 1 7 4970 1 1 53 THR HA H -6.992 -12.243 -5.098 1.00 . A A . 53 THR HA 1 1 7 4971 1 1 53 THR HB H -9.614 -13.065 -4.927 1.00 . A A . 53 THR HB 1 1 7 4972 1 1 53 THR HG1 H -9.500 -15.011 -3.670 1.00 . A A . 53 THR HG1 1 1 7 4973 1 1 53 THR HG21 H -7.390 -13.801 -6.302 1.00 . A A . 53 THR HG21 1 1 7 4974 1 1 53 THR HG22 H -8.942 -14.630 -6.408 1.00 . A A . 53 THR HG22 1 1 7 4975 1 1 53 THR HG23 H -7.684 -15.248 -5.338 1.00 . A A . 53 THR HG23 1 1 7 4976 1 1 53 THR N N -6.948 -12.619 -3.064 1.00 . A A . 53 THR N 1 1 7 4977 1 1 53 THR O O -8.514 -10.457 -3.058 1.00 . A A . 53 THR O 1 1 7 4978 1 1 53 THR OG1 O -8.887 -14.305 -3.457 1.00 . A A . 53 THR OG1 1 1 7 4979 1 1 54 CYS C C -11.213 -9.543 -5.971 1.00 . A A . 54 CYS C 1 1 7 4980 1 1 54 CYS CA C -9.920 -9.387 -5.176 1.00 . A A . 54 CYS CA 1 1 7 4981 1 1 54 CYS CB C -9.105 -8.216 -5.726 1.00 . A A . 54 CYS CB 1 1 7 4982 1 1 54 CYS H H -9.083 -11.122 -6.049 1.00 . A A . 54 CYS H 1 1 7 4983 1 1 54 CYS HA H -10.170 -9.186 -4.145 1.00 . A A . 54 CYS HA 1 1 7 4984 1 1 54 CYS HB2 H -8.405 -8.587 -6.459 1.00 . A A . 54 CYS HB2 1 1 7 4985 1 1 54 CYS HB3 H -9.773 -7.511 -6.198 1.00 . A A . 54 CYS HB3 1 1 7 4986 1 1 54 CYS N N -9.133 -10.615 -5.212 1.00 . A A . 54 CYS N 1 1 7 4987 1 1 54 CYS O O -11.192 -9.940 -7.136 1.00 . A A . 54 CYS O 1 1 7 4988 1 1 54 CYS SG S -8.154 -7.315 -4.458 1.00 . A A . 54 CYS SG 1 1 7 4989 1 1 55 ILE C C -14.510 -8.125 -5.648 1.00 . A A . 55 ILE C 1 1 7 4990 1 1 55 ILE CA C -13.639 -9.335 -5.975 1.00 . A A . 55 ILE CA 1 1 7 4991 1 1 55 ILE CB C -14.376 -10.618 -5.541 1.00 . A A . 55 ILE CB 1 1 7 4992 1 1 55 ILE CD1 C -15.381 -11.727 -3.481 1.00 . A A . 55 ILE CD1 1 1 7 4993 1 1 55 ILE CG1 C -14.345 -10.761 -4.017 1.00 . A A . 55 ILE CG1 1 1 7 4994 1 1 55 ILE CG2 C -13.751 -11.836 -6.205 1.00 . A A . 55 ILE CG2 1 1 7 4995 1 1 55 ILE H H -12.284 -8.920 -4.402 1.00 . A A . 55 ILE H 1 1 7 4996 1 1 55 ILE HA H -13.483 -9.377 -7.043 1.00 . A A . 55 ILE HA 1 1 7 4997 1 1 55 ILE HB H -15.401 -10.546 -5.869 1.00 . A A . 55 ILE HB 1 1 7 4998 1 1 55 ILE HD11 H -15.919 -12.172 -4.306 1.00 . A A . 55 ILE HD11 1 1 7 4999 1 1 55 ILE HD12 H -16.072 -11.196 -2.844 1.00 . A A . 55 ILE HD12 1 1 7 5000 1 1 55 ILE HD13 H -14.889 -12.502 -2.912 1.00 . A A . 55 ILE HD13 1 1 7 5001 1 1 55 ILE HG12 H -13.372 -11.118 -3.715 1.00 . A A . 55 ILE HG12 1 1 7 5002 1 1 55 ILE HG13 H -14.526 -9.796 -3.568 1.00 . A A . 55 ILE HG13 1 1 7 5003 1 1 55 ILE HG21 H -13.588 -11.632 -7.253 1.00 . A A . 55 ILE HG21 1 1 7 5004 1 1 55 ILE HG22 H -14.414 -12.682 -6.101 1.00 . A A . 55 ILE HG22 1 1 7 5005 1 1 55 ILE HG23 H -12.806 -12.060 -5.731 1.00 . A A . 55 ILE HG23 1 1 7 5006 1 1 55 ILE N N -12.335 -9.230 -5.331 1.00 . A A . 55 ILE N 1 1 7 5007 1 1 55 ILE O O -14.023 -7.122 -5.130 1.00 . A A . 55 ILE O 1 1 7 5008 1 1 56 SER C C -17.998 -7.653 -5.012 1.00 . A A . 56 SER C 1 1 7 5009 1 1 56 SER CA C -16.734 -7.135 -5.692 1.00 . A A . 56 SER CA 1 1 7 5010 1 1 56 SER CB C -17.096 -6.416 -6.994 1.00 . A A . 56 SER CB 1 1 7 5011 1 1 56 SER H H -16.133 -9.048 -6.370 1.00 . A A . 56 SER H 1 1 7 5012 1 1 56 SER HA H -16.245 -6.436 -5.031 1.00 . A A . 56 SER HA 1 1 7 5013 1 1 56 SER HB2 H -16.206 -5.981 -7.422 1.00 . A A . 56 SER HB2 1 1 7 5014 1 1 56 SER HB3 H -17.519 -7.128 -7.688 1.00 . A A . 56 SER HB3 1 1 7 5015 1 1 56 SER HG H -17.613 -4.656 -6.307 1.00 . A A . 56 SER HG 1 1 7 5016 1 1 56 SER N N -15.800 -8.225 -5.955 1.00 . A A . 56 SER N 1 1 7 5017 1 1 56 SER O O -18.054 -7.617 -3.765 1.00 . A A . 56 SER O 1 1 7 5018 1 1 56 SER OXT O -18.920 -8.089 -5.732 1.00 . A A . 56 SER OXT 1 1 7 5019 1 1 56 SER OG O -18.040 -5.386 -6.761 1.00 . A A . 56 SER OG 1 1 8 5020 1 1 1 ASP C C 1.863 15.002 -2.901 1.00 . A A . 1 ASP C 1 1 8 5021 1 1 1 ASP CA C 2.790 14.972 -4.114 1.00 . A A . 1 ASP CA 1 1 8 5022 1 1 1 ASP CB C 4.253 14.961 -3.663 1.00 . A A . 1 ASP CB 1 1 8 5023 1 1 1 ASP CG C 5.188 15.528 -4.714 1.00 . A A . 1 ASP CG 1 1 8 5024 1 1 1 ASP H1 H 2.859 15.939 -5.962 1.00 . A A . 1 ASP H1 1 1 8 5025 1 1 1 ASP H2 H 3.138 16.960 -4.643 1.00 . A A . 1 ASP H2 1 1 8 5026 1 1 1 ASP H3 H 1.569 16.426 -4.981 1.00 . A A . 1 ASP H3 1 1 8 5027 1 1 1 ASP HA H 2.589 14.081 -4.690 1.00 . A A . 1 ASP HA 1 1 8 5028 1 1 1 ASP HB2 H 4.350 15.554 -2.766 1.00 . A A . 1 ASP HB2 1 1 8 5029 1 1 1 ASP HB3 H 4.550 13.945 -3.453 1.00 . A A . 1 ASP HB3 1 1 8 5030 1 1 1 ASP N N 2.574 16.157 -4.985 1.00 . A A . 1 ASP N 1 1 8 5031 1 1 1 ASP O O 1.653 16.051 -2.294 1.00 . A A . 1 ASP O 1 1 8 5032 1 1 1 ASP OD1 O 5.141 15.056 -5.869 1.00 . A A . 1 ASP OD1 1 1 8 5033 1 1 1 ASP OD2 O 5.969 16.446 -4.382 1.00 . A A . 1 ASP OD2 1 1 8 5034 1 1 2 VAL C C 1.020 12.900 -0.299 1.00 . A A . 2 VAL C 1 1 8 5035 1 1 2 VAL CA C 0.403 13.734 -1.418 1.00 . A A . 2 VAL CA 1 1 8 5036 1 1 2 VAL CB C -0.942 13.100 -1.823 1.00 . A A . 2 VAL CB 1 1 8 5037 1 1 2 VAL CG1 C -2.022 13.439 -0.809 1.00 . A A . 2 VAL CG1 1 1 8 5038 1 1 2 VAL CG2 C -1.350 13.550 -3.218 1.00 . A A . 2 VAL CG2 1 1 8 5039 1 1 2 VAL H H 1.514 13.041 -3.081 1.00 . A A . 2 VAL H 1 1 8 5040 1 1 2 VAL HA H 0.210 14.731 -1.047 1.00 . A A . 2 VAL HA 1 1 8 5041 1 1 2 VAL HB H -0.819 12.027 -1.838 1.00 . A A . 2 VAL HB 1 1 8 5042 1 1 2 VAL HG11 H -2.044 12.681 -0.040 1.00 . A A . 2 VAL HG11 1 1 8 5043 1 1 2 VAL HG12 H -2.982 13.477 -1.304 1.00 . A A . 2 VAL HG12 1 1 8 5044 1 1 2 VAL HG13 H -1.808 14.399 -0.363 1.00 . A A . 2 VAL HG13 1 1 8 5045 1 1 2 VAL HG21 H -1.379 12.694 -3.876 1.00 . A A . 2 VAL HG21 1 1 8 5046 1 1 2 VAL HG22 H -0.632 14.266 -3.589 1.00 . A A . 2 VAL HG22 1 1 8 5047 1 1 2 VAL HG23 H -2.328 14.006 -3.177 1.00 . A A . 2 VAL HG23 1 1 8 5048 1 1 2 VAL N N 1.310 13.842 -2.557 1.00 . A A . 2 VAL N 1 1 8 5049 1 1 2 VAL O O 0.663 11.735 -0.117 1.00 . A A . 2 VAL O 1 1 8 5050 1 1 3 GLN C C 1.676 11.951 2.342 1.00 . A A . 3 GLN C 1 1 8 5051 1 1 3 GLN CA C 2.635 12.823 1.540 1.00 . A A . 3 GLN CA 1 1 8 5052 1 1 3 GLN CB C 3.300 13.847 2.462 1.00 . A A . 3 GLN CB 1 1 8 5053 1 1 3 GLN CD C 2.778 15.783 3.997 1.00 . A A . 3 GLN CD 1 1 8 5054 1 1 3 GLN CG C 2.466 15.099 2.681 1.00 . A A . 3 GLN CG 1 1 8 5055 1 1 3 GLN H H 2.200 14.428 0.231 1.00 . A A . 3 GLN H 1 1 8 5056 1 1 3 GLN HA H 3.400 12.193 1.113 1.00 . A A . 3 GLN HA 1 1 8 5057 1 1 3 GLN HB2 H 3.477 13.386 3.423 1.00 . A A . 3 GLN HB2 1 1 8 5058 1 1 3 GLN HB3 H 4.246 14.140 2.034 1.00 . A A . 3 GLN HB3 1 1 8 5059 1 1 3 GLN HE21 H 4.727 15.528 3.697 1.00 . A A . 3 GLN HE21 1 1 8 5060 1 1 3 GLN HE22 H 4.293 16.329 5.166 1.00 . A A . 3 GLN HE22 1 1 8 5061 1 1 3 GLN HG2 H 2.664 15.792 1.877 1.00 . A A . 3 GLN HG2 1 1 8 5062 1 1 3 GLN HG3 H 1.421 14.827 2.671 1.00 . A A . 3 GLN HG3 1 1 8 5063 1 1 3 GLN N N 1.953 13.502 0.438 1.00 . A A . 3 GLN N 1 1 8 5064 1 1 3 GLN NE2 N 4.062 15.891 4.319 1.00 . A A . 3 GLN NE2 1 1 8 5065 1 1 3 GLN O O 0.504 12.289 2.512 1.00 . A A . 3 GLN O 1 1 8 5066 1 1 3 GLN OE1 O 1.875 16.211 4.717 1.00 . A A . 3 GLN OE1 1 1 8 5067 1 1 4 CYS C C 1.278 10.316 5.069 1.00 . A A . 4 CYS C 1 1 8 5068 1 1 4 CYS CA C 1.374 9.895 3.608 1.00 . A A . 4 CYS CA 1 1 8 5069 1 1 4 CYS CB C 1.948 8.487 3.538 1.00 . A A . 4 CYS CB 1 1 8 5070 1 1 4 CYS H H 3.124 10.609 2.656 1.00 . A A . 4 CYS H 1 1 8 5071 1 1 4 CYS HA H 0.380 9.879 3.186 1.00 . A A . 4 CYS HA 1 1 8 5072 1 1 4 CYS HB2 H 1.959 8.154 2.512 1.00 . A A . 4 CYS HB2 1 1 8 5073 1 1 4 CYS HB3 H 2.957 8.477 3.929 1.00 . A A . 4 CYS HB3 1 1 8 5074 1 1 4 CYS N N 2.184 10.823 2.829 1.00 . A A . 4 CYS N 1 1 8 5075 1 1 4 CYS O O 0.188 10.579 5.579 1.00 . A A . 4 CYS O 1 1 8 5076 1 1 4 CYS SG S 0.965 7.307 4.499 1.00 . A A . 4 CYS SG 1 1 8 5077 1 1 5 GLY C C 3.849 11.095 7.596 1.00 . A A . 5 GLY C 1 1 8 5078 1 1 5 GLY CA C 2.452 10.743 7.136 1.00 . A A . 5 GLY CA 1 1 8 5079 1 1 5 GLY H H 3.259 10.146 5.277 1.00 . A A . 5 GLY H 1 1 8 5080 1 1 5 GLY HA2 H 1.807 11.591 7.287 1.00 . A A . 5 GLY HA2 1 1 8 5081 1 1 5 GLY HA3 H 2.088 9.917 7.728 1.00 . A A . 5 GLY HA3 1 1 8 5082 1 1 5 GLY N N 2.422 10.367 5.737 1.00 . A A . 5 GLY N 1 1 8 5083 1 1 5 GLY O O 4.420 12.096 7.164 1.00 . A A . 5 GLY O 1 1 8 5084 1 1 6 GLY C C 6.714 9.434 8.466 1.00 . A A . 6 GLY C 1 1 8 5085 1 1 6 GLY CA C 5.746 10.489 8.959 1.00 . A A . 6 GLY CA 1 1 8 5086 1 1 6 GLY H H 3.902 9.473 8.762 1.00 . A A . 6 GLY H 1 1 8 5087 1 1 6 GLY HA2 H 6.082 11.460 8.626 1.00 . A A . 6 GLY HA2 1 1 8 5088 1 1 6 GLY HA3 H 5.730 10.473 10.039 1.00 . A A . 6 GLY HA3 1 1 8 5089 1 1 6 GLY N N 4.405 10.259 8.464 1.00 . A A . 6 GLY N 1 1 8 5090 1 1 6 GLY O O 7.213 8.627 9.250 1.00 . A A . 6 GLY O 1 1 8 5091 1 1 7 GLY C C 7.847 8.392 5.083 1.00 . A A . 7 GLY C 1 1 8 5092 1 1 7 GLY CA C 7.895 8.466 6.599 1.00 . A A . 7 GLY CA 1 1 8 5093 1 1 7 GLY H H 6.556 10.109 6.585 1.00 . A A . 7 GLY H 1 1 8 5094 1 1 7 GLY HA2 H 8.899 8.723 6.898 1.00 . A A . 7 GLY HA2 1 1 8 5095 1 1 7 GLY HA3 H 7.653 7.493 7.001 1.00 . A A . 7 GLY HA3 1 1 8 5096 1 1 7 GLY N N 6.981 9.439 7.161 1.00 . A A . 7 GLY N 1 1 8 5097 1 1 7 GLY O O 8.848 8.660 4.417 1.00 . A A . 7 GLY O 1 1 8 5098 1 1 8 PHE C C 5.612 8.893 2.485 1.00 . A A . 8 PHE C 1 1 8 5099 1 1 8 PHE CA C 6.564 7.865 3.081 1.00 . A A . 8 PHE CA 1 1 8 5100 1 1 8 PHE CB C 6.064 6.467 2.731 1.00 . A A . 8 PHE CB 1 1 8 5101 1 1 8 PHE CD1 C 7.687 5.181 4.161 1.00 . A A . 8 PHE CD1 1 1 8 5102 1 1 8 PHE CD2 C 7.469 4.578 1.864 1.00 . A A . 8 PHE CD2 1 1 8 5103 1 1 8 PHE CE1 C 8.632 4.190 4.336 1.00 . A A . 8 PHE CE1 1 1 8 5104 1 1 8 PHE CE2 C 8.414 3.583 2.033 1.00 . A A . 8 PHE CE2 1 1 8 5105 1 1 8 PHE CG C 7.095 5.388 2.923 1.00 . A A . 8 PHE CG 1 1 8 5106 1 1 8 PHE CZ C 8.996 3.389 3.271 1.00 . A A . 8 PHE CZ 1 1 8 5107 1 1 8 PHE H H 5.935 7.774 5.105 1.00 . A A . 8 PHE H 1 1 8 5108 1 1 8 PHE HA H 7.541 8.002 2.645 1.00 . A A . 8 PHE HA 1 1 8 5109 1 1 8 PHE HB2 H 5.210 6.237 3.354 1.00 . A A . 8 PHE HB2 1 1 8 5110 1 1 8 PHE HB3 H 5.760 6.454 1.695 1.00 . A A . 8 PHE HB3 1 1 8 5111 1 1 8 PHE HD1 H 7.403 5.807 4.995 1.00 . A A . 8 PHE HD1 1 1 8 5112 1 1 8 PHE HD2 H 7.016 4.729 0.896 1.00 . A A . 8 PHE HD2 1 1 8 5113 1 1 8 PHE HE1 H 9.086 4.040 5.304 1.00 . A A . 8 PHE HE1 1 1 8 5114 1 1 8 PHE HE2 H 8.697 2.959 1.198 1.00 . A A . 8 PHE HE2 1 1 8 5115 1 1 8 PHE HZ H 9.735 2.613 3.405 1.00 . A A . 8 PHE HZ 1 1 8 5116 1 1 8 PHE N N 6.699 7.999 4.530 1.00 . A A . 8 PHE N 1 1 8 5117 1 1 8 PHE O O 5.117 9.785 3.172 1.00 . A A . 8 PHE O 1 1 8 5118 1 1 9 SER C C 3.972 8.908 -0.811 1.00 . A A . 9 SER C 1 1 8 5119 1 1 9 SER CA C 4.471 9.617 0.445 1.00 . A A . 9 SER CA 1 1 8 5120 1 1 9 SER CB C 5.187 10.913 0.061 1.00 . A A . 9 SER CB 1 1 8 5121 1 1 9 SER H H 5.795 7.996 0.711 1.00 . A A . 9 SER H 1 1 8 5122 1 1 9 SER HA H 3.626 9.849 1.077 1.00 . A A . 9 SER HA 1 1 8 5123 1 1 9 SER HB2 H 5.483 10.864 -0.977 1.00 . A A . 9 SER HB2 1 1 8 5124 1 1 9 SER HB3 H 4.518 11.748 0.204 1.00 . A A . 9 SER HB3 1 1 8 5125 1 1 9 SER HG H 6.760 11.944 0.608 1.00 . A A . 9 SER HG 1 1 8 5126 1 1 9 SER N N 5.364 8.738 1.187 1.00 . A A . 9 SER N 1 1 8 5127 1 1 9 SER O O 4.571 7.927 -1.253 1.00 . A A . 9 SER O 1 1 8 5128 1 1 9 SER OG O 6.344 11.115 0.854 1.00 . A A . 9 SER OG 1 1 8 5129 1 1 10 CYS C C 2.162 9.857 -3.688 1.00 . A A . 10 CYS C 1 1 8 5130 1 1 10 CYS CA C 2.326 8.808 -2.594 1.00 . A A . 10 CYS CA 1 1 8 5131 1 1 10 CYS CB C 0.976 8.149 -2.299 1.00 . A A . 10 CYS CB 1 1 8 5132 1 1 10 CYS H H 2.450 10.190 -0.996 1.00 . A A . 10 CYS H 1 1 8 5133 1 1 10 CYS HA H 3.017 8.055 -2.939 1.00 . A A . 10 CYS HA 1 1 8 5134 1 1 10 CYS HB2 H 0.491 8.686 -1.496 1.00 . A A . 10 CYS HB2 1 1 8 5135 1 1 10 CYS HB3 H 0.359 8.206 -3.183 1.00 . A A . 10 CYS HB3 1 1 8 5136 1 1 10 CYS N N 2.884 9.404 -1.387 1.00 . A A . 10 CYS N 1 1 8 5137 1 1 10 CYS O O 2.072 11.052 -3.407 1.00 . A A . 10 CYS O 1 1 8 5138 1 1 10 CYS SG S 1.082 6.392 -1.808 1.00 . A A . 10 CYS SG 1 1 8 5139 1 1 11 HIS C C 0.506 10.612 -6.318 1.00 . A A . 11 HIS C 1 1 8 5140 1 1 11 HIS CA C 1.976 10.295 -6.072 1.00 . A A . 11 HIS CA 1 1 8 5141 1 1 11 HIS CB C 2.594 9.671 -7.326 1.00 . A A . 11 HIS CB 1 1 8 5142 1 1 11 HIS CD2 C 5.081 9.544 -6.595 1.00 . A A . 11 HIS CD2 1 1 8 5143 1 1 11 HIS CE1 C 5.437 7.426 -7.038 1.00 . A A . 11 HIS CE1 1 1 8 5144 1 1 11 HIS CG C 3.926 9.030 -7.083 1.00 . A A . 11 HIS CG 1 1 8 5145 1 1 11 HIS H H 2.208 8.435 -5.088 1.00 . A A . 11 HIS H 1 1 8 5146 1 1 11 HIS HA H 2.497 11.213 -5.843 1.00 . A A . 11 HIS HA 1 1 8 5147 1 1 11 HIS HB2 H 1.927 8.914 -7.709 1.00 . A A . 11 HIS HB2 1 1 8 5148 1 1 11 HIS HB3 H 2.725 10.439 -8.074 1.00 . A A . 11 HIS HB3 1 1 8 5149 1 1 11 HIS HD1 H 3.542 7.056 -7.716 1.00 . A A . 11 HIS HD1 1 1 8 5150 1 1 11 HIS HD2 H 5.245 10.564 -6.278 1.00 . A A . 11 HIS HD2 1 1 8 5151 1 1 11 HIS HE1 H 5.919 6.465 -7.142 1.00 . A A . 11 HIS HE1 1 1 8 5152 1 1 11 HIS HE2 H 6.927 8.599 -6.263 1.00 . A A . 11 HIS HE2 1 1 8 5153 1 1 11 HIS N N 2.126 9.399 -4.934 1.00 . A A . 11 HIS N 1 1 8 5154 1 1 11 HIS ND1 N 4.183 7.702 -7.352 1.00 . A A . 11 HIS ND1 1 1 8 5155 1 1 11 HIS NE2 N 6.002 8.527 -6.578 1.00 . A A . 11 HIS NE2 1 1 8 5156 1 1 11 HIS O O -0.378 10.046 -5.672 1.00 . A A . 11 HIS O 1 1 8 5157 1 1 12 ASP C C -1.946 10.729 -8.015 1.00 . A A . 12 ASP C 1 1 8 5158 1 1 12 ASP CA C -1.112 11.927 -7.571 1.00 . A A . 12 ASP CA 1 1 8 5159 1 1 12 ASP CB C -1.097 12.989 -8.673 1.00 . A A . 12 ASP CB 1 1 8 5160 1 1 12 ASP CG C -2.482 13.286 -9.214 1.00 . A A . 12 ASP CG 1 1 8 5161 1 1 12 ASP H H 0.996 11.950 -7.721 1.00 . A A . 12 ASP H 1 1 8 5162 1 1 12 ASP HA H -1.555 12.349 -6.683 1.00 . A A . 12 ASP HA 1 1 8 5163 1 1 12 ASP HB2 H -0.682 13.904 -8.276 1.00 . A A . 12 ASP HB2 1 1 8 5164 1 1 12 ASP HB3 H -0.478 12.643 -9.488 1.00 . A A . 12 ASP HB3 1 1 8 5165 1 1 12 ASP N N 0.250 11.527 -7.245 1.00 . A A . 12 ASP N 1 1 8 5166 1 1 12 ASP O O -1.580 10.017 -8.952 1.00 . A A . 12 ASP O 1 1 8 5167 1 1 12 ASP OD1 O -2.630 13.365 -10.452 1.00 . A A . 12 ASP OD1 1 1 8 5168 1 1 12 ASP OD2 O -3.417 13.441 -8.402 1.00 . A A . 12 ASP OD2 1 1 8 5169 1 1 13 GLY C C -3.680 8.160 -6.881 1.00 . A A . 13 GLY C 1 1 8 5170 1 1 13 GLY CA C -3.951 9.416 -7.689 1.00 . A A . 13 GLY CA 1 1 8 5171 1 1 13 GLY H H -3.318 11.126 -6.613 1.00 . A A . 13 GLY H 1 1 8 5172 1 1 13 GLY HA2 H -4.973 9.720 -7.523 1.00 . A A . 13 GLY HA2 1 1 8 5173 1 1 13 GLY HA3 H -3.823 9.187 -8.737 1.00 . A A . 13 GLY HA3 1 1 8 5174 1 1 13 GLY N N -3.074 10.519 -7.343 1.00 . A A . 13 GLY N 1 1 8 5175 1 1 13 GLY O O -4.492 7.235 -6.879 1.00 . A A . 13 GLY O 1 1 8 5176 1 1 14 GLU C C -2.659 7.103 -3.952 1.00 . A A . 14 GLU C 1 1 8 5177 1 1 14 GLU CA C -2.180 6.953 -5.393 1.00 . A A . 14 GLU CA 1 1 8 5178 1 1 14 GLU CB C -0.666 6.731 -5.410 1.00 . A A . 14 GLU CB 1 1 8 5179 1 1 14 GLU CD C 0.769 6.179 -7.413 1.00 . A A . 14 GLU CD 1 1 8 5180 1 1 14 GLU CG C 0.022 7.261 -6.656 1.00 . A A . 14 GLU CG 1 1 8 5181 1 1 14 GLU H H -1.922 8.880 -6.236 1.00 . A A . 14 GLU H 1 1 8 5182 1 1 14 GLU HA H -2.663 6.092 -5.830 1.00 . A A . 14 GLU HA 1 1 8 5183 1 1 14 GLU HB2 H -0.234 7.223 -4.552 1.00 . A A . 14 GLU HB2 1 1 8 5184 1 1 14 GLU HB3 H -0.470 5.671 -5.339 1.00 . A A . 14 GLU HB3 1 1 8 5185 1 1 14 GLU HG2 H -0.724 7.686 -7.311 1.00 . A A . 14 GLU HG2 1 1 8 5186 1 1 14 GLU HG3 H 0.725 8.027 -6.363 1.00 . A A . 14 GLU HG3 1 1 8 5187 1 1 14 GLU N N -2.539 8.118 -6.196 1.00 . A A . 14 GLU N 1 1 8 5188 1 1 14 GLU O O -3.103 8.175 -3.540 1.00 . A A . 14 GLU O 1 1 8 5189 1 1 14 GLU OE1 O 1.597 5.483 -6.789 1.00 . A A . 14 GLU OE1 1 1 8 5190 1 1 14 GLU OE2 O 0.524 6.029 -8.628 1.00 . A A . 14 GLU OE2 1 1 8 5191 1 1 15 THR C C -1.949 5.243 -0.955 1.00 . A A . 15 THR C 1 1 8 5192 1 1 15 THR CA C -2.970 6.005 -1.794 1.00 . A A . 15 THR CA 1 1 8 5193 1 1 15 THR CB C -4.353 5.349 -1.624 1.00 . A A . 15 THR CB 1 1 8 5194 1 1 15 THR CG2 C -4.797 5.382 -0.168 1.00 . A A . 15 THR CG2 1 1 8 5195 1 1 15 THR H H -2.194 5.192 -3.577 1.00 . A A . 15 THR H 1 1 8 5196 1 1 15 THR HA H -3.025 7.026 -1.447 1.00 . A A . 15 THR HA 1 1 8 5197 1 1 15 THR HB H -4.286 4.317 -1.941 1.00 . A A . 15 THR HB 1 1 8 5198 1 1 15 THR HG1 H -4.926 6.817 -2.811 1.00 . A A . 15 THR HG1 1 1 8 5199 1 1 15 THR HG21 H -3.977 5.717 0.450 1.00 . A A . 15 THR HG21 1 1 8 5200 1 1 15 THR HG22 H -5.098 4.391 0.139 1.00 . A A . 15 THR HG22 1 1 8 5201 1 1 15 THR HG23 H -5.629 6.062 -0.061 1.00 . A A . 15 THR HG23 1 1 8 5202 1 1 15 THR N N -2.559 6.016 -3.192 1.00 . A A . 15 THR N 1 1 8 5203 1 1 15 THR O O -1.484 4.177 -1.353 1.00 . A A . 15 THR O 1 1 8 5204 1 1 15 THR OG1 O -5.320 6.026 -2.437 1.00 . A A . 15 THR OG1 1 1 8 5205 1 1 16 CYS C C -1.314 4.194 2.061 1.00 . A A . 16 CYS C 1 1 8 5206 1 1 16 CYS CA C -0.628 5.136 1.076 1.00 . A A . 16 CYS CA 1 1 8 5207 1 1 16 CYS CB C 0.213 6.174 1.819 1.00 . A A . 16 CYS CB 1 1 8 5208 1 1 16 CYS H H -2.000 6.636 0.484 1.00 . A A . 16 CYS H 1 1 8 5209 1 1 16 CYS HA H 0.025 4.550 0.447 1.00 . A A . 16 CYS HA 1 1 8 5210 1 1 16 CYS HB2 H 1.129 5.709 2.159 1.00 . A A . 16 CYS HB2 1 1 8 5211 1 1 16 CYS HB3 H 0.458 6.979 1.140 1.00 . A A . 16 CYS HB3 1 1 8 5212 1 1 16 CYS N N -1.598 5.787 0.205 1.00 . A A . 16 CYS N 1 1 8 5213 1 1 16 CYS O O -2.258 4.577 2.753 1.00 . A A . 16 CYS O 1 1 8 5214 1 1 16 CYS SG S -0.596 6.905 3.274 1.00 . A A . 16 CYS SG 1 1 8 5215 1 1 17 CYS C C -0.293 1.368 3.900 1.00 . A A . 17 CYS C 1 1 8 5216 1 1 17 CYS CA C -1.385 1.945 3.003 1.00 . A A . 17 CYS CA 1 1 8 5217 1 1 17 CYS CB C -2.040 0.827 2.192 1.00 . A A . 17 CYS CB 1 1 8 5218 1 1 17 CYS H H -0.081 2.713 1.532 1.00 . A A . 17 CYS H 1 1 8 5219 1 1 17 CYS HA H -2.133 2.416 3.622 1.00 . A A . 17 CYS HA 1 1 8 5220 1 1 17 CYS HB2 H -1.433 0.618 1.323 1.00 . A A . 17 CYS HB2 1 1 8 5221 1 1 17 CYS HB3 H -2.103 -0.062 2.802 1.00 . A A . 17 CYS HB3 1 1 8 5222 1 1 17 CYS N N -0.831 2.956 2.112 1.00 . A A . 17 CYS N 1 1 8 5223 1 1 17 CYS O O 0.801 1.050 3.431 1.00 . A A . 17 CYS O 1 1 8 5224 1 1 17 CYS SG S -3.720 1.222 1.610 1.00 . A A . 17 CYS SG 1 1 8 5225 1 1 18 PRO C C 0.360 -0.822 6.233 1.00 . A A . 18 PRO C 1 1 8 5226 1 1 18 PRO CA C 0.389 0.704 6.171 1.00 . A A . 18 PRO CA 1 1 8 5227 1 1 18 PRO CB C -0.096 1.316 7.481 1.00 . A A . 18 PRO CB 1 1 8 5228 1 1 18 PRO CD C -1.848 1.600 5.861 1.00 . A A . 18 PRO CD 1 1 8 5229 1 1 18 PRO CG C -1.579 1.367 7.329 1.00 . A A . 18 PRO CG 1 1 8 5230 1 1 18 PRO HA H 1.394 1.040 5.960 1.00 . A A . 18 PRO HA 1 1 8 5231 1 1 18 PRO HB2 H 0.202 0.693 8.310 1.00 . A A . 18 PRO HB2 1 1 8 5232 1 1 18 PRO HB3 H 0.321 2.306 7.597 1.00 . A A . 18 PRO HB3 1 1 8 5233 1 1 18 PRO HD2 H -2.651 0.965 5.516 1.00 . A A . 18 PRO HD2 1 1 8 5234 1 1 18 PRO HD3 H -2.086 2.638 5.683 1.00 . A A . 18 PRO HD3 1 1 8 5235 1 1 18 PRO HG2 H -2.013 0.429 7.644 1.00 . A A . 18 PRO HG2 1 1 8 5236 1 1 18 PRO HG3 H -1.980 2.181 7.915 1.00 . A A . 18 PRO HG3 1 1 8 5237 1 1 18 PRO N N -0.572 1.235 5.210 1.00 . A A . 18 PRO N 1 1 8 5238 1 1 18 PRO O O -0.655 -1.420 6.595 1.00 . A A . 18 PRO O 1 1 8 5239 1 1 19 THR C C 2.032 -3.436 7.214 1.00 . A A . 19 THR C 1 1 8 5240 1 1 19 THR CA C 1.573 -2.900 5.861 1.00 . A A . 19 THR CA 1 1 8 5241 1 1 19 THR CB C 2.546 -3.396 4.775 1.00 . A A . 19 THR CB 1 1 8 5242 1 1 19 THR CG2 C 2.436 -2.546 3.518 1.00 . A A . 19 THR CG2 1 1 8 5243 1 1 19 THR H H 2.245 -0.912 5.574 1.00 . A A . 19 THR H 1 1 8 5244 1 1 19 THR HA H 0.594 -3.299 5.643 1.00 . A A . 19 THR HA 1 1 8 5245 1 1 19 THR HB H 2.293 -4.416 4.525 1.00 . A A . 19 THR HB 1 1 8 5246 1 1 19 THR HG1 H 4.487 -3.704 4.600 1.00 . A A . 19 THR HG1 1 1 8 5247 1 1 19 THR HG21 H 2.208 -1.525 3.792 1.00 . A A . 19 THR HG21 1 1 8 5248 1 1 19 THR HG22 H 1.648 -2.933 2.888 1.00 . A A . 19 THR HG22 1 1 8 5249 1 1 19 THR HG23 H 3.373 -2.573 2.981 1.00 . A A . 19 THR HG23 1 1 8 5250 1 1 19 THR N N 1.474 -1.444 5.863 1.00 . A A . 19 THR N 1 1 8 5251 1 1 19 THR O O 2.015 -4.646 7.447 1.00 . A A . 19 THR O 1 1 8 5252 1 1 19 THR OG1 O 3.891 -3.355 5.267 1.00 . A A . 19 THR OG1 1 1 8 5253 1 1 20 SER C C 2.630 -1.832 10.457 1.00 . A A . 20 SER C 1 1 8 5254 1 1 20 SER CA C 2.895 -2.935 9.432 1.00 . A A . 20 SER CA 1 1 8 5255 1 1 20 SER CB C 4.385 -3.279 9.401 1.00 . A A . 20 SER CB 1 1 8 5256 1 1 20 SER H H 2.423 -1.586 7.870 1.00 . A A . 20 SER H 1 1 8 5257 1 1 20 SER HA H 2.339 -3.814 9.721 1.00 . A A . 20 SER HA 1 1 8 5258 1 1 20 SER HB2 H 4.964 -2.368 9.416 1.00 . A A . 20 SER HB2 1 1 8 5259 1 1 20 SER HB3 H 4.632 -3.878 10.266 1.00 . A A . 20 SER HB3 1 1 8 5260 1 1 20 SER HG H 5.432 -3.567 7.770 1.00 . A A . 20 SER HG 1 1 8 5261 1 1 20 SER N N 2.438 -2.537 8.105 1.00 . A A . 20 SER N 1 1 8 5262 1 1 20 SER O O 1.550 -1.761 11.043 1.00 . A A . 20 SER O 1 1 8 5263 1 1 20 SER OG O 4.717 -4.010 8.232 1.00 . A A . 20 SER OG 1 1 8 5264 1 1 21 GLN C C 4.619 1.146 11.385 1.00 . A A . 21 GLN C 1 1 8 5265 1 1 21 GLN CA C 3.513 0.123 11.618 1.00 . A A . 21 GLN CA 1 1 8 5266 1 1 21 GLN CB C 3.581 -0.403 13.053 1.00 . A A . 21 GLN CB 1 1 8 5267 1 1 21 GLN CD C 2.687 -0.185 15.407 1.00 . A A . 21 GLN CD 1 1 8 5268 1 1 21 GLN CG C 2.445 0.088 13.934 1.00 . A A . 21 GLN CG 1 1 8 5269 1 1 21 GLN H H 4.464 -1.088 10.169 1.00 . A A . 21 GLN H 1 1 8 5270 1 1 21 GLN HA H 2.557 0.601 11.462 1.00 . A A . 21 GLN HA 1 1 8 5271 1 1 21 GLN HB2 H 3.550 -1.483 13.030 1.00 . A A . 21 GLN HB2 1 1 8 5272 1 1 21 GLN HB3 H 4.514 -0.087 13.497 1.00 . A A . 21 GLN HB3 1 1 8 5273 1 1 21 GLN HE21 H 0.789 0.238 15.821 1.00 . A A . 21 GLN HE21 1 1 8 5274 1 1 21 GLN HE22 H 1.771 -0.206 17.170 1.00 . A A . 21 GLN HE22 1 1 8 5275 1 1 21 GLN HG2 H 2.333 1.153 13.795 1.00 . A A . 21 GLN HG2 1 1 8 5276 1 1 21 GLN HG3 H 1.534 -0.410 13.635 1.00 . A A . 21 GLN HG3 1 1 8 5277 1 1 21 GLN N N 3.627 -0.976 10.667 1.00 . A A . 21 GLN N 1 1 8 5278 1 1 21 GLN NE2 N 1.644 -0.036 16.214 1.00 . A A . 21 GLN NE2 1 1 8 5279 1 1 21 GLN O O 4.532 2.288 11.837 1.00 . A A . 21 GLN O 1 1 8 5280 1 1 21 GLN OE1 O 3.797 -0.527 15.813 1.00 . A A . 21 GLN OE1 1 1 8 5281 1 1 22 THR C C 7.038 1.632 8.860 1.00 . A A . 22 THR C 1 1 8 5282 1 1 22 THR CA C 6.784 1.593 10.362 1.00 . A A . 22 THR CA 1 1 8 5283 1 1 22 THR CB C 8.066 1.130 11.076 1.00 . A A . 22 THR CB 1 1 8 5284 1 1 22 THR CG2 C 7.809 0.905 12.559 1.00 . A A . 22 THR CG2 1 1 8 5285 1 1 22 THR H H 5.661 -0.198 10.336 1.00 . A A . 22 THR H 1 1 8 5286 1 1 22 THR HA H 6.542 2.589 10.705 1.00 . A A . 22 THR HA 1 1 8 5287 1 1 22 THR HB H 8.818 1.899 10.969 1.00 . A A . 22 THR HB 1 1 8 5288 1 1 22 THR HG1 H 8.914 0.112 9.616 1.00 . A A . 22 THR HG1 1 1 8 5289 1 1 22 THR HG21 H 7.233 0.001 12.691 1.00 . A A . 22 THR HG21 1 1 8 5290 1 1 22 THR HG22 H 7.262 1.743 12.961 1.00 . A A . 22 THR HG22 1 1 8 5291 1 1 22 THR HG23 H 8.753 0.810 13.077 1.00 . A A . 22 THR HG23 1 1 8 5292 1 1 22 THR N N 5.657 0.724 10.671 1.00 . A A . 22 THR N 1 1 8 5293 1 1 22 THR O O 7.938 2.328 8.389 1.00 . A A . 22 THR O 1 1 8 5294 1 1 22 THR OG1 O 8.548 -0.080 10.481 1.00 . A A . 22 THR OG1 1 1 8 5295 1 1 23 THR C C 5.165 1.490 5.986 1.00 . A A . 23 THR C 1 1 8 5296 1 1 23 THR CA C 6.360 0.827 6.663 1.00 . A A . 23 THR CA 1 1 8 5297 1 1 23 THR CB C 6.480 -0.624 6.163 1.00 . A A . 23 THR CB 1 1 8 5298 1 1 23 THR CG2 C 7.865 -1.183 6.455 1.00 . A A . 23 THR CG2 1 1 8 5299 1 1 23 THR H H 5.532 0.354 8.552 1.00 . A A . 23 THR H 1 1 8 5300 1 1 23 THR HA H 7.259 1.358 6.387 1.00 . A A . 23 THR HA 1 1 8 5301 1 1 23 THR HB H 6.322 -0.634 5.094 1.00 . A A . 23 THR HB 1 1 8 5302 1 1 23 THR HG1 H 4.732 -1.537 6.204 1.00 . A A . 23 THR HG1 1 1 8 5303 1 1 23 THR HG21 H 8.013 -2.092 5.891 1.00 . A A . 23 THR HG21 1 1 8 5304 1 1 23 THR HG22 H 7.952 -1.394 7.511 1.00 . A A . 23 THR HG22 1 1 8 5305 1 1 23 THR HG23 H 8.612 -0.457 6.171 1.00 . A A . 23 THR HG23 1 1 8 5306 1 1 23 THR N N 6.233 0.881 8.114 1.00 . A A . 23 THR N 1 1 8 5307 1 1 23 THR O O 4.147 1.754 6.625 1.00 . A A . 23 THR O 1 1 8 5308 1 1 23 THR OG1 O 5.487 -1.445 6.790 1.00 . A A . 23 THR OG1 1 1 8 5309 1 1 24 TRP C C 4.300 2.005 2.454 1.00 . A A . 24 TRP C 1 1 8 5310 1 1 24 TRP CA C 4.228 2.394 3.928 1.00 . A A . 24 TRP CA 1 1 8 5311 1 1 24 TRP CB C 4.321 3.915 4.062 1.00 . A A . 24 TRP CB 1 1 8 5312 1 1 24 TRP CD1 C 4.228 4.995 6.384 1.00 . A A . 24 TRP CD1 1 1 8 5313 1 1 24 TRP CD2 C 2.229 4.533 5.504 1.00 . A A . 24 TRP CD2 1 1 8 5314 1 1 24 TRP CE2 C 2.035 5.115 6.770 1.00 . A A . 24 TRP CE2 1 1 8 5315 1 1 24 TRP CE3 C 1.115 4.162 4.756 1.00 . A A . 24 TRP CE3 1 1 8 5316 1 1 24 TRP CG C 3.636 4.460 5.278 1.00 . A A . 24 TRP CG 1 1 8 5317 1 1 24 TRP CH2 C -0.308 4.962 6.547 1.00 . A A . 24 TRP CH2 1 1 8 5318 1 1 24 TRP CZ2 C 0.768 5.333 7.304 1.00 . A A . 24 TRP CZ2 1 1 8 5319 1 1 24 TRP CZ3 C -0.143 4.382 5.284 1.00 . A A . 24 TRP CZ3 1 1 8 5320 1 1 24 TRP H H 6.134 1.525 4.237 1.00 . A A . 24 TRP H 1 1 8 5321 1 1 24 TRP HA H 3.284 2.062 4.334 1.00 . A A . 24 TRP HA 1 1 8 5322 1 1 24 TRP HB2 H 5.360 4.200 4.113 1.00 . A A . 24 TRP HB2 1 1 8 5323 1 1 24 TRP HB3 H 3.870 4.372 3.194 1.00 . A A . 24 TRP HB3 1 1 8 5324 1 1 24 TRP HD1 H 5.293 5.087 6.514 1.00 . A A . 24 TRP HD1 1 1 8 5325 1 1 24 TRP HE1 H 3.444 5.800 8.162 1.00 . A A . 24 TRP HE1 1 1 8 5326 1 1 24 TRP HE3 H 1.225 3.717 3.780 1.00 . A A . 24 TRP HE3 1 1 8 5327 1 1 24 TRP HH2 H -1.308 5.113 6.918 1.00 . A A . 24 TRP HH2 1 1 8 5328 1 1 24 TRP HZ2 H 0.626 5.782 8.276 1.00 . A A . 24 TRP HZ2 1 1 8 5329 1 1 24 TRP HZ3 H -1.018 4.113 4.714 1.00 . A A . 24 TRP HZ3 1 1 8 5330 1 1 24 TRP N N 5.297 1.758 4.690 1.00 . A A . 24 TRP N 1 1 8 5331 1 1 24 TRP NE1 N 3.271 5.389 7.290 1.00 . A A . 24 TRP NE1 1 1 8 5332 1 1 24 TRP O O 5.385 1.895 1.884 1.00 . A A . 24 TRP O 1 1 8 5333 1 1 25 GLY C C 2.187 2.365 -0.366 1.00 . A A . 25 GLY C 1 1 8 5334 1 1 25 GLY CA C 3.088 1.442 0.434 1.00 . A A . 25 GLY CA 1 1 8 5335 1 1 25 GLY H H 2.301 1.915 2.346 1.00 . A A . 25 GLY H 1 1 8 5336 1 1 25 GLY HA2 H 4.086 1.487 0.028 1.00 . A A . 25 GLY HA2 1 1 8 5337 1 1 25 GLY HA3 H 2.719 0.431 0.348 1.00 . A A . 25 GLY HA3 1 1 8 5338 1 1 25 GLY N N 3.136 1.807 1.840 1.00 . A A . 25 GLY N 1 1 8 5339 1 1 25 GLY O O 1.331 3.041 0.198 1.00 . A A . 25 GLY O 1 1 8 5340 1 1 26 CYS C C 0.691 2.407 -3.477 1.00 . A A . 26 CYS C 1 1 8 5341 1 1 26 CYS CA C 1.570 3.246 -2.550 1.00 . A A . 26 CYS CA 1 1 8 5342 1 1 26 CYS CB C 2.466 4.171 -3.379 1.00 . A A . 26 CYS CB 1 1 8 5343 1 1 26 CYS H H 3.077 1.831 -2.078 1.00 . A A . 26 CYS H 1 1 8 5344 1 1 26 CYS HA H 0.933 3.848 -1.920 1.00 . A A . 26 CYS HA 1 1 8 5345 1 1 26 CYS HB2 H 3.399 3.667 -3.581 1.00 . A A . 26 CYS HB2 1 1 8 5346 1 1 26 CYS HB3 H 1.973 4.392 -4.314 1.00 . A A . 26 CYS HB3 1 1 8 5347 1 1 26 CYS N N 2.379 2.394 -1.682 1.00 . A A . 26 CYS N 1 1 8 5348 1 1 26 CYS O O 1.161 1.457 -4.103 1.00 . A A . 26 CYS O 1 1 8 5349 1 1 26 CYS SG S 2.860 5.759 -2.571 1.00 . A A . 26 CYS SG 1 1 8 5350 1 1 27 CYS C C -2.131 3.005 -5.449 1.00 . A A . 27 CYS C 1 1 8 5351 1 1 27 CYS CA C -1.536 2.060 -4.405 1.00 . A A . 27 CYS CA 1 1 8 5352 1 1 27 CYS CB C -2.653 1.446 -3.556 1.00 . A A . 27 CYS CB 1 1 8 5353 1 1 27 CYS H H -0.896 3.537 -3.034 1.00 . A A . 27 CYS H 1 1 8 5354 1 1 27 CYS HA H -1.003 1.270 -4.912 1.00 . A A . 27 CYS HA 1 1 8 5355 1 1 27 CYS HB2 H -2.392 1.536 -2.512 1.00 . A A . 27 CYS HB2 1 1 8 5356 1 1 27 CYS HB3 H -3.573 1.982 -3.738 1.00 . A A . 27 CYS HB3 1 1 8 5357 1 1 27 CYS N N -0.585 2.771 -3.557 1.00 . A A . 27 CYS N 1 1 8 5358 1 1 27 CYS O O -2.698 4.040 -5.103 1.00 . A A . 27 CYS O 1 1 8 5359 1 1 27 CYS SG S -2.959 -0.319 -3.899 1.00 . A A . 27 CYS SG 1 1 8 5360 1 1 28 PRO C C -4.042 3.438 -7.965 1.00 . A A . 28 PRO C 1 1 8 5361 1 1 28 PRO CA C -2.522 3.502 -7.837 1.00 . A A . 28 PRO CA 1 1 8 5362 1 1 28 PRO CB C -1.854 2.911 -9.079 1.00 . A A . 28 PRO CB 1 1 8 5363 1 1 28 PRO CD C -1.330 1.454 -7.252 1.00 . A A . 28 PRO CD 1 1 8 5364 1 1 28 PRO CG C -1.607 1.484 -8.732 1.00 . A A . 28 PRO CG 1 1 8 5365 1 1 28 PRO HA H -2.218 4.532 -7.721 1.00 . A A . 28 PRO HA 1 1 8 5366 1 1 28 PRO HB2 H -2.519 3.003 -9.925 1.00 . A A . 28 PRO HB2 1 1 8 5367 1 1 28 PRO HB3 H -0.931 3.434 -9.279 1.00 . A A . 28 PRO HB3 1 1 8 5368 1 1 28 PRO HD2 H -1.754 0.565 -6.808 1.00 . A A . 28 PRO HD2 1 1 8 5369 1 1 28 PRO HD3 H -0.266 1.498 -7.067 1.00 . A A . 28 PRO HD3 1 1 8 5370 1 1 28 PRO HG2 H -2.482 0.895 -8.961 1.00 . A A . 28 PRO HG2 1 1 8 5371 1 1 28 PRO HG3 H -0.752 1.117 -9.280 1.00 . A A . 28 PRO HG3 1 1 8 5372 1 1 28 PRO N N -2.001 2.668 -6.746 1.00 . A A . 28 PRO N 1 1 8 5373 1 1 28 PRO O O -4.585 3.506 -9.068 1.00 . A A . 28 PRO O 1 1 8 5374 1 1 29 SER C C -6.765 4.447 -6.066 1.00 . A A . 29 SER C 1 1 8 5375 1 1 29 SER CA C -6.182 3.250 -6.818 1.00 . A A . 29 SER CA 1 1 8 5376 1 1 29 SER CB C -6.649 1.945 -6.170 1.00 . A A . 29 SER CB 1 1 8 5377 1 1 29 SER H H -4.241 3.269 -5.983 1.00 . A A . 29 SER H 1 1 8 5378 1 1 29 SER HA H -6.527 3.280 -7.841 1.00 . A A . 29 SER HA 1 1 8 5379 1 1 29 SER HB2 H -5.789 1.385 -5.833 1.00 . A A . 29 SER HB2 1 1 8 5380 1 1 29 SER HB3 H -7.284 2.171 -5.326 1.00 . A A . 29 SER HB3 1 1 8 5381 1 1 29 SER HG H -6.770 0.750 -7.718 1.00 . A A . 29 SER HG 1 1 8 5382 1 1 29 SER N N -4.726 3.314 -6.831 1.00 . A A . 29 SER N 1 1 8 5383 1 1 29 SER O O -6.110 5.012 -5.189 1.00 . A A . 29 SER O 1 1 8 5384 1 1 29 SER OG O -7.377 1.150 -7.090 1.00 . A A . 29 SER OG 1 1 8 5385 1 1 30 PRO C C -8.628 5.882 -4.224 1.00 . A A . 30 PRO C 1 1 8 5386 1 1 30 PRO CA C -8.667 5.990 -5.747 1.00 . A A . 30 PRO CA 1 1 8 5387 1 1 30 PRO CB C -10.106 5.905 -6.261 1.00 . A A . 30 PRO CB 1 1 8 5388 1 1 30 PRO CD C -8.859 4.239 -7.436 1.00 . A A . 30 PRO CD 1 1 8 5389 1 1 30 PRO CG C -9.996 5.212 -7.574 1.00 . A A . 30 PRO CG 1 1 8 5390 1 1 30 PRO HA H -8.227 6.929 -6.051 1.00 . A A . 30 PRO HA 1 1 8 5391 1 1 30 PRO HB2 H -10.708 5.342 -5.564 1.00 . A A . 30 PRO HB2 1 1 8 5392 1 1 30 PRO HB3 H -10.510 6.901 -6.374 1.00 . A A . 30 PRO HB3 1 1 8 5393 1 1 30 PRO HD2 H -9.222 3.275 -7.113 1.00 . A A . 30 PRO HD2 1 1 8 5394 1 1 30 PRO HD3 H -8.323 4.148 -8.369 1.00 . A A . 30 PRO HD3 1 1 8 5395 1 1 30 PRO HG2 H -10.915 4.685 -7.789 1.00 . A A . 30 PRO HG2 1 1 8 5396 1 1 30 PRO HG3 H -9.783 5.929 -8.352 1.00 . A A . 30 PRO HG3 1 1 8 5397 1 1 30 PRO N N -8.006 4.853 -6.399 1.00 . A A . 30 PRO N 1 1 8 5398 1 1 30 PRO O O -7.824 6.545 -3.567 1.00 . A A . 30 PRO O 1 1 8 5399 1 1 31 LYS C C -8.595 3.677 -1.844 1.00 . A A . 31 LYS C 1 1 8 5400 1 1 31 LYS CA C -9.531 4.817 -2.227 1.00 . A A . 31 LYS CA 1 1 8 5401 1 1 31 LYS CB C -10.959 4.502 -1.780 1.00 . A A . 31 LYS CB 1 1 8 5402 1 1 31 LYS CD C -12.516 3.971 0.118 1.00 . A A . 31 LYS CD 1 1 8 5403 1 1 31 LYS CE C -12.817 4.239 1.584 1.00 . A A . 31 LYS CE 1 1 8 5404 1 1 31 LYS CG C -11.135 4.475 -0.270 1.00 . A A . 31 LYS CG 1 1 8 5405 1 1 31 LYS H H -10.087 4.514 -4.246 1.00 . A A . 31 LYS H 1 1 8 5406 1 1 31 LYS HA H -9.196 5.724 -1.745 1.00 . A A . 31 LYS HA 1 1 8 5407 1 1 31 LYS HB2 H -11.624 5.251 -2.183 1.00 . A A . 31 LYS HB2 1 1 8 5408 1 1 31 LYS HB3 H -11.240 3.535 -2.170 1.00 . A A . 31 LYS HB3 1 1 8 5409 1 1 31 LYS HD2 H -13.254 4.475 -0.488 1.00 . A A . 31 LYS HD2 1 1 8 5410 1 1 31 LYS HD3 H -12.565 2.908 -0.063 1.00 . A A . 31 LYS HD3 1 1 8 5411 1 1 31 LYS HE2 H -12.126 3.671 2.189 1.00 . A A . 31 LYS HE2 1 1 8 5412 1 1 31 LYS HE3 H -12.684 5.292 1.779 1.00 . A A . 31 LYS HE3 1 1 8 5413 1 1 31 LYS HG2 H -10.390 3.820 0.158 1.00 . A A . 31 LYS HG2 1 1 8 5414 1 1 31 LYS HG3 H -11.004 5.475 0.116 1.00 . A A . 31 LYS HG3 1 1 8 5415 1 1 31 LYS HZ1 H -14.890 4.435 1.418 1.00 . A A . 31 LYS HZ1 1 1 8 5416 1 1 31 LYS HZ2 H -14.365 3.983 2.962 1.00 . A A . 31 LYS HZ2 1 1 8 5417 1 1 31 LYS HZ3 H -14.372 2.850 1.706 1.00 . A A . 31 LYS HZ3 1 1 8 5418 1 1 31 LYS N N -9.485 5.030 -3.670 1.00 . A A . 31 LYS N 1 1 8 5419 1 1 31 LYS NZ N -14.209 3.849 1.943 1.00 . A A . 31 LYS NZ 1 1 8 5420 1 1 31 LYS O O -7.666 3.855 -1.056 1.00 . A A . 31 LYS O 1 1 8 5421 1 1 32 ALA C C -8.118 0.826 -0.758 1.00 . A A . 32 ALA C 1 1 8 5422 1 1 32 ALA CA C -8.038 1.318 -2.201 1.00 . A A . 32 ALA CA 1 1 8 5423 1 1 32 ALA CB C -6.590 1.580 -2.586 1.00 . A A . 32 ALA CB 1 1 8 5424 1 1 32 ALA H H -9.597 2.452 -3.060 1.00 . A A . 32 ALA H 1 1 8 5425 1 1 32 ALA HA H -8.413 0.539 -2.849 1.00 . A A . 32 ALA HA 1 1 8 5426 1 1 32 ALA HB1 H -6.472 1.447 -3.651 1.00 . A A . 32 ALA HB1 1 1 8 5427 1 1 32 ALA HB2 H -5.947 0.886 -2.063 1.00 . A A . 32 ALA HB2 1 1 8 5428 1 1 32 ALA HB3 H -6.322 2.591 -2.317 1.00 . A A . 32 ALA HB3 1 1 8 5429 1 1 32 ALA N N -8.848 2.510 -2.433 1.00 . A A . 32 ALA N 1 1 8 5430 1 1 32 ALA O O -7.851 1.571 0.184 1.00 . A A . 32 ALA O 1 1 8 5431 1 1 33 VAL C C -7.238 -1.771 1.038 1.00 . A A . 33 VAL C 1 1 8 5432 1 1 33 VAL CA C -8.552 -1.071 0.713 1.00 . A A . 33 VAL CA 1 1 8 5433 1 1 33 VAL CB C -9.710 -2.087 0.788 1.00 . A A . 33 VAL CB 1 1 8 5434 1 1 33 VAL CG1 C -9.818 -2.675 2.188 1.00 . A A . 33 VAL CG1 1 1 8 5435 1 1 33 VAL CG2 C -11.020 -1.433 0.376 1.00 . A A . 33 VAL CG2 1 1 8 5436 1 1 33 VAL H H -8.642 -0.994 -1.400 1.00 . A A . 33 VAL H 1 1 8 5437 1 1 33 VAL HA H -8.728 -0.293 1.442 1.00 . A A . 33 VAL HA 1 1 8 5438 1 1 33 VAL HB H -9.501 -2.893 0.100 1.00 . A A . 33 VAL HB 1 1 8 5439 1 1 33 VAL HG11 H -9.058 -2.240 2.821 1.00 . A A . 33 VAL HG11 1 1 8 5440 1 1 33 VAL HG12 H -9.678 -3.746 2.142 1.00 . A A . 33 VAL HG12 1 1 8 5441 1 1 33 VAL HG13 H -10.794 -2.457 2.595 1.00 . A A . 33 VAL HG13 1 1 8 5442 1 1 33 VAL HG21 H -11.692 -2.184 -0.012 1.00 . A A . 33 VAL HG21 1 1 8 5443 1 1 33 VAL HG22 H -10.828 -0.693 -0.386 1.00 . A A . 33 VAL HG22 1 1 8 5444 1 1 33 VAL HG23 H -11.471 -0.957 1.235 1.00 . A A . 33 VAL HG23 1 1 8 5445 1 1 33 VAL N N -8.463 -0.451 -0.604 1.00 . A A . 33 VAL N 1 1 8 5446 1 1 33 VAL O O -6.830 -2.696 0.342 1.00 . A A . 33 VAL O 1 1 8 5447 1 1 34 CYS C C -5.417 -3.280 3.049 1.00 . A A . 34 CYS C 1 1 8 5448 1 1 34 CYS CA C -5.282 -1.872 2.478 1.00 . A A . 34 CYS CA 1 1 8 5449 1 1 34 CYS CB C -4.612 -0.962 3.508 1.00 . A A . 34 CYS CB 1 1 8 5450 1 1 34 CYS H H -6.937 -0.558 2.597 1.00 . A A . 34 CYS H 1 1 8 5451 1 1 34 CYS HA H -4.660 -1.914 1.598 1.00 . A A . 34 CYS HA 1 1 8 5452 1 1 34 CYS HB2 H -4.995 -1.197 4.489 1.00 . A A . 34 CYS HB2 1 1 8 5453 1 1 34 CYS HB3 H -3.546 -1.137 3.492 1.00 . A A . 34 CYS HB3 1 1 8 5454 1 1 34 CYS N N -6.567 -1.307 2.084 1.00 . A A . 34 CYS N 1 1 8 5455 1 1 34 CYS O O -5.616 -3.449 4.253 1.00 . A A . 34 CYS O 1 1 8 5456 1 1 34 CYS SG S -4.888 0.815 3.216 1.00 . A A . 34 CYS SG 1 1 8 5457 1 1 35 CYS C C -4.415 -5.906 3.795 1.00 . A A . 35 CYS C 1 1 8 5458 1 1 35 CYS CA C -5.367 -5.682 2.626 1.00 . A A . 35 CYS CA 1 1 8 5459 1 1 35 CYS CB C -5.022 -6.628 1.475 1.00 . A A . 35 CYS CB 1 1 8 5460 1 1 35 CYS H H -5.117 -4.105 1.239 1.00 . A A . 35 CYS H 1 1 8 5461 1 1 35 CYS HA H -6.378 -5.871 2.955 1.00 . A A . 35 CYS HA 1 1 8 5462 1 1 35 CYS HB2 H -5.132 -6.101 0.540 1.00 . A A . 35 CYS HB2 1 1 8 5463 1 1 35 CYS HB3 H -3.996 -6.953 1.581 1.00 . A A . 35 CYS HB3 1 1 8 5464 1 1 35 CYS N N -5.286 -4.292 2.187 1.00 . A A . 35 CYS N 1 1 8 5465 1 1 35 CYS O O -3.189 -5.939 3.617 1.00 . A A . 35 CYS O 1 1 8 5466 1 1 35 CYS SG S -6.069 -8.117 1.397 1.00 . A A . 35 CYS SG 1 1 8 5467 1 1 36 ASP C C -4.052 -7.675 6.595 1.00 . A A . 36 ASP C 1 1 8 5468 1 1 36 ASP CA C -4.213 -6.209 6.208 1.00 . A A . 36 ASP CA 1 1 8 5469 1 1 36 ASP CB C -4.862 -5.443 7.362 1.00 . A A . 36 ASP CB 1 1 8 5470 1 1 36 ASP CG C -3.859 -4.626 8.156 1.00 . A A . 36 ASP CG 1 1 8 5471 1 1 36 ASP H H -5.968 -5.972 5.053 1.00 . A A . 36 ASP H 1 1 8 5472 1 1 36 ASP HA H -3.233 -5.793 6.031 1.00 . A A . 36 ASP HA 1 1 8 5473 1 1 36 ASP HB2 H -5.610 -4.772 6.967 1.00 . A A . 36 ASP HB2 1 1 8 5474 1 1 36 ASP HB3 H -5.334 -6.147 8.033 1.00 . A A . 36 ASP HB3 1 1 8 5475 1 1 36 ASP N N -4.991 -6.027 4.990 1.00 . A A . 36 ASP N 1 1 8 5476 1 1 36 ASP O O -3.194 -7.999 7.417 1.00 . A A . 36 ASP O 1 1 8 5477 1 1 36 ASP OD1 O -4.229 -4.122 9.237 1.00 . A A . 36 ASP OD1 1 1 8 5478 1 1 36 ASP OD2 O -2.706 -4.490 7.695 1.00 . A A . 36 ASP OD2 1 1 8 5479 1 1 37 ASP C C -3.315 -10.458 6.175 1.00 . A A . 37 ASP C 1 1 8 5480 1 1 37 ASP CA C -4.753 -9.990 6.343 1.00 . A A . 37 ASP CA 1 1 8 5481 1 1 37 ASP CB C -5.679 -10.813 5.445 1.00 . A A . 37 ASP CB 1 1 8 5482 1 1 37 ASP CG C -6.879 -11.354 6.196 1.00 . A A . 37 ASP CG 1 1 8 5483 1 1 37 ASP H H -5.532 -8.292 5.363 1.00 . A A . 37 ASP H 1 1 8 5484 1 1 37 ASP HA H -5.047 -10.122 7.373 1.00 . A A . 37 ASP HA 1 1 8 5485 1 1 37 ASP HB2 H -6.034 -10.190 4.637 1.00 . A A . 37 ASP HB2 1 1 8 5486 1 1 37 ASP HB3 H -5.127 -11.646 5.035 1.00 . A A . 37 ASP HB3 1 1 8 5487 1 1 37 ASP N N -4.858 -8.569 6.019 1.00 . A A . 37 ASP N 1 1 8 5488 1 1 37 ASP O O -2.779 -11.183 7.014 1.00 . A A . 37 ASP O 1 1 8 5489 1 1 37 ASP OD1 O -6.836 -12.531 6.612 1.00 . A A . 37 ASP OD1 1 1 8 5490 1 1 37 ASP OD2 O -7.861 -10.602 6.367 1.00 . A A . 37 ASP OD2 1 1 8 5491 1 1 38 MET C C -0.503 -9.066 4.641 1.00 . A A . 38 MET C 1 1 8 5492 1 1 38 MET CA C -1.313 -10.349 4.799 1.00 . A A . 38 MET CA 1 1 8 5493 1 1 38 MET CB C -1.218 -11.209 3.535 1.00 . A A . 38 MET CB 1 1 8 5494 1 1 38 MET CE C -3.277 -12.582 0.525 1.00 . A A . 38 MET CE 1 1 8 5495 1 1 38 MET CG C -2.298 -10.910 2.508 1.00 . A A . 38 MET CG 1 1 8 5496 1 1 38 MET H H -3.181 -9.425 4.475 1.00 . A A . 38 MET H 1 1 8 5497 1 1 38 MET HA H -0.922 -10.907 5.639 1.00 . A A . 38 MET HA 1 1 8 5498 1 1 38 MET HB2 H -0.257 -11.042 3.073 1.00 . A A . 38 MET HB2 1 1 8 5499 1 1 38 MET HB3 H -1.298 -12.249 3.816 1.00 . A A . 38 MET HB3 1 1 8 5500 1 1 38 MET HE1 H -2.960 -13.613 0.558 1.00 . A A . 38 MET HE1 1 1 8 5501 1 1 38 MET HE2 H -3.673 -12.358 -0.454 1.00 . A A . 38 MET HE2 1 1 8 5502 1 1 38 MET HE3 H -4.042 -12.416 1.270 1.00 . A A . 38 MET HE3 1 1 8 5503 1 1 38 MET HG2 H -3.217 -11.380 2.824 1.00 . A A . 38 MET HG2 1 1 8 5504 1 1 38 MET HG3 H -2.442 -9.840 2.457 1.00 . A A . 38 MET HG3 1 1 8 5505 1 1 38 MET N N -2.696 -10.013 5.091 1.00 . A A . 38 MET N 1 1 8 5506 1 1 38 MET O O -0.184 -8.404 5.629 1.00 . A A . 38 MET O 1 1 8 5507 1 1 38 MET SD S -1.878 -11.514 0.861 1.00 . A A . 38 MET SD 1 1 8 5508 1 1 39 GLN C C 0.155 -6.959 1.718 1.00 . A A . 39 GLN C 1 1 8 5509 1 1 39 GLN CA C 0.507 -7.457 3.116 1.00 . A A . 39 GLN CA 1 1 8 5510 1 1 39 GLN CB C 2.019 -7.683 3.222 1.00 . A A . 39 GLN CB 1 1 8 5511 1 1 39 GLN CD C 3.967 -7.462 4.818 1.00 . A A . 39 GLN CD 1 1 8 5512 1 1 39 GLN CG C 2.517 -7.871 4.646 1.00 . A A . 39 GLN CG 1 1 8 5513 1 1 39 GLN H H -0.544 -9.223 2.644 1.00 . A A . 39 GLN H 1 1 8 5514 1 1 39 GLN HA H 0.204 -6.716 3.842 1.00 . A A . 39 GLN HA 1 1 8 5515 1 1 39 GLN HB2 H 2.279 -8.564 2.655 1.00 . A A . 39 GLN HB2 1 1 8 5516 1 1 39 GLN HB3 H 2.528 -6.831 2.796 1.00 . A A . 39 GLN HB3 1 1 8 5517 1 1 39 GLN HE21 H 4.565 -9.300 4.359 1.00 . A A . 39 GLN HE21 1 1 8 5518 1 1 39 GLN HE22 H 5.822 -8.169 4.714 1.00 . A A . 39 GLN HE22 1 1 8 5519 1 1 39 GLN HG2 H 1.910 -7.272 5.308 1.00 . A A . 39 GLN HG2 1 1 8 5520 1 1 39 GLN HG3 H 2.418 -8.912 4.914 1.00 . A A . 39 GLN HG3 1 1 8 5521 1 1 39 GLN N N -0.216 -8.690 3.398 1.00 . A A . 39 GLN N 1 1 8 5522 1 1 39 GLN NE2 N 4.877 -8.405 4.609 1.00 . A A . 39 GLN NE2 1 1 8 5523 1 1 39 GLN O O 0.896 -7.216 0.768 1.00 . A A . 39 GLN O 1 1 8 5524 1 1 39 GLN OE1 O 4.266 -6.310 5.135 1.00 . A A . 39 GLN OE1 1 1 8 5525 1 1 40 HIS C C -2.442 -4.720 0.268 1.00 . A A . 40 HIS C 1 1 8 5526 1 1 40 HIS CA C -1.367 -5.799 0.241 1.00 . A A . 40 HIS CA 1 1 8 5527 1 1 40 HIS CB C -1.850 -6.978 -0.606 1.00 . A A . 40 HIS CB 1 1 8 5528 1 1 40 HIS CD2 C -0.043 -6.891 -2.466 1.00 . A A . 40 HIS CD2 1 1 8 5529 1 1 40 HIS CE1 C -1.370 -7.007 -4.207 1.00 . A A . 40 HIS CE1 1 1 8 5530 1 1 40 HIS CG C -1.314 -6.968 -2.004 1.00 . A A . 40 HIS CG 1 1 8 5531 1 1 40 HIS H H -1.562 -6.114 2.350 1.00 . A A . 40 HIS H 1 1 8 5532 1 1 40 HIS HA H -0.485 -5.389 -0.224 1.00 . A A . 40 HIS HA 1 1 8 5533 1 1 40 HIS HB2 H -1.539 -7.900 -0.138 1.00 . A A . 40 HIS HB2 1 1 8 5534 1 1 40 HIS HB3 H -2.929 -6.955 -0.662 1.00 . A A . 40 HIS HB3 1 1 8 5535 1 1 40 HIS HD1 H -3.099 -7.102 -3.116 1.00 . A A . 40 HIS HD1 1 1 8 5536 1 1 40 HIS HD2 H 0.854 -6.823 -1.866 1.00 . A A . 40 HIS HD2 1 1 8 5537 1 1 40 HIS HE1 H -1.730 -7.046 -5.224 1.00 . A A . 40 HIS HE1 1 1 8 5538 1 1 40 HIS HE2 H 0.664 -6.944 -4.443 1.00 . A A . 40 HIS HE2 1 1 8 5539 1 1 40 HIS N N -0.979 -6.271 1.570 1.00 . A A . 40 HIS N 1 1 8 5540 1 1 40 HIS ND1 N -2.121 -7.038 -3.120 1.00 . A A . 40 HIS ND1 1 1 8 5541 1 1 40 HIS NE2 N -0.107 -6.917 -3.837 1.00 . A A . 40 HIS NE2 1 1 8 5542 1 1 40 HIS O O -2.839 -4.231 1.325 1.00 . A A . 40 HIS O 1 1 8 5543 1 1 41 CYS C C -4.834 -3.748 -2.289 1.00 . A A . 41 CYS C 1 1 8 5544 1 1 41 CYS CA C -3.931 -3.355 -1.122 1.00 . A A . 41 CYS CA 1 1 8 5545 1 1 41 CYS CB C -3.289 -1.988 -1.381 1.00 . A A . 41 CYS CB 1 1 8 5546 1 1 41 CYS H H -2.526 -4.812 -1.721 1.00 . A A . 41 CYS H 1 1 8 5547 1 1 41 CYS HA H -4.522 -3.306 -0.220 1.00 . A A . 41 CYS HA 1 1 8 5548 1 1 41 CYS HB2 H -3.148 -1.484 -0.437 1.00 . A A . 41 CYS HB2 1 1 8 5549 1 1 41 CYS HB3 H -2.328 -2.135 -1.851 1.00 . A A . 41 CYS HB3 1 1 8 5550 1 1 41 CYS N N -2.899 -4.366 -0.932 1.00 . A A . 41 CYS N 1 1 8 5551 1 1 41 CYS O O -4.383 -4.378 -3.247 1.00 . A A . 41 CYS O 1 1 8 5552 1 1 41 CYS SG S -4.269 -0.886 -2.453 1.00 . A A . 41 CYS SG 1 1 8 5553 1 1 42 CYS C C -7.707 -2.458 -3.835 1.00 . A A . 42 CYS C 1 1 8 5554 1 1 42 CYS CA C -7.071 -3.717 -3.250 1.00 . A A . 42 CYS CA 1 1 8 5555 1 1 42 CYS CB C -8.157 -4.643 -2.698 1.00 . A A . 42 CYS CB 1 1 8 5556 1 1 42 CYS H H -6.415 -2.894 -1.416 1.00 . A A . 42 CYS H 1 1 8 5557 1 1 42 CYS HA H -6.539 -4.234 -4.034 1.00 . A A . 42 CYS HA 1 1 8 5558 1 1 42 CYS HB2 H -8.045 -4.719 -1.626 1.00 . A A . 42 CYS HB2 1 1 8 5559 1 1 42 CYS HB3 H -9.126 -4.222 -2.924 1.00 . A A . 42 CYS HB3 1 1 8 5560 1 1 42 CYS N N -6.111 -3.387 -2.203 1.00 . A A . 42 CYS N 1 1 8 5561 1 1 42 CYS O O -7.776 -1.425 -3.171 1.00 . A A . 42 CYS O 1 1 8 5562 1 1 42 CYS SG S -8.111 -6.330 -3.382 1.00 . A A . 42 CYS SG 1 1 8 5563 1 1 43 PRO C C -10.098 -0.934 -5.113 1.00 . A A . 43 PRO C 1 1 8 5564 1 1 43 PRO CA C -8.800 -1.388 -5.776 1.00 . A A . 43 PRO CA 1 1 8 5565 1 1 43 PRO CB C -9.081 -1.914 -7.188 1.00 . A A . 43 PRO CB 1 1 8 5566 1 1 43 PRO CD C -8.127 -3.723 -5.961 1.00 . A A . 43 PRO CD 1 1 8 5567 1 1 43 PRO CG C -9.111 -3.396 -7.045 1.00 . A A . 43 PRO CG 1 1 8 5568 1 1 43 PRO HA H -8.122 -0.549 -5.836 1.00 . A A . 43 PRO HA 1 1 8 5569 1 1 43 PRO HB2 H -10.029 -1.531 -7.535 1.00 . A A . 43 PRO HB2 1 1 8 5570 1 1 43 PRO HB3 H -8.293 -1.598 -7.855 1.00 . A A . 43 PRO HB3 1 1 8 5571 1 1 43 PRO HD2 H -8.438 -4.604 -5.419 1.00 . A A . 43 PRO HD2 1 1 8 5572 1 1 43 PRO HD3 H -7.139 -3.858 -6.373 1.00 . A A . 43 PRO HD3 1 1 8 5573 1 1 43 PRO HG2 H -10.103 -3.719 -6.763 1.00 . A A . 43 PRO HG2 1 1 8 5574 1 1 43 PRO HG3 H -8.813 -3.861 -7.973 1.00 . A A . 43 PRO HG3 1 1 8 5575 1 1 43 PRO N N -8.175 -2.528 -5.096 1.00 . A A . 43 PRO N 1 1 8 5576 1 1 43 PRO O O -10.967 -1.749 -4.790 1.00 . A A . 43 PRO O 1 1 8 5577 1 1 44 ALA C C -12.674 0.361 -4.840 1.00 . A A . 44 ALA C 1 1 8 5578 1 1 44 ALA CA C -11.391 0.971 -4.290 1.00 . A A . 44 ALA CA 1 1 8 5579 1 1 44 ALA CB C -11.396 2.475 -4.507 1.00 . A A . 44 ALA CB 1 1 8 5580 1 1 44 ALA H H -9.474 0.960 -5.191 1.00 . A A . 44 ALA H 1 1 8 5581 1 1 44 ALA HA H -11.339 0.784 -3.227 1.00 . A A . 44 ALA HA 1 1 8 5582 1 1 44 ALA HB1 H -12.098 2.935 -3.826 1.00 . A A . 44 ALA HB1 1 1 8 5583 1 1 44 ALA HB2 H -11.688 2.692 -5.525 1.00 . A A . 44 ALA HB2 1 1 8 5584 1 1 44 ALA HB3 H -10.407 2.869 -4.324 1.00 . A A . 44 ALA HB3 1 1 8 5585 1 1 44 ALA N N -10.212 0.378 -4.913 1.00 . A A . 44 ALA N 1 1 8 5586 1 1 44 ALA O O -12.854 0.260 -6.054 1.00 . A A . 44 ALA O 1 1 8 5587 1 1 45 GLY C C -14.804 -2.143 -4.312 1.00 . A A . 45 GLY C 1 1 8 5588 1 1 45 GLY CA C -14.821 -0.629 -4.361 1.00 . A A . 45 GLY CA 1 1 8 5589 1 1 45 GLY H H -13.373 0.070 -2.986 1.00 . A A . 45 GLY H 1 1 8 5590 1 1 45 GLY HA2 H -15.607 -0.269 -3.714 1.00 . A A . 45 GLY HA2 1 1 8 5591 1 1 45 GLY HA3 H -15.031 -0.315 -5.372 1.00 . A A . 45 GLY HA3 1 1 8 5592 1 1 45 GLY N N -13.566 -0.040 -3.941 1.00 . A A . 45 GLY N 1 1 8 5593 1 1 45 GLY O O -15.844 -2.782 -4.473 1.00 . A A . 45 GLY O 1 1 8 5594 1 1 46 TYR C C -13.104 -4.626 -2.619 1.00 . A A . 46 TYR C 1 1 8 5595 1 1 46 TYR CA C -13.503 -4.176 -4.022 1.00 . A A . 46 TYR CA 1 1 8 5596 1 1 46 TYR CB C -12.476 -4.673 -5.041 1.00 . A A . 46 TYR CB 1 1 8 5597 1 1 46 TYR CD1 C -13.197 -5.523 -7.305 1.00 . A A . 46 TYR CD1 1 1 8 5598 1 1 46 TYR CD2 C -12.957 -3.169 -7.015 1.00 . A A . 46 TYR CD2 1 1 8 5599 1 1 46 TYR CE1 C -13.570 -5.327 -8.621 1.00 . A A . 46 TYR CE1 1 1 8 5600 1 1 46 TYR CE2 C -13.331 -2.965 -8.330 1.00 . A A . 46 TYR CE2 1 1 8 5601 1 1 46 TYR CG C -12.885 -4.450 -6.480 1.00 . A A . 46 TYR CG 1 1 8 5602 1 1 46 TYR CZ C -13.636 -4.046 -9.128 1.00 . A A . 46 TYR CZ 1 1 8 5603 1 1 46 TYR H H -12.823 -2.175 -3.963 1.00 . A A . 46 TYR H 1 1 8 5604 1 1 46 TYR HA H -14.466 -4.602 -4.260 1.00 . A A . 46 TYR HA 1 1 8 5605 1 1 46 TYR HB2 H -11.540 -4.160 -4.879 1.00 . A A . 46 TYR HB2 1 1 8 5606 1 1 46 TYR HB3 H -12.326 -5.734 -4.900 1.00 . A A . 46 TYR HB3 1 1 8 5607 1 1 46 TYR HD1 H -13.144 -6.525 -6.906 1.00 . A A . 46 TYR HD1 1 1 8 5608 1 1 46 TYR HD2 H -12.716 -2.324 -6.387 1.00 . A A . 46 TYR HD2 1 1 8 5609 1 1 46 TYR HE1 H -13.810 -6.174 -9.246 1.00 . A A . 46 TYR HE1 1 1 8 5610 1 1 46 TYR HE2 H -13.382 -1.962 -8.727 1.00 . A A . 46 TYR HE2 1 1 8 5611 1 1 46 TYR HH H -13.292 -4.118 -11.019 1.00 . A A . 46 TYR HH 1 1 8 5612 1 1 46 TYR N N -13.628 -2.726 -4.089 1.00 . A A . 46 TYR N 1 1 8 5613 1 1 46 TYR O O -12.687 -3.815 -1.790 1.00 . A A . 46 TYR O 1 1 8 5614 1 1 46 TYR OH O -14.008 -3.847 -10.438 1.00 . A A . 46 TYR OH 1 1 8 5615 1 1 47 LYS C C -11.841 -7.586 -1.208 1.00 . A A . 47 LYS C 1 1 8 5616 1 1 47 LYS CA C -12.895 -6.491 -1.063 1.00 . A A . 47 LYS CA 1 1 8 5617 1 1 47 LYS CB C -14.148 -7.057 -0.392 1.00 . A A . 47 LYS CB 1 1 8 5618 1 1 47 LYS CD C -14.129 -8.743 1.473 1.00 . A A . 47 LYS CD 1 1 8 5619 1 1 47 LYS CE C -15.549 -9.249 1.272 1.00 . A A . 47 LYS CE 1 1 8 5620 1 1 47 LYS CG C -13.998 -7.272 1.106 1.00 . A A . 47 LYS CG 1 1 8 5621 1 1 47 LYS H H -13.575 -6.515 -3.064 1.00 . A A . 47 LYS H 1 1 8 5622 1 1 47 LYS HA H -12.494 -5.699 -0.449 1.00 . A A . 47 LYS HA 1 1 8 5623 1 1 47 LYS HB2 H -14.968 -6.372 -0.554 1.00 . A A . 47 LYS HB2 1 1 8 5624 1 1 47 LYS HB3 H -14.388 -8.006 -0.848 1.00 . A A . 47 LYS HB3 1 1 8 5625 1 1 47 LYS HD2 H -13.462 -9.319 0.850 1.00 . A A . 47 LYS HD2 1 1 8 5626 1 1 47 LYS HD3 H -13.855 -8.869 2.510 1.00 . A A . 47 LYS HD3 1 1 8 5627 1 1 47 LYS HE2 H -15.780 -9.222 0.217 1.00 . A A . 47 LYS HE2 1 1 8 5628 1 1 47 LYS HE3 H -15.608 -10.268 1.626 1.00 . A A . 47 LYS HE3 1 1 8 5629 1 1 47 LYS HG2 H -13.026 -6.919 1.415 1.00 . A A . 47 LYS HG2 1 1 8 5630 1 1 47 LYS HG3 H -14.766 -6.712 1.619 1.00 . A A . 47 LYS HG3 1 1 8 5631 1 1 47 LYS HZ1 H -16.431 -7.419 1.757 1.00 . A A . 47 LYS HZ1 1 1 8 5632 1 1 47 LYS HZ2 H -16.418 -8.531 3.031 1.00 . A A . 47 LYS HZ2 1 1 8 5633 1 1 47 LYS HZ3 H -17.511 -8.721 1.755 1.00 . A A . 47 LYS HZ3 1 1 8 5634 1 1 47 LYS N N -13.237 -5.923 -2.362 1.00 . A A . 47 LYS N 1 1 8 5635 1 1 47 LYS NZ N -16.547 -8.421 2.005 1.00 . A A . 47 LYS NZ 1 1 8 5636 1 1 47 LYS O O -11.671 -8.156 -2.286 1.00 . A A . 47 LYS O 1 1 8 5637 1 1 48 CYS C C -10.688 -10.280 0.144 1.00 . A A . 48 CYS C 1 1 8 5638 1 1 48 CYS CA C -10.097 -8.899 -0.125 1.00 . A A . 48 CYS CA 1 1 8 5639 1 1 48 CYS CB C -9.031 -8.577 0.923 1.00 . A A . 48 CYS CB 1 1 8 5640 1 1 48 CYS H H -11.317 -7.383 0.710 1.00 . A A . 48 CYS H 1 1 8 5641 1 1 48 CYS HA H -9.639 -8.902 -1.102 1.00 . A A . 48 CYS HA 1 1 8 5642 1 1 48 CYS HB2 H -9.496 -8.064 1.752 1.00 . A A . 48 CYS HB2 1 1 8 5643 1 1 48 CYS HB3 H -8.595 -9.500 1.277 1.00 . A A . 48 CYS HB3 1 1 8 5644 1 1 48 CYS N N -11.135 -7.873 -0.119 1.00 . A A . 48 CYS N 1 1 8 5645 1 1 48 CYS O O -11.652 -10.416 0.898 1.00 . A A . 48 CYS O 1 1 8 5646 1 1 48 CYS SG S -7.678 -7.522 0.310 1.00 . A A . 48 CYS SG 1 1 8 5647 1 1 49 GLY C C -9.455 -13.674 -0.227 1.00 . A A . 49 GLY C 1 1 8 5648 1 1 49 GLY CA C -10.584 -12.658 -0.283 1.00 . A A . 49 GLY CA 1 1 8 5649 1 1 49 GLY H H -9.335 -11.134 -1.060 1.00 . A A . 49 GLY H 1 1 8 5650 1 1 49 GLY HA2 H -11.141 -12.705 0.641 1.00 . A A . 49 GLY HA2 1 1 8 5651 1 1 49 GLY HA3 H -11.242 -12.913 -1.101 1.00 . A A . 49 GLY HA3 1 1 8 5652 1 1 49 GLY N N -10.102 -11.302 -0.473 1.00 . A A . 49 GLY N 1 1 8 5653 1 1 49 GLY O O -8.308 -13.345 -0.532 1.00 . A A . 49 GLY O 1 1 8 5654 1 1 50 PRO C C -8.077 -16.279 -1.090 1.00 . A A . 50 PRO C 1 1 8 5655 1 1 50 PRO CA C -8.741 -15.991 0.253 1.00 . A A . 50 PRO CA 1 1 8 5656 1 1 50 PRO CB C -9.535 -17.215 0.726 1.00 . A A . 50 PRO CB 1 1 8 5657 1 1 50 PRO CD C -11.088 -15.413 0.545 1.00 . A A . 50 PRO CD 1 1 8 5658 1 1 50 PRO CG C -10.787 -16.663 1.318 1.00 . A A . 50 PRO CG 1 1 8 5659 1 1 50 PRO HA H -7.981 -15.749 0.982 1.00 . A A . 50 PRO HA 1 1 8 5660 1 1 50 PRO HB2 H -9.746 -17.856 -0.116 1.00 . A A . 50 PRO HB2 1 1 8 5661 1 1 50 PRO HB3 H -8.959 -17.757 1.461 1.00 . A A . 50 PRO HB3 1 1 8 5662 1 1 50 PRO HD2 H -11.682 -15.641 -0.328 1.00 . A A . 50 PRO HD2 1 1 8 5663 1 1 50 PRO HD3 H -11.594 -14.692 1.172 1.00 . A A . 50 PRO HD3 1 1 8 5664 1 1 50 PRO HG2 H -11.590 -17.376 1.207 1.00 . A A . 50 PRO HG2 1 1 8 5665 1 1 50 PRO HG3 H -10.630 -16.431 2.361 1.00 . A A . 50 PRO HG3 1 1 8 5666 1 1 50 PRO N N -9.751 -14.930 0.162 1.00 . A A . 50 PRO N 1 1 8 5667 1 1 50 PRO O O -8.693 -16.119 -2.144 1.00 . A A . 50 PRO O 1 1 8 5668 1 1 51 GLY C C -5.205 -15.874 -2.712 1.00 . A A . 51 GLY C 1 1 8 5669 1 1 51 GLY CA C -6.091 -17.017 -2.258 1.00 . A A . 51 GLY CA 1 1 8 5670 1 1 51 GLY H H -6.384 -16.820 -0.172 1.00 . A A . 51 GLY H 1 1 8 5671 1 1 51 GLY HA2 H -5.475 -17.888 -2.085 1.00 . A A . 51 GLY HA2 1 1 8 5672 1 1 51 GLY HA3 H -6.800 -17.242 -3.042 1.00 . A A . 51 GLY HA3 1 1 8 5673 1 1 51 GLY N N -6.820 -16.709 -1.042 1.00 . A A . 51 GLY N 1 1 8 5674 1 1 51 GLY O O -4.116 -16.098 -3.242 1.00 . A A . 51 GLY O 1 1 8 5675 1 1 52 GLY C C -5.524 -12.759 -4.084 1.00 . A A . 52 GLY C 1 1 8 5676 1 1 52 GLY CA C -4.905 -13.482 -2.905 1.00 . A A . 52 GLY CA 1 1 8 5677 1 1 52 GLY H H -6.549 -14.533 -2.081 1.00 . A A . 52 GLY H 1 1 8 5678 1 1 52 GLY HA2 H -4.846 -12.800 -2.069 1.00 . A A . 52 GLY HA2 1 1 8 5679 1 1 52 GLY HA3 H -3.907 -13.796 -3.172 1.00 . A A . 52 GLY HA3 1 1 8 5680 1 1 52 GLY N N -5.674 -14.648 -2.506 1.00 . A A . 52 GLY N 1 1 8 5681 1 1 52 GLY O O -4.814 -12.206 -4.926 1.00 . A A . 52 GLY O 1 1 8 5682 1 1 53 THR C C -8.653 -11.180 -4.675 1.00 . A A . 53 THR C 1 1 8 5683 1 1 53 THR CA C -7.575 -12.103 -5.227 1.00 . A A . 53 THR CA 1 1 8 5684 1 1 53 THR CB C -8.230 -13.127 -6.175 1.00 . A A . 53 THR CB 1 1 8 5685 1 1 53 THR CG2 C -7.267 -14.256 -6.506 1.00 . A A . 53 THR CG2 1 1 8 5686 1 1 53 THR H H -7.361 -13.221 -3.443 1.00 . A A . 53 THR H 1 1 8 5687 1 1 53 THR HA H -6.866 -11.518 -5.795 1.00 . A A . 53 THR HA 1 1 8 5688 1 1 53 THR HB H -8.501 -12.623 -7.092 1.00 . A A . 53 THR HB 1 1 8 5689 1 1 53 THR HG1 H -9.416 -13.458 -4.633 1.00 . A A . 53 THR HG1 1 1 8 5690 1 1 53 THR HG21 H -7.543 -14.699 -7.451 1.00 . A A . 53 THR HG21 1 1 8 5691 1 1 53 THR HG22 H -7.312 -15.006 -5.729 1.00 . A A . 53 THR HG22 1 1 8 5692 1 1 53 THR HG23 H -6.263 -13.865 -6.570 1.00 . A A . 53 THR HG23 1 1 8 5693 1 1 53 THR N N -6.853 -12.763 -4.145 1.00 . A A . 53 THR N 1 1 8 5694 1 1 53 THR O O -9.132 -11.369 -3.557 1.00 . A A . 53 THR O 1 1 8 5695 1 1 53 THR OG1 O -9.413 -13.664 -5.571 1.00 . A A . 53 THR OG1 1 1 8 5696 1 1 54 CYS C C -11.423 -9.622 -5.616 1.00 . A A . 54 CYS C 1 1 8 5697 1 1 54 CYS CA C -10.059 -9.232 -5.053 1.00 . A A . 54 CYS CA 1 1 8 5698 1 1 54 CYS CB C -9.688 -7.821 -5.506 1.00 . A A . 54 CYS CB 1 1 8 5699 1 1 54 CYS H H -8.617 -10.083 -6.347 1.00 . A A . 54 CYS H 1 1 8 5700 1 1 54 CYS HA H -10.111 -9.252 -3.975 1.00 . A A . 54 CYS HA 1 1 8 5701 1 1 54 CYS HB2 H -8.646 -7.802 -5.788 1.00 . A A . 54 CYS HB2 1 1 8 5702 1 1 54 CYS HB3 H -10.293 -7.554 -6.360 1.00 . A A . 54 CYS HB3 1 1 8 5703 1 1 54 CYS N N -9.034 -10.183 -5.466 1.00 . A A . 54 CYS N 1 1 8 5704 1 1 54 CYS O O -11.540 -9.999 -6.782 1.00 . A A . 54 CYS O 1 1 8 5705 1 1 54 CYS SG S -9.941 -6.548 -4.228 1.00 . A A . 54 CYS SG 1 1 8 5706 1 1 55 ILE C C -14.764 -8.722 -4.951 1.00 . A A . 55 ILE C 1 1 8 5707 1 1 55 ILE CA C -13.804 -9.884 -5.178 1.00 . A A . 55 ILE CA 1 1 8 5708 1 1 55 ILE CB C -14.321 -11.112 -4.405 1.00 . A A . 55 ILE CB 1 1 8 5709 1 1 55 ILE CD1 C -15.041 -11.503 -1.994 1.00 . A A . 55 ILE CD1 1 1 8 5710 1 1 55 ILE CG1 C -13.958 -10.998 -2.922 1.00 . A A . 55 ILE CG1 1 1 8 5711 1 1 55 ILE CG2 C -13.749 -12.392 -4.998 1.00 . A A . 55 ILE CG2 1 1 8 5712 1 1 55 ILE H H -12.284 -9.234 -3.856 1.00 . A A . 55 ILE H 1 1 8 5713 1 1 55 ILE HA H -13.789 -10.127 -6.231 1.00 . A A . 55 ILE HA 1 1 8 5714 1 1 55 ILE HB H -15.394 -11.147 -4.504 1.00 . A A . 55 ILE HB 1 1 8 5715 1 1 55 ILE HD11 H -14.588 -11.960 -1.127 1.00 . A A . 55 ILE HD11 1 1 8 5716 1 1 55 ILE HD12 H -15.647 -12.233 -2.512 1.00 . A A . 55 ILE HD12 1 1 8 5717 1 1 55 ILE HD13 H -15.662 -10.678 -1.682 1.00 . A A . 55 ILE HD13 1 1 8 5718 1 1 55 ILE HG12 H -13.064 -11.571 -2.730 1.00 . A A . 55 ILE HG12 1 1 8 5719 1 1 55 ILE HG13 H -13.774 -9.960 -2.684 1.00 . A A . 55 ILE HG13 1 1 8 5720 1 1 55 ILE HG21 H -13.587 -12.256 -6.057 1.00 . A A . 55 ILE HG21 1 1 8 5721 1 1 55 ILE HG22 H -14.446 -13.202 -4.841 1.00 . A A . 55 ILE HG22 1 1 8 5722 1 1 55 ILE HG23 H -12.811 -12.625 -4.516 1.00 . A A . 55 ILE HG23 1 1 8 5723 1 1 55 ILE N N -12.447 -9.536 -4.774 1.00 . A A . 55 ILE N 1 1 8 5724 1 1 55 ILE O O -14.456 -7.785 -4.216 1.00 . A A . 55 ILE O 1 1 8 5725 1 1 56 SER C C -18.212 -8.296 -4.816 1.00 . A A . 56 SER C 1 1 8 5726 1 1 56 SER CA C -16.938 -7.743 -5.446 1.00 . A A . 56 SER CA 1 1 8 5727 1 1 56 SER CB C -17.257 -7.127 -6.810 1.00 . A A . 56 SER CB 1 1 8 5728 1 1 56 SER H H -16.122 -9.563 -6.156 1.00 . A A . 56 SER H 1 1 8 5729 1 1 56 SER HA H -16.534 -6.978 -4.801 1.00 . A A . 56 SER HA 1 1 8 5730 1 1 56 SER HB2 H -17.690 -6.148 -6.668 1.00 . A A . 56 SER HB2 1 1 8 5731 1 1 56 SER HB3 H -16.346 -7.037 -7.385 1.00 . A A . 56 SER HB3 1 1 8 5732 1 1 56 SER HG H -17.694 -8.509 -8.129 1.00 . A A . 56 SER HG 1 1 8 5733 1 1 56 SER N N -15.932 -8.790 -5.584 1.00 . A A . 56 SER N 1 1 8 5734 1 1 56 SER O O -18.884 -7.542 -4.082 1.00 . A A . 56 SER O 1 1 8 5735 1 1 56 SER OXT O -18.527 -9.479 -5.063 1.00 . A A . 56 SER OXT 1 1 8 5736 1 1 56 SER OG O -18.174 -7.931 -7.533 1.00 . A A . 56 SER OG 1 1 9 5737 1 1 1 ASP C C 1.894 14.439 -2.986 1.00 . A A . 1 ASP C 1 1 9 5738 1 1 1 ASP CA C 2.896 14.747 -4.095 1.00 . A A . 1 ASP CA 1 1 9 5739 1 1 1 ASP CB C 4.293 14.274 -3.693 1.00 . A A . 1 ASP CB 1 1 9 5740 1 1 1 ASP CG C 5.267 14.293 -4.855 1.00 . A A . 1 ASP CG 1 1 9 5741 1 1 1 ASP H1 H 2.021 16.637 -4.211 1.00 . A A . 1 ASP H1 1 1 9 5742 1 1 1 ASP H2 H 3.229 16.368 -5.365 1.00 . A A . 1 ASP H2 1 1 9 5743 1 1 1 ASP H3 H 3.650 16.660 -3.753 1.00 . A A . 1 ASP H3 1 1 9 5744 1 1 1 ASP HA H 2.591 14.234 -4.996 1.00 . A A . 1 ASP HA 1 1 9 5745 1 1 1 ASP HB2 H 4.676 14.919 -2.916 1.00 . A A . 1 ASP HB2 1 1 9 5746 1 1 1 ASP HB3 H 4.230 13.263 -3.316 1.00 . A A . 1 ASP HB3 1 1 9 5747 1 1 1 ASP N N 2.953 16.205 -4.376 1.00 . A A . 1 ASP N 1 1 9 5748 1 1 1 ASP O O 1.348 15.349 -2.361 1.00 . A A . 1 ASP O 1 1 9 5749 1 1 1 ASP OD1 O 5.128 13.444 -5.760 1.00 . A A . 1 ASP OD1 1 1 9 5750 1 1 1 ASP OD2 O 6.169 15.157 -4.860 1.00 . A A . 1 ASP OD2 1 1 9 5751 1 1 2 VAL C C 1.460 12.376 -0.420 1.00 . A A . 2 VAL C 1 1 9 5752 1 1 2 VAL CA C 0.727 12.730 -1.708 1.00 . A A . 2 VAL CA 1 1 9 5753 1 1 2 VAL CB C -0.111 11.520 -2.161 1.00 . A A . 2 VAL CB 1 1 9 5754 1 1 2 VAL CG1 C -1.174 11.188 -1.126 1.00 . A A . 2 VAL CG1 1 1 9 5755 1 1 2 VAL CG2 C -0.743 11.789 -3.519 1.00 . A A . 2 VAL CG2 1 1 9 5756 1 1 2 VAL H H 2.129 12.475 -3.277 1.00 . A A . 2 VAL H 1 1 9 5757 1 1 2 VAL HA H 0.053 13.552 -1.512 1.00 . A A . 2 VAL HA 1 1 9 5758 1 1 2 VAL HB H 0.546 10.667 -2.257 1.00 . A A . 2 VAL HB 1 1 9 5759 1 1 2 VAL HG11 H -1.102 11.881 -0.302 1.00 . A A . 2 VAL HG11 1 1 9 5760 1 1 2 VAL HG12 H -1.024 10.181 -0.766 1.00 . A A . 2 VAL HG12 1 1 9 5761 1 1 2 VAL HG13 H -2.152 11.266 -1.578 1.00 . A A . 2 VAL HG13 1 1 9 5762 1 1 2 VAL HG21 H -0.640 10.913 -4.143 1.00 . A A . 2 VAL HG21 1 1 9 5763 1 1 2 VAL HG22 H -0.246 12.626 -3.987 1.00 . A A . 2 VAL HG22 1 1 9 5764 1 1 2 VAL HG23 H -1.790 12.017 -3.389 1.00 . A A . 2 VAL HG23 1 1 9 5765 1 1 2 VAL N N 1.661 13.153 -2.745 1.00 . A A . 2 VAL N 1 1 9 5766 1 1 2 VAL O O 2.001 11.278 -0.281 1.00 . A A . 2 VAL O 1 1 9 5767 1 1 3 GLN C C 1.451 12.035 2.618 1.00 . A A . 3 GLN C 1 1 9 5768 1 1 3 GLN CA C 2.145 13.118 1.798 1.00 . A A . 3 GLN CA 1 1 9 5769 1 1 3 GLN CB C 2.178 14.428 2.587 1.00 . A A . 3 GLN CB 1 1 9 5770 1 1 3 GLN CD C 2.954 15.167 4.874 1.00 . A A . 3 GLN CD 1 1 9 5771 1 1 3 GLN CG C 3.344 14.524 3.558 1.00 . A A . 3 GLN CG 1 1 9 5772 1 1 3 GLN H H 1.028 14.173 0.342 1.00 . A A . 3 GLN H 1 1 9 5773 1 1 3 GLN HA H 3.159 12.805 1.596 1.00 . A A . 3 GLN HA 1 1 9 5774 1 1 3 GLN HB2 H 2.247 15.252 1.892 1.00 . A A . 3 GLN HB2 1 1 9 5775 1 1 3 GLN HB3 H 1.260 14.519 3.150 1.00 . A A . 3 GLN HB3 1 1 9 5776 1 1 3 GLN HE21 H 2.527 13.386 5.647 1.00 . A A . 3 GLN HE21 1 1 9 5777 1 1 3 GLN HE22 H 2.292 14.736 6.700 1.00 . A A . 3 GLN HE22 1 1 9 5778 1 1 3 GLN HG2 H 3.713 13.529 3.757 1.00 . A A . 3 GLN HG2 1 1 9 5779 1 1 3 GLN HG3 H 4.126 15.114 3.104 1.00 . A A . 3 GLN HG3 1 1 9 5780 1 1 3 GLN N N 1.477 13.319 0.517 1.00 . A A . 3 GLN N 1 1 9 5781 1 1 3 GLN NE2 N 2.550 14.347 5.838 1.00 . A A . 3 GLN NE2 1 1 9 5782 1 1 3 GLN O O 0.341 12.232 3.112 1.00 . A A . 3 GLN O 1 1 9 5783 1 1 3 GLN OE1 O 3.014 16.387 5.025 1.00 . A A . 3 GLN OE1 1 1 9 5784 1 1 4 CYS C C 1.775 10.017 5.028 1.00 . A A . 4 CYS C 1 1 9 5785 1 1 4 CYS CA C 1.572 9.783 3.537 1.00 . A A . 4 CYS CA 1 1 9 5786 1 1 4 CYS CB C 2.234 8.465 3.120 1.00 . A A . 4 CYS CB 1 1 9 5787 1 1 4 CYS H H 3.004 10.801 2.356 1.00 . A A . 4 CYS H 1 1 9 5788 1 1 4 CYS HA H 0.514 9.727 3.333 1.00 . A A . 4 CYS HA 1 1 9 5789 1 1 4 CYS HB2 H 3.307 8.547 3.232 1.00 . A A . 4 CYS HB2 1 1 9 5790 1 1 4 CYS HB3 H 1.871 7.672 3.756 1.00 . A A . 4 CYS HB3 1 1 9 5791 1 1 4 CYS N N 2.119 10.894 2.768 1.00 . A A . 4 CYS N 1 1 9 5792 1 1 4 CYS O O 1.011 9.525 5.858 1.00 . A A . 4 CYS O 1 1 9 5793 1 1 4 CYS SG S 1.892 7.994 1.397 1.00 . A A . 4 CYS SG 1 1 9 5794 1 1 5 GLY C C 4.540 10.624 7.082 1.00 . A A . 5 GLY C 1 1 9 5795 1 1 5 GLY CA C 3.132 11.053 6.737 1.00 . A A . 5 GLY CA 1 1 9 5796 1 1 5 GLY H H 3.396 11.117 4.641 1.00 . A A . 5 GLY H 1 1 9 5797 1 1 5 GLY HA2 H 3.031 12.114 6.910 1.00 . A A . 5 GLY HA2 1 1 9 5798 1 1 5 GLY HA3 H 2.439 10.524 7.373 1.00 . A A . 5 GLY HA3 1 1 9 5799 1 1 5 GLY N N 2.821 10.765 5.352 1.00 . A A . 5 GLY N 1 1 9 5800 1 1 5 GLY O O 5.174 9.926 6.294 1.00 . A A . 5 GLY O 1 1 9 5801 1 1 6 GLY C C 6.692 9.227 8.409 1.00 . A A . 6 GLY C 1 1 9 5802 1 1 6 GLY CA C 6.377 10.688 8.663 1.00 . A A . 6 GLY CA 1 1 9 5803 1 1 6 GLY H H 4.475 11.611 8.824 1.00 . A A . 6 GLY H 1 1 9 5804 1 1 6 GLY HA2 H 7.084 11.298 8.120 1.00 . A A . 6 GLY HA2 1 1 9 5805 1 1 6 GLY HA3 H 6.481 10.888 9.719 1.00 . A A . 6 GLY HA3 1 1 9 5806 1 1 6 GLY N N 5.030 11.046 8.247 1.00 . A A . 6 GLY N 1 1 9 5807 1 1 6 GLY O O 6.468 8.376 9.270 1.00 . A A . 6 GLY O 1 1 9 5808 1 1 7 GLY C C 7.763 7.386 5.372 1.00 . A A . 7 GLY C 1 1 9 5809 1 1 7 GLY CA C 7.533 7.569 6.861 1.00 . A A . 7 GLY CA 1 1 9 5810 1 1 7 GLY H H 7.354 9.656 6.567 1.00 . A A . 7 GLY H 1 1 9 5811 1 1 7 GLY HA2 H 8.427 7.277 7.390 1.00 . A A . 7 GLY HA2 1 1 9 5812 1 1 7 GLY HA3 H 6.721 6.927 7.169 1.00 . A A . 7 GLY HA3 1 1 9 5813 1 1 7 GLY N N 7.205 8.935 7.215 1.00 . A A . 7 GLY N 1 1 9 5814 1 1 7 GLY O O 8.898 7.179 4.939 1.00 . A A . 7 GLY O 1 1 9 5815 1 1 8 PHE C C 6.390 8.496 2.350 1.00 . A A . 8 PHE C 1 1 9 5816 1 1 8 PHE CA C 6.803 7.254 3.137 1.00 . A A . 8 PHE CA 1 1 9 5817 1 1 8 PHE CB C 5.937 6.080 2.693 1.00 . A A . 8 PHE CB 1 1 9 5818 1 1 8 PHE CD1 C 7.037 4.069 3.723 1.00 . A A . 8 PHE CD1 1 1 9 5819 1 1 8 PHE CD2 C 7.038 4.274 1.346 1.00 . A A . 8 PHE CD2 1 1 9 5820 1 1 8 PHE CE1 C 7.726 2.875 3.622 1.00 . A A . 8 PHE CE1 1 1 9 5821 1 1 8 PHE CE2 C 7.727 3.081 1.240 1.00 . A A . 8 PHE CE2 1 1 9 5822 1 1 8 PHE CG C 6.686 4.782 2.586 1.00 . A A . 8 PHE CG 1 1 9 5823 1 1 8 PHE CZ C 8.071 2.380 2.380 1.00 . A A . 8 PHE CZ 1 1 9 5824 1 1 8 PHE H H 5.802 7.590 4.978 1.00 . A A . 8 PHE H 1 1 9 5825 1 1 8 PHE HA H 7.834 7.028 2.913 1.00 . A A . 8 PHE HA 1 1 9 5826 1 1 8 PHE HB2 H 5.133 5.949 3.404 1.00 . A A . 8 PHE HB2 1 1 9 5827 1 1 8 PHE HB3 H 5.515 6.303 1.723 1.00 . A A . 8 PHE HB3 1 1 9 5828 1 1 8 PHE HD1 H 6.766 4.455 4.694 1.00 . A A . 8 PHE HD1 1 1 9 5829 1 1 8 PHE HD2 H 6.771 4.821 0.454 1.00 . A A . 8 PHE HD2 1 1 9 5830 1 1 8 PHE HE1 H 7.993 2.329 4.515 1.00 . A A . 8 PHE HE1 1 1 9 5831 1 1 8 PHE HE2 H 7.996 2.696 0.267 1.00 . A A . 8 PHE HE2 1 1 9 5832 1 1 8 PHE HZ H 8.609 1.447 2.298 1.00 . A A . 8 PHE HZ 1 1 9 5833 1 1 8 PHE N N 6.689 7.441 4.581 1.00 . A A . 8 PHE N 1 1 9 5834 1 1 8 PHE O O 6.085 9.545 2.916 1.00 . A A . 8 PHE O 1 1 9 5835 1 1 9 SER C C 5.811 8.816 -1.293 1.00 . A A . 9 SER C 1 1 9 5836 1 1 9 SER CA C 5.997 9.401 0.105 1.00 . A A . 9 SER CA 1 1 9 5837 1 1 9 SER CB C 7.059 10.502 0.076 1.00 . A A . 9 SER CB 1 1 9 5838 1 1 9 SER H H 6.625 7.465 0.659 1.00 . A A . 9 SER H 1 1 9 5839 1 1 9 SER HA H 5.059 9.818 0.440 1.00 . A A . 9 SER HA 1 1 9 5840 1 1 9 SER HB2 H 7.194 10.841 -0.941 1.00 . A A . 9 SER HB2 1 1 9 5841 1 1 9 SER HB3 H 6.733 11.327 0.690 1.00 . A A . 9 SER HB3 1 1 9 5842 1 1 9 SER HG H 8.612 10.608 1.266 1.00 . A A . 9 SER HG 1 1 9 5843 1 1 9 SER N N 6.377 8.338 1.028 1.00 . A A . 9 SER N 1 1 9 5844 1 1 9 SER O O 6.514 7.881 -1.675 1.00 . A A . 9 SER O 1 1 9 5845 1 1 9 SER OG O 8.300 10.028 0.567 1.00 . A A . 9 SER OG 1 1 9 5846 1 1 10 CYS C C 4.196 9.967 -4.353 1.00 . A A . 10 CYS C 1 1 9 5847 1 1 10 CYS CA C 4.590 8.847 -3.392 1.00 . A A . 10 CYS CA 1 1 9 5848 1 1 10 CYS CB C 3.487 7.794 -3.348 1.00 . A A . 10 CYS CB 1 1 9 5849 1 1 10 CYS H H 4.316 10.088 -1.692 1.00 . A A . 10 CYS H 1 1 9 5850 1 1 10 CYS HA H 5.496 8.385 -3.754 1.00 . A A . 10 CYS HA 1 1 9 5851 1 1 10 CYS HB2 H 2.942 7.895 -2.422 1.00 . A A . 10 CYS HB2 1 1 9 5852 1 1 10 CYS HB3 H 2.812 7.962 -4.174 1.00 . A A . 10 CYS HB3 1 1 9 5853 1 1 10 CYS N N 4.857 9.351 -2.047 1.00 . A A . 10 CYS N 1 1 9 5854 1 1 10 CYS O O 4.253 11.149 -4.011 1.00 . A A . 10 CYS O 1 1 9 5855 1 1 10 CYS SG S 4.070 6.071 -3.454 1.00 . A A . 10 CYS SG 1 1 9 5856 1 1 11 HIS C C 1.957 10.890 -6.580 1.00 . A A . 11 HIS C 1 1 9 5857 1 1 11 HIS CA C 3.445 10.529 -6.614 1.00 . A A . 11 HIS CA 1 1 9 5858 1 1 11 HIS CB C 3.804 9.964 -7.991 1.00 . A A . 11 HIS CB 1 1 9 5859 1 1 11 HIS CD2 C 6.357 9.498 -8.003 1.00 . A A . 11 HIS CD2 1 1 9 5860 1 1 11 HIS CE1 C 6.283 7.306 -7.992 1.00 . A A . 11 HIS CE1 1 1 9 5861 1 1 11 HIS CG C 5.052 9.136 -7.994 1.00 . A A . 11 HIS CG 1 1 9 5862 1 1 11 HIS H H 3.827 8.618 -5.777 1.00 . A A . 11 HIS H 1 1 9 5863 1 1 11 HIS HA H 4.019 11.429 -6.454 1.00 . A A . 11 HIS HA 1 1 9 5864 1 1 11 HIS HB2 H 2.993 9.342 -8.338 1.00 . A A . 11 HIS HB2 1 1 9 5865 1 1 11 HIS HB3 H 3.946 10.783 -8.681 1.00 . A A . 11 HIS HB3 1 1 9 5866 1 1 11 HIS HD1 H 4.241 7.191 -7.980 1.00 . A A . 11 HIS HD1 1 1 9 5867 1 1 11 HIS HD2 H 6.742 10.508 -8.008 1.00 . A A . 11 HIS HD2 1 1 9 5868 1 1 11 HIS HE1 H 6.579 6.267 -7.990 1.00 . A A . 11 HIS HE1 1 1 9 5869 1 1 11 HIS HE2 H 8.075 8.294 -7.907 1.00 . A A . 11 HIS HE2 1 1 9 5870 1 1 11 HIS N N 3.823 9.576 -5.572 1.00 . A A . 11 HIS N 1 1 9 5871 1 1 11 HIS ND1 N 5.041 7.756 -7.988 1.00 . A A . 11 HIS ND1 1 1 9 5872 1 1 11 HIS NE2 N 7.101 8.343 -8.002 1.00 . A A . 11 HIS NE2 1 1 9 5873 1 1 11 HIS O O 1.110 10.120 -6.109 1.00 . A A . 11 HIS O 1 1 9 5874 1 1 12 ASP C C -0.627 11.505 -7.783 1.00 . A A . 12 ASP C 1 1 9 5875 1 1 12 ASP CA C 0.283 12.562 -7.171 1.00 . A A . 12 ASP CA 1 1 9 5876 1 1 12 ASP CB C 0.214 13.854 -7.991 1.00 . A A . 12 ASP CB 1 1 9 5877 1 1 12 ASP CG C 1.094 13.806 -9.225 1.00 . A A . 12 ASP CG 1 1 9 5878 1 1 12 ASP H H 2.379 12.623 -7.477 1.00 . A A . 12 ASP H 1 1 9 5879 1 1 12 ASP HA H -0.044 12.766 -6.163 1.00 . A A . 12 ASP HA 1 1 9 5880 1 1 12 ASP HB2 H -0.805 14.020 -8.305 1.00 . A A . 12 ASP HB2 1 1 9 5881 1 1 12 ASP HB3 H 0.536 14.681 -7.374 1.00 . A A . 12 ASP HB3 1 1 9 5882 1 1 12 ASP N N 1.655 12.073 -7.109 1.00 . A A . 12 ASP N 1 1 9 5883 1 1 12 ASP O O -0.284 10.883 -8.788 1.00 . A A . 12 ASP O 1 1 9 5884 1 1 12 ASP OD1 O 2.292 14.143 -9.114 1.00 . A A . 12 ASP OD1 1 1 9 5885 1 1 12 ASP OD2 O 0.584 13.433 -10.303 1.00 . A A . 12 ASP OD2 1 1 9 5886 1 1 13 GLY C C -2.606 8.994 -6.907 1.00 . A A . 13 GLY C 1 1 9 5887 1 1 13 GLY CA C -2.716 10.306 -7.658 1.00 . A A . 13 GLY CA 1 1 9 5888 1 1 13 GLY H H -2.001 11.820 -6.364 1.00 . A A . 13 GLY H 1 1 9 5889 1 1 13 GLY HA2 H -3.721 10.688 -7.554 1.00 . A A . 13 GLY HA2 1 1 9 5890 1 1 13 GLY HA3 H -2.515 10.128 -8.705 1.00 . A A . 13 GLY HA3 1 1 9 5891 1 1 13 GLY N N -1.782 11.299 -7.165 1.00 . A A . 13 GLY N 1 1 9 5892 1 1 13 GLY O O -3.377 8.066 -7.153 1.00 . A A . 13 GLY O 1 1 9 5893 1 1 14 GLU C C -2.296 7.713 -3.935 1.00 . A A . 14 GLU C 1 1 9 5894 1 1 14 GLU CA C -1.442 7.702 -5.202 1.00 . A A . 14 GLU CA 1 1 9 5895 1 1 14 GLU CB C 0.025 7.571 -4.812 1.00 . A A . 14 GLU CB 1 1 9 5896 1 1 14 GLU CD C 0.541 7.955 -2.365 1.00 . A A . 14 GLU CD 1 1 9 5897 1 1 14 GLU CG C 0.444 8.570 -3.747 1.00 . A A . 14 GLU CG 1 1 9 5898 1 1 14 GLU H H -1.055 9.696 -5.842 1.00 . A A . 14 GLU H 1 1 9 5899 1 1 14 GLU HA H -1.724 6.856 -5.810 1.00 . A A . 14 GLU HA 1 1 9 5900 1 1 14 GLU HB2 H 0.200 6.574 -4.433 1.00 . A A . 14 GLU HB2 1 1 9 5901 1 1 14 GLU HB3 H 0.637 7.729 -5.687 1.00 . A A . 14 GLU HB3 1 1 9 5902 1 1 14 GLU HG2 H 1.409 8.974 -4.012 1.00 . A A . 14 GLU HG2 1 1 9 5903 1 1 14 GLU HG3 H -0.283 9.368 -3.719 1.00 . A A . 14 GLU HG3 1 1 9 5904 1 1 14 GLU N N -1.645 8.916 -5.989 1.00 . A A . 14 GLU N 1 1 9 5905 1 1 14 GLU O O -2.894 8.729 -3.581 1.00 . A A . 14 GLU O 1 1 9 5906 1 1 14 GLU OE1 O 0.140 6.783 -2.203 1.00 . A A . 14 GLU OE1 1 1 9 5907 1 1 14 GLU OE2 O 1.030 8.645 -1.447 1.00 . A A . 14 GLU OE2 1 1 9 5908 1 1 15 THR C C -2.232 5.788 -0.932 1.00 . A A . 15 THR C 1 1 9 5909 1 1 15 THR CA C -3.092 6.430 -2.016 1.00 . A A . 15 THR CA 1 1 9 5910 1 1 15 THR CB C -4.361 5.584 -2.224 1.00 . A A . 15 THR CB 1 1 9 5911 1 1 15 THR CG2 C -5.145 5.452 -0.926 1.00 . A A . 15 THR CG2 1 1 9 5912 1 1 15 THR H H -1.828 5.800 -3.586 1.00 . A A . 15 THR H 1 1 9 5913 1 1 15 THR HA H -3.388 7.418 -1.689 1.00 . A A . 15 THR HA 1 1 9 5914 1 1 15 THR HB H -4.069 4.597 -2.551 1.00 . A A . 15 THR HB 1 1 9 5915 1 1 15 THR HG1 H -4.826 5.996 -4.096 1.00 . A A . 15 THR HG1 1 1 9 5916 1 1 15 THR HG21 H -4.709 6.094 -0.176 1.00 . A A . 15 THR HG21 1 1 9 5917 1 1 15 THR HG22 H -5.113 4.427 -0.588 1.00 . A A . 15 THR HG22 1 1 9 5918 1 1 15 THR HG23 H -6.173 5.742 -1.095 1.00 . A A . 15 THR HG23 1 1 9 5919 1 1 15 THR N N -2.332 6.571 -3.252 1.00 . A A . 15 THR N 1 1 9 5920 1 1 15 THR O O -1.603 4.754 -1.160 1.00 . A A . 15 THR O 1 1 9 5921 1 1 15 THR OG1 O -5.190 6.182 -3.228 1.00 . A A . 15 THR OG1 1 1 9 5922 1 1 16 CYS C C -2.209 4.949 2.230 1.00 . A A . 16 CYS C 1 1 9 5923 1 1 16 CYS CA C -1.404 5.901 1.351 1.00 . A A . 16 CYS CA 1 1 9 5924 1 1 16 CYS CB C -0.871 7.063 2.188 1.00 . A A . 16 CYS CB 1 1 9 5925 1 1 16 CYS H H -2.719 7.231 0.359 1.00 . A A . 16 CYS H 1 1 9 5926 1 1 16 CYS HA H -0.567 5.361 0.936 1.00 . A A . 16 CYS HA 1 1 9 5927 1 1 16 CYS HB2 H -1.688 7.507 2.737 1.00 . A A . 16 CYS HB2 1 1 9 5928 1 1 16 CYS HB3 H -0.132 6.690 2.886 1.00 . A A . 16 CYS HB3 1 1 9 5929 1 1 16 CYS N N -2.200 6.409 0.239 1.00 . A A . 16 CYS N 1 1 9 5930 1 1 16 CYS O O -3.209 5.340 2.833 1.00 . A A . 16 CYS O 1 1 9 5931 1 1 16 CYS SG S -0.088 8.377 1.201 1.00 . A A . 16 CYS SG 1 1 9 5932 1 1 17 CYS C C -1.428 2.074 4.104 1.00 . A A . 17 CYS C 1 1 9 5933 1 1 17 CYS CA C -2.424 2.692 3.123 1.00 . A A . 17 CYS CA 1 1 9 5934 1 1 17 CYS CB C -3.063 1.620 2.230 1.00 . A A . 17 CYS CB 1 1 9 5935 1 1 17 CYS H H -0.948 3.452 1.808 1.00 . A A . 17 CYS H 1 1 9 5936 1 1 17 CYS HA H -3.201 3.189 3.686 1.00 . A A . 17 CYS HA 1 1 9 5937 1 1 17 CYS HB2 H -4.136 1.735 2.261 1.00 . A A . 17 CYS HB2 1 1 9 5938 1 1 17 CYS HB3 H -2.726 1.768 1.214 1.00 . A A . 17 CYS HB3 1 1 9 5939 1 1 17 CYS N N -1.757 3.701 2.307 1.00 . A A . 17 CYS N 1 1 9 5940 1 1 17 CYS O O -0.434 1.475 3.695 1.00 . A A . 17 CYS O 1 1 9 5941 1 1 17 CYS SG S -2.686 -0.104 2.692 1.00 . A A . 17 CYS SG 1 1 9 5942 1 1 18 PRO C C -1.037 0.215 6.732 1.00 . A A . 18 PRO C 1 1 9 5943 1 1 18 PRO CA C -0.787 1.693 6.456 1.00 . A A . 18 PRO CA 1 1 9 5944 1 1 18 PRO CB C -1.152 2.546 7.669 1.00 . A A . 18 PRO CB 1 1 9 5945 1 1 18 PRO CD C -2.832 2.934 6.003 1.00 . A A . 18 PRO CD 1 1 9 5946 1 1 18 PRO CG C -2.603 2.831 7.491 1.00 . A A . 18 PRO CG 1 1 9 5947 1 1 18 PRO HA H 0.252 1.844 6.204 1.00 . A A . 18 PRO HA 1 1 9 5948 1 1 18 PRO HB2 H -0.962 1.991 8.576 1.00 . A A . 18 PRO HB2 1 1 9 5949 1 1 18 PRO HB3 H -0.570 3.456 7.663 1.00 . A A . 18 PRO HB3 1 1 9 5950 1 1 18 PRO HD2 H -3.757 2.448 5.730 1.00 . A A . 18 PRO HD2 1 1 9 5951 1 1 18 PRO HD3 H -2.844 3.969 5.695 1.00 . A A . 18 PRO HD3 1 1 9 5952 1 1 18 PRO HG2 H -3.189 2.022 7.905 1.00 . A A . 18 PRO HG2 1 1 9 5953 1 1 18 PRO HG3 H -2.856 3.764 7.974 1.00 . A A . 18 PRO HG3 1 1 9 5954 1 1 18 PRO N N -1.674 2.225 5.420 1.00 . A A . 18 PRO N 1 1 9 5955 1 1 18 PRO O O -1.619 -0.149 7.755 1.00 . A A . 18 PRO O 1 1 9 5956 1 1 19 THR C C 0.408 -2.724 6.652 1.00 . A A . 19 THR C 1 1 9 5957 1 1 19 THR CA C -0.774 -2.073 5.942 1.00 . A A . 19 THR CA 1 1 9 5958 1 1 19 THR CB C -0.963 -2.743 4.566 1.00 . A A . 19 THR CB 1 1 9 5959 1 1 19 THR CG2 C 0.264 -2.537 3.689 1.00 . A A . 19 THR CG2 1 1 9 5960 1 1 19 THR H H -0.143 -0.278 5.012 1.00 . A A . 19 THR H 1 1 9 5961 1 1 19 THR HA H -1.668 -2.244 6.523 1.00 . A A . 19 THR HA 1 1 9 5962 1 1 19 THR HB H -1.814 -2.292 4.078 1.00 . A A . 19 THR HB 1 1 9 5963 1 1 19 THR HG1 H -1.504 -4.314 5.629 1.00 . A A . 19 THR HG1 1 1 9 5964 1 1 19 THR HG21 H 1.011 -1.982 4.238 1.00 . A A . 19 THR HG21 1 1 9 5965 1 1 19 THR HG22 H -0.014 -1.985 2.803 1.00 . A A . 19 THR HG22 1 1 9 5966 1 1 19 THR HG23 H 0.668 -3.498 3.402 1.00 . A A . 19 THR HG23 1 1 9 5967 1 1 19 THR N N -0.596 -0.632 5.808 1.00 . A A . 19 THR N 1 1 9 5968 1 1 19 THR O O 0.474 -3.948 6.770 1.00 . A A . 19 THR O 1 1 9 5969 1 1 19 THR OG1 O -1.207 -4.145 4.732 1.00 . A A . 19 THR OG1 1 1 9 5970 1 1 20 SER C C 2.666 -1.808 9.200 1.00 . A A . 20 SER C 1 1 9 5971 1 1 20 SER CA C 2.523 -2.421 7.810 1.00 . A A . 20 SER CA 1 1 9 5972 1 1 20 SER CB C 3.780 -2.146 6.986 1.00 . A A . 20 SER CB 1 1 9 5973 1 1 20 SER H H 1.246 -0.939 6.995 1.00 . A A . 20 SER H 1 1 9 5974 1 1 20 SER HA H 2.403 -3.489 7.914 1.00 . A A . 20 SER HA 1 1 9 5975 1 1 20 SER HB2 H 4.039 -1.100 7.065 1.00 . A A . 20 SER HB2 1 1 9 5976 1 1 20 SER HB3 H 4.595 -2.747 7.362 1.00 . A A . 20 SER HB3 1 1 9 5977 1 1 20 SER HG H 2.695 -2.180 5.356 1.00 . A A . 20 SER HG 1 1 9 5978 1 1 20 SER N N 1.345 -1.906 7.120 1.00 . A A . 20 SER N 1 1 9 5979 1 1 20 SER O O 1.757 -1.142 9.694 1.00 . A A . 20 SER O 1 1 9 5980 1 1 20 SER OG O 3.573 -2.462 5.620 1.00 . A A . 20 SER OG 1 1 9 5981 1 1 21 GLN C C 4.706 -0.133 11.088 1.00 . A A . 21 GLN C 1 1 9 5982 1 1 21 GLN CA C 4.089 -1.527 11.157 1.00 . A A . 21 GLN CA 1 1 9 5983 1 1 21 GLN CB C 5.025 -2.474 11.912 1.00 . A A . 21 GLN CB 1 1 9 5984 1 1 21 GLN CD C 4.434 -1.715 14.247 1.00 . A A . 21 GLN CD 1 1 9 5985 1 1 21 GLN CG C 4.505 -2.882 13.280 1.00 . A A . 21 GLN CG 1 1 9 5986 1 1 21 GLN H H 4.499 -2.588 9.374 1.00 . A A . 21 GLN H 1 1 9 5987 1 1 21 GLN HA H 3.152 -1.467 11.687 1.00 . A A . 21 GLN HA 1 1 9 5988 1 1 21 GLN HB2 H 5.166 -3.368 11.322 1.00 . A A . 21 GLN HB2 1 1 9 5989 1 1 21 GLN HB3 H 5.980 -1.988 12.044 1.00 . A A . 21 GLN HB3 1 1 9 5990 1 1 21 GLN HE21 H 2.459 -1.904 14.369 1.00 . A A . 21 GLN HE21 1 1 9 5991 1 1 21 GLN HE22 H 3.153 -0.635 15.314 1.00 . A A . 21 GLN HE22 1 1 9 5992 1 1 21 GLN HG2 H 3.514 -3.295 13.166 1.00 . A A . 21 GLN HG2 1 1 9 5993 1 1 21 GLN HG3 H 5.162 -3.633 13.692 1.00 . A A . 21 GLN HG3 1 1 9 5994 1 1 21 GLN N N 3.817 -2.046 9.823 1.00 . A A . 21 GLN N 1 1 9 5995 1 1 21 GLN NE2 N 3.227 -1.385 14.687 1.00 . A A . 21 GLN NE2 1 1 9 5996 1 1 21 GLN O O 4.200 0.809 11.699 1.00 . A A . 21 GLN O 1 1 9 5997 1 1 21 GLN OE1 O 5.454 -1.120 14.593 1.00 . A A . 21 GLN OE1 1 1 9 5998 1 1 22 THR C C 6.685 1.647 8.740 1.00 . A A . 22 THR C 1 1 9 5999 1 1 22 THR CA C 6.487 1.273 10.208 1.00 . A A . 22 THR CA 1 1 9 6000 1 1 22 THR CB C 7.855 1.257 10.916 1.00 . A A . 22 THR CB 1 1 9 6001 1 1 22 THR CG2 C 8.811 0.291 10.232 1.00 . A A . 22 THR CG2 1 1 9 6002 1 1 22 THR H H 6.163 -0.794 9.887 1.00 . A A . 22 THR H 1 1 9 6003 1 1 22 THR HA H 5.873 2.028 10.678 1.00 . A A . 22 THR HA 1 1 9 6004 1 1 22 THR HB H 7.711 0.934 11.938 1.00 . A A . 22 THR HB 1 1 9 6005 1 1 22 THR HG1 H 9.274 2.556 11.361 1.00 . A A . 22 THR HG1 1 1 9 6006 1 1 22 THR HG21 H 9.309 -0.312 10.978 1.00 . A A . 22 THR HG21 1 1 9 6007 1 1 22 THR HG22 H 9.547 0.848 9.672 1.00 . A A . 22 THR HG22 1 1 9 6008 1 1 22 THR HG23 H 8.258 -0.350 9.562 1.00 . A A . 22 THR HG23 1 1 9 6009 1 1 22 THR N N 5.803 -0.008 10.347 1.00 . A A . 22 THR N 1 1 9 6010 1 1 22 THR O O 7.573 2.432 8.405 1.00 . A A . 22 THR O 1 1 9 6011 1 1 22 THR OG1 O 8.421 2.575 10.920 1.00 . A A . 22 THR OG1 1 1 9 6012 1 1 23 THR C C 4.608 1.895 5.906 1.00 . A A . 23 THR C 1 1 9 6013 1 1 23 THR CA C 5.939 1.374 6.441 1.00 . A A . 23 THR CA 1 1 9 6014 1 1 23 THR CB C 6.359 0.132 5.627 1.00 . A A . 23 THR CB 1 1 9 6015 1 1 23 THR CG2 C 7.002 -0.919 6.521 1.00 . A A . 23 THR CG2 1 1 9 6016 1 1 23 THR H H 5.159 0.475 8.194 1.00 . A A . 23 THR H 1 1 9 6017 1 1 23 THR HA H 6.691 2.139 6.303 1.00 . A A . 23 THR HA 1 1 9 6018 1 1 23 THR HB H 7.079 0.438 4.883 1.00 . A A . 23 THR HB 1 1 9 6019 1 1 23 THR HG1 H 5.511 -0.975 4.232 1.00 . A A . 23 THR HG1 1 1 9 6020 1 1 23 THR HG21 H 6.917 -1.889 6.053 1.00 . A A . 23 THR HG21 1 1 9 6021 1 1 23 THR HG22 H 6.501 -0.935 7.476 1.00 . A A . 23 THR HG22 1 1 9 6022 1 1 23 THR HG23 H 8.045 -0.680 6.665 1.00 . A A . 23 THR HG23 1 1 9 6023 1 1 23 THR N N 5.851 1.088 7.869 1.00 . A A . 23 THR N 1 1 9 6024 1 1 23 THR O O 3.631 2.004 6.646 1.00 . A A . 23 THR O 1 1 9 6025 1 1 23 THR OG1 O 5.219 -0.431 4.966 1.00 . A A . 23 THR OG1 1 1 9 6026 1 1 24 TRP C C 3.208 2.147 2.582 1.00 . A A . 24 TRP C 1 1 9 6027 1 1 24 TRP CA C 3.373 2.731 3.980 1.00 . A A . 24 TRP CA 1 1 9 6028 1 1 24 TRP CB C 3.430 4.256 3.896 1.00 . A A . 24 TRP CB 1 1 9 6029 1 1 24 TRP CD1 C 3.645 5.399 6.177 1.00 . A A . 24 TRP CD1 1 1 9 6030 1 1 24 TRP CD2 C 1.554 5.274 5.402 1.00 . A A . 24 TRP CD2 1 1 9 6031 1 1 24 TRP CE2 C 1.528 5.916 6.653 1.00 . A A . 24 TRP CE2 1 1 9 6032 1 1 24 TRP CE3 C 0.356 5.081 4.719 1.00 . A A . 24 TRP CE3 1 1 9 6033 1 1 24 TRP CG C 2.915 4.948 5.118 1.00 . A A . 24 TRP CG 1 1 9 6034 1 1 24 TRP CH2 C -0.815 6.165 6.539 1.00 . A A . 24 TRP CH2 1 1 9 6035 1 1 24 TRP CZ2 C 0.347 6.367 7.233 1.00 . A A . 24 TRP CZ2 1 1 9 6036 1 1 24 TRP CZ3 C -0.817 5.529 5.293 1.00 . A A . 24 TRP CZ3 1 1 9 6037 1 1 24 TRP H H 5.394 2.110 4.081 1.00 . A A . 24 TRP H 1 1 9 6038 1 1 24 TRP HA H 2.525 2.441 4.584 1.00 . A A . 24 TRP HA 1 1 9 6039 1 1 24 TRP HB2 H 4.455 4.561 3.750 1.00 . A A . 24 TRP HB2 1 1 9 6040 1 1 24 TRP HB3 H 2.840 4.585 3.052 1.00 . A A . 24 TRP HB3 1 1 9 6041 1 1 24 TRP HD1 H 4.715 5.303 6.258 1.00 . A A . 24 TRP HD1 1 1 9 6042 1 1 24 TRP HE1 H 3.106 6.376 7.957 1.00 . A A . 24 TRP HE1 1 1 9 6043 1 1 24 TRP HE3 H 0.338 4.594 3.757 1.00 . A A . 24 TRP HE3 1 1 9 6044 1 1 24 TRP HH2 H -1.754 6.494 6.950 1.00 . A A . 24 TRP HH2 1 1 9 6045 1 1 24 TRP HZ2 H 0.334 6.864 8.192 1.00 . A A . 24 TRP HZ2 1 1 9 6046 1 1 24 TRP HZ3 H -1.756 5.387 4.777 1.00 . A A . 24 TRP HZ3 1 1 9 6047 1 1 24 TRP N N 4.581 2.217 4.617 1.00 . A A . 24 TRP N 1 1 9 6048 1 1 24 TRP NE1 N 2.819 5.980 7.108 1.00 . A A . 24 TRP NE1 1 1 9 6049 1 1 24 TRP O O 4.124 2.212 1.760 1.00 . A A . 24 TRP O 1 1 9 6050 1 1 25 GLY C C 1.207 1.992 0.029 1.00 . A A . 25 GLY C 1 1 9 6051 1 1 25 GLY CA C 1.779 0.995 1.013 1.00 . A A . 25 GLY CA 1 1 9 6052 1 1 25 GLY H H 1.345 1.557 3.007 1.00 . A A . 25 GLY H 1 1 9 6053 1 1 25 GLY HA2 H 2.706 0.610 0.616 1.00 . A A . 25 GLY HA2 1 1 9 6054 1 1 25 GLY HA3 H 1.085 0.179 1.122 1.00 . A A . 25 GLY HA3 1 1 9 6055 1 1 25 GLY N N 2.037 1.579 2.315 1.00 . A A . 25 GLY N 1 1 9 6056 1 1 25 GLY O O 0.243 2.702 0.330 1.00 . A A . 25 GLY O 1 1 9 6057 1 1 26 CYS C C 0.411 2.270 -3.158 1.00 . A A . 26 CYS C 1 1 9 6058 1 1 26 CYS CA C 1.394 2.951 -2.208 1.00 . A A . 26 CYS CA 1 1 9 6059 1 1 26 CYS CB C 2.618 3.440 -2.988 1.00 . A A . 26 CYS CB 1 1 9 6060 1 1 26 CYS H H 2.579 1.450 -1.304 1.00 . A A . 26 CYS H 1 1 9 6061 1 1 26 CYS HA H 0.908 3.798 -1.748 1.00 . A A . 26 CYS HA 1 1 9 6062 1 1 26 CYS HB2 H 3.443 3.567 -2.304 1.00 . A A . 26 CYS HB2 1 1 9 6063 1 1 26 CYS HB3 H 2.882 2.699 -3.728 1.00 . A A . 26 CYS HB3 1 1 9 6064 1 1 26 CYS N N 1.815 2.041 -1.148 1.00 . A A . 26 CYS N 1 1 9 6065 1 1 26 CYS O O 0.782 1.362 -3.903 1.00 . A A . 26 CYS O 1 1 9 6066 1 1 26 CYS SG S 2.372 5.025 -3.853 1.00 . A A . 26 CYS SG 1 1 9 6067 1 1 27 CYS C C -2.351 3.166 -5.022 1.00 . A A . 27 CYS C 1 1 9 6068 1 1 27 CYS CA C -1.879 2.147 -3.985 1.00 . A A . 27 CYS CA 1 1 9 6069 1 1 27 CYS CB C -3.065 1.675 -3.143 1.00 . A A . 27 CYS CB 1 1 9 6070 1 1 27 CYS H H -1.076 3.438 -2.510 1.00 . A A . 27 CYS H 1 1 9 6071 1 1 27 CYS HA H -1.454 1.298 -4.499 1.00 . A A . 27 CYS HA 1 1 9 6072 1 1 27 CYS HB2 H -2.784 1.685 -2.100 1.00 . A A . 27 CYS HB2 1 1 9 6073 1 1 27 CYS HB3 H -3.895 2.351 -3.294 1.00 . A A . 27 CYS HB3 1 1 9 6074 1 1 27 CYS N N -0.842 2.714 -3.127 1.00 . A A . 27 CYS N 1 1 9 6075 1 1 27 CYS O O -2.617 4.321 -4.691 1.00 . A A . 27 CYS O 1 1 9 6076 1 1 27 CYS SG S -3.641 -0.006 -3.545 1.00 . A A . 27 CYS SG 1 1 9 6077 1 1 28 PRO C C -4.411 3.854 -7.390 1.00 . A A . 28 PRO C 1 1 9 6078 1 1 28 PRO CA C -2.899 3.640 -7.381 1.00 . A A . 28 PRO CA 1 1 9 6079 1 1 28 PRO CB C -2.457 2.894 -8.637 1.00 . A A . 28 PRO CB 1 1 9 6080 1 1 28 PRO CD C -2.161 1.393 -6.790 1.00 . A A . 28 PRO CD 1 1 9 6081 1 1 28 PRO CG C -2.513 1.455 -8.255 1.00 . A A . 28 PRO CG 1 1 9 6082 1 1 28 PRO HA H -2.402 4.598 -7.334 1.00 . A A . 28 PRO HA 1 1 9 6083 1 1 28 PRO HB2 H -3.135 3.116 -9.449 1.00 . A A . 28 PRO HB2 1 1 9 6084 1 1 28 PRO HB3 H -1.455 3.192 -8.903 1.00 . A A . 28 PRO HB3 1 1 9 6085 1 1 28 PRO HD2 H -2.775 0.661 -6.286 1.00 . A A . 28 PRO HD2 1 1 9 6086 1 1 28 PRO HD3 H -1.115 1.161 -6.664 1.00 . A A . 28 PRO HD3 1 1 9 6087 1 1 28 PRO HG2 H -3.510 1.071 -8.416 1.00 . A A . 28 PRO HG2 1 1 9 6088 1 1 28 PRO HG3 H -1.796 0.894 -8.835 1.00 . A A . 28 PRO HG3 1 1 9 6089 1 1 28 PRO N N -2.461 2.754 -6.299 1.00 . A A . 28 PRO N 1 1 9 6090 1 1 28 PRO O O -4.898 4.883 -7.858 1.00 . A A . 28 PRO O 1 1 9 6091 1 1 29 SER C C -7.062 4.204 -6.070 1.00 . A A . 29 SER C 1 1 9 6092 1 1 29 SER CA C -6.604 2.952 -6.820 1.00 . A A . 29 SER CA 1 1 9 6093 1 1 29 SER CB C -7.175 1.703 -6.148 1.00 . A A . 29 SER CB 1 1 9 6094 1 1 29 SER H H -4.699 2.079 -6.515 1.00 . A A . 29 SER H 1 1 9 6095 1 1 29 SER HA H -6.968 3.001 -7.836 1.00 . A A . 29 SER HA 1 1 9 6096 1 1 29 SER HB2 H -6.445 1.300 -5.461 1.00 . A A . 29 SER HB2 1 1 9 6097 1 1 29 SER HB3 H -8.072 1.965 -5.606 1.00 . A A . 29 SER HB3 1 1 9 6098 1 1 29 SER HG H -8.443 0.551 -7.100 1.00 . A A . 29 SER HG 1 1 9 6099 1 1 29 SER N N -5.147 2.875 -6.871 1.00 . A A . 29 SER N 1 1 9 6100 1 1 29 SER O O -6.329 4.737 -5.238 1.00 . A A . 29 SER O 1 1 9 6101 1 1 29 SER OG O -7.496 0.708 -7.105 1.00 . A A . 29 SER OG 1 1 9 6102 1 1 30 PRO C C -8.722 5.816 -4.183 1.00 . A A . 30 PRO C 1 1 9 6103 1 1 30 PRO CA C -8.837 5.887 -5.703 1.00 . A A . 30 PRO CA 1 1 9 6104 1 1 30 PRO CB C -10.304 5.882 -6.135 1.00 . A A . 30 PRO CB 1 1 9 6105 1 1 30 PRO CD C -9.230 4.119 -7.340 1.00 . A A . 30 PRO CD 1 1 9 6106 1 1 30 PRO CG C -10.309 5.162 -7.438 1.00 . A A . 30 PRO CG 1 1 9 6107 1 1 30 PRO HA H -8.355 6.787 -6.058 1.00 . A A . 30 PRO HA 1 1 9 6108 1 1 30 PRO HB2 H -10.898 5.367 -5.395 1.00 . A A . 30 PRO HB2 1 1 9 6109 1 1 30 PRO HB3 H -10.654 6.897 -6.243 1.00 . A A . 30 PRO HB3 1 1 9 6110 1 1 30 PRO HD2 H -9.639 3.186 -6.982 1.00 . A A . 30 PRO HD2 1 1 9 6111 1 1 30 PRO HD3 H -8.750 3.981 -8.298 1.00 . A A . 30 PRO HD3 1 1 9 6112 1 1 30 PRO HG2 H -11.271 4.695 -7.596 1.00 . A A . 30 PRO HG2 1 1 9 6113 1 1 30 PRO HG3 H -10.092 5.852 -8.241 1.00 . A A . 30 PRO HG3 1 1 9 6114 1 1 30 PRO N N -8.287 4.691 -6.357 1.00 . A A . 30 PRO N 1 1 9 6115 1 1 30 PRO O O -7.843 6.441 -3.589 1.00 . A A . 30 PRO O 1 1 9 6116 1 1 31 LYS C C -8.704 3.719 -1.715 1.00 . A A . 31 LYS C 1 1 9 6117 1 1 31 LYS CA C -9.597 4.889 -2.108 1.00 . A A . 31 LYS CA 1 1 9 6118 1 1 31 LYS CB C -11.016 4.665 -1.581 1.00 . A A . 31 LYS CB 1 1 9 6119 1 1 31 LYS CD C -12.812 6.322 -0.997 1.00 . A A . 31 LYS CD 1 1 9 6120 1 1 31 LYS CE C -14.313 6.191 -1.205 1.00 . A A . 31 LYS CE 1 1 9 6121 1 1 31 LYS CG C -12.032 5.660 -2.119 1.00 . A A . 31 LYS CG 1 1 9 6122 1 1 31 LYS H H -10.282 4.568 -4.085 1.00 . A A . 31 LYS H 1 1 9 6123 1 1 31 LYS HA H -9.197 5.796 -1.677 1.00 . A A . 31 LYS HA 1 1 9 6124 1 1 31 LYS HB2 H -11.337 3.671 -1.857 1.00 . A A . 31 LYS HB2 1 1 9 6125 1 1 31 LYS HB3 H -11.004 4.744 -0.505 1.00 . A A . 31 LYS HB3 1 1 9 6126 1 1 31 LYS HD2 H -12.547 5.854 -0.060 1.00 . A A . 31 LYS HD2 1 1 9 6127 1 1 31 LYS HD3 H -12.554 7.371 -0.963 1.00 . A A . 31 LYS HD3 1 1 9 6128 1 1 31 LYS HE2 H -14.814 6.943 -0.614 1.00 . A A . 31 LYS HE2 1 1 9 6129 1 1 31 LYS HE3 H -14.533 6.348 -2.251 1.00 . A A . 31 LYS HE3 1 1 9 6130 1 1 31 LYS HG2 H -11.513 6.421 -2.681 1.00 . A A . 31 LYS HG2 1 1 9 6131 1 1 31 LYS HG3 H -12.722 5.139 -2.767 1.00 . A A . 31 LYS HG3 1 1 9 6132 1 1 31 LYS HZ1 H -14.679 4.168 -1.577 1.00 . A A . 31 LYS HZ1 1 1 9 6133 1 1 31 LYS HZ2 H -15.828 4.898 -0.573 1.00 . A A . 31 LYS HZ2 1 1 9 6134 1 1 31 LYS HZ3 H -14.299 4.509 0.035 1.00 . A A . 31 LYS HZ3 1 1 9 6135 1 1 31 LYS N N -9.610 5.048 -3.558 1.00 . A A . 31 LYS N 1 1 9 6136 1 1 31 LYS NZ N -14.815 4.847 -0.801 1.00 . A A . 31 LYS NZ 1 1 9 6137 1 1 31 LYS O O -7.742 3.882 -0.965 1.00 . A A . 31 LYS O 1 1 9 6138 1 1 32 ALA C C -8.255 0.967 -0.496 1.00 . A A . 32 ALA C 1 1 9 6139 1 1 32 ALA CA C -8.275 1.325 -1.977 1.00 . A A . 32 ALA CA 1 1 9 6140 1 1 32 ALA CB C -6.856 1.451 -2.500 1.00 . A A . 32 ALA CB 1 1 9 6141 1 1 32 ALA H H -9.808 2.494 -2.838 1.00 . A A . 32 ALA H 1 1 9 6142 1 1 32 ALA HA H -8.754 0.520 -2.517 1.00 . A A . 32 ALA HA 1 1 9 6143 1 1 32 ALA HB1 H -6.349 0.504 -2.384 1.00 . A A . 32 ALA HB1 1 1 9 6144 1 1 32 ALA HB2 H -6.332 2.212 -1.942 1.00 . A A . 32 ALA HB2 1 1 9 6145 1 1 32 ALA HB3 H -6.880 1.720 -3.546 1.00 . A A . 32 ALA HB3 1 1 9 6146 1 1 32 ALA N N -9.033 2.543 -2.242 1.00 . A A . 32 ALA N 1 1 9 6147 1 1 32 ALA O O -7.749 1.721 0.335 1.00 . A A . 32 ALA O 1 1 9 6148 1 1 33 VAL C C -7.491 -1.253 1.602 1.00 . A A . 33 VAL C 1 1 9 6149 1 1 33 VAL CA C -8.843 -0.678 1.195 1.00 . A A . 33 VAL CA 1 1 9 6150 1 1 33 VAL CB C -9.928 -1.753 1.389 1.00 . A A . 33 VAL CB 1 1 9 6151 1 1 33 VAL CG1 C -10.190 -1.986 2.869 1.00 . A A . 33 VAL CG1 1 1 9 6152 1 1 33 VAL CG2 C -11.208 -1.353 0.670 1.00 . A A . 33 VAL CG2 1 1 9 6153 1 1 33 VAL H H -9.181 -0.750 -0.894 1.00 . A A . 33 VAL H 1 1 9 6154 1 1 33 VAL HA H -9.075 0.161 1.836 1.00 . A A . 33 VAL HA 1 1 9 6155 1 1 33 VAL HB H -9.572 -2.677 0.959 1.00 . A A . 33 VAL HB 1 1 9 6156 1 1 33 VAL HG11 H -9.249 -2.099 3.387 1.00 . A A . 33 VAL HG11 1 1 9 6157 1 1 33 VAL HG12 H -10.780 -2.882 2.993 1.00 . A A . 33 VAL HG12 1 1 9 6158 1 1 33 VAL HG13 H -10.726 -1.142 3.276 1.00 . A A . 33 VAL HG13 1 1 9 6159 1 1 33 VAL HG21 H -11.030 -0.461 0.088 1.00 . A A . 33 VAL HG21 1 1 9 6160 1 1 33 VAL HG22 H -11.984 -1.159 1.396 1.00 . A A . 33 VAL HG22 1 1 9 6161 1 1 33 VAL HG23 H -11.520 -2.154 0.017 1.00 . A A . 33 VAL HG23 1 1 9 6162 1 1 33 VAL N N -8.802 -0.198 -0.179 1.00 . A A . 33 VAL N 1 1 9 6163 1 1 33 VAL O O -6.919 -2.073 0.890 1.00 . A A . 33 VAL O 1 1 9 6164 1 1 34 CYS C C -5.759 -2.721 3.723 1.00 . A A . 34 CYS C 1 1 9 6165 1 1 34 CYS CA C -5.691 -1.275 3.235 1.00 . A A . 34 CYS CA 1 1 9 6166 1 1 34 CYS CB C -5.217 -0.374 4.376 1.00 . A A . 34 CYS CB 1 1 9 6167 1 1 34 CYS H H -7.485 -0.152 3.267 1.00 . A A . 34 CYS H 1 1 9 6168 1 1 34 CYS HA H -4.983 -1.212 2.423 1.00 . A A . 34 CYS HA 1 1 9 6169 1 1 34 CYS HB2 H -5.572 0.630 4.205 1.00 . A A . 34 CYS HB2 1 1 9 6170 1 1 34 CYS HB3 H -5.632 -0.744 5.302 1.00 . A A . 34 CYS HB3 1 1 9 6171 1 1 34 CYS N N -6.983 -0.811 2.743 1.00 . A A . 34 CYS N 1 1 9 6172 1 1 34 CYS O O -5.847 -2.967 4.925 1.00 . A A . 34 CYS O 1 1 9 6173 1 1 34 CYS SG S -3.408 -0.293 4.581 1.00 . A A . 34 CYS SG 1 1 9 6174 1 1 35 CYS C C -4.708 -5.370 4.235 1.00 . A A . 35 CYS C 1 1 9 6175 1 1 35 CYS CA C -5.739 -5.090 3.147 1.00 . A A . 35 CYS CA 1 1 9 6176 1 1 35 CYS CB C -5.468 -5.964 1.920 1.00 . A A . 35 CYS CB 1 1 9 6177 1 1 35 CYS H H -5.623 -3.423 1.847 1.00 . A A . 35 CYS H 1 1 9 6178 1 1 35 CYS HA H -6.724 -5.312 3.532 1.00 . A A . 35 CYS HA 1 1 9 6179 1 1 35 CYS HB2 H -5.881 -5.483 1.047 1.00 . A A . 35 CYS HB2 1 1 9 6180 1 1 35 CYS HB3 H -4.401 -6.073 1.794 1.00 . A A . 35 CYS HB3 1 1 9 6181 1 1 35 CYS N N -5.702 -3.674 2.790 1.00 . A A . 35 CYS N 1 1 9 6182 1 1 35 CYS O O -3.498 -5.395 3.972 1.00 . A A . 35 CYS O 1 1 9 6183 1 1 35 CYS SG S -6.188 -7.636 2.022 1.00 . A A . 35 CYS SG 1 1 9 6184 1 1 36 ASP C C -4.170 -7.271 6.915 1.00 . A A . 36 ASP C 1 1 9 6185 1 1 36 ASP CA C -4.340 -5.786 6.612 1.00 . A A . 36 ASP CA 1 1 9 6186 1 1 36 ASP CB C -4.898 -5.067 7.841 1.00 . A A . 36 ASP CB 1 1 9 6187 1 1 36 ASP CG C -4.238 -3.720 8.070 1.00 . A A . 36 ASP CG 1 1 9 6188 1 1 36 ASP H H -6.170 -5.494 5.592 1.00 . A A . 36 ASP H 1 1 9 6189 1 1 36 ASP HA H -3.370 -5.372 6.384 1.00 . A A . 36 ASP HA 1 1 9 6190 1 1 36 ASP HB2 H -5.957 -4.909 7.707 1.00 . A A . 36 ASP HB2 1 1 9 6191 1 1 36 ASP HB3 H -4.735 -5.681 8.714 1.00 . A A . 36 ASP HB3 1 1 9 6192 1 1 36 ASP N N -5.200 -5.547 5.460 1.00 . A A . 36 ASP N 1 1 9 6193 1 1 36 ASP O O -3.288 -7.641 7.692 1.00 . A A . 36 ASP O 1 1 9 6194 1 1 36 ASP OD1 O -4.943 -2.779 8.493 1.00 . A A . 36 ASP OD1 1 1 9 6195 1 1 36 ASP OD2 O -3.018 -3.608 7.828 1.00 . A A . 36 ASP OD2 1 1 9 6196 1 1 37 ASP C C -3.450 -10.015 6.317 1.00 . A A . 37 ASP C 1 1 9 6197 1 1 37 ASP CA C -4.886 -9.563 6.543 1.00 . A A . 37 ASP CA 1 1 9 6198 1 1 37 ASP CB C -5.830 -10.328 5.615 1.00 . A A . 37 ASP CB 1 1 9 6199 1 1 37 ASP CG C -6.098 -11.739 6.101 1.00 . A A . 37 ASP CG 1 1 9 6200 1 1 37 ASP H H -5.682 -7.803 5.692 1.00 . A A . 37 ASP H 1 1 9 6201 1 1 37 ASP HA H -5.159 -9.758 7.570 1.00 . A A . 37 ASP HA 1 1 9 6202 1 1 37 ASP HB2 H -6.772 -9.803 5.557 1.00 . A A . 37 ASP HB2 1 1 9 6203 1 1 37 ASP HB3 H -5.391 -10.383 4.630 1.00 . A A . 37 ASP HB3 1 1 9 6204 1 1 37 ASP N N -4.995 -8.126 6.311 1.00 . A A . 37 ASP N 1 1 9 6205 1 1 37 ASP O O -2.904 -10.812 7.079 1.00 . A A . 37 ASP O 1 1 9 6206 1 1 37 ASP OD1 O -5.991 -12.678 5.284 1.00 . A A . 37 ASP OD1 1 1 9 6207 1 1 37 ASP OD2 O -6.415 -11.905 7.297 1.00 . A A . 37 ASP OD2 1 1 9 6208 1 1 38 MET C C -0.667 -8.474 4.862 1.00 . A A . 38 MET C 1 1 9 6209 1 1 38 MET CA C -1.466 -9.773 4.929 1.00 . A A . 38 MET CA 1 1 9 6210 1 1 38 MET CB C -1.394 -10.523 3.596 1.00 . A A . 38 MET CB 1 1 9 6211 1 1 38 MET CE C 1.189 -12.357 2.493 1.00 . A A . 38 MET CE 1 1 9 6212 1 1 38 MET CG C -1.258 -12.029 3.754 1.00 . A A . 38 MET CG 1 1 9 6213 1 1 38 MET H H -3.340 -8.829 4.718 1.00 . A A . 38 MET H 1 1 9 6214 1 1 38 MET HA H -1.057 -10.395 5.712 1.00 . A A . 38 MET HA 1 1 9 6215 1 1 38 MET HB2 H -2.293 -10.322 3.033 1.00 . A A . 38 MET HB2 1 1 9 6216 1 1 38 MET HB3 H -0.542 -10.164 3.039 1.00 . A A . 38 MET HB3 1 1 9 6217 1 1 38 MET HE1 H 1.727 -11.422 2.451 1.00 . A A . 38 MET HE1 1 1 9 6218 1 1 38 MET HE2 H 0.421 -12.365 1.733 1.00 . A A . 38 MET HE2 1 1 9 6219 1 1 38 MET HE3 H 1.874 -13.174 2.320 1.00 . A A . 38 MET HE3 1 1 9 6220 1 1 38 MET HG2 H -1.893 -12.351 4.566 1.00 . A A . 38 MET HG2 1 1 9 6221 1 1 38 MET HG3 H -1.580 -12.503 2.838 1.00 . A A . 38 MET HG3 1 1 9 6222 1 1 38 MET N N -2.846 -9.469 5.270 1.00 . A A . 38 MET N 1 1 9 6223 1 1 38 MET O O -0.326 -7.897 5.893 1.00 . A A . 38 MET O 1 1 9 6224 1 1 38 MET SD S 0.434 -12.541 4.106 1.00 . A A . 38 MET SD 1 1 9 6225 1 1 39 GLN C C -0.071 -6.129 2.102 1.00 . A A . 39 GLN C 1 1 9 6226 1 1 39 GLN CA C 0.273 -6.719 3.466 1.00 . A A . 39 GLN CA 1 1 9 6227 1 1 39 GLN CB C 1.787 -6.915 3.591 1.00 . A A . 39 GLN CB 1 1 9 6228 1 1 39 GLN CD C 3.771 -8.073 2.541 1.00 . A A . 39 GLN CD 1 1 9 6229 1 1 39 GLN CG C 2.301 -8.169 2.903 1.00 . A A . 39 GLN CG 1 1 9 6230 1 1 39 GLN H H -0.777 -8.443 2.860 1.00 . A A . 39 GLN H 1 1 9 6231 1 1 39 GLN HA H -0.061 -6.040 4.236 1.00 . A A . 39 GLN HA 1 1 9 6232 1 1 39 GLN HB2 H 2.285 -6.062 3.154 1.00 . A A . 39 GLN HB2 1 1 9 6233 1 1 39 GLN HB3 H 2.045 -6.973 4.638 1.00 . A A . 39 GLN HB3 1 1 9 6234 1 1 39 GLN HE21 H 4.222 -7.556 4.408 1.00 . A A . 39 GLN HE21 1 1 9 6235 1 1 39 GLN HE22 H 5.556 -7.657 3.314 1.00 . A A . 39 GLN HE22 1 1 9 6236 1 1 39 GLN HG2 H 2.165 -9.010 3.566 1.00 . A A . 39 GLN HG2 1 1 9 6237 1 1 39 GLN HG3 H 1.733 -8.328 1.999 1.00 . A A . 39 GLN HG3 1 1 9 6238 1 1 39 GLN N N -0.422 -7.985 3.649 1.00 . A A . 39 GLN N 1 1 9 6239 1 1 39 GLN NE2 N 4.600 -7.727 3.519 1.00 . A A . 39 GLN NE2 1 1 9 6240 1 1 39 GLN O O 0.699 -6.288 1.153 1.00 . A A . 39 GLN O 1 1 9 6241 1 1 39 GLN OE1 O 4.156 -8.305 1.396 1.00 . A A . 39 GLN OE1 1 1 9 6242 1 1 40 HIS C C -2.839 -4.041 0.734 1.00 . A A . 40 HIS C 1 1 9 6243 1 1 40 HIS CA C -1.603 -4.923 0.674 1.00 . A A . 40 HIS CA 1 1 9 6244 1 1 40 HIS CB C -1.843 -6.058 -0.323 1.00 . A A . 40 HIS CB 1 1 9 6245 1 1 40 HIS CD2 C 0.177 -5.889 -1.941 1.00 . A A . 40 HIS CD2 1 1 9 6246 1 1 40 HIS CE1 C -0.928 -5.502 -3.793 1.00 . A A . 40 HIS CE1 1 1 9 6247 1 1 40 HIS CG C -1.140 -5.867 -1.631 1.00 . A A . 40 HIS CG 1 1 9 6248 1 1 40 HIS H H -1.841 -5.395 2.747 1.00 . A A . 40 HIS H 1 1 9 6249 1 1 40 HIS HA H -0.776 -4.327 0.321 1.00 . A A . 40 HIS HA 1 1 9 6250 1 1 40 HIS HB2 H -1.496 -6.985 0.107 1.00 . A A . 40 HIS HB2 1 1 9 6251 1 1 40 HIS HB3 H -2.902 -6.134 -0.522 1.00 . A A . 40 HIS HB3 1 1 9 6252 1 1 40 HIS HD1 H -2.777 -5.547 -2.919 1.00 . A A . 40 HIS HD1 1 1 9 6253 1 1 40 HIS HD2 H 0.995 -6.056 -1.254 1.00 . A A . 40 HIS HD2 1 1 9 6254 1 1 40 HIS HE1 H -1.162 -5.309 -4.830 1.00 . A A . 40 HIS HE1 1 1 9 6255 1 1 40 HIS HE2 H 1.106 -5.730 -3.817 1.00 . A A . 40 HIS HE2 1 1 9 6256 1 1 40 HIS N N -1.227 -5.472 1.975 1.00 . A A . 40 HIS N 1 1 9 6257 1 1 40 HIS ND1 N -1.806 -5.622 -2.813 1.00 . A A . 40 HIS ND1 1 1 9 6258 1 1 40 HIS NE2 N 0.282 -5.660 -3.291 1.00 . A A . 40 HIS NE2 1 1 9 6259 1 1 40 HIS O O -3.359 -3.734 1.803 1.00 . A A . 40 HIS O 1 1 9 6260 1 1 41 CYS C C -5.330 -3.335 -1.758 1.00 . A A . 41 CYS C 1 1 9 6261 1 1 41 CYS CA C -4.475 -2.815 -0.606 1.00 . A A . 41 CYS CA 1 1 9 6262 1 1 41 CYS CB C -4.070 -1.363 -0.864 1.00 . A A . 41 CYS CB 1 1 9 6263 1 1 41 CYS H H -2.823 -3.953 -1.256 1.00 . A A . 41 CYS H 1 1 9 6264 1 1 41 CYS HA H -5.045 -2.869 0.309 1.00 . A A . 41 CYS HA 1 1 9 6265 1 1 41 CYS HB2 H -4.935 -0.809 -1.196 1.00 . A A . 41 CYS HB2 1 1 9 6266 1 1 41 CYS HB3 H -3.703 -0.930 0.056 1.00 . A A . 41 CYS HB3 1 1 9 6267 1 1 41 CYS N N -3.296 -3.651 -0.453 1.00 . A A . 41 CYS N 1 1 9 6268 1 1 41 CYS O O -4.804 -3.766 -2.784 1.00 . A A . 41 CYS O 1 1 9 6269 1 1 41 CYS SG S -2.769 -1.169 -2.126 1.00 . A A . 41 CYS SG 1 1 9 6270 1 1 42 CYS C C -8.299 -2.598 -3.262 1.00 . A A . 42 CYS C 1 1 9 6271 1 1 42 CYS CA C -7.563 -3.768 -2.616 1.00 . A A . 42 CYS CA 1 1 9 6272 1 1 42 CYS CB C -8.567 -4.758 -2.022 1.00 . A A . 42 CYS CB 1 1 9 6273 1 1 42 CYS H H -7.010 -2.941 -0.751 1.00 . A A . 42 CYS H 1 1 9 6274 1 1 42 CYS HA H -6.979 -4.271 -3.372 1.00 . A A . 42 CYS HA 1 1 9 6275 1 1 42 CYS HB2 H -8.460 -4.765 -0.946 1.00 . A A . 42 CYS HB2 1 1 9 6276 1 1 42 CYS HB3 H -9.569 -4.443 -2.280 1.00 . A A . 42 CYS HB3 1 1 9 6277 1 1 42 CYS N N -6.646 -3.296 -1.585 1.00 . A A . 42 CYS N 1 1 9 6278 1 1 42 CYS O O -8.566 -1.590 -2.610 1.00 . A A . 42 CYS O 1 1 9 6279 1 1 42 CYS SG S -8.354 -6.470 -2.608 1.00 . A A . 42 CYS SG 1 1 9 6280 1 1 43 PRO C C -10.535 -1.107 -4.540 1.00 . A A . 43 PRO C 1 1 9 6281 1 1 43 PRO CA C -9.335 -1.662 -5.301 1.00 . A A . 43 PRO CA 1 1 9 6282 1 1 43 PRO CB C -9.787 -2.374 -6.574 1.00 . A A . 43 PRO CB 1 1 9 6283 1 1 43 PRO CD C -8.344 -3.886 -5.417 1.00 . A A . 43 PRO CD 1 1 9 6284 1 1 43 PRO CG C -8.762 -3.432 -6.788 1.00 . A A . 43 PRO CG 1 1 9 6285 1 1 43 PRO HA H -8.670 -0.851 -5.558 1.00 . A A . 43 PRO HA 1 1 9 6286 1 1 43 PRO HB2 H -10.770 -2.797 -6.423 1.00 . A A . 43 PRO HB2 1 1 9 6287 1 1 43 PRO HB3 H -9.810 -1.674 -7.395 1.00 . A A . 43 PRO HB3 1 1 9 6288 1 1 43 PRO HD2 H -8.927 -4.741 -5.109 1.00 . A A . 43 PRO HD2 1 1 9 6289 1 1 43 PRO HD3 H -7.290 -4.122 -5.403 1.00 . A A . 43 PRO HD3 1 1 9 6290 1 1 43 PRO HG2 H -9.192 -4.253 -7.342 1.00 . A A . 43 PRO HG2 1 1 9 6291 1 1 43 PRO HG3 H -7.917 -3.021 -7.320 1.00 . A A . 43 PRO HG3 1 1 9 6292 1 1 43 PRO N N -8.631 -2.716 -4.562 1.00 . A A . 43 PRO N 1 1 9 6293 1 1 43 PRO O O -11.316 -1.859 -3.955 1.00 . A A . 43 PRO O 1 1 9 6294 1 1 44 ALA C C -13.110 0.307 -4.247 1.00 . A A . 44 ALA C 1 1 9 6295 1 1 44 ALA CA C -11.757 0.898 -3.867 1.00 . A A . 44 ALA CA 1 1 9 6296 1 1 44 ALA CB C -11.730 2.386 -4.183 1.00 . A A . 44 ALA CB 1 1 9 6297 1 1 44 ALA H H -9.998 0.751 -5.035 1.00 . A A . 44 ALA H 1 1 9 6298 1 1 44 ALA HA H -11.609 0.778 -2.804 1.00 . A A . 44 ALA HA 1 1 9 6299 1 1 44 ALA HB1 H -12.210 2.932 -3.385 1.00 . A A . 44 ALA HB1 1 1 9 6300 1 1 44 ALA HB2 H -12.255 2.567 -5.109 1.00 . A A . 44 ALA HB2 1 1 9 6301 1 1 44 ALA HB3 H -10.705 2.715 -4.279 1.00 . A A . 44 ALA HB3 1 1 9 6302 1 1 44 ALA N N -10.663 0.218 -4.553 1.00 . A A . 44 ALA N 1 1 9 6303 1 1 44 ALA O O -13.682 0.657 -5.280 1.00 . A A . 44 ALA O 1 1 9 6304 1 1 45 GLY C C -14.831 -2.717 -3.737 1.00 . A A . 45 GLY C 1 1 9 6305 1 1 45 GLY CA C -14.905 -1.203 -3.673 1.00 . A A . 45 GLY CA 1 1 9 6306 1 1 45 GLY H H -13.123 -0.827 -2.596 1.00 . A A . 45 GLY H 1 1 9 6307 1 1 45 GLY HA2 H -15.597 -0.923 -2.892 1.00 . A A . 45 GLY HA2 1 1 9 6308 1 1 45 GLY HA3 H -15.278 -0.834 -4.617 1.00 . A A . 45 GLY HA3 1 1 9 6309 1 1 45 GLY N N -13.620 -0.587 -3.405 1.00 . A A . 45 GLY N 1 1 9 6310 1 1 45 GLY O O -15.802 -3.373 -4.112 1.00 . A A . 45 GLY O 1 1 9 6311 1 1 46 TYR C C -12.803 -5.198 -2.115 1.00 . A A . 46 TYR C 1 1 9 6312 1 1 46 TYR CA C -13.497 -4.724 -3.388 1.00 . A A . 46 TYR CA 1 1 9 6313 1 1 46 TYR CB C -12.677 -5.143 -4.610 1.00 . A A . 46 TYR CB 1 1 9 6314 1 1 46 TYR CD1 C -13.123 -3.505 -6.481 1.00 . A A . 46 TYR CD1 1 1 9 6315 1 1 46 TYR CD2 C -14.105 -5.673 -6.625 1.00 . A A . 46 TYR CD2 1 1 9 6316 1 1 46 TYR CE1 C -13.702 -3.159 -7.687 1.00 . A A . 46 TYR CE1 1 1 9 6317 1 1 46 TYR CE2 C -14.687 -5.333 -7.831 1.00 . A A . 46 TYR CE2 1 1 9 6318 1 1 46 TYR CG C -13.314 -4.766 -5.931 1.00 . A A . 46 TYR CG 1 1 9 6319 1 1 46 TYR CZ C -14.483 -4.076 -8.358 1.00 . A A . 46 TYR CZ 1 1 9 6320 1 1 46 TYR H H -12.936 -2.710 -3.075 1.00 . A A . 46 TYR H 1 1 9 6321 1 1 46 TYR HA H -14.472 -5.182 -3.445 1.00 . A A . 46 TYR HA 1 1 9 6322 1 1 46 TYR HB2 H -11.706 -4.670 -4.563 1.00 . A A . 46 TYR HB2 1 1 9 6323 1 1 46 TYR HB3 H -12.550 -6.215 -4.597 1.00 . A A . 46 TYR HB3 1 1 9 6324 1 1 46 TYR HD1 H -12.510 -2.790 -5.954 1.00 . A A . 46 TYR HD1 1 1 9 6325 1 1 46 TYR HD2 H -14.264 -6.658 -6.209 1.00 . A A . 46 TYR HD2 1 1 9 6326 1 1 46 TYR HE1 H -13.540 -2.173 -8.099 1.00 . A A . 46 TYR HE1 1 1 9 6327 1 1 46 TYR HE2 H -15.299 -6.051 -8.356 1.00 . A A . 46 TYR HE2 1 1 9 6328 1 1 46 TYR HH H -15.374 -2.827 -9.517 1.00 . A A . 46 TYR HH 1 1 9 6329 1 1 46 TYR N N -13.680 -3.276 -3.370 1.00 . A A . 46 TYR N 1 1 9 6330 1 1 46 TYR O O -12.190 -4.405 -1.399 1.00 . A A . 46 TYR O 1 1 9 6331 1 1 46 TYR OH O -15.061 -3.733 -9.558 1.00 . A A . 46 TYR OH 1 1 9 6332 1 1 47 LYS C C -11.317 -8.192 -1.020 1.00 . A A . 47 LYS C 1 1 9 6333 1 1 47 LYS CA C -12.287 -7.074 -0.647 1.00 . A A . 47 LYS CA 1 1 9 6334 1 1 47 LYS CB C -13.363 -7.609 0.300 1.00 . A A . 47 LYS CB 1 1 9 6335 1 1 47 LYS CD C -14.098 -10.002 0.527 1.00 . A A . 47 LYS CD 1 1 9 6336 1 1 47 LYS CE C -15.469 -10.603 0.792 1.00 . A A . 47 LYS CE 1 1 9 6337 1 1 47 LYS CG C -14.197 -8.729 -0.300 1.00 . A A . 47 LYS CG 1 1 9 6338 1 1 47 LYS H H -13.407 -7.075 -2.444 1.00 . A A . 47 LYS H 1 1 9 6339 1 1 47 LYS HA H -11.737 -6.290 -0.146 1.00 . A A . 47 LYS HA 1 1 9 6340 1 1 47 LYS HB2 H -12.885 -7.983 1.194 1.00 . A A . 47 LYS HB2 1 1 9 6341 1 1 47 LYS HB3 H -14.025 -6.798 0.567 1.00 . A A . 47 LYS HB3 1 1 9 6342 1 1 47 LYS HD2 H -13.499 -10.722 -0.011 1.00 . A A . 47 LYS HD2 1 1 9 6343 1 1 47 LYS HD3 H -13.627 -9.771 1.471 1.00 . A A . 47 LYS HD3 1 1 9 6344 1 1 47 LYS HE2 H -15.844 -10.215 1.728 1.00 . A A . 47 LYS HE2 1 1 9 6345 1 1 47 LYS HE3 H -16.135 -10.314 -0.009 1.00 . A A . 47 LYS HE3 1 1 9 6346 1 1 47 LYS HG2 H -15.230 -8.415 -0.336 1.00 . A A . 47 LYS HG2 1 1 9 6347 1 1 47 LYS HG3 H -13.845 -8.931 -1.301 1.00 . A A . 47 LYS HG3 1 1 9 6348 1 1 47 LYS HZ1 H -16.186 -12.442 1.476 1.00 . A A . 47 LYS HZ1 1 1 9 6349 1 1 47 LYS HZ2 H -14.508 -12.396 1.265 1.00 . A A . 47 LYS HZ2 1 1 9 6350 1 1 47 LYS HZ3 H -15.525 -12.498 -0.081 1.00 . A A . 47 LYS HZ3 1 1 9 6351 1 1 47 LYS N N -12.904 -6.494 -1.836 1.00 . A A . 47 LYS N 1 1 9 6352 1 1 47 LYS NZ N -15.419 -12.089 0.869 1.00 . A A . 47 LYS NZ 1 1 9 6353 1 1 47 LYS O O -11.367 -8.728 -2.128 1.00 . A A . 47 LYS O 1 1 9 6354 1 1 48 CYS C C -10.052 -10.968 -0.005 1.00 . A A . 48 CYS C 1 1 9 6355 1 1 48 CYS CA C -9.455 -9.595 -0.308 1.00 . A A . 48 CYS CA 1 1 9 6356 1 1 48 CYS CB C -8.216 -9.362 0.562 1.00 . A A . 48 CYS CB 1 1 9 6357 1 1 48 CYS H H -10.451 -8.075 0.778 1.00 . A A . 48 CYS H 1 1 9 6358 1 1 48 CYS HA H -9.165 -9.564 -1.348 1.00 . A A . 48 CYS HA 1 1 9 6359 1 1 48 CYS HB2 H -8.436 -9.662 1.575 1.00 . A A . 48 CYS HB2 1 1 9 6360 1 1 48 CYS HB3 H -7.402 -9.962 0.183 1.00 . A A . 48 CYS HB3 1 1 9 6361 1 1 48 CYS N N -10.438 -8.541 -0.084 1.00 . A A . 48 CYS N 1 1 9 6362 1 1 48 CYS O O -10.968 -11.089 0.809 1.00 . A A . 48 CYS O 1 1 9 6363 1 1 48 CYS SG S -7.652 -7.628 0.612 1.00 . A A . 48 CYS SG 1 1 9 6364 1 1 49 GLY C C -8.919 -14.361 -0.253 1.00 . A A . 49 GLY C 1 1 9 6365 1 1 49 GLY CA C -10.030 -13.345 -0.457 1.00 . A A . 49 GLY CA 1 1 9 6366 1 1 49 GLY H H -8.805 -11.841 -1.308 1.00 . A A . 49 GLY H 1 1 9 6367 1 1 49 GLY HA2 H -10.666 -13.347 0.416 1.00 . A A . 49 GLY HA2 1 1 9 6368 1 1 49 GLY HA3 H -10.617 -13.638 -1.315 1.00 . A A . 49 GLY HA3 1 1 9 6369 1 1 49 GLY N N -9.531 -11.997 -0.669 1.00 . A A . 49 GLY N 1 1 9 6370 1 1 49 GLY O O -7.743 -14.039 -0.430 1.00 . A A . 49 GLY O 1 1 9 6371 1 1 50 PRO C C -7.530 -17.057 -0.919 1.00 . A A . 50 PRO C 1 1 9 6372 1 1 50 PRO CA C -8.279 -16.670 0.353 1.00 . A A . 50 PRO CA 1 1 9 6373 1 1 50 PRO CB C -9.123 -17.853 0.850 1.00 . A A . 50 PRO CB 1 1 9 6374 1 1 50 PRO CD C -10.638 -16.076 0.359 1.00 . A A . 50 PRO CD 1 1 9 6375 1 1 50 PRO CG C -10.432 -17.264 1.251 1.00 . A A . 50 PRO CG 1 1 9 6376 1 1 50 PRO HA H -7.567 -16.390 1.116 1.00 . A A . 50 PRO HA 1 1 9 6377 1 1 50 PRO HB2 H -9.242 -18.572 0.051 1.00 . A A . 50 PRO HB2 1 1 9 6378 1 1 50 PRO HB3 H -8.629 -18.321 1.689 1.00 . A A . 50 PRO HB3 1 1 9 6379 1 1 50 PRO HD2 H -11.111 -16.373 -0.566 1.00 . A A . 50 PRO HD2 1 1 9 6380 1 1 50 PRO HD3 H -11.223 -15.320 0.861 1.00 . A A . 50 PRO HD3 1 1 9 6381 1 1 50 PRO HG2 H -11.222 -17.986 1.102 1.00 . A A . 50 PRO HG2 1 1 9 6382 1 1 50 PRO HG3 H -10.395 -16.955 2.285 1.00 . A A . 50 PRO HG3 1 1 9 6383 1 1 50 PRO N N -9.264 -15.607 0.123 1.00 . A A . 50 PRO N 1 1 9 6384 1 1 50 PRO O O -6.446 -17.637 -0.859 1.00 . A A . 50 PRO O 1 1 9 6385 1 1 51 GLY C C -6.431 -16.064 -3.742 1.00 . A A . 51 GLY C 1 1 9 6386 1 1 51 GLY CA C -7.494 -17.066 -3.337 1.00 . A A . 51 GLY CA 1 1 9 6387 1 1 51 GLY H H -8.985 -16.281 -2.054 1.00 . A A . 51 GLY H 1 1 9 6388 1 1 51 GLY HA2 H -7.041 -18.042 -3.260 1.00 . A A . 51 GLY HA2 1 1 9 6389 1 1 51 GLY HA3 H -8.257 -17.094 -4.102 1.00 . A A . 51 GLY HA3 1 1 9 6390 1 1 51 GLY N N -8.119 -16.739 -2.067 1.00 . A A . 51 GLY N 1 1 9 6391 1 1 51 GLY O O -6.040 -16.004 -4.908 1.00 . A A . 51 GLY O 1 1 9 6392 1 1 52 GLY C C -5.382 -13.265 -4.091 1.00 . A A . 52 GLY C 1 1 9 6393 1 1 52 GLY CA C -4.939 -14.285 -3.060 1.00 . A A . 52 GLY CA 1 1 9 6394 1 1 52 GLY H H -6.310 -15.372 -1.868 1.00 . A A . 52 GLY H 1 1 9 6395 1 1 52 GLY HA2 H -4.694 -13.768 -2.143 1.00 . A A . 52 GLY HA2 1 1 9 6396 1 1 52 GLY HA3 H -4.056 -14.788 -3.423 1.00 . A A . 52 GLY HA3 1 1 9 6397 1 1 52 GLY N N -5.962 -15.277 -2.778 1.00 . A A . 52 GLY N 1 1 9 6398 1 1 52 GLY O O -4.554 -12.567 -4.677 1.00 . A A . 52 GLY O 1 1 9 6399 1 1 53 THR C C -8.296 -11.345 -4.644 1.00 . A A . 53 THR C 1 1 9 6400 1 1 53 THR CA C -7.239 -12.237 -5.283 1.00 . A A . 53 THR CA 1 1 9 6401 1 1 53 THR CB C -7.861 -12.964 -6.489 1.00 . A A . 53 THR CB 1 1 9 6402 1 1 53 THR CG2 C -6.884 -13.013 -7.653 1.00 . A A . 53 THR CG2 1 1 9 6403 1 1 53 THR H H -7.299 -13.762 -3.817 1.00 . A A . 53 THR H 1 1 9 6404 1 1 53 THR HA H -6.429 -11.618 -5.642 1.00 . A A . 53 THR HA 1 1 9 6405 1 1 53 THR HB H -8.743 -12.423 -6.800 1.00 . A A . 53 THR HB 1 1 9 6406 1 1 53 THR HG1 H -8.092 -14.887 -6.862 1.00 . A A . 53 THR HG1 1 1 9 6407 1 1 53 THR HG21 H -6.068 -13.676 -7.411 1.00 . A A . 53 THR HG21 1 1 9 6408 1 1 53 THR HG22 H -6.499 -12.022 -7.842 1.00 . A A . 53 THR HG22 1 1 9 6409 1 1 53 THR HG23 H -7.393 -13.375 -8.536 1.00 . A A . 53 THR HG23 1 1 9 6410 1 1 53 THR N N -6.690 -13.179 -4.315 1.00 . A A . 53 THR N 1 1 9 6411 1 1 53 THR O O -8.745 -11.600 -3.527 1.00 . A A . 53 THR O 1 1 9 6412 1 1 53 THR OG1 O -8.237 -14.296 -6.121 1.00 . A A . 53 THR OG1 1 1 9 6413 1 1 54 CYS C C -11.043 -9.624 -5.533 1.00 . A A . 54 CYS C 1 1 9 6414 1 1 54 CYS CA C -9.694 -9.368 -4.868 1.00 . A A . 54 CYS CA 1 1 9 6415 1 1 54 CYS CB C -9.250 -7.927 -5.119 1.00 . A A . 54 CYS CB 1 1 9 6416 1 1 54 CYS H H -8.293 -10.150 -6.246 1.00 . A A . 54 CYS H 1 1 9 6417 1 1 54 CYS HA H -9.796 -9.524 -3.805 1.00 . A A . 54 CYS HA 1 1 9 6418 1 1 54 CYS HB2 H -8.171 -7.880 -5.087 1.00 . A A . 54 CYS HB2 1 1 9 6419 1 1 54 CYS HB3 H -9.589 -7.619 -6.097 1.00 . A A . 54 CYS HB3 1 1 9 6420 1 1 54 CYS N N -8.689 -10.300 -5.362 1.00 . A A . 54 CYS N 1 1 9 6421 1 1 54 CYS O O -11.151 -9.635 -6.760 1.00 . A A . 54 CYS O 1 1 9 6422 1 1 54 CYS SG S -9.892 -6.730 -3.906 1.00 . A A . 54 CYS SG 1 1 9 6423 1 1 55 ILE C C -14.369 -8.964 -4.829 1.00 . A A . 55 ILE C 1 1 9 6424 1 1 55 ILE CA C -13.413 -10.086 -5.216 1.00 . A A . 55 ILE CA 1 1 9 6425 1 1 55 ILE CB C -13.969 -11.424 -4.686 1.00 . A A . 55 ILE CB 1 1 9 6426 1 1 55 ILE CD1 C -14.550 -12.482 -2.444 1.00 . A A . 55 ILE CD1 1 1 9 6427 1 1 55 ILE CG1 C -13.575 -11.624 -3.221 1.00 . A A . 55 ILE CG1 1 1 9 6428 1 1 55 ILE CG2 C -13.468 -12.579 -5.539 1.00 . A A . 55 ILE CG2 1 1 9 6429 1 1 55 ILE H H -11.917 -9.807 -3.745 1.00 . A A . 55 ILE H 1 1 9 6430 1 1 55 ILE HA H -13.360 -10.145 -6.295 1.00 . A A . 55 ILE HA 1 1 9 6431 1 1 55 ILE HB H -15.045 -11.394 -4.761 1.00 . A A . 55 ILE HB 1 1 9 6432 1 1 55 ILE HD11 H -14.414 -12.315 -1.386 1.00 . A A . 55 ILE HD11 1 1 9 6433 1 1 55 ILE HD12 H -14.372 -13.524 -2.670 1.00 . A A . 55 ILE HD12 1 1 9 6434 1 1 55 ILE HD13 H -15.560 -12.221 -2.722 1.00 . A A . 55 ILE HD13 1 1 9 6435 1 1 55 ILE HG12 H -12.607 -12.100 -3.177 1.00 . A A . 55 ILE HG12 1 1 9 6436 1 1 55 ILE HG13 H -13.519 -10.661 -2.734 1.00 . A A . 55 ILE HG13 1 1 9 6437 1 1 55 ILE HG21 H -12.453 -12.820 -5.259 1.00 . A A . 55 ILE HG21 1 1 9 6438 1 1 55 ILE HG22 H -13.497 -12.297 -6.580 1.00 . A A . 55 ILE HG22 1 1 9 6439 1 1 55 ILE HG23 H -14.100 -13.441 -5.381 1.00 . A A . 55 ILE HG23 1 1 9 6440 1 1 55 ILE N N -12.069 -9.830 -4.713 1.00 . A A . 55 ILE N 1 1 9 6441 1 1 55 ILE O O -14.028 -8.097 -4.026 1.00 . A A . 55 ILE O 1 1 9 6442 1 1 56 SER C C -17.134 -8.134 -3.717 1.00 . A A . 56 SER C 1 1 9 6443 1 1 56 SER CA C -16.568 -7.962 -5.123 1.00 . A A . 56 SER CA 1 1 9 6444 1 1 56 SER CB C -17.697 -8.023 -6.154 1.00 . A A . 56 SER CB 1 1 9 6445 1 1 56 SER H H -15.781 -9.696 -6.045 1.00 . A A . 56 SER H 1 1 9 6446 1 1 56 SER HA H -16.086 -6.998 -5.188 1.00 . A A . 56 SER HA 1 1 9 6447 1 1 56 SER HB2 H -18.481 -7.338 -5.868 1.00 . A A . 56 SER HB2 1 1 9 6448 1 1 56 SER HB3 H -17.312 -7.744 -7.123 1.00 . A A . 56 SER HB3 1 1 9 6449 1 1 56 SER HG H -17.538 -9.961 -6.391 1.00 . A A . 56 SER HG 1 1 9 6450 1 1 56 SER N N -15.567 -8.982 -5.409 1.00 . A A . 56 SER N 1 1 9 6451 1 1 56 SER O O -17.911 -9.089 -3.504 1.00 . A A . 56 SER O 1 1 9 6452 1 1 56 SER OXT O -16.795 -7.313 -2.839 1.00 . A A . 56 SER OXT 1 1 9 6453 1 1 56 SER OG O -18.243 -9.329 -6.238 1.00 . A A . 56 SER OG 1 1 10 6454 1 1 1 ASP C C 1.287 13.548 -3.271 1.00 . A A . 1 ASP C 1 1 10 6455 1 1 1 ASP CA C 2.615 13.617 -4.019 1.00 . A A . 1 ASP CA 1 1 10 6456 1 1 1 ASP CB C 3.781 13.480 -3.039 1.00 . A A . 1 ASP CB 1 1 10 6457 1 1 1 ASP CG C 5.129 13.519 -3.732 1.00 . A A . 1 ASP CG 1 1 10 6458 1 1 1 ASP H1 H 1.906 15.091 -5.314 1.00 . A A . 1 ASP H1 1 1 10 6459 1 1 1 ASP H2 H 3.582 14.874 -5.376 1.00 . A A . 1 ASP H2 1 1 10 6460 1 1 1 ASP H3 H 2.884 15.685 -4.066 1.00 . A A . 1 ASP H3 1 1 10 6461 1 1 1 ASP HA H 2.658 12.812 -4.738 1.00 . A A . 1 ASP HA 1 1 10 6462 1 1 1 ASP HB2 H 3.741 14.290 -2.326 1.00 . A A . 1 ASP HB2 1 1 10 6463 1 1 1 ASP HB3 H 3.693 12.540 -2.514 1.00 . A A . 1 ASP HB3 1 1 10 6464 1 1 1 ASP N N 2.757 14.906 -4.744 1.00 . A A . 1 ASP N 1 1 10 6465 1 1 1 ASP O O 0.485 14.480 -3.324 1.00 . A A . 1 ASP O 1 1 10 6466 1 1 1 ASP OD1 O 6.010 14.277 -3.275 1.00 . A A . 1 ASP OD1 1 1 10 6467 1 1 1 ASP OD2 O 5.304 12.790 -4.731 1.00 . A A . 1 ASP OD2 1 1 10 6468 1 1 2 VAL C C 0.134 11.854 -0.371 1.00 . A A . 2 VAL C 1 1 10 6469 1 1 2 VAL CA C -0.168 12.245 -1.815 1.00 . A A . 2 VAL CA 1 1 10 6470 1 1 2 VAL CB C -1.060 11.162 -2.452 1.00 . A A . 2 VAL CB 1 1 10 6471 1 1 2 VAL CG1 C -2.408 11.095 -1.751 1.00 . A A . 2 VAL CG1 1 1 10 6472 1 1 2 VAL CG2 C -1.238 11.423 -3.940 1.00 . A A . 2 VAL CG2 1 1 10 6473 1 1 2 VAL H H 1.741 11.730 -2.572 1.00 . A A . 2 VAL H 1 1 10 6474 1 1 2 VAL HA H -0.712 13.178 -1.818 1.00 . A A . 2 VAL HA 1 1 10 6475 1 1 2 VAL HB H -0.571 10.205 -2.333 1.00 . A A . 2 VAL HB 1 1 10 6476 1 1 2 VAL HG11 H -3.060 10.420 -2.285 1.00 . A A . 2 VAL HG11 1 1 10 6477 1 1 2 VAL HG12 H -2.851 12.080 -1.728 1.00 . A A . 2 VAL HG12 1 1 10 6478 1 1 2 VAL HG13 H -2.271 10.739 -0.741 1.00 . A A . 2 VAL HG13 1 1 10 6479 1 1 2 VAL HG21 H -1.830 10.633 -4.377 1.00 . A A . 2 VAL HG21 1 1 10 6480 1 1 2 VAL HG22 H -0.270 11.453 -4.419 1.00 . A A . 2 VAL HG22 1 1 10 6481 1 1 2 VAL HG23 H -1.739 12.369 -4.082 1.00 . A A . 2 VAL HG23 1 1 10 6482 1 1 2 VAL N N 1.062 12.437 -2.574 1.00 . A A . 2 VAL N 1 1 10 6483 1 1 2 VAL O O 0.726 10.805 -0.118 1.00 . A A . 2 VAL O 1 1 10 6484 1 1 3 GLN C C -0.204 11.016 2.370 1.00 . A A . 3 GLN C 1 1 10 6485 1 1 3 GLN CA C -0.034 12.486 1.994 1.00 . A A . 3 GLN CA 1 1 10 6486 1 1 3 GLN CB C -0.988 13.343 2.831 1.00 . A A . 3 GLN CB 1 1 10 6487 1 1 3 GLN CD C -1.983 15.630 3.222 1.00 . A A . 3 GLN CD 1 1 10 6488 1 1 3 GLN CG C -1.228 14.731 2.262 1.00 . A A . 3 GLN CG 1 1 10 6489 1 1 3 GLN H H -0.715 13.540 0.289 1.00 . A A . 3 GLN H 1 1 10 6490 1 1 3 GLN HA H 0.980 12.784 2.214 1.00 . A A . 3 GLN HA 1 1 10 6491 1 1 3 GLN HB2 H -1.940 12.836 2.899 1.00 . A A . 3 GLN HB2 1 1 10 6492 1 1 3 GLN HB3 H -0.577 13.451 3.824 1.00 . A A . 3 GLN HB3 1 1 10 6493 1 1 3 GLN HE21 H -3.509 15.745 1.953 1.00 . A A . 3 GLN HE21 1 1 10 6494 1 1 3 GLN HE22 H -3.692 16.623 3.430 1.00 . A A . 3 GLN HE22 1 1 10 6495 1 1 3 GLN HG2 H -0.274 15.186 2.040 1.00 . A A . 3 GLN HG2 1 1 10 6496 1 1 3 GLN HG3 H -1.802 14.638 1.351 1.00 . A A . 3 GLN HG3 1 1 10 6497 1 1 3 GLN N N -0.264 12.716 0.566 1.00 . A A . 3 GLN N 1 1 10 6498 1 1 3 GLN NE2 N -3.183 16.040 2.829 1.00 . A A . 3 GLN NE2 1 1 10 6499 1 1 3 GLN O O -1.322 10.506 2.440 1.00 . A A . 3 GLN O 1 1 10 6500 1 1 3 GLN OE1 O -1.493 15.951 4.305 1.00 . A A . 3 GLN OE1 1 1 10 6501 1 1 4 CYS C C 0.999 8.782 4.502 1.00 . A A . 4 CYS C 1 1 10 6502 1 1 4 CYS CA C 0.912 8.939 2.992 1.00 . A A . 4 CYS CA 1 1 10 6503 1 1 4 CYS CB C 2.079 8.221 2.345 1.00 . A A . 4 CYS CB 1 1 10 6504 1 1 4 CYS H H 1.775 10.820 2.542 1.00 . A A . 4 CYS H 1 1 10 6505 1 1 4 CYS HA H -0.011 8.502 2.643 1.00 . A A . 4 CYS HA 1 1 10 6506 1 1 4 CYS HB2 H 2.976 8.755 2.584 1.00 . A A . 4 CYS HB2 1 1 10 6507 1 1 4 CYS HB3 H 2.145 7.220 2.747 1.00 . A A . 4 CYS HB3 1 1 10 6508 1 1 4 CYS N N 0.920 10.348 2.616 1.00 . A A . 4 CYS N 1 1 10 6509 1 1 4 CYS O O 1.921 8.156 5.021 1.00 . A A . 4 CYS O 1 1 10 6510 1 1 4 CYS SG S 1.967 8.089 0.536 1.00 . A A . 4 CYS SG 1 1 10 6511 1 1 5 GLY C C 1.248 9.580 7.322 1.00 . A A . 5 GLY C 1 1 10 6512 1 1 5 GLY CA C -0.067 9.268 6.633 1.00 . A A . 5 GLY CA 1 1 10 6513 1 1 5 GLY H H -0.685 9.790 4.673 1.00 . A A . 5 GLY H 1 1 10 6514 1 1 5 GLY HA2 H -0.811 9.972 6.975 1.00 . A A . 5 GLY HA2 1 1 10 6515 1 1 5 GLY HA3 H -0.379 8.272 6.913 1.00 . A A . 5 GLY HA3 1 1 10 6516 1 1 5 GLY N N 0.013 9.340 5.180 1.00 . A A . 5 GLY N 1 1 10 6517 1 1 5 GLY O O 1.483 10.710 7.750 1.00 . A A . 5 GLY O 1 1 10 6518 1 1 6 GLY C C 4.299 9.670 7.250 1.00 . A A . 6 GLY C 1 1 10 6519 1 1 6 GLY CA C 3.399 8.746 8.047 1.00 . A A . 6 GLY CA 1 1 10 6520 1 1 6 GLY H H 1.855 7.702 7.044 1.00 . A A . 6 GLY H 1 1 10 6521 1 1 6 GLY HA2 H 3.255 9.160 9.034 1.00 . A A . 6 GLY HA2 1 1 10 6522 1 1 6 GLY HA3 H 3.877 7.782 8.137 1.00 . A A . 6 GLY HA3 1 1 10 6523 1 1 6 GLY N N 2.106 8.571 7.418 1.00 . A A . 6 GLY N 1 1 10 6524 1 1 6 GLY O O 3.818 10.509 6.488 1.00 . A A . 6 GLY O 1 1 10 6525 1 1 7 GLY C C 6.842 9.867 5.311 1.00 . A A . 7 GLY C 1 1 10 6526 1 1 7 GLY CA C 6.545 10.365 6.713 1.00 . A A . 7 GLY CA 1 1 10 6527 1 1 7 GLY H H 5.935 8.842 8.051 1.00 . A A . 7 GLY H 1 1 10 6528 1 1 7 GLY HA2 H 6.137 11.363 6.648 1.00 . A A . 7 GLY HA2 1 1 10 6529 1 1 7 GLY HA3 H 7.469 10.403 7.271 1.00 . A A . 7 GLY HA3 1 1 10 6530 1 1 7 GLY N N 5.606 9.523 7.427 1.00 . A A . 7 GLY N 1 1 10 6531 1 1 7 GLY O O 7.930 10.105 4.784 1.00 . A A . 7 GLY O 1 1 10 6532 1 1 8 PHE C C 5.351 9.505 2.316 1.00 . A A . 8 PHE C 1 1 10 6533 1 1 8 PHE CA C 6.073 8.652 3.350 1.00 . A A . 8 PHE CA 1 1 10 6534 1 1 8 PHE CB C 5.583 7.208 3.261 1.00 . A A . 8 PHE CB 1 1 10 6535 1 1 8 PHE CD1 C 6.998 6.202 5.077 1.00 . A A . 8 PHE CD1 1 1 10 6536 1 1 8 PHE CD2 C 7.135 5.269 2.886 1.00 . A A . 8 PHE CD2 1 1 10 6537 1 1 8 PHE CE1 C 7.926 5.284 5.528 1.00 . A A . 8 PHE CE1 1 1 10 6538 1 1 8 PHE CE2 C 8.064 4.348 3.332 1.00 . A A . 8 PHE CE2 1 1 10 6539 1 1 8 PHE CG C 6.591 6.205 3.752 1.00 . A A . 8 PHE CG 1 1 10 6540 1 1 8 PHE CZ C 8.460 4.356 4.656 1.00 . A A . 8 PHE CZ 1 1 10 6541 1 1 8 PHE H H 5.032 9.007 5.163 1.00 . A A . 8 PHE H 1 1 10 6542 1 1 8 PHE HA H 7.130 8.673 3.135 1.00 . A A . 8 PHE HA 1 1 10 6543 1 1 8 PHE HB2 H 4.686 7.102 3.850 1.00 . A A . 8 PHE HB2 1 1 10 6544 1 1 8 PHE HB3 H 5.359 6.976 2.229 1.00 . A A . 8 PHE HB3 1 1 10 6545 1 1 8 PHE HD1 H 6.580 6.926 5.761 1.00 . A A . 8 PHE HD1 1 1 10 6546 1 1 8 PHE HD2 H 6.826 5.262 1.851 1.00 . A A . 8 PHE HD2 1 1 10 6547 1 1 8 PHE HE1 H 8.236 5.292 6.564 1.00 . A A . 8 PHE HE1 1 1 10 6548 1 1 8 PHE HE2 H 8.479 3.623 2.648 1.00 . A A . 8 PHE HE2 1 1 10 6549 1 1 8 PHE HZ H 9.186 3.637 5.007 1.00 . A A . 8 PHE HZ 1 1 10 6550 1 1 8 PHE N N 5.882 9.175 4.699 1.00 . A A . 8 PHE N 1 1 10 6551 1 1 8 PHE O O 4.784 10.550 2.636 1.00 . A A . 8 PHE O 1 1 10 6552 1 1 9 SER C C 4.726 8.879 -1.290 1.00 . A A . 9 SER C 1 1 10 6553 1 1 9 SER CA C 4.737 9.746 -0.032 1.00 . A A . 9 SER CA 1 1 10 6554 1 1 9 SER CB C 5.454 11.068 -0.315 1.00 . A A . 9 SER CB 1 1 10 6555 1 1 9 SER H H 5.851 8.201 0.893 1.00 . A A . 9 SER H 1 1 10 6556 1 1 9 SER HA H 3.717 9.953 0.257 1.00 . A A . 9 SER HA 1 1 10 6557 1 1 9 SER HB2 H 4.993 11.551 -1.164 1.00 . A A . 9 SER HB2 1 1 10 6558 1 1 9 SER HB3 H 5.376 11.709 0.550 1.00 . A A . 9 SER HB3 1 1 10 6559 1 1 9 SER HG H 7.291 11.693 -0.581 1.00 . A A . 9 SER HG 1 1 10 6560 1 1 9 SER N N 5.382 9.042 1.072 1.00 . A A . 9 SER N 1 1 10 6561 1 1 9 SER O O 5.513 7.940 -1.415 1.00 . A A . 9 SER O 1 1 10 6562 1 1 9 SER OG O 6.825 10.854 -0.603 1.00 . A A . 9 SER OG 1 1 10 6563 1 1 10 CYS C C 3.379 9.393 -4.621 1.00 . A A . 10 CYS C 1 1 10 6564 1 1 10 CYS CA C 3.713 8.454 -3.465 1.00 . A A . 10 CYS CA 1 1 10 6565 1 1 10 CYS CB C 2.655 7.355 -3.346 1.00 . A A . 10 CYS CB 1 1 10 6566 1 1 10 CYS H H 3.230 9.959 -2.060 1.00 . A A . 10 CYS H 1 1 10 6567 1 1 10 CYS HA H 4.670 7.996 -3.662 1.00 . A A . 10 CYS HA 1 1 10 6568 1 1 10 CYS HB2 H 1.923 7.646 -2.607 1.00 . A A . 10 CYS HB2 1 1 10 6569 1 1 10 CYS HB3 H 2.168 7.233 -4.301 1.00 . A A . 10 CYS HB3 1 1 10 6570 1 1 10 CYS N N 3.830 9.200 -2.217 1.00 . A A . 10 CYS N 1 1 10 6571 1 1 10 CYS O O 3.409 10.614 -4.466 1.00 . A A . 10 CYS O 1 1 10 6572 1 1 10 CYS SG S 3.328 5.732 -2.856 1.00 . A A . 10 CYS SG 1 1 10 6573 1 1 11 HIS C C 1.308 10.067 -6.963 1.00 . A A . 11 HIS C 1 1 10 6574 1 1 11 HIS CA C 2.767 9.613 -6.965 1.00 . A A . 11 HIS CA 1 1 10 6575 1 1 11 HIS CB C 3.056 8.806 -8.231 1.00 . A A . 11 HIS CB 1 1 10 6576 1 1 11 HIS CD2 C 4.774 9.761 -9.923 1.00 . A A . 11 HIS CD2 1 1 10 6577 1 1 11 HIS CE1 C 3.425 11.086 -11.034 1.00 . A A . 11 HIS CE1 1 1 10 6578 1 1 11 HIS CG C 3.541 9.641 -9.374 1.00 . A A . 11 HIS CG 1 1 10 6579 1 1 11 HIS H H 3.089 7.842 -5.848 1.00 . A A . 11 HIS H 1 1 10 6580 1 1 11 HIS HA H 3.401 10.485 -6.955 1.00 . A A . 11 HIS HA 1 1 10 6581 1 1 11 HIS HB2 H 3.814 8.069 -8.013 1.00 . A A . 11 HIS HB2 1 1 10 6582 1 1 11 HIS HB3 H 2.152 8.305 -8.545 1.00 . A A . 11 HIS HB3 1 1 10 6583 1 1 11 HIS HD1 H 1.762 10.621 -9.936 1.00 . A A . 11 HIS HD1 1 1 10 6584 1 1 11 HIS HD2 H 5.669 9.244 -9.610 1.00 . A A . 11 HIS HD2 1 1 10 6585 1 1 11 HIS HE1 H 3.045 11.800 -11.750 1.00 . A A . 11 HIS HE1 1 1 10 6586 1 1 11 HIS HE2 H 5.396 10.912 -11.567 1.00 . A A . 11 HIS HE2 1 1 10 6587 1 1 11 HIS N N 3.081 8.819 -5.782 1.00 . A A . 11 HIS N 1 1 10 6588 1 1 11 HIS ND1 N 2.720 10.484 -10.093 1.00 . A A . 11 HIS ND1 1 1 10 6589 1 1 11 HIS NE2 N 4.673 10.665 -10.952 1.00 . A A . 11 HIS NE2 1 1 10 6590 1 1 11 HIS O O 0.494 9.599 -6.165 1.00 . A A . 11 HIS O 1 1 10 6591 1 1 12 ASP C C -1.375 10.435 -8.243 1.00 . A A . 12 ASP C 1 1 10 6592 1 1 12 ASP CA C -0.357 11.537 -7.974 1.00 . A A . 12 ASP CA 1 1 10 6593 1 1 12 ASP CB C -0.417 12.584 -9.086 1.00 . A A . 12 ASP CB 1 1 10 6594 1 1 12 ASP CG C -0.190 13.992 -8.572 1.00 . A A . 12 ASP CG 1 1 10 6595 1 1 12 ASP H H 1.692 11.329 -8.462 1.00 . A A . 12 ASP H 1 1 10 6596 1 1 12 ASP HA H -0.600 12.011 -7.035 1.00 . A A . 12 ASP HA 1 1 10 6597 1 1 12 ASP HB2 H 0.341 12.363 -9.822 1.00 . A A . 12 ASP HB2 1 1 10 6598 1 1 12 ASP HB3 H -1.390 12.544 -9.556 1.00 . A A . 12 ASP HB3 1 1 10 6599 1 1 12 ASP N N 0.993 10.996 -7.861 1.00 . A A . 12 ASP N 1 1 10 6600 1 1 12 ASP O O -1.178 9.593 -9.121 1.00 . A A . 12 ASP O 1 1 10 6601 1 1 12 ASP OD1 O 0.141 14.143 -7.376 1.00 . A A . 12 ASP OD1 1 1 10 6602 1 1 12 ASP OD2 O -0.341 14.945 -9.365 1.00 . A A . 12 ASP OD2 1 1 10 6603 1 1 13 GLY C C -3.266 8.211 -6.820 1.00 . A A . 13 GLY C 1 1 10 6604 1 1 13 GLY CA C -3.506 9.452 -7.653 1.00 . A A . 13 GLY CA 1 1 10 6605 1 1 13 GLY H H -2.567 11.147 -6.802 1.00 . A A . 13 GLY H 1 1 10 6606 1 1 13 GLY HA2 H -4.453 9.886 -7.370 1.00 . A A . 13 GLY HA2 1 1 10 6607 1 1 13 GLY HA3 H -3.550 9.170 -8.695 1.00 . A A . 13 GLY HA3 1 1 10 6608 1 1 13 GLY N N -2.466 10.450 -7.483 1.00 . A A . 13 GLY N 1 1 10 6609 1 1 13 GLY O O -4.144 7.355 -6.708 1.00 . A A . 13 GLY O 1 1 10 6610 1 1 14 GLU C C -2.108 7.185 -3.952 1.00 . A A . 14 GLU C 1 1 10 6611 1 1 14 GLU CA C -1.733 6.954 -5.413 1.00 . A A . 14 GLU CA 1 1 10 6612 1 1 14 GLU CB C -0.240 6.648 -5.516 1.00 . A A . 14 GLU CB 1 1 10 6613 1 1 14 GLU CD C -0.105 5.656 -7.838 1.00 . A A . 14 GLU CD 1 1 10 6614 1 1 14 GLU CG C 0.318 6.788 -6.923 1.00 . A A . 14 GLU CG 1 1 10 6615 1 1 14 GLU H H -1.412 8.821 -6.362 1.00 . A A . 14 GLU H 1 1 10 6616 1 1 14 GLU HA H -2.290 6.106 -5.784 1.00 . A A . 14 GLU HA 1 1 10 6617 1 1 14 GLU HB2 H 0.296 7.327 -4.872 1.00 . A A . 14 GLU HB2 1 1 10 6618 1 1 14 GLU HB3 H -0.067 5.635 -5.182 1.00 . A A . 14 GLU HB3 1 1 10 6619 1 1 14 GLU HG2 H -0.032 7.719 -7.344 1.00 . A A . 14 GLU HG2 1 1 10 6620 1 1 14 GLU HG3 H 1.397 6.803 -6.866 1.00 . A A . 14 GLU HG3 1 1 10 6621 1 1 14 GLU N N -2.076 8.108 -6.235 1.00 . A A . 14 GLU N 1 1 10 6622 1 1 14 GLU O O -2.437 8.302 -3.552 1.00 . A A . 14 GLU O 1 1 10 6623 1 1 14 GLU OE1 O -0.049 5.838 -9.072 1.00 . A A . 14 GLU OE1 1 1 10 6624 1 1 14 GLU OE2 O -0.493 4.587 -7.321 1.00 . A A . 14 GLU OE2 1 1 10 6625 1 1 15 THR C C -1.559 5.147 -0.981 1.00 . A A . 15 THR C 1 1 10 6626 1 1 15 THR CA C -2.376 6.178 -1.744 1.00 . A A . 15 THR CA 1 1 10 6627 1 1 15 THR CB C -3.872 5.903 -1.505 1.00 . A A . 15 THR CB 1 1 10 6628 1 1 15 THR CG2 C -4.227 6.065 -0.034 1.00 . A A . 15 THR CG2 1 1 10 6629 1 1 15 THR H H -1.778 5.255 -3.549 1.00 . A A . 15 THR H 1 1 10 6630 1 1 15 THR HA H -2.140 7.168 -1.380 1.00 . A A . 15 THR HA 1 1 10 6631 1 1 15 THR HB H -4.086 4.883 -1.804 1.00 . A A . 15 THR HB 1 1 10 6632 1 1 15 THR HG1 H -4.449 6.688 -3.221 1.00 . A A . 15 THR HG1 1 1 10 6633 1 1 15 THR HG21 H -5.217 5.672 0.142 1.00 . A A . 15 THR HG21 1 1 10 6634 1 1 15 THR HG22 H -4.202 7.111 0.230 1.00 . A A . 15 THR HG22 1 1 10 6635 1 1 15 THR HG23 H -3.512 5.525 0.569 1.00 . A A . 15 THR HG23 1 1 10 6636 1 1 15 THR N N -2.050 6.117 -3.166 1.00 . A A . 15 THR N 1 1 10 6637 1 1 15 THR O O -1.582 3.972 -1.322 1.00 . A A . 15 THR O 1 1 10 6638 1 1 15 THR OG1 O -4.667 6.798 -2.293 1.00 . A A . 15 THR OG1 1 1 10 6639 1 1 16 CYS C C -0.851 3.917 1.876 1.00 . A A . 16 CYS C 1 1 10 6640 1 1 16 CYS CA C -0.024 4.624 0.806 1.00 . A A . 16 CYS CA 1 1 10 6641 1 1 16 CYS CB C 1.190 5.313 1.427 1.00 . A A . 16 CYS CB 1 1 10 6642 1 1 16 CYS H H -0.830 6.514 0.299 1.00 . A A . 16 CYS H 1 1 10 6643 1 1 16 CYS HA H 0.330 3.881 0.110 1.00 . A A . 16 CYS HA 1 1 10 6644 1 1 16 CYS HB2 H 0.860 6.066 2.129 1.00 . A A . 16 CYS HB2 1 1 10 6645 1 1 16 CYS HB3 H 1.781 4.577 1.953 1.00 . A A . 16 CYS HB3 1 1 10 6646 1 1 16 CYS N N -0.833 5.568 0.048 1.00 . A A . 16 CYS N 1 1 10 6647 1 1 16 CYS O O -1.957 4.344 2.207 1.00 . A A . 16 CYS O 1 1 10 6648 1 1 16 CYS SG S 2.274 6.121 0.207 1.00 . A A . 16 CYS SG 1 1 10 6649 1 1 17 CYS C C 0.013 1.636 4.521 1.00 . A A . 17 CYS C 1 1 10 6650 1 1 17 CYS CA C -0.969 2.038 3.428 1.00 . A A . 17 CYS CA 1 1 10 6651 1 1 17 CYS CB C -1.590 0.782 2.822 1.00 . A A . 17 CYS CB 1 1 10 6652 1 1 17 CYS H H 0.582 2.548 2.091 1.00 . A A . 17 CYS H 1 1 10 6653 1 1 17 CYS HA H -1.751 2.643 3.866 1.00 . A A . 17 CYS HA 1 1 10 6654 1 1 17 CYS HB2 H -2.664 0.893 2.802 1.00 . A A . 17 CYS HB2 1 1 10 6655 1 1 17 CYS HB3 H -1.225 0.657 1.813 1.00 . A A . 17 CYS HB3 1 1 10 6656 1 1 17 CYS N N -0.301 2.829 2.402 1.00 . A A . 17 CYS N 1 1 10 6657 1 1 17 CYS O O 1.158 1.281 4.243 1.00 . A A . 17 CYS O 1 1 10 6658 1 1 17 CYS SG S -1.201 -0.737 3.749 1.00 . A A . 17 CYS SG 1 1 10 6659 1 1 18 PRO C C 0.334 -0.162 7.250 1.00 . A A . 18 PRO C 1 1 10 6660 1 1 18 PRO CA C 0.403 1.330 6.926 1.00 . A A . 18 PRO CA 1 1 10 6661 1 1 18 PRO CB C -0.238 2.150 8.040 1.00 . A A . 18 PRO CB 1 1 10 6662 1 1 18 PRO CD C -1.781 2.104 6.200 1.00 . A A . 18 PRO CD 1 1 10 6663 1 1 18 PRO CG C -1.694 2.122 7.710 1.00 . A A . 18 PRO CG 1 1 10 6664 1 1 18 PRO HA H 1.432 1.632 6.784 1.00 . A A . 18 PRO HA 1 1 10 6665 1 1 18 PRO HB2 H -0.033 1.693 8.996 1.00 . A A . 18 PRO HB2 1 1 10 6666 1 1 18 PRO HB3 H 0.151 3.158 8.022 1.00 . A A . 18 PRO HB3 1 1 10 6667 1 1 18 PRO HD2 H -2.522 1.393 5.862 1.00 . A A . 18 PRO HD2 1 1 10 6668 1 1 18 PRO HD3 H -2.010 3.090 5.825 1.00 . A A . 18 PRO HD3 1 1 10 6669 1 1 18 PRO HG2 H -2.146 1.232 8.122 1.00 . A A . 18 PRO HG2 1 1 10 6670 1 1 18 PRO HG3 H -2.176 3.005 8.102 1.00 . A A . 18 PRO HG3 1 1 10 6671 1 1 18 PRO N N -0.429 1.686 5.782 1.00 . A A . 18 PRO N 1 1 10 6672 1 1 18 PRO O O 0.004 -0.548 8.371 1.00 . A A . 18 PRO O 1 1 10 6673 1 1 19 THR C C 1.729 -2.927 7.350 1.00 . A A . 19 THR C 1 1 10 6674 1 1 19 THR CA C 0.605 -2.444 6.438 1.00 . A A . 19 THR CA 1 1 10 6675 1 1 19 THR CB C 0.706 -3.179 5.088 1.00 . A A . 19 THR CB 1 1 10 6676 1 1 19 THR CG2 C 2.017 -2.852 4.390 1.00 . A A . 19 THR CG2 1 1 10 6677 1 1 19 THR H H 0.891 -0.630 5.385 1.00 . A A . 19 THR H 1 1 10 6678 1 1 19 THR HA H -0.342 -2.699 6.889 1.00 . A A . 19 THR HA 1 1 10 6679 1 1 19 THR HB H -0.110 -2.855 4.457 1.00 . A A . 19 THR HB 1 1 10 6680 1 1 19 THR HG1 H 1.384 -5.025 4.926 1.00 . A A . 19 THR HG1 1 1 10 6681 1 1 19 THR HG21 H 2.698 -3.684 4.493 1.00 . A A . 19 THR HG21 1 1 10 6682 1 1 19 THR HG22 H 2.454 -1.972 4.839 1.00 . A A . 19 THR HG22 1 1 10 6683 1 1 19 THR HG23 H 1.833 -2.667 3.342 1.00 . A A . 19 THR HG23 1 1 10 6684 1 1 19 THR N N 0.641 -0.995 6.259 1.00 . A A . 19 THR N 1 1 10 6685 1 1 19 THR O O 1.857 -4.123 7.612 1.00 . A A . 19 THR O 1 1 10 6686 1 1 19 THR OG1 O 0.607 -4.594 5.288 1.00 . A A . 19 THR OG1 1 1 10 6687 1 1 20 SER C C 3.641 -1.433 9.953 1.00 . A A . 20 SER C 1 1 10 6688 1 1 20 SER CA C 3.648 -2.328 8.719 1.00 . A A . 20 SER CA 1 1 10 6689 1 1 20 SER CB C 4.980 -2.192 7.979 1.00 . A A . 20 SER CB 1 1 10 6690 1 1 20 SER H H 2.389 -1.055 7.594 1.00 . A A . 20 SER H 1 1 10 6691 1 1 20 SER HA H 3.523 -3.355 9.033 1.00 . A A . 20 SER HA 1 1 10 6692 1 1 20 SER HB2 H 5.030 -1.222 7.507 1.00 . A A . 20 SER HB2 1 1 10 6693 1 1 20 SER HB3 H 5.793 -2.290 8.684 1.00 . A A . 20 SER HB3 1 1 10 6694 1 1 20 SER HG H 6.046 -3.307 6.771 1.00 . A A . 20 SER HG 1 1 10 6695 1 1 20 SER N N 2.541 -1.993 7.834 1.00 . A A . 20 SER N 1 1 10 6696 1 1 20 SER O O 2.623 -0.824 10.282 1.00 . A A . 20 SER O 1 1 10 6697 1 1 20 SER OG O 5.117 -3.190 6.984 1.00 . A A . 20 SER OG 1 1 10 6698 1 1 21 GLN C C 5.559 0.801 11.503 1.00 . A A . 21 GLN C 1 1 10 6699 1 1 21 GLN CA C 4.903 -0.536 11.829 1.00 . A A . 21 GLN CA 1 1 10 6700 1 1 21 GLN CB C 5.715 -1.273 12.896 1.00 . A A . 21 GLN CB 1 1 10 6701 1 1 21 GLN CD C 5.431 -3.148 14.568 1.00 . A A . 21 GLN CD 1 1 10 6702 1 1 21 GLN CG C 5.255 -2.704 13.129 1.00 . A A . 21 GLN CG 1 1 10 6703 1 1 21 GLN H H 5.557 -1.868 10.320 1.00 . A A . 21 GLN H 1 1 10 6704 1 1 21 GLN HA H 3.909 -0.354 12.208 1.00 . A A . 21 GLN HA 1 1 10 6705 1 1 21 GLN HB2 H 6.751 -1.295 12.593 1.00 . A A . 21 GLN HB2 1 1 10 6706 1 1 21 GLN HB3 H 5.633 -0.734 13.829 1.00 . A A . 21 GLN HB3 1 1 10 6707 1 1 21 GLN HE21 H 5.763 -5.016 13.975 1.00 . A A . 21 GLN HE21 1 1 10 6708 1 1 21 GLN HE22 H 5.815 -4.749 15.681 1.00 . A A . 21 GLN HE22 1 1 10 6709 1 1 21 GLN HG2 H 4.210 -2.779 12.871 1.00 . A A . 21 GLN HG2 1 1 10 6710 1 1 21 GLN HG3 H 5.830 -3.360 12.493 1.00 . A A . 21 GLN HG3 1 1 10 6711 1 1 21 GLN N N 4.781 -1.359 10.632 1.00 . A A . 21 GLN N 1 1 10 6712 1 1 21 GLN NE2 N 5.697 -4.434 14.761 1.00 . A A . 21 GLN NE2 1 1 10 6713 1 1 21 GLN O O 5.164 1.841 12.031 1.00 . A A . 21 GLN O 1 1 10 6714 1 1 21 GLN OE1 O 5.329 -2.344 15.496 1.00 . A A . 21 GLN OE1 1 1 10 6715 1 1 22 THR C C 7.465 2.052 8.729 1.00 . A A . 22 THR C 1 1 10 6716 1 1 22 THR CA C 7.277 1.977 10.242 1.00 . A A . 22 THR CA 1 1 10 6717 1 1 22 THR CB C 8.656 2.057 10.924 1.00 . A A . 22 THR CB 1 1 10 6718 1 1 22 THR CG2 C 8.505 2.280 12.421 1.00 . A A . 22 THR CG2 1 1 10 6719 1 1 22 THR H H 6.836 -0.094 10.252 1.00 . A A . 22 THR H 1 1 10 6720 1 1 22 THR HA H 6.692 2.826 10.564 1.00 . A A . 22 THR HA 1 1 10 6721 1 1 22 THR HB H 9.202 2.889 10.504 1.00 . A A . 22 THR HB 1 1 10 6722 1 1 22 THR HG1 H 8.851 0.093 10.940 1.00 . A A . 22 THR HG1 1 1 10 6723 1 1 22 THR HG21 H 9.103 1.555 12.956 1.00 . A A . 22 THR HG21 1 1 10 6724 1 1 22 THR HG22 H 7.468 2.166 12.700 1.00 . A A . 22 THR HG22 1 1 10 6725 1 1 22 THR HG23 H 8.838 3.276 12.672 1.00 . A A . 22 THR HG23 1 1 10 6726 1 1 22 THR N N 6.565 0.766 10.634 1.00 . A A . 22 THR N 1 1 10 6727 1 1 22 THR O O 8.405 2.680 8.241 1.00 . A A . 22 THR O 1 1 10 6728 1 1 22 THR OG1 O 9.389 0.848 10.689 1.00 . A A . 22 THR OG1 1 1 10 6729 1 1 23 THR C C 5.292 1.799 5.916 1.00 . A A . 23 THR C 1 1 10 6730 1 1 23 THR CA C 6.633 1.412 6.531 1.00 . A A . 23 THR CA 1 1 10 6731 1 1 23 THR CB C 7.059 0.037 5.984 1.00 . A A . 23 THR CB 1 1 10 6732 1 1 23 THR CG2 C 8.134 0.190 4.918 1.00 . A A . 23 THR CG2 1 1 10 6733 1 1 23 THR H H 5.836 0.929 8.434 1.00 . A A . 23 THR H 1 1 10 6734 1 1 23 THR HA H 7.375 2.140 6.234 1.00 . A A . 23 THR HA 1 1 10 6735 1 1 23 THR HB H 6.198 -0.441 5.540 1.00 . A A . 23 THR HB 1 1 10 6736 1 1 23 THR HG1 H 8.277 -0.334 7.492 1.00 . A A . 23 THR HG1 1 1 10 6737 1 1 23 THR HG21 H 9.095 0.323 5.391 1.00 . A A . 23 THR HG21 1 1 10 6738 1 1 23 THR HG22 H 7.912 1.051 4.305 1.00 . A A . 23 THR HG22 1 1 10 6739 1 1 23 THR HG23 H 8.156 -0.695 4.299 1.00 . A A . 23 THR HG23 1 1 10 6740 1 1 23 THR N N 6.564 1.412 7.989 1.00 . A A . 23 THR N 1 1 10 6741 1 1 23 THR O O 4.273 1.852 6.605 1.00 . A A . 23 THR O 1 1 10 6742 1 1 23 THR OG1 O 7.553 -0.783 7.050 1.00 . A A . 23 THR OG1 1 1 10 6743 1 1 24 TRP C C 4.109 1.905 2.470 1.00 . A A . 24 TRP C 1 1 10 6744 1 1 24 TRP CA C 4.089 2.455 3.898 1.00 . A A . 24 TRP CA 1 1 10 6745 1 1 24 TRP CB C 3.959 3.982 3.863 1.00 . A A . 24 TRP CB 1 1 10 6746 1 1 24 TRP CD1 C 4.025 4.951 6.235 1.00 . A A . 24 TRP CD1 1 1 10 6747 1 1 24 TRP CD2 C 1.977 4.825 5.354 1.00 . A A . 24 TRP CD2 1 1 10 6748 1 1 24 TRP CE2 C 1.871 5.358 6.649 1.00 . A A . 24 TRP CE2 1 1 10 6749 1 1 24 TRP CE3 C 0.820 4.655 4.602 1.00 . A A . 24 TRP CE3 1 1 10 6750 1 1 24 TRP CG C 3.361 4.563 5.110 1.00 . A A . 24 TRP CG 1 1 10 6751 1 1 24 TRP CH2 C -0.471 5.540 6.441 1.00 . A A . 24 TRP CH2 1 1 10 6752 1 1 24 TRP CZ2 C 0.648 5.721 7.206 1.00 . A A . 24 TRP CZ2 1 1 10 6753 1 1 24 TRP CZ3 C -0.393 5.015 5.150 1.00 . A A . 24 TRP CZ3 1 1 10 6754 1 1 24 TRP H H 6.148 2.010 4.121 1.00 . A A . 24 TRP H 1 1 10 6755 1 1 24 TRP HA H 3.241 2.039 4.429 1.00 . A A . 24 TRP HA 1 1 10 6756 1 1 24 TRP HB2 H 4.939 4.416 3.733 1.00 . A A . 24 TRP HB2 1 1 10 6757 1 1 24 TRP HB3 H 3.332 4.264 3.029 1.00 . A A . 24 TRP HB3 1 1 10 6758 1 1 24 TRP HD1 H 5.092 4.884 6.358 1.00 . A A . 24 TRP HD1 1 1 10 6759 1 1 24 TRP HE1 H 3.369 5.762 8.060 1.00 . A A . 24 TRP HE1 1 1 10 6760 1 1 24 TRP HE3 H 0.863 4.254 3.602 1.00 . A A . 24 TRP HE3 1 1 10 6761 1 1 24 TRP HH2 H -1.439 5.805 6.828 1.00 . A A . 24 TRP HH2 1 1 10 6762 1 1 24 TRP HZ2 H 0.570 6.130 8.203 1.00 . A A . 24 TRP HZ2 1 1 10 6763 1 1 24 TRP HZ3 H -1.301 4.887 4.580 1.00 . A A . 24 TRP HZ3 1 1 10 6764 1 1 24 TRP N N 5.302 2.070 4.614 1.00 . A A . 24 TRP N 1 1 10 6765 1 1 24 TRP NE1 N 3.136 5.427 7.169 1.00 . A A . 24 TRP NE1 1 1 10 6766 1 1 24 TRP O O 5.037 2.177 1.708 1.00 . A A . 24 TRP O 1 1 10 6767 1 1 25 GLY C C 2.214 1.471 -0.168 1.00 . A A . 25 GLY C 1 1 10 6768 1 1 25 GLY CA C 2.998 0.579 0.774 1.00 . A A . 25 GLY CA 1 1 10 6769 1 1 25 GLY H H 2.364 0.967 2.757 1.00 . A A . 25 GLY H 1 1 10 6770 1 1 25 GLY HA2 H 3.998 0.451 0.386 1.00 . A A . 25 GLY HA2 1 1 10 6771 1 1 25 GLY HA3 H 2.515 -0.386 0.826 1.00 . A A . 25 GLY HA3 1 1 10 6772 1 1 25 GLY N N 3.078 1.142 2.113 1.00 . A A . 25 GLY N 1 1 10 6773 1 1 25 GLY O O 1.282 2.147 0.255 1.00 . A A . 25 GLY O 1 1 10 6774 1 1 26 CYS C C 0.744 1.599 -3.082 1.00 . A A . 26 CYS C 1 1 10 6775 1 1 26 CYS CA C 1.917 2.325 -2.427 1.00 . A A . 26 CYS CA 1 1 10 6776 1 1 26 CYS CB C 2.904 2.792 -3.499 1.00 . A A . 26 CYS CB 1 1 10 6777 1 1 26 CYS H H 3.354 0.934 -1.724 1.00 . A A . 26 CYS H 1 1 10 6778 1 1 26 CYS HA H 1.536 3.192 -1.908 1.00 . A A . 26 CYS HA 1 1 10 6779 1 1 26 CYS HB2 H 3.893 2.840 -3.070 1.00 . A A . 26 CYS HB2 1 1 10 6780 1 1 26 CYS HB3 H 2.903 2.081 -4.312 1.00 . A A . 26 CYS HB3 1 1 10 6781 1 1 26 CYS N N 2.595 1.487 -1.442 1.00 . A A . 26 CYS N 1 1 10 6782 1 1 26 CYS O O 0.900 0.518 -3.649 1.00 . A A . 26 CYS O 1 1 10 6783 1 1 26 CYS SG S 2.524 4.435 -4.196 1.00 . A A . 26 CYS SG 1 1 10 6784 1 1 27 CYS C C -2.054 2.456 -4.822 1.00 . A A . 27 CYS C 1 1 10 6785 1 1 27 CYS CA C -1.651 1.664 -3.577 1.00 . A A . 27 CYS CA 1 1 10 6786 1 1 27 CYS CB C -2.788 1.697 -2.549 1.00 . A A . 27 CYS CB 1 1 10 6787 1 1 27 CYS H H -0.475 3.078 -2.532 1.00 . A A . 27 CYS H 1 1 10 6788 1 1 27 CYS HA H -1.453 0.641 -3.857 1.00 . A A . 27 CYS HA 1 1 10 6789 1 1 27 CYS HB2 H -2.742 2.627 -2.006 1.00 . A A . 27 CYS HB2 1 1 10 6790 1 1 27 CYS HB3 H -3.736 1.639 -3.064 1.00 . A A . 27 CYS HB3 1 1 10 6791 1 1 27 CYS N N -0.430 2.219 -2.998 1.00 . A A . 27 CYS N 1 1 10 6792 1 1 27 CYS O O -2.101 3.687 -4.791 1.00 . A A . 27 CYS O 1 1 10 6793 1 1 27 CYS SG S -2.730 0.347 -1.325 1.00 . A A . 27 CYS SG 1 1 10 6794 1 1 28 PRO C C -4.201 2.835 -7.205 1.00 . A A . 28 PRO C 1 1 10 6795 1 1 28 PRO CA C -2.736 2.409 -7.193 1.00 . A A . 28 PRO CA 1 1 10 6796 1 1 28 PRO CB C -2.490 1.316 -8.230 1.00 . A A . 28 PRO CB 1 1 10 6797 1 1 28 PRO CD C -2.305 0.290 -6.070 1.00 . A A . 28 PRO CD 1 1 10 6798 1 1 28 PRO CG C -2.733 0.044 -7.495 1.00 . A A . 28 PRO CG 1 1 10 6799 1 1 28 PRO HA H -2.111 3.262 -7.411 1.00 . A A . 28 PRO HA 1 1 10 6800 1 1 28 PRO HB2 H -3.178 1.436 -9.055 1.00 . A A . 28 PRO HB2 1 1 10 6801 1 1 28 PRO HB3 H -1.473 1.376 -8.589 1.00 . A A . 28 PRO HB3 1 1 10 6802 1 1 28 PRO HD2 H -2.998 -0.175 -5.383 1.00 . A A . 28 PRO HD2 1 1 10 6803 1 1 28 PRO HD3 H -1.305 -0.083 -5.907 1.00 . A A . 28 PRO HD3 1 1 10 6804 1 1 28 PRO HG2 H -3.783 -0.206 -7.532 1.00 . A A . 28 PRO HG2 1 1 10 6805 1 1 28 PRO HG3 H -2.143 -0.750 -7.929 1.00 . A A . 28 PRO HG3 1 1 10 6806 1 1 28 PRO N N -2.344 1.761 -5.938 1.00 . A A . 28 PRO N 1 1 10 6807 1 1 28 PRO O O -4.877 2.732 -8.229 1.00 . A A . 28 PRO O 1 1 10 6808 1 1 29 SER C C -6.229 4.748 -4.795 1.00 . A A . 29 SER C 1 1 10 6809 1 1 29 SER CA C -6.072 3.755 -5.945 1.00 . A A . 29 SER CA 1 1 10 6810 1 1 29 SER CB C -6.995 2.555 -5.726 1.00 . A A . 29 SER CB 1 1 10 6811 1 1 29 SER H H -4.098 3.371 -5.282 1.00 . A A . 29 SER H 1 1 10 6812 1 1 29 SER HA H -6.344 4.244 -6.868 1.00 . A A . 29 SER HA 1 1 10 6813 1 1 29 SER HB2 H -7.303 2.526 -4.691 1.00 . A A . 29 SER HB2 1 1 10 6814 1 1 29 SER HB3 H -7.866 2.655 -6.358 1.00 . A A . 29 SER HB3 1 1 10 6815 1 1 29 SER HG H -5.477 1.321 -5.621 1.00 . A A . 29 SER HG 1 1 10 6816 1 1 29 SER N N -4.685 3.313 -6.063 1.00 . A A . 29 SER N 1 1 10 6817 1 1 29 SER O O -5.453 4.727 -3.841 1.00 . A A . 29 SER O 1 1 10 6818 1 1 29 SER OG O -6.341 1.337 -6.040 1.00 . A A . 29 SER OG 1 1 10 6819 1 1 30 PRO C C -7.870 6.004 -2.490 1.00 . A A . 30 PRO C 1 1 10 6820 1 1 30 PRO CA C -7.486 6.639 -3.826 1.00 . A A . 30 PRO CA 1 1 10 6821 1 1 30 PRO CB C -8.646 7.469 -4.387 1.00 . A A . 30 PRO CB 1 1 10 6822 1 1 30 PRO CD C -8.216 5.737 -5.970 1.00 . A A . 30 PRO CD 1 1 10 6823 1 1 30 PRO CG C -9.309 6.579 -5.380 1.00 . A A . 30 PRO CG 1 1 10 6824 1 1 30 PRO HA H -6.624 7.274 -3.681 1.00 . A A . 30 PRO HA 1 1 10 6825 1 1 30 PRO HB2 H -9.318 7.739 -3.586 1.00 . A A . 30 PRO HB2 1 1 10 6826 1 1 30 PRO HB3 H -8.259 8.362 -4.855 1.00 . A A . 30 PRO HB3 1 1 10 6827 1 1 30 PRO HD2 H -8.593 4.762 -6.241 1.00 . A A . 30 PRO HD2 1 1 10 6828 1 1 30 PRO HD3 H -7.780 6.228 -6.828 1.00 . A A . 30 PRO HD3 1 1 10 6829 1 1 30 PRO HG2 H -10.038 5.955 -4.885 1.00 . A A . 30 PRO HG2 1 1 10 6830 1 1 30 PRO HG3 H -9.781 7.174 -6.149 1.00 . A A . 30 PRO HG3 1 1 10 6831 1 1 30 PRO N N -7.239 5.636 -4.870 1.00 . A A . 30 PRO N 1 1 10 6832 1 1 30 PRO O O -7.007 5.726 -1.657 1.00 . A A . 30 PRO O 1 1 10 6833 1 1 31 LYS C C -9.530 3.659 -1.095 1.00 . A A . 31 LYS C 1 1 10 6834 1 1 31 LYS CA C -9.649 5.180 -1.047 1.00 . A A . 31 LYS CA 1 1 10 6835 1 1 31 LYS CB C -11.101 5.588 -0.787 1.00 . A A . 31 LYS CB 1 1 10 6836 1 1 31 LYS CD C -12.743 6.563 0.846 1.00 . A A . 31 LYS CD 1 1 10 6837 1 1 31 LYS CE C -13.407 7.739 0.149 1.00 . A A . 31 LYS CE 1 1 10 6838 1 1 31 LYS CG C -11.279 6.440 0.458 1.00 . A A . 31 LYS CG 1 1 10 6839 1 1 31 LYS H H -9.811 6.023 -2.982 1.00 . A A . 31 LYS H 1 1 10 6840 1 1 31 LYS HA H -9.033 5.550 -0.241 1.00 . A A . 31 LYS HA 1 1 10 6841 1 1 31 LYS HB2 H -11.463 6.149 -1.637 1.00 . A A . 31 LYS HB2 1 1 10 6842 1 1 31 LYS HB3 H -11.699 4.695 -0.675 1.00 . A A . 31 LYS HB3 1 1 10 6843 1 1 31 LYS HD2 H -13.257 5.655 0.567 1.00 . A A . 31 LYS HD2 1 1 10 6844 1 1 31 LYS HD3 H -12.811 6.703 1.916 1.00 . A A . 31 LYS HD3 1 1 10 6845 1 1 31 LYS HE2 H -13.361 7.581 -0.918 1.00 . A A . 31 LYS HE2 1 1 10 6846 1 1 31 LYS HE3 H -14.440 7.789 0.460 1.00 . A A . 31 LYS HE3 1 1 10 6847 1 1 31 LYS HG2 H -10.738 5.985 1.274 1.00 . A A . 31 LYS HG2 1 1 10 6848 1 1 31 LYS HG3 H -10.882 7.427 0.266 1.00 . A A . 31 LYS HG3 1 1 10 6849 1 1 31 LYS HZ1 H -12.519 9.072 1.492 1.00 . A A . 31 LYS HZ1 1 1 10 6850 1 1 31 LYS HZ2 H -13.362 9.826 0.235 1.00 . A A . 31 LYS HZ2 1 1 10 6851 1 1 31 LYS HZ3 H -11.854 9.121 -0.063 1.00 . A A . 31 LYS HZ3 1 1 10 6852 1 1 31 LYS N N -9.166 5.779 -2.286 1.00 . A A . 31 LYS N 1 1 10 6853 1 1 31 LYS NZ N -12.739 9.030 0.476 1.00 . A A . 31 LYS NZ 1 1 10 6854 1 1 31 LYS O O -10.480 2.938 -0.786 1.00 . A A . 31 LYS O 1 1 10 6855 1 1 32 ALA C C -8.225 1.074 -0.211 1.00 . A A . 32 ALA C 1 1 10 6856 1 1 32 ALA CA C -8.095 1.747 -1.574 1.00 . A A . 32 ALA CA 1 1 10 6857 1 1 32 ALA CB C -6.708 1.500 -2.150 1.00 . A A . 32 ALA CB 1 1 10 6858 1 1 32 ALA H H -7.636 3.806 -1.715 1.00 . A A . 32 ALA H 1 1 10 6859 1 1 32 ALA HA H -8.820 1.316 -2.252 1.00 . A A . 32 ALA HA 1 1 10 6860 1 1 32 ALA HB1 H -5.962 1.815 -1.436 1.00 . A A . 32 ALA HB1 1 1 10 6861 1 1 32 ALA HB2 H -6.593 2.064 -3.064 1.00 . A A . 32 ALA HB2 1 1 10 6862 1 1 32 ALA HB3 H -6.586 0.448 -2.358 1.00 . A A . 32 ALA HB3 1 1 10 6863 1 1 32 ALA N N -8.352 3.179 -1.484 1.00 . A A . 32 ALA N 1 1 10 6864 1 1 32 ALA O O -8.272 1.740 0.823 1.00 . A A . 32 ALA O 1 1 10 6865 1 1 33 VAL C C -7.170 -1.953 1.142 1.00 . A A . 33 VAL C 1 1 10 6866 1 1 33 VAL CA C -8.380 -1.039 1.000 1.00 . A A . 33 VAL CA 1 1 10 6867 1 1 33 VAL CB C -9.660 -1.899 1.006 1.00 . A A . 33 VAL CB 1 1 10 6868 1 1 33 VAL CG1 C -10.286 -1.919 2.392 1.00 . A A . 33 VAL CG1 1 1 10 6869 1 1 33 VAL CG2 C -10.656 -1.393 -0.028 1.00 . A A . 33 VAL CG2 1 1 10 6870 1 1 33 VAL H H -8.217 -0.720 -1.079 1.00 . A A . 33 VAL H 1 1 10 6871 1 1 33 VAL HA H -8.414 -0.359 1.839 1.00 . A A . 33 VAL HA 1 1 10 6872 1 1 33 VAL HB H -9.387 -2.911 0.745 1.00 . A A . 33 VAL HB 1 1 10 6873 1 1 33 VAL HG11 H -10.183 -2.905 2.820 1.00 . A A . 33 VAL HG11 1 1 10 6874 1 1 33 VAL HG12 H -11.333 -1.666 2.317 1.00 . A A . 33 VAL HG12 1 1 10 6875 1 1 33 VAL HG13 H -9.786 -1.199 3.023 1.00 . A A . 33 VAL HG13 1 1 10 6876 1 1 33 VAL HG21 H -10.409 -1.802 -0.995 1.00 . A A . 33 VAL HG21 1 1 10 6877 1 1 33 VAL HG22 H -10.613 -0.315 -0.070 1.00 . A A . 33 VAL HG22 1 1 10 6878 1 1 33 VAL HG23 H -11.653 -1.704 0.252 1.00 . A A . 33 VAL HG23 1 1 10 6879 1 1 33 VAL N N -8.270 -0.253 -0.223 1.00 . A A . 33 VAL N 1 1 10 6880 1 1 33 VAL O O -7.079 -2.980 0.469 1.00 . A A . 33 VAL O 1 1 10 6881 1 1 34 CYS C C -5.322 -3.722 2.811 1.00 . A A . 34 CYS C 1 1 10 6882 1 1 34 CYS CA C -5.023 -2.356 2.201 1.00 . A A . 34 CYS CA 1 1 10 6883 1 1 34 CYS CB C -4.023 -1.610 3.087 1.00 . A A . 34 CYS CB 1 1 10 6884 1 1 34 CYS H H -6.351 -0.735 2.503 1.00 . A A . 34 CYS H 1 1 10 6885 1 1 34 CYS HA H -4.576 -2.505 1.235 1.00 . A A . 34 CYS HA 1 1 10 6886 1 1 34 CYS HB2 H -4.066 -0.551 2.871 1.00 . A A . 34 CYS HB2 1 1 10 6887 1 1 34 CYS HB3 H -4.277 -1.772 4.124 1.00 . A A . 34 CYS HB3 1 1 10 6888 1 1 34 CYS N N -6.234 -1.570 2.002 1.00 . A A . 34 CYS N 1 1 10 6889 1 1 34 CYS O O -5.676 -3.819 3.986 1.00 . A A . 34 CYS O 1 1 10 6890 1 1 34 CYS SG S -2.306 -2.162 2.842 1.00 . A A . 34 CYS SG 1 1 10 6891 1 1 35 CYS C C -4.481 -6.382 3.713 1.00 . A A . 35 CYS C 1 1 10 6892 1 1 35 CYS CA C -5.369 -6.137 2.501 1.00 . A A . 35 CYS CA 1 1 10 6893 1 1 35 CYS CB C -5.074 -7.162 1.407 1.00 . A A . 35 CYS CB 1 1 10 6894 1 1 35 CYS H H -4.843 -4.641 1.093 1.00 . A A . 35 CYS H 1 1 10 6895 1 1 35 CYS HA H -6.403 -6.220 2.801 1.00 . A A . 35 CYS HA 1 1 10 6896 1 1 35 CYS HB2 H -4.879 -6.643 0.480 1.00 . A A . 35 CYS HB2 1 1 10 6897 1 1 35 CYS HB3 H -4.201 -7.733 1.684 1.00 . A A . 35 CYS HB3 1 1 10 6898 1 1 35 CYS N N -5.147 -4.779 2.015 1.00 . A A . 35 CYS N 1 1 10 6899 1 1 35 CYS O O -3.246 -6.360 3.607 1.00 . A A . 35 CYS O 1 1 10 6900 1 1 35 CYS SG S -6.433 -8.337 1.107 1.00 . A A . 35 CYS SG 1 1 10 6901 1 1 36 ASP C C -4.248 -8.262 6.480 1.00 . A A . 36 ASP C 1 1 10 6902 1 1 36 ASP CA C -4.419 -6.788 6.121 1.00 . A A . 36 ASP CA 1 1 10 6903 1 1 36 ASP CB C -5.154 -6.071 7.253 1.00 . A A . 36 ASP CB 1 1 10 6904 1 1 36 ASP CG C -4.204 -5.441 8.251 1.00 . A A . 36 ASP CG 1 1 10 6905 1 1 36 ASP H H -6.105 -6.572 4.859 1.00 . A A . 36 ASP H 1 1 10 6906 1 1 36 ASP HA H -3.439 -6.347 6.019 1.00 . A A . 36 ASP HA 1 1 10 6907 1 1 36 ASP HB2 H -5.776 -5.293 6.834 1.00 . A A . 36 ASP HB2 1 1 10 6908 1 1 36 ASP HB3 H -5.778 -6.782 7.775 1.00 . A A . 36 ASP HB3 1 1 10 6909 1 1 36 ASP N N -5.124 -6.582 4.862 1.00 . A A . 36 ASP N 1 1 10 6910 1 1 36 ASP O O -3.468 -8.584 7.376 1.00 . A A . 36 ASP O 1 1 10 6911 1 1 36 ASP OD1 O -4.379 -5.673 9.466 1.00 . A A . 36 ASP OD1 1 1 10 6912 1 1 36 ASP OD2 O -3.284 -4.715 7.819 1.00 . A A . 36 ASP OD2 1 1 10 6913 1 1 37 ASP C C -3.374 -11.004 6.030 1.00 . A A . 37 ASP C 1 1 10 6914 1 1 37 ASP CA C -4.836 -10.584 6.094 1.00 . A A . 37 ASP CA 1 1 10 6915 1 1 37 ASP CB C -5.664 -11.410 5.108 1.00 . A A . 37 ASP CB 1 1 10 6916 1 1 37 ASP CG C -6.858 -12.071 5.770 1.00 . A A . 37 ASP CG 1 1 10 6917 1 1 37 ASP H H -5.572 -8.882 5.087 1.00 . A A . 37 ASP H 1 1 10 6918 1 1 37 ASP HA H -5.205 -10.751 7.096 1.00 . A A . 37 ASP HA 1 1 10 6919 1 1 37 ASP HB2 H -6.025 -10.764 4.321 1.00 . A A . 37 ASP HB2 1 1 10 6920 1 1 37 ASP HB3 H -5.041 -12.180 4.680 1.00 . A A . 37 ASP HB3 1 1 10 6921 1 1 37 ASP N N -4.959 -9.160 5.799 1.00 . A A . 37 ASP N 1 1 10 6922 1 1 37 ASP O O -2.886 -11.748 6.882 1.00 . A A . 37 ASP O 1 1 10 6923 1 1 37 ASP OD1 O -7.924 -12.155 5.125 1.00 . A A . 37 ASP OD1 1 1 10 6924 1 1 37 ASP OD2 O -6.726 -12.505 6.935 1.00 . A A . 37 ASP OD2 1 1 10 6925 1 1 38 MET C C -0.514 -9.487 4.550 1.00 . A A . 38 MET C 1 1 10 6926 1 1 38 MET CA C -1.267 -10.785 4.830 1.00 . A A . 38 MET CA 1 1 10 6927 1 1 38 MET CB C -1.066 -11.777 3.681 1.00 . A A . 38 MET CB 1 1 10 6928 1 1 38 MET CE C -2.068 -15.278 5.321 1.00 . A A . 38 MET CE 1 1 10 6929 1 1 38 MET CG C -1.978 -12.991 3.757 1.00 . A A . 38 MET CG 1 1 10 6930 1 1 38 MET H H -3.131 -9.902 4.385 1.00 . A A . 38 MET H 1 1 10 6931 1 1 38 MET HA H -0.889 -11.218 5.744 1.00 . A A . 38 MET HA 1 1 10 6932 1 1 38 MET HB2 H -1.254 -11.270 2.746 1.00 . A A . 38 MET HB2 1 1 10 6933 1 1 38 MET HB3 H -0.042 -12.122 3.694 1.00 . A A . 38 MET HB3 1 1 10 6934 1 1 38 MET HE1 H -2.979 -14.712 5.450 1.00 . A A . 38 MET HE1 1 1 10 6935 1 1 38 MET HE2 H -1.515 -15.284 6.249 1.00 . A A . 38 MET HE2 1 1 10 6936 1 1 38 MET HE3 H -2.311 -16.292 5.041 1.00 . A A . 38 MET HE3 1 1 10 6937 1 1 38 MET HG2 H -2.677 -12.849 4.567 1.00 . A A . 38 MET HG2 1 1 10 6938 1 1 38 MET HG3 H -2.520 -13.075 2.826 1.00 . A A . 38 MET HG3 1 1 10 6939 1 1 38 MET N N -2.680 -10.498 5.018 1.00 . A A . 38 MET N 1 1 10 6940 1 1 38 MET O O -0.140 -8.766 5.475 1.00 . A A . 38 MET O 1 1 10 6941 1 1 38 MET SD S -1.071 -14.525 4.037 1.00 . A A . 38 MET SD 1 1 10 6942 1 1 39 GLN C C -0.123 -7.540 1.465 1.00 . A A . 39 GLN C 1 1 10 6943 1 1 39 GLN CA C 0.326 -7.936 2.870 1.00 . A A . 39 GLN CA 1 1 10 6944 1 1 39 GLN CB C 1.847 -8.104 2.912 1.00 . A A . 39 GLN CB 1 1 10 6945 1 1 39 GLN CD C 3.534 -7.987 4.794 1.00 . A A . 39 GLN CD 1 1 10 6946 1 1 39 GLN CG C 2.528 -7.226 3.951 1.00 . A A . 39 GLN CG 1 1 10 6947 1 1 39 GLN H H -0.698 -9.752 2.571 1.00 . A A . 39 GLN H 1 1 10 6948 1 1 39 GLN HA H 0.035 -7.161 3.564 1.00 . A A . 39 GLN HA 1 1 10 6949 1 1 39 GLN HB2 H 2.078 -9.135 3.137 1.00 . A A . 39 GLN HB2 1 1 10 6950 1 1 39 GLN HB3 H 2.253 -7.857 1.943 1.00 . A A . 39 GLN HB3 1 1 10 6951 1 1 39 GLN HE21 H 3.872 -6.368 5.897 1.00 . A A . 39 GLN HE21 1 1 10 6952 1 1 39 GLN HE22 H 4.775 -7.775 6.334 1.00 . A A . 39 GLN HE22 1 1 10 6953 1 1 39 GLN HG2 H 3.042 -6.424 3.444 1.00 . A A . 39 GLN HG2 1 1 10 6954 1 1 39 GLN HG3 H 1.774 -6.813 4.605 1.00 . A A . 39 GLN HG3 1 1 10 6955 1 1 39 GLN N N -0.333 -9.171 3.271 1.00 . A A . 39 GLN N 1 1 10 6956 1 1 39 GLN NE2 N 4.119 -7.308 5.774 1.00 . A A . 39 GLN NE2 1 1 10 6957 1 1 39 GLN O O 0.560 -7.853 0.489 1.00 . A A . 39 GLN O 1 1 10 6958 1 1 39 GLN OE1 O 3.783 -9.172 4.567 1.00 . A A . 39 GLN OE1 1 1 10 6959 1 1 40 HIS C C -2.613 -5.241 0.014 1.00 . A A . 40 HIS C 1 1 10 6960 1 1 40 HIS CA C -1.756 -6.502 0.013 1.00 . A A . 40 HIS CA 1 1 10 6961 1 1 40 HIS CB C -2.538 -7.662 -0.608 1.00 . A A . 40 HIS CB 1 1 10 6962 1 1 40 HIS CD2 C -1.315 -8.683 -2.655 1.00 . A A . 40 HIS CD2 1 1 10 6963 1 1 40 HIS CE1 C -2.416 -7.638 -4.238 1.00 . A A . 40 HIS CE1 1 1 10 6964 1 1 40 HIS CG C -2.230 -7.884 -2.056 1.00 . A A . 40 HIS CG 1 1 10 6965 1 1 40 HIS H H -1.806 -6.669 2.149 1.00 . A A . 40 HIS H 1 1 10 6966 1 1 40 HIS HA H -0.887 -6.317 -0.600 1.00 . A A . 40 HIS HA 1 1 10 6967 1 1 40 HIS HB2 H -2.304 -8.571 -0.075 1.00 . A A . 40 HIS HB2 1 1 10 6968 1 1 40 HIS HB3 H -3.596 -7.461 -0.520 1.00 . A A . 40 HIS HB3 1 1 10 6969 1 1 40 HIS HD1 H -3.629 -6.595 -2.962 1.00 . A A . 40 HIS HD1 1 1 10 6970 1 1 40 HIS HD2 H -0.608 -9.333 -2.159 1.00 . A A . 40 HIS HD2 1 1 10 6971 1 1 40 HIS HE1 H -2.749 -7.303 -5.209 1.00 . A A . 40 HIS HE1 1 1 10 6972 1 1 40 HIS HE2 H -0.968 -9.012 -4.700 1.00 . A A . 40 HIS HE2 1 1 10 6973 1 1 40 HIS N N -1.275 -6.877 1.344 1.00 . A A . 40 HIS N 1 1 10 6974 1 1 40 HIS ND1 N -2.903 -7.243 -3.075 1.00 . A A . 40 HIS ND1 1 1 10 6975 1 1 40 HIS NE2 N -1.451 -8.511 -4.011 1.00 . A A . 40 HIS NE2 1 1 10 6976 1 1 40 HIS O O -2.759 -4.567 1.032 1.00 . A A . 40 HIS O 1 1 10 6977 1 1 41 CYS C C -5.156 -4.064 -2.310 1.00 . A A . 41 CYS C 1 1 10 6978 1 1 41 CYS CA C -4.008 -3.760 -1.350 1.00 . A A . 41 CYS CA 1 1 10 6979 1 1 41 CYS CB C -3.171 -2.597 -1.887 1.00 . A A . 41 CYS CB 1 1 10 6980 1 1 41 CYS H H -2.992 -5.522 -1.926 1.00 . A A . 41 CYS H 1 1 10 6981 1 1 41 CYS HA H -4.418 -3.489 -0.394 1.00 . A A . 41 CYS HA 1 1 10 6982 1 1 41 CYS HB2 H -2.326 -2.440 -1.233 1.00 . A A . 41 CYS HB2 1 1 10 6983 1 1 41 CYS HB3 H -2.811 -2.850 -2.873 1.00 . A A . 41 CYS HB3 1 1 10 6984 1 1 41 CYS N N -3.165 -4.936 -1.161 1.00 . A A . 41 CYS N 1 1 10 6985 1 1 41 CYS O O -5.020 -4.894 -3.210 1.00 . A A . 41 CYS O 1 1 10 6986 1 1 41 CYS SG S -4.068 -1.016 -2.015 1.00 . A A . 41 CYS SG 1 1 10 6987 1 1 42 CYS C C -7.944 -2.253 -3.530 1.00 . A A . 42 CYS C 1 1 10 6988 1 1 42 CYS CA C -7.453 -3.585 -2.963 1.00 . A A . 42 CYS CA 1 1 10 6989 1 1 42 CYS CB C -8.574 -4.260 -2.170 1.00 . A A . 42 CYS CB 1 1 10 6990 1 1 42 CYS H H -6.333 -2.737 -1.381 1.00 . A A . 42 CYS H 1 1 10 6991 1 1 42 CYS HA H -7.164 -4.228 -3.781 1.00 . A A . 42 CYS HA 1 1 10 6992 1 1 42 CYS HB2 H -8.618 -3.825 -1.183 1.00 . A A . 42 CYS HB2 1 1 10 6993 1 1 42 CYS HB3 H -9.513 -4.089 -2.674 1.00 . A A . 42 CYS HB3 1 1 10 6994 1 1 42 CYS N N -6.284 -3.387 -2.114 1.00 . A A . 42 CYS N 1 1 10 6995 1 1 42 CYS O O -8.065 -1.270 -2.802 1.00 . A A . 42 CYS O 1 1 10 6996 1 1 42 CYS SG S -8.370 -6.061 -1.970 1.00 . A A . 42 CYS SG 1 1 10 6997 1 1 43 PRO C C -9.939 -0.382 -4.826 1.00 . A A . 43 PRO C 1 1 10 6998 1 1 43 PRO CA C -8.704 -0.970 -5.500 1.00 . A A . 43 PRO CA 1 1 10 6999 1 1 43 PRO CB C -9.040 -1.436 -6.918 1.00 . A A . 43 PRO CB 1 1 10 7000 1 1 43 PRO CD C -8.108 -3.316 -5.796 1.00 . A A . 43 PRO CD 1 1 10 7001 1 1 43 PRO CG C -8.173 -2.625 -7.128 1.00 . A A . 43 PRO CG 1 1 10 7002 1 1 43 PRO HA H -7.928 -0.220 -5.541 1.00 . A A . 43 PRO HA 1 1 10 7003 1 1 43 PRO HB2 H -10.089 -1.693 -6.977 1.00 . A A . 43 PRO HB2 1 1 10 7004 1 1 43 PRO HB3 H -8.814 -0.652 -7.623 1.00 . A A . 43 PRO HB3 1 1 10 7005 1 1 43 PRO HD2 H -8.928 -4.010 -5.688 1.00 . A A . 43 PRO HD2 1 1 10 7006 1 1 43 PRO HD3 H -7.162 -3.823 -5.677 1.00 . A A . 43 PRO HD3 1 1 10 7007 1 1 43 PRO HG2 H -8.608 -3.276 -7.872 1.00 . A A . 43 PRO HG2 1 1 10 7008 1 1 43 PRO HG3 H -7.186 -2.308 -7.432 1.00 . A A . 43 PRO HG3 1 1 10 7009 1 1 43 PRO N N -8.230 -2.198 -4.843 1.00 . A A . 43 PRO N 1 1 10 7010 1 1 43 PRO O O -10.850 -1.111 -4.431 1.00 . A A . 43 PRO O 1 1 10 7011 1 1 44 ALA C C -12.405 1.145 -4.594 1.00 . A A . 44 ALA C 1 1 10 7012 1 1 44 ALA CA C -11.065 1.649 -4.069 1.00 . A A . 44 ALA CA 1 1 10 7013 1 1 44 ALA CB C -10.937 3.148 -4.300 1.00 . A A . 44 ALA CB 1 1 10 7014 1 1 44 ALA H H -9.187 1.456 -5.028 1.00 . A A . 44 ALA H 1 1 10 7015 1 1 44 ALA HA H -11.016 1.469 -3.005 1.00 . A A . 44 ALA HA 1 1 10 7016 1 1 44 ALA HB1 H -11.707 3.475 -4.983 1.00 . A A . 44 ALA HB1 1 1 10 7017 1 1 44 ALA HB2 H -9.966 3.364 -4.723 1.00 . A A . 44 ALA HB2 1 1 10 7018 1 1 44 ALA HB3 H -11.044 3.667 -3.360 1.00 . A A . 44 ALA HB3 1 1 10 7019 1 1 44 ALA N N -9.953 0.944 -4.696 1.00 . A A . 44 ALA N 1 1 10 7020 1 1 44 ALA O O -12.785 1.427 -5.730 1.00 . A A . 44 ALA O 1 1 10 7021 1 1 45 GLY C C -14.387 -1.667 -4.190 1.00 . A A . 45 GLY C 1 1 10 7022 1 1 45 GLY CA C -14.397 -0.152 -4.152 1.00 . A A . 45 GLY CA 1 1 10 7023 1 1 45 GLY H H -12.753 0.196 -2.867 1.00 . A A . 45 GLY H 1 1 10 7024 1 1 45 GLY HA2 H -15.148 0.178 -3.448 1.00 . A A . 45 GLY HA2 1 1 10 7025 1 1 45 GLY HA3 H -14.649 0.221 -5.134 1.00 . A A . 45 GLY HA3 1 1 10 7026 1 1 45 GLY N N -13.112 0.392 -3.759 1.00 . A A . 45 GLY N 1 1 10 7027 1 1 45 GLY O O -15.373 -2.292 -4.583 1.00 . A A . 45 GLY O 1 1 10 7028 1 1 46 TYR C C -12.950 -4.222 -2.341 1.00 . A A . 46 TYR C 1 1 10 7029 1 1 46 TYR CA C -13.123 -3.708 -3.766 1.00 . A A . 46 TYR CA 1 1 10 7030 1 1 46 TYR CB C -11.925 -4.131 -4.618 1.00 . A A . 46 TYR CB 1 1 10 7031 1 1 46 TYR CD1 C -12.266 -5.235 -6.863 1.00 . A A . 46 TYR CD1 1 1 10 7032 1 1 46 TYR CD2 C -12.346 -2.855 -6.758 1.00 . A A . 46 TYR CD2 1 1 10 7033 1 1 46 TYR CE1 C -12.501 -5.187 -8.223 1.00 . A A . 46 TYR CE1 1 1 10 7034 1 1 46 TYR CE2 C -12.582 -2.798 -8.117 1.00 . A A . 46 TYR CE2 1 1 10 7035 1 1 46 TYR CG C -12.185 -4.072 -6.107 1.00 . A A . 46 TYR CG 1 1 10 7036 1 1 46 TYR CZ C -12.658 -3.966 -8.846 1.00 . A A . 46 TYR CZ 1 1 10 7037 1 1 46 TYR H H -12.519 -1.701 -3.480 1.00 . A A . 46 TYR H 1 1 10 7038 1 1 46 TYR HA H -14.021 -4.135 -4.184 1.00 . A A . 46 TYR HA 1 1 10 7039 1 1 46 TYR HB2 H -11.090 -3.481 -4.402 1.00 . A A . 46 TYR HB2 1 1 10 7040 1 1 46 TYR HB3 H -11.656 -5.146 -4.368 1.00 . A A . 46 TYR HB3 1 1 10 7041 1 1 46 TYR HD1 H -12.144 -6.189 -6.372 1.00 . A A . 46 TYR HD1 1 1 10 7042 1 1 46 TYR HD2 H -12.285 -1.941 -6.184 1.00 . A A . 46 TYR HD2 1 1 10 7043 1 1 46 TYR HE1 H -12.563 -6.103 -8.793 1.00 . A A . 46 TYR HE1 1 1 10 7044 1 1 46 TYR HE2 H -12.705 -1.843 -8.605 1.00 . A A . 46 TYR HE2 1 1 10 7045 1 1 46 TYR HH H -13.309 -3.079 -10.422 1.00 . A A . 46 TYR HH 1 1 10 7046 1 1 46 TYR N N -13.268 -2.256 -3.780 1.00 . A A . 46 TYR N 1 1 10 7047 1 1 46 TYR O O -12.729 -3.444 -1.412 1.00 . A A . 46 TYR O 1 1 10 7048 1 1 46 TYR OH O -12.894 -3.915 -10.201 1.00 . A A . 46 TYR OH 1 1 10 7049 1 1 47 LYS C C -11.868 -7.278 -0.906 1.00 . A A . 47 LYS C 1 1 10 7050 1 1 47 LYS CA C -12.903 -6.158 -0.867 1.00 . A A . 47 LYS CA 1 1 10 7051 1 1 47 LYS CB C -14.248 -6.705 -0.384 1.00 . A A . 47 LYS CB 1 1 10 7052 1 1 47 LYS CD C -15.155 -9.049 -0.350 1.00 . A A . 47 LYS CD 1 1 10 7053 1 1 47 LYS CE C -16.641 -9.351 -0.443 1.00 . A A . 47 LYS CE 1 1 10 7054 1 1 47 LYS CG C -14.773 -7.862 -1.220 1.00 . A A . 47 LYS CG 1 1 10 7055 1 1 47 LYS H H -13.226 -6.104 -2.957 1.00 . A A . 47 LYS H 1 1 10 7056 1 1 47 LYS HA H -12.567 -5.398 -0.178 1.00 . A A . 47 LYS HA 1 1 10 7057 1 1 47 LYS HB2 H -14.139 -7.047 0.636 1.00 . A A . 47 LYS HB2 1 1 10 7058 1 1 47 LYS HB3 H -14.978 -5.909 -0.411 1.00 . A A . 47 LYS HB3 1 1 10 7059 1 1 47 LYS HD2 H -14.601 -9.915 -0.677 1.00 . A A . 47 LYS HD2 1 1 10 7060 1 1 47 LYS HD3 H -14.905 -8.826 0.677 1.00 . A A . 47 LYS HD3 1 1 10 7061 1 1 47 LYS HE2 H -17.160 -8.777 0.311 1.00 . A A . 47 LYS HE2 1 1 10 7062 1 1 47 LYS HE3 H -16.994 -9.061 -1.422 1.00 . A A . 47 LYS HE3 1 1 10 7063 1 1 47 LYS HG2 H -15.645 -7.533 -1.765 1.00 . A A . 47 LYS HG2 1 1 10 7064 1 1 47 LYS HG3 H -14.005 -8.168 -1.915 1.00 . A A . 47 LYS HG3 1 1 10 7065 1 1 47 LYS HZ1 H -16.059 -11.298 0.044 1.00 . A A . 47 LYS HZ1 1 1 10 7066 1 1 47 LYS HZ2 H -17.295 -11.220 -1.109 1.00 . A A . 47 LYS HZ2 1 1 10 7067 1 1 47 LYS HZ3 H -17.637 -10.915 0.519 1.00 . A A . 47 LYS HZ3 1 1 10 7068 1 1 47 LYS N N -13.050 -5.537 -2.177 1.00 . A A . 47 LYS N 1 1 10 7069 1 1 47 LYS NZ N -16.928 -10.797 -0.233 1.00 . A A . 47 LYS NZ 1 1 10 7070 1 1 47 LYS O O -11.567 -7.823 -1.969 1.00 . A A . 47 LYS O 1 1 10 7071 1 1 48 CYS C C -10.984 -10.035 0.477 1.00 . A A . 48 CYS C 1 1 10 7072 1 1 48 CYS CA C -10.325 -8.664 0.369 1.00 . A A . 48 CYS CA 1 1 10 7073 1 1 48 CYS CB C -9.428 -8.418 1.585 1.00 . A A . 48 CYS CB 1 1 10 7074 1 1 48 CYS H H -11.613 -7.134 1.068 1.00 . A A . 48 CYS H 1 1 10 7075 1 1 48 CYS HA H -9.721 -8.637 -0.525 1.00 . A A . 48 CYS HA 1 1 10 7076 1 1 48 CYS HB2 H -10.034 -8.056 2.401 1.00 . A A . 48 CYS HB2 1 1 10 7077 1 1 48 CYS HB3 H -8.963 -9.349 1.873 1.00 . A A . 48 CYS HB3 1 1 10 7078 1 1 48 CYS N N -11.329 -7.611 0.261 1.00 . A A . 48 CYS N 1 1 10 7079 1 1 48 CYS O O -12.042 -10.180 1.090 1.00 . A A . 48 CYS O 1 1 10 7080 1 1 48 CYS SG S -8.105 -7.200 1.296 1.00 . A A . 48 CYS SG 1 1 10 7081 1 1 49 GLY C C -9.800 -13.442 -0.126 1.00 . A A . 49 GLY C 1 1 10 7082 1 1 49 GLY CA C -10.887 -12.383 -0.086 1.00 . A A . 49 GLY CA 1 1 10 7083 1 1 49 GLY H H -9.511 -10.859 -0.598 1.00 . A A . 49 GLY H 1 1 10 7084 1 1 49 GLY HA2 H -11.460 -12.506 0.821 1.00 . A A . 49 GLY HA2 1 1 10 7085 1 1 49 GLY HA3 H -11.541 -12.523 -0.934 1.00 . A A . 49 GLY HA3 1 1 10 7086 1 1 49 GLY N N -10.351 -11.036 -0.124 1.00 . A A . 49 GLY N 1 1 10 7087 1 1 49 GLY O O -8.616 -13.114 -0.213 1.00 . A A . 49 GLY O 1 1 10 7088 1 1 50 PRO C C -8.474 -15.932 -1.432 1.00 . A A . 50 PRO C 1 1 10 7089 1 1 50 PRO CA C -9.202 -15.836 -0.096 1.00 . A A . 50 PRO CA 1 1 10 7090 1 1 50 PRO CB C -10.065 -17.082 0.130 1.00 . A A . 50 PRO CB 1 1 10 7091 1 1 50 PRO CD C -11.559 -15.222 0.038 1.00 . A A . 50 PRO CD 1 1 10 7092 1 1 50 PRO CG C -11.436 -16.681 -0.294 1.00 . A A . 50 PRO CG 1 1 10 7093 1 1 50 PRO HA H -8.479 -15.747 0.700 1.00 . A A . 50 PRO HA 1 1 10 7094 1 1 50 PRO HB2 H -9.688 -17.897 -0.471 1.00 . A A . 50 PRO HB2 1 1 10 7095 1 1 50 PRO HB3 H -10.039 -17.356 1.175 1.00 . A A . 50 PRO HB3 1 1 10 7096 1 1 50 PRO HD2 H -12.198 -14.724 -0.677 1.00 . A A . 50 PRO HD2 1 1 10 7097 1 1 50 PRO HD3 H -11.939 -15.092 1.041 1.00 . A A . 50 PRO HD3 1 1 10 7098 1 1 50 PRO HG2 H -11.552 -16.835 -1.357 1.00 . A A . 50 PRO HG2 1 1 10 7099 1 1 50 PRO HG3 H -12.171 -17.253 0.252 1.00 . A A . 50 PRO HG3 1 1 10 7100 1 1 50 PRO N N -10.171 -14.734 -0.066 1.00 . A A . 50 PRO N 1 1 10 7101 1 1 50 PRO O O -9.051 -15.667 -2.486 1.00 . A A . 50 PRO O 1 1 10 7102 1 1 51 GLY C C -5.566 -15.220 -2.868 1.00 . A A . 51 GLY C 1 1 10 7103 1 1 51 GLY CA C -6.411 -16.446 -2.588 1.00 . A A . 51 GLY CA 1 1 10 7104 1 1 51 GLY H H -6.797 -16.517 -0.508 1.00 . A A . 51 GLY H 1 1 10 7105 1 1 51 GLY HA2 H -5.760 -17.300 -2.487 1.00 . A A . 51 GLY HA2 1 1 10 7106 1 1 51 GLY HA3 H -7.076 -16.610 -3.424 1.00 . A A . 51 GLY HA3 1 1 10 7107 1 1 51 GLY N N -7.202 -16.316 -1.378 1.00 . A A . 51 GLY N 1 1 10 7108 1 1 51 GLY O O -5.039 -15.060 -3.970 1.00 . A A . 51 GLY O 1 1 10 7109 1 1 52 GLY C C -5.085 -12.305 -3.205 1.00 . A A . 52 GLY C 1 1 10 7110 1 1 52 GLY CA C -4.641 -13.146 -2.024 1.00 . A A . 52 GLY CA 1 1 10 7111 1 1 52 GLY H H -5.873 -14.538 -1.011 1.00 . A A . 52 GLY H 1 1 10 7112 1 1 52 GLY HA2 H -4.726 -12.555 -1.124 1.00 . A A . 52 GLY HA2 1 1 10 7113 1 1 52 GLY HA3 H -3.607 -13.423 -2.162 1.00 . A A . 52 GLY HA3 1 1 10 7114 1 1 52 GLY N N -5.432 -14.355 -1.867 1.00 . A A . 52 GLY N 1 1 10 7115 1 1 52 GLY O O -4.255 -11.742 -3.919 1.00 . A A . 52 GLY O 1 1 10 7116 1 1 53 THR C C -8.097 -10.559 -4.063 1.00 . A A . 53 THR C 1 1 10 7117 1 1 53 THR CA C -6.942 -11.443 -4.521 1.00 . A A . 53 THR CA 1 1 10 7118 1 1 53 THR CB C -7.432 -12.358 -5.658 1.00 . A A . 53 THR CB 1 1 10 7119 1 1 53 THR CG2 C -6.262 -12.868 -6.485 1.00 . A A . 53 THR CG2 1 1 10 7120 1 1 53 THR H H -7.007 -12.694 -2.813 1.00 . A A . 53 THR H 1 1 10 7121 1 1 53 THR HA H -6.152 -10.815 -4.907 1.00 . A A . 53 THR HA 1 1 10 7122 1 1 53 THR HB H -8.086 -11.787 -6.302 1.00 . A A . 53 THR HB 1 1 10 7123 1 1 53 THR HG1 H -7.931 -14.266 -5.597 1.00 . A A . 53 THR HG1 1 1 10 7124 1 1 53 THR HG21 H -6.632 -13.475 -7.298 1.00 . A A . 53 THR HG21 1 1 10 7125 1 1 53 THR HG22 H -5.611 -13.463 -5.860 1.00 . A A . 53 THR HG22 1 1 10 7126 1 1 53 THR HG23 H -5.709 -12.030 -6.884 1.00 . A A . 53 THR HG23 1 1 10 7127 1 1 53 THR N N -6.395 -12.220 -3.414 1.00 . A A . 53 THR N 1 1 10 7128 1 1 53 THR O O -8.725 -10.819 -3.036 1.00 . A A . 53 THR O 1 1 10 7129 1 1 53 THR OG1 O -8.159 -13.467 -5.117 1.00 . A A . 53 THR OG1 1 1 10 7130 1 1 54 CYS C C -10.683 -8.880 -5.387 1.00 . A A . 54 CYS C 1 1 10 7131 1 1 54 CYS CA C -9.459 -8.590 -4.525 1.00 . A A . 54 CYS CA 1 1 10 7132 1 1 54 CYS CB C -9.004 -7.144 -4.736 1.00 . A A . 54 CYS CB 1 1 10 7133 1 1 54 CYS H H -7.841 -9.365 -5.647 1.00 . A A . 54 CYS H 1 1 10 7134 1 1 54 CYS HA H -9.723 -8.728 -3.486 1.00 . A A . 54 CYS HA 1 1 10 7135 1 1 54 CYS HB2 H -8.743 -7.006 -5.774 1.00 . A A . 54 CYS HB2 1 1 10 7136 1 1 54 CYS HB3 H -9.817 -6.479 -4.484 1.00 . A A . 54 CYS HB3 1 1 10 7137 1 1 54 CYS N N -8.376 -9.515 -4.839 1.00 . A A . 54 CYS N 1 1 10 7138 1 1 54 CYS O O -10.559 -9.159 -6.581 1.00 . A A . 54 CYS O 1 1 10 7139 1 1 54 CYS SG S -7.561 -6.661 -3.733 1.00 . A A . 54 CYS SG 1 1 10 7140 1 1 55 ILE C C -14.090 -7.926 -5.348 1.00 . A A . 55 ILE C 1 1 10 7141 1 1 55 ILE CA C -13.106 -9.081 -5.497 1.00 . A A . 55 ILE CA 1 1 10 7142 1 1 55 ILE CB C -13.780 -10.380 -5.009 1.00 . A A . 55 ILE CB 1 1 10 7143 1 1 55 ILE CD1 C -14.194 -11.766 -2.913 1.00 . A A . 55 ILE CD1 1 1 10 7144 1 1 55 ILE CG1 C -13.341 -10.709 -3.580 1.00 . A A . 55 ILE CG1 1 1 10 7145 1 1 55 ILE CG2 C -13.453 -11.530 -5.949 1.00 . A A . 55 ILE CG2 1 1 10 7146 1 1 55 ILE H H -11.896 -8.596 -3.822 1.00 . A A . 55 ILE H 1 1 10 7147 1 1 55 ILE HA H -12.865 -9.199 -6.543 1.00 . A A . 55 ILE HA 1 1 10 7148 1 1 55 ILE HB H -14.849 -10.230 -5.023 1.00 . A A . 55 ILE HB 1 1 10 7149 1 1 55 ILE HD11 H -13.555 -12.488 -2.425 1.00 . A A . 55 ILE HD11 1 1 10 7150 1 1 55 ILE HD12 H -14.797 -12.265 -3.657 1.00 . A A . 55 ILE HD12 1 1 10 7151 1 1 55 ILE HD13 H -14.837 -11.301 -2.181 1.00 . A A . 55 ILE HD13 1 1 10 7152 1 1 55 ILE HG12 H -12.323 -11.067 -3.596 1.00 . A A . 55 ILE HG12 1 1 10 7153 1 1 55 ILE HG13 H -13.393 -9.813 -2.980 1.00 . A A . 55 ILE HG13 1 1 10 7154 1 1 55 ILE HG21 H -12.871 -11.162 -6.782 1.00 . A A . 55 ILE HG21 1 1 10 7155 1 1 55 ILE HG22 H -14.370 -11.967 -6.317 1.00 . A A . 55 ILE HG22 1 1 10 7156 1 1 55 ILE HG23 H -12.885 -12.280 -5.418 1.00 . A A . 55 ILE HG23 1 1 10 7157 1 1 55 ILE N N -11.862 -8.818 -4.778 1.00 . A A . 55 ILE N 1 1 10 7158 1 1 55 ILE O O -13.845 -6.982 -4.597 1.00 . A A . 55 ILE O 1 1 10 7159 1 1 56 SER C C -15.672 -5.630 -6.483 1.00 . A A . 56 SER C 1 1 10 7160 1 1 56 SER CA C -16.233 -6.974 -6.029 1.00 . A A . 56 SER CA 1 1 10 7161 1 1 56 SER CB C -16.814 -6.853 -4.618 1.00 . A A . 56 SER CB 1 1 10 7162 1 1 56 SER H H -15.339 -8.786 -6.655 1.00 . A A . 56 SER H 1 1 10 7163 1 1 56 SER HA H -17.021 -7.266 -6.707 1.00 . A A . 56 SER HA 1 1 10 7164 1 1 56 SER HB2 H -16.032 -7.024 -3.894 1.00 . A A . 56 SER HB2 1 1 10 7165 1 1 56 SER HB3 H -17.218 -5.859 -4.482 1.00 . A A . 56 SER HB3 1 1 10 7166 1 1 56 SER HG H -18.545 -7.662 -5.049 1.00 . A A . 56 SER HG 1 1 10 7167 1 1 56 SER N N -15.206 -8.010 -6.072 1.00 . A A . 56 SER N 1 1 10 7168 1 1 56 SER O O -15.312 -4.814 -5.611 1.00 . A A . 56 SER O 1 1 10 7169 1 1 56 SER OXT O -15.597 -5.405 -7.710 1.00 . A A . 56 SER OXT 1 1 10 7170 1 1 56 SER OG O -17.847 -7.800 -4.405 1.00 . A A . 56 SER OG 1 1 11 7171 1 1 1 ASP C C 3.020 14.655 -2.065 1.00 . A A . 1 ASP C 1 1 11 7172 1 1 1 ASP CA C 4.102 14.578 -3.138 1.00 . A A . 1 ASP CA 1 1 11 7173 1 1 1 ASP CB C 4.974 13.341 -2.919 1.00 . A A . 1 ASP CB 1 1 11 7174 1 1 1 ASP CG C 5.827 13.013 -4.127 1.00 . A A . 1 ASP CG 1 1 11 7175 1 1 1 ASP H1 H 5.655 15.713 -2.329 1.00 . A A . 1 ASP H1 1 1 11 7176 1 1 1 ASP H2 H 4.393 16.637 -2.973 1.00 . A A . 1 ASP H2 1 1 11 7177 1 1 1 ASP H3 H 5.490 15.870 -4.007 1.00 . A A . 1 ASP H3 1 1 11 7178 1 1 1 ASP HA H 3.632 14.516 -4.108 1.00 . A A . 1 ASP HA 1 1 11 7179 1 1 1 ASP HB2 H 5.627 13.513 -2.076 1.00 . A A . 1 ASP HB2 1 1 11 7180 1 1 1 ASP HB3 H 4.338 12.494 -2.708 1.00 . A A . 1 ASP HB3 1 1 11 7181 1 1 1 ASP N N 4.971 15.783 -3.110 1.00 . A A . 1 ASP N 1 1 11 7182 1 1 1 ASP O O 2.806 15.704 -1.458 1.00 . A A . 1 ASP O 1 1 11 7183 1 1 1 ASP OD1 O 5.291 13.034 -5.256 1.00 . A A . 1 ASP OD1 1 1 11 7184 1 1 1 ASP OD2 O 7.031 12.737 -3.946 1.00 . A A . 1 ASP OD2 1 1 11 7185 1 1 2 VAL C C 1.819 12.977 0.500 1.00 . A A . 2 VAL C 1 1 11 7186 1 1 2 VAL CA C 1.282 13.472 -0.839 1.00 . A A . 2 VAL CA 1 1 11 7187 1 1 2 VAL CB C 0.135 12.548 -1.295 1.00 . A A . 2 VAL CB 1 1 11 7188 1 1 2 VAL CG1 C -1.025 12.609 -0.314 1.00 . A A . 2 VAL CG1 1 1 11 7189 1 1 2 VAL CG2 C -0.324 12.919 -2.698 1.00 . A A . 2 VAL CG2 1 1 11 7190 1 1 2 VAL H H 2.560 12.730 -2.353 1.00 . A A . 2 VAL H 1 1 11 7191 1 1 2 VAL HA H 0.885 14.469 -0.711 1.00 . A A . 2 VAL HA 1 1 11 7192 1 1 2 VAL HB H 0.506 11.534 -1.318 1.00 . A A . 2 VAL HB 1 1 11 7193 1 1 2 VAL HG11 H -0.770 13.264 0.505 1.00 . A A . 2 VAL HG11 1 1 11 7194 1 1 2 VAL HG12 H -1.227 11.618 0.066 1.00 . A A . 2 VAL HG12 1 1 11 7195 1 1 2 VAL HG13 H -1.902 12.987 -0.817 1.00 . A A . 2 VAL HG13 1 1 11 7196 1 1 2 VAL HG21 H -1.399 12.831 -2.759 1.00 . A A . 2 VAL HG21 1 1 11 7197 1 1 2 VAL HG22 H 0.134 12.253 -3.415 1.00 . A A . 2 VAL HG22 1 1 11 7198 1 1 2 VAL HG23 H -0.034 13.936 -2.915 1.00 . A A . 2 VAL HG23 1 1 11 7199 1 1 2 VAL N N 2.342 13.534 -1.838 1.00 . A A . 2 VAL N 1 1 11 7200 1 1 2 VAL O O 2.557 11.993 0.559 1.00 . A A . 2 VAL O 1 1 11 7201 1 1 3 GLN C C 1.281 11.961 3.335 1.00 . A A . 3 GLN C 1 1 11 7202 1 1 3 GLN CA C 1.883 13.298 2.913 1.00 . A A . 3 GLN CA 1 1 11 7203 1 1 3 GLN CB C 1.495 14.387 3.917 1.00 . A A . 3 GLN CB 1 1 11 7204 1 1 3 GLN CD C 3.103 16.322 4.141 1.00 . A A . 3 GLN CD 1 1 11 7205 1 1 3 GLN CG C 2.677 14.968 4.674 1.00 . A A . 3 GLN CG 1 1 11 7206 1 1 3 GLN H H 0.853 14.441 1.460 1.00 . A A . 3 GLN H 1 1 11 7207 1 1 3 GLN HA H 2.959 13.205 2.895 1.00 . A A . 3 GLN HA 1 1 11 7208 1 1 3 GLN HB2 H 1.005 15.190 3.385 1.00 . A A . 3 GLN HB2 1 1 11 7209 1 1 3 GLN HB3 H 0.805 13.968 4.635 1.00 . A A . 3 GLN HB3 1 1 11 7210 1 1 3 GLN HE21 H 1.224 16.967 4.209 1.00 . A A . 3 GLN HE21 1 1 11 7211 1 1 3 GLN HE22 H 2.388 18.107 3.635 1.00 . A A . 3 GLN HE22 1 1 11 7212 1 1 3 GLN HG2 H 2.404 15.078 5.713 1.00 . A A . 3 GLN HG2 1 1 11 7213 1 1 3 GLN HG3 H 3.512 14.286 4.593 1.00 . A A . 3 GLN HG3 1 1 11 7214 1 1 3 GLN N N 1.443 13.666 1.573 1.00 . A A . 3 GLN N 1 1 11 7215 1 1 3 GLN NE2 N 2.141 17.223 3.978 1.00 . A A . 3 GLN NE2 1 1 11 7216 1 1 3 GLN O O 0.124 11.894 3.754 1.00 . A A . 3 GLN O 1 1 11 7217 1 1 3 GLN OE1 O 4.283 16.556 3.878 1.00 . A A . 3 GLN OE1 1 1 11 7218 1 1 4 CYS C C 1.262 9.472 5.052 1.00 . A A . 4 CYS C 1 1 11 7219 1 1 4 CYS CA C 1.618 9.559 3.572 1.00 . A A . 4 CYS CA 1 1 11 7220 1 1 4 CYS CB C 2.699 8.530 3.242 1.00 . A A . 4 CYS CB 1 1 11 7221 1 1 4 CYS H H 2.979 11.017 2.865 1.00 . A A . 4 CYS H 1 1 11 7222 1 1 4 CYS HA H 0.737 9.340 2.990 1.00 . A A . 4 CYS HA 1 1 11 7223 1 1 4 CYS HB2 H 3.669 8.975 3.395 1.00 . A A . 4 CYS HB2 1 1 11 7224 1 1 4 CYS HB3 H 2.591 7.681 3.901 1.00 . A A . 4 CYS HB3 1 1 11 7225 1 1 4 CYS N N 2.070 10.899 3.212 1.00 . A A . 4 CYS N 1 1 11 7226 1 1 4 CYS O O 0.276 8.838 5.427 1.00 . A A . 4 CYS O 1 1 11 7227 1 1 4 CYS SG S 2.639 7.915 1.530 1.00 . A A . 4 CYS SG 1 1 11 7228 1 1 5 GLY C C 2.588 8.933 7.989 1.00 . A A . 5 GLY C 1 1 11 7229 1 1 5 GLY CA C 1.839 10.065 7.320 1.00 . A A . 5 GLY CA 1 1 11 7230 1 1 5 GLY H H 2.856 10.580 5.533 1.00 . A A . 5 GLY H 1 1 11 7231 1 1 5 GLY HA2 H 2.159 11.003 7.752 1.00 . A A . 5 GLY HA2 1 1 11 7232 1 1 5 GLY HA3 H 0.781 9.938 7.495 1.00 . A A . 5 GLY HA3 1 1 11 7233 1 1 5 GLY N N 2.079 10.098 5.889 1.00 . A A . 5 GLY N 1 1 11 7234 1 1 5 GLY O O 1.984 8.010 8.534 1.00 . A A . 5 GLY O 1 1 11 7235 1 1 6 GLY C C 6.169 8.041 8.026 1.00 . A A . 6 GLY C 1 1 11 7236 1 1 6 GLY CA C 4.745 7.985 8.538 1.00 . A A . 6 GLY CA 1 1 11 7237 1 1 6 GLY H H 4.325 9.777 7.490 1.00 . A A . 6 GLY H 1 1 11 7238 1 1 6 GLY HA2 H 4.751 8.121 9.610 1.00 . A A . 6 GLY HA2 1 1 11 7239 1 1 6 GLY HA3 H 4.327 7.015 8.309 1.00 . A A . 6 GLY HA3 1 1 11 7240 1 1 6 GLY N N 3.912 9.010 7.939 1.00 . A A . 6 GLY N 1 1 11 7241 1 1 6 GLY O O 7.022 7.263 8.457 1.00 . A A . 6 GLY O 1 1 11 7242 1 1 7 GLY C C 7.823 8.857 5.068 1.00 . A A . 7 GLY C 1 1 11 7243 1 1 7 GLY CA C 7.761 9.117 6.561 1.00 . A A . 7 GLY CA 1 1 11 7244 1 1 7 GLY H H 5.709 9.567 6.815 1.00 . A A . 7 GLY H 1 1 11 7245 1 1 7 GLY HA2 H 8.104 10.123 6.752 1.00 . A A . 7 GLY HA2 1 1 11 7246 1 1 7 GLY HA3 H 8.420 8.424 7.063 1.00 . A A . 7 GLY HA3 1 1 11 7247 1 1 7 GLY N N 6.427 8.971 7.111 1.00 . A A . 7 GLY N 1 1 11 7248 1 1 7 GLY O O 8.867 9.057 4.447 1.00 . A A . 7 GLY O 1 1 11 7249 1 1 8 PHE C C 5.861 9.139 2.283 1.00 . A A . 8 PHE C 1 1 11 7250 1 1 8 PHE CA C 6.689 8.113 3.053 1.00 . A A . 8 PHE CA 1 1 11 7251 1 1 8 PHE CB C 6.132 6.712 2.811 1.00 . A A . 8 PHE CB 1 1 11 7252 1 1 8 PHE CD1 C 7.663 5.105 1.641 1.00 . A A . 8 PHE CD1 1 1 11 7253 1 1 8 PHE CD2 C 7.687 5.160 4.024 1.00 . A A . 8 PHE CD2 1 1 11 7254 1 1 8 PHE CE1 C 8.628 4.116 1.650 1.00 . A A . 8 PHE CE1 1 1 11 7255 1 1 8 PHE CE2 C 8.652 4.171 4.041 1.00 . A A . 8 PHE CE2 1 1 11 7256 1 1 8 PHE CG C 7.182 5.637 2.825 1.00 . A A . 8 PHE CG 1 1 11 7257 1 1 8 PHE CZ C 9.123 3.649 2.852 1.00 . A A . 8 PHE CZ 1 1 11 7258 1 1 8 PHE H H 5.906 8.247 5.020 1.00 . A A . 8 PHE H 1 1 11 7259 1 1 8 PHE HA H 7.705 8.148 2.693 1.00 . A A . 8 PHE HA 1 1 11 7260 1 1 8 PHE HB2 H 5.411 6.481 3.582 1.00 . A A . 8 PHE HB2 1 1 11 7261 1 1 8 PHE HB3 H 5.640 6.689 1.850 1.00 . A A . 8 PHE HB3 1 1 11 7262 1 1 8 PHE HD1 H 7.277 5.471 0.700 1.00 . A A . 8 PHE HD1 1 1 11 7263 1 1 8 PHE HD2 H 7.320 5.567 4.954 1.00 . A A . 8 PHE HD2 1 1 11 7264 1 1 8 PHE HE1 H 8.995 3.709 0.719 1.00 . A A . 8 PHE HE1 1 1 11 7265 1 1 8 PHE HE2 H 9.038 3.807 4.982 1.00 . A A . 8 PHE HE2 1 1 11 7266 1 1 8 PHE HZ H 9.877 2.876 2.862 1.00 . A A . 8 PHE HZ 1 1 11 7267 1 1 8 PHE N N 6.716 8.401 4.483 1.00 . A A . 8 PHE N 1 1 11 7268 1 1 8 PHE O O 5.338 10.095 2.856 1.00 . A A . 8 PHE O 1 1 11 7269 1 1 9 SER C C 4.629 9.093 -1.195 1.00 . A A . 9 SER C 1 1 11 7270 1 1 9 SER CA C 4.998 9.814 0.099 1.00 . A A . 9 SER CA 1 1 11 7271 1 1 9 SER CB C 5.807 11.073 -0.214 1.00 . A A . 9 SER CB 1 1 11 7272 1 1 9 SER H H 6.198 8.142 0.586 1.00 . A A . 9 SER H 1 1 11 7273 1 1 9 SER HA H 4.091 10.095 0.614 1.00 . A A . 9 SER HA 1 1 11 7274 1 1 9 SER HB2 H 5.680 11.331 -1.255 1.00 . A A . 9 SER HB2 1 1 11 7275 1 1 9 SER HB3 H 5.458 11.886 0.404 1.00 . A A . 9 SER HB3 1 1 11 7276 1 1 9 SER HG H 7.648 11.709 -0.004 1.00 . A A . 9 SER HG 1 1 11 7277 1 1 9 SER N N 5.755 8.925 0.974 1.00 . A A . 9 SER N 1 1 11 7278 1 1 9 SER O O 5.314 8.157 -1.607 1.00 . A A . 9 SER O 1 1 11 7279 1 1 9 SER OG O 7.187 10.868 0.037 1.00 . A A . 9 SER OG 1 1 11 7280 1 1 10 CYS C C 2.647 9.927 -4.101 1.00 . A A . 10 CYS C 1 1 11 7281 1 1 10 CYS CA C 3.093 8.895 -3.069 1.00 . A A . 10 CYS CA 1 1 11 7282 1 1 10 CYS CB C 1.947 7.921 -2.784 1.00 . A A . 10 CYS CB 1 1 11 7283 1 1 10 CYS H H 3.026 10.266 -1.452 1.00 . A A . 10 CYS H 1 1 11 7284 1 1 10 CYS HA H 3.925 8.340 -3.475 1.00 . A A . 10 CYS HA 1 1 11 7285 1 1 10 CYS HB2 H 1.372 8.288 -1.946 1.00 . A A . 10 CYS HB2 1 1 11 7286 1 1 10 CYS HB3 H 1.306 7.862 -3.654 1.00 . A A . 10 CYS HB3 1 1 11 7287 1 1 10 CYS N N 3.541 9.522 -1.830 1.00 . A A . 10 CYS N 1 1 11 7288 1 1 10 CYS O O 2.781 11.134 -3.895 1.00 . A A . 10 CYS O 1 1 11 7289 1 1 10 CYS SG S 2.491 6.229 -2.382 1.00 . A A . 10 CYS SG 1 1 11 7290 1 1 11 HIS C C 0.306 10.838 -6.047 1.00 . A A . 11 HIS C 1 1 11 7291 1 1 11 HIS CA C 1.701 10.285 -6.317 1.00 . A A . 11 HIS CA 1 1 11 7292 1 1 11 HIS CB C 1.723 9.522 -7.642 1.00 . A A . 11 HIS CB 1 1 11 7293 1 1 11 HIS CD2 C 3.860 8.949 -9.001 1.00 . A A . 11 HIS CD2 1 1 11 7294 1 1 11 HIS CE1 C 4.452 10.991 -9.539 1.00 . A A . 11 HIS CE1 1 1 11 7295 1 1 11 HIS CG C 2.944 9.793 -8.465 1.00 . A A . 11 HIS CG 1 1 11 7296 1 1 11 HIS H H 2.116 8.451 -5.316 1.00 . A A . 11 HIS H 1 1 11 7297 1 1 11 HIS HA H 2.391 11.113 -6.381 1.00 . A A . 11 HIS HA 1 1 11 7298 1 1 11 HIS HB2 H 1.687 8.462 -7.441 1.00 . A A . 11 HIS HB2 1 1 11 7299 1 1 11 HIS HB3 H 0.858 9.802 -8.226 1.00 . A A . 11 HIS HB3 1 1 11 7300 1 1 11 HIS HD1 H 2.887 11.897 -8.582 1.00 . A A . 11 HIS HD1 1 1 11 7301 1 1 11 HIS HD2 H 3.861 7.872 -8.921 1.00 . A A . 11 HIS HD2 1 1 11 7302 1 1 11 HIS HE1 H 4.993 11.828 -9.954 1.00 . A A . 11 HIS HE1 1 1 11 7303 1 1 11 HIS HE2 H 5.603 9.387 -10.085 1.00 . A A . 11 HIS HE2 1 1 11 7304 1 1 11 HIS N N 2.143 9.426 -5.224 1.00 . A A . 11 HIS N 1 1 11 7305 1 1 11 HIS ND1 N 3.346 11.064 -8.821 1.00 . A A . 11 HIS ND1 1 1 11 7306 1 1 11 HIS NE2 N 4.784 9.719 -9.662 1.00 . A A . 11 HIS NE2 1 1 11 7307 1 1 11 HIS O O -0.503 10.224 -5.341 1.00 . A A . 11 HIS O 1 1 11 7308 1 1 12 ASP C C -2.395 12.006 -7.045 1.00 . A A . 12 ASP C 1 1 11 7309 1 1 12 ASP CA C -1.218 12.721 -6.396 1.00 . A A . 12 ASP CA 1 1 11 7310 1 1 12 ASP CB C -1.125 14.154 -6.921 1.00 . A A . 12 ASP CB 1 1 11 7311 1 1 12 ASP CG C -1.022 14.212 -8.433 1.00 . A A . 12 ASP CG 1 1 11 7312 1 1 12 ASP H H 0.756 12.463 -7.114 1.00 . A A . 12 ASP H 1 1 11 7313 1 1 12 ASP HA H -1.398 12.753 -5.338 1.00 . A A . 12 ASP HA 1 1 11 7314 1 1 12 ASP HB2 H -2.005 14.700 -6.617 1.00 . A A . 12 ASP HB2 1 1 11 7315 1 1 12 ASP HB3 H -0.249 14.627 -6.501 1.00 . A A . 12 ASP HB3 1 1 11 7316 1 1 12 ASP N N 0.053 12.028 -6.590 1.00 . A A . 12 ASP N 1 1 11 7317 1 1 12 ASP O O -3.405 12.633 -7.369 1.00 . A A . 12 ASP O 1 1 11 7318 1 1 12 ASP OD1 O -1.742 15.028 -9.045 1.00 . A A . 12 ASP OD1 1 1 11 7319 1 1 12 ASP OD2 O -0.223 13.441 -9.004 1.00 . A A . 12 ASP OD2 1 1 11 7320 1 1 13 GLY C C -3.360 8.527 -7.181 1.00 . A A . 13 GLY C 1 1 11 7321 1 1 13 GLY CA C -3.354 9.918 -7.784 1.00 . A A . 13 GLY CA 1 1 11 7322 1 1 13 GLY H H -1.481 10.224 -6.926 1.00 . A A . 13 GLY H 1 1 11 7323 1 1 13 GLY HA2 H -4.299 10.402 -7.584 1.00 . A A . 13 GLY HA2 1 1 11 7324 1 1 13 GLY HA3 H -3.207 9.840 -8.851 1.00 . A A . 13 GLY HA3 1 1 11 7325 1 1 13 GLY N N -2.284 10.700 -7.208 1.00 . A A . 13 GLY N 1 1 11 7326 1 1 13 GLY O O -3.877 7.577 -7.767 1.00 . A A . 13 GLY O 1 1 11 7327 1 1 14 GLU C C -3.050 7.338 -3.795 1.00 . A A . 14 GLU C 1 1 11 7328 1 1 14 GLU CA C -2.680 7.162 -5.266 1.00 . A A . 14 GLU CA 1 1 11 7329 1 1 14 GLU CB C -1.268 6.576 -5.370 1.00 . A A . 14 GLU CB 1 1 11 7330 1 1 14 GLU CD C -0.444 6.575 -7.759 1.00 . A A . 14 GLU CD 1 1 11 7331 1 1 14 GLU CG C -0.391 7.258 -6.406 1.00 . A A . 14 GLU CG 1 1 11 7332 1 1 14 GLU H H -2.387 9.249 -5.596 1.00 . A A . 14 GLU H 1 1 11 7333 1 1 14 GLU HA H -3.378 6.475 -5.719 1.00 . A A . 14 GLU HA 1 1 11 7334 1 1 14 GLU HB2 H -0.784 6.663 -4.409 1.00 . A A . 14 GLU HB2 1 1 11 7335 1 1 14 GLU HB3 H -1.344 5.531 -5.628 1.00 . A A . 14 GLU HB3 1 1 11 7336 1 1 14 GLU HG2 H -0.721 8.279 -6.523 1.00 . A A . 14 GLU HG2 1 1 11 7337 1 1 14 GLU HG3 H 0.631 7.249 -6.055 1.00 . A A . 14 GLU HG3 1 1 11 7338 1 1 14 GLU N N -2.767 8.430 -5.989 1.00 . A A . 14 GLU N 1 1 11 7339 1 1 14 GLU O O -3.522 8.398 -3.383 1.00 . A A . 14 GLU O 1 1 11 7340 1 1 14 GLU OE1 O -0.648 7.278 -8.771 1.00 . A A . 14 GLU OE1 1 1 11 7341 1 1 14 GLU OE2 O -0.279 5.338 -7.807 1.00 . A A . 14 GLU OE2 1 1 11 7342 1 1 15 THR C C -2.041 5.587 -0.792 1.00 . A A . 15 THR C 1 1 11 7343 1 1 15 THR CA C -3.127 6.309 -1.584 1.00 . A A . 15 THR CA 1 1 11 7344 1 1 15 THR CB C -4.489 5.651 -1.287 1.00 . A A . 15 THR CB 1 1 11 7345 1 1 15 THR CG2 C -4.819 5.734 0.197 1.00 . A A . 15 THR CG2 1 1 11 7346 1 1 15 THR H H -2.446 5.472 -3.401 1.00 . A A . 15 THR H 1 1 11 7347 1 1 15 THR HA H -3.169 7.341 -1.266 1.00 . A A . 15 THR HA 1 1 11 7348 1 1 15 THR HB H -4.439 4.609 -1.573 1.00 . A A . 15 THR HB 1 1 11 7349 1 1 15 THR HG1 H -6.293 6.420 -1.492 1.00 . A A . 15 THR HG1 1 1 11 7350 1 1 15 THR HG21 H -5.071 6.751 0.454 1.00 . A A . 15 THR HG21 1 1 11 7351 1 1 15 THR HG22 H -3.963 5.418 0.774 1.00 . A A . 15 THR HG22 1 1 11 7352 1 1 15 THR HG23 H -5.658 5.088 0.415 1.00 . A A . 15 THR HG23 1 1 11 7353 1 1 15 THR N N -2.826 6.287 -3.011 1.00 . A A . 15 THR N 1 1 11 7354 1 1 15 THR O O -1.503 4.577 -1.240 1.00 . A A . 15 THR O 1 1 11 7355 1 1 15 THR OG1 O -5.518 6.297 -2.045 1.00 . A A . 15 THR OG1 1 1 11 7356 1 1 16 CYS C C -1.291 4.435 2.131 1.00 . A A . 16 CYS C 1 1 11 7357 1 1 16 CYS CA C -0.696 5.516 1.236 1.00 . A A . 16 CYS CA 1 1 11 7358 1 1 16 CYS CB C -0.025 6.597 2.078 1.00 . A A . 16 CYS CB 1 1 11 7359 1 1 16 CYS H H -2.185 6.919 0.692 1.00 . A A . 16 CYS H 1 1 11 7360 1 1 16 CYS HA H 0.045 5.065 0.593 1.00 . A A . 16 CYS HA 1 1 11 7361 1 1 16 CYS HB2 H -0.750 7.017 2.759 1.00 . A A . 16 CYS HB2 1 1 11 7362 1 1 16 CYS HB3 H 0.785 6.156 2.645 1.00 . A A . 16 CYS HB3 1 1 11 7363 1 1 16 CYS N N -1.721 6.112 0.386 1.00 . A A . 16 CYS N 1 1 11 7364 1 1 16 CYS O O -2.305 4.654 2.794 1.00 . A A . 16 CYS O 1 1 11 7365 1 1 16 CYS SG S 0.665 7.961 1.089 1.00 . A A . 16 CYS SG 1 1 11 7366 1 1 17 CYS C C -0.096 1.710 3.965 1.00 . A A . 17 CYS C 1 1 11 7367 1 1 17 CYS CA C -1.137 2.139 2.933 1.00 . A A . 17 CYS CA 1 1 11 7368 1 1 17 CYS CB C -1.470 0.962 2.019 1.00 . A A . 17 CYS CB 1 1 11 7369 1 1 17 CYS H H 0.133 3.141 1.579 1.00 . A A . 17 CYS H 1 1 11 7370 1 1 17 CYS HA H -2.034 2.449 3.447 1.00 . A A . 17 CYS HA 1 1 11 7371 1 1 17 CYS HB2 H -1.248 1.232 0.999 1.00 . A A . 17 CYS HB2 1 1 11 7372 1 1 17 CYS HB3 H -0.864 0.115 2.303 1.00 . A A . 17 CYS HB3 1 1 11 7373 1 1 17 CYS N N -0.663 3.262 2.134 1.00 . A A . 17 CYS N 1 1 11 7374 1 1 17 CYS O O 1.062 1.469 3.627 1.00 . A A . 17 CYS O 1 1 11 7375 1 1 17 CYS SG S -3.211 0.442 2.085 1.00 . A A . 17 CYS SG 1 1 11 7376 1 1 18 PRO C C 0.442 -0.323 6.482 1.00 . A A . 18 PRO C 1 1 11 7377 1 1 18 PRO CA C 0.394 1.195 6.324 1.00 . A A . 18 PRO CA 1 1 11 7378 1 1 18 PRO CB C -0.257 1.845 7.541 1.00 . A A . 18 PRO CB 1 1 11 7379 1 1 18 PRO CD C -1.865 1.864 5.738 1.00 . A A . 18 PRO CD 1 1 11 7380 1 1 18 PRO CG C -1.722 1.813 7.243 1.00 . A A . 18 PRO CG 1 1 11 7381 1 1 18 PRO HA H 1.392 1.582 6.187 1.00 . A A . 18 PRO HA 1 1 11 7382 1 1 18 PRO HB2 H -0.017 1.278 8.427 1.00 . A A . 18 PRO HB2 1 1 11 7383 1 1 18 PRO HB3 H 0.101 2.858 7.646 1.00 . A A . 18 PRO HB3 1 1 11 7384 1 1 18 PRO HD2 H -2.548 1.103 5.397 1.00 . A A . 18 PRO HD2 1 1 11 7385 1 1 18 PRO HD3 H -2.207 2.837 5.425 1.00 . A A . 18 PRO HD3 1 1 11 7386 1 1 18 PRO HG2 H -2.153 0.901 7.627 1.00 . A A . 18 PRO HG2 1 1 11 7387 1 1 18 PRO HG3 H -2.203 2.671 7.691 1.00 . A A . 18 PRO HG3 1 1 11 7388 1 1 18 PRO N N -0.500 1.602 5.243 1.00 . A A . 18 PRO N 1 1 11 7389 1 1 18 PRO O O -0.522 -0.939 6.938 1.00 . A A . 18 PRO O 1 1 11 7390 1 1 19 THR C C 2.343 -2.795 7.522 1.00 . A A . 19 THR C 1 1 11 7391 1 1 19 THR CA C 1.727 -2.372 6.191 1.00 . A A . 19 THR CA 1 1 11 7392 1 1 19 THR CB C 2.605 -2.909 5.046 1.00 . A A . 19 THR CB 1 1 11 7393 1 1 19 THR CG2 C 1.934 -2.687 3.699 1.00 . A A . 19 THR CG2 1 1 11 7394 1 1 19 THR H H 2.305 -0.390 5.741 1.00 . A A . 19 THR H 1 1 11 7395 1 1 19 THR HA H 0.748 -2.820 6.102 1.00 . A A . 19 THR HA 1 1 11 7396 1 1 19 THR HB H 2.748 -3.970 5.189 1.00 . A A . 19 THR HB 1 1 11 7397 1 1 19 THR HG1 H 4.575 -2.917 5.163 1.00 . A A . 19 THR HG1 1 1 11 7398 1 1 19 THR HG21 H 2.085 -1.665 3.385 1.00 . A A . 19 THR HG21 1 1 11 7399 1 1 19 THR HG22 H 0.876 -2.884 3.786 1.00 . A A . 19 THR HG22 1 1 11 7400 1 1 19 THR HG23 H 2.366 -3.355 2.968 1.00 . A A . 19 THR HG23 1 1 11 7401 1 1 19 THR N N 1.565 -0.925 6.097 1.00 . A A . 19 THR N 1 1 11 7402 1 1 19 THR O O 2.422 -3.987 7.821 1.00 . A A . 19 THR O 1 1 11 7403 1 1 19 THR OG1 O 3.882 -2.260 5.061 1.00 . A A . 19 THR OG1 1 1 11 7404 1 1 20 SER C C 3.159 -0.966 10.599 1.00 . A A . 20 SER C 1 1 11 7405 1 1 20 SER CA C 3.375 -2.120 9.620 1.00 . A A . 20 SER CA 1 1 11 7406 1 1 20 SER CB C 4.871 -2.409 9.465 1.00 . A A . 20 SER CB 1 1 11 7407 1 1 20 SER H H 2.676 -0.888 8.049 1.00 . A A . 20 SER H 1 1 11 7408 1 1 20 SER HA H 2.888 -3.001 10.014 1.00 . A A . 20 SER HA 1 1 11 7409 1 1 20 SER HB2 H 5.438 -1.645 9.975 1.00 . A A . 20 SER HB2 1 1 11 7410 1 1 20 SER HB3 H 5.095 -3.373 9.898 1.00 . A A . 20 SER HB3 1 1 11 7411 1 1 20 SER HG H 6.161 -2.719 8.024 1.00 . A A . 20 SER HG 1 1 11 7412 1 1 20 SER N N 2.774 -1.824 8.322 1.00 . A A . 20 SER N 1 1 11 7413 1 1 20 SER O O 2.142 -0.906 11.290 1.00 . A A . 20 SER O 1 1 11 7414 1 1 20 SER OG O 5.251 -2.422 8.100 1.00 . A A . 20 SER OG 1 1 11 7415 1 1 21 GLN C C 5.150 2.109 11.170 1.00 . A A . 21 GLN C 1 1 11 7416 1 1 21 GLN CA C 4.057 1.107 11.527 1.00 . A A . 21 GLN CA 1 1 11 7417 1 1 21 GLN CB C 4.194 0.676 12.990 1.00 . A A . 21 GLN CB 1 1 11 7418 1 1 21 GLN CD C 5.609 -0.623 14.631 1.00 . A A . 21 GLN CD 1 1 11 7419 1 1 21 GLN CG C 5.591 0.208 13.363 1.00 . A A . 21 GLN CG 1 1 11 7420 1 1 21 GLN H H 4.908 -0.159 10.064 1.00 . A A . 21 GLN H 1 1 11 7421 1 1 21 GLN HA H 3.095 1.575 11.386 1.00 . A A . 21 GLN HA 1 1 11 7422 1 1 21 GLN HB2 H 3.936 1.511 13.625 1.00 . A A . 21 GLN HB2 1 1 11 7423 1 1 21 GLN HB3 H 3.504 -0.134 13.180 1.00 . A A . 21 GLN HB3 1 1 11 7424 1 1 21 GLN HE21 H 7.260 -1.550 14.028 1.00 . A A . 21 GLN HE21 1 1 11 7425 1 1 21 GLN HE22 H 6.641 -2.045 15.563 1.00 . A A . 21 GLN HE22 1 1 11 7426 1 1 21 GLN HG2 H 5.984 -0.391 12.555 1.00 . A A . 21 GLN HG2 1 1 11 7427 1 1 21 GLN HG3 H 6.220 1.075 13.508 1.00 . A A . 21 GLN HG3 1 1 11 7428 1 1 21 GLN N N 4.126 -0.052 10.644 1.00 . A A . 21 GLN N 1 1 11 7429 1 1 21 GLN NE2 N 6.603 -1.494 14.753 1.00 . A A . 21 GLN NE2 1 1 11 7430 1 1 21 GLN O O 5.087 3.280 11.547 1.00 . A A . 21 GLN O 1 1 11 7431 1 1 21 GLN OE1 O 4.740 -0.483 15.493 1.00 . A A . 21 GLN OE1 1 1 11 7432 1 1 22 THR C C 7.447 2.373 8.490 1.00 . A A . 22 THR C 1 1 11 7433 1 1 22 THR CA C 7.260 2.474 9.999 1.00 . A A . 22 THR CA 1 1 11 7434 1 1 22 THR CB C 8.574 2.076 10.697 1.00 . A A . 22 THR CB 1 1 11 7435 1 1 22 THR CG2 C 8.416 2.109 12.210 1.00 . A A . 22 THR CG2 1 1 11 7436 1 1 22 THR H H 6.131 0.694 10.156 1.00 . A A . 22 THR H 1 1 11 7437 1 1 22 THR HA H 7.029 3.498 10.258 1.00 . A A . 22 THR HA 1 1 11 7438 1 1 22 THR HB H 9.341 2.782 10.415 1.00 . A A . 22 THR HB 1 1 11 7439 1 1 22 THR HG1 H 9.765 0.824 9.746 1.00 . A A . 22 THR HG1 1 1 11 7440 1 1 22 THR HG21 H 8.678 1.144 12.620 1.00 . A A . 22 THR HG21 1 1 11 7441 1 1 22 THR HG22 H 7.391 2.340 12.460 1.00 . A A . 22 THR HG22 1 1 11 7442 1 1 22 THR HG23 H 9.066 2.865 12.624 1.00 . A A . 22 THR HG23 1 1 11 7443 1 1 22 THR N N 6.148 1.635 10.429 1.00 . A A . 22 THR N 1 1 11 7444 1 1 22 THR O O 8.278 3.070 7.906 1.00 . A A . 22 THR O 1 1 11 7445 1 1 22 THR OG1 O 8.970 0.764 10.282 1.00 . A A . 22 THR OG1 1 1 11 7446 1 1 23 THR C C 5.422 1.751 5.764 1.00 . A A . 23 THR C 1 1 11 7447 1 1 23 THR CA C 6.718 1.302 6.424 1.00 . A A . 23 THR CA 1 1 11 7448 1 1 23 THR CB C 6.976 -0.175 6.073 1.00 . A A . 23 THR CB 1 1 11 7449 1 1 23 THR CG2 C 7.886 -0.293 4.859 1.00 . A A . 23 THR CG2 1 1 11 7450 1 1 23 THR H H 6.013 0.986 8.392 1.00 . A A . 23 THR H 1 1 11 7451 1 1 23 THR HA H 7.536 1.893 6.037 1.00 . A A . 23 THR HA 1 1 11 7452 1 1 23 THR HB H 6.030 -0.644 5.840 1.00 . A A . 23 THR HB 1 1 11 7453 1 1 23 THR HG1 H 7.036 -0.701 7.972 1.00 . A A . 23 THR HG1 1 1 11 7454 1 1 23 THR HG21 H 7.316 -0.100 3.962 1.00 . A A . 23 THR HG21 1 1 11 7455 1 1 23 THR HG22 H 8.299 -1.290 4.815 1.00 . A A . 23 THR HG22 1 1 11 7456 1 1 23 THR HG23 H 8.688 0.426 4.939 1.00 . A A . 23 THR HG23 1 1 11 7457 1 1 23 THR N N 6.659 1.502 7.866 1.00 . A A . 23 THR N 1 1 11 7458 1 1 23 THR O O 4.354 1.697 6.374 1.00 . A A . 23 THR O 1 1 11 7459 1 1 23 THR OG1 O 7.570 -0.850 7.188 1.00 . A A . 23 THR OG1 1 1 11 7460 1 1 24 TRP C C 4.418 2.257 2.315 1.00 . A A . 24 TRP C 1 1 11 7461 1 1 24 TRP CA C 4.348 2.663 3.785 1.00 . A A . 24 TRP CA 1 1 11 7462 1 1 24 TRP CB C 4.224 4.184 3.897 1.00 . A A . 24 TRP CB 1 1 11 7463 1 1 24 TRP CD1 C 4.243 4.978 6.334 1.00 . A A . 24 TRP CD1 1 1 11 7464 1 1 24 TRP CD2 C 2.204 4.793 5.438 1.00 . A A . 24 TRP CD2 1 1 11 7465 1 1 24 TRP CE2 C 2.069 5.228 6.768 1.00 . A A . 24 TRP CE2 1 1 11 7466 1 1 24 TRP CE3 C 1.058 4.605 4.671 1.00 . A A . 24 TRP CE3 1 1 11 7467 1 1 24 TRP CG C 3.599 4.636 5.181 1.00 . A A . 24 TRP CG 1 1 11 7468 1 1 24 TRP CH2 C -0.283 5.282 6.568 1.00 . A A . 24 TRP CH2 1 1 11 7469 1 1 24 TRP CZ2 C 0.825 5.477 7.345 1.00 . A A . 24 TRP CZ2 1 1 11 7470 1 1 24 TRP CZ3 C -0.175 4.851 5.241 1.00 . A A . 24 TRP CZ3 1 1 11 7471 1 1 24 TRP H H 6.397 2.224 4.084 1.00 . A A . 24 TRP H 1 1 11 7472 1 1 24 TRP HA H 3.476 2.208 4.231 1.00 . A A . 24 TRP HA 1 1 11 7473 1 1 24 TRP HB2 H 5.207 4.624 3.832 1.00 . A A . 24 TRP HB2 1 1 11 7474 1 1 24 TRP HB3 H 3.615 4.549 3.083 1.00 . A A . 24 TRP HB3 1 1 11 7475 1 1 24 TRP HD1 H 5.315 4.964 6.456 1.00 . A A . 24 TRP HD1 1 1 11 7476 1 1 24 TRP HE1 H 3.544 5.619 8.209 1.00 . A A . 24 TRP HE1 1 1 11 7477 1 1 24 TRP HE3 H 1.127 4.277 3.646 1.00 . A A . 24 TRP HE3 1 1 11 7478 1 1 24 TRP HH2 H -1.265 5.463 6.972 1.00 . A A . 24 TRP HH2 1 1 11 7479 1 1 24 TRP HZ2 H 0.726 5.812 8.367 1.00 . A A . 24 TRP HZ2 1 1 11 7480 1 1 24 TRP HZ3 H -1.076 4.704 4.661 1.00 . A A . 24 TRP HZ3 1 1 11 7481 1 1 24 TRP N N 5.520 2.200 4.518 1.00 . A A . 24 TRP N 1 1 11 7482 1 1 24 TRP NE1 N 3.328 5.335 7.296 1.00 . A A . 24 TRP NE1 1 1 11 7483 1 1 24 TRP O O 5.399 2.542 1.627 1.00 . A A . 24 TRP O 1 1 11 7484 1 1 25 GLY C C 2.382 2.025 -0.377 1.00 . A A . 25 GLY C 1 1 11 7485 1 1 25 GLY CA C 3.317 1.166 0.455 1.00 . A A . 25 GLY CA 1 1 11 7486 1 1 25 GLY H H 2.612 1.404 2.436 1.00 . A A . 25 GLY H 1 1 11 7487 1 1 25 GLY HA2 H 4.311 1.222 0.036 1.00 . A A . 25 GLY HA2 1 1 11 7488 1 1 25 GLY HA3 H 2.978 0.142 0.418 1.00 . A A . 25 GLY HA3 1 1 11 7489 1 1 25 GLY N N 3.366 1.596 1.840 1.00 . A A . 25 GLY N 1 1 11 7490 1 1 25 GLY O O 1.435 2.606 0.150 1.00 . A A . 25 GLY O 1 1 11 7491 1 1 26 CYS C C 0.684 2.087 -3.165 1.00 . A A . 26 CYS C 1 1 11 7492 1 1 26 CYS CA C 1.825 2.912 -2.574 1.00 . A A . 26 CYS CA 1 1 11 7493 1 1 26 CYS CB C 2.679 3.501 -3.698 1.00 . A A . 26 CYS CB 1 1 11 7494 1 1 26 CYS H H 3.423 1.628 -2.039 1.00 . A A . 26 CYS H 1 1 11 7495 1 1 26 CYS HA H 1.402 3.721 -1.997 1.00 . A A . 26 CYS HA 1 1 11 7496 1 1 26 CYS HB2 H 3.716 3.484 -3.399 1.00 . A A . 26 CYS HB2 1 1 11 7497 1 1 26 CYS HB3 H 2.555 2.899 -4.586 1.00 . A A . 26 CYS HB3 1 1 11 7498 1 1 26 CYS N N 2.650 2.109 -1.677 1.00 . A A . 26 CYS N 1 1 11 7499 1 1 26 CYS O O 0.909 1.034 -3.763 1.00 . A A . 26 CYS O 1 1 11 7500 1 1 26 CYS SG S 2.257 5.220 -4.127 1.00 . A A . 26 CYS SG 1 1 11 7501 1 1 27 CYS C C -2.320 2.669 -4.687 1.00 . A A . 27 CYS C 1 1 11 7502 1 1 27 CYS CA C -1.725 1.900 -3.507 1.00 . A A . 27 CYS CA 1 1 11 7503 1 1 27 CYS CB C -2.771 1.752 -2.399 1.00 . A A . 27 CYS CB 1 1 11 7504 1 1 27 CYS H H -0.647 3.422 -2.509 1.00 . A A . 27 CYS H 1 1 11 7505 1 1 27 CYS HA H -1.427 0.918 -3.844 1.00 . A A . 27 CYS HA 1 1 11 7506 1 1 27 CYS HB2 H -2.861 2.691 -1.873 1.00 . A A . 27 CYS HB2 1 1 11 7507 1 1 27 CYS HB3 H -3.723 1.501 -2.841 1.00 . A A . 27 CYS HB3 1 1 11 7508 1 1 27 CYS N N -0.540 2.580 -2.994 1.00 . A A . 27 CYS N 1 1 11 7509 1 1 27 CYS O O -2.665 3.844 -4.557 1.00 . A A . 27 CYS O 1 1 11 7510 1 1 27 CYS SG S -2.371 0.468 -1.168 1.00 . A A . 27 CYS SG 1 1 11 7511 1 1 28 PRO C C -4.511 2.740 -7.045 1.00 . A A . 28 PRO C 1 1 11 7512 1 1 28 PRO CA C -2.986 2.648 -7.068 1.00 . A A . 28 PRO CA 1 1 11 7513 1 1 28 PRO CB C -2.527 1.721 -8.208 1.00 . A A . 28 PRO CB 1 1 11 7514 1 1 28 PRO CD C -2.048 0.633 -6.120 1.00 . A A . 28 PRO CD 1 1 11 7515 1 1 28 PRO CG C -1.665 0.674 -7.571 1.00 . A A . 28 PRO CG 1 1 11 7516 1 1 28 PRO HA H -2.573 3.634 -7.218 1.00 . A A . 28 PRO HA 1 1 11 7517 1 1 28 PRO HB2 H -3.391 1.280 -8.682 1.00 . A A . 28 PRO HB2 1 1 11 7518 1 1 28 PRO HB3 H -1.971 2.295 -8.934 1.00 . A A . 28 PRO HB3 1 1 11 7519 1 1 28 PRO HD2 H -2.877 -0.043 -5.965 1.00 . A A . 28 PRO HD2 1 1 11 7520 1 1 28 PRO HD3 H -1.203 0.349 -5.511 1.00 . A A . 28 PRO HD3 1 1 11 7521 1 1 28 PRO HG2 H -1.851 -0.285 -8.033 1.00 . A A . 28 PRO HG2 1 1 11 7522 1 1 28 PRO HG3 H -0.625 0.943 -7.675 1.00 . A A . 28 PRO HG3 1 1 11 7523 1 1 28 PRO N N -2.442 2.020 -5.862 1.00 . A A . 28 PRO N 1 1 11 7524 1 1 28 PRO O O -5.179 2.349 -8.004 1.00 . A A . 28 PRO O 1 1 11 7525 1 1 29 SER C C -6.837 4.318 -4.627 1.00 . A A . 29 SER C 1 1 11 7526 1 1 29 SER CA C -6.499 3.411 -5.810 1.00 . A A . 29 SER CA 1 1 11 7527 1 1 29 SER CB C -7.161 2.043 -5.626 1.00 . A A . 29 SER CB 1 1 11 7528 1 1 29 SER H H -4.471 3.561 -5.224 1.00 . A A . 29 SER H 1 1 11 7529 1 1 29 SER HA H -6.876 3.864 -6.715 1.00 . A A . 29 SER HA 1 1 11 7530 1 1 29 SER HB2 H -6.409 1.270 -5.689 1.00 . A A . 29 SER HB2 1 1 11 7531 1 1 29 SER HB3 H -7.639 2.003 -4.658 1.00 . A A . 29 SER HB3 1 1 11 7532 1 1 29 SER HG H -8.636 1.021 -6.412 1.00 . A A . 29 SER HG 1 1 11 7533 1 1 29 SER N N -5.055 3.263 -5.952 1.00 . A A . 29 SER N 1 1 11 7534 1 1 29 SER O O -6.202 4.235 -3.576 1.00 . A A . 29 SER O 1 1 11 7535 1 1 29 SER OG O -8.136 1.812 -6.627 1.00 . A A . 29 SER OG 1 1 11 7536 1 1 30 PRO C C -8.767 5.397 -2.480 1.00 . A A . 30 PRO C 1 1 11 7537 1 1 30 PRO CA C -8.253 6.126 -3.719 1.00 . A A . 30 PRO CA 1 1 11 7538 1 1 30 PRO CB C -9.371 6.954 -4.363 1.00 . A A . 30 PRO CB 1 1 11 7539 1 1 30 PRO CD C -8.652 5.371 -6.002 1.00 . A A . 30 PRO CD 1 1 11 7540 1 1 30 PRO CG C -9.849 6.135 -5.514 1.00 . A A . 30 PRO CG 1 1 11 7541 1 1 30 PRO HA H -7.439 6.778 -3.434 1.00 . A A . 30 PRO HA 1 1 11 7542 1 1 30 PRO HB2 H -10.160 7.120 -3.643 1.00 . A A . 30 PRO HB2 1 1 11 7543 1 1 30 PRO HB3 H -8.975 7.902 -4.694 1.00 . A A . 30 PRO HB3 1 1 11 7544 1 1 30 PRO HD2 H -8.951 4.414 -6.403 1.00 . A A . 30 PRO HD2 1 1 11 7545 1 1 30 PRO HD3 H -8.115 5.943 -6.744 1.00 . A A . 30 PRO HD3 1 1 11 7546 1 1 30 PRO HG2 H -10.620 5.455 -5.185 1.00 . A A . 30 PRO HG2 1 1 11 7547 1 1 30 PRO HG3 H -10.224 6.781 -6.294 1.00 . A A . 30 PRO HG3 1 1 11 7548 1 1 30 PRO N N -7.842 5.201 -4.783 1.00 . A A . 30 PRO N 1 1 11 7549 1 1 30 PRO O O -8.013 5.153 -1.538 1.00 . A A . 30 PRO O 1 1 11 7550 1 1 31 LYS C C -10.428 2.844 -1.478 1.00 . A A . 31 LYS C 1 1 11 7551 1 1 31 LYS CA C -10.659 4.348 -1.361 1.00 . A A . 31 LYS CA 1 1 11 7552 1 1 31 LYS CB C -12.159 4.649 -1.287 1.00 . A A . 31 LYS CB 1 1 11 7553 1 1 31 LYS CD C -13.892 5.796 -2.705 1.00 . A A . 31 LYS CD 1 1 11 7554 1 1 31 LYS CE C -13.886 6.500 -4.053 1.00 . A A . 31 LYS CE 1 1 11 7555 1 1 31 LYS CG C -12.842 4.698 -2.644 1.00 . A A . 31 LYS CG 1 1 11 7556 1 1 31 LYS H H -10.602 5.271 -3.265 1.00 . A A . 31 LYS H 1 1 11 7557 1 1 31 LYS HA H -10.185 4.701 -0.458 1.00 . A A . 31 LYS HA 1 1 11 7558 1 1 31 LYS HB2 H -12.640 3.883 -0.696 1.00 . A A . 31 LYS HB2 1 1 11 7559 1 1 31 LYS HB3 H -12.299 5.604 -0.803 1.00 . A A . 31 LYS HB3 1 1 11 7560 1 1 31 LYS HD2 H -14.866 5.358 -2.544 1.00 . A A . 31 LYS HD2 1 1 11 7561 1 1 31 LYS HD3 H -13.687 6.519 -1.930 1.00 . A A . 31 LYS HD3 1 1 11 7562 1 1 31 LYS HE2 H -12.863 6.688 -4.342 1.00 . A A . 31 LYS HE2 1 1 11 7563 1 1 31 LYS HE3 H -14.352 5.853 -4.784 1.00 . A A . 31 LYS HE3 1 1 11 7564 1 1 31 LYS HG2 H -12.097 4.885 -3.404 1.00 . A A . 31 LYS HG2 1 1 11 7565 1 1 31 LYS HG3 H -13.316 3.747 -2.831 1.00 . A A . 31 LYS HG3 1 1 11 7566 1 1 31 LYS HZ1 H -15.002 7.957 -3.056 1.00 . A A . 31 LYS HZ1 1 1 11 7567 1 1 31 LYS HZ2 H -15.414 7.777 -4.686 1.00 . A A . 31 LYS HZ2 1 1 11 7568 1 1 31 LYS HZ3 H -13.986 8.577 -4.258 1.00 . A A . 31 LYS HZ3 1 1 11 7569 1 1 31 LYS N N -10.051 5.050 -2.486 1.00 . A A . 31 LYS N 1 1 11 7570 1 1 31 LYS NZ N -14.624 7.792 -4.010 1.00 . A A . 31 LYS NZ 1 1 11 7571 1 1 31 LYS O O -11.373 2.055 -1.481 1.00 . A A . 31 LYS O 1 1 11 7572 1 1 32 ALA C C -8.881 0.342 -0.347 1.00 . A A . 32 ALA C 1 1 11 7573 1 1 32 ALA CA C -8.790 1.052 -1.694 1.00 . A A . 32 ALA CA 1 1 11 7574 1 1 32 ALA CB C -7.382 0.929 -2.258 1.00 . A A . 32 ALA CB 1 1 11 7575 1 1 32 ALA H H -8.453 3.136 -1.568 1.00 . A A . 32 ALA H 1 1 11 7576 1 1 32 ALA HA H -9.471 0.581 -2.389 1.00 . A A . 32 ALA HA 1 1 11 7577 1 1 32 ALA HB1 H -6.794 0.285 -1.620 1.00 . A A . 32 ALA HB1 1 1 11 7578 1 1 32 ALA HB2 H -6.924 1.905 -2.303 1.00 . A A . 32 ALA HB2 1 1 11 7579 1 1 32 ALA HB3 H -7.427 0.506 -3.250 1.00 . A A . 32 ALA HB3 1 1 11 7580 1 1 32 ALA N N -9.159 2.457 -1.575 1.00 . A A . 32 ALA N 1 1 11 7581 1 1 32 ALA O O -8.968 0.983 0.700 1.00 . A A . 32 ALA O 1 1 11 7582 1 1 33 VAL C C -7.554 -2.428 1.110 1.00 . A A . 33 VAL C 1 1 11 7583 1 1 33 VAL CA C -8.911 -1.794 0.828 1.00 . A A . 33 VAL CA 1 1 11 7584 1 1 33 VAL CB C -9.976 -2.901 0.714 1.00 . A A . 33 VAL CB 1 1 11 7585 1 1 33 VAL CG1 C -10.423 -3.357 2.094 1.00 . A A . 33 VAL CG1 1 1 11 7586 1 1 33 VAL CG2 C -11.164 -2.418 -0.106 1.00 . A A . 33 VAL CG2 1 1 11 7587 1 1 33 VAL H H -8.765 -1.438 -1.248 1.00 . A A . 33 VAL H 1 1 11 7588 1 1 33 VAL HA H -9.175 -1.144 1.650 1.00 . A A . 33 VAL HA 1 1 11 7589 1 1 33 VAL HB H -9.535 -3.745 0.205 1.00 . A A . 33 VAL HB 1 1 11 7590 1 1 33 VAL HG11 H -10.938 -4.302 2.011 1.00 . A A . 33 VAL HG11 1 1 11 7591 1 1 33 VAL HG12 H -11.089 -2.620 2.518 1.00 . A A . 33 VAL HG12 1 1 11 7592 1 1 33 VAL HG13 H -9.560 -3.472 2.732 1.00 . A A . 33 VAL HG13 1 1 11 7593 1 1 33 VAL HG21 H -11.165 -2.913 -1.065 1.00 . A A . 33 VAL HG21 1 1 11 7594 1 1 33 VAL HG22 H -11.091 -1.349 -0.251 1.00 . A A . 33 VAL HG22 1 1 11 7595 1 1 33 VAL HG23 H -12.080 -2.647 0.418 1.00 . A A . 33 VAL HG23 1 1 11 7596 1 1 33 VAL N N -8.846 -0.987 -0.384 1.00 . A A . 33 VAL N 1 1 11 7597 1 1 33 VAL O O -7.122 -3.335 0.399 1.00 . A A . 33 VAL O 1 1 11 7598 1 1 34 CYS C C -5.622 -3.875 3.012 1.00 . A A . 34 CYS C 1 1 11 7599 1 1 34 CYS CA C -5.562 -2.438 2.506 1.00 . A A . 34 CYS CA 1 1 11 7600 1 1 34 CYS CB C -4.934 -1.535 3.572 1.00 . A A . 34 CYS CB 1 1 11 7601 1 1 34 CYS H H -7.273 -1.205 2.664 1.00 . A A . 34 CYS H 1 1 11 7602 1 1 34 CYS HA H -4.944 -2.410 1.621 1.00 . A A . 34 CYS HA 1 1 11 7603 1 1 34 CYS HB2 H -5.459 -0.592 3.591 1.00 . A A . 34 CYS HB2 1 1 11 7604 1 1 34 CYS HB3 H -5.023 -2.008 4.539 1.00 . A A . 34 CYS HB3 1 1 11 7605 1 1 34 CYS N N -6.880 -1.934 2.141 1.00 . A A . 34 CYS N 1 1 11 7606 1 1 34 CYS O O -5.879 -4.110 4.194 1.00 . A A . 34 CYS O 1 1 11 7607 1 1 34 CYS SG S -3.174 -1.179 3.294 1.00 . A A . 34 CYS SG 1 1 11 7608 1 1 35 CYS C C -4.448 -6.436 3.702 1.00 . A A . 35 CYS C 1 1 11 7609 1 1 35 CYS CA C -5.366 -6.245 2.503 1.00 . A A . 35 CYS CA 1 1 11 7610 1 1 35 CYS CB C -4.917 -7.126 1.336 1.00 . A A . 35 CYS CB 1 1 11 7611 1 1 35 CYS H H -5.150 -4.590 1.195 1.00 . A A . 35 CYS H 1 1 11 7612 1 1 35 CYS HA H -6.374 -6.512 2.787 1.00 . A A . 35 CYS HA 1 1 11 7613 1 1 35 CYS HB2 H -5.011 -6.567 0.417 1.00 . A A . 35 CYS HB2 1 1 11 7614 1 1 35 CYS HB3 H -3.883 -7.402 1.479 1.00 . A A . 35 CYS HB3 1 1 11 7615 1 1 35 CYS N N -5.363 -4.835 2.121 1.00 . A A . 35 CYS N 1 1 11 7616 1 1 35 CYS O O -3.223 -6.295 3.590 1.00 . A A . 35 CYS O 1 1 11 7617 1 1 35 CYS SG S -5.882 -8.661 1.150 1.00 . A A . 35 CYS SG 1 1 11 7618 1 1 36 ASP C C -4.031 -8.349 6.429 1.00 . A A . 36 ASP C 1 1 11 7619 1 1 36 ASP CA C -4.330 -6.889 6.102 1.00 . A A . 36 ASP CA 1 1 11 7620 1 1 36 ASP CB C -5.112 -6.255 7.252 1.00 . A A . 36 ASP CB 1 1 11 7621 1 1 36 ASP CG C -4.300 -6.179 8.531 1.00 . A A . 36 ASP CG 1 1 11 7622 1 1 36 ASP H H -6.039 -6.801 4.854 1.00 . A A . 36 ASP H 1 1 11 7623 1 1 36 ASP HA H -3.392 -6.366 5.999 1.00 . A A . 36 ASP HA 1 1 11 7624 1 1 36 ASP HB2 H -5.401 -5.252 6.973 1.00 . A A . 36 ASP HB2 1 1 11 7625 1 1 36 ASP HB3 H -5.999 -6.841 7.444 1.00 . A A . 36 ASP HB3 1 1 11 7626 1 1 36 ASP N N -5.061 -6.721 4.851 1.00 . A A . 36 ASP N 1 1 11 7627 1 1 36 ASP O O -3.173 -8.621 7.270 1.00 . A A . 36 ASP O 1 1 11 7628 1 1 36 ASP OD1 O -3.186 -5.616 8.496 1.00 . A A . 36 ASP OD1 1 1 11 7629 1 1 36 ASP OD2 O -4.779 -6.684 9.569 1.00 . A A . 36 ASP OD2 1 1 11 7630 1 1 37 ASP C C -2.977 -11.000 5.886 1.00 . A A . 37 ASP C 1 1 11 7631 1 1 37 ASP CA C -4.461 -10.708 6.048 1.00 . A A . 37 ASP CA 1 1 11 7632 1 1 37 ASP CB C -5.278 -11.589 5.099 1.00 . A A . 37 ASP CB 1 1 11 7633 1 1 37 ASP CG C -6.703 -11.787 5.577 1.00 . A A . 37 ASP CG 1 1 11 7634 1 1 37 ASP H H -5.386 -9.057 5.108 1.00 . A A . 37 ASP H 1 1 11 7635 1 1 37 ASP HA H -4.752 -10.914 7.066 1.00 . A A . 37 ASP HA 1 1 11 7636 1 1 37 ASP HB2 H -5.306 -11.128 4.123 1.00 . A A . 37 ASP HB2 1 1 11 7637 1 1 37 ASP HB3 H -4.804 -12.557 5.023 1.00 . A A . 37 ASP HB3 1 1 11 7638 1 1 37 ASP N N -4.713 -9.294 5.781 1.00 . A A . 37 ASP N 1 1 11 7639 1 1 37 ASP O O -2.375 -11.710 6.691 1.00 . A A . 37 ASP O 1 1 11 7640 1 1 37 ASP OD1 O -6.962 -12.792 6.274 1.00 . A A . 37 ASP OD1 1 1 11 7641 1 1 37 ASP OD2 O -7.561 -10.939 5.254 1.00 . A A . 37 ASP OD2 1 1 11 7642 1 1 38 MET C C -0.347 -9.192 4.394 1.00 . A A . 38 MET C 1 1 11 7643 1 1 38 MET CA C -0.980 -10.570 4.563 1.00 . A A . 38 MET CA 1 1 11 7644 1 1 38 MET CB C -0.769 -11.419 3.306 1.00 . A A . 38 MET CB 1 1 11 7645 1 1 38 MET CE C -3.593 -12.486 1.742 1.00 . A A . 38 MET CE 1 1 11 7646 1 1 38 MET CG C -1.392 -12.803 3.395 1.00 . A A . 38 MET CG 1 1 11 7647 1 1 38 MET H H -2.939 -9.852 4.257 1.00 . A A . 38 MET H 1 1 11 7648 1 1 38 MET HA H -0.522 -11.065 5.408 1.00 . A A . 38 MET HA 1 1 11 7649 1 1 38 MET HB2 H -1.204 -10.905 2.462 1.00 . A A . 38 MET HB2 1 1 11 7650 1 1 38 MET HB3 H 0.291 -11.535 3.138 1.00 . A A . 38 MET HB3 1 1 11 7651 1 1 38 MET HE1 H -3.831 -12.261 0.713 1.00 . A A . 38 MET HE1 1 1 11 7652 1 1 38 MET HE2 H -3.507 -11.567 2.301 1.00 . A A . 38 MET HE2 1 1 11 7653 1 1 38 MET HE3 H -4.375 -13.096 2.168 1.00 . A A . 38 MET HE3 1 1 11 7654 1 1 38 MET HG2 H -0.640 -13.500 3.733 1.00 . A A . 38 MET HG2 1 1 11 7655 1 1 38 MET HG3 H -2.201 -12.773 4.110 1.00 . A A . 38 MET HG3 1 1 11 7656 1 1 38 MET N N -2.397 -10.417 4.846 1.00 . A A . 38 MET N 1 1 11 7657 1 1 38 MET O O -0.090 -8.495 5.375 1.00 . A A . 38 MET O 1 1 11 7658 1 1 38 MET SD S -2.039 -13.375 1.812 1.00 . A A . 38 MET SD 1 1 11 7659 1 1 39 GLN C C -0.006 -7.028 1.453 1.00 . A A . 39 GLN C 1 1 11 7660 1 1 39 GLN CA C 0.416 -7.468 2.852 1.00 . A A . 39 GLN CA 1 1 11 7661 1 1 39 GLN CB C 1.942 -7.490 2.959 1.00 . A A . 39 GLN CB 1 1 11 7662 1 1 39 GLN CD C 3.717 -6.006 3.974 1.00 . A A . 39 GLN CD 1 1 11 7663 1 1 39 GLN CG C 2.570 -6.106 2.989 1.00 . A A . 39 GLN CG 1 1 11 7664 1 1 39 GLN H H -0.407 -9.354 2.396 1.00 . A A . 39 GLN H 1 1 11 7665 1 1 39 GLN HA H 0.019 -6.768 3.574 1.00 . A A . 39 GLN HA 1 1 11 7666 1 1 39 GLN HB2 H 2.219 -8.007 3.866 1.00 . A A . 39 GLN HB2 1 1 11 7667 1 1 39 GLN HB3 H 2.343 -8.026 2.113 1.00 . A A . 39 GLN HB3 1 1 11 7668 1 1 39 GLN HE21 H 2.635 -6.927 5.365 1.00 . A A . 39 GLN HE21 1 1 11 7669 1 1 39 GLN HE22 H 4.232 -6.469 5.838 1.00 . A A . 39 GLN HE22 1 1 11 7670 1 1 39 GLN HG2 H 2.943 -5.873 2.002 1.00 . A A . 39 GLN HG2 1 1 11 7671 1 1 39 GLN HG3 H 1.813 -5.387 3.265 1.00 . A A . 39 GLN HG3 1 1 11 7672 1 1 39 GLN N N -0.137 -8.782 3.145 1.00 . A A . 39 GLN N 1 1 11 7673 1 1 39 GLN NE2 N 3.507 -6.518 5.182 1.00 . A A . 39 GLN NE2 1 1 11 7674 1 1 39 GLN O O 0.746 -7.219 0.497 1.00 . A A . 39 GLN O 1 1 11 7675 1 1 39 GLN OE1 O 4.781 -5.474 3.656 1.00 . A A . 39 GLN OE1 1 1 11 7676 1 1 40 HIS C C -2.665 -4.918 -0.011 1.00 . A A . 40 HIS C 1 1 11 7677 1 1 40 HIS CA C -1.656 -6.060 -0.023 1.00 . A A . 40 HIS CA 1 1 11 7678 1 1 40 HIS CB C -2.252 -7.262 -0.758 1.00 . A A . 40 HIS CB 1 1 11 7679 1 1 40 HIS CD2 C -0.501 -8.752 -1.958 1.00 . A A . 40 HIS CD2 1 1 11 7680 1 1 40 HIS CE1 C -0.586 -7.817 -3.938 1.00 . A A . 40 HIS CE1 1 1 11 7681 1 1 40 HIS CG C -1.406 -7.748 -1.894 1.00 . A A . 40 HIS CG 1 1 11 7682 1 1 40 HIS H H -1.795 -6.355 2.096 1.00 . A A . 40 HIS H 1 1 11 7683 1 1 40 HIS HA H -0.783 -5.733 -0.567 1.00 . A A . 40 HIS HA 1 1 11 7684 1 1 40 HIS HB2 H -2.371 -8.079 -0.061 1.00 . A A . 40 HIS HB2 1 1 11 7685 1 1 40 HIS HB3 H -3.219 -6.988 -1.154 1.00 . A A . 40 HIS HB3 1 1 11 7686 1 1 40 HIS HD1 H -1.997 -6.427 -3.426 1.00 . A A . 40 HIS HD1 1 1 11 7687 1 1 40 HIS HD2 H -0.220 -9.414 -1.150 1.00 . A A . 40 HIS HD2 1 1 11 7688 1 1 40 HIS HE1 H -0.395 -7.590 -4.977 1.00 . A A . 40 HIS HE1 1 1 11 7689 1 1 40 HIS HE2 H 0.741 -9.327 -3.551 1.00 . A A . 40 HIS HE2 1 1 11 7690 1 1 40 HIS N N -1.208 -6.466 1.311 1.00 . A A . 40 HIS N 1 1 11 7691 1 1 40 HIS ND1 N -1.436 -7.182 -3.151 1.00 . A A . 40 HIS ND1 1 1 11 7692 1 1 40 HIS NE2 N -0.005 -8.774 -3.239 1.00 . A A . 40 HIS NE2 1 1 11 7693 1 1 40 HIS O O -2.980 -4.345 1.032 1.00 . A A . 40 HIS O 1 1 11 7694 1 1 41 CYS C C -5.175 -3.978 -2.440 1.00 . A A . 41 CYS C 1 1 11 7695 1 1 41 CYS CA C -4.132 -3.539 -1.416 1.00 . A A . 41 CYS CA 1 1 11 7696 1 1 41 CYS CB C -3.427 -2.272 -1.910 1.00 . A A . 41 CYS CB 1 1 11 7697 1 1 41 CYS H H -2.846 -5.110 -1.989 1.00 . A A . 41 CYS H 1 1 11 7698 1 1 41 CYS HA H -4.619 -3.335 -0.474 1.00 . A A . 41 CYS HA 1 1 11 7699 1 1 41 CYS HB2 H -2.370 -2.357 -1.706 1.00 . A A . 41 CYS HB2 1 1 11 7700 1 1 41 CYS HB3 H -3.574 -2.183 -2.977 1.00 . A A . 41 CYS HB3 1 1 11 7701 1 1 41 CYS N N -3.157 -4.602 -1.210 1.00 . A A . 41 CYS N 1 1 11 7702 1 1 41 CYS O O -4.860 -4.710 -3.379 1.00 . A A . 41 CYS O 1 1 11 7703 1 1 41 CYS SG S -4.013 -0.728 -1.140 1.00 . A A . 41 CYS SG 1 1 11 7704 1 1 42 CYS C C -8.119 -2.637 -3.792 1.00 . A A . 42 CYS C 1 1 11 7705 1 1 42 CYS CA C -7.491 -3.888 -3.182 1.00 . A A . 42 CYS CA 1 1 11 7706 1 1 42 CYS CB C -8.561 -4.710 -2.458 1.00 . A A . 42 CYS CB 1 1 11 7707 1 1 42 CYS H H -6.608 -2.950 -1.498 1.00 . A A . 42 CYS H 1 1 11 7708 1 1 42 CYS HA H -7.066 -4.485 -3.973 1.00 . A A . 42 CYS HA 1 1 11 7709 1 1 42 CYS HB2 H -8.490 -4.523 -1.397 1.00 . A A . 42 CYS HB2 1 1 11 7710 1 1 42 CYS HB3 H -9.536 -4.402 -2.806 1.00 . A A . 42 CYS HB3 1 1 11 7711 1 1 42 CYS N N -6.414 -3.532 -2.262 1.00 . A A . 42 CYS N 1 1 11 7712 1 1 42 CYS O O -8.503 -1.718 -3.073 1.00 . A A . 42 CYS O 1 1 11 7713 1 1 42 CYS SG S -8.424 -6.510 -2.712 1.00 . A A . 42 CYS SG 1 1 11 7714 1 1 43 PRO C C -10.170 -1.024 -5.265 1.00 . A A . 43 PRO C 1 1 11 7715 1 1 43 PRO CA C -8.811 -1.426 -5.827 1.00 . A A . 43 PRO CA 1 1 11 7716 1 1 43 PRO CB C -8.946 -1.916 -7.269 1.00 . A A . 43 PRO CB 1 1 11 7717 1 1 43 PRO CD C -7.795 -3.627 -6.077 1.00 . A A . 43 PRO CD 1 1 11 7718 1 1 43 PRO CG C -7.871 -2.934 -7.408 1.00 . A A . 43 PRO CG 1 1 11 7719 1 1 43 PRO HA H -8.148 -0.575 -5.796 1.00 . A A . 43 PRO HA 1 1 11 7720 1 1 43 PRO HB2 H -9.925 -2.348 -7.417 1.00 . A A . 43 PRO HB2 1 1 11 7721 1 1 43 PRO HB3 H -8.800 -1.092 -7.949 1.00 . A A . 43 PRO HB3 1 1 11 7722 1 1 43 PRO HD2 H -8.467 -4.473 -6.053 1.00 . A A . 43 PRO HD2 1 1 11 7723 1 1 43 PRO HD3 H -6.782 -3.939 -5.868 1.00 . A A . 43 PRO HD3 1 1 11 7724 1 1 43 PRO HG2 H -8.125 -3.637 -8.187 1.00 . A A . 43 PRO HG2 1 1 11 7725 1 1 43 PRO HG3 H -6.933 -2.446 -7.628 1.00 . A A . 43 PRO HG3 1 1 11 7726 1 1 43 PRO N N -8.230 -2.581 -5.131 1.00 . A A . 43 PRO N 1 1 11 7727 1 1 43 PRO O O -11.020 -1.875 -4.991 1.00 . A A . 43 PRO O 1 1 11 7728 1 1 44 ALA C C -12.814 0.179 -5.222 1.00 . A A . 44 ALA C 1 1 11 7729 1 1 44 ALA CA C -11.601 0.821 -4.558 1.00 . A A . 44 ALA CA 1 1 11 7730 1 1 44 ALA CB C -11.638 2.330 -4.742 1.00 . A A . 44 ALA CB 1 1 11 7731 1 1 44 ALA H H -9.630 0.896 -5.324 1.00 . A A . 44 ALA H 1 1 11 7732 1 1 44 ALA HA H -11.629 0.610 -3.498 1.00 . A A . 44 ALA HA 1 1 11 7733 1 1 44 ALA HB1 H -12.648 2.684 -4.608 1.00 . A A . 44 ALA HB1 1 1 11 7734 1 1 44 ALA HB2 H -11.298 2.579 -5.737 1.00 . A A . 44 ALA HB2 1 1 11 7735 1 1 44 ALA HB3 H -10.992 2.797 -4.014 1.00 . A A . 44 ALA HB3 1 1 11 7736 1 1 44 ALA N N -10.357 0.281 -5.092 1.00 . A A . 44 ALA N 1 1 11 7737 1 1 44 ALA O O -13.113 0.449 -6.385 1.00 . A A . 44 ALA O 1 1 11 7738 1 1 45 GLY C C -14.591 -2.846 -4.912 1.00 . A A . 45 GLY C 1 1 11 7739 1 1 45 GLY CA C -14.681 -1.336 -5.003 1.00 . A A . 45 GLY CA 1 1 11 7740 1 1 45 GLY H H -13.222 -0.844 -3.551 1.00 . A A . 45 GLY H 1 1 11 7741 1 1 45 GLY HA2 H -15.548 -1.004 -4.453 1.00 . A A . 45 GLY HA2 1 1 11 7742 1 1 45 GLY HA3 H -14.799 -1.056 -6.041 1.00 . A A . 45 GLY HA3 1 1 11 7743 1 1 45 GLY N N -13.508 -0.671 -4.472 1.00 . A A . 45 GLY N 1 1 11 7744 1 1 45 GLY O O -15.554 -3.547 -5.222 1.00 . A A . 45 GLY O 1 1 11 7745 1 1 46 TYR C C -12.803 -5.145 -2.926 1.00 . A A . 46 TYR C 1 1 11 7746 1 1 46 TYR CA C -13.242 -4.792 -4.345 1.00 . A A . 46 TYR CA 1 1 11 7747 1 1 46 TYR CB C -12.198 -5.285 -5.349 1.00 . A A . 46 TYR CB 1 1 11 7748 1 1 46 TYR CD1 C -11.712 -4.160 -7.556 1.00 . A A . 46 TYR CD1 1 1 11 7749 1 1 46 TYR CD2 C -13.688 -5.481 -7.379 1.00 . A A . 46 TYR CD2 1 1 11 7750 1 1 46 TYR CE1 C -12.021 -3.867 -8.871 1.00 . A A . 46 TYR CE1 1 1 11 7751 1 1 46 TYR CE2 C -14.003 -5.194 -8.693 1.00 . A A . 46 TYR CE2 1 1 11 7752 1 1 46 TYR CG C -12.541 -4.968 -6.788 1.00 . A A . 46 TYR CG 1 1 11 7753 1 1 46 TYR CZ C -13.166 -4.388 -9.434 1.00 . A A . 46 TYR CZ 1 1 11 7754 1 1 46 TYR H H -12.703 -2.751 -4.236 1.00 . A A . 46 TYR H 1 1 11 7755 1 1 46 TYR HA H -14.185 -5.277 -4.550 1.00 . A A . 46 TYR HA 1 1 11 7756 1 1 46 TYR HB2 H -11.248 -4.821 -5.127 1.00 . A A . 46 TYR HB2 1 1 11 7757 1 1 46 TYR HB3 H -12.100 -6.356 -5.259 1.00 . A A . 46 TYR HB3 1 1 11 7758 1 1 46 TYR HD1 H -10.815 -3.754 -7.112 1.00 . A A . 46 TYR HD1 1 1 11 7759 1 1 46 TYR HD2 H -14.342 -6.111 -6.794 1.00 . A A . 46 TYR HD2 1 1 11 7760 1 1 46 TYR HE1 H -11.364 -3.236 -9.452 1.00 . A A . 46 TYR HE1 1 1 11 7761 1 1 46 TYR HE2 H -14.901 -5.602 -9.134 1.00 . A A . 46 TYR HE2 1 1 11 7762 1 1 46 TYR HH H -13.795 -4.895 -11.179 1.00 . A A . 46 TYR HH 1 1 11 7763 1 1 46 TYR N N -13.439 -3.352 -4.479 1.00 . A A . 46 TYR N 1 1 11 7764 1 1 46 TYR O O -12.397 -4.273 -2.160 1.00 . A A . 46 TYR O 1 1 11 7765 1 1 46 TYR OH O -13.477 -4.101 -10.744 1.00 . A A . 46 TYR OH 1 1 11 7766 1 1 47 LYS C C -11.592 -8.110 -1.335 1.00 . A A . 47 LYS C 1 1 11 7767 1 1 47 LYS CA C -12.504 -6.888 -1.252 1.00 . A A . 47 LYS CA 1 1 11 7768 1 1 47 LYS CB C -13.749 -7.219 -0.425 1.00 . A A . 47 LYS CB 1 1 11 7769 1 1 47 LYS CD C -14.486 -9.487 0.368 1.00 . A A . 47 LYS CD 1 1 11 7770 1 1 47 LYS CE C -15.861 -9.465 1.015 1.00 . A A . 47 LYS CE 1 1 11 7771 1 1 47 LYS CG C -14.411 -8.532 -0.812 1.00 . A A . 47 LYS CG 1 1 11 7772 1 1 47 LYS H H -13.225 -7.074 -3.235 1.00 . A A . 47 LYS H 1 1 11 7773 1 1 47 LYS HA H -11.966 -6.086 -0.769 1.00 . A A . 47 LYS HA 1 1 11 7774 1 1 47 LYS HB2 H -13.470 -7.275 0.617 1.00 . A A . 47 LYS HB2 1 1 11 7775 1 1 47 LYS HB3 H -14.471 -6.426 -0.552 1.00 . A A . 47 LYS HB3 1 1 11 7776 1 1 47 LYS HD2 H -14.279 -10.490 0.022 1.00 . A A . 47 LYS HD2 1 1 11 7777 1 1 47 LYS HD3 H -13.748 -9.197 1.101 1.00 . A A . 47 LYS HD3 1 1 11 7778 1 1 47 LYS HE2 H -16.599 -9.739 0.275 1.00 . A A . 47 LYS HE2 1 1 11 7779 1 1 47 LYS HE3 H -15.877 -10.183 1.822 1.00 . A A . 47 LYS HE3 1 1 11 7780 1 1 47 LYS HG2 H -15.412 -8.331 -1.164 1.00 . A A . 47 LYS HG2 1 1 11 7781 1 1 47 LYS HG3 H -13.836 -8.993 -1.602 1.00 . A A . 47 LYS HG3 1 1 11 7782 1 1 47 LYS HZ1 H -15.674 -7.948 2.438 1.00 . A A . 47 LYS HZ1 1 1 11 7783 1 1 47 LYS HZ2 H -17.218 -8.059 1.755 1.00 . A A . 47 LYS HZ2 1 1 11 7784 1 1 47 LYS HZ3 H -15.947 -7.382 0.867 1.00 . A A . 47 LYS HZ3 1 1 11 7785 1 1 47 LYS N N -12.891 -6.426 -2.583 1.00 . A A . 47 LYS N 1 1 11 7786 1 1 47 LYS NZ N -16.199 -8.120 1.557 1.00 . A A . 47 LYS NZ 1 1 11 7787 1 1 47 LYS O O -11.542 -8.793 -2.359 1.00 . A A . 47 LYS O 1 1 11 7788 1 1 48 CYS C C -10.724 -10.787 0.214 1.00 . A A . 48 CYS C 1 1 11 7789 1 1 48 CYS CA C -9.971 -9.520 -0.182 1.00 . A A . 48 CYS CA 1 1 11 7790 1 1 48 CYS CB C -8.844 -9.250 0.819 1.00 . A A . 48 CYS CB 1 1 11 7791 1 1 48 CYS H H -10.968 -7.796 0.538 1.00 . A A . 48 CYS H 1 1 11 7792 1 1 48 CYS HA H -9.543 -9.660 -1.164 1.00 . A A . 48 CYS HA 1 1 11 7793 1 1 48 CYS HB2 H -9.269 -8.857 1.731 1.00 . A A . 48 CYS HB2 1 1 11 7794 1 1 48 CYS HB3 H -8.337 -10.179 1.037 1.00 . A A . 48 CYS HB3 1 1 11 7795 1 1 48 CYS N N -10.879 -8.380 -0.245 1.00 . A A . 48 CYS N 1 1 11 7796 1 1 48 CYS O O -11.325 -10.854 1.287 1.00 . A A . 48 CYS O 1 1 11 7797 1 1 48 CYS SG S -7.593 -8.059 0.236 1.00 . A A . 48 CYS SG 1 1 11 7798 1 1 49 GLY C C -10.535 -14.001 0.434 1.00 . A A . 49 GLY C 1 1 11 7799 1 1 49 GLY CA C -11.377 -13.040 -0.387 1.00 . A A . 49 GLY CA 1 1 11 7800 1 1 49 GLY H H -10.197 -11.677 -1.500 1.00 . A A . 49 GLY H 1 1 11 7801 1 1 49 GLY HA2 H -12.288 -12.825 0.155 1.00 . A A . 49 GLY HA2 1 1 11 7802 1 1 49 GLY HA3 H -11.631 -13.510 -1.324 1.00 . A A . 49 GLY HA3 1 1 11 7803 1 1 49 GLY N N -10.691 -11.789 -0.660 1.00 . A A . 49 GLY N 1 1 11 7804 1 1 49 GLY O O -9.386 -13.701 0.757 1.00 . A A . 49 GLY O 1 1 11 7805 1 1 50 PRO C C -9.109 -16.683 0.872 1.00 . A A . 50 PRO C 1 1 11 7806 1 1 50 PRO CA C -10.364 -16.184 1.580 1.00 . A A . 50 PRO CA 1 1 11 7807 1 1 50 PRO CB C -11.376 -17.326 1.735 1.00 . A A . 50 PRO CB 1 1 11 7808 1 1 50 PRO CD C -12.447 -15.623 0.449 1.00 . A A . 50 PRO CD 1 1 11 7809 1 1 50 PRO CG C -12.704 -16.713 1.448 1.00 . A A . 50 PRO CG 1 1 11 7810 1 1 50 PRO HA H -10.096 -15.802 2.554 1.00 . A A . 50 PRO HA 1 1 11 7811 1 1 50 PRO HB2 H -11.145 -18.112 1.031 1.00 . A A . 50 PRO HB2 1 1 11 7812 1 1 50 PRO HB3 H -11.331 -17.714 2.741 1.00 . A A . 50 PRO HB3 1 1 11 7813 1 1 50 PRO HD2 H -12.488 -16.014 -0.557 1.00 . A A . 50 PRO HD2 1 1 11 7814 1 1 50 PRO HD3 H -13.157 -14.819 0.575 1.00 . A A . 50 PRO HD3 1 1 11 7815 1 1 50 PRO HG2 H -13.369 -17.455 1.032 1.00 . A A . 50 PRO HG2 1 1 11 7816 1 1 50 PRO HG3 H -13.121 -16.300 2.354 1.00 . A A . 50 PRO HG3 1 1 11 7817 1 1 50 PRO N N -11.085 -15.179 0.789 1.00 . A A . 50 PRO N 1 1 11 7818 1 1 50 PRO O O -8.170 -17.157 1.512 1.00 . A A . 50 PRO O 1 1 11 7819 1 1 51 GLY C C -7.079 -15.872 -1.681 1.00 . A A . 51 GLY C 1 1 11 7820 1 1 51 GLY CA C -7.958 -17.021 -1.228 1.00 . A A . 51 GLY CA 1 1 11 7821 1 1 51 GLY H H -9.879 -16.190 -0.909 1.00 . A A . 51 GLY H 1 1 11 7822 1 1 51 GLY HA2 H -7.368 -17.695 -0.623 1.00 . A A . 51 GLY HA2 1 1 11 7823 1 1 51 GLY HA3 H -8.312 -17.553 -2.098 1.00 . A A . 51 GLY HA3 1 1 11 7824 1 1 51 GLY N N -9.101 -16.575 -0.453 1.00 . A A . 51 GLY N 1 1 11 7825 1 1 51 GLY O O -6.419 -15.965 -2.715 1.00 . A A . 51 GLY O 1 1 11 7826 1 1 52 GLY C C -6.472 -13.176 -2.674 1.00 . A A . 52 GLY C 1 1 11 7827 1 1 52 GLY CA C -6.264 -13.630 -1.243 1.00 . A A . 52 GLY CA 1 1 11 7828 1 1 52 GLY H H -7.616 -14.783 -0.089 1.00 . A A . 52 GLY H 1 1 11 7829 1 1 52 GLY HA2 H -6.523 -12.819 -0.579 1.00 . A A . 52 GLY HA2 1 1 11 7830 1 1 52 GLY HA3 H -5.222 -13.877 -1.102 1.00 . A A . 52 GLY HA3 1 1 11 7831 1 1 52 GLY N N -7.072 -14.791 -0.903 1.00 . A A . 52 GLY N 1 1 11 7832 1 1 52 GLY O O -5.781 -13.638 -3.581 1.00 . A A . 52 GLY O 1 1 11 7833 1 1 53 THR C C -8.745 -10.613 -4.102 1.00 . A A . 53 THR C 1 1 11 7834 1 1 53 THR CA C -7.724 -11.740 -4.204 1.00 . A A . 53 THR CA 1 1 11 7835 1 1 53 THR CB C -8.289 -12.832 -5.135 1.00 . A A . 53 THR CB 1 1 11 7836 1 1 53 THR CG2 C -7.228 -13.326 -6.106 1.00 . A A . 53 THR CG2 1 1 11 7837 1 1 53 THR H H -7.936 -11.922 -2.115 1.00 . A A . 53 THR H 1 1 11 7838 1 1 53 THR HA H -6.810 -11.357 -4.634 1.00 . A A . 53 THR HA 1 1 11 7839 1 1 53 THR HB H -9.105 -12.411 -5.702 1.00 . A A . 53 THR HB 1 1 11 7840 1 1 53 THR HG1 H -9.674 -13.741 -4.063 1.00 . A A . 53 THR HG1 1 1 11 7841 1 1 53 THR HG21 H -7.638 -13.350 -7.105 1.00 . A A . 53 THR HG21 1 1 11 7842 1 1 53 THR HG22 H -6.915 -14.320 -5.822 1.00 . A A . 53 THR HG22 1 1 11 7843 1 1 53 THR HG23 H -6.377 -12.661 -6.081 1.00 . A A . 53 THR HG23 1 1 11 7844 1 1 53 THR N N -7.422 -12.266 -2.876 1.00 . A A . 53 THR N 1 1 11 7845 1 1 53 THR O O -9.553 -10.584 -3.173 1.00 . A A . 53 THR O 1 1 11 7846 1 1 53 THR OG1 O -8.781 -13.932 -4.359 1.00 . A A . 53 THR OG1 1 1 11 7847 1 1 54 CYS C C -10.887 -8.887 -5.875 1.00 . A A . 54 CYS C 1 1 11 7848 1 1 54 CYS CA C -9.646 -8.564 -5.049 1.00 . A A . 54 CYS CA 1 1 11 7849 1 1 54 CYS CB C -8.966 -7.306 -5.594 1.00 . A A . 54 CYS CB 1 1 11 7850 1 1 54 CYS H H -8.051 -9.748 -5.773 1.00 . A A . 54 CYS H 1 1 11 7851 1 1 54 CYS HA H -9.944 -8.386 -4.026 1.00 . A A . 54 CYS HA 1 1 11 7852 1 1 54 CYS HB2 H -8.565 -7.519 -6.573 1.00 . A A . 54 CYS HB2 1 1 11 7853 1 1 54 CYS HB3 H -9.699 -6.518 -5.676 1.00 . A A . 54 CYS HB3 1 1 11 7854 1 1 54 CYS N N -8.713 -9.685 -5.053 1.00 . A A . 54 CYS N 1 1 11 7855 1 1 54 CYS O O -10.904 -8.698 -7.091 1.00 . A A . 54 CYS O 1 1 11 7856 1 1 54 CYS SG S -7.598 -6.691 -4.559 1.00 . A A . 54 CYS SG 1 1 11 7857 1 1 55 ILE C C -14.259 -8.696 -5.607 1.00 . A A . 55 ILE C 1 1 11 7858 1 1 55 ILE CA C -13.173 -9.732 -5.878 1.00 . A A . 55 ILE CA 1 1 11 7859 1 1 55 ILE CB C -13.681 -11.117 -5.433 1.00 . A A . 55 ILE CB 1 1 11 7860 1 1 55 ILE CD1 C -14.575 -12.170 -3.292 1.00 . A A . 55 ILE CD1 1 1 11 7861 1 1 55 ILE CG1 C -13.520 -11.285 -3.920 1.00 . A A . 55 ILE CG1 1 1 11 7862 1 1 55 ILE CG2 C -12.938 -12.219 -6.175 1.00 . A A . 55 ILE CG2 1 1 11 7863 1 1 55 ILE H H -11.853 -9.510 -4.236 1.00 . A A . 55 ILE H 1 1 11 7864 1 1 55 ILE HA H -12.980 -9.767 -6.940 1.00 . A A . 55 ILE HA 1 1 11 7865 1 1 55 ILE HB H -14.728 -11.190 -5.686 1.00 . A A . 55 ILE HB 1 1 11 7866 1 1 55 ILE HD11 H -15.554 -11.758 -3.489 1.00 . A A . 55 ILE HD11 1 1 11 7867 1 1 55 ILE HD12 H -14.414 -12.221 -2.226 1.00 . A A . 55 ILE HD12 1 1 11 7868 1 1 55 ILE HD13 H -14.510 -13.162 -3.713 1.00 . A A . 55 ILE HD13 1 1 11 7869 1 1 55 ILE HG12 H -12.556 -11.724 -3.713 1.00 . A A . 55 ILE HG12 1 1 11 7870 1 1 55 ILE HG13 H -13.577 -10.314 -3.448 1.00 . A A . 55 ILE HG13 1 1 11 7871 1 1 55 ILE HG21 H -11.935 -12.301 -5.786 1.00 . A A . 55 ILE HG21 1 1 11 7872 1 1 55 ILE HG22 H -12.899 -11.979 -7.228 1.00 . A A . 55 ILE HG22 1 1 11 7873 1 1 55 ILE HG23 H -13.456 -13.157 -6.038 1.00 . A A . 55 ILE HG23 1 1 11 7874 1 1 55 ILE N N -11.927 -9.378 -5.206 1.00 . A A . 55 ILE N 1 1 11 7875 1 1 55 ILE O O -14.045 -7.739 -4.864 1.00 . A A . 55 ILE O 1 1 11 7876 1 1 56 SER C C -17.770 -8.711 -5.509 1.00 . A A . 56 SER C 1 1 11 7877 1 1 56 SER CA C -16.543 -7.976 -6.038 1.00 . A A . 56 SER CA 1 1 11 7878 1 1 56 SER CB C -16.878 -7.284 -7.360 1.00 . A A . 56 SER CB 1 1 11 7879 1 1 56 SER H H -15.534 -9.676 -6.796 1.00 . A A . 56 SER H 1 1 11 7880 1 1 56 SER HA H -16.247 -7.230 -5.317 1.00 . A A . 56 SER HA 1 1 11 7881 1 1 56 SER HB2 H -15.977 -7.176 -7.946 1.00 . A A . 56 SER HB2 1 1 11 7882 1 1 56 SER HB3 H -17.593 -7.882 -7.906 1.00 . A A . 56 SER HB3 1 1 11 7883 1 1 56 SER HG H -17.632 -5.893 -6.204 1.00 . A A . 56 SER HG 1 1 11 7884 1 1 56 SER N N -15.423 -8.895 -6.215 1.00 . A A . 56 SER N 1 1 11 7885 1 1 56 SER O O -18.235 -9.651 -6.187 1.00 . A A . 56 SER O 1 1 11 7886 1 1 56 SER OXT O -18.256 -8.340 -4.420 1.00 . A A . 56 SER OXT 1 1 11 7887 1 1 56 SER OG O -17.433 -5.999 -7.138 1.00 . A A . 56 SER OG 1 1 12 7888 1 1 1 ASP C C 1.958 14.727 -2.242 1.00 . A A . 1 ASP C 1 1 12 7889 1 1 1 ASP CA C 3.017 15.003 -3.304 1.00 . A A . 1 ASP CA 1 1 12 7890 1 1 1 ASP CB C 4.283 14.193 -3.014 1.00 . A A . 1 ASP CB 1 1 12 7891 1 1 1 ASP CG C 4.788 13.445 -4.233 1.00 . A A . 1 ASP CG 1 1 12 7892 1 1 1 ASP H1 H 3.705 16.707 -4.291 1.00 . A A . 1 ASP H1 1 1 12 7893 1 1 1 ASP H2 H 4.137 16.641 -2.657 1.00 . A A . 1 ASP H2 1 1 12 7894 1 1 1 ASP H3 H 2.550 17.027 -3.098 1.00 . A A . 1 ASP H3 1 1 12 7895 1 1 1 ASP HA H 2.628 14.722 -4.271 1.00 . A A . 1 ASP HA 1 1 12 7896 1 1 1 ASP HB2 H 5.060 14.861 -2.678 1.00 . A A . 1 ASP HB2 1 1 12 7897 1 1 1 ASP HB3 H 4.070 13.474 -2.234 1.00 . A A . 1 ASP HB3 1 1 12 7898 1 1 1 ASP N N 3.377 16.444 -3.340 1.00 . A A . 1 ASP N 1 1 12 7899 1 1 1 ASP O O 1.330 15.650 -1.722 1.00 . A A . 1 ASP O 1 1 12 7900 1 1 1 ASP OD1 O 5.641 12.548 -4.067 1.00 . A A . 1 ASP OD1 1 1 12 7901 1 1 1 ASP OD2 O 4.330 13.754 -5.354 1.00 . A A . 1 ASP OD2 1 1 12 7902 1 1 2 VAL C C 1.466 12.413 0.284 1.00 . A A . 2 VAL C 1 1 12 7903 1 1 2 VAL CA C 0.786 13.051 -0.922 1.00 . A A . 2 VAL CA 1 1 12 7904 1 1 2 VAL CB C -0.240 12.057 -1.501 1.00 . A A . 2 VAL CB 1 1 12 7905 1 1 2 VAL CG1 C -1.466 11.971 -0.606 1.00 . A A . 2 VAL CG1 1 1 12 7906 1 1 2 VAL CG2 C -0.630 12.456 -2.917 1.00 . A A . 2 VAL CG2 1 1 12 7907 1 1 2 VAL H H 2.298 12.760 -2.370 1.00 . A A . 2 VAL H 1 1 12 7908 1 1 2 VAL HA H 0.257 13.937 -0.599 1.00 . A A . 2 VAL HA 1 1 12 7909 1 1 2 VAL HB H 0.219 11.080 -1.539 1.00 . A A . 2 VAL HB 1 1 12 7910 1 1 2 VAL HG11 H -2.280 12.521 -1.056 1.00 . A A . 2 VAL HG11 1 1 12 7911 1 1 2 VAL HG12 H -1.237 12.393 0.361 1.00 . A A . 2 VAL HG12 1 1 12 7912 1 1 2 VAL HG13 H -1.754 10.937 -0.488 1.00 . A A . 2 VAL HG13 1 1 12 7913 1 1 2 VAL HG21 H -1.663 12.194 -3.093 1.00 . A A . 2 VAL HG21 1 1 12 7914 1 1 2 VAL HG22 H 0.000 11.935 -3.623 1.00 . A A . 2 VAL HG22 1 1 12 7915 1 1 2 VAL HG23 H -0.503 13.522 -3.039 1.00 . A A . 2 VAL HG23 1 1 12 7916 1 1 2 VAL N N 1.766 13.451 -1.923 1.00 . A A . 2 VAL N 1 1 12 7917 1 1 2 VAL O O 2.169 11.411 0.154 1.00 . A A . 2 VAL O 1 1 12 7918 1 1 3 GLN C C 1.071 11.279 3.201 1.00 . A A . 3 GLN C 1 1 12 7919 1 1 3 GLN CA C 1.846 12.487 2.687 1.00 . A A . 3 GLN CA 1 1 12 7920 1 1 3 GLN CB C 1.881 13.581 3.755 1.00 . A A . 3 GLN CB 1 1 12 7921 1 1 3 GLN CD C 3.334 15.076 5.183 1.00 . A A . 3 GLN CD 1 1 12 7922 1 1 3 GLN CG C 3.256 14.202 3.946 1.00 . A A . 3 GLN CG 1 1 12 7923 1 1 3 GLN H H 0.682 13.796 1.497 1.00 . A A . 3 GLN H 1 1 12 7924 1 1 3 GLN HA H 2.858 12.182 2.463 1.00 . A A . 3 GLN HA 1 1 12 7925 1 1 3 GLN HB2 H 1.192 14.363 3.476 1.00 . A A . 3 GLN HB2 1 1 12 7926 1 1 3 GLN HB3 H 1.569 13.156 4.698 1.00 . A A . 3 GLN HB3 1 1 12 7927 1 1 3 GLN HE21 H 4.791 13.943 5.923 1.00 . A A . 3 GLN HE21 1 1 12 7928 1 1 3 GLN HE22 H 4.304 15.277 6.907 1.00 . A A . 3 GLN HE22 1 1 12 7929 1 1 3 GLN HG2 H 3.985 13.411 4.036 1.00 . A A . 3 GLN HG2 1 1 12 7930 1 1 3 GLN HG3 H 3.487 14.807 3.081 1.00 . A A . 3 GLN HG3 1 1 12 7931 1 1 3 GLN N N 1.252 13.000 1.457 1.00 . A A . 3 GLN N 1 1 12 7932 1 1 3 GLN NE2 N 4.234 14.730 6.096 1.00 . A A . 3 GLN NE2 1 1 12 7933 1 1 3 GLN O O -0.052 11.413 3.689 1.00 . A A . 3 GLN O 1 1 12 7934 1 1 3 GLN OE1 O 2.594 16.050 5.315 1.00 . A A . 3 GLN OE1 1 1 12 7935 1 1 4 CYS C C 0.423 8.976 4.892 1.00 . A A . 4 CYS C 1 1 12 7936 1 1 4 CYS CA C 1.055 8.849 3.509 1.00 . A A . 4 CYS CA 1 1 12 7937 1 1 4 CYS CB C 2.095 7.726 3.523 1.00 . A A . 4 CYS CB 1 1 12 7938 1 1 4 CYS H H 2.564 10.061 2.660 1.00 . A A . 4 CYS H 1 1 12 7939 1 1 4 CYS HA H 0.283 8.597 2.797 1.00 . A A . 4 CYS HA 1 1 12 7940 1 1 4 CYS HB2 H 2.936 8.032 4.126 1.00 . A A . 4 CYS HB2 1 1 12 7941 1 1 4 CYS HB3 H 1.652 6.842 3.956 1.00 . A A . 4 CYS HB3 1 1 12 7942 1 1 4 CYS N N 1.676 10.098 3.072 1.00 . A A . 4 CYS N 1 1 12 7943 1 1 4 CYS O O -0.508 8.243 5.228 1.00 . A A . 4 CYS O 1 1 12 7944 1 1 4 CYS SG S 2.728 7.283 1.875 1.00 . A A . 4 CYS SG 1 1 12 7945 1 1 5 GLY C C 1.507 10.300 8.043 1.00 . A A . 5 GLY C 1 1 12 7946 1 1 5 GLY CA C 0.406 10.107 7.024 1.00 . A A . 5 GLY CA 1 1 12 7947 1 1 5 GLY H H 1.674 10.461 5.368 1.00 . A A . 5 GLY H 1 1 12 7948 1 1 5 GLY HA2 H -0.229 10.981 7.023 1.00 . A A . 5 GLY HA2 1 1 12 7949 1 1 5 GLY HA3 H -0.182 9.245 7.302 1.00 . A A . 5 GLY HA3 1 1 12 7950 1 1 5 GLY N N 0.932 9.906 5.689 1.00 . A A . 5 GLY N 1 1 12 7951 1 1 5 GLY O O 1.719 11.409 8.536 1.00 . A A . 5 GLY O 1 1 12 7952 1 1 6 GLY C C 4.436 10.175 8.819 1.00 . A A . 6 GLY C 1 1 12 7953 1 1 6 GLY CA C 3.302 9.301 9.313 1.00 . A A . 6 GLY CA 1 1 12 7954 1 1 6 GLY H H 2.012 8.362 7.928 1.00 . A A . 6 GLY H 1 1 12 7955 1 1 6 GLY HA2 H 2.921 9.708 10.238 1.00 . A A . 6 GLY HA2 1 1 12 7956 1 1 6 GLY HA3 H 3.681 8.307 9.497 1.00 . A A . 6 GLY HA3 1 1 12 7957 1 1 6 GLY N N 2.218 9.220 8.354 1.00 . A A . 6 GLY N 1 1 12 7958 1 1 6 GLY O O 4.698 11.236 9.385 1.00 . A A . 6 GLY O 1 1 12 7959 1 1 7 GLY C C 6.595 10.131 5.798 1.00 . A A . 7 GLY C 1 1 12 7960 1 1 7 GLY CA C 6.214 10.506 7.222 1.00 . A A . 7 GLY CA 1 1 12 7961 1 1 7 GLY H H 4.861 8.878 7.353 1.00 . A A . 7 GLY H 1 1 12 7962 1 1 7 GLY HA2 H 5.942 11.550 7.240 1.00 . A A . 7 GLY HA2 1 1 12 7963 1 1 7 GLY HA3 H 7.075 10.364 7.859 1.00 . A A . 7 GLY HA3 1 1 12 7964 1 1 7 GLY N N 5.111 9.732 7.762 1.00 . A A . 7 GLY N 1 1 12 7965 1 1 7 GLY O O 7.581 10.646 5.272 1.00 . A A . 7 GLY O 1 1 12 7966 1 1 8 PHE C C 5.437 9.711 2.781 1.00 . A A . 8 PHE C 1 1 12 7967 1 1 8 PHE CA C 6.145 8.825 3.800 1.00 . A A . 8 PHE CA 1 1 12 7968 1 1 8 PHE CB C 5.762 7.363 3.576 1.00 . A A . 8 PHE CB 1 1 12 7969 1 1 8 PHE CD1 C 7.297 5.517 2.850 1.00 . A A . 8 PHE CD1 1 1 12 7970 1 1 8 PHE CD2 C 7.531 6.373 5.063 1.00 . A A . 8 PHE CD2 1 1 12 7971 1 1 8 PHE CE1 C 8.329 4.627 3.080 1.00 . A A . 8 PHE CE1 1 1 12 7972 1 1 8 PHE CE2 C 8.564 5.486 5.300 1.00 . A A . 8 PHE CE2 1 1 12 7973 1 1 8 PHE CG C 6.886 6.398 3.835 1.00 . A A . 8 PHE CG 1 1 12 7974 1 1 8 PHE CZ C 8.963 4.612 4.307 1.00 . A A . 8 PHE CZ 1 1 12 7975 1 1 8 PHE H H 5.060 8.839 5.622 1.00 . A A . 8 PHE H 1 1 12 7976 1 1 8 PHE HA H 7.211 8.929 3.662 1.00 . A A . 8 PHE HA 1 1 12 7977 1 1 8 PHE HB2 H 4.945 7.108 4.233 1.00 . A A . 8 PHE HB2 1 1 12 7978 1 1 8 PHE HB3 H 5.445 7.236 2.551 1.00 . A A . 8 PHE HB3 1 1 12 7979 1 1 8 PHE HD1 H 6.802 5.527 1.890 1.00 . A A . 8 PHE HD1 1 1 12 7980 1 1 8 PHE HD2 H 7.219 7.056 5.840 1.00 . A A . 8 PHE HD2 1 1 12 7981 1 1 8 PHE HE1 H 8.639 3.944 2.303 1.00 . A A . 8 PHE HE1 1 1 12 7982 1 1 8 PHE HE2 H 9.059 5.476 6.260 1.00 . A A . 8 PHE HE2 1 1 12 7983 1 1 8 PHE HZ H 9.771 3.918 4.491 1.00 . A A . 8 PHE HZ 1 1 12 7984 1 1 8 PHE N N 5.835 9.236 5.166 1.00 . A A . 8 PHE N 1 1 12 7985 1 1 8 PHE O O 4.740 10.659 3.141 1.00 . A A . 8 PHE O 1 1 12 7986 1 1 9 SER C C 4.874 9.272 -0.825 1.00 . A A . 9 SER C 1 1 12 7987 1 1 9 SER CA C 5.013 10.145 0.418 1.00 . A A . 9 SER CA 1 1 12 7988 1 1 9 SER CB C 5.846 11.388 0.097 1.00 . A A . 9 SER CB 1 1 12 7989 1 1 9 SER H H 6.193 8.620 1.289 1.00 . A A . 9 SER H 1 1 12 7990 1 1 9 SER HA H 4.029 10.453 0.740 1.00 . A A . 9 SER HA 1 1 12 7991 1 1 9 SER HB2 H 6.073 11.405 -0.959 1.00 . A A . 9 SER HB2 1 1 12 7992 1 1 9 SER HB3 H 5.285 12.273 0.358 1.00 . A A . 9 SER HB3 1 1 12 7993 1 1 9 SER HG H 7.710 10.847 0.366 1.00 . A A . 9 SER HG 1 1 12 7994 1 1 9 SER N N 5.626 9.390 1.506 1.00 . A A . 9 SER N 1 1 12 7995 1 1 9 SER O O 5.656 8.342 -1.028 1.00 . A A . 9 SER O 1 1 12 7996 1 1 9 SER OG O 7.064 11.389 0.824 1.00 . A A . 9 SER OG 1 1 12 7997 1 1 10 CYS C C 3.150 9.662 -4.010 1.00 . A A . 10 CYS C 1 1 12 7998 1 1 10 CYS CA C 3.631 8.783 -2.855 1.00 . A A . 10 CYS CA 1 1 12 7999 1 1 10 CYS CB C 2.623 7.676 -2.575 1.00 . A A . 10 CYS CB 1 1 12 8000 1 1 10 CYS H H 3.270 10.306 -1.428 1.00 . A A . 10 CYS H 1 1 12 8001 1 1 10 CYS HA H 4.569 8.331 -3.140 1.00 . A A . 10 CYS HA 1 1 12 8002 1 1 10 CYS HB2 H 1.949 8.000 -1.798 1.00 . A A . 10 CYS HB2 1 1 12 8003 1 1 10 CYS HB3 H 2.060 7.480 -3.473 1.00 . A A . 10 CYS HB3 1 1 12 8004 1 1 10 CYS N N 3.869 9.562 -1.646 1.00 . A A . 10 CYS N 1 1 12 8005 1 1 10 CYS O O 3.152 10.888 -3.913 1.00 . A A . 10 CYS O 1 1 12 8006 1 1 10 CYS SG S 3.374 6.106 -2.035 1.00 . A A . 10 CYS SG 1 1 12 8007 1 1 11 HIS C C 0.810 10.015 -6.302 1.00 . A A . 11 HIS C 1 1 12 8008 1 1 11 HIS CA C 2.315 9.733 -6.308 1.00 . A A . 11 HIS CA 1 1 12 8009 1 1 11 HIS CB C 2.678 8.935 -7.561 1.00 . A A . 11 HIS CB 1 1 12 8010 1 1 11 HIS CD2 C 4.818 7.613 -8.196 1.00 . A A . 11 HIS CD2 1 1 12 8011 1 1 11 HIS CE1 C 6.308 9.102 -7.588 1.00 . A A . 11 HIS CE1 1 1 12 8012 1 1 11 HIS CG C 4.147 8.685 -7.710 1.00 . A A . 11 HIS CG 1 1 12 8013 1 1 11 HIS H H 2.807 8.041 -5.135 1.00 . A A . 11 HIS H 1 1 12 8014 1 1 11 HIS HA H 2.838 10.676 -6.341 1.00 . A A . 11 HIS HA 1 1 12 8015 1 1 11 HIS HB2 H 2.181 7.977 -7.526 1.00 . A A . 11 HIS HB2 1 1 12 8016 1 1 11 HIS HB3 H 2.343 9.476 -8.434 1.00 . A A . 11 HIS HB3 1 1 12 8017 1 1 11 HIS HD1 H 4.940 10.483 -6.947 1.00 . A A . 11 HIS HD1 1 1 12 8018 1 1 11 HIS HD2 H 4.379 6.703 -8.581 1.00 . A A . 11 HIS HD2 1 1 12 8019 1 1 11 HIS HE1 H 7.249 9.596 -7.398 1.00 . A A . 11 HIS HE1 1 1 12 8020 1 1 11 HIS HE2 H 6.887 7.278 -8.319 1.00 . A A . 11 HIS HE2 1 1 12 8021 1 1 11 HIS N N 2.768 9.019 -5.115 1.00 . A A . 11 HIS N 1 1 12 8022 1 1 11 HIS ND1 N 5.110 9.599 -7.336 1.00 . A A . 11 HIS ND1 1 1 12 8023 1 1 11 HIS NE2 N 6.158 7.898 -8.109 1.00 . A A . 11 HIS NE2 1 1 12 8024 1 1 11 HIS O O 0.007 9.255 -5.748 1.00 . A A . 11 HIS O 1 1 12 8025 1 1 12 ASP C C -1.782 10.394 -7.668 1.00 . A A . 12 ASP C 1 1 12 8026 1 1 12 ASP CA C -0.951 11.520 -7.065 1.00 . A A . 12 ASP CA 1 1 12 8027 1 1 12 ASP CB C -1.073 12.779 -7.926 1.00 . A A . 12 ASP CB 1 1 12 8028 1 1 12 ASP CG C -1.724 13.929 -7.182 1.00 . A A . 12 ASP CG 1 1 12 8029 1 1 12 ASP H H 1.140 11.654 -7.385 1.00 . A A . 12 ASP H 1 1 12 8030 1 1 12 ASP HA H -1.316 11.732 -6.071 1.00 . A A . 12 ASP HA 1 1 12 8031 1 1 12 ASP HB2 H -0.087 13.091 -8.239 1.00 . A A . 12 ASP HB2 1 1 12 8032 1 1 12 ASP HB3 H -1.668 12.554 -8.798 1.00 . A A . 12 ASP HB3 1 1 12 8033 1 1 12 ASP N N 0.445 11.115 -6.955 1.00 . A A . 12 ASP N 1 1 12 8034 1 1 12 ASP O O -1.350 9.726 -8.608 1.00 . A A . 12 ASP O 1 1 12 8035 1 1 12 ASP OD1 O -2.610 13.668 -6.341 1.00 . A A . 12 ASP OD1 1 1 12 8036 1 1 12 ASP OD2 O -1.348 15.092 -7.442 1.00 . A A . 12 ASP OD2 1 1 12 8037 1 1 13 GLY C C -3.606 7.810 -6.921 1.00 . A A . 13 GLY C 1 1 12 8038 1 1 13 GLY CA C -3.841 9.135 -7.618 1.00 . A A . 13 GLY CA 1 1 12 8039 1 1 13 GLY H H -3.266 10.747 -6.373 1.00 . A A . 13 GLY H 1 1 12 8040 1 1 13 GLY HA2 H -4.869 9.430 -7.469 1.00 . A A . 13 GLY HA2 1 1 12 8041 1 1 13 GLY HA3 H -3.664 9.009 -8.677 1.00 . A A . 13 GLY HA3 1 1 12 8042 1 1 13 GLY N N -2.974 10.184 -7.120 1.00 . A A . 13 GLY N 1 1 12 8043 1 1 13 GLY O O -4.329 6.841 -7.155 1.00 . A A . 13 GLY O 1 1 12 8044 1 1 14 GLU C C -2.775 6.631 -3.879 1.00 . A A . 14 GLU C 1 1 12 8045 1 1 14 GLU CA C -2.279 6.546 -5.324 1.00 . A A . 14 GLU CA 1 1 12 8046 1 1 14 GLU CB C -0.772 6.283 -5.358 1.00 . A A . 14 GLU CB 1 1 12 8047 1 1 14 GLU CD C 0.090 5.748 -3.049 1.00 . A A . 14 GLU CD 1 1 12 8048 1 1 14 GLU CG C -0.037 6.796 -4.135 1.00 . A A . 14 GLU CG 1 1 12 8049 1 1 14 GLU H H -2.057 8.582 -5.912 1.00 . A A . 14 GLU H 1 1 12 8050 1 1 14 GLU HA H -2.786 5.730 -5.814 1.00 . A A . 14 GLU HA 1 1 12 8051 1 1 14 GLU HB2 H -0.605 5.219 -5.431 1.00 . A A . 14 GLU HB2 1 1 12 8052 1 1 14 GLU HB3 H -0.354 6.765 -6.229 1.00 . A A . 14 GLU HB3 1 1 12 8053 1 1 14 GLU HG2 H 0.955 7.106 -4.431 1.00 . A A . 14 GLU HG2 1 1 12 8054 1 1 14 GLU HG3 H -0.575 7.643 -3.736 1.00 . A A . 14 GLU HG3 1 1 12 8055 1 1 14 GLU N N -2.594 7.767 -6.056 1.00 . A A . 14 GLU N 1 1 12 8056 1 1 14 GLU O O -3.171 7.698 -3.410 1.00 . A A . 14 GLU O 1 1 12 8057 1 1 14 GLU OE1 O 0.200 6.129 -1.867 1.00 . A A . 14 GLU OE1 1 1 12 8058 1 1 14 GLU OE2 O 0.077 4.547 -3.382 1.00 . A A . 14 GLU OE2 1 1 12 8059 1 1 15 THR C C -2.082 4.836 -0.905 1.00 . A A . 15 THR C 1 1 12 8060 1 1 15 THR CA C -3.172 5.440 -1.785 1.00 . A A . 15 THR CA 1 1 12 8061 1 1 15 THR CB C -4.454 4.603 -1.627 1.00 . A A . 15 THR CB 1 1 12 8062 1 1 15 THR CG2 C -4.980 4.680 -0.202 1.00 . A A . 15 THR CG2 1 1 12 8063 1 1 15 THR H H -2.406 4.682 -3.596 1.00 . A A . 15 THR H 1 1 12 8064 1 1 15 THR HA H -3.377 6.448 -1.452 1.00 . A A . 15 THR HA 1 1 12 8065 1 1 15 THR HB H -4.221 3.570 -1.854 1.00 . A A . 15 THR HB 1 1 12 8066 1 1 15 THR HG1 H -5.998 4.325 -2.822 1.00 . A A . 15 THR HG1 1 1 12 8067 1 1 15 THR HG21 H -4.641 5.597 0.257 1.00 . A A . 15 THR HG21 1 1 12 8068 1 1 15 THR HG22 H -4.611 3.837 0.364 1.00 . A A . 15 THR HG22 1 1 12 8069 1 1 15 THR HG23 H -6.060 4.661 -0.214 1.00 . A A . 15 THR HG23 1 1 12 8070 1 1 15 THR N N -2.738 5.500 -3.176 1.00 . A A . 15 THR N 1 1 12 8071 1 1 15 THR O O -1.513 3.797 -1.237 1.00 . A A . 15 THR O 1 1 12 8072 1 1 15 THR OG1 O -5.458 5.065 -2.537 1.00 . A A . 15 THR OG1 1 1 12 8073 1 1 16 CYS C C -1.415 4.075 2.187 1.00 . A A . 16 CYS C 1 1 12 8074 1 1 16 CYS CA C -0.789 4.997 1.148 1.00 . A A . 16 CYS CA 1 1 12 8075 1 1 16 CYS CB C -0.091 6.168 1.837 1.00 . A A . 16 CYS CB 1 1 12 8076 1 1 16 CYS H H -2.302 6.299 0.439 1.00 . A A . 16 CYS H 1 1 12 8077 1 1 16 CYS HA H -0.061 4.438 0.579 1.00 . A A . 16 CYS HA 1 1 12 8078 1 1 16 CYS HB2 H -0.837 6.861 2.197 1.00 . A A . 16 CYS HB2 1 1 12 8079 1 1 16 CYS HB3 H 0.482 5.795 2.676 1.00 . A A . 16 CYS HB3 1 1 12 8080 1 1 16 CYS N N -1.803 5.483 0.219 1.00 . A A . 16 CYS N 1 1 12 8081 1 1 16 CYS O O -2.416 4.425 2.813 1.00 . A A . 16 CYS O 1 1 12 8082 1 1 16 CYS SG S 1.048 7.095 0.757 1.00 . A A . 16 CYS SG 1 1 12 8083 1 1 17 CYS C C -0.289 1.544 4.354 1.00 . A A . 17 CYS C 1 1 12 8084 1 1 17 CYS CA C -1.347 1.928 3.324 1.00 . A A . 17 CYS CA 1 1 12 8085 1 1 17 CYS CB C -1.839 0.671 2.607 1.00 . A A . 17 CYS CB 1 1 12 8086 1 1 17 CYS H H -0.039 2.664 1.831 1.00 . A A . 17 CYS H 1 1 12 8087 1 1 17 CYS HA H -2.180 2.385 3.838 1.00 . A A . 17 CYS HA 1 1 12 8088 1 1 17 CYS HB2 H -2.908 0.738 2.466 1.00 . A A . 17 CYS HB2 1 1 12 8089 1 1 17 CYS HB3 H -1.357 0.603 1.642 1.00 . A A . 17 CYS HB3 1 1 12 8090 1 1 17 CYS N N -0.830 2.894 2.363 1.00 . A A . 17 CYS N 1 1 12 8091 1 1 17 CYS O O 0.861 1.275 4.007 1.00 . A A . 17 CYS O 1 1 12 8092 1 1 17 CYS SG S -1.495 -0.875 3.510 1.00 . A A . 17 CYS SG 1 1 12 8093 1 1 18 PRO C C 0.274 -0.386 6.922 1.00 . A A . 18 PRO C 1 1 12 8094 1 1 18 PRO CA C 0.225 1.129 6.728 1.00 . A A . 18 PRO CA 1 1 12 8095 1 1 18 PRO CB C -0.428 1.808 7.928 1.00 . A A . 18 PRO CB 1 1 12 8096 1 1 18 PRO CD C -2.035 1.789 6.135 1.00 . A A . 18 PRO CD 1 1 12 8097 1 1 18 PRO CG C -1.891 1.743 7.639 1.00 . A A . 18 PRO CG 1 1 12 8098 1 1 18 PRO HA H 1.224 1.515 6.578 1.00 . A A . 18 PRO HA 1 1 12 8099 1 1 18 PRO HB2 H -0.176 1.273 8.833 1.00 . A A . 18 PRO HB2 1 1 12 8100 1 1 18 PRO HB3 H -0.086 2.831 7.998 1.00 . A A . 18 PRO HB3 1 1 12 8101 1 1 18 PRO HD2 H -2.735 1.039 5.796 1.00 . A A . 18 PRO HD2 1 1 12 8102 1 1 18 PRO HD3 H -2.356 2.771 5.819 1.00 . A A . 18 PRO HD3 1 1 12 8103 1 1 18 PRO HG2 H -2.299 0.820 8.024 1.00 . A A . 18 PRO HG2 1 1 12 8104 1 1 18 PRO HG3 H -2.390 2.588 8.088 1.00 . A A . 18 PRO HG3 1 1 12 8105 1 1 18 PRO N N -0.675 1.498 5.640 1.00 . A A . 18 PRO N 1 1 12 8106 1 1 18 PRO O O -0.620 -0.971 7.532 1.00 . A A . 18 PRO O 1 1 12 8107 1 1 19 THR C C 2.251 -2.883 7.724 1.00 . A A . 19 THR C 1 1 12 8108 1 1 19 THR CA C 1.456 -2.470 6.488 1.00 . A A . 19 THR CA 1 1 12 8109 1 1 19 THR CB C 2.143 -3.053 5.239 1.00 . A A . 19 THR CB 1 1 12 8110 1 1 19 THR CG2 C 1.556 -2.455 3.969 1.00 . A A . 19 THR CG2 1 1 12 8111 1 1 19 THR H H 1.996 -0.513 5.903 1.00 . A A . 19 THR H 1 1 12 8112 1 1 19 THR HA H 0.466 -2.895 6.556 1.00 . A A . 19 THR HA 1 1 12 8113 1 1 19 THR HB H 1.982 -4.121 5.223 1.00 . A A . 19 THR HB 1 1 12 8114 1 1 19 THR HG1 H 3.953 -3.058 4.456 1.00 . A A . 19 THR HG1 1 1 12 8115 1 1 19 THR HG21 H 1.833 -3.065 3.122 1.00 . A A . 19 THR HG21 1 1 12 8116 1 1 19 THR HG22 H 1.941 -1.454 3.831 1.00 . A A . 19 THR HG22 1 1 12 8117 1 1 19 THR HG23 H 0.480 -2.419 4.051 1.00 . A A . 19 THR HG23 1 1 12 8118 1 1 19 THR N N 1.313 -1.021 6.385 1.00 . A A . 19 THR N 1 1 12 8119 1 1 19 THR O O 2.398 -4.073 8.001 1.00 . A A . 19 THR O 1 1 12 8120 1 1 19 THR OG1 O 3.551 -2.793 5.287 1.00 . A A . 19 THR OG1 1 1 12 8121 1 1 20 SER C C 3.405 -1.068 10.691 1.00 . A A . 20 SER C 1 1 12 8122 1 1 20 SER CA C 3.540 -2.193 9.666 1.00 . A A . 20 SER CA 1 1 12 8123 1 1 20 SER CB C 5.013 -2.408 9.306 1.00 . A A . 20 SER CB 1 1 12 8124 1 1 20 SER H H 2.615 -0.972 8.204 1.00 . A A . 20 SER H 1 1 12 8125 1 1 20 SER HA H 3.151 -3.102 10.098 1.00 . A A . 20 SER HA 1 1 12 8126 1 1 20 SER HB2 H 5.474 -1.453 9.106 1.00 . A A . 20 SER HB2 1 1 12 8127 1 1 20 SER HB3 H 5.517 -2.886 10.133 1.00 . A A . 20 SER HB3 1 1 12 8128 1 1 20 SER HG H 4.952 -2.709 7.371 1.00 . A A . 20 SER HG 1 1 12 8129 1 1 20 SER N N 2.763 -1.904 8.464 1.00 . A A . 20 SER N 1 1 12 8130 1 1 20 SER O O 2.398 -0.978 11.394 1.00 . A A . 20 SER O 1 1 12 8131 1 1 20 SER OG O 5.144 -3.226 8.156 1.00 . A A . 20 SER OG 1 1 12 8132 1 1 21 GLN C C 5.070 2.133 11.087 1.00 . A A . 21 GLN C 1 1 12 8133 1 1 21 GLN CA C 4.414 0.905 11.708 1.00 . A A . 21 GLN CA 1 1 12 8134 1 1 21 GLN CB C 5.142 0.526 13.003 1.00 . A A . 21 GLN CB 1 1 12 8135 1 1 21 GLN CD C 7.493 -0.403 12.955 1.00 . A A . 21 GLN CD 1 1 12 8136 1 1 21 GLN CG C 6.012 -0.717 12.882 1.00 . A A . 21 GLN CG 1 1 12 8137 1 1 21 GLN H H 5.197 -0.335 10.183 1.00 . A A . 21 GLN H 1 1 12 8138 1 1 21 GLN HA H 3.386 1.137 11.937 1.00 . A A . 21 GLN HA 1 1 12 8139 1 1 21 GLN HB2 H 5.772 1.350 13.301 1.00 . A A . 21 GLN HB2 1 1 12 8140 1 1 21 GLN HB3 H 4.407 0.350 13.776 1.00 . A A . 21 GLN HB3 1 1 12 8141 1 1 21 GLN HE21 H 7.807 -1.371 11.246 1.00 . A A . 21 GLN HE21 1 1 12 8142 1 1 21 GLN HE22 H 9.206 -0.676 11.982 1.00 . A A . 21 GLN HE22 1 1 12 8143 1 1 21 GLN HG2 H 5.763 -1.395 13.685 1.00 . A A . 21 GLN HG2 1 1 12 8144 1 1 21 GLN HG3 H 5.806 -1.193 11.933 1.00 . A A . 21 GLN HG3 1 1 12 8145 1 1 21 GLN N N 4.422 -0.213 10.770 1.00 . A A . 21 GLN N 1 1 12 8146 1 1 21 GLN NE2 N 8.244 -0.862 11.960 1.00 . A A . 21 GLN NE2 1 1 12 8147 1 1 21 GLN O O 4.396 3.110 10.761 1.00 . A A . 21 GLN O 1 1 12 8148 1 1 21 GLN OE1 O 7.957 0.245 13.892 1.00 . A A . 21 GLN OE1 1 1 12 8149 1 1 22 THR C C 7.353 2.960 8.845 1.00 . A A . 22 THR C 1 1 12 8150 1 1 22 THR CA C 7.137 3.179 10.338 1.00 . A A . 22 THR CA 1 1 12 8151 1 1 22 THR CB C 8.504 3.359 11.025 1.00 . A A . 22 THR CB 1 1 12 8152 1 1 22 THR CG2 C 8.371 3.239 12.537 1.00 . A A . 22 THR CG2 1 1 12 8153 1 1 22 THR H H 6.868 1.265 11.202 1.00 . A A . 22 THR H 1 1 12 8154 1 1 22 THR HA H 6.563 4.082 10.481 1.00 . A A . 22 THR HA 1 1 12 8155 1 1 22 THR HB H 8.881 4.343 10.789 1.00 . A A . 22 THR HB 1 1 12 8156 1 1 22 THR HG1 H 10.257 2.454 11.023 1.00 . A A . 22 THR HG1 1 1 12 8157 1 1 22 THR HG21 H 7.864 2.317 12.781 1.00 . A A . 22 THR HG21 1 1 12 8158 1 1 22 THR HG22 H 7.801 4.075 12.915 1.00 . A A . 22 THR HG22 1 1 12 8159 1 1 22 THR HG23 H 9.353 3.240 12.985 1.00 . A A . 22 THR HG23 1 1 12 8160 1 1 22 THR N N 6.388 2.074 10.923 1.00 . A A . 22 THR N 1 1 12 8161 1 1 22 THR O O 8.143 3.662 8.212 1.00 . A A . 22 THR O 1 1 12 8162 1 1 22 THR OG1 O 9.429 2.376 10.543 1.00 . A A . 22 THR OG1 1 1 12 8163 1 1 23 THR C C 5.411 1.896 6.166 1.00 . A A . 23 THR C 1 1 12 8164 1 1 23 THR CA C 6.745 1.675 6.868 1.00 . A A . 23 THR CA 1 1 12 8165 1 1 23 THR CB C 7.200 0.221 6.637 1.00 . A A . 23 THR CB 1 1 12 8166 1 1 23 THR CG2 C 8.477 0.180 5.812 1.00 . A A . 23 THR CG2 1 1 12 8167 1 1 23 THR H H 6.024 1.467 8.845 1.00 . A A . 23 THR H 1 1 12 8168 1 1 23 THR HA H 7.483 2.336 6.435 1.00 . A A . 23 THR HA 1 1 12 8169 1 1 23 THR HB H 6.423 -0.301 6.098 1.00 . A A . 23 THR HB 1 1 12 8170 1 1 23 THR HG1 H 7.865 0.171 8.494 1.00 . A A . 23 THR HG1 1 1 12 8171 1 1 23 THR HG21 H 8.279 0.570 4.824 1.00 . A A . 23 THR HG21 1 1 12 8172 1 1 23 THR HG22 H 8.823 -0.840 5.734 1.00 . A A . 23 THR HG22 1 1 12 8173 1 1 23 THR HG23 H 9.235 0.782 6.291 1.00 . A A . 23 THR HG23 1 1 12 8174 1 1 23 THR N N 6.641 1.986 8.288 1.00 . A A . 23 THR N 1 1 12 8175 1 1 23 THR O O 4.393 1.322 6.552 1.00 . A A . 23 THR O 1 1 12 8176 1 1 23 THR OG1 O 7.417 -0.430 7.894 1.00 . A A . 23 THR OG1 1 1 12 8177 1 1 24 TRP C C 4.292 2.501 2.964 1.00 . A A . 24 TRP C 1 1 12 8178 1 1 24 TRP CA C 4.209 3.041 4.389 1.00 . A A . 24 TRP CA 1 1 12 8179 1 1 24 TRP CB C 3.971 4.551 4.374 1.00 . A A . 24 TRP CB 1 1 12 8180 1 1 24 TRP CD1 C 3.701 5.517 6.733 1.00 . A A . 24 TRP CD1 1 1 12 8181 1 1 24 TRP CD2 C 1.778 5.043 5.699 1.00 . A A . 24 TRP CD2 1 1 12 8182 1 1 24 TRP CE2 C 1.483 5.554 6.975 1.00 . A A . 24 TRP CE2 1 1 12 8183 1 1 24 TRP CE3 C 0.729 4.675 4.860 1.00 . A A . 24 TRP CE3 1 1 12 8184 1 1 24 TRP CG C 3.198 5.026 5.563 1.00 . A A . 24 TRP CG 1 1 12 8185 1 1 24 TRP CH2 C -0.835 5.331 6.585 1.00 . A A . 24 TRP CH2 1 1 12 8186 1 1 24 TRP CZ2 C 0.176 5.702 7.431 1.00 . A A . 24 TRP CZ2 1 1 12 8187 1 1 24 TRP CZ3 C -0.567 4.823 5.311 1.00 . A A . 24 TRP CZ3 1 1 12 8188 1 1 24 TRP H H 6.263 3.168 4.881 1.00 . A A . 24 TRP H 1 1 12 8189 1 1 24 TRP HA H 3.382 2.562 4.893 1.00 . A A . 24 TRP HA 1 1 12 8190 1 1 24 TRP HB2 H 4.923 5.060 4.367 1.00 . A A . 24 TRP HB2 1 1 12 8191 1 1 24 TRP HB3 H 3.418 4.815 3.485 1.00 . A A . 24 TRP HB3 1 1 12 8192 1 1 24 TRP HD1 H 4.753 5.630 6.940 1.00 . A A . 24 TRP HD1 1 1 12 8193 1 1 24 TRP HE1 H 2.779 6.205 8.491 1.00 . A A . 24 TRP HE1 1 1 12 8194 1 1 24 TRP HE3 H 0.920 4.286 3.873 1.00 . A A . 24 TRP HE3 1 1 12 8195 1 1 24 TRP HH2 H -1.861 5.424 6.896 1.00 . A A . 24 TRP HH2 1 1 12 8196 1 1 24 TRP HZ2 H -0.048 6.094 8.412 1.00 . A A . 24 TRP HZ2 1 1 12 8197 1 1 24 TRP HZ3 H -1.393 4.539 4.675 1.00 . A A . 24 TRP HZ3 1 1 12 8198 1 1 24 TRP N N 5.421 2.738 5.137 1.00 . A A . 24 TRP N 1 1 12 8199 1 1 24 TRP NE1 N 2.674 5.836 7.590 1.00 . A A . 24 TRP NE1 1 1 12 8200 1 1 24 TRP O O 5.184 2.870 2.199 1.00 . A A . 24 TRP O 1 1 12 8201 1 1 25 GLY C C 2.572 1.877 0.287 1.00 . A A . 25 GLY C 1 1 12 8202 1 1 25 GLY CA C 3.333 1.032 1.292 1.00 . A A . 25 GLY CA 1 1 12 8203 1 1 25 GLY H H 2.674 1.366 3.275 1.00 . A A . 25 GLY H 1 1 12 8204 1 1 25 GLY HA2 H 4.350 0.914 0.947 1.00 . A A . 25 GLY HA2 1 1 12 8205 1 1 25 GLY HA3 H 2.870 0.059 1.352 1.00 . A A . 25 GLY HA3 1 1 12 8206 1 1 25 GLY N N 3.356 1.620 2.620 1.00 . A A . 25 GLY N 1 1 12 8207 1 1 25 GLY O O 1.596 2.545 0.636 1.00 . A A . 25 GLY O 1 1 12 8208 1 1 26 CYS C C 1.454 1.723 -2.861 1.00 . A A . 26 CYS C 1 1 12 8209 1 1 26 CYS CA C 2.394 2.605 -2.038 1.00 . A A . 26 CYS CA 1 1 12 8210 1 1 26 CYS CB C 3.468 3.212 -2.945 1.00 . A A . 26 CYS CB 1 1 12 8211 1 1 26 CYS H H 3.807 1.289 -1.172 1.00 . A A . 26 CYS H 1 1 12 8212 1 1 26 CYS HA H 1.822 3.403 -1.588 1.00 . A A . 26 CYS HA 1 1 12 8213 1 1 26 CYS HB2 H 4.388 3.304 -2.388 1.00 . A A . 26 CYS HB2 1 1 12 8214 1 1 26 CYS HB3 H 3.629 2.554 -3.786 1.00 . A A . 26 CYS HB3 1 1 12 8215 1 1 26 CYS N N 3.024 1.842 -0.965 1.00 . A A . 26 CYS N 1 1 12 8216 1 1 26 CYS O O 1.892 0.784 -3.524 1.00 . A A . 26 CYS O 1 1 12 8217 1 1 26 CYS SG S 3.058 4.859 -3.604 1.00 . A A . 26 CYS SG 1 1 12 8218 1 1 27 CYS C C -1.356 2.076 -4.754 1.00 . A A . 27 CYS C 1 1 12 8219 1 1 27 CYS CA C -0.846 1.280 -3.550 1.00 . A A . 27 CYS CA 1 1 12 8220 1 1 27 CYS CB C -2.016 0.928 -2.627 1.00 . A A . 27 CYS CB 1 1 12 8221 1 1 27 CYS H H -0.121 2.798 -2.264 1.00 . A A . 27 CYS H 1 1 12 8222 1 1 27 CYS HA H -0.387 0.369 -3.900 1.00 . A A . 27 CYS HA 1 1 12 8223 1 1 27 CYS HB2 H -2.218 1.769 -1.980 1.00 . A A . 27 CYS HB2 1 1 12 8224 1 1 27 CYS HB3 H -2.892 0.726 -3.228 1.00 . A A . 27 CYS HB3 1 1 12 8225 1 1 27 CYS N N 0.162 2.038 -2.812 1.00 . A A . 27 CYS N 1 1 12 8226 1 1 27 CYS O O -1.816 3.206 -4.607 1.00 . A A . 27 CYS O 1 1 12 8227 1 1 27 CYS SG S -1.718 -0.524 -1.568 1.00 . A A . 27 CYS SG 1 1 12 8228 1 1 28 PRO C C -3.257 2.125 -7.354 1.00 . A A . 28 PRO C 1 1 12 8229 1 1 28 PRO CA C -1.738 2.169 -7.188 1.00 . A A . 28 PRO CA 1 1 12 8230 1 1 28 PRO CB C -1.053 1.368 -8.294 1.00 . A A . 28 PRO CB 1 1 12 8231 1 1 28 PRO CD C -0.747 0.149 -6.249 1.00 . A A . 28 PRO CD 1 1 12 8232 1 1 28 PRO CG C -0.925 -0.008 -7.737 1.00 . A A . 28 PRO CG 1 1 12 8233 1 1 28 PRO HA H -1.403 3.194 -7.224 1.00 . A A . 28 PRO HA 1 1 12 8234 1 1 28 PRO HB2 H -1.665 1.381 -9.185 1.00 . A A . 28 PRO HB2 1 1 12 8235 1 1 28 PRO HB3 H -0.086 1.798 -8.509 1.00 . A A . 28 PRO HB3 1 1 12 8236 1 1 28 PRO HD2 H -1.310 -0.606 -5.721 1.00 . A A . 28 PRO HD2 1 1 12 8237 1 1 28 PRO HD3 H 0.300 0.090 -5.987 1.00 . A A . 28 PRO HD3 1 1 12 8238 1 1 28 PRO HG2 H -1.821 -0.574 -7.949 1.00 . A A . 28 PRO HG2 1 1 12 8239 1 1 28 PRO HG3 H -0.063 -0.498 -8.167 1.00 . A A . 28 PRO HG3 1 1 12 8240 1 1 28 PRO N N -1.283 1.497 -5.968 1.00 . A A . 28 PRO N 1 1 12 8241 1 1 28 PRO O O -3.791 1.234 -8.016 1.00 . A A . 28 PRO O 1 1 12 8242 1 1 29 SER C C -5.929 4.424 -6.123 1.00 . A A . 29 SER C 1 1 12 8243 1 1 29 SER CA C -5.403 3.172 -6.832 1.00 . A A . 29 SER CA 1 1 12 8244 1 1 29 SER CB C -6.034 1.923 -6.214 1.00 . A A . 29 SER CB 1 1 12 8245 1 1 29 SER H H -3.460 3.779 -6.242 1.00 . A A . 29 SER H 1 1 12 8246 1 1 29 SER HA H -5.675 3.224 -7.876 1.00 . A A . 29 SER HA 1 1 12 8247 1 1 29 SER HB2 H -6.943 2.197 -5.699 1.00 . A A . 29 SER HB2 1 1 12 8248 1 1 29 SER HB3 H -6.263 1.214 -6.997 1.00 . A A . 29 SER HB3 1 1 12 8249 1 1 29 SER HG H -5.160 1.804 -4.465 1.00 . A A . 29 SER HG 1 1 12 8250 1 1 29 SER N N -3.945 3.096 -6.752 1.00 . A A . 29 SER N 1 1 12 8251 1 1 29 SER O O -5.286 4.941 -5.209 1.00 . A A . 29 SER O 1 1 12 8252 1 1 29 SER OG O -5.153 1.311 -5.289 1.00 . A A . 29 SER OG 1 1 12 8253 1 1 30 PRO C C -8.003 5.938 -4.445 1.00 . A A . 30 PRO C 1 1 12 8254 1 1 30 PRO CA C -7.718 6.125 -5.932 1.00 . A A . 30 PRO CA 1 1 12 8255 1 1 30 PRO CB C -9.028 6.301 -6.712 1.00 . A A . 30 PRO CB 1 1 12 8256 1 1 30 PRO CD C -7.945 4.381 -7.619 1.00 . A A . 30 PRO CD 1 1 12 8257 1 1 30 PRO CG C -8.826 5.542 -7.978 1.00 . A A . 30 PRO CG 1 1 12 8258 1 1 30 PRO HA H -7.094 6.996 -6.069 1.00 . A A . 30 PRO HA 1 1 12 8259 1 1 30 PRO HB2 H -9.849 5.898 -6.136 1.00 . A A . 30 PRO HB2 1 1 12 8260 1 1 30 PRO HB3 H -9.197 7.350 -6.904 1.00 . A A . 30 PRO HB3 1 1 12 8261 1 1 30 PRO HD2 H -8.540 3.550 -7.266 1.00 . A A . 30 PRO HD2 1 1 12 8262 1 1 30 PRO HD3 H -7.340 4.086 -8.462 1.00 . A A . 30 PRO HD3 1 1 12 8263 1 1 30 PRO HG2 H -9.775 5.193 -8.355 1.00 . A A . 30 PRO HG2 1 1 12 8264 1 1 30 PRO HG3 H -8.337 6.169 -8.708 1.00 . A A . 30 PRO HG3 1 1 12 8265 1 1 30 PRO N N -7.111 4.929 -6.536 1.00 . A A . 30 PRO N 1 1 12 8266 1 1 30 PRO O O -7.291 6.472 -3.595 1.00 . A A . 30 PRO O 1 1 12 8267 1 1 31 LYS C C -8.690 3.510 -2.366 1.00 . A A . 31 LYS C 1 1 12 8268 1 1 31 LYS CA C -9.363 4.823 -2.755 1.00 . A A . 31 LYS CA 1 1 12 8269 1 1 31 LYS CB C -10.879 4.724 -2.582 1.00 . A A . 31 LYS CB 1 1 12 8270 1 1 31 LYS CD C -11.556 6.673 -1.143 1.00 . A A . 31 LYS CD 1 1 12 8271 1 1 31 LYS CE C -11.415 8.186 -1.188 1.00 . A A . 31 LYS CE 1 1 12 8272 1 1 31 LYS CG C -11.577 6.073 -2.541 1.00 . A A . 31 LYS CG 1 1 12 8273 1 1 31 LYS H H -9.507 4.688 -4.860 1.00 . A A . 31 LYS H 1 1 12 8274 1 1 31 LYS HA H -8.980 5.614 -2.127 1.00 . A A . 31 LYS HA 1 1 12 8275 1 1 31 LYS HB2 H -11.287 4.157 -3.405 1.00 . A A . 31 LYS HB2 1 1 12 8276 1 1 31 LYS HB3 H -11.092 4.205 -1.658 1.00 . A A . 31 LYS HB3 1 1 12 8277 1 1 31 LYS HD2 H -12.479 6.423 -0.641 1.00 . A A . 31 LYS HD2 1 1 12 8278 1 1 31 LYS HD3 H -10.722 6.258 -0.596 1.00 . A A . 31 LYS HD3 1 1 12 8279 1 1 31 LYS HE2 H -10.385 8.445 -0.993 1.00 . A A . 31 LYS HE2 1 1 12 8280 1 1 31 LYS HE3 H -11.692 8.531 -2.174 1.00 . A A . 31 LYS HE3 1 1 12 8281 1 1 31 LYS HG2 H -11.074 6.748 -3.217 1.00 . A A . 31 LYS HG2 1 1 12 8282 1 1 31 LYS HG3 H -12.603 5.946 -2.853 1.00 . A A . 31 LYS HG3 1 1 12 8283 1 1 31 LYS HZ1 H -11.867 8.757 0.771 1.00 . A A . 31 LYS HZ1 1 1 12 8284 1 1 31 LYS HZ2 H -13.228 8.425 -0.177 1.00 . A A . 31 LYS HZ2 1 1 12 8285 1 1 31 LYS HZ3 H -12.374 9.868 -0.401 1.00 . A A . 31 LYS HZ3 1 1 12 8286 1 1 31 LYS N N -9.018 5.136 -4.138 1.00 . A A . 31 LYS N 1 1 12 8287 1 1 31 LYS NZ N -12.282 8.855 -0.179 1.00 . A A . 31 LYS NZ 1 1 12 8288 1 1 31 LYS O O -7.628 3.495 -1.747 1.00 . A A . 31 LYS O 1 1 12 8289 1 1 32 ALA C C -8.623 0.710 -1.090 1.00 . A A . 32 ALA C 1 1 12 8290 1 1 32 ALA CA C -8.808 1.064 -2.563 1.00 . A A . 32 ALA CA 1 1 12 8291 1 1 32 ALA CB C -7.494 0.877 -3.305 1.00 . A A . 32 ALA CB 1 1 12 8292 1 1 32 ALA H H -10.143 2.519 -3.308 1.00 . A A . 32 ALA H 1 1 12 8293 1 1 32 ALA HA H -9.519 0.374 -2.992 1.00 . A A . 32 ALA HA 1 1 12 8294 1 1 32 ALA HB1 H -7.687 0.448 -4.276 1.00 . A A . 32 ALA HB1 1 1 12 8295 1 1 32 ALA HB2 H -6.853 0.217 -2.740 1.00 . A A . 32 ALA HB2 1 1 12 8296 1 1 32 ALA HB3 H -7.009 1.835 -3.425 1.00 . A A . 32 ALA HB3 1 1 12 8297 1 1 32 ALA N N -9.317 2.414 -2.790 1.00 . A A . 32 ALA N 1 1 12 8298 1 1 32 ALA O O -8.206 1.534 -0.276 1.00 . A A . 32 ALA O 1 1 12 8299 1 1 33 VAL C C -7.481 -1.928 0.621 1.00 . A A . 33 VAL C 1 1 12 8300 1 1 33 VAL CA C -8.748 -1.081 0.569 1.00 . A A . 33 VAL CA 1 1 12 8301 1 1 33 VAL CB C -9.956 -1.943 0.988 1.00 . A A . 33 VAL CB 1 1 12 8302 1 1 33 VAL CG1 C -9.975 -2.142 2.496 1.00 . A A . 33 VAL CG1 1 1 12 8303 1 1 33 VAL CG2 C -11.255 -1.313 0.510 1.00 . A A . 33 VAL CG2 1 1 12 8304 1 1 33 VAL H H -9.209 -1.154 -1.490 1.00 . A A . 33 VAL H 1 1 12 8305 1 1 33 VAL HA H -8.653 -0.252 1.254 1.00 . A A . 33 VAL HA 1 1 12 8306 1 1 33 VAL HB H -9.859 -2.913 0.522 1.00 . A A . 33 VAL HB 1 1 12 8307 1 1 33 VAL HG11 H -8.962 -2.223 2.861 1.00 . A A . 33 VAL HG11 1 1 12 8308 1 1 33 VAL HG12 H -10.517 -3.046 2.733 1.00 . A A . 33 VAL HG12 1 1 12 8309 1 1 33 VAL HG13 H -10.461 -1.297 2.963 1.00 . A A . 33 VAL HG13 1 1 12 8310 1 1 33 VAL HG21 H -11.467 -1.641 -0.498 1.00 . A A . 33 VAL HG21 1 1 12 8311 1 1 33 VAL HG22 H -11.160 -0.237 0.524 1.00 . A A . 33 VAL HG22 1 1 12 8312 1 1 33 VAL HG23 H -12.063 -1.611 1.163 1.00 . A A . 33 VAL HG23 1 1 12 8313 1 1 33 VAL N N -8.906 -0.552 -0.779 1.00 . A A . 33 VAL N 1 1 12 8314 1 1 33 VAL O O -7.369 -2.930 -0.086 1.00 . A A . 33 VAL O 1 1 12 8315 1 1 34 CYS C C -5.406 -3.614 2.155 1.00 . A A . 34 CYS C 1 1 12 8316 1 1 34 CYS CA C -5.249 -2.229 1.530 1.00 . A A . 34 CYS CA 1 1 12 8317 1 1 34 CYS CB C -4.236 -1.412 2.335 1.00 . A A . 34 CYS CB 1 1 12 8318 1 1 34 CYS H H -6.647 -0.700 1.963 1.00 . A A . 34 CYS H 1 1 12 8319 1 1 34 CYS HA H -4.868 -2.349 0.528 1.00 . A A . 34 CYS HA 1 1 12 8320 1 1 34 CYS HB2 H -4.042 -0.484 1.817 1.00 . A A . 34 CYS HB2 1 1 12 8321 1 1 34 CYS HB3 H -4.643 -1.196 3.313 1.00 . A A . 34 CYS HB3 1 1 12 8322 1 1 34 CYS N N -6.516 -1.514 1.431 1.00 . A A . 34 CYS N 1 1 12 8323 1 1 34 CYS O O -5.506 -3.742 3.375 1.00 . A A . 34 CYS O 1 1 12 8324 1 1 34 CYS SG S -2.640 -2.257 2.571 1.00 . A A . 34 CYS SG 1 1 12 8325 1 1 35 CYS C C -4.452 -6.277 2.862 1.00 . A A . 35 CYS C 1 1 12 8326 1 1 35 CYS CA C -5.507 -6.026 1.792 1.00 . A A . 35 CYS CA 1 1 12 8327 1 1 35 CYS CB C -5.334 -7.016 0.638 1.00 . A A . 35 CYS CB 1 1 12 8328 1 1 35 CYS H H -5.298 -4.490 0.349 1.00 . A A . 35 CYS H 1 1 12 8329 1 1 35 CYS HA H -6.488 -6.152 2.227 1.00 . A A . 35 CYS HA 1 1 12 8330 1 1 35 CYS HB2 H -5.457 -6.492 -0.298 1.00 . A A . 35 CYS HB2 1 1 12 8331 1 1 35 CYS HB3 H -4.341 -7.437 0.682 1.00 . A A . 35 CYS HB3 1 1 12 8332 1 1 35 CYS N N -5.398 -4.651 1.311 1.00 . A A . 35 CYS N 1 1 12 8333 1 1 35 CYS O O -3.244 -6.221 2.587 1.00 . A A . 35 CYS O 1 1 12 8334 1 1 35 CYS SG S -6.524 -8.397 0.657 1.00 . A A . 35 CYS SG 1 1 12 8335 1 1 36 ASP C C -3.594 -8.193 5.367 1.00 . A A . 36 ASP C 1 1 12 8336 1 1 36 ASP CA C -4.040 -6.739 5.228 1.00 . A A . 36 ASP CA 1 1 12 8337 1 1 36 ASP CB C -4.732 -6.295 6.517 1.00 . A A . 36 ASP CB 1 1 12 8338 1 1 36 ASP CG C -3.741 -5.935 7.609 1.00 . A A . 36 ASP CG 1 1 12 8339 1 1 36 ASP H H -5.891 -6.525 4.228 1.00 . A A . 36 ASP H 1 1 12 8340 1 1 36 ASP HA H -3.164 -6.127 5.083 1.00 . A A . 36 ASP HA 1 1 12 8341 1 1 36 ASP HB2 H -5.342 -5.428 6.312 1.00 . A A . 36 ASP HB2 1 1 12 8342 1 1 36 ASP HB3 H -5.360 -7.097 6.877 1.00 . A A . 36 ASP HB3 1 1 12 8343 1 1 36 ASP N N -4.921 -6.520 4.086 1.00 . A A . 36 ASP N 1 1 12 8344 1 1 36 ASP O O -2.587 -8.460 6.024 1.00 . A A . 36 ASP O 1 1 12 8345 1 1 36 ASP OD1 O -3.166 -6.862 8.218 1.00 . A A . 36 ASP OD1 1 1 12 8346 1 1 36 ASP OD2 O -3.541 -4.726 7.854 1.00 . A A . 36 ASP OD2 1 1 12 8347 1 1 37 ASP C C -2.475 -10.745 4.701 1.00 . A A . 37 ASP C 1 1 12 8348 1 1 37 ASP CA C -3.978 -10.550 4.859 1.00 . A A . 37 ASP CA 1 1 12 8349 1 1 37 ASP CB C -4.723 -11.349 3.789 1.00 . A A . 37 ASP CB 1 1 12 8350 1 1 37 ASP CG C -5.926 -12.088 4.347 1.00 . A A . 37 ASP CG 1 1 12 8351 1 1 37 ASP H H -5.134 -8.889 4.259 1.00 . A A . 37 ASP H 1 1 12 8352 1 1 37 ASP HA H -4.276 -10.904 5.834 1.00 . A A . 37 ASP HA 1 1 12 8353 1 1 37 ASP HB2 H -5.065 -10.675 3.017 1.00 . A A . 37 ASP HB2 1 1 12 8354 1 1 37 ASP HB3 H -4.049 -12.073 3.355 1.00 . A A . 37 ASP HB3 1 1 12 8355 1 1 37 ASP N N -4.333 -9.132 4.769 1.00 . A A . 37 ASP N 1 1 12 8356 1 1 37 ASP O O -1.846 -11.471 5.471 1.00 . A A . 37 ASP O 1 1 12 8357 1 1 37 ASP OD1 O -6.216 -13.200 3.858 1.00 . A A . 37 ASP OD1 1 1 12 8358 1 1 37 ASP OD2 O -6.576 -11.554 5.269 1.00 . A A . 37 ASP OD2 1 1 12 8359 1 1 38 MET C C 0.078 -8.748 3.230 1.00 . A A . 38 MET C 1 1 12 8360 1 1 38 MET CA C -0.479 -10.149 3.445 1.00 . A A . 38 MET CA 1 1 12 8361 1 1 38 MET CB C -0.203 -11.026 2.221 1.00 . A A . 38 MET CB 1 1 12 8362 1 1 38 MET CE C 0.355 -14.930 1.329 1.00 . A A . 38 MET CE 1 1 12 8363 1 1 38 MET CG C -0.343 -12.515 2.494 1.00 . A A . 38 MET CG 1 1 12 8364 1 1 38 MET H H -2.469 -9.506 3.138 1.00 . A A . 38 MET H 1 1 12 8365 1 1 38 MET HA H -0.004 -10.586 4.310 1.00 . A A . 38 MET HA 1 1 12 8366 1 1 38 MET HB2 H -0.896 -10.760 1.437 1.00 . A A . 38 MET HB2 1 1 12 8367 1 1 38 MET HB3 H 0.804 -10.838 1.879 1.00 . A A . 38 MET HB3 1 1 12 8368 1 1 38 MET HE1 H 0.560 -15.449 0.403 1.00 . A A . 38 MET HE1 1 1 12 8369 1 1 38 MET HE2 H -0.189 -15.585 1.993 1.00 . A A . 38 MET HE2 1 1 12 8370 1 1 38 MET HE3 H 1.286 -14.640 1.793 1.00 . A A . 38 MET HE3 1 1 12 8371 1 1 38 MET HG2 H 0.563 -12.869 2.963 1.00 . A A . 38 MET HG2 1 1 12 8372 1 1 38 MET HG3 H -1.177 -12.668 3.164 1.00 . A A . 38 MET HG3 1 1 12 8373 1 1 38 MET N N -1.909 -10.076 3.706 1.00 . A A . 38 MET N 1 1 12 8374 1 1 38 MET O O 0.416 -8.052 4.188 1.00 . A A . 38 MET O 1 1 12 8375 1 1 38 MET SD S -0.626 -13.470 0.992 1.00 . A A . 38 MET SD 1 1 12 8376 1 1 39 GLN C C -0.040 -6.593 0.281 1.00 . A A . 39 GLN C 1 1 12 8377 1 1 39 GLN CA C 0.553 -6.972 1.631 1.00 . A A . 39 GLN CA 1 1 12 8378 1 1 39 GLN CB C 2.081 -6.898 1.580 1.00 . A A . 39 GLN CB 1 1 12 8379 1 1 39 GLN CD C 4.131 -5.421 1.510 1.00 . A A . 39 GLN CD 1 1 12 8380 1 1 39 GLN CG C 2.616 -5.478 1.471 1.00 . A A . 39 GLN CG 1 1 12 8381 1 1 39 GLN H H -0.245 -8.878 1.257 1.00 . A A . 39 GLN H 1 1 12 8382 1 1 39 GLN HA H 0.184 -6.291 2.384 1.00 . A A . 39 GLN HA 1 1 12 8383 1 1 39 GLN HB2 H 2.483 -7.343 2.478 1.00 . A A . 39 GLN HB2 1 1 12 8384 1 1 39 GLN HB3 H 2.428 -7.456 0.724 1.00 . A A . 39 GLN HB3 1 1 12 8385 1 1 39 GLN HE21 H 4.249 -6.950 0.246 1.00 . A A . 39 GLN HE21 1 1 12 8386 1 1 39 GLN HE22 H 5.757 -6.299 0.778 1.00 . A A . 39 GLN HE22 1 1 12 8387 1 1 39 GLN HG2 H 2.280 -5.050 0.538 1.00 . A A . 39 GLN HG2 1 1 12 8388 1 1 39 GLN HG3 H 2.228 -4.896 2.294 1.00 . A A . 39 GLN HG3 1 1 12 8389 1 1 39 GLN N N 0.112 -8.315 1.976 1.00 . A A . 39 GLN N 1 1 12 8390 1 1 39 GLN NE2 N 4.778 -6.314 0.770 1.00 . A A . 39 GLN NE2 1 1 12 8391 1 1 39 GLN O O 0.632 -6.722 -0.744 1.00 . A A . 39 GLN O 1 1 12 8392 1 1 39 GLN OE1 O 4.714 -4.583 2.198 1.00 . A A . 39 GLN OE1 1 1 12 8393 1 1 40 HIS C C -2.978 -4.722 -0.891 1.00 . A A . 40 HIS C 1 1 12 8394 1 1 40 HIS CA C -1.926 -5.813 -1.023 1.00 . A A . 40 HIS CA 1 1 12 8395 1 1 40 HIS CB C -2.571 -7.055 -1.644 1.00 . A A . 40 HIS CB 1 1 12 8396 1 1 40 HIS CD2 C -1.248 -9.281 -1.508 1.00 . A A . 40 HIS CD2 1 1 12 8397 1 1 40 HIS CE1 C -0.055 -9.060 -3.335 1.00 . A A . 40 HIS CE1 1 1 12 8398 1 1 40 HIS CG C -1.589 -8.100 -2.077 1.00 . A A . 40 HIS CG 1 1 12 8399 1 1 40 HIS H H -1.815 -6.091 1.093 1.00 . A A . 40 HIS H 1 1 12 8400 1 1 40 HIS HA H -1.149 -5.462 -1.684 1.00 . A A . 40 HIS HA 1 1 12 8401 1 1 40 HIS HB2 H -3.234 -7.506 -0.923 1.00 . A A . 40 HIS HB2 1 1 12 8402 1 1 40 HIS HB3 H -3.142 -6.757 -2.512 1.00 . A A . 40 HIS HB3 1 1 12 8403 1 1 40 HIS HD1 H -0.844 -7.243 -3.851 1.00 . A A . 40 HIS HD1 1 1 12 8404 1 1 40 HIS HD2 H -1.651 -9.694 -0.595 1.00 . A A . 40 HIS HD2 1 1 12 8405 1 1 40 HIS HE1 H 0.649 -9.248 -4.131 1.00 . A A . 40 HIS HE1 1 1 12 8406 1 1 40 HIS HE2 H 0.168 -10.702 -2.131 1.00 . A A . 40 HIS HE2 1 1 12 8407 1 1 40 HIS N N -1.299 -6.154 0.255 1.00 . A A . 40 HIS N 1 1 12 8408 1 1 40 HIS ND1 N -0.824 -7.991 -3.219 1.00 . A A . 40 HIS ND1 1 1 12 8409 1 1 40 HIS NE2 N -0.294 -9.856 -2.310 1.00 . A A . 40 HIS NE2 1 1 12 8410 1 1 40 HIS O O -3.168 -4.141 0.176 1.00 . A A . 40 HIS O 1 1 12 8411 1 1 41 CYS C C -5.781 -3.901 -3.069 1.00 . A A . 41 CYS C 1 1 12 8412 1 1 41 CYS CA C -4.715 -3.466 -2.068 1.00 . A A . 41 CYS CA 1 1 12 8413 1 1 41 CYS CB C -4.145 -2.104 -2.467 1.00 . A A . 41 CYS CB 1 1 12 8414 1 1 41 CYS H H -3.450 -4.978 -2.814 1.00 . A A . 41 CYS H 1 1 12 8415 1 1 41 CYS HA H -5.164 -3.394 -1.091 1.00 . A A . 41 CYS HA 1 1 12 8416 1 1 41 CYS HB2 H -4.599 -1.789 -3.394 1.00 . A A . 41 CYS HB2 1 1 12 8417 1 1 41 CYS HB3 H -4.382 -1.385 -1.695 1.00 . A A . 41 CYS HB3 1 1 12 8418 1 1 41 CYS N N -3.661 -4.467 -2.004 1.00 . A A . 41 CYS N 1 1 12 8419 1 1 41 CYS O O -5.478 -4.568 -4.058 1.00 . A A . 41 CYS O 1 1 12 8420 1 1 41 CYS SG S -2.338 -2.088 -2.703 1.00 . A A . 41 CYS SG 1 1 12 8421 1 1 42 CYS C C -8.877 -2.653 -4.166 1.00 . A A . 42 CYS C 1 1 12 8422 1 1 42 CYS CA C -8.133 -3.894 -3.679 1.00 . A A . 42 CYS CA 1 1 12 8423 1 1 42 CYS CB C -9.090 -4.832 -2.947 1.00 . A A . 42 CYS CB 1 1 12 8424 1 1 42 CYS H H -7.209 -3.003 -1.998 1.00 . A A . 42 CYS H 1 1 12 8425 1 1 42 CYS HA H -7.721 -4.410 -4.533 1.00 . A A . 42 CYS HA 1 1 12 8426 1 1 42 CYS HB2 H -9.042 -4.628 -1.887 1.00 . A A . 42 CYS HB2 1 1 12 8427 1 1 42 CYS HB3 H -10.095 -4.655 -3.297 1.00 . A A . 42 CYS HB3 1 1 12 8428 1 1 42 CYS N N -7.027 -3.529 -2.803 1.00 . A A . 42 CYS N 1 1 12 8429 1 1 42 CYS O O -9.146 -1.741 -3.388 1.00 . A A . 42 CYS O 1 1 12 8430 1 1 42 CYS SG S -8.720 -6.599 -3.188 1.00 . A A . 42 CYS SG 1 1 12 8431 1 1 43 PRO C C -11.165 -1.056 -5.260 1.00 . A A . 43 PRO C 1 1 12 8432 1 1 43 PRO CA C -9.930 -1.464 -6.060 1.00 . A A . 43 PRO CA 1 1 12 8433 1 1 43 PRO CB C -10.339 -1.964 -7.455 1.00 . A A . 43 PRO CB 1 1 12 8434 1 1 43 PRO CD C -8.939 -3.637 -6.469 1.00 . A A . 43 PRO CD 1 1 12 8435 1 1 43 PRO CG C -10.037 -3.427 -7.470 1.00 . A A . 43 PRO CG 1 1 12 8436 1 1 43 PRO HA H -9.279 -0.609 -6.163 1.00 . A A . 43 PRO HA 1 1 12 8437 1 1 43 PRO HB2 H -11.392 -1.781 -7.608 1.00 . A A . 43 PRO HB2 1 1 12 8438 1 1 43 PRO HB3 H -9.767 -1.438 -8.206 1.00 . A A . 43 PRO HB3 1 1 12 8439 1 1 43 PRO HD2 H -9.004 -4.625 -6.037 1.00 . A A . 43 PRO HD2 1 1 12 8440 1 1 43 PRO HD3 H -7.973 -3.483 -6.927 1.00 . A A . 43 PRO HD3 1 1 12 8441 1 1 43 PRO HG2 H -10.915 -3.986 -7.183 1.00 . A A . 43 PRO HG2 1 1 12 8442 1 1 43 PRO HG3 H -9.707 -3.723 -8.455 1.00 . A A . 43 PRO HG3 1 1 12 8443 1 1 43 PRO N N -9.219 -2.601 -5.468 1.00 . A A . 43 PRO N 1 1 12 8444 1 1 43 PRO O O -11.986 -1.897 -4.883 1.00 . A A . 43 PRO O 1 1 12 8445 1 1 44 ALA C C -13.720 0.173 -4.718 1.00 . A A . 44 ALA C 1 1 12 8446 1 1 44 ALA CA C -12.409 0.792 -4.256 1.00 . A A . 44 ALA CA 1 1 12 8447 1 1 44 ALA CB C -12.462 2.303 -4.404 1.00 . A A . 44 ALA CB 1 1 12 8448 1 1 44 ALA H H -10.588 0.856 -5.334 1.00 . A A . 44 ALA H 1 1 12 8449 1 1 44 ALA HA H -12.258 0.559 -3.212 1.00 . A A . 44 ALA HA 1 1 12 8450 1 1 44 ALA HB1 H -11.990 2.765 -3.549 1.00 . A A . 44 ALA HB1 1 1 12 8451 1 1 44 ALA HB2 H -13.492 2.623 -4.463 1.00 . A A . 44 ALA HB2 1 1 12 8452 1 1 44 ALA HB3 H -11.942 2.596 -5.304 1.00 . A A . 44 ALA HB3 1 1 12 8453 1 1 44 ALA N N -11.283 0.248 -5.007 1.00 . A A . 44 ALA N 1 1 12 8454 1 1 44 ALA O O -14.003 0.118 -5.915 1.00 . A A . 44 ALA O 1 1 12 8455 1 1 45 GLY C C -15.702 -2.427 -4.074 1.00 . A A . 45 GLY C 1 1 12 8456 1 1 45 GLY CA C -15.780 -0.916 -4.103 1.00 . A A . 45 GLY CA 1 1 12 8457 1 1 45 GLY H H -14.239 -0.236 -2.827 1.00 . A A . 45 GLY H 1 1 12 8458 1 1 45 GLY HA2 H -16.527 -0.588 -3.396 1.00 . A A . 45 GLY HA2 1 1 12 8459 1 1 45 GLY HA3 H -16.069 -0.599 -5.094 1.00 . A A . 45 GLY HA3 1 1 12 8460 1 1 45 GLY N N -14.514 -0.299 -3.766 1.00 . A A . 45 GLY N 1 1 12 8461 1 1 45 GLY O O -16.722 -3.106 -4.200 1.00 . A A . 45 GLY O 1 1 12 8462 1 1 46 TYR C C -13.877 -4.850 -2.460 1.00 . A A . 46 TYR C 1 1 12 8463 1 1 46 TYR CA C -14.297 -4.403 -3.858 1.00 . A A . 46 TYR CA 1 1 12 8464 1 1 46 TYR CB C -13.246 -4.828 -4.885 1.00 . A A . 46 TYR CB 1 1 12 8465 1 1 46 TYR CD1 C -14.162 -3.617 -6.904 1.00 . A A . 46 TYR CD1 1 1 12 8466 1 1 46 TYR CD2 C -13.828 -5.972 -7.062 1.00 . A A . 46 TYR CD2 1 1 12 8467 1 1 46 TYR CE1 C -14.631 -3.592 -8.204 1.00 . A A . 46 TYR CE1 1 1 12 8468 1 1 46 TYR CE2 C -14.294 -5.955 -8.363 1.00 . A A . 46 TYR CE2 1 1 12 8469 1 1 46 TYR CG C -13.754 -4.806 -6.311 1.00 . A A . 46 TYR CG 1 1 12 8470 1 1 46 TYR CZ C -14.695 -4.762 -8.929 1.00 . A A . 46 TYR CZ 1 1 12 8471 1 1 46 TYR H H -13.710 -2.372 -3.807 1.00 . A A . 46 TYR H 1 1 12 8472 1 1 46 TYR HA H -15.238 -4.871 -4.105 1.00 . A A . 46 TYR HA 1 1 12 8473 1 1 46 TYR HB2 H -12.400 -4.161 -4.823 1.00 . A A . 46 TYR HB2 1 1 12 8474 1 1 46 TYR HB3 H -12.921 -5.835 -4.663 1.00 . A A . 46 TYR HB3 1 1 12 8475 1 1 46 TYR HD1 H -14.110 -2.702 -6.333 1.00 . A A . 46 TYR HD1 1 1 12 8476 1 1 46 TYR HD2 H -13.514 -6.905 -6.616 1.00 . A A . 46 TYR HD2 1 1 12 8477 1 1 46 TYR HE1 H -14.943 -2.658 -8.646 1.00 . A A . 46 TYR HE1 1 1 12 8478 1 1 46 TYR HE2 H -14.345 -6.872 -8.931 1.00 . A A . 46 TYR HE2 1 1 12 8479 1 1 46 TYR HH H -15.047 -5.607 -10.621 1.00 . A A . 46 TYR HH 1 1 12 8480 1 1 46 TYR N N -14.493 -2.959 -3.904 1.00 . A A . 46 TYR N 1 1 12 8481 1 1 46 TYR O O -13.461 -4.037 -1.635 1.00 . A A . 46 TYR O 1 1 12 8482 1 1 46 TYR OH O -15.162 -4.741 -10.223 1.00 . A A . 46 TYR OH 1 1 12 8483 1 1 47 LYS C C -12.539 -7.771 -1.077 1.00 . A A . 47 LYS C 1 1 12 8484 1 1 47 LYS CA C -13.631 -6.717 -0.909 1.00 . A A . 47 LYS CA 1 1 12 8485 1 1 47 LYS CB C -14.873 -7.329 -0.246 1.00 . A A . 47 LYS CB 1 1 12 8486 1 1 47 LYS CD C -14.728 -9.738 0.470 1.00 . A A . 47 LYS CD 1 1 12 8487 1 1 47 LYS CE C -16.185 -10.181 0.504 1.00 . A A . 47 LYS CE 1 1 12 8488 1 1 47 LYS CG C -14.567 -8.286 0.898 1.00 . A A . 47 LYS CG 1 1 12 8489 1 1 47 LYS H H -14.333 -6.743 -2.905 1.00 . A A . 47 LYS H 1 1 12 8490 1 1 47 LYS HA H -13.254 -5.918 -0.287 1.00 . A A . 47 LYS HA 1 1 12 8491 1 1 47 LYS HB2 H -15.486 -6.530 0.142 1.00 . A A . 47 LYS HB2 1 1 12 8492 1 1 47 LYS HB3 H -15.434 -7.867 -0.995 1.00 . A A . 47 LYS HB3 1 1 12 8493 1 1 47 LYS HD2 H -14.354 -9.849 -0.537 1.00 . A A . 47 LYS HD2 1 1 12 8494 1 1 47 LYS HD3 H -14.156 -10.364 1.139 1.00 . A A . 47 LYS HD3 1 1 12 8495 1 1 47 LYS HE2 H -16.566 -10.196 -0.505 1.00 . A A . 47 LYS HE2 1 1 12 8496 1 1 47 LYS HE3 H -16.233 -11.177 0.920 1.00 . A A . 47 LYS HE3 1 1 12 8497 1 1 47 LYS HG2 H -13.550 -8.129 1.224 1.00 . A A . 47 LYS HG2 1 1 12 8498 1 1 47 LYS HG3 H -15.245 -8.083 1.713 1.00 . A A . 47 LYS HG3 1 1 12 8499 1 1 47 LYS HZ1 H -17.147 -8.358 0.844 1.00 . A A . 47 LYS HZ1 1 1 12 8500 1 1 47 LYS HZ2 H -16.586 -9.108 2.252 1.00 . A A . 47 LYS HZ2 1 1 12 8501 1 1 47 LYS HZ3 H -17.970 -9.695 1.475 1.00 . A A . 47 LYS HZ3 1 1 12 8502 1 1 47 LYS N N -13.993 -6.149 -2.204 1.00 . A A . 47 LYS N 1 1 12 8503 1 1 47 LYS NZ N -17.031 -9.272 1.326 1.00 . A A . 47 LYS NZ 1 1 12 8504 1 1 47 LYS O O -12.411 -8.372 -2.143 1.00 . A A . 47 LYS O 1 1 12 8505 1 1 48 CYS C C -11.222 -10.367 0.314 1.00 . A A . 48 CYS C 1 1 12 8506 1 1 48 CYS CA C -10.689 -8.990 -0.072 1.00 . A A . 48 CYS CA 1 1 12 8507 1 1 48 CYS CB C -9.547 -8.588 0.865 1.00 . A A . 48 CYS CB 1 1 12 8508 1 1 48 CYS H H -11.904 -7.503 0.808 1.00 . A A . 48 CYS H 1 1 12 8509 1 1 48 CYS HA H -10.317 -9.031 -1.085 1.00 . A A . 48 CYS HA 1 1 12 8510 1 1 48 CYS HB2 H -9.954 -8.039 1.701 1.00 . A A . 48 CYS HB2 1 1 12 8511 1 1 48 CYS HB3 H -9.060 -9.480 1.231 1.00 . A A . 48 CYS HB3 1 1 12 8512 1 1 48 CYS N N -11.758 -8.000 -0.025 1.00 . A A . 48 CYS N 1 1 12 8513 1 1 48 CYS O O -11.970 -10.502 1.282 1.00 . A A . 48 CYS O 1 1 12 8514 1 1 48 CYS SG S -8.275 -7.542 0.084 1.00 . A A . 48 CYS SG 1 1 12 8515 1 1 49 GLY C C -10.186 -13.642 0.331 1.00 . A A . 49 GLY C 1 1 12 8516 1 1 49 GLY CA C -11.295 -12.734 -0.166 1.00 . A A . 49 GLY CA 1 1 12 8517 1 1 49 GLY H H -10.239 -11.225 -1.205 1.00 . A A . 49 GLY H 1 1 12 8518 1 1 49 GLY HA2 H -12.070 -12.688 0.586 1.00 . A A . 49 GLY HA2 1 1 12 8519 1 1 49 GLY HA3 H -11.712 -13.156 -1.069 1.00 . A A . 49 GLY HA3 1 1 12 8520 1 1 49 GLY N N -10.837 -11.387 -0.447 1.00 . A A . 49 GLY N 1 1 12 8521 1 1 49 GLY O O -9.055 -13.195 0.525 1.00 . A A . 49 GLY O 1 1 12 8522 1 1 50 PRO C C -8.277 -15.992 0.117 1.00 . A A . 50 PRO C 1 1 12 8523 1 1 50 PRO CA C -9.496 -15.908 1.031 1.00 . A A . 50 PRO CA 1 1 12 8524 1 1 50 PRO CB C -10.260 -17.237 1.026 1.00 . A A . 50 PRO CB 1 1 12 8525 1 1 50 PRO CD C -11.809 -15.552 0.347 1.00 . A A . 50 PRO CD 1 1 12 8526 1 1 50 PRO CG C -11.698 -16.853 1.089 1.00 . A A . 50 PRO CG 1 1 12 8527 1 1 50 PRO HA H -9.175 -15.678 2.037 1.00 . A A . 50 PRO HA 1 1 12 8528 1 1 50 PRO HB2 H -10.036 -17.780 0.119 1.00 . A A . 50 PRO HB2 1 1 12 8529 1 1 50 PRO HB3 H -9.971 -17.824 1.884 1.00 . A A . 50 PRO HB3 1 1 12 8530 1 1 50 PRO HD2 H -11.997 -15.730 -0.702 1.00 . A A . 50 PRO HD2 1 1 12 8531 1 1 50 PRO HD3 H -12.589 -14.939 0.774 1.00 . A A . 50 PRO HD3 1 1 12 8532 1 1 50 PRO HG2 H -12.302 -17.611 0.611 1.00 . A A . 50 PRO HG2 1 1 12 8533 1 1 50 PRO HG3 H -11.999 -16.724 2.118 1.00 . A A . 50 PRO HG3 1 1 12 8534 1 1 50 PRO N N -10.485 -14.936 0.550 1.00 . A A . 50 PRO N 1 1 12 8535 1 1 50 PRO O O -8.404 -16.224 -1.085 1.00 . A A . 50 PRO O 1 1 12 8536 1 1 51 GLY C C -5.565 -14.553 -0.779 1.00 . A A . 51 GLY C 1 1 12 8537 1 1 51 GLY CA C -5.869 -15.859 -0.073 1.00 . A A . 51 GLY CA 1 1 12 8538 1 1 51 GLY H H -7.059 -15.619 1.661 1.00 . A A . 51 GLY H 1 1 12 8539 1 1 51 GLY HA2 H -5.053 -16.089 0.592 1.00 . A A . 51 GLY HA2 1 1 12 8540 1 1 51 GLY HA3 H -5.954 -16.642 -0.810 1.00 . A A . 51 GLY HA3 1 1 12 8541 1 1 51 GLY N N -7.097 -15.801 0.698 1.00 . A A . 51 GLY N 1 1 12 8542 1 1 51 GLY O O -4.669 -14.488 -1.620 1.00 . A A . 51 GLY O 1 1 12 8543 1 1 52 GLY C C -6.624 -12.143 -2.462 1.00 . A A . 52 GLY C 1 1 12 8544 1 1 52 GLY CA C -6.106 -12.214 -1.039 1.00 . A A . 52 GLY CA 1 1 12 8545 1 1 52 GLY H H -7.009 -13.633 0.248 1.00 . A A . 52 GLY H 1 1 12 8546 1 1 52 GLY HA2 H -6.615 -11.468 -0.446 1.00 . A A . 52 GLY HA2 1 1 12 8547 1 1 52 GLY HA3 H -5.048 -11.995 -1.042 1.00 . A A . 52 GLY HA3 1 1 12 8548 1 1 52 GLY N N -6.312 -13.515 -0.431 1.00 . A A . 52 GLY N 1 1 12 8549 1 1 52 GLY O O -5.964 -12.604 -3.393 1.00 . A A . 52 GLY O 1 1 12 8550 1 1 53 THR C C -9.534 -10.367 -3.906 1.00 . A A . 53 THR C 1 1 12 8551 1 1 53 THR CA C -8.414 -11.399 -3.947 1.00 . A A . 53 THR CA 1 1 12 8552 1 1 53 THR CB C -8.989 -12.726 -4.471 1.00 . A A . 53 THR CB 1 1 12 8553 1 1 53 THR CG2 C -8.002 -13.417 -5.400 1.00 . A A . 53 THR CG2 1 1 12 8554 1 1 53 THR H H -8.271 -11.191 -1.848 1.00 . A A . 53 THR H 1 1 12 8555 1 1 53 THR HA H -7.651 -11.063 -4.634 1.00 . A A . 53 THR HA 1 1 12 8556 1 1 53 THR HB H -9.891 -12.509 -5.028 1.00 . A A . 53 THR HB 1 1 12 8557 1 1 53 THR HG1 H -9.377 -14.496 -3.691 1.00 . A A . 53 THR HG1 1 1 12 8558 1 1 53 THR HG21 H -7.389 -14.100 -4.829 1.00 . A A . 53 THR HG21 1 1 12 8559 1 1 53 THR HG22 H -7.374 -12.676 -5.871 1.00 . A A . 53 THR HG22 1 1 12 8560 1 1 53 THR HG23 H -8.543 -13.965 -6.156 1.00 . A A . 53 THR HG23 1 1 12 8561 1 1 53 THR N N -7.803 -11.550 -2.630 1.00 . A A . 53 THR N 1 1 12 8562 1 1 53 THR O O -10.280 -10.287 -2.930 1.00 . A A . 53 THR O 1 1 12 8563 1 1 53 THR OG1 O -9.312 -13.591 -3.376 1.00 . A A . 53 THR OG1 1 1 12 8564 1 1 54 CYS C C -11.933 -9.030 -5.705 1.00 . A A . 54 CYS C 1 1 12 8565 1 1 54 CYS CA C -10.660 -8.527 -5.030 1.00 . A A . 54 CYS CA 1 1 12 8566 1 1 54 CYS CB C -10.115 -7.311 -5.777 1.00 . A A . 54 CYS CB 1 1 12 8567 1 1 54 CYS H H -9.009 -9.662 -5.703 1.00 . A A . 54 CYS H 1 1 12 8568 1 1 54 CYS HA H -10.899 -8.234 -4.019 1.00 . A A . 54 CYS HA 1 1 12 8569 1 1 54 CYS HB2 H -10.029 -7.551 -6.826 1.00 . A A . 54 CYS HB2 1 1 12 8570 1 1 54 CYS HB3 H -10.800 -6.485 -5.655 1.00 . A A . 54 CYS HB3 1 1 12 8571 1 1 54 CYS N N -9.639 -9.566 -4.960 1.00 . A A . 54 CYS N 1 1 12 8572 1 1 54 CYS O O -11.992 -9.166 -6.927 1.00 . A A . 54 CYS O 1 1 12 8573 1 1 54 CYS SG S -8.479 -6.768 -5.195 1.00 . A A . 54 CYS SG 1 1 12 8574 1 1 55 ILE C C -15.328 -8.732 -5.191 1.00 . A A . 55 ILE C 1 1 12 8575 1 1 55 ILE CA C -14.235 -9.775 -5.399 1.00 . A A . 55 ILE CA 1 1 12 8576 1 1 55 ILE CB C -14.661 -11.092 -4.715 1.00 . A A . 55 ILE CB 1 1 12 8577 1 1 55 ILE CD1 C -14.207 -12.550 -2.671 1.00 . A A . 55 ILE CD1 1 1 12 8578 1 1 55 ILE CG1 C -13.704 -11.440 -3.569 1.00 . A A . 55 ILE CG1 1 1 12 8579 1 1 55 ILE CG2 C -14.712 -12.222 -5.733 1.00 . A A . 55 ILE CG2 1 1 12 8580 1 1 55 ILE H H -12.838 -9.162 -3.930 1.00 . A A . 55 ILE H 1 1 12 8581 1 1 55 ILE HA H -14.126 -9.964 -6.457 1.00 . A A . 55 ILE HA 1 1 12 8582 1 1 55 ILE HB H -15.655 -10.958 -4.315 1.00 . A A . 55 ILE HB 1 1 12 8583 1 1 55 ILE HD11 H -14.891 -12.142 -1.942 1.00 . A A . 55 ILE HD11 1 1 12 8584 1 1 55 ILE HD12 H -13.370 -13.009 -2.163 1.00 . A A . 55 ILE HD12 1 1 12 8585 1 1 55 ILE HD13 H -14.716 -13.293 -3.267 1.00 . A A . 55 ILE HD13 1 1 12 8586 1 1 55 ILE HG12 H -12.757 -11.752 -3.982 1.00 . A A . 55 ILE HG12 1 1 12 8587 1 1 55 ILE HG13 H -13.552 -10.562 -2.958 1.00 . A A . 55 ILE HG13 1 1 12 8588 1 1 55 ILE HG21 H -15.655 -12.741 -5.646 1.00 . A A . 55 ILE HG21 1 1 12 8589 1 1 55 ILE HG22 H -13.903 -12.911 -5.547 1.00 . A A . 55 ILE HG22 1 1 12 8590 1 1 55 ILE HG23 H -14.616 -11.813 -6.728 1.00 . A A . 55 ILE HG23 1 1 12 8591 1 1 55 ILE N N -12.953 -9.296 -4.894 1.00 . A A . 55 ILE N 1 1 12 8592 1 1 55 ILE O O -15.210 -7.859 -4.331 1.00 . A A . 55 ILE O 1 1 12 8593 1 1 56 SER C C -18.530 -8.359 -4.864 1.00 . A A . 56 SER C 1 1 12 8594 1 1 56 SER CA C -17.504 -7.886 -5.889 1.00 . A A . 56 SER CA 1 1 12 8595 1 1 56 SER CB C -18.173 -7.712 -7.254 1.00 . A A . 56 SER CB 1 1 12 8596 1 1 56 SER H H -16.427 -9.542 -6.654 1.00 . A A . 56 SER H 1 1 12 8597 1 1 56 SER HA H -17.107 -6.935 -5.569 1.00 . A A . 56 SER HA 1 1 12 8598 1 1 56 SER HB2 H -17.957 -8.570 -7.872 1.00 . A A . 56 SER HB2 1 1 12 8599 1 1 56 SER HB3 H -19.241 -7.624 -7.120 1.00 . A A . 56 SER HB3 1 1 12 8600 1 1 56 SER HG H -17.512 -5.868 -7.256 1.00 . A A . 56 SER HG 1 1 12 8601 1 1 56 SER N N -16.391 -8.826 -5.985 1.00 . A A . 56 SER N 1 1 12 8602 1 1 56 SER O O -19.212 -7.497 -4.271 1.00 . A A . 56 SER O 1 1 12 8603 1 1 56 SER OXT O -18.645 -9.587 -4.666 1.00 . A A . 56 SER OXT 1 1 12 8604 1 1 56 SER OG O -17.697 -6.548 -7.907 1.00 . A A . 56 SER OG 1 1 13 8605 1 1 1 ASP C C 3.439 14.972 -2.598 1.00 . A A . 1 ASP C 1 1 13 8606 1 1 1 ASP CA C 4.460 14.995 -3.732 1.00 . A A . 1 ASP CA 1 1 13 8607 1 1 1 ASP CB C 5.838 14.582 -3.209 1.00 . A A . 1 ASP CB 1 1 13 8608 1 1 1 ASP CG C 6.501 15.677 -2.395 1.00 . A A . 1 ASP CG 1 1 13 8609 1 1 1 ASP H1 H 3.622 16.777 -4.420 1.00 . A A . 1 ASP H1 1 1 13 8610 1 1 1 ASP H2 H 4.995 16.289 -5.279 1.00 . A A . 1 ASP H2 1 1 13 8611 1 1 1 ASP H3 H 5.159 16.961 -3.735 1.00 . A A . 1 ASP H3 1 1 13 8612 1 1 1 ASP HA H 4.149 14.302 -4.499 1.00 . A A . 1 ASP HA 1 1 13 8613 1 1 1 ASP HB2 H 5.733 13.708 -2.585 1.00 . A A . 1 ASP HB2 1 1 13 8614 1 1 1 ASP HB3 H 6.477 14.345 -4.048 1.00 . A A . 1 ASP HB3 1 1 13 8615 1 1 1 ASP N N 4.566 16.350 -4.333 1.00 . A A . 1 ASP N 1 1 13 8616 1 1 1 ASP O O 3.003 16.021 -2.121 1.00 . A A . 1 ASP O 1 1 13 8617 1 1 1 ASP OD1 O 7.568 16.168 -2.819 1.00 . A A . 1 ASP OD1 1 1 13 8618 1 1 1 ASP OD2 O 5.953 16.042 -1.334 1.00 . A A . 1 ASP OD2 1 1 13 8619 1 1 2 VAL C C 2.669 12.807 0.058 1.00 . A A . 2 VAL C 1 1 13 8620 1 1 2 VAL CA C 2.086 13.609 -1.100 1.00 . A A . 2 VAL CA 1 1 13 8621 1 1 2 VAL CB C 0.808 12.906 -1.595 1.00 . A A . 2 VAL CB 1 1 13 8622 1 1 2 VAL CG1 C -0.356 13.192 -0.661 1.00 . A A . 2 VAL CG1 1 1 13 8623 1 1 2 VAL CG2 C 0.476 13.333 -3.017 1.00 . A A . 2 VAL CG2 1 1 13 8624 1 1 2 VAL H H 3.441 12.973 -2.597 1.00 . A A . 2 VAL H 1 1 13 8625 1 1 2 VAL HA H 1.815 14.593 -0.743 1.00 . A A . 2 VAL HA 1 1 13 8626 1 1 2 VAL HB H 0.986 11.840 -1.595 1.00 . A A . 2 VAL HB 1 1 13 8627 1 1 2 VAL HG11 H -1.135 12.462 -0.823 1.00 . A A . 2 VAL HG11 1 1 13 8628 1 1 2 VAL HG12 H -0.743 14.181 -0.859 1.00 . A A . 2 VAL HG12 1 1 13 8629 1 1 2 VAL HG13 H -0.019 13.136 0.364 1.00 . A A . 2 VAL HG13 1 1 13 8630 1 1 2 VAL HG21 H -0.576 13.569 -3.085 1.00 . A A . 2 VAL HG21 1 1 13 8631 1 1 2 VAL HG22 H 0.709 12.528 -3.698 1.00 . A A . 2 VAL HG22 1 1 13 8632 1 1 2 VAL HG23 H 1.059 14.205 -3.276 1.00 . A A . 2 VAL HG23 1 1 13 8633 1 1 2 VAL N N 3.059 13.770 -2.175 1.00 . A A . 2 VAL N 1 1 13 8634 1 1 2 VAL O O 3.266 11.750 -0.146 1.00 . A A . 2 VAL O 1 1 13 8635 1 1 3 GLN C C 1.929 11.691 3.030 1.00 . A A . 3 GLN C 1 1 13 8636 1 1 3 GLN CA C 2.987 12.632 2.463 1.00 . A A . 3 GLN CA 1 1 13 8637 1 1 3 GLN CB C 3.401 13.653 3.524 1.00 . A A . 3 GLN CB 1 1 13 8638 1 1 3 GLN CD C 5.272 13.673 5.223 1.00 . A A . 3 GLN CD 1 1 13 8639 1 1 3 GLN CG C 4.903 13.721 3.752 1.00 . A A . 3 GLN CG 1 1 13 8640 1 1 3 GLN H H 1.997 14.152 1.373 1.00 . A A . 3 GLN H 1 1 13 8641 1 1 3 GLN HA H 3.852 12.052 2.176 1.00 . A A . 3 GLN HA 1 1 13 8642 1 1 3 GLN HB2 H 3.061 14.631 3.217 1.00 . A A . 3 GLN HB2 1 1 13 8643 1 1 3 GLN HB3 H 2.927 13.394 4.459 1.00 . A A . 3 GLN HB3 1 1 13 8644 1 1 3 GLN HE21 H 7.128 13.127 4.764 1.00 . A A . 3 GLN HE21 1 1 13 8645 1 1 3 GLN HE22 H 6.789 13.289 6.450 1.00 . A A . 3 GLN HE22 1 1 13 8646 1 1 3 GLN HG2 H 5.369 12.885 3.252 1.00 . A A . 3 GLN HG2 1 1 13 8647 1 1 3 GLN HG3 H 5.276 14.644 3.333 1.00 . A A . 3 GLN HG3 1 1 13 8648 1 1 3 GLN N N 2.485 13.308 1.273 1.00 . A A . 3 GLN N 1 1 13 8649 1 1 3 GLN NE2 N 6.523 13.328 5.507 1.00 . A A . 3 GLN NE2 1 1 13 8650 1 1 3 GLN O O 0.810 12.110 3.327 1.00 . A A . 3 GLN O 1 1 13 8651 1 1 3 GLN OE1 O 4.444 13.943 6.093 1.00 . A A . 3 GLN OE1 1 1 13 8652 1 1 4 CYS C C 0.893 9.805 5.104 1.00 . A A . 4 CYS C 1 1 13 8653 1 1 4 CYS CA C 1.363 9.421 3.703 1.00 . A A . 4 CYS CA 1 1 13 8654 1 1 4 CYS CB C 2.023 8.040 3.724 1.00 . A A . 4 CYS CB 1 1 13 8655 1 1 4 CYS H H 3.193 10.145 2.916 1.00 . A A . 4 CYS H 1 1 13 8656 1 1 4 CYS HA H 0.505 9.389 3.047 1.00 . A A . 4 CYS HA 1 1 13 8657 1 1 4 CYS HB2 H 2.786 8.024 4.486 1.00 . A A . 4 CYS HB2 1 1 13 8658 1 1 4 CYS HB3 H 1.275 7.296 3.957 1.00 . A A . 4 CYS HB3 1 1 13 8659 1 1 4 CYS N N 2.287 10.418 3.173 1.00 . A A . 4 CYS N 1 1 13 8660 1 1 4 CYS O O -0.237 10.256 5.287 1.00 . A A . 4 CYS O 1 1 13 8661 1 1 4 CYS SG S 2.808 7.565 2.149 1.00 . A A . 4 CYS SG 1 1 13 8662 1 1 5 GLY C C 2.640 10.042 8.359 1.00 . A A . 5 GLY C 1 1 13 8663 1 1 5 GLY CA C 1.424 9.960 7.460 1.00 . A A . 5 GLY CA 1 1 13 8664 1 1 5 GLY H H 2.655 9.262 5.886 1.00 . A A . 5 GLY H 1 1 13 8665 1 1 5 GLY HA2 H 0.918 10.915 7.470 1.00 . A A . 5 GLY HA2 1 1 13 8666 1 1 5 GLY HA3 H 0.755 9.206 7.846 1.00 . A A . 5 GLY HA3 1 1 13 8667 1 1 5 GLY N N 1.769 9.626 6.090 1.00 . A A . 5 GLY N 1 1 13 8668 1 1 5 GLY O O 2.786 9.251 9.293 1.00 . A A . 5 GLY O 1 1 13 8669 1 1 6 GLY C C 5.681 9.993 8.699 1.00 . A A . 6 GLY C 1 1 13 8670 1 1 6 GLY CA C 4.724 11.156 8.869 1.00 . A A . 6 GLY CA 1 1 13 8671 1 1 6 GLY H H 3.354 11.591 7.313 1.00 . A A . 6 GLY H 1 1 13 8672 1 1 6 GLY HA2 H 5.222 12.067 8.569 1.00 . A A . 6 GLY HA2 1 1 13 8673 1 1 6 GLY HA3 H 4.448 11.234 9.909 1.00 . A A . 6 GLY HA3 1 1 13 8674 1 1 6 GLY N N 3.521 10.995 8.074 1.00 . A A . 6 GLY N 1 1 13 8675 1 1 6 GLY O O 6.009 9.304 9.666 1.00 . A A . 6 GLY O 1 1 13 8676 1 1 7 GLY C C 7.329 8.519 5.714 1.00 . A A . 7 GLY C 1 1 13 8677 1 1 7 GLY CA C 7.045 8.686 7.194 1.00 . A A . 7 GLY CA 1 1 13 8678 1 1 7 GLY H H 5.830 10.357 6.738 1.00 . A A . 7 GLY H 1 1 13 8679 1 1 7 GLY HA2 H 7.976 8.877 7.707 1.00 . A A . 7 GLY HA2 1 1 13 8680 1 1 7 GLY HA3 H 6.620 7.768 7.573 1.00 . A A . 7 GLY HA3 1 1 13 8681 1 1 7 GLY N N 6.127 9.774 7.467 1.00 . A A . 7 GLY N 1 1 13 8682 1 1 7 GLY O O 8.338 9.012 5.210 1.00 . A A . 7 GLY O 1 1 13 8683 1 1 8 PHE C C 5.950 8.667 2.755 1.00 . A A . 8 PHE C 1 1 13 8684 1 1 8 PHE CA C 6.612 7.575 3.588 1.00 . A A . 8 PHE CA 1 1 13 8685 1 1 8 PHE CB C 6.031 6.215 3.202 1.00 . A A . 8 PHE CB 1 1 13 8686 1 1 8 PHE CD1 C 7.039 4.732 4.959 1.00 . A A . 8 PHE CD1 1 1 13 8687 1 1 8 PHE CD2 C 7.526 4.274 2.669 1.00 . A A . 8 PHE CD2 1 1 13 8688 1 1 8 PHE CE1 C 7.820 3.659 5.343 1.00 . A A . 8 PHE CE1 1 1 13 8689 1 1 8 PHE CE2 C 8.309 3.200 3.048 1.00 . A A . 8 PHE CE2 1 1 13 8690 1 1 8 PHE CG C 6.883 5.051 3.619 1.00 . A A . 8 PHE CG 1 1 13 8691 1 1 8 PHE CZ C 8.456 2.893 4.387 1.00 . A A . 8 PHE CZ 1 1 13 8692 1 1 8 PHE H H 5.660 7.435 5.475 1.00 . A A . 8 PHE H 1 1 13 8693 1 1 8 PHE HA H 7.672 7.574 3.377 1.00 . A A . 8 PHE HA 1 1 13 8694 1 1 8 PHE HB2 H 5.064 6.100 3.666 1.00 . A A . 8 PHE HB2 1 1 13 8695 1 1 8 PHE HB3 H 5.915 6.174 2.129 1.00 . A A . 8 PHE HB3 1 1 13 8696 1 1 8 PHE HD1 H 6.541 5.332 5.707 1.00 . A A . 8 PHE HD1 1 1 13 8697 1 1 8 PHE HD2 H 7.412 4.514 1.623 1.00 . A A . 8 PHE HD2 1 1 13 8698 1 1 8 PHE HE1 H 7.933 3.421 6.390 1.00 . A A . 8 PHE HE1 1 1 13 8699 1 1 8 PHE HE2 H 8.806 2.602 2.298 1.00 . A A . 8 PHE HE2 1 1 13 8700 1 1 8 PHE HZ H 9.067 2.053 4.684 1.00 . A A . 8 PHE HZ 1 1 13 8701 1 1 8 PHE N N 6.442 7.813 5.016 1.00 . A A . 8 PHE N 1 1 13 8702 1 1 8 PHE O O 5.273 9.549 3.285 1.00 . A A . 8 PHE O 1 1 13 8703 1 1 9 SER C C 5.204 8.843 -0.793 1.00 . A A . 9 SER C 1 1 13 8704 1 1 9 SER CA C 5.572 9.544 0.509 1.00 . A A . 9 SER CA 1 1 13 8705 1 1 9 SER CB C 6.558 10.682 0.236 1.00 . A A . 9 SER CB 1 1 13 8706 1 1 9 SER H H 6.690 7.849 1.093 1.00 . A A . 9 SER H 1 1 13 8707 1 1 9 SER HA H 4.676 9.951 0.955 1.00 . A A . 9 SER HA 1 1 13 8708 1 1 9 SER HB2 H 6.919 10.605 -0.779 1.00 . A A . 9 SER HB2 1 1 13 8709 1 1 9 SER HB3 H 6.057 11.628 0.369 1.00 . A A . 9 SER HB3 1 1 13 8710 1 1 9 SER HG H 8.179 9.832 0.935 1.00 . A A . 9 SER HG 1 1 13 8711 1 1 9 SER N N 6.146 8.585 1.444 1.00 . A A . 9 SER N 1 1 13 8712 1 1 9 SER O O 5.756 7.791 -1.114 1.00 . A A . 9 SER O 1 1 13 8713 1 1 9 SER OG O 7.664 10.620 1.118 1.00 . A A . 9 SER OG 1 1 13 8714 1 1 10 CYS C C 3.491 9.870 -3.844 1.00 . A A . 10 CYS C 1 1 13 8715 1 1 10 CYS CA C 3.833 8.818 -2.794 1.00 . A A . 10 CYS CA 1 1 13 8716 1 1 10 CYS CB C 2.619 7.915 -2.559 1.00 . A A . 10 CYS CB 1 1 13 8717 1 1 10 CYS H H 3.848 10.249 -1.233 1.00 . A A . 10 CYS H 1 1 13 8718 1 1 10 CYS HA H 4.646 8.212 -3.164 1.00 . A A . 10 CYS HA 1 1 13 8719 1 1 10 CYS HB2 H 2.005 8.346 -1.782 1.00 . A A . 10 CYS HB2 1 1 13 8720 1 1 10 CYS HB3 H 2.044 7.853 -3.472 1.00 . A A . 10 CYS HB3 1 1 13 8721 1 1 10 CYS N N 4.264 9.417 -1.538 1.00 . A A . 10 CYS N 1 1 13 8722 1 1 10 CYS O O 3.609 11.072 -3.611 1.00 . A A . 10 CYS O 1 1 13 8723 1 1 10 CYS SG S 3.042 6.217 -2.052 1.00 . A A . 10 CYS SG 1 1 13 8724 1 1 11 HIS C C 1.326 10.784 -5.989 1.00 . A A . 11 HIS C 1 1 13 8725 1 1 11 HIS CA C 2.744 10.244 -6.132 1.00 . A A . 11 HIS CA 1 1 13 8726 1 1 11 HIS CB C 2.886 9.482 -7.450 1.00 . A A . 11 HIS CB 1 1 13 8727 1 1 11 HIS CD2 C 5.380 10.123 -7.774 1.00 . A A . 11 HIS CD2 1 1 13 8728 1 1 11 HIS CE1 C 5.406 10.212 -9.964 1.00 . A A . 11 HIS CE1 1 1 13 8729 1 1 11 HIS CG C 4.131 9.825 -8.209 1.00 . A A . 11 HIS CG 1 1 13 8730 1 1 11 HIS H H 3.062 8.406 -5.103 1.00 . A A . 11 HIS H 1 1 13 8731 1 1 11 HIS HA H 3.432 11.075 -6.132 1.00 . A A . 11 HIS HA 1 1 13 8732 1 1 11 HIS HB2 H 2.903 8.423 -7.245 1.00 . A A . 11 HIS HB2 1 1 13 8733 1 1 11 HIS HB3 H 2.039 9.708 -8.081 1.00 . A A . 11 HIS HB3 1 1 13 8734 1 1 11 HIS HD1 H 3.432 9.722 -10.194 1.00 . A A . 11 HIS HD1 1 1 13 8735 1 1 11 HIS HD2 H 5.708 10.167 -6.745 1.00 . A A . 11 HIS HD2 1 1 13 8736 1 1 11 HIS HE1 H 5.740 10.337 -10.984 1.00 . A A . 11 HIS HE1 1 1 13 8737 1 1 11 HIS HE2 H 7.088 10.647 -8.879 1.00 . A A . 11 HIS HE2 1 1 13 8738 1 1 11 HIS N N 3.088 9.380 -5.009 1.00 . A A . 11 HIS N 1 1 13 8739 1 1 11 HIS ND1 N 4.182 9.889 -9.585 1.00 . A A . 11 HIS ND1 1 1 13 8740 1 1 11 HIS NE2 N 6.151 10.360 -8.885 1.00 . A A . 11 HIS NE2 1 1 13 8741 1 1 11 HIS O O 0.451 10.131 -5.408 1.00 . A A . 11 HIS O 1 1 13 8742 1 1 12 ASP C C -1.201 11.992 -7.359 1.00 . A A . 12 ASP C 1 1 13 8743 1 1 12 ASP CA C -0.181 12.654 -6.442 1.00 . A A . 12 ASP CA 1 1 13 8744 1 1 12 ASP CB C -0.036 14.134 -6.804 1.00 . A A . 12 ASP CB 1 1 13 8745 1 1 12 ASP CG C 0.407 14.339 -8.240 1.00 . A A . 12 ASP CG 1 1 13 8746 1 1 12 ASP H H 1.857 12.462 -6.949 1.00 . A A . 12 ASP H 1 1 13 8747 1 1 12 ASP HA H -0.533 12.580 -5.423 1.00 . A A . 12 ASP HA 1 1 13 8748 1 1 12 ASP HB2 H -0.988 14.627 -6.669 1.00 . A A . 12 ASP HB2 1 1 13 8749 1 1 12 ASP HB3 H 0.695 14.589 -6.152 1.00 . A A . 12 ASP HB3 1 1 13 8750 1 1 12 ASP N N 1.116 11.992 -6.512 1.00 . A A . 12 ASP N 1 1 13 8751 1 1 12 ASP O O -1.990 12.670 -8.019 1.00 . A A . 12 ASP O 1 1 13 8752 1 1 12 ASP OD1 O -0.254 15.115 -8.960 1.00 . A A . 12 ASP OD1 1 1 13 8753 1 1 12 ASP OD2 O 1.417 13.725 -8.642 1.00 . A A . 12 ASP OD2 1 1 13 8754 1 1 13 GLY C C -2.244 8.517 -7.582 1.00 . A A . 13 GLY C 1 1 13 8755 1 1 13 GLY CA C -2.132 9.908 -8.173 1.00 . A A . 13 GLY CA 1 1 13 8756 1 1 13 GLY H H -0.585 10.152 -6.824 1.00 . A A . 13 GLY H 1 1 13 8757 1 1 13 GLY HA2 H -3.100 10.390 -8.161 1.00 . A A . 13 GLY HA2 1 1 13 8758 1 1 13 GLY HA3 H -1.771 9.838 -9.187 1.00 . A A . 13 GLY HA3 1 1 13 8759 1 1 13 GLY N N -1.202 10.668 -7.375 1.00 . A A . 13 GLY N 1 1 13 8760 1 1 13 GLY O O -2.712 7.577 -8.225 1.00 . A A . 13 GLY O 1 1 13 8761 1 1 14 GLU C C -2.386 7.392 -4.178 1.00 . A A . 14 GLU C 1 1 13 8762 1 1 14 GLU CA C -1.814 7.167 -5.575 1.00 . A A . 14 GLU CA 1 1 13 8763 1 1 14 GLU CB C -0.399 6.587 -5.458 1.00 . A A . 14 GLU CB 1 1 13 8764 1 1 14 GLU CD C 1.114 6.068 -7.417 1.00 . A A . 14 GLU CD 1 1 13 8765 1 1 14 GLU CG C 0.584 7.137 -6.480 1.00 . A A . 14 GLU CG 1 1 13 8766 1 1 14 GLU H H -1.449 9.234 -5.897 1.00 . A A . 14 GLU H 1 1 13 8767 1 1 14 GLU HA H -2.442 6.466 -6.104 1.00 . A A . 14 GLU HA 1 1 13 8768 1 1 14 GLU HB2 H -0.016 6.805 -4.473 1.00 . A A . 14 GLU HB2 1 1 13 8769 1 1 14 GLU HB3 H -0.452 5.516 -5.583 1.00 . A A . 14 GLU HB3 1 1 13 8770 1 1 14 GLU HG2 H 0.089 7.895 -7.067 1.00 . A A . 14 GLU HG2 1 1 13 8771 1 1 14 GLU HG3 H 1.418 7.578 -5.954 1.00 . A A . 14 GLU HG3 1 1 13 8772 1 1 14 GLU N N -1.795 8.419 -6.327 1.00 . A A . 14 GLU N 1 1 13 8773 1 1 14 GLU O O -2.800 8.500 -3.840 1.00 . A A . 14 GLU O 1 1 13 8774 1 1 14 GLU OE1 O 1.037 4.873 -7.060 1.00 . A A . 14 GLU OE1 1 1 13 8775 1 1 14 GLU OE2 O 1.606 6.427 -8.507 1.00 . A A . 14 GLU OE2 1 1 13 8776 1 1 15 THR C C -2.008 5.615 -1.060 1.00 . A A . 15 THR C 1 1 13 8777 1 1 15 THR CA C -2.901 6.419 -2.001 1.00 . A A . 15 THR CA 1 1 13 8778 1 1 15 THR CB C -4.352 5.902 -1.900 1.00 . A A . 15 THR CB 1 1 13 8779 1 1 15 THR CG2 C -4.853 5.964 -0.463 1.00 . A A . 15 THR CG2 1 1 13 8780 1 1 15 THR H H -2.047 5.478 -3.678 1.00 . A A . 15 THR H 1 1 13 8781 1 1 15 THR HA H -2.885 7.457 -1.699 1.00 . A A . 15 THR HA 1 1 13 8782 1 1 15 THR HB H -4.381 4.871 -2.232 1.00 . A A . 15 THR HB 1 1 13 8783 1 1 15 THR HG1 H -4.702 7.400 -3.136 1.00 . A A . 15 THR HG1 1 1 13 8784 1 1 15 THR HG21 H -5.926 5.835 -0.450 1.00 . A A . 15 THR HG21 1 1 13 8785 1 1 15 THR HG22 H -4.600 6.923 -0.036 1.00 . A A . 15 THR HG22 1 1 13 8786 1 1 15 THR HG23 H -4.388 5.178 0.113 1.00 . A A . 15 THR HG23 1 1 13 8787 1 1 15 THR N N -2.395 6.337 -3.365 1.00 . A A . 15 THR N 1 1 13 8788 1 1 15 THR O O -1.596 4.502 -1.386 1.00 . A A . 15 THR O 1 1 13 8789 1 1 15 THR OG1 O -5.208 6.688 -2.739 1.00 . A A . 15 THR OG1 1 1 13 8790 1 1 16 CYS C C -1.692 4.683 2.055 1.00 . A A . 16 CYS C 1 1 13 8791 1 1 16 CYS CA C -0.860 5.515 1.084 1.00 . A A . 16 CYS CA 1 1 13 8792 1 1 16 CYS CB C -0.036 6.545 1.857 1.00 . A A . 16 CYS CB 1 1 13 8793 1 1 16 CYS H H -2.068 7.071 0.311 1.00 . A A . 16 CYS H 1 1 13 8794 1 1 16 CYS HA H -0.189 4.859 0.550 1.00 . A A . 16 CYS HA 1 1 13 8795 1 1 16 CYS HB2 H -0.696 7.308 2.240 1.00 . A A . 16 CYS HB2 1 1 13 8796 1 1 16 CYS HB3 H 0.455 6.054 2.684 1.00 . A A . 16 CYS HB3 1 1 13 8797 1 1 16 CYS N N -1.708 6.183 0.103 1.00 . A A . 16 CYS N 1 1 13 8798 1 1 16 CYS O O -2.643 5.185 2.655 1.00 . A A . 16 CYS O 1 1 13 8799 1 1 16 CYS SG S 1.247 7.373 0.863 1.00 . A A . 16 CYS SG 1 1 13 8800 1 1 17 CYS C C -1.099 1.953 4.173 1.00 . A A . 17 CYS C 1 1 13 8801 1 1 17 CYS CA C -2.045 2.515 3.112 1.00 . A A . 17 CYS CA 1 1 13 8802 1 1 17 CYS CB C -2.705 1.380 2.324 1.00 . A A . 17 CYS CB 1 1 13 8803 1 1 17 CYS H H -0.566 3.062 1.707 1.00 . A A . 17 CYS H 1 1 13 8804 1 1 17 CYS HA H -2.814 3.088 3.609 1.00 . A A . 17 CYS HA 1 1 13 8805 1 1 17 CYS HB2 H -3.665 1.160 2.764 1.00 . A A . 17 CYS HB2 1 1 13 8806 1 1 17 CYS HB3 H -2.849 1.703 1.303 1.00 . A A . 17 CYS HB3 1 1 13 8807 1 1 17 CYS N N -1.330 3.412 2.209 1.00 . A A . 17 CYS N 1 1 13 8808 1 1 17 CYS O O 0.041 1.596 3.874 1.00 . A A . 17 CYS O 1 1 13 8809 1 1 17 CYS SG S -1.748 -0.171 2.284 1.00 . A A . 17 CYS SG 1 1 13 8810 1 1 18 PRO C C -0.756 -0.145 6.642 1.00 . A A . 18 PRO C 1 1 13 8811 1 1 18 PRO CA C -0.747 1.380 6.545 1.00 . A A . 18 PRO CA 1 1 13 8812 1 1 18 PRO CB C -1.427 2.005 7.760 1.00 . A A . 18 PRO CB 1 1 13 8813 1 1 18 PRO CD C -2.899 2.304 5.881 1.00 . A A . 18 PRO CD 1 1 13 8814 1 1 18 PRO CG C -2.866 2.104 7.376 1.00 . A A . 18 PRO CG 1 1 13 8815 1 1 18 PRO HA H 0.274 1.730 6.481 1.00 . A A . 18 PRO HA 1 1 13 8816 1 1 18 PRO HB2 H -1.289 1.368 8.623 1.00 . A A . 18 PRO HB2 1 1 13 8817 1 1 18 PRO HB3 H -1.004 2.980 7.952 1.00 . A A . 18 PRO HB3 1 1 13 8818 1 1 18 PRO HD2 H -3.662 1.684 5.433 1.00 . A A . 18 PRO HD2 1 1 13 8819 1 1 18 PRO HD3 H -3.074 3.341 5.643 1.00 . A A . 18 PRO HD3 1 1 13 8820 1 1 18 PRO HG2 H -3.379 1.191 7.643 1.00 . A A . 18 PRO HG2 1 1 13 8821 1 1 18 PRO HG3 H -3.320 2.947 7.876 1.00 . A A . 18 PRO HG3 1 1 13 8822 1 1 18 PRO N N -1.556 1.883 5.435 1.00 . A A . 18 PRO N 1 1 13 8823 1 1 18 PRO O O -1.748 -0.747 7.052 1.00 . A A . 18 PRO O 1 1 13 8824 1 1 19 THR C C 0.884 -2.711 7.678 1.00 . A A . 19 THR C 1 1 13 8825 1 1 19 THR CA C 0.486 -2.215 6.290 1.00 . A A . 19 THR CA 1 1 13 8826 1 1 19 THR CB C 1.520 -2.727 5.262 1.00 . A A . 19 THR CB 1 1 13 8827 1 1 19 THR CG2 C 1.866 -1.652 4.243 1.00 . A A . 19 THR CG2 1 1 13 8828 1 1 19 THR H H 1.108 -0.217 5.933 1.00 . A A . 19 THR H 1 1 13 8829 1 1 19 THR HA H -0.476 -2.635 6.036 1.00 . A A . 19 THR HA 1 1 13 8830 1 1 19 THR HB H 1.092 -3.571 4.740 1.00 . A A . 19 THR HB 1 1 13 8831 1 1 19 THR HG1 H 3.477 -2.936 5.395 1.00 . A A . 19 THR HG1 1 1 13 8832 1 1 19 THR HG21 H 1.915 -0.691 4.734 1.00 . A A . 19 THR HG21 1 1 13 8833 1 1 19 THR HG22 H 1.107 -1.624 3.475 1.00 . A A . 19 THR HG22 1 1 13 8834 1 1 19 THR HG23 H 2.823 -1.875 3.794 1.00 . A A . 19 THR HG23 1 1 13 8835 1 1 19 THR N N 0.359 -0.760 6.256 1.00 . A A . 19 THR N 1 1 13 8836 1 1 19 THR O O 0.792 -3.905 7.968 1.00 . A A . 19 THR O 1 1 13 8837 1 1 19 THR OG1 O 2.712 -3.152 5.934 1.00 . A A . 19 THR OG1 1 1 13 8838 1 1 20 SER C C 1.499 -0.985 10.857 1.00 . A A . 20 SER C 1 1 13 8839 1 1 20 SER CA C 1.721 -2.150 9.893 1.00 . A A . 20 SER CA 1 1 13 8840 1 1 20 SER CB C 3.187 -2.590 9.919 1.00 . A A . 20 SER CB 1 1 13 8841 1 1 20 SER H H 1.361 -0.855 8.255 1.00 . A A . 20 SER H 1 1 13 8842 1 1 20 SER HA H 1.104 -2.979 10.209 1.00 . A A . 20 SER HA 1 1 13 8843 1 1 20 SER HB2 H 3.717 -2.119 9.105 1.00 . A A . 20 SER HB2 1 1 13 8844 1 1 20 SER HB3 H 3.633 -2.294 10.858 1.00 . A A . 20 SER HB3 1 1 13 8845 1 1 20 SER HG H 2.640 -4.425 10.335 1.00 . A A . 20 SER HG 1 1 13 8846 1 1 20 SER N N 1.319 -1.794 8.536 1.00 . A A . 20 SER N 1 1 13 8847 1 1 20 SER O O 0.399 -0.797 11.376 1.00 . A A . 20 SER O 1 1 13 8848 1 1 20 SER OG O 3.300 -3.996 9.784 1.00 . A A . 20 SER OG 1 1 13 8849 1 1 21 GLN C C 3.584 1.939 11.675 1.00 . A A . 21 GLN C 1 1 13 8850 1 1 21 GLN CA C 2.477 0.938 11.990 1.00 . A A . 21 GLN CA 1 1 13 8851 1 1 21 GLN CB C 2.585 0.480 13.446 1.00 . A A . 21 GLN CB 1 1 13 8852 1 1 21 GLN CD C 3.628 -1.346 14.845 1.00 . A A . 21 GLN CD 1 1 13 8853 1 1 21 GLN CG C 3.838 -0.329 13.740 1.00 . A A . 21 GLN CG 1 1 13 8854 1 1 21 GLN H H 3.403 -0.407 10.647 1.00 . A A . 21 GLN H 1 1 13 8855 1 1 21 GLN HA H 1.521 1.417 11.840 1.00 . A A . 21 GLN HA 1 1 13 8856 1 1 21 GLN HB2 H 2.587 1.351 14.086 1.00 . A A . 21 GLN HB2 1 1 13 8857 1 1 21 GLN HB3 H 1.726 -0.128 13.683 1.00 . A A . 21 GLN HB3 1 1 13 8858 1 1 21 GLN HE21 H 4.313 -0.056 16.196 1.00 . A A . 21 GLN HE21 1 1 13 8859 1 1 21 GLN HE22 H 3.830 -1.597 16.808 1.00 . A A . 21 GLN HE22 1 1 13 8860 1 1 21 GLN HG2 H 4.132 -0.853 12.841 1.00 . A A . 21 GLN HG2 1 1 13 8861 1 1 21 GLN HG3 H 4.628 0.346 14.036 1.00 . A A . 21 GLN HG3 1 1 13 8862 1 1 21 GLN N N 2.552 -0.207 11.091 1.00 . A A . 21 GLN N 1 1 13 8863 1 1 21 GLN NE2 N 3.958 -0.961 16.073 1.00 . A A . 21 GLN NE2 1 1 13 8864 1 1 21 GLN O O 3.495 3.115 12.027 1.00 . A A . 21 GLN O 1 1 13 8865 1 1 21 GLN OE1 O 3.175 -2.464 14.600 1.00 . A A . 21 GLN OE1 1 1 13 8866 1 1 22 THR C C 6.025 2.185 9.129 1.00 . A A . 22 THR C 1 1 13 8867 1 1 22 THR CA C 5.752 2.299 10.623 1.00 . A A . 22 THR CA 1 1 13 8868 1 1 22 THR CB C 7.027 1.920 11.401 1.00 . A A . 22 THR CB 1 1 13 8869 1 1 22 THR CG2 C 6.754 1.875 12.896 1.00 . A A . 22 THR CG2 1 1 13 8870 1 1 22 THR H H 4.629 0.513 10.746 1.00 . A A . 22 THR H 1 1 13 8871 1 1 22 THR HA H 5.501 3.323 10.858 1.00 . A A . 22 THR HA 1 1 13 8872 1 1 22 THR HB H 7.784 2.668 11.210 1.00 . A A . 22 THR HB 1 1 13 8873 1 1 22 THR HG1 H 7.807 0.711 10.050 1.00 . A A . 22 THR HG1 1 1 13 8874 1 1 22 THR HG21 H 7.669 1.644 13.423 1.00 . A A . 22 THR HG21 1 1 13 8875 1 1 22 THR HG22 H 6.017 1.114 13.106 1.00 . A A . 22 THR HG22 1 1 13 8876 1 1 22 THR HG23 H 6.383 2.835 13.225 1.00 . A A . 22 THR HG23 1 1 13 8877 1 1 22 THR N N 4.624 1.459 11.002 1.00 . A A . 22 THR N 1 1 13 8878 1 1 22 THR O O 6.889 2.876 8.587 1.00 . A A . 22 THR O 1 1 13 8879 1 1 22 THR OG1 O 7.510 0.645 10.960 1.00 . A A . 22 THR OG1 1 1 13 8880 1 1 23 THR C C 4.246 1.739 6.284 1.00 . A A . 23 THR C 1 1 13 8881 1 1 23 THR CA C 5.411 1.104 7.032 1.00 . A A . 23 THR CA 1 1 13 8882 1 1 23 THR CB C 5.480 -0.394 6.681 1.00 . A A . 23 THR CB 1 1 13 8883 1 1 23 THR CG2 C 6.449 -0.634 5.533 1.00 . A A . 23 THR CG2 1 1 13 8884 1 1 23 THR H H 4.593 0.801 8.957 1.00 . A A . 23 THR H 1 1 13 8885 1 1 23 THR HA H 6.331 1.574 6.714 1.00 . A A . 23 THR HA 1 1 13 8886 1 1 23 THR HB H 4.497 -0.723 6.377 1.00 . A A . 23 THR HB 1 1 13 8887 1 1 23 THR HG1 H 5.382 -1.960 7.877 1.00 . A A . 23 THR HG1 1 1 13 8888 1 1 23 THR HG21 H 5.926 -0.534 4.594 1.00 . A A . 23 THR HG21 1 1 13 8889 1 1 23 THR HG22 H 6.861 -1.629 5.612 1.00 . A A . 23 THR HG22 1 1 13 8890 1 1 23 THR HG23 H 7.248 0.091 5.580 1.00 . A A . 23 THR HG23 1 1 13 8891 1 1 23 THR N N 5.270 1.311 8.468 1.00 . A A . 23 THR N 1 1 13 8892 1 1 23 THR O O 3.182 1.969 6.861 1.00 . A A . 23 THR O 1 1 13 8893 1 1 23 THR OG1 O 5.893 -1.149 7.827 1.00 . A A . 23 THR OG1 1 1 13 8894 1 1 24 TRP C C 3.482 2.204 2.740 1.00 . A A . 24 TRP C 1 1 13 8895 1 1 24 TRP CA C 3.405 2.652 4.198 1.00 . A A . 24 TRP CA 1 1 13 8896 1 1 24 TRP CB C 3.521 4.174 4.284 1.00 . A A . 24 TRP CB 1 1 13 8897 1 1 24 TRP CD1 C 3.406 5.137 6.659 1.00 . A A . 24 TRP CD1 1 1 13 8898 1 1 24 TRP CD2 C 1.431 4.984 5.622 1.00 . A A . 24 TRP CD2 1 1 13 8899 1 1 24 TRP CE2 C 1.220 5.518 6.906 1.00 . A A . 24 TRP CE2 1 1 13 8900 1 1 24 TRP CE3 C 0.334 4.796 4.781 1.00 . A A . 24 TRP CE3 1 1 13 8901 1 1 24 TRP CG C 2.831 4.747 5.482 1.00 . A A . 24 TRP CG 1 1 13 8902 1 1 24 TRP CH2 C -1.104 5.667 6.519 1.00 . A A . 24 TRP CH2 1 1 13 8903 1 1 24 TRP CZ2 C -0.047 5.864 7.368 1.00 . A A . 24 TRP CZ2 1 1 13 8904 1 1 24 TRP CZ3 C -0.921 5.139 5.238 1.00 . A A . 24 TRP CZ3 1 1 13 8905 1 1 24 TRP H H 5.318 1.834 4.597 1.00 . A A . 24 TRP H 1 1 13 8906 1 1 24 TRP HA H 2.450 2.352 4.605 1.00 . A A . 24 TRP HA 1 1 13 8907 1 1 24 TRP HB2 H 4.564 4.448 4.336 1.00 . A A . 24 TRP HB2 1 1 13 8908 1 1 24 TRP HB3 H 3.081 4.614 3.401 1.00 . A A . 24 TRP HB3 1 1 13 8909 1 1 24 TRP HD1 H 4.464 5.080 6.867 1.00 . A A . 24 TRP HD1 1 1 13 8910 1 1 24 TRP HE1 H 2.603 5.937 8.428 1.00 . A A . 24 TRP HE1 1 1 13 8911 1 1 24 TRP HE3 H 0.458 4.391 3.788 1.00 . A A . 24 TRP HE3 1 1 13 8912 1 1 24 TRP HH2 H -2.104 5.917 6.834 1.00 . A A . 24 TRP HH2 1 1 13 8913 1 1 24 TRP HZ2 H -0.205 6.273 8.354 1.00 . A A . 24 TRP HZ2 1 1 13 8914 1 1 24 TRP HZ3 H -1.783 4.999 4.601 1.00 . A A . 24 TRP HZ3 1 1 13 8915 1 1 24 TRP N N 4.448 2.032 5.004 1.00 . A A . 24 TRP N 1 1 13 8916 1 1 24 TRP NE1 N 2.442 5.601 7.522 1.00 . A A . 24 TRP NE1 1 1 13 8917 1 1 24 TRP O O 4.422 2.548 2.023 1.00 . A A . 24 TRP O 1 1 13 8918 1 1 25 GLY C C 1.807 1.940 -0.013 1.00 . A A . 25 GLY C 1 1 13 8919 1 1 25 GLY CA C 2.450 0.950 0.942 1.00 . A A . 25 GLY CA 1 1 13 8920 1 1 25 GLY H H 1.764 1.194 2.930 1.00 . A A . 25 GLY H 1 1 13 8921 1 1 25 GLY HA2 H 3.462 0.759 0.615 1.00 . A A . 25 GLY HA2 1 1 13 8922 1 1 25 GLY HA3 H 1.893 0.025 0.913 1.00 . A A . 25 GLY HA3 1 1 13 8923 1 1 25 GLY N N 2.483 1.435 2.310 1.00 . A A . 25 GLY N 1 1 13 8924 1 1 25 GLY O O 0.914 2.696 0.375 1.00 . A A . 25 GLY O 1 1 13 8925 1 1 26 CYS C C 0.720 2.130 -3.171 1.00 . A A . 26 CYS C 1 1 13 8926 1 1 26 CYS CA C 1.738 2.838 -2.282 1.00 . A A . 26 CYS CA 1 1 13 8927 1 1 26 CYS CB C 2.879 3.391 -3.138 1.00 . A A . 26 CYS CB 1 1 13 8928 1 1 26 CYS H H 2.980 1.308 -1.505 1.00 . A A . 26 CYS H 1 1 13 8929 1 1 26 CYS HA H 1.250 3.658 -1.777 1.00 . A A . 26 CYS HA 1 1 13 8930 1 1 26 CYS HB2 H 3.793 3.366 -2.563 1.00 . A A . 26 CYS HB2 1 1 13 8931 1 1 26 CYS HB3 H 2.994 2.771 -4.014 1.00 . A A . 26 CYS HB3 1 1 13 8932 1 1 26 CYS N N 2.266 1.935 -1.262 1.00 . A A . 26 CYS N 1 1 13 8933 1 1 26 CYS O O 0.981 1.042 -3.687 1.00 . A A . 26 CYS O 1 1 13 8934 1 1 26 CYS SG S 2.626 5.105 -3.698 1.00 . A A . 26 CYS SG 1 1 13 8935 1 1 27 CYS C C -1.900 3.087 -5.306 1.00 . A A . 27 CYS C 1 1 13 8936 1 1 27 CYS CA C -1.513 2.170 -4.147 1.00 . A A . 27 CYS CA 1 1 13 8937 1 1 27 CYS CB C -2.736 1.903 -3.274 1.00 . A A . 27 CYS CB 1 1 13 8938 1 1 27 CYS H H -0.599 3.605 -2.884 1.00 . A A . 27 CYS H 1 1 13 8939 1 1 27 CYS HA H -1.158 1.233 -4.546 1.00 . A A . 27 CYS HA 1 1 13 8940 1 1 27 CYS HB2 H -2.779 2.647 -2.493 1.00 . A A . 27 CYS HB2 1 1 13 8941 1 1 27 CYS HB3 H -3.626 1.974 -3.882 1.00 . A A . 27 CYS HB3 1 1 13 8942 1 1 27 CYS N N -0.447 2.747 -3.334 1.00 . A A . 27 CYS N 1 1 13 8943 1 1 27 CYS O O -2.212 4.256 -5.099 1.00 . A A . 27 CYS O 1 1 13 8944 1 1 27 CYS SG S -2.730 0.267 -2.481 1.00 . A A . 27 CYS SG 1 1 13 8945 1 1 28 PRO C C -3.771 3.494 -7.895 1.00 . A A . 28 PRO C 1 1 13 8946 1 1 28 PRO CA C -2.259 3.350 -7.730 1.00 . A A . 28 PRO CA 1 1 13 8947 1 1 28 PRO CB C -1.669 2.530 -8.875 1.00 . A A . 28 PRO CB 1 1 13 8948 1 1 28 PRO CD C -1.549 1.174 -6.897 1.00 . A A . 28 PRO CD 1 1 13 8949 1 1 28 PRO CG C -1.727 1.121 -8.394 1.00 . A A . 28 PRO CG 1 1 13 8950 1 1 28 PRO HA H -1.803 4.329 -7.712 1.00 . A A . 28 PRO HA 1 1 13 8951 1 1 28 PRO HB2 H -2.263 2.671 -9.767 1.00 . A A . 28 PRO HB2 1 1 13 8952 1 1 28 PRO HB3 H -0.652 2.842 -9.060 1.00 . A A . 28 PRO HB3 1 1 13 8953 1 1 28 PRO HD2 H -2.220 0.479 -6.415 1.00 . A A . 28 PRO HD2 1 1 13 8954 1 1 28 PRO HD3 H -0.525 0.955 -6.632 1.00 . A A . 28 PRO HD3 1 1 13 8955 1 1 28 PRO HG2 H -2.685 0.689 -8.642 1.00 . A A . 28 PRO HG2 1 1 13 8956 1 1 28 PRO HG3 H -0.930 0.548 -8.844 1.00 . A A . 28 PRO HG3 1 1 13 8957 1 1 28 PRO N N -1.897 2.566 -6.548 1.00 . A A . 28 PRO N 1 1 13 8958 1 1 28 PRO O O -4.286 3.495 -9.014 1.00 . A A . 28 PRO O 1 1 13 8959 1 1 29 SER C C -6.401 4.676 -5.661 1.00 . A A . 29 SER C 1 1 13 8960 1 1 29 SER CA C -5.931 3.760 -6.792 1.00 . A A . 29 SER CA 1 1 13 8961 1 1 29 SER CB C -6.598 2.388 -6.668 1.00 . A A . 29 SER CB 1 1 13 8962 1 1 29 SER H H -4.011 3.607 -5.912 1.00 . A A . 29 SER H 1 1 13 8963 1 1 29 SER HA H -6.208 4.201 -7.737 1.00 . A A . 29 SER HA 1 1 13 8964 1 1 29 SER HB2 H -6.665 2.115 -5.625 1.00 . A A . 29 SER HB2 1 1 13 8965 1 1 29 SER HB3 H -7.591 2.435 -7.091 1.00 . A A . 29 SER HB3 1 1 13 8966 1 1 29 SER HG H -6.405 0.618 -7.486 1.00 . A A . 29 SER HG 1 1 13 8967 1 1 29 SER N N -4.478 3.615 -6.773 1.00 . A A . 29 SER N 1 1 13 8968 1 1 29 SER O O -5.704 4.837 -4.659 1.00 . A A . 29 SER O 1 1 13 8969 1 1 29 SER OG O -5.855 1.393 -7.352 1.00 . A A . 29 SER OG 1 1 13 8970 1 1 30 PRO C C -8.379 5.486 -3.451 1.00 . A A . 30 PRO C 1 1 13 8971 1 1 30 PRO CA C -8.142 6.194 -4.785 1.00 . A A . 30 PRO CA 1 1 13 8972 1 1 30 PRO CB C -9.465 6.675 -5.393 1.00 . A A . 30 PRO CB 1 1 13 8973 1 1 30 PRO CD C -8.492 5.162 -6.965 1.00 . A A . 30 PRO CD 1 1 13 8974 1 1 30 PRO CG C -9.804 5.668 -6.438 1.00 . A A . 30 PRO CG 1 1 13 8975 1 1 30 PRO HA H -7.491 7.042 -4.623 1.00 . A A . 30 PRO HA 1 1 13 8976 1 1 30 PRO HB2 H -10.223 6.716 -4.625 1.00 . A A . 30 PRO HB2 1 1 13 8977 1 1 30 PRO HB3 H -9.330 7.656 -5.824 1.00 . A A . 30 PRO HB3 1 1 13 8978 1 1 30 PRO HD2 H -8.580 4.130 -7.272 1.00 . A A . 30 PRO HD2 1 1 13 8979 1 1 30 PRO HD3 H -8.152 5.775 -7.787 1.00 . A A . 30 PRO HD3 1 1 13 8980 1 1 30 PRO HG2 H -10.369 4.859 -5.998 1.00 . A A . 30 PRO HG2 1 1 13 8981 1 1 30 PRO HG3 H -10.370 6.134 -7.230 1.00 . A A . 30 PRO HG3 1 1 13 8982 1 1 30 PRO N N -7.592 5.292 -5.804 1.00 . A A . 30 PRO N 1 1 13 8983 1 1 30 PRO O O -7.447 5.306 -2.667 1.00 . A A . 30 PRO O 1 1 13 8984 1 1 31 LYS C C -9.158 3.095 -1.836 1.00 . A A . 31 LYS C 1 1 13 8985 1 1 31 LYS CA C -9.955 4.391 -1.953 1.00 . A A . 31 LYS CA 1 1 13 8986 1 1 31 LYS CB C -11.457 4.101 -1.892 1.00 . A A . 31 LYS CB 1 1 13 8987 1 1 31 LYS CD C -12.409 6.429 -1.846 1.00 . A A . 31 LYS CD 1 1 13 8988 1 1 31 LYS CE C -13.132 7.470 -1.009 1.00 . A A . 31 LYS CE 1 1 13 8989 1 1 31 LYS CG C -12.242 5.123 -1.086 1.00 . A A . 31 LYS CG 1 1 13 8990 1 1 31 LYS H H -10.327 5.246 -3.855 1.00 . A A . 31 LYS H 1 1 13 8991 1 1 31 LYS HA H -9.687 5.039 -1.132 1.00 . A A . 31 LYS HA 1 1 13 8992 1 1 31 LYS HB2 H -11.850 4.090 -2.899 1.00 . A A . 31 LYS HB2 1 1 13 8993 1 1 31 LYS HB3 H -11.606 3.130 -1.446 1.00 . A A . 31 LYS HB3 1 1 13 8994 1 1 31 LYS HD2 H -11.433 6.808 -2.110 1.00 . A A . 31 LYS HD2 1 1 13 8995 1 1 31 LYS HD3 H -12.979 6.241 -2.744 1.00 . A A . 31 LYS HD3 1 1 13 8996 1 1 31 LYS HE2 H -14.187 7.244 -1.006 1.00 . A A . 31 LYS HE2 1 1 13 8997 1 1 31 LYS HE3 H -12.753 7.428 0.003 1.00 . A A . 31 LYS HE3 1 1 13 8998 1 1 31 LYS HG2 H -13.221 4.719 -0.868 1.00 . A A . 31 LYS HG2 1 1 13 8999 1 1 31 LYS HG3 H -11.717 5.318 -0.162 1.00 . A A . 31 LYS HG3 1 1 13 9000 1 1 31 LYS HZ1 H -13.095 8.859 -2.569 1.00 . A A . 31 LYS HZ1 1 1 13 9001 1 1 31 LYS HZ2 H -11.966 9.171 -1.349 1.00 . A A . 31 LYS HZ2 1 1 13 9002 1 1 31 LYS HZ3 H -13.605 9.503 -1.089 1.00 . A A . 31 LYS HZ3 1 1 13 9003 1 1 31 LYS N N -9.621 5.082 -3.195 1.00 . A A . 31 LYS N 1 1 13 9004 1 1 31 LYS NZ N -12.936 8.847 -1.540 1.00 . A A . 31 LYS NZ 1 1 13 9005 1 1 31 LYS O O -8.092 3.068 -1.221 1.00 . A A . 31 LYS O 1 1 13 9006 1 1 32 ALA C C -8.907 0.155 -1.017 1.00 . A A . 32 ALA C 1 1 13 9007 1 1 32 ALA CA C -9.012 0.727 -2.430 1.00 . A A . 32 ALA CA 1 1 13 9008 1 1 32 ALA CB C -7.628 0.843 -3.056 1.00 . A A . 32 ALA CB 1 1 13 9009 1 1 32 ALA H H -10.523 2.122 -2.927 1.00 . A A . 32 ALA H 1 1 13 9010 1 1 32 ALA HA H -9.595 0.047 -3.041 1.00 . A A . 32 ALA HA 1 1 13 9011 1 1 32 ALA HB1 H -7.120 1.709 -2.650 1.00 . A A . 32 ALA HB1 1 1 13 9012 1 1 32 ALA HB2 H -7.724 0.951 -4.126 1.00 . A A . 32 ALA HB2 1 1 13 9013 1 1 32 ALA HB3 H -7.056 -0.045 -2.833 1.00 . A A . 32 ALA HB3 1 1 13 9014 1 1 32 ALA N N -9.677 2.028 -2.445 1.00 . A A . 32 ALA N 1 1 13 9015 1 1 32 ALA O O -8.718 0.891 -0.047 1.00 . A A . 32 ALA O 1 1 13 9016 1 1 33 VAL C C -7.498 -2.397 0.561 1.00 . A A . 33 VAL C 1 1 13 9017 1 1 33 VAL CA C -8.908 -1.849 0.375 1.00 . A A . 33 VAL CA 1 1 13 9018 1 1 33 VAL CB C -9.926 -3.000 0.491 1.00 . A A . 33 VAL CB 1 1 13 9019 1 1 33 VAL CG1 C -9.798 -3.697 1.837 1.00 . A A . 33 VAL CG1 1 1 13 9020 1 1 33 VAL CG2 C -11.340 -2.482 0.284 1.00 . A A . 33 VAL CG2 1 1 13 9021 1 1 33 VAL H H -9.146 -1.702 -1.719 1.00 . A A . 33 VAL H 1 1 13 9022 1 1 33 VAL HA H -9.113 -1.129 1.154 1.00 . A A . 33 VAL HA 1 1 13 9023 1 1 33 VAL HB H -9.713 -3.722 -0.284 1.00 . A A . 33 VAL HB 1 1 13 9024 1 1 33 VAL HG11 H -8.782 -4.037 1.971 1.00 . A A . 33 VAL HG11 1 1 13 9025 1 1 33 VAL HG12 H -10.469 -4.543 1.870 1.00 . A A . 33 VAL HG12 1 1 13 9026 1 1 33 VAL HG13 H -10.053 -3.005 2.626 1.00 . A A . 33 VAL HG13 1 1 13 9027 1 1 33 VAL HG21 H -11.794 -2.996 -0.550 1.00 . A A . 33 VAL HG21 1 1 13 9028 1 1 33 VAL HG22 H -11.308 -1.421 0.078 1.00 . A A . 33 VAL HG22 1 1 13 9029 1 1 33 VAL HG23 H -11.923 -2.658 1.175 1.00 . A A . 33 VAL HG23 1 1 13 9030 1 1 33 VAL N N -9.012 -1.168 -0.911 1.00 . A A . 33 VAL N 1 1 13 9031 1 1 33 VAL O O -7.122 -3.388 -0.067 1.00 . A A . 33 VAL O 1 1 13 9032 1 1 34 CYS C C -5.209 -3.486 2.302 1.00 . A A . 34 CYS C 1 1 13 9033 1 1 34 CYS CA C -5.333 -2.107 1.664 1.00 . A A . 34 CYS CA 1 1 13 9034 1 1 34 CYS CB C -4.651 -1.057 2.546 1.00 . A A . 34 CYS CB 1 1 13 9035 1 1 34 CYS H H -7.082 -0.931 1.853 1.00 . A A . 34 CYS H 1 1 13 9036 1 1 34 CYS HA H -4.825 -2.131 0.714 1.00 . A A . 34 CYS HA 1 1 13 9037 1 1 34 CYS HB2 H -4.546 -0.141 1.984 1.00 . A A . 34 CYS HB2 1 1 13 9038 1 1 34 CYS HB3 H -5.267 -0.870 3.415 1.00 . A A . 34 CYS HB3 1 1 13 9039 1 1 34 CYS N N -6.720 -1.725 1.406 1.00 . A A . 34 CYS N 1 1 13 9040 1 1 34 CYS O O -5.051 -3.603 3.518 1.00 . A A . 34 CYS O 1 1 13 9041 1 1 34 CYS SG S -2.992 -1.536 3.134 1.00 . A A . 34 CYS SG 1 1 13 9042 1 1 35 CYS C C -3.782 -6.047 2.695 1.00 . A A . 35 CYS C 1 1 13 9043 1 1 35 CYS CA C -5.116 -5.896 1.971 1.00 . A A . 35 CYS CA 1 1 13 9044 1 1 35 CYS CB C -5.217 -6.904 0.824 1.00 . A A . 35 CYS CB 1 1 13 9045 1 1 35 CYS H H -5.375 -4.390 0.514 1.00 . A A . 35 CYS H 1 1 13 9046 1 1 35 CYS HA H -5.917 -6.077 2.673 1.00 . A A . 35 CYS HA 1 1 13 9047 1 1 35 CYS HB2 H -4.345 -6.808 0.193 1.00 . A A . 35 CYS HB2 1 1 13 9048 1 1 35 CYS HB3 H -5.249 -7.902 1.235 1.00 . A A . 35 CYS HB3 1 1 13 9049 1 1 35 CYS N N -5.256 -4.532 1.476 1.00 . A A . 35 CYS N 1 1 13 9050 1 1 35 CYS O O -2.699 -5.831 2.108 1.00 . A A . 35 CYS O 1 1 13 9051 1 1 35 CYS SG S -6.688 -6.688 -0.231 1.00 . A A . 35 CYS SG 1 1 13 9052 1 1 36 ASP C C -2.229 -7.993 4.899 1.00 . A A . 36 ASP C 1 1 13 9053 1 1 36 ASP CA C -2.726 -6.552 4.845 1.00 . A A . 36 ASP CA 1 1 13 9054 1 1 36 ASP CB C -3.058 -6.069 6.258 1.00 . A A . 36 ASP CB 1 1 13 9055 1 1 36 ASP CG C -3.625 -4.665 6.269 1.00 . A A . 36 ASP CG 1 1 13 9056 1 1 36 ASP H H -4.783 -6.520 4.353 1.00 . A A . 36 ASP H 1 1 13 9057 1 1 36 ASP HA H -1.937 -5.933 4.449 1.00 . A A . 36 ASP HA 1 1 13 9058 1 1 36 ASP HB2 H -3.785 -6.735 6.698 1.00 . A A . 36 ASP HB2 1 1 13 9059 1 1 36 ASP HB3 H -2.158 -6.080 6.855 1.00 . A A . 36 ASP HB3 1 1 13 9060 1 1 36 ASP N N -3.886 -6.392 3.979 1.00 . A A . 36 ASP N 1 1 13 9061 1 1 36 ASP O O -1.074 -8.223 5.259 1.00 . A A . 36 ASP O 1 1 13 9062 1 1 36 ASP OD1 O -2.829 -3.703 6.297 1.00 . A A . 36 ASP OD1 1 1 13 9063 1 1 36 ASP OD2 O -4.865 -4.525 6.247 1.00 . A A . 36 ASP OD2 1 1 13 9064 1 1 37 ASP C C -1.268 -10.496 4.009 1.00 . A A . 37 ASP C 1 1 13 9065 1 1 37 ASP CA C -2.679 -10.372 4.557 1.00 . A A . 37 ASP CA 1 1 13 9066 1 1 37 ASP CB C -3.645 -11.213 3.721 1.00 . A A . 37 ASP CB 1 1 13 9067 1 1 37 ASP CG C -3.542 -12.694 4.029 1.00 . A A . 37 ASP CG 1 1 13 9068 1 1 37 ASP H H -3.994 -8.742 4.259 1.00 . A A . 37 ASP H 1 1 13 9069 1 1 37 ASP HA H -2.693 -10.717 5.580 1.00 . A A . 37 ASP HA 1 1 13 9070 1 1 37 ASP HB2 H -4.658 -10.893 3.922 1.00 . A A . 37 ASP HB2 1 1 13 9071 1 1 37 ASP HB3 H -3.427 -11.065 2.673 1.00 . A A . 37 ASP HB3 1 1 13 9072 1 1 37 ASP N N -3.082 -8.963 4.542 1.00 . A A . 37 ASP N 1 1 13 9073 1 1 37 ASP O O -0.419 -11.192 4.568 1.00 . A A . 37 ASP O 1 1 13 9074 1 1 37 ASP OD1 O -4.546 -13.277 4.490 1.00 . A A . 37 ASP OD1 1 1 13 9075 1 1 37 ASP OD2 O -2.457 -13.272 3.807 1.00 . A A . 37 ASP OD2 1 1 13 9076 1 1 38 MET C C 0.722 -8.267 2.236 1.00 . A A . 38 MET C 1 1 13 9077 1 1 38 MET CA C 0.274 -9.723 2.295 1.00 . A A . 38 MET CA 1 1 13 9078 1 1 38 MET CB C 0.215 -10.338 0.893 1.00 . A A . 38 MET CB 1 1 13 9079 1 1 38 MET CE C 0.550 -14.297 1.960 1.00 . A A . 38 MET CE 1 1 13 9080 1 1 38 MET CG C -0.106 -11.825 0.893 1.00 . A A . 38 MET CG 1 1 13 9081 1 1 38 MET H H -1.750 -9.218 2.564 1.00 . A A . 38 MET H 1 1 13 9082 1 1 38 MET HA H 0.967 -10.282 2.907 1.00 . A A . 38 MET HA 1 1 13 9083 1 1 38 MET HB2 H -0.544 -9.828 0.321 1.00 . A A . 38 MET HB2 1 1 13 9084 1 1 38 MET HB3 H 1.171 -10.198 0.411 1.00 . A A . 38 MET HB3 1 1 13 9085 1 1 38 MET HE1 H -0.046 -14.783 1.202 1.00 . A A . 38 MET HE1 1 1 13 9086 1 1 38 MET HE2 H -0.084 -14.002 2.783 1.00 . A A . 38 MET HE2 1 1 13 9087 1 1 38 MET HE3 H 1.308 -14.980 2.315 1.00 . A A . 38 MET HE3 1 1 13 9088 1 1 38 MET HG2 H -0.864 -12.016 1.638 1.00 . A A . 38 MET HG2 1 1 13 9089 1 1 38 MET HG3 H -0.484 -12.096 -0.081 1.00 . A A . 38 MET HG3 1 1 13 9090 1 1 38 MET N N -1.028 -9.770 2.930 1.00 . A A . 38 MET N 1 1 13 9091 1 1 38 MET O O 1.016 -7.663 3.268 1.00 . A A . 38 MET O 1 1 13 9092 1 1 38 MET SD S 1.334 -12.846 1.260 1.00 . A A . 38 MET SD 1 1 13 9093 1 1 39 GLN C C 0.453 -5.706 -0.367 1.00 . A A . 39 GLN C 1 1 13 9094 1 1 39 GLN CA C 1.096 -6.287 0.886 1.00 . A A . 39 GLN CA 1 1 13 9095 1 1 39 GLN CB C 2.615 -6.134 0.817 1.00 . A A . 39 GLN CB 1 1 13 9096 1 1 39 GLN CD C 2.840 -3.635 0.519 1.00 . A A . 39 GLN CD 1 1 13 9097 1 1 39 GLN CG C 3.123 -4.830 1.411 1.00 . A A . 39 GLN CG 1 1 13 9098 1 1 39 GLN H H 0.451 -8.195 0.254 1.00 . A A . 39 GLN H 1 1 13 9099 1 1 39 GLN HA H 0.726 -5.751 1.748 1.00 . A A . 39 GLN HA 1 1 13 9100 1 1 39 GLN HB2 H 3.074 -6.951 1.355 1.00 . A A . 39 GLN HB2 1 1 13 9101 1 1 39 GLN HB3 H 2.924 -6.176 -0.218 1.00 . A A . 39 GLN HB3 1 1 13 9102 1 1 39 GLN HE21 H 1.490 -2.957 1.813 1.00 . A A . 39 GLN HE21 1 1 13 9103 1 1 39 GLN HE22 H 1.724 -1.995 0.397 1.00 . A A . 39 GLN HE22 1 1 13 9104 1 1 39 GLN HG2 H 2.640 -4.671 2.363 1.00 . A A . 39 GLN HG2 1 1 13 9105 1 1 39 GLN HG3 H 4.190 -4.906 1.558 1.00 . A A . 39 GLN HG3 1 1 13 9106 1 1 39 GLN N N 0.732 -7.687 1.042 1.00 . A A . 39 GLN N 1 1 13 9107 1 1 39 GLN NE2 N 1.926 -2.776 0.954 1.00 . A A . 39 GLN NE2 1 1 13 9108 1 1 39 GLN O O 1.105 -5.628 -1.408 1.00 . A A . 39 GLN O 1 1 13 9109 1 1 39 GLN OE1 O 3.437 -3.488 -0.546 1.00 . A A . 39 GLN OE1 1 1 13 9110 1 1 40 HIS C C -2.918 -4.330 -1.161 1.00 . A A . 40 HIS C 1 1 13 9111 1 1 40 HIS CA C -1.479 -4.704 -1.456 1.00 . A A . 40 HIS CA 1 1 13 9112 1 1 40 HIS CB C -1.450 -5.682 -2.633 1.00 . A A . 40 HIS CB 1 1 13 9113 1 1 40 HIS CD2 C -2.071 -7.976 -1.592 1.00 . A A . 40 HIS CD2 1 1 13 9114 1 1 40 HIS CE1 C -3.947 -8.320 -2.674 1.00 . A A . 40 HIS CE1 1 1 13 9115 1 1 40 HIS CG C -2.268 -6.916 -2.410 1.00 . A A . 40 HIS CG 1 1 13 9116 1 1 40 HIS H H -1.307 -5.350 0.579 1.00 . A A . 40 HIS H 1 1 13 9117 1 1 40 HIS HA H -0.940 -3.810 -1.733 1.00 . A A . 40 HIS HA 1 1 13 9118 1 1 40 HIS HB2 H -1.840 -5.184 -3.509 1.00 . A A . 40 HIS HB2 1 1 13 9119 1 1 40 HIS HB3 H -0.430 -5.984 -2.818 1.00 . A A . 40 HIS HB3 1 1 13 9120 1 1 40 HIS HD1 H -3.867 -6.577 -3.741 1.00 . A A . 40 HIS HD1 1 1 13 9121 1 1 40 HIS HD2 H -1.236 -8.120 -0.919 1.00 . A A . 40 HIS HD2 1 1 13 9122 1 1 40 HIS HE1 H -4.864 -8.770 -3.024 1.00 . A A . 40 HIS HE1 1 1 13 9123 1 1 40 HIS HE2 H -3.208 -9.730 -1.386 1.00 . A A . 40 HIS HE2 1 1 13 9124 1 1 40 HIS N N -0.815 -5.281 -0.280 1.00 . A A . 40 HIS N 1 1 13 9125 1 1 40 HIS ND1 N -3.451 -7.163 -3.075 1.00 . A A . 40 HIS ND1 1 1 13 9126 1 1 40 HIS NE2 N -3.127 -8.835 -1.775 1.00 . A A . 40 HIS NE2 1 1 13 9127 1 1 40 HIS O O -3.497 -4.808 -0.197 1.00 . A A . 40 HIS O 1 1 13 9128 1 1 41 CYS C C -5.689 -3.273 -3.087 1.00 . A A . 41 CYS C 1 1 13 9129 1 1 41 CYS CA C -4.867 -3.040 -1.825 1.00 . A A . 41 CYS CA 1 1 13 9130 1 1 41 CYS CB C -4.912 -1.556 -1.469 1.00 . A A . 41 CYS CB 1 1 13 9131 1 1 41 CYS H H -2.977 -3.114 -2.755 1.00 . A A . 41 CYS H 1 1 13 9132 1 1 41 CYS HA H -5.294 -3.610 -1.016 1.00 . A A . 41 CYS HA 1 1 13 9133 1 1 41 CYS HB2 H -5.891 -1.313 -1.085 1.00 . A A . 41 CYS HB2 1 1 13 9134 1 1 41 CYS HB3 H -4.172 -1.354 -0.708 1.00 . A A . 41 CYS HB3 1 1 13 9135 1 1 41 CYS N N -3.490 -3.473 -2.001 1.00 . A A . 41 CYS N 1 1 13 9136 1 1 41 CYS O O -5.243 -2.969 -4.194 1.00 . A A . 41 CYS O 1 1 13 9137 1 1 41 CYS SG S -4.579 -0.449 -2.873 1.00 . A A . 41 CYS SG 1 1 13 9138 1 1 42 CYS C C -8.582 -2.887 -4.425 1.00 . A A . 42 CYS C 1 1 13 9139 1 1 42 CYS CA C -7.751 -4.117 -4.063 1.00 . A A . 42 CYS CA 1 1 13 9140 1 1 42 CYS CB C -8.673 -5.298 -3.740 1.00 . A A . 42 CYS CB 1 1 13 9141 1 1 42 CYS H H -7.179 -4.096 -2.022 1.00 . A A . 42 CYS H 1 1 13 9142 1 1 42 CYS HA H -7.124 -4.378 -4.902 1.00 . A A . 42 CYS HA 1 1 13 9143 1 1 42 CYS HB2 H -8.159 -5.974 -3.074 1.00 . A A . 42 CYS HB2 1 1 13 9144 1 1 42 CYS HB3 H -9.560 -4.926 -3.248 1.00 . A A . 42 CYS HB3 1 1 13 9145 1 1 42 CYS N N -6.885 -3.832 -2.922 1.00 . A A . 42 CYS N 1 1 13 9146 1 1 42 CYS O O -8.966 -2.109 -3.555 1.00 . A A . 42 CYS O 1 1 13 9147 1 1 42 CYS SG S -9.208 -6.257 -5.195 1.00 . A A . 42 CYS SG 1 1 13 9148 1 1 43 PRO C C -10.877 -1.237 -5.430 1.00 . A A . 43 PRO C 1 1 13 9149 1 1 43 PRO CA C -9.620 -1.545 -6.235 1.00 . A A . 43 PRO CA 1 1 13 9150 1 1 43 PRO CB C -9.995 -1.960 -7.668 1.00 . A A . 43 PRO CB 1 1 13 9151 1 1 43 PRO CD C -8.427 -3.549 -6.835 1.00 . A A . 43 PRO CD 1 1 13 9152 1 1 43 PRO CG C -9.564 -3.383 -7.796 1.00 . A A . 43 PRO CG 1 1 13 9153 1 1 43 PRO HA H -9.006 -0.657 -6.276 1.00 . A A . 43 PRO HA 1 1 13 9154 1 1 43 PRO HB2 H -11.061 -1.859 -7.805 1.00 . A A . 43 PRO HB2 1 1 13 9155 1 1 43 PRO HB3 H -9.477 -1.328 -8.374 1.00 . A A . 43 PRO HB3 1 1 13 9156 1 1 43 PRO HD2 H -8.337 -4.578 -6.521 1.00 . A A . 43 PRO HD2 1 1 13 9157 1 1 43 PRO HD3 H -7.504 -3.195 -7.269 1.00 . A A . 43 PRO HD3 1 1 13 9158 1 1 43 PRO HG2 H -10.379 -4.035 -7.523 1.00 . A A . 43 PRO HG2 1 1 13 9159 1 1 43 PRO HG3 H -9.238 -3.584 -8.805 1.00 . A A . 43 PRO HG3 1 1 13 9160 1 1 43 PRO N N -8.854 -2.689 -5.730 1.00 . A A . 43 PRO N 1 1 13 9161 1 1 43 PRO O O -11.694 -2.123 -5.146 1.00 . A A . 43 PRO O 1 1 13 9162 1 1 44 ALA C C -13.429 -0.175 -4.719 1.00 . A A . 44 ALA C 1 1 13 9163 1 1 44 ALA CA C -12.144 0.519 -4.294 1.00 . A A . 44 ALA CA 1 1 13 9164 1 1 44 ALA CB C -12.285 2.024 -4.451 1.00 . A A . 44 ALA CB 1 1 13 9165 1 1 44 ALA H H -10.298 0.664 -5.319 1.00 . A A . 44 ALA H 1 1 13 9166 1 1 44 ALA HA H -11.956 0.304 -3.252 1.00 . A A . 44 ALA HA 1 1 13 9167 1 1 44 ALA HB1 H -13.157 2.362 -3.910 1.00 . A A . 44 ALA HB1 1 1 13 9168 1 1 44 ALA HB2 H -12.393 2.268 -5.498 1.00 . A A . 44 ALA HB2 1 1 13 9169 1 1 44 ALA HB3 H -11.406 2.511 -4.056 1.00 . A A . 44 ALA HB3 1 1 13 9170 1 1 44 ALA N N -11.007 0.036 -5.065 1.00 . A A . 44 ALA N 1 1 13 9171 1 1 44 ALA O O -13.841 -0.095 -5.876 1.00 . A A . 44 ALA O 1 1 13 9172 1 1 45 GLY C C -15.180 -3.048 -3.941 1.00 . A A . 45 GLY C 1 1 13 9173 1 1 45 GLY CA C -15.296 -1.541 -4.056 1.00 . A A . 45 GLY CA 1 1 13 9174 1 1 45 GLY H H -13.678 -0.859 -2.866 1.00 . A A . 45 GLY H 1 1 13 9175 1 1 45 GLY HA2 H -16.053 -1.200 -3.365 1.00 . A A . 45 GLY HA2 1 1 13 9176 1 1 45 GLY HA3 H -15.606 -1.293 -5.061 1.00 . A A . 45 GLY HA3 1 1 13 9177 1 1 45 GLY N N -14.059 -0.849 -3.769 1.00 . A A . 45 GLY N 1 1 13 9178 1 1 45 GLY O O -16.196 -3.744 -3.928 1.00 . A A . 45 GLY O 1 1 13 9179 1 1 46 TYR C C -13.099 -5.339 -2.380 1.00 . A A . 46 TYR C 1 1 13 9180 1 1 46 TYR CA C -13.761 -5.009 -3.713 1.00 . A A . 46 TYR CA 1 1 13 9181 1 1 46 TYR CB C -12.907 -5.546 -4.863 1.00 . A A . 46 TYR CB 1 1 13 9182 1 1 46 TYR CD1 C -14.499 -6.509 -6.570 1.00 . A A . 46 TYR CD1 1 1 13 9183 1 1 46 TYR CD2 C -13.364 -4.483 -7.107 1.00 . A A . 46 TYR CD2 1 1 13 9184 1 1 46 TYR CE1 C -15.136 -6.482 -7.796 1.00 . A A . 46 TYR CE1 1 1 13 9185 1 1 46 TYR CE2 C -13.997 -4.448 -8.333 1.00 . A A . 46 TYR CE2 1 1 13 9186 1 1 46 TYR CG C -13.603 -5.512 -6.205 1.00 . A A . 46 TYR CG 1 1 13 9187 1 1 46 TYR CZ C -14.881 -5.450 -8.675 1.00 . A A . 46 TYR CZ 1 1 13 9188 1 1 46 TYR H H -13.159 -2.987 -3.840 1.00 . A A . 46 TYR H 1 1 13 9189 1 1 46 TYR HA H -14.733 -5.478 -3.746 1.00 . A A . 46 TYR HA 1 1 13 9190 1 1 46 TYR HB2 H -12.008 -4.957 -4.941 1.00 . A A . 46 TYR HB2 1 1 13 9191 1 1 46 TYR HB3 H -12.642 -6.572 -4.654 1.00 . A A . 46 TYR HB3 1 1 13 9192 1 1 46 TYR HD1 H -14.695 -7.316 -5.880 1.00 . A A . 46 TYR HD1 1 1 13 9193 1 1 46 TYR HD2 H -12.669 -3.700 -6.838 1.00 . A A . 46 TYR HD2 1 1 13 9194 1 1 46 TYR HE1 H -15.828 -7.267 -8.062 1.00 . A A . 46 TYR HE1 1 1 13 9195 1 1 46 TYR HE2 H -13.797 -3.640 -9.021 1.00 . A A . 46 TYR HE2 1 1 13 9196 1 1 46 TYR HH H -15.268 -6.196 -10.404 1.00 . A A . 46 TYR HH 1 1 13 9197 1 1 46 TYR N N -13.956 -3.567 -3.844 1.00 . A A . 46 TYR N 1 1 13 9198 1 1 46 TYR O O -12.573 -4.455 -1.704 1.00 . A A . 46 TYR O 1 1 13 9199 1 1 46 TYR OH O -15.513 -5.419 -9.896 1.00 . A A . 46 TYR OH 1 1 13 9200 1 1 47 LYS C C -11.609 -8.247 -0.966 1.00 . A A . 47 LYS C 1 1 13 9201 1 1 47 LYS CA C -12.530 -7.049 -0.749 1.00 . A A . 47 LYS CA 1 1 13 9202 1 1 47 LYS CB C -13.619 -7.399 0.269 1.00 . A A . 47 LYS CB 1 1 13 9203 1 1 47 LYS CD C -14.457 -9.584 1.179 1.00 . A A . 47 LYS CD 1 1 13 9204 1 1 47 LYS CE C -15.744 -9.334 1.950 1.00 . A A . 47 LYS CE 1 1 13 9205 1 1 47 LYS CG C -14.358 -8.689 -0.045 1.00 . A A . 47 LYS CG 1 1 13 9206 1 1 47 LYS H H -13.564 -7.273 -2.584 1.00 . A A . 47 LYS H 1 1 13 9207 1 1 47 LYS HA H -11.942 -6.229 -0.363 1.00 . A A . 47 LYS HA 1 1 13 9208 1 1 47 LYS HB2 H -13.165 -7.497 1.244 1.00 . A A . 47 LYS HB2 1 1 13 9209 1 1 47 LYS HB3 H -14.340 -6.595 0.297 1.00 . A A . 47 LYS HB3 1 1 13 9210 1 1 47 LYS HD2 H -14.434 -10.616 0.863 1.00 . A A . 47 LYS HD2 1 1 13 9211 1 1 47 LYS HD3 H -13.615 -9.386 1.828 1.00 . A A . 47 LYS HD3 1 1 13 9212 1 1 47 LYS HE2 H -16.395 -8.719 1.348 1.00 . A A . 47 LYS HE2 1 1 13 9213 1 1 47 LYS HE3 H -16.222 -10.283 2.144 1.00 . A A . 47 LYS HE3 1 1 13 9214 1 1 47 LYS HG2 H -15.354 -8.450 -0.385 1.00 . A A . 47 LYS HG2 1 1 13 9215 1 1 47 LYS HG3 H -13.827 -9.217 -0.823 1.00 . A A . 47 LYS HG3 1 1 13 9216 1 1 47 LYS HZ1 H -14.569 -8.935 3.632 1.00 . A A . 47 LYS HZ1 1 1 13 9217 1 1 47 LYS HZ2 H -16.233 -8.890 3.932 1.00 . A A . 47 LYS HZ2 1 1 13 9218 1 1 47 LYS HZ3 H -15.488 -7.614 3.109 1.00 . A A . 47 LYS HZ3 1 1 13 9219 1 1 47 LYS N N -13.129 -6.613 -2.005 1.00 . A A . 47 LYS N 1 1 13 9220 1 1 47 LYS NZ N -15.491 -8.645 3.246 1.00 . A A . 47 LYS NZ 1 1 13 9221 1 1 47 LYS O O -11.778 -9.010 -1.917 1.00 . A A . 47 LYS O 1 1 13 9222 1 1 48 CYS C C -10.247 -10.759 0.488 1.00 . A A . 48 CYS C 1 1 13 9223 1 1 48 CYS CA C -9.682 -9.502 -0.164 1.00 . A A . 48 CYS CA 1 1 13 9224 1 1 48 CYS CB C -8.357 -9.117 0.499 1.00 . A A . 48 CYS CB 1 1 13 9225 1 1 48 CYS H H -10.556 -7.753 0.656 1.00 . A A . 48 CYS H 1 1 13 9226 1 1 48 CYS HA H -9.506 -9.702 -1.211 1.00 . A A . 48 CYS HA 1 1 13 9227 1 1 48 CYS HB2 H -8.242 -9.685 1.411 1.00 . A A . 48 CYS HB2 1 1 13 9228 1 1 48 CYS HB3 H -7.545 -9.358 -0.172 1.00 . A A . 48 CYS HB3 1 1 13 9229 1 1 48 CYS N N -10.635 -8.401 -0.076 1.00 . A A . 48 CYS N 1 1 13 9230 1 1 48 CYS O O -11.048 -10.681 1.420 1.00 . A A . 48 CYS O 1 1 13 9231 1 1 48 CYS SG S -8.219 -7.351 0.927 1.00 . A A . 48 CYS SG 1 1 13 9232 1 1 49 GLY C C -9.193 -14.203 0.680 1.00 . A A . 49 GLY C 1 1 13 9233 1 1 49 GLY CA C -10.301 -13.176 0.533 1.00 . A A . 49 GLY CA 1 1 13 9234 1 1 49 GLY H H -9.187 -11.917 -0.754 1.00 . A A . 49 GLY H 1 1 13 9235 1 1 49 GLY HA2 H -10.740 -12.993 1.504 1.00 . A A . 49 GLY HA2 1 1 13 9236 1 1 49 GLY HA3 H -11.062 -13.574 -0.123 1.00 . A A . 49 GLY HA3 1 1 13 9237 1 1 49 GLY N N -9.826 -11.918 -0.011 1.00 . A A . 49 GLY N 1 1 13 9238 1 1 49 GLY O O -8.041 -13.925 0.351 1.00 . A A . 49 GLY O 1 1 13 9239 1 1 50 PRO C C -7.905 -16.926 0.038 1.00 . A A . 50 PRO C 1 1 13 9240 1 1 50 PRO CA C -8.526 -16.483 1.359 1.00 . A A . 50 PRO CA 1 1 13 9241 1 1 50 PRO CB C -9.335 -17.631 1.979 1.00 . A A . 50 PRO CB 1 1 13 9242 1 1 50 PRO CD C -10.861 -15.837 1.592 1.00 . A A . 50 PRO CD 1 1 13 9243 1 1 50 PRO CG C -10.578 -16.996 2.503 1.00 . A A . 50 PRO CG 1 1 13 9244 1 1 50 PRO HA H -7.742 -16.183 2.039 1.00 . A A . 50 PRO HA 1 1 13 9245 1 1 50 PRO HB2 H -9.558 -18.366 1.220 1.00 . A A . 50 PRO HB2 1 1 13 9246 1 1 50 PRO HB3 H -8.764 -18.089 2.773 1.00 . A A . 50 PRO HB3 1 1 13 9247 1 1 50 PRO HD2 H -11.448 -16.157 0.744 1.00 . A A . 50 PRO HD2 1 1 13 9248 1 1 50 PRO HD3 H -11.366 -15.047 2.128 1.00 . A A . 50 PRO HD3 1 1 13 9249 1 1 50 PRO HG2 H -11.393 -17.705 2.473 1.00 . A A . 50 PRO HG2 1 1 13 9250 1 1 50 PRO HG3 H -10.417 -16.649 3.512 1.00 . A A . 50 PRO HG3 1 1 13 9251 1 1 50 PRO N N -9.515 -15.414 1.175 1.00 . A A . 50 PRO N 1 1 13 9252 1 1 50 PRO O O -8.577 -17.522 -0.804 1.00 . A A . 50 PRO O 1 1 13 9253 1 1 51 GLY C C -5.490 -15.809 -2.174 1.00 . A A . 51 GLY C 1 1 13 9254 1 1 51 GLY CA C -5.933 -17.009 -1.357 1.00 . A A . 51 GLY CA 1 1 13 9255 1 1 51 GLY H H -6.136 -16.156 0.571 1.00 . A A . 51 GLY H 1 1 13 9256 1 1 51 GLY HA2 H -5.064 -17.596 -1.101 1.00 . A A . 51 GLY HA2 1 1 13 9257 1 1 51 GLY HA3 H -6.597 -17.613 -1.958 1.00 . A A . 51 GLY HA3 1 1 13 9258 1 1 51 GLY N N -6.621 -16.632 -0.135 1.00 . A A . 51 GLY N 1 1 13 9259 1 1 51 GLY O O -5.193 -15.937 -3.362 1.00 . A A . 51 GLY O 1 1 13 9260 1 1 52 GLY C C -5.917 -13.104 -3.412 1.00 . A A . 52 GLY C 1 1 13 9261 1 1 52 GLY CA C -5.030 -13.433 -2.227 1.00 . A A . 52 GLY CA 1 1 13 9262 1 1 52 GLY H H -5.688 -14.601 -0.588 1.00 . A A . 52 GLY H 1 1 13 9263 1 1 52 GLY HA2 H -5.058 -12.608 -1.531 1.00 . A A . 52 GLY HA2 1 1 13 9264 1 1 52 GLY HA3 H -4.016 -13.561 -2.576 1.00 . A A . 52 GLY HA3 1 1 13 9265 1 1 52 GLY N N -5.443 -14.642 -1.536 1.00 . A A . 52 GLY N 1 1 13 9266 1 1 52 GLY O O -5.429 -12.704 -4.469 1.00 . A A . 52 GLY O 1 1 13 9267 1 1 53 THR C C -8.992 -11.739 -3.994 1.00 . A A . 53 THR C 1 1 13 9268 1 1 53 THR CA C -8.182 -12.995 -4.299 1.00 . A A . 53 THR CA 1 1 13 9269 1 1 53 THR CB C -9.148 -14.174 -4.508 1.00 . A A . 53 THR CB 1 1 13 9270 1 1 53 THR CG2 C -8.426 -15.363 -5.125 1.00 . A A . 53 THR CG2 1 1 13 9271 1 1 53 THR H H -7.551 -13.599 -2.372 1.00 . A A . 53 THR H 1 1 13 9272 1 1 53 THR HA H -7.630 -12.842 -5.215 1.00 . A A . 53 THR HA 1 1 13 9273 1 1 53 THR HB H -9.935 -13.862 -5.178 1.00 . A A . 53 THR HB 1 1 13 9274 1 1 53 THR HG1 H -9.038 -14.889 -2.672 1.00 . A A . 53 THR HG1 1 1 13 9275 1 1 53 THR HG21 H -8.583 -15.363 -6.193 1.00 . A A . 53 THR HG21 1 1 13 9276 1 1 53 THR HG22 H -8.815 -16.278 -4.705 1.00 . A A . 53 THR HG22 1 1 13 9277 1 1 53 THR HG23 H -7.369 -15.290 -4.916 1.00 . A A . 53 THR HG23 1 1 13 9278 1 1 53 THR N N -7.223 -13.275 -3.236 1.00 . A A . 53 THR N 1 1 13 9279 1 1 53 THR O O -8.745 -11.057 -2.999 1.00 . A A . 53 THR O 1 1 13 9280 1 1 53 THR OG1 O -9.727 -14.560 -3.255 1.00 . A A . 53 THR OG1 1 1 13 9281 1 1 54 CYS C C -12.247 -10.562 -5.088 1.00 . A A . 54 CYS C 1 1 13 9282 1 1 54 CYS CA C -10.809 -10.268 -4.673 1.00 . A A . 54 CYS CA 1 1 13 9283 1 1 54 CYS CB C -10.262 -9.087 -5.476 1.00 . A A . 54 CYS CB 1 1 13 9284 1 1 54 CYS H H -10.111 -12.023 -5.628 1.00 . A A . 54 CYS H 1 1 13 9285 1 1 54 CYS HA H -10.797 -10.012 -3.624 1.00 . A A . 54 CYS HA 1 1 13 9286 1 1 54 CYS HB2 H -9.883 -9.448 -6.421 1.00 . A A . 54 CYS HB2 1 1 13 9287 1 1 54 CYS HB3 H -11.062 -8.384 -5.659 1.00 . A A . 54 CYS HB3 1 1 13 9288 1 1 54 CYS N N -9.961 -11.441 -4.854 1.00 . A A . 54 CYS N 1 1 13 9289 1 1 54 CYS O O -12.499 -11.065 -6.184 1.00 . A A . 54 CYS O 1 1 13 9290 1 1 54 CYS SG S -8.912 -8.188 -4.646 1.00 . A A . 54 CYS SG 1 1 13 9291 1 1 55 ILE C C -15.434 -9.253 -4.113 1.00 . A A . 55 ILE C 1 1 13 9292 1 1 55 ILE CA C -14.601 -10.482 -4.461 1.00 . A A . 55 ILE CA 1 1 13 9293 1 1 55 ILE CB C -15.130 -11.690 -3.661 1.00 . A A . 55 ILE CB 1 1 13 9294 1 1 55 ILE CD1 C -15.202 -12.570 -1.271 1.00 . A A . 55 ILE CD1 1 1 13 9295 1 1 55 ILE CG1 C -14.425 -11.784 -2.306 1.00 . A A . 55 ILE CG1 1 1 13 9296 1 1 55 ILE CG2 C -14.938 -12.974 -4.455 1.00 . A A . 55 ILE CG2 1 1 13 9297 1 1 55 ILE H H -12.912 -9.858 -3.343 1.00 . A A . 55 ILE H 1 1 13 9298 1 1 55 ILE HA H -14.714 -10.696 -5.514 1.00 . A A . 55 ILE HA 1 1 13 9299 1 1 55 ILE HB H -16.188 -11.551 -3.500 1.00 . A A . 55 ILE HB 1 1 13 9300 1 1 55 ILE HD11 H -14.792 -12.376 -0.290 1.00 . A A . 55 ILE HD11 1 1 13 9301 1 1 55 ILE HD12 H -15.127 -13.625 -1.490 1.00 . A A . 55 ILE HD12 1 1 13 9302 1 1 55 ILE HD13 H -16.239 -12.270 -1.294 1.00 . A A . 55 ILE HD13 1 1 13 9303 1 1 55 ILE HG12 H -13.469 -12.268 -2.438 1.00 . A A . 55 ILE HG12 1 1 13 9304 1 1 55 ILE HG13 H -14.269 -10.788 -1.920 1.00 . A A . 55 ILE HG13 1 1 13 9305 1 1 55 ILE HG21 H -15.892 -13.464 -4.584 1.00 . A A . 55 ILE HG21 1 1 13 9306 1 1 55 ILE HG22 H -14.266 -13.630 -3.921 1.00 . A A . 55 ILE HG22 1 1 13 9307 1 1 55 ILE HG23 H -14.520 -12.740 -5.423 1.00 . A A . 55 ILE HG23 1 1 13 9308 1 1 55 ILE N N -13.185 -10.249 -4.199 1.00 . A A . 55 ILE N 1 1 13 9309 1 1 55 ILE O O -14.901 -8.230 -3.687 1.00 . A A . 55 ILE O 1 1 13 9310 1 1 56 SER C C -19.049 -8.774 -3.671 1.00 . A A . 56 SER C 1 1 13 9311 1 1 56 SER CA C -17.653 -8.258 -4.004 1.00 . A A . 56 SER CA 1 1 13 9312 1 1 56 SER CB C -17.722 -7.295 -5.191 1.00 . A A . 56 SER CB 1 1 13 9313 1 1 56 SER H H -17.115 -10.202 -4.643 1.00 . A A . 56 SER H 1 1 13 9314 1 1 56 SER HA H -17.264 -7.730 -3.146 1.00 . A A . 56 SER HA 1 1 13 9315 1 1 56 SER HB2 H -16.898 -6.599 -5.135 1.00 . A A . 56 SER HB2 1 1 13 9316 1 1 56 SER HB3 H -17.655 -7.857 -6.112 1.00 . A A . 56 SER HB3 1 1 13 9317 1 1 56 SER HG H -18.831 -5.767 -5.712 1.00 . A A . 56 SER HG 1 1 13 9318 1 1 56 SER N N -16.747 -9.361 -4.299 1.00 . A A . 56 SER N 1 1 13 9319 1 1 56 SER O O -19.598 -9.558 -4.474 1.00 . A A . 56 SER O 1 1 13 9320 1 1 56 SER OXT O -19.583 -8.391 -2.608 1.00 . A A . 56 SER OXT 1 1 13 9321 1 1 56 SER OG O -18.936 -6.565 -5.188 1.00 . A A . 56 SER OG 1 1 14 9322 1 1 1 ASP C C 3.190 13.965 -2.934 1.00 . A A . 1 ASP C 1 1 14 9323 1 1 1 ASP CA C 4.652 13.776 -3.327 1.00 . A A . 1 ASP CA 1 1 14 9324 1 1 1 ASP CB C 5.511 13.558 -2.079 1.00 . A A . 1 ASP CB 1 1 14 9325 1 1 1 ASP CG C 6.175 14.835 -1.601 1.00 . A A . 1 ASP CG 1 1 14 9326 1 1 1 ASP H1 H 4.586 15.150 -4.897 1.00 . A A . 1 ASP H1 1 1 14 9327 1 1 1 ASP H2 H 6.151 14.793 -4.364 1.00 . A A . 1 ASP H2 1 1 14 9328 1 1 1 ASP H3 H 5.152 15.799 -3.442 1.00 . A A . 1 ASP H3 1 1 14 9329 1 1 1 ASP HA H 4.735 12.912 -3.970 1.00 . A A . 1 ASP HA 1 1 14 9330 1 1 1 ASP HB2 H 4.888 13.179 -1.282 1.00 . A A . 1 ASP HB2 1 1 14 9331 1 1 1 ASP HB3 H 6.281 12.835 -2.303 1.00 . A A . 1 ASP HB3 1 1 14 9332 1 1 1 ASP N N 5.171 14.962 -4.058 1.00 . A A . 1 ASP N 1 1 14 9333 1 1 1 ASP O O 2.551 14.935 -3.341 1.00 . A A . 1 ASP O 1 1 14 9334 1 1 1 ASP OD1 O 7.382 15.013 -1.870 1.00 . A A . 1 ASP OD1 1 1 14 9335 1 1 1 ASP OD2 O 5.488 15.657 -0.959 1.00 . A A . 1 ASP OD2 1 1 14 9336 1 1 2 VAL C C 1.188 13.542 -0.236 1.00 . A A . 2 VAL C 1 1 14 9337 1 1 2 VAL CA C 1.280 13.102 -1.700 1.00 . A A . 2 VAL CA 1 1 14 9338 1 1 2 VAL CB C 0.554 11.753 -1.916 1.00 . A A . 2 VAL CB 1 1 14 9339 1 1 2 VAL CG1 C -0.863 11.801 -1.360 1.00 . A A . 2 VAL CG1 1 1 14 9340 1 1 2 VAL CG2 C 0.530 11.402 -3.395 1.00 . A A . 2 VAL CG2 1 1 14 9341 1 1 2 VAL H H 3.227 12.284 -1.851 1.00 . A A . 2 VAL H 1 1 14 9342 1 1 2 VAL HA H 0.785 13.842 -2.300 1.00 . A A . 2 VAL HA 1 1 14 9343 1 1 2 VAL HB H 1.099 10.979 -1.398 1.00 . A A . 2 VAL HB 1 1 14 9344 1 1 2 VAL HG11 H -1.549 11.396 -2.087 1.00 . A A . 2 VAL HG11 1 1 14 9345 1 1 2 VAL HG12 H -1.131 12.825 -1.143 1.00 . A A . 2 VAL HG12 1 1 14 9346 1 1 2 VAL HG13 H -0.914 11.216 -0.453 1.00 . A A . 2 VAL HG13 1 1 14 9347 1 1 2 VAL HG21 H -0.492 11.275 -3.719 1.00 . A A . 2 VAL HG21 1 1 14 9348 1 1 2 VAL HG22 H 1.076 10.483 -3.556 1.00 . A A . 2 VAL HG22 1 1 14 9349 1 1 2 VAL HG23 H 0.990 12.198 -3.962 1.00 . A A . 2 VAL HG23 1 1 14 9350 1 1 2 VAL N N 2.668 13.034 -2.142 1.00 . A A . 2 VAL N 1 1 14 9351 1 1 2 VAL O O 1.241 14.737 0.054 1.00 . A A . 2 VAL O 1 1 14 9352 1 1 3 GLN C C 0.455 11.586 2.830 1.00 . A A . 3 GLN C 1 1 14 9353 1 1 3 GLN CA C 0.965 12.833 2.110 1.00 . A A . 3 GLN CA 1 1 14 9354 1 1 3 GLN CB C 0.031 14.013 2.405 1.00 . A A . 3 GLN CB 1 1 14 9355 1 1 3 GLN CD C 0.065 15.737 4.254 1.00 . A A . 3 GLN CD 1 1 14 9356 1 1 3 GLN CG C 0.744 15.216 3.002 1.00 . A A . 3 GLN CG 1 1 14 9357 1 1 3 GLN H H 1.039 11.649 0.366 1.00 . A A . 3 GLN H 1 1 14 9358 1 1 3 GLN HA H 1.956 13.064 2.472 1.00 . A A . 3 GLN HA 1 1 14 9359 1 1 3 GLN HB2 H -0.443 14.321 1.486 1.00 . A A . 3 GLN HB2 1 1 14 9360 1 1 3 GLN HB3 H -0.729 13.690 3.102 1.00 . A A . 3 GLN HB3 1 1 14 9361 1 1 3 GLN HE21 H 0.983 14.357 5.352 1.00 . A A . 3 GLN HE21 1 1 14 9362 1 1 3 GLN HE22 H -0.069 15.424 6.212 1.00 . A A . 3 GLN HE22 1 1 14 9363 1 1 3 GLN HG2 H 1.755 14.932 3.252 1.00 . A A . 3 GLN HG2 1 1 14 9364 1 1 3 GLN HG3 H 0.765 16.007 2.266 1.00 . A A . 3 GLN HG3 1 1 14 9365 1 1 3 GLN N N 1.061 12.574 0.670 1.00 . A A . 3 GLN N 1 1 14 9366 1 1 3 GLN NE2 N 0.356 15.110 5.387 1.00 . A A . 3 GLN NE2 1 1 14 9367 1 1 3 GLN O O -0.647 11.581 3.378 1.00 . A A . 3 GLN O 1 1 14 9368 1 1 3 GLN OE1 O -0.711 16.691 4.202 1.00 . A A . 3 GLN OE1 1 1 14 9369 1 1 4 CYS C C 0.408 9.460 4.868 1.00 . A A . 4 CYS C 1 1 14 9370 1 1 4 CYS CA C 0.887 9.261 3.433 1.00 . A A . 4 CYS CA 1 1 14 9371 1 1 4 CYS CB C 2.065 8.281 3.405 1.00 . A A . 4 CYS CB 1 1 14 9372 1 1 4 CYS H H 2.117 10.589 2.335 1.00 . A A . 4 CYS H 1 1 14 9373 1 1 4 CYS HA H 0.076 8.842 2.859 1.00 . A A . 4 CYS HA 1 1 14 9374 1 1 4 CYS HB2 H 2.889 8.694 3.965 1.00 . A A . 4 CYS HB2 1 1 14 9375 1 1 4 CYS HB3 H 1.759 7.350 3.859 1.00 . A A . 4 CYS HB3 1 1 14 9376 1 1 4 CYS N N 1.259 10.525 2.803 1.00 . A A . 4 CYS N 1 1 14 9377 1 1 4 CYS O O -0.585 8.864 5.286 1.00 . A A . 4 CYS O 1 1 14 9378 1 1 4 CYS SG S 2.670 7.907 1.730 1.00 . A A . 4 CYS SG 1 1 14 9379 1 1 5 GLY C C 1.720 9.877 7.960 1.00 . A A . 5 GLY C 1 1 14 9380 1 1 5 GLY CA C 0.754 10.532 6.999 1.00 . A A . 5 GLY CA 1 1 14 9381 1 1 5 GLY H H 1.909 10.727 5.236 1.00 . A A . 5 GLY H 1 1 14 9382 1 1 5 GLY HA2 H 0.750 11.597 7.177 1.00 . A A . 5 GLY HA2 1 1 14 9383 1 1 5 GLY HA3 H -0.236 10.141 7.175 1.00 . A A . 5 GLY HA3 1 1 14 9384 1 1 5 GLY N N 1.121 10.287 5.618 1.00 . A A . 5 GLY N 1 1 14 9385 1 1 5 GLY O O 1.335 9.032 8.769 1.00 . A A . 5 GLY O 1 1 14 9386 1 1 6 GLY C C 5.395 10.109 8.251 1.00 . A A . 6 GLY C 1 1 14 9387 1 1 6 GLY CA C 4.011 9.717 8.717 1.00 . A A . 6 GLY CA 1 1 14 9388 1 1 6 GLY H H 3.221 10.945 7.192 1.00 . A A . 6 GLY H 1 1 14 9389 1 1 6 GLY HA2 H 3.862 10.078 9.724 1.00 . A A . 6 GLY HA2 1 1 14 9390 1 1 6 GLY HA3 H 3.930 8.639 8.713 1.00 . A A . 6 GLY HA3 1 1 14 9391 1 1 6 GLY N N 2.983 10.269 7.861 1.00 . A A . 6 GLY N 1 1 14 9392 1 1 6 GLY O O 5.880 11.193 8.574 1.00 . A A . 6 GLY O 1 1 14 9393 1 1 7 GLY C C 7.542 9.166 5.528 1.00 . A A . 7 GLY C 1 1 14 9394 1 1 7 GLY CA C 7.366 9.517 6.994 1.00 . A A . 7 GLY CA 1 1 14 9395 1 1 7 GLY H H 5.607 8.375 7.266 1.00 . A A . 7 GLY H 1 1 14 9396 1 1 7 GLY HA2 H 7.564 10.571 7.123 1.00 . A A . 7 GLY HA2 1 1 14 9397 1 1 7 GLY HA3 H 8.084 8.955 7.574 1.00 . A A . 7 GLY HA3 1 1 14 9398 1 1 7 GLY N N 6.037 9.228 7.489 1.00 . A A . 7 GLY N 1 1 14 9399 1 1 7 GLY O O 8.586 9.450 4.942 1.00 . A A . 7 GLY O 1 1 14 9400 1 1 8 PHE C C 6.004 9.205 2.606 1.00 . A A . 8 PHE C 1 1 14 9401 1 1 8 PHE CA C 6.609 8.151 3.525 1.00 . A A . 8 PHE CA 1 1 14 9402 1 1 8 PHE CB C 5.907 6.816 3.298 1.00 . A A . 8 PHE CB 1 1 14 9403 1 1 8 PHE CD1 C 7.479 5.117 4.268 1.00 . A A . 8 PHE CD1 1 1 14 9404 1 1 8 PHE CD2 C 7.121 5.115 1.909 1.00 . A A . 8 PHE CD2 1 1 14 9405 1 1 8 PHE CE1 C 8.352 4.052 4.139 1.00 . A A . 8 PHE CE1 1 1 14 9406 1 1 8 PHE CE2 C 7.994 4.051 1.774 1.00 . A A . 8 PHE CE2 1 1 14 9407 1 1 8 PHE CG C 6.854 5.659 3.156 1.00 . A A . 8 PHE CG 1 1 14 9408 1 1 8 PHE CZ C 8.609 3.519 2.890 1.00 . A A . 8 PHE CZ 1 1 14 9409 1 1 8 PHE H H 5.716 8.325 5.442 1.00 . A A . 8 PHE H 1 1 14 9410 1 1 8 PHE HA H 7.653 8.039 3.277 1.00 . A A . 8 PHE HA 1 1 14 9411 1 1 8 PHE HB2 H 5.253 6.616 4.132 1.00 . A A . 8 PHE HB2 1 1 14 9412 1 1 8 PHE HB3 H 5.318 6.878 2.395 1.00 . A A . 8 PHE HB3 1 1 14 9413 1 1 8 PHE HD1 H 7.277 5.532 5.243 1.00 . A A . 8 PHE HD1 1 1 14 9414 1 1 8 PHE HD2 H 6.640 5.531 1.036 1.00 . A A . 8 PHE HD2 1 1 14 9415 1 1 8 PHE HE1 H 8.832 3.638 5.013 1.00 . A A . 8 PHE HE1 1 1 14 9416 1 1 8 PHE HE2 H 8.193 3.637 0.797 1.00 . A A . 8 PHE HE2 1 1 14 9417 1 1 8 PHE HZ H 9.291 2.688 2.788 1.00 . A A . 8 PHE HZ 1 1 14 9418 1 1 8 PHE N N 6.529 8.540 4.929 1.00 . A A . 8 PHE N 1 1 14 9419 1 1 8 PHE O O 5.586 10.275 3.045 1.00 . A A . 8 PHE O 1 1 14 9420 1 1 9 SER C C 5.270 8.984 -1.016 1.00 . A A . 9 SER C 1 1 14 9421 1 1 9 SER CA C 5.414 9.750 0.295 1.00 . A A . 9 SER CA 1 1 14 9422 1 1 9 SER CB C 6.318 10.969 0.095 1.00 . A A . 9 SER CB 1 1 14 9423 1 1 9 SER H H 6.313 7.995 1.053 1.00 . A A . 9 SER H 1 1 14 9424 1 1 9 SER HA H 4.438 10.077 0.621 1.00 . A A . 9 SER HA 1 1 14 9425 1 1 9 SER HB2 H 7.349 10.673 0.215 1.00 . A A . 9 SER HB2 1 1 14 9426 1 1 9 SER HB3 H 6.170 11.363 -0.900 1.00 . A A . 9 SER HB3 1 1 14 9427 1 1 9 SER HG H 6.806 12.177 1.558 1.00 . A A . 9 SER HG 1 1 14 9428 1 1 9 SER N N 5.963 8.871 1.321 1.00 . A A . 9 SER N 1 1 14 9429 1 1 9 SER O O 5.985 8.010 -1.251 1.00 . A A . 9 SER O 1 1 14 9430 1 1 9 SER OG O 6.023 11.985 1.037 1.00 . A A . 9 SER OG 1 1 14 9431 1 1 10 CYS C C 3.658 9.717 -4.222 1.00 . A A . 10 CYS C 1 1 14 9432 1 1 10 CYS CA C 4.121 8.741 -3.139 1.00 . A A . 10 CYS CA 1 1 14 9433 1 1 10 CYS CB C 3.117 7.605 -2.968 1.00 . A A . 10 CYS CB 1 1 14 9434 1 1 10 CYS H H 3.794 10.192 -1.627 1.00 . A A . 10 CYS H 1 1 14 9435 1 1 10 CYS HA H 5.065 8.319 -3.447 1.00 . A A . 10 CYS HA 1 1 14 9436 1 1 10 CYS HB2 H 3.047 7.348 -1.921 1.00 . A A . 10 CYS HB2 1 1 14 9437 1 1 10 CYS HB3 H 2.150 7.934 -3.318 1.00 . A A . 10 CYS HB3 1 1 14 9438 1 1 10 CYS N N 4.343 9.415 -1.865 1.00 . A A . 10 CYS N 1 1 14 9439 1 1 10 CYS O O 3.672 10.932 -4.025 1.00 . A A . 10 CYS O 1 1 14 9440 1 1 10 CYS SG S 3.548 6.086 -3.882 1.00 . A A . 10 CYS SG 1 1 14 9441 1 1 11 HIS C C 1.393 10.382 -6.489 1.00 . A A . 11 HIS C 1 1 14 9442 1 1 11 HIS CA C 2.874 9.988 -6.523 1.00 . A A . 11 HIS CA 1 1 14 9443 1 1 11 HIS CB C 3.178 9.247 -7.823 1.00 . A A . 11 HIS CB 1 1 14 9444 1 1 11 HIS CD2 C 5.445 8.020 -8.121 1.00 . A A . 11 HIS CD2 1 1 14 9445 1 1 11 HIS CE1 C 6.689 9.761 -8.597 1.00 . A A . 11 HIS CE1 1 1 14 9446 1 1 11 HIS CG C 4.643 9.111 -8.101 1.00 . A A . 11 HIS CG 1 1 14 9447 1 1 11 HIS H H 3.335 8.199 -5.484 1.00 . A A . 11 HIS H 1 1 14 9448 1 1 11 HIS HA H 3.464 10.892 -6.503 1.00 . A A . 11 HIS HA 1 1 14 9449 1 1 11 HIS HB2 H 2.757 8.255 -7.771 1.00 . A A . 11 HIS HB2 1 1 14 9450 1 1 11 HIS HB3 H 2.730 9.782 -8.648 1.00 . A A . 11 HIS HB3 1 1 14 9451 1 1 11 HIS HD1 H 5.164 11.120 -8.466 1.00 . A A . 11 HIS HD1 1 1 14 9452 1 1 11 HIS HD2 H 5.145 6.999 -7.926 1.00 . A A . 11 HIS HD2 1 1 14 9453 1 1 11 HIS HE1 H 7.537 10.381 -8.848 1.00 . A A . 11 HIS HE1 1 1 14 9454 1 1 11 HIS HE2 H 7.505 7.884 -8.511 1.00 . A A . 11 HIS HE2 1 1 14 9455 1 1 11 HIS N N 3.292 9.174 -5.382 1.00 . A A . 11 HIS N 1 1 14 9456 1 1 11 HIS ND1 N 5.453 10.185 -8.403 1.00 . A A . 11 HIS ND1 1 1 14 9457 1 1 11 HIS NE2 N 6.709 8.452 -8.432 1.00 . A A . 11 HIS NE2 1 1 14 9458 1 1 11 HIS O O 0.537 9.677 -5.940 1.00 . A A . 11 HIS O 1 1 14 9459 1 1 12 ASP C C -1.179 11.004 -7.796 1.00 . A A . 12 ASP C 1 1 14 9460 1 1 12 ASP CA C -0.243 12.051 -7.202 1.00 . A A . 12 ASP CA 1 1 14 9461 1 1 12 ASP CB C -0.267 13.322 -8.055 1.00 . A A . 12 ASP CB 1 1 14 9462 1 1 12 ASP CG C -1.259 14.348 -7.541 1.00 . A A . 12 ASP CG 1 1 14 9463 1 1 12 ASP H H 1.854 12.007 -7.535 1.00 . A A . 12 ASP H 1 1 14 9464 1 1 12 ASP HA H -0.574 12.289 -6.203 1.00 . A A . 12 ASP HA 1 1 14 9465 1 1 12 ASP HB2 H 0.717 13.768 -8.051 1.00 . A A . 12 ASP HB2 1 1 14 9466 1 1 12 ASP HB3 H -0.535 13.063 -9.068 1.00 . A A . 12 ASP HB3 1 1 14 9467 1 1 12 ASP N N 1.113 11.524 -7.114 1.00 . A A . 12 ASP N 1 1 14 9468 1 1 12 ASP O O -0.793 10.251 -8.690 1.00 . A A . 12 ASP O 1 1 14 9469 1 1 12 ASP OD1 O -2.287 13.943 -6.959 1.00 . A A . 12 ASP OD1 1 1 14 9470 1 1 12 ASP OD2 O -1.008 15.558 -7.722 1.00 . A A . 12 ASP OD2 1 1 14 9471 1 1 13 GLY C C -3.246 8.655 -7.060 1.00 . A A . 13 GLY C 1 1 14 9472 1 1 13 GLY CA C -3.366 9.985 -7.777 1.00 . A A . 13 GLY CA 1 1 14 9473 1 1 13 GLY H H -2.656 11.575 -6.573 1.00 . A A . 13 GLY H 1 1 14 9474 1 1 13 GLY HA2 H -4.363 10.375 -7.630 1.00 . A A . 13 GLY HA2 1 1 14 9475 1 1 13 GLY HA3 H -3.203 9.830 -8.832 1.00 . A A . 13 GLY HA3 1 1 14 9476 1 1 13 GLY N N -2.405 10.954 -7.288 1.00 . A A . 13 GLY N 1 1 14 9477 1 1 13 GLY O O -4.061 7.754 -7.263 1.00 . A A . 13 GLY O 1 1 14 9478 1 1 14 GLU C C -2.533 7.465 -4.021 1.00 . A A . 14 GLU C 1 1 14 9479 1 1 14 GLU CA C -2.016 7.313 -5.450 1.00 . A A . 14 GLU CA 1 1 14 9480 1 1 14 GLU CB C -0.531 6.935 -5.448 1.00 . A A . 14 GLU CB 1 1 14 9481 1 1 14 GLU CD C 0.401 5.972 -3.309 1.00 . A A . 14 GLU CD 1 1 14 9482 1 1 14 GLU CG C 0.176 7.223 -4.137 1.00 . A A . 14 GLU CG 1 1 14 9483 1 1 14 GLU H H -1.624 9.310 -6.091 1.00 . A A . 14 GLU H 1 1 14 9484 1 1 14 GLU HA H -2.575 6.526 -5.936 1.00 . A A . 14 GLU HA 1 1 14 9485 1 1 14 GLU HB2 H -0.439 5.881 -5.653 1.00 . A A . 14 GLU HB2 1 1 14 9486 1 1 14 GLU HB3 H -0.032 7.488 -6.230 1.00 . A A . 14 GLU HB3 1 1 14 9487 1 1 14 GLU HG2 H 1.134 7.671 -4.352 1.00 . A A . 14 GLU HG2 1 1 14 9488 1 1 14 GLU HG3 H -0.423 7.915 -3.563 1.00 . A A . 14 GLU HG3 1 1 14 9489 1 1 14 GLU N N -2.229 8.539 -6.210 1.00 . A A . 14 GLU N 1 1 14 9490 1 1 14 GLU O O -2.868 8.568 -3.586 1.00 . A A . 14 GLU O 1 1 14 9491 1 1 14 GLU OE1 O 0.451 4.872 -3.898 1.00 . A A . 14 GLU OE1 1 1 14 9492 1 1 14 GLU OE2 O 0.535 6.095 -2.074 1.00 . A A . 14 GLU OE2 1 1 14 9493 1 1 15 THR C C -2.079 5.562 -1.037 1.00 . A A . 15 THR C 1 1 14 9494 1 1 15 THR CA C -3.044 6.356 -1.909 1.00 . A A . 15 THR CA 1 1 14 9495 1 1 15 THR CB C -4.456 5.754 -1.787 1.00 . A A . 15 THR CB 1 1 14 9496 1 1 15 THR CG2 C -4.946 5.795 -0.347 1.00 . A A . 15 THR CG2 1 1 14 9497 1 1 15 THR H H -2.296 5.506 -3.684 1.00 . A A . 15 THR H 1 1 14 9498 1 1 15 THR HA H -3.075 7.379 -1.564 1.00 . A A . 15 THR HA 1 1 14 9499 1 1 15 THR HB H -4.422 4.723 -2.112 1.00 . A A . 15 THR HB 1 1 14 9500 1 1 15 THR HG1 H -4.923 6.722 -3.442 1.00 . A A . 15 THR HG1 1 1 14 9501 1 1 15 THR HG21 H -4.224 6.315 0.265 1.00 . A A . 15 THR HG21 1 1 14 9502 1 1 15 THR HG22 H -5.069 4.787 0.021 1.00 . A A . 15 THR HG22 1 1 14 9503 1 1 15 THR HG23 H -5.894 6.311 -0.302 1.00 . A A . 15 THR HG23 1 1 14 9504 1 1 15 THR N N -2.585 6.354 -3.291 1.00 . A A . 15 THR N 1 1 14 9505 1 1 15 THR O O -1.638 4.480 -1.418 1.00 . A A . 15 THR O 1 1 14 9506 1 1 15 THR OG1 O -5.365 6.478 -2.626 1.00 . A A . 15 THR OG1 1 1 14 9507 1 1 16 CYS C C -1.568 4.535 2.022 1.00 . A A . 16 CYS C 1 1 14 9508 1 1 16 CYS CA C -0.826 5.433 1.039 1.00 . A A . 16 CYS CA 1 1 14 9509 1 1 16 CYS CB C 0.009 6.466 1.787 1.00 . A A . 16 CYS CB 1 1 14 9510 1 1 16 CYS H H -2.135 6.964 0.389 1.00 . A A . 16 CYS H 1 1 14 9511 1 1 16 CYS HA H -0.165 4.822 0.445 1.00 . A A . 16 CYS HA 1 1 14 9512 1 1 16 CYS HB2 H -0.646 7.082 2.383 1.00 . A A . 16 CYS HB2 1 1 14 9513 1 1 16 CYS HB3 H 0.709 5.955 2.435 1.00 . A A . 16 CYS HB3 1 1 14 9514 1 1 16 CYS N N -1.748 6.102 0.129 1.00 . A A . 16 CYS N 1 1 14 9515 1 1 16 CYS O O -2.537 4.955 2.655 1.00 . A A . 16 CYS O 1 1 14 9516 1 1 16 CYS SG S 0.966 7.563 0.691 1.00 . A A . 16 CYS SG 1 1 14 9517 1 1 17 CYS C C -0.721 1.942 4.156 1.00 . A A . 17 CYS C 1 1 14 9518 1 1 17 CYS CA C -1.705 2.337 3.058 1.00 . A A . 17 CYS CA 1 1 14 9519 1 1 17 CYS CB C -2.176 1.098 2.287 1.00 . A A . 17 CYS CB 1 1 14 9520 1 1 17 CYS H H -0.322 3.029 1.620 1.00 . A A . 17 CYS H 1 1 14 9521 1 1 17 CYS HA H -2.562 2.810 3.514 1.00 . A A . 17 CYS HA 1 1 14 9522 1 1 17 CYS HB2 H -3.183 0.861 2.591 1.00 . A A . 17 CYS HB2 1 1 14 9523 1 1 17 CYS HB3 H -2.172 1.322 1.229 1.00 . A A . 17 CYS HB3 1 1 14 9524 1 1 17 CYS N N -1.098 3.299 2.149 1.00 . A A . 17 CYS N 1 1 14 9525 1 1 17 CYS O O 0.408 1.543 3.876 1.00 . A A . 17 CYS O 1 1 14 9526 1 1 17 CYS SG S -1.157 -0.396 2.542 1.00 . A A . 17 CYS SG 1 1 14 9527 1 1 18 PRO C C -0.397 0.256 6.953 1.00 . A A . 18 PRO C 1 1 14 9528 1 1 18 PRO CA C -0.288 1.728 6.566 1.00 . A A . 18 PRO CA 1 1 14 9529 1 1 18 PRO CB C -0.860 2.617 7.666 1.00 . A A . 18 PRO CB 1 1 14 9530 1 1 18 PRO CD C -2.459 2.547 5.860 1.00 . A A . 18 PRO CD 1 1 14 9531 1 1 18 PRO CG C -2.321 2.694 7.358 1.00 . A A . 18 PRO CG 1 1 14 9532 1 1 18 PRO HA H 0.747 1.985 6.387 1.00 . A A . 18 PRO HA 1 1 14 9533 1 1 18 PRO HB2 H -0.680 2.164 8.630 1.00 . A A . 18 PRO HB2 1 1 14 9534 1 1 18 PRO HB3 H -0.398 3.591 7.626 1.00 . A A . 18 PRO HB3 1 1 14 9535 1 1 18 PRO HD2 H -3.226 1.826 5.619 1.00 . A A . 18 PRO HD2 1 1 14 9536 1 1 18 PRO HD3 H -2.686 3.500 5.408 1.00 . A A . 18 PRO HD3 1 1 14 9537 1 1 18 PRO HG2 H -2.842 1.892 7.860 1.00 . A A . 18 PRO HG2 1 1 14 9538 1 1 18 PRO HG3 H -2.710 3.650 7.676 1.00 . A A . 18 PRO HG3 1 1 14 9539 1 1 18 PRO N N -1.134 2.063 5.428 1.00 . A A . 18 PRO N 1 1 14 9540 1 1 18 PRO O O -0.811 -0.074 8.064 1.00 . A A . 18 PRO O 1 1 14 9541 1 1 19 THR C C 1.011 -2.515 7.222 1.00 . A A . 19 THR C 1 1 14 9542 1 1 19 THR CA C -0.094 -2.062 6.273 1.00 . A A . 19 THR CA 1 1 14 9543 1 1 19 THR CB C 0.010 -2.860 4.959 1.00 . A A . 19 THR CB 1 1 14 9544 1 1 19 THR CG2 C 1.393 -2.709 4.339 1.00 . A A . 19 THR CG2 1 1 14 9545 1 1 19 THR H H 0.288 -0.308 5.155 1.00 . A A . 19 THR H 1 1 14 9546 1 1 19 THR HA H -1.052 -2.278 6.724 1.00 . A A . 19 THR HA 1 1 14 9547 1 1 19 THR HB H -0.723 -2.475 4.264 1.00 . A A . 19 THR HB 1 1 14 9548 1 1 19 THR HG1 H -0.941 -4.550 4.596 1.00 . A A . 19 THR HG1 1 1 14 9549 1 1 19 THR HG21 H 1.376 -3.084 3.326 1.00 . A A . 19 THR HG21 1 1 14 9550 1 1 19 THR HG22 H 2.110 -3.270 4.920 1.00 . A A . 19 THR HG22 1 1 14 9551 1 1 19 THR HG23 H 1.672 -1.666 4.333 1.00 . A A . 19 THR HG23 1 1 14 9552 1 1 19 THR N N -0.030 -0.625 6.027 1.00 . A A . 19 THR N 1 1 14 9553 1 1 19 THR O O 1.172 -3.710 7.475 1.00 . A A . 19 THR O 1 1 14 9554 1 1 19 THR OG1 O -0.261 -4.246 5.202 1.00 . A A . 19 THR OG1 1 1 14 9555 1 1 20 SER C C 2.940 -0.814 9.769 1.00 . A A . 20 SER C 1 1 14 9556 1 1 20 SER CA C 2.856 -1.862 8.666 1.00 . A A . 20 SER CA 1 1 14 9557 1 1 20 SER CB C 4.185 -1.933 7.913 1.00 . A A . 20 SER CB 1 1 14 9558 1 1 20 SER H H 1.592 -0.624 7.510 1.00 . A A . 20 SER H 1 1 14 9559 1 1 20 SER HA H 2.653 -2.824 9.114 1.00 . A A . 20 SER HA 1 1 14 9560 1 1 20 SER HB2 H 4.322 -1.026 7.342 1.00 . A A . 20 SER HB2 1 1 14 9561 1 1 20 SER HB3 H 4.994 -2.037 8.622 1.00 . A A . 20 SER HB3 1 1 14 9562 1 1 20 SER HG H 3.400 -3.541 7.114 1.00 . A A . 20 SER HG 1 1 14 9563 1 1 20 SER N N 1.768 -1.558 7.746 1.00 . A A . 20 SER N 1 1 14 9564 1 1 20 SER O O 2.150 0.130 9.802 1.00 . A A . 20 SER O 1 1 14 9565 1 1 20 SER OG O 4.212 -3.037 7.024 1.00 . A A . 20 SER OG 1 1 14 9566 1 1 21 GLN C C 5.162 0.984 11.421 1.00 . A A . 21 GLN C 1 1 14 9567 1 1 21 GLN CA C 4.093 -0.046 11.769 1.00 . A A . 21 GLN CA 1 1 14 9568 1 1 21 GLN CB C 4.481 -0.786 13.054 1.00 . A A . 21 GLN CB 1 1 14 9569 1 1 21 GLN CD C 5.333 -2.981 13.967 1.00 . A A . 21 GLN CD 1 1 14 9570 1 1 21 GLN CG C 4.471 -2.301 12.921 1.00 . A A . 21 GLN CG 1 1 14 9571 1 1 21 GLN H H 4.505 -1.753 10.584 1.00 . A A . 21 GLN H 1 1 14 9572 1 1 21 GLN HA H 3.156 0.468 11.929 1.00 . A A . 21 GLN HA 1 1 14 9573 1 1 21 GLN HB2 H 5.476 -0.480 13.343 1.00 . A A . 21 GLN HB2 1 1 14 9574 1 1 21 GLN HB3 H 3.789 -0.510 13.835 1.00 . A A . 21 GLN HB3 1 1 14 9575 1 1 21 GLN HE21 H 6.981 -2.292 13.094 1.00 . A A . 21 GLN HE21 1 1 14 9576 1 1 21 GLN HE22 H 7.228 -3.255 14.507 1.00 . A A . 21 GLN HE22 1 1 14 9577 1 1 21 GLN HG2 H 3.455 -2.652 13.029 1.00 . A A . 21 GLN HG2 1 1 14 9578 1 1 21 GLN HG3 H 4.842 -2.566 11.942 1.00 . A A . 21 GLN HG3 1 1 14 9579 1 1 21 GLN N N 3.904 -0.982 10.667 1.00 . A A . 21 GLN N 1 1 14 9580 1 1 21 GLN NE2 N 6.646 -2.827 13.843 1.00 . A A . 21 GLN NE2 1 1 14 9581 1 1 21 GLN O O 5.104 2.130 11.868 1.00 . A A . 21 GLN O 1 1 14 9582 1 1 21 GLN OE1 O 4.824 -3.635 14.877 1.00 . A A . 21 GLN OE1 1 1 14 9583 1 1 22 THR C C 7.353 1.506 8.692 1.00 . A A . 22 THR C 1 1 14 9584 1 1 22 THR CA C 7.221 1.451 10.211 1.00 . A A . 22 THR CA 1 1 14 9585 1 1 22 THR CB C 8.566 1.003 10.813 1.00 . A A . 22 THR CB 1 1 14 9586 1 1 22 THR CG2 C 8.719 1.512 12.238 1.00 . A A . 22 THR CG2 1 1 14 9587 1 1 22 THR H H 6.127 -0.358 10.298 1.00 . A A . 22 THR H 1 1 14 9588 1 1 22 THR HA H 7.000 2.442 10.579 1.00 . A A . 22 THR HA 1 1 14 9589 1 1 22 THR HB H 9.368 1.413 10.214 1.00 . A A . 22 THR HB 1 1 14 9590 1 1 22 THR HG1 H 7.783 -0.805 10.708 1.00 . A A . 22 THR HG1 1 1 14 9591 1 1 22 THR HG21 H 8.845 2.584 12.225 1.00 . A A . 22 THR HG21 1 1 14 9592 1 1 22 THR HG22 H 9.583 1.052 12.695 1.00 . A A . 22 THR HG22 1 1 14 9593 1 1 22 THR HG23 H 7.835 1.261 12.806 1.00 . A A . 22 THR HG23 1 1 14 9594 1 1 22 THR N N 6.137 0.567 10.620 1.00 . A A . 22 THR N 1 1 14 9595 1 1 22 THR O O 8.275 2.127 8.164 1.00 . A A . 22 THR O 1 1 14 9596 1 1 22 THR OG1 O 8.660 -0.427 10.800 1.00 . A A . 22 THR OG1 1 1 14 9597 1 1 23 THR C C 5.129 1.272 5.937 1.00 . A A . 23 THR C 1 1 14 9598 1 1 23 THR CA C 6.460 0.820 6.534 1.00 . A A . 23 THR CA 1 1 14 9599 1 1 23 THR CB C 6.795 -0.587 6.003 1.00 . A A . 23 THR CB 1 1 14 9600 1 1 23 THR CG2 C 7.857 -0.515 4.915 1.00 . A A . 23 THR CG2 1 1 14 9601 1 1 23 THR H H 5.724 0.363 8.467 1.00 . A A . 23 THR H 1 1 14 9602 1 1 23 THR HA H 7.235 1.497 6.206 1.00 . A A . 23 THR HA 1 1 14 9603 1 1 23 THR HB H 5.899 -1.021 5.584 1.00 . A A . 23 THR HB 1 1 14 9604 1 1 23 THR HG1 H 6.939 -2.313 6.949 1.00 . A A . 23 THR HG1 1 1 14 9605 1 1 23 THR HG21 H 8.754 -1.012 5.256 1.00 . A A . 23 THR HG21 1 1 14 9606 1 1 23 THR HG22 H 8.079 0.519 4.696 1.00 . A A . 23 THR HG22 1 1 14 9607 1 1 23 THR HG23 H 7.493 -1.003 4.023 1.00 . A A . 23 THR HG23 1 1 14 9608 1 1 23 THR N N 6.432 0.847 7.992 1.00 . A A . 23 THR N 1 1 14 9609 1 1 23 THR O O 4.060 0.956 6.459 1.00 . A A . 23 THR O 1 1 14 9610 1 1 23 THR OG1 O 7.260 -1.417 7.075 1.00 . A A . 23 THR OG1 1 1 14 9611 1 1 24 TRP C C 3.961 1.957 2.722 1.00 . A A . 24 TRP C 1 1 14 9612 1 1 24 TRP CA C 4.027 2.515 4.143 1.00 . A A . 24 TRP CA 1 1 14 9613 1 1 24 TRP CB C 4.063 4.044 4.079 1.00 . A A . 24 TRP CB 1 1 14 9614 1 1 24 TRP CD1 C 4.030 5.218 6.356 1.00 . A A . 24 TRP CD1 1 1 14 9615 1 1 24 TRP CD2 C 2.022 5.017 5.397 1.00 . A A . 24 TRP CD2 1 1 14 9616 1 1 24 TRP CE2 C 1.864 5.676 6.630 1.00 . A A . 24 TRP CE2 1 1 14 9617 1 1 24 TRP CE3 C 0.895 4.778 4.613 1.00 . A A . 24 TRP CE3 1 1 14 9618 1 1 24 TRP CG C 3.413 4.729 5.242 1.00 . A A . 24 TRP CG 1 1 14 9619 1 1 24 TRP CH2 C -0.466 5.852 6.303 1.00 . A A . 24 TRP CH2 1 1 14 9620 1 1 24 TRP CZ2 C 0.621 6.100 7.093 1.00 . A A . 24 TRP CZ2 1 1 14 9621 1 1 24 TRP CZ3 C -0.339 5.199 5.072 1.00 . A A . 24 TRP CZ3 1 1 14 9622 1 1 24 TRP H H 6.096 2.223 4.470 1.00 . A A . 24 TRP H 1 1 14 9623 1 1 24 TRP HA H 3.149 2.198 4.693 1.00 . A A . 24 TRP HA 1 1 14 9624 1 1 24 TRP HB2 H 5.091 4.367 4.041 1.00 . A A . 24 TRP HB2 1 1 14 9625 1 1 24 TRP HB3 H 3.560 4.367 3.179 1.00 . A A . 24 TRP HB3 1 1 14 9626 1 1 24 TRP HD1 H 5.092 5.158 6.536 1.00 . A A . 24 TRP HD1 1 1 14 9627 1 1 24 TRP HE1 H 3.302 6.209 8.060 1.00 . A A . 24 TRP HE1 1 1 14 9628 1 1 24 TRP HE3 H 0.978 4.280 3.661 1.00 . A A . 24 TRP HE3 1 1 14 9629 1 1 24 TRP HH2 H -1.449 6.163 6.622 1.00 . A A . 24 TRP HH2 1 1 14 9630 1 1 24 TRP HZ2 H 0.507 6.606 8.040 1.00 . A A . 24 TRP HZ2 1 1 14 9631 1 1 24 TRP HZ3 H -1.224 5.019 4.479 1.00 . A A . 24 TRP HZ3 1 1 14 9632 1 1 24 TRP N N 5.211 2.011 4.833 1.00 . A A . 24 TRP N 1 1 14 9633 1 1 24 TRP NE1 N 3.106 5.790 7.196 1.00 . A A . 24 TRP NE1 1 1 14 9634 1 1 24 TRP O O 4.911 2.095 1.952 1.00 . A A . 24 TRP O 1 1 14 9635 1 1 25 GLY C C 1.985 1.738 0.099 1.00 . A A . 25 GLY C 1 1 14 9636 1 1 25 GLY CA C 2.682 0.780 1.044 1.00 . A A . 25 GLY CA 1 1 14 9637 1 1 25 GLY H H 2.112 1.258 3.028 1.00 . A A . 25 GLY H 1 1 14 9638 1 1 25 GLY HA2 H 3.658 0.545 0.646 1.00 . A A . 25 GLY HA2 1 1 14 9639 1 1 25 GLY HA3 H 2.104 -0.129 1.108 1.00 . A A . 25 GLY HA3 1 1 14 9640 1 1 25 GLY N N 2.838 1.335 2.377 1.00 . A A . 25 GLY N 1 1 14 9641 1 1 25 GLY O O 1.054 2.438 0.494 1.00 . A A . 25 GLY O 1 1 14 9642 1 1 26 CYS C C 0.771 1.938 -2.954 1.00 . A A . 26 CYS C 1 1 14 9643 1 1 26 CYS CA C 1.845 2.660 -2.146 1.00 . A A . 26 CYS CA 1 1 14 9644 1 1 26 CYS CB C 2.928 3.213 -3.078 1.00 . A A . 26 CYS CB 1 1 14 9645 1 1 26 CYS H H 3.183 1.194 -1.403 1.00 . A A . 26 CYS H 1 1 14 9646 1 1 26 CYS HA H 1.385 3.483 -1.621 1.00 . A A . 26 CYS HA 1 1 14 9647 1 1 26 CYS HB2 H 3.671 2.449 -3.247 1.00 . A A . 26 CYS HB2 1 1 14 9648 1 1 26 CYS HB3 H 2.476 3.485 -4.020 1.00 . A A . 26 CYS HB3 1 1 14 9649 1 1 26 CYS N N 2.436 1.774 -1.148 1.00 . A A . 26 CYS N 1 1 14 9650 1 1 26 CYS O O 1.027 0.897 -3.561 1.00 . A A . 26 CYS O 1 1 14 9651 1 1 26 CYS SG S 3.785 4.686 -2.425 1.00 . A A . 26 CYS SG 1 1 14 9652 1 1 27 CYS C C -1.969 2.814 -4.852 1.00 . A A . 27 CYS C 1 1 14 9653 1 1 27 CYS CA C -1.564 1.923 -3.676 1.00 . A A . 27 CYS CA 1 1 14 9654 1 1 27 CYS CB C -2.753 1.735 -2.730 1.00 . A A . 27 CYS CB 1 1 14 9655 1 1 27 CYS H H -0.568 3.328 -2.445 1.00 . A A . 27 CYS H 1 1 14 9656 1 1 27 CYS HA H -1.257 0.960 -4.055 1.00 . A A . 27 CYS HA 1 1 14 9657 1 1 27 CYS HB2 H -2.849 2.611 -2.107 1.00 . A A . 27 CYS HB2 1 1 14 9658 1 1 27 CYS HB3 H -3.653 1.615 -3.315 1.00 . A A . 27 CYS HB3 1 1 14 9659 1 1 27 CYS N N -0.434 2.501 -2.951 1.00 . A A . 27 CYS N 1 1 14 9660 1 1 27 CYS O O -1.861 4.036 -4.778 1.00 . A A . 27 CYS O 1 1 14 9661 1 1 27 CYS SG S -2.607 0.290 -1.628 1.00 . A A . 27 CYS SG 1 1 14 9662 1 1 28 PRO C C -4.255 3.540 -7.038 1.00 . A A . 28 PRO C 1 1 14 9663 1 1 28 PRO CA C -2.844 2.963 -7.152 1.00 . A A . 28 PRO CA 1 1 14 9664 1 1 28 PRO CB C -2.785 1.906 -8.253 1.00 . A A . 28 PRO CB 1 1 14 9665 1 1 28 PRO CD C -2.588 0.756 -6.153 1.00 . A A . 28 PRO CD 1 1 14 9666 1 1 28 PRO CG C -3.111 0.626 -7.561 1.00 . A A . 28 PRO CG 1 1 14 9667 1 1 28 PRO HA H -2.149 3.758 -7.377 1.00 . A A . 28 PRO HA 1 1 14 9668 1 1 28 PRO HB2 H -3.510 2.139 -9.020 1.00 . A A . 28 PRO HB2 1 1 14 9669 1 1 28 PRO HB3 H -1.794 1.882 -8.680 1.00 . A A . 28 PRO HB3 1 1 14 9670 1 1 28 PRO HD2 H -3.300 0.351 -5.449 1.00 . A A . 28 PRO HD2 1 1 14 9671 1 1 28 PRO HD3 H -1.637 0.253 -6.057 1.00 . A A . 28 PRO HD3 1 1 14 9672 1 1 28 PRO HG2 H -4.181 0.480 -7.550 1.00 . A A . 28 PRO HG2 1 1 14 9673 1 1 28 PRO HG3 H -2.627 -0.196 -8.066 1.00 . A A . 28 PRO HG3 1 1 14 9674 1 1 28 PRO N N -2.435 2.212 -5.963 1.00 . A A . 28 PRO N 1 1 14 9675 1 1 28 PRO O O -4.453 4.747 -7.182 1.00 . A A . 28 PRO O 1 1 14 9676 1 1 29 SER C C -6.798 4.132 -5.562 1.00 . A A . 29 SER C 1 1 14 9677 1 1 29 SER CA C -6.624 3.088 -6.666 1.00 . A A . 29 SER CA 1 1 14 9678 1 1 29 SER CB C -7.515 1.876 -6.387 1.00 . A A . 29 SER CB 1 1 14 9679 1 1 29 SER H H -5.009 1.721 -6.692 1.00 . A A . 29 SER H 1 1 14 9680 1 1 29 SER HA H -6.919 3.527 -7.607 1.00 . A A . 29 SER HA 1 1 14 9681 1 1 29 SER HB2 H -7.212 1.415 -5.459 1.00 . A A . 29 SER HB2 1 1 14 9682 1 1 29 SER HB3 H -8.543 2.198 -6.311 1.00 . A A . 29 SER HB3 1 1 14 9683 1 1 29 SER HG H -8.282 0.752 -7.797 1.00 . A A . 29 SER HG 1 1 14 9684 1 1 29 SER N N -5.230 2.669 -6.789 1.00 . A A . 29 SER N 1 1 14 9685 1 1 29 SER O O -6.039 4.156 -4.594 1.00 . A A . 29 SER O 1 1 14 9686 1 1 29 SER OG O -7.412 0.918 -7.426 1.00 . A A . 29 SER OG 1 1 14 9687 1 1 30 PRO C C -8.449 5.517 -3.341 1.00 . A A . 30 PRO C 1 1 14 9688 1 1 30 PRO CA C -8.078 6.074 -4.717 1.00 . A A . 30 PRO CA 1 1 14 9689 1 1 30 PRO CB C -9.261 6.845 -5.324 1.00 . A A . 30 PRO CB 1 1 14 9690 1 1 30 PRO CD C -8.751 5.063 -6.829 1.00 . A A . 30 PRO CD 1 1 14 9691 1 1 30 PRO CG C -9.286 6.462 -6.764 1.00 . A A . 30 PRO CG 1 1 14 9692 1 1 30 PRO HA H -7.232 6.737 -4.614 1.00 . A A . 30 PRO HA 1 1 14 9693 1 1 30 PRO HB2 H -10.173 6.557 -4.824 1.00 . A A . 30 PRO HB2 1 1 14 9694 1 1 30 PRO HB3 H -9.099 7.907 -5.202 1.00 . A A . 30 PRO HB3 1 1 14 9695 1 1 30 PRO HD2 H -9.547 4.346 -6.696 1.00 . A A . 30 PRO HD2 1 1 14 9696 1 1 30 PRO HD3 H -8.240 4.896 -7.766 1.00 . A A . 30 PRO HD3 1 1 14 9697 1 1 30 PRO HG2 H -10.301 6.492 -7.134 1.00 . A A . 30 PRO HG2 1 1 14 9698 1 1 30 PRO HG3 H -8.658 7.131 -7.333 1.00 . A A . 30 PRO HG3 1 1 14 9699 1 1 30 PRO N N -7.806 5.017 -5.701 1.00 . A A . 30 PRO N 1 1 14 9700 1 1 30 PRO O O -7.575 5.238 -2.521 1.00 . A A . 30 PRO O 1 1 14 9701 1 1 31 LYS C C -10.096 3.335 -1.723 1.00 . A A . 31 LYS C 1 1 14 9702 1 1 31 LYS CA C -10.223 4.855 -1.804 1.00 . A A . 31 LYS CA 1 1 14 9703 1 1 31 LYS CB C -11.678 5.268 -1.579 1.00 . A A . 31 LYS CB 1 1 14 9704 1 1 31 LYS CD C -13.117 6.837 -0.246 1.00 . A A . 31 LYS CD 1 1 14 9705 1 1 31 LYS CE C -13.192 8.195 0.431 1.00 . A A . 31 LYS CE 1 1 14 9706 1 1 31 LYS CG C -11.832 6.681 -1.043 1.00 . A A . 31 LYS CG 1 1 14 9707 1 1 31 LYS H H -10.401 5.611 -3.774 1.00 . A A . 31 LYS H 1 1 14 9708 1 1 31 LYS HA H -9.613 5.295 -1.029 1.00 . A A . 31 LYS HA 1 1 14 9709 1 1 31 LYS HB2 H -12.208 5.203 -2.518 1.00 . A A . 31 LYS HB2 1 1 14 9710 1 1 31 LYS HB3 H -12.128 4.587 -0.873 1.00 . A A . 31 LYS HB3 1 1 14 9711 1 1 31 LYS HD2 H -13.959 6.733 -0.915 1.00 . A A . 31 LYS HD2 1 1 14 9712 1 1 31 LYS HD3 H -13.157 6.065 0.508 1.00 . A A . 31 LYS HD3 1 1 14 9713 1 1 31 LYS HE2 H -12.472 8.223 1.235 1.00 . A A . 31 LYS HE2 1 1 14 9714 1 1 31 LYS HE3 H -12.951 8.958 -0.295 1.00 . A A . 31 LYS HE3 1 1 14 9715 1 1 31 LYS HG2 H -10.994 6.907 -0.400 1.00 . A A . 31 LYS HG2 1 1 14 9716 1 1 31 LYS HG3 H -11.848 7.372 -1.873 1.00 . A A . 31 LYS HG3 1 1 14 9717 1 1 31 LYS HZ1 H -14.822 7.706 1.643 1.00 . A A . 31 LYS HZ1 1 1 14 9718 1 1 31 LYS HZ2 H -15.246 8.512 0.217 1.00 . A A . 31 LYS HZ2 1 1 14 9719 1 1 31 LYS HZ3 H -14.550 9.370 1.498 1.00 . A A . 31 LYS HZ3 1 1 14 9720 1 1 31 LYS N N -9.748 5.366 -3.087 1.00 . A A . 31 LYS N 1 1 14 9721 1 1 31 LYS NZ N -14.547 8.465 0.985 1.00 . A A . 31 LYS NZ 1 1 14 9722 1 1 31 LYS O O -10.945 2.663 -1.137 1.00 . A A . 31 LYS O 1 1 14 9723 1 1 32 ALA C C -8.625 0.846 -0.875 1.00 . A A . 32 ALA C 1 1 14 9724 1 1 32 ALA CA C -8.789 1.364 -2.300 1.00 . A A . 32 ALA CA 1 1 14 9725 1 1 32 ALA CB C -7.550 1.037 -3.119 1.00 . A A . 32 ALA CB 1 1 14 9726 1 1 32 ALA H H -8.387 3.389 -2.758 1.00 . A A . 32 ALA H 1 1 14 9727 1 1 32 ALA HA H -9.634 0.875 -2.762 1.00 . A A . 32 ALA HA 1 1 14 9728 1 1 32 ALA HB1 H -6.689 1.000 -2.467 1.00 . A A . 32 ALA HB1 1 1 14 9729 1 1 32 ALA HB2 H -7.403 1.800 -3.868 1.00 . A A . 32 ALA HB2 1 1 14 9730 1 1 32 ALA HB3 H -7.681 0.080 -3.599 1.00 . A A . 32 ALA HB3 1 1 14 9731 1 1 32 ALA N N -9.030 2.802 -2.311 1.00 . A A . 32 ALA N 1 1 14 9732 1 1 32 ALA O O -8.345 1.614 0.047 1.00 . A A . 32 ALA O 1 1 14 9733 1 1 33 VAL C C -7.333 -1.881 0.647 1.00 . A A . 33 VAL C 1 1 14 9734 1 1 33 VAL CA C -8.635 -1.093 0.597 1.00 . A A . 33 VAL CA 1 1 14 9735 1 1 33 VAL CB C -9.810 -2.041 0.907 1.00 . A A . 33 VAL CB 1 1 14 9736 1 1 33 VAL CG1 C -9.982 -2.203 2.409 1.00 . A A . 33 VAL CG1 1 1 14 9737 1 1 33 VAL CG2 C -11.093 -1.535 0.265 1.00 . A A . 33 VAL CG2 1 1 14 9738 1 1 33 VAL H H -8.988 -1.022 -1.480 1.00 . A A . 33 VAL H 1 1 14 9739 1 1 33 VAL HA H -8.609 -0.316 1.349 1.00 . A A . 33 VAL HA 1 1 14 9740 1 1 33 VAL HB H -9.581 -3.010 0.488 1.00 . A A . 33 VAL HB 1 1 14 9741 1 1 33 VAL HG11 H -9.668 -1.299 2.909 1.00 . A A . 33 VAL HG11 1 1 14 9742 1 1 33 VAL HG12 H -9.380 -3.032 2.754 1.00 . A A . 33 VAL HG12 1 1 14 9743 1 1 33 VAL HG13 H -11.021 -2.396 2.634 1.00 . A A . 33 VAL HG13 1 1 14 9744 1 1 33 VAL HG21 H -10.973 -0.497 -0.011 1.00 . A A . 33 VAL HG21 1 1 14 9745 1 1 33 VAL HG22 H -11.909 -1.630 0.966 1.00 . A A . 33 VAL HG22 1 1 14 9746 1 1 33 VAL HG23 H -11.308 -2.120 -0.618 1.00 . A A . 33 VAL HG23 1 1 14 9747 1 1 33 VAL N N -8.783 -0.462 -0.707 1.00 . A A . 33 VAL N 1 1 14 9748 1 1 33 VAL O O -7.193 -2.901 -0.026 1.00 . A A . 33 VAL O 1 1 14 9749 1 1 34 CYS C C -5.212 -3.416 2.237 1.00 . A A . 34 CYS C 1 1 14 9750 1 1 34 CYS CA C -5.087 -2.062 1.550 1.00 . A A . 34 CYS CA 1 1 14 9751 1 1 34 CYS CB C -4.108 -1.167 2.314 1.00 . A A . 34 CYS CB 1 1 14 9752 1 1 34 CYS H H -6.545 -0.584 1.949 1.00 . A A . 34 CYS H 1 1 14 9753 1 1 34 CYS HA H -4.708 -2.215 0.553 1.00 . A A . 34 CYS HA 1 1 14 9754 1 1 34 CYS HB2 H -3.928 -0.277 1.734 1.00 . A A . 34 CYS HB2 1 1 14 9755 1 1 34 CYS HB3 H -4.543 -0.890 3.265 1.00 . A A . 34 CYS HB3 1 1 14 9756 1 1 34 CYS N N -6.380 -1.401 1.434 1.00 . A A . 34 CYS N 1 1 14 9757 1 1 34 CYS O O -5.408 -3.491 3.451 1.00 . A A . 34 CYS O 1 1 14 9758 1 1 34 CYS SG S -2.490 -1.936 2.647 1.00 . A A . 34 CYS SG 1 1 14 9759 1 1 35 CYS C C -4.153 -5.999 3.120 1.00 . A A . 35 CYS C 1 1 14 9760 1 1 35 CYS CA C -5.158 -5.840 1.988 1.00 . A A . 35 CYS CA 1 1 14 9761 1 1 35 CYS CB C -4.894 -6.873 0.891 1.00 . A A . 35 CYS CB 1 1 14 9762 1 1 35 CYS H H -4.910 -4.358 0.495 1.00 . A A . 35 CYS H 1 1 14 9763 1 1 35 CYS HA H -6.154 -5.985 2.380 1.00 . A A . 35 CYS HA 1 1 14 9764 1 1 35 CYS HB2 H -3.946 -6.656 0.423 1.00 . A A . 35 CYS HB2 1 1 14 9765 1 1 35 CYS HB3 H -4.853 -7.857 1.335 1.00 . A A . 35 CYS HB3 1 1 14 9766 1 1 35 CYS N N -5.079 -4.486 1.452 1.00 . A A . 35 CYS N 1 1 14 9767 1 1 35 CYS O O -2.937 -6.010 2.890 1.00 . A A . 35 CYS O 1 1 14 9768 1 1 35 CYS SG S -6.161 -6.907 -0.420 1.00 . A A . 35 CYS SG 1 1 14 9769 1 1 36 ASP C C -3.643 -7.683 5.937 1.00 . A A . 36 ASP C 1 1 14 9770 1 1 36 ASP CA C -3.849 -6.229 5.531 1.00 . A A . 36 ASP CA 1 1 14 9771 1 1 36 ASP CB C -4.474 -5.455 6.693 1.00 . A A . 36 ASP CB 1 1 14 9772 1 1 36 ASP CG C -3.637 -4.260 7.105 1.00 . A A . 36 ASP CG 1 1 14 9773 1 1 36 ASP H H -5.653 -6.075 4.437 1.00 . A A . 36 ASP H 1 1 14 9774 1 1 36 ASP HA H -2.886 -5.795 5.307 1.00 . A A . 36 ASP HA 1 1 14 9775 1 1 36 ASP HB2 H -5.450 -5.102 6.398 1.00 . A A . 36 ASP HB2 1 1 14 9776 1 1 36 ASP HB3 H -4.574 -6.113 7.544 1.00 . A A . 36 ASP HB3 1 1 14 9777 1 1 36 ASP N N -4.678 -6.100 4.340 1.00 . A A . 36 ASP N 1 1 14 9778 1 1 36 ASP O O -2.771 -7.977 6.756 1.00 . A A . 36 ASP O 1 1 14 9779 1 1 36 ASP OD1 O -2.720 -4.436 7.934 1.00 . A A . 36 ASP OD1 1 1 14 9780 1 1 36 ASP OD2 O -3.897 -3.149 6.598 1.00 . A A . 36 ASP OD2 1 1 14 9781 1 1 37 ASP C C -2.850 -10.451 5.505 1.00 . A A . 37 ASP C 1 1 14 9782 1 1 37 ASP CA C -4.294 -10.010 5.695 1.00 . A A . 37 ASP CA 1 1 14 9783 1 1 37 ASP CB C -5.223 -10.852 4.816 1.00 . A A . 37 ASP CB 1 1 14 9784 1 1 37 ASP CG C -6.194 -11.684 5.631 1.00 . A A . 37 ASP CG 1 1 14 9785 1 1 37 ASP H H -5.110 -8.326 4.716 1.00 . A A . 37 ASP H 1 1 14 9786 1 1 37 ASP HA H -4.569 -10.143 6.731 1.00 . A A . 37 ASP HA 1 1 14 9787 1 1 37 ASP HB2 H -5.792 -10.196 4.174 1.00 . A A . 37 ASP HB2 1 1 14 9788 1 1 37 ASP HB3 H -4.628 -11.517 4.208 1.00 . A A . 37 ASP HB3 1 1 14 9789 1 1 37 ASP N N -4.430 -8.595 5.369 1.00 . A A . 37 ASP N 1 1 14 9790 1 1 37 ASP O O -2.296 -11.187 6.321 1.00 . A A . 37 ASP O 1 1 14 9791 1 1 37 ASP OD1 O -7.389 -11.725 5.270 1.00 . A A . 37 ASP OD1 1 1 14 9792 1 1 37 ASP OD2 O -5.759 -12.296 6.630 1.00 . A A . 37 ASP OD2 1 1 14 9793 1 1 38 MET C C -0.111 -9.010 3.728 1.00 . A A . 38 MET C 1 1 14 9794 1 1 38 MET CA C -0.857 -10.283 4.114 1.00 . A A . 38 MET CA 1 1 14 9795 1 1 38 MET CB C -0.776 -11.309 2.980 1.00 . A A . 38 MET CB 1 1 14 9796 1 1 38 MET CE C -4.161 -12.260 1.594 1.00 . A A . 38 MET CE 1 1 14 9797 1 1 38 MET CG C -1.824 -12.405 3.073 1.00 . A A . 38 MET CG 1 1 14 9798 1 1 38 MET H H -2.744 -9.379 3.824 1.00 . A A . 38 MET H 1 1 14 9799 1 1 38 MET HA H -0.403 -10.699 5.001 1.00 . A A . 38 MET HA 1 1 14 9800 1 1 38 MET HB2 H -0.904 -10.797 2.038 1.00 . A A . 38 MET HB2 1 1 14 9801 1 1 38 MET HB3 H 0.200 -11.771 2.999 1.00 . A A . 38 MET HB3 1 1 14 9802 1 1 38 MET HE1 H -4.629 -12.681 2.472 1.00 . A A . 38 MET HE1 1 1 14 9803 1 1 38 MET HE2 H -4.719 -12.548 0.716 1.00 . A A . 38 MET HE2 1 1 14 9804 1 1 38 MET HE3 H -4.145 -11.183 1.675 1.00 . A A . 38 MET HE3 1 1 14 9805 1 1 38 MET HG2 H -1.375 -13.276 3.529 1.00 . A A . 38 MET HG2 1 1 14 9806 1 1 38 MET HG3 H -2.637 -12.055 3.692 1.00 . A A . 38 MET HG3 1 1 14 9807 1 1 38 MET N N -2.244 -9.971 4.424 1.00 . A A . 38 MET N 1 1 14 9808 1 1 38 MET O O 0.364 -8.273 4.592 1.00 . A A . 38 MET O 1 1 14 9809 1 1 38 MET SD S -2.483 -12.873 1.462 1.00 . A A . 38 MET SD 1 1 14 9810 1 1 39 GLN C C 0.028 -7.167 0.556 1.00 . A A . 39 GLN C 1 1 14 9811 1 1 39 GLN CA C 0.593 -7.521 1.929 1.00 . A A . 39 GLN CA 1 1 14 9812 1 1 39 GLN CB C 2.108 -7.717 1.841 1.00 . A A . 39 GLN CB 1 1 14 9813 1 1 39 GLN CD C 3.860 -7.167 3.573 1.00 . A A . 39 GLN CD 1 1 14 9814 1 1 39 GLN CG C 2.904 -6.623 2.531 1.00 . A A . 39 GLN CG 1 1 14 9815 1 1 39 GLN H H -0.492 -9.319 1.783 1.00 . A A . 39 GLN H 1 1 14 9816 1 1 39 GLN HA H 0.377 -6.718 2.618 1.00 . A A . 39 GLN HA 1 1 14 9817 1 1 39 GLN HB2 H 2.364 -8.661 2.298 1.00 . A A . 39 GLN HB2 1 1 14 9818 1 1 39 GLN HB3 H 2.396 -7.741 0.800 1.00 . A A . 39 GLN HB3 1 1 14 9819 1 1 39 GLN HE21 H 3.205 -5.841 4.902 1.00 . A A . 39 GLN HE21 1 1 14 9820 1 1 39 GLN HE22 H 4.439 -6.915 5.459 1.00 . A A . 39 GLN HE22 1 1 14 9821 1 1 39 GLN HG2 H 3.475 -6.086 1.788 1.00 . A A . 39 GLN HG2 1 1 14 9822 1 1 39 GLN HG3 H 2.215 -5.945 3.014 1.00 . A A . 39 GLN HG3 1 1 14 9823 1 1 39 GLN N N -0.048 -8.731 2.428 1.00 . A A . 39 GLN N 1 1 14 9824 1 1 39 GLN NE2 N 3.833 -6.582 4.765 1.00 . A A . 39 GLN NE2 1 1 14 9825 1 1 39 GLN O O 0.623 -7.519 -0.462 1.00 . A A . 39 GLN O 1 1 14 9826 1 1 39 GLN OE1 O 4.615 -8.104 3.312 1.00 . A A . 39 GLN OE1 1 1 14 9827 1 1 40 HIS C C -2.668 -4.987 -0.734 1.00 . A A . 40 HIS C 1 1 14 9828 1 1 40 HIS CA C -1.714 -6.173 -0.789 1.00 . A A . 40 HIS CA 1 1 14 9829 1 1 40 HIS CB C -2.445 -7.397 -1.346 1.00 . A A . 40 HIS CB 1 1 14 9830 1 1 40 HIS CD2 C -1.152 -7.868 -3.548 1.00 . A A . 40 HIS CD2 1 1 14 9831 1 1 40 HIS CE1 C -2.838 -7.730 -4.943 1.00 . A A . 40 HIS CE1 1 1 14 9832 1 1 40 HIS CG C -2.260 -7.592 -2.820 1.00 . A A . 40 HIS CG 1 1 14 9833 1 1 40 HIS H H -1.588 -6.264 1.348 1.00 . A A . 40 HIS H 1 1 14 9834 1 1 40 HIS HA H -0.905 -5.926 -1.458 1.00 . A A . 40 HIS HA 1 1 14 9835 1 1 40 HIS HB2 H -2.079 -8.282 -0.848 1.00 . A A . 40 HIS HB2 1 1 14 9836 1 1 40 HIS HB3 H -3.502 -7.293 -1.154 1.00 . A A . 40 HIS HB3 1 1 14 9837 1 1 40 HIS HD1 H -4.234 -7.322 -3.504 1.00 . A A . 40 HIS HD1 1 1 14 9838 1 1 40 HIS HD2 H -0.149 -8.000 -3.165 1.00 . A A . 40 HIS HD2 1 1 14 9839 1 1 40 HIS HE1 H -3.424 -7.727 -5.850 1.00 . A A . 40 HIS HE1 1 1 14 9840 1 1 40 HIS HE2 H -0.949 -8.141 -5.621 1.00 . A A . 40 HIS HE2 1 1 14 9841 1 1 40 HIS N N -1.125 -6.501 0.510 1.00 . A A . 40 HIS N 1 1 14 9842 1 1 40 HIS ND1 N -3.299 -7.510 -3.724 1.00 . A A . 40 HIS ND1 1 1 14 9843 1 1 40 HIS NE2 N -1.540 -7.948 -4.863 1.00 . A A . 40 HIS NE2 1 1 14 9844 1 1 40 HIS O O -2.814 -4.328 0.295 1.00 . A A . 40 HIS O 1 1 14 9845 1 1 41 CYS C C -5.424 -4.072 -2.907 1.00 . A A . 41 CYS C 1 1 14 9846 1 1 41 CYS CA C -4.264 -3.641 -2.014 1.00 . A A . 41 CYS CA 1 1 14 9847 1 1 41 CYS CB C -3.576 -2.411 -2.612 1.00 . A A . 41 CYS CB 1 1 14 9848 1 1 41 CYS H H -3.136 -5.303 -2.651 1.00 . A A . 41 CYS H 1 1 14 9849 1 1 41 CYS HA H -4.644 -3.397 -1.033 1.00 . A A . 41 CYS HA 1 1 14 9850 1 1 41 CYS HB2 H -2.530 -2.431 -2.346 1.00 . A A . 41 CYS HB2 1 1 14 9851 1 1 41 CYS HB3 H -3.670 -2.445 -3.688 1.00 . A A . 41 CYS HB3 1 1 14 9852 1 1 41 CYS N N -3.311 -4.734 -1.873 1.00 . A A . 41 CYS N 1 1 14 9853 1 1 41 CYS O O -5.240 -4.850 -3.843 1.00 . A A . 41 CYS O 1 1 14 9854 1 1 41 CYS SG S -4.258 -0.819 -2.047 1.00 . A A . 41 CYS SG 1 1 14 9855 1 1 42 CYS C C -8.487 -2.649 -3.916 1.00 . A A . 42 CYS C 1 1 14 9856 1 1 42 CYS CA C -7.803 -3.911 -3.392 1.00 . A A . 42 CYS CA 1 1 14 9857 1 1 42 CYS CB C -8.782 -4.724 -2.541 1.00 . A A . 42 CYS CB 1 1 14 9858 1 1 42 CYS H H -6.704 -2.957 -1.855 1.00 . A A . 42 CYS H 1 1 14 9859 1 1 42 CYS HA H -7.486 -4.510 -4.232 1.00 . A A . 42 CYS HA 1 1 14 9860 1 1 42 CYS HB2 H -8.521 -4.607 -1.499 1.00 . A A . 42 CYS HB2 1 1 14 9861 1 1 42 CYS HB3 H -9.783 -4.348 -2.699 1.00 . A A . 42 CYS HB3 1 1 14 9862 1 1 42 CYS N N -6.618 -3.569 -2.612 1.00 . A A . 42 CYS N 1 1 14 9863 1 1 42 CYS O O -8.828 -1.758 -3.142 1.00 . A A . 42 CYS O 1 1 14 9864 1 1 42 CYS SG S -8.794 -6.511 -2.908 1.00 . A A . 42 CYS SG 1 1 14 9865 1 1 43 PRO C C -10.620 -0.966 -5.163 1.00 . A A . 43 PRO C 1 1 14 9866 1 1 43 PRO CA C -9.332 -1.387 -5.864 1.00 . A A . 43 PRO CA 1 1 14 9867 1 1 43 PRO CB C -9.620 -1.870 -7.283 1.00 . A A . 43 PRO CB 1 1 14 9868 1 1 43 PRO CD C -8.312 -3.565 -6.248 1.00 . A A . 43 PRO CD 1 1 14 9869 1 1 43 PRO CG C -8.533 -2.847 -7.550 1.00 . A A . 43 PRO CG 1 1 14 9870 1 1 43 PRO HA H -8.657 -0.545 -5.902 1.00 . A A . 43 PRO HA 1 1 14 9871 1 1 43 PRO HB2 H -10.595 -2.336 -7.320 1.00 . A A . 43 PRO HB2 1 1 14 9872 1 1 43 PRO HB3 H -9.582 -1.037 -7.968 1.00 . A A . 43 PRO HB3 1 1 14 9873 1 1 43 PRO HD2 H -8.951 -4.435 -6.185 1.00 . A A . 43 PRO HD2 1 1 14 9874 1 1 43 PRO HD3 H -7.276 -3.846 -6.142 1.00 . A A . 43 PRO HD3 1 1 14 9875 1 1 43 PRO HG2 H -8.837 -3.540 -8.320 1.00 . A A . 43 PRO HG2 1 1 14 9876 1 1 43 PRO HG3 H -7.636 -2.322 -7.843 1.00 . A A . 43 PRO HG3 1 1 14 9877 1 1 43 PRO N N -8.692 -2.553 -5.242 1.00 . A A . 43 PRO N 1 1 14 9878 1 1 43 PRO O O -11.506 -1.789 -4.908 1.00 . A A . 43 PRO O 1 1 14 9879 1 1 44 ALA C C -13.156 0.307 -4.716 1.00 . A A . 44 ALA C 1 1 14 9880 1 1 44 ALA CA C -11.860 0.894 -4.174 1.00 . A A . 44 ALA CA 1 1 14 9881 1 1 44 ALA CB C -11.865 2.408 -4.320 1.00 . A A . 44 ALA CB 1 1 14 9882 1 1 44 ALA H H -9.945 0.910 -5.075 1.00 . A A . 44 ALA H 1 1 14 9883 1 1 44 ALA HA H -11.782 0.658 -3.123 1.00 . A A . 44 ALA HA 1 1 14 9884 1 1 44 ALA HB1 H -11.803 2.669 -5.367 1.00 . A A . 44 ALA HB1 1 1 14 9885 1 1 44 ALA HB2 H -11.018 2.823 -3.795 1.00 . A A . 44 ALA HB2 1 1 14 9886 1 1 44 ALA HB3 H -12.778 2.807 -3.903 1.00 . A A . 44 ALA HB3 1 1 14 9887 1 1 44 ALA N N -10.699 0.326 -4.850 1.00 . A A . 44 ALA N 1 1 14 9888 1 1 44 ALA O O -13.528 0.549 -5.864 1.00 . A A . 44 ALA O 1 1 14 9889 1 1 45 GLY C C -15.023 -2.592 -4.285 1.00 . A A . 45 GLY C 1 1 14 9890 1 1 45 GLY CA C -15.084 -1.078 -4.289 1.00 . A A . 45 GLY CA 1 1 14 9891 1 1 45 GLY H H -13.489 -0.620 -2.977 1.00 . A A . 45 GLY H 1 1 14 9892 1 1 45 GLY HA2 H -15.866 -0.759 -3.616 1.00 . A A . 45 GLY HA2 1 1 14 9893 1 1 45 GLY HA3 H -15.325 -0.743 -5.287 1.00 . A A . 45 GLY HA3 1 1 14 9894 1 1 45 GLY N N -13.838 -0.466 -3.880 1.00 . A A . 45 GLY N 1 1 14 9895 1 1 45 GLY O O -16.029 -3.255 -4.542 1.00 . A A . 45 GLY O 1 1 14 9896 1 1 46 TYR C C -13.259 -5.065 -2.557 1.00 . A A . 46 TYR C 1 1 14 9897 1 1 46 TYR CA C -13.690 -4.602 -3.946 1.00 . A A . 46 TYR CA 1 1 14 9898 1 1 46 TYR CB C -12.663 -5.056 -4.987 1.00 . A A . 46 TYR CB 1 1 14 9899 1 1 46 TYR CD1 C -12.299 -4.893 -7.481 1.00 . A A . 46 TYR CD1 1 1 14 9900 1 1 46 TYR CD2 C -14.533 -5.155 -6.690 1.00 . A A . 46 TYR CD2 1 1 14 9901 1 1 46 TYR CE1 C -12.759 -4.875 -8.784 1.00 . A A . 46 TYR CE1 1 1 14 9902 1 1 46 TYR CE2 C -15.000 -5.137 -7.990 1.00 . A A . 46 TYR CE2 1 1 14 9903 1 1 46 TYR CG C -13.176 -5.034 -6.412 1.00 . A A . 46 TYR CG 1 1 14 9904 1 1 46 TYR CZ C -14.109 -4.997 -9.033 1.00 . A A . 46 TYR CZ 1 1 14 9905 1 1 46 TYR H H -13.072 -2.587 -3.777 1.00 . A A . 46 TYR H 1 1 14 9906 1 1 46 TYR HA H -14.646 -5.046 -4.178 1.00 . A A . 46 TYR HA 1 1 14 9907 1 1 46 TYR HB2 H -11.800 -4.409 -4.936 1.00 . A A . 46 TYR HB2 1 1 14 9908 1 1 46 TYR HB3 H -12.358 -6.068 -4.761 1.00 . A A . 46 TYR HB3 1 1 14 9909 1 1 46 TYR HD1 H -11.242 -4.798 -7.284 1.00 . A A . 46 TYR HD1 1 1 14 9910 1 1 46 TYR HD2 H -15.229 -5.263 -5.871 1.00 . A A . 46 TYR HD2 1 1 14 9911 1 1 46 TYR HE1 H -12.062 -4.765 -9.601 1.00 . A A . 46 TYR HE1 1 1 14 9912 1 1 46 TYR HE2 H -16.058 -5.232 -8.184 1.00 . A A . 46 TYR HE2 1 1 14 9913 1 1 46 TYR HH H -15.390 -4.479 -10.371 1.00 . A A . 46 TYR HH 1 1 14 9914 1 1 46 TYR N N -13.850 -3.152 -3.985 1.00 . A A . 46 TYR N 1 1 14 9915 1 1 46 TYR O O -12.858 -4.257 -1.719 1.00 . A A . 46 TYR O 1 1 14 9916 1 1 46 TYR OH O -14.571 -4.979 -10.329 1.00 . A A . 46 TYR OH 1 1 14 9917 1 1 47 LYS C C -11.812 -7.937 -1.209 1.00 . A A . 47 LYS C 1 1 14 9918 1 1 47 LYS CA C -12.958 -6.946 -1.035 1.00 . A A . 47 LYS CA 1 1 14 9919 1 1 47 LYS CB C -14.158 -7.641 -0.386 1.00 . A A . 47 LYS CB 1 1 14 9920 1 1 47 LYS CD C -13.910 -9.719 1.005 1.00 . A A . 47 LYS CD 1 1 14 9921 1 1 47 LYS CE C -15.339 -10.236 1.061 1.00 . A A . 47 LYS CE 1 1 14 9922 1 1 47 LYS CG C -13.864 -8.200 0.997 1.00 . A A . 47 LYS CG 1 1 14 9923 1 1 47 LYS H H -13.667 -6.967 -3.030 1.00 . A A . 47 LYS H 1 1 14 9924 1 1 47 LYS HA H -12.629 -6.140 -0.396 1.00 . A A . 47 LYS HA 1 1 14 9925 1 1 47 LYS HB2 H -14.967 -6.931 -0.299 1.00 . A A . 47 LYS HB2 1 1 14 9926 1 1 47 LYS HB3 H -14.473 -8.456 -1.021 1.00 . A A . 47 LYS HB3 1 1 14 9927 1 1 47 LYS HD2 H -13.440 -10.088 0.106 1.00 . A A . 47 LYS HD2 1 1 14 9928 1 1 47 LYS HD3 H -13.372 -10.081 1.869 1.00 . A A . 47 LYS HD3 1 1 14 9929 1 1 47 LYS HE2 H -15.757 -10.208 0.066 1.00 . A A . 47 LYS HE2 1 1 14 9930 1 1 47 LYS HE3 H -15.325 -11.257 1.415 1.00 . A A . 47 LYS HE3 1 1 14 9931 1 1 47 LYS HG2 H -12.881 -7.879 1.303 1.00 . A A . 47 LYS HG2 1 1 14 9932 1 1 47 LYS HG3 H -14.601 -7.823 1.690 1.00 . A A . 47 LYS HG3 1 1 14 9933 1 1 47 LYS HZ1 H -16.967 -10.001 2.350 1.00 . A A . 47 LYS HZ1 1 1 14 9934 1 1 47 LYS HZ2 H -16.602 -8.616 1.449 1.00 . A A . 47 LYS HZ2 1 1 14 9935 1 1 47 LYS HZ3 H -15.627 -9.052 2.760 1.00 . A A . 47 LYS HZ3 1 1 14 9936 1 1 47 LYS N N -13.342 -6.372 -2.322 1.00 . A A . 47 LYS N 1 1 14 9937 1 1 47 LYS NZ N -16.193 -9.419 1.968 1.00 . A A . 47 LYS NZ 1 1 14 9938 1 1 47 LYS O O -11.707 -8.601 -2.239 1.00 . A A . 47 LYS O 1 1 14 9939 1 1 48 CYS C C -10.206 -10.318 0.342 1.00 . A A . 48 CYS C 1 1 14 9940 1 1 48 CYS CA C -9.826 -8.960 -0.238 1.00 . A A . 48 CYS CA 1 1 14 9941 1 1 48 CYS CB C -8.640 -8.378 0.531 1.00 . A A . 48 CYS CB 1 1 14 9942 1 1 48 CYS H H -11.094 -7.496 0.609 1.00 . A A . 48 CYS H 1 1 14 9943 1 1 48 CYS HA H -9.545 -9.090 -1.273 1.00 . A A . 48 CYS HA 1 1 14 9944 1 1 48 CYS HB2 H -8.746 -7.305 0.584 1.00 . A A . 48 CYS HB2 1 1 14 9945 1 1 48 CYS HB3 H -8.636 -8.783 1.533 1.00 . A A . 48 CYS HB3 1 1 14 9946 1 1 48 CYS N N -10.959 -8.041 -0.194 1.00 . A A . 48 CYS N 1 1 14 9947 1 1 48 CYS O O -10.643 -10.411 1.491 1.00 . A A . 48 CYS O 1 1 14 9948 1 1 48 CYS SG S -7.018 -8.737 -0.219 1.00 . A A . 48 CYS SG 1 1 14 9949 1 1 49 GLY C C -9.238 -13.363 0.766 1.00 . A A . 49 GLY C 1 1 14 9950 1 1 49 GLY CA C -10.373 -12.706 0.001 1.00 . A A . 49 GLY CA 1 1 14 9951 1 1 49 GLY H H -9.691 -11.235 -1.361 1.00 . A A . 49 GLY H 1 1 14 9952 1 1 49 GLY HA2 H -11.240 -12.650 0.643 1.00 . A A . 49 GLY HA2 1 1 14 9953 1 1 49 GLY HA3 H -10.614 -13.317 -0.857 1.00 . A A . 49 GLY HA3 1 1 14 9954 1 1 49 GLY N N -10.041 -11.369 -0.455 1.00 . A A . 49 GLY N 1 1 14 9955 1 1 49 GLY O O -8.130 -12.826 0.816 1.00 . A A . 49 GLY O 1 1 14 9956 1 1 50 PRO C C -7.405 -15.893 1.266 1.00 . A A . 50 PRO C 1 1 14 9957 1 1 50 PRO CA C -8.469 -15.257 2.156 1.00 . A A . 50 PRO CA 1 1 14 9958 1 1 50 PRO CB C -9.264 -16.348 2.891 1.00 . A A . 50 PRO CB 1 1 14 9959 1 1 50 PRO CD C -10.770 -15.243 1.389 1.00 . A A . 50 PRO CD 1 1 14 9960 1 1 50 PRO CG C -10.706 -16.027 2.667 1.00 . A A . 50 PRO CG 1 1 14 9961 1 1 50 PRO HA H -7.990 -14.611 2.878 1.00 . A A . 50 PRO HA 1 1 14 9962 1 1 50 PRO HB2 H -9.009 -17.315 2.480 1.00 . A A . 50 PRO HB2 1 1 14 9963 1 1 50 PRO HB3 H -9.017 -16.326 3.942 1.00 . A A . 50 PRO HB3 1 1 14 9964 1 1 50 PRO HD2 H -10.850 -15.906 0.541 1.00 . A A . 50 PRO HD2 1 1 14 9965 1 1 50 PRO HD3 H -11.595 -14.548 1.411 1.00 . A A . 50 PRO HD3 1 1 14 9966 1 1 50 PRO HG2 H -11.274 -16.940 2.573 1.00 . A A . 50 PRO HG2 1 1 14 9967 1 1 50 PRO HG3 H -11.081 -15.434 3.489 1.00 . A A . 50 PRO HG3 1 1 14 9968 1 1 50 PRO N N -9.485 -14.533 1.385 1.00 . A A . 50 PRO N 1 1 14 9969 1 1 50 PRO O O -6.546 -16.633 1.746 1.00 . A A . 50 PRO O 1 1 14 9970 1 1 51 GLY C C -5.424 -15.168 -1.345 1.00 . A A . 51 GLY C 1 1 14 9971 1 1 51 GLY CA C -6.506 -16.159 -0.964 1.00 . A A . 51 GLY CA 1 1 14 9972 1 1 51 GLY H H -8.177 -15.009 -0.356 1.00 . A A . 51 GLY H 1 1 14 9973 1 1 51 GLY HA2 H -6.045 -17.025 -0.514 1.00 . A A . 51 GLY HA2 1 1 14 9974 1 1 51 GLY HA3 H -7.027 -16.468 -1.859 1.00 . A A . 51 GLY HA3 1 1 14 9975 1 1 51 GLY N N -7.470 -15.603 -0.031 1.00 . A A . 51 GLY N 1 1 14 9976 1 1 51 GLY O O -4.263 -15.545 -1.517 1.00 . A A . 51 GLY O 1 1 14 9977 1 1 52 GLY C C -5.231 -12.139 -3.109 1.00 . A A . 52 GLY C 1 1 14 9978 1 1 52 GLY CA C -4.841 -12.873 -1.841 1.00 . A A . 52 GLY CA 1 1 14 9979 1 1 52 GLY H H -6.738 -13.658 -1.327 1.00 . A A . 52 GLY H 1 1 14 9980 1 1 52 GLY HA2 H -4.771 -12.160 -1.032 1.00 . A A . 52 GLY HA2 1 1 14 9981 1 1 52 GLY HA3 H -3.876 -13.333 -1.986 1.00 . A A . 52 GLY HA3 1 1 14 9982 1 1 52 GLY N N -5.801 -13.900 -1.478 1.00 . A A . 52 GLY N 1 1 14 9983 1 1 52 GLY O O -4.382 -11.554 -3.782 1.00 . A A . 52 GLY O 1 1 14 9984 1 1 53 THR C C -8.249 -10.655 -4.303 1.00 . A A . 53 THR C 1 1 14 9985 1 1 53 THR CA C -7.027 -11.506 -4.629 1.00 . A A . 53 THR CA 1 1 14 9986 1 1 53 THR CB C -7.402 -12.518 -5.733 1.00 . A A . 53 THR CB 1 1 14 9987 1 1 53 THR CG2 C -6.822 -13.894 -5.438 1.00 . A A . 53 THR CG2 1 1 14 9988 1 1 53 THR H H -7.147 -12.654 -2.857 1.00 . A A . 53 THR H 1 1 14 9989 1 1 53 THR HA H -6.246 -10.864 -5.010 1.00 . A A . 53 THR HA 1 1 14 9990 1 1 53 THR HB H -6.996 -12.168 -6.672 1.00 . A A . 53 THR HB 1 1 14 9991 1 1 53 THR HG1 H -9.151 -13.313 -5.277 1.00 . A A . 53 THR HG1 1 1 14 9992 1 1 53 THR HG21 H -7.580 -14.515 -4.985 1.00 . A A . 53 THR HG21 1 1 14 9993 1 1 53 THR HG22 H -5.986 -13.795 -4.762 1.00 . A A . 53 THR HG22 1 1 14 9994 1 1 53 THR HG23 H -6.488 -14.349 -6.360 1.00 . A A . 53 THR HG23 1 1 14 9995 1 1 53 THR N N -6.520 -12.172 -3.435 1.00 . A A . 53 THR N 1 1 14 9996 1 1 53 THR O O -8.826 -10.770 -3.222 1.00 . A A . 53 THR O 1 1 14 9997 1 1 53 THR OG1 O -8.827 -12.613 -5.849 1.00 . A A . 53 THR OG1 1 1 14 9998 1 1 54 CYS C C -11.046 -9.550 -5.673 1.00 . A A . 54 CYS C 1 1 14 9999 1 1 54 CYS CA C -9.795 -8.934 -5.055 1.00 . A A . 54 CYS CA 1 1 14 10000 1 1 54 CYS CB C -9.531 -7.556 -5.665 1.00 . A A . 54 CYS CB 1 1 14 10001 1 1 54 CYS H H -8.140 -9.757 -6.086 1.00 . A A . 54 CYS H 1 1 14 10002 1 1 54 CYS HA H -9.953 -8.822 -3.992 1.00 . A A . 54 CYS HA 1 1 14 10003 1 1 54 CYS HB2 H -9.259 -7.676 -6.703 1.00 . A A . 54 CYS HB2 1 1 14 10004 1 1 54 CYS HB3 H -10.433 -6.963 -5.602 1.00 . A A . 54 CYS HB3 1 1 14 10005 1 1 54 CYS N N -8.640 -9.802 -5.245 1.00 . A A . 54 CYS N 1 1 14 10006 1 1 54 CYS O O -11.086 -9.833 -6.871 1.00 . A A . 54 CYS O 1 1 14 10007 1 1 54 CYS SG S -8.195 -6.626 -4.846 1.00 . A A . 54 CYS SG 1 1 14 10008 1 1 55 ILE C C -14.508 -9.480 -4.880 1.00 . A A . 55 ILE C 1 1 14 10009 1 1 55 ILE CA C -13.321 -10.340 -5.302 1.00 . A A . 55 ILE CA 1 1 14 10010 1 1 55 ILE CB C -13.512 -11.766 -4.750 1.00 . A A . 55 ILE CB 1 1 14 10011 1 1 55 ILE CD1 C -14.236 -12.723 -2.504 1.00 . A A . 55 ILE CD1 1 1 14 10012 1 1 55 ILE CG1 C -13.297 -11.788 -3.235 1.00 . A A . 55 ILE CG1 1 1 14 10013 1 1 55 ILE CG2 C -12.559 -12.733 -5.438 1.00 . A A . 55 ILE CG2 1 1 14 10014 1 1 55 ILE H H -11.971 -9.510 -3.902 1.00 . A A . 55 ILE H 1 1 14 10015 1 1 55 ILE HA H -13.292 -10.393 -6.380 1.00 . A A . 55 ILE HA 1 1 14 10016 1 1 55 ILE HB H -14.522 -12.080 -4.967 1.00 . A A . 55 ILE HB 1 1 14 10017 1 1 55 ILE HD11 H -14.370 -12.376 -1.490 1.00 . A A . 55 ILE HD11 1 1 14 10018 1 1 55 ILE HD12 H -13.815 -13.718 -2.492 1.00 . A A . 55 ILE HD12 1 1 14 10019 1 1 55 ILE HD13 H -15.191 -12.741 -3.008 1.00 . A A . 55 ILE HD13 1 1 14 10020 1 1 55 ILE HG12 H -12.286 -12.103 -3.026 1.00 . A A . 55 ILE HG12 1 1 14 10021 1 1 55 ILE HG13 H -13.446 -10.793 -2.843 1.00 . A A . 55 ILE HG13 1 1 14 10022 1 1 55 ILE HG21 H -13.103 -13.611 -5.755 1.00 . A A . 55 ILE HG21 1 1 14 10023 1 1 55 ILE HG22 H -11.780 -13.021 -4.748 1.00 . A A . 55 ILE HG22 1 1 14 10024 1 1 55 ILE HG23 H -12.120 -12.252 -6.299 1.00 . A A . 55 ILE HG23 1 1 14 10025 1 1 55 ILE N N -12.066 -9.756 -4.845 1.00 . A A . 55 ILE N 1 1 14 10026 1 1 55 ILE O O -14.370 -8.570 -4.060 1.00 . A A . 55 ILE O 1 1 14 10027 1 1 56 SER C C -18.128 -9.854 -5.457 1.00 . A A . 56 SER C 1 1 14 10028 1 1 56 SER CA C -16.887 -9.028 -5.134 1.00 . A A . 56 SER CA 1 1 14 10029 1 1 56 SER CB C -16.916 -7.712 -5.913 1.00 . A A . 56 SER CB 1 1 14 10030 1 1 56 SER H H -15.718 -10.508 -6.094 1.00 . A A . 56 SER H 1 1 14 10031 1 1 56 SER HA H -16.880 -8.811 -4.077 1.00 . A A . 56 SER HA 1 1 14 10032 1 1 56 SER HB2 H -17.909 -7.289 -5.866 1.00 . A A . 56 SER HB2 1 1 14 10033 1 1 56 SER HB3 H -16.210 -7.022 -5.475 1.00 . A A . 56 SER HB3 1 1 14 10034 1 1 56 SER HG H -17.318 -8.304 -7.736 1.00 . A A . 56 SER HG 1 1 14 10035 1 1 56 SER N N -15.674 -9.774 -5.448 1.00 . A A . 56 SER N 1 1 14 10036 1 1 56 SER O O -18.093 -10.613 -6.448 1.00 . A A . 56 SER O 1 1 14 10037 1 1 56 SER OXT O -19.126 -9.738 -4.713 1.00 . A A . 56 SER OXT 1 1 14 10038 1 1 56 SER OG O -16.573 -7.916 -7.273 1.00 . A A . 56 SER OG 1 1 15 10039 1 1 1 ASP C C 2.258 14.424 -2.284 1.00 . A A . 1 ASP C 1 1 15 10040 1 1 1 ASP CA C 3.486 14.702 -3.145 1.00 . A A . 1 ASP CA 1 1 15 10041 1 1 1 ASP CB C 4.745 14.163 -2.463 1.00 . A A . 1 ASP CB 1 1 15 10042 1 1 1 ASP CG C 5.192 15.032 -1.302 1.00 . A A . 1 ASP CG 1 1 15 10043 1 1 1 ASP H1 H 2.811 16.552 -3.833 1.00 . A A . 1 ASP H1 1 1 15 10044 1 1 1 ASP H2 H 4.480 16.329 -3.994 1.00 . A A . 1 ASP H2 1 1 15 10045 1 1 1 ASP H3 H 3.813 16.649 -2.473 1.00 . A A . 1 ASP H3 1 1 15 10046 1 1 1 ASP HA H 3.364 14.214 -4.101 1.00 . A A . 1 ASP HA 1 1 15 10047 1 1 1 ASP HB2 H 4.548 13.170 -2.089 1.00 . A A . 1 ASP HB2 1 1 15 10048 1 1 1 ASP HB3 H 5.548 14.120 -3.186 1.00 . A A . 1 ASP HB3 1 1 15 10049 1 1 1 ASP N N 3.660 16.160 -3.378 1.00 . A A . 1 ASP N 1 1 15 10050 1 1 1 ASP O O 1.445 15.315 -2.038 1.00 . A A . 1 ASP O 1 1 15 10051 1 1 1 ASP OD1 O 4.337 15.389 -0.465 1.00 . A A . 1 ASP OD1 1 1 15 10052 1 1 1 ASP OD2 O 6.396 15.355 -1.232 1.00 . A A . 1 ASP OD2 1 1 15 10053 1 1 2 VAL C C 1.478 12.282 0.365 1.00 . A A . 2 VAL C 1 1 15 10054 1 1 2 VAL CA C 1.002 12.784 -0.994 1.00 . A A . 2 VAL CA 1 1 15 10055 1 1 2 VAL CB C 0.161 11.684 -1.670 1.00 . A A . 2 VAL CB 1 1 15 10056 1 1 2 VAL CG1 C -1.247 11.661 -1.096 1.00 . A A . 2 VAL CG1 1 1 15 10057 1 1 2 VAL CG2 C 0.125 11.885 -3.177 1.00 . A A . 2 VAL CG2 1 1 15 10058 1 1 2 VAL H H 2.812 12.516 -2.059 1.00 . A A . 2 VAL H 1 1 15 10059 1 1 2 VAL HA H 0.374 13.651 -0.849 1.00 . A A . 2 VAL HA 1 1 15 10060 1 1 2 VAL HB H 0.624 10.728 -1.467 1.00 . A A . 2 VAL HB 1 1 15 10061 1 1 2 VAL HG11 H -1.703 12.631 -1.223 1.00 . A A . 2 VAL HG11 1 1 15 10062 1 1 2 VAL HG12 H -1.203 11.417 -0.044 1.00 . A A . 2 VAL HG12 1 1 15 10063 1 1 2 VAL HG13 H -1.834 10.917 -1.614 1.00 . A A . 2 VAL HG13 1 1 15 10064 1 1 2 VAL HG21 H 1.134 11.919 -3.561 1.00 . A A . 2 VAL HG21 1 1 15 10065 1 1 2 VAL HG22 H -0.380 12.812 -3.405 1.00 . A A . 2 VAL HG22 1 1 15 10066 1 1 2 VAL HG23 H -0.407 11.065 -3.637 1.00 . A A . 2 VAL HG23 1 1 15 10067 1 1 2 VAL N N 2.131 13.181 -1.830 1.00 . A A . 2 VAL N 1 1 15 10068 1 1 2 VAL O O 2.118 11.234 0.462 1.00 . A A . 2 VAL O 1 1 15 10069 1 1 3 GLN C C 0.912 11.367 3.203 1.00 . A A . 3 GLN C 1 1 15 10070 1 1 3 GLN CA C 1.562 12.678 2.770 1.00 . A A . 3 GLN CA 1 1 15 10071 1 1 3 GLN CB C 1.186 13.795 3.745 1.00 . A A . 3 GLN CB 1 1 15 10072 1 1 3 GLN CD C 1.197 16.282 4.200 1.00 . A A . 3 GLN CD 1 1 15 10073 1 1 3 GLN CG C 1.778 15.147 3.378 1.00 . A A . 3 GLN CG 1 1 15 10074 1 1 3 GLN H H 0.658 13.866 1.269 1.00 . A A . 3 GLN H 1 1 15 10075 1 1 3 GLN HA H 2.634 12.553 2.777 1.00 . A A . 3 GLN HA 1 1 15 10076 1 1 3 GLN HB2 H 0.111 13.890 3.770 1.00 . A A . 3 GLN HB2 1 1 15 10077 1 1 3 GLN HB3 H 1.537 13.529 4.732 1.00 . A A . 3 GLN HB3 1 1 15 10078 1 1 3 GLN HE21 H 2.883 17.318 4.002 1.00 . A A . 3 GLN HE21 1 1 15 10079 1 1 3 GLN HE22 H 1.635 18.083 4.921 1.00 . A A . 3 GLN HE22 1 1 15 10080 1 1 3 GLN HG2 H 2.844 15.114 3.541 1.00 . A A . 3 GLN HG2 1 1 15 10081 1 1 3 GLN HG3 H 1.579 15.340 2.334 1.00 . A A . 3 GLN HG3 1 1 15 10082 1 1 3 GLN N N 1.165 13.039 1.413 1.00 . A A . 3 GLN N 1 1 15 10083 1 1 3 GLN NE2 N 1.985 17.334 4.394 1.00 . A A . 3 GLN NE2 1 1 15 10084 1 1 3 GLN O O -0.226 11.354 3.675 1.00 . A A . 3 GLN O 1 1 15 10085 1 1 3 GLN OE1 O 0.055 16.216 4.654 1.00 . A A . 3 GLN OE1 1 1 15 10086 1 1 4 CYS C C 0.596 8.916 4.815 1.00 . A A . 4 CYS C 1 1 15 10087 1 1 4 CYS CA C 1.147 8.942 3.393 1.00 . A A . 4 CYS CA 1 1 15 10088 1 1 4 CYS CB C 2.269 7.911 3.259 1.00 . A A . 4 CYS CB 1 1 15 10089 1 1 4 CYS H H 2.537 10.349 2.639 1.00 . A A . 4 CYS H 1 1 15 10090 1 1 4 CYS HA H 0.353 8.687 2.708 1.00 . A A . 4 CYS HA 1 1 15 10091 1 1 4 CYS HB2 H 3.200 8.358 3.569 1.00 . A A . 4 CYS HB2 1 1 15 10092 1 1 4 CYS HB3 H 2.049 7.068 3.898 1.00 . A A . 4 CYS HB3 1 1 15 10093 1 1 4 CYS N N 1.642 10.268 3.031 1.00 . A A . 4 CYS N 1 1 15 10094 1 1 4 CYS O O -0.385 8.229 5.097 1.00 . A A . 4 CYS O 1 1 15 10095 1 1 4 CYS SG S 2.495 7.278 1.567 1.00 . A A . 4 CYS SG 1 1 15 10096 1 1 5 GLY C C 1.966 9.829 8.044 1.00 . A A . 5 GLY C 1 1 15 10097 1 1 5 GLY CA C 0.801 9.706 7.087 1.00 . A A . 5 GLY CA 1 1 15 10098 1 1 5 GLY H H 2.015 10.186 5.421 1.00 . A A . 5 GLY H 1 1 15 10099 1 1 5 GLY HA2 H 0.144 10.553 7.221 1.00 . A A . 5 GLY HA2 1 1 15 10100 1 1 5 GLY HA3 H 0.257 8.801 7.312 1.00 . A A . 5 GLY HA3 1 1 15 10101 1 1 5 GLY N N 1.237 9.662 5.704 1.00 . A A . 5 GLY N 1 1 15 10102 1 1 5 GLY O O 2.262 10.921 8.532 1.00 . A A . 5 GLY O 1 1 15 10103 1 1 6 GLY C C 4.902 9.592 8.685 1.00 . A A . 6 GLY C 1 1 15 10104 1 1 6 GLY CA C 3.774 8.728 9.207 1.00 . A A . 6 GLY CA 1 1 15 10105 1 1 6 GLY H H 2.364 7.868 7.891 1.00 . A A . 6 GLY H 1 1 15 10106 1 1 6 GLY HA2 H 3.456 9.109 10.168 1.00 . A A . 6 GLY HA2 1 1 15 10107 1 1 6 GLY HA3 H 4.136 7.718 9.332 1.00 . A A . 6 GLY HA3 1 1 15 10108 1 1 6 GLY N N 2.636 8.712 8.309 1.00 . A A . 6 GLY N 1 1 15 10109 1 1 6 GLY O O 5.218 10.628 9.271 1.00 . A A . 6 GLY O 1 1 15 10110 1 1 7 GLY C C 6.956 9.533 5.586 1.00 . A A . 7 GLY C 1 1 15 10111 1 1 7 GLY CA C 6.607 9.936 7.009 1.00 . A A . 7 GLY CA 1 1 15 10112 1 1 7 GLY H H 5.222 8.336 7.156 1.00 . A A . 7 GLY H 1 1 15 10113 1 1 7 GLY HA2 H 6.335 10.980 7.013 1.00 . A A . 7 GLY HA2 1 1 15 10114 1 1 7 GLY HA3 H 7.481 9.804 7.631 1.00 . A A . 7 GLY HA3 1 1 15 10115 1 1 7 GLY N N 5.513 9.170 7.580 1.00 . A A . 7 GLY N 1 1 15 10116 1 1 7 GLY O O 7.995 9.942 5.067 1.00 . A A . 7 GLY O 1 1 15 10117 1 1 8 PHE C C 5.628 9.182 2.576 1.00 . A A . 8 PHE C 1 1 15 10118 1 1 8 PHE CA C 6.366 8.301 3.577 1.00 . A A . 8 PHE CA 1 1 15 10119 1 1 8 PHE CB C 5.957 6.841 3.388 1.00 . A A . 8 PHE CB 1 1 15 10120 1 1 8 PHE CD1 C 7.576 4.968 2.981 1.00 . A A . 8 PHE CD1 1 1 15 10121 1 1 8 PHE CD2 C 7.368 5.823 5.198 1.00 . A A . 8 PHE CD2 1 1 15 10122 1 1 8 PHE CE1 C 8.524 4.061 3.417 1.00 . A A . 8 PHE CE1 1 1 15 10123 1 1 8 PHE CE2 C 8.315 4.919 5.639 1.00 . A A . 8 PHE CE2 1 1 15 10124 1 1 8 PHE CG C 6.989 5.859 3.865 1.00 . A A . 8 PHE CG 1 1 15 10125 1 1 8 PHE CZ C 8.893 4.037 4.747 1.00 . A A . 8 PHE CZ 1 1 15 10126 1 1 8 PHE H H 5.287 8.426 5.400 1.00 . A A . 8 PHE H 1 1 15 10127 1 1 8 PHE HA H 7.427 8.391 3.400 1.00 . A A . 8 PHE HA 1 1 15 10128 1 1 8 PHE HB2 H 5.045 6.657 3.937 1.00 . A A . 8 PHE HB2 1 1 15 10129 1 1 8 PHE HB3 H 5.780 6.658 2.338 1.00 . A A . 8 PHE HB3 1 1 15 10130 1 1 8 PHE HD1 H 7.289 4.989 1.940 1.00 . A A . 8 PHE HD1 1 1 15 10131 1 1 8 PHE HD2 H 6.916 6.512 5.896 1.00 . A A . 8 PHE HD2 1 1 15 10132 1 1 8 PHE HE1 H 8.974 3.372 2.717 1.00 . A A . 8 PHE HE1 1 1 15 10133 1 1 8 PHE HE2 H 8.602 4.901 6.680 1.00 . A A . 8 PHE HE2 1 1 15 10134 1 1 8 PHE HZ H 9.632 3.328 5.090 1.00 . A A . 8 PHE HZ 1 1 15 10135 1 1 8 PHE N N 6.104 8.733 4.946 1.00 . A A . 8 PHE N 1 1 15 10136 1 1 8 PHE O O 4.908 10.104 2.958 1.00 . A A . 8 PHE O 1 1 15 10137 1 1 9 SER C C 5.154 8.871 -1.077 1.00 . A A . 9 SER C 1 1 15 10138 1 1 9 SER CA C 5.165 9.653 0.233 1.00 . A A . 9 SER CA 1 1 15 10139 1 1 9 SER CB C 5.870 10.995 0.034 1.00 . A A . 9 SER CB 1 1 15 10140 1 1 9 SER H H 6.399 8.140 1.053 1.00 . A A . 9 SER H 1 1 15 10141 1 1 9 SER HA H 4.144 9.835 0.535 1.00 . A A . 9 SER HA 1 1 15 10142 1 1 9 SER HB2 H 5.178 11.702 -0.397 1.00 . A A . 9 SER HB2 1 1 15 10143 1 1 9 SER HB3 H 6.211 11.364 0.991 1.00 . A A . 9 SER HB3 1 1 15 10144 1 1 9 SER HG H 7.358 11.731 -1.004 1.00 . A A . 9 SER HG 1 1 15 10145 1 1 9 SER N N 5.813 8.888 1.292 1.00 . A A . 9 SER N 1 1 15 10146 1 1 9 SER O O 5.956 7.958 -1.274 1.00 . A A . 9 SER O 1 1 15 10147 1 1 9 SER OG O 6.985 10.864 -0.830 1.00 . A A . 9 SER OG 1 1 15 10148 1 1 10 CYS C C 3.616 9.545 -4.326 1.00 . A A . 10 CYS C 1 1 15 10149 1 1 10 CYS CA C 4.103 8.568 -3.255 1.00 . A A . 10 CYS CA 1 1 15 10150 1 1 10 CYS CB C 3.160 7.374 -3.145 1.00 . A A . 10 CYS CB 1 1 15 10151 1 1 10 CYS H H 3.619 9.964 -1.741 1.00 . A A . 10 CYS H 1 1 15 10152 1 1 10 CYS HA H 5.082 8.211 -3.537 1.00 . A A . 10 CYS HA 1 1 15 10153 1 1 10 CYS HB2 H 2.657 7.407 -2.191 1.00 . A A . 10 CYS HB2 1 1 15 10154 1 1 10 CYS HB3 H 2.425 7.435 -3.935 1.00 . A A . 10 CYS HB3 1 1 15 10155 1 1 10 CYS N N 4.233 9.234 -1.963 1.00 . A A . 10 CYS N 1 1 15 10156 1 1 10 CYS O O 3.568 10.754 -4.095 1.00 . A A . 10 CYS O 1 1 15 10157 1 1 10 CYS SG S 3.984 5.755 -3.281 1.00 . A A . 10 CYS SG 1 1 15 10158 1 1 11 HIS C C 1.357 10.198 -6.579 1.00 . A A . 11 HIS C 1 1 15 10159 1 1 11 HIS CA C 2.853 9.862 -6.626 1.00 . A A . 11 HIS CA 1 1 15 10160 1 1 11 HIS CB C 3.179 9.174 -7.952 1.00 . A A . 11 HIS CB 1 1 15 10161 1 1 11 HIS CD2 C 5.522 8.108 -7.642 1.00 . A A . 11 HIS CD2 1 1 15 10162 1 1 11 HIS CE1 C 6.636 9.374 -9.044 1.00 . A A . 11 HIS CE1 1 1 15 10163 1 1 11 HIS CG C 4.646 8.990 -8.181 1.00 . A A . 11 HIS CG 1 1 15 10164 1 1 11 HIS H H 3.372 8.056 -5.646 1.00 . A A . 11 HIS H 1 1 15 10165 1 1 11 HIS HA H 3.409 10.784 -6.577 1.00 . A A . 11 HIS HA 1 1 15 10166 1 1 11 HIS HB2 H 2.715 8.199 -7.968 1.00 . A A . 11 HIS HB2 1 1 15 10167 1 1 11 HIS HB3 H 2.786 9.768 -8.765 1.00 . A A . 11 HIS HB3 1 1 15 10168 1 1 11 HIS HD1 H 5.022 10.500 -9.600 1.00 . A A . 11 HIS HD1 1 1 15 10169 1 1 11 HIS HD2 H 5.296 7.344 -6.913 1.00 . A A . 11 HIS HD2 1 1 15 10170 1 1 11 HIS HE1 H 7.437 9.801 -9.630 1.00 . A A . 11 HIS HE1 1 1 15 10171 1 1 11 HIS HE2 H 7.594 7.940 -7.940 1.00 . A A . 11 HIS HE2 1 1 15 10172 1 1 11 HIS N N 3.293 9.023 -5.510 1.00 . A A . 11 HIS N 1 1 15 10173 1 1 11 HIS ND1 N 5.375 9.768 -9.054 1.00 . A A . 11 HIS ND1 1 1 15 10174 1 1 11 HIS NE2 N 6.751 8.369 -8.196 1.00 . A A . 11 HIS NE2 1 1 15 10175 1 1 11 HIS O O 0.531 9.436 -6.070 1.00 . A A . 11 HIS O 1 1 15 10176 1 1 12 ASP C C -1.264 10.757 -7.774 1.00 . A A . 12 ASP C 1 1 15 10177 1 1 12 ASP CA C -0.346 11.832 -7.199 1.00 . A A . 12 ASP CA 1 1 15 10178 1 1 12 ASP CB C -0.434 13.105 -8.044 1.00 . A A . 12 ASP CB 1 1 15 10179 1 1 12 ASP CG C -0.145 12.849 -9.510 1.00 . A A . 12 ASP CG 1 1 15 10180 1 1 12 ASP H H 1.750 11.893 -7.537 1.00 . A A . 12 ASP H 1 1 15 10181 1 1 12 ASP HA H -0.661 12.056 -6.191 1.00 . A A . 12 ASP HA 1 1 15 10182 1 1 12 ASP HB2 H -1.427 13.519 -7.958 1.00 . A A . 12 ASP HB2 1 1 15 10183 1 1 12 ASP HB3 H 0.284 13.824 -7.675 1.00 . A A . 12 ASP HB3 1 1 15 10184 1 1 12 ASP N N 1.032 11.357 -7.142 1.00 . A A . 12 ASP N 1 1 15 10185 1 1 12 ASP O O -0.913 10.082 -8.742 1.00 . A A . 12 ASP O 1 1 15 10186 1 1 12 ASP OD1 O 0.992 12.444 -9.830 1.00 . A A . 12 ASP OD1 1 1 15 10187 1 1 12 ASP OD2 O -1.058 13.053 -10.338 1.00 . A A . 12 ASP OD2 1 1 15 10188 1 1 13 GLY C C -3.218 8.271 -6.940 1.00 . A A . 13 GLY C 1 1 15 10189 1 1 13 GLY CA C -3.387 9.608 -7.637 1.00 . A A . 13 GLY CA 1 1 15 10190 1 1 13 GLY H H -2.664 11.172 -6.406 1.00 . A A . 13 GLY H 1 1 15 10191 1 1 13 GLY HA2 H -4.389 9.970 -7.458 1.00 . A A . 13 GLY HA2 1 1 15 10192 1 1 13 GLY HA3 H -3.252 9.466 -8.699 1.00 . A A . 13 GLY HA3 1 1 15 10193 1 1 13 GLY N N -2.439 10.603 -7.171 1.00 . A A . 13 GLY N 1 1 15 10194 1 1 13 GLY O O -4.004 7.348 -7.154 1.00 . A A . 13 GLY O 1 1 15 10195 1 1 14 GLU C C -2.647 6.911 -4.024 1.00 . A A . 14 GLU C 1 1 15 10196 1 1 14 GLU CA C -1.931 6.929 -5.371 1.00 . A A . 14 GLU CA 1 1 15 10197 1 1 14 GLU CB C -0.433 6.755 -5.138 1.00 . A A . 14 GLU CB 1 1 15 10198 1 1 14 GLU CD C -0.011 6.932 -2.649 1.00 . A A . 14 GLU CD 1 1 15 10199 1 1 14 GLU CG C 0.097 7.612 -4.001 1.00 . A A . 14 GLU CG 1 1 15 10200 1 1 14 GLU H H -1.600 8.947 -5.971 1.00 . A A . 14 GLU H 1 1 15 10201 1 1 14 GLU HA H -2.291 6.107 -5.970 1.00 . A A . 14 GLU HA 1 1 15 10202 1 1 14 GLU HB2 H -0.233 5.719 -4.906 1.00 . A A . 14 GLU HB2 1 1 15 10203 1 1 14 GLU HB3 H 0.096 7.023 -6.040 1.00 . A A . 14 GLU HB3 1 1 15 10204 1 1 14 GLU HG2 H 1.134 7.837 -4.192 1.00 . A A . 14 GLU HG2 1 1 15 10205 1 1 14 GLU HG3 H -0.469 8.531 -3.969 1.00 . A A . 14 GLU HG3 1 1 15 10206 1 1 14 GLU N N -2.191 8.167 -6.100 1.00 . A A . 14 GLU N 1 1 15 10207 1 1 14 GLU O O -3.236 7.907 -3.603 1.00 . A A . 14 GLU O 1 1 15 10208 1 1 14 GLU OE1 O -0.709 7.478 -1.769 1.00 . A A . 14 GLU OE1 1 1 15 10209 1 1 14 GLU OE2 O 0.597 5.856 -2.472 1.00 . A A . 14 GLU OE2 1 1 15 10210 1 1 15 THR C C -2.126 4.986 -1.083 1.00 . A A . 15 THR C 1 1 15 10211 1 1 15 THR CA C -3.158 5.591 -2.030 1.00 . A A . 15 THR CA 1 1 15 10212 1 1 15 THR CB C -4.391 4.667 -2.087 1.00 . A A . 15 THR CB 1 1 15 10213 1 1 15 THR CG2 C -4.898 4.354 -0.687 1.00 . A A . 15 THR CG2 1 1 15 10214 1 1 15 THR H H -2.063 5.022 -3.728 1.00 . A A . 15 THR H 1 1 15 10215 1 1 15 THR HA H -3.463 6.559 -1.657 1.00 . A A . 15 THR HA 1 1 15 10216 1 1 15 THR HB H -4.105 3.739 -2.564 1.00 . A A . 15 THR HB 1 1 15 10217 1 1 15 THR HG1 H -5.789 6.030 -2.361 1.00 . A A . 15 THR HG1 1 1 15 10218 1 1 15 THR HG21 H -5.088 3.295 -0.602 1.00 . A A . 15 THR HG21 1 1 15 10219 1 1 15 THR HG22 H -5.813 4.900 -0.505 1.00 . A A . 15 THR HG22 1 1 15 10220 1 1 15 THR HG23 H -4.154 4.646 0.039 1.00 . A A . 15 THR HG23 1 1 15 10221 1 1 15 THR N N -2.560 5.771 -3.345 1.00 . A A . 15 THR N 1 1 15 10222 1 1 15 THR O O -1.504 3.978 -1.405 1.00 . A A . 15 THR O 1 1 15 10223 1 1 15 THR OG1 O -5.434 5.285 -2.850 1.00 . A A . 15 THR OG1 1 1 15 10224 1 1 16 CYS C C -1.611 4.104 2.006 1.00 . A A . 16 CYS C 1 1 15 10225 1 1 16 CYS CA C -0.970 5.100 1.045 1.00 . A A . 16 CYS CA 1 1 15 10226 1 1 16 CYS CB C -0.350 6.263 1.815 1.00 . A A . 16 CYS CB 1 1 15 10227 1 1 16 CYS H H -2.465 6.400 0.288 1.00 . A A . 16 CYS H 1 1 15 10228 1 1 16 CYS HA H -0.191 4.594 0.494 1.00 . A A . 16 CYS HA 1 1 15 10229 1 1 16 CYS HB2 H -1.137 6.844 2.274 1.00 . A A . 16 CYS HB2 1 1 15 10230 1 1 16 CYS HB3 H 0.300 5.872 2.583 1.00 . A A . 16 CYS HB3 1 1 15 10231 1 1 16 CYS N N -1.941 5.599 0.076 1.00 . A A . 16 CYS N 1 1 15 10232 1 1 16 CYS O O -2.620 4.403 2.642 1.00 . A A . 16 CYS O 1 1 15 10233 1 1 16 CYS SG S 0.635 7.389 0.774 1.00 . A A . 16 CYS SG 1 1 15 10234 1 1 17 CYS C C -0.463 1.391 3.957 1.00 . A A . 17 CYS C 1 1 15 10235 1 1 17 CYS CA C -1.538 1.872 2.980 1.00 . A A . 17 CYS CA 1 1 15 10236 1 1 17 CYS CB C -2.071 0.699 2.148 1.00 . A A . 17 CYS CB 1 1 15 10237 1 1 17 CYS H H -0.216 2.734 1.563 1.00 . A A . 17 CYS H 1 1 15 10238 1 1 17 CYS HA H -2.354 2.297 3.546 1.00 . A A . 17 CYS HA 1 1 15 10239 1 1 17 CYS HB2 H -3.143 0.659 2.248 1.00 . A A . 17 CYS HB2 1 1 15 10240 1 1 17 CYS HB3 H -1.822 0.867 1.110 1.00 . A A . 17 CYS HB3 1 1 15 10241 1 1 17 CYS N N -1.019 2.915 2.100 1.00 . A A . 17 CYS N 1 1 15 10242 1 1 17 CYS O O 0.625 0.994 3.544 1.00 . A A . 17 CYS O 1 1 15 10243 1 1 17 CYS SG S -1.409 -0.937 2.616 1.00 . A A . 17 CYS SG 1 1 15 10244 1 1 18 PRO C C 0.123 -0.523 6.531 1.00 . A A . 18 PRO C 1 1 15 10245 1 1 18 PRO CA C 0.185 0.985 6.301 1.00 . A A . 18 PRO CA 1 1 15 10246 1 1 18 PRO CB C -0.308 1.746 7.528 1.00 . A A . 18 PRO CB 1 1 15 10247 1 1 18 PRO CD C -2.033 1.876 5.862 1.00 . A A . 18 PRO CD 1 1 15 10248 1 1 18 PRO CG C -1.787 1.802 7.351 1.00 . A A . 18 PRO CG 1 1 15 10249 1 1 18 PRO HA H 1.199 1.278 6.069 1.00 . A A . 18 PRO HA 1 1 15 10250 1 1 18 PRO HB2 H -0.031 1.212 8.426 1.00 . A A . 18 PRO HB2 1 1 15 10251 1 1 18 PRO HB3 H 0.124 2.737 7.542 1.00 . A A . 18 PRO HB3 1 1 15 10252 1 1 18 PRO HD2 H -2.843 1.219 5.582 1.00 . A A . 18 PRO HD2 1 1 15 10253 1 1 18 PRO HD3 H -2.252 2.892 5.568 1.00 . A A . 18 PRO HD3 1 1 15 10254 1 1 18 PRO HG2 H -2.238 0.911 7.761 1.00 . A A . 18 PRO HG2 1 1 15 10255 1 1 18 PRO HG3 H -2.181 2.681 7.839 1.00 . A A . 18 PRO HG3 1 1 15 10256 1 1 18 PRO N N -0.757 1.419 5.271 1.00 . A A . 18 PRO N 1 1 15 10257 1 1 18 PRO O O -0.771 -1.019 7.217 1.00 . A A . 18 PRO O 1 1 15 10258 1 1 19 THR C C 1.954 -3.156 7.252 1.00 . A A . 19 THR C 1 1 15 10259 1 1 19 THR CA C 1.107 -2.704 6.066 1.00 . A A . 19 THR CA 1 1 15 10260 1 1 19 THR CB C 1.659 -3.363 4.786 1.00 . A A . 19 THR CB 1 1 15 10261 1 1 19 THR CG2 C 1.458 -2.460 3.577 1.00 . A A . 19 THR CG2 1 1 15 10262 1 1 19 THR H H 1.750 -0.804 5.397 1.00 . A A . 19 THR H 1 1 15 10263 1 1 19 THR HA H 0.095 -3.050 6.211 1.00 . A A . 19 THR HA 1 1 15 10264 1 1 19 THR HB H 1.126 -4.287 4.617 1.00 . A A . 19 THR HB 1 1 15 10265 1 1 19 THR HG1 H 3.523 -3.403 4.141 1.00 . A A . 19 THR HG1 1 1 15 10266 1 1 19 THR HG21 H 2.346 -1.866 3.420 1.00 . A A . 19 THR HG21 1 1 15 10267 1 1 19 THR HG22 H 0.614 -1.807 3.752 1.00 . A A . 19 THR HG22 1 1 15 10268 1 1 19 THR HG23 H 1.270 -3.064 2.702 1.00 . A A . 19 THR HG23 1 1 15 10269 1 1 19 THR N N 1.067 -1.251 5.940 1.00 . A A . 19 THR N 1 1 15 10270 1 1 19 THR O O 2.117 -4.357 7.478 1.00 . A A . 19 THR O 1 1 15 10271 1 1 19 THR OG1 O 3.054 -3.651 4.941 1.00 . A A . 19 THR OG1 1 1 15 10272 1 1 20 SER C C 3.220 -1.458 10.238 1.00 . A A . 20 SER C 1 1 15 10273 1 1 20 SER CA C 3.318 -2.539 9.166 1.00 . A A . 20 SER CA 1 1 15 10274 1 1 20 SER CB C 4.774 -2.722 8.737 1.00 . A A . 20 SER CB 1 1 15 10275 1 1 20 SER H H 2.331 -1.263 7.797 1.00 . A A . 20 SER H 1 1 15 10276 1 1 20 SER HA H 2.953 -3.469 9.576 1.00 . A A . 20 SER HA 1 1 15 10277 1 1 20 SER HB2 H 4.805 -3.139 7.741 1.00 . A A . 20 SER HB2 1 1 15 10278 1 1 20 SER HB3 H 5.271 -1.762 8.742 1.00 . A A . 20 SER HB3 1 1 15 10279 1 1 20 SER HG H 5.190 -4.500 9.445 1.00 . A A . 20 SER HG 1 1 15 10280 1 1 20 SER N N 2.491 -2.207 8.010 1.00 . A A . 20 SER N 1 1 15 10281 1 1 20 SER O O 2.268 -0.677 10.260 1.00 . A A . 20 SER O 1 1 15 10282 1 1 20 SER OG O 5.459 -3.595 9.619 1.00 . A A . 20 SER OG 1 1 15 10283 1 1 21 GLN C C 4.322 0.982 11.614 1.00 . A A . 21 GLN C 1 1 15 10284 1 1 21 GLN CA C 4.239 -0.424 12.195 1.00 . A A . 21 GLN CA 1 1 15 10285 1 1 21 GLN CB C 5.419 -0.663 13.149 1.00 . A A . 21 GLN CB 1 1 15 10286 1 1 21 GLN CD C 7.690 -1.767 13.251 1.00 . A A . 21 GLN CD 1 1 15 10287 1 1 21 GLN CG C 6.238 -1.906 12.835 1.00 . A A . 21 GLN CG 1 1 15 10288 1 1 21 GLN H H 4.943 -2.063 11.050 1.00 . A A . 21 GLN H 1 1 15 10289 1 1 21 GLN HA H 3.316 -0.516 12.749 1.00 . A A . 21 GLN HA 1 1 15 10290 1 1 21 GLN HB2 H 6.077 0.192 13.105 1.00 . A A . 21 GLN HB2 1 1 15 10291 1 1 21 GLN HB3 H 5.037 -0.757 14.155 1.00 . A A . 21 GLN HB3 1 1 15 10292 1 1 21 GLN HE21 H 7.156 -1.652 15.163 1.00 . A A . 21 GLN HE21 1 1 15 10293 1 1 21 GLN HE22 H 8.852 -1.554 14.850 1.00 . A A . 21 GLN HE22 1 1 15 10294 1 1 21 GLN HG2 H 5.809 -2.748 13.360 1.00 . A A . 21 GLN HG2 1 1 15 10295 1 1 21 GLN HG3 H 6.200 -2.090 11.771 1.00 . A A . 21 GLN HG3 1 1 15 10296 1 1 21 GLN N N 4.213 -1.416 11.123 1.00 . A A . 21 GLN N 1 1 15 10297 1 1 21 GLN NE2 N 7.923 -1.645 14.553 1.00 . A A . 21 GLN NE2 1 1 15 10298 1 1 21 GLN O O 3.651 1.901 12.085 1.00 . A A . 21 GLN O 1 1 15 10299 1 1 21 GLN OE1 O 8.591 -1.768 12.413 1.00 . A A . 21 GLN OE1 1 1 15 10300 1 1 22 THR C C 5.385 2.278 8.417 1.00 . A A . 22 THR C 1 1 15 10301 1 1 22 THR CA C 5.317 2.433 9.933 1.00 . A A . 22 THR CA 1 1 15 10302 1 1 22 THR CB C 6.590 3.152 10.422 1.00 . A A . 22 THR CB 1 1 15 10303 1 1 22 THR CG2 C 7.769 2.192 10.476 1.00 . A A . 22 THR CG2 1 1 15 10304 1 1 22 THR H H 5.654 0.370 10.252 1.00 . A A . 22 THR H 1 1 15 10305 1 1 22 THR HA H 4.464 3.046 10.183 1.00 . A A . 22 THR HA 1 1 15 10306 1 1 22 THR HB H 6.410 3.532 11.417 1.00 . A A . 22 THR HB 1 1 15 10307 1 1 22 THR HG1 H 6.094 4.564 9.138 1.00 . A A . 22 THR HG1 1 1 15 10308 1 1 22 THR HG21 H 8.494 2.552 11.191 1.00 . A A . 22 THR HG21 1 1 15 10309 1 1 22 THR HG22 H 8.226 2.129 9.499 1.00 . A A . 22 THR HG22 1 1 15 10310 1 1 22 THR HG23 H 7.423 1.214 10.775 1.00 . A A . 22 THR HG23 1 1 15 10311 1 1 22 THR N N 5.147 1.141 10.584 1.00 . A A . 22 THR N 1 1 15 10312 1 1 22 THR O O 4.759 3.041 7.685 1.00 . A A . 22 THR O 1 1 15 10313 1 1 22 THR OG1 O 6.899 4.246 9.552 1.00 . A A . 22 THR OG1 1 1 15 10314 1 1 23 THR C C 5.063 1.342 5.740 1.00 . A A . 23 THR C 1 1 15 10315 1 1 23 THR CA C 6.328 1.019 6.531 1.00 . A A . 23 THR CA 1 1 15 10316 1 1 23 THR CB C 6.713 -0.450 6.279 1.00 . A A . 23 THR CB 1 1 15 10317 1 1 23 THR CG2 C 6.989 -0.691 4.802 1.00 . A A . 23 THR CG2 1 1 15 10318 1 1 23 THR H H 6.636 0.731 8.611 1.00 . A A . 23 THR H 1 1 15 10319 1 1 23 THR HA H 7.132 1.645 6.171 1.00 . A A . 23 THR HA 1 1 15 10320 1 1 23 THR HB H 5.890 -1.080 6.584 1.00 . A A . 23 THR HB 1 1 15 10321 1 1 23 THR HG1 H 7.611 -1.318 7.806 1.00 . A A . 23 THR HG1 1 1 15 10322 1 1 23 THR HG21 H 7.957 -0.284 4.546 1.00 . A A . 23 THR HG21 1 1 15 10323 1 1 23 THR HG22 H 6.227 -0.206 4.210 1.00 . A A . 23 THR HG22 1 1 15 10324 1 1 23 THR HG23 H 6.980 -1.751 4.603 1.00 . A A . 23 THR HG23 1 1 15 10325 1 1 23 THR N N 6.157 1.289 7.962 1.00 . A A . 23 THR N 1 1 15 10326 1 1 23 THR O O 3.988 0.814 6.026 1.00 . A A . 23 THR O 1 1 15 10327 1 1 23 THR OG1 O 7.873 -0.790 7.047 1.00 . A A . 23 THR OG1 1 1 15 10328 1 1 24 TRP C C 4.156 2.040 2.524 1.00 . A A . 24 TRP C 1 1 15 10329 1 1 24 TRP CA C 4.067 2.631 3.927 1.00 . A A . 24 TRP CA 1 1 15 10330 1 1 24 TRP CB C 4.003 4.156 3.847 1.00 . A A . 24 TRP CB 1 1 15 10331 1 1 24 TRP CD1 C 3.987 5.349 6.116 1.00 . A A . 24 TRP CD1 1 1 15 10332 1 1 24 TRP CD2 C 1.962 4.874 5.301 1.00 . A A . 24 TRP CD2 1 1 15 10333 1 1 24 TRP CE2 C 1.803 5.511 6.544 1.00 . A A . 24 TRP CE2 1 1 15 10334 1 1 24 TRP CE3 C 0.829 4.483 4.594 1.00 . A A . 24 TRP CE3 1 1 15 10335 1 1 24 TRP CG C 3.361 4.776 5.048 1.00 . A A . 24 TRP CG 1 1 15 10336 1 1 24 TRP CH2 C -0.545 5.365 6.377 1.00 . A A . 24 TRP CH2 1 1 15 10337 1 1 24 TRP CZ2 C 0.550 5.762 7.095 1.00 . A A . 24 TRP CZ2 1 1 15 10338 1 1 24 TRP CZ3 C -0.413 4.731 5.137 1.00 . A A . 24 TRP CZ3 1 1 15 10339 1 1 24 TRP H H 6.080 2.616 4.582 1.00 . A A . 24 TRP H 1 1 15 10340 1 1 24 TRP HA H 3.168 2.268 4.400 1.00 . A A . 24 TRP HA 1 1 15 10341 1 1 24 TRP HB2 H 5.004 4.549 3.761 1.00 . A A . 24 TRP HB2 1 1 15 10342 1 1 24 TRP HB3 H 3.431 4.441 2.976 1.00 . A A . 24 TRP HB3 1 1 15 10343 1 1 24 TRP HD1 H 5.058 5.431 6.223 1.00 . A A . 24 TRP HD1 1 1 15 10344 1 1 24 TRP HE1 H 3.254 6.233 7.876 1.00 . A A . 24 TRP HE1 1 1 15 10345 1 1 24 TRP HE3 H 0.914 3.996 3.635 1.00 . A A . 24 TRP HE3 1 1 15 10346 1 1 24 TRP HH2 H -1.535 5.536 6.763 1.00 . A A . 24 TRP HH2 1 1 15 10347 1 1 24 TRP HZ2 H 0.432 6.251 8.050 1.00 . A A . 24 TRP HZ2 1 1 15 10348 1 1 24 TRP HZ3 H -1.303 4.432 4.603 1.00 . A A . 24 TRP HZ3 1 1 15 10349 1 1 24 TRP N N 5.199 2.223 4.753 1.00 . A A . 24 TRP N 1 1 15 10350 1 1 24 TRP NE1 N 3.054 5.790 7.026 1.00 . A A . 24 TRP NE1 1 1 15 10351 1 1 24 TRP O O 5.217 2.048 1.899 1.00 . A A . 24 TRP O 1 1 15 10352 1 1 25 GLY C C 2.173 1.762 -0.272 1.00 . A A . 25 GLY C 1 1 15 10353 1 1 25 GLY CA C 2.988 0.939 0.709 1.00 . A A . 25 GLY CA 1 1 15 10354 1 1 25 GLY H H 2.215 1.548 2.579 1.00 . A A . 25 GLY H 1 1 15 10355 1 1 25 GLY HA2 H 3.997 0.850 0.336 1.00 . A A . 25 GLY HA2 1 1 15 10356 1 1 25 GLY HA3 H 2.555 -0.048 0.780 1.00 . A A . 25 GLY HA3 1 1 15 10357 1 1 25 GLY N N 3.028 1.528 2.034 1.00 . A A . 25 GLY N 1 1 15 10358 1 1 25 GLY O O 1.186 2.401 0.110 1.00 . A A . 25 GLY O 1 1 15 10359 1 1 26 CYS C C 0.824 1.640 -3.247 1.00 . A A . 26 CYS C 1 1 15 10360 1 1 26 CYS CA C 1.914 2.487 -2.595 1.00 . A A . 26 CYS CA 1 1 15 10361 1 1 26 CYS CB C 2.925 2.935 -3.652 1.00 . A A . 26 CYS CB 1 1 15 10362 1 1 26 CYS H H 3.385 1.213 -1.765 1.00 . A A . 26 CYS H 1 1 15 10363 1 1 26 CYS HA H 1.460 3.359 -2.149 1.00 . A A . 26 CYS HA 1 1 15 10364 1 1 26 CYS HB2 H 3.916 2.912 -3.224 1.00 . A A . 26 CYS HB2 1 1 15 10365 1 1 26 CYS HB3 H 2.884 2.253 -4.489 1.00 . A A . 26 CYS HB3 1 1 15 10366 1 1 26 CYS N N 2.593 1.743 -1.537 1.00 . A A . 26 CYS N 1 1 15 10367 1 1 26 CYS O O 1.110 0.657 -3.929 1.00 . A A . 26 CYS O 1 1 15 10368 1 1 26 CYS SG S 2.640 4.617 -4.293 1.00 . A A . 26 CYS SG 1 1 15 10369 1 1 27 CYS C C -2.323 2.141 -4.596 1.00 . A A . 27 CYS C 1 1 15 10370 1 1 27 CYS CA C -1.573 1.307 -3.558 1.00 . A A . 27 CYS CA 1 1 15 10371 1 1 27 CYS CB C -2.519 0.928 -2.421 1.00 . A A . 27 CYS CB 1 1 15 10372 1 1 27 CYS H H -0.579 2.808 -2.449 1.00 . A A . 27 CYS H 1 1 15 10373 1 1 27 CYS HA H -1.211 0.405 -4.027 1.00 . A A . 27 CYS HA 1 1 15 10374 1 1 27 CYS HB2 H -2.866 1.829 -1.935 1.00 . A A . 27 CYS HB2 1 1 15 10375 1 1 27 CYS HB3 H -3.367 0.395 -2.826 1.00 . A A . 27 CYS HB3 1 1 15 10376 1 1 27 CYS N N -0.425 2.026 -3.015 1.00 . A A . 27 CYS N 1 1 15 10377 1 1 27 CYS O O -2.316 3.368 -4.539 1.00 . A A . 27 CYS O 1 1 15 10378 1 1 27 CYS SG S -1.755 -0.126 -1.149 1.00 . A A . 27 CYS SG 1 1 15 10379 1 1 28 PRO C C -5.169 2.499 -6.174 1.00 . A A . 28 PRO C 1 1 15 10380 1 1 28 PRO CA C -3.744 2.165 -6.612 1.00 . A A . 28 PRO CA 1 1 15 10381 1 1 28 PRO CB C -3.759 1.134 -7.734 1.00 . A A . 28 PRO CB 1 1 15 10382 1 1 28 PRO CD C -3.051 0.014 -5.718 1.00 . A A . 28 PRO CD 1 1 15 10383 1 1 28 PRO CG C -3.767 -0.185 -7.035 1.00 . A A . 28 PRO CG 1 1 15 10384 1 1 28 PRO HA H -3.247 3.063 -6.945 1.00 . A A . 28 PRO HA 1 1 15 10385 1 1 28 PRO HB2 H -4.644 1.268 -8.339 1.00 . A A . 28 PRO HB2 1 1 15 10386 1 1 28 PRO HB3 H -2.876 1.250 -8.346 1.00 . A A . 28 PRO HB3 1 1 15 10387 1 1 28 PRO HD2 H -3.615 -0.432 -4.913 1.00 . A A . 28 PRO HD2 1 1 15 10388 1 1 28 PRO HD3 H -2.059 -0.410 -5.763 1.00 . A A . 28 PRO HD3 1 1 15 10389 1 1 28 PRO HG2 H -4.785 -0.499 -6.860 1.00 . A A . 28 PRO HG2 1 1 15 10390 1 1 28 PRO HG3 H -3.248 -0.918 -7.633 1.00 . A A . 28 PRO HG3 1 1 15 10391 1 1 28 PRO N N -2.987 1.481 -5.565 1.00 . A A . 28 PRO N 1 1 15 10392 1 1 28 PRO O O -5.494 2.430 -4.989 1.00 . A A . 28 PRO O 1 1 15 10393 1 1 29 SER C C -7.535 4.458 -6.024 1.00 . A A . 29 SER C 1 1 15 10394 1 1 29 SER CA C -7.414 3.192 -6.874 1.00 . A A . 29 SER CA 1 1 15 10395 1 1 29 SER CB C -8.123 2.026 -6.181 1.00 . A A . 29 SER CB 1 1 15 10396 1 1 29 SER H H -5.690 2.881 -8.067 1.00 . A A . 29 SER H 1 1 15 10397 1 1 29 SER HA H -7.894 3.371 -7.826 1.00 . A A . 29 SER HA 1 1 15 10398 1 1 29 SER HB2 H -7.389 1.312 -5.838 1.00 . A A . 29 SER HB2 1 1 15 10399 1 1 29 SER HB3 H -8.684 2.400 -5.336 1.00 . A A . 29 SER HB3 1 1 15 10400 1 1 29 SER HG H -8.585 0.602 -7.444 1.00 . A A . 29 SER HG 1 1 15 10401 1 1 29 SER N N -6.015 2.852 -7.143 1.00 . A A . 29 SER N 1 1 15 10402 1 1 29 SER O O -6.628 4.797 -5.264 1.00 . A A . 29 SER O 1 1 15 10403 1 1 29 SER OG O -9.015 1.372 -7.068 1.00 . A A . 29 SER OG 1 1 15 10404 1 1 30 PRO C C -8.861 6.206 -3.881 1.00 . A A . 30 PRO C 1 1 15 10405 1 1 30 PRO CA C -8.907 6.421 -5.391 1.00 . A A . 30 PRO CA 1 1 15 10406 1 1 30 PRO CB C -10.314 6.847 -5.821 1.00 . A A . 30 PRO CB 1 1 15 10407 1 1 30 PRO CD C -9.799 4.858 -7.036 1.00 . A A . 30 PRO CD 1 1 15 10408 1 1 30 PRO CG C -10.549 6.157 -7.119 1.00 . A A . 30 PRO CG 1 1 15 10409 1 1 30 PRO HA H -8.198 7.189 -5.662 1.00 . A A . 30 PRO HA 1 1 15 10410 1 1 30 PRO HB2 H -11.030 6.537 -5.073 1.00 . A A . 30 PRO HB2 1 1 15 10411 1 1 30 PRO HB3 H -10.348 7.920 -5.934 1.00 . A A . 30 PRO HB3 1 1 15 10412 1 1 30 PRO HD2 H -10.422 4.089 -6.602 1.00 . A A . 30 PRO HD2 1 1 15 10413 1 1 30 PRO HD3 H -9.448 4.561 -8.012 1.00 . A A . 30 PRO HD3 1 1 15 10414 1 1 30 PRO HG2 H -11.605 5.972 -7.252 1.00 . A A . 30 PRO HG2 1 1 15 10415 1 1 30 PRO HG3 H -10.167 6.758 -7.930 1.00 . A A . 30 PRO HG3 1 1 15 10416 1 1 30 PRO N N -8.668 5.183 -6.147 1.00 . A A . 30 PRO N 1 1 15 10417 1 1 30 PRO O O -8.042 6.806 -3.185 1.00 . A A . 30 PRO O 1 1 15 10418 1 1 31 LYS C C -8.881 3.814 -1.663 1.00 . A A . 31 LYS C 1 1 15 10419 1 1 31 LYS CA C -9.770 5.017 -1.956 1.00 . A A . 31 LYS CA 1 1 15 10420 1 1 31 LYS CB C -11.205 4.741 -1.508 1.00 . A A . 31 LYS CB 1 1 15 10421 1 1 31 LYS CD C -13.371 5.670 -2.383 1.00 . A A . 31 LYS CD 1 1 15 10422 1 1 31 LYS CE C -13.252 6.166 -3.815 1.00 . A A . 31 LYS CE 1 1 15 10423 1 1 31 LYS CG C -12.109 5.962 -1.586 1.00 . A A . 31 LYS CG 1 1 15 10424 1 1 31 LYS H H -10.335 4.854 -3.987 1.00 . A A . 31 LYS H 1 1 15 10425 1 1 31 LYS HA H -9.388 5.873 -1.418 1.00 . A A . 31 LYS HA 1 1 15 10426 1 1 31 LYS HB2 H -11.624 3.968 -2.135 1.00 . A A . 31 LYS HB2 1 1 15 10427 1 1 31 LYS HB3 H -11.191 4.396 -0.485 1.00 . A A . 31 LYS HB3 1 1 15 10428 1 1 31 LYS HD2 H -13.540 4.605 -2.394 1.00 . A A . 31 LYS HD2 1 1 15 10429 1 1 31 LYS HD3 H -14.206 6.165 -1.909 1.00 . A A . 31 LYS HD3 1 1 15 10430 1 1 31 LYS HE2 H -13.410 7.233 -3.829 1.00 . A A . 31 LYS HE2 1 1 15 10431 1 1 31 LYS HE3 H -12.258 5.945 -4.177 1.00 . A A . 31 LYS HE3 1 1 15 10432 1 1 31 LYS HG2 H -12.388 6.256 -0.586 1.00 . A A . 31 LYS HG2 1 1 15 10433 1 1 31 LYS HG3 H -11.569 6.767 -2.064 1.00 . A A . 31 LYS HG3 1 1 15 10434 1 1 31 LYS HZ1 H -14.771 6.243 -5.247 1.00 . A A . 31 LYS HZ1 1 1 15 10435 1 1 31 LYS HZ2 H -14.925 4.961 -4.154 1.00 . A A . 31 LYS HZ2 1 1 15 10436 1 1 31 LYS HZ3 H -13.767 4.887 -5.385 1.00 . A A . 31 LYS HZ3 1 1 15 10437 1 1 31 LYS N N -9.729 5.329 -3.382 1.00 . A A . 31 LYS N 1 1 15 10438 1 1 31 LYS NZ N -14.249 5.519 -4.713 1.00 . A A . 31 LYS NZ 1 1 15 10439 1 1 31 LYS O O -7.839 3.939 -1.021 1.00 . A A . 31 LYS O 1 1 15 10440 1 1 32 ALA C C -8.439 0.986 -0.537 1.00 . A A . 32 ALA C 1 1 15 10441 1 1 32 ALA CA C -8.561 1.409 -1.998 1.00 . A A . 32 ALA CA 1 1 15 10442 1 1 32 ALA CB C -7.180 1.536 -2.622 1.00 . A A . 32 ALA CB 1 1 15 10443 1 1 32 ALA H H -10.138 2.641 -2.680 1.00 . A A . 32 ALA H 1 1 15 10444 1 1 32 ALA HA H -9.094 0.639 -2.535 1.00 . A A . 32 ALA HA 1 1 15 10445 1 1 32 ALA HB1 H -6.670 0.585 -2.564 1.00 . A A . 32 ALA HB1 1 1 15 10446 1 1 32 ALA HB2 H -6.611 2.283 -2.088 1.00 . A A . 32 ALA HB2 1 1 15 10447 1 1 32 ALA HB3 H -7.277 1.829 -3.656 1.00 . A A . 32 ALA HB3 1 1 15 10448 1 1 32 ALA N N -9.305 2.656 -2.165 1.00 . A A . 32 ALA N 1 1 15 10449 1 1 32 ALA O O -8.010 1.761 0.318 1.00 . A A . 32 ALA O 1 1 15 10450 1 1 33 VAL C C -7.390 -1.588 1.220 1.00 . A A . 33 VAL C 1 1 15 10451 1 1 33 VAL CA C -8.701 -0.825 1.075 1.00 . A A . 33 VAL CA 1 1 15 10452 1 1 33 VAL CB C -9.876 -1.772 1.385 1.00 . A A . 33 VAL CB 1 1 15 10453 1 1 33 VAL CG1 C -10.030 -1.955 2.886 1.00 . A A . 33 VAL CG1 1 1 15 10454 1 1 33 VAL CG2 C -11.166 -1.247 0.769 1.00 . A A . 33 VAL CG2 1 1 15 10455 1 1 33 VAL H H -9.106 -0.841 -1.000 1.00 . A A . 33 VAL H 1 1 15 10456 1 1 33 VAL HA H -8.717 -0.008 1.783 1.00 . A A . 33 VAL HA 1 1 15 10457 1 1 33 VAL HB H -9.661 -2.735 0.947 1.00 . A A . 33 VAL HB 1 1 15 10458 1 1 33 VAL HG11 H -10.960 -1.512 3.211 1.00 . A A . 33 VAL HG11 1 1 15 10459 1 1 33 VAL HG12 H -9.205 -1.475 3.394 1.00 . A A . 33 VAL HG12 1 1 15 10460 1 1 33 VAL HG13 H -10.033 -3.009 3.121 1.00 . A A . 33 VAL HG13 1 1 15 10461 1 1 33 VAL HG21 H -11.807 -0.864 1.550 1.00 . A A . 33 VAL HG21 1 1 15 10462 1 1 33 VAL HG22 H -11.669 -2.049 0.251 1.00 . A A . 33 VAL HG22 1 1 15 10463 1 1 33 VAL HG23 H -10.937 -0.455 0.071 1.00 . A A . 33 VAL HG23 1 1 15 10464 1 1 33 VAL N N -8.794 -0.268 -0.269 1.00 . A A . 33 VAL N 1 1 15 10465 1 1 33 VAL O O -7.110 -2.503 0.450 1.00 . A A . 33 VAL O 1 1 15 10466 1 1 34 CYS C C -5.431 -3.239 3.015 1.00 . A A . 34 CYS C 1 1 15 10467 1 1 34 CYS CA C -5.287 -1.851 2.401 1.00 . A A . 34 CYS CA 1 1 15 10468 1 1 34 CYS CB C -4.397 -0.977 3.284 1.00 . A A . 34 CYS CB 1 1 15 10469 1 1 34 CYS H H -6.841 -0.464 2.780 1.00 . A A . 34 CYS H 1 1 15 10470 1 1 34 CYS HA H -4.817 -1.953 1.434 1.00 . A A . 34 CYS HA 1 1 15 10471 1 1 34 CYS HB2 H -4.138 -0.085 2.740 1.00 . A A . 34 CYS HB2 1 1 15 10472 1 1 34 CYS HB3 H -4.943 -0.703 4.174 1.00 . A A . 34 CYS HB3 1 1 15 10473 1 1 34 CYS N N -6.577 -1.204 2.194 1.00 . A A . 34 CYS N 1 1 15 10474 1 1 34 CYS O O -5.664 -3.379 4.215 1.00 . A A . 34 CYS O 1 1 15 10475 1 1 34 CYS SG S -2.842 -1.769 3.808 1.00 . A A . 34 CYS SG 1 1 15 10476 1 1 35 CYS C C -4.272 -5.858 3.727 1.00 . A A . 35 CYS C 1 1 15 10477 1 1 35 CYS CA C -5.319 -5.645 2.642 1.00 . A A . 35 CYS CA 1 1 15 10478 1 1 35 CYS CB C -5.088 -6.612 1.480 1.00 . A A . 35 CYS CB 1 1 15 10479 1 1 35 CYS H H -5.040 -4.082 1.246 1.00 . A A . 35 CYS H 1 1 15 10480 1 1 35 CYS HA H -6.300 -5.813 3.060 1.00 . A A . 35 CYS HA 1 1 15 10481 1 1 35 CYS HB2 H -5.546 -6.208 0.589 1.00 . A A . 35 CYS HB2 1 1 15 10482 1 1 35 CYS HB3 H -4.026 -6.718 1.315 1.00 . A A . 35 CYS HB3 1 1 15 10483 1 1 35 CYS N N -5.252 -4.264 2.183 1.00 . A A . 35 CYS N 1 1 15 10484 1 1 35 CYS O O -3.062 -5.782 3.463 1.00 . A A . 35 CYS O 1 1 15 10485 1 1 35 CYS SG S -5.779 -8.276 1.748 1.00 . A A . 35 CYS SG 1 1 15 10486 1 1 36 ASP C C -3.661 -7.771 6.420 1.00 . A A . 36 ASP C 1 1 15 10487 1 1 36 ASP CA C -3.883 -6.297 6.099 1.00 . A A . 36 ASP CA 1 1 15 10488 1 1 36 ASP CB C -4.466 -5.586 7.321 1.00 . A A . 36 ASP CB 1 1 15 10489 1 1 36 ASP CG C -4.100 -4.115 7.364 1.00 . A A . 36 ASP CG 1 1 15 10490 1 1 36 ASP H H -5.725 -6.142 5.064 1.00 . A A . 36 ASP H 1 1 15 10491 1 1 36 ASP HA H -2.929 -5.850 5.865 1.00 . A A . 36 ASP HA 1 1 15 10492 1 1 36 ASP HB2 H -5.543 -5.668 7.297 1.00 . A A . 36 ASP HB2 1 1 15 10493 1 1 36 ASP HB3 H -4.091 -6.058 8.216 1.00 . A A . 36 ASP HB3 1 1 15 10494 1 1 36 ASP N N -4.753 -6.102 4.944 1.00 . A A . 36 ASP N 1 1 15 10495 1 1 36 ASP O O -2.770 -8.102 7.201 1.00 . A A . 36 ASP O 1 1 15 10496 1 1 36 ASP OD1 O -2.930 -3.803 7.674 1.00 . A A . 36 ASP OD1 1 1 15 10497 1 1 36 ASP OD2 O -4.981 -3.275 7.086 1.00 . A A . 36 ASP OD2 1 1 15 10498 1 1 37 ASP C C -2.857 -10.500 5.797 1.00 . A A . 37 ASP C 1 1 15 10499 1 1 37 ASP CA C -4.297 -10.088 6.068 1.00 . A A . 37 ASP CA 1 1 15 10500 1 1 37 ASP CB C -5.249 -10.894 5.183 1.00 . A A . 37 ASP CB 1 1 15 10501 1 1 37 ASP CG C -5.740 -12.157 5.863 1.00 . A A . 37 ASP CG 1 1 15 10502 1 1 37 ASP H H -5.148 -8.362 5.196 1.00 . A A . 37 ASP H 1 1 15 10503 1 1 37 ASP HA H -4.527 -10.278 7.106 1.00 . A A . 37 ASP HA 1 1 15 10504 1 1 37 ASP HB2 H -6.105 -10.284 4.938 1.00 . A A . 37 ASP HB2 1 1 15 10505 1 1 37 ASP HB3 H -4.736 -11.171 4.274 1.00 . A A . 37 ASP HB3 1 1 15 10506 1 1 37 ASP N N -4.455 -8.659 5.821 1.00 . A A . 37 ASP N 1 1 15 10507 1 1 37 ASP O O -2.265 -11.280 6.543 1.00 . A A . 37 ASP O 1 1 15 10508 1 1 37 ASP OD1 O -4.952 -12.776 6.608 1.00 . A A . 37 ASP OD1 1 1 15 10509 1 1 37 ASP OD2 O -6.913 -12.527 5.649 1.00 . A A . 37 ASP OD2 1 1 15 10510 1 1 38 MET C C -0.202 -8.902 4.062 1.00 . A A . 38 MET C 1 1 15 10511 1 1 38 MET CA C -0.927 -10.215 4.341 1.00 . A A . 38 MET CA 1 1 15 10512 1 1 38 MET CB C -0.885 -11.124 3.108 1.00 . A A . 38 MET CB 1 1 15 10513 1 1 38 MET CE C 0.453 -13.442 1.170 1.00 . A A . 38 MET CE 1 1 15 10514 1 1 38 MET CG C -0.897 -12.607 3.445 1.00 . A A . 38 MET CG 1 1 15 10515 1 1 38 MET H H -2.831 -9.322 4.187 1.00 . A A . 38 MET H 1 1 15 10516 1 1 38 MET HA H -0.440 -10.714 5.166 1.00 . A A . 38 MET HA 1 1 15 10517 1 1 38 MET HB2 H -1.745 -10.910 2.490 1.00 . A A . 38 MET HB2 1 1 15 10518 1 1 38 MET HB3 H 0.013 -10.910 2.547 1.00 . A A . 38 MET HB3 1 1 15 10519 1 1 38 MET HE1 H 1.389 -13.151 0.720 1.00 . A A . 38 MET HE1 1 1 15 10520 1 1 38 MET HE2 H -0.318 -12.743 0.882 1.00 . A A . 38 MET HE2 1 1 15 10521 1 1 38 MET HE3 H 0.184 -14.433 0.833 1.00 . A A . 38 MET HE3 1 1 15 10522 1 1 38 MET HG2 H -1.023 -12.719 4.511 1.00 . A A . 38 MET HG2 1 1 15 10523 1 1 38 MET HG3 H -1.729 -13.071 2.935 1.00 . A A . 38 MET HG3 1 1 15 10524 1 1 38 MET N N -2.301 -9.944 4.727 1.00 . A A . 38 MET N 1 1 15 10525 1 1 38 MET O O 0.244 -8.223 4.988 1.00 . A A . 38 MET O 1 1 15 10526 1 1 38 MET SD S 0.623 -13.444 2.953 1.00 . A A . 38 MET SD 1 1 15 10527 1 1 39 GLN C C -0.073 -6.814 1.051 1.00 . A A . 39 GLN C 1 1 15 10528 1 1 39 GLN CA C 0.492 -7.265 2.395 1.00 . A A . 39 GLN CA 1 1 15 10529 1 1 39 GLN CB C 2.012 -7.419 2.309 1.00 . A A . 39 GLN CB 1 1 15 10530 1 1 39 GLN CD C 3.449 -9.482 2.578 1.00 . A A . 39 GLN CD 1 1 15 10531 1 1 39 GLN CG C 2.458 -8.741 1.702 1.00 . A A . 39 GLN CG 1 1 15 10532 1 1 39 GLN H H -0.550 -9.070 2.096 1.00 . A A . 39 GLN H 1 1 15 10533 1 1 39 GLN HA H 0.250 -6.524 3.144 1.00 . A A . 39 GLN HA 1 1 15 10534 1 1 39 GLN HB2 H 2.411 -6.617 1.706 1.00 . A A . 39 GLN HB2 1 1 15 10535 1 1 39 GLN HB3 H 2.427 -7.350 3.305 1.00 . A A . 39 GLN HB3 1 1 15 10536 1 1 39 GLN HE21 H 4.943 -8.381 1.861 1.00 . A A . 39 GLN HE21 1 1 15 10537 1 1 39 GLN HE22 H 5.382 -9.568 3.039 1.00 . A A . 39 GLN HE22 1 1 15 10538 1 1 39 GLN HG2 H 1.591 -9.366 1.557 1.00 . A A . 39 GLN HG2 1 1 15 10539 1 1 39 GLN HG3 H 2.922 -8.543 0.745 1.00 . A A . 39 GLN HG3 1 1 15 10540 1 1 39 GLN N N -0.129 -8.523 2.790 1.00 . A A . 39 GLN N 1 1 15 10541 1 1 39 GLN NE2 N 4.719 -9.105 2.483 1.00 . A A . 39 GLN NE2 1 1 15 10542 1 1 39 GLN O O 0.531 -7.080 0.011 1.00 . A A . 39 GLN O 1 1 15 10543 1 1 39 GLN OE1 O 3.078 -10.381 3.331 1.00 . A A . 39 GLN OE1 1 1 15 10544 1 1 40 HIS C C -2.906 -4.693 -0.068 1.00 . A A . 40 HIS C 1 1 15 10545 1 1 40 HIS CA C -1.829 -5.753 -0.224 1.00 . A A . 40 HIS CA 1 1 15 10546 1 1 40 HIS CB C -2.407 -6.970 -0.950 1.00 . A A . 40 HIS CB 1 1 15 10547 1 1 40 HIS CD2 C -1.082 -6.444 -3.121 1.00 . A A . 40 HIS CD2 1 1 15 10548 1 1 40 HIS CE1 C -1.078 -8.457 -3.988 1.00 . A A . 40 HIS CE1 1 1 15 10549 1 1 40 HIS CG C -1.748 -7.257 -2.264 1.00 . A A . 40 HIS CG 1 1 15 10550 1 1 40 HIS H H -1.709 -6.004 1.904 1.00 . A A . 40 HIS H 1 1 15 10551 1 1 40 HIS HA H -1.035 -5.343 -0.829 1.00 . A A . 40 HIS HA 1 1 15 10552 1 1 40 HIS HB2 H -2.291 -7.842 -0.324 1.00 . A A . 40 HIS HB2 1 1 15 10553 1 1 40 HIS HB3 H -3.458 -6.803 -1.134 1.00 . A A . 40 HIS HB3 1 1 15 10554 1 1 40 HIS HD1 H -2.131 -9.320 -2.459 1.00 . A A . 40 HIS HD1 1 1 15 10555 1 1 40 HIS HD2 H -0.903 -5.385 -2.991 1.00 . A A . 40 HIS HD2 1 1 15 10556 1 1 40 HIS HE1 H -0.906 -9.288 -4.656 1.00 . A A . 40 HIS HE1 1 1 15 10557 1 1 40 HIS HE2 H -0.219 -6.886 -4.983 1.00 . A A . 40 HIS HE2 1 1 15 10558 1 1 40 HIS N N -1.239 -6.166 1.049 1.00 . A A . 40 HIS N 1 1 15 10559 1 1 40 HIS ND1 N -1.728 -8.511 -2.838 1.00 . A A . 40 HIS ND1 1 1 15 10560 1 1 40 HIS NE2 N -0.678 -7.215 -4.181 1.00 . A A . 40 HIS NE2 1 1 15 10561 1 1 40 HIS O O -3.117 -4.152 1.013 1.00 . A A . 40 HIS O 1 1 15 10562 1 1 41 CYS C C -5.650 -3.790 -2.323 1.00 . A A . 41 CYS C 1 1 15 10563 1 1 41 CYS CA C -4.644 -3.420 -1.236 1.00 . A A . 41 CYS CA 1 1 15 10564 1 1 41 CYS CB C -4.072 -2.029 -1.504 1.00 . A A . 41 CYS CB 1 1 15 10565 1 1 41 CYS H H -3.336 -4.882 -2.010 1.00 . A A . 41 CYS H 1 1 15 10566 1 1 41 CYS HA H -5.144 -3.419 -0.279 1.00 . A A . 41 CYS HA 1 1 15 10567 1 1 41 CYS HB2 H -4.516 -1.633 -2.405 1.00 . A A . 41 CYS HB2 1 1 15 10568 1 1 41 CYS HB3 H -4.316 -1.382 -0.674 1.00 . A A . 41 CYS HB3 1 1 15 10569 1 1 41 CYS N N -3.574 -4.407 -1.186 1.00 . A A . 41 CYS N 1 1 15 10570 1 1 41 CYS O O -5.292 -4.408 -3.326 1.00 . A A . 41 CYS O 1 1 15 10571 1 1 41 CYS SG S -2.264 -1.999 -1.719 1.00 . A A . 41 CYS SG 1 1 15 10572 1 1 42 CYS C C -8.595 -2.421 -3.598 1.00 . A A . 42 CYS C 1 1 15 10573 1 1 42 CYS CA C -7.963 -3.712 -3.077 1.00 . A A . 42 CYS CA 1 1 15 10574 1 1 42 CYS CB C -9.028 -4.599 -2.429 1.00 . A A . 42 CYS CB 1 1 15 10575 1 1 42 CYS H H -7.132 -2.929 -1.300 1.00 . A A . 42 CYS H 1 1 15 10576 1 1 42 CYS HA H -7.519 -4.242 -3.906 1.00 . A A . 42 CYS HA 1 1 15 10577 1 1 42 CYS HB2 H -8.591 -5.112 -1.584 1.00 . A A . 42 CYS HB2 1 1 15 10578 1 1 42 CYS HB3 H -9.841 -3.978 -2.084 1.00 . A A . 42 CYS HB3 1 1 15 10579 1 1 42 CYS N N -6.907 -3.414 -2.117 1.00 . A A . 42 CYS N 1 1 15 10580 1 1 42 CYS O O -8.684 -1.433 -2.870 1.00 . A A . 42 CYS O 1 1 15 10581 1 1 42 CYS SG S -9.730 -5.864 -3.540 1.00 . A A . 42 CYS SG 1 1 15 10582 1 1 43 PRO C C -10.688 -0.554 -4.602 1.00 . A A . 43 PRO C 1 1 15 10583 1 1 43 PRO CA C -9.652 -1.233 -5.495 1.00 . A A . 43 PRO CA 1 1 15 10584 1 1 43 PRO CB C -10.318 -1.813 -6.739 1.00 . A A . 43 PRO CB 1 1 15 10585 1 1 43 PRO CD C -8.954 -3.549 -5.812 1.00 . A A . 43 PRO CD 1 1 15 10586 1 1 43 PRO CG C -9.468 -2.979 -7.107 1.00 . A A . 43 PRO CG 1 1 15 10587 1 1 43 PRO HA H -8.908 -0.509 -5.790 1.00 . A A . 43 PRO HA 1 1 15 10588 1 1 43 PRO HB2 H -11.328 -2.118 -6.503 1.00 . A A . 43 PRO HB2 1 1 15 10589 1 1 43 PRO HB3 H -10.333 -1.072 -7.524 1.00 . A A . 43 PRO HB3 1 1 15 10590 1 1 43 PRO HD2 H -9.582 -4.364 -5.484 1.00 . A A . 43 PRO HD2 1 1 15 10591 1 1 43 PRO HD3 H -7.933 -3.881 -5.926 1.00 . A A . 43 PRO HD3 1 1 15 10592 1 1 43 PRO HG2 H -10.061 -3.714 -7.632 1.00 . A A . 43 PRO HG2 1 1 15 10593 1 1 43 PRO HG3 H -8.644 -2.651 -7.724 1.00 . A A . 43 PRO HG3 1 1 15 10594 1 1 43 PRO N N -9.035 -2.412 -4.872 1.00 . A A . 43 PRO N 1 1 15 10595 1 1 43 PRO O O -11.272 -1.181 -3.717 1.00 . A A . 43 PRO O 1 1 15 10596 1 1 44 ALA C C -13.288 0.990 -4.276 1.00 . A A . 44 ALA C 1 1 15 10597 1 1 44 ALA CA C -11.870 1.515 -4.080 1.00 . A A . 44 ALA CA 1 1 15 10598 1 1 44 ALA CB C -11.793 2.983 -4.473 1.00 . A A . 44 ALA CB 1 1 15 10599 1 1 44 ALA H H -10.410 1.170 -5.572 1.00 . A A . 44 ALA H 1 1 15 10600 1 1 44 ALA HA H -11.607 1.432 -3.035 1.00 . A A . 44 ALA HA 1 1 15 10601 1 1 44 ALA HB1 H -11.204 3.084 -5.372 1.00 . A A . 44 ALA HB1 1 1 15 10602 1 1 44 ALA HB2 H -11.331 3.545 -3.675 1.00 . A A . 44 ALA HB2 1 1 15 10603 1 1 44 ALA HB3 H -12.788 3.361 -4.650 1.00 . A A . 44 ALA HB3 1 1 15 10604 1 1 44 ALA N N -10.909 0.735 -4.850 1.00 . A A . 44 ALA N 1 1 15 10605 1 1 44 ALA O O -13.971 1.360 -5.231 1.00 . A A . 44 ALA O 1 1 15 10606 1 1 45 GLY C C -15.023 -1.950 -3.619 1.00 . A A . 45 GLY C 1 1 15 10607 1 1 45 GLY CA C -15.052 -0.444 -3.459 1.00 . A A . 45 GLY CA 1 1 15 10608 1 1 45 GLY H H -13.130 -0.138 -2.631 1.00 . A A . 45 GLY H 1 1 15 10609 1 1 45 GLY HA2 H -15.600 -0.198 -2.561 1.00 . A A . 45 GLY HA2 1 1 15 10610 1 1 45 GLY HA3 H -15.560 -0.013 -4.308 1.00 . A A . 45 GLY HA3 1 1 15 10611 1 1 45 GLY N N -13.721 0.123 -3.367 1.00 . A A . 45 GLY N 1 1 15 10612 1 1 45 GLY O O -16.050 -2.575 -3.888 1.00 . A A . 45 GLY O 1 1 15 10613 1 1 46 TYR C C -13.292 -4.585 -2.225 1.00 . A A . 46 TYR C 1 1 15 10614 1 1 46 TYR CA C -13.673 -3.977 -3.570 1.00 . A A . 46 TYR CA 1 1 15 10615 1 1 46 TYR CB C -12.594 -4.306 -4.608 1.00 . A A . 46 TYR CB 1 1 15 10616 1 1 46 TYR CD1 C -12.691 -5.092 -7.005 1.00 . A A . 46 TYR CD1 1 1 15 10617 1 1 46 TYR CD2 C -13.811 -3.063 -6.449 1.00 . A A . 46 TYR CD2 1 1 15 10618 1 1 46 TYR CE1 C -13.090 -4.958 -8.321 1.00 . A A . 46 TYR CE1 1 1 15 10619 1 1 46 TYR CE2 C -14.216 -2.923 -7.763 1.00 . A A . 46 TYR CE2 1 1 15 10620 1 1 46 TYR CG C -13.042 -4.150 -6.047 1.00 . A A . 46 TYR CG 1 1 15 10621 1 1 46 TYR CZ C -13.853 -3.872 -8.695 1.00 . A A . 46 TYR CZ 1 1 15 10622 1 1 46 TYR H H -13.059 -1.983 -3.230 1.00 . A A . 46 TYR H 1 1 15 10623 1 1 46 TYR HA H -14.614 -4.397 -3.892 1.00 . A A . 46 TYR HA 1 1 15 10624 1 1 46 TYR HB2 H -11.747 -3.656 -4.455 1.00 . A A . 46 TYR HB2 1 1 15 10625 1 1 46 TYR HB3 H -12.280 -5.331 -4.470 1.00 . A A . 46 TYR HB3 1 1 15 10626 1 1 46 TYR HD1 H -12.093 -5.942 -6.709 1.00 . A A . 46 TYR HD1 1 1 15 10627 1 1 46 TYR HD2 H -14.093 -2.321 -5.718 1.00 . A A . 46 TYR HD2 1 1 15 10628 1 1 46 TYR HE1 H -12.806 -5.702 -9.050 1.00 . A A . 46 TYR HE1 1 1 15 10629 1 1 46 TYR HE2 H -14.814 -2.072 -8.055 1.00 . A A . 46 TYR HE2 1 1 15 10630 1 1 46 TYR HH H -13.926 -4.475 -10.518 1.00 . A A . 46 TYR HH 1 1 15 10631 1 1 46 TYR N N -13.840 -2.534 -3.448 1.00 . A A . 46 TYR N 1 1 15 10632 1 1 46 TYR O O -13.014 -3.868 -1.264 1.00 . A A . 46 TYR O 1 1 15 10633 1 1 46 TYR OH O -14.254 -3.735 -10.003 1.00 . A A . 46 TYR OH 1 1 15 10634 1 1 47 LYS C C -11.725 -7.533 -1.188 1.00 . A A . 47 LYS C 1 1 15 10635 1 1 47 LYS CA C -12.922 -6.621 -0.946 1.00 . A A . 47 LYS CA 1 1 15 10636 1 1 47 LYS CB C -14.111 -7.441 -0.444 1.00 . A A . 47 LYS CB 1 1 15 10637 1 1 47 LYS CD C -13.866 -9.104 1.424 1.00 . A A . 47 LYS CD 1 1 15 10638 1 1 47 LYS CE C -15.155 -9.909 1.407 1.00 . A A . 47 LYS CE 1 1 15 10639 1 1 47 LYS CG C -14.113 -7.648 1.061 1.00 . A A . 47 LYS CG 1 1 15 10640 1 1 47 LYS H H -13.503 -6.426 -2.969 1.00 . A A . 47 LYS H 1 1 15 10641 1 1 47 LYS HA H -12.657 -5.888 -0.199 1.00 . A A . 47 LYS HA 1 1 15 10642 1 1 47 LYS HB2 H -15.024 -6.933 -0.717 1.00 . A A . 47 LYS HB2 1 1 15 10643 1 1 47 LYS HB3 H -14.092 -8.410 -0.918 1.00 . A A . 47 LYS HB3 1 1 15 10644 1 1 47 LYS HD2 H -13.178 -9.530 0.709 1.00 . A A . 47 LYS HD2 1 1 15 10645 1 1 47 LYS HD3 H -13.434 -9.151 2.413 1.00 . A A . 47 LYS HD3 1 1 15 10646 1 1 47 LYS HE2 H -15.715 -9.648 0.522 1.00 . A A . 47 LYS HE2 1 1 15 10647 1 1 47 LYS HE3 H -14.906 -10.960 1.379 1.00 . A A . 47 LYS HE3 1 1 15 10648 1 1 47 LYS HG2 H -13.335 -7.041 1.500 1.00 . A A . 47 LYS HG2 1 1 15 10649 1 1 47 LYS HG3 H -15.072 -7.345 1.455 1.00 . A A . 47 LYS HG3 1 1 15 10650 1 1 47 LYS HZ1 H -16.925 -9.282 2.321 1.00 . A A . 47 LYS HZ1 1 1 15 10651 1 1 47 LYS HZ2 H -15.531 -8.932 3.214 1.00 . A A . 47 LYS HZ2 1 1 15 10652 1 1 47 LYS HZ3 H -16.121 -10.515 3.155 1.00 . A A . 47 LYS HZ3 1 1 15 10653 1 1 47 LYS N N -13.276 -5.912 -2.168 1.00 . A A . 47 LYS N 1 1 15 10654 1 1 47 LYS NZ N -15.991 -9.641 2.608 1.00 . A A . 47 LYS NZ 1 1 15 10655 1 1 47 LYS O O -11.586 -8.112 -2.267 1.00 . A A . 47 LYS O 1 1 15 10656 1 1 48 CYS C C -10.009 -9.928 0.188 1.00 . A A . 48 CYS C 1 1 15 10657 1 1 48 CYS CA C -9.692 -8.517 -0.288 1.00 . A A . 48 CYS CA 1 1 15 10658 1 1 48 CYS CB C -8.536 -7.937 0.531 1.00 . A A . 48 CYS CB 1 1 15 10659 1 1 48 CYS H H -11.032 -7.193 0.663 1.00 . A A . 48 CYS H 1 1 15 10660 1 1 48 CYS HA H -9.402 -8.556 -1.328 1.00 . A A . 48 CYS HA 1 1 15 10661 1 1 48 CYS HB2 H -8.503 -6.867 0.385 1.00 . A A . 48 CYS HB2 1 1 15 10662 1 1 48 CYS HB3 H -8.707 -8.147 1.578 1.00 . A A . 48 CYS HB3 1 1 15 10663 1 1 48 CYS N N -10.868 -7.666 -0.180 1.00 . A A . 48 CYS N 1 1 15 10664 1 1 48 CYS O O -10.453 -10.125 1.320 1.00 . A A . 48 CYS O 1 1 15 10665 1 1 48 CYS SG S -6.902 -8.607 0.090 1.00 . A A . 48 CYS SG 1 1 15 10666 1 1 49 GLY C C -8.897 -12.932 0.422 1.00 . A A . 49 GLY C 1 1 15 10667 1 1 49 GLY CA C -10.053 -12.286 -0.320 1.00 . A A . 49 GLY CA 1 1 15 10668 1 1 49 GLY H H -9.428 -10.693 -1.567 1.00 . A A . 49 GLY H 1 1 15 10669 1 1 49 GLY HA2 H -10.932 -12.317 0.308 1.00 . A A . 49 GLY HA2 1 1 15 10670 1 1 49 GLY HA3 H -10.248 -12.849 -1.220 1.00 . A A . 49 GLY HA3 1 1 15 10671 1 1 49 GLY N N -9.782 -10.907 -0.678 1.00 . A A . 49 GLY N 1 1 15 10672 1 1 49 GLY O O -7.776 -12.423 0.387 1.00 . A A . 49 GLY O 1 1 15 10673 1 1 50 PRO C C -7.220 -15.603 0.898 1.00 . A A . 50 PRO C 1 1 15 10674 1 1 50 PRO CA C -8.094 -14.780 1.837 1.00 . A A . 50 PRO CA 1 1 15 10675 1 1 50 PRO CB C -8.890 -15.682 2.778 1.00 . A A . 50 PRO CB 1 1 15 10676 1 1 50 PRO CD C -10.442 -14.757 1.182 1.00 . A A . 50 PRO CD 1 1 15 10677 1 1 50 PRO CG C -10.168 -15.955 2.058 1.00 . A A . 50 PRO CG 1 1 15 10678 1 1 50 PRO HA H -7.477 -14.102 2.408 1.00 . A A . 50 PRO HA 1 1 15 10679 1 1 50 PRO HB2 H -8.336 -16.592 2.960 1.00 . A A . 50 PRO HB2 1 1 15 10680 1 1 50 PRO HB3 H -9.065 -15.168 3.710 1.00 . A A . 50 PRO HB3 1 1 15 10681 1 1 50 PRO HD2 H -10.768 -15.075 0.203 1.00 . A A . 50 PRO HD2 1 1 15 10682 1 1 50 PRO HD3 H -11.186 -14.116 1.635 1.00 . A A . 50 PRO HD3 1 1 15 10683 1 1 50 PRO HG2 H -10.063 -16.842 1.453 1.00 . A A . 50 PRO HG2 1 1 15 10684 1 1 50 PRO HG3 H -10.967 -16.084 2.773 1.00 . A A . 50 PRO HG3 1 1 15 10685 1 1 50 PRO N N -9.137 -14.068 1.099 1.00 . A A . 50 PRO N 1 1 15 10686 1 1 50 PRO O O -7.386 -16.817 0.780 1.00 . A A . 50 PRO O 1 1 15 10687 1 1 51 GLY C C -6.130 -15.774 -2.068 1.00 . A A . 51 GLY C 1 1 15 10688 1 1 51 GLY CA C -5.443 -15.595 -0.745 1.00 . A A . 51 GLY CA 1 1 15 10689 1 1 51 GLY H H -6.242 -13.953 0.327 1.00 . A A . 51 GLY H 1 1 15 10690 1 1 51 GLY HA2 H -4.561 -14.991 -0.909 1.00 . A A . 51 GLY HA2 1 1 15 10691 1 1 51 GLY HA3 H -5.157 -16.560 -0.356 1.00 . A A . 51 GLY HA3 1 1 15 10692 1 1 51 GLY N N -6.310 -14.924 0.207 1.00 . A A . 51 GLY N 1 1 15 10693 1 1 51 GLY O O -5.473 -15.799 -3.109 1.00 . A A . 51 GLY O 1 1 15 10694 1 1 52 GLY C C -7.741 -14.944 -4.240 1.00 . A A . 52 GLY C 1 1 15 10695 1 1 52 GLY CA C -8.204 -15.993 -3.263 1.00 . A A . 52 GLY CA 1 1 15 10696 1 1 52 GLY H H -7.924 -15.818 -1.175 1.00 . A A . 52 GLY H 1 1 15 10697 1 1 52 GLY HA2 H -8.042 -16.977 -3.682 1.00 . A A . 52 GLY HA2 1 1 15 10698 1 1 52 GLY HA3 H -9.255 -15.854 -3.063 1.00 . A A . 52 GLY HA3 1 1 15 10699 1 1 52 GLY N N -7.457 -15.865 -2.035 1.00 . A A . 52 GLY N 1 1 15 10700 1 1 52 GLY O O -6.911 -15.231 -5.099 1.00 . A A . 52 GLY O 1 1 15 10701 1 1 53 THR C C -8.768 -11.389 -4.590 1.00 . A A . 53 THR C 1 1 15 10702 1 1 53 THR CA C -7.863 -12.578 -4.899 1.00 . A A . 53 THR CA 1 1 15 10703 1 1 53 THR CB C -7.870 -12.885 -6.406 1.00 . A A . 53 THR CB 1 1 15 10704 1 1 53 THR CG2 C -6.455 -13.233 -6.850 1.00 . A A . 53 THR CG2 1 1 15 10705 1 1 53 THR H H -8.880 -13.547 -3.345 1.00 . A A . 53 THR H 1 1 15 10706 1 1 53 THR HA H -6.853 -12.310 -4.619 1.00 . A A . 53 THR HA 1 1 15 10707 1 1 53 THR HB H -8.196 -12.006 -6.941 1.00 . A A . 53 THR HB 1 1 15 10708 1 1 53 THR HG1 H -9.650 -13.635 -6.813 1.00 . A A . 53 THR HG1 1 1 15 10709 1 1 53 THR HG21 H -5.978 -12.354 -7.257 1.00 . A A . 53 THR HG21 1 1 15 10710 1 1 53 THR HG22 H -6.491 -14.007 -7.602 1.00 . A A . 53 THR HG22 1 1 15 10711 1 1 53 THR HG23 H -5.888 -13.587 -5.990 1.00 . A A . 53 THR HG23 1 1 15 10712 1 1 53 THR N N -8.247 -13.719 -4.073 1.00 . A A . 53 THR N 1 1 15 10713 1 1 53 THR O O -9.558 -11.444 -3.646 1.00 . A A . 53 THR O 1 1 15 10714 1 1 53 THR OG1 O -8.759 -13.973 -6.692 1.00 . A A . 53 THR OG1 1 1 15 10715 1 1 54 CYS C C -10.828 -9.288 -5.841 1.00 . A A . 54 CYS C 1 1 15 10716 1 1 54 CYS CA C -9.488 -9.137 -5.130 1.00 . A A . 54 CYS CA 1 1 15 10717 1 1 54 CYS CB C -8.774 -7.872 -5.612 1.00 . A A . 54 CYS CB 1 1 15 10718 1 1 54 CYS H H -8.016 -10.312 -6.105 1.00 . A A . 54 CYS H 1 1 15 10719 1 1 54 CYS HA H -9.664 -9.061 -4.067 1.00 . A A . 54 CYS HA 1 1 15 10720 1 1 54 CYS HB2 H -7.951 -8.154 -6.251 1.00 . A A . 54 CYS HB2 1 1 15 10721 1 1 54 CYS HB3 H -9.471 -7.267 -6.175 1.00 . A A . 54 CYS HB3 1 1 15 10722 1 1 54 CYS N N -8.661 -10.317 -5.367 1.00 . A A . 54 CYS N 1 1 15 10723 1 1 54 CYS O O -10.881 -9.586 -7.035 1.00 . A A . 54 CYS O 1 1 15 10724 1 1 54 CYS SG S -8.102 -6.838 -4.268 1.00 . A A . 54 CYS SG 1 1 15 10725 1 1 55 ILE C C -14.017 -7.932 -5.614 1.00 . A A . 55 ILE C 1 1 15 10726 1 1 55 ILE CA C -13.257 -9.253 -5.630 1.00 . A A . 55 ILE CA 1 1 15 10727 1 1 55 ILE CB C -14.062 -10.306 -4.839 1.00 . A A . 55 ILE CB 1 1 15 10728 1 1 55 ILE CD1 C -14.338 -11.352 -2.519 1.00 . A A . 55 ILE CD1 1 1 15 10729 1 1 55 ILE CG1 C -13.618 -10.323 -3.370 1.00 . A A . 55 ILE CG1 1 1 15 10730 1 1 55 ILE CG2 C -13.891 -11.681 -5.472 1.00 . A A . 55 ILE CG2 1 1 15 10731 1 1 55 ILE H H -11.800 -8.888 -4.137 1.00 . A A . 55 ILE H 1 1 15 10732 1 1 55 ILE HA H -13.169 -9.593 -6.651 1.00 . A A . 55 ILE HA 1 1 15 10733 1 1 55 ILE HB H -15.107 -10.040 -4.891 1.00 . A A . 55 ILE HB 1 1 15 10734 1 1 55 ILE HD11 H -13.628 -11.836 -1.861 1.00 . A A . 55 ILE HD11 1 1 15 10735 1 1 55 ILE HD12 H -14.799 -12.090 -3.158 1.00 . A A . 55 ILE HD12 1 1 15 10736 1 1 55 ILE HD13 H -15.098 -10.862 -1.929 1.00 . A A . 55 ILE HD13 1 1 15 10737 1 1 55 ILE HG12 H -12.561 -10.538 -3.323 1.00 . A A . 55 ILE HG12 1 1 15 10738 1 1 55 ILE HG13 H -13.800 -9.349 -2.937 1.00 . A A . 55 ILE HG13 1 1 15 10739 1 1 55 ILE HG21 H -13.940 -12.439 -4.705 1.00 . A A . 55 ILE HG21 1 1 15 10740 1 1 55 ILE HG22 H -12.933 -11.732 -5.969 1.00 . A A . 55 ILE HG22 1 1 15 10741 1 1 55 ILE HG23 H -14.680 -11.846 -6.192 1.00 . A A . 55 ILE HG23 1 1 15 10742 1 1 55 ILE N N -11.910 -9.108 -5.087 1.00 . A A . 55 ILE N 1 1 15 10743 1 1 55 ILE O O -13.738 -7.054 -4.799 1.00 . A A . 55 ILE O 1 1 15 10744 1 1 56 SER C C -16.945 -6.629 -5.624 1.00 . A A . 56 SER C 1 1 15 10745 1 1 56 SER CA C -15.787 -6.591 -6.616 1.00 . A A . 56 SER CA 1 1 15 10746 1 1 56 SER CB C -16.322 -6.417 -8.040 1.00 . A A . 56 SER CB 1 1 15 10747 1 1 56 SER H H -15.154 -8.541 -7.142 1.00 . A A . 56 SER H 1 1 15 10748 1 1 56 SER HA H -15.152 -5.751 -6.376 1.00 . A A . 56 SER HA 1 1 15 10749 1 1 56 SER HB2 H -17.056 -5.624 -8.053 1.00 . A A . 56 SER HB2 1 1 15 10750 1 1 56 SER HB3 H -15.506 -6.164 -8.701 1.00 . A A . 56 SER HB3 1 1 15 10751 1 1 56 SER HG H -16.690 -8.339 -7.930 1.00 . A A . 56 SER HG 1 1 15 10752 1 1 56 SER N N -14.981 -7.802 -6.522 1.00 . A A . 56 SER N 1 1 15 10753 1 1 56 SER O O -18.031 -7.119 -6.001 1.00 . A A . 56 SER O 1 1 15 10754 1 1 56 SER OXT O -16.757 -6.170 -4.478 1.00 . A A . 56 SER OXT 1 1 15 10755 1 1 56 SER OG O -16.933 -7.609 -8.505 1.00 . A A . 56 SER OG 1 1 16 10756 1 1 1 ASP C C -0.847 12.128 -3.559 1.00 . A A . 1 ASP C 1 1 16 10757 1 1 1 ASP CA C -0.660 13.370 -4.409 1.00 . A A . 1 ASP CA 1 1 16 10758 1 1 1 ASP CB C 0.595 14.140 -3.972 1.00 . A A . 1 ASP CB 1 1 16 10759 1 1 1 ASP CG C 0.284 15.558 -3.532 1.00 . A A . 1 ASP CG 1 1 16 10760 1 1 1 ASP H1 H -1.895 14.690 -3.366 1.00 . A A . 1 ASP H1 1 1 16 10761 1 1 1 ASP H2 H -2.711 13.740 -4.504 1.00 . A A . 1 ASP H2 1 1 16 10762 1 1 1 ASP H3 H -1.756 15.038 -5.017 1.00 . A A . 1 ASP H3 1 1 16 10763 1 1 1 ASP HA H -0.541 13.065 -5.415 1.00 . A A . 1 ASP HA 1 1 16 10764 1 1 1 ASP HB2 H 1.065 13.625 -3.150 1.00 . A A . 1 ASP HB2 1 1 16 10765 1 1 1 ASP HB3 H 1.288 14.184 -4.798 1.00 . A A . 1 ASP HB3 1 1 16 10766 1 1 1 ASP N N -1.837 14.272 -4.318 1.00 . A A . 1 ASP N 1 1 16 10767 1 1 1 ASP O O -1.337 11.098 -4.022 1.00 . A A . 1 ASP O 1 1 16 10768 1 1 1 ASP OD1 O 0.365 16.474 -4.377 1.00 . A A . 1 ASP OD1 1 1 16 10769 1 1 1 ASP OD2 O -0.039 15.753 -2.341 1.00 . A A . 1 ASP OD2 1 1 16 10770 1 1 2 VAL C C -0.723 11.762 0.085 1.00 . A A . 2 VAL C 1 1 16 10771 1 1 2 VAL CA C -0.588 11.196 -1.334 1.00 . A A . 2 VAL CA 1 1 16 10772 1 1 2 VAL CB C 0.612 10.226 -1.452 1.00 . A A . 2 VAL CB 1 1 16 10773 1 1 2 VAL CG1 C 0.925 9.521 -0.138 1.00 . A A . 2 VAL CG1 1 1 16 10774 1 1 2 VAL CG2 C 0.336 9.211 -2.551 1.00 . A A . 2 VAL CG2 1 1 16 10775 1 1 2 VAL H H -0.139 13.136 -2.056 1.00 . A A . 2 VAL H 1 1 16 10776 1 1 2 VAL HA H -1.487 10.643 -1.566 1.00 . A A . 2 VAL HA 1 1 16 10777 1 1 2 VAL HB H 1.479 10.798 -1.741 1.00 . A A . 2 VAL HB 1 1 16 10778 1 1 2 VAL HG11 H 0.172 8.770 0.054 1.00 . A A . 2 VAL HG11 1 1 16 10779 1 1 2 VAL HG12 H 0.928 10.242 0.666 1.00 . A A . 2 VAL HG12 1 1 16 10780 1 1 2 VAL HG13 H 1.895 9.051 -0.204 1.00 . A A . 2 VAL HG13 1 1 16 10781 1 1 2 VAL HG21 H 0.054 8.268 -2.108 1.00 . A A . 2 VAL HG21 1 1 16 10782 1 1 2 VAL HG22 H 1.225 9.078 -3.149 1.00 . A A . 2 VAL HG22 1 1 16 10783 1 1 2 VAL HG23 H -0.468 9.569 -3.177 1.00 . A A . 2 VAL HG23 1 1 16 10784 1 1 2 VAL N N -0.469 12.264 -2.314 1.00 . A A . 2 VAL N 1 1 16 10785 1 1 2 VAL O O -0.449 12.940 0.318 1.00 . A A . 2 VAL O 1 1 16 10786 1 1 3 GLN C C -1.272 10.081 3.321 1.00 . A A . 3 GLN C 1 1 16 10787 1 1 3 GLN CA C -1.278 11.312 2.425 1.00 . A A . 3 GLN CA 1 1 16 10788 1 1 3 GLN CB C -2.572 12.093 2.639 1.00 . A A . 3 GLN CB 1 1 16 10789 1 1 3 GLN CD C -3.534 14.338 3.282 1.00 . A A . 3 GLN CD 1 1 16 10790 1 1 3 GLN CG C -2.387 13.601 2.619 1.00 . A A . 3 GLN CG 1 1 16 10791 1 1 3 GLN H H -1.302 9.980 0.786 1.00 . A A . 3 GLN H 1 1 16 10792 1 1 3 GLN HA H -0.437 11.938 2.684 1.00 . A A . 3 GLN HA 1 1 16 10793 1 1 3 GLN HB2 H -3.276 11.825 1.865 1.00 . A A . 3 GLN HB2 1 1 16 10794 1 1 3 GLN HB3 H -2.979 11.816 3.601 1.00 . A A . 3 GLN HB3 1 1 16 10795 1 1 3 GLN HE21 H -3.591 12.988 4.742 1.00 . A A . 3 GLN HE21 1 1 16 10796 1 1 3 GLN HE22 H -4.746 14.267 4.857 1.00 . A A . 3 GLN HE22 1 1 16 10797 1 1 3 GLN HG2 H -1.473 13.846 3.139 1.00 . A A . 3 GLN HG2 1 1 16 10798 1 1 3 GLN HG3 H -2.314 13.929 1.591 1.00 . A A . 3 GLN HG3 1 1 16 10799 1 1 3 GLN N N -1.127 10.913 1.028 1.00 . A A . 3 GLN N 1 1 16 10800 1 1 3 GLN NE2 N -4.005 13.812 4.408 1.00 . A A . 3 GLN NE2 1 1 16 10801 1 1 3 GLN O O -2.303 9.694 3.873 1.00 . A A . 3 GLN O 1 1 16 10802 1 1 3 GLN OE1 O -3.992 15.369 2.790 1.00 . A A . 3 GLN OE1 1 1 16 10803 1 1 4 CYS C C -0.494 8.467 5.668 1.00 . A A . 4 CYS C 1 1 16 10804 1 1 4 CYS CA C 0.044 8.260 4.257 1.00 . A A . 4 CYS CA 1 1 16 10805 1 1 4 CYS CB C 1.516 7.840 4.309 1.00 . A A . 4 CYS CB 1 1 16 10806 1 1 4 CYS H H 0.673 9.815 2.967 1.00 . A A . 4 CYS H 1 1 16 10807 1 1 4 CYS HA H -0.525 7.474 3.788 1.00 . A A . 4 CYS HA 1 1 16 10808 1 1 4 CYS HB2 H 1.999 8.348 5.130 1.00 . A A . 4 CYS HB2 1 1 16 10809 1 1 4 CYS HB3 H 1.571 6.774 4.470 1.00 . A A . 4 CYS HB3 1 1 16 10810 1 1 4 CYS N N -0.106 9.460 3.445 1.00 . A A . 4 CYS N 1 1 16 10811 1 1 4 CYS O O -1.411 7.771 6.102 1.00 . A A . 4 CYS O 1 1 16 10812 1 1 4 CYS SG S 2.458 8.223 2.792 1.00 . A A . 4 CYS SG 1 1 16 10813 1 1 5 GLY C C 0.155 11.039 8.222 1.00 . A A . 5 GLY C 1 1 16 10814 1 1 5 GLY CA C -0.343 9.699 7.733 1.00 . A A . 5 GLY CA 1 1 16 10815 1 1 5 GLY H H 0.810 9.944 5.976 1.00 . A A . 5 GLY H 1 1 16 10816 1 1 5 GLY HA2 H -1.419 9.686 7.772 1.00 . A A . 5 GLY HA2 1 1 16 10817 1 1 5 GLY HA3 H 0.039 8.927 8.384 1.00 . A A . 5 GLY HA3 1 1 16 10818 1 1 5 GLY N N 0.084 9.423 6.376 1.00 . A A . 5 GLY N 1 1 16 10819 1 1 5 GLY O O -0.528 11.729 8.981 1.00 . A A . 5 GLY O 1 1 16 10820 1 1 6 GLY C C 3.442 12.669 8.056 1.00 . A A . 6 GLY C 1 1 16 10821 1 1 6 GLY CA C 1.933 12.669 8.178 1.00 . A A . 6 GLY CA 1 1 16 10822 1 1 6 GLY H H 1.843 10.811 7.177 1.00 . A A . 6 GLY H 1 1 16 10823 1 1 6 GLY HA2 H 1.532 13.452 7.552 1.00 . A A . 6 GLY HA2 1 1 16 10824 1 1 6 GLY HA3 H 1.666 12.870 9.204 1.00 . A A . 6 GLY HA3 1 1 16 10825 1 1 6 GLY N N 1.351 11.406 7.781 1.00 . A A . 6 GLY N 1 1 16 10826 1 1 6 GLY O O 4.062 13.730 7.985 1.00 . A A . 6 GLY O 1 1 16 10827 1 1 7 GLY C C 5.965 11.005 6.551 1.00 . A A . 7 GLY C 1 1 16 10828 1 1 7 GLY CA C 5.485 11.382 7.941 1.00 . A A . 7 GLY CA 1 1 16 10829 1 1 7 GLY H H 3.514 10.656 8.113 1.00 . A A . 7 GLY H 1 1 16 10830 1 1 7 GLY HA2 H 5.915 12.335 8.208 1.00 . A A . 7 GLY HA2 1 1 16 10831 1 1 7 GLY HA3 H 5.832 10.636 8.642 1.00 . A A . 7 GLY HA3 1 1 16 10832 1 1 7 GLY N N 4.043 11.478 8.043 1.00 . A A . 7 GLY N 1 1 16 10833 1 1 7 GLY O O 6.927 11.589 6.052 1.00 . A A . 7 GLY O 1 1 16 10834 1 1 8 PHE C C 4.786 10.168 3.515 1.00 . A A . 8 PHE C 1 1 16 10835 1 1 8 PHE CA C 5.718 9.603 4.581 1.00 . A A . 8 PHE CA 1 1 16 10836 1 1 8 PHE CB C 5.747 8.076 4.493 1.00 . A A . 8 PHE CB 1 1 16 10837 1 1 8 PHE CD1 C 7.872 6.743 4.433 1.00 . A A . 8 PHE CD1 1 1 16 10838 1 1 8 PHE CD2 C 7.128 7.595 6.534 1.00 . A A . 8 PHE CD2 1 1 16 10839 1 1 8 PHE CE1 C 8.971 6.174 5.050 1.00 . A A . 8 PHE CE1 1 1 16 10840 1 1 8 PHE CE2 C 8.224 7.028 7.156 1.00 . A A . 8 PHE CE2 1 1 16 10841 1 1 8 PHE CG C 6.939 7.458 5.166 1.00 . A A . 8 PHE CG 1 1 16 10842 1 1 8 PHE CZ C 9.146 6.317 6.412 1.00 . A A . 8 PHE CZ 1 1 16 10843 1 1 8 PHE H H 4.547 9.582 6.354 1.00 . A A . 8 PHE H 1 1 16 10844 1 1 8 PHE HA H 6.713 9.980 4.405 1.00 . A A . 8 PHE HA 1 1 16 10845 1 1 8 PHE HB2 H 4.858 7.678 4.957 1.00 . A A . 8 PHE HB2 1 1 16 10846 1 1 8 PHE HB3 H 5.764 7.785 3.452 1.00 . A A . 8 PHE HB3 1 1 16 10847 1 1 8 PHE HD1 H 7.735 6.631 3.367 1.00 . A A . 8 PHE HD1 1 1 16 10848 1 1 8 PHE HD2 H 6.408 8.150 7.115 1.00 . A A . 8 PHE HD2 1 1 16 10849 1 1 8 PHE HE1 H 9.690 5.619 4.466 1.00 . A A . 8 PHE HE1 1 1 16 10850 1 1 8 PHE HE2 H 8.360 7.142 8.221 1.00 . A A . 8 PHE HE2 1 1 16 10851 1 1 8 PHE HZ H 10.005 5.874 6.896 1.00 . A A . 8 PHE HZ 1 1 16 10852 1 1 8 PHE N N 5.312 10.028 5.918 1.00 . A A . 8 PHE N 1 1 16 10853 1 1 8 PHE O O 3.784 10.812 3.825 1.00 . A A . 8 PHE O 1 1 16 10854 1 1 9 SER C C 4.552 9.505 -0.094 1.00 . A A . 9 SER C 1 1 16 10855 1 1 9 SER CA C 4.325 10.382 1.131 1.00 . A A . 9 SER CA 1 1 16 10856 1 1 9 SER CB C 4.658 11.838 0.798 1.00 . A A . 9 SER CB 1 1 16 10857 1 1 9 SER H H 5.934 9.387 2.078 1.00 . A A . 9 SER H 1 1 16 10858 1 1 9 SER HA H 3.285 10.317 1.417 1.00 . A A . 9 SER HA 1 1 16 10859 1 1 9 SER HB2 H 4.089 12.147 -0.069 1.00 . A A . 9 SER HB2 1 1 16 10860 1 1 9 SER HB3 H 4.402 12.466 1.639 1.00 . A A . 9 SER HB3 1 1 16 10861 1 1 9 SER HG H 6.289 12.913 0.642 1.00 . A A . 9 SER HG 1 1 16 10862 1 1 9 SER N N 5.126 9.912 2.256 1.00 . A A . 9 SER N 1 1 16 10863 1 1 9 SER O O 5.373 8.587 -0.071 1.00 . A A . 9 SER O 1 1 16 10864 1 1 9 SER OG O 6.038 11.994 0.516 1.00 . A A . 9 SER OG 1 1 16 10865 1 1 10 CYS C C 3.608 9.971 -3.591 1.00 . A A . 10 CYS C 1 1 16 10866 1 1 10 CYS CA C 3.979 9.076 -2.417 1.00 . A A . 10 CYS CA 1 1 16 10867 1 1 10 CYS CB C 3.129 7.804 -2.406 1.00 . A A . 10 CYS CB 1 1 16 10868 1 1 10 CYS H H 3.230 10.585 -1.128 1.00 . A A . 10 CYS H 1 1 16 10869 1 1 10 CYS HA H 5.019 8.800 -2.516 1.00 . A A . 10 CYS HA 1 1 16 10870 1 1 10 CYS HB2 H 2.337 7.916 -1.681 1.00 . A A . 10 CYS HB2 1 1 16 10871 1 1 10 CYS HB3 H 2.694 7.662 -3.385 1.00 . A A . 10 CYS HB3 1 1 16 10872 1 1 10 CYS N N 3.838 9.813 -1.168 1.00 . A A . 10 CYS N 1 1 16 10873 1 1 10 CYS O O 3.366 11.165 -3.414 1.00 . A A . 10 CYS O 1 1 16 10874 1 1 10 CYS SG S 4.054 6.292 -1.984 1.00 . A A . 10 CYS SG 1 1 16 10875 1 1 11 HIS C C 1.740 10.286 -6.183 1.00 . A A . 11 HIS C 1 1 16 10876 1 1 11 HIS CA C 3.248 10.180 -5.977 1.00 . A A . 11 HIS CA 1 1 16 10877 1 1 11 HIS CB C 3.905 9.566 -7.215 1.00 . A A . 11 HIS CB 1 1 16 10878 1 1 11 HIS CD2 C 6.220 10.124 -8.249 1.00 . A A . 11 HIS CD2 1 1 16 10879 1 1 11 HIS CE1 C 5.916 12.271 -8.572 1.00 . A A . 11 HIS CE1 1 1 16 10880 1 1 11 HIS CG C 4.973 10.428 -7.817 1.00 . A A . 11 HIS CG 1 1 16 10881 1 1 11 HIS H H 3.793 8.452 -4.881 1.00 . A A . 11 HIS H 1 1 16 10882 1 1 11 HIS HA H 3.639 11.175 -5.831 1.00 . A A . 11 HIS HA 1 1 16 10883 1 1 11 HIS HB2 H 4.355 8.622 -6.945 1.00 . A A . 11 HIS HB2 1 1 16 10884 1 1 11 HIS HB3 H 3.150 9.397 -7.968 1.00 . A A . 11 HIS HB3 1 1 16 10885 1 1 11 HIS HD1 H 4.013 12.304 -7.822 1.00 . A A . 11 HIS HD1 1 1 16 10886 1 1 11 HIS HD2 H 6.685 9.148 -8.233 1.00 . A A . 11 HIS HD2 1 1 16 10887 1 1 11 HIS HE1 H 6.079 13.302 -8.850 1.00 . A A . 11 HIS HE1 1 1 16 10888 1 1 11 HIS HE2 H 7.710 11.389 -9.017 1.00 . A A . 11 HIS HE2 1 1 16 10889 1 1 11 HIS N N 3.576 9.404 -4.789 1.00 . A A . 11 HIS N 1 1 16 10890 1 1 11 HIS ND1 N 4.814 11.780 -8.033 1.00 . A A . 11 HIS ND1 1 1 16 10891 1 1 11 HIS NE2 N 6.784 11.287 -8.714 1.00 . A A . 11 HIS NE2 1 1 16 10892 1 1 11 HIS O O 0.954 9.534 -5.599 1.00 . A A . 11 HIS O 1 1 16 10893 1 1 12 ASP C C -0.680 10.199 -7.920 1.00 . A A . 12 ASP C 1 1 16 10894 1 1 12 ASP CA C -0.047 11.457 -7.343 1.00 . A A . 12 ASP CA 1 1 16 10895 1 1 12 ASP CB C -0.196 12.620 -8.328 1.00 . A A . 12 ASP CB 1 1 16 10896 1 1 12 ASP CG C 0.557 12.383 -9.623 1.00 . A A . 12 ASP CG 1 1 16 10897 1 1 12 ASP H H 2.045 11.774 -7.467 1.00 . A A . 12 ASP H 1 1 16 10898 1 1 12 ASP HA H -0.552 11.709 -6.422 1.00 . A A . 12 ASP HA 1 1 16 10899 1 1 12 ASP HB2 H -1.242 12.753 -8.561 1.00 . A A . 12 ASP HB2 1 1 16 10900 1 1 12 ASP HB3 H 0.183 13.522 -7.871 1.00 . A A . 12 ASP HB3 1 1 16 10901 1 1 12 ASP N N 1.355 11.229 -7.033 1.00 . A A . 12 ASP N 1 1 16 10902 1 1 12 ASP O O -0.201 9.649 -8.912 1.00 . A A . 12 ASP O 1 1 16 10903 1 1 12 ASP OD1 O 1.799 12.266 -9.574 1.00 . A A . 12 ASP OD1 1 1 16 10904 1 1 12 ASP OD2 O -0.097 12.315 -10.685 1.00 . A A . 12 ASP OD2 1 1 16 10905 1 1 13 GLY C C -2.171 7.340 -6.926 1.00 . A A . 13 GLY C 1 1 16 10906 1 1 13 GLY CA C -2.449 8.568 -7.770 1.00 . A A . 13 GLY CA 1 1 16 10907 1 1 13 GLY H H -2.105 10.239 -6.518 1.00 . A A . 13 GLY H 1 1 16 10908 1 1 13 GLY HA2 H -3.512 8.757 -7.765 1.00 . A A . 13 GLY HA2 1 1 16 10909 1 1 13 GLY HA3 H -2.137 8.370 -8.785 1.00 . A A . 13 GLY HA3 1 1 16 10910 1 1 13 GLY N N -1.763 9.752 -7.298 1.00 . A A . 13 GLY N 1 1 16 10911 1 1 13 GLY O O -2.922 6.365 -6.991 1.00 . A A . 13 GLY O 1 1 16 10912 1 1 14 GLU C C -1.423 6.280 -3.952 1.00 . A A . 14 GLU C 1 1 16 10913 1 1 14 GLU CA C -0.745 6.206 -5.316 1.00 . A A . 14 GLU CA 1 1 16 10914 1 1 14 GLU CB C 0.772 6.112 -5.133 1.00 . A A . 14 GLU CB 1 1 16 10915 1 1 14 GLU CD C 1.797 5.682 -7.402 1.00 . A A . 14 GLU CD 1 1 16 10916 1 1 14 GLU CG C 1.570 6.688 -6.292 1.00 . A A . 14 GLU CG 1 1 16 10917 1 1 14 GLU H H -0.498 8.146 -6.133 1.00 . A A . 14 GLU H 1 1 16 10918 1 1 14 GLU HA H -1.090 5.321 -5.827 1.00 . A A . 14 GLU HA 1 1 16 10919 1 1 14 GLU HB2 H 1.049 6.645 -4.236 1.00 . A A . 14 GLU HB2 1 1 16 10920 1 1 14 GLU HB3 H 1.044 5.072 -5.021 1.00 . A A . 14 GLU HB3 1 1 16 10921 1 1 14 GLU HG2 H 1.033 7.533 -6.697 1.00 . A A . 14 GLU HG2 1 1 16 10922 1 1 14 GLU HG3 H 2.530 7.018 -5.922 1.00 . A A . 14 GLU HG3 1 1 16 10923 1 1 14 GLU N N -1.090 7.359 -6.144 1.00 . A A . 14 GLU N 1 1 16 10924 1 1 14 GLU O O -1.981 7.310 -3.577 1.00 . A A . 14 GLU O 1 1 16 10925 1 1 14 GLU OE1 O 1.038 5.712 -8.394 1.00 . A A . 14 GLU OE1 1 1 16 10926 1 1 14 GLU OE2 O 2.733 4.864 -7.281 1.00 . A A . 14 GLU OE2 1 1 16 10927 1 1 15 THR C C -1.015 4.535 -0.865 1.00 . A A . 15 THR C 1 1 16 10928 1 1 15 THR CA C -1.986 5.095 -1.897 1.00 . A A . 15 THR CA 1 1 16 10929 1 1 15 THR CB C -3.246 4.212 -1.915 1.00 . A A . 15 THR CB 1 1 16 10930 1 1 15 THR CG2 C -4.068 4.410 -0.651 1.00 . A A . 15 THR CG2 1 1 16 10931 1 1 15 THR H H -0.916 4.381 -3.578 1.00 . A A . 15 THR H 1 1 16 10932 1 1 15 THR HA H -2.275 6.093 -1.603 1.00 . A A . 15 THR HA 1 1 16 10933 1 1 15 THR HB H -2.940 3.176 -1.971 1.00 . A A . 15 THR HB 1 1 16 10934 1 1 15 THR HG1 H -4.200 5.473 -3.091 1.00 . A A . 15 THR HG1 1 1 16 10935 1 1 15 THR HG21 H -3.848 3.617 0.049 1.00 . A A . 15 THR HG21 1 1 16 10936 1 1 15 THR HG22 H -5.119 4.390 -0.899 1.00 . A A . 15 THR HG22 1 1 16 10937 1 1 15 THR HG23 H -3.821 5.362 -0.206 1.00 . A A . 15 THR HG23 1 1 16 10938 1 1 15 THR N N -1.373 5.171 -3.218 1.00 . A A . 15 THR N 1 1 16 10939 1 1 15 THR O O -0.406 3.487 -1.073 1.00 . A A . 15 THR O 1 1 16 10940 1 1 15 THR OG1 O -4.041 4.526 -3.061 1.00 . A A . 15 THR OG1 1 1 16 10941 1 1 16 CYS C C -0.721 3.873 2.286 1.00 . A A . 16 CYS C 1 1 16 10942 1 1 16 CYS CA C 0.004 4.807 1.326 1.00 . A A . 16 CYS CA 1 1 16 10943 1 1 16 CYS CB C 0.522 6.015 2.098 1.00 . A A . 16 CYS CB 1 1 16 10944 1 1 16 CYS H H -1.402 6.062 0.365 1.00 . A A . 16 CYS H 1 1 16 10945 1 1 16 CYS HA H 0.837 4.284 0.884 1.00 . A A . 16 CYS HA 1 1 16 10946 1 1 16 CYS HB2 H -0.172 6.832 1.975 1.00 . A A . 16 CYS HB2 1 1 16 10947 1 1 16 CYS HB3 H 0.588 5.761 3.150 1.00 . A A . 16 CYS HB3 1 1 16 10948 1 1 16 CYS N N -0.884 5.237 0.254 1.00 . A A . 16 CYS N 1 1 16 10949 1 1 16 CYS O O -1.693 4.266 2.932 1.00 . A A . 16 CYS O 1 1 16 10950 1 1 16 CYS SG S 2.159 6.613 1.584 1.00 . A A . 16 CYS SG 1 1 16 10951 1 1 17 CYS C C 0.186 1.203 4.306 1.00 . A A . 17 CYS C 1 1 16 10952 1 1 17 CYS CA C -0.835 1.659 3.269 1.00 . A A . 17 CYS CA 1 1 16 10953 1 1 17 CYS CB C -1.354 0.464 2.464 1.00 . A A . 17 CYS CB 1 1 16 10954 1 1 17 CYS H H 0.535 2.388 1.847 1.00 . A A . 17 CYS H 1 1 16 10955 1 1 17 CYS HA H -1.664 2.129 3.777 1.00 . A A . 17 CYS HA 1 1 16 10956 1 1 17 CYS HB2 H -2.431 0.495 2.453 1.00 . A A . 17 CYS HB2 1 1 16 10957 1 1 17 CYS HB3 H -0.989 0.541 1.451 1.00 . A A . 17 CYS HB3 1 1 16 10958 1 1 17 CYS N N -0.241 2.643 2.382 1.00 . A A . 17 CYS N 1 1 16 10959 1 1 17 CYS O O 1.288 0.780 3.957 1.00 . A A . 17 CYS O 1 1 16 10960 1 1 17 CYS SG S -0.849 -1.163 3.115 1.00 . A A . 17 CYS SG 1 1 16 10961 1 1 18 PRO C C 0.663 -0.610 6.949 1.00 . A A . 18 PRO C 1 1 16 10962 1 1 18 PRO CA C 0.735 0.889 6.681 1.00 . A A . 18 PRO CA 1 1 16 10963 1 1 18 PRO CB C 0.193 1.686 7.865 1.00 . A A . 18 PRO CB 1 1 16 10964 1 1 18 PRO CD C -1.455 1.782 6.118 1.00 . A A . 18 PRO CD 1 1 16 10965 1 1 18 PRO CG C -1.276 1.762 7.617 1.00 . A A . 18 PRO CG 1 1 16 10966 1 1 18 PRO HA H 1.758 1.177 6.479 1.00 . A A . 18 PRO HA 1 1 16 10967 1 1 18 PRO HB2 H 0.419 1.170 8.787 1.00 . A A . 18 PRO HB2 1 1 16 10968 1 1 18 PRO HB3 H 0.639 2.669 7.875 1.00 . A A . 18 PRO HB3 1 1 16 10969 1 1 18 PRO HD2 H -2.262 1.126 5.824 1.00 . A A . 18 PRO HD2 1 1 16 10970 1 1 18 PRO HD3 H -1.645 2.790 5.777 1.00 . A A . 18 PRO HD3 1 1 16 10971 1 1 18 PRO HG2 H -1.764 0.895 8.040 1.00 . A A . 18 PRO HG2 1 1 16 10972 1 1 18 PRO HG3 H -1.675 2.665 8.054 1.00 . A A . 18 PRO HG3 1 1 16 10973 1 1 18 PRO N N -0.161 1.288 5.601 1.00 . A A . 18 PRO N 1 1 16 10974 1 1 18 PRO O O -0.087 -1.064 7.812 1.00 . A A . 18 PRO O 1 1 16 10975 1 1 19 THR C C 2.521 -3.268 7.349 1.00 . A A . 19 THR C 1 1 16 10976 1 1 19 THR CA C 1.467 -2.826 6.339 1.00 . A A . 19 THR CA 1 1 16 10977 1 1 19 THR CB C 1.739 -3.515 4.988 1.00 . A A . 19 THR CB 1 1 16 10978 1 1 19 THR CG2 C 3.003 -2.965 4.346 1.00 . A A . 19 THR CG2 1 1 16 10979 1 1 19 THR H H 2.022 -0.959 5.518 1.00 . A A . 19 THR H 1 1 16 10980 1 1 19 THR HA H 0.494 -3.140 6.689 1.00 . A A . 19 THR HA 1 1 16 10981 1 1 19 THR HB H 0.906 -3.320 4.329 1.00 . A A . 19 THR HB 1 1 16 10982 1 1 19 THR HG1 H 2.777 -5.146 5.381 1.00 . A A . 19 THR HG1 1 1 16 10983 1 1 19 THR HG21 H 2.762 -2.080 3.775 1.00 . A A . 19 THR HG21 1 1 16 10984 1 1 19 THR HG22 H 3.428 -3.711 3.690 1.00 . A A . 19 THR HG22 1 1 16 10985 1 1 19 THR HG23 H 3.717 -2.713 5.115 1.00 . A A . 19 THR HG23 1 1 16 10986 1 1 19 THR N N 1.445 -1.376 6.193 1.00 . A A . 19 THR N 1 1 16 10987 1 1 19 THR O O 2.767 -4.463 7.519 1.00 . A A . 19 THR O 1 1 16 10988 1 1 19 THR OG1 O 1.866 -4.931 5.170 1.00 . A A . 19 THR OG1 1 1 16 10989 1 1 20 SER C C 4.075 -1.616 10.181 1.00 . A A . 20 SER C 1 1 16 10990 1 1 20 SER CA C 4.162 -2.598 9.012 1.00 . A A . 20 SER CA 1 1 16 10991 1 1 20 SER CB C 5.550 -2.546 8.366 1.00 . A A . 20 SER CB 1 1 16 10992 1 1 20 SER H H 2.902 -1.366 7.848 1.00 . A A . 20 SER H 1 1 16 10993 1 1 20 SER HA H 3.985 -3.596 9.383 1.00 . A A . 20 SER HA 1 1 16 10994 1 1 20 SER HB2 H 5.446 -2.339 7.310 1.00 . A A . 20 SER HB2 1 1 16 10995 1 1 20 SER HB3 H 6.133 -1.764 8.829 1.00 . A A . 20 SER HB3 1 1 16 10996 1 1 20 SER HG H 6.898 -3.865 7.836 1.00 . A A . 20 SER HG 1 1 16 10997 1 1 20 SER N N 3.138 -2.302 8.019 1.00 . A A . 20 SER N 1 1 16 10998 1 1 20 SER O O 2.992 -1.374 10.713 1.00 . A A . 20 SER O 1 1 16 10999 1 1 20 SER OG O 6.232 -3.779 8.522 1.00 . A A . 20 SER OG 1 1 16 11000 1 1 21 GLN C C 6.406 0.877 11.517 1.00 . A A . 21 GLN C 1 1 16 11001 1 1 21 GLN CA C 5.246 -0.097 11.680 1.00 . A A . 21 GLN CA 1 1 16 11002 1 1 21 GLN CB C 5.367 -0.834 13.015 1.00 . A A . 21 GLN CB 1 1 16 11003 1 1 21 GLN CD C 3.806 0.623 14.363 1.00 . A A . 21 GLN CD 1 1 16 11004 1 1 21 GLN CG C 5.212 0.072 14.225 1.00 . A A . 21 GLN CG 1 1 16 11005 1 1 21 GLN H H 6.048 -1.277 10.120 1.00 . A A . 21 GLN H 1 1 16 11006 1 1 21 GLN HA H 4.320 0.457 11.667 1.00 . A A . 21 GLN HA 1 1 16 11007 1 1 21 GLN HB2 H 4.604 -1.596 13.063 1.00 . A A . 21 GLN HB2 1 1 16 11008 1 1 21 GLN HB3 H 6.338 -1.305 13.066 1.00 . A A . 21 GLN HB3 1 1 16 11009 1 1 21 GLN HE21 H 3.435 -0.631 15.862 1.00 . A A . 21 GLN HE21 1 1 16 11010 1 1 21 GLN HE22 H 2.136 0.419 15.423 1.00 . A A . 21 GLN HE22 1 1 16 11011 1 1 21 GLN HG2 H 5.450 -0.492 15.115 1.00 . A A . 21 GLN HG2 1 1 16 11012 1 1 21 GLN HG3 H 5.900 0.900 14.130 1.00 . A A . 21 GLN HG3 1 1 16 11013 1 1 21 GLN N N 5.213 -1.051 10.578 1.00 . A A . 21 GLN N 1 1 16 11014 1 1 21 GLN NE2 N 3.049 0.082 15.312 1.00 . A A . 21 GLN NE2 1 1 16 11015 1 1 21 GLN O O 6.380 1.985 12.052 1.00 . A A . 21 GLN O 1 1 16 11016 1 1 21 GLN OE1 O 3.405 1.524 13.629 1.00 . A A . 21 GLN OE1 1 1 16 11017 1 1 22 THR C C 8.685 1.742 9.096 1.00 . A A . 22 THR C 1 1 16 11018 1 1 22 THR CA C 8.603 1.282 10.551 1.00 . A A . 22 THR CA 1 1 16 11019 1 1 22 THR CB C 9.902 0.531 10.924 1.00 . A A . 22 THR CB 1 1 16 11020 1 1 22 THR CG2 C 9.650 -0.964 11.074 1.00 . A A . 22 THR CG2 1 1 16 11021 1 1 22 THR H H 7.390 -0.443 10.386 1.00 . A A . 22 THR H 1 1 16 11022 1 1 22 THR HA H 8.523 2.152 11.186 1.00 . A A . 22 THR HA 1 1 16 11023 1 1 22 THR HB H 10.260 0.914 11.869 1.00 . A A . 22 THR HB 1 1 16 11024 1 1 22 THR HG1 H 11.597 1.310 10.286 1.00 . A A . 22 THR HG1 1 1 16 11025 1 1 22 THR HG21 H 8.740 -1.230 10.556 1.00 . A A . 22 THR HG21 1 1 16 11026 1 1 22 THR HG22 H 9.553 -1.210 12.120 1.00 . A A . 22 THR HG22 1 1 16 11027 1 1 22 THR HG23 H 10.477 -1.513 10.650 1.00 . A A . 22 THR HG23 1 1 16 11028 1 1 22 THR N N 7.427 0.453 10.780 1.00 . A A . 22 THR N 1 1 16 11029 1 1 22 THR O O 9.570 2.517 8.730 1.00 . A A . 22 THR O 1 1 16 11030 1 1 22 THR OG1 O 10.908 0.747 9.926 1.00 . A A . 22 THR OG1 1 1 16 11031 1 1 23 THR C C 6.321 1.845 6.338 1.00 . A A . 23 THR C 1 1 16 11032 1 1 23 THR CA C 7.741 1.637 6.856 1.00 . A A . 23 THR CA 1 1 16 11033 1 1 23 THR CB C 8.433 0.566 5.991 1.00 . A A . 23 THR CB 1 1 16 11034 1 1 23 THR CG2 C 9.942 0.616 6.172 1.00 . A A . 23 THR CG2 1 1 16 11035 1 1 23 THR H H 7.076 0.653 8.612 1.00 . A A . 23 THR H 1 1 16 11036 1 1 23 THR HA H 8.290 2.560 6.749 1.00 . A A . 23 THR HA 1 1 16 11037 1 1 23 THR HB H 8.204 0.759 4.953 1.00 . A A . 23 THR HB 1 1 16 11038 1 1 23 THR HG1 H 8.411 -1.399 5.825 1.00 . A A . 23 THR HG1 1 1 16 11039 1 1 23 THR HG21 H 10.207 0.148 7.109 1.00 . A A . 23 THR HG21 1 1 16 11040 1 1 23 THR HG22 H 10.269 1.645 6.179 1.00 . A A . 23 THR HG22 1 1 16 11041 1 1 23 THR HG23 H 10.419 0.091 5.358 1.00 . A A . 23 THR HG23 1 1 16 11042 1 1 23 THR N N 7.758 1.266 8.268 1.00 . A A . 23 THR N 1 1 16 11043 1 1 23 THR O O 5.342 1.532 7.018 1.00 . A A . 23 THR O 1 1 16 11044 1 1 23 THR OG1 O 7.948 -0.736 6.342 1.00 . A A . 23 THR OG1 1 1 16 11045 1 1 24 TRP C C 4.905 1.981 3.099 1.00 . A A . 24 TRP C 1 1 16 11046 1 1 24 TRP CA C 4.940 2.634 4.480 1.00 . A A . 24 TRP CA 1 1 16 11047 1 1 24 TRP CB C 4.714 4.144 4.343 1.00 . A A . 24 TRP CB 1 1 16 11048 1 1 24 TRP CD1 C 4.481 5.377 6.577 1.00 . A A . 24 TRP CD1 1 1 16 11049 1 1 24 TRP CD2 C 2.539 4.794 5.646 1.00 . A A . 24 TRP CD2 1 1 16 11050 1 1 24 TRP CE2 C 2.272 5.454 6.859 1.00 . A A . 24 TRP CE2 1 1 16 11051 1 1 24 TRP CE3 C 1.470 4.337 4.881 1.00 . A A . 24 TRP CE3 1 1 16 11052 1 1 24 TRP CG C 3.957 4.750 5.487 1.00 . A A . 24 TRP CG 1 1 16 11053 1 1 24 TRP CH2 C -0.048 5.207 6.551 1.00 . A A . 24 TRP CH2 1 1 16 11054 1 1 24 TRP CZ2 C 0.980 5.666 7.322 1.00 . A A . 24 TRP CZ2 1 1 16 11055 1 1 24 TRP CZ3 C 0.186 4.549 5.340 1.00 . A A . 24 TRP CZ3 1 1 16 11056 1 1 24 TRP H H 7.048 2.596 4.638 1.00 . A A . 24 TRP H 1 1 16 11057 1 1 24 TRP HA H 4.157 2.205 5.096 1.00 . A A . 24 TRP HA 1 1 16 11058 1 1 24 TRP HB2 H 5.672 4.639 4.282 1.00 . A A . 24 TRP HB2 1 1 16 11059 1 1 24 TRP HB3 H 4.159 4.337 3.437 1.00 . A A . 24 TRP HB3 1 1 16 11060 1 1 24 TRP HD1 H 5.532 5.512 6.747 1.00 . A A . 24 TRP HD1 1 1 16 11061 1 1 24 TRP HE1 H 3.590 6.276 8.258 1.00 . A A . 24 TRP HE1 1 1 16 11062 1 1 24 TRP HE3 H 1.634 3.832 3.944 1.00 . A A . 24 TRP HE3 1 1 16 11063 1 1 24 TRP HH2 H -1.064 5.350 6.870 1.00 . A A . 24 TRP HH2 1 1 16 11064 1 1 24 TRP HZ2 H 0.782 6.173 8.255 1.00 . A A . 24 TRP HZ2 1 1 16 11065 1 1 24 TRP HZ3 H -0.656 4.200 4.761 1.00 . A A . 24 TRP HZ3 1 1 16 11066 1 1 24 TRP N N 6.225 2.376 5.122 1.00 . A A . 24 TRP N 1 1 16 11067 1 1 24 TRP NE1 N 3.472 5.802 7.410 1.00 . A A . 24 TRP NE1 1 1 16 11068 1 1 24 TRP O O 5.939 1.858 2.442 1.00 . A A . 24 TRP O 1 1 16 11069 1 1 25 GLY C C 2.927 1.805 0.336 1.00 . A A . 25 GLY C 1 1 16 11070 1 1 25 GLY CA C 3.598 0.919 1.368 1.00 . A A . 25 GLY CA 1 1 16 11071 1 1 25 GLY H H 2.930 1.675 3.233 1.00 . A A . 25 GLY H 1 1 16 11072 1 1 25 GLY HA2 H 4.583 0.658 1.013 1.00 . A A . 25 GLY HA2 1 1 16 11073 1 1 25 GLY HA3 H 3.018 0.016 1.478 1.00 . A A . 25 GLY HA3 1 1 16 11074 1 1 25 GLY N N 3.722 1.558 2.667 1.00 . A A . 25 GLY N 1 1 16 11075 1 1 25 GLY O O 1.983 2.530 0.648 1.00 . A A . 25 GLY O 1 1 16 11076 1 1 26 CYS C C 2.133 1.662 -2.991 1.00 . A A . 26 CYS C 1 1 16 11077 1 1 26 CYS CA C 2.861 2.547 -1.982 1.00 . A A . 26 CYS CA 1 1 16 11078 1 1 26 CYS CB C 3.970 3.336 -2.682 1.00 . A A . 26 CYS CB 1 1 16 11079 1 1 26 CYS H H 4.173 1.150 -1.081 1.00 . A A . 26 CYS H 1 1 16 11080 1 1 26 CYS HA H 2.153 3.240 -1.553 1.00 . A A . 26 CYS HA 1 1 16 11081 1 1 26 CYS HB2 H 4.762 3.533 -1.976 1.00 . A A . 26 CYS HB2 1 1 16 11082 1 1 26 CYS HB3 H 4.361 2.748 -3.498 1.00 . A A . 26 CYS HB3 1 1 16 11083 1 1 26 CYS N N 3.417 1.746 -0.897 1.00 . A A . 26 CYS N 1 1 16 11084 1 1 26 CYS O O 2.742 0.808 -3.636 1.00 . A A . 26 CYS O 1 1 16 11085 1 1 26 CYS SG S 3.428 4.938 -3.363 1.00 . A A . 26 CYS SG 1 1 16 11086 1 1 27 CYS C C -0.447 1.941 -5.227 1.00 . A A . 27 CYS C 1 1 16 11087 1 1 27 CYS CA C 0.008 1.091 -4.042 1.00 . A A . 27 CYS CA 1 1 16 11088 1 1 27 CYS CB C -1.213 0.518 -3.319 1.00 . A A . 27 CYS CB 1 1 16 11089 1 1 27 CYS H H 0.398 2.562 -2.571 1.00 . A A . 27 CYS H 1 1 16 11090 1 1 27 CYS HA H 0.612 0.276 -4.409 1.00 . A A . 27 CYS HA 1 1 16 11091 1 1 27 CYS HB2 H -0.977 0.389 -2.274 1.00 . A A . 27 CYS HB2 1 1 16 11092 1 1 27 CYS HB3 H -2.036 1.211 -3.414 1.00 . A A . 27 CYS HB3 1 1 16 11093 1 1 27 CYS N N 0.825 1.870 -3.116 1.00 . A A . 27 CYS N 1 1 16 11094 1 1 27 CYS O O -1.018 3.017 -5.044 1.00 . A A . 27 CYS O 1 1 16 11095 1 1 27 CYS SG S -1.769 -1.094 -3.966 1.00 . A A . 27 CYS SG 1 1 16 11096 1 1 28 PRO C C -2.100 2.080 -7.949 1.00 . A A . 28 PRO C 1 1 16 11097 1 1 28 PRO CA C -0.601 2.187 -7.677 1.00 . A A . 28 PRO CA 1 1 16 11098 1 1 28 PRO CB C 0.195 1.483 -8.775 1.00 . A A . 28 PRO CB 1 1 16 11099 1 1 28 PRO CD C 0.467 0.189 -6.776 1.00 . A A . 28 PRO CD 1 1 16 11100 1 1 28 PRO CG C 0.371 0.090 -8.277 1.00 . A A . 28 PRO CG 1 1 16 11101 1 1 28 PRO HA H -0.318 3.228 -7.629 1.00 . A A . 28 PRO HA 1 1 16 11102 1 1 28 PRO HB2 H -0.363 1.505 -9.699 1.00 . A A . 28 PRO HB2 1 1 16 11103 1 1 28 PRO HB3 H 1.146 1.977 -8.908 1.00 . A A . 28 PRO HB3 1 1 16 11104 1 1 28 PRO HD2 H -0.045 -0.641 -6.311 1.00 . A A . 28 PRO HD2 1 1 16 11105 1 1 28 PRO HD3 H 1.502 0.214 -6.467 1.00 . A A . 28 PRO HD3 1 1 16 11106 1 1 28 PRO HG2 H -0.483 -0.509 -8.557 1.00 . A A . 28 PRO HG2 1 1 16 11107 1 1 28 PRO HG3 H 1.277 -0.333 -8.683 1.00 . A A . 28 PRO HG3 1 1 16 11108 1 1 28 PRO N N -0.206 1.465 -6.464 1.00 . A A . 28 PRO N 1 1 16 11109 1 1 28 PRO O O -2.523 1.408 -8.892 1.00 . A A . 28 PRO O 1 1 16 11110 1 1 29 SER C C -4.986 3.904 -6.530 1.00 . A A . 29 SER C 1 1 16 11111 1 1 29 SER CA C -4.350 2.721 -7.263 1.00 . A A . 29 SER CA 1 1 16 11112 1 1 29 SER CB C -4.914 1.404 -6.722 1.00 . A A . 29 SER CB 1 1 16 11113 1 1 29 SER H H -2.501 3.257 -6.384 1.00 . A A . 29 SER H 1 1 16 11114 1 1 29 SER HA H -4.580 2.796 -8.315 1.00 . A A . 29 SER HA 1 1 16 11115 1 1 29 SER HB2 H -4.461 1.186 -5.765 1.00 . A A . 29 SER HB2 1 1 16 11116 1 1 29 SER HB3 H -5.984 1.496 -6.600 1.00 . A A . 29 SER HB3 1 1 16 11117 1 1 29 SER HG H -4.726 -0.503 -7.135 1.00 . A A . 29 SER HG 1 1 16 11118 1 1 29 SER N N -2.898 2.742 -7.116 1.00 . A A . 29 SER N 1 1 16 11119 1 1 29 SER O O -4.363 4.500 -5.653 1.00 . A A . 29 SER O 1 1 16 11120 1 1 29 SER OG O -4.646 0.330 -7.606 1.00 . A A . 29 SER OG 1 1 16 11121 1 1 30 PRO C C -7.267 5.104 -4.775 1.00 . A A . 30 PRO C 1 1 16 11122 1 1 30 PRO CA C -6.945 5.383 -6.244 1.00 . A A . 30 PRO CA 1 1 16 11123 1 1 30 PRO CB C -8.228 5.511 -7.073 1.00 . A A . 30 PRO CB 1 1 16 11124 1 1 30 PRO CD C -7.059 3.612 -7.920 1.00 . A A . 30 PRO CD 1 1 16 11125 1 1 30 PRO CG C -8.434 4.160 -7.663 1.00 . A A . 30 PRO CG 1 1 16 11126 1 1 30 PRO HA H -6.375 6.298 -6.317 1.00 . A A . 30 PRO HA 1 1 16 11127 1 1 30 PRO HB2 H -9.049 5.791 -6.430 1.00 . A A . 30 PRO HB2 1 1 16 11128 1 1 30 PRO HB3 H -8.092 6.259 -7.840 1.00 . A A . 30 PRO HB3 1 1 16 11129 1 1 30 PRO HD2 H -7.051 2.538 -7.802 1.00 . A A . 30 PRO HD2 1 1 16 11130 1 1 30 PRO HD3 H -6.720 3.889 -8.908 1.00 . A A . 30 PRO HD3 1 1 16 11131 1 1 30 PRO HG2 H -8.965 3.530 -6.964 1.00 . A A . 30 PRO HG2 1 1 16 11132 1 1 30 PRO HG3 H -8.984 4.241 -8.589 1.00 . A A . 30 PRO HG3 1 1 16 11133 1 1 30 PRO N N -6.237 4.263 -6.881 1.00 . A A . 30 PRO N 1 1 16 11134 1 1 30 PRO O O -6.375 4.786 -3.992 1.00 . A A . 30 PRO O 1 1 16 11135 1 1 31 LYS C C -9.072 3.501 -2.729 1.00 . A A . 31 LYS C 1 1 16 11136 1 1 31 LYS CA C -8.958 4.997 -3.019 1.00 . A A . 31 LYS CA 1 1 16 11137 1 1 31 LYS CB C -10.296 5.690 -2.750 1.00 . A A . 31 LYS CB 1 1 16 11138 1 1 31 LYS CD C -11.622 7.218 -1.260 1.00 . A A . 31 LYS CD 1 1 16 11139 1 1 31 LYS CE C -12.393 6.889 0.008 1.00 . A A . 31 LYS CE 1 1 16 11140 1 1 31 LYS CG C -10.371 6.364 -1.389 1.00 . A A . 31 LYS CG 1 1 16 11141 1 1 31 LYS H H -9.210 5.499 -5.061 1.00 . A A . 31 LYS H 1 1 16 11142 1 1 31 LYS HA H -8.207 5.420 -2.369 1.00 . A A . 31 LYS HA 1 1 16 11143 1 1 31 LYS HB2 H -10.458 6.440 -3.508 1.00 . A A . 31 LYS HB2 1 1 16 11144 1 1 31 LYS HB3 H -11.086 4.955 -2.807 1.00 . A A . 31 LYS HB3 1 1 16 11145 1 1 31 LYS HD2 H -11.336 8.259 -1.234 1.00 . A A . 31 LYS HD2 1 1 16 11146 1 1 31 LYS HD3 H -12.258 7.039 -2.114 1.00 . A A . 31 LYS HD3 1 1 16 11147 1 1 31 LYS HE2 H -11.690 6.653 0.793 1.00 . A A . 31 LYS HE2 1 1 16 11148 1 1 31 LYS HE3 H -12.976 7.753 0.295 1.00 . A A . 31 LYS HE3 1 1 16 11149 1 1 31 LYS HG2 H -10.385 5.605 -0.621 1.00 . A A . 31 LYS HG2 1 1 16 11150 1 1 31 LYS HG3 H -9.501 6.993 -1.261 1.00 . A A . 31 LYS HG3 1 1 16 11151 1 1 31 LYS HZ1 H -14.222 5.915 0.277 1.00 . A A . 31 LYS HZ1 1 1 16 11152 1 1 31 LYS HZ2 H -12.891 4.873 0.228 1.00 . A A . 31 LYS HZ2 1 1 16 11153 1 1 31 LYS HZ3 H -13.470 5.569 -1.200 1.00 . A A . 31 LYS HZ3 1 1 16 11154 1 1 31 LYS N N -8.539 5.234 -4.400 1.00 . A A . 31 LYS N 1 1 16 11155 1 1 31 LYS NZ N -13.309 5.731 -0.185 1.00 . A A . 31 LYS NZ 1 1 16 11156 1 1 31 LYS O O -10.063 3.040 -2.161 1.00 . A A . 31 LYS O 1 1 16 11157 1 1 32 ALA C C -7.828 0.956 -1.443 1.00 . A A . 32 ALA C 1 1 16 11158 1 1 32 ALA CA C -8.023 1.307 -2.917 1.00 . A A . 32 ALA CA 1 1 16 11159 1 1 32 ALA CB C -6.911 0.686 -3.751 1.00 . A A . 32 ALA CB 1 1 16 11160 1 1 32 ALA H H -7.291 3.177 -3.572 1.00 . A A . 32 ALA H 1 1 16 11161 1 1 32 ALA HA H -8.964 0.901 -3.256 1.00 . A A . 32 ALA HA 1 1 16 11162 1 1 32 ALA HB1 H -6.003 0.643 -3.168 1.00 . A A . 32 ALA HB1 1 1 16 11163 1 1 32 ALA HB2 H -6.742 1.287 -4.633 1.00 . A A . 32 ALA HB2 1 1 16 11164 1 1 32 ALA HB3 H -7.196 -0.313 -4.046 1.00 . A A . 32 ALA HB3 1 1 16 11165 1 1 32 ALA N N -8.049 2.750 -3.125 1.00 . A A . 32 ALA N 1 1 16 11166 1 1 32 ALA O O -7.227 1.720 -0.687 1.00 . A A . 32 ALA O 1 1 16 11167 1 1 33 VAL C C -6.928 -1.557 0.435 1.00 . A A . 33 VAL C 1 1 16 11168 1 1 33 VAL CA C -8.175 -0.688 0.326 1.00 . A A . 33 VAL CA 1 1 16 11169 1 1 33 VAL CB C -9.404 -1.496 0.786 1.00 . A A . 33 VAL CB 1 1 16 11170 1 1 33 VAL CG1 C -9.361 -1.721 2.290 1.00 . A A . 33 VAL CG1 1 1 16 11171 1 1 33 VAL CG2 C -10.690 -0.792 0.380 1.00 . A A . 33 VAL CG2 1 1 16 11172 1 1 33 VAL H H -8.767 -0.794 -1.700 1.00 . A A . 33 VAL H 1 1 16 11173 1 1 33 VAL HA H -8.065 0.174 0.969 1.00 . A A . 33 VAL HA 1 1 16 11174 1 1 33 VAL HB H -9.377 -2.460 0.300 1.00 . A A . 33 VAL HB 1 1 16 11175 1 1 33 VAL HG11 H -8.836 -2.641 2.502 1.00 . A A . 33 VAL HG11 1 1 16 11176 1 1 33 VAL HG12 H -10.369 -1.786 2.673 1.00 . A A . 33 VAL HG12 1 1 16 11177 1 1 33 VAL HG13 H -8.850 -0.897 2.763 1.00 . A A . 33 VAL HG13 1 1 16 11178 1 1 33 VAL HG21 H -10.949 -0.055 1.126 1.00 . A A . 33 VAL HG21 1 1 16 11179 1 1 33 VAL HG22 H -11.487 -1.516 0.299 1.00 . A A . 33 VAL HG22 1 1 16 11180 1 1 33 VAL HG23 H -10.547 -0.305 -0.573 1.00 . A A . 33 VAL HG23 1 1 16 11181 1 1 33 VAL N N -8.319 -0.217 -1.047 1.00 . A A . 33 VAL N 1 1 16 11182 1 1 33 VAL O O -6.731 -2.463 -0.370 1.00 . A A . 33 VAL O 1 1 16 11183 1 1 34 CYS C C -5.058 -3.396 2.197 1.00 . A A . 34 CYS C 1 1 16 11184 1 1 34 CYS CA C -4.836 -2.019 1.573 1.00 . A A . 34 CYS CA 1 1 16 11185 1 1 34 CYS CB C -3.841 -1.219 2.418 1.00 . A A . 34 CYS CB 1 1 16 11186 1 1 34 CYS H H -6.269 -0.524 2.014 1.00 . A A . 34 CYS H 1 1 16 11187 1 1 34 CYS HA H -4.411 -2.159 0.591 1.00 . A A . 34 CYS HA 1 1 16 11188 1 1 34 CYS HB2 H -3.324 -0.520 1.779 1.00 . A A . 34 CYS HB2 1 1 16 11189 1 1 34 CYS HB3 H -4.381 -0.672 3.179 1.00 . A A . 34 CYS HB3 1 1 16 11190 1 1 34 CYS N N -6.075 -1.267 1.407 1.00 . A A . 34 CYS N 1 1 16 11191 1 1 34 CYS O O -5.168 -3.526 3.417 1.00 . A A . 34 CYS O 1 1 16 11192 1 1 34 CYS SG S -2.578 -2.235 3.258 1.00 . A A . 34 CYS SG 1 1 16 11193 1 1 35 CYS C C -4.130 -6.107 2.817 1.00 . A A . 35 CYS C 1 1 16 11194 1 1 35 CYS CA C -5.238 -5.800 1.820 1.00 . A A . 35 CYS CA 1 1 16 11195 1 1 35 CYS CB C -5.181 -6.781 0.648 1.00 . A A . 35 CYS CB 1 1 16 11196 1 1 35 CYS H H -4.967 -4.266 0.392 1.00 . A A . 35 CYS H 1 1 16 11197 1 1 35 CYS HA H -6.195 -5.882 2.315 1.00 . A A . 35 CYS HA 1 1 16 11198 1 1 35 CYS HB2 H -4.450 -6.436 -0.066 1.00 . A A . 35 CYS HB2 1 1 16 11199 1 1 35 CYS HB3 H -4.884 -7.753 1.017 1.00 . A A . 35 CYS HB3 1 1 16 11200 1 1 35 CYS N N -5.083 -4.429 1.350 1.00 . A A . 35 CYS N 1 1 16 11201 1 1 35 CYS O O -2.944 -6.143 2.452 1.00 . A A . 35 CYS O 1 1 16 11202 1 1 35 CYS SG S -6.762 -6.981 -0.233 1.00 . A A . 35 CYS SG 1 1 16 11203 1 1 36 ASP C C -3.362 -8.039 5.410 1.00 . A A . 36 ASP C 1 1 16 11204 1 1 36 ASP CA C -3.591 -6.551 5.157 1.00 . A A . 36 ASP CA 1 1 16 11205 1 1 36 ASP CB C -4.086 -5.884 6.443 1.00 . A A . 36 ASP CB 1 1 16 11206 1 1 36 ASP CG C -5.186 -6.677 7.120 1.00 . A A . 36 ASP CG 1 1 16 11207 1 1 36 ASP H H -5.486 -6.231 4.277 1.00 . A A . 36 ASP H 1 1 16 11208 1 1 36 ASP HA H -2.648 -6.102 4.884 1.00 . A A . 36 ASP HA 1 1 16 11209 1 1 36 ASP HB2 H -3.261 -5.786 7.133 1.00 . A A . 36 ASP HB2 1 1 16 11210 1 1 36 ASP HB3 H -4.470 -4.902 6.205 1.00 . A A . 36 ASP HB3 1 1 16 11211 1 1 36 ASP N N -4.529 -6.291 4.074 1.00 . A A . 36 ASP N 1 1 16 11212 1 1 36 ASP O O -2.393 -8.402 6.077 1.00 . A A . 36 ASP O 1 1 16 11213 1 1 36 ASP OD1 O -6.278 -6.806 6.527 1.00 . A A . 36 ASP OD1 1 1 16 11214 1 1 36 ASP OD2 O -4.956 -7.170 8.245 1.00 . A A . 36 ASP OD2 1 1 16 11215 1 1 37 ASP C C -2.661 -10.777 4.727 1.00 . A A . 37 ASP C 1 1 16 11216 1 1 37 ASP CA C -4.074 -10.344 5.096 1.00 . A A . 37 ASP CA 1 1 16 11217 1 1 37 ASP CB C -5.095 -11.119 4.260 1.00 . A A . 37 ASP CB 1 1 16 11218 1 1 37 ASP CG C -5.502 -12.425 4.913 1.00 . A A . 37 ASP CG 1 1 16 11219 1 1 37 ASP H H -4.998 -8.594 4.363 1.00 . A A . 37 ASP H 1 1 16 11220 1 1 37 ASP HA H -4.241 -10.552 6.142 1.00 . A A . 37 ASP HA 1 1 16 11221 1 1 37 ASP HB2 H -5.979 -10.513 4.129 1.00 . A A . 37 ASP HB2 1 1 16 11222 1 1 37 ASP HB3 H -4.667 -11.338 3.293 1.00 . A A . 37 ASP HB3 1 1 16 11223 1 1 37 ASP N N -4.234 -8.905 4.892 1.00 . A A . 37 ASP N 1 1 16 11224 1 1 37 ASP O O -2.028 -11.554 5.443 1.00 . A A . 37 ASP O 1 1 16 11225 1 1 37 ASP OD1 O -4.617 -13.276 5.139 1.00 . A A . 37 ASP OD1 1 1 16 11226 1 1 37 ASP OD2 O -6.706 -12.597 5.197 1.00 . A A . 37 ASP OD2 1 1 16 11227 1 1 38 MET C C -0.092 -9.257 2.824 1.00 . A A . 38 MET C 1 1 16 11228 1 1 38 MET CA C -0.829 -10.552 3.143 1.00 . A A . 38 MET CA 1 1 16 11229 1 1 38 MET CB C -0.884 -11.456 1.907 1.00 . A A . 38 MET CB 1 1 16 11230 1 1 38 MET CE C 0.087 -15.367 2.496 1.00 . A A . 38 MET CE 1 1 16 11231 1 1 38 MET CG C -1.173 -12.912 2.232 1.00 . A A . 38 MET CG 1 1 16 11232 1 1 38 MET H H -2.727 -9.628 3.097 1.00 . A A . 38 MET H 1 1 16 11233 1 1 38 MET HA H -0.306 -11.067 3.936 1.00 . A A . 38 MET HA 1 1 16 11234 1 1 38 MET HB2 H -1.657 -11.096 1.246 1.00 . A A . 38 MET HB2 1 1 16 11235 1 1 38 MET HB3 H 0.067 -11.405 1.397 1.00 . A A . 38 MET HB3 1 1 16 11236 1 1 38 MET HE1 H -0.633 -15.940 3.064 1.00 . A A . 38 MET HE1 1 1 16 11237 1 1 38 MET HE2 H 1.059 -15.831 2.574 1.00 . A A . 38 MET HE2 1 1 16 11238 1 1 38 MET HE3 H -0.216 -15.336 1.460 1.00 . A A . 38 MET HE3 1 1 16 11239 1 1 38 MET HG2 H -2.074 -12.962 2.826 1.00 . A A . 38 MET HG2 1 1 16 11240 1 1 38 MET HG3 H -1.324 -13.449 1.307 1.00 . A A . 38 MET HG3 1 1 16 11241 1 1 38 MET N N -2.172 -10.250 3.613 1.00 . A A . 38 MET N 1 1 16 11242 1 1 38 MET O O 0.435 -8.599 3.722 1.00 . A A . 38 MET O 1 1 16 11243 1 1 38 MET SD S 0.166 -13.699 3.146 1.00 . A A . 38 MET SD 1 1 16 11244 1 1 39 GLN C C -0.121 -7.144 -0.170 1.00 . A A . 39 GLN C 1 1 16 11245 1 1 39 GLN CA C 0.520 -7.620 1.130 1.00 . A A . 39 GLN CA 1 1 16 11246 1 1 39 GLN CB C 2.026 -7.810 0.937 1.00 . A A . 39 GLN CB 1 1 16 11247 1 1 39 GLN CD C 2.729 -5.506 1.699 1.00 . A A . 39 GLN CD 1 1 16 11248 1 1 39 GLN CG C 2.762 -6.528 0.580 1.00 . A A . 39 GLN CG 1 1 16 11249 1 1 39 GLN H H -0.587 -9.394 0.888 1.00 . A A . 39 GLN H 1 1 16 11250 1 1 39 GLN HA H 0.348 -6.881 1.899 1.00 . A A . 39 GLN HA 1 1 16 11251 1 1 39 GLN HB2 H 2.448 -8.199 1.853 1.00 . A A . 39 GLN HB2 1 1 16 11252 1 1 39 GLN HB3 H 2.188 -8.526 0.145 1.00 . A A . 39 GLN HB3 1 1 16 11253 1 1 39 GLN HE21 H 1.250 -4.532 0.797 1.00 . A A . 39 GLN HE21 1 1 16 11254 1 1 39 GLN HE22 H 1.788 -3.860 2.294 1.00 . A A . 39 GLN HE22 1 1 16 11255 1 1 39 GLN HG2 H 3.793 -6.768 0.364 1.00 . A A . 39 GLN HG2 1 1 16 11256 1 1 39 GLN HG3 H 2.302 -6.096 -0.297 1.00 . A A . 39 GLN HG3 1 1 16 11257 1 1 39 GLN N N -0.100 -8.867 1.554 1.00 . A A . 39 GLN N 1 1 16 11258 1 1 39 GLN NE2 N 1.832 -4.534 1.585 1.00 . A A . 39 GLN NE2 1 1 16 11259 1 1 39 GLN O O 0.414 -7.398 -1.250 1.00 . A A . 39 GLN O 1 1 16 11260 1 1 39 GLN OE1 O 3.500 -5.590 2.654 1.00 . A A . 39 GLN OE1 1 1 16 11261 1 1 40 HIS C C -2.963 -4.947 -1.086 1.00 . A A . 40 HIS C 1 1 16 11262 1 1 40 HIS CA C -1.942 -6.048 -1.318 1.00 . A A . 40 HIS CA 1 1 16 11263 1 1 40 HIS CB C -2.623 -7.241 -1.990 1.00 . A A . 40 HIS CB 1 1 16 11264 1 1 40 HIS CD2 C -1.957 -8.733 -4.004 1.00 . A A . 40 HIS CD2 1 1 16 11265 1 1 40 HIS CE1 C -1.187 -7.164 -5.327 1.00 . A A . 40 HIS CE1 1 1 16 11266 1 1 40 HIS CG C -2.081 -7.555 -3.351 1.00 . A A . 40 HIS CG 1 1 16 11267 1 1 40 HIS H H -1.697 -6.339 0.794 1.00 . A A . 40 HIS H 1 1 16 11268 1 1 40 HIS HA H -1.179 -5.673 -1.982 1.00 . A A . 40 HIS HA 1 1 16 11269 1 1 40 HIS HB2 H -2.490 -8.117 -1.372 1.00 . A A . 40 HIS HB2 1 1 16 11270 1 1 40 HIS HB3 H -3.679 -7.035 -2.091 1.00 . A A . 40 HIS HB3 1 1 16 11271 1 1 40 HIS HD1 H -1.542 -5.631 -4.019 1.00 . A A . 40 HIS HD1 1 1 16 11272 1 1 40 HIS HD2 H -2.243 -9.707 -3.630 1.00 . A A . 40 HIS HD2 1 1 16 11273 1 1 40 HIS HE1 H -0.758 -6.656 -6.177 1.00 . A A . 40 HIS HE1 1 1 16 11274 1 1 40 HIS HE2 H -1.298 -9.107 -5.963 1.00 . A A . 40 HIS HE2 1 1 16 11275 1 1 40 HIS N N -1.278 -6.488 -0.088 1.00 . A A . 40 HIS N 1 1 16 11276 1 1 40 HIS ND1 N -1.590 -6.591 -4.206 1.00 . A A . 40 HIS ND1 1 1 16 11277 1 1 40 HIS NE2 N -1.399 -8.464 -5.230 1.00 . A A . 40 HIS NE2 1 1 16 11278 1 1 40 HIS O O -3.085 -4.416 0.013 1.00 . A A . 40 HIS O 1 1 16 11279 1 1 41 CYS C C -5.785 -3.882 -3.184 1.00 . A A . 41 CYS C 1 1 16 11280 1 1 41 CYS CA C -4.718 -3.583 -2.128 1.00 . A A . 41 CYS CA 1 1 16 11281 1 1 41 CYS CB C -4.113 -2.197 -2.382 1.00 . A A . 41 CYS CB 1 1 16 11282 1 1 41 CYS H H -3.521 -5.079 -3.004 1.00 . A A . 41 CYS H 1 1 16 11283 1 1 41 CYS HA H -5.177 -3.597 -1.151 1.00 . A A . 41 CYS HA 1 1 16 11284 1 1 41 CYS HB2 H -4.407 -1.861 -3.365 1.00 . A A . 41 CYS HB2 1 1 16 11285 1 1 41 CYS HB3 H -4.496 -1.507 -1.645 1.00 . A A . 41 CYS HB3 1 1 16 11286 1 1 41 CYS N N -3.686 -4.614 -2.158 1.00 . A A . 41 CYS N 1 1 16 11287 1 1 41 CYS O O -5.482 -4.442 -4.236 1.00 . A A . 41 CYS O 1 1 16 11288 1 1 41 CYS SG S -2.292 -2.139 -2.305 1.00 . A A . 41 CYS SG 1 1 16 11289 1 1 42 CYS C C -8.765 -2.413 -4.264 1.00 . A A . 42 CYS C 1 1 16 11290 1 1 42 CYS CA C -8.132 -3.734 -3.838 1.00 . A A . 42 CYS CA 1 1 16 11291 1 1 42 CYS CB C -9.195 -4.637 -3.208 1.00 . A A . 42 CYS CB 1 1 16 11292 1 1 42 CYS H H -7.216 -3.055 -2.054 1.00 . A A . 42 CYS H 1 1 16 11293 1 1 42 CYS HA H -7.727 -4.224 -4.711 1.00 . A A . 42 CYS HA 1 1 16 11294 1 1 42 CYS HB2 H -9.485 -4.226 -2.254 1.00 . A A . 42 CYS HB2 1 1 16 11295 1 1 42 CYS HB3 H -10.057 -4.669 -3.856 1.00 . A A . 42 CYS HB3 1 1 16 11296 1 1 42 CYS N N -7.032 -3.504 -2.902 1.00 . A A . 42 CYS N 1 1 16 11297 1 1 42 CYS O O -8.862 -1.483 -3.468 1.00 . A A . 42 CYS O 1 1 16 11298 1 1 42 CYS SG S -8.647 -6.352 -2.929 1.00 . A A . 42 CYS SG 1 1 16 11299 1 1 43 PRO C C -10.826 -0.453 -5.110 1.00 . A A . 43 PRO C 1 1 16 11300 1 1 43 PRO CA C -9.826 -1.095 -6.068 1.00 . A A . 43 PRO CA 1 1 16 11301 1 1 43 PRO CB C -10.529 -1.601 -7.322 1.00 . A A . 43 PRO CB 1 1 16 11302 1 1 43 PRO CD C -9.129 -3.378 -6.553 1.00 . A A . 43 PRO CD 1 1 16 11303 1 1 43 PRO CG C -9.661 -2.713 -7.795 1.00 . A A . 43 PRO CG 1 1 16 11304 1 1 43 PRO HA H -9.081 -0.364 -6.345 1.00 . A A . 43 PRO HA 1 1 16 11305 1 1 43 PRO HB2 H -11.521 -1.948 -7.070 1.00 . A A . 43 PRO HB2 1 1 16 11306 1 1 43 PRO HB3 H -10.590 -0.809 -8.053 1.00 . A A . 43 PRO HB3 1 1 16 11307 1 1 43 PRO HD2 H -9.751 -4.218 -6.278 1.00 . A A . 43 PRO HD2 1 1 16 11308 1 1 43 PRO HD3 H -8.107 -3.695 -6.703 1.00 . A A . 43 PRO HD3 1 1 16 11309 1 1 43 PRO HG2 H -10.243 -3.412 -8.377 1.00 . A A . 43 PRO HG2 1 1 16 11310 1 1 43 PRO HG3 H -8.848 -2.316 -8.384 1.00 . A A . 43 PRO HG3 1 1 16 11311 1 1 43 PRO N N -9.205 -2.311 -5.532 1.00 . A A . 43 PRO N 1 1 16 11312 1 1 43 PRO O O -11.501 -1.140 -4.341 1.00 . A A . 43 PRO O 1 1 16 11313 1 1 44 ALA C C -13.231 1.113 -4.392 1.00 . A A . 44 ALA C 1 1 16 11314 1 1 44 ALA CA C -11.803 1.642 -4.315 1.00 . A A . 44 ALA CA 1 1 16 11315 1 1 44 ALA CB C -11.767 3.115 -4.701 1.00 . A A . 44 ALA CB 1 1 16 11316 1 1 44 ALA H H -10.324 1.350 -5.801 1.00 . A A . 44 ALA H 1 1 16 11317 1 1 44 ALA HA H -11.453 1.555 -3.296 1.00 . A A . 44 ALA HA 1 1 16 11318 1 1 44 ALA HB1 H -12.718 3.570 -4.472 1.00 . A A . 44 ALA HB1 1 1 16 11319 1 1 44 ALA HB2 H -11.570 3.204 -5.759 1.00 . A A . 44 ALA HB2 1 1 16 11320 1 1 44 ALA HB3 H -10.986 3.613 -4.146 1.00 . A A . 44 ALA HB3 1 1 16 11321 1 1 44 ALA N N -10.902 0.875 -5.167 1.00 . A A . 44 ALA N 1 1 16 11322 1 1 44 ALA O O -13.983 1.458 -5.304 1.00 . A A . 44 ALA O 1 1 16 11323 1 1 45 GLY C C -14.922 -1.806 -3.398 1.00 . A A . 45 GLY C 1 1 16 11324 1 1 45 GLY CA C -14.933 -0.290 -3.406 1.00 . A A . 45 GLY CA 1 1 16 11325 1 1 45 GLY H H -12.956 0.032 -2.730 1.00 . A A . 45 GLY H 1 1 16 11326 1 1 45 GLY HA2 H -15.445 0.060 -2.521 1.00 . A A . 45 GLY HA2 1 1 16 11327 1 1 45 GLY HA3 H -15.471 0.049 -4.279 1.00 . A A . 45 GLY HA3 1 1 16 11328 1 1 45 GLY N N -13.597 0.274 -3.430 1.00 . A A . 45 GLY N 1 1 16 11329 1 1 45 GLY O O -15.964 -2.440 -3.563 1.00 . A A . 45 GLY O 1 1 16 11330 1 1 46 TYR C C -13.041 -4.307 -1.839 1.00 . A A . 46 TYR C 1 1 16 11331 1 1 46 TYR CA C -13.603 -3.840 -3.177 1.00 . A A . 46 TYR CA 1 1 16 11332 1 1 46 TYR CB C -12.691 -4.310 -4.314 1.00 . A A . 46 TYR CB 1 1 16 11333 1 1 46 TYR CD1 C -13.635 -2.955 -6.228 1.00 . A A . 46 TYR CD1 1 1 16 11334 1 1 46 TYR CD2 C -13.597 -5.329 -6.440 1.00 . A A . 46 TYR CD2 1 1 16 11335 1 1 46 TYR CE1 C -14.209 -2.849 -7.481 1.00 . A A . 46 TYR CE1 1 1 16 11336 1 1 46 TYR CE2 C -14.171 -5.230 -7.694 1.00 . A A . 46 TYR CE2 1 1 16 11337 1 1 46 TYR CG C -13.319 -4.196 -5.687 1.00 . A A . 46 TYR CG 1 1 16 11338 1 1 46 TYR CZ C -14.475 -3.989 -8.209 1.00 . A A . 46 TYR CZ 1 1 16 11339 1 1 46 TYR H H -12.943 -1.834 -3.078 1.00 . A A . 46 TYR H 1 1 16 11340 1 1 46 TYR HA H -14.584 -4.271 -3.313 1.00 . A A . 46 TYR HA 1 1 16 11341 1 1 46 TYR HB2 H -11.789 -3.716 -4.311 1.00 . A A . 46 TYR HB2 1 1 16 11342 1 1 46 TYR HB3 H -12.432 -5.347 -4.153 1.00 . A A . 46 TYR HB3 1 1 16 11343 1 1 46 TYR HD1 H -13.425 -2.065 -5.656 1.00 . A A . 46 TYR HD1 1 1 16 11344 1 1 46 TYR HD2 H -13.359 -6.301 -6.034 1.00 . A A . 46 TYR HD2 1 1 16 11345 1 1 46 TYR HE1 H -14.447 -1.876 -7.885 1.00 . A A . 46 TYR HE1 1 1 16 11346 1 1 46 TYR HE2 H -14.380 -6.124 -8.264 1.00 . A A . 46 TYR HE2 1 1 16 11347 1 1 46 TYR HH H -14.865 -4.681 -9.960 1.00 . A A . 46 TYR HH 1 1 16 11348 1 1 46 TYR N N -13.742 -2.389 -3.206 1.00 . A A . 46 TYR N 1 1 16 11349 1 1 46 TYR O O -12.441 -3.526 -1.100 1.00 . A A . 46 TYR O 1 1 16 11350 1 1 46 TYR OH O -15.049 -3.885 -9.456 1.00 . A A . 46 TYR OH 1 1 16 11351 1 1 47 LYS C C -11.856 -7.372 -0.585 1.00 . A A . 47 LYS C 1 1 16 11352 1 1 47 LYS CA C -12.740 -6.165 -0.294 1.00 . A A . 47 LYS CA 1 1 16 11353 1 1 47 LYS CB C -13.907 -6.572 0.610 1.00 . A A . 47 LYS CB 1 1 16 11354 1 1 47 LYS CD C -15.136 -8.726 1.011 1.00 . A A . 47 LYS CD 1 1 16 11355 1 1 47 LYS CE C -16.543 -8.571 1.563 1.00 . A A . 47 LYS CE 1 1 16 11356 1 1 47 LYS CG C -14.809 -7.635 0.003 1.00 . A A . 47 LYS CG 1 1 16 11357 1 1 47 LYS H H -13.713 -6.159 -2.171 1.00 . A A . 47 LYS H 1 1 16 11358 1 1 47 LYS HA H -12.150 -5.413 0.209 1.00 . A A . 47 LYS HA 1 1 16 11359 1 1 47 LYS HB2 H -13.510 -6.954 1.538 1.00 . A A . 47 LYS HB2 1 1 16 11360 1 1 47 LYS HB3 H -14.507 -5.698 0.817 1.00 . A A . 47 LYS HB3 1 1 16 11361 1 1 47 LYS HD2 H -15.054 -9.687 0.525 1.00 . A A . 47 LYS HD2 1 1 16 11362 1 1 47 LYS HD3 H -14.430 -8.672 1.826 1.00 . A A . 47 LYS HD3 1 1 16 11363 1 1 47 LYS HE2 H -17.137 -8.015 0.853 1.00 . A A . 47 LYS HE2 1 1 16 11364 1 1 47 LYS HE3 H -16.973 -9.553 1.700 1.00 . A A . 47 LYS HE3 1 1 16 11365 1 1 47 LYS HG2 H -15.729 -7.172 -0.320 1.00 . A A . 47 LYS HG2 1 1 16 11366 1 1 47 LYS HG3 H -14.308 -8.078 -0.845 1.00 . A A . 47 LYS HG3 1 1 16 11367 1 1 47 LYS HZ1 H -15.928 -7.021 2.821 1.00 . A A . 47 LYS HZ1 1 1 16 11368 1 1 47 LYS HZ2 H -16.215 -8.482 3.624 1.00 . A A . 47 LYS HZ2 1 1 16 11369 1 1 47 LYS HZ3 H -17.516 -7.539 3.096 1.00 . A A . 47 LYS HZ3 1 1 16 11370 1 1 47 LYS N N -13.234 -5.588 -1.538 1.00 . A A . 47 LYS N 1 1 16 11371 1 1 47 LYS NZ N -16.551 -7.853 2.867 1.00 . A A . 47 LYS NZ 1 1 16 11372 1 1 47 LYS O O -11.930 -7.956 -1.667 1.00 . A A . 47 LYS O 1 1 16 11373 1 1 48 CYS C C -10.826 -10.185 0.570 1.00 . A A . 48 CYS C 1 1 16 11374 1 1 48 CYS CA C -10.125 -8.880 0.215 1.00 . A A . 48 CYS CA 1 1 16 11375 1 1 48 CYS CB C -8.879 -8.702 1.086 1.00 . A A . 48 CYS CB 1 1 16 11376 1 1 48 CYS H H -11.002 -7.243 1.223 1.00 . A A . 48 CYS H 1 1 16 11377 1 1 48 CYS HA H -9.825 -8.917 -0.822 1.00 . A A . 48 CYS HA 1 1 16 11378 1 1 48 CYS HB2 H -8.891 -7.712 1.519 1.00 . A A . 48 CYS HB2 1 1 16 11379 1 1 48 CYS HB3 H -8.895 -9.437 1.877 1.00 . A A . 48 CYS HB3 1 1 16 11380 1 1 48 CYS N N -11.021 -7.743 0.380 1.00 . A A . 48 CYS N 1 1 16 11381 1 1 48 CYS O O -11.684 -10.222 1.452 1.00 . A A . 48 CYS O 1 1 16 11382 1 1 48 CYS SG S -7.309 -8.891 0.183 1.00 . A A . 48 CYS SG 1 1 16 11383 1 1 49 GLY C C -10.023 -13.583 0.566 1.00 . A A . 49 GLY C 1 1 16 11384 1 1 49 GLY CA C -11.047 -12.553 0.129 1.00 . A A . 49 GLY CA 1 1 16 11385 1 1 49 GLY H H -9.761 -11.162 -0.813 1.00 . A A . 49 GLY H 1 1 16 11386 1 1 49 GLY HA2 H -11.794 -12.450 0.902 1.00 . A A . 49 GLY HA2 1 1 16 11387 1 1 49 GLY HA3 H -11.526 -12.899 -0.776 1.00 . A A . 49 GLY HA3 1 1 16 11388 1 1 49 GLY N N -10.451 -11.255 -0.124 1.00 . A A . 49 GLY N 1 1 16 11389 1 1 49 GLY O O -8.820 -13.333 0.485 1.00 . A A . 49 GLY O 1 1 16 11390 1 1 50 PRO C C -8.643 -16.313 0.373 1.00 . A A . 50 PRO C 1 1 16 11391 1 1 50 PRO CA C -9.567 -15.828 1.486 1.00 . A A . 50 PRO CA 1 1 16 11392 1 1 50 PRO CB C -10.514 -16.954 1.920 1.00 . A A . 50 PRO CB 1 1 16 11393 1 1 50 PRO CD C -11.884 -15.148 1.171 1.00 . A A . 50 PRO CD 1 1 16 11394 1 1 50 PRO CG C -11.815 -16.645 1.263 1.00 . A A . 50 PRO CG 1 1 16 11395 1 1 50 PRO HA H -8.971 -15.510 2.330 1.00 . A A . 50 PRO HA 1 1 16 11396 1 1 50 PRO HB2 H -10.121 -17.904 1.589 1.00 . A A . 50 PRO HB2 1 1 16 11397 1 1 50 PRO HB3 H -10.607 -16.953 2.996 1.00 . A A . 50 PRO HB3 1 1 16 11398 1 1 50 PRO HD2 H -12.452 -14.848 0.302 1.00 . A A . 50 PRO HD2 1 1 16 11399 1 1 50 PRO HD3 H -12.315 -14.733 2.069 1.00 . A A . 50 PRO HD3 1 1 16 11400 1 1 50 PRO HG2 H -11.841 -17.083 0.276 1.00 . A A . 50 PRO HG2 1 1 16 11401 1 1 50 PRO HG3 H -12.629 -17.021 1.863 1.00 . A A . 50 PRO HG3 1 1 16 11402 1 1 50 PRO N N -10.470 -14.761 1.038 1.00 . A A . 50 PRO N 1 1 16 11403 1 1 50 PRO O O -7.648 -16.990 0.632 1.00 . A A . 50 PRO O 1 1 16 11404 1 1 51 GLY C C -7.314 -15.239 -2.542 1.00 . A A . 51 GLY C 1 1 16 11405 1 1 51 GLY CA C -8.168 -16.369 -1.999 1.00 . A A . 51 GLY CA 1 1 16 11406 1 1 51 GLY H H -9.782 -15.420 -1.010 1.00 . A A . 51 GLY H 1 1 16 11407 1 1 51 GLY HA2 H -7.522 -17.180 -1.693 1.00 . A A . 51 GLY HA2 1 1 16 11408 1 1 51 GLY HA3 H -8.820 -16.721 -2.785 1.00 . A A . 51 GLY HA3 1 1 16 11409 1 1 51 GLY N N -8.978 -15.961 -0.866 1.00 . A A . 51 GLY N 1 1 16 11410 1 1 51 GLY O O -6.923 -15.253 -3.710 1.00 . A A . 51 GLY O 1 1 16 11411 1 1 52 GLY C C -6.806 -12.370 -3.268 1.00 . A A . 52 GLY C 1 1 16 11412 1 1 52 GLY CA C -6.204 -13.132 -2.103 1.00 . A A . 52 GLY CA 1 1 16 11413 1 1 52 GLY H H -7.354 -14.309 -0.771 1.00 . A A . 52 GLY H 1 1 16 11414 1 1 52 GLY HA2 H -6.094 -12.457 -1.266 1.00 . A A . 52 GLY HA2 1 1 16 11415 1 1 52 GLY HA3 H -5.227 -13.494 -2.390 1.00 . A A . 52 GLY HA3 1 1 16 11416 1 1 52 GLY N N -7.019 -14.261 -1.690 1.00 . A A . 52 GLY N 1 1 16 11417 1 1 52 GLY O O -6.085 -11.739 -4.043 1.00 . A A . 52 GLY O 1 1 16 11418 1 1 53 THR C C -9.625 -10.556 -3.967 1.00 . A A . 53 THR C 1 1 16 11419 1 1 53 THR CA C -8.824 -11.748 -4.481 1.00 . A A . 53 THR CA 1 1 16 11420 1 1 53 THR CB C -9.776 -12.704 -5.225 1.00 . A A . 53 THR CB 1 1 16 11421 1 1 53 THR CG2 C -9.010 -13.878 -5.818 1.00 . A A . 53 THR CG2 1 1 16 11422 1 1 53 THR H H -8.645 -12.957 -2.751 1.00 . A A . 53 THR H 1 1 16 11423 1 1 53 THR HA H -8.083 -11.396 -5.183 1.00 . A A . 53 THR HA 1 1 16 11424 1 1 53 THR HB H -10.251 -12.161 -6.029 1.00 . A A . 53 THR HB 1 1 16 11425 1 1 53 THR HG1 H -10.366 -13.666 -3.608 1.00 . A A . 53 THR HG1 1 1 16 11426 1 1 53 THR HG21 H -9.534 -14.249 -6.686 1.00 . A A . 53 THR HG21 1 1 16 11427 1 1 53 THR HG22 H -8.931 -14.664 -5.082 1.00 . A A . 53 THR HG22 1 1 16 11428 1 1 53 THR HG23 H -8.021 -13.554 -6.105 1.00 . A A . 53 THR HG23 1 1 16 11429 1 1 53 THR N N -8.127 -12.433 -3.397 1.00 . A A . 53 THR N 1 1 16 11430 1 1 53 THR O O -9.680 -10.301 -2.763 1.00 . A A . 53 THR O 1 1 16 11431 1 1 53 THR OG1 O -10.783 -13.189 -4.330 1.00 . A A . 53 THR OG1 1 1 16 11432 1 1 54 CYS C C -12.485 -8.825 -5.028 1.00 . A A . 54 CYS C 1 1 16 11433 1 1 54 CYS CA C -11.047 -8.661 -4.544 1.00 . A A . 54 CYS CA 1 1 16 11434 1 1 54 CYS CB C -10.436 -7.395 -5.148 1.00 . A A . 54 CYS CB 1 1 16 11435 1 1 54 CYS H H -10.160 -10.088 -5.834 1.00 . A A . 54 CYS H 1 1 16 11436 1 1 54 CYS HA H -11.050 -8.572 -3.469 1.00 . A A . 54 CYS HA 1 1 16 11437 1 1 54 CYS HB2 H -10.548 -7.427 -6.221 1.00 . A A . 54 CYS HB2 1 1 16 11438 1 1 54 CYS HB3 H -10.960 -6.533 -4.763 1.00 . A A . 54 CYS HB3 1 1 16 11439 1 1 54 CYS N N -10.245 -9.830 -4.893 1.00 . A A . 54 CYS N 1 1 16 11440 1 1 54 CYS O O -12.727 -9.086 -6.206 1.00 . A A . 54 CYS O 1 1 16 11441 1 1 54 CYS SG S -8.664 -7.176 -4.784 1.00 . A A . 54 CYS SG 1 1 16 11442 1 1 55 ILE C C -15.615 -7.528 -4.110 1.00 . A A . 55 ILE C 1 1 16 11443 1 1 55 ILE CA C -14.850 -8.805 -4.443 1.00 . A A . 55 ILE CA 1 1 16 11444 1 1 55 ILE CB C -15.506 -9.986 -3.698 1.00 . A A . 55 ILE CB 1 1 16 11445 1 1 55 ILE CD1 C -15.182 -11.508 -1.680 1.00 . A A . 55 ILE CD1 1 1 16 11446 1 1 55 ILE CG1 C -14.523 -10.610 -2.704 1.00 . A A . 55 ILE CG1 1 1 16 11447 1 1 55 ILE CG2 C -16.000 -11.030 -4.689 1.00 . A A . 55 ILE CG2 1 1 16 11448 1 1 55 ILE H H -13.177 -8.467 -3.186 1.00 . A A . 55 ILE H 1 1 16 11449 1 1 55 ILE HA H -14.926 -8.991 -5.504 1.00 . A A . 55 ILE HA 1 1 16 11450 1 1 55 ILE HB H -16.361 -9.609 -3.156 1.00 . A A . 55 ILE HB 1 1 16 11451 1 1 55 ILE HD11 H -15.467 -12.438 -2.147 1.00 . A A . 55 ILE HD11 1 1 16 11452 1 1 55 ILE HD12 H -16.062 -11.019 -1.285 1.00 . A A . 55 ILE HD12 1 1 16 11453 1 1 55 ILE HD13 H -14.490 -11.706 -0.876 1.00 . A A . 55 ILE HD13 1 1 16 11454 1 1 55 ILE HG12 H -13.801 -11.202 -3.246 1.00 . A A . 55 ILE HG12 1 1 16 11455 1 1 55 ILE HG13 H -14.009 -9.822 -2.173 1.00 . A A . 55 ILE HG13 1 1 16 11456 1 1 55 ILE HG21 H -16.975 -11.383 -4.383 1.00 . A A . 55 ILE HG21 1 1 16 11457 1 1 55 ILE HG22 H -15.309 -11.859 -4.715 1.00 . A A . 55 ILE HG22 1 1 16 11458 1 1 55 ILE HG23 H -16.070 -10.588 -5.672 1.00 . A A . 55 ILE HG23 1 1 16 11459 1 1 55 ILE N N -13.435 -8.672 -4.109 1.00 . A A . 55 ILE N 1 1 16 11460 1 1 55 ILE O O -15.053 -6.584 -3.560 1.00 . A A . 55 ILE O 1 1 16 11461 1 1 56 SER C C -18.756 -6.640 -3.092 1.00 . A A . 56 SER C 1 1 16 11462 1 1 56 SER CA C -17.740 -6.343 -4.190 1.00 . A A . 56 SER CA 1 1 16 11463 1 1 56 SER CB C -18.463 -5.915 -5.467 1.00 . A A . 56 SER CB 1 1 16 11464 1 1 56 SER H H -17.295 -8.288 -4.892 1.00 . A A . 56 SER H 1 1 16 11465 1 1 56 SER HA H -17.100 -5.538 -3.863 1.00 . A A . 56 SER HA 1 1 16 11466 1 1 56 SER HB2 H -18.394 -6.706 -6.199 1.00 . A A . 56 SER HB2 1 1 16 11467 1 1 56 SER HB3 H -19.502 -5.722 -5.243 1.00 . A A . 56 SER HB3 1 1 16 11468 1 1 56 SER HG H -17.060 -4.552 -5.563 1.00 . A A . 56 SER HG 1 1 16 11469 1 1 56 SER N N -16.901 -7.507 -4.451 1.00 . A A . 56 SER N 1 1 16 11470 1 1 56 SER O O -19.099 -7.827 -2.908 1.00 . A A . 56 SER O 1 1 16 11471 1 1 56 SER OXT O -19.201 -5.683 -2.424 1.00 . A A . 56 SER OXT 1 1 16 11472 1 1 56 SER OG O -17.888 -4.740 -6.011 1.00 . A A . 56 SER OG 1 1 stop_ save_
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