NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
397215 | 1ssl | 6165 | cing | 4-filtered-FRED | STAR | entry | full | 399 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1ssl # This FRED archive file contains, for PDB entry <1ssl>: # # - Coordinates and sequence information from the PDB mmCIF file # - NMR restraints from the PDB MR file # # In this file, the coordinates and NMR restraints share the same atom names, # and in this way can differ from the data deposited at the wwPDB. To achieve # this aim, the NMR restraints were parsed from their original format files, and # the coordinates and NMR restraints information were subsequently harmonized. # # Due to the complexity of this harmonization process and the filtering process # used in creating these files, the NMR restraints information in these files # may differ significantly from that in the originally deposited file. Other # modifications could have occurred to the NMR restraints information, or data # could have been lost because of parsing or conversion errors. The PDB file # remains the authoritative reference for the atomic coordinates and the # originally deposited restraints files remain the primary reference for these # data. # # This file is generated at the BioMagResBank (BMRB) in collaboration with the # PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and # the CMBI/IMM group at the Radboud University of Nijmegen. # # Several software packages were used to produce this file: # # - Wattos (BMRB and CMBI/IMM). # - FormatConverter and NMRStarExport (PDBe). # - CCPN framework (http://www.ccpn.ac.uk/). # # More information about this process can be found in the references below. # Please cite the original reference for this PDB entry. # # JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL # Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED # containing converted and filtered sets of experimental NMR restraints and # coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12. # # WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL # Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy: # development of a software pipeline. Proteins 59, 687-696. # # JF Doreleijers, W Vranken, C Penkett, J Lin, CF Schulte, G Vuister, G Vriend, # JL Markley, EL Ulrich. BioMagResBank database `NMR Restraints Grid` with # curated sets of experimental NMR restraints for over 4,000 protein and nucleic # acid PDB entries. (in preparation) save_Conversion_project_for_entry_Name_1 _Study_list.Sf_category study_list _Study_list.Entry_ID 1 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project for entry 1" NMR . 1 1 stop_ save_ save_originalConstraints_1 _Entry.Sf_category entry_information _Entry.ID 1 _Entry.Title "Data for entry 1" _Entry.NMR_STAR_version 3.1.0.8 _Entry.Experimental_method NMR _Entry.Details . save_ save_assembly_1ssl _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 1ssl _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all disulfide bound" _Assembly.Molecular_mass 5302.00 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 $Hepatocyte_growth_factor_receptor A . 1 1 stop_ save_ save_Hepatocyte_growth_factor_receptor _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Hepatocyte growth factor receptor" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code GSAMGCRHFQSCSQCLSAPPFVQCGWCHDKCVRSEECLSGTWTQQICL _Entity.Number_of_monomers 48 loop_ _Entity_comp_index.ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 GLY . 1 1 2 SER . 1 1 3 ALA . 1 1 4 MET . 1 1 5 GLY . 1 1 6 CYS . 1 1 7 ARG . 1 1 8 HIS . 1 1 9 PHE . 1 1 10 GLN . 1 1 11 SER . 1 1 12 CYS . 1 1 13 SER . 1 1 14 GLN . 1 1 15 CYS . 1 1 16 LEU . 1 1 17 SER . 1 1 18 ALA . 1 1 19 PRO . 1 1 20 PRO . 1 1 21 PHE . 1 1 22 VAL . 1 1 23 GLN . 1 1 24 CYS . 1 1 25 GLY . 1 1 26 TRP . 1 1 27 CYS . 1 1 28 HIS . 1 1 29 ASP . 1 1 30 LYS . 1 1 31 CYS . 1 1 32 VAL . 1 1 33 ARG . 1 1 34 SER . 1 1 35 GLU . 1 1 36 GLU . 1 1 37 CYS . 1 1 38 LEU . 1 1 39 SER . 1 1 40 GLY . 1 1 41 THR . 1 1 42 TRP . 1 1 43 THR . 1 1 44 GLN . 1 1 45 GLN . 1 1 46 ILE . 1 1 47 CYS . 1 1 48 LEU . 1 1 stop_ loop_ _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID GLY 1 1 1 1 SER 2 2 1 1 ALA 3 3 1 1 MET 4 4 1 1 GLY 5 5 1 1 CYS 6 6 1 1 ARG 7 7 1 1 HIS 8 8 1 1 PHE 9 9 1 1 GLN 10 10 1 1 SER 11 11 1 1 CYS 12 12 1 1 SER 13 13 1 1 GLN 14 14 1 1 CYS 15 15 1 1 LEU 16 16 1 1 SER 17 17 1 1 ALA 18 18 1 1 PRO 19 19 1 1 PRO 20 20 1 1 PHE 21 21 1 1 VAL 22 22 1 1 GLN 23 23 1 1 CYS 24 24 1 1 GLY 25 25 1 1 TRP 26 26 1 1 CYS 27 27 1 1 HIS 28 28 1 1 ASP 29 29 1 1 LYS 30 30 1 1 CYS 31 31 1 1 VAL 32 32 1 1 ARG 33 33 1 1 SER 34 34 1 1 GLU 35 35 1 1 GLU 36 36 1 1 CYS 37 37 1 1 LEU 38 38 1 1 SER 39 39 1 1 GLY 40 40 1 1 THR 41 41 1 1 TRP 42 42 1 1 THR 43 43 1 1 GLN 44 44 1 1 GLN 45 45 1 1 ILE 46 46 1 1 CYS 47 47 1 1 LEU 48 48 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type "general distance" _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 121 1 . . . 1 1 122 1 . . . 1 1 123 1 . . . 1 1 124 1 . . . 1 1 125 1 . . . 1 1 126 1 . . . 1 1 127 1 . . . 1 1 128 1 . . . 1 1 129 1 . . . 1 1 130 1 . . . 1 1 131 1 . . . 1 1 132 1 . . . 1 1 133 1 . . . 1 1 134 1 . . . 1 1 135 1 . . . 1 1 136 1 . . . 1 1 137 1 . . . 1 1 138 1 . . . 1 1 139 1 . . . 1 1 140 1 . . . 1 1 141 1 . . . 1 1 142 1 . . . 1 1 143 1 . . . 1 1 144 1 . . . 1 1 145 1 . . . 1 1 146 1 . . . 1 1 147 1 . . . 1 1 148 1 . . . 1 1 149 1 . . . 1 1 150 1 . . . 1 1 151 1 . . . 1 1 152 1 . . . 1 1 153 1 . . . 1 1 154 1 . . . 1 1 155 1 . . . 1 1 156 1 . . . 1 1 157 1 . . . 1 1 158 1 . . . 1 1 159 1 . . . 1 1 160 1 . . . 1 1 161 1 . . . 1 1 162 1 . . . 1 1 163 1 . . . 1 1 164 1 . . . 1 1 165 1 . . . 1 1 166 1 . . . 1 1 167 1 . . . 1 1 168 1 . . . 1 1 169 1 . . . 1 1 170 1 . . . 1 1 171 1 . . . 1 1 172 1 . . . 1 1 173 1 . . . 1 1 174 1 . . . 1 1 175 1 . . . 1 1 176 1 . . . 1 1 177 1 . . . 1 1 178 1 . . . 1 1 179 1 . . . 1 1 180 1 . . . 1 1 181 1 . . . 1 1 182 1 . . . 1 1 183 1 . . . 1 1 184 1 . . . 1 1 185 1 . . . 1 1 186 1 . . . 1 1 187 1 . . . 1 1 188 1 . . . 1 1 189 1 . . . 1 1 190 1 . . . 1 1 191 1 . . . 1 1 192 1 . . . 1 1 193 1 . . . 1 1 194 1 . . . 1 1 195 1 . . . 1 1 196 1 . . . 1 1 197 1 . . . 1 1 198 1 . . . 1 1 199 1 . . . 1 1 200 1 . . . 1 1 201 1 . . . 1 1 202 1 . . . 1 1 203 1 . . . 1 1 204 1 . . . 1 1 205 1 . . . 1 1 206 1 . . . 1 1 207 1 . . . 1 1 208 1 . . . 1 1 209 1 . . . 1 1 210 1 . . . 1 1 211 1 . . . 1 1 212 1 . . . 1 1 213 1 . . . 1 1 214 1 . . . 1 1 215 1 . . . 1 1 216 1 . . . 1 1 217 1 . . . 1 1 218 1 . . . 1 1 219 1 . . . 1 1 220 1 . . . 1 1 221 1 . . . 1 1 222 1 . . . 1 1 223 1 . . . 1 1 224 1 . . . 1 1 225 1 . . . 1 1 226 1 . . . 1 1 227 1 . . . 1 1 228 1 . . . 1 1 229 1 . . . 1 1 230 1 . . . 1 1 231 1 . . . 1 1 232 1 . . . 1 1 233 1 . . . 1 1 234 1 . . . 1 1 235 1 . . . 1 1 236 1 . . . 1 1 237 1 . . . 1 1 238 1 . . . 1 1 239 1 . . . 1 1 240 1 . . . 1 1 241 1 . . . 1 1 242 1 . . . 1 1 243 1 . . . 1 1 244 1 . . . 1 1 245 1 . . . 1 1 246 1 . . . 1 1 247 1 . . . 1 1 248 1 . . . 1 1 249 1 . . . 1 1 250 1 . . . 1 1 251 1 . . . 1 1 252 1 . . . 1 1 253 1 . . . 1 1 254 1 . . . 1 1 255 1 . . . 1 1 256 1 . . . 1 1 257 1 . . . 1 1 258 1 . . . 1 1 259 1 . . . 1 1 260 1 . . . 1 1 261 1 . . . 1 1 262 1 . . . 1 1 263 1 . . . 1 1 264 1 . . . 1 1 265 1 . . . 1 1 266 1 . . . 1 1 267 1 . . . 1 1 268 1 . . . 1 1 269 1 . . . 1 1 270 1 . . . 1 1 271 1 . . . 1 1 272 1 . . . 1 1 273 1 . . . 1 1 274 1 . . . 1 1 275 1 . . . 1 1 276 1 . . . 1 1 277 1 . . . 1 1 278 1 . . . 1 1 279 1 . . . 1 1 280 1 . . . 1 1 281 1 . . . 1 1 282 1 . . . 1 1 283 1 . . . 1 1 284 1 . . . 1 1 285 1 . . . 1 1 286 1 . . . 1 1 287 1 . . . 1 1 288 1 . . . 1 1 289 1 . . . 1 1 290 1 . . . 1 1 291 1 . . . 1 1 292 1 . . . 1 1 293 1 . . . 1 1 294 1 . . . 1 1 295 1 . . . 1 1 296 1 . . . 1 1 297 1 . . . 1 1 298 1 . . . 1 1 299 1 . . . 1 1 300 1 . . . 1 1 301 1 . . . 1 1 302 1 . . . 1 1 303 1 . . . 1 1 304 1 . . . 1 1 305 1 . . . 1 1 306 1 . . . 1 1 307 1 . . . 1 1 308 1 . . . 1 1 309 1 . . . 1 1 310 1 . . . 1 1 311 1 . . . 1 1 312 1 . . . 1 1 313 1 . . . 1 1 314 1 . . . 1 1 315 1 . . . 1 1 316 1 . . . 1 1 317 1 . . . 1 1 318 1 . . . 1 1 319 1 . . . 1 1 320 1 . . . 1 1 321 1 . . . 1 1 322 1 . . . 1 1 323 1 . . . 1 1 324 1 . . . 1 1 325 1 . . . 1 1 326 1 . . . 1 1 327 1 . . . 1 1 328 1 . . . 1 1 329 1 . . . 1 1 330 1 . . . 1 1 331 1 . . . 1 1 332 1 . . . 1 1 333 1 . . . 1 1 334 1 . . . 1 1 335 1 . . . 1 1 336 1 . . . 1 1 337 1 . . . 1 1 338 1 . . . 1 1 339 1 . . . 1 1 340 1 . . . 1 1 341 1 . . . 1 1 342 1 . . . 1 1 343 1 . . . 1 1 344 1 . . . 1 1 345 1 . . . 1 1 346 1 . . . 1 1 347 1 . . . 1 1 348 1 . . . 1 1 349 1 . . . 1 1 350 1 . . . 1 1 351 1 . . . 1 1 352 1 . . . 1 1 353 1 . . . 1 1 354 1 . . . 1 1 355 1 . . . 1 1 356 1 . . . 1 1 357 1 . . . 1 1 358 1 . . . 1 1 359 1 . . . 1 1 360 1 . . . 1 1 361 1 . . . 1 1 362 1 . . . 1 1 363 1 . . . 1 1 364 1 . . . 1 1 365 1 . . . 1 1 366 1 . . . 1 1 367 1 . . . 1 1 368 1 . . . 1 1 369 1 . . . 1 1 370 1 . . . 1 1 371 1 . . . 1 1 372 1 . . . 1 1 373 1 . . . 1 1 374 1 . . . 1 1 375 1 . . . 1 1 376 1 . . . 1 1 377 1 . . . 1 1 378 1 . . . 1 1 379 1 . . . 1 1 380 1 . . . 1 1 381 1 . . . 1 1 382 1 . . . 1 1 383 1 . . . 1 1 384 1 . . . 1 1 385 1 . . . 1 1 386 1 . . . 1 1 387 1 . . . 1 1 388 1 . . . 1 1 389 1 . . . 1 1 390 1 . . . 1 1 391 1 . . . 1 1 392 1 . . . 1 1 393 1 . . . 1 1 394 1 . . . 1 1 395 1 . . . 1 1 396 1 . . . 1 1 397 1 . . . 1 1 398 1 . . . 1 1 399 1 . . . 1 1 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 2 SER QB . 2 . HB# 1 1 1 1 2 1 1 3 ALA H . 3 . HN 1 1 2 1 1 1 1 3 ALA H . 3 . HN 1 1 2 1 2 1 1 3 ALA MB . 3 . HB# 1 1 3 1 1 1 1 3 ALA HA . 3 . HA 1 1 3 1 2 1 1 4 MET H . 4 . HN 1 1 4 1 1 1 1 3 ALA MB . 3 . HB# 1 1 4 1 2 1 1 4 MET H . 4 . HN 1 1 5 1 1 1 1 3 ALA MB . 3 . HB# 1 1 5 1 2 1 1 4 MET HA . 4 . HA 1 1 6 1 1 1 1 3 ALA MB . 3 . HB# 1 1 6 1 2 1 1 5 GLY H . 5 . HN 1 1 7 1 1 1 1 4 MET H . 4 . HN 1 1 7 1 2 1 1 4 MET QB . 4 . HB# 1 1 8 1 1 1 1 4 MET H . 4 . HN 1 1 8 1 2 1 1 4 MET QG . 4 . HG# 1 1 9 1 1 1 1 4 MET HA . 4 . HA 1 1 9 1 2 1 1 5 GLY H . 5 . HN 1 1 10 1 1 1 1 4 MET QB . 4 . HB# 1 1 10 1 2 1 1 5 GLY H . 5 . HN 1 1 11 1 1 1 1 4 MET QG . 4 . HG# 1 1 11 1 2 1 1 5 GLY H . 5 . HN 1 1 12 1 1 1 1 5 GLY H . 5 . HN 1 1 12 1 2 1 1 6 CYS H . 6 . HN 1 1 13 1 1 1 1 5 GLY H . 5 . HN 1 1 13 1 2 1 1 22 VAL MG1 . 22 . HG1# 1 1 14 1 1 1 1 5 GLY HA2 . 5 . HA2 1 1 14 1 2 1 1 6 CYS H . 6 . HN 1 1 15 1 1 1 1 5 GLY HA2 . 5 . HA2 1 1 15 1 2 1 1 22 VAL MG1 . 22 . HG1# 1 1 16 1 1 1 1 5 GLY HA3 . 5 . HA1 1 1 16 1 2 1 1 7 ARG H . 7 . HN 1 1 17 1 1 1 1 6 CYS CB . 6 . CB 1 1 17 1 2 1 1 24 CYS SG . 24 . SG 1 1 18 1 1 1 1 6 CYS H . 6 . HN 1 1 18 1 2 1 1 6 CYS HB2 . 6 . HB2 1 1 19 1 1 1 1 6 CYS H . 6 . HN 1 1 19 1 2 1 1 7 ARG H . 7 . HN 1 1 20 1 1 1 1 6 CYS H . 6 . HN 1 1 20 1 2 1 1 9 PHE QD . 9 . HD# 1 1 21 1 1 1 1 6 CYS H . 6 . HN 1 1 21 1 2 1 1 22 VAL MG1 . 22 . HG1# 1 1 22 1 1 1 1 6 CYS HA . 6 . HA 1 1 22 1 2 1 1 9 PHE QD . 9 . HD# 1 1 23 1 1 1 1 6 CYS HA . 6 . HA 1 1 23 1 2 1 1 9 PHE QE . 9 . HE# 1 1 24 1 1 1 1 6 CYS HB2 . 6 . HB2 1 1 24 1 2 1 1 7 ARG H . 7 . HN 1 1 25 1 1 1 1 6 CYS HB2 . 6 . HB2 1 1 25 1 2 1 1 9 PHE QD . 9 . HD# 1 1 26 1 1 1 1 6 CYS HB2 . 6 . HB2 1 1 26 1 2 1 1 9 PHE QE . 9 . HE# 1 1 27 1 1 1 1 6 CYS HB3 . 6 . HB1 1 1 27 1 2 1 1 7 ARG H . 7 . HN 1 1 28 1 1 1 1 6 CYS HB3 . 6 . HB1 1 1 28 1 2 1 1 22 VAL MG1 . 22 . HG1# 1 1 29 1 1 1 1 6 CYS SG . 6 . SG 1 1 29 1 2 1 1 24 CYS CB . 24 . CB 1 1 30 1 1 1 1 6 CYS SG . 6 . SG 1 1 30 1 2 1 1 24 CYS SG . 24 . SG 1 1 31 1 1 1 1 7 ARG H . 7 . HN 1 1 31 1 2 1 1 7 ARG HB2 . 7 . HB2 1 1 32 1 1 1 1 7 ARG H . 7 . HN 1 1 32 1 2 1 1 7 ARG QD . 7 . HD# 1 1 33 1 1 1 1 7 ARG H . 7 . HN 1 1 33 1 2 1 1 7 ARG QG . 7 . HG# 1 1 34 1 1 1 1 7 ARG H . 7 . HN 1 1 34 1 2 1 1 8 HIS H . 8 . HN 1 1 35 1 1 1 1 7 ARG H . 7 . HN 1 1 35 1 2 1 1 24 CYS HB2 . 24 . HB2 1 1 36 1 1 1 1 7 ARG HA . 7 . HA 1 1 36 1 2 1 1 7 ARG QG . 7 . HG# 1 1 37 1 1 1 1 7 ARG HB2 . 7 . HB2 1 1 37 1 2 1 1 7 ARG QD . 7 . HD# 1 1 38 1 1 1 1 7 ARG HB2 . 7 . HB2 1 1 38 1 2 1 1 7 ARG QH . 7 . HH# 1 1 39 1 1 1 1 7 ARG HB2 . 7 . HB2 1 1 39 1 2 1 1 8 HIS H . 8 . HN 1 1 40 1 1 1 1 7 ARG HB2 . 7 . HB2 1 1 40 1 2 1 1 24 CYS HB2 . 24 . HB2 1 1 41 1 1 1 1 7 ARG HB3 . 7 . HB1 1 1 41 1 2 1 1 24 CYS HB2 . 24 . HB2 1 1 42 1 1 1 1 7 ARG QD . 7 . HD# 1 1 42 1 2 1 1 7 ARG QH . 7 . HH# 1 1 43 1 1 1 1 7 ARG QD . 7 . HD# 1 1 43 1 2 1 1 24 CYS HB2 . 24 . HB2 1 1 44 1 1 1 1 7 ARG QG . 7 . HG# 1 1 44 1 2 1 1 7 ARG QH . 7 . HH# 1 1 45 1 1 1 1 7 ARG QG . 7 . HG# 1 1 45 1 2 1 1 24 CYS HB2 . 24 . HB2 1 1 46 1 1 1 1 7 ARG QH . 7 . HH# 1 1 46 1 2 1 1 24 CYS HB2 . 24 . HB2 1 1 47 1 1 1 1 8 HIS H . 8 . HN 1 1 47 1 2 1 1 8 HIS HB2 . 8 . HB2 1 1 48 1 1 1 1 8 HIS H . 8 . HN 1 1 48 1 2 1 1 8 HIS HB3 . 8 . HB1 1 1 49 1 1 1 1 8 HIS H . 8 . HN 1 1 49 1 2 1 1 8 HIS HD2 . 8 . HD2 1 1 50 1 1 1 1 8 HIS H . 8 . HN 1 1 50 1 2 1 1 9 PHE H . 9 . HN 1 1 51 1 1 1 1 8 HIS HA . 8 . HA 1 1 51 1 2 1 1 8 HIS HD2 . 8 . HD2 1 1 52 1 1 1 1 8 HIS HB2 . 8 . HB2 1 1 52 1 2 1 1 9 PHE H . 9 . HN 1 1 53 1 1 1 1 8 HIS HD2 . 8 . HD2 1 1 53 1 2 1 1 9 PHE QD . 9 . HD# 1 1 54 1 1 1 1 8 HIS HD2 . 8 . HD2 1 1 54 1 2 1 1 9 PHE QE . 9 . HE# 1 1 55 1 1 1 1 9 PHE H . 9 . HN 1 1 55 1 2 1 1 10 GLN H . 10 . HN 1 1 56 1 1 1 1 9 PHE HA . 9 . HA 1 1 56 1 2 1 1 9 PHE QD . 9 . HD# 1 1 57 1 1 1 1 9 PHE HA . 9 . HA 1 1 57 1 2 1 1 9 PHE QE . 9 . HE# 1 1 58 1 1 1 1 9 PHE HA . 9 . HA 1 1 58 1 2 1 1 10 GLN H . 10 . HN 1 1 59 1 1 1 1 9 PHE HB2 . 9 . HB2 1 1 59 1 2 1 1 10 GLN H . 10 . HN 1 1 60 1 1 1 1 9 PHE HB2 . 9 . HB2 1 1 60 1 2 1 1 15 CYS H . 15 . HN 1 1 61 1 1 1 1 9 PHE HB3 . 9 . HB1 1 1 61 1 2 1 1 10 GLN H . 10 . HN 1 1 62 1 1 1 1 9 PHE HB3 . 9 . HB1 1 1 62 1 2 1 1 15 CYS H . 15 . HN 1 1 63 1 1 1 1 9 PHE HB3 . 9 . HB1 1 1 63 1 2 1 1 15 CYS HA . 15 . HA 1 1 64 1 1 1 1 9 PHE QD . 9 . HD# 1 1 64 1 2 1 1 14 GLN HA . 14 . HA 1 1 65 1 1 1 1 9 PHE QD . 9 . HD# 1 1 65 1 2 1 1 14 GLN HB2 . 14 . HB2 1 1 66 1 1 1 1 9 PHE QD . 9 . HD# 1 1 66 1 2 1 1 14 GLN HB3 . 14 . HB1 1 1 67 1 1 1 1 9 PHE QD . 9 . HD# 1 1 67 1 2 1 1 14 GLN QG . 14 . HG# 1 1 68 1 1 1 1 9 PHE QD . 9 . HD# 1 1 68 1 2 1 1 15 CYS H . 15 . HN 1 1 69 1 1 1 1 9 PHE QD . 9 . HD# 1 1 69 1 2 1 1 15 CYS HA . 15 . HA 1 1 70 1 1 1 1 9 PHE QE . 9 . HE# 1 1 70 1 2 1 1 14 GLN HB3 . 14 . HB1 1 1 71 1 1 1 1 9 PHE QE . 9 . HE# 1 1 71 1 2 1 1 14 GLN QG . 14 . HG# 1 1 72 1 1 1 1 9 PHE QE . 9 . HE# 1 1 72 1 2 1 1 18 ALA H . 18 . HN 1 1 73 1 1 1 1 9 PHE QE . 9 . HE# 1 1 73 1 2 1 1 18 ALA MB . 18 . HB# 1 1 74 1 1 1 1 9 PHE QE . 9 . HE# 1 1 74 1 2 1 1 21 PHE HB2 . 21 . HB2 1 1 75 1 1 1 1 9 PHE QE . 9 . HE# 1 1 75 1 2 1 1 22 VAL HB . 22 . HB 1 1 76 1 1 1 1 9 PHE QE . 9 . HE# 1 1 76 1 2 1 1 22 VAL MG1 . 22 . HG1# 1 1 77 1 1 1 1 10 GLN H . 10 . HN 1 1 77 1 2 1 1 10 GLN QB . 10 . HB# 1 1 78 1 1 1 1 10 GLN H . 10 . HN 1 1 78 1 2 1 1 10 GLN QG . 10 . HG# 1 1 79 1 1 1 1 10 GLN H . 10 . HN 1 1 79 1 2 1 1 11 SER H . 11 . HN 1 1 80 1 1 1 1 10 GLN HA . 10 . HA 1 1 80 1 2 1 1 10 GLN QG . 10 . HG# 1 1 81 1 1 1 1 11 SER H . 11 . HN 1 1 81 1 2 1 1 12 CYS H . 12 . HN 1 1 82 1 1 1 1 11 SER H . 11 . HN 1 1 82 1 2 1 1 14 GLN H . 14 . HN 1 1 83 1 1 1 1 11 SER H . 11 . HN 1 1 83 1 2 1 1 26 TRP HZ3 . 26 . HZ3 1 1 84 1 1 1 1 11 SER HA . 11 . HA 1 1 84 1 2 1 1 12 CYS H . 12 . HN 1 1 85 1 1 1 1 11 SER HA . 11 . HA 1 1 85 1 2 1 1 13 SER H . 13 . HN 1 1 86 1 1 1 1 11 SER HA . 11 . HA 1 1 86 1 2 1 1 26 TRP HH2 . 26 . HH2 1 1 87 1 1 1 1 11 SER HA . 11 . HA 1 1 87 1 2 1 1 26 TRP HZ2 . 26 . HZ2 1 1 88 1 1 1 1 11 SER HA . 11 . HA 1 1 88 1 2 1 1 26 TRP HZ3 . 26 . HZ3 1 1 89 1 1 1 1 11 SER QB . 11 . HB# 1 1 89 1 2 1 1 12 CYS H . 12 . HN 1 1 90 1 1 1 1 11 SER QB . 11 . HB# 1 1 90 1 2 1 1 12 CYS HA . 12 . HA 1 1 91 1 1 1 1 12 CYS CB . 12 . CB 1 1 91 1 2 1 1 47 CYS SG . 47 . SG 1 1 92 1 1 1 1 12 CYS H . 12 . HN 1 1 92 1 2 1 1 12 CYS HB2 . 12 . HB2 1 1 93 1 1 1 1 12 CYS H . 12 . HN 1 1 93 1 2 1 1 12 CYS HB3 . 12 . HB1 1 1 94 1 1 1 1 12 CYS H . 12 . HN 1 1 94 1 2 1 1 13 SER H . 13 . HN 1 1 95 1 1 1 1 12 CYS H . 12 . HN 1 1 95 1 2 1 1 14 GLN H . 14 . HN 1 1 96 1 1 1 1 12 CYS H . 12 . HN 1 1 96 1 2 1 1 26 TRP HH2 . 26 . HH2 1 1 97 1 1 1 1 12 CYS HA . 12 . HA 1 1 97 1 2 1 1 15 CYS H . 15 . HN 1 1 98 1 1 1 1 12 CYS HA . 12 . HA 1 1 98 1 2 1 1 15 CYS HB2 . 15 . HB2 1 1 99 1 1 1 1 12 CYS HA . 12 . HA 1 1 99 1 2 1 1 15 CYS HB3 . 15 . HB1 1 1 100 1 1 1 1 12 CYS HB2 . 12 . HB2 1 1 100 1 2 1 1 13 SER H . 13 . HN 1 1 101 1 1 1 1 12 CYS HB2 . 12 . HB2 1 1 101 1 2 1 1 15 CYS H . 15 . HN 1 1 102 1 1 1 1 12 CYS HB2 . 12 . HB2 1 1 102 1 2 1 1 15 CYS HB2 . 15 . HB2 1 1 103 1 1 1 1 12 CYS HB2 . 12 . HB2 1 1 103 1 2 1 1 15 CYS HB3 . 15 . HB1 1 1 104 1 1 1 1 12 CYS HB2 . 12 . HB2 1 1 104 1 2 1 1 26 TRP HE3 . 26 . HE3 1 1 105 1 1 1 1 12 CYS HB2 . 12 . HB2 1 1 105 1 2 1 1 26 TRP HZ3 . 26 . HZ3 1 1 106 1 1 1 1 12 CYS HB3 . 12 . HB1 1 1 106 1 2 1 1 13 SER H . 13 . HN 1 1 107 1 1 1 1 12 CYS SG . 12 . SG 1 1 107 1 2 1 1 47 CYS CB . 47 . CB 1 1 108 1 1 1 1 12 CYS SG . 12 . SG 1 1 108 1 2 1 1 47 CYS SG . 47 . SG 1 1 109 1 1 1 1 13 SER H . 13 . HN 1 1 109 1 2 1 1 13 SER QB . 13 . HB# 1 1 110 1 1 1 1 13 SER H . 13 . HN 1 1 110 1 2 1 1 14 GLN H . 14 . HN 1 1 111 1 1 1 1 13 SER HA . 13 . HA 1 1 111 1 2 1 1 15 CYS H . 15 . HN 1 1 112 1 1 1 1 13 SER QB . 13 . HB# 1 1 112 1 2 1 1 14 GLN H . 14 . HN 1 1 113 1 1 1 1 13 SER QB . 13 . HB# 1 1 113 1 2 1 1 14 GLN HB2 . 14 . HB2 1 1 114 1 1 1 1 13 SER QB . 13 . HB# 1 1 114 1 2 1 1 14 GLN HB3 . 14 . HB1 1 1 115 1 1 1 1 14 GLN H . 14 . HN 1 1 115 1 2 1 1 14 GLN HB3 . 14 . HB1 1 1 116 1 1 1 1 14 GLN H . 14 . HN 1 1 116 1 2 1 1 14 GLN QG . 14 . HG# 1 1 117 1 1 1 1 14 GLN H . 14 . HN 1 1 117 1 2 1 1 15 CYS H . 15 . HN 1 1 118 1 1 1 1 14 GLN H . 14 . HN 1 1 118 1 2 1 1 17 SER H . 17 . HN 1 1 119 1 1 1 1 14 GLN HA . 14 . HA 1 1 119 1 2 1 1 14 GLN QG . 14 . HG# 1 1 120 1 1 1 1 14 GLN HB2 . 14 . HB2 1 1 120 1 2 1 1 15 CYS H . 15 . HN 1 1 121 1 1 1 1 14 GLN HB3 . 14 . HB1 1 1 121 1 2 1 1 15 CYS H . 15 . HN 1 1 122 1 1 1 1 14 GLN HB3 . 14 . HB1 1 1 122 1 2 1 1 17 SER H . 17 . HN 1 1 123 1 1 1 1 14 GLN QG . 14 . HG# 1 1 123 1 2 1 1 15 CYS H . 15 . HN 1 1 124 1 1 1 1 14 GLN QG . 14 . HG# 1 1 124 1 2 1 1 17 SER H . 17 . HN 1 1 125 1 1 1 1 14 GLN QG . 14 . HG# 1 1 125 1 2 1 1 18 ALA MB . 18 . HB# 1 1 126 1 1 1 1 14 GLN QG . 14 . HG# 1 1 126 1 2 1 1 22 VAL MG1 . 22 . HG1# 1 1 127 1 1 1 1 15 CYS CB . 15 . CB 1 1 127 1 2 1 1 31 CYS SG . 31 . SG 1 1 128 1 1 1 1 15 CYS H . 15 . HN 1 1 128 1 2 1 1 15 CYS HB2 . 15 . HB2 1 1 129 1 1 1 1 15 CYS H . 15 . HN 1 1 129 1 2 1 1 15 CYS HB3 . 15 . HB1 1 1 130 1 1 1 1 15 CYS HB2 . 15 . HB2 1 1 130 1 2 1 1 26 TRP HE3 . 26 . HE3 1 1 131 1 1 1 1 15 CYS HB3 . 15 . HB1 1 1 131 1 2 1 1 16 LEU HG . 16 . HG 1 1 132 1 1 1 1 15 CYS HB3 . 15 . HB1 1 1 132 1 2 1 1 26 TRP HE3 . 26 . HE3 1 1 133 1 1 1 1 15 CYS HB3 . 15 . HB1 1 1 133 1 2 1 1 26 TRP HZ3 . 26 . HZ3 1 1 134 1 1 1 1 15 CYS SG . 15 . SG 1 1 134 1 2 1 1 31 CYS CB . 31 . CB 1 1 135 1 1 1 1 15 CYS SG . 15 . SG 1 1 135 1 2 1 1 31 CYS SG . 31 . SG 1 1 136 1 1 1 1 16 LEU H . 16 . HN 1 1 136 1 2 1 1 16 LEU HB3 . 16 . HB1 1 1 137 1 1 1 1 16 LEU H . 16 . HN 1 1 137 1 2 1 1 16 LEU MD1 . 16 . HD1# 1 1 138 1 1 1 1 16 LEU H . 16 . HN 1 1 138 1 2 1 1 16 LEU MD2 . 16 . HD2# 1 1 139 1 1 1 1 16 LEU H . 16 . HN 1 1 139 1 2 1 1 16 LEU HG . 16 . HG 1 1 140 1 1 1 1 16 LEU H . 16 . HN 1 1 140 1 2 1 1 17 SER H . 17 . HN 1 1 141 1 1 1 1 16 LEU H . 16 . HN 1 1 141 1 2 1 1 18 ALA H . 18 . HN 1 1 142 1 1 1 1 16 LEU HA . 16 . HA 1 1 142 1 2 1 1 16 LEU MD1 . 16 . HD1# 1 1 143 1 1 1 1 16 LEU HA . 16 . HA 1 1 143 1 2 1 1 16 LEU MD2 . 16 . HD2# 1 1 144 1 1 1 1 16 LEU HA . 16 . HA 1 1 144 1 2 1 1 16 LEU HG . 16 . HG 1 1 145 1 1 1 1 16 LEU HA . 16 . HA 1 1 145 1 2 1 1 44 GLN HE21 . 44 . HE21 1 1 146 1 1 1 1 16 LEU HB2 . 16 . HB2 1 1 146 1 2 1 1 16 LEU MD1 . 16 . HD1# 1 1 147 1 1 1 1 16 LEU HB2 . 16 . HB2 1 1 147 1 2 1 1 16 LEU MD2 . 16 . HD2# 1 1 148 1 1 1 1 16 LEU HB2 . 16 . HB2 1 1 148 1 2 1 1 17 SER H . 17 . HN 1 1 149 1 1 1 1 16 LEU HB3 . 16 . HB1 1 1 149 1 2 1 1 16 LEU MD1 . 16 . HD1# 1 1 150 1 1 1 1 16 LEU HB3 . 16 . HB1 1 1 150 1 2 1 1 16 LEU MD2 . 16 . HD2# 1 1 151 1 1 1 1 16 LEU HB3 . 16 . HB1 1 1 151 1 2 1 1 17 SER H . 17 . HN 1 1 152 1 1 1 1 16 LEU MD1 . 16 . HD1# 1 1 152 1 2 1 1 25 GLY QA . 25 . HA# 1 1 153 1 1 1 1 16 LEU MD1 . 16 . HD1# 1 1 153 1 2 1 1 26 TRP H . 26 . HN 1 1 154 1 1 1 1 16 LEU MD1 . 16 . HD1# 1 1 154 1 2 1 1 26 TRP HB2 . 26 . HB2 1 1 155 1 1 1 1 16 LEU MD1 . 16 . HD1# 1 1 155 1 2 1 1 26 TRP HB3 . 26 . HB1 1 1 156 1 1 1 1 16 LEU MD1 . 16 . HD1# 1 1 156 1 2 1 1 44 GLN HA . 44 . HA 1 1 157 1 1 1 1 16 LEU MD1 . 16 . HD1# 1 1 157 1 2 1 1 45 GLN H . 45 . HN 1 1 158 1 1 1 1 16 LEU MD1 . 16 . HD1# 1 1 158 1 2 1 1 45 GLN HA . 45 . HA 1 1 159 1 1 1 1 16 LEU MD1 . 16 . HD1# 1 1 159 1 2 1 1 46 ILE H . 46 . HN 1 1 160 1 1 1 1 16 LEU MD1 . 16 . HD1# 1 1 160 1 2 1 1 47 CYS H . 47 . HN 1 1 161 1 1 1 1 16 LEU MD2 . 16 . HD2# 1 1 161 1 2 1 1 26 TRP H . 26 . HN 1 1 162 1 1 1 1 16 LEU MD2 . 16 . HD2# 1 1 162 1 2 1 1 26 TRP HB2 . 26 . HB2 1 1 163 1 1 1 1 16 LEU MD2 . 16 . HD2# 1 1 163 1 2 1 1 26 TRP HB3 . 26 . HB1 1 1 164 1 1 1 1 16 LEU MD2 . 16 . HD2# 1 1 164 1 2 1 1 44 GLN HA . 44 . HA 1 1 165 1 1 1 1 16 LEU MD2 . 16 . HD2# 1 1 165 1 2 1 1 45 GLN H . 45 . HN 1 1 166 1 1 1 1 16 LEU MD2 . 16 . HD2# 1 1 166 1 2 1 1 45 GLN HA . 45 . HA 1 1 167 1 1 1 1 16 LEU MD2 . 16 . HD2# 1 1 167 1 2 1 1 46 ILE H . 46 . HN 1 1 168 1 1 1 1 16 LEU MD2 . 16 . HD2# 1 1 168 1 2 1 1 46 ILE HA . 46 . HA 1 1 169 1 1 1 1 16 LEU MD2 . 16 . HD2# 1 1 169 1 2 1 1 47 CYS H . 47 . HN 1 1 170 1 1 1 1 17 SER H . 17 . HN 1 1 170 1 2 1 1 17 SER QB . 17 . HB# 1 1 171 1 1 1 1 17 SER H . 17 . HN 1 1 171 1 2 1 1 18 ALA H . 18 . HN 1 1 172 1 1 1 1 17 SER QB . 17 . HB# 1 1 172 1 2 1 1 18 ALA H . 18 . HN 1 1 173 1 1 1 1 17 SER QB . 17 . HB# 1 1 173 1 2 1 1 18 ALA MB . 18 . HB# 1 1 174 1 1 1 1 18 ALA H . 18 . HN 1 1 174 1 2 1 1 18 ALA MB . 18 . HB# 1 1 175 1 1 1 1 18 ALA MB . 18 . HB# 1 1 175 1 2 1 1 20 PRO HG2 . 20 . HG2 1 1 176 1 1 1 1 18 ALA MB . 18 . HB# 1 1 176 1 2 1 1 21 PHE HB2 . 21 . HB2 1 1 177 1 1 1 1 20 PRO HB2 . 20 . HB2 1 1 177 1 2 1 1 21 PHE H . 21 . HN 1 1 178 1 1 1 1 20 PRO HB2 . 20 . HB2 1 1 178 1 2 1 1 21 PHE QD . 21 . HD# 1 1 179 1 1 1 1 20 PRO HB2 . 20 . HB2 1 1 179 1 2 1 1 21 PHE QE . 21 . HE# 1 1 180 1 1 1 1 20 PRO HB3 . 20 . HB1 1 1 180 1 2 1 1 21 PHE QD . 21 . HD# 1 1 181 1 1 1 1 20 PRO HB3 . 20 . HB1 1 1 181 1 2 1 1 21 PHE QE . 21 . HE# 1 1 182 1 1 1 1 20 PRO HD2 . 20 . HD2 1 1 182 1 2 1 1 21 PHE H . 21 . HN 1 1 183 1 1 1 1 20 PRO HD2 . 20 . HD2 1 1 183 1 2 1 1 21 PHE QD . 21 . HD# 1 1 184 1 1 1 1 20 PRO HD3 . 20 . HD1 1 1 184 1 2 1 1 21 PHE H . 21 . HN 1 1 185 1 1 1 1 20 PRO HG2 . 20 . HG2 1 1 185 1 2 1 1 21 PHE H . 21 . HN 1 1 186 1 1 1 1 20 PRO HG2 . 20 . HG2 1 1 186 1 2 1 1 21 PHE HB2 . 21 . HB2 1 1 187 1 1 1 1 20 PRO HG2 . 20 . HG2 1 1 187 1 2 1 1 21 PHE QD . 21 . HD# 1 1 188 1 1 1 1 20 PRO HG2 . 20 . HG2 1 1 188 1 2 1 1 21 PHE QE . 21 . HE# 1 1 189 1 1 1 1 20 PRO HG3 . 20 . HG1 1 1 189 1 2 1 1 21 PHE H . 21 . HN 1 1 190 1 1 1 1 21 PHE H . 21 . HN 1 1 190 1 2 1 1 21 PHE HB2 . 21 . HB2 1 1 191 1 1 1 1 21 PHE H . 21 . HN 1 1 191 1 2 1 1 21 PHE HB3 . 21 . HB1 1 1 192 1 1 1 1 21 PHE H . 21 . HN 1 1 192 1 2 1 1 21 PHE QD . 21 . HD# 1 1 193 1 1 1 1 21 PHE HA . 21 . HA 1 1 193 1 2 1 1 21 PHE QD . 21 . HD# 1 1 194 1 1 1 1 21 PHE HB2 . 21 . HB2 1 1 194 1 2 1 1 21 PHE QD . 21 . HD# 1 1 195 1 1 1 1 21 PHE HB2 . 21 . HB2 1 1 195 1 2 1 1 22 VAL HA . 22 . HA 1 1 196 1 1 1 1 21 PHE HB2 . 21 . HB2 1 1 196 1 2 1 1 22 VAL MG1 . 22 . HG1# 1 1 197 1 1 1 1 21 PHE HB2 . 21 . HB2 1 1 197 1 2 1 1 22 VAL MG2 . 22 . HG2# 1 1 198 1 1 1 1 21 PHE QD . 21 . HD# 1 1 198 1 2 1 1 22 VAL MG1 . 22 . HG1# 1 1 199 1 1 1 1 22 VAL H . 22 . HN 1 1 199 1 2 1 1 22 VAL HB . 22 . HB 1 1 200 1 1 1 1 22 VAL H . 22 . HN 1 1 200 1 2 1 1 22 VAL MG1 . 22 . HG1# 1 1 201 1 1 1 1 22 VAL H . 22 . HN 1 1 201 1 2 1 1 22 VAL MG2 . 22 . HG2# 1 1 202 1 1 1 1 22 VAL HA . 22 . HA 1 1 202 1 2 1 1 22 VAL MG1 . 22 . HG1# 1 1 203 1 1 1 1 22 VAL HA . 22 . HA 1 1 203 1 2 1 1 22 VAL MG2 . 22 . HG2# 1 1 204 1 1 1 1 22 VAL HB . 22 . HB 1 1 204 1 2 1 1 23 GLN H . 23 . HN 1 1 205 1 1 1 1 22 VAL MG2 . 22 . HG2# 1 1 205 1 2 1 1 23 GLN H . 23 . HN 1 1 206 1 1 1 1 22 VAL MG2 . 22 . HG2# 1 1 206 1 2 1 1 24 CYS H . 24 . HN 1 1 207 1 1 1 1 23 GLN H . 23 . HN 1 1 207 1 2 1 1 23 GLN QB . 23 . HB# 1 1 208 1 1 1 1 23 GLN H . 23 . HN 1 1 208 1 2 1 1 23 GLN QG . 23 . HG# 1 1 209 1 1 1 1 23 GLN H . 23 . HN 1 1 209 1 2 1 1 24 CYS H . 24 . HN 1 1 210 1 1 1 1 23 GLN HA . 23 . HA 1 1 210 1 2 1 1 23 GLN QG . 23 . HG# 1 1 211 1 1 1 1 23 GLN QB . 23 . HB# 1 1 211 1 2 1 1 24 CYS H . 24 . HN 1 1 212 1 1 1 1 23 GLN QG . 23 . HG# 1 1 212 1 2 1 1 24 CYS H . 24 . HN 1 1 213 1 1 1 1 23 GLN QG . 23 . HG# 1 1 213 1 2 1 1 33 ARG QB . 33 . HB1 1 1 214 1 1 1 1 24 CYS H . 24 . HN 1 1 214 1 2 1 1 24 CYS HB2 . 24 . HB2 1 1 215 1 1 1 1 24 CYS H . 24 . HN 1 1 215 1 2 1 1 24 CYS HB3 . 24 . HB1 1 1 216 1 1 1 1 24 CYS HA . 24 . HA 1 1 216 1 2 1 1 33 ARG QB . 33 . HB1 1 1 217 1 1 1 1 24 CYS HA . 24 . HA 1 1 217 1 2 1 1 34 SER H . 34 . HN 1 1 218 1 1 1 1 24 CYS HA . 24 . HA 1 1 218 1 2 1 1 42 TRP HE1 . 42 . HE1 1 1 219 1 1 1 1 24 CYS HA . 24 . HA 1 1 219 1 2 1 1 42 TRP HZ2 . 42 . HZ2 1 1 220 1 1 1 1 24 CYS HB2 . 24 . HB2 1 1 220 1 2 1 1 25 GLY H . 25 . HN 1 1 221 1 1 1 1 24 CYS HB2 . 24 . HB2 1 1 221 1 2 1 1 33 ARG QB . 33 . HB1 1 1 222 1 1 1 1 24 CYS HB3 . 24 . HB1 1 1 222 1 2 1 1 25 GLY H . 25 . HN 1 1 223 1 1 1 1 25 GLY H . 25 . HN 1 1 223 1 2 1 1 42 TRP HE1 . 42 . HE1 1 1 224 1 1 1 1 25 GLY H . 25 . HN 1 1 224 1 2 1 1 42 TRP HZ2 . 42 . HZ2 1 1 225 1 1 1 1 25 GLY QA . 25 . HA# 1 1 225 1 2 1 1 42 TRP HE1 . 42 . HE1 1 1 226 1 1 1 1 26 TRP H . 26 . HN 1 1 226 1 2 1 1 26 TRP HB2 . 26 . HB2 1 1 227 1 1 1 1 26 TRP H . 26 . HN 1 1 227 1 2 1 1 26 TRP HB3 . 26 . HB1 1 1 228 1 1 1 1 26 TRP H . 26 . HN 1 1 228 1 2 1 1 43 THR H . 43 . HN 1 1 229 1 1 1 1 26 TRP H . 26 . HN 1 1 229 1 2 1 1 43 THR HA . 43 . HA 1 1 230 1 1 1 1 26 TRP H . 26 . HN 1 1 230 1 2 1 1 43 THR MG . 43 . HG2# 1 1 231 1 1 1 1 26 TRP H . 26 . HN 1 1 231 1 2 1 1 44 GLN HA . 44 . HA 1 1 232 1 1 1 1 26 TRP HA . 26 . HA 1 1 232 1 2 1 1 26 TRP HE3 . 26 . HE3 1 1 233 1 1 1 1 26 TRP HA . 26 . HA 1 1 233 1 2 1 1 27 CYS H . 27 . HN 1 1 234 1 1 1 1 26 TRP HA . 26 . HA 1 1 234 1 2 1 1 42 TRP HE1 . 42 . HE1 1 1 235 1 1 1 1 26 TRP HB2 . 26 . HB2 1 1 235 1 2 1 1 26 TRP HD1 . 26 . HD1 1 1 236 1 1 1 1 26 TRP HB2 . 26 . HB2 1 1 236 1 2 1 1 27 CYS H . 27 . HN 1 1 237 1 1 1 1 26 TRP HB2 . 26 . HB2 1 1 237 1 2 1 1 43 THR MG . 43 . HG2# 1 1 238 1 1 1 1 26 TRP HB3 . 26 . HB1 1 1 238 1 2 1 1 26 TRP HE3 . 26 . HE3 1 1 239 1 1 1 1 26 TRP HB3 . 26 . HB1 1 1 239 1 2 1 1 27 CYS H . 27 . HN 1 1 240 1 1 1 1 26 TRP HB3 . 26 . HB1 1 1 240 1 2 1 1 43 THR H . 43 . HN 1 1 241 1 1 1 1 26 TRP HB3 . 26 . HB1 1 1 241 1 2 1 1 43 THR MG . 43 . HG2# 1 1 242 1 1 1 1 26 TRP HD1 . 26 . HD1 1 1 242 1 2 1 1 28 HIS H . 28 . HN 1 1 243 1 1 1 1 26 TRP HD1 . 26 . HD1 1 1 243 1 2 1 1 28 HIS HA . 28 . HA 1 1 244 1 1 1 1 26 TRP HD1 . 26 . HD1 1 1 244 1 2 1 1 43 THR MG . 43 . HG2# 1 1 245 1 1 1 1 26 TRP HE1 . 26 . HE1 1 1 245 1 2 1 1 28 HIS HA . 28 . HA 1 1 246 1 1 1 1 26 TRP HE1 . 26 . HE1 1 1 246 1 2 1 1 29 ASP HA . 29 . HA 1 1 247 1 1 1 1 26 TRP HE3 . 26 . HE3 1 1 247 1 2 1 1 27 CYS H . 27 . HN 1 1 248 1 1 1 1 26 TRP HE3 . 26 . HE3 1 1 248 1 2 1 1 30 LYS HA . 30 . HA 1 1 249 1 1 1 1 26 TRP HE3 . 26 . HE3 1 1 249 1 2 1 1 31 CYS H . 31 . HN 1 1 250 1 1 1 1 26 TRP HE3 . 26 . HE3 1 1 250 1 2 1 1 31 CYS HA . 31 . HA 1 1 251 1 1 1 1 26 TRP HE3 . 26 . HE3 1 1 251 1 2 1 1 31 CYS QB . 31 . HB# 1 1 252 1 1 1 1 26 TRP HH2 . 26 . HH2 1 1 252 1 2 1 1 30 LYS HA . 30 . HA 1 1 253 1 1 1 1 26 TRP HH2 . 26 . HH2 1 1 253 1 2 1 1 31 CYS QB . 31 . HB# 1 1 254 1 1 1 1 26 TRP HZ2 . 26 . HZ2 1 1 254 1 2 1 1 29 ASP HA . 29 . HA 1 1 255 1 1 1 1 26 TRP HZ2 . 26 . HZ2 1 1 255 1 2 1 1 29 ASP HB2 . 29 . HB2 1 1 256 1 1 1 1 26 TRP HZ3 . 26 . HZ3 1 1 256 1 2 1 1 30 LYS HA . 30 . HA 1 1 257 1 1 1 1 26 TRP HZ3 . 26 . HZ3 1 1 257 1 2 1 1 31 CYS H . 31 . HN 1 1 258 1 1 1 1 26 TRP HZ3 . 26 . HZ3 1 1 258 1 2 1 1 31 CYS HA . 31 . HA 1 1 259 1 1 1 1 26 TRP HZ3 . 26 . HZ3 1 1 259 1 2 1 1 31 CYS QB . 31 . HB# 1 1 260 1 1 1 1 27 CYS CB . 27 . CB 1 1 260 1 2 1 1 37 CYS SG . 37 . SG 1 1 261 1 1 1 1 27 CYS H . 27 . HN 1 1 261 1 2 1 1 27 CYS HB2 . 27 . HB2 1 1 262 1 1 1 1 27 CYS H . 27 . HN 1 1 262 1 2 1 1 28 HIS H . 28 . HN 1 1 263 1 1 1 1 27 CYS H . 27 . HN 1 1 263 1 2 1 1 31 CYS HA . 31 . HA 1 1 264 1 1 1 1 27 CYS H . 27 . HN 1 1 264 1 2 1 1 32 VAL MG2 . 32 . HG2# 1 1 265 1 1 1 1 27 CYS H . 27 . HN 1 1 265 1 2 1 1 42 TRP HD1 . 42 . HD1 1 1 266 1 1 1 1 27 CYS HB2 . 27 . HB2 1 1 266 1 2 1 1 28 HIS H . 28 . HN 1 1 267 1 1 1 1 27 CYS HB2 . 27 . HB2 1 1 267 1 2 1 1 32 VAL MG2 . 32 . HG2# 1 1 268 1 1 1 1 27 CYS HB2 . 27 . HB2 1 1 268 1 2 1 1 42 TRP HD1 . 42 . HD1 1 1 269 1 1 1 1 27 CYS HB2 . 27 . HB2 1 1 269 1 2 1 1 42 TRP HE1 . 42 . HE1 1 1 270 1 1 1 1 27 CYS HB2 . 27 . HB2 1 1 270 1 2 1 1 43 THR MG . 43 . HG2# 1 1 271 1 1 1 1 27 CYS HB3 . 27 . HB1 1 1 271 1 2 1 1 28 HIS H . 28 . HN 1 1 272 1 1 1 1 27 CYS HB3 . 27 . HB1 1 1 272 1 2 1 1 32 VAL MG2 . 32 . HG2# 1 1 273 1 1 1 1 27 CYS HB3 . 27 . HB1 1 1 273 1 2 1 1 42 TRP HD1 . 42 . HD1 1 1 274 1 1 1 1 27 CYS SG . 27 . SG 1 1 274 1 2 1 1 37 CYS CB . 37 . CB 1 1 275 1 1 1 1 27 CYS SG . 27 . SG 1 1 275 1 2 1 1 37 CYS SG . 37 . SG 1 1 276 1 1 1 1 28 HIS H . 28 . HN 1 1 276 1 2 1 1 28 HIS HB3 . 28 . HB1 1 1 277 1 1 1 1 28 HIS HB2 . 28 . HB2 1 1 277 1 2 1 1 29 ASP H . 29 . HN 1 1 278 1 1 1 1 28 HIS HB3 . 28 . HB1 1 1 278 1 2 1 1 29 ASP H . 29 . HN 1 1 279 1 1 1 1 30 LYS H . 30 . HN 1 1 279 1 2 1 1 30 LYS HB3 . 30 . HB1 1 1 280 1 1 1 1 30 LYS HA . 30 . HA 1 1 280 1 2 1 1 31 CYS QB . 31 . HB# 1 1 281 1 1 1 1 30 LYS HA . 30 . HA 1 1 281 1 2 1 1 32 VAL MG1 . 32 . HG1# 1 1 282 1 1 1 1 30 LYS HB2 . 30 . HB2 1 1 282 1 2 1 1 30 LYS QE . 30 . HE# 1 1 283 1 1 1 1 30 LYS HB3 . 30 . HB1 1 1 283 1 2 1 1 30 LYS QE . 30 . HE# 1 1 284 1 1 1 1 30 LYS QE . 30 . HE# 1 1 284 1 2 1 1 30 LYS QG . 30 . HG# 1 1 285 1 1 1 1 30 LYS QE . 30 . HE# 1 1 285 1 2 1 1 32 VAL MG1 . 32 . HG1# 1 1 286 1 1 1 1 30 LYS QG . 30 . HG# 1 1 286 1 2 1 1 31 CYS QB . 31 . HB# 1 1 287 1 1 1 1 30 LYS QG . 30 . HG# 1 1 287 1 2 1 1 32 VAL MG1 . 32 . HG1# 1 1 288 1 1 1 1 31 CYS H . 31 . HN 1 1 288 1 2 1 1 31 CYS QB . 31 . HB# 1 1 289 1 1 1 1 31 CYS HA . 31 . HA 1 1 289 1 2 1 1 32 VAL H . 32 . HN 1 1 290 1 1 1 1 31 CYS HA . 31 . HA 1 1 290 1 2 1 1 32 VAL MG1 . 32 . HG1# 1 1 291 1 1 1 1 31 CYS QB . 31 . HB# 1 1 291 1 2 1 1 32 VAL H . 32 . HN 1 1 292 1 1 1 1 31 CYS QB . 31 . HB# 1 1 292 1 2 1 1 32 VAL HA . 32 . HA 1 1 293 1 1 1 1 31 CYS QB . 31 . HB# 1 1 293 1 2 1 1 32 VAL MG1 . 32 . HG1# 1 1 294 1 1 1 1 32 VAL H . 32 . HN 1 1 294 1 2 1 1 32 VAL MG2 . 32 . HG2# 1 1 295 1 1 1 1 32 VAL H . 32 . HN 1 1 295 1 2 1 1 42 TRP HE1 . 42 . HE1 1 1 296 1 1 1 1 32 VAL HA . 32 . HA 1 1 296 1 2 1 1 32 VAL MG1 . 32 . HG1# 1 1 297 1 1 1 1 32 VAL HA . 32 . HA 1 1 297 1 2 1 1 33 ARG H . 33 . HN 1 1 298 1 1 1 1 32 VAL HB . 32 . HB 1 1 298 1 2 1 1 33 ARG H . 33 . HN 1 1 299 1 1 1 1 32 VAL MG2 . 32 . HG2# 1 1 299 1 2 1 1 33 ARG H . 33 . HN 1 1 300 1 1 1 1 32 VAL MG2 . 32 . HG2# 1 1 300 1 2 1 1 36 GLU H . 36 . HN 1 1 301 1 1 1 1 32 VAL MG2 . 32 . HG2# 1 1 301 1 2 1 1 37 CYS H . 37 . HN 1 1 302 1 1 1 1 32 VAL MG2 . 32 . HG2# 1 1 302 1 2 1 1 42 TRP HD1 . 42 . HD1 1 1 303 1 1 1 1 32 VAL MG2 . 32 . HG2# 1 1 303 1 2 1 1 42 TRP HE1 . 42 . HE1 1 1 304 1 1 1 1 33 ARG H . 33 . HN 1 1 304 1 2 1 1 33 ARG QB . 33 . HB1 1 1 305 1 1 1 1 33 ARG H . 33 . HN 1 1 305 1 2 1 1 33 ARG QG . 33 . HG# 1 1 306 1 1 1 1 33 ARG HA . 33 . HA 1 1 306 1 2 1 1 33 ARG QG . 33 . HG# 1 1 307 1 1 1 1 33 ARG QB . 33 . HB1 1 1 307 1 2 1 1 33 ARG QH2 . 33 . HH21 1 1 308 1 1 1 1 33 ARG QB . 33 . HB1 1 1 308 1 2 1 1 34 SER H . 34 . HN 1 1 309 1 1 1 1 33 ARG QB . 33 . HB1 1 1 309 1 2 1 1 35 GLU H . 35 . HN 1 1 310 1 1 1 1 33 ARG QB . 33 . HB1 1 1 310 1 2 1 1 42 TRP HD1 . 42 . HD1 1 1 311 1 1 1 1 33 ARG QB . 33 . HB1 1 1 311 1 2 1 1 42 TRP HE1 . 42 . HE1 1 1 312 1 1 1 1 33 ARG QG . 33 . HG# 1 1 312 1 2 1 1 33 ARG QH2 . 33 . HH21 1 1 313 1 1 1 1 33 ARG QG . 33 . HG# 1 1 313 1 2 1 1 34 SER H . 34 . HN 1 1 314 1 1 1 1 33 ARG QG . 33 . HG# 1 1 314 1 2 1 1 42 TRP QB . 42 . HB2 1 1 315 1 1 1 1 33 ARG QH2 . 33 . HH21 1 1 315 1 2 1 1 42 TRP QB . 42 . HB2 1 1 316 1 1 1 1 34 SER H . 34 . HN 1 1 316 1 2 1 1 42 TRP HE1 . 42 . HE1 1 1 317 1 1 1 1 35 GLU H . 35 . HN 1 1 317 1 2 1 1 35 GLU QB . 35 . HB# 1 1 318 1 1 1 1 35 GLU H . 35 . HN 1 1 318 1 2 1 1 35 GLU HG2 . 35 . HG2 1 1 319 1 1 1 1 35 GLU H . 35 . HN 1 1 319 1 2 1 1 35 GLU HG3 . 35 . HG1 1 1 320 1 1 1 1 36 GLU H . 36 . HN 1 1 320 1 2 1 1 36 GLU QB . 36 . HB# 1 1 321 1 1 1 1 36 GLU H . 36 . HN 1 1 321 1 2 1 1 37 CYS H . 37 . HN 1 1 322 1 1 1 1 36 GLU HA . 36 . HA 1 1 322 1 2 1 1 36 GLU QG . 36 . HG# 1 1 323 1 1 1 1 36 GLU QB . 36 . HB# 1 1 323 1 2 1 1 37 CYS H . 37 . HN 1 1 324 1 1 1 1 36 GLU QG . 36 . HG# 1 1 324 1 2 1 1 37 CYS H . 37 . HN 1 1 325 1 1 1 1 37 CYS H . 37 . HN 1 1 325 1 2 1 1 37 CYS QB . 37 . HB# 1 1 326 1 1 1 1 38 LEU HA . 38 . HA 1 1 326 1 2 1 1 38 LEU MD1 . 38 . HD1# 1 1 327 1 1 1 1 38 LEU HA . 38 . HA 1 1 327 1 2 1 1 38 LEU MD2 . 38 . HD2# 1 1 328 1 1 1 1 38 LEU HB2 . 38 . HB2 1 1 328 1 2 1 1 38 LEU MD1 . 38 . HD1# 1 1 329 1 1 1 1 38 LEU HB2 . 38 . HB2 1 1 329 1 2 1 1 38 LEU MD2 . 38 . HD2# 1 1 330 1 1 1 1 38 LEU HB2 . 38 . HB2 1 1 330 1 2 1 1 39 SER H . 39 . HN 1 1 331 1 1 1 1 38 LEU HB3 . 38 . HB1 1 1 331 1 2 1 1 38 LEU MD1 . 38 . HD1# 1 1 332 1 1 1 1 38 LEU HB3 . 38 . HB1 1 1 332 1 2 1 1 38 LEU MD2 . 38 . HD2# 1 1 333 1 1 1 1 38 LEU MD2 . 38 . HD2# 1 1 333 1 2 1 1 39 SER H . 39 . HN 1 1 334 1 1 1 1 39 SER H . 39 . HN 1 1 334 1 2 1 1 40 GLY H . 40 . HN 1 1 335 1 1 1 1 39 SER HB2 . 39 . HB2 1 1 335 1 2 1 1 41 THR MG . 41 . HG2# 1 1 336 1 1 1 1 39 SER HB3 . 39 . HB1 1 1 336 1 2 1 1 41 THR MG . 41 . HG2# 1 1 337 1 1 1 1 40 GLY H . 40 . HN 1 1 337 1 2 1 1 41 THR H . 41 . HN 1 1 338 1 1 1 1 41 THR H . 41 . HN 1 1 338 1 2 1 1 41 THR MG . 41 . HG2# 1 1 339 1 1 1 1 41 THR H . 41 . HN 1 1 339 1 2 1 1 42 TRP H . 42 . HN 1 1 340 1 1 1 1 41 THR HA . 41 . HA 1 1 340 1 2 1 1 41 THR MG . 41 . HG2# 1 1 341 1 1 1 1 41 THR MG . 41 . HG2# 1 1 341 1 2 1 1 42 TRP H . 42 . HN 1 1 342 1 1 1 1 42 TRP H . 42 . HN 1 1 342 1 2 1 1 42 TRP QB . 42 . HB1 1 1 343 1 1 1 1 42 TRP H . 42 . HN 1 1 343 1 2 1 1 42 TRP HE3 . 42 . HE3 1 1 344 1 1 1 1 42 TRP H . 42 . HN 1 1 344 1 2 1 1 43 THR H . 43 . HN 1 1 345 1 1 1 1 42 TRP HA . 42 . HA 1 1 345 1 2 1 1 42 TRP HD1 . 42 . HD1 1 1 346 1 1 1 1 42 TRP HA . 42 . HA 1 1 346 1 2 1 1 43 THR H . 43 . HN 1 1 347 1 1 1 1 42 TRP HA . 42 . HA 1 1 347 1 2 1 1 43 THR MG . 43 . HG2# 1 1 348 1 1 1 1 42 TRP QB . 42 . HB1 1 1 348 1 2 1 1 42 TRP HZ3 . 42 . HZ3 1 1 349 1 1 1 1 42 TRP QB . 42 . HB2 1 1 349 1 2 1 1 43 THR H . 43 . HN 1 1 350 1 1 1 1 42 TRP HE3 . 42 . HE3 1 1 350 1 2 1 1 43 THR HA . 43 . HA 1 1 351 1 1 1 1 42 TRP HH2 . 42 . HH2 1 1 351 1 2 1 1 44 GLN HB2 . 44 . HB2 1 1 352 1 1 1 1 42 TRP HH2 . 42 . HH2 1 1 352 1 2 1 1 44 GLN HE21 . 44 . HE21 1 1 353 1 1 1 1 42 TRP HH2 . 42 . HH2 1 1 353 1 2 1 1 44 GLN HG2 . 44 . HG2 1 1 354 1 1 1 1 42 TRP HH2 . 42 . HH2 1 1 354 1 2 1 1 44 GLN HG3 . 44 . HG1 1 1 355 1 1 1 1 42 TRP HZ2 . 42 . HZ2 1 1 355 1 2 1 1 44 GLN HB2 . 44 . HB2 1 1 356 1 1 1 1 42 TRP HZ3 . 42 . HZ3 1 1 356 1 2 1 1 44 GLN HG2 . 44 . HG2 1 1 357 1 1 1 1 42 TRP HZ3 . 42 . HZ3 1 1 357 1 2 1 1 44 GLN HG3 . 44 . HG1 1 1 358 1 1 1 1 43 THR H . 43 . HN 1 1 358 1 2 1 1 43 THR MG . 43 . HG2# 1 1 359 1 1 1 1 43 THR HA . 43 . HA 1 1 359 1 2 1 1 43 THR MG . 43 . HG2# 1 1 360 1 1 1 1 43 THR HB . 43 . HB 1 1 360 1 2 1 1 44 GLN H . 44 . HN 1 1 361 1 1 1 1 43 THR MG . 43 . HG2# 1 1 361 1 2 1 1 44 GLN H . 44 . HN 1 1 362 1 1 1 1 43 THR MG . 43 . HG2# 1 1 362 1 2 1 1 45 GLN H . 45 . HN 1 1 363 1 1 1 1 44 GLN H . 44 . HN 1 1 363 1 2 1 1 44 GLN HB3 . 44 . HB1 1 1 364 1 1 1 1 44 GLN H . 44 . HN 1 1 364 1 2 1 1 44 GLN HG2 . 44 . HG2 1 1 365 1 1 1 1 44 GLN H . 44 . HN 1 1 365 1 2 1 1 44 GLN HG3 . 44 . HG1 1 1 366 1 1 1 1 44 GLN H . 44 . HN 1 1 366 1 2 1 1 45 GLN H . 45 . HN 1 1 367 1 1 1 1 44 GLN HA . 44 . HA 1 1 367 1 2 1 1 44 GLN HE21 . 44 . HE21 1 1 368 1 1 1 1 44 GLN HA . 44 . HA 1 1 368 1 2 1 1 44 GLN HG2 . 44 . HG2 1 1 369 1 1 1 1 44 GLN HB2 . 44 . HB2 1 1 369 1 2 1 1 44 GLN HE21 . 44 . HE21 1 1 370 1 1 1 1 44 GLN HB2 . 44 . HB2 1 1 370 1 2 1 1 44 GLN HE22 . 44 . HE22 1 1 371 1 1 1 1 44 GLN HB3 . 44 . HB1 1 1 371 1 2 1 1 44 GLN HE21 . 44 . HE21 1 1 372 1 1 1 1 44 GLN HE21 . 44 . HE21 1 1 372 1 2 1 1 44 GLN HG2 . 44 . HG2 1 1 373 1 1 1 1 45 GLN H . 45 . HN 1 1 373 1 2 1 1 45 GLN HB3 . 45 . HB1 1 1 374 1 1 1 1 45 GLN H . 45 . HN 1 1 374 1 2 1 1 45 GLN QG . 45 . HG# 1 1 375 1 1 1 1 45 GLN H . 45 . HN 1 1 375 1 2 1 1 46 ILE H . 46 . HN 1 1 376 1 1 1 1 45 GLN HA . 45 . HA 1 1 376 1 2 1 1 45 GLN QG . 45 . HG# 1 1 377 1 1 1 1 45 GLN HB2 . 45 . HB2 1 1 377 1 2 1 1 46 ILE H . 46 . HN 1 1 378 1 1 1 1 45 GLN HB3 . 45 . HB1 1 1 378 1 2 1 1 46 ILE H . 46 . HN 1 1 379 1 1 1 1 46 ILE H . 46 . HN 1 1 379 1 2 1 1 46 ILE MG . 46 . HG2# 1 1 380 1 1 1 1 46 ILE H . 46 . HN 1 1 380 1 2 1 1 47 CYS H . 47 . HN 1 1 381 1 1 1 1 46 ILE HA . 46 . HA 1 1 381 1 2 1 1 46 ILE MD . 46 . HD1# 1 1 382 1 1 1 1 46 ILE HA . 46 . HA 1 1 382 1 2 1 1 46 ILE MG . 46 . HG2# 1 1 383 1 1 1 1 46 ILE HA . 46 . HA 1 1 383 1 2 1 1 47 CYS H . 47 . HN 1 1 384 1 1 1 1 46 ILE HB . 46 . HB 1 1 384 1 2 1 1 46 ILE MD . 46 . HD1# 1 1 385 1 1 1 1 46 ILE HG12 . 46 . HG12 1 1 385 1 2 1 1 47 CYS H . 47 . HN 1 1 386 1 1 1 1 46 ILE HG13 . 46 . HG11 1 1 386 1 2 1 1 47 CYS H . 47 . HN 1 1 387 1 1 1 1 46 ILE MG . 46 . HG2# 1 1 387 1 2 1 1 47 CYS H . 47 . HN 1 1 388 1 1 1 1 47 CYS H . 47 . HN 1 1 388 1 2 1 1 47 CYS HB3 . 47 . HB1 1 1 389 1 1 1 1 47 CYS HA . 47 . HA 1 1 389 1 2 1 1 48 LEU H . 48 . HN 1 1 390 1 1 1 1 47 CYS HA . 47 . HA 1 1 390 1 2 1 1 48 LEU MD1 . 48 . HD1# 1 1 391 1 1 1 1 47 CYS HB2 . 47 . HB2 1 1 391 1 2 1 1 48 LEU H . 48 . HN 1 1 392 1 1 1 1 47 CYS HB3 . 47 . HB1 1 1 392 1 2 1 1 48 LEU H . 48 . HN 1 1 393 1 1 1 1 48 LEU H . 48 . HN 1 1 393 1 2 1 1 48 LEU QB . 48 . HB# 1 1 394 1 1 1 1 48 LEU H . 48 . HN 1 1 394 1 2 1 1 48 LEU MD1 . 48 . HD1# 1 1 395 1 1 1 1 48 LEU H . 48 . HN 1 1 395 1 2 1 1 48 LEU MD2 . 48 . HD2# 1 1 396 1 1 1 1 48 LEU H . 48 . HN 1 1 396 1 2 1 1 48 LEU HG . 48 . HG 1 1 397 1 1 1 1 48 LEU HA . 48 . HA 1 1 397 1 2 1 1 48 LEU MD1 . 48 . HD1# 1 1 398 1 1 1 1 48 LEU HA . 48 . HA 1 1 398 1 2 1 1 48 LEU MD2 . 48 . HD2# 1 1 399 1 1 1 1 48 LEU QB . 48 . HB# 1 1 399 1 2 1 1 48 LEU MD1 . 48 . HD1# 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 . . . . . 3.27 1.8 4.74 1 1 2 1 . . . . . 2.785 1.8 3.77 1 1 3 1 . . . . . 2.69 1.8 3.58 1 1 4 1 . . . . . 3.14 1.8 4.48 1 1 5 1 . . . . . 3.63 1.8 5.46 1 1 6 1 . . . . . 3.65 1.8 5.5 1 1 7 1 . . . . . 2.735 1.8 3.67 1 1 8 1 . . . . . 3.04 1.8 4.28 1 1 9 1 . . . . . 2.735 1.8 3.67 1 1 10 1 . . . . . 3.19 1.8 4.58 1 1 11 1 . . . . . 3.65 1.8 5.5 1 1 12 1 . . . . . 3.355 1.8 4.91 1 1 13 1 . . . . . 3.65 1.8 5.5 1 1 14 1 . . . . . 2.72 1.8 3.64 1 1 15 1 . . . . . 3.09 1.8 4.38 1 1 16 1 . . . . . 3.3 1.8 4.8 1 1 17 1 . . . . . 3.05 3.0 3.1 1 1 18 1 . . . . . 2.965 1.8 4.13 1 1 19 1 . . . . . 2.87 1.8 3.94 1 1 20 1 . . . . . 3.575 1.8 5.35 1 1 21 1 . . . . . 3.315 1.8 4.83 1 1 22 1 . . . . . 2.735 1.8 3.67 1 1 23 1 . . . . . 2.895 1.8 3.99 1 1 24 1 . . . . . 3.39 1.8 4.98 1 1 25 1 . . . . . 3.555 1.8 5.31 1 1 26 1 . . . . . 3.65 1.8 5.5 1 1 27 1 . . . . . 3.28 1.8 4.76 1 1 28 1 . . . . . 3.49 1.8 5.18 1 1 29 1 . . . . . 3.05 3.0 3.1 1 1 30 1 . . . . . 2.05 2.0 2.1 1 1 31 1 . . . . . 2.755 1.8 3.71 1 1 32 1 . . . . . 3.65 1.8 5.5 1 1 33 1 . . . . . 3.16 1.8 4.52 1 1 34 1 . . . . . 3.215 1.8 4.63 1 1 35 1 . . . . . 3.65 1.8 5.5 1 1 36 1 . . . . . 2.865 1.8 3.93 1 1 37 1 . . . . . 2.91 1.8 4.02 1 1 38 1 . . . . . 3.555 1.8 5.31 1 1 39 1 . . . . . 3.505 1.8 5.21 1 1 40 1 . . . . . 3.65 1.8 5.5 1 1 41 1 . . . . . 3.545 1.8 5.29 1 1 42 1 . . . . . 2.9 1.8 4.0 1 1 43 1 . . . . . 2.935 1.8 4.07 1 1 44 1 . . . . . 3.51 1.8 5.22 1 1 45 1 . . . . . 3.39 1.8 4.98 1 1 46 1 . . . . . 2.99 1.8 4.18 1 1 47 1 . . . . . 2.905 1.8 4.01 1 1 48 1 . . . . . 2.925 1.8 4.05 1 1 49 1 . . . . . 3.65 1.8 5.5 1 1 50 1 . . . . . 3.42 1.8 5.04 1 1 51 1 . . . . . 3.65 1.8 5.5 1 1 52 1 . . . . . 3.47 1.8 5.14 1 1 53 1 . . . . . 3.465 1.8 5.13 1 1 54 1 . . . . . 3.07 1.8 4.34 1 1 55 1 . . . . . 3.225 1.8 4.65 1 1 56 1 . . . . . 2.935 1.8 4.07 1 1 57 1 . . . . . 3.41 1.8 5.02 1 1 58 1 . . . . . 2.68 1.8 3.56 1 1 59 1 . . . . . 3.65 1.8 5.5 1 1 60 1 . . . . . 3.65 1.8 5.5 1 1 61 1 . . . . . 3.39 1.8 4.98 1 1 62 1 . . . . . 3.4 1.8 5.0 1 1 63 1 . . . . . 3.03 1.8 4.26 1 1 64 1 . . . . . 3.53 1.8 5.26 1 1 65 1 . . . . . 3.045 1.8 4.29 1 1 66 1 . . . . . 2.99 1.8 4.18 1 1 67 1 . . . . . 2.955 1.8 4.11 1 1 68 1 . . . . . 3.295 1.8 4.79 1 1 69 1 . . . . . 3.005 1.8 4.21 1 1 70 1 . . . . . 3.215 1.8 4.63 1 1 71 1 . . . . . 3.62 1.8 5.44 1 1 72 1 . . . . . 3.65 1.8 5.5 1 1 73 1 . . . . . 3.295 1.8 4.79 1 1 74 1 . . . . . 3.585 1.8 5.37 1 1 75 1 . . . . . 3.565 1.8 5.33 1 1 76 1 . . . . . 3.42 1.8 5.04 1 1 77 1 . . . . . 2.965 1.8 4.13 1 1 78 1 . . . . . 3.03 1.8 4.26 1 1 79 1 . . . . . 2.975 1.8 4.15 1 1 80 1 . . . . . 2.735 1.8 3.67 1 1 81 1 . . . . . 3.65 1.8 5.5 1 1 82 1 . . . . . 3.65 1.8 5.5 1 1 83 1 . . . . . 3.65 1.8 5.5 1 1 84 1 . . . . . 2.76 1.8 3.72 1 1 85 1 . . . . . 3.615 1.8 5.43 1 1 86 1 . . . . . 3.2 1.8 4.6 1 1 87 1 . . . . . 3.65 1.8 5.5 1 1 88 1 . . . . . 3.65 1.8 5.5 1 1 89 1 . . . . . 3.05 1.8 4.3 1 1 90 1 . . . . . 3.465 1.8 5.13 1 1 91 1 . . . . . 3.05 3.0 3.1 1 1 92 1 . . . . . 2.995 1.8 4.19 1 1 93 1 . . . . . 2.775 1.8 3.75 1 1 94 1 . . . . . 3.035 1.8 4.27 1 1 95 1 . . . . . 3.54 1.8 5.28 1 1 96 1 . . . . . 3.48 1.8 5.16 1 1 97 1 . . . . . 2.87 1.8 3.94 1 1 98 1 . . . . . 3.435 1.8 5.07 1 1 99 1 . . . . . 3.1 1.8 4.4 1 1 100 1 . . . . . 3.36 1.8 4.92 1 1 101 1 . . . . . 3.54 1.8 5.28 1 1 102 1 . . . . . 3.265 1.8 4.73 1 1 103 1 . . . . . 3.11 1.8 4.42 1 1 104 1 . . . . . 3.035 1.8 4.27 1 1 105 1 . . . . . 3.65 1.8 5.5 1 1 106 1 . . . . . 3.135 1.8 4.47 1 1 107 1 . . . . . 3.05 3.0 3.1 1 1 108 1 . . . . . 2.05 2.0 2.1 1 1 109 1 . . . . . 2.79 1.8 3.78 1 1 110 1 . . . . . 2.94 1.8 4.08 1 1 111 1 . . . . . 3.245 1.8 4.69 1 1 112 1 . . . . . 3.185 1.8 4.57 1 1 113 1 . . . . . 3.65 1.8 5.5 1 1 114 1 . . . . . 3.65 1.8 5.5 1 1 115 1 . . . . . 2.895 1.8 3.99 1 1 116 1 . . . . . 3.295 1.8 4.79 1 1 117 1 . . . . . 2.84 1.8 3.88 1 1 118 1 . . . . . 3.65 1.8 5.5 1 1 119 1 . . . . . 2.745 1.8 3.69 1 1 120 1 . . . . . 3.155 1.8 4.51 1 1 121 1 . . . . . 3.01 1.8 4.22 1 1 122 1 . . . . . 3.65 1.8 5.5 1 1 123 1 . . . . . 3.375 1.8 4.95 1 1 124 1 . . . . . 3.455 1.8 5.11 1 1 125 1 . . . . . 2.925 1.8 4.05 1 1 126 1 . . . . . 3.65 1.8 5.5 1 1 127 1 . . . . . 3.05 3.0 3.1 1 1 128 1 . . . . . 2.795 1.8 3.79 1 1 129 1 . . . . . 2.73 1.8 3.66 1 1 130 1 . . . . . 3.075 1.8 4.35 1 1 131 1 . . . . . 3.615 1.8 5.43 1 1 132 1 . . . . . 2.95 1.8 4.1 1 1 133 1 . . . . . 3.65 1.8 5.5 1 1 134 1 . . . . . 3.05 3.0 3.1 1 1 135 1 . . . . . 2.05 2.0 2.1 1 1 136 1 . . . . . 2.74 1.8 3.68 1 1 137 1 . . . . . 3.55 1.8 5.3 1 1 138 1 . . . . . 3.5 1.8 5.2 1 1 139 1 . . . . . 2.93 1.8 4.06 1 1 140 1 . . . . . 2.885 1.8 3.97 1 1 141 1 . . . . . 3.65 1.8 5.5 1 1 142 1 . . . . . 3.32 1.8 4.84 1 1 143 1 . . . . . 3.125 1.8 4.45 1 1 144 1 . . . . . 2.985 1.8 4.17 1 1 145 1 . . . . . 3.5 1.8 5.2 1 1 146 1 . . . . . 2.935 1.8 4.07 1 1 147 1 . . . . . 2.9 1.8 4.0 1 1 148 1 . . . . . 3.58 1.8 5.36 1 1 149 1 . . . . . 2.86 1.8 3.92 1 1 150 1 . . . . . 2.91 1.8 4.02 1 1 151 1 . . . . . 3.395 1.8 4.99 1 1 152 1 . . . . . 3.65 1.8 5.5 1 1 153 1 . . . . . 3.25 1.8 4.7 1 1 154 1 . . . . . 3.365 1.8 4.93 1 1 155 1 . . . . . 3.335 1.8 4.87 1 1 156 1 . . . . . 3.19 1.8 4.58 1 1 157 1 . . . . . 3.65 1.8 5.5 1 1 158 1 . . . . . 3.65 1.8 5.5 1 1 159 1 . . . . . 3.505 1.8 5.21 1 1 160 1 . . . . . 3.65 1.8 5.5 1 1 161 1 . . . . . 3.65 1.8 5.5 1 1 162 1 . . . . . 3.65 1.8 5.5 1 1 163 1 . . . . . 3.65 1.8 5.5 1 1 164 1 . . . . . 2.925 1.8 4.05 1 1 165 1 . . . . . 3.53 1.8 5.26 1 1 166 1 . . . . . 3.65 1.8 5.5 1 1 167 1 . . . . . 3.4 1.8 5.0 1 1 168 1 . . . . . 3.65 1.8 5.5 1 1 169 1 . . . . . 3.65 1.8 5.5 1 1 170 1 . . . . . 2.935 1.8 4.07 1 1 171 1 . . . . . 2.655 1.8 3.51 1 1 172 1 . . . . . 3.45 1.8 5.1 1 1 173 1 . . . . . 3.43 1.8 5.06 1 1 174 1 . . . . . 2.7 1.8 3.6 1 1 175 1 . . . . . 3.65 1.8 5.5 1 1 176 1 . . . . . 3.43 1.8 5.06 1 1 177 1 . . . . . 3.185 1.8 4.57 1 1 178 1 . . . . . 3.495 1.8 5.19 1 1 179 1 . . . . . 3.65 1.8 5.5 1 1 180 1 . . . . . 3.65 1.8 5.5 1 1 181 1 . . . . . 3.485 1.8 5.17 1 1 182 1 . . . . . 3.65 1.8 5.5 1 1 183 1 . . . . . 3.215 1.8 4.63 1 1 184 1 . . . . . 3.445 1.8 5.09 1 1 185 1 . . . . . 3.235 1.8 4.67 1 1 186 1 . . . . . 3.125 1.8 4.45 1 1 187 1 . . . . . 3.09 1.8 4.38 1 1 188 1 . . . . . 3.175 1.8 4.55 1 1 189 1 . . . . . 3.15 1.8 4.5 1 1 190 1 . . . . . 2.875 1.8 3.95 1 1 191 1 . . . . . 2.8 1.8 3.8 1 1 192 1 . . . . . 3.57 1.8 5.34 1 1 193 1 . . . . . 3.055 1.8 4.31 1 1 194 1 . . . . . 2.905 1.8 4.01 1 1 195 1 . . . . . 3.41 1.8 5.02 1 1 196 1 . . . . . 3.57 1.8 5.34 1 1 197 1 . . . . . 3.565 1.8 5.33 1 1 198 1 . . . . . 3.65 1.8 5.5 1 1 199 1 . . . . . 2.94 1.8 4.08 1 1 200 1 . . . . . 3.39 1.8 4.98 1 1 201 1 . . . . . 2.775 1.8 3.75 1 1 202 1 . . . . . 2.895 1.8 3.99 1 1 203 1 . . . . . 2.94 1.8 4.08 1 1 204 1 . . . . . 3.07 1.8 4.34 1 1 205 1 . . . . . 3.215 1.8 4.63 1 1 206 1 . . . . . 3.45 1.8 5.1 1 1 207 1 . . . . . 2.87 1.8 3.94 1 1 208 1 . . . . . 3.405 1.8 5.01 1 1 209 1 . . . . . 3.105 1.8 4.41 1 1 210 1 . . . . . 2.995 1.8 4.19 1 1 211 1 . . . . . 3.12 1.8 4.44 1 1 212 1 . . . . . 3.65 1.8 5.5 1 1 213 1 . . . . . 3.265 1.8 4.73 1 1 214 1 . . . . . 2.81 1.8 3.82 1 1 215 1 . . . . . 2.845 1.8 3.89 1 1 216 1 . . . . . 3.065 1.8 4.33 1 1 217 1 . . . . . 3.475 1.8 5.15 1 1 218 1 . . . . . 3.205 1.8 4.61 1 1 219 1 . . . . . 3.09 1.8 4.38 1 1 220 1 . . . . . 3.51 1.8 5.22 1 1 221 1 . . . . . 3.345 1.8 4.28 1 1 222 1 . . . . . 3.32 1.8 4.84 1 1 223 1 . . . . . 2.785 1.8 3.77 1 1 224 1 . . . . . 3.195 1.8 4.59 1 1 225 1 . . . . . 3.555 1.8 5.31 1 1 226 1 . . . . . 2.97 1.8 4.14 1 1 227 1 . . . . . 2.92 1.8 4.04 1 1 228 1 . . . . . 3.115 1.8 4.43 1 1 229 1 . . . . . 3.65 1.8 5.5 1 1 230 1 . . . . . 3.295 1.8 4.79 1 1 231 1 . . . . . 3.65 1.8 5.5 1 1 232 1 . . . . . 3.105 1.8 4.41 1 1 233 1 . . . . . 2.625 1.8 3.45 1 1 234 1 . . . . . 3.51 1.8 5.22 1 1 235 1 . . . . . 2.935 1.8 4.07 1 1 236 1 . . . . . 3.65 1.8 5.5 1 1 237 1 . . . . . 3.53 1.8 5.26 1 1 238 1 . . . . . 2.98 1.8 4.16 1 1 239 1 . . . . . 3.51 1.8 5.22 1 1 240 1 . . . . . 3.65 1.8 5.5 1 1 241 1 . . . . . 3.205 1.8 4.61 1 1 242 1 . . . . . 3.56 1.8 5.32 1 1 243 1 . . . . . 3.65 1.8 5.5 1 1 244 1 . . . . . 3.17 1.8 4.54 1 1 245 1 . . . . . 3.65 1.8 5.5 1 1 246 1 . . . . . 3.525 1.8 5.25 1 1 247 1 . . . . . 3.455 1.8 5.11 1 1 248 1 . . . . . 3.445 1.8 5.09 1 1 249 1 . . . . . 3.65 1.8 5.5 1 1 250 1 . . . . . 2.905 1.8 4.01 1 1 251 1 . . . . . 2.915 1.8 4.03 1 1 252 1 . . . . . 3.19 1.8 4.58 1 1 253 1 . . . . . 3.65 1.8 5.5 1 1 254 1 . . . . . 3.44 1.8 5.08 1 1 255 1 . . . . . 3.65 1.8 5.5 1 1 256 1 . . . . . 3.195 1.8 4.59 1 1 257 1 . . . . . 3.21 1.8 4.62 1 1 258 1 . . . . . 3.55 1.8 5.3 1 1 259 1 . . . . . 3.135 1.8 4.47 1 1 260 1 . . . . . 3.05 3.0 3.1 1 1 261 1 . . . . . 2.96 1.8 4.12 1 1 262 1 . . . . . 3.46 1.8 5.12 1 1 263 1 . . . . . 3.215 1.8 4.63 1 1 264 1 . . . . . 3.415 1.8 5.03 1 1 265 1 . . . . . 3.65 1.8 5.5 1 1 266 1 . . . . . 3.555 1.8 5.31 1 1 267 1 . . . . . 2.935 1.8 4.07 1 1 268 1 . . . . . 2.975 1.8 4.15 1 1 269 1 . . . . . 3.4 1.8 5.0 1 1 270 1 . . . . . 3.57 1.8 5.34 1 1 271 1 . . . . . 3.475 1.8 5.15 1 1 272 1 . . . . . 2.855 1.8 3.91 1 1 273 1 . . . . . 3.4 1.8 5.0 1 1 274 1 . . . . . 3.05 3.0 3.1 1 1 275 1 . . . . . 2.05 2.0 2.1 1 1 276 1 . . . . . 3.36 1.8 4.92 1 1 277 1 . . . . . 3.505 1.8 5.21 1 1 278 1 . . . . . 3.52 1.8 5.24 1 1 279 1 . . . . . 3.14 1.8 4.48 1 1 280 1 . . . . . 3.65 1.8 5.5 1 1 281 1 . . . . . 3.615 1.8 5.43 1 1 282 1 . . . . . 3.48 1.8 5.16 1 1 283 1 . . . . . 3.65 1.8 5.5 1 1 284 1 . . . . . 3.155 1.8 4.51 1 1 285 1 . . . . . 3.425 1.8 5.05 1 1 286 1 . . . . . 3.44 1.8 5.08 1 1 287 1 . . . . . 3.375 1.8 4.95 1 1 288 1 . . . . . 2.9 1.8 4.0 1 1 289 1 . . . . . 2.675 1.8 3.55 1 1 290 1 . . . . . 3.61 1.8 5.42 1 1 291 1 . . . . . 3.55 1.8 5.3 1 1 292 1 . . . . . 3.65 1.8 5.5 1 1 293 1 . . . . . 3.555 1.8 5.31 1 1 294 1 . . . . . 3.115 1.8 4.43 1 1 295 1 . . . . . 3.485 1.8 5.17 1 1 296 1 . . . . . 2.98 1.8 4.16 1 1 297 1 . . . . . 2.69 1.8 3.58 1 1 298 1 . . . . . 2.935 1.8 4.07 1 1 299 1 . . . . . 3.135 1.8 4.47 1 1 300 1 . . . . . 3.59 1.8 5.38 1 1 301 1 . . . . . 3.585 1.8 5.37 1 1 302 1 . . . . . 3.215 1.8 4.63 1 1 303 1 . . . . . 3.5 1.8 5.2 1 1 304 1 . . . . . 2.94 1.8 4.08 1 1 305 1 . . . . . 3.375 1.8 4.95 1 1 306 1 . . . . . 2.915 1.8 4.03 1 1 307 1 . . . . . 3.17 1.8 4.54 1 1 308 1 . . . . . 2.975 1.8 4.13 1 1 309 1 . . . . . 3.265 1.8 4.73 1 1 310 1 . . . . . 3.65 1.8 5.5 1 1 311 1 . . . . . 3.315 1.8 4.83 1 1 312 1 . . . . . 3.12 1.8 4.44 1 1 313 1 . . . . . 3.26 1.8 4.72 1 1 314 1 . . . . . 3.65 1.8 5.5 1 1 315 1 . . . . . 3.135 1.8 4.47 1 1 316 1 . . . . . 3.65 1.8 5.5 1 1 317 1 . . . . . 2.915 1.8 4.03 1 1 318 1 . . . . . 3.205 1.8 4.61 1 1 319 1 . . . . . 3.165 1.8 4.53 1 1 320 1 . . . . . 2.975 1.8 4.15 1 1 321 1 . . . . . 3.185 1.8 4.57 1 1 322 1 . . . . . 3.0 1.8 4.2 1 1 323 1 . . . . . 3.65 1.8 5.5 1 1 324 1 . . . . . 3.495 1.8 5.19 1 1 325 1 . . . . . 2.99 1.8 4.18 1 1 326 1 . . . . . 3.215 1.8 4.63 1 1 327 1 . . . . . 3.305 1.8 4.81 1 1 328 1 . . . . . 2.955 1.8 4.11 1 1 329 1 . . . . . 3.055 1.8 4.31 1 1 330 1 . . . . . 3.275 1.8 4.75 1 1 331 1 . . . . . 3.14 1.8 4.48 1 1 332 1 . . . . . 3.26 1.8 4.72 1 1 333 1 . . . . . 3.65 1.8 5.5 1 1 334 1 . . . . . 3.215 1.8 4.63 1 1 335 1 . . . . . 3.275 1.8 4.75 1 1 336 1 . . . . . 3.48 1.8 5.16 1 1 337 1 . . . . . 3.08 1.8 4.36 1 1 338 1 . . . . . 3.285 1.8 4.77 1 1 339 1 . . . . . 3.31 1.8 4.82 1 1 340 1 . . . . . 2.905 1.8 4.01 1 1 341 1 . . . . . 3.365 1.8 4.93 1 1 342 1 . . . . . 2.93 1.8 4.06 1 1 343 1 . . . . . 3.5 1.8 5.2 1 1 344 1 . . . . . 3.65 1.8 5.5 1 1 345 1 . . . . . 3.405 1.8 5.01 1 1 346 1 . . . . . 2.695 1.8 3.59 1 1 347 1 . . . . . 3.575 1.8 5.35 1 1 348 1 . . . . . 3.37 1.8 4.94 1 1 349 1 . . . . . 3.65 1.8 5.5 1 1 350 1 . . . . . 3.35 1.8 4.9 1 1 351 1 . . . . . 3.315 1.8 4.83 1 1 352 1 . . . . . 3.65 1.8 5.5 1 1 353 1 . . . . . 3.65 1.8 5.5 1 1 354 1 . . . . . 3.53 1.8 5.26 1 1 355 1 . . . . . 3.365 1.8 4.93 1 1 356 1 . . . . . 3.65 1.8 5.5 1 1 357 1 . . . . . 3.61 1.8 5.42 1 1 358 1 . . . . . 2.98 1.8 4.16 1 1 359 1 . . . . . 2.94 1.8 4.08 1 1 360 1 . . . . . 3.65 1.8 5.5 1 1 361 1 . . . . . 3.395 1.8 4.99 1 1 362 1 . . . . . 3.565 1.8 5.33 1 1 363 1 . . . . . 2.925 1.8 4.05 1 1 364 1 . . . . . 3.65 1.8 5.5 1 1 365 1 . . . . . 3.435 1.8 5.07 1 1 366 1 . . . . . 3.15 1.8 4.5 1 1 367 1 . . . . . 3.52 1.8 5.24 1 1 368 1 . . . . . 3.01 1.8 4.22 1 1 369 1 . . . . . 3.29 1.8 4.78 1 1 370 1 . . . . . 3.52 1.8 5.24 1 1 371 1 . . . . . 3.595 1.8 5.39 1 1 372 1 . . . . . 2.955 1.8 4.11 1 1 373 1 . . . . . 2.905 1.8 4.01 1 1 374 1 . . . . . 3.285 1.8 4.77 1 1 375 1 . . . . . 3.65 1.8 5.5 1 1 376 1 . . . . . 2.775 1.8 3.75 1 1 377 1 . . . . . 3.455 1.8 5.11 1 1 378 1 . . . . . 3.35 1.8 4.9 1 1 379 1 . . . . . 3.295 1.8 4.79 1 1 380 1 . . . . . 3.65 1.8 5.5 1 1 381 1 . . . . . 3.53 1.8 5.26 1 1 382 1 . . . . . 2.925 1.8 4.05 1 1 383 1 . . . . . 2.72 1.8 3.64 1 1 384 1 . . . . . 2.785 1.8 3.77 1 1 385 1 . . . . . 3.185 1.8 4.57 1 1 386 1 . . . . . 3.345 1.8 4.89 1 1 387 1 . . . . . 3.31 1.8 4.82 1 1 388 1 . . . . . 3.165 1.8 4.53 1 1 389 1 . . . . . 2.79 1.8 3.78 1 1 390 1 . . . . . 3.65 1.8 5.5 1 1 391 1 . . . . . 3.42 1.8 5.04 1 1 392 1 . . . . . 3.4 1.8 5.0 1 1 393 1 . . . . . 2.76 1.8 3.72 1 1 394 1 . . . . . 3.32 1.8 4.84 1 1 395 1 . . . . . 3.495 1.8 5.19 1 1 396 1 . . . . . 3.375 1.8 4.95 1 1 397 1 . . . . . 3.16 1.8 4.52 1 1 398 1 . . . . . 3.65 1.8 5.5 1 1 399 1 . . . . . 2.855 1.8 3.91 1 1 stop_ save_ save_conformer_family_coord_set_1 _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Entry_ID 1 _Conformer_family_coord_set.ID 1 loop_ _Atom_site.Model_ID _Atom_site.ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Occupancy _Atom_site.Uncertainty _Atom_site.PDBX_label_asym_ID _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID 1 1 1 1 1 GLY C C 4.466 7.395 22.324 1.00 . A A . 1 GLY C 1 1 1 2 1 1 1 GLY CA C 4.663 7.565 23.831 1.00 . A A . 1 GLY CA 1 1 1 3 1 1 1 GLY H1 H 5.934 9.110 23.250 1.00 . A A . 1 GLY H1 1 1 1 4 1 1 1 GLY H2 H 6.661 7.960 24.267 1.00 . A A . 1 GLY H2 1 1 1 5 1 1 1 GLY H3 H 5.575 9.099 24.907 1.00 . A A . 1 GLY H3 1 1 1 6 1 1 1 GLY HA2 H 4.886 6.606 24.278 1.00 . A A . 1 GLY HA2 1 1 1 7 1 1 1 GLY HA3 H 3.759 7.963 24.266 1.00 . A A . 1 GLY HA3 1 1 1 8 1 1 1 GLY N N 5.793 8.505 24.083 1.00 . A A . 1 GLY N 1 1 1 9 1 1 1 GLY O O 4.198 8.344 21.613 1.00 . A A . 1 GLY O 1 1 1 10 1 1 2 SER C C 3.583 4.702 20.130 1.00 . A A . 2 SER C 1 1 1 11 1 1 2 SER CA C 4.416 5.965 20.368 1.00 . A A . 2 SER CA 1 1 1 12 1 1 2 SER CB C 5.830 5.787 19.815 1.00 . A A . 2 SER CB 1 1 1 13 1 1 2 SER H H 4.813 5.442 22.421 1.00 . A A . 2 SER H 1 1 1 14 1 1 2 SER HA H 3.945 6.819 19.908 1.00 . A A . 2 SER HA 1 1 1 15 1 1 2 SER HB2 H 6.407 6.676 20.002 1.00 . A A . 2 SER HB2 1 1 1 16 1 1 2 SER HB3 H 6.303 4.944 20.302 1.00 . A A . 2 SER HB3 1 1 1 17 1 1 2 SER HG H 6.567 5.900 18.017 1.00 . A A . 2 SER HG 1 1 1 18 1 1 2 SER N N 4.597 6.194 21.831 1.00 . A A . 2 SER N 1 1 1 19 1 1 2 SER O O 4.033 3.597 20.361 1.00 . A A . 2 SER O 1 1 1 20 1 1 2 SER OG O 5.760 5.561 18.413 1.00 . A A . 2 SER OG 1 1 1 21 1 1 3 ALA C C 0.276 4.067 18.611 1.00 . A A . 3 ALA C 1 1 1 22 1 1 3 ALA CA C 1.510 3.665 19.422 1.00 . A A . 3 ALA CA 1 1 1 23 1 1 3 ALA CB C 1.103 3.172 20.810 1.00 . A A . 3 ALA CB 1 1 1 24 1 1 3 ALA H H 2.026 5.756 19.493 1.00 . A A . 3 ALA H 1 1 1 25 1 1 3 ALA HA H 2.068 2.898 18.907 1.00 . A A . 3 ALA HA 1 1 1 26 1 1 3 ALA HB1 H 0.451 2.318 20.712 1.00 . A A . 3 ALA HB1 1 1 1 27 1 1 3 ALA HB2 H 0.586 3.962 21.335 1.00 . A A . 3 ALA HB2 1 1 1 28 1 1 3 ALA HB3 H 1.986 2.890 21.365 1.00 . A A . 3 ALA HB3 1 1 1 29 1 1 3 ALA N N 2.371 4.857 19.672 1.00 . A A . 3 ALA N 1 1 1 30 1 1 3 ALA O O 0.155 5.190 18.163 1.00 . A A . 3 ALA O 1 1 1 31 1 1 4 MET C C -1.484 4.099 16.286 1.00 . A A . 4 MET C 1 1 1 32 1 1 4 MET CA C -1.867 3.492 17.638 1.00 . A A . 4 MET CA 1 1 1 33 1 1 4 MET CB C -2.614 4.517 18.491 1.00 . A A . 4 MET CB 1 1 1 34 1 1 4 MET CE C -2.831 5.237 22.380 1.00 . A A . 4 MET CE 1 1 1 35 1 1 4 MET CG C -2.652 4.043 19.945 1.00 . A A . 4 MET CG 1 1 1 36 1 1 4 MET H H -0.526 2.259 18.788 1.00 . A A . 4 MET H 1 1 1 37 1 1 4 MET HA H -2.476 2.614 17.498 1.00 . A A . 4 MET HA 1 1 1 38 1 1 4 MET HB2 H -2.107 5.469 18.435 1.00 . A A . 4 MET HB2 1 1 1 39 1 1 4 MET HB3 H -3.624 4.624 18.123 1.00 . A A . 4 MET HB3 1 1 1 40 1 1 4 MET HE1 H -1.990 5.886 22.178 1.00 . A A . 4 MET HE1 1 1 1 41 1 1 4 MET HE2 H -2.469 4.270 22.691 1.00 . A A . 4 MET HE2 1 1 1 42 1 1 4 MET HE3 H -3.440 5.661 23.166 1.00 . A A . 4 MET HE3 1 1 1 43 1 1 4 MET HG2 H -2.963 3.010 19.980 1.00 . A A . 4 MET HG2 1 1 1 44 1 1 4 MET HG3 H -1.668 4.139 20.381 1.00 . A A . 4 MET HG3 1 1 1 45 1 1 4 MET N N -0.642 3.159 18.419 1.00 . A A . 4 MET N 1 1 1 46 1 1 4 MET O O -2.050 5.083 15.853 1.00 . A A . 4 MET O 1 1 1 47 1 1 4 MET SD S -3.825 5.058 20.878 1.00 . A A . 4 MET SD 1 1 1 48 1 1 5 GLY C C 0.399 2.933 13.404 1.00 . A A . 5 GLY C 1 1 1 49 1 1 5 GLY CA C -0.109 4.067 14.295 1.00 . A A . 5 GLY CA 1 1 1 50 1 1 5 GLY H H -0.080 2.728 15.982 1.00 . A A . 5 GLY H 1 1 1 51 1 1 5 GLY HA2 H -0.955 4.547 13.823 1.00 . A A . 5 GLY HA2 1 1 1 52 1 1 5 GLY HA3 H 0.681 4.789 14.437 1.00 . A A . 5 GLY HA3 1 1 1 53 1 1 5 GLY N N -0.525 3.521 15.616 1.00 . A A . 5 GLY N 1 1 1 54 1 1 5 GLY O O 1.085 2.036 13.850 1.00 . A A . 5 GLY O 1 1 1 55 1 1 6 CYS C C 2.064 1.822 11.247 1.00 . A A . 6 CYS C 1 1 1 56 1 1 6 CYS CA C 0.534 1.901 11.215 1.00 . A A . 6 CYS CA 1 1 1 57 1 1 6 CYS CB C 0.022 2.339 9.836 1.00 . A A . 6 CYS CB 1 1 1 58 1 1 6 CYS H H -0.481 3.704 11.805 1.00 . A A . 6 CYS H 1 1 1 59 1 1 6 CYS HA H 0.101 0.950 11.486 1.00 . A A . 6 CYS HA 1 1 1 60 1 1 6 CYS HB2 H -1.010 2.042 9.730 1.00 . A A . 6 CYS HB2 1 1 1 61 1 1 6 CYS HB3 H 0.093 3.412 9.754 1.00 . A A . 6 CYS HB3 1 1 1 62 1 1 6 CYS N N 0.069 2.970 12.143 1.00 . A A . 6 CYS N 1 1 1 63 1 1 6 CYS O O 2.644 0.760 11.143 1.00 . A A . 6 CYS O 1 1 1 64 1 1 6 CYS SG S 1.000 1.565 8.521 1.00 . A A . 6 CYS SG 1 1 1 65 1 1 7 ARG C C 4.684 2.232 12.715 1.00 . A A . 7 ARG C 1 1 1 66 1 1 7 ARG CA C 4.207 2.933 11.440 1.00 . A A . 7 ARG CA 1 1 1 67 1 1 7 ARG CB C 4.608 4.408 11.456 1.00 . A A . 7 ARG CB 1 1 1 68 1 1 7 ARG CD C 2.928 6.197 11.928 1.00 . A A . 7 ARG CD 1 1 1 69 1 1 7 ARG CG C 3.831 5.134 12.556 1.00 . A A . 7 ARG CG 1 1 1 70 1 1 7 ARG CZ C 3.512 8.167 10.649 1.00 . A A . 7 ARG CZ 1 1 1 71 1 1 7 ARG H H 2.229 3.786 11.482 1.00 . A A . 7 ARG H 1 1 1 72 1 1 7 ARG HA H 4.611 2.448 10.565 1.00 . A A . 7 ARG HA 1 1 1 73 1 1 7 ARG HB2 H 5.668 4.490 11.646 1.00 . A A . 7 ARG HB2 1 1 1 74 1 1 7 ARG HB3 H 4.377 4.855 10.501 1.00 . A A . 7 ARG HB3 1 1 1 75 1 1 7 ARG HD2 H 2.455 5.808 11.036 1.00 . A A . 7 ARG HD2 1 1 1 76 1 1 7 ARG HD3 H 2.184 6.525 12.637 1.00 . A A . 7 ARG HD3 1 1 1 77 1 1 7 ARG HE H 4.687 7.430 12.069 1.00 . A A . 7 ARG HE 1 1 1 78 1 1 7 ARG HG2 H 3.227 4.422 13.099 1.00 . A A . 7 ARG HG2 1 1 1 79 1 1 7 ARG HG3 H 4.525 5.608 13.233 1.00 . A A . 7 ARG HG3 1 1 1 80 1 1 7 ARG HH11 H 2.469 9.357 11.875 1.00 . A A . 7 ARG HH11 1 1 1 81 1 1 7 ARG HH12 H 2.526 9.855 10.217 1.00 . A A . 7 ARG HH12 1 1 1 82 1 1 7 ARG HH21 H 4.478 7.173 9.205 1.00 . A A . 7 ARG HH21 1 1 1 83 1 1 7 ARG HH22 H 3.663 8.617 8.704 1.00 . A A . 7 ARG HH22 1 1 1 84 1 1 7 ARG N N 2.718 2.941 11.395 1.00 . A A . 7 ARG N 1 1 1 85 1 1 7 ARG NE N 3.840 7.323 11.588 1.00 . A A . 7 ARG NE 1 1 1 86 1 1 7 ARG NH1 N 2.778 9.208 10.936 1.00 . A A . 7 ARG NH1 1 1 1 87 1 1 7 ARG NH2 N 3.916 7.971 9.424 1.00 . A A . 7 ARG NH2 1 1 1 88 1 1 7 ARG O O 5.826 1.835 12.830 1.00 . A A . 7 ARG O 1 1 1 89 1 1 8 HIS C C 4.005 -0.114 14.805 1.00 . A A . 8 HIS C 1 1 1 90 1 1 8 HIS CA C 4.197 1.400 14.943 1.00 . A A . 8 HIS CA 1 1 1 91 1 1 8 HIS CB C 3.253 1.992 16.000 1.00 . A A . 8 HIS CB 1 1 1 92 1 1 8 HIS CD2 C 2.036 0.108 17.371 1.00 . A A . 8 HIS CD2 1 1 1 93 1 1 8 HIS CE1 C 3.462 -0.074 18.992 1.00 . A A . 8 HIS CE1 1 1 1 94 1 1 8 HIS CG C 3.040 1.010 17.122 1.00 . A A . 8 HIS CG 1 1 1 95 1 1 8 HIS H H 2.893 2.404 13.553 1.00 . A A . 8 HIS H 1 1 1 96 1 1 8 HIS HA H 5.221 1.629 15.194 1.00 . A A . 8 HIS HA 1 1 1 97 1 1 8 HIS HB2 H 3.686 2.898 16.397 1.00 . A A . 8 HIS HB2 1 1 1 98 1 1 8 HIS HB3 H 2.303 2.221 15.541 1.00 . A A . 8 HIS HB3 1 1 1 99 1 1 8 HIS HD1 H 4.769 1.384 18.287 1.00 . A A . 8 HIS HD1 1 1 1 100 1 1 8 HIS HD2 H 1.169 -0.048 16.743 1.00 . A A . 8 HIS HD2 1 1 1 101 1 1 8 HIS HE1 H 3.956 -0.393 19.898 1.00 . A A . 8 HIS HE1 1 1 1 102 1 1 8 HIS N N 3.809 2.076 13.672 1.00 . A A . 8 HIS N 1 1 1 103 1 1 8 HIS ND1 N 3.938 0.877 18.168 1.00 . A A . 8 HIS ND1 1 1 1 104 1 1 8 HIS NE2 N 2.304 -0.576 18.553 1.00 . A A . 8 HIS NE2 1 1 1 105 1 1 8 HIS O O 4.600 -0.894 15.522 1.00 . A A . 8 HIS O 1 1 1 106 1 1 9 PHE C C 4.276 -2.687 13.370 1.00 . A A . 9 PHE C 1 1 1 107 1 1 9 PHE CA C 2.951 -1.993 13.702 1.00 . A A . 9 PHE CA 1 1 1 108 1 1 9 PHE CB C 1.980 -2.091 12.524 1.00 . A A . 9 PHE CB 1 1 1 109 1 1 9 PHE CD1 C 0.340 -1.175 14.234 1.00 . A A . 9 PHE CD1 1 1 1 110 1 1 9 PHE CD2 C -0.358 -1.382 11.923 1.00 . A A . 9 PHE CD2 1 1 1 111 1 1 9 PHE CE1 C -0.922 -0.666 14.567 1.00 . A A . 9 PHE CE1 1 1 1 112 1 1 9 PHE CE2 C -1.619 -0.874 12.255 1.00 . A A . 9 PHE CE2 1 1 1 113 1 1 9 PHE CG C 0.623 -1.534 12.908 1.00 . A A . 9 PHE CG 1 1 1 114 1 1 9 PHE CZ C -1.901 -0.516 13.577 1.00 . A A . 9 PHE CZ 1 1 1 115 1 1 9 PHE H H 2.710 0.113 13.319 1.00 . A A . 9 PHE H 1 1 1 116 1 1 9 PHE HA H 2.508 -2.423 14.585 1.00 . A A . 9 PHE HA 1 1 1 117 1 1 9 PHE HB2 H 2.372 -1.527 11.690 1.00 . A A . 9 PHE HB2 1 1 1 118 1 1 9 PHE HB3 H 1.872 -3.126 12.235 1.00 . A A . 9 PHE HB3 1 1 1 119 1 1 9 PHE HD1 H 1.094 -1.288 14.998 1.00 . A A . 9 PHE HD1 1 1 1 120 1 1 9 PHE HD2 H -0.141 -1.659 10.907 1.00 . A A . 9 PHE HD2 1 1 1 121 1 1 9 PHE HE1 H -1.141 -0.391 15.586 1.00 . A A . 9 PHE HE1 1 1 1 122 1 1 9 PHE HE2 H -2.374 -0.760 11.489 1.00 . A A . 9 PHE HE2 1 1 1 123 1 1 9 PHE HZ H -2.873 -0.122 13.835 1.00 . A A . 9 PHE HZ 1 1 1 124 1 1 9 PHE N N 3.179 -0.533 13.888 1.00 . A A . 9 PHE N 1 1 1 125 1 1 9 PHE O O 4.971 -2.310 12.448 1.00 . A A . 9 PHE O 1 1 1 126 1 1 10 GLN C C 5.840 -5.192 12.538 1.00 . A A . 10 GLN C 1 1 1 127 1 1 10 GLN CA C 5.923 -4.403 13.848 1.00 . A A . 10 GLN CA 1 1 1 128 1 1 10 GLN CB C 6.109 -5.357 15.028 1.00 . A A . 10 GLN CB 1 1 1 129 1 1 10 GLN CD C 7.354 -4.981 17.161 1.00 . A A . 10 GLN CD 1 1 1 130 1 1 10 GLN CG C 7.491 -5.139 15.646 1.00 . A A . 10 GLN CG 1 1 1 131 1 1 10 GLN H H 4.067 -3.982 14.863 1.00 . A A . 10 GLN H 1 1 1 132 1 1 10 GLN HA H 6.740 -3.701 13.813 1.00 . A A . 10 GLN HA 1 1 1 133 1 1 10 GLN HB2 H 5.346 -5.165 15.770 1.00 . A A . 10 GLN HB2 1 1 1 134 1 1 10 GLN HB3 H 6.028 -6.377 14.683 1.00 . A A . 10 GLN HB3 1 1 1 135 1 1 10 GLN HE21 H 9.240 -4.418 17.413 1.00 . A A . 10 GLN HE21 1 1 1 136 1 1 10 GLN HE22 H 8.311 -4.496 18.831 1.00 . A A . 10 GLN HE22 1 1 1 137 1 1 10 GLN HG2 H 8.122 -5.988 15.427 1.00 . A A . 10 GLN HG2 1 1 1 138 1 1 10 GLN HG3 H 7.933 -4.245 15.232 1.00 . A A . 10 GLN HG3 1 1 1 139 1 1 10 GLN N N 4.637 -3.695 14.119 1.00 . A A . 10 GLN N 1 1 1 140 1 1 10 GLN NE2 N 8.387 -4.600 17.860 1.00 . A A . 10 GLN NE2 1 1 1 141 1 1 10 GLN O O 6.805 -5.303 11.809 1.00 . A A . 10 GLN O 1 1 1 142 1 1 10 GLN OE1 O 6.296 -5.208 17.714 1.00 . A A . 10 GLN OE1 1 1 1 143 1 1 11 SER C C 3.647 -5.813 9.988 1.00 . A A . 11 SER C 1 1 1 144 1 1 11 SER CA C 4.564 -6.534 10.979 1.00 . A A . 11 SER CA 1 1 1 145 1 1 11 SER CB C 3.944 -7.862 11.411 1.00 . A A . 11 SER CB 1 1 1 146 1 1 11 SER H H 3.932 -5.650 12.842 1.00 . A A . 11 SER H 1 1 1 147 1 1 11 SER HA H 5.534 -6.707 10.537 1.00 . A A . 11 SER HA 1 1 1 148 1 1 11 SER HB2 H 4.074 -7.994 12.472 1.00 . A A . 11 SER HB2 1 1 1 149 1 1 11 SER HB3 H 2.887 -7.857 11.178 1.00 . A A . 11 SER HB3 1 1 1 150 1 1 11 SER HG H 4.646 -8.690 9.795 1.00 . A A . 11 SER HG 1 1 1 151 1 1 11 SER N N 4.698 -5.746 12.238 1.00 . A A . 11 SER N 1 1 1 152 1 1 11 SER O O 3.258 -4.681 10.193 1.00 . A A . 11 SER O 1 1 1 153 1 1 11 SER OG O 4.589 -8.926 10.724 1.00 . A A . 11 SER OG 1 1 1 154 1 1 12 CYS C C 0.958 -6.249 8.147 1.00 . A A . 12 CYS C 1 1 1 155 1 1 12 CYS CA C 2.415 -5.829 7.900 1.00 . A A . 12 CYS CA 1 1 1 156 1 1 12 CYS CB C 2.958 -6.338 6.548 1.00 . A A . 12 CYS CB 1 1 1 157 1 1 12 CYS H H 3.632 -7.378 8.769 1.00 . A A . 12 CYS H 1 1 1 158 1 1 12 CYS HA H 2.508 -4.756 7.950 1.00 . A A . 12 CYS HA 1 1 1 159 1 1 12 CYS HB2 H 3.537 -5.554 6.085 1.00 . A A . 12 CYS HB2 1 1 1 160 1 1 12 CYS HB3 H 3.598 -7.190 6.725 1.00 . A A . 12 CYS HB3 1 1 1 161 1 1 12 CYS N N 3.303 -6.466 8.912 1.00 . A A . 12 CYS N 1 1 1 162 1 1 12 CYS O O 0.041 -5.728 7.544 1.00 . A A . 12 CYS O 1 1 1 163 1 1 12 CYS SG S 1.618 -6.821 5.421 1.00 . A A . 12 CYS SG 1 1 1 164 1 1 13 SER C C -1.524 -6.446 9.717 1.00 . A A . 13 SER C 1 1 1 165 1 1 13 SER CA C -0.654 -7.636 9.307 1.00 . A A . 13 SER CA 1 1 1 166 1 1 13 SER CB C -0.527 -8.628 10.462 1.00 . A A . 13 SER CB 1 1 1 167 1 1 13 SER H H 1.492 -7.597 9.504 1.00 . A A . 13 SER H 1 1 1 168 1 1 13 SER HA H -1.072 -8.129 8.443 1.00 . A A . 13 SER HA 1 1 1 169 1 1 13 SER HB2 H 0.510 -8.738 10.731 1.00 . A A . 13 SER HB2 1 1 1 170 1 1 13 SER HB3 H -1.081 -8.258 11.315 1.00 . A A . 13 SER HB3 1 1 1 171 1 1 13 SER HG H -1.687 -10.170 10.710 1.00 . A A . 13 SER HG 1 1 1 172 1 1 13 SER N N 0.740 -7.187 9.028 1.00 . A A . 13 SER N 1 1 1 173 1 1 13 SER O O -2.513 -6.140 9.082 1.00 . A A . 13 SER O 1 1 1 174 1 1 13 SER OG O -1.042 -9.889 10.057 1.00 . A A . 13 SER OG 1 1 1 175 1 1 14 GLN C C -1.789 -3.420 10.285 1.00 . A A . 14 GLN C 1 1 1 176 1 1 14 GLN CA C -1.973 -4.609 11.237 1.00 . A A . 14 GLN CA 1 1 1 177 1 1 14 GLN CB C -1.429 -4.283 12.627 1.00 . A A . 14 GLN CB 1 1 1 178 1 1 14 GLN CD C -3.092 -4.674 14.448 1.00 . A A . 14 GLN CD 1 1 1 179 1 1 14 GLN CG C -2.530 -3.639 13.470 1.00 . A A . 14 GLN CG 1 1 1 180 1 1 14 GLN H H -0.366 -6.043 11.278 1.00 . A A . 14 GLN H 1 1 1 181 1 1 14 GLN HA H -3.015 -4.877 11.305 1.00 . A A . 14 GLN HA 1 1 1 182 1 1 14 GLN HB2 H -1.096 -5.193 13.104 1.00 . A A . 14 GLN HB2 1 1 1 183 1 1 14 GLN HB3 H -0.599 -3.600 12.538 1.00 . A A . 14 GLN HB3 1 1 1 184 1 1 14 GLN HE21 H -1.738 -4.294 15.851 1.00 . A A . 14 GLN HE21 1 1 1 185 1 1 14 GLN HE22 H -2.873 -5.495 16.243 1.00 . A A . 14 GLN HE22 1 1 1 186 1 1 14 GLN HG2 H -2.121 -2.805 14.020 1.00 . A A . 14 GLN HG2 1 1 1 187 1 1 14 GLN HG3 H -3.322 -3.292 12.823 1.00 . A A . 14 GLN HG3 1 1 1 188 1 1 14 GLN N N -1.166 -5.776 10.778 1.00 . A A . 14 GLN N 1 1 1 189 1 1 14 GLN NE2 N -2.520 -4.834 15.611 1.00 . A A . 14 GLN NE2 1 1 1 190 1 1 14 GLN O O -2.653 -2.573 10.163 1.00 . A A . 14 GLN O 1 1 1 191 1 1 14 GLN OE1 O -4.060 -5.344 14.150 1.00 . A A . 14 GLN OE1 1 1 1 192 1 1 15 CYS C C -1.532 -2.210 7.586 1.00 . A A . 15 CYS C 1 1 1 193 1 1 15 CYS CA C -0.446 -2.221 8.658 1.00 . A A . 15 CYS CA 1 1 1 194 1 1 15 CYS CB C 0.917 -2.502 8.030 1.00 . A A . 15 CYS CB 1 1 1 195 1 1 15 CYS H H 0.006 -4.047 9.714 1.00 . A A . 15 CYS H 1 1 1 196 1 1 15 CYS HA H -0.425 -1.279 9.181 1.00 . A A . 15 CYS HA 1 1 1 197 1 1 15 CYS HB2 H 1.104 -3.565 8.041 1.00 . A A . 15 CYS HB2 1 1 1 198 1 1 15 CYS HB3 H 0.924 -2.145 7.010 1.00 . A A . 15 CYS HB3 1 1 1 199 1 1 15 CYS N N -0.676 -3.352 9.606 1.00 . A A . 15 CYS N 1 1 1 200 1 1 15 CYS O O -2.001 -1.169 7.170 1.00 . A A . 15 CYS O 1 1 1 201 1 1 15 CYS SG S 2.206 -1.653 8.974 1.00 . A A . 15 CYS SG 1 1 1 202 1 1 16 LEU C C -4.287 -3.979 6.679 1.00 . A A . 16 LEU C 1 1 1 203 1 1 16 LEU CA C -2.987 -3.423 6.087 1.00 . A A . 16 LEU CA 1 1 1 204 1 1 16 LEU CB C -2.420 -4.362 5.020 1.00 . A A . 16 LEU CB 1 1 1 205 1 1 16 LEU CD1 C -0.253 -3.098 5.005 1.00 . A A . 16 LEU CD1 1 1 1 206 1 1 16 LEU CD2 C -0.874 -4.527 3.061 1.00 . A A . 16 LEU CD2 1 1 1 207 1 1 16 LEU CG C -1.417 -3.598 4.148 1.00 . A A . 16 LEU CG 1 1 1 208 1 1 16 LEU H H -1.540 -4.189 7.482 1.00 . A A . 16 LEU H 1 1 1 209 1 1 16 LEU HA H -3.154 -2.445 5.665 1.00 . A A . 16 LEU HA 1 1 1 210 1 1 16 LEU HB2 H -1.923 -5.193 5.500 1.00 . A A . 16 LEU HB2 1 1 1 211 1 1 16 LEU HB3 H -3.225 -4.730 4.401 1.00 . A A . 16 LEU HB3 1 1 1 212 1 1 16 LEU HD11 H 0.617 -2.956 4.380 1.00 . A A . 16 LEU HD11 1 1 1 213 1 1 16 LEU HD12 H -0.031 -3.825 5.771 1.00 . A A . 16 LEU HD12 1 1 1 214 1 1 16 LEU HD13 H -0.522 -2.159 5.466 1.00 . A A . 16 LEU HD13 1 1 1 215 1 1 16 LEU HD21 H -0.246 -5.280 3.514 1.00 . A A . 16 LEU HD21 1 1 1 216 1 1 16 LEU HD22 H -0.293 -3.953 2.355 1.00 . A A . 16 LEU HD22 1 1 1 217 1 1 16 LEU HD23 H -1.697 -5.003 2.550 1.00 . A A . 16 LEU HD23 1 1 1 218 1 1 16 LEU HG H -1.911 -2.755 3.688 1.00 . A A . 16 LEU HG 1 1 1 219 1 1 16 LEU N N -1.933 -3.362 7.134 1.00 . A A . 16 LEU N 1 1 1 220 1 1 16 LEU O O -5.282 -4.117 5.995 1.00 . A A . 16 LEU O 1 1 1 221 1 1 17 SER C C -6.243 -3.743 9.383 1.00 . A A . 17 SER C 1 1 1 222 1 1 17 SER CA C -5.531 -4.837 8.578 1.00 . A A . 17 SER CA 1 1 1 223 1 1 17 SER CB C -5.062 -5.959 9.505 1.00 . A A . 17 SER CB 1 1 1 224 1 1 17 SER H H -3.480 -4.176 8.487 1.00 . A A . 17 SER H 1 1 1 225 1 1 17 SER HA H -6.191 -5.237 7.823 1.00 . A A . 17 SER HA 1 1 1 226 1 1 17 SER HB2 H -4.247 -5.609 10.113 1.00 . A A . 17 SER HB2 1 1 1 227 1 1 17 SER HB3 H -5.881 -6.259 10.145 1.00 . A A . 17 SER HB3 1 1 1 228 1 1 17 SER HG H -4.035 -6.733 8.046 1.00 . A A . 17 SER HG 1 1 1 229 1 1 17 SER N N -4.290 -4.296 7.949 1.00 . A A . 17 SER N 1 1 1 230 1 1 17 SER O O -7.344 -3.932 9.860 1.00 . A A . 17 SER O 1 1 1 231 1 1 17 SER OG O -4.626 -7.065 8.725 1.00 . A A . 17 SER OG 1 1 1 232 1 1 18 ALA C C -5.958 -0.146 9.693 1.00 . A A . 18 ALA C 1 1 1 233 1 1 18 ALA CA C -6.276 -1.507 10.324 1.00 . A A . 18 ALA CA 1 1 1 234 1 1 18 ALA CB C -5.666 -1.607 11.722 1.00 . A A . 18 ALA CB 1 1 1 235 1 1 18 ALA H H -4.732 -2.462 9.162 1.00 . A A . 18 ALA H 1 1 1 236 1 1 18 ALA HA H -7.342 -1.662 10.374 1.00 . A A . 18 ALA HA 1 1 1 237 1 1 18 ALA HB1 H -4.605 -1.412 11.666 1.00 . A A . 18 ALA HB1 1 1 1 238 1 1 18 ALA HB2 H -5.829 -2.600 12.115 1.00 . A A . 18 ALA HB2 1 1 1 239 1 1 18 ALA HB3 H -6.132 -0.882 12.371 1.00 . A A . 18 ALA HB3 1 1 1 240 1 1 18 ALA N N -5.625 -2.600 9.544 1.00 . A A . 18 ALA N 1 1 1 241 1 1 18 ALA O O -5.362 0.708 10.318 1.00 . A A . 18 ALA O 1 1 1 242 1 1 19 PRO C C -7.069 2.415 8.170 1.00 . A A . 19 PRO C 1 1 1 243 1 1 19 PRO CA C -6.149 1.258 7.714 1.00 . A A . 19 PRO CA 1 1 1 244 1 1 19 PRO CB C -6.436 0.870 6.266 1.00 . A A . 19 PRO CB 1 1 1 245 1 1 19 PRO CD C -7.095 -1.000 7.661 1.00 . A A . 19 PRO CD 1 1 1 246 1 1 19 PRO CG C -7.348 -0.313 6.341 1.00 . A A . 19 PRO CG 1 1 1 247 1 1 19 PRO HA H -5.118 1.554 7.801 1.00 . A A . 19 PRO HA 1 1 1 248 1 1 19 PRO HB2 H -6.921 1.688 5.750 1.00 . A A . 19 PRO HB2 1 1 1 249 1 1 19 PRO HB3 H -5.522 0.598 5.763 1.00 . A A . 19 PRO HB3 1 1 1 250 1 1 19 PRO HD2 H -8.029 -1.268 8.133 1.00 . A A . 19 PRO HD2 1 1 1 251 1 1 19 PRO HD3 H -6.477 -1.873 7.520 1.00 . A A . 19 PRO HD3 1 1 1 252 1 1 19 PRO HG2 H -8.377 0.011 6.279 1.00 . A A . 19 PRO HG2 1 1 1 253 1 1 19 PRO HG3 H -7.129 -0.994 5.533 1.00 . A A . 19 PRO HG3 1 1 1 254 1 1 19 PRO N N -6.378 -0.001 8.463 1.00 . A A . 19 PRO N 1 1 1 255 1 1 19 PRO O O -6.688 3.561 8.037 1.00 . A A . 19 PRO O 1 1 1 256 1 1 20 PRO C C -8.657 3.829 10.425 1.00 . A A . 20 PRO C 1 1 1 257 1 1 20 PRO CA C -9.154 3.210 9.118 1.00 . A A . 20 PRO CA 1 1 1 258 1 1 20 PRO CB C -10.494 2.514 9.323 1.00 . A A . 20 PRO CB 1 1 1 259 1 1 20 PRO CD C -8.848 0.792 8.907 1.00 . A A . 20 PRO CD 1 1 1 260 1 1 20 PRO CG C -10.153 1.087 9.602 1.00 . A A . 20 PRO CG 1 1 1 261 1 1 20 PRO HA H -9.241 3.960 8.349 1.00 . A A . 20 PRO HA 1 1 1 262 1 1 20 PRO HB2 H -11.016 2.950 10.164 1.00 . A A . 20 PRO HB2 1 1 1 263 1 1 20 PRO HB3 H -11.094 2.582 8.430 1.00 . A A . 20 PRO HB3 1 1 1 264 1 1 20 PRO HD2 H -8.223 0.189 9.546 1.00 . A A . 20 PRO HD2 1 1 1 265 1 1 20 PRO HD3 H -9.024 0.297 7.967 1.00 . A A . 20 PRO HD3 1 1 1 266 1 1 20 PRO HG2 H -10.045 0.938 10.669 1.00 . A A . 20 PRO HG2 1 1 1 267 1 1 20 PRO HG3 H -10.925 0.441 9.215 1.00 . A A . 20 PRO HG3 1 1 1 268 1 1 20 PRO N N -8.247 2.117 8.682 1.00 . A A . 20 PRO N 1 1 1 269 1 1 20 PRO O O -9.089 4.892 10.824 1.00 . A A . 20 PRO O 1 1 1 270 1 1 21 PHE C C -5.775 4.182 12.184 1.00 . A A . 21 PHE C 1 1 1 271 1 1 21 PHE CA C -7.225 3.722 12.374 1.00 . A A . 21 PHE CA 1 1 1 272 1 1 21 PHE CB C -7.302 2.560 13.370 1.00 . A A . 21 PHE CB 1 1 1 273 1 1 21 PHE CD1 C -9.799 2.527 13.008 1.00 . A A . 21 PHE CD1 1 1 1 274 1 1 21 PHE CD2 C -8.619 0.417 13.195 1.00 . A A . 21 PHE CD2 1 1 1 275 1 1 21 PHE CE1 C -11.005 1.837 12.837 1.00 . A A . 21 PHE CE1 1 1 1 276 1 1 21 PHE CE2 C -9.825 -0.273 13.023 1.00 . A A . 21 PHE CE2 1 1 1 277 1 1 21 PHE CG C -8.606 1.817 13.188 1.00 . A A . 21 PHE CG 1 1 1 278 1 1 21 PHE CZ C -11.018 0.437 12.844 1.00 . A A . 21 PHE CZ 1 1 1 279 1 1 21 PHE H H -7.416 2.318 10.753 1.00 . A A . 21 PHE H 1 1 1 280 1 1 21 PHE HA H -7.839 4.542 12.714 1.00 . A A . 21 PHE HA 1 1 1 281 1 1 21 PHE HB2 H -6.477 1.884 13.197 1.00 . A A . 21 PHE HB2 1 1 1 282 1 1 21 PHE HB3 H -7.247 2.946 14.378 1.00 . A A . 21 PHE HB3 1 1 1 283 1 1 21 PHE HD1 H -9.789 3.607 13.002 1.00 . A A . 21 PHE HD1 1 1 1 284 1 1 21 PHE HD2 H -7.699 -0.132 13.333 1.00 . A A . 21 PHE HD2 1 1 1 285 1 1 21 PHE HE1 H -11.925 2.384 12.698 1.00 . A A . 21 PHE HE1 1 1 1 286 1 1 21 PHE HE2 H -9.835 -1.353 13.029 1.00 . A A . 21 PHE HE2 1 1 1 287 1 1 21 PHE HZ H -11.949 -0.096 12.711 1.00 . A A . 21 PHE HZ 1 1 1 288 1 1 21 PHE N N -7.751 3.173 11.093 1.00 . A A . 21 PHE N 1 1 1 289 1 1 21 PHE O O -5.175 4.765 13.065 1.00 . A A . 21 PHE O 1 1 1 290 1 1 22 VAL C C -3.709 5.038 9.411 1.00 . A A . 22 VAL C 1 1 1 291 1 1 22 VAL CA C -3.806 4.346 10.773 1.00 . A A . 22 VAL CA 1 1 1 292 1 1 22 VAL CB C -2.999 3.050 10.765 1.00 . A A . 22 VAL CB 1 1 1 293 1 1 22 VAL CG1 C -3.337 2.226 12.007 1.00 . A A . 22 VAL CG1 1 1 1 294 1 1 22 VAL CG2 C -3.344 2.246 9.510 1.00 . A A . 22 VAL CG2 1 1 1 295 1 1 22 VAL H H -5.718 3.457 10.337 1.00 . A A . 22 VAL H 1 1 1 296 1 1 22 VAL HA H -3.453 4.997 11.556 1.00 . A A . 22 VAL HA 1 1 1 297 1 1 22 VAL HB H -1.945 3.284 10.764 1.00 . A A . 22 VAL HB 1 1 1 298 1 1 22 VAL HG11 H -3.202 2.834 12.890 1.00 . A A . 22 VAL HG11 1 1 1 299 1 1 22 VAL HG12 H -2.685 1.367 12.058 1.00 . A A . 22 VAL HG12 1 1 1 300 1 1 22 VAL HG13 H -4.364 1.896 11.951 1.00 . A A . 22 VAL HG13 1 1 1 301 1 1 22 VAL HG21 H -4.308 2.558 9.138 1.00 . A A . 22 VAL HG21 1 1 1 302 1 1 22 VAL HG22 H -3.375 1.194 9.752 1.00 . A A . 22 VAL HG22 1 1 1 303 1 1 22 VAL HG23 H -2.592 2.419 8.754 1.00 . A A . 22 VAL HG23 1 1 1 304 1 1 22 VAL N N -5.213 3.925 11.033 1.00 . A A . 22 VAL N 1 1 1 305 1 1 22 VAL O O -4.645 5.038 8.637 1.00 . A A . 22 VAL O 1 1 1 306 1 1 23 GLN C C -1.152 5.874 7.092 1.00 . A A . 23 GLN C 1 1 1 307 1 1 23 GLN CA C -2.437 6.320 7.799 1.00 . A A . 23 GLN CA 1 1 1 308 1 1 23 GLN CB C -2.370 7.809 8.145 1.00 . A A . 23 GLN CB 1 1 1 309 1 1 23 GLN CD C -3.236 9.672 6.722 1.00 . A A . 23 GLN CD 1 1 1 310 1 1 23 GLN CG C -2.134 8.621 6.870 1.00 . A A . 23 GLN CG 1 1 1 311 1 1 23 GLN H H -1.842 5.622 9.751 1.00 . A A . 23 GLN H 1 1 1 312 1 1 23 GLN HA H -3.296 6.128 7.176 1.00 . A A . 23 GLN HA 1 1 1 313 1 1 23 GLN HB2 H -3.301 8.114 8.601 1.00 . A A . 23 GLN HB2 1 1 1 314 1 1 23 GLN HB3 H -1.558 7.981 8.835 1.00 . A A . 23 GLN HB3 1 1 1 315 1 1 23 GLN HE21 H -2.662 10.705 8.318 1.00 . A A . 23 GLN HE21 1 1 1 316 1 1 23 GLN HE22 H -4.012 11.327 7.498 1.00 . A A . 23 GLN HE22 1 1 1 317 1 1 23 GLN HG2 H -1.173 9.111 6.929 1.00 . A A . 23 GLN HG2 1 1 1 318 1 1 23 GLN HG3 H -2.150 7.962 6.015 1.00 . A A . 23 GLN HG3 1 1 1 319 1 1 23 GLN N N -2.585 5.630 9.113 1.00 . A A . 23 GLN N 1 1 1 320 1 1 23 GLN NE2 N -3.310 10.649 7.585 1.00 . A A . 23 GLN NE2 1 1 1 321 1 1 23 GLN O O -0.950 6.155 5.929 1.00 . A A . 23 GLN O 1 1 1 322 1 1 23 GLN OE1 O -4.039 9.603 5.813 1.00 . A A . 23 GLN OE1 1 1 1 323 1 1 24 CYS C C 0.753 3.497 6.275 1.00 . A A . 24 CYS C 1 1 1 324 1 1 24 CYS CA C 0.994 4.740 7.147 1.00 . A A . 24 CYS CA 1 1 1 325 1 1 24 CYS CB C 1.941 4.461 8.341 1.00 . A A . 24 CYS CB 1 1 1 326 1 1 24 CYS H H -0.457 4.978 8.722 1.00 . A A . 24 CYS H 1 1 1 327 1 1 24 CYS HA H 1.404 5.537 6.540 1.00 . A A . 24 CYS HA 1 1 1 328 1 1 24 CYS HB2 H 2.763 5.159 8.305 1.00 . A A . 24 CYS HB2 1 1 1 329 1 1 24 CYS HB3 H 1.398 4.612 9.262 1.00 . A A . 24 CYS HB3 1 1 1 330 1 1 24 CYS N N -0.279 5.190 7.783 1.00 . A A . 24 CYS N 1 1 1 331 1 1 24 CYS O O -0.331 2.950 6.229 1.00 . A A . 24 CYS O 1 1 1 332 1 1 24 CYS SG S 2.612 2.769 8.310 1.00 . A A . 24 CYS SG 1 1 1 333 1 1 25 GLY C C 3.016 1.197 4.612 1.00 . A A . 25 GLY C 1 1 1 334 1 1 25 GLY CA C 1.649 1.867 4.702 1.00 . A A . 25 GLY CA 1 1 1 335 1 1 25 GLY H H 2.631 3.532 5.645 1.00 . A A . 25 GLY H 1 1 1 336 1 1 25 GLY HA2 H 0.929 1.178 5.121 1.00 . A A . 25 GLY HA2 1 1 1 337 1 1 25 GLY HA3 H 1.334 2.169 3.718 1.00 . A A . 25 GLY HA3 1 1 1 338 1 1 25 GLY N N 1.771 3.062 5.585 1.00 . A A . 25 GLY N 1 1 1 339 1 1 25 GLY O O 3.962 1.635 5.230 1.00 . A A . 25 GLY O 1 1 1 340 1 1 26 TRP C C 5.275 0.160 2.633 1.00 . A A . 26 TRP C 1 1 1 341 1 1 26 TRP CA C 4.480 -0.507 3.759 1.00 . A A . 26 TRP CA 1 1 1 342 1 1 26 TRP CB C 4.176 -1.974 3.443 1.00 . A A . 26 TRP CB 1 1 1 343 1 1 26 TRP CD1 C 6.266 -3.317 2.962 1.00 . A A . 26 TRP CD1 1 1 1 344 1 1 26 TRP CD2 C 5.721 -3.313 5.144 1.00 . A A . 26 TRP CD2 1 1 1 345 1 1 26 TRP CE2 C 6.894 -4.094 5.022 1.00 . A A . 26 TRP CE2 1 1 1 346 1 1 26 TRP CE3 C 5.166 -3.149 6.425 1.00 . A A . 26 TRP CE3 1 1 1 347 1 1 26 TRP CG C 5.343 -2.830 3.823 1.00 . A A . 26 TRP CG 1 1 1 348 1 1 26 TRP CH2 C 6.927 -4.520 7.397 1.00 . A A . 26 TRP CH2 1 1 1 349 1 1 26 TRP CZ2 C 7.493 -4.693 6.132 1.00 . A A . 26 TRP CZ2 1 1 1 350 1 1 26 TRP CZ3 C 5.766 -3.750 7.544 1.00 . A A . 26 TRP CZ3 1 1 1 351 1 1 26 TRP H H 2.382 -0.206 3.347 1.00 . A A . 26 TRP H 1 1 1 352 1 1 26 TRP HA H 5.008 -0.426 4.696 1.00 . A A . 26 TRP HA 1 1 1 353 1 1 26 TRP HB2 H 3.308 -2.286 4.004 1.00 . A A . 26 TRP HB2 1 1 1 354 1 1 26 TRP HB3 H 3.976 -2.083 2.390 1.00 . A A . 26 TRP HB3 1 1 1 355 1 1 26 TRP HD1 H 6.282 -3.148 1.896 1.00 . A A . 26 TRP HD1 1 1 1 356 1 1 26 TRP HE1 H 7.959 -4.530 3.285 1.00 . A A . 26 TRP HE1 1 1 1 357 1 1 26 TRP HE3 H 4.273 -2.556 6.548 1.00 . A A . 26 TRP HE3 1 1 1 358 1 1 26 TRP HH2 H 7.384 -4.980 8.261 1.00 . A A . 26 TRP HH2 1 1 1 359 1 1 26 TRP HZ2 H 8.390 -5.284 6.015 1.00 . A A . 26 TRP HZ2 1 1 1 360 1 1 26 TRP HZ3 H 5.330 -3.619 8.523 1.00 . A A . 26 TRP HZ3 1 1 1 361 1 1 26 TRP N N 3.147 0.147 3.855 1.00 . A A . 26 TRP N 1 1 1 362 1 1 26 TRP NE1 N 7.188 -4.067 3.672 1.00 . A A . 26 TRP NE1 1 1 1 363 1 1 26 TRP O O 4.749 0.444 1.576 1.00 . A A . 26 TRP O 1 1 1 364 1 1 27 CYS C C 8.691 0.472 1.622 1.00 . A A . 27 CYS C 1 1 1 365 1 1 27 CYS CA C 7.326 1.142 1.807 1.00 . A A . 27 CYS CA 1 1 1 366 1 1 27 CYS CB C 7.498 2.564 2.341 1.00 . A A . 27 CYS CB 1 1 1 367 1 1 27 CYS H H 6.932 0.251 3.733 1.00 . A A . 27 CYS H 1 1 1 368 1 1 27 CYS HA H 6.784 1.162 0.875 1.00 . A A . 27 CYS HA 1 1 1 369 1 1 27 CYS HB2 H 6.647 2.820 2.952 1.00 . A A . 27 CYS HB2 1 1 1 370 1 1 27 CYS HB3 H 8.397 2.616 2.939 1.00 . A A . 27 CYS HB3 1 1 1 371 1 1 27 CYS N N 6.528 0.455 2.863 1.00 . A A . 27 CYS N 1 1 1 372 1 1 27 CYS O O 9.629 0.729 2.351 1.00 . A A . 27 CYS O 1 1 1 373 1 1 27 CYS SG S 7.621 3.733 0.966 1.00 . A A . 27 CYS SG 1 1 1 374 1 1 28 HIS C C 10.768 -1.639 1.613 1.00 . A A . 28 HIS C 1 1 1 375 1 1 28 HIS CA C 10.107 -1.056 0.349 1.00 . A A . 28 HIS CA 1 1 1 376 1 1 28 HIS CB C 10.996 0.035 -0.246 1.00 . A A . 28 HIS CB 1 1 1 377 1 1 28 HIS CD2 C 11.792 0.009 -2.750 1.00 . A A . 28 HIS CD2 1 1 1 378 1 1 28 HIS CE1 C 9.846 0.077 -3.700 1.00 . A A . 28 HIS CE1 1 1 1 379 1 1 28 HIS CG C 10.859 0.038 -1.743 1.00 . A A . 28 HIS CG 1 1 1 380 1 1 28 HIS H H 8.036 -0.540 0.052 1.00 . A A . 28 HIS H 1 1 1 381 1 1 28 HIS HA H 9.961 -1.833 -0.382 1.00 . A A . 28 HIS HA 1 1 1 382 1 1 28 HIS HB2 H 10.697 0.996 0.146 1.00 . A A . 28 HIS HB2 1 1 1 383 1 1 28 HIS HB3 H 12.025 -0.157 0.020 1.00 . A A . 28 HIS HB3 1 1 1 384 1 1 28 HIS HD1 H 8.749 0.107 -1.931 1.00 . A A . 28 HIS HD1 1 1 1 385 1 1 28 HIS HD2 H 12.861 -0.026 -2.605 1.00 . A A . 28 HIS HD2 1 1 1 386 1 1 28 HIS HE1 H 9.065 0.106 -4.445 1.00 . A A . 28 HIS HE1 1 1 1 387 1 1 28 HIS N N 8.808 -0.369 0.631 1.00 . A A . 28 HIS N 1 1 1 388 1 1 28 HIS ND1 N 9.624 0.080 -2.372 1.00 . A A . 28 HIS ND1 1 1 1 389 1 1 28 HIS NE2 N 11.150 0.034 -3.984 1.00 . A A . 28 HIS NE2 1 1 1 390 1 1 28 HIS O O 11.906 -2.062 1.564 1.00 . A A . 28 HIS O 1 1 1 391 1 1 29 ASP C C 9.918 -1.995 5.219 1.00 . A A . 29 ASP C 1 1 1 392 1 1 29 ASP CA C 10.748 -2.262 3.956 1.00 . A A . 29 ASP CA 1 1 1 393 1 1 29 ASP CB C 12.119 -1.580 4.069 1.00 . A A . 29 ASP CB 1 1 1 394 1 1 29 ASP CG C 12.040 -0.126 3.587 1.00 . A A . 29 ASP CG 1 1 1 395 1 1 29 ASP H H 9.176 -1.361 2.783 1.00 . A A . 29 ASP H 1 1 1 396 1 1 29 ASP HA H 10.887 -3.323 3.827 1.00 . A A . 29 ASP HA 1 1 1 397 1 1 29 ASP HB2 H 12.436 -1.597 5.101 1.00 . A A . 29 ASP HB2 1 1 1 398 1 1 29 ASP HB3 H 12.836 -2.117 3.466 1.00 . A A . 29 ASP HB3 1 1 1 399 1 1 29 ASP N N 10.095 -1.685 2.737 1.00 . A A . 29 ASP N 1 1 1 400 1 1 29 ASP O O 9.205 -2.853 5.693 1.00 . A A . 29 ASP O 1 1 1 401 1 1 29 ASP OD1 O 11.249 0.620 4.141 1.00 . A A . 29 ASP OD1 1 1 1 402 1 1 29 ASP OD2 O 12.774 0.215 2.674 1.00 . A A . 29 ASP OD2 1 1 1 403 1 1 30 LYS C C 7.891 0.076 6.690 1.00 . A A . 30 LYS C 1 1 1 404 1 1 30 LYS CA C 9.263 -0.511 7.027 1.00 . A A . 30 LYS CA 1 1 1 405 1 1 30 LYS CB C 10.128 0.518 7.760 1.00 . A A . 30 LYS CB 1 1 1 406 1 1 30 LYS CD C 9.436 -0.128 10.075 1.00 . A A . 30 LYS CD 1 1 1 407 1 1 30 LYS CE C 9.048 0.443 11.441 1.00 . A A . 30 LYS CE 1 1 1 408 1 1 30 LYS CG C 9.416 0.989 9.030 1.00 . A A . 30 LYS CG 1 1 1 409 1 1 30 LYS H H 10.619 -0.145 5.396 1.00 . A A . 30 LYS H 1 1 1 410 1 1 30 LYS HA H 9.152 -1.397 7.631 1.00 . A A . 30 LYS HA 1 1 1 411 1 1 30 LYS HB2 H 11.073 0.066 8.025 1.00 . A A . 30 LYS HB2 1 1 1 412 1 1 30 LYS HB3 H 10.303 1.364 7.114 1.00 . A A . 30 LYS HB3 1 1 1 413 1 1 30 LYS HD2 H 8.734 -0.898 9.792 1.00 . A A . 30 LYS HD2 1 1 1 414 1 1 30 LYS HD3 H 10.429 -0.549 10.133 1.00 . A A . 30 LYS HD3 1 1 1 415 1 1 30 LYS HE2 H 9.477 1.427 11.572 1.00 . A A . 30 LYS HE2 1 1 1 416 1 1 30 LYS HE3 H 7.975 0.482 11.542 1.00 . A A . 30 LYS HE3 1 1 1 417 1 1 30 LYS HG2 H 9.924 1.859 9.423 1.00 . A A . 30 LYS HG2 1 1 1 418 1 1 30 LYS HG3 H 8.394 1.245 8.799 1.00 . A A . 30 LYS HG3 1 1 1 419 1 1 30 LYS HZ1 H 9.974 0.014 13.256 1.00 . A A . 30 LYS HZ1 1 1 1 420 1 1 30 LYS HZ2 H 10.402 -1.040 11.995 1.00 . A A . 30 LYS HZ2 1 1 1 421 1 1 30 LYS HZ3 H 8.881 -1.175 12.741 1.00 . A A . 30 LYS HZ3 1 1 1 422 1 1 30 LYS N N 10.025 -0.820 5.781 1.00 . A A . 30 LYS N 1 1 1 423 1 1 30 LYS NZ N 9.619 -0.512 12.433 1.00 . A A . 30 LYS NZ 1 1 1 424 1 1 30 LYS O O 7.652 0.539 5.592 1.00 . A A . 30 LYS O 1 1 1 425 1 1 31 CYS C C 5.615 2.120 7.573 1.00 . A A . 31 CYS C 1 1 1 426 1 1 31 CYS CA C 5.628 0.604 7.369 1.00 . A A . 31 CYS CA 1 1 1 427 1 1 31 CYS CB C 4.720 -0.078 8.390 1.00 . A A . 31 CYS CB 1 1 1 428 1 1 31 CYS H H 7.199 -0.328 8.507 1.00 . A A . 31 CYS H 1 1 1 429 1 1 31 CYS HA H 5.308 0.357 6.370 1.00 . A A . 31 CYS HA 1 1 1 430 1 1 31 CYS HB2 H 5.204 -0.967 8.767 1.00 . A A . 31 CYS HB2 1 1 1 431 1 1 31 CYS HB3 H 4.523 0.600 9.207 1.00 . A A . 31 CYS HB3 1 1 1 432 1 1 31 CYS N N 6.986 0.054 7.630 1.00 . A A . 31 CYS N 1 1 1 433 1 1 31 CYS O O 5.619 2.611 8.685 1.00 . A A . 31 CYS O 1 1 1 434 1 1 31 CYS SG S 3.160 -0.531 7.593 1.00 . A A . 31 CYS SG 1 1 1 435 1 1 32 VAL C C 4.714 4.917 5.472 1.00 . A A . 32 VAL C 1 1 1 436 1 1 32 VAL CA C 5.559 4.345 6.612 1.00 . A A . 32 VAL CA 1 1 1 437 1 1 32 VAL CB C 7.018 4.781 6.483 1.00 . A A . 32 VAL CB 1 1 1 438 1 1 32 VAL CG1 C 7.874 3.995 7.478 1.00 . A A . 32 VAL CG1 1 1 1 439 1 1 32 VAL CG2 C 7.509 4.506 5.060 1.00 . A A . 32 VAL CG2 1 1 1 440 1 1 32 VAL H H 5.576 2.438 5.620 1.00 . A A . 32 VAL H 1 1 1 441 1 1 32 VAL HA H 5.162 4.647 7.568 1.00 . A A . 32 VAL HA 1 1 1 442 1 1 32 VAL HB H 7.098 5.837 6.696 1.00 . A A . 32 VAL HB 1 1 1 443 1 1 32 VAL HG11 H 7.310 3.825 8.383 1.00 . A A . 32 VAL HG11 1 1 1 444 1 1 32 VAL HG12 H 8.766 4.558 7.711 1.00 . A A . 32 VAL HG12 1 1 1 445 1 1 32 VAL HG13 H 8.151 3.046 7.044 1.00 . A A . 32 VAL HG13 1 1 1 446 1 1 32 VAL HG21 H 7.577 3.440 4.903 1.00 . A A . 32 VAL HG21 1 1 1 447 1 1 32 VAL HG22 H 8.482 4.954 4.923 1.00 . A A . 32 VAL HG22 1 1 1 448 1 1 32 VAL HG23 H 6.814 4.931 4.352 1.00 . A A . 32 VAL HG23 1 1 1 449 1 1 32 VAL N N 5.587 2.861 6.504 1.00 . A A . 32 VAL N 1 1 1 450 1 1 32 VAL O O 4.256 4.193 4.610 1.00 . A A . 32 VAL O 1 1 1 451 1 1 33 ARG C C 4.541 7.676 3.459 1.00 . A A . 33 ARG C 1 1 1 452 1 1 33 ARG CA C 3.676 6.788 4.355 1.00 . A A . 33 ARG CA 1 1 1 453 1 1 33 ARG CB C 2.583 7.609 5.042 1.00 . A A . 33 ARG CB 1 1 1 454 1 1 33 ARG CD C 0.624 8.864 4.111 1.00 . A A . 33 ARG CD 1 1 1 455 1 1 33 ARG CG C 1.287 7.489 4.235 1.00 . A A . 33 ARG CG 1 1 1 456 1 1 33 ARG CZ C -0.564 8.964 2.000 1.00 . A A . 33 ARG CZ 1 1 1 457 1 1 33 ARG H H 4.866 6.777 6.155 1.00 . A A . 33 ARG H 1 1 1 458 1 1 33 ARG HA H 3.226 6.001 3.770 1.00 . A A . 33 ARG HA 1 1 1 459 1 1 33 ARG HB2 H 2.422 7.232 6.042 1.00 . A A . 33 ARG HB2 1 1 1 460 1 1 33 ARG HB3 H 2.881 8.645 5.090 1.00 . A A . 33 ARG HB3 1 1 1 461 1 1 33 ARG HD2 H 0.337 9.231 5.087 1.00 . A A . 33 ARG HD2 1 1 1 462 1 1 33 ARG HD3 H 1.290 9.562 3.627 1.00 . A A . 33 ARG HD3 1 1 1 463 1 1 33 ARG HE H -1.387 8.239 3.656 1.00 . A A . 33 ARG HE 1 1 1 464 1 1 33 ARG HG2 H 1.514 7.109 3.250 1.00 . A A . 33 ARG HG2 1 1 1 465 1 1 33 ARG HG3 H 0.615 6.812 4.735 1.00 . A A . 33 ARG HG3 1 1 1 466 1 1 33 ARG HH11 H 0.552 7.397 1.448 1.00 . A A . 33 ARG HH11 1 1 1 467 1 1 33 ARG HH12 H 0.087 8.472 0.172 1.00 . A A . 33 ARG HH12 1 1 1 468 1 1 33 ARG HH21 H -1.682 10.605 2.255 1.00 . A A . 33 ARG HH21 1 1 1 469 1 1 33 ARG HH22 H -1.176 10.288 0.630 1.00 . A A . 33 ARG HH22 1 1 1 470 1 1 33 ARG N N 4.495 6.202 5.453 1.00 . A A . 33 ARG N 1 1 1 471 1 1 33 ARG NE N -0.581 8.635 3.264 1.00 . A A . 33 ARG NE 1 1 1 472 1 1 33 ARG NH1 N 0.075 8.219 1.140 1.00 . A A . 33 ARG NH1 1 1 1 473 1 1 33 ARG NH2 N -1.190 10.036 1.597 1.00 . A A . 33 ARG NH2 1 1 1 474 1 1 33 ARG O O 5.709 7.895 3.717 1.00 . A A . 33 ARG O 1 1 1 475 1 1 34 SER C C 5.655 10.001 2.255 1.00 . A A . 34 SER C 1 1 1 476 1 1 34 SER CA C 4.748 9.049 1.469 1.00 . A A . 34 SER CA 1 1 1 477 1 1 34 SER CB C 3.692 9.834 0.693 1.00 . A A . 34 SER CB 1 1 1 478 1 1 34 SER H H 3.029 7.978 2.214 1.00 . A A . 34 SER H 1 1 1 479 1 1 34 SER HA H 5.332 8.448 0.789 1.00 . A A . 34 SER HA 1 1 1 480 1 1 34 SER HB2 H 4.144 10.703 0.244 1.00 . A A . 34 SER HB2 1 1 1 481 1 1 34 SER HB3 H 3.276 9.205 -0.085 1.00 . A A . 34 SER HB3 1 1 1 482 1 1 34 SER HG H 1.869 9.755 1.371 1.00 . A A . 34 SER HG 1 1 1 483 1 1 34 SER N N 3.971 8.178 2.400 1.00 . A A . 34 SER N 1 1 1 484 1 1 34 SER O O 6.841 10.093 2.005 1.00 . A A . 34 SER O 1 1 1 485 1 1 34 SER OG O 2.665 10.248 1.585 1.00 . A A . 34 SER OG 1 1 1 486 1 1 35 GLU C C 7.260 11.006 4.398 1.00 . A A . 35 GLU C 1 1 1 487 1 1 35 GLU CA C 5.933 11.659 4.003 1.00 . A A . 35 GLU CA 1 1 1 488 1 1 35 GLU CB C 5.095 11.957 5.248 1.00 . A A . 35 GLU CB 1 1 1 489 1 1 35 GLU CD C 5.855 14.321 5.539 1.00 . A A . 35 GLU CD 1 1 1 490 1 1 35 GLU CG C 4.656 13.422 5.233 1.00 . A A . 35 GLU CG 1 1 1 491 1 1 35 GLU H H 4.147 10.622 3.385 1.00 . A A . 35 GLU H 1 1 1 492 1 1 35 GLU HA H 6.108 12.568 3.451 1.00 . A A . 35 GLU HA 1 1 1 493 1 1 35 GLU HB2 H 4.223 11.319 5.254 1.00 . A A . 35 GLU HB2 1 1 1 494 1 1 35 GLU HB3 H 5.685 11.768 6.132 1.00 . A A . 35 GLU HB3 1 1 1 495 1 1 35 GLU HG2 H 4.259 13.668 4.260 1.00 . A A . 35 GLU HG2 1 1 1 496 1 1 35 GLU HG3 H 3.894 13.575 5.983 1.00 . A A . 35 GLU HG3 1 1 1 497 1 1 35 GLU N N 5.106 10.711 3.201 1.00 . A A . 35 GLU N 1 1 1 498 1 1 35 GLU O O 8.257 11.673 4.590 1.00 . A A . 35 GLU O 1 1 1 499 1 1 35 GLU OE1 O 6.538 14.054 6.514 1.00 . A A . 35 GLU OE1 1 1 1 500 1 1 35 GLU OE2 O 6.070 15.262 4.793 1.00 . A A . 35 GLU OE2 1 1 1 501 1 1 36 GLU C C 9.250 8.468 3.670 1.00 . A A . 36 GLU C 1 1 1 502 1 1 36 GLU CA C 8.543 9.017 4.911 1.00 . A A . 36 GLU CA 1 1 1 503 1 1 36 GLU CB C 8.105 7.877 5.831 1.00 . A A . 36 GLU CB 1 1 1 504 1 1 36 GLU CD C 9.693 8.339 7.705 1.00 . A A . 36 GLU CD 1 1 1 505 1 1 36 GLU CG C 8.221 8.325 7.289 1.00 . A A . 36 GLU CG 1 1 1 506 1 1 36 GLU H H 6.464 9.187 4.367 1.00 . A A . 36 GLU H 1 1 1 507 1 1 36 GLU HA H 9.192 9.693 5.446 1.00 . A A . 36 GLU HA 1 1 1 508 1 1 36 GLU HB2 H 7.080 7.614 5.614 1.00 . A A . 36 GLU HB2 1 1 1 509 1 1 36 GLU HB3 H 8.740 7.020 5.668 1.00 . A A . 36 GLU HB3 1 1 1 510 1 1 36 GLU HG2 H 7.806 9.317 7.395 1.00 . A A . 36 GLU HG2 1 1 1 511 1 1 36 GLU HG3 H 7.677 7.638 7.920 1.00 . A A . 36 GLU HG3 1 1 1 512 1 1 36 GLU N N 7.280 9.708 4.524 1.00 . A A . 36 GLU N 1 1 1 513 1 1 36 GLU O O 10.461 8.484 3.578 1.00 . A A . 36 GLU O 1 1 1 514 1 1 36 GLU OE1 O 10.221 7.273 7.978 1.00 . A A . 36 GLU OE1 1 1 1 515 1 1 36 GLU OE2 O 10.267 9.415 7.744 1.00 . A A . 36 GLU OE2 1 1 1 516 1 1 37 CYS C C 9.722 8.580 0.637 1.00 . A A . 37 CYS C 1 1 1 517 1 1 37 CYS CA C 9.145 7.438 1.480 1.00 . A A . 37 CYS CA 1 1 1 518 1 1 37 CYS CB C 8.021 6.728 0.722 1.00 . A A . 37 CYS CB 1 1 1 519 1 1 37 CYS H H 7.528 7.981 2.804 1.00 . A A . 37 CYS H 1 1 1 520 1 1 37 CYS HA H 9.918 6.732 1.738 1.00 . A A . 37 CYS HA 1 1 1 521 1 1 37 CYS HB2 H 7.294 7.455 0.391 1.00 . A A . 37 CYS HB2 1 1 1 522 1 1 37 CYS HB3 H 8.433 6.217 -0.136 1.00 . A A . 37 CYS HB3 1 1 1 523 1 1 37 CYS N N 8.505 7.984 2.713 1.00 . A A . 37 CYS N 1 1 1 524 1 1 37 CYS O O 8.997 9.364 0.058 1.00 . A A . 37 CYS O 1 1 1 525 1 1 37 CYS SG S 7.220 5.525 1.812 1.00 . A A . 37 CYS SG 1 1 1 526 1 1 38 LEU C C 11.552 9.431 -1.737 1.00 . A A . 38 LEU C 1 1 1 527 1 1 38 LEU CA C 11.640 9.768 -0.247 1.00 . A A . 38 LEU CA 1 1 1 528 1 1 38 LEU CB C 13.098 9.818 0.210 1.00 . A A . 38 LEU CB 1 1 1 529 1 1 38 LEU CD1 C 14.581 10.189 2.187 1.00 . A A . 38 LEU CD1 1 1 1 530 1 1 38 LEU CD2 C 12.229 11.029 2.212 1.00 . A A . 38 LEU CD2 1 1 1 531 1 1 38 LEU CG C 13.148 9.902 1.736 1.00 . A A . 38 LEU CG 1 1 1 532 1 1 38 LEU H H 11.590 8.035 1.034 1.00 . A A . 38 LEU H 1 1 1 533 1 1 38 LEU HA H 11.158 10.710 -0.043 1.00 . A A . 38 LEU HA 1 1 1 534 1 1 38 LEU HB2 H 13.610 8.926 -0.120 1.00 . A A . 38 LEU HB2 1 1 1 535 1 1 38 LEU HB3 H 13.579 10.687 -0.212 1.00 . A A . 38 LEU HB3 1 1 1 536 1 1 38 LEU HD11 H 14.863 11.184 1.878 1.00 . A A . 38 LEU HD11 1 1 1 537 1 1 38 LEU HD12 H 15.250 9.469 1.739 1.00 . A A . 38 LEU HD12 1 1 1 538 1 1 38 LEU HD13 H 14.641 10.115 3.263 1.00 . A A . 38 LEU HD13 1 1 1 539 1 1 38 LEU HD21 H 12.236 11.066 3.292 1.00 . A A . 38 LEU HD21 1 1 1 540 1 1 38 LEU HD22 H 11.223 10.845 1.865 1.00 . A A . 38 LEU HD22 1 1 1 541 1 1 38 LEU HD23 H 12.580 11.971 1.817 1.00 . A A . 38 LEU HD23 1 1 1 542 1 1 38 LEU HG H 12.819 8.963 2.159 1.00 . A A . 38 LEU HG 1 1 1 543 1 1 38 LEU N N 11.021 8.678 0.561 1.00 . A A . 38 LEU N 1 1 1 544 1 1 38 LEU O O 11.835 10.251 -2.588 1.00 . A A . 38 LEU O 1 1 1 545 1 1 39 SER C C 9.650 8.173 -4.022 1.00 . A A . 39 SER C 1 1 1 546 1 1 39 SER CA C 11.046 7.839 -3.494 1.00 . A A . 39 SER CA 1 1 1 547 1 1 39 SER CB C 11.273 6.328 -3.512 1.00 . A A . 39 SER CB 1 1 1 548 1 1 39 SER H H 10.931 7.583 -1.357 1.00 . A A . 39 SER H 1 1 1 549 1 1 39 SER HA H 11.802 8.334 -4.081 1.00 . A A . 39 SER HA 1 1 1 550 1 1 39 SER HB2 H 11.787 6.029 -2.614 1.00 . A A . 39 SER HB2 1 1 1 551 1 1 39 SER HB3 H 10.316 5.824 -3.560 1.00 . A A . 39 SER HB3 1 1 1 552 1 1 39 SER HG H 12.531 6.765 -4.933 1.00 . A A . 39 SER HG 1 1 1 553 1 1 39 SER N N 11.157 8.229 -2.059 1.00 . A A . 39 SER N 1 1 1 554 1 1 39 SER O O 9.436 8.285 -5.212 1.00 . A A . 39 SER O 1 1 1 555 1 1 39 SER OG O 12.062 5.980 -4.643 1.00 . A A . 39 SER OG 1 1 1 556 1 1 40 GLY C C 6.532 7.346 -3.791 1.00 . A A . 40 GLY C 1 1 1 557 1 1 40 GLY CA C 7.315 8.646 -3.595 1.00 . A A . 40 GLY CA 1 1 1 558 1 1 40 GLY H H 8.891 8.228 -2.189 1.00 . A A . 40 GLY H 1 1 1 559 1 1 40 GLY HA2 H 6.825 9.255 -2.848 1.00 . A A . 40 GLY HA2 1 1 1 560 1 1 40 GLY HA3 H 7.355 9.183 -4.530 1.00 . A A . 40 GLY HA3 1 1 1 561 1 1 40 GLY N N 8.698 8.327 -3.144 1.00 . A A . 40 GLY N 1 1 1 562 1 1 40 GLY O O 5.353 7.359 -4.084 1.00 . A A . 40 GLY O 1 1 1 563 1 1 41 THR C C 5.892 4.453 -2.467 1.00 . A A . 41 THR C 1 1 1 564 1 1 41 THR CA C 6.470 4.923 -3.805 1.00 . A A . 41 THR CA 1 1 1 565 1 1 41 THR CB C 7.543 3.951 -4.298 1.00 . A A . 41 THR CB 1 1 1 566 1 1 41 THR CG2 C 8.565 3.708 -3.186 1.00 . A A . 41 THR CG2 1 1 1 567 1 1 41 THR H H 8.129 6.233 -3.391 1.00 . A A . 41 THR H 1 1 1 568 1 1 41 THR HA H 5.689 5.015 -4.543 1.00 . A A . 41 THR HA 1 1 1 569 1 1 41 THR HB H 8.045 4.372 -5.155 1.00 . A A . 41 THR HB 1 1 1 570 1 1 41 THR HG1 H 6.253 2.525 -4.013 1.00 . A A . 41 THR HG1 1 1 1 571 1 1 41 THR HG21 H 8.693 4.613 -2.610 1.00 . A A . 41 THR HG21 1 1 1 572 1 1 41 THR HG22 H 9.511 3.422 -3.622 1.00 . A A . 41 THR HG22 1 1 1 573 1 1 41 THR HG23 H 8.213 2.917 -2.540 1.00 . A A . 41 THR HG23 1 1 1 574 1 1 41 THR N N 7.178 6.222 -3.629 1.00 . A A . 41 THR N 1 1 1 575 1 1 41 THR O O 6.576 4.414 -1.465 1.00 . A A . 41 THR O 1 1 1 576 1 1 41 THR OG1 O 6.933 2.721 -4.661 1.00 . A A . 41 THR OG1 1 1 1 577 1 1 42 TRP C C 3.136 2.410 -1.449 1.00 . A A . 42 TRP C 1 1 1 578 1 1 42 TRP CA C 4.010 3.636 -1.175 1.00 . A A . 42 TRP CA 1 1 1 579 1 1 42 TRP CB C 3.154 4.818 -0.717 1.00 . A A . 42 TRP CB 1 1 1 580 1 1 42 TRP CD1 C 3.190 4.482 1.787 1.00 . A A . 42 TRP CD1 1 1 1 581 1 1 42 TRP CD2 C 1.138 4.201 0.905 1.00 . A A . 42 TRP CD2 1 1 1 582 1 1 42 TRP CE2 C 1.013 3.990 2.298 1.00 . A A . 42 TRP CE2 1 1 1 583 1 1 42 TRP CE3 C -0.016 4.082 0.110 1.00 . A A . 42 TRP CE3 1 1 1 584 1 1 42 TRP CG C 2.530 4.513 0.606 1.00 . A A . 42 TRP CG 1 1 1 585 1 1 42 TRP CH2 C -1.351 3.558 2.078 1.00 . A A . 42 TRP CH2 1 1 1 586 1 1 42 TRP CZ2 C -0.215 3.673 2.882 1.00 . A A . 42 TRP CZ2 1 1 1 587 1 1 42 TRP CZ3 C -1.253 3.762 0.695 1.00 . A A . 42 TRP CZ3 1 1 1 588 1 1 42 TRP H H 4.104 4.142 -3.267 1.00 . A A . 42 TRP H 1 1 1 589 1 1 42 TRP HA H 4.763 3.413 -0.436 1.00 . A A . 42 TRP HA 1 1 1 590 1 1 42 TRP HB2 H 3.775 5.697 -0.626 1.00 . A A . 42 TRP HB2 1 1 1 591 1 1 42 TRP HB3 H 2.377 5.001 -1.446 1.00 . A A . 42 TRP HB3 1 1 1 592 1 1 42 TRP HD1 H 4.245 4.669 1.922 1.00 . A A . 42 TRP HD1 1 1 1 593 1 1 42 TRP HE1 H 2.515 4.087 3.743 1.00 . A A . 42 TRP HE1 1 1 1 594 1 1 42 TRP HE3 H 0.049 4.236 -0.956 1.00 . A A . 42 TRP HE3 1 1 1 595 1 1 42 TRP HH2 H -2.305 3.313 2.522 1.00 . A A . 42 TRP HH2 1 1 1 596 1 1 42 TRP HZ2 H -0.286 3.518 3.949 1.00 . A A . 42 TRP HZ2 1 1 1 597 1 1 42 TRP HZ3 H -2.132 3.671 0.076 1.00 . A A . 42 TRP HZ3 1 1 1 598 1 1 42 TRP N N 4.638 4.100 -2.446 1.00 . A A . 42 TRP N 1 1 1 599 1 1 42 TRP NE1 N 2.291 4.172 2.792 1.00 . A A . 42 TRP NE1 1 1 1 600 1 1 42 TRP O O 2.200 2.469 -2.220 1.00 . A A . 42 TRP O 1 1 1 601 1 1 43 THR C C 1.802 -0.301 0.167 1.00 . A A . 43 THR C 1 1 1 602 1 1 43 THR CA C 2.601 0.080 -1.084 1.00 . A A . 43 THR CA 1 1 1 603 1 1 43 THR CB C 3.593 -1.028 -1.459 1.00 . A A . 43 THR CB 1 1 1 604 1 1 43 THR CG2 C 4.644 -1.183 -0.361 1.00 . A A . 43 THR CG2 1 1 1 605 1 1 43 THR H H 4.191 1.255 -0.213 1.00 . A A . 43 THR H 1 1 1 606 1 1 43 THR HA H 1.929 0.258 -1.909 1.00 . A A . 43 THR HA 1 1 1 607 1 1 43 THR HB H 4.083 -0.772 -2.385 1.00 . A A . 43 THR HB 1 1 1 608 1 1 43 THR HG1 H 3.043 -2.568 -2.513 1.00 . A A . 43 THR HG1 1 1 1 609 1 1 43 THR HG21 H 4.154 -1.322 0.591 1.00 . A A . 43 THR HG21 1 1 1 610 1 1 43 THR HG22 H 5.259 -0.295 -0.323 1.00 . A A . 43 THR HG22 1 1 1 611 1 1 43 THR HG23 H 5.264 -2.041 -0.575 1.00 . A A . 43 THR HG23 1 1 1 612 1 1 43 THR N N 3.430 1.294 -0.833 1.00 . A A . 43 THR N 1 1 1 613 1 1 43 THR O O 2.335 -0.418 1.257 1.00 . A A . 43 THR O 1 1 1 614 1 1 43 THR OG1 O 2.892 -2.253 -1.618 1.00 . A A . 43 THR OG1 1 1 1 615 1 1 44 GLN C C -0.963 -2.246 0.914 1.00 . A A . 44 GLN C 1 1 1 616 1 1 44 GLN CA C -0.333 -0.874 1.169 1.00 . A A . 44 GLN CA 1 1 1 617 1 1 44 GLN CB C -1.406 0.214 1.240 1.00 . A A . 44 GLN CB 1 1 1 618 1 1 44 GLN CD C -2.277 1.015 3.442 1.00 . A A . 44 GLN CD 1 1 1 619 1 1 44 GLN CG C -2.372 -0.090 2.387 1.00 . A A . 44 GLN CG 1 1 1 620 1 1 44 GLN H H 0.120 -0.396 -0.880 1.00 . A A . 44 GLN H 1 1 1 621 1 1 44 GLN HA H 0.246 -0.885 2.078 1.00 . A A . 44 GLN HA 1 1 1 622 1 1 44 GLN HB2 H -0.936 1.171 1.409 1.00 . A A . 44 GLN HB2 1 1 1 623 1 1 44 GLN HB3 H -1.954 0.242 0.309 1.00 . A A . 44 GLN HB3 1 1 1 624 1 1 44 GLN HE21 H -4.166 1.588 3.219 1.00 . A A . 44 GLN HE21 1 1 1 625 1 1 44 GLN HE22 H -3.275 2.457 4.373 1.00 . A A . 44 GLN HE22 1 1 1 626 1 1 44 GLN HG2 H -3.381 -0.138 2.004 1.00 . A A . 44 GLN HG2 1 1 1 627 1 1 44 GLN HG3 H -2.112 -1.035 2.834 1.00 . A A . 44 GLN HG3 1 1 1 628 1 1 44 GLN N N 0.522 -0.496 0.009 1.00 . A A . 44 GLN N 1 1 1 629 1 1 44 GLN NE2 N -3.326 1.747 3.699 1.00 . A A . 44 GLN NE2 1 1 1 630 1 1 44 GLN O O -2.061 -2.530 1.350 1.00 . A A . 44 GLN O 1 1 1 631 1 1 44 GLN OE1 O -1.237 1.213 4.038 1.00 . A A . 44 GLN OE1 1 1 1 632 1 1 45 GLN C C 0.331 -5.453 -0.276 1.00 . A A . 45 GLN C 1 1 1 633 1 1 45 GLN CA C -0.816 -4.455 -0.092 1.00 . A A . 45 GLN CA 1 1 1 634 1 1 45 GLN CB C -1.592 -4.291 -1.398 1.00 . A A . 45 GLN CB 1 1 1 635 1 1 45 GLN CD C -1.292 -2.495 -3.110 1.00 . A A . 45 GLN CD 1 1 1 636 1 1 45 GLN CG C -0.660 -3.735 -2.477 1.00 . A A . 45 GLN CG 1 1 1 637 1 1 45 GLN H H 0.611 -2.843 -0.138 1.00 . A A . 45 GLN H 1 1 1 638 1 1 45 GLN HA H -1.479 -4.777 0.695 1.00 . A A . 45 GLN HA 1 1 1 639 1 1 45 GLN HB2 H -1.975 -5.251 -1.712 1.00 . A A . 45 GLN HB2 1 1 1 640 1 1 45 GLN HB3 H -2.412 -3.606 -1.247 1.00 . A A . 45 GLN HB3 1 1 1 641 1 1 45 GLN HE21 H 0.425 -1.816 -3.839 1.00 . A A . 45 GLN HE21 1 1 1 642 1 1 45 GLN HE22 H -0.934 -0.854 -4.167 1.00 . A A . 45 GLN HE22 1 1 1 643 1 1 45 GLN HG2 H 0.288 -3.469 -2.030 1.00 . A A . 45 GLN HG2 1 1 1 644 1 1 45 GLN HG3 H -0.502 -4.485 -3.237 1.00 . A A . 45 GLN HG3 1 1 1 645 1 1 45 GLN N N -0.271 -3.098 0.203 1.00 . A A . 45 GLN N 1 1 1 646 1 1 45 GLN NE2 N -0.538 -1.652 -3.759 1.00 . A A . 45 GLN NE2 1 1 1 647 1 1 45 GLN O O 1.003 -5.457 -1.289 1.00 . A A . 45 GLN O 1 1 1 648 1 1 45 GLN OE1 O -2.486 -2.292 -3.012 1.00 . A A . 45 GLN OE1 1 1 1 649 1 1 46 ILE C C 1.288 -8.606 1.236 1.00 . A A . 46 ILE C 1 1 1 650 1 1 46 ILE CA C 1.673 -7.286 0.563 1.00 . A A . 46 ILE CA 1 1 1 651 1 1 46 ILE CB C 2.863 -6.647 1.281 1.00 . A A . 46 ILE CB 1 1 1 652 1 1 46 ILE CD1 C 3.723 -5.613 -0.827 1.00 . A A . 46 ILE CD1 1 1 1 653 1 1 46 ILE CG1 C 3.232 -5.330 0.594 1.00 . A A . 46 ILE CG1 1 1 1 654 1 1 46 ILE CG2 C 4.061 -7.597 1.229 1.00 . A A . 46 ILE CG2 1 1 1 655 1 1 46 ILE H H 0.015 -6.277 1.503 1.00 . A A . 46 ILE H 1 1 1 656 1 1 46 ILE HA H 1.913 -7.449 -0.475 1.00 . A A . 46 ILE HA 1 1 1 657 1 1 46 ILE HB H 2.601 -6.456 2.312 1.00 . A A . 46 ILE HB 1 1 1 658 1 1 46 ILE HD11 H 3.464 -6.624 -1.103 1.00 . A A . 46 ILE HD11 1 1 1 659 1 1 46 ILE HD12 H 4.796 -5.493 -0.867 1.00 . A A . 46 ILE HD12 1 1 1 660 1 1 46 ILE HD13 H 3.258 -4.922 -1.513 1.00 . A A . 46 ILE HD13 1 1 1 661 1 1 46 ILE HG12 H 2.365 -4.688 0.555 1.00 . A A . 46 ILE HG12 1 1 1 662 1 1 46 ILE HG13 H 4.016 -4.841 1.152 1.00 . A A . 46 ILE HG13 1 1 1 663 1 1 46 ILE HG21 H 3.982 -8.319 2.027 1.00 . A A . 46 ILE HG21 1 1 1 664 1 1 46 ILE HG22 H 4.974 -7.031 1.343 1.00 . A A . 46 ILE HG22 1 1 1 665 1 1 46 ILE HG23 H 4.072 -8.110 0.279 1.00 . A A . 46 ILE HG23 1 1 1 666 1 1 46 ILE N N 0.565 -6.296 0.692 1.00 . A A . 46 ILE N 1 1 1 667 1 1 46 ILE O O 1.442 -9.670 0.670 1.00 . A A . 46 ILE O 1 1 1 668 1 1 47 CYS C C -0.920 -10.336 2.593 1.00 . A A . 47 CYS C 1 1 1 669 1 1 47 CYS CA C 0.401 -9.799 3.149 1.00 . A A . 47 CYS CA 1 1 1 670 1 1 47 CYS CB C 0.240 -9.392 4.613 1.00 . A A . 47 CYS CB 1 1 1 671 1 1 47 CYS H H 0.677 -7.679 2.881 1.00 . A A . 47 CYS H 1 1 1 672 1 1 47 CYS HA H 1.177 -10.541 3.056 1.00 . A A . 47 CYS HA 1 1 1 673 1 1 47 CYS HB2 H -0.485 -8.595 4.688 1.00 . A A . 47 CYS HB2 1 1 1 674 1 1 47 CYS HB3 H -0.097 -10.241 5.188 1.00 . A A . 47 CYS HB3 1 1 1 675 1 1 47 CYS N N 0.791 -8.546 2.441 1.00 . A A . 47 CYS N 1 1 1 676 1 1 47 CYS O O -1.709 -9.607 2.025 1.00 . A A . 47 CYS O 1 1 1 677 1 1 47 CYS SG S 1.832 -8.823 5.255 1.00 . A A . 47 CYS SG 1 1 1 678 1 1 48 LEU C C -3.351 -12.580 3.401 1.00 . A A . 48 LEU C 1 1 1 679 1 1 48 LEU CA C -2.435 -12.194 2.237 1.00 . A A . 48 LEU CA 1 1 1 680 1 1 48 LEU CB C -2.005 -13.437 1.457 1.00 . A A . 48 LEU CB 1 1 1 681 1 1 48 LEU CD1 C -0.428 -14.089 -0.369 1.00 . A A . 48 LEU CD1 1 1 1 682 1 1 48 LEU CD2 C -2.522 -12.838 -0.910 1.00 . A A . 48 LEU CD2 1 1 1 683 1 1 48 LEU CG C -1.402 -13.013 0.117 1.00 . A A . 48 LEU CG 1 1 1 684 1 1 48 LEU H H -0.516 -12.176 3.216 1.00 . A A . 48 LEU H 1 1 1 685 1 1 48 LEU HA H -2.932 -11.499 1.579 1.00 . A A . 48 LEU HA 1 1 1 686 1 1 48 LEU HB2 H -1.270 -13.984 2.028 1.00 . A A . 48 LEU HB2 1 1 1 687 1 1 48 LEU HB3 H -2.865 -14.065 1.280 1.00 . A A . 48 LEU HB3 1 1 1 688 1 1 48 LEU HD11 H -0.910 -14.699 -1.118 1.00 . A A . 48 LEU HD11 1 1 1 689 1 1 48 LEU HD12 H -0.131 -14.709 0.464 1.00 . A A . 48 LEU HD12 1 1 1 690 1 1 48 LEU HD13 H 0.445 -13.617 -0.797 1.00 . A A . 48 LEU HD13 1 1 1 691 1 1 48 LEU HD21 H -3.022 -13.783 -1.061 1.00 . A A . 48 LEU HD21 1 1 1 692 1 1 48 LEU HD22 H -2.103 -12.498 -1.845 1.00 . A A . 48 LEU HD22 1 1 1 693 1 1 48 LEU HD23 H -3.231 -12.110 -0.547 1.00 . A A . 48 LEU HD23 1 1 1 694 1 1 48 LEU HG H -0.874 -12.079 0.240 1.00 . A A . 48 LEU HG 1 1 1 695 1 1 48 LEU N N -1.166 -11.607 2.754 1.00 . A A . 48 LEU N 1 1 1 696 1 1 48 LEU O O -3.976 -13.624 3.317 1.00 . A A . 48 LEU O 1 1 1 697 1 1 48 LEU OXT O -3.411 -11.825 4.358 1.00 . A A . 48 LEU OXT 1 1 2 698 1 1 1 GLY C C 0.727 0.596 23.823 1.00 . A A . 1 GLY C 1 1 2 699 1 1 1 GLY CA C 1.938 0.632 24.758 1.00 . A A . 1 GLY CA 1 1 2 700 1 1 1 GLY H1 H 2.209 2.495 23.867 1.00 . A A . 1 GLY H1 1 1 2 701 1 1 1 GLY H2 H 3.616 1.850 24.567 1.00 . A A . 1 GLY H2 1 1 2 702 1 1 1 GLY H3 H 2.397 2.501 25.553 1.00 . A A . 1 GLY H3 1 1 2 703 1 1 1 GLY HA2 H 2.646 -0.130 24.462 1.00 . A A . 1 GLY HA2 1 1 2 704 1 1 1 GLY HA3 H 1.612 0.448 25.771 1.00 . A A . 1 GLY HA3 1 1 2 705 1 1 1 GLY N N 2.589 1.971 24.681 1.00 . A A . 1 GLY N 1 1 2 706 1 1 1 GLY O O 0.444 -0.406 23.198 1.00 . A A . 1 GLY O 1 1 2 707 1 1 2 SER C C -0.745 1.973 21.381 1.00 . A A . 2 SER C 1 1 2 708 1 1 2 SER CA C -1.180 1.708 22.825 1.00 . A A . 2 SER CA 1 1 2 709 1 1 2 SER CB C -2.044 2.854 23.348 1.00 . A A . 2 SER CB 1 1 2 710 1 1 2 SER H H 0.256 2.481 24.234 1.00 . A A . 2 SER H 1 1 2 711 1 1 2 SER HA H -1.721 0.778 22.891 1.00 . A A . 2 SER HA 1 1 2 712 1 1 2 SER HB2 H -2.542 2.547 24.253 1.00 . A A . 2 SER HB2 1 1 2 713 1 1 2 SER HB3 H -1.415 3.711 23.557 1.00 . A A . 2 SER HB3 1 1 2 714 1 1 2 SER HG H -3.563 2.418 22.214 1.00 . A A . 2 SER HG 1 1 2 715 1 1 2 SER N N 0.011 1.682 23.722 1.00 . A A . 2 SER N 1 1 2 716 1 1 2 SER O O 0.403 2.267 21.114 1.00 . A A . 2 SER O 1 1 2 717 1 1 2 SER OG O -3.018 3.192 22.369 1.00 . A A . 2 SER OG 1 1 2 718 1 1 3 ALA C C -1.657 3.533 18.605 1.00 . A A . 3 ALA C 1 1 2 719 1 1 3 ALA CA C -1.283 2.109 19.023 1.00 . A A . 3 ALA CA 1 1 2 720 1 1 3 ALA CB C -2.094 1.090 18.226 1.00 . A A . 3 ALA CB 1 1 2 721 1 1 3 ALA H H -2.572 1.626 20.682 1.00 . A A . 3 ALA H 1 1 2 722 1 1 3 ALA HA H -0.229 1.938 18.874 1.00 . A A . 3 ALA HA 1 1 2 723 1 1 3 ALA HB1 H -3.003 1.551 17.872 1.00 . A A . 3 ALA HB1 1 1 2 724 1 1 3 ALA HB2 H -2.340 0.249 18.858 1.00 . A A . 3 ALA HB2 1 1 2 725 1 1 3 ALA HB3 H -1.513 0.748 17.382 1.00 . A A . 3 ALA HB3 1 1 2 726 1 1 3 ALA N N -1.651 1.867 20.448 1.00 . A A . 3 ALA N 1 1 2 727 1 1 3 ALA O O -2.813 3.907 18.603 1.00 . A A . 3 ALA O 1 1 2 728 1 1 4 MET C C -0.744 5.864 16.309 1.00 . A A . 4 MET C 1 1 2 729 1 1 4 MET CA C -0.985 5.723 17.813 1.00 . A A . 4 MET CA 1 1 2 730 1 1 4 MET CB C -0.009 6.600 18.598 1.00 . A A . 4 MET CB 1 1 2 731 1 1 4 MET CE C 4.100 6.578 18.458 1.00 . A A . 4 MET CE 1 1 2 732 1 1 4 MET CG C 1.417 6.352 18.101 1.00 . A A . 4 MET CG 1 1 2 733 1 1 4 MET H H 0.238 4.002 18.244 1.00 . A A . 4 MET H 1 1 2 734 1 1 4 MET HA H -2.002 5.987 18.059 1.00 . A A . 4 MET HA 1 1 2 735 1 1 4 MET HB2 H -0.266 7.641 18.455 1.00 . A A . 4 MET HB2 1 1 2 736 1 1 4 MET HB3 H -0.069 6.356 19.649 1.00 . A A . 4 MET HB3 1 1 2 737 1 1 4 MET HE1 H 3.856 6.259 17.454 1.00 . A A . 4 MET HE1 1 1 2 738 1 1 4 MET HE2 H 4.785 5.872 18.900 1.00 . A A . 4 MET HE2 1 1 2 739 1 1 4 MET HE3 H 4.561 7.555 18.430 1.00 . A A . 4 MET HE3 1 1 2 740 1 1 4 MET HG2 H 1.508 5.329 17.767 1.00 . A A . 4 MET HG2 1 1 2 741 1 1 4 MET HG3 H 1.633 7.020 17.281 1.00 . A A . 4 MET HG3 1 1 2 742 1 1 4 MET N N -0.687 4.326 18.242 1.00 . A A . 4 MET N 1 1 2 743 1 1 4 MET O O -0.648 6.956 15.781 1.00 . A A . 4 MET O 1 1 2 744 1 1 4 MET SD S 2.587 6.655 19.449 1.00 . A A . 4 MET SD 1 1 2 745 1 1 5 GLY C C 0.253 3.519 13.686 1.00 . A A . 5 GLY C 1 1 2 746 1 1 5 GLY CA C -0.404 4.822 14.145 1.00 . A A . 5 GLY CA 1 1 2 747 1 1 5 GLY H H -0.721 3.896 16.063 1.00 . A A . 5 GLY H 1 1 2 748 1 1 5 GLY HA2 H -1.347 4.954 13.632 1.00 . A A . 5 GLY HA2 1 1 2 749 1 1 5 GLY HA3 H 0.250 5.650 13.918 1.00 . A A . 5 GLY HA3 1 1 2 750 1 1 5 GLY N N -0.642 4.764 15.615 1.00 . A A . 5 GLY N 1 1 2 751 1 1 5 GLY O O 1.142 3.001 14.331 1.00 . A A . 5 GLY O 1 1 2 752 1 1 6 CYS C C 1.953 1.820 12.048 1.00 . A A . 6 CYS C 1 1 2 753 1 1 6 CYS CA C 0.424 1.710 12.081 1.00 . A A . 6 CYS CA 1 1 2 754 1 1 6 CYS CB C -0.133 1.519 10.666 1.00 . A A . 6 CYS CB 1 1 2 755 1 1 6 CYS H H -0.897 3.416 12.072 1.00 . A A . 6 CYS H 1 1 2 756 1 1 6 CYS HA H 0.122 0.886 12.707 1.00 . A A . 6 CYS HA 1 1 2 757 1 1 6 CYS HB2 H 0.446 0.767 10.152 1.00 . A A . 6 CYS HB2 1 1 2 758 1 1 6 CYS HB3 H -1.164 1.198 10.729 1.00 . A A . 6 CYS HB3 1 1 2 759 1 1 6 CYS N N -0.178 2.983 12.577 1.00 . A A . 6 CYS N 1 1 2 760 1 1 6 CYS O O 2.652 0.828 12.020 1.00 . A A . 6 CYS O 1 1 2 761 1 1 6 CYS SG S -0.043 3.079 9.751 1.00 . A A . 6 CYS SG 1 1 2 762 1 1 7 ARG C C 4.605 2.395 13.173 1.00 . A A . 7 ARG C 1 1 2 763 1 1 7 ARG CA C 3.961 3.178 12.025 1.00 . A A . 7 ARG CA 1 1 2 764 1 1 7 ARG CB C 4.200 4.677 12.205 1.00 . A A . 7 ARG CB 1 1 2 765 1 1 7 ARG CD C 4.211 6.740 10.797 1.00 . A A . 7 ARG CD 1 1 2 766 1 1 7 ARG CG C 3.447 5.454 11.123 1.00 . A A . 7 ARG CG 1 1 2 767 1 1 7 ARG CZ C 2.091 7.872 10.501 1.00 . A A . 7 ARG CZ 1 1 2 768 1 1 7 ARG H H 1.899 3.806 12.075 1.00 . A A . 7 ARG H 1 1 2 769 1 1 7 ARG HA H 4.357 2.853 11.076 1.00 . A A . 7 ARG HA 1 1 2 770 1 1 7 ARG HB2 H 3.847 4.983 13.179 1.00 . A A . 7 ARG HB2 1 1 2 771 1 1 7 ARG HB3 H 5.256 4.885 12.124 1.00 . A A . 7 ARG HB3 1 1 2 772 1 1 7 ARG HD2 H 5.089 6.823 11.422 1.00 . A A . 7 ARG HD2 1 1 2 773 1 1 7 ARG HD3 H 4.487 6.760 9.754 1.00 . A A . 7 ARG HD3 1 1 2 774 1 1 7 ARG HE H 3.498 8.544 11.730 1.00 . A A . 7 ARG HE 1 1 2 775 1 1 7 ARG HG2 H 3.366 4.845 10.234 1.00 . A A . 7 ARG HG2 1 1 2 776 1 1 7 ARG HG3 H 2.460 5.705 11.480 1.00 . A A . 7 ARG HG3 1 1 2 777 1 1 7 ARG HH11 H 2.838 7.493 8.683 1.00 . A A . 7 ARG HH11 1 1 2 778 1 1 7 ARG HH12 H 1.120 7.694 8.759 1.00 . A A . 7 ARG HH12 1 1 2 779 1 1 7 ARG HH21 H 1.073 8.249 12.183 1.00 . A A . 7 ARG HH21 1 1 2 780 1 1 7 ARG HH22 H 0.120 8.123 10.742 1.00 . A A . 7 ARG HH22 1 1 2 781 1 1 7 ARG N N 2.477 3.016 12.053 1.00 . A A . 7 ARG N 1 1 2 782 1 1 7 ARG NE N 3.253 7.841 11.092 1.00 . A A . 7 ARG NE 1 1 2 783 1 1 7 ARG NH1 N 2.010 7.671 9.214 1.00 . A A . 7 ARG NH1 1 1 2 784 1 1 7 ARG NH2 N 1.011 8.098 11.196 1.00 . A A . 7 ARG NH2 1 1 2 785 1 1 7 ARG O O 5.790 2.128 13.164 1.00 . A A . 7 ARG O 1 1 2 786 1 1 8 HIS C C 4.069 -0.223 15.187 1.00 . A A . 8 HIS C 1 1 2 787 1 1 8 HIS CA C 4.417 1.269 15.310 1.00 . A A . 8 HIS CA 1 1 2 788 1 1 8 HIS CB C 3.795 1.913 16.565 1.00 . A A . 8 HIS CB 1 1 2 789 1 1 8 HIS CD2 C 1.410 0.808 16.704 1.00 . A A . 8 HIS CD2 1 1 2 790 1 1 8 HIS CE1 C 1.701 -0.347 18.513 1.00 . A A . 8 HIS CE1 1 1 2 791 1 1 8 HIS CG C 2.692 1.052 17.128 1.00 . A A . 8 HIS CG 1 1 2 792 1 1 8 HIS H H 2.884 2.257 14.158 1.00 . A A . 8 HIS H 1 1 2 793 1 1 8 HIS HA H 5.489 1.397 15.330 1.00 . A A . 8 HIS HA 1 1 2 794 1 1 8 HIS HB2 H 4.562 2.041 17.315 1.00 . A A . 8 HIS HB2 1 1 2 795 1 1 8 HIS HB3 H 3.393 2.881 16.303 1.00 . A A . 8 HIS HB3 1 1 2 796 1 1 8 HIS HD1 H 3.665 0.259 18.835 1.00 . A A . 8 HIS HD1 1 1 2 797 1 1 8 HIS HD2 H 0.955 1.237 15.823 1.00 . A A . 8 HIS HD2 1 1 2 798 1 1 8 HIS HE1 H 1.534 -1.008 19.351 1.00 . A A . 8 HIS HE1 1 1 2 799 1 1 8 HIS N N 3.838 2.029 14.165 1.00 . A A . 8 HIS N 1 1 2 800 1 1 8 HIS ND1 N 2.856 0.305 18.285 1.00 . A A . 8 HIS ND1 1 1 2 801 1 1 8 HIS NE2 N 0.786 -0.076 17.579 1.00 . A A . 8 HIS NE2 1 1 2 802 1 1 8 HIS O O 4.698 -1.067 15.793 1.00 . A A . 8 HIS O 1 1 2 803 1 1 9 PHE C C 3.951 -2.832 14.046 1.00 . A A . 9 PHE C 1 1 2 804 1 1 9 PHE CA C 2.695 -1.981 14.243 1.00 . A A . 9 PHE CA 1 1 2 805 1 1 9 PHE CB C 1.819 -2.023 12.986 1.00 . A A . 9 PHE CB 1 1 2 806 1 1 9 PHE CD1 C 0.074 -1.083 14.575 1.00 . A A . 9 PHE CD1 1 1 2 807 1 1 9 PHE CD2 C -0.510 -1.413 12.245 1.00 . A A . 9 PHE CD2 1 1 2 808 1 1 9 PHE CE1 C -1.215 -0.598 14.826 1.00 . A A . 9 PHE CE1 1 1 2 809 1 1 9 PHE CE2 C -1.799 -0.929 12.498 1.00 . A A . 9 PHE CE2 1 1 2 810 1 1 9 PHE CG C 0.429 -1.492 13.280 1.00 . A A . 9 PHE CG 1 1 2 811 1 1 9 PHE CZ C -2.151 -0.522 13.788 1.00 . A A . 9 PHE CZ 1 1 2 812 1 1 9 PHE H H 2.583 0.144 13.922 1.00 . A A . 9 PHE H 1 1 2 813 1 1 9 PHE HA H 2.137 -2.327 15.097 1.00 . A A . 9 PHE HA 1 1 2 814 1 1 9 PHE HB2 H 2.274 -1.421 12.214 1.00 . A A . 9 PHE HB2 1 1 2 815 1 1 9 PHE HB3 H 1.744 -3.044 12.641 1.00 . A A . 9 PHE HB3 1 1 2 816 1 1 9 PHE HD1 H 0.793 -1.138 15.378 1.00 . A A . 9 PHE HD1 1 1 2 817 1 1 9 PHE HD2 H -0.240 -1.727 11.249 1.00 . A A . 9 PHE HD2 1 1 2 818 1 1 9 PHE HE1 H -1.489 -0.284 15.822 1.00 . A A . 9 PHE HE1 1 1 2 819 1 1 9 PHE HE2 H -2.522 -0.871 11.696 1.00 . A A . 9 PHE HE2 1 1 2 820 1 1 9 PHE HZ H -3.146 -0.148 13.984 1.00 . A A . 9 PHE HZ 1 1 2 821 1 1 9 PHE N N 3.076 -0.550 14.404 1.00 . A A . 9 PHE N 1 1 2 822 1 1 9 PHE O O 4.976 -2.352 13.605 1.00 . A A . 9 PHE O 1 1 2 823 1 1 10 GLN C C 5.353 -5.212 12.720 1.00 . A A . 10 GLN C 1 1 2 824 1 1 10 GLN CA C 5.071 -4.974 14.207 1.00 . A A . 10 GLN CA 1 1 2 825 1 1 10 GLN CB C 4.695 -6.285 14.902 1.00 . A A . 10 GLN CB 1 1 2 826 1 1 10 GLN CD C 6.482 -7.792 15.790 1.00 . A A . 10 GLN CD 1 1 2 827 1 1 10 GLN CG C 5.713 -7.369 14.536 1.00 . A A . 10 GLN CG 1 1 2 828 1 1 10 GLN H H 3.043 -4.456 14.728 1.00 . A A . 10 GLN H 1 1 2 829 1 1 10 GLN HA H 5.930 -4.536 14.688 1.00 . A A . 10 GLN HA 1 1 2 830 1 1 10 GLN HB2 H 4.694 -6.137 15.972 1.00 . A A . 10 GLN HB2 1 1 2 831 1 1 10 GLN HB3 H 3.711 -6.594 14.580 1.00 . A A . 10 GLN HB3 1 1 2 832 1 1 10 GLN HE21 H 8.050 -6.638 15.391 1.00 . A A . 10 GLN HE21 1 1 2 833 1 1 10 GLN HE22 H 8.165 -7.551 16.816 1.00 . A A . 10 GLN HE22 1 1 2 834 1 1 10 GLN HG2 H 5.194 -8.224 14.127 1.00 . A A . 10 GLN HG2 1 1 2 835 1 1 10 GLN HG3 H 6.405 -6.983 13.805 1.00 . A A . 10 GLN HG3 1 1 2 836 1 1 10 GLN N N 3.879 -4.092 14.372 1.00 . A A . 10 GLN N 1 1 2 837 1 1 10 GLN NE2 N 7.664 -7.284 16.018 1.00 . A A . 10 GLN NE2 1 1 2 838 1 1 10 GLN O O 6.122 -4.500 12.103 1.00 . A A . 10 GLN O 1 1 2 839 1 1 10 GLN OE1 O 6.006 -8.593 16.569 1.00 . A A . 10 GLN OE1 1 1 2 840 1 1 11 SER C C 3.952 -5.785 9.826 1.00 . A A . 11 SER C 1 1 2 841 1 1 11 SER CA C 4.988 -6.499 10.698 1.00 . A A . 11 SER CA 1 1 2 842 1 1 11 SER CB C 4.839 -8.013 10.571 1.00 . A A . 11 SER CB 1 1 2 843 1 1 11 SER H H 4.135 -6.777 12.658 1.00 . A A . 11 SER H 1 1 2 844 1 1 11 SER HA H 5.986 -6.204 10.417 1.00 . A A . 11 SER HA 1 1 2 845 1 1 11 SER HB2 H 4.044 -8.354 11.213 1.00 . A A . 11 SER HB2 1 1 2 846 1 1 11 SER HB3 H 4.603 -8.266 9.546 1.00 . A A . 11 SER HB3 1 1 2 847 1 1 11 SER HG H 5.934 -8.996 11.843 1.00 . A A . 11 SER HG 1 1 2 848 1 1 11 SER N N 4.745 -6.212 12.142 1.00 . A A . 11 SER N 1 1 2 849 1 1 11 SER O O 3.210 -4.940 10.288 1.00 . A A . 11 SER O 1 1 2 850 1 1 11 SER OG O 6.054 -8.639 10.961 1.00 . A A . 11 SER OG 1 1 2 851 1 1 12 CYS C C 1.511 -6.024 7.916 1.00 . A A . 12 CYS C 1 1 2 852 1 1 12 CYS CA C 2.911 -5.468 7.657 1.00 . A A . 12 CYS CA 1 1 2 853 1 1 12 CYS CB C 3.374 -5.831 6.245 1.00 . A A . 12 CYS CB 1 1 2 854 1 1 12 CYS H H 4.507 -6.806 8.217 1.00 . A A . 12 CYS H 1 1 2 855 1 1 12 CYS HA H 2.926 -4.398 7.788 1.00 . A A . 12 CYS HA 1 1 2 856 1 1 12 CYS HB2 H 2.731 -5.351 5.522 1.00 . A A . 12 CYS HB2 1 1 2 857 1 1 12 CYS HB3 H 4.390 -5.495 6.100 1.00 . A A . 12 CYS HB3 1 1 2 858 1 1 12 CYS N N 3.898 -6.121 8.566 1.00 . A A . 12 CYS N 1 1 2 859 1 1 12 CYS O O 0.536 -5.563 7.357 1.00 . A A . 12 CYS O 1 1 2 860 1 1 12 CYS SG S 3.293 -7.626 6.023 1.00 . A A . 12 CYS SG 1 1 2 861 1 1 13 SER C C -0.882 -6.521 9.582 1.00 . A A . 13 SER C 1 1 2 862 1 1 13 SER CA C 0.065 -7.600 9.050 1.00 . A A . 13 SER CA 1 1 2 863 1 1 13 SER CB C 0.322 -8.663 10.117 1.00 . A A . 13 SER CB 1 1 2 864 1 1 13 SER H H 2.202 -7.372 9.199 1.00 . A A . 13 SER H 1 1 2 865 1 1 13 SER HA H -0.345 -8.059 8.165 1.00 . A A . 13 SER HA 1 1 2 866 1 1 13 SER HB2 H 1.326 -9.040 10.019 1.00 . A A . 13 SER HB2 1 1 2 867 1 1 13 SER HB3 H 0.199 -8.224 11.099 1.00 . A A . 13 SER HB3 1 1 2 868 1 1 13 SER HG H -0.444 -10.120 9.078 1.00 . A A . 13 SER HG 1 1 2 869 1 1 13 SER N N 1.403 -7.014 8.759 1.00 . A A . 13 SER N 1 1 2 870 1 1 13 SER O O -1.907 -6.242 8.996 1.00 . A A . 13 SER O 1 1 2 871 1 1 13 SER OG O -0.598 -9.733 9.944 1.00 . A A . 13 SER OG 1 1 2 872 1 1 14 GLN C C -1.414 -3.610 10.350 1.00 . A A . 14 GLN C 1 1 2 873 1 1 14 GLN CA C -1.432 -4.850 11.246 1.00 . A A . 14 GLN CA 1 1 2 874 1 1 14 GLN CB C -0.840 -4.525 12.617 1.00 . A A . 14 GLN CB 1 1 2 875 1 1 14 GLN CD C -2.469 -4.849 14.478 1.00 . A A . 14 GLN CD 1 1 2 876 1 1 14 GLN CG C -1.901 -3.841 13.480 1.00 . A A . 14 GLN CG 1 1 2 877 1 1 14 GLN H H 0.288 -6.145 11.142 1.00 . A A . 14 GLN H 1 1 2 878 1 1 14 GLN HA H -2.438 -5.220 11.358 1.00 . A A . 14 GLN HA 1 1 2 879 1 1 14 GLN HB2 H -0.519 -5.440 13.096 1.00 . A A . 14 GLN HB2 1 1 2 880 1 1 14 GLN HB3 H 0.006 -3.866 12.498 1.00 . A A . 14 GLN HB3 1 1 2 881 1 1 14 GLN HE21 H -4.348 -4.263 14.218 1.00 . A A . 14 GLN HE21 1 1 2 882 1 1 14 GLN HE22 H -4.128 -5.523 15.334 1.00 . A A . 14 GLN HE22 1 1 2 883 1 1 14 GLN HG2 H -1.452 -3.015 14.014 1.00 . A A . 14 GLN HG2 1 1 2 884 1 1 14 GLN HG3 H -2.696 -3.473 12.849 1.00 . A A . 14 GLN HG3 1 1 2 885 1 1 14 GLN N N -0.546 -5.909 10.683 1.00 . A A . 14 GLN N 1 1 2 886 1 1 14 GLN NE2 N -3.756 -4.882 14.694 1.00 . A A . 14 GLN NE2 1 1 2 887 1 1 14 GLN O O -2.407 -2.923 10.203 1.00 . A A . 14 GLN O 1 1 2 888 1 1 14 GLN OE1 O -1.735 -5.617 15.067 1.00 . A A . 14 GLN OE1 1 1 2 889 1 1 15 CYS C C -1.312 -2.172 7.809 1.00 . A A . 15 CYS C 1 1 2 890 1 1 15 CYS CA C -0.213 -2.119 8.870 1.00 . A A . 15 CYS CA 1 1 2 891 1 1 15 CYS CB C 1.168 -2.200 8.220 1.00 . A A . 15 CYS CB 1 1 2 892 1 1 15 CYS H H 0.496 -3.882 9.884 1.00 . A A . 15 CYS H 1 1 2 893 1 1 15 CYS HA H -0.293 -1.215 9.451 1.00 . A A . 15 CYS HA 1 1 2 894 1 1 15 CYS HB2 H 1.519 -3.221 8.246 1.00 . A A . 15 CYS HB2 1 1 2 895 1 1 15 CYS HB3 H 1.104 -1.867 7.194 1.00 . A A . 15 CYS HB3 1 1 2 896 1 1 15 CYS N N -0.293 -3.317 9.752 1.00 . A A . 15 CYS N 1 1 2 897 1 1 15 CYS O O -1.891 -1.167 7.449 1.00 . A A . 15 CYS O 1 1 2 898 1 1 15 CYS SG S 2.322 -1.141 9.127 1.00 . A A . 15 CYS SG 1 1 2 899 1 1 16 LEU C C -3.936 -4.069 6.865 1.00 . A A . 16 LEU C 1 1 2 900 1 1 16 LEU CA C -2.665 -3.453 6.266 1.00 . A A . 16 LEU CA 1 1 2 901 1 1 16 LEU CB C -2.069 -4.365 5.194 1.00 . A A . 16 LEU CB 1 1 2 902 1 1 16 LEU CD1 C 0.012 -2.979 5.043 1.00 . A A . 16 LEU CD1 1 1 2 903 1 1 16 LEU CD2 C -0.658 -4.432 3.130 1.00 . A A . 16 LEU CD2 1 1 2 904 1 1 16 LEU CG C -1.177 -3.541 4.260 1.00 . A A . 16 LEU CG 1 1 2 905 1 1 16 LEU H H -1.124 -4.137 7.605 1.00 . A A . 16 LEU H 1 1 2 906 1 1 16 LEU HA H -2.881 -2.485 5.843 1.00 . A A . 16 LEU HA 1 1 2 907 1 1 16 LEU HB2 H -1.480 -5.139 5.666 1.00 . A A . 16 LEU HB2 1 1 2 908 1 1 16 LEU HB3 H -2.866 -4.818 4.622 1.00 . A A . 16 LEU HB3 1 1 2 909 1 1 16 LEU HD11 H -0.211 -1.970 5.361 1.00 . A A . 16 LEU HD11 1 1 2 910 1 1 16 LEU HD12 H 0.888 -2.972 4.412 1.00 . A A . 16 LEU HD12 1 1 2 911 1 1 16 LEU HD13 H 0.198 -3.596 5.910 1.00 . A A . 16 LEU HD13 1 1 2 912 1 1 16 LEU HD21 H -0.020 -5.201 3.541 1.00 . A A . 16 LEU HD21 1 1 2 913 1 1 16 LEU HD22 H -0.094 -3.833 2.430 1.00 . A A . 16 LEU HD22 1 1 2 914 1 1 16 LEU HD23 H -1.493 -4.890 2.620 1.00 . A A . 16 LEU HD23 1 1 2 915 1 1 16 LEU HG H -1.751 -2.726 3.844 1.00 . A A . 16 LEU HG 1 1 2 916 1 1 16 LEU N N -1.604 -3.338 7.305 1.00 . A A . 16 LEU N 1 1 2 917 1 1 16 LEU O O -4.939 -4.215 6.194 1.00 . A A . 16 LEU O 1 1 2 918 1 1 17 SER C C -5.938 -3.938 9.461 1.00 . A A . 17 SER C 1 1 2 919 1 1 17 SER CA C -5.125 -5.022 8.752 1.00 . A A . 17 SER CA 1 1 2 920 1 1 17 SER CB C -4.603 -6.034 9.770 1.00 . A A . 17 SER CB 1 1 2 921 1 1 17 SER H H -3.095 -4.297 8.652 1.00 . A A . 17 SER H 1 1 2 922 1 1 17 SER HA H -5.728 -5.523 8.012 1.00 . A A . 17 SER HA 1 1 2 923 1 1 17 SER HB2 H -3.906 -6.698 9.293 1.00 . A A . 17 SER HB2 1 1 2 924 1 1 17 SER HB3 H -4.108 -5.508 10.576 1.00 . A A . 17 SER HB3 1 1 2 925 1 1 17 SER HG H -6.452 -6.207 10.351 1.00 . A A . 17 SER HG 1 1 2 926 1 1 17 SER N N -3.910 -4.425 8.122 1.00 . A A . 17 SER N 1 1 2 927 1 1 17 SER O O -7.049 -4.167 9.896 1.00 . A A . 17 SER O 1 1 2 928 1 1 17 SER OG O -5.694 -6.790 10.279 1.00 . A A . 17 SER OG 1 1 2 929 1 1 18 ALA C C -5.855 -0.328 9.586 1.00 . A A . 18 ALA C 1 1 2 930 1 1 18 ALA CA C -6.135 -1.668 10.271 1.00 . A A . 18 ALA CA 1 1 2 931 1 1 18 ALA CB C -5.591 -1.669 11.699 1.00 . A A . 18 ALA CB 1 1 2 932 1 1 18 ALA H H -4.491 -2.596 9.235 1.00 . A A . 18 ALA H 1 1 2 933 1 1 18 ALA HA H -7.193 -1.876 10.279 1.00 . A A . 18 ALA HA 1 1 2 934 1 1 18 ALA HB1 H -6.383 -1.413 12.387 1.00 . A A . 18 ALA HB1 1 1 2 935 1 1 18 ALA HB2 H -4.794 -0.946 11.781 1.00 . A A . 18 ALA HB2 1 1 2 936 1 1 18 ALA HB3 H -5.212 -2.653 11.938 1.00 . A A . 18 ALA HB3 1 1 2 937 1 1 18 ALA N N -5.392 -2.761 9.585 1.00 . A A . 18 ALA N 1 1 2 938 1 1 18 ALA O O -5.300 0.573 10.182 1.00 . A A . 18 ALA O 1 1 2 939 1 1 19 PRO C C -7.012 2.127 7.965 1.00 . A A . 19 PRO C 1 1 2 940 1 1 19 PRO CA C -6.054 0.985 7.553 1.00 . A A . 19 PRO CA 1 1 2 941 1 1 19 PRO CB C -6.307 0.537 6.115 1.00 . A A . 19 PRO CB 1 1 2 942 1 1 19 PRO CD C -6.922 -1.305 7.569 1.00 . A A . 19 PRO CD 1 1 2 943 1 1 19 PRO CG C -7.177 -0.677 6.219 1.00 . A A . 19 PRO CG 1 1 2 944 1 1 19 PRO HA H -5.032 1.316 7.645 1.00 . A A . 19 PRO HA 1 1 2 945 1 1 19 PRO HB2 H -6.814 1.317 5.565 1.00 . A A . 19 PRO HB2 1 1 2 946 1 1 19 PRO HB3 H -5.376 0.281 5.635 1.00 . A A . 19 PRO HB3 1 1 2 947 1 1 19 PRO HD2 H -7.855 -1.588 8.035 1.00 . A A . 19 PRO HD2 1 1 2 948 1 1 19 PRO HD3 H -6.271 -2.159 7.471 1.00 . A A . 19 PRO HD3 1 1 2 949 1 1 19 PRO HG2 H -8.214 -0.394 6.127 1.00 . A A . 19 PRO HG2 1 1 2 950 1 1 19 PRO HG3 H -6.918 -1.378 5.442 1.00 . A A . 19 PRO HG3 1 1 2 951 1 1 19 PRO N N -6.255 -0.249 8.345 1.00 . A A . 19 PRO N 1 1 2 952 1 1 19 PRO O O -6.658 3.280 7.818 1.00 . A A . 19 PRO O 1 1 2 953 1 1 20 PRO C C -8.685 3.519 10.180 1.00 . A A . 20 PRO C 1 1 2 954 1 1 20 PRO CA C -9.133 2.882 8.863 1.00 . A A . 20 PRO CA 1 1 2 955 1 1 20 PRO CB C -10.464 2.158 9.035 1.00 . A A . 20 PRO CB 1 1 2 956 1 1 20 PRO CD C -8.761 0.471 8.700 1.00 . A A . 20 PRO CD 1 1 2 957 1 1 20 PRO CG C -10.103 0.740 9.334 1.00 . A A . 20 PRO CG 1 1 2 958 1 1 20 PRO HA H -9.214 3.626 8.087 1.00 . A A . 20 PRO HA 1 1 2 959 1 1 20 PRO HB2 H -11.019 2.589 9.857 1.00 . A A . 20 PRO HB2 1 1 2 960 1 1 20 PRO HB3 H -11.041 2.208 8.124 1.00 . A A . 20 PRO HB3 1 1 2 961 1 1 20 PRO HD2 H -8.142 -0.096 9.378 1.00 . A A . 20 PRO HD2 1 1 2 962 1 1 20 PRO HD3 H -8.884 -0.054 7.769 1.00 . A A . 20 PRO HD3 1 1 2 963 1 1 20 PRO HG2 H -10.043 0.595 10.404 1.00 . A A . 20 PRO HG2 1 1 2 964 1 1 20 PRO HG3 H -10.842 0.076 8.914 1.00 . A A . 20 PRO HG3 1 1 2 965 1 1 20 PRO N N -8.191 1.806 8.462 1.00 . A A . 20 PRO N 1 1 2 966 1 1 20 PRO O O -8.960 4.671 10.449 1.00 . A A . 20 PRO O 1 1 2 967 1 1 21 PHE C C -6.077 3.812 12.182 1.00 . A A . 21 PHE C 1 1 2 968 1 1 21 PHE CA C -7.529 3.344 12.302 1.00 . A A . 21 PHE CA 1 1 2 969 1 1 21 PHE CB C -7.644 2.189 13.296 1.00 . A A . 21 PHE CB 1 1 2 970 1 1 21 PHE CD1 C -10.144 2.395 13.058 1.00 . A A . 21 PHE CD1 1 1 2 971 1 1 21 PHE CD2 C -9.165 0.182 13.220 1.00 . A A . 21 PHE CD2 1 1 2 972 1 1 21 PHE CE1 C -11.418 1.824 12.958 1.00 . A A . 21 PHE CE1 1 1 2 973 1 1 21 PHE CE2 C -10.440 -0.389 13.120 1.00 . A A . 21 PHE CE2 1 1 2 974 1 1 21 PHE CG C -9.018 1.573 13.189 1.00 . A A . 21 PHE CG 1 1 2 975 1 1 21 PHE CZ C -11.567 0.432 12.988 1.00 . A A . 21 PHE CZ 1 1 2 976 1 1 21 PHE H H -7.782 1.851 10.768 1.00 . A A . 21 PHE H 1 1 2 977 1 1 21 PHE HA H -8.166 4.160 12.608 1.00 . A A . 21 PHE HA 1 1 2 978 1 1 21 PHE HB2 H -6.895 1.444 13.068 1.00 . A A . 21 PHE HB2 1 1 2 979 1 1 21 PHE HB3 H -7.491 2.559 14.298 1.00 . A A . 21 PHE HB3 1 1 2 980 1 1 21 PHE HD1 H -10.030 3.468 13.034 1.00 . A A . 21 PHE HD1 1 1 2 981 1 1 21 PHE HD2 H -8.297 -0.452 13.321 1.00 . A A . 21 PHE HD2 1 1 2 982 1 1 21 PHE HE1 H -12.287 2.457 12.856 1.00 . A A . 21 PHE HE1 1 1 2 983 1 1 21 PHE HE2 H -10.555 -1.462 13.144 1.00 . A A . 21 PHE HE2 1 1 2 984 1 1 21 PHE HZ H -12.550 -0.008 12.912 1.00 . A A . 21 PHE HZ 1 1 2 985 1 1 21 PHE N N -7.994 2.779 11.003 1.00 . A A . 21 PHE N 1 1 2 986 1 1 21 PHE O O -5.445 4.163 13.159 1.00 . A A . 21 PHE O 1 1 2 987 1 1 22 VAL C C -4.001 5.079 9.521 1.00 . A A . 22 VAL C 1 1 2 988 1 1 22 VAL CA C -4.134 4.260 10.810 1.00 . A A . 22 VAL CA 1 1 2 989 1 1 22 VAL CB C -3.327 2.966 10.719 1.00 . A A . 22 VAL CB 1 1 2 990 1 1 22 VAL CG1 C -3.768 2.012 11.830 1.00 . A A . 22 VAL CG1 1 1 2 991 1 1 22 VAL CG2 C -3.565 2.305 9.359 1.00 . A A . 22 VAL CG2 1 1 2 992 1 1 22 VAL H H -6.071 3.529 10.218 1.00 . A A . 22 VAL H 1 1 2 993 1 1 22 VAL HA H -3.807 4.838 11.659 1.00 . A A . 22 VAL HA 1 1 2 994 1 1 22 VAL HB H -2.279 3.189 10.835 1.00 . A A . 22 VAL HB 1 1 2 995 1 1 22 VAL HG11 H -3.501 2.430 12.789 1.00 . A A . 22 VAL HG11 1 1 2 996 1 1 22 VAL HG12 H -3.277 1.059 11.704 1.00 . A A . 22 VAL HG12 1 1 2 997 1 1 22 VAL HG13 H -4.839 1.873 11.783 1.00 . A A . 22 VAL HG13 1 1 2 998 1 1 22 VAL HG21 H -4.593 2.451 9.064 1.00 . A A . 22 VAL HG21 1 1 2 999 1 1 22 VAL HG22 H -3.358 1.248 9.432 1.00 . A A . 22 VAL HG22 1 1 2 1000 1 1 22 VAL HG23 H -2.913 2.751 8.623 1.00 . A A . 22 VAL HG23 1 1 2 1001 1 1 22 VAL N N -5.544 3.818 10.993 1.00 . A A . 22 VAL N 1 1 2 1002 1 1 22 VAL O O -4.983 5.457 8.915 1.00 . A A . 22 VAL O 1 1 2 1003 1 1 23 GLN C C -1.355 5.750 7.102 1.00 . A A . 23 GLN C 1 1 2 1004 1 1 23 GLN CA C -2.623 6.173 7.855 1.00 . A A . 23 GLN CA 1 1 2 1005 1 1 23 GLN CB C -2.509 7.623 8.338 1.00 . A A . 23 GLN CB 1 1 2 1006 1 1 23 GLN CD C -2.615 9.775 7.066 1.00 . A A . 23 GLN CD 1 1 2 1007 1 1 23 GLN CG C -1.826 8.480 7.266 1.00 . A A . 23 GLN CG 1 1 2 1008 1 1 23 GLN H H -2.014 5.062 9.603 1.00 . A A . 23 GLN H 1 1 2 1009 1 1 23 GLN HA H -3.488 6.068 7.219 1.00 . A A . 23 GLN HA 1 1 2 1010 1 1 23 GLN HB2 H -3.497 8.015 8.534 1.00 . A A . 23 GLN HB2 1 1 2 1011 1 1 23 GLN HB3 H -1.925 7.654 9.245 1.00 . A A . 23 GLN HB3 1 1 2 1012 1 1 23 GLN HE21 H -4.025 8.911 5.967 1.00 . A A . 23 GLN HE21 1 1 2 1013 1 1 23 GLN HE22 H -4.226 10.576 6.226 1.00 . A A . 23 GLN HE22 1 1 2 1014 1 1 23 GLN HG2 H -0.819 8.716 7.581 1.00 . A A . 23 GLN HG2 1 1 2 1015 1 1 23 GLN HG3 H -1.793 7.933 6.335 1.00 . A A . 23 GLN HG3 1 1 2 1016 1 1 23 GLN N N -2.797 5.367 9.101 1.00 . A A . 23 GLN N 1 1 2 1017 1 1 23 GLN NE2 N -3.713 9.752 6.361 1.00 . A A . 23 GLN NE2 1 1 2 1018 1 1 23 GLN O O -1.310 5.780 5.889 1.00 . A A . 23 GLN O 1 1 2 1019 1 1 23 GLN OE1 O -2.228 10.818 7.555 1.00 . A A . 23 GLN OE1 1 1 2 1020 1 1 24 CYS C C 0.713 3.710 6.265 1.00 . A A . 24 CYS C 1 1 2 1021 1 1 24 CYS CA C 0.936 4.973 7.105 1.00 . A A . 24 CYS CA 1 1 2 1022 1 1 24 CYS CB C 1.968 4.734 8.219 1.00 . A A . 24 CYS CB 1 1 2 1023 1 1 24 CYS H H -0.364 5.366 8.783 1.00 . A A . 24 CYS H 1 1 2 1024 1 1 24 CYS HA H 1.273 5.780 6.470 1.00 . A A . 24 CYS HA 1 1 2 1025 1 1 24 CYS HB2 H 2.962 4.846 7.814 1.00 . A A . 24 CYS HB2 1 1 2 1026 1 1 24 CYS HB3 H 1.820 5.463 9.003 1.00 . A A . 24 CYS HB3 1 1 2 1027 1 1 24 CYS N N -0.321 5.374 7.804 1.00 . A A . 24 CYS N 1 1 2 1028 1 1 24 CYS O O -0.328 3.084 6.320 1.00 . A A . 24 CYS O 1 1 2 1029 1 1 24 CYS SG S 1.790 3.067 8.910 1.00 . A A . 24 CYS SG 1 1 2 1030 1 1 25 GLY C C 2.957 1.524 4.457 1.00 . A A . 25 GLY C 1 1 2 1031 1 1 25 GLY CA C 1.569 2.138 4.618 1.00 . A A . 25 GLY CA 1 1 2 1032 1 1 25 GLY H H 2.513 3.878 5.458 1.00 . A A . 25 GLY H 1 1 2 1033 1 1 25 GLY HA2 H 0.903 1.422 5.080 1.00 . A A . 25 GLY HA2 1 1 2 1034 1 1 25 GLY HA3 H 1.187 2.419 3.649 1.00 . A A . 25 GLY HA3 1 1 2 1035 1 1 25 GLY N N 1.689 3.346 5.483 1.00 . A A . 25 GLY N 1 1 2 1036 1 1 25 GLY O O 3.917 2.010 5.011 1.00 . A A . 25 GLY O 1 1 2 1037 1 1 26 TRP C C 5.144 0.534 2.354 1.00 . A A . 26 TRP C 1 1 2 1038 1 1 26 TRP CA C 4.437 -0.134 3.536 1.00 . A A . 26 TRP CA 1 1 2 1039 1 1 26 TRP CB C 4.183 -1.616 3.260 1.00 . A A . 26 TRP CB 1 1 2 1040 1 1 26 TRP CD1 C 6.419 -2.718 2.858 1.00 . A A . 26 TRP CD1 1 1 2 1041 1 1 26 TRP CD2 C 5.704 -2.962 4.976 1.00 . A A . 26 TRP CD2 1 1 2 1042 1 1 26 TRP CE2 C 6.954 -3.615 4.892 1.00 . A A . 26 TRP CE2 1 1 2 1043 1 1 26 TRP CE3 C 5.034 -2.969 6.213 1.00 . A A . 26 TRP CE3 1 1 2 1044 1 1 26 TRP CG C 5.386 -2.400 3.670 1.00 . A A . 26 TRP CG 1 1 2 1045 1 1 26 TRP CH2 C 6.847 -4.248 7.218 1.00 . A A . 26 TRP CH2 1 1 2 1046 1 1 26 TRP CZ2 C 7.525 -4.250 5.996 1.00 . A A . 26 TRP CZ2 1 1 2 1047 1 1 26 TRP CZ3 C 5.604 -3.609 7.327 1.00 . A A . 26 TRP CZ3 1 1 2 1048 1 1 26 TRP H H 2.308 0.080 3.252 1.00 . A A . 26 TRP H 1 1 2 1049 1 1 26 TRP HA H 5.017 -0.017 4.438 1.00 . A A . 26 TRP HA 1 1 2 1050 1 1 26 TRP HB2 H 3.326 -1.947 3.828 1.00 . A A . 26 TRP HB2 1 1 2 1051 1 1 26 TRP HB3 H 3.997 -1.762 2.208 1.00 . A A . 26 TRP HB3 1 1 2 1052 1 1 26 TRP HD1 H 6.503 -2.452 1.814 1.00 . A A . 26 TRP HD1 1 1 2 1053 1 1 26 TRP HE1 H 8.194 -3.789 3.227 1.00 . A A . 26 TRP HE1 1 1 2 1054 1 1 26 TRP HE3 H 4.075 -2.480 6.307 1.00 . A A . 26 TRP HE3 1 1 2 1055 1 1 26 TRP HH2 H 7.280 -4.738 8.078 1.00 . A A . 26 TRP HH2 1 1 2 1056 1 1 26 TRP HZ2 H 8.487 -4.735 5.905 1.00 . A A . 26 TRP HZ2 1 1 2 1057 1 1 26 TRP HZ3 H 5.081 -3.609 8.272 1.00 . A A . 26 TRP HZ3 1 1 2 1058 1 1 26 TRP N N 3.088 0.469 3.706 1.00 . A A . 26 TRP N 1 1 2 1059 1 1 26 TRP NE1 N 7.351 -3.438 3.582 1.00 . A A . 26 TRP NE1 1 1 2 1060 1 1 26 TRP O O 4.532 0.853 1.349 1.00 . A A . 26 TRP O 1 1 2 1061 1 1 27 CYS C C 8.527 0.852 1.117 1.00 . A A . 27 CYS C 1 1 2 1062 1 1 27 CYS CA C 7.148 1.474 1.372 1.00 . A A . 27 CYS CA 1 1 2 1063 1 1 27 CYS CB C 7.302 2.915 1.857 1.00 . A A . 27 CYS CB 1 1 2 1064 1 1 27 CYS H H 6.892 0.552 3.305 1.00 . A A . 27 CYS H 1 1 2 1065 1 1 27 CYS HA H 6.557 1.458 0.471 1.00 . A A . 27 CYS HA 1 1 2 1066 1 1 27 CYS HB2 H 6.562 3.119 2.617 1.00 . A A . 27 CYS HB2 1 1 2 1067 1 1 27 CYS HB3 H 8.290 3.052 2.271 1.00 . A A . 27 CYS HB3 1 1 2 1068 1 1 27 CYS N N 6.422 0.788 2.479 1.00 . A A . 27 CYS N 1 1 2 1069 1 1 27 CYS O O 9.492 1.151 1.793 1.00 . A A . 27 CYS O 1 1 2 1070 1 1 27 CYS SG S 7.068 4.048 0.468 1.00 . A A . 27 CYS SG 1 1 2 1071 1 1 28 HIS C C 10.697 -1.128 0.998 1.00 . A A . 28 HIS C 1 1 2 1072 1 1 28 HIS CA C 9.941 -0.602 -0.232 1.00 . A A . 28 HIS CA 1 1 2 1073 1 1 28 HIS CB C 10.733 0.532 -0.885 1.00 . A A . 28 HIS CB 1 1 2 1074 1 1 28 HIS CD2 C 12.507 -1.013 -2.056 1.00 . A A . 28 HIS CD2 1 1 2 1075 1 1 28 HIS CE1 C 12.344 -0.215 -4.063 1.00 . A A . 28 HIS CE1 1 1 2 1076 1 1 28 HIS CG C 11.565 -0.015 -2.012 1.00 . A A . 28 HIS CG 1 1 2 1077 1 1 28 HIS H H 7.837 -0.179 -0.427 1.00 . A A . 28 HIS H 1 1 2 1078 1 1 28 HIS HA H 9.797 -1.395 -0.946 1.00 . A A . 28 HIS HA 1 1 2 1079 1 1 28 HIS HB2 H 10.048 1.272 -1.272 1.00 . A A . 28 HIS HB2 1 1 2 1080 1 1 28 HIS HB3 H 11.379 0.989 -0.151 1.00 . A A . 28 HIS HB3 1 1 2 1081 1 1 28 HIS HD1 H 10.893 1.205 -3.607 1.00 . A A . 28 HIS HD1 1 1 2 1082 1 1 28 HIS HD2 H 12.821 -1.609 -1.212 1.00 . A A . 28 HIS HD2 1 1 2 1083 1 1 28 HIS HE1 H 12.491 -0.047 -5.120 1.00 . A A . 28 HIS HE1 1 1 2 1084 1 1 28 HIS N N 8.627 0.020 0.119 1.00 . A A . 28 HIS N 1 1 2 1085 1 1 28 HIS ND1 N 11.477 0.480 -3.303 1.00 . A A . 28 HIS ND1 1 1 2 1086 1 1 28 HIS NE2 N 12.997 -1.137 -3.353 1.00 . A A . 28 HIS NE2 1 1 2 1087 1 1 28 HIS O O 11.884 -1.378 0.927 1.00 . A A . 28 HIS O 1 1 2 1088 1 1 29 ASP C C 9.951 -1.793 4.580 1.00 . A A . 29 ASP C 1 1 2 1089 1 1 29 ASP CA C 10.798 -1.842 3.304 1.00 . A A . 29 ASP CA 1 1 2 1090 1 1 29 ASP CB C 12.031 -0.945 3.455 1.00 . A A . 29 ASP CB 1 1 2 1091 1 1 29 ASP CG C 11.692 0.499 3.066 1.00 . A A . 29 ASP CG 1 1 2 1092 1 1 29 ASP H H 9.090 -1.127 2.179 1.00 . A A . 29 ASP H 1 1 2 1093 1 1 29 ASP HA H 11.115 -2.855 3.115 1.00 . A A . 29 ASP HA 1 1 2 1094 1 1 29 ASP HB2 H 12.358 -0.972 4.485 1.00 . A A . 29 ASP HB2 1 1 2 1095 1 1 29 ASP HB3 H 12.821 -1.311 2.818 1.00 . A A . 29 ASP HB3 1 1 2 1096 1 1 29 ASP N N 10.048 -1.316 2.118 1.00 . A A . 29 ASP N 1 1 2 1097 1 1 29 ASP O O 9.347 -2.770 4.964 1.00 . A A . 29 ASP O 1 1 2 1098 1 1 29 ASP OD1 O 10.937 1.126 3.792 1.00 . A A . 29 ASP OD1 1 1 2 1099 1 1 29 ASP OD2 O 12.195 0.952 2.050 1.00 . A A . 29 ASP OD2 1 1 2 1100 1 1 30 LYS C C 7.788 0.098 6.276 1.00 . A A . 30 LYS C 1 1 2 1101 1 1 30 LYS CA C 9.135 -0.591 6.519 1.00 . A A . 30 LYS CA 1 1 2 1102 1 1 30 LYS CB C 10.008 0.225 7.478 1.00 . A A . 30 LYS CB 1 1 2 1103 1 1 30 LYS CD C 10.986 2.493 7.861 1.00 . A A . 30 LYS CD 1 1 2 1104 1 1 30 LYS CE C 11.045 2.135 9.347 1.00 . A A . 30 LYS CE 1 1 2 1105 1 1 30 LYS CG C 9.845 1.720 7.197 1.00 . A A . 30 LYS CG 1 1 2 1106 1 1 30 LYS H H 10.434 0.100 4.948 1.00 . A A . 30 LYS H 1 1 2 1107 1 1 30 LYS HA H 8.977 -1.577 6.924 1.00 . A A . 30 LYS HA 1 1 2 1108 1 1 30 LYS HB2 H 9.711 0.018 8.496 1.00 . A A . 30 LYS HB2 1 1 2 1109 1 1 30 LYS HB3 H 11.042 -0.052 7.343 1.00 . A A . 30 LYS HB3 1 1 2 1110 1 1 30 LYS HD2 H 11.921 2.229 7.388 1.00 . A A . 30 LYS HD2 1 1 2 1111 1 1 30 LYS HD3 H 10.813 3.553 7.754 1.00 . A A . 30 LYS HD3 1 1 2 1112 1 1 30 LYS HE2 H 10.049 2.124 9.770 1.00 . A A . 30 LYS HE2 1 1 2 1113 1 1 30 LYS HE3 H 11.525 1.179 9.486 1.00 . A A . 30 LYS HE3 1 1 2 1114 1 1 30 LYS HG2 H 9.863 1.891 6.130 1.00 . A A . 30 LYS HG2 1 1 2 1115 1 1 30 LYS HG3 H 8.901 2.059 7.599 1.00 . A A . 30 LYS HG3 1 1 2 1116 1 1 30 LYS HZ1 H 12.866 3.062 9.741 1.00 . A A . 30 LYS HZ1 1 1 2 1117 1 1 30 LYS HZ2 H 11.736 3.191 11.003 1.00 . A A . 30 LYS HZ2 1 1 2 1118 1 1 30 LYS HZ3 H 11.561 4.136 9.601 1.00 . A A . 30 LYS HZ3 1 1 2 1119 1 1 30 LYS N N 9.923 -0.676 5.257 1.00 . A A . 30 LYS N 1 1 2 1120 1 1 30 LYS NZ N 11.864 3.213 9.970 1.00 . A A . 30 LYS NZ 1 1 2 1121 1 1 30 LYS O O 7.465 0.487 5.171 1.00 . A A . 30 LYS O 1 1 2 1122 1 1 31 CYS C C 5.780 2.414 7.267 1.00 . A A . 31 CYS C 1 1 2 1123 1 1 31 CYS CA C 5.667 0.891 7.146 1.00 . A A . 31 CYS CA 1 1 2 1124 1 1 31 CYS CB C 4.823 0.335 8.289 1.00 . A A . 31 CYS CB 1 1 2 1125 1 1 31 CYS H H 7.278 -0.089 8.185 1.00 . A A . 31 CYS H 1 1 2 1126 1 1 31 CYS HA H 5.225 0.619 6.200 1.00 . A A . 31 CYS HA 1 1 2 1127 1 1 31 CYS HB2 H 5.255 -0.592 8.636 1.00 . A A . 31 CYS HB2 1 1 2 1128 1 1 31 CYS HB3 H 4.804 1.048 9.100 1.00 . A A . 31 CYS HB3 1 1 2 1129 1 1 31 CYS N N 6.998 0.241 7.305 1.00 . A A . 31 CYS N 1 1 2 1130 1 1 31 CYS O O 5.927 2.954 8.345 1.00 . A A . 31 CYS O 1 1 2 1131 1 1 31 CYS SG S 3.137 0.037 7.705 1.00 . A A . 31 CYS SG 1 1 2 1132 1 1 32 VAL C C 4.770 5.184 5.208 1.00 . A A . 32 VAL C 1 1 2 1133 1 1 32 VAL CA C 5.774 4.593 6.205 1.00 . A A . 32 VAL CA 1 1 2 1134 1 1 32 VAL CB C 7.214 4.916 5.804 1.00 . A A . 32 VAL CB 1 1 2 1135 1 1 32 VAL CG1 C 8.166 4.048 6.624 1.00 . A A . 32 VAL CG1 1 1 2 1136 1 1 32 VAL CG2 C 7.422 4.620 4.315 1.00 . A A . 32 VAL CG2 1 1 2 1137 1 1 32 VAL H H 5.561 2.648 5.311 1.00 . A A . 32 VAL H 1 1 2 1138 1 1 32 VAL HA H 5.576 4.957 7.200 1.00 . A A . 32 VAL HA 1 1 2 1139 1 1 32 VAL HB H 7.417 5.959 5.999 1.00 . A A . 32 VAL HB 1 1 2 1140 1 1 32 VAL HG11 H 8.295 3.094 6.134 1.00 . A A . 32 VAL HG11 1 1 2 1141 1 1 32 VAL HG12 H 7.753 3.891 7.611 1.00 . A A . 32 VAL HG12 1 1 2 1142 1 1 32 VAL HG13 H 9.123 4.541 6.708 1.00 . A A . 32 VAL HG13 1 1 2 1143 1 1 32 VAL HG21 H 8.280 5.169 3.955 1.00 . A A . 32 VAL HG21 1 1 2 1144 1 1 32 VAL HG22 H 6.546 4.917 3.758 1.00 . A A . 32 VAL HG22 1 1 2 1145 1 1 32 VAL HG23 H 7.592 3.562 4.179 1.00 . A A . 32 VAL HG23 1 1 2 1146 1 1 32 VAL N N 5.693 3.107 6.167 1.00 . A A . 32 VAL N 1 1 2 1147 1 1 32 VAL O O 4.153 4.468 4.444 1.00 . A A . 32 VAL O 1 1 2 1148 1 1 33 ARG C C 4.344 7.978 3.244 1.00 . A A . 33 ARG C 1 1 2 1149 1 1 33 ARG CA C 3.618 7.085 4.253 1.00 . A A . 33 ARG CA 1 1 2 1150 1 1 33 ARG CB C 2.671 7.913 5.122 1.00 . A A . 33 ARG CB 1 1 2 1151 1 1 33 ARG CD C 0.846 9.503 4.497 1.00 . A A . 33 ARG CD 1 1 2 1152 1 1 33 ARG CG C 1.321 8.050 4.416 1.00 . A A . 33 ARG CG 1 1 2 1153 1 1 33 ARG CZ C -0.489 9.064 2.522 1.00 . A A . 33 ARG CZ 1 1 2 1154 1 1 33 ARG H H 5.092 7.045 5.830 1.00 . A A . 33 ARG H 1 1 2 1155 1 1 33 ARG HA H 3.066 6.313 3.741 1.00 . A A . 33 ARG HA 1 1 2 1156 1 1 33 ARG HB2 H 2.532 7.418 6.073 1.00 . A A . 33 ARG HB2 1 1 2 1157 1 1 33 ARG HB3 H 3.092 8.892 5.283 1.00 . A A . 33 ARG HB3 1 1 2 1158 1 1 33 ARG HD2 H 0.034 9.593 5.205 1.00 . A A . 33 ARG HD2 1 1 2 1159 1 1 33 ARG HD3 H 1.664 10.150 4.774 1.00 . A A . 33 ARG HD3 1 1 2 1160 1 1 33 ARG HE H 0.724 10.630 2.665 1.00 . A A . 33 ARG HE 1 1 2 1161 1 1 33 ARG HG2 H 1.426 7.762 3.379 1.00 . A A . 33 ARG HG2 1 1 2 1162 1 1 33 ARG HG3 H 0.597 7.410 4.896 1.00 . A A . 33 ARG HG3 1 1 2 1163 1 1 33 ARG HH11 H -2.065 9.822 3.497 1.00 . A A . 33 ARG HH11 1 1 2 1164 1 1 33 ARG HH12 H -2.422 8.568 2.357 1.00 . A A . 33 ARG HH12 1 1 2 1165 1 1 33 ARG HH21 H 0.884 8.131 1.403 1.00 . A A . 33 ARG HH21 1 1 2 1166 1 1 33 ARG HH22 H -0.752 7.611 1.170 1.00 . A A . 33 ARG HH22 1 1 2 1167 1 1 33 ARG N N 4.592 6.477 5.206 1.00 . A A . 33 ARG N 1 1 2 1168 1 1 33 ARG NE N 0.379 9.834 3.121 1.00 . A A . 33 ARG NE 1 1 2 1169 1 1 33 ARG NH1 N -1.757 9.159 2.814 1.00 . A A . 33 ARG NH1 1 1 2 1170 1 1 33 ARG NH2 N -0.087 8.201 1.629 1.00 . A A . 33 ARG NH2 1 1 2 1171 1 1 33 ARG O O 5.497 8.318 3.417 1.00 . A A . 33 ARG O 1 1 2 1172 1 1 34 SER C C 5.182 10.303 1.817 1.00 . A A . 34 SER C 1 1 2 1173 1 1 34 SER CA C 4.320 9.221 1.157 1.00 . A A . 34 SER CA 1 1 2 1174 1 1 34 SER CB C 3.159 9.858 0.394 1.00 . A A . 34 SER CB 1 1 2 1175 1 1 34 SER H H 2.746 8.063 2.070 1.00 . A A . 34 SER H 1 1 2 1176 1 1 34 SER HA H 4.916 8.624 0.485 1.00 . A A . 34 SER HA 1 1 2 1177 1 1 34 SER HB2 H 2.571 10.459 1.067 1.00 . A A . 34 SER HB2 1 1 2 1178 1 1 34 SER HB3 H 3.552 10.486 -0.396 1.00 . A A . 34 SER HB3 1 1 2 1179 1 1 34 SER HG H 2.910 8.224 -0.631 1.00 . A A . 34 SER HG 1 1 2 1180 1 1 34 SER N N 3.675 8.355 2.188 1.00 . A A . 34 SER N 1 1 2 1181 1 1 34 SER O O 6.185 10.723 1.276 1.00 . A A . 34 SER O 1 1 2 1182 1 1 34 SER OG O 2.342 8.836 -0.159 1.00 . A A . 34 SER OG 1 1 2 1183 1 1 35 GLU C C 6.954 11.275 4.100 1.00 . A A . 35 GLU C 1 1 2 1184 1 1 35 GLU CA C 5.594 11.823 3.658 1.00 . A A . 35 GLU CA 1 1 2 1185 1 1 35 GLU CB C 4.760 12.224 4.876 1.00 . A A . 35 GLU CB 1 1 2 1186 1 1 35 GLU CD C 3.580 14.207 5.830 1.00 . A A . 35 GLU CD 1 1 2 1187 1 1 35 GLU CG C 3.929 13.463 4.540 1.00 . A A . 35 GLU CG 1 1 2 1188 1 1 35 GLU H H 3.982 10.415 3.395 1.00 . A A . 35 GLU H 1 1 2 1189 1 1 35 GLU HA H 5.725 12.673 3.009 1.00 . A A . 35 GLU HA 1 1 2 1190 1 1 35 GLU HB2 H 4.102 11.409 5.145 1.00 . A A . 35 GLU HB2 1 1 2 1191 1 1 35 GLU HB3 H 5.416 12.445 5.705 1.00 . A A . 35 GLU HB3 1 1 2 1192 1 1 35 GLU HG2 H 4.499 14.113 3.892 1.00 . A A . 35 GLU HG2 1 1 2 1193 1 1 35 GLU HG3 H 3.020 13.163 4.042 1.00 . A A . 35 GLU HG3 1 1 2 1194 1 1 35 GLU N N 4.797 10.762 2.976 1.00 . A A . 35 GLU N 1 1 2 1195 1 1 35 GLU O O 7.902 12.014 4.276 1.00 . A A . 35 GLU O 1 1 2 1196 1 1 35 GLU OE1 O 3.127 13.560 6.759 1.00 . A A . 35 GLU OE1 1 1 2 1197 1 1 35 GLU OE2 O 3.773 15.411 5.866 1.00 . A A . 35 GLU OE2 1 1 2 1198 1 1 36 GLU C C 8.880 8.413 3.681 1.00 . A A . 36 GLU C 1 1 2 1199 1 1 36 GLU CA C 8.359 9.406 4.724 1.00 . A A . 36 GLU CA 1 1 2 1200 1 1 36 GLU CB C 8.046 8.689 6.037 1.00 . A A . 36 GLU CB 1 1 2 1201 1 1 36 GLU CD C 10.160 9.506 7.089 1.00 . A A . 36 GLU CD 1 1 2 1202 1 1 36 GLU CG C 9.352 8.263 6.710 1.00 . A A . 36 GLU CG 1 1 2 1203 1 1 36 GLU H H 6.281 9.408 4.145 1.00 . A A . 36 GLU H 1 1 2 1204 1 1 36 GLU HA H 9.082 10.186 4.896 1.00 . A A . 36 GLU HA 1 1 2 1205 1 1 36 GLU HB2 H 7.504 9.357 6.690 1.00 . A A . 36 GLU HB2 1 1 2 1206 1 1 36 GLU HB3 H 7.446 7.815 5.835 1.00 . A A . 36 GLU HB3 1 1 2 1207 1 1 36 GLU HG2 H 9.129 7.692 7.598 1.00 . A A . 36 GLU HG2 1 1 2 1208 1 1 36 GLU HG3 H 9.928 7.657 6.027 1.00 . A A . 36 GLU HG3 1 1 2 1209 1 1 36 GLU N N 7.057 9.989 4.287 1.00 . A A . 36 GLU N 1 1 2 1210 1 1 36 GLU O O 9.945 7.847 3.828 1.00 . A A . 36 GLU O 1 1 2 1211 1 1 36 GLU OE1 O 9.957 10.009 8.181 1.00 . A A . 36 GLU OE1 1 1 2 1212 1 1 36 GLU OE2 O 10.968 9.932 6.280 1.00 . A A . 36 GLU OE2 1 1 2 1213 1 1 37 CYS C C 9.777 7.821 0.804 1.00 . A A . 37 CYS C 1 1 2 1214 1 1 37 CYS CA C 8.599 7.235 1.585 1.00 . A A . 37 CYS CA 1 1 2 1215 1 1 37 CYS CB C 7.394 7.046 0.666 1.00 . A A . 37 CYS CB 1 1 2 1216 1 1 37 CYS H H 7.282 8.657 2.528 1.00 . A A . 37 CYS H 1 1 2 1217 1 1 37 CYS HA H 8.874 6.293 2.032 1.00 . A A . 37 CYS HA 1 1 2 1218 1 1 37 CYS HB2 H 6.832 7.966 0.614 1.00 . A A . 37 CYS HB2 1 1 2 1219 1 1 37 CYS HB3 H 7.735 6.776 -0.323 1.00 . A A . 37 CYS HB3 1 1 2 1220 1 1 37 CYS N N 8.141 8.194 2.630 1.00 . A A . 37 CYS N 1 1 2 1221 1 1 37 CYS O O 9.616 8.330 -0.288 1.00 . A A . 37 CYS O 1 1 2 1222 1 1 37 CYS SG S 6.341 5.729 1.320 1.00 . A A . 37 CYS SG 1 1 2 1223 1 1 38 LEU C C 12.218 7.697 -0.780 1.00 . A A . 38 LEU C 1 1 2 1224 1 1 38 LEU CA C 12.137 8.309 0.623 1.00 . A A . 38 LEU CA 1 1 2 1225 1 1 38 LEU CB C 13.352 7.919 1.467 1.00 . A A . 38 LEU CB 1 1 2 1226 1 1 38 LEU CD1 C 14.937 6.405 0.270 1.00 . A A . 38 LEU CD1 1 1 2 1227 1 1 38 LEU CD2 C 14.075 5.783 2.529 1.00 . A A . 38 LEU CD2 1 1 2 1228 1 1 38 LEU CG C 13.726 6.459 1.204 1.00 . A A . 38 LEU CG 1 1 2 1229 1 1 38 LEU H H 11.075 7.338 2.229 1.00 . A A . 38 LEU H 1 1 2 1230 1 1 38 LEU HA H 12.065 9.381 0.560 1.00 . A A . 38 LEU HA 1 1 2 1231 1 1 38 LEU HB2 H 14.185 8.555 1.209 1.00 . A A . 38 LEU HB2 1 1 2 1232 1 1 38 LEU HB3 H 13.116 8.043 2.513 1.00 . A A . 38 LEU HB3 1 1 2 1233 1 1 38 LEU HD11 H 15.482 7.335 0.334 1.00 . A A . 38 LEU HD11 1 1 2 1234 1 1 38 LEU HD12 H 14.602 6.252 -0.744 1.00 . A A . 38 LEU HD12 1 1 2 1235 1 1 38 LEU HD13 H 15.581 5.590 0.564 1.00 . A A . 38 LEU HD13 1 1 2 1236 1 1 38 LEU HD21 H 14.901 5.103 2.379 1.00 . A A . 38 LEU HD21 1 1 2 1237 1 1 38 LEU HD22 H 13.217 5.234 2.889 1.00 . A A . 38 LEU HD22 1 1 2 1238 1 1 38 LEU HD23 H 14.352 6.534 3.254 1.00 . A A . 38 LEU HD23 1 1 2 1239 1 1 38 LEU HG H 12.892 5.950 0.743 1.00 . A A . 38 LEU HG 1 1 2 1240 1 1 38 LEU N N 10.960 7.754 1.348 1.00 . A A . 38 LEU N 1 1 2 1241 1 1 38 LEU O O 12.850 8.234 -1.667 1.00 . A A . 38 LEU O 1 1 2 1242 1 1 39 SER C C 10.784 6.755 -3.322 1.00 . A A . 39 SER C 1 1 2 1243 1 1 39 SER CA C 11.610 5.934 -2.329 1.00 . A A . 39 SER CA 1 1 2 1244 1 1 39 SER CB C 10.985 4.555 -2.127 1.00 . A A . 39 SER CB 1 1 2 1245 1 1 39 SER H H 11.069 6.163 -0.256 1.00 . A A . 39 SER H 1 1 2 1246 1 1 39 SER HA H 12.626 5.833 -2.674 1.00 . A A . 39 SER HA 1 1 2 1247 1 1 39 SER HB2 H 10.163 4.626 -1.434 1.00 . A A . 39 SER HB2 1 1 2 1248 1 1 39 SER HB3 H 10.622 4.182 -3.077 1.00 . A A . 39 SER HB3 1 1 2 1249 1 1 39 SER HG H 11.558 3.163 -0.894 1.00 . A A . 39 SER HG 1 1 2 1250 1 1 39 SER N N 11.576 6.578 -0.985 1.00 . A A . 39 SER N 1 1 2 1251 1 1 39 SER O O 11.249 7.111 -4.386 1.00 . A A . 39 SER O 1 1 2 1252 1 1 39 SER OG O 11.964 3.669 -1.601 1.00 . A A . 39 SER OG 1 1 2 1253 1 1 40 GLY C C 7.404 7.115 -4.181 1.00 . A A . 40 GLY C 1 1 2 1254 1 1 40 GLY CA C 8.709 7.864 -3.900 1.00 . A A . 40 GLY CA 1 1 2 1255 1 1 40 GLY H H 9.206 6.768 -2.114 1.00 . A A . 40 GLY H 1 1 2 1256 1 1 40 GLY HA2 H 8.486 8.818 -3.444 1.00 . A A . 40 GLY HA2 1 1 2 1257 1 1 40 GLY HA3 H 9.234 8.024 -4.830 1.00 . A A . 40 GLY HA3 1 1 2 1258 1 1 40 GLY N N 9.561 7.064 -2.979 1.00 . A A . 40 GLY N 1 1 2 1259 1 1 40 GLY O O 6.451 7.678 -4.682 1.00 . A A . 40 GLY O 1 1 2 1260 1 1 41 THR C C 5.540 4.504 -2.819 1.00 . A A . 41 THR C 1 1 2 1261 1 1 41 THR CA C 6.105 5.071 -4.125 1.00 . A A . 41 THR CA 1 1 2 1262 1 1 41 THR CB C 6.531 3.937 -5.058 1.00 . A A . 41 THR CB 1 1 2 1263 1 1 41 THR CG2 C 7.600 3.085 -4.372 1.00 . A A . 41 THR CG2 1 1 2 1264 1 1 41 THR H H 8.131 5.409 -3.467 1.00 . A A . 41 THR H 1 1 2 1265 1 1 41 THR HA H 5.371 5.691 -4.614 1.00 . A A . 41 THR HA 1 1 2 1266 1 1 41 THR HB H 6.935 4.352 -5.969 1.00 . A A . 41 THR HB 1 1 2 1267 1 1 41 THR HG1 H 4.620 3.690 -5.328 1.00 . A A . 41 THR HG1 1 1 2 1268 1 1 41 THR HG21 H 7.218 2.088 -4.213 1.00 . A A . 41 THR HG21 1 1 2 1269 1 1 41 THR HG22 H 7.858 3.528 -3.422 1.00 . A A . 41 THR HG22 1 1 2 1270 1 1 41 THR HG23 H 8.478 3.038 -4.999 1.00 . A A . 41 THR HG23 1 1 2 1271 1 1 41 THR N N 7.351 5.848 -3.867 1.00 . A A . 41 THR N 1 1 2 1272 1 1 41 THR O O 6.197 3.768 -2.113 1.00 . A A . 41 THR O 1 1 2 1273 1 1 41 THR OG1 O 5.400 3.132 -5.363 1.00 . A A . 41 THR OG1 1 1 2 1274 1 1 42 TRP C C 2.812 3.116 -1.566 1.00 . A A . 42 TRP C 1 1 2 1275 1 1 42 TRP CA C 3.699 4.323 -1.247 1.00 . A A . 42 TRP CA 1 1 2 1276 1 1 42 TRP CB C 2.855 5.489 -0.731 1.00 . A A . 42 TRP CB 1 1 2 1277 1 1 42 TRP CD1 C 2.949 4.895 1.723 1.00 . A A . 42 TRP CD1 1 1 2 1278 1 1 42 TRP CD2 C 0.844 4.986 0.936 1.00 . A A . 42 TRP CD2 1 1 2 1279 1 1 42 TRP CE2 C 0.752 4.650 2.306 1.00 . A A . 42 TRP CE2 1 1 2 1280 1 1 42 TRP CE3 C -0.348 5.107 0.199 1.00 . A A . 42 TRP CE3 1 1 2 1281 1 1 42 TRP CG C 2.252 5.136 0.590 1.00 . A A . 42 TRP CG 1 1 2 1282 1 1 42 TRP CH2 C -1.656 4.567 2.181 1.00 . A A . 42 TRP CH2 1 1 2 1283 1 1 42 TRP CZ2 C -0.481 4.443 2.926 1.00 . A A . 42 TRP CZ2 1 1 2 1284 1 1 42 TRP CZ3 C -1.591 4.899 0.820 1.00 . A A . 42 TRP CZ3 1 1 2 1285 1 1 42 TRP H H 3.808 5.433 -3.091 1.00 . A A . 42 TRP H 1 1 2 1286 1 1 42 TRP HA H 4.455 4.062 -0.525 1.00 . A A . 42 TRP HA 1 1 2 1287 1 1 42 TRP HB2 H 3.481 6.362 -0.616 1.00 . A A . 42 TRP HB2 1 1 2 1288 1 1 42 TRP HB3 H 2.069 5.703 -1.439 1.00 . A A . 42 TRP HB3 1 1 2 1289 1 1 42 TRP HD1 H 4.023 4.922 1.816 1.00 . A A . 42 TRP HD1 1 1 2 1290 1 1 42 TRP HE1 H 2.310 4.398 3.666 1.00 . A A . 42 TRP HE1 1 1 2 1291 1 1 42 TRP HE3 H -0.308 5.362 -0.850 1.00 . A A . 42 TRP HE3 1 1 2 1292 1 1 42 TRP HH2 H -2.615 4.408 2.653 1.00 . A A . 42 TRP HH2 1 1 2 1293 1 1 42 TRP HZ2 H -0.527 4.188 3.975 1.00 . A A . 42 TRP HZ2 1 1 2 1294 1 1 42 TRP HZ3 H -2.501 4.994 0.247 1.00 . A A . 42 TRP HZ3 1 1 2 1295 1 1 42 TRP N N 4.320 4.841 -2.501 1.00 . A A . 42 TRP N 1 1 2 1296 1 1 42 TRP NE1 N 2.061 4.608 2.742 1.00 . A A . 42 TRP NE1 1 1 2 1297 1 1 42 TRP O O 1.994 3.160 -2.464 1.00 . A A . 42 TRP O 1 1 2 1298 1 1 43 THR C C 1.549 0.267 0.172 1.00 . A A . 43 THR C 1 1 2 1299 1 1 43 THR CA C 2.120 0.835 -1.130 1.00 . A A . 43 THR CA 1 1 2 1300 1 1 43 THR CB C 3.068 -0.167 -1.789 1.00 . A A . 43 THR CB 1 1 2 1301 1 1 43 THR CG2 C 4.307 -0.355 -0.911 1.00 . A A . 43 THR CG2 1 1 2 1302 1 1 43 THR H H 3.630 2.009 -0.124 1.00 . A A . 43 THR H 1 1 2 1303 1 1 43 THR HA H 1.323 1.090 -1.810 1.00 . A A . 43 THR HA 1 1 2 1304 1 1 43 THR HB H 3.371 0.205 -2.754 1.00 . A A . 43 THR HB 1 1 2 1305 1 1 43 THR HG1 H 1.977 -1.415 -2.807 1.00 . A A . 43 THR HG1 1 1 2 1306 1 1 43 THR HG21 H 4.811 0.593 -0.793 1.00 . A A . 43 THR HG21 1 1 2 1307 1 1 43 THR HG22 H 4.975 -1.062 -1.378 1.00 . A A . 43 THR HG22 1 1 2 1308 1 1 43 THR HG23 H 4.009 -0.727 0.058 1.00 . A A . 43 THR HG23 1 1 2 1309 1 1 43 THR N N 2.963 2.034 -0.846 1.00 . A A . 43 THR N 1 1 2 1310 1 1 43 THR O O 2.219 0.209 1.181 1.00 . A A . 43 THR O 1 1 2 1311 1 1 43 THR OG1 O 2.402 -1.414 -1.946 1.00 . A A . 43 THR OG1 1 1 2 1312 1 1 44 GLN C C -1.007 -2.032 1.108 1.00 . A A . 44 GLN C 1 1 2 1313 1 1 44 GLN CA C -0.291 -0.710 1.404 1.00 . A A . 44 GLN CA 1 1 2 1314 1 1 44 GLN CB C -1.290 0.351 1.869 1.00 . A A . 44 GLN CB 1 1 2 1315 1 1 44 GLN CD C -3.602 1.064 1.243 1.00 . A A . 44 GLN CD 1 1 2 1316 1 1 44 GLN CG C -2.208 0.734 0.706 1.00 . A A . 44 GLN CG 1 1 2 1317 1 1 44 GLN H H -0.219 -0.096 -0.662 1.00 . A A . 44 GLN H 1 1 2 1318 1 1 44 GLN HA H 0.467 -0.855 2.157 1.00 . A A . 44 GLN HA 1 1 2 1319 1 1 44 GLN HB2 H -1.881 -0.044 2.682 1.00 . A A . 44 GLN HB2 1 1 2 1320 1 1 44 GLN HB3 H -0.754 1.226 2.204 1.00 . A A . 44 GLN HB3 1 1 2 1321 1 1 44 GLN HE21 H -3.701 -0.559 2.383 1.00 . A A . 44 GLN HE21 1 1 2 1322 1 1 44 GLN HE22 H -5.061 0.455 2.444 1.00 . A A . 44 GLN HE22 1 1 2 1323 1 1 44 GLN HG2 H -1.803 1.598 0.199 1.00 . A A . 44 GLN HG2 1 1 2 1324 1 1 44 GLN HG3 H -2.277 -0.090 0.014 1.00 . A A . 44 GLN HG3 1 1 2 1325 1 1 44 GLN N N 0.312 -0.152 0.161 1.00 . A A . 44 GLN N 1 1 2 1326 1 1 44 GLN NE2 N -4.168 0.253 2.094 1.00 . A A . 44 GLN NE2 1 1 2 1327 1 1 44 GLN O O -2.057 -2.315 1.650 1.00 . A A . 44 GLN O 1 1 2 1328 1 1 44 GLN OE1 O -4.183 2.069 0.883 1.00 . A A . 44 GLN OE1 1 1 2 1329 1 1 45 GLN C C -0.022 -5.225 -0.293 1.00 . A A . 45 GLN C 1 1 2 1330 1 1 45 GLN CA C -1.089 -4.152 -0.062 1.00 . A A . 45 GLN CA 1 1 2 1331 1 1 45 GLN CB C -1.884 -3.902 -1.345 1.00 . A A . 45 GLN CB 1 1 2 1332 1 1 45 GLN CD C -4.254 -4.227 -0.625 1.00 . A A . 45 GLN CD 1 1 2 1333 1 1 45 GLN CG C -3.085 -4.849 -1.390 1.00 . A A . 45 GLN CG 1 1 2 1334 1 1 45 GLN H H 0.407 -2.603 -0.164 1.00 . A A . 45 GLN H 1 1 2 1335 1 1 45 GLN HA H -1.756 -4.449 0.733 1.00 . A A . 45 GLN HA 1 1 2 1336 1 1 45 GLN HB2 H -2.230 -2.878 -1.361 1.00 . A A . 45 GLN HB2 1 1 2 1337 1 1 45 GLN HB3 H -1.253 -4.084 -2.201 1.00 . A A . 45 GLN HB3 1 1 2 1338 1 1 45 GLN HE21 H -5.477 -5.753 -0.969 1.00 . A A . 45 GLN HE21 1 1 2 1339 1 1 45 GLN HE22 H -6.138 -4.486 -0.055 1.00 . A A . 45 GLN HE22 1 1 2 1340 1 1 45 GLN HG2 H -3.373 -5.016 -2.417 1.00 . A A . 45 GLN HG2 1 1 2 1341 1 1 45 GLN HG3 H -2.819 -5.790 -0.933 1.00 . A A . 45 GLN HG3 1 1 2 1342 1 1 45 GLN N N -0.443 -2.847 0.258 1.00 . A A . 45 GLN N 1 1 2 1343 1 1 45 GLN NE2 N -5.384 -4.876 -0.543 1.00 . A A . 45 GLN NE2 1 1 2 1344 1 1 45 GLN O O 0.627 -5.261 -1.320 1.00 . A A . 45 GLN O 1 1 2 1345 1 1 45 GLN OE1 O -4.138 -3.140 -0.095 1.00 . A A . 45 GLN OE1 1 1 2 1346 1 1 46 ILE C C 0.764 -8.416 1.281 1.00 . A A . 46 ILE C 1 1 2 1347 1 1 46 ILE CA C 1.186 -7.171 0.497 1.00 . A A . 46 ILE CA 1 1 2 1348 1 1 46 ILE CB C 2.472 -6.583 1.076 1.00 . A A . 46 ILE CB 1 1 2 1349 1 1 46 ILE CD1 C 4.206 -4.806 0.779 1.00 . A A . 46 ILE CD1 1 1 2 1350 1 1 46 ILE CG1 C 2.845 -5.317 0.301 1.00 . A A . 46 ILE CG1 1 1 2 1351 1 1 46 ILE CG2 C 3.602 -7.606 0.953 1.00 . A A . 46 ILE CG2 1 1 2 1352 1 1 46 ILE H H -0.372 -6.053 1.477 1.00 . A A . 46 ILE H 1 1 2 1353 1 1 46 ILE HA H 1.324 -7.410 -0.545 1.00 . A A . 46 ILE HA 1 1 2 1354 1 1 46 ILE HB H 2.319 -6.338 2.118 1.00 . A A . 46 ILE HB 1 1 2 1355 1 1 46 ILE HD11 H 4.623 -4.142 0.036 1.00 . A A . 46 ILE HD11 1 1 2 1356 1 1 46 ILE HD12 H 4.873 -5.643 0.928 1.00 . A A . 46 ILE HD12 1 1 2 1357 1 1 46 ILE HD13 H 4.084 -4.274 1.711 1.00 . A A . 46 ILE HD13 1 1 2 1358 1 1 46 ILE HG12 H 2.893 -5.544 -0.753 1.00 . A A . 46 ILE HG12 1 1 2 1359 1 1 46 ILE HG13 H 2.098 -4.556 0.472 1.00 . A A . 46 ILE HG13 1 1 2 1360 1 1 46 ILE HG21 H 3.437 -8.409 1.654 1.00 . A A . 46 ILE HG21 1 1 2 1361 1 1 46 ILE HG22 H 4.545 -7.127 1.170 1.00 . A A . 46 ILE HG22 1 1 2 1362 1 1 46 ILE HG23 H 3.622 -8.000 -0.052 1.00 . A A . 46 ILE HG23 1 1 2 1363 1 1 46 ILE N N 0.164 -6.099 0.657 1.00 . A A . 46 ILE N 1 1 2 1364 1 1 46 ILE O O 0.363 -9.415 0.717 1.00 . A A . 46 ILE O 1 1 2 1365 1 1 47 CYS C C -0.970 -9.361 3.928 1.00 . A A . 47 CYS C 1 1 2 1366 1 1 47 CYS CA C 0.462 -9.534 3.412 1.00 . A A . 47 CYS CA 1 1 2 1367 1 1 47 CYS CB C 1.458 -9.551 4.574 1.00 . A A . 47 CYS CB 1 1 2 1368 1 1 47 CYS H H 1.183 -7.542 3.011 1.00 . A A . 47 CYS H 1 1 2 1369 1 1 47 CYS HA H 0.548 -10.445 2.840 1.00 . A A . 47 CYS HA 1 1 2 1370 1 1 47 CYS HB2 H 1.212 -10.358 5.248 1.00 . A A . 47 CYS HB2 1 1 2 1371 1 1 47 CYS HB3 H 2.457 -9.698 4.189 1.00 . A A . 47 CYS HB3 1 1 2 1372 1 1 47 CYS N N 0.855 -8.360 2.581 1.00 . A A . 47 CYS N 1 1 2 1373 1 1 47 CYS O O -1.303 -8.369 4.544 1.00 . A A . 47 CYS O 1 1 2 1374 1 1 47 CYS SG S 1.382 -7.977 5.467 1.00 . A A . 47 CYS SG 1 1 2 1375 1 1 48 LEU C C -3.313 -10.498 5.649 1.00 . A A . 48 LEU C 1 1 2 1376 1 1 48 LEU CA C -3.231 -10.210 4.147 1.00 . A A . 48 LEU CA 1 1 2 1377 1 1 48 LEU CB C -3.997 -11.271 3.356 1.00 . A A . 48 LEU CB 1 1 2 1378 1 1 48 LEU CD1 C -3.339 -10.464 1.085 1.00 . A A . 48 LEU CD1 1 1 2 1379 1 1 48 LEU CD2 C -5.536 -11.602 1.415 1.00 . A A . 48 LEU CD2 1 1 2 1380 1 1 48 LEU CG C -4.509 -10.662 2.051 1.00 . A A . 48 LEU CG 1 1 2 1381 1 1 48 LEU H H -1.531 -11.111 3.175 1.00 . A A . 48 LEU H 1 1 2 1382 1 1 48 LEU HA H -3.627 -9.232 3.929 1.00 . A A . 48 LEU HA 1 1 2 1383 1 1 48 LEU HB2 H -3.338 -12.099 3.135 1.00 . A A . 48 LEU HB2 1 1 2 1384 1 1 48 LEU HB3 H -4.834 -11.624 3.940 1.00 . A A . 48 LEU HB3 1 1 2 1385 1 1 48 LEU HD11 H -3.716 -10.173 0.117 1.00 . A A . 48 LEU HD11 1 1 2 1386 1 1 48 LEU HD12 H -2.788 -11.388 0.994 1.00 . A A . 48 LEU HD12 1 1 2 1387 1 1 48 LEU HD13 H -2.686 -9.691 1.465 1.00 . A A . 48 LEU HD13 1 1 2 1388 1 1 48 LEU HD21 H -5.306 -12.623 1.685 1.00 . A A . 48 LEU HD21 1 1 2 1389 1 1 48 LEU HD22 H -5.503 -11.498 0.341 1.00 . A A . 48 LEU HD22 1 1 2 1390 1 1 48 LEU HD23 H -6.524 -11.350 1.771 1.00 . A A . 48 LEU HD23 1 1 2 1391 1 1 48 LEU HG H -4.970 -9.706 2.256 1.00 . A A . 48 LEU HG 1 1 2 1392 1 1 48 LEU N N -1.820 -10.319 3.676 1.00 . A A . 48 LEU N 1 1 2 1393 1 1 48 LEU O O -2.646 -11.418 6.093 1.00 . A A . 48 LEU O 1 1 2 1394 1 1 48 LEU OXT O -4.042 -9.794 6.328 1.00 . A A . 48 LEU OXT 1 1 3 1395 1 1 1 GLY C C -8.234 2.690 17.372 1.00 . A A . 1 GLY C 1 1 3 1396 1 1 1 GLY CA C -9.483 3.317 16.749 1.00 . A A . 1 GLY CA 1 1 3 1397 1 1 1 GLY H1 H -9.295 3.209 14.678 1.00 . A A . 1 GLY H1 1 1 3 1398 1 1 1 GLY H2 H -10.790 2.661 15.269 1.00 . A A . 1 GLY H2 1 1 3 1399 1 1 1 GLY H3 H -9.402 1.698 15.443 1.00 . A A . 1 GLY H3 1 1 3 1400 1 1 1 GLY HA2 H -9.320 4.376 16.602 1.00 . A A . 1 GLY HA2 1 1 3 1401 1 1 1 GLY HA3 H -10.323 3.170 17.410 1.00 . A A . 1 GLY HA3 1 1 3 1402 1 1 1 GLY N N -9.764 2.672 15.436 1.00 . A A . 1 GLY N 1 1 3 1403 1 1 1 GLY O O -7.236 3.350 17.586 1.00 . A A . 1 GLY O 1 1 3 1404 1 1 2 SER C C -5.929 0.722 17.289 1.00 . A A . 2 SER C 1 1 3 1405 1 1 2 SER CA C -7.097 0.750 18.280 1.00 . A A . 2 SER CA 1 1 3 1406 1 1 2 SER CB C -7.564 -0.668 18.596 1.00 . A A . 2 SER CB 1 1 3 1407 1 1 2 SER H H -9.095 0.905 17.489 1.00 . A A . 2 SER H 1 1 3 1408 1 1 2 SER HA H -6.807 1.254 19.189 1.00 . A A . 2 SER HA 1 1 3 1409 1 1 2 SER HB2 H -8.608 -0.655 18.860 1.00 . A A . 2 SER HB2 1 1 3 1410 1 1 2 SER HB3 H -7.423 -1.295 17.725 1.00 . A A . 2 SER HB3 1 1 3 1411 1 1 2 SER HG H -7.006 -0.638 20.460 1.00 . A A . 2 SER HG 1 1 3 1412 1 1 2 SER N N -8.280 1.419 17.667 1.00 . A A . 2 SER N 1 1 3 1413 1 1 2 SER O O -5.737 -0.237 16.569 1.00 . A A . 2 SER O 1 1 3 1414 1 1 2 SER OG O -6.813 -1.178 19.690 1.00 . A A . 2 SER OG 1 1 3 1415 1 1 3 ALA C C -3.239 3.125 16.448 1.00 . A A . 3 ALA C 1 1 3 1416 1 1 3 ALA CA C -3.994 1.802 16.305 1.00 . A A . 3 ALA CA 1 1 3 1417 1 1 3 ALA CB C -4.617 1.687 14.914 1.00 . A A . 3 ALA CB 1 1 3 1418 1 1 3 ALA H H -5.321 2.530 17.838 1.00 . A A . 3 ALA H 1 1 3 1419 1 1 3 ALA HA H -3.333 0.967 16.483 1.00 . A A . 3 ALA HA 1 1 3 1420 1 1 3 ALA HB1 H -5.395 2.428 14.806 1.00 . A A . 3 ALA HB1 1 1 3 1421 1 1 3 ALA HB2 H -5.039 0.700 14.788 1.00 . A A . 3 ALA HB2 1 1 3 1422 1 1 3 ALA HB3 H -3.858 1.850 14.164 1.00 . A A . 3 ALA HB3 1 1 3 1423 1 1 3 ALA N N -5.148 1.767 17.248 1.00 . A A . 3 ALA N 1 1 3 1424 1 1 3 ALA O O -2.026 3.166 16.424 1.00 . A A . 3 ALA O 1 1 3 1425 1 1 4 MET C C -2.147 5.670 15.725 1.00 . A A . 4 MET C 1 1 3 1426 1 1 4 MET CA C -3.281 5.530 16.744 1.00 . A A . 4 MET CA 1 1 3 1427 1 1 4 MET CB C -2.726 5.540 18.168 1.00 . A A . 4 MET CB 1 1 3 1428 1 1 4 MET CE C -4.424 3.068 20.107 1.00 . A A . 4 MET CE 1 1 3 1429 1 1 4 MET CG C -3.885 5.560 19.168 1.00 . A A . 4 MET CG 1 1 3 1430 1 1 4 MET H H -4.931 4.150 16.614 1.00 . A A . 4 MET H 1 1 3 1431 1 1 4 MET HA H -3.996 6.330 16.622 1.00 . A A . 4 MET HA 1 1 3 1432 1 1 4 MET HB2 H -2.126 4.656 18.327 1.00 . A A . 4 MET HB2 1 1 3 1433 1 1 4 MET HB3 H -2.117 6.420 18.310 1.00 . A A . 4 MET HB3 1 1 3 1434 1 1 4 MET HE1 H -4.719 2.520 20.991 1.00 . A A . 4 MET HE1 1 1 3 1435 1 1 4 MET HE2 H -3.820 2.435 19.479 1.00 . A A . 4 MET HE2 1 1 3 1436 1 1 4 MET HE3 H -5.304 3.381 19.560 1.00 . A A . 4 MET HE3 1 1 3 1437 1 1 4 MET HG2 H -4.059 6.573 19.497 1.00 . A A . 4 MET HG2 1 1 3 1438 1 1 4 MET HG3 H -4.775 5.177 18.693 1.00 . A A . 4 MET HG3 1 1 3 1439 1 1 4 MET N N -3.952 4.207 16.597 1.00 . A A . 4 MET N 1 1 3 1440 1 1 4 MET O O -1.160 6.335 15.969 1.00 . A A . 4 MET O 1 1 3 1441 1 1 4 MET SD S -3.470 4.526 20.595 1.00 . A A . 4 MET SD 1 1 3 1442 1 1 5 GLY C C -0.502 3.816 13.393 1.00 . A A . 5 GLY C 1 1 3 1443 1 1 5 GLY CA C -1.211 5.161 13.551 1.00 . A A . 5 GLY CA 1 1 3 1444 1 1 5 GLY H H -3.086 4.526 14.401 1.00 . A A . 5 GLY H 1 1 3 1445 1 1 5 GLY HA2 H -1.652 5.449 12.607 1.00 . A A . 5 GLY HA2 1 1 3 1446 1 1 5 GLY HA3 H -0.493 5.908 13.854 1.00 . A A . 5 GLY HA3 1 1 3 1447 1 1 5 GLY N N -2.281 5.054 14.583 1.00 . A A . 5 GLY N 1 1 3 1448 1 1 5 GLY O O -0.075 3.211 14.353 1.00 . A A . 5 GLY O 1 1 3 1449 1 1 6 CYS C C 1.840 2.255 11.905 1.00 . A A . 6 CYS C 1 1 3 1450 1 1 6 CYS CA C 0.326 2.044 11.962 1.00 . A A . 6 CYS CA 1 1 3 1451 1 1 6 CYS CB C -0.200 1.508 10.622 1.00 . A A . 6 CYS CB 1 1 3 1452 1 1 6 CYS H H -0.711 3.861 11.427 1.00 . A A . 6 CYS H 1 1 3 1453 1 1 6 CYS HA H 0.077 1.353 12.753 1.00 . A A . 6 CYS HA 1 1 3 1454 1 1 6 CYS HB2 H 0.380 0.645 10.332 1.00 . A A . 6 CYS HB2 1 1 3 1455 1 1 6 CYS HB3 H -1.235 1.221 10.734 1.00 . A A . 6 CYS HB3 1 1 3 1456 1 1 6 CYS N N -0.366 3.349 12.184 1.00 . A A . 6 CYS N 1 1 3 1457 1 1 6 CYS O O 2.601 1.324 11.731 1.00 . A A . 6 CYS O 1 1 3 1458 1 1 6 CYS SG S -0.065 2.777 9.332 1.00 . A A . 6 CYS SG 1 1 3 1459 1 1 7 ARG C C 4.462 2.981 13.132 1.00 . A A . 7 ARG C 1 1 3 1460 1 1 7 ARG CA C 3.746 3.745 12.015 1.00 . A A . 7 ARG CA 1 1 3 1461 1 1 7 ARG CB C 3.874 5.254 12.228 1.00 . A A . 7 ARG CB 1 1 3 1462 1 1 7 ARG CD C 5.155 5.571 10.107 1.00 . A A . 7 ARG CD 1 1 3 1463 1 1 7 ARG CG C 5.192 5.746 11.627 1.00 . A A . 7 ARG CG 1 1 3 1464 1 1 7 ARG CZ C 4.524 7.683 9.104 1.00 . A A . 7 ARG CZ 1 1 3 1465 1 1 7 ARG H H 1.652 4.209 12.198 1.00 . A A . 7 ARG H 1 1 3 1466 1 1 7 ARG HA H 4.153 3.476 11.053 1.00 . A A . 7 ARG HA 1 1 3 1467 1 1 7 ARG HB2 H 3.047 5.756 11.747 1.00 . A A . 7 ARG HB2 1 1 3 1468 1 1 7 ARG HB3 H 3.861 5.470 13.286 1.00 . A A . 7 ARG HB3 1 1 3 1469 1 1 7 ARG HD2 H 5.894 4.846 9.795 1.00 . A A . 7 ARG HD2 1 1 3 1470 1 1 7 ARG HD3 H 4.171 5.268 9.787 1.00 . A A . 7 ARG HD3 1 1 3 1471 1 1 7 ARG HE H 6.408 7.227 9.537 1.00 . A A . 7 ARG HE 1 1 3 1472 1 1 7 ARG HG2 H 5.328 6.791 11.866 1.00 . A A . 7 ARG HG2 1 1 3 1473 1 1 7 ARG HG3 H 6.010 5.173 12.033 1.00 . A A . 7 ARG HG3 1 1 3 1474 1 1 7 ARG HH11 H 3.260 7.254 10.596 1.00 . A A . 7 ARG HH11 1 1 3 1475 1 1 7 ARG HH12 H 2.664 8.359 9.403 1.00 . A A . 7 ARG HH12 1 1 3 1476 1 1 7 ARG HH21 H 5.567 8.295 7.508 1.00 . A A . 7 ARG HH21 1 1 3 1477 1 1 7 ARG HH22 H 3.970 8.949 7.656 1.00 . A A . 7 ARG HH22 1 1 3 1478 1 1 7 ARG N N 2.282 3.473 12.056 1.00 . A A . 7 ARG N 1 1 3 1479 1 1 7 ARG NE N 5.479 6.916 9.557 1.00 . A A . 7 ARG NE 1 1 3 1480 1 1 7 ARG NH1 N 3.395 7.772 9.752 1.00 . A A . 7 ARG NH1 1 1 3 1481 1 1 7 ARG NH2 N 4.701 8.363 8.004 1.00 . A A . 7 ARG NH2 1 1 3 1482 1 1 7 ARG O O 5.646 2.719 13.054 1.00 . A A . 7 ARG O 1 1 3 1483 1 1 8 HIS C C 4.027 0.389 15.234 1.00 . A A . 8 HIS C 1 1 3 1484 1 1 8 HIS CA C 4.414 1.871 15.284 1.00 . A A . 8 HIS CA 1 1 3 1485 1 1 8 HIS CB C 3.925 2.530 16.580 1.00 . A A . 8 HIS CB 1 1 3 1486 1 1 8 HIS CD2 C 1.464 1.718 16.089 1.00 . A A . 8 HIS CD2 1 1 3 1487 1 1 8 HIS CE1 C 0.411 3.198 17.270 1.00 . A A . 8 HIS CE1 1 1 3 1488 1 1 8 HIS CG C 2.419 2.533 16.647 1.00 . A A . 8 HIS CG 1 1 3 1489 1 1 8 HIS H H 2.804 2.837 14.222 1.00 . A A . 8 HIS H 1 1 3 1490 1 1 8 HIS HA H 5.486 1.973 15.210 1.00 . A A . 8 HIS HA 1 1 3 1491 1 1 8 HIS HB2 H 4.316 1.983 17.426 1.00 . A A . 8 HIS HB2 1 1 3 1492 1 1 8 HIS HB3 H 4.285 3.547 16.619 1.00 . A A . 8 HIS HB3 1 1 3 1493 1 1 8 HIS HD1 H 2.114 4.198 17.922 1.00 . A A . 8 HIS HD1 1 1 3 1494 1 1 8 HIS HD2 H 1.661 0.880 15.441 1.00 . A A . 8 HIS HD2 1 1 3 1495 1 1 8 HIS HE1 H -0.374 3.767 17.744 1.00 . A A . 8 HIS HE1 1 1 3 1496 1 1 8 HIS N N 3.758 2.619 14.173 1.00 . A A . 8 HIS N 1 1 3 1497 1 1 8 HIS ND1 N 1.722 3.470 17.395 1.00 . A A . 8 HIS ND1 1 1 3 1498 1 1 8 HIS NE2 N 0.198 2.139 16.486 1.00 . A A . 8 HIS NE2 1 1 3 1499 1 1 8 HIS O O 4.451 -0.400 16.055 1.00 . A A . 8 HIS O 1 1 3 1500 1 1 9 PHE C C 4.064 -2.314 14.082 1.00 . A A . 9 PHE C 1 1 3 1501 1 1 9 PHE CA C 2.822 -1.425 14.168 1.00 . A A . 9 PHE CA 1 1 3 1502 1 1 9 PHE CB C 2.014 -1.505 12.870 1.00 . A A . 9 PHE CB 1 1 3 1503 1 1 9 PHE CD1 C 0.107 -0.756 14.383 1.00 . A A . 9 PHE CD1 1 1 3 1504 1 1 9 PHE CD2 C -0.317 -1.104 12.020 1.00 . A A . 9 PHE CD2 1 1 3 1505 1 1 9 PHE CE1 C -1.235 -0.400 14.568 1.00 . A A . 9 PHE CE1 1 1 3 1506 1 1 9 PHE CE2 C -1.657 -0.746 12.207 1.00 . A A . 9 PHE CE2 1 1 3 1507 1 1 9 PHE CG C 0.568 -1.109 13.104 1.00 . A A . 9 PHE CG 1 1 3 1508 1 1 9 PHE CZ C -2.116 -0.395 13.481 1.00 . A A . 9 PHE CZ 1 1 3 1509 1 1 9 PHE H H 2.903 0.656 13.621 1.00 . A A . 9 PHE H 1 1 3 1510 1 1 9 PHE HA H 2.214 -1.713 15.008 1.00 . A A . 9 PHE HA 1 1 3 1511 1 1 9 PHE HB2 H 2.449 -0.838 12.141 1.00 . A A . 9 PHE HB2 1 1 3 1512 1 1 9 PHE HB3 H 2.047 -2.515 12.489 1.00 . A A . 9 PHE HB3 1 1 3 1513 1 1 9 PHE HD1 H 0.780 -0.754 15.223 1.00 . A A . 9 PHE HD1 1 1 3 1514 1 1 9 PHE HD2 H 0.035 -1.375 11.037 1.00 . A A . 9 PHE HD2 1 1 3 1515 1 1 9 PHE HE1 H -1.590 -0.129 15.551 1.00 . A A . 9 PHE HE1 1 1 3 1516 1 1 9 PHE HE2 H -2.337 -0.743 11.368 1.00 . A A . 9 PHE HE2 1 1 3 1517 1 1 9 PHE HZ H -3.151 -0.120 13.626 1.00 . A A . 9 PHE HZ 1 1 3 1518 1 1 9 PHE N N 3.230 0.005 14.274 1.00 . A A . 9 PHE N 1 1 3 1519 1 1 9 PHE O O 5.163 -1.844 13.868 1.00 . A A . 9 PHE O 1 1 3 1520 1 1 10 GLN C C 5.498 -4.690 12.709 1.00 . A A . 10 GLN C 1 1 3 1521 1 1 10 GLN CA C 5.069 -4.514 14.166 1.00 . A A . 10 GLN CA 1 1 3 1522 1 1 10 GLN CB C 4.576 -5.841 14.747 1.00 . A A . 10 GLN CB 1 1 3 1523 1 1 10 GLN CD C 3.656 -4.738 16.792 1.00 . A A . 10 GLN CD 1 1 3 1524 1 1 10 GLN CG C 4.642 -5.787 16.275 1.00 . A A . 10 GLN CG 1 1 3 1525 1 1 10 GLN H H 3.002 -3.956 14.413 1.00 . A A . 10 GLN H 1 1 3 1526 1 1 10 GLN HA H 5.886 -4.133 14.758 1.00 . A A . 10 GLN HA 1 1 3 1527 1 1 10 GLN HB2 H 3.557 -6.014 14.435 1.00 . A A . 10 GLN HB2 1 1 3 1528 1 1 10 GLN HB3 H 5.203 -6.645 14.390 1.00 . A A . 10 GLN HB3 1 1 3 1529 1 1 10 GLN HE21 H 4.953 -3.943 18.068 1.00 . A A . 10 GLN HE21 1 1 3 1530 1 1 10 GLN HE22 H 3.416 -3.223 18.055 1.00 . A A . 10 GLN HE22 1 1 3 1531 1 1 10 GLN HG2 H 4.384 -6.755 16.680 1.00 . A A . 10 GLN HG2 1 1 3 1532 1 1 10 GLN HG3 H 5.642 -5.522 16.583 1.00 . A A . 10 GLN HG3 1 1 3 1533 1 1 10 GLN N N 3.896 -3.597 14.244 1.00 . A A . 10 GLN N 1 1 3 1534 1 1 10 GLN NE2 N 4.041 -3.898 17.715 1.00 . A A . 10 GLN NE2 1 1 3 1535 1 1 10 GLN O O 6.344 -3.975 12.209 1.00 . A A . 10 GLN O 1 1 3 1536 1 1 10 GLN OE1 O 2.525 -4.682 16.354 1.00 . A A . 10 GLN OE1 1 1 3 1537 1 1 11 SER C C 4.273 -5.173 9.673 1.00 . A A . 11 SER C 1 1 3 1538 1 1 11 SER CA C 5.292 -5.851 10.592 1.00 . A A . 11 SER CA 1 1 3 1539 1 1 11 SER CB C 5.256 -7.366 10.401 1.00 . A A . 11 SER CB 1 1 3 1540 1 1 11 SER H H 4.237 -6.200 12.439 1.00 . A A . 11 SER H 1 1 3 1541 1 1 11 SER HA H 6.285 -5.478 10.400 1.00 . A A . 11 SER HA 1 1 3 1542 1 1 11 SER HB2 H 4.233 -7.704 10.378 1.00 . A A . 11 SER HB2 1 1 3 1543 1 1 11 SER HB3 H 5.737 -7.622 9.466 1.00 . A A . 11 SER HB3 1 1 3 1544 1 1 11 SER HG H 6.429 -8.735 11.133 1.00 . A A . 11 SER HG 1 1 3 1545 1 1 11 SER N N 4.919 -5.635 12.020 1.00 . A A . 11 SER N 1 1 3 1546 1 1 11 SER O O 3.736 -4.129 9.990 1.00 . A A . 11 SER O 1 1 3 1547 1 1 11 SER OG O 5.931 -7.993 11.483 1.00 . A A . 11 SER OG 1 1 3 1548 1 1 12 CYS C C 1.626 -5.757 7.834 1.00 . A A . 12 CYS C 1 1 3 1549 1 1 12 CYS CA C 3.011 -5.147 7.606 1.00 . A A . 12 CYS CA 1 1 3 1550 1 1 12 CYS CB C 3.525 -5.488 6.206 1.00 . A A . 12 CYS CB 1 1 3 1551 1 1 12 CYS H H 4.440 -6.600 8.305 1.00 . A A . 12 CYS H 1 1 3 1552 1 1 12 CYS HA H 2.980 -4.078 7.738 1.00 . A A . 12 CYS HA 1 1 3 1553 1 1 12 CYS HB2 H 2.891 -5.021 5.466 1.00 . A A . 12 CYS HB2 1 1 3 1554 1 1 12 CYS HB3 H 4.536 -5.122 6.095 1.00 . A A . 12 CYS HB3 1 1 3 1555 1 1 12 CYS N N 3.999 -5.759 8.540 1.00 . A A . 12 CYS N 1 1 3 1556 1 1 12 CYS O O 0.650 -5.346 7.239 1.00 . A A . 12 CYS O 1 1 3 1557 1 1 12 CYS SG S 3.504 -7.283 5.974 1.00 . A A . 12 CYS SG 1 1 3 1558 1 1 13 SER C C -0.783 -6.334 9.477 1.00 . A A . 13 SER C 1 1 3 1559 1 1 13 SER CA C 0.210 -7.374 8.954 1.00 . A A . 13 SER CA 1 1 3 1560 1 1 13 SER CB C 0.487 -8.430 10.022 1.00 . A A . 13 SER CB 1 1 3 1561 1 1 13 SER H H 2.331 -7.057 9.161 1.00 . A A . 13 SER H 1 1 3 1562 1 1 13 SER HA H -0.169 -7.843 8.060 1.00 . A A . 13 SER HA 1 1 3 1563 1 1 13 SER HB2 H 1.343 -8.138 10.607 1.00 . A A . 13 SER HB2 1 1 3 1564 1 1 13 SER HB3 H -0.375 -8.520 10.670 1.00 . A A . 13 SER HB3 1 1 3 1565 1 1 13 SER HG H 1.707 -9.762 9.300 1.00 . A A . 13 SER HG 1 1 3 1566 1 1 13 SER N N 1.532 -6.738 8.691 1.00 . A A . 13 SER N 1 1 3 1567 1 1 13 SER O O -1.810 -6.088 8.879 1.00 . A A . 13 SER O 1 1 3 1568 1 1 13 SER OG O 0.756 -9.675 9.392 1.00 . A A . 13 SER OG 1 1 3 1569 1 1 14 GLN C C -1.450 -3.461 10.246 1.00 . A A . 14 GLN C 1 1 3 1570 1 1 14 GLN CA C -1.411 -4.695 11.150 1.00 . A A . 14 GLN CA 1 1 3 1571 1 1 14 GLN CB C -0.825 -4.339 12.516 1.00 . A A . 14 GLN CB 1 1 3 1572 1 1 14 GLN CD C -2.117 -4.532 14.646 1.00 . A A . 14 GLN CD 1 1 3 1573 1 1 14 GLN CG C -1.906 -3.692 13.385 1.00 . A A . 14 GLN CG 1 1 3 1574 1 1 14 GLN H H 0.352 -5.932 11.056 1.00 . A A . 14 GLN H 1 1 3 1575 1 1 14 GLN HA H -2.401 -5.107 11.270 1.00 . A A . 14 GLN HA 1 1 3 1576 1 1 14 GLN HB2 H -0.464 -5.236 12.998 1.00 . A A . 14 GLN HB2 1 1 3 1577 1 1 14 GLN HB3 H -0.008 -3.645 12.387 1.00 . A A . 14 GLN HB3 1 1 3 1578 1 1 14 GLN HE21 H -4.032 -4.041 14.822 1.00 . A A . 14 GLN HE21 1 1 3 1579 1 1 14 GLN HE22 H -3.441 -5.092 16.016 1.00 . A A . 14 GLN HE22 1 1 3 1580 1 1 14 GLN HG2 H -1.596 -2.696 13.663 1.00 . A A . 14 GLN HG2 1 1 3 1581 1 1 14 GLN HG3 H -2.831 -3.640 12.830 1.00 . A A . 14 GLN HG3 1 1 3 1582 1 1 14 GLN N N -0.483 -5.720 10.589 1.00 . A A . 14 GLN N 1 1 3 1583 1 1 14 GLN NE2 N -3.295 -4.557 15.208 1.00 . A A . 14 GLN NE2 1 1 3 1584 1 1 14 GLN O O -2.463 -2.804 10.119 1.00 . A A . 14 GLN O 1 1 3 1585 1 1 14 GLN OE1 O -1.202 -5.171 15.124 1.00 . A A . 14 GLN OE1 1 1 3 1586 1 1 15 CYS C C -1.427 -2.056 7.664 1.00 . A A . 15 CYS C 1 1 3 1587 1 1 15 CYS CA C -0.326 -1.949 8.722 1.00 . A A . 15 CYS CA 1 1 3 1588 1 1 15 CYS CB C 1.053 -1.978 8.063 1.00 . A A . 15 CYS CB 1 1 3 1589 1 1 15 CYS H H 0.455 -3.684 9.734 1.00 . A A . 15 CYS H 1 1 3 1590 1 1 15 CYS HA H -0.440 -1.043 9.295 1.00 . A A . 15 CYS HA 1 1 3 1591 1 1 15 CYS HB2 H 1.317 -2.999 7.827 1.00 . A A . 15 CYS HB2 1 1 3 1592 1 1 15 CYS HB3 H 1.032 -1.393 7.155 1.00 . A A . 15 CYS HB3 1 1 3 1593 1 1 15 CYS N N -0.352 -3.141 9.617 1.00 . A A . 15 CYS N 1 1 3 1594 1 1 15 CYS O O -2.055 -1.080 7.304 1.00 . A A . 15 CYS O 1 1 3 1595 1 1 15 CYS SG S 2.280 -1.284 9.198 1.00 . A A . 15 CYS SG 1 1 3 1596 1 1 16 LEU C C -3.976 -4.037 6.726 1.00 . A A . 16 LEU C 1 1 3 1597 1 1 16 LEU CA C -2.717 -3.409 6.118 1.00 . A A . 16 LEU CA 1 1 3 1598 1 1 16 LEU CB C -2.091 -4.347 5.085 1.00 . A A . 16 LEU CB 1 1 3 1599 1 1 16 LEU CD1 C -0.140 -2.785 5.028 1.00 . A A . 16 LEU CD1 1 1 3 1600 1 1 16 LEU CD2 C -0.411 -4.504 3.240 1.00 . A A . 16 LEU CD2 1 1 3 1601 1 1 16 LEU CG C -1.154 -3.548 4.176 1.00 . A A . 16 LEU CG 1 1 3 1602 1 1 16 LEU H H -1.142 -4.010 7.459 1.00 . A A . 16 LEU H 1 1 3 1603 1 1 16 LEU HA H -2.953 -2.464 5.660 1.00 . A A . 16 LEU HA 1 1 3 1604 1 1 16 LEU HB2 H -1.531 -5.120 5.591 1.00 . A A . 16 LEU HB2 1 1 3 1605 1 1 16 LEU HB3 H -2.870 -4.798 4.488 1.00 . A A . 16 LEU HB3 1 1 3 1606 1 1 16 LEU HD11 H 0.167 -3.400 5.861 1.00 . A A . 16 LEU HD11 1 1 3 1607 1 1 16 LEU HD12 H -0.594 -1.877 5.399 1.00 . A A . 16 LEU HD12 1 1 3 1608 1 1 16 LEU HD13 H 0.722 -2.537 4.427 1.00 . A A . 16 LEU HD13 1 1 3 1609 1 1 16 LEU HD21 H 0.289 -5.095 3.811 1.00 . A A . 16 LEU HD21 1 1 3 1610 1 1 16 LEU HD22 H 0.123 -3.934 2.494 1.00 . A A . 16 LEU HD22 1 1 3 1611 1 1 16 LEU HD23 H -1.121 -5.157 2.753 1.00 . A A . 16 LEU HD23 1 1 3 1612 1 1 16 LEU HG H -1.733 -2.847 3.593 1.00 . A A . 16 LEU HG 1 1 3 1613 1 1 16 LEU N N -1.663 -3.237 7.159 1.00 . A A . 16 LEU N 1 1 3 1614 1 1 16 LEU O O -5.015 -4.097 6.098 1.00 . A A . 16 LEU O 1 1 3 1615 1 1 17 SER C C -5.964 -4.033 9.226 1.00 . A A . 17 SER C 1 1 3 1616 1 1 17 SER CA C -5.094 -5.116 8.585 1.00 . A A . 17 SER CA 1 1 3 1617 1 1 17 SER CB C -4.540 -6.056 9.655 1.00 . A A . 17 SER CB 1 1 3 1618 1 1 17 SER H H -3.051 -4.440 8.437 1.00 . A A . 17 SER H 1 1 3 1619 1 1 17 SER HA H -5.663 -5.677 7.859 1.00 . A A . 17 SER HA 1 1 3 1620 1 1 17 SER HB2 H -3.785 -6.690 9.224 1.00 . A A . 17 SER HB2 1 1 3 1621 1 1 17 SER HB3 H -4.104 -5.472 10.455 1.00 . A A . 17 SER HB3 1 1 3 1622 1 1 17 SER HG H -5.795 -7.536 9.505 1.00 . A A . 17 SER HG 1 1 3 1623 1 1 17 SER N N -3.897 -4.500 7.944 1.00 . A A . 17 SER N 1 1 3 1624 1 1 17 SER O O -7.105 -4.264 9.571 1.00 . A A . 17 SER O 1 1 3 1625 1 1 17 SER OG O -5.596 -6.862 10.160 1.00 . A A . 17 SER OG 1 1 3 1626 1 1 18 ALA C C -5.898 -0.416 9.356 1.00 . A A . 18 ALA C 1 1 3 1627 1 1 18 ALA CA C -6.234 -1.759 10.012 1.00 . A A . 18 ALA CA 1 1 3 1628 1 1 18 ALA CB C -5.821 -1.757 11.483 1.00 . A A . 18 ALA CB 1 1 3 1629 1 1 18 ALA H H -4.510 -2.683 9.107 1.00 . A A . 18 ALA H 1 1 3 1630 1 1 18 ALA HA H -7.288 -1.968 9.924 1.00 . A A . 18 ALA HA 1 1 3 1631 1 1 18 ALA HB1 H -5.728 -0.740 11.830 1.00 . A A . 18 ALA HB1 1 1 3 1632 1 1 18 ALA HB2 H -4.875 -2.264 11.592 1.00 . A A . 18 ALA HB2 1 1 3 1633 1 1 18 ALA HB3 H -6.573 -2.269 12.066 1.00 . A A . 18 ALA HB3 1 1 3 1634 1 1 18 ALA N N -5.434 -2.851 9.390 1.00 . A A . 18 ALA N 1 1 3 1635 1 1 18 ALA O O -5.388 0.481 9.998 1.00 . A A . 18 ALA O 1 1 3 1636 1 1 19 PRO C C -6.926 2.055 7.676 1.00 . A A . 19 PRO C 1 1 3 1637 1 1 19 PRO CA C -5.945 0.913 7.324 1.00 . A A . 19 PRO CA 1 1 3 1638 1 1 19 PRO CB C -6.101 0.477 5.868 1.00 . A A . 19 PRO CB 1 1 3 1639 1 1 19 PRO CD C -6.817 -1.374 7.259 1.00 . A A . 19 PRO CD 1 1 3 1640 1 1 19 PRO CG C -6.984 -0.729 5.903 1.00 . A A . 19 PRO CG 1 1 3 1641 1 1 19 PRO HA H -4.931 1.238 7.488 1.00 . A A . 19 PRO HA 1 1 3 1642 1 1 19 PRO HB2 H -6.564 1.266 5.291 1.00 . A A . 19 PRO HB2 1 1 3 1643 1 1 19 PRO HB3 H -5.141 0.219 5.450 1.00 . A A . 19 PRO HB3 1 1 3 1644 1 1 19 PRO HD2 H -7.779 -1.665 7.659 1.00 . A A . 19 PRO HD2 1 1 3 1645 1 1 19 PRO HD3 H -6.159 -2.227 7.195 1.00 . A A . 19 PRO HD3 1 1 3 1646 1 1 19 PRO HG2 H -8.013 -0.437 5.748 1.00 . A A . 19 PRO HG2 1 1 3 1647 1 1 19 PRO HG3 H -6.683 -1.425 5.135 1.00 . A A . 19 PRO HG3 1 1 3 1648 1 1 19 PRO N N -6.207 -0.328 8.089 1.00 . A A . 19 PRO N 1 1 3 1649 1 1 19 PRO O O -6.560 3.208 7.560 1.00 . A A . 19 PRO O 1 1 3 1650 1 1 20 PRO C C -8.765 3.426 9.784 1.00 . A A . 20 PRO C 1 1 3 1651 1 1 20 PRO CA C -9.106 2.807 8.426 1.00 . A A . 20 PRO CA 1 1 3 1652 1 1 20 PRO CB C -10.446 2.084 8.492 1.00 . A A . 20 PRO CB 1 1 3 1653 1 1 20 PRO CD C -8.725 0.397 8.276 1.00 . A A . 20 PRO CD 1 1 3 1654 1 1 20 PRO CG C -10.108 0.664 8.811 1.00 . A A . 20 PRO CG 1 1 3 1655 1 1 20 PRO HA H -9.129 3.560 7.655 1.00 . A A . 20 PRO HA 1 1 3 1656 1 1 20 PRO HB2 H -11.063 2.509 9.271 1.00 . A A . 20 PRO HB2 1 1 3 1657 1 1 20 PRO HB3 H -10.951 2.138 7.540 1.00 . A A . 20 PRO HB3 1 1 3 1658 1 1 20 PRO HD2 H -8.159 -0.175 8.994 1.00 . A A . 20 PRO HD2 1 1 3 1659 1 1 20 PRO HD3 H -8.781 -0.122 7.336 1.00 . A A . 20 PRO HD3 1 1 3 1660 1 1 20 PRO HG2 H -10.126 0.516 9.883 1.00 . A A . 20 PRO HG2 1 1 3 1661 1 1 20 PRO HG3 H -10.815 0.001 8.336 1.00 . A A . 20 PRO HG3 1 1 3 1662 1 1 20 PRO N N -8.139 1.733 8.087 1.00 . A A . 20 PRO N 1 1 3 1663 1 1 20 PRO O O -9.238 4.491 10.127 1.00 . A A . 20 PRO O 1 1 3 1664 1 1 21 PHE C C -6.151 3.829 11.888 1.00 . A A . 21 PHE C 1 1 3 1665 1 1 21 PHE CA C -7.590 3.309 11.899 1.00 . A A . 21 PHE CA 1 1 3 1666 1 1 21 PHE CB C -7.714 2.123 12.862 1.00 . A A . 21 PHE CB 1 1 3 1667 1 1 21 PHE CD1 C -10.192 1.983 12.417 1.00 . A A . 21 PHE CD1 1 1 3 1668 1 1 21 PHE CD2 C -8.886 -0.060 12.393 1.00 . A A . 21 PHE CD2 1 1 3 1669 1 1 21 PHE CE1 C -11.347 1.247 12.129 1.00 . A A . 21 PHE CE1 1 1 3 1670 1 1 21 PHE CE2 C -10.041 -0.796 12.105 1.00 . A A . 21 PHE CE2 1 1 3 1671 1 1 21 PHE CG C -8.962 1.330 12.549 1.00 . A A . 21 PHE CG 1 1 3 1672 1 1 21 PHE CZ C -11.272 -0.142 11.973 1.00 . A A . 21 PHE CZ 1 1 3 1673 1 1 21 PHE H H -7.589 1.902 10.268 1.00 . A A . 21 PHE H 1 1 3 1674 1 1 21 PHE HA H -8.275 4.091 12.189 1.00 . A A . 21 PHE HA 1 1 3 1675 1 1 21 PHE HB2 H -6.849 1.485 12.755 1.00 . A A . 21 PHE HB2 1 1 3 1676 1 1 21 PHE HB3 H -7.767 2.487 13.877 1.00 . A A . 21 PHE HB3 1 1 3 1677 1 1 21 PHE HD1 H -10.251 3.055 12.537 1.00 . A A . 21 PHE HD1 1 1 3 1678 1 1 21 PHE HD2 H -7.936 -0.563 12.494 1.00 . A A . 21 PHE HD2 1 1 3 1679 1 1 21 PHE HE1 H -12.297 1.750 12.028 1.00 . A A . 21 PHE HE1 1 1 3 1680 1 1 21 PHE HE2 H -9.982 -1.867 11.985 1.00 . A A . 21 PHE HE2 1 1 3 1681 1 1 21 PHE HZ H -12.164 -0.710 11.751 1.00 . A A . 21 PHE HZ 1 1 3 1682 1 1 21 PHE N N -7.955 2.763 10.561 1.00 . A A . 21 PHE N 1 1 3 1683 1 1 21 PHE O O -5.641 4.287 12.892 1.00 . A A . 21 PHE O 1 1 3 1684 1 1 22 VAL C C -3.860 5.197 9.543 1.00 . A A . 22 VAL C 1 1 3 1685 1 1 22 VAL CA C -4.071 4.229 10.714 1.00 . A A . 22 VAL CA 1 1 3 1686 1 1 22 VAL CB C -3.238 2.966 10.513 1.00 . A A . 22 VAL CB 1 1 3 1687 1 1 22 VAL CG1 C -3.565 1.949 11.608 1.00 . A A . 22 VAL CG1 1 1 3 1688 1 1 22 VAL CG2 C -3.552 2.361 9.142 1.00 . A A . 22 VAL CG2 1 1 3 1689 1 1 22 VAL H H -5.905 3.369 9.970 1.00 . A A . 22 VAL H 1 1 3 1690 1 1 22 VAL HA H -3.799 4.700 11.644 1.00 . A A . 22 VAL HA 1 1 3 1691 1 1 22 VAL HB H -2.192 3.219 10.562 1.00 . A A . 22 VAL HB 1 1 3 1692 1 1 22 VAL HG11 H -3.640 0.962 11.173 1.00 . A A . 22 VAL HG11 1 1 3 1693 1 1 22 VAL HG12 H -4.503 2.208 12.074 1.00 . A A . 22 VAL HG12 1 1 3 1694 1 1 22 VAL HG13 H -2.781 1.956 12.350 1.00 . A A . 22 VAL HG13 1 1 3 1695 1 1 22 VAL HG21 H -3.129 1.368 9.081 1.00 . A A . 22 VAL HG21 1 1 3 1696 1 1 22 VAL HG22 H -3.124 2.981 8.368 1.00 . A A . 22 VAL HG22 1 1 3 1697 1 1 22 VAL HG23 H -4.622 2.305 9.008 1.00 . A A . 22 VAL HG23 1 1 3 1698 1 1 22 VAL N N -5.483 3.751 10.768 1.00 . A A . 22 VAL N 1 1 3 1699 1 1 22 VAL O O -4.800 5.671 8.937 1.00 . A A . 22 VAL O 1 1 3 1700 1 1 23 GLN C C -1.087 5.982 7.335 1.00 . A A . 23 GLN C 1 1 3 1701 1 1 23 GLN CA C -2.341 6.426 8.097 1.00 . A A . 23 GLN CA 1 1 3 1702 1 1 23 GLN CB C -2.111 7.787 8.753 1.00 . A A . 23 GLN CB 1 1 3 1703 1 1 23 GLN CD C -2.136 10.157 7.959 1.00 . A A . 23 GLN CD 1 1 3 1704 1 1 23 GLN CG C -1.548 8.765 7.719 1.00 . A A . 23 GLN CG 1 1 3 1705 1 1 23 GLN H H -1.883 5.096 9.730 1.00 . A A . 23 GLN H 1 1 3 1706 1 1 23 GLN HA H -3.188 6.478 7.430 1.00 . A A . 23 GLN HA 1 1 3 1707 1 1 23 GLN HB2 H -3.047 8.166 9.136 1.00 . A A . 23 GLN HB2 1 1 3 1708 1 1 23 GLN HB3 H -1.406 7.682 9.564 1.00 . A A . 23 GLN HB3 1 1 3 1709 1 1 23 GLN HE21 H -3.668 9.882 6.724 1.00 . A A . 23 GLN HE21 1 1 3 1710 1 1 23 GLN HE22 H -3.614 11.397 7.486 1.00 . A A . 23 GLN HE22 1 1 3 1711 1 1 23 GLN HG2 H -0.472 8.808 7.810 1.00 . A A . 23 GLN HG2 1 1 3 1712 1 1 23 GLN HG3 H -1.812 8.431 6.726 1.00 . A A . 23 GLN HG3 1 1 3 1713 1 1 23 GLN N N -2.625 5.491 9.226 1.00 . A A . 23 GLN N 1 1 3 1714 1 1 23 GLN NE2 N -3.230 10.508 7.338 1.00 . A A . 23 GLN NE2 1 1 3 1715 1 1 23 GLN O O -1.003 6.120 6.130 1.00 . A A . 23 GLN O 1 1 3 1716 1 1 23 GLN OE1 O -1.595 10.934 8.719 1.00 . A A . 23 GLN OE1 1 1 3 1717 1 1 24 CYS C C 0.838 3.819 6.409 1.00 . A A . 24 CYS C 1 1 3 1718 1 1 24 CYS CA C 1.136 5.017 7.323 1.00 . A A . 24 CYS CA 1 1 3 1719 1 1 24 CYS CB C 2.131 4.657 8.442 1.00 . A A . 24 CYS CB 1 1 3 1720 1 1 24 CYS H H -0.187 5.356 8.995 1.00 . A A . 24 CYS H 1 1 3 1721 1 1 24 CYS HA H 1.531 5.832 6.736 1.00 . A A . 24 CYS HA 1 1 3 1722 1 1 24 CYS HB2 H 3.137 4.789 8.078 1.00 . A A . 24 CYS HB2 1 1 3 1723 1 1 24 CYS HB3 H 1.970 5.316 9.283 1.00 . A A . 24 CYS HB3 1 1 3 1724 1 1 24 CYS N N -0.107 5.456 8.024 1.00 . A A . 24 CYS N 1 1 3 1725 1 1 24 CYS O O -0.263 3.305 6.381 1.00 . A A . 24 CYS O 1 1 3 1726 1 1 24 CYS SG S 1.914 2.938 8.980 1.00 . A A . 24 CYS SG 1 1 3 1727 1 1 25 GLY C C 2.905 1.488 4.540 1.00 . A A . 25 GLY C 1 1 3 1728 1 1 25 GLY CA C 1.592 2.242 4.727 1.00 . A A . 25 GLY CA 1 1 3 1729 1 1 25 GLY H H 2.683 3.829 5.688 1.00 . A A . 25 GLY H 1 1 3 1730 1 1 25 GLY HA2 H 0.847 1.577 5.144 1.00 . A A . 25 GLY HA2 1 1 3 1731 1 1 25 GLY HA3 H 1.252 2.608 3.772 1.00 . A A . 25 GLY HA3 1 1 3 1732 1 1 25 GLY N N 1.809 3.389 5.654 1.00 . A A . 25 GLY N 1 1 3 1733 1 1 25 GLY O O 3.908 1.823 5.128 1.00 . A A . 25 GLY O 1 1 3 1734 1 1 26 TRP C C 4.967 0.345 2.370 1.00 . A A . 26 TRP C 1 1 3 1735 1 1 26 TRP CA C 4.172 -0.296 3.510 1.00 . A A . 26 TRP CA 1 1 3 1736 1 1 26 TRP CB C 3.704 -1.698 3.116 1.00 . A A . 26 TRP CB 1 1 3 1737 1 1 26 TRP CD1 C 5.451 -3.433 2.537 1.00 . A A . 26 TRP CD1 1 1 3 1738 1 1 26 TRP CD2 C 5.244 -3.115 4.753 1.00 . A A . 26 TRP CD2 1 1 3 1739 1 1 26 TRP CE2 C 6.240 -4.103 4.577 1.00 . A A . 26 TRP CE2 1 1 3 1740 1 1 26 TRP CE3 C 4.919 -2.725 6.061 1.00 . A A . 26 TRP CE3 1 1 3 1741 1 1 26 TRP CG C 4.759 -2.706 3.444 1.00 . A A . 26 TRP CG 1 1 3 1742 1 1 26 TRP CH2 C 6.554 -4.289 6.962 1.00 . A A . 26 TRP CH2 1 1 3 1743 1 1 26 TRP CZ2 C 6.890 -4.685 5.665 1.00 . A A . 26 TRP CZ2 1 1 3 1744 1 1 26 TRP CZ3 C 5.571 -3.309 7.160 1.00 . A A . 26 TRP CZ3 1 1 3 1745 1 1 26 TRP H H 2.093 0.213 3.252 1.00 . A A . 26 TRP H 1 1 3 1746 1 1 26 TRP HA H 4.758 -0.336 4.414 1.00 . A A . 26 TRP HA 1 1 3 1747 1 1 26 TRP HB2 H 2.800 -1.938 3.656 1.00 . A A . 26 TRP HB2 1 1 3 1748 1 1 26 TRP HB3 H 3.504 -1.723 2.057 1.00 . A A . 26 TRP HB3 1 1 3 1749 1 1 26 TRP HD1 H 5.335 -3.376 1.465 1.00 . A A . 26 TRP HD1 1 1 3 1750 1 1 26 TRP HE1 H 6.950 -4.894 2.785 1.00 . A A . 26 TRP HE1 1 1 3 1751 1 1 26 TRP HE3 H 4.165 -1.971 6.222 1.00 . A A . 26 TRP HE3 1 1 3 1752 1 1 26 TRP HH2 H 7.053 -4.734 7.810 1.00 . A A . 26 TRP HH2 1 1 3 1753 1 1 26 TRP HZ2 H 7.646 -5.440 5.506 1.00 . A A . 26 TRP HZ2 1 1 3 1754 1 1 26 TRP HZ3 H 5.313 -3.003 8.163 1.00 . A A . 26 TRP HZ3 1 1 3 1755 1 1 26 TRP N N 2.913 0.472 3.726 1.00 . A A . 26 TRP N 1 1 3 1756 1 1 26 TRP NE1 N 6.331 -4.263 3.209 1.00 . A A . 26 TRP NE1 1 1 3 1757 1 1 26 TRP O O 4.413 0.737 1.360 1.00 . A A . 26 TRP O 1 1 3 1758 1 1 27 CYS C C 8.384 0.371 1.221 1.00 . A A . 27 CYS C 1 1 3 1759 1 1 27 CYS CA C 7.063 1.114 1.447 1.00 . A A . 27 CYS CA 1 1 3 1760 1 1 27 CYS CB C 7.330 2.529 1.958 1.00 . A A . 27 CYS CB 1 1 3 1761 1 1 27 CYS H H 6.690 0.173 3.352 1.00 . A A . 27 CYS H 1 1 3 1762 1 1 27 CYS HA H 6.496 1.159 0.531 1.00 . A A . 27 CYS HA 1 1 3 1763 1 1 27 CYS HB2 H 6.684 2.730 2.800 1.00 . A A . 27 CYS HB2 1 1 3 1764 1 1 27 CYS HB3 H 8.361 2.611 2.267 1.00 . A A . 27 CYS HB3 1 1 3 1765 1 1 27 CYS N N 6.258 0.477 2.526 1.00 . A A . 27 CYS N 1 1 3 1766 1 1 27 CYS O O 9.362 0.585 1.912 1.00 . A A . 27 CYS O 1 1 3 1767 1 1 27 CYS SG S 6.994 3.727 0.644 1.00 . A A . 27 CYS SG 1 1 3 1768 1 1 28 HIS C C 10.264 -2.019 1.075 1.00 . A A . 28 HIS C 1 1 3 1769 1 1 28 HIS CA C 9.673 -1.226 -0.109 1.00 . A A . 28 HIS CA 1 1 3 1770 1 1 28 HIS CB C 10.657 -0.146 -0.555 1.00 . A A . 28 HIS CB 1 1 3 1771 1 1 28 HIS CD2 C 9.538 -0.243 -2.931 1.00 . A A . 28 HIS CD2 1 1 3 1772 1 1 28 HIS CE1 C 11.122 0.709 -4.064 1.00 . A A . 28 HIS CE1 1 1 3 1773 1 1 28 HIS CG C 10.536 0.065 -2.039 1.00 . A A . 28 HIS CG 1 1 3 1774 1 1 28 HIS H H 7.622 -0.602 -0.324 1.00 . A A . 28 HIS H 1 1 3 1775 1 1 28 HIS HA H 9.486 -1.893 -0.935 1.00 . A A . 28 HIS HA 1 1 3 1776 1 1 28 HIS HB2 H 10.434 0.778 -0.041 1.00 . A A . 28 HIS HB2 1 1 3 1777 1 1 28 HIS HB3 H 11.664 -0.456 -0.317 1.00 . A A . 28 HIS HB3 1 1 3 1778 1 1 28 HIS HD1 H 12.388 1.010 -2.441 1.00 . A A . 28 HIS HD1 1 1 3 1779 1 1 28 HIS HD2 H 8.606 -0.728 -2.680 1.00 . A A . 28 HIS HD2 1 1 3 1780 1 1 28 HIS HE1 H 11.698 1.128 -4.874 1.00 . A A . 28 HIS HE1 1 1 3 1781 1 1 28 HIS N N 8.422 -0.475 0.228 1.00 . A A . 28 HIS N 1 1 3 1782 1 1 28 HIS ND1 N 11.535 0.671 -2.784 1.00 . A A . 28 HIS ND1 1 1 3 1783 1 1 28 HIS NE2 N 9.911 0.164 -4.209 1.00 . A A . 28 HIS NE2 1 1 3 1784 1 1 28 HIS O O 11.267 -2.684 0.914 1.00 . A A . 28 HIS O 1 1 3 1785 1 1 29 ASP C C 9.630 -2.396 4.723 1.00 . A A . 29 ASP C 1 1 3 1786 1 1 29 ASP CA C 10.283 -2.758 3.382 1.00 . A A . 29 ASP CA 1 1 3 1787 1 1 29 ASP CB C 11.774 -2.387 3.404 1.00 . A A . 29 ASP CB 1 1 3 1788 1 1 29 ASP CG C 11.961 -0.915 3.019 1.00 . A A . 29 ASP CG 1 1 3 1789 1 1 29 ASP H H 8.874 -1.455 2.394 1.00 . A A . 29 ASP H 1 1 3 1790 1 1 29 ASP HA H 10.178 -3.816 3.196 1.00 . A A . 29 ASP HA 1 1 3 1791 1 1 29 ASP HB2 H 12.168 -2.548 4.397 1.00 . A A . 29 ASP HB2 1 1 3 1792 1 1 29 ASP HB3 H 12.309 -3.010 2.702 1.00 . A A . 29 ASP HB3 1 1 3 1793 1 1 29 ASP N N 9.684 -1.978 2.252 1.00 . A A . 29 ASP N 1 1 3 1794 1 1 29 ASP O O 8.963 -3.206 5.334 1.00 . A A . 29 ASP O 1 1 3 1795 1 1 29 ASP OD1 O 11.295 -0.080 3.608 1.00 . A A . 29 ASP OD1 1 1 3 1796 1 1 29 ASP OD2 O 12.766 -0.651 2.141 1.00 . A A . 29 ASP OD2 1 1 3 1797 1 1 30 LYS C C 7.854 -0.198 6.320 1.00 . A A . 30 LYS C 1 1 3 1798 1 1 30 LYS CA C 9.245 -0.804 6.509 1.00 . A A . 30 LYS CA 1 1 3 1799 1 1 30 LYS CB C 10.212 0.238 7.077 1.00 . A A . 30 LYS CB 1 1 3 1800 1 1 30 LYS CD C 11.314 1.076 9.160 1.00 . A A . 30 LYS CD 1 1 3 1801 1 1 30 LYS CE C 10.640 2.302 9.781 1.00 . A A . 30 LYS CE 1 1 3 1802 1 1 30 LYS CG C 10.247 0.129 8.603 1.00 . A A . 30 LYS CG 1 1 3 1803 1 1 30 LYS H H 10.391 -0.561 4.699 1.00 . A A . 30 LYS H 1 1 3 1804 1 1 30 LYS HA H 9.195 -1.655 7.169 1.00 . A A . 30 LYS HA 1 1 3 1805 1 1 30 LYS HB2 H 11.201 0.064 6.681 1.00 . A A . 30 LYS HB2 1 1 3 1806 1 1 30 LYS HB3 H 9.880 1.227 6.797 1.00 . A A . 30 LYS HB3 1 1 3 1807 1 1 30 LYS HD2 H 11.892 0.562 9.914 1.00 . A A . 30 LYS HD2 1 1 3 1808 1 1 30 LYS HD3 H 11.967 1.393 8.362 1.00 . A A . 30 LYS HD3 1 1 3 1809 1 1 30 LYS HE2 H 9.785 2.599 9.190 1.00 . A A . 30 LYS HE2 1 1 3 1810 1 1 30 LYS HE3 H 10.343 2.094 10.797 1.00 . A A . 30 LYS HE3 1 1 3 1811 1 1 30 LYS HG2 H 9.281 0.398 9.006 1.00 . A A . 30 LYS HG2 1 1 3 1812 1 1 30 LYS HG3 H 10.486 -0.885 8.886 1.00 . A A . 30 LYS HG3 1 1 3 1813 1 1 30 LYS HZ1 H 12.291 3.272 10.600 1.00 . A A . 30 LYS HZ1 1 1 3 1814 1 1 30 LYS HZ2 H 11.223 4.301 9.772 1.00 . A A . 30 LYS HZ2 1 1 3 1815 1 1 30 LYS HZ3 H 12.260 3.274 8.904 1.00 . A A . 30 LYS HZ3 1 1 3 1816 1 1 30 LYS N N 9.837 -1.197 5.197 1.00 . A A . 30 LYS N 1 1 3 1817 1 1 30 LYS NZ N 11.682 3.367 9.763 1.00 . A A . 30 LYS NZ 1 1 3 1818 1 1 30 LYS O O 7.449 0.128 5.221 1.00 . A A . 30 LYS O 1 1 3 1819 1 1 31 CYS C C 5.816 2.057 7.464 1.00 . A A . 31 CYS C 1 1 3 1820 1 1 31 CYS CA C 5.757 0.539 7.280 1.00 . A A . 31 CYS CA 1 1 3 1821 1 1 31 CYS CB C 4.954 -0.105 8.409 1.00 . A A . 31 CYS CB 1 1 3 1822 1 1 31 CYS H H 7.469 -0.315 8.266 1.00 . A A . 31 CYS H 1 1 3 1823 1 1 31 CYS HA H 5.317 0.291 6.327 1.00 . A A . 31 CYS HA 1 1 3 1824 1 1 31 CYS HB2 H 5.155 -1.165 8.435 1.00 . A A . 31 CYS HB2 1 1 3 1825 1 1 31 CYS HB3 H 5.239 0.339 9.351 1.00 . A A . 31 CYS HB3 1 1 3 1826 1 1 31 CYS N N 7.122 -0.046 7.390 1.00 . A A . 31 CYS N 1 1 3 1827 1 1 31 CYS O O 5.966 2.557 8.560 1.00 . A A . 31 CYS O 1 1 3 1828 1 1 31 CYS SG S 3.187 0.168 8.125 1.00 . A A . 31 CYS SG 1 1 3 1829 1 1 32 VAL C C 4.826 4.887 5.426 1.00 . A A . 32 VAL C 1 1 3 1830 1 1 32 VAL CA C 5.731 4.273 6.495 1.00 . A A . 32 VAL CA 1 1 3 1831 1 1 32 VAL CB C 7.189 4.647 6.239 1.00 . A A . 32 VAL CB 1 1 3 1832 1 1 32 VAL CG1 C 8.104 3.743 7.069 1.00 . A A . 32 VAL CG1 1 1 3 1833 1 1 32 VAL CG2 C 7.507 4.465 4.752 1.00 . A A . 32 VAL CG2 1 1 3 1834 1 1 32 VAL H H 5.567 2.364 5.523 1.00 . A A . 32 VAL H 1 1 3 1835 1 1 32 VAL HA H 5.432 4.597 7.479 1.00 . A A . 32 VAL HA 1 1 3 1836 1 1 32 VAL HB H 7.350 5.676 6.520 1.00 . A A . 32 VAL HB 1 1 3 1837 1 1 32 VAL HG11 H 9.090 4.180 7.122 1.00 . A A . 32 VAL HG11 1 1 3 1838 1 1 32 VAL HG12 H 8.164 2.769 6.605 1.00 . A A . 32 VAL HG12 1 1 3 1839 1 1 32 VAL HG13 H 7.701 3.642 8.066 1.00 . A A . 32 VAL HG13 1 1 3 1840 1 1 32 VAL HG21 H 7.652 5.432 4.294 1.00 . A A . 32 VAL HG21 1 1 3 1841 1 1 32 VAL HG22 H 6.684 3.959 4.268 1.00 . A A . 32 VAL HG22 1 1 3 1842 1 1 32 VAL HG23 H 8.404 3.876 4.644 1.00 . A A . 32 VAL HG23 1 1 3 1843 1 1 32 VAL N N 5.692 2.790 6.395 1.00 . A A . 32 VAL N 1 1 3 1844 1 1 32 VAL O O 4.305 4.198 4.573 1.00 . A A . 32 VAL O 1 1 3 1845 1 1 33 ARG C C 4.628 7.681 3.495 1.00 . A A . 33 ARG C 1 1 3 1846 1 1 33 ARG CA C 3.777 6.824 4.434 1.00 . A A . 33 ARG CA 1 1 3 1847 1 1 33 ARG CB C 2.800 7.692 5.227 1.00 . A A . 33 ARG CB 1 1 3 1848 1 1 33 ARG CD C 0.889 9.130 4.513 1.00 . A A . 33 ARG CD 1 1 3 1849 1 1 33 ARG CG C 1.445 7.706 4.520 1.00 . A A . 33 ARG CG 1 1 3 1850 1 1 33 ARG CZ C -0.478 8.540 2.604 1.00 . A A . 33 ARG CZ 1 1 3 1851 1 1 33 ARG H H 5.076 6.718 6.151 1.00 . A A . 33 ARG H 1 1 3 1852 1 1 33 ARG HA H 3.236 6.078 3.874 1.00 . A A . 33 ARG HA 1 1 3 1853 1 1 33 ARG HB2 H 2.684 7.286 6.222 1.00 . A A . 33 ARG HB2 1 1 3 1854 1 1 33 ARG HB3 H 3.180 8.700 5.292 1.00 . A A . 33 ARG HB3 1 1 3 1855 1 1 33 ARG HD2 H 0.749 9.481 5.526 1.00 . A A . 33 ARG HD2 1 1 3 1856 1 1 33 ARG HD3 H 1.550 9.790 3.973 1.00 . A A . 33 ARG HD3 1 1 3 1857 1 1 33 ARG HE H -1.238 9.336 4.255 1.00 . A A . 33 ARG HE 1 1 3 1858 1 1 33 ARG HG2 H 1.567 7.360 3.503 1.00 . A A . 33 ARG HG2 1 1 3 1859 1 1 33 ARG HG3 H 0.759 7.055 5.041 1.00 . A A . 33 ARG HG3 1 1 3 1860 1 1 33 ARG HH11 H 1.437 8.939 2.180 1.00 . A A . 33 ARG HH11 1 1 3 1861 1 1 33 ARG HH12 H 0.535 8.174 0.915 1.00 . A A . 33 ARG HH12 1 1 3 1862 1 1 33 ARG HH21 H -2.407 8.028 2.742 1.00 . A A . 33 ARG HH21 1 1 3 1863 1 1 33 ARG HH22 H -1.641 7.659 1.234 1.00 . A A . 33 ARG HH22 1 1 3 1864 1 1 33 ARG N N 4.642 6.176 5.458 1.00 . A A . 33 ARG N 1 1 3 1865 1 1 33 ARG NE N -0.420 9.031 3.811 1.00 . A A . 33 ARG NE 1 1 3 1866 1 1 33 ARG NH1 N 0.581 8.552 1.840 1.00 . A A . 33 ARG NH1 1 1 3 1867 1 1 33 ARG NH2 N -1.596 8.036 2.159 1.00 . A A . 33 ARG NH2 1 1 3 1868 1 1 33 ARG O O 5.815 7.852 3.697 1.00 . A A . 33 ARG O 1 1 3 1869 1 1 34 SER C C 5.753 9.999 2.268 1.00 . A A . 34 SER C 1 1 3 1870 1 1 34 SER CA C 4.808 9.060 1.511 1.00 . A A . 34 SER CA 1 1 3 1871 1 1 34 SER CB C 3.756 9.858 0.747 1.00 . A A . 34 SER CB 1 1 3 1872 1 1 34 SER H H 3.077 8.064 2.322 1.00 . A A . 34 SER H 1 1 3 1873 1 1 34 SER HA H 5.366 8.438 0.828 1.00 . A A . 34 SER HA 1 1 3 1874 1 1 34 SER HB2 H 2.869 9.957 1.349 1.00 . A A . 34 SER HB2 1 1 3 1875 1 1 34 SER HB3 H 4.145 10.842 0.520 1.00 . A A . 34 SER HB3 1 1 3 1876 1 1 34 SER HG H 2.736 9.668 -0.899 1.00 . A A . 34 SER HG 1 1 3 1877 1 1 34 SER N N 4.034 8.217 2.467 1.00 . A A . 34 SER N 1 1 3 1878 1 1 34 SER O O 6.764 10.428 1.749 1.00 . A A . 34 SER O 1 1 3 1879 1 1 34 SER OG O 3.431 9.176 -0.457 1.00 . A A . 34 SER OG 1 1 3 1880 1 1 35 GLU C C 7.617 10.546 4.659 1.00 . A A . 35 GLU C 1 1 3 1881 1 1 35 GLU CA C 6.308 11.244 4.274 1.00 . A A . 35 GLU CA 1 1 3 1882 1 1 35 GLU CB C 5.500 11.588 5.525 1.00 . A A . 35 GLU CB 1 1 3 1883 1 1 35 GLU CD C 5.130 14.002 6.049 1.00 . A A . 35 GLU CD 1 1 3 1884 1 1 35 GLU CG C 6.097 12.826 6.196 1.00 . A A . 35 GLU CG 1 1 3 1885 1 1 35 GLU H H 4.608 9.976 3.891 1.00 . A A . 35 GLU H 1 1 3 1886 1 1 35 GLU HA H 6.512 12.141 3.712 1.00 . A A . 35 GLU HA 1 1 3 1887 1 1 35 GLU HB2 H 4.474 11.787 5.248 1.00 . A A . 35 GLU HB2 1 1 3 1888 1 1 35 GLU HB3 H 5.532 10.758 6.214 1.00 . A A . 35 GLU HB3 1 1 3 1889 1 1 35 GLU HG2 H 6.263 12.624 7.244 1.00 . A A . 35 GLU HG2 1 1 3 1890 1 1 35 GLU HG3 H 7.036 13.073 5.724 1.00 . A A . 35 GLU HG3 1 1 3 1891 1 1 35 GLU N N 5.430 10.328 3.490 1.00 . A A . 35 GLU N 1 1 3 1892 1 1 35 GLU O O 8.664 11.160 4.718 1.00 . A A . 35 GLU O 1 1 3 1893 1 1 35 GLU OE1 O 3.961 13.822 6.348 1.00 . A A . 35 GLU OE1 1 1 3 1894 1 1 35 GLU OE2 O 5.574 15.062 5.638 1.00 . A A . 35 GLU OE2 1 1 3 1895 1 1 36 GLU C C 9.273 7.616 4.186 1.00 . A A . 36 GLU C 1 1 3 1896 1 1 36 GLU CA C 8.817 8.546 5.315 1.00 . A A . 36 GLU CA 1 1 3 1897 1 1 36 GLU CB C 8.440 7.735 6.554 1.00 . A A . 36 GLU CB 1 1 3 1898 1 1 36 GLU CD C 10.276 7.775 8.246 1.00 . A A . 36 GLU CD 1 1 3 1899 1 1 36 GLU CG C 8.971 8.437 7.805 1.00 . A A . 36 GLU CG 1 1 3 1900 1 1 36 GLU H H 6.717 8.788 4.881 1.00 . A A . 36 GLU H 1 1 3 1901 1 1 36 GLU HA H 9.597 9.248 5.561 1.00 . A A . 36 GLU HA 1 1 3 1902 1 1 36 GLU HB2 H 7.364 7.651 6.617 1.00 . A A . 36 GLU HB2 1 1 3 1903 1 1 36 GLU HB3 H 8.875 6.750 6.486 1.00 . A A . 36 GLU HB3 1 1 3 1904 1 1 36 GLU HG2 H 9.152 9.479 7.583 1.00 . A A . 36 GLU HG2 1 1 3 1905 1 1 36 GLU HG3 H 8.243 8.359 8.599 1.00 . A A . 36 GLU HG3 1 1 3 1906 1 1 36 GLU N N 7.570 9.269 4.928 1.00 . A A . 36 GLU N 1 1 3 1907 1 1 36 GLU O O 10.296 6.967 4.280 1.00 . A A . 36 GLU O 1 1 3 1908 1 1 36 GLU OE1 O 10.239 6.602 8.580 1.00 . A A . 36 GLU OE1 1 1 3 1909 1 1 36 GLU OE2 O 11.291 8.451 8.242 1.00 . A A . 36 GLU OE2 1 1 3 1910 1 1 37 CYS C C 10.155 7.238 1.277 1.00 . A A . 37 CYS C 1 1 3 1911 1 1 37 CYS CA C 8.928 6.658 1.988 1.00 . A A . 37 CYS CA 1 1 3 1912 1 1 37 CYS CB C 7.720 6.639 1.051 1.00 . A A . 37 CYS CB 1 1 3 1913 1 1 37 CYS H H 7.704 8.077 3.057 1.00 . A A . 37 CYS H 1 1 3 1914 1 1 37 CYS HA H 9.133 5.661 2.346 1.00 . A A . 37 CYS HA 1 1 3 1915 1 1 37 CYS HB2 H 7.262 7.617 1.036 1.00 . A A . 37 CYS HB2 1 1 3 1916 1 1 37 CYS HB3 H 8.042 6.376 0.053 1.00 . A A . 37 CYS HB3 1 1 3 1917 1 1 37 CYS N N 8.526 7.547 3.117 1.00 . A A . 37 CYS N 1 1 3 1918 1 1 37 CYS O O 10.213 8.415 0.982 1.00 . A A . 37 CYS O 1 1 3 1919 1 1 37 CYS SG S 6.518 5.420 1.637 1.00 . A A . 37 CYS SG 1 1 3 1920 1 1 38 LEU C C 11.993 7.688 -0.957 1.00 . A A . 38 LEU C 1 1 3 1921 1 1 38 LEU CA C 12.365 6.935 0.323 1.00 . A A . 38 LEU CA 1 1 3 1922 1 1 38 LEU CB C 13.189 5.691 -0.008 1.00 . A A . 38 LEU CB 1 1 3 1923 1 1 38 LEU CD1 C 15.682 5.521 -0.015 1.00 . A A . 38 LEU CD1 1 1 3 1924 1 1 38 LEU CD2 C 14.428 5.574 -2.175 1.00 . A A . 38 LEU CD2 1 1 3 1925 1 1 38 LEU CG C 14.467 6.104 -0.739 1.00 . A A . 38 LEU CG 1 1 3 1926 1 1 38 LEU H H 11.078 5.478 1.257 1.00 . A A . 38 LEU H 1 1 3 1927 1 1 38 LEU HA H 12.923 7.577 0.987 1.00 . A A . 38 LEU HA 1 1 3 1928 1 1 38 LEU HB2 H 13.447 5.177 0.909 1.00 . A A . 38 LEU HB2 1 1 3 1929 1 1 38 LEU HB3 H 12.611 5.033 -0.639 1.00 . A A . 38 LEU HB3 1 1 3 1930 1 1 38 LEU HD11 H 15.664 5.830 1.020 1.00 . A A . 38 LEU HD11 1 1 3 1931 1 1 38 LEU HD12 H 16.586 5.882 -0.481 1.00 . A A . 38 LEU HD12 1 1 3 1932 1 1 38 LEU HD13 H 15.652 4.444 -0.070 1.00 . A A . 38 LEU HD13 1 1 3 1933 1 1 38 LEU HD21 H 13.632 4.852 -2.271 1.00 . A A . 38 LEU HD21 1 1 3 1934 1 1 38 LEU HD22 H 15.372 5.103 -2.410 1.00 . A A . 38 LEU HD22 1 1 3 1935 1 1 38 LEU HD23 H 14.256 6.393 -2.856 1.00 . A A . 38 LEU HD23 1 1 3 1936 1 1 38 LEU HG H 14.540 7.182 -0.753 1.00 . A A . 38 LEU HG 1 1 3 1937 1 1 38 LEU N N 11.140 6.423 1.007 1.00 . A A . 38 LEU N 1 1 3 1938 1 1 38 LEU O O 12.657 8.626 -1.351 1.00 . A A . 38 LEU O 1 1 3 1939 1 1 39 SER C C 9.051 8.379 -2.796 1.00 . A A . 39 SER C 1 1 3 1940 1 1 39 SER CA C 10.531 7.992 -2.864 1.00 . A A . 39 SER CA 1 1 3 1941 1 1 39 SER CB C 10.770 6.983 -3.990 1.00 . A A . 39 SER CB 1 1 3 1942 1 1 39 SER H H 10.411 6.532 -1.280 1.00 . A A . 39 SER H 1 1 3 1943 1 1 39 SER HA H 11.141 8.867 -3.018 1.00 . A A . 39 SER HA 1 1 3 1944 1 1 39 SER HB2 H 9.873 6.879 -4.577 1.00 . A A . 39 SER HB2 1 1 3 1945 1 1 39 SER HB3 H 11.571 7.339 -4.624 1.00 . A A . 39 SER HB3 1 1 3 1946 1 1 39 SER HG H 11.127 5.077 -4.144 1.00 . A A . 39 SER HG 1 1 3 1947 1 1 39 SER N N 10.937 7.291 -1.611 1.00 . A A . 39 SER N 1 1 3 1948 1 1 39 SER O O 8.443 8.360 -1.743 1.00 . A A . 39 SER O 1 1 3 1949 1 1 39 SER OG O 11.112 5.721 -3.432 1.00 . A A . 39 SER OG 1 1 3 1950 1 1 40 GLY C C 6.165 7.872 -4.125 1.00 . A A . 40 GLY C 1 1 3 1951 1 1 40 GLY CA C 7.029 9.116 -3.908 1.00 . A A . 40 GLY CA 1 1 3 1952 1 1 40 GLY H H 8.977 8.738 -4.747 1.00 . A A . 40 GLY H 1 1 3 1953 1 1 40 GLY HA2 H 6.778 9.571 -2.960 1.00 . A A . 40 GLY HA2 1 1 3 1954 1 1 40 GLY HA3 H 6.844 9.821 -4.706 1.00 . A A . 40 GLY HA3 1 1 3 1955 1 1 40 GLY N N 8.468 8.730 -3.909 1.00 . A A . 40 GLY N 1 1 3 1956 1 1 40 GLY O O 5.038 7.957 -4.572 1.00 . A A . 40 GLY O 1 1 3 1957 1 1 41 THR C C 5.383 4.958 -2.647 1.00 . A A . 41 THR C 1 1 3 1958 1 1 41 THR CA C 5.892 5.468 -3.998 1.00 . A A . 41 THR CA 1 1 3 1959 1 1 41 THR CB C 6.866 4.464 -4.621 1.00 . A A . 41 THR CB 1 1 3 1960 1 1 41 THR CG2 C 7.848 3.970 -3.558 1.00 . A A . 41 THR CG2 1 1 3 1961 1 1 41 THR H H 7.595 6.670 -3.452 1.00 . A A . 41 THR H 1 1 3 1962 1 1 41 THR HA H 5.067 5.644 -4.669 1.00 . A A . 41 THR HA 1 1 3 1963 1 1 41 THR HB H 7.416 4.942 -5.417 1.00 . A A . 41 THR HB 1 1 3 1964 1 1 41 THR HG1 H 5.575 3.020 -4.444 1.00 . A A . 41 THR HG1 1 1 3 1965 1 1 41 THR HG21 H 7.414 3.132 -3.031 1.00 . A A . 41 THR HG21 1 1 3 1966 1 1 41 THR HG22 H 8.053 4.766 -2.860 1.00 . A A . 41 THR HG22 1 1 3 1967 1 1 41 THR HG23 H 8.766 3.659 -4.033 1.00 . A A . 41 THR HG23 1 1 3 1968 1 1 41 THR N N 6.684 6.717 -3.810 1.00 . A A . 41 THR N 1 1 3 1969 1 1 41 THR O O 6.117 4.891 -1.681 1.00 . A A . 41 THR O 1 1 3 1970 1 1 41 THR OG1 O 6.137 3.363 -5.144 1.00 . A A . 41 THR OG1 1 1 3 1971 1 1 42 TRP C C 2.665 2.888 -1.566 1.00 . A A . 42 TRP C 1 1 3 1972 1 1 42 TRP CA C 3.569 4.092 -1.291 1.00 . A A . 42 TRP CA 1 1 3 1973 1 1 42 TRP CB C 2.760 5.265 -0.734 1.00 . A A . 42 TRP CB 1 1 3 1974 1 1 42 TRP CD1 C 2.959 4.698 1.724 1.00 . A A . 42 TRP CD1 1 1 3 1975 1 1 42 TRP CD2 C 0.825 4.730 1.008 1.00 . A A . 42 TRP CD2 1 1 3 1976 1 1 42 TRP CE2 C 0.787 4.405 2.384 1.00 . A A . 42 TRP CE2 1 1 3 1977 1 1 42 TRP CE3 C -0.394 4.815 0.311 1.00 . A A . 42 TRP CE3 1 1 3 1978 1 1 42 TRP CG C 2.215 4.911 0.612 1.00 . A A . 42 TRP CG 1 1 3 1979 1 1 42 TRP CH2 C -1.621 4.261 2.340 1.00 . A A . 42 TRP CH2 1 1 3 1980 1 1 42 TRP CZ2 C -0.418 4.172 3.046 1.00 . A A . 42 TRP CZ2 1 1 3 1981 1 1 42 TRP CZ3 C -1.609 4.581 0.975 1.00 . A A . 42 TRP CZ3 1 1 3 1982 1 1 42 TRP H H 3.560 4.661 -3.368 1.00 . A A . 42 TRP H 1 1 3 1983 1 1 42 TRP HA H 4.360 3.827 -0.608 1.00 . A A . 42 TRP HA 1 1 3 1984 1 1 42 TRP HB2 H 3.398 6.132 -0.646 1.00 . A A . 42 TRP HB2 1 1 3 1985 1 1 42 TRP HB3 H 1.943 5.486 -1.404 1.00 . A A . 42 TRP HB3 1 1 3 1986 1 1 42 TRP HD1 H 4.036 4.754 1.781 1.00 . A A . 42 TRP HD1 1 1 3 1987 1 1 42 TRP HE1 H 2.399 4.204 3.693 1.00 . A A . 42 TRP HE1 1 1 3 1988 1 1 42 TRP HE3 H -0.394 5.061 -0.740 1.00 . A A . 42 TRP HE3 1 1 3 1989 1 1 42 TRP HH2 H -2.558 4.083 2.845 1.00 . A A . 42 TRP HH2 1 1 3 1990 1 1 42 TRP HZ2 H -0.422 3.927 4.097 1.00 . A A . 42 TRP HZ2 1 1 3 1991 1 1 42 TRP HZ3 H -2.539 4.649 0.431 1.00 . A A . 42 TRP HZ3 1 1 3 1992 1 1 42 TRP N N 4.132 4.598 -2.575 1.00 . A A . 42 TRP N 1 1 3 1993 1 1 42 TRP NE1 N 2.112 4.399 2.775 1.00 . A A . 42 TRP NE1 1 1 3 1994 1 1 42 TRP O O 1.749 2.962 -2.360 1.00 . A A . 42 TRP O 1 1 3 1995 1 1 43 THR C C 1.393 0.107 0.112 1.00 . A A . 43 THR C 1 1 3 1996 1 1 43 THR CA C 2.061 0.578 -1.182 1.00 . A A . 43 THR CA 1 1 3 1997 1 1 43 THR CB C 3.021 -0.489 -1.715 1.00 . A A . 43 THR CB 1 1 3 1998 1 1 43 THR CG2 C 4.092 -0.791 -0.665 1.00 . A A . 43 THR CG2 1 1 3 1999 1 1 43 THR H H 3.663 1.723 -0.293 1.00 . A A . 43 THR H 1 1 3 2000 1 1 43 THR HA H 1.316 0.803 -1.927 1.00 . A A . 43 THR HA 1 1 3 2001 1 1 43 THR HB H 3.498 -0.126 -2.613 1.00 . A A . 43 THR HB 1 1 3 2002 1 1 43 THR HG1 H 1.475 -1.654 -1.513 1.00 . A A . 43 THR HG1 1 1 3 2003 1 1 43 THR HG21 H 3.621 -0.954 0.292 1.00 . A A . 43 THR HG21 1 1 3 2004 1 1 43 THR HG22 H 4.773 0.045 -0.595 1.00 . A A . 43 THR HG22 1 1 3 2005 1 1 43 THR HG23 H 4.638 -1.677 -0.954 1.00 . A A . 43 THR HG23 1 1 3 2006 1 1 43 THR N N 2.915 1.775 -0.929 1.00 . A A . 43 THR N 1 1 3 2007 1 1 43 THR O O 1.937 0.235 1.190 1.00 . A A . 43 THR O 1 1 3 2008 1 1 43 THR OG1 O 2.296 -1.675 -2.011 1.00 . A A . 43 THR OG1 1 1 3 2009 1 1 44 GLN C C -1.038 -2.335 0.993 1.00 . A A . 44 GLN C 1 1 3 2010 1 1 44 GLN CA C -0.499 -0.921 1.227 1.00 . A A . 44 GLN CA 1 1 3 2011 1 1 44 GLN CB C -1.647 0.065 1.434 1.00 . A A . 44 GLN CB 1 1 3 2012 1 1 44 GLN CD C -2.702 1.155 3.420 1.00 . A A . 44 GLN CD 1 1 3 2013 1 1 44 GLN CG C -1.384 0.898 2.689 1.00 . A A . 44 GLN CG 1 1 3 2014 1 1 44 GLN H H -0.208 -0.531 -0.871 1.00 . A A . 44 GLN H 1 1 3 2015 1 1 44 GLN HA H 0.160 -0.905 2.081 1.00 . A A . 44 GLN HA 1 1 3 2016 1 1 44 GLN HB2 H -1.719 0.719 0.577 1.00 . A A . 44 GLN HB2 1 1 3 2017 1 1 44 GLN HB3 H -2.574 -0.478 1.551 1.00 . A A . 44 GLN HB3 1 1 3 2018 1 1 44 GLN HE21 H -1.824 1.543 5.157 1.00 . A A . 44 GLN HE21 1 1 3 2019 1 1 44 GLN HE22 H -3.519 1.640 5.162 1.00 . A A . 44 GLN HE22 1 1 3 2020 1 1 44 GLN HG2 H -0.709 0.362 3.340 1.00 . A A . 44 GLN HG2 1 1 3 2021 1 1 44 GLN HG3 H -0.941 1.841 2.408 1.00 . A A . 44 GLN HG3 1 1 3 2022 1 1 44 GLN N N 0.211 -0.438 0.009 1.00 . A A . 44 GLN N 1 1 3 2023 1 1 44 GLN NE2 N -2.680 1.472 4.685 1.00 . A A . 44 GLN NE2 1 1 3 2024 1 1 44 GLN O O -2.062 -2.717 1.525 1.00 . A A . 44 GLN O 1 1 3 2025 1 1 44 GLN OE1 O -3.764 1.066 2.834 1.00 . A A . 44 GLN OE1 1 1 3 2026 1 1 45 GLN C C 0.373 -5.436 -0.260 1.00 . A A . 45 GLN C 1 1 3 2027 1 1 45 GLN CA C -0.826 -4.504 -0.066 1.00 . A A . 45 GLN CA 1 1 3 2028 1 1 45 GLN CB C -1.640 -4.406 -1.356 1.00 . A A . 45 GLN CB 1 1 3 2029 1 1 45 GLN CD C -3.993 -5.074 -1.864 1.00 . A A . 45 GLN CD 1 1 3 2030 1 1 45 GLN CG C -2.616 -5.582 -1.435 1.00 . A A . 45 GLN CG 1 1 3 2031 1 1 45 GLN H H 0.468 -2.788 -0.219 1.00 . A A . 45 GLN H 1 1 3 2032 1 1 45 GLN HA H -1.451 -4.853 0.740 1.00 . A A . 45 GLN HA 1 1 3 2033 1 1 45 GLN HB2 H -2.193 -3.477 -1.362 1.00 . A A . 45 GLN HB2 1 1 3 2034 1 1 45 GLN HB3 H -0.975 -4.435 -2.206 1.00 . A A . 45 GLN HB3 1 1 3 2035 1 1 45 GLN HE21 H -4.521 -6.790 -2.712 1.00 . A A . 45 GLN HE21 1 1 3 2036 1 1 45 GLN HE22 H -5.684 -5.556 -2.787 1.00 . A A . 45 GLN HE22 1 1 3 2037 1 1 45 GLN HG2 H -2.254 -6.302 -2.156 1.00 . A A . 45 GLN HG2 1 1 3 2038 1 1 45 GLN HG3 H -2.693 -6.051 -0.465 1.00 . A A . 45 GLN HG3 1 1 3 2039 1 1 45 GLN N N -0.355 -3.115 0.200 1.00 . A A . 45 GLN N 1 1 3 2040 1 1 45 GLN NE2 N -4.800 -5.873 -2.507 1.00 . A A . 45 GLN NE2 1 1 3 2041 1 1 45 GLN O O 1.020 -5.424 -1.288 1.00 . A A . 45 GLN O 1 1 3 2042 1 1 45 GLN OE1 O -4.339 -3.938 -1.612 1.00 . A A . 45 GLN OE1 1 1 3 2043 1 1 46 ILE C C 1.583 -8.446 1.407 1.00 . A A . 46 ILE C 1 1 3 2044 1 1 46 ILE CA C 1.830 -7.175 0.588 1.00 . A A . 46 ILE CA 1 1 3 2045 1 1 46 ILE CB C 3.029 -6.399 1.139 1.00 . A A . 46 ILE CB 1 1 3 2046 1 1 46 ILE CD1 C 5.297 -6.035 0.148 1.00 . A A . 46 ILE CD1 1 1 3 2047 1 1 46 ILE CG1 C 4.323 -7.083 0.693 1.00 . A A . 46 ILE CG1 1 1 3 2048 1 1 46 ILE CG2 C 2.970 -6.370 2.668 1.00 . A A . 46 ILE CG2 1 1 3 2049 1 1 46 ILE H H 0.138 -6.238 1.540 1.00 . A A . 46 ILE H 1 1 3 2050 1 1 46 ILE HA H 1.996 -7.423 -0.449 1.00 . A A . 46 ILE HA 1 1 3 2051 1 1 46 ILE HB H 3.006 -5.387 0.759 1.00 . A A . 46 ILE HB 1 1 3 2052 1 1 46 ILE HD11 H 4.785 -5.404 -0.564 1.00 . A A . 46 ILE HD11 1 1 3 2053 1 1 46 ILE HD12 H 6.123 -6.530 -0.340 1.00 . A A . 46 ILE HD12 1 1 3 2054 1 1 46 ILE HD13 H 5.669 -5.431 0.961 1.00 . A A . 46 ILE HD13 1 1 3 2055 1 1 46 ILE HG12 H 4.772 -7.587 1.536 1.00 . A A . 46 ILE HG12 1 1 3 2056 1 1 46 ILE HG13 H 4.102 -7.802 -0.080 1.00 . A A . 46 ILE HG13 1 1 3 2057 1 1 46 ILE HG21 H 2.038 -5.922 2.984 1.00 . A A . 46 ILE HG21 1 1 3 2058 1 1 46 ILE HG22 H 3.797 -5.787 3.050 1.00 . A A . 46 ILE HG22 1 1 3 2059 1 1 46 ILE HG23 H 3.033 -7.377 3.050 1.00 . A A . 46 ILE HG23 1 1 3 2060 1 1 46 ILE N N 0.673 -6.243 0.719 1.00 . A A . 46 ILE N 1 1 3 2061 1 1 46 ILE O O 1.853 -9.544 0.965 1.00 . A A . 46 ILE O 1 1 3 2062 1 1 47 CYS C C -0.655 -9.511 3.902 1.00 . A A . 47 CYS C 1 1 3 2063 1 1 47 CYS CA C 0.806 -9.500 3.446 1.00 . A A . 47 CYS CA 1 1 3 2064 1 1 47 CYS CB C 1.743 -9.357 4.649 1.00 . A A . 47 CYS CB 1 1 3 2065 1 1 47 CYS H H 0.859 -7.407 2.936 1.00 . A A . 47 CYS H 1 1 3 2066 1 1 47 CYS HA H 1.038 -10.404 2.904 1.00 . A A . 47 CYS HA 1 1 3 2067 1 1 47 CYS HB2 H 1.453 -10.062 5.414 1.00 . A A . 47 CYS HB2 1 1 3 2068 1 1 47 CYS HB3 H 2.759 -9.560 4.341 1.00 . A A . 47 CYS HB3 1 1 3 2069 1 1 47 CYS N N 1.071 -8.302 2.599 1.00 . A A . 47 CYS N 1 1 3 2070 1 1 47 CYS O O -1.193 -8.504 4.318 1.00 . A A . 47 CYS O 1 1 3 2071 1 1 47 CYS SG S 1.636 -7.674 5.308 1.00 . A A . 47 CYS SG 1 1 3 2072 1 1 48 LEU C C -2.814 -11.008 5.753 1.00 . A A . 48 LEU C 1 1 3 2073 1 1 48 LEU CA C -2.727 -10.716 4.252 1.00 . A A . 48 LEU CA 1 1 3 2074 1 1 48 LEU CB C -3.321 -11.870 3.445 1.00 . A A . 48 LEU CB 1 1 3 2075 1 1 48 LEU CD1 C -4.023 -10.090 1.829 1.00 . A A . 48 LEU CD1 1 1 3 2076 1 1 48 LEU CD2 C -1.984 -11.459 1.374 1.00 . A A . 48 LEU CD2 1 1 3 2077 1 1 48 LEU CG C -3.395 -11.479 1.966 1.00 . A A . 48 LEU CG 1 1 3 2078 1 1 48 LEU H H -0.849 -11.442 3.486 1.00 . A A . 48 LEU H 1 1 3 2079 1 1 48 LEU HA H -3.241 -9.797 4.016 1.00 . A A . 48 LEU HA 1 1 3 2080 1 1 48 LEU HB2 H -2.694 -12.743 3.554 1.00 . A A . 48 LEU HB2 1 1 3 2081 1 1 48 LEU HB3 H -4.313 -12.091 3.808 1.00 . A A . 48 LEU HB3 1 1 3 2082 1 1 48 LEU HD11 H -3.267 -9.336 1.987 1.00 . A A . 48 LEU HD11 1 1 3 2083 1 1 48 LEU HD12 H -4.806 -9.975 2.565 1.00 . A A . 48 LEU HD12 1 1 3 2084 1 1 48 LEU HD13 H -4.441 -9.980 0.839 1.00 . A A . 48 LEU HD13 1 1 3 2085 1 1 48 LEU HD21 H -2.040 -11.609 0.306 1.00 . A A . 48 LEU HD21 1 1 3 2086 1 1 48 LEU HD22 H -1.397 -12.249 1.818 1.00 . A A . 48 LEU HD22 1 1 3 2087 1 1 48 LEU HD23 H -1.521 -10.505 1.581 1.00 . A A . 48 LEU HD23 1 1 3 2088 1 1 48 LEU HG H -3.999 -12.200 1.434 1.00 . A A . 48 LEU HG 1 1 3 2089 1 1 48 LEU N N -1.301 -10.641 3.824 1.00 . A A . 48 LEU N 1 1 3 2090 1 1 48 LEU O O -2.157 -10.314 6.511 1.00 . A A . 48 LEU O 1 1 3 2091 1 1 48 LEU OXT O -3.537 -11.921 6.118 1.00 . A A . 48 LEU OXT 1 1 4 2092 1 1 1 GLY C C -2.626 13.434 9.514 1.00 . A A . 1 GLY C 1 1 4 2093 1 1 1 GLY CA C -3.593 14.593 9.258 1.00 . A A . 1 GLY CA 1 1 4 2094 1 1 1 GLY H1 H -5.556 14.678 8.568 1.00 . A A . 1 GLY H1 1 1 4 2095 1 1 1 GLY H2 H -4.873 13.124 8.523 1.00 . A A . 1 GLY H2 1 1 4 2096 1 1 1 GLY H3 H -4.419 14.286 7.370 1.00 . A A . 1 GLY H3 1 1 4 2097 1 1 1 GLY HA2 H -3.063 15.410 8.787 1.00 . A A . 1 GLY HA2 1 1 4 2098 1 1 1 GLY HA3 H -4.008 14.925 10.197 1.00 . A A . 1 GLY HA3 1 1 4 2099 1 1 1 GLY N N -4.693 14.135 8.362 1.00 . A A . 1 GLY N 1 1 4 2100 1 1 1 GLY O O -3.012 12.283 9.521 1.00 . A A . 1 GLY O 1 1 4 2101 1 1 2 SER C C -0.082 12.549 11.482 1.00 . A A . 2 SER C 1 1 4 2102 1 1 2 SER CA C -0.383 12.647 9.984 1.00 . A A . 2 SER CA 1 1 4 2103 1 1 2 SER CB C 0.869 13.063 9.212 1.00 . A A . 2 SER CB 1 1 4 2104 1 1 2 SER H H -1.084 14.668 9.717 1.00 . A A . 2 SER H 1 1 4 2105 1 1 2 SER HA H -0.749 11.705 9.610 1.00 . A A . 2 SER HA 1 1 4 2106 1 1 2 SER HB2 H 1.434 13.774 9.793 1.00 . A A . 2 SER HB2 1 1 4 2107 1 1 2 SER HB3 H 1.480 12.191 9.023 1.00 . A A . 2 SER HB3 1 1 4 2108 1 1 2 SER HG H 0.771 13.088 7.270 1.00 . A A . 2 SER HG 1 1 4 2109 1 1 2 SER N N -1.374 13.732 9.726 1.00 . A A . 2 SER N 1 1 4 2110 1 1 2 SER O O 0.318 13.511 12.108 1.00 . A A . 2 SER O 1 1 4 2111 1 1 2 SER OG O 0.485 13.665 7.983 1.00 . A A . 2 SER OG 1 1 4 2112 1 1 3 ALA C C 0.877 10.003 13.768 1.00 . A A . 3 ALA C 1 1 4 2113 1 1 3 ALA CA C 0.006 11.241 13.519 1.00 . A A . 3 ALA CA 1 1 4 2114 1 1 3 ALA CB C -1.370 11.084 14.167 1.00 . A A . 3 ALA CB 1 1 4 2115 1 1 3 ALA H H -0.592 10.631 11.540 1.00 . A A . 3 ALA H 1 1 4 2116 1 1 3 ALA HA H 0.493 12.123 13.903 1.00 . A A . 3 ALA HA 1 1 4 2117 1 1 3 ALA HB1 H -1.926 12.003 14.055 1.00 . A A . 3 ALA HB1 1 1 4 2118 1 1 3 ALA HB2 H -1.251 10.861 15.216 1.00 . A A . 3 ALA HB2 1 1 4 2119 1 1 3 ALA HB3 H -1.903 10.279 13.684 1.00 . A A . 3 ALA HB3 1 1 4 2120 1 1 3 ALA N N -0.270 11.395 12.062 1.00 . A A . 3 ALA N 1 1 4 2121 1 1 3 ALA O O 2.080 10.042 13.605 1.00 . A A . 3 ALA O 1 1 4 2122 1 1 4 MET C C 0.198 6.496 14.775 1.00 . A A . 4 MET C 1 1 4 2123 1 1 4 MET CA C 1.101 7.679 14.415 1.00 . A A . 4 MET CA 1 1 4 2124 1 1 4 MET CB C 2.001 8.037 15.596 1.00 . A A . 4 MET CB 1 1 4 2125 1 1 4 MET CE C 0.960 10.151 18.966 1.00 . A A . 4 MET CE 1 1 4 2126 1 1 4 MET CG C 1.157 8.652 16.713 1.00 . A A . 4 MET CG 1 1 4 2127 1 1 4 MET H H -0.682 8.882 14.291 1.00 . A A . 4 MET H 1 1 4 2128 1 1 4 MET HA H 1.704 7.443 13.553 1.00 . A A . 4 MET HA 1 1 4 2129 1 1 4 MET HB2 H 2.487 7.144 15.961 1.00 . A A . 4 MET HB2 1 1 4 2130 1 1 4 MET HB3 H 2.747 8.750 15.278 1.00 . A A . 4 MET HB3 1 1 4 2131 1 1 4 MET HE1 H 1.338 10.322 19.965 1.00 . A A . 4 MET HE1 1 1 4 2132 1 1 4 MET HE2 H 0.100 9.504 19.016 1.00 . A A . 4 MET HE2 1 1 4 2133 1 1 4 MET HE3 H 0.675 11.092 18.516 1.00 . A A . 4 MET HE3 1 1 4 2134 1 1 4 MET HG2 H 0.523 9.423 16.302 1.00 . A A . 4 MET HG2 1 1 4 2135 1 1 4 MET HG3 H 0.545 7.885 17.166 1.00 . A A . 4 MET HG3 1 1 4 2136 1 1 4 MET N N 0.287 8.904 14.163 1.00 . A A . 4 MET N 1 1 4 2137 1 1 4 MET O O 0.054 6.141 15.927 1.00 . A A . 4 MET O 1 1 4 2138 1 1 4 MET SD S 2.248 9.371 17.964 1.00 . A A . 4 MET SD 1 1 4 2139 1 1 5 GLY C C -0.560 3.428 13.675 1.00 . A A . 5 GLY C 1 1 4 2140 1 1 5 GLY CA C -1.283 4.711 14.085 1.00 . A A . 5 GLY CA 1 1 4 2141 1 1 5 GLY H H -0.268 6.174 12.872 1.00 . A A . 5 GLY H 1 1 4 2142 1 1 5 GLY HA2 H -1.508 4.681 15.142 1.00 . A A . 5 GLY HA2 1 1 4 2143 1 1 5 GLY HA3 H -2.201 4.801 13.523 1.00 . A A . 5 GLY HA3 1 1 4 2144 1 1 5 GLY N N -0.403 5.877 13.796 1.00 . A A . 5 GLY N 1 1 4 2145 1 1 5 GLY O O -0.142 2.646 14.506 1.00 . A A . 5 GLY O 1 1 4 2146 1 1 6 CYS C C 1.799 2.273 11.766 1.00 . A A . 6 CYS C 1 1 4 2147 1 1 6 CYS CA C 0.304 1.984 11.931 1.00 . A A . 6 CYS CA 1 1 4 2148 1 1 6 CYS CB C -0.337 1.633 10.585 1.00 . A A . 6 CYS CB 1 1 4 2149 1 1 6 CYS H H -0.740 3.859 11.750 1.00 . A A . 6 CYS H 1 1 4 2150 1 1 6 CYS HA H 0.154 1.180 12.629 1.00 . A A . 6 CYS HA 1 1 4 2151 1 1 6 CYS HB2 H 0.172 0.782 10.157 1.00 . A A . 6 CYS HB2 1 1 4 2152 1 1 6 CYS HB3 H -1.378 1.388 10.737 1.00 . A A . 6 CYS HB3 1 1 4 2153 1 1 6 CYS N N -0.403 3.211 12.399 1.00 . A A . 6 CYS N 1 1 4 2154 1 1 6 CYS O O 2.594 1.382 11.542 1.00 . A A . 6 CYS O 1 1 4 2155 1 1 6 CYS SG S -0.207 3.043 9.454 1.00 . A A . 6 CYS SG 1 1 4 2156 1 1 7 ARG C C 4.475 3.126 12.751 1.00 . A A . 7 ARG C 1 1 4 2157 1 1 7 ARG CA C 3.624 3.870 11.718 1.00 . A A . 7 ARG CA 1 1 4 2158 1 1 7 ARG CB C 3.683 5.378 11.959 1.00 . A A . 7 ARG CB 1 1 4 2159 1 1 7 ARG CD C 4.929 6.479 10.092 1.00 . A A . 7 ARG CD 1 1 4 2160 1 1 7 ARG CG C 5.043 5.915 11.510 1.00 . A A . 7 ARG CG 1 1 4 2161 1 1 7 ARG CZ C 3.053 8.011 10.069 1.00 . A A . 7 ARG CZ 1 1 4 2162 1 1 7 ARG H H 1.524 4.217 12.050 1.00 . A A . 7 ARG H 1 1 4 2163 1 1 7 ARG HA H 3.962 3.645 10.720 1.00 . A A . 7 ARG HA 1 1 4 2164 1 1 7 ARG HB2 H 2.900 5.863 11.396 1.00 . A A . 7 ARG HB2 1 1 4 2165 1 1 7 ARG HB3 H 3.548 5.580 13.009 1.00 . A A . 7 ARG HB3 1 1 4 2166 1 1 7 ARG HD2 H 5.906 6.552 9.637 1.00 . A A . 7 ARG HD2 1 1 4 2167 1 1 7 ARG HD3 H 4.279 5.862 9.492 1.00 . A A . 7 ARG HD3 1 1 4 2168 1 1 7 ARG HE H 4.898 8.590 10.523 1.00 . A A . 7 ARG HE 1 1 4 2169 1 1 7 ARG HG2 H 5.362 6.697 12.185 1.00 . A A . 7 ARG HG2 1 1 4 2170 1 1 7 ARG HG3 H 5.767 5.115 11.519 1.00 . A A . 7 ARG HG3 1 1 4 2171 1 1 7 ARG HH11 H 3.182 7.881 8.074 1.00 . A A . 7 ARG HH11 1 1 4 2172 1 1 7 ARG HH12 H 1.593 8.151 8.706 1.00 . A A . 7 ARG HH12 1 1 4 2173 1 1 7 ARG HH21 H 2.625 8.181 12.017 1.00 . A A . 7 ARG HH21 1 1 4 2174 1 1 7 ARG HH22 H 1.277 8.321 10.938 1.00 . A A . 7 ARG HH22 1 1 4 2175 1 1 7 ARG N N 2.183 3.515 11.873 1.00 . A A . 7 ARG N 1 1 4 2176 1 1 7 ARG NE N 4.331 7.833 10.264 1.00 . A A . 7 ARG NE 1 1 4 2177 1 1 7 ARG NH1 N 2.572 8.015 8.855 1.00 . A A . 7 ARG NH1 1 1 4 2178 1 1 7 ARG NH2 N 2.256 8.185 11.088 1.00 . A A . 7 ARG NH2 1 1 4 2179 1 1 7 ARG O O 5.667 2.962 12.581 1.00 . A A . 7 ARG O 1 1 4 2180 1 1 8 HIS C C 4.303 0.451 14.853 1.00 . A A . 8 HIS C 1 1 4 2181 1 1 8 HIS CA C 4.671 1.940 14.853 1.00 . A A . 8 HIS CA 1 1 4 2182 1 1 8 HIS CB C 4.301 2.600 16.187 1.00 . A A . 8 HIS CB 1 1 4 2183 1 1 8 HIS CD2 C 1.880 1.585 16.008 1.00 . A A . 8 HIS CD2 1 1 4 2184 1 1 8 HIS CE1 C 1.425 1.489 18.124 1.00 . A A . 8 HIS CE1 1 1 4 2185 1 1 8 HIS CG C 2.976 2.074 16.674 1.00 . A A . 8 HIS CG 1 1 4 2186 1 1 8 HIS H H 2.917 2.812 13.945 1.00 . A A . 8 HIS H 1 1 4 2187 1 1 8 HIS HA H 5.725 2.062 14.667 1.00 . A A . 8 HIS HA 1 1 4 2188 1 1 8 HIS HB2 H 5.064 2.379 16.917 1.00 . A A . 8 HIS HB2 1 1 4 2189 1 1 8 HIS HB3 H 4.233 3.668 16.050 1.00 . A A . 8 HIS HB3 1 1 4 2190 1 1 8 HIS HD1 H 3.238 2.281 18.766 1.00 . A A . 8 HIS HD1 1 1 4 2191 1 1 8 HIS HD2 H 1.792 1.499 14.936 1.00 . A A . 8 HIS HD2 1 1 4 2192 1 1 8 HIS HE1 H 0.918 1.316 19.061 1.00 . A A . 8 HIS HE1 1 1 4 2193 1 1 8 HIS N N 3.880 2.673 13.821 1.00 . A A . 8 HIS N 1 1 4 2194 1 1 8 HIS ND1 N 2.663 2.004 18.022 1.00 . A A . 8 HIS ND1 1 1 4 2195 1 1 8 HIS NE2 N 0.902 1.216 16.925 1.00 . A A . 8 HIS NE2 1 1 4 2196 1 1 8 HIS O O 4.890 -0.343 15.560 1.00 . A A . 8 HIS O 1 1 4 2197 1 1 9 PHE C C 4.196 -2.251 13.935 1.00 . A A . 9 PHE C 1 1 4 2198 1 1 9 PHE CA C 2.946 -1.371 14.011 1.00 . A A . 9 PHE CA 1 1 4 2199 1 1 9 PHE CB C 2.110 -1.511 12.734 1.00 . A A . 9 PHE CB 1 1 4 2200 1 1 9 PHE CD1 C 0.309 -0.500 14.213 1.00 . A A . 9 PHE CD1 1 1 4 2201 1 1 9 PHE CD2 C -0.278 -1.226 11.972 1.00 . A A . 9 PHE CD2 1 1 4 2202 1 1 9 PHE CE1 C -1.015 -0.094 14.425 1.00 . A A . 9 PHE CE1 1 1 4 2203 1 1 9 PHE CE2 C -1.601 -0.819 12.188 1.00 . A A . 9 PHE CE2 1 1 4 2204 1 1 9 PHE CG C 0.681 -1.068 12.983 1.00 . A A . 9 PHE CG 1 1 4 2205 1 1 9 PHE CZ C -1.968 -0.254 13.413 1.00 . A A . 9 PHE CZ 1 1 4 2206 1 1 9 PHE H H 2.882 0.716 13.491 1.00 . A A . 9 PHE H 1 1 4 2207 1 1 9 PHE HA H 2.354 -1.633 14.872 1.00 . A A . 9 PHE HA 1 1 4 2208 1 1 9 PHE HB2 H 2.544 -0.900 11.956 1.00 . A A . 9 PHE HB2 1 1 4 2209 1 1 9 PHE HB3 H 2.114 -2.544 12.418 1.00 . A A . 9 PHE HB3 1 1 4 2210 1 1 9 PHE HD1 H 1.041 -0.373 14.994 1.00 . A A . 9 PHE HD1 1 1 4 2211 1 1 9 PHE HD2 H 0.005 -1.663 11.025 1.00 . A A . 9 PHE HD2 1 1 4 2212 1 1 9 PHE HE1 H -1.301 0.343 15.370 1.00 . A A . 9 PHE HE1 1 1 4 2213 1 1 9 PHE HE2 H -2.337 -0.941 11.407 1.00 . A A . 9 PHE HE2 1 1 4 2214 1 1 9 PHE HZ H -2.988 0.060 13.578 1.00 . A A . 9 PHE HZ 1 1 4 2215 1 1 9 PHE N N 3.341 0.064 14.059 1.00 . A A . 9 PHE N 1 1 4 2216 1 1 9 PHE O O 5.271 -1.793 13.602 1.00 . A A . 9 PHE O 1 1 4 2217 1 1 10 GLN C C 5.549 -4.823 12.751 1.00 . A A . 10 GLN C 1 1 4 2218 1 1 10 GLN CA C 5.250 -4.415 14.197 1.00 . A A . 10 GLN CA 1 1 4 2219 1 1 10 GLN CB C 4.853 -5.634 15.030 1.00 . A A . 10 GLN CB 1 1 4 2220 1 1 10 GLN CD C 5.690 -7.220 16.773 1.00 . A A . 10 GLN CD 1 1 4 2221 1 1 10 GLN CG C 5.865 -5.828 16.161 1.00 . A A . 10 GLN CG 1 1 4 2222 1 1 10 GLN H H 3.191 -3.857 14.514 1.00 . A A . 10 GLN H 1 1 4 2223 1 1 10 GLN HA H 6.109 -3.935 14.636 1.00 . A A . 10 GLN HA 1 1 4 2224 1 1 10 GLN HB2 H 3.869 -5.479 15.449 1.00 . A A . 10 GLN HB2 1 1 4 2225 1 1 10 GLN HB3 H 4.843 -6.513 14.403 1.00 . A A . 10 GLN HB3 1 1 4 2226 1 1 10 GLN HE21 H 7.546 -7.792 16.356 1.00 . A A . 10 GLN HE21 1 1 4 2227 1 1 10 GLN HE22 H 6.589 -8.950 17.147 1.00 . A A . 10 GLN HE22 1 1 4 2228 1 1 10 GLN HG2 H 6.866 -5.729 15.768 1.00 . A A . 10 GLN HG2 1 1 4 2229 1 1 10 GLN HG3 H 5.701 -5.080 16.923 1.00 . A A . 10 GLN HG3 1 1 4 2230 1 1 10 GLN N N 4.066 -3.510 14.246 1.00 . A A . 10 GLN N 1 1 4 2231 1 1 10 GLN NE2 N 6.692 -8.057 16.757 1.00 . A A . 10 GLN NE2 1 1 4 2232 1 1 10 GLN O O 6.536 -4.412 12.174 1.00 . A A . 10 GLN O 1 1 4 2233 1 1 10 GLN OE1 O 4.631 -7.549 17.270 1.00 . A A . 10 GLN OE1 1 1 4 2234 1 1 11 SER C C 3.822 -5.571 9.847 1.00 . A A . 11 SER C 1 1 4 2235 1 1 11 SER CA C 4.952 -6.059 10.755 1.00 . A A . 11 SER CA 1 1 4 2236 1 1 11 SER CB C 4.981 -7.586 10.804 1.00 . A A . 11 SER CB 1 1 4 2237 1 1 11 SER H H 3.917 -5.951 12.644 1.00 . A A . 11 SER H 1 1 4 2238 1 1 11 SER HA H 5.903 -5.685 10.408 1.00 . A A . 11 SER HA 1 1 4 2239 1 1 11 SER HB2 H 4.702 -7.922 11.789 1.00 . A A . 11 SER HB2 1 1 4 2240 1 1 11 SER HB3 H 4.281 -7.981 10.080 1.00 . A A . 11 SER HB3 1 1 4 2241 1 1 11 SER HG H 6.415 -8.894 10.933 1.00 . A A . 11 SER HG 1 1 4 2242 1 1 11 SER N N 4.708 -5.630 12.163 1.00 . A A . 11 SER N 1 1 4 2243 1 1 11 SER O O 2.995 -4.774 10.242 1.00 . A A . 11 SER O 1 1 4 2244 1 1 11 SER OG O 6.294 -8.042 10.508 1.00 . A A . 11 SER OG 1 1 4 2245 1 1 12 CYS C C 1.352 -6.157 8.127 1.00 . A A . 12 CYS C 1 1 4 2246 1 1 12 CYS CA C 2.711 -5.595 7.694 1.00 . A A . 12 CYS CA 1 1 4 2247 1 1 12 CYS CB C 3.114 -6.159 6.331 1.00 . A A . 12 CYS CB 1 1 4 2248 1 1 12 CYS H H 4.464 -6.677 8.328 1.00 . A A . 12 CYS H 1 1 4 2249 1 1 12 CYS HA H 2.677 -4.519 7.650 1.00 . A A . 12 CYS HA 1 1 4 2250 1 1 12 CYS HB2 H 2.335 -5.955 5.613 1.00 . A A . 12 CYS HB2 1 1 4 2251 1 1 12 CYS HB3 H 4.033 -5.693 6.007 1.00 . A A . 12 CYS HB3 1 1 4 2252 1 1 12 CYS N N 3.784 -6.039 8.630 1.00 . A A . 12 CYS N 1 1 4 2253 1 1 12 CYS O O 0.327 -5.822 7.566 1.00 . A A . 12 CYS O 1 1 4 2254 1 1 12 CYS SG S 3.360 -7.948 6.462 1.00 . A A . 12 CYS SG 1 1 4 2255 1 1 13 SER C C -0.957 -6.477 9.916 1.00 . A A . 13 SER C 1 1 4 2256 1 1 13 SER CA C 0.036 -7.590 9.575 1.00 . A A . 13 SER CA 1 1 4 2257 1 1 13 SER CB C 0.379 -8.400 10.825 1.00 . A A . 13 SER CB 1 1 4 2258 1 1 13 SER H H 2.169 -7.269 9.559 1.00 . A A . 13 SER H 1 1 4 2259 1 1 13 SER HA H -0.374 -8.240 8.817 1.00 . A A . 13 SER HA 1 1 4 2260 1 1 13 SER HB2 H 1.172 -9.092 10.601 1.00 . A A . 13 SER HB2 1 1 4 2261 1 1 13 SER HB3 H 0.700 -7.728 11.610 1.00 . A A . 13 SER HB3 1 1 4 2262 1 1 13 SER HG H -1.152 -8.666 11.998 1.00 . A A . 13 SER HG 1 1 4 2263 1 1 13 SER N N 1.333 -7.009 9.119 1.00 . A A . 13 SER N 1 1 4 2264 1 1 13 SER O O -2.011 -6.371 9.323 1.00 . A A . 13 SER O 1 1 4 2265 1 1 13 SER OG O -0.771 -9.125 11.245 1.00 . A A . 13 SER OG 1 1 4 2266 1 1 14 GLN C C -1.416 -3.379 10.244 1.00 . A A . 14 GLN C 1 1 4 2267 1 1 14 GLN CA C -1.568 -4.541 11.225 1.00 . A A . 14 GLN CA 1 1 4 2268 1 1 14 GLN CB C -1.162 -4.111 12.633 1.00 . A A . 14 GLN CB 1 1 4 2269 1 1 14 GLN CD C -3.287 -4.332 13.931 1.00 . A A . 14 GLN CD 1 1 4 2270 1 1 14 GLN CG C -2.319 -3.343 13.276 1.00 . A A . 14 GLN CG 1 1 4 2271 1 1 14 GLN H H 0.223 -5.734 11.332 1.00 . A A . 14 GLN H 1 1 4 2272 1 1 14 GLN HA H -2.584 -4.900 11.229 1.00 . A A . 14 GLN HA 1 1 4 2273 1 1 14 GLN HB2 H -0.935 -4.986 13.226 1.00 . A A . 14 GLN HB2 1 1 4 2274 1 1 14 GLN HB3 H -0.294 -3.473 12.581 1.00 . A A . 14 GLN HB3 1 1 4 2275 1 1 14 GLN HE21 H -2.855 -3.752 15.780 1.00 . A A . 14 GLN HE21 1 1 4 2276 1 1 14 GLN HE22 H -4.011 -4.990 15.659 1.00 . A A . 14 GLN HE22 1 1 4 2277 1 1 14 GLN HG2 H -1.932 -2.667 14.022 1.00 . A A . 14 GLN HG2 1 1 4 2278 1 1 14 GLN HG3 H -2.843 -2.781 12.516 1.00 . A A . 14 GLN HG3 1 1 4 2279 1 1 14 GLN N N -0.632 -5.640 10.862 1.00 . A A . 14 GLN N 1 1 4 2280 1 1 14 GLN NE2 N -3.393 -4.360 15.231 1.00 . A A . 14 GLN NE2 1 1 4 2281 1 1 14 GLN O O -2.307 -2.569 10.084 1.00 . A A . 14 GLN O 1 1 4 2282 1 1 14 GLN OE1 O -3.954 -5.088 13.252 1.00 . A A . 14 GLN OE1 1 1 4 2283 1 1 15 CYS C C -1.224 -2.176 7.585 1.00 . A A . 15 CYS C 1 1 4 2284 1 1 15 CYS CA C -0.090 -2.186 8.610 1.00 . A A . 15 CYS CA 1 1 4 2285 1 1 15 CYS CB C 1.242 -2.497 7.929 1.00 . A A . 15 CYS CB 1 1 4 2286 1 1 15 CYS H H 0.410 -3.961 9.725 1.00 . A A . 15 CYS H 1 1 4 2287 1 1 15 CYS HA H -0.032 -1.240 9.121 1.00 . A A . 15 CYS HA 1 1 4 2288 1 1 15 CYS HB2 H 2.029 -2.516 8.670 1.00 . A A . 15 CYS HB2 1 1 4 2289 1 1 15 CYS HB3 H 1.181 -3.459 7.443 1.00 . A A . 15 CYS HB3 1 1 4 2290 1 1 15 CYS N N -0.295 -3.295 9.583 1.00 . A A . 15 CYS N 1 1 4 2291 1 1 15 CYS O O -1.673 -1.134 7.152 1.00 . A A . 15 CYS O 1 1 4 2292 1 1 15 CYS SG S 1.599 -1.222 6.698 1.00 . A A . 15 CYS SG 1 1 4 2293 1 1 16 LEU C C -4.081 -3.901 6.848 1.00 . A A . 16 LEU C 1 1 4 2294 1 1 16 LEU CA C -2.792 -3.388 6.194 1.00 . A A . 16 LEU CA 1 1 4 2295 1 1 16 LEU CB C -2.304 -4.360 5.118 1.00 . A A . 16 LEU CB 1 1 4 2296 1 1 16 LEU CD1 C -0.080 -3.262 4.800 1.00 . A A . 16 LEU CD1 1 1 4 2297 1 1 16 LEU CD2 C -1.138 -4.496 2.907 1.00 . A A . 16 LEU CD2 1 1 4 2298 1 1 16 LEU CG C -1.408 -3.612 4.127 1.00 . A A . 16 LEU CG 1 1 4 2299 1 1 16 LEU H H -1.308 -4.161 7.552 1.00 . A A . 16 LEU H 1 1 4 2300 1 1 16 LEU HA H -2.955 -2.414 5.760 1.00 . A A . 16 LEU HA 1 1 4 2301 1 1 16 LEU HB2 H -1.742 -5.158 5.582 1.00 . A A . 16 LEU HB2 1 1 4 2302 1 1 16 LEU HB3 H -3.152 -4.773 4.594 1.00 . A A . 16 LEU HB3 1 1 4 2303 1 1 16 LEU HD11 H 0.213 -4.066 5.459 1.00 . A A . 16 LEU HD11 1 1 4 2304 1 1 16 LEU HD12 H -0.196 -2.353 5.369 1.00 . A A . 16 LEU HD12 1 1 4 2305 1 1 16 LEU HD13 H 0.680 -3.121 4.045 1.00 . A A . 16 LEU HD13 1 1 4 2306 1 1 16 LEU HD21 H -0.412 -4.014 2.268 1.00 . A A . 16 LEU HD21 1 1 4 2307 1 1 16 LEU HD22 H -2.057 -4.645 2.359 1.00 . A A . 16 LEU HD22 1 1 4 2308 1 1 16 LEU HD23 H -0.753 -5.450 3.232 1.00 . A A . 16 LEU HD23 1 1 4 2309 1 1 16 LEU HG H -1.901 -2.703 3.814 1.00 . A A . 16 LEU HG 1 1 4 2310 1 1 16 LEU N N -1.687 -3.331 7.192 1.00 . A A . 16 LEU N 1 1 4 2311 1 1 16 LEU O O -5.152 -3.806 6.281 1.00 . A A . 16 LEU O 1 1 4 2312 1 1 17 SER C C -5.909 -3.807 9.482 1.00 . A A . 17 SER C 1 1 4 2313 1 1 17 SER CA C -5.229 -4.940 8.713 1.00 . A A . 17 SER CA 1 1 4 2314 1 1 17 SER CB C -4.748 -6.020 9.680 1.00 . A A . 17 SER CB 1 1 4 2315 1 1 17 SER H H -3.126 -4.502 8.490 1.00 . A A . 17 SER H 1 1 4 2316 1 1 17 SER HA H -5.907 -5.366 7.990 1.00 . A A . 17 SER HA 1 1 4 2317 1 1 17 SER HB2 H -4.066 -6.679 9.176 1.00 . A A . 17 SER HB2 1 1 4 2318 1 1 17 SER HB3 H -4.245 -5.554 10.519 1.00 . A A . 17 SER HB3 1 1 4 2319 1 1 17 SER HG H -6.386 -6.201 10.714 1.00 . A A . 17 SER HG 1 1 4 2320 1 1 17 SER N N -3.995 -4.435 8.038 1.00 . A A . 17 SER N 1 1 4 2321 1 1 17 SER O O -6.993 -3.963 10.006 1.00 . A A . 17 SER O 1 1 4 2322 1 1 17 SER OG O -5.867 -6.767 10.139 1.00 . A A . 17 SER OG 1 1 4 2323 1 1 18 ALA C C -5.557 -0.210 9.596 1.00 . A A . 18 ALA C 1 1 4 2324 1 1 18 ALA CA C -5.889 -1.529 10.296 1.00 . A A . 18 ALA CA 1 1 4 2325 1 1 18 ALA CB C -5.256 -1.585 11.687 1.00 . A A . 18 ALA CB 1 1 4 2326 1 1 18 ALA H H -4.403 -2.564 9.130 1.00 . A A . 18 ALA H 1 1 4 2327 1 1 18 ALA HA H -6.956 -1.658 10.371 1.00 . A A . 18 ALA HA 1 1 4 2328 1 1 18 ALA HB1 H -6.027 -1.751 12.425 1.00 . A A . 18 ALA HB1 1 1 4 2329 1 1 18 ALA HB2 H -4.754 -0.652 11.892 1.00 . A A . 18 ALA HB2 1 1 4 2330 1 1 18 ALA HB3 H -4.542 -2.395 11.724 1.00 . A A . 18 ALA HB3 1 1 4 2331 1 1 18 ALA N N -5.279 -2.669 9.557 1.00 . A A . 18 ALA N 1 1 4 2332 1 1 18 ALA O O -5.027 0.703 10.199 1.00 . A A . 18 ALA O 1 1 4 2333 1 1 19 PRO C C -6.611 2.207 7.827 1.00 . A A . 19 PRO C 1 1 4 2334 1 1 19 PRO CA C -5.630 1.050 7.520 1.00 . A A . 19 PRO CA 1 1 4 2335 1 1 19 PRO CB C -5.795 0.558 6.084 1.00 . A A . 19 PRO CB 1 1 4 2336 1 1 19 PRO CD C -6.517 -1.231 7.551 1.00 . A A . 19 PRO CD 1 1 4 2337 1 1 19 PRO CG C -6.686 -0.641 6.171 1.00 . A A . 19 PRO CG 1 1 4 2338 1 1 19 PRO HA H -4.615 1.382 7.665 1.00 . A A . 19 PRO HA 1 1 4 2339 1 1 19 PRO HB2 H -6.254 1.327 5.477 1.00 . A A . 19 PRO HB2 1 1 4 2340 1 1 19 PRO HB3 H -4.838 0.276 5.673 1.00 . A A . 19 PRO HB3 1 1 4 2341 1 1 19 PRO HD2 H -7.480 -1.493 7.969 1.00 . A A . 19 PRO HD2 1 1 4 2342 1 1 19 PRO HD3 H -5.872 -2.096 7.514 1.00 . A A . 19 PRO HD3 1 1 4 2343 1 1 19 PRO HG2 H -7.713 -0.347 6.014 1.00 . A A . 19 PRO HG2 1 1 4 2344 1 1 19 PRO HG3 H -6.395 -1.369 5.430 1.00 . A A . 19 PRO HG3 1 1 4 2345 1 1 19 PRO N N -5.885 -0.161 8.332 1.00 . A A . 19 PRO N 1 1 4 2346 1 1 19 PRO O O -6.249 3.352 7.647 1.00 . A A . 19 PRO O 1 1 4 2347 1 1 20 PRO C C -8.390 3.742 9.839 1.00 . A A . 20 PRO C 1 1 4 2348 1 1 20 PRO CA C -8.783 2.999 8.561 1.00 . A A . 20 PRO CA 1 1 4 2349 1 1 20 PRO CB C -10.114 2.276 8.737 1.00 . A A . 20 PRO CB 1 1 4 2350 1 1 20 PRO CD C -8.403 0.583 8.536 1.00 . A A . 20 PRO CD 1 1 4 2351 1 1 20 PRO CG C -9.752 0.885 9.137 1.00 . A A . 20 PRO CG 1 1 4 2352 1 1 20 PRO HA H -8.844 3.682 7.730 1.00 . A A . 20 PRO HA 1 1 4 2353 1 1 20 PRO HB2 H -10.698 2.752 9.514 1.00 . A A . 20 PRO HB2 1 1 4 2354 1 1 20 PRO HB3 H -10.661 2.264 7.808 1.00 . A A . 20 PRO HB3 1 1 4 2355 1 1 20 PRO HD2 H -7.805 0.033 9.244 1.00 . A A . 20 PRO HD2 1 1 4 2356 1 1 20 PRO HD3 H -8.512 0.029 7.619 1.00 . A A . 20 PRO HD3 1 1 4 2357 1 1 20 PRO HG2 H -9.704 0.812 10.215 1.00 . A A . 20 PRO HG2 1 1 4 2358 1 1 20 PRO HG3 H -10.483 0.190 8.753 1.00 . A A . 20 PRO HG3 1 1 4 2359 1 1 20 PRO N N -7.819 1.908 8.268 1.00 . A A . 20 PRO N 1 1 4 2360 1 1 20 PRO O O -8.574 4.938 9.954 1.00 . A A . 20 PRO O 1 1 4 2361 1 1 21 PHE C C -5.999 4.217 11.945 1.00 . A A . 21 PHE C 1 1 4 2362 1 1 21 PHE CA C -7.438 3.722 12.063 1.00 . A A . 21 PHE CA 1 1 4 2363 1 1 21 PHE CB C -7.545 2.646 13.145 1.00 . A A . 21 PHE CB 1 1 4 2364 1 1 21 PHE CD1 C -10.037 2.627 12.788 1.00 . A A . 21 PHE CD1 1 1 4 2365 1 1 21 PHE CD2 C -8.877 0.514 13.042 1.00 . A A . 21 PHE CD2 1 1 4 2366 1 1 21 PHE CE1 C -11.250 1.946 12.640 1.00 . A A . 21 PHE CE1 1 1 4 2367 1 1 21 PHE CE2 C -10.090 -0.169 12.894 1.00 . A A . 21 PHE CE2 1 1 4 2368 1 1 21 PHE CG C -8.852 1.911 12.990 1.00 . A A . 21 PHE CG 1 1 4 2369 1 1 21 PHE CZ C -11.276 0.547 12.693 1.00 . A A . 21 PHE CZ 1 1 4 2370 1 1 21 PHE H H -7.702 2.086 10.687 1.00 . A A . 21 PHE H 1 1 4 2371 1 1 21 PHE HA H -8.104 4.541 12.289 1.00 . A A . 21 PHE HA 1 1 4 2372 1 1 21 PHE HB2 H -6.723 1.950 13.044 1.00 . A A . 21 PHE HB2 1 1 4 2373 1 1 21 PHE HB3 H -7.507 3.109 14.120 1.00 . A A . 21 PHE HB3 1 1 4 2374 1 1 21 PHE HD1 H -10.015 3.707 12.748 1.00 . A A . 21 PHE HD1 1 1 4 2375 1 1 21 PHE HD2 H -7.962 -0.038 13.198 1.00 . A A . 21 PHE HD2 1 1 4 2376 1 1 21 PHE HE1 H -12.164 2.499 12.484 1.00 . A A . 21 PHE HE1 1 1 4 2377 1 1 21 PHE HE2 H -10.110 -1.248 12.933 1.00 . A A . 21 PHE HE2 1 1 4 2378 1 1 21 PHE HZ H -12.212 0.020 12.578 1.00 . A A . 21 PHE HZ 1 1 4 2379 1 1 21 PHE N N -7.846 3.047 10.799 1.00 . A A . 21 PHE N 1 1 4 2380 1 1 21 PHE O O -5.339 4.475 12.930 1.00 . A A . 21 PHE O 1 1 4 2381 1 1 22 VAL C C -3.937 5.518 9.214 1.00 . A A . 22 VAL C 1 1 4 2382 1 1 22 VAL CA C -4.103 4.812 10.564 1.00 . A A . 22 VAL CA 1 1 4 2383 1 1 22 VAL CB C -3.257 3.543 10.601 1.00 . A A . 22 VAL CB 1 1 4 2384 1 1 22 VAL CG1 C -3.659 2.682 11.801 1.00 . A A . 22 VAL CG1 1 1 4 2385 1 1 22 VAL CG2 C -3.473 2.749 9.311 1.00 . A A . 22 VAL CG2 1 1 4 2386 1 1 22 VAL H H -6.054 4.124 9.961 1.00 . A A . 22 VAL H 1 1 4 2387 1 1 22 VAL HA H -3.819 5.468 11.371 1.00 . A A . 22 VAL HA 1 1 4 2388 1 1 22 VAL HB H -2.220 3.813 10.688 1.00 . A A . 22 VAL HB 1 1 4 2389 1 1 22 VAL HG11 H -4.659 2.299 11.651 1.00 . A A . 22 VAL HG11 1 1 4 2390 1 1 22 VAL HG12 H -3.635 3.282 12.698 1.00 . A A . 22 VAL HG12 1 1 4 2391 1 1 22 VAL HG13 H -2.969 1.859 11.900 1.00 . A A . 22 VAL HG13 1 1 4 2392 1 1 22 VAL HG21 H -3.249 1.707 9.487 1.00 . A A . 22 VAL HG21 1 1 4 2393 1 1 22 VAL HG22 H -2.822 3.132 8.539 1.00 . A A . 22 VAL HG22 1 1 4 2394 1 1 22 VAL HG23 H -4.502 2.848 8.996 1.00 . A A . 22 VAL HG23 1 1 4 2395 1 1 22 VAL N N -5.506 4.343 10.743 1.00 . A A . 22 VAL N 1 1 4 2396 1 1 22 VAL O O -4.896 5.918 8.585 1.00 . A A . 22 VAL O 1 1 4 2397 1 1 23 GLN C C -1.207 5.810 6.791 1.00 . A A . 23 GLN C 1 1 4 2398 1 1 23 GLN CA C -2.477 6.350 7.462 1.00 . A A . 23 GLN CA 1 1 4 2399 1 1 23 GLN CB C -2.306 7.830 7.812 1.00 . A A . 23 GLN CB 1 1 4 2400 1 1 23 GLN CD C -3.239 9.287 6.008 1.00 . A A . 23 GLN CD 1 1 4 2401 1 1 23 GLN CG C -1.970 8.619 6.545 1.00 . A A . 23 GLN CG 1 1 4 2402 1 1 23 GLN H H -1.963 5.340 9.296 1.00 . A A . 23 GLN H 1 1 4 2403 1 1 23 GLN HA H -3.327 6.224 6.811 1.00 . A A . 23 GLN HA 1 1 4 2404 1 1 23 GLN HB2 H -3.224 8.207 8.240 1.00 . A A . 23 GLN HB2 1 1 4 2405 1 1 23 GLN HB3 H -1.504 7.940 8.525 1.00 . A A . 23 GLN HB3 1 1 4 2406 1 1 23 GLN HE21 H -4.202 7.569 5.739 1.00 . A A . 23 GLN HE21 1 1 4 2407 1 1 23 GLN HE22 H -5.073 8.964 5.317 1.00 . A A . 23 GLN HE22 1 1 4 2408 1 1 23 GLN HG2 H -1.235 9.376 6.777 1.00 . A A . 23 GLN HG2 1 1 4 2409 1 1 23 GLN HG3 H -1.574 7.948 5.797 1.00 . A A . 23 GLN HG3 1 1 4 2410 1 1 23 GLN N N -2.718 5.671 8.769 1.00 . A A . 23 GLN N 1 1 4 2411 1 1 23 GLN NE2 N -4.255 8.545 5.658 1.00 . A A . 23 GLN NE2 1 1 4 2412 1 1 23 GLN O O -1.103 5.778 5.581 1.00 . A A . 23 GLN O 1 1 4 2413 1 1 23 GLN OE1 O -3.306 10.495 5.904 1.00 . A A . 23 GLN OE1 1 1 4 2414 1 1 24 CYS C C 0.757 3.585 6.163 1.00 . A A . 24 CYS C 1 1 4 2415 1 1 24 CYS CA C 1.027 4.881 6.948 1.00 . A A . 24 CYS CA 1 1 4 2416 1 1 24 CYS CB C 1.986 4.666 8.130 1.00 . A A . 24 CYS CB 1 1 4 2417 1 1 24 CYS H H -0.321 5.441 8.533 1.00 . A A . 24 CYS H 1 1 4 2418 1 1 24 CYS HA H 1.438 5.626 6.284 1.00 . A A . 24 CYS HA 1 1 4 2419 1 1 24 CYS HB2 H 3.005 4.735 7.782 1.00 . A A . 24 CYS HB2 1 1 4 2420 1 1 24 CYS HB3 H 1.813 5.437 8.870 1.00 . A A . 24 CYS HB3 1 1 4 2421 1 1 24 CYS N N -0.232 5.398 7.559 1.00 . A A . 24 CYS N 1 1 4 2422 1 1 24 CYS O O -0.288 2.975 6.282 1.00 . A A . 24 CYS O 1 1 4 2423 1 1 24 CYS SG S 1.728 3.044 8.889 1.00 . A A . 24 CYS SG 1 1 4 2424 1 1 25 GLY C C 2.842 1.205 4.414 1.00 . A A . 25 GLY C 1 1 4 2425 1 1 25 GLY CA C 1.510 1.949 4.511 1.00 . A A . 25 GLY CA 1 1 4 2426 1 1 25 GLY H H 2.515 3.705 5.256 1.00 . A A . 25 GLY H 1 1 4 2427 1 1 25 GLY HA2 H 0.769 1.309 4.969 1.00 . A A . 25 GLY HA2 1 1 4 2428 1 1 25 GLY HA3 H 1.186 2.225 3.521 1.00 . A A . 25 GLY HA3 1 1 4 2429 1 1 25 GLY N N 1.692 3.181 5.342 1.00 . A A . 25 GLY N 1 1 4 2430 1 1 25 GLY O O 3.817 1.602 5.007 1.00 . A A . 25 GLY O 1 1 4 2431 1 1 26 TRP C C 5.027 -0.039 2.434 1.00 . A A . 26 TRP C 1 1 4 2432 1 1 26 TRP CA C 4.191 -0.620 3.578 1.00 . A A . 26 TRP CA 1 1 4 2433 1 1 26 TRP CB C 3.793 -2.068 3.286 1.00 . A A . 26 TRP CB 1 1 4 2434 1 1 26 TRP CD1 C 5.786 -3.591 2.979 1.00 . A A . 26 TRP CD1 1 1 4 2435 1 1 26 TRP CD2 C 5.160 -3.406 5.130 1.00 . A A . 26 TRP CD2 1 1 4 2436 1 1 26 TRP CE2 C 6.273 -4.275 5.106 1.00 . A A . 26 TRP CE2 1 1 4 2437 1 1 26 TRP CE3 C 4.570 -3.121 6.371 1.00 . A A . 26 TRP CE3 1 1 4 2438 1 1 26 TRP CG C 4.870 -2.985 3.767 1.00 . A A . 26 TRP CG 1 1 4 2439 1 1 26 TRP CH2 C 6.186 -4.546 7.502 1.00 . A A . 26 TRP CH2 1 1 4 2440 1 1 26 TRP CZ2 C 6.785 -4.841 6.275 1.00 . A A . 26 TRP CZ2 1 1 4 2441 1 1 26 TRP CZ3 C 5.079 -3.687 7.550 1.00 . A A . 26 TRP CZ3 1 1 4 2442 1 1 26 TRP H H 2.104 -0.197 3.197 1.00 . A A . 26 TRP H 1 1 4 2443 1 1 26 TRP HA H 4.735 -0.565 4.505 1.00 . A A . 26 TRP HA 1 1 4 2444 1 1 26 TRP HB2 H 2.870 -2.297 3.798 1.00 . A A . 26 TRP HB2 1 1 4 2445 1 1 26 TRP HB3 H 3.657 -2.197 2.224 1.00 . A A . 26 TRP HB3 1 1 4 2446 1 1 26 TRP HD1 H 5.855 -3.492 1.906 1.00 . A A . 26 TRP HD1 1 1 4 2447 1 1 26 TRP HE1 H 7.369 -4.899 3.448 1.00 . A A . 26 TRP HE1 1 1 4 2448 1 1 26 TRP HE3 H 3.720 -2.462 6.415 1.00 . A A . 26 TRP HE3 1 1 4 2449 1 1 26 TRP HH2 H 6.576 -4.979 8.412 1.00 . A A . 26 TRP HH2 1 1 4 2450 1 1 26 TRP HZ2 H 7.644 -5.496 6.229 1.00 . A A . 26 TRP HZ2 1 1 4 2451 1 1 26 TRP HZ3 H 4.617 -3.460 8.500 1.00 . A A . 26 TRP HZ3 1 1 4 2452 1 1 26 TRP N N 2.901 0.124 3.680 1.00 . A A . 26 TRP N 1 1 4 2453 1 1 26 TRP NE1 N 6.620 -4.357 3.772 1.00 . A A . 26 TRP NE1 1 1 4 2454 1 1 26 TRP O O 4.516 0.267 1.375 1.00 . A A . 26 TRP O 1 1 4 2455 1 1 27 CYS C C 8.493 0.033 1.426 1.00 . A A . 27 CYS C 1 1 4 2456 1 1 27 CYS CA C 7.151 0.760 1.580 1.00 . A A . 27 CYS CA 1 1 4 2457 1 1 27 CYS CB C 7.382 2.199 2.040 1.00 . A A . 27 CYS CB 1 1 4 2458 1 1 27 CYS H H 6.698 -0.069 3.522 1.00 . A A . 27 CYS H 1 1 4 2459 1 1 27 CYS HA H 6.618 0.763 0.643 1.00 . A A . 27 CYS HA 1 1 4 2460 1 1 27 CYS HB2 H 6.441 2.727 2.059 1.00 . A A . 27 CYS HB2 1 1 4 2461 1 1 27 CYS HB3 H 7.813 2.196 3.031 1.00 . A A . 27 CYS HB3 1 1 4 2462 1 1 27 CYS N N 6.306 0.156 2.651 1.00 . A A . 27 CYS N 1 1 4 2463 1 1 27 CYS O O 9.430 0.269 2.159 1.00 . A A . 27 CYS O 1 1 4 2464 1 1 27 CYS SG S 8.516 3.024 0.894 1.00 . A A . 27 CYS SG 1 1 4 2465 1 1 28 HIS C C 10.525 -2.089 1.462 1.00 . A A . 28 HIS C 1 1 4 2466 1 1 28 HIS CA C 9.875 -1.547 0.182 1.00 . A A . 28 HIS CA 1 1 4 2467 1 1 28 HIS CB C 10.786 -0.504 -0.464 1.00 . A A . 28 HIS CB 1 1 4 2468 1 1 28 HIS CD2 C 13.385 -0.736 -0.784 1.00 . A A . 28 HIS CD2 1 1 4 2469 1 1 28 HIS CE1 C 13.415 -2.713 -1.669 1.00 . A A . 28 HIS CE1 1 1 4 2470 1 1 28 HIS CG C 12.080 -1.155 -0.865 1.00 . A A . 28 HIS CG 1 1 4 2471 1 1 28 HIS H H 7.828 -0.966 -0.149 1.00 . A A . 28 HIS H 1 1 4 2472 1 1 28 HIS HA H 9.706 -2.351 -0.515 1.00 . A A . 28 HIS HA 1 1 4 2473 1 1 28 HIS HB2 H 10.302 -0.093 -1.338 1.00 . A A . 28 HIS HB2 1 1 4 2474 1 1 28 HIS HB3 H 10.986 0.289 0.243 1.00 . A A . 28 HIS HB3 1 1 4 2475 1 1 28 HIS HD1 H 11.353 -2.993 -1.627 1.00 . A A . 28 HIS HD1 1 1 4 2476 1 1 28 HIS HD2 H 13.710 0.215 -0.386 1.00 . A A . 28 HIS HD2 1 1 4 2477 1 1 28 HIS HE1 H 13.754 -3.639 -2.111 1.00 . A A . 28 HIS HE1 1 1 4 2478 1 1 28 HIS N N 8.594 -0.819 0.444 1.00 . A A . 28 HIS N 1 1 4 2479 1 1 28 HIS ND1 N 12.123 -2.418 -1.434 1.00 . A A . 28 HIS ND1 1 1 4 2480 1 1 28 HIS NE2 N 14.226 -1.721 -1.292 1.00 . A A . 28 HIS NE2 1 1 4 2481 1 1 28 HIS O O 11.704 -2.384 1.479 1.00 . A A . 28 HIS O 1 1 4 2482 1 1 29 ASP C C 9.461 -2.761 4.945 1.00 . A A . 29 ASP C 1 1 4 2483 1 1 29 ASP CA C 10.422 -2.803 3.762 1.00 . A A . 29 ASP CA 1 1 4 2484 1 1 29 ASP CB C 11.649 -1.932 4.047 1.00 . A A . 29 ASP CB 1 1 4 2485 1 1 29 ASP CG C 11.380 -0.479 3.646 1.00 . A A . 29 ASP CG 1 1 4 2486 1 1 29 ASP H H 8.835 -2.029 2.509 1.00 . A A . 29 ASP H 1 1 4 2487 1 1 29 ASP HA H 10.739 -3.819 3.586 1.00 . A A . 29 ASP HA 1 1 4 2488 1 1 29 ASP HB2 H 11.868 -1.978 5.104 1.00 . A A . 29 ASP HB2 1 1 4 2489 1 1 29 ASP HB3 H 12.493 -2.309 3.489 1.00 . A A . 29 ASP HB3 1 1 4 2490 1 1 29 ASP N N 9.790 -2.251 2.525 1.00 . A A . 29 ASP N 1 1 4 2491 1 1 29 ASP O O 8.762 -3.711 5.206 1.00 . A A . 29 ASP O 1 1 4 2492 1 1 29 ASP OD1 O 10.524 0.137 4.259 1.00 . A A . 29 ASP OD1 1 1 4 2493 1 1 29 ASP OD2 O 12.037 -0.006 2.733 1.00 . A A . 29 ASP OD2 1 1 4 2494 1 1 30 LYS C C 7.281 -0.776 6.527 1.00 . A A . 30 LYS C 1 1 4 2495 1 1 30 LYS CA C 8.524 -1.610 6.856 1.00 . A A . 30 LYS CA 1 1 4 2496 1 1 30 LYS CB C 9.358 -0.962 7.968 1.00 . A A . 30 LYS CB 1 1 4 2497 1 1 30 LYS CD C 10.432 1.176 8.683 1.00 . A A . 30 LYS CD 1 1 4 2498 1 1 30 LYS CE C 10.017 1.196 10.155 1.00 . A A . 30 LYS CE 1 1 4 2499 1 1 30 LYS CG C 9.309 0.563 7.848 1.00 . A A . 30 LYS CG 1 1 4 2500 1 1 30 LYS H H 10.021 -0.928 5.465 1.00 . A A . 30 LYS H 1 1 4 2501 1 1 30 LYS HA H 8.233 -2.604 7.155 1.00 . A A . 30 LYS HA 1 1 4 2502 1 1 30 LYS HB2 H 8.962 -1.258 8.928 1.00 . A A . 30 LYS HB2 1 1 4 2503 1 1 30 LYS HB3 H 10.382 -1.294 7.886 1.00 . A A . 30 LYS HB3 1 1 4 2504 1 1 30 LYS HD2 H 11.331 0.585 8.570 1.00 . A A . 30 LYS HD2 1 1 4 2505 1 1 30 LYS HD3 H 10.621 2.185 8.351 1.00 . A A . 30 LYS HD3 1 1 4 2506 1 1 30 LYS HE2 H 10.030 2.208 10.536 1.00 . A A . 30 LYS HE2 1 1 4 2507 1 1 30 LYS HE3 H 9.038 0.759 10.276 1.00 . A A . 30 LYS HE3 1 1 4 2508 1 1 30 LYS HG2 H 9.431 0.848 6.812 1.00 . A A . 30 LYS HG2 1 1 4 2509 1 1 30 LYS HG3 H 8.358 0.920 8.212 1.00 . A A . 30 LYS HG3 1 1 4 2510 1 1 30 LYS HZ1 H 11.982 0.601 10.491 1.00 . A A . 30 LYS HZ1 1 1 4 2511 1 1 30 LYS HZ2 H 10.841 -0.644 10.671 1.00 . A A . 30 LYS HZ2 1 1 4 2512 1 1 30 LYS HZ3 H 10.999 0.548 11.872 1.00 . A A . 30 LYS HZ3 1 1 4 2513 1 1 30 LYS N N 9.435 -1.682 5.678 1.00 . A A . 30 LYS N 1 1 4 2514 1 1 30 LYS NZ N 11.037 0.362 10.850 1.00 . A A . 30 LYS NZ 1 1 4 2515 1 1 30 LYS O O 7.118 -0.290 5.425 1.00 . A A . 30 LYS O 1 1 4 2516 1 1 31 CYS C C 5.384 1.656 7.491 1.00 . A A . 31 CYS C 1 1 4 2517 1 1 31 CYS CA C 5.158 0.167 7.216 1.00 . A A . 31 CYS CA 1 1 4 2518 1 1 31 CYS CB C 4.123 -0.401 8.181 1.00 . A A . 31 CYS CB 1 1 4 2519 1 1 31 CYS H H 6.544 -1.030 8.352 1.00 . A A . 31 CYS H 1 1 4 2520 1 1 31 CYS HA H 4.828 0.023 6.204 1.00 . A A . 31 CYS HA 1 1 4 2521 1 1 31 CYS HB2 H 4.115 -1.477 8.108 1.00 . A A . 31 CYS HB2 1 1 4 2522 1 1 31 CYS HB3 H 4.375 -0.107 9.189 1.00 . A A . 31 CYS HB3 1 1 4 2523 1 1 31 CYS N N 6.397 -0.620 7.474 1.00 . A A . 31 CYS N 1 1 4 2524 1 1 31 CYS O O 5.439 2.092 8.624 1.00 . A A . 31 CYS O 1 1 4 2525 1 1 31 CYS SG S 2.488 0.249 7.755 1.00 . A A . 31 CYS SG 1 1 4 2526 1 1 32 VAL C C 4.962 4.652 5.509 1.00 . A A . 32 VAL C 1 1 4 2527 1 1 32 VAL CA C 5.706 3.902 6.622 1.00 . A A . 32 VAL CA 1 1 4 2528 1 1 32 VAL CB C 7.216 4.100 6.502 1.00 . A A . 32 VAL CB 1 1 4 2529 1 1 32 VAL CG1 C 7.930 3.035 7.335 1.00 . A A . 32 VAL CG1 1 1 4 2530 1 1 32 VAL CG2 C 7.634 3.960 5.037 1.00 . A A . 32 VAL CG2 1 1 4 2531 1 1 32 VAL H H 5.443 2.056 5.552 1.00 . A A . 32 VAL H 1 1 4 2532 1 1 32 VAL HA H 5.363 4.223 7.593 1.00 . A A . 32 VAL HA 1 1 4 2533 1 1 32 VAL HB H 7.483 5.083 6.865 1.00 . A A . 32 VAL HB 1 1 4 2534 1 1 32 VAL HG11 H 7.836 2.076 6.846 1.00 . A A . 32 VAL HG11 1 1 4 2535 1 1 32 VAL HG12 H 7.480 2.983 8.316 1.00 . A A . 32 VAL HG12 1 1 4 2536 1 1 32 VAL HG13 H 8.974 3.289 7.430 1.00 . A A . 32 VAL HG13 1 1 4 2537 1 1 32 VAL HG21 H 6.792 3.612 4.456 1.00 . A A . 32 VAL HG21 1 1 4 2538 1 1 32 VAL HG22 H 8.442 3.247 4.961 1.00 . A A . 32 VAL HG22 1 1 4 2539 1 1 32 VAL HG23 H 7.960 4.918 4.661 1.00 . A A . 32 VAL HG23 1 1 4 2540 1 1 32 VAL N N 5.500 2.435 6.453 1.00 . A A . 32 VAL N 1 1 4 2541 1 1 32 VAL O O 4.394 4.051 4.620 1.00 . A A . 32 VAL O 1 1 4 2542 1 1 33 ARG C C 5.147 7.809 3.910 1.00 . A A . 33 ARG C 1 1 4 2543 1 1 33 ARG CA C 4.236 6.726 4.491 1.00 . A A . 33 ARG CA 1 1 4 2544 1 1 33 ARG CB C 3.036 7.359 5.192 1.00 . A A . 33 ARG CB 1 1 4 2545 1 1 33 ARG CD C 0.860 8.424 4.568 1.00 . A A . 33 ARG CD 1 1 4 2546 1 1 33 ARG CG C 1.803 7.249 4.291 1.00 . A A . 33 ARG CG 1 1 4 2547 1 1 33 ARG CZ C 0.080 9.154 2.397 1.00 . A A . 33 ARG CZ 1 1 4 2548 1 1 33 ARG H H 5.410 6.428 6.276 1.00 . A A . 33 ARG H 1 1 4 2549 1 1 33 ARG HA H 3.897 6.063 3.710 1.00 . A A . 33 ARG HA 1 1 4 2550 1 1 33 ARG HB2 H 2.850 6.845 6.123 1.00 . A A . 33 ARG HB2 1 1 4 2551 1 1 33 ARG HB3 H 3.243 8.400 5.390 1.00 . A A . 33 ARG HB3 1 1 4 2552 1 1 33 ARG HD2 H 0.354 8.283 5.513 1.00 . A A . 33 ARG HD2 1 1 4 2553 1 1 33 ARG HD3 H 1.405 9.354 4.565 1.00 . A A . 33 ARG HD3 1 1 4 2554 1 1 33 ARG HE H -0.906 7.823 3.492 1.00 . A A . 33 ARG HE 1 1 4 2555 1 1 33 ARG HG2 H 2.111 7.271 3.255 1.00 . A A . 33 ARG HG2 1 1 4 2556 1 1 33 ARG HG3 H 1.289 6.321 4.495 1.00 . A A . 33 ARG HG3 1 1 4 2557 1 1 33 ARG HH11 H 1.353 7.877 1.528 1.00 . A A . 33 ARG HH11 1 1 4 2558 1 1 33 ARG HH12 H 1.039 9.336 0.648 1.00 . A A . 33 ARG HH12 1 1 4 2559 1 1 33 ARG HH21 H -1.147 10.608 3.020 1.00 . A A . 33 ARG HH21 1 1 4 2560 1 1 33 ARG HH22 H -0.378 10.881 1.492 1.00 . A A . 33 ARG HH22 1 1 4 2561 1 1 33 ARG N N 4.952 5.956 5.551 1.00 . A A . 33 ARG N 1 1 4 2562 1 1 33 ARG NE N -0.117 8.402 3.444 1.00 . A A . 33 ARG NE 1 1 4 2563 1 1 33 ARG NH1 N 0.886 8.758 1.451 1.00 . A A . 33 ARG NH1 1 1 4 2564 1 1 33 ARG NH2 N -0.529 10.305 2.295 1.00 . A A . 33 ARG NH2 1 1 4 2565 1 1 33 ARG O O 6.259 8.003 4.361 1.00 . A A . 33 ARG O 1 1 4 2566 1 1 34 SER C C 6.330 10.317 3.341 1.00 . A A . 34 SER C 1 1 4 2567 1 1 34 SER CA C 5.506 9.584 2.280 1.00 . A A . 34 SER CA 1 1 4 2568 1 1 34 SER CB C 4.494 10.532 1.637 1.00 . A A . 34 SER CB 1 1 4 2569 1 1 34 SER H H 3.781 8.322 2.564 1.00 . A A . 34 SER H 1 1 4 2570 1 1 34 SER HA H 6.151 9.168 1.522 1.00 . A A . 34 SER HA 1 1 4 2571 1 1 34 SER HB2 H 3.752 9.961 1.103 1.00 . A A . 34 SER HB2 1 1 4 2572 1 1 34 SER HB3 H 4.010 11.117 2.408 1.00 . A A . 34 SER HB3 1 1 4 2573 1 1 34 SER HG H 4.522 11.991 0.349 1.00 . A A . 34 SER HG 1 1 4 2574 1 1 34 SER N N 4.680 8.508 2.907 1.00 . A A . 34 SER N 1 1 4 2575 1 1 34 SER O O 7.441 10.742 3.093 1.00 . A A . 34 SER O 1 1 4 2576 1 1 34 SER OG O 5.169 11.390 0.726 1.00 . A A . 34 SER OG 1 1 4 2577 1 1 35 GLU C C 7.984 10.602 5.668 1.00 . A A . 35 GLU C 1 1 4 2578 1 1 35 GLU CA C 6.561 11.160 5.599 1.00 . A A . 35 GLU CA 1 1 4 2579 1 1 35 GLU CB C 5.800 10.856 6.891 1.00 . A A . 35 GLU CB 1 1 4 2580 1 1 35 GLU CD C 6.648 12.251 8.783 1.00 . A A . 35 GLU CD 1 1 4 2581 1 1 35 GLU CG C 5.593 12.151 7.680 1.00 . A A . 35 GLU CG 1 1 4 2582 1 1 35 GLU H H 4.903 10.108 4.708 1.00 . A A . 35 GLU H 1 1 4 2583 1 1 35 GLU HA H 6.579 12.224 5.420 1.00 . A A . 35 GLU HA 1 1 4 2584 1 1 35 GLU HB2 H 4.841 10.422 6.650 1.00 . A A . 35 GLU HB2 1 1 4 2585 1 1 35 GLU HB3 H 6.371 10.161 7.488 1.00 . A A . 35 GLU HB3 1 1 4 2586 1 1 35 GLU HG2 H 5.686 12.997 7.014 1.00 . A A . 35 GLU HG2 1 1 4 2587 1 1 35 GLU HG3 H 4.610 12.148 8.125 1.00 . A A . 35 GLU HG3 1 1 4 2588 1 1 35 GLU N N 5.799 10.462 4.525 1.00 . A A . 35 GLU N 1 1 4 2589 1 1 35 GLU O O 8.926 11.308 5.968 1.00 . A A . 35 GLU O 1 1 4 2590 1 1 35 GLU OE1 O 7.816 12.366 8.450 1.00 . A A . 35 GLU OE1 1 1 4 2591 1 1 35 GLU OE2 O 6.270 12.211 9.943 1.00 . A A . 35 GLU OE2 1 1 4 2592 1 1 36 GLU C C 9.899 8.235 4.035 1.00 . A A . 36 GLU C 1 1 4 2593 1 1 36 GLU CA C 9.502 8.723 5.431 1.00 . A A . 36 GLU CA 1 1 4 2594 1 1 36 GLU CB C 9.378 7.546 6.399 1.00 . A A . 36 GLU CB 1 1 4 2595 1 1 36 GLU CD C 10.241 7.247 8.728 1.00 . A A . 36 GLU CD 1 1 4 2596 1 1 36 GLU CG C 10.637 7.461 7.265 1.00 . A A . 36 GLU CG 1 1 4 2597 1 1 36 GLU H H 7.368 8.788 5.147 1.00 . A A . 36 GLU H 1 1 4 2598 1 1 36 GLU HA H 10.224 9.433 5.803 1.00 . A A . 36 GLU HA 1 1 4 2599 1 1 36 GLU HB2 H 8.513 7.691 7.031 1.00 . A A . 36 GLU HB2 1 1 4 2600 1 1 36 GLU HB3 H 9.266 6.630 5.839 1.00 . A A . 36 GLU HB3 1 1 4 2601 1 1 36 GLU HG2 H 11.246 6.632 6.932 1.00 . A A . 36 GLU HG2 1 1 4 2602 1 1 36 GLU HG3 H 11.197 8.378 7.177 1.00 . A A . 36 GLU HG3 1 1 4 2603 1 1 36 GLU N N 8.143 9.336 5.389 1.00 . A A . 36 GLU N 1 1 4 2604 1 1 36 GLU O O 11.030 8.379 3.614 1.00 . A A . 36 GLU O 1 1 4 2605 1 1 36 GLU OE1 O 9.064 7.364 9.027 1.00 . A A . 36 GLU OE1 1 1 4 2606 1 1 36 GLU OE2 O 11.122 6.970 9.525 1.00 . A A . 36 GLU OE2 1 1 4 2607 1 1 37 CYS C C 8.931 8.239 0.903 1.00 . A A . 37 CYS C 1 1 4 2608 1 1 37 CYS CA C 9.293 7.171 1.939 1.00 . A A . 37 CYS CA 1 1 4 2609 1 1 37 CYS CB C 8.421 5.926 1.751 1.00 . A A . 37 CYS CB 1 1 4 2610 1 1 37 CYS H H 8.067 7.560 3.669 1.00 . A A . 37 CYS H 1 1 4 2611 1 1 37 CYS HA H 10.336 6.907 1.864 1.00 . A A . 37 CYS HA 1 1 4 2612 1 1 37 CYS HB2 H 7.610 5.946 2.463 1.00 . A A . 37 CYS HB2 1 1 4 2613 1 1 37 CYS HB3 H 8.020 5.917 0.748 1.00 . A A . 37 CYS HB3 1 1 4 2614 1 1 37 CYS N N 8.974 7.663 3.312 1.00 . A A . 37 CYS N 1 1 4 2615 1 1 37 CYS O O 8.163 8.000 -0.008 1.00 . A A . 37 CYS O 1 1 4 2616 1 1 37 CYS SG S 9.421 4.441 2.016 1.00 . A A . 37 CYS SG 1 1 4 2617 1 1 38 LEU C C 9.955 10.295 -1.235 1.00 . A A . 38 LEU C 1 1 4 2618 1 1 38 LEU CA C 9.167 10.502 0.061 1.00 . A A . 38 LEU CA 1 1 4 2619 1 1 38 LEU CB C 9.607 11.793 0.754 1.00 . A A . 38 LEU CB 1 1 4 2620 1 1 38 LEU CD1 C 8.625 13.702 2.033 1.00 . A A . 38 LEU CD1 1 1 4 2621 1 1 38 LEU CD2 C 8.328 13.572 -0.443 1.00 . A A . 38 LEU CD2 1 1 4 2622 1 1 38 LEU CG C 8.423 12.756 0.847 1.00 . A A . 38 LEU CG 1 1 4 2623 1 1 38 LEU H H 10.095 9.588 1.779 1.00 . A A . 38 LEU H 1 1 4 2624 1 1 38 LEU HA H 8.108 10.534 -0.141 1.00 . A A . 38 LEU HA 1 1 4 2625 1 1 38 LEU HB2 H 9.965 11.563 1.748 1.00 . A A . 38 LEU HB2 1 1 4 2626 1 1 38 LEU HB3 H 10.398 12.255 0.184 1.00 . A A . 38 LEU HB3 1 1 4 2627 1 1 38 LEU HD11 H 9.328 13.266 2.726 1.00 . A A . 38 LEU HD11 1 1 4 2628 1 1 38 LEU HD12 H 7.680 13.863 2.531 1.00 . A A . 38 LEU HD12 1 1 4 2629 1 1 38 LEU HD13 H 9.009 14.648 1.677 1.00 . A A . 38 LEU HD13 1 1 4 2630 1 1 38 LEU HD21 H 7.290 13.704 -0.710 1.00 . A A . 38 LEU HD21 1 1 4 2631 1 1 38 LEU HD22 H 8.840 13.049 -1.236 1.00 . A A . 38 LEU HD22 1 1 4 2632 1 1 38 LEU HD23 H 8.787 14.538 -0.293 1.00 . A A . 38 LEU HD23 1 1 4 2633 1 1 38 LEU HG H 7.511 12.193 0.989 1.00 . A A . 38 LEU HG 1 1 4 2634 1 1 38 LEU N N 9.479 9.416 1.036 1.00 . A A . 38 LEU N 1 1 4 2635 1 1 38 LEU O O 10.655 11.176 -1.694 1.00 . A A . 38 LEU O 1 1 4 2636 1 1 39 SER C C 9.609 8.699 -4.254 1.00 . A A . 39 SER C 1 1 4 2637 1 1 39 SER CA C 10.591 8.877 -3.093 1.00 . A A . 39 SER CA 1 1 4 2638 1 1 39 SER CB C 11.360 7.582 -2.840 1.00 . A A . 39 SER CB 1 1 4 2639 1 1 39 SER H H 9.277 8.440 -1.442 1.00 . A A . 39 SER H 1 1 4 2640 1 1 39 SER HA H 11.279 9.682 -3.301 1.00 . A A . 39 SER HA 1 1 4 2641 1 1 39 SER HB2 H 11.023 7.134 -1.921 1.00 . A A . 39 SER HB2 1 1 4 2642 1 1 39 SER HB3 H 11.185 6.895 -3.658 1.00 . A A . 39 SER HB3 1 1 4 2643 1 1 39 SER HG H 12.858 8.563 -2.080 1.00 . A A . 39 SER HG 1 1 4 2644 1 1 39 SER N N 9.847 9.137 -1.828 1.00 . A A . 39 SER N 1 1 4 2645 1 1 39 SER O O 9.942 8.916 -5.402 1.00 . A A . 39 SER O 1 1 4 2646 1 1 39 SER OG O 12.748 7.873 -2.738 1.00 . A A . 39 SER OG 1 1 4 2647 1 1 40 GLY C C 6.949 6.652 -5.079 1.00 . A A . 40 GLY C 1 1 4 2648 1 1 40 GLY CA C 7.396 8.114 -5.048 1.00 . A A . 40 GLY CA 1 1 4 2649 1 1 40 GLY H H 8.150 8.137 -3.031 1.00 . A A . 40 GLY H 1 1 4 2650 1 1 40 GLY HA2 H 6.541 8.750 -4.863 1.00 . A A . 40 GLY HA2 1 1 4 2651 1 1 40 GLY HA3 H 7.839 8.372 -5.998 1.00 . A A . 40 GLY HA3 1 1 4 2652 1 1 40 GLY N N 8.399 8.306 -3.963 1.00 . A A . 40 GLY N 1 1 4 2653 1 1 40 GLY O O 6.419 6.178 -6.064 1.00 . A A . 40 GLY O 1 1 4 2654 1 1 41 THR C C 6.078 4.155 -2.649 1.00 . A A . 41 THR C 1 1 4 2655 1 1 41 THR CA C 6.741 4.500 -3.987 1.00 . A A . 41 THR CA 1 1 4 2656 1 1 41 THR CB C 8.037 3.705 -4.173 1.00 . A A . 41 THR CB 1 1 4 2657 1 1 41 THR CG2 C 8.842 3.712 -2.874 1.00 . A A . 41 THR CG2 1 1 4 2658 1 1 41 THR H H 7.588 6.330 -3.224 1.00 . A A . 41 THR H 1 1 4 2659 1 1 41 THR HA H 6.066 4.295 -4.803 1.00 . A A . 41 THR HA 1 1 4 2660 1 1 41 THR HB H 8.624 4.154 -4.960 1.00 . A A . 41 THR HB 1 1 4 2661 1 1 41 THR HG1 H 8.508 1.832 -4.406 1.00 . A A . 41 THR HG1 1 1 4 2662 1 1 41 THR HG21 H 8.467 2.944 -2.213 1.00 . A A . 41 THR HG21 1 1 4 2663 1 1 41 THR HG22 H 8.746 4.676 -2.396 1.00 . A A . 41 THR HG22 1 1 4 2664 1 1 41 THR HG23 H 9.882 3.521 -3.093 1.00 . A A . 41 THR HG23 1 1 4 2665 1 1 41 THR N N 7.158 5.932 -4.011 1.00 . A A . 41 THR N 1 1 4 2666 1 1 41 THR O O 6.679 4.260 -1.599 1.00 . A A . 41 THR O 1 1 4 2667 1 1 41 THR OG1 O 7.719 2.366 -4.527 1.00 . A A . 41 THR OG1 1 1 4 2668 1 1 42 TRP C C 3.117 2.273 -1.702 1.00 . A A . 42 TRP C 1 1 4 2669 1 1 42 TRP CA C 4.132 3.385 -1.422 1.00 . A A . 42 TRP CA 1 1 4 2670 1 1 42 TRP CB C 3.424 4.668 -0.990 1.00 . A A . 42 TRP CB 1 1 4 2671 1 1 42 TRP CD1 C 3.376 4.399 1.518 1.00 . A A . 42 TRP CD1 1 1 4 2672 1 1 42 TRP CD2 C 1.331 4.253 0.594 1.00 . A A . 42 TRP CD2 1 1 4 2673 1 1 42 TRP CE2 C 1.158 4.089 1.987 1.00 . A A . 42 TRP CE2 1 1 4 2674 1 1 42 TRP CE3 C 0.190 4.203 -0.228 1.00 . A A . 42 TRP CE3 1 1 4 2675 1 1 42 TRP CG C 2.748 4.449 0.322 1.00 . A A . 42 TRP CG 1 1 4 2676 1 1 42 TRP CH2 C -1.228 3.835 1.717 1.00 . A A . 42 TRP CH2 1 1 4 2677 1 1 42 TRP CZ2 C -0.105 3.883 2.548 1.00 . A A . 42 TRP CZ2 1 1 4 2678 1 1 42 TRP CZ3 C -1.081 3.995 0.332 1.00 . A A . 42 TRP CZ3 1 1 4 2679 1 1 42 TRP H H 4.376 3.664 -3.544 1.00 . A A . 42 TRP H 1 1 4 2680 1 1 42 TRP HA H 4.836 3.076 -0.665 1.00 . A A . 42 TRP HA 1 1 4 2681 1 1 42 TRP HB2 H 4.147 5.464 -0.891 1.00 . A A . 42 TRP HB2 1 1 4 2682 1 1 42 TRP HB3 H 2.687 4.941 -1.732 1.00 . A A . 42 TRP HB3 1 1 4 2683 1 1 42 TRP HD1 H 4.440 4.508 1.674 1.00 . A A . 42 TRP HD1 1 1 4 2684 1 1 42 TRP HE1 H 2.633 4.108 3.463 1.00 . A A . 42 TRP HE1 1 1 4 2685 1 1 42 TRP HE3 H 0.292 4.324 -1.296 1.00 . A A . 42 TRP HE3 1 1 4 2686 1 1 42 TRP HH2 H -2.209 3.676 2.141 1.00 . A A . 42 TRP HH2 1 1 4 2687 1 1 42 TRP HZ2 H -0.212 3.761 3.616 1.00 . A A . 42 TRP HZ2 1 1 4 2688 1 1 42 TRP HZ3 H -1.949 3.959 -0.309 1.00 . A A . 42 TRP HZ3 1 1 4 2689 1 1 42 TRP N N 4.842 3.742 -2.684 1.00 . A A . 42 TRP N 1 1 4 2690 1 1 42 TRP NE1 N 2.437 4.185 2.507 1.00 . A A . 42 TRP NE1 1 1 4 2691 1 1 42 TRP O O 2.263 2.406 -2.555 1.00 . A A . 42 TRP O 1 1 4 2692 1 1 43 THR C C 1.419 -0.257 -0.013 1.00 . A A . 43 THR C 1 1 4 2693 1 1 43 THR CA C 2.252 0.059 -1.261 1.00 . A A . 43 THR CA 1 1 4 2694 1 1 43 THR CB C 3.124 -1.140 -1.641 1.00 . A A . 43 THR CB 1 1 4 2695 1 1 43 THR CG2 C 4.205 -1.352 -0.579 1.00 . A A . 43 THR CG2 1 1 4 2696 1 1 43 THR H H 3.912 1.074 -0.328 1.00 . A A . 43 THR H 1 1 4 2697 1 1 43 THR HA H 1.603 0.309 -2.086 1.00 . A A . 43 THR HA 1 1 4 2698 1 1 43 THR HB H 3.595 -0.954 -2.594 1.00 . A A . 43 THR HB 1 1 4 2699 1 1 43 THR HG1 H 2.824 -3.048 -1.406 1.00 . A A . 43 THR HG1 1 1 4 2700 1 1 43 THR HG21 H 3.744 -1.428 0.394 1.00 . A A . 43 THR HG21 1 1 4 2701 1 1 43 THR HG22 H 4.887 -0.514 -0.589 1.00 . A A . 43 THR HG22 1 1 4 2702 1 1 43 THR HG23 H 4.749 -2.261 -0.793 1.00 . A A . 43 THR HG23 1 1 4 2703 1 1 43 THR N N 3.210 1.172 -1.005 1.00 . A A . 43 THR N 1 1 4 2704 1 1 43 THR O O 1.893 -0.195 1.107 1.00 . A A . 43 THR O 1 1 4 2705 1 1 43 THR OG1 O 2.313 -2.303 -1.732 1.00 . A A . 43 THR OG1 1 1 4 2706 1 1 44 GLN C C -1.254 -2.365 0.756 1.00 . A A . 44 GLN C 1 1 4 2707 1 1 44 GLN CA C -0.707 -0.947 0.938 1.00 . A A . 44 GLN CA 1 1 4 2708 1 1 44 GLN CB C -1.841 0.079 0.879 1.00 . A A . 44 GLN CB 1 1 4 2709 1 1 44 GLN CD C -3.652 1.115 2.252 1.00 . A A . 44 GLN CD 1 1 4 2710 1 1 44 GLN CG C -2.279 0.442 2.298 1.00 . A A . 44 GLN CG 1 1 4 2711 1 1 44 GLN H H -0.172 -0.657 -1.126 1.00 . A A . 44 GLN H 1 1 4 2712 1 1 44 GLN HA H -0.172 -0.859 1.869 1.00 . A A . 44 GLN HA 1 1 4 2713 1 1 44 GLN HB2 H -1.495 0.967 0.370 1.00 . A A . 44 GLN HB2 1 1 4 2714 1 1 44 GLN HB3 H -2.677 -0.341 0.341 1.00 . A A . 44 GLN HB3 1 1 4 2715 1 1 44 GLN HE21 H -3.831 1.213 4.228 1.00 . A A . 44 GLN HE21 1 1 4 2716 1 1 44 GLN HE22 H -5.136 1.850 3.350 1.00 . A A . 44 GLN HE22 1 1 4 2717 1 1 44 GLN HG2 H -2.336 -0.457 2.897 1.00 . A A . 44 GLN HG2 1 1 4 2718 1 1 44 GLN HG3 H -1.561 1.120 2.735 1.00 . A A . 44 GLN HG3 1 1 4 2719 1 1 44 GLN N N 0.178 -0.608 -0.212 1.00 . A A . 44 GLN N 1 1 4 2720 1 1 44 GLN NE2 N -4.257 1.418 3.369 1.00 . A A . 44 GLN NE2 1 1 4 2721 1 1 44 GLN O O -2.239 -2.747 1.356 1.00 . A A . 44 GLN O 1 1 4 2722 1 1 44 GLN OE1 O -4.182 1.369 1.189 1.00 . A A . 44 GLN OE1 1 1 4 2723 1 1 45 GLN C C 0.098 -5.471 -0.550 1.00 . A A . 45 GLN C 1 1 4 2724 1 1 45 GLN CA C -1.094 -4.544 -0.307 1.00 . A A . 45 GLN CA 1 1 4 2725 1 1 45 GLN CB C -1.971 -4.465 -1.559 1.00 . A A . 45 GLN CB 1 1 4 2726 1 1 45 GLN CD C -1.726 -4.010 -4.007 1.00 . A A . 45 GLN CD 1 1 4 2727 1 1 45 GLN CG C -1.299 -3.571 -2.605 1.00 . A A . 45 GLN CG 1 1 4 2728 1 1 45 GLN H H 0.172 -2.816 -0.548 1.00 . A A . 45 GLN H 1 1 4 2729 1 1 45 GLN HA H -1.677 -4.888 0.532 1.00 . A A . 45 GLN HA 1 1 4 2730 1 1 45 GLN HB2 H -2.105 -5.456 -1.966 1.00 . A A . 45 GLN HB2 1 1 4 2731 1 1 45 GLN HB3 H -2.933 -4.049 -1.298 1.00 . A A . 45 GLN HB3 1 1 4 2732 1 1 45 GLN HE21 H -0.335 -2.931 -4.922 1.00 . A A . 45 GLN HE21 1 1 4 2733 1 1 45 GLN HE22 H -1.353 -3.822 -5.948 1.00 . A A . 45 GLN HE22 1 1 4 2734 1 1 45 GLN HG2 H -1.595 -2.544 -2.443 1.00 . A A . 45 GLN HG2 1 1 4 2735 1 1 45 GLN HG3 H -0.227 -3.655 -2.514 1.00 . A A . 45 GLN HG3 1 1 4 2736 1 1 45 GLN N N -0.618 -3.148 -0.075 1.00 . A A . 45 GLN N 1 1 4 2737 1 1 45 GLN NE2 N -1.084 -3.550 -5.045 1.00 . A A . 45 GLN NE2 1 1 4 2738 1 1 45 GLN O O 0.697 -5.465 -1.608 1.00 . A A . 45 GLN O 1 1 4 2739 1 1 45 GLN OE1 O -2.654 -4.781 -4.159 1.00 . A A . 45 GLN OE1 1 1 4 2740 1 1 46 ILE C C 1.399 -8.463 1.085 1.00 . A A . 46 ILE C 1 1 4 2741 1 1 46 ILE CA C 1.601 -7.198 0.246 1.00 . A A . 46 ILE CA 1 1 4 2742 1 1 46 ILE CB C 2.824 -6.421 0.737 1.00 . A A . 46 ILE CB 1 1 4 2743 1 1 46 ILE CD1 C 4.445 -7.820 -0.550 1.00 . A A . 46 ILE CD1 1 1 4 2744 1 1 46 ILE CG1 C 4.017 -7.374 0.849 1.00 . A A . 46 ILE CG1 1 1 4 2745 1 1 46 ILE CG2 C 2.535 -5.808 2.112 1.00 . A A . 46 ILE CG2 1 1 4 2746 1 1 46 ILE H H -0.050 -6.259 1.264 1.00 . A A . 46 ILE H 1 1 4 2747 1 1 46 ILE HA H 1.722 -7.454 -0.795 1.00 . A A . 46 ILE HA 1 1 4 2748 1 1 46 ILE HB H 3.055 -5.633 0.034 1.00 . A A . 46 ILE HB 1 1 4 2749 1 1 46 ILE HD11 H 5.522 -7.901 -0.588 1.00 . A A . 46 ILE HD11 1 1 4 2750 1 1 46 ILE HD12 H 4.113 -7.095 -1.277 1.00 . A A . 46 ILE HD12 1 1 4 2751 1 1 46 ILE HD13 H 4.005 -8.781 -0.772 1.00 . A A . 46 ILE HD13 1 1 4 2752 1 1 46 ILE HG12 H 4.838 -6.866 1.334 1.00 . A A . 46 ILE HG12 1 1 4 2753 1 1 46 ILE HG13 H 3.735 -8.238 1.430 1.00 . A A . 46 ILE HG13 1 1 4 2754 1 1 46 ILE HG21 H 1.470 -5.687 2.240 1.00 . A A . 46 ILE HG21 1 1 4 2755 1 1 46 ILE HG22 H 3.016 -4.844 2.183 1.00 . A A . 46 ILE HG22 1 1 4 2756 1 1 46 ILE HG23 H 2.919 -6.459 2.883 1.00 . A A . 46 ILE HG23 1 1 4 2757 1 1 46 ILE N N 0.447 -6.270 0.420 1.00 . A A . 46 ILE N 1 1 4 2758 1 1 46 ILE O O 1.577 -9.568 0.612 1.00 . A A . 46 ILE O 1 1 4 2759 1 1 47 CYS C C -0.650 -9.912 3.193 1.00 . A A . 47 CYS C 1 1 4 2760 1 1 47 CYS CA C 0.824 -9.500 3.199 1.00 . A A . 47 CYS CA 1 1 4 2761 1 1 47 CYS CB C 1.247 -9.045 4.597 1.00 . A A . 47 CYS CB 1 1 4 2762 1 1 47 CYS H H 0.898 -7.408 2.690 1.00 . A A . 47 CYS H 1 1 4 2763 1 1 47 CYS HA H 1.447 -10.319 2.875 1.00 . A A . 47 CYS HA 1 1 4 2764 1 1 47 CYS HB2 H 0.677 -8.172 4.878 1.00 . A A . 47 CYS HB2 1 1 4 2765 1 1 47 CYS HB3 H 1.062 -9.839 5.305 1.00 . A A . 47 CYS HB3 1 1 4 2766 1 1 47 CYS N N 1.033 -8.308 2.328 1.00 . A A . 47 CYS N 1 1 4 2767 1 1 47 CYS O O -1.520 -9.146 3.560 1.00 . A A . 47 CYS O 1 1 4 2768 1 1 47 CYS SG S 3.010 -8.638 4.595 1.00 . A A . 47 CYS SG 1 1 4 2769 1 1 48 LEU C C -2.816 -11.944 4.166 1.00 . A A . 48 LEU C 1 1 4 2770 1 1 48 LEU CA C -2.357 -11.574 2.753 1.00 . A A . 48 LEU CA 1 1 4 2771 1 1 48 LEU CB C -2.359 -12.808 1.850 1.00 . A A . 48 LEU CB 1 1 4 2772 1 1 48 LEU CD1 C -0.944 -12.621 -0.199 1.00 . A A . 48 LEU CD1 1 1 4 2773 1 1 48 LEU CD2 C -3.369 -13.175 -0.404 1.00 . A A . 48 LEU CD2 1 1 4 2774 1 1 48 LEU CG C -2.335 -12.370 0.386 1.00 . A A . 48 LEU CG 1 1 4 2775 1 1 48 LEU H H -0.222 -11.719 2.487 1.00 . A A . 48 LEU H 1 1 4 2776 1 1 48 LEU HA H -2.993 -10.809 2.335 1.00 . A A . 48 LEU HA 1 1 4 2777 1 1 48 LEU HB2 H -1.487 -13.408 2.061 1.00 . A A . 48 LEU HB2 1 1 4 2778 1 1 48 LEU HB3 H -3.251 -13.388 2.035 1.00 . A A . 48 LEU HB3 1 1 4 2779 1 1 48 LEU HD11 H -0.820 -13.676 -0.390 1.00 . A A . 48 LEU HD11 1 1 4 2780 1 1 48 LEU HD12 H -0.193 -12.291 0.503 1.00 . A A . 48 LEU HD12 1 1 4 2781 1 1 48 LEU HD13 H -0.839 -12.073 -1.124 1.00 . A A . 48 LEU HD13 1 1 4 2782 1 1 48 LEU HD21 H -3.875 -13.860 0.260 1.00 . A A . 48 LEU HD21 1 1 4 2783 1 1 48 LEU HD22 H -2.872 -13.732 -1.185 1.00 . A A . 48 LEU HD22 1 1 4 2784 1 1 48 LEU HD23 H -4.089 -12.502 -0.844 1.00 . A A . 48 LEU HD23 1 1 4 2785 1 1 48 LEU HG H -2.568 -11.317 0.319 1.00 . A A . 48 LEU HG 1 1 4 2786 1 1 48 LEU N N -0.938 -11.116 2.780 1.00 . A A . 48 LEU N 1 1 4 2787 1 1 48 LEU O O -3.361 -11.081 4.835 1.00 . A A . 48 LEU O 1 1 4 2788 1 1 48 LEU OXT O -2.616 -13.083 4.552 1.00 . A A . 48 LEU OXT 1 1 5 2789 1 1 1 GLY C C 3.924 13.365 14.068 1.00 . A A . 1 GLY C 1 1 5 2790 1 1 1 GLY CA C 5.076 14.207 14.618 1.00 . A A . 1 GLY CA 1 1 5 2791 1 1 1 GLY H1 H 5.940 12.458 15.349 1.00 . A A . 1 GLY H1 1 1 5 2792 1 1 1 GLY H2 H 5.236 13.436 16.546 1.00 . A A . 1 GLY H2 1 1 5 2793 1 1 1 GLY H3 H 6.722 13.876 15.850 1.00 . A A . 1 GLY H3 1 1 5 2794 1 1 1 GLY HA2 H 4.685 15.119 15.046 1.00 . A A . 1 GLY HA2 1 1 5 2795 1 1 1 GLY HA3 H 5.757 14.449 13.817 1.00 . A A . 1 GLY HA3 1 1 5 2796 1 1 1 GLY N N 5.798 13.437 15.670 1.00 . A A . 1 GLY N 1 1 5 2797 1 1 1 GLY O O 4.016 12.157 13.974 1.00 . A A . 1 GLY O 1 1 5 2798 1 1 2 SER C C 1.277 12.121 14.143 1.00 . A A . 2 SER C 1 1 5 2799 1 1 2 SER CA C 1.683 13.223 13.160 1.00 . A A . 2 SER CA 1 1 5 2800 1 1 2 SER CB C 2.188 12.615 11.852 1.00 . A A . 2 SER CB 1 1 5 2801 1 1 2 SER H H 2.784 14.965 13.787 1.00 . A A . 2 SER H 1 1 5 2802 1 1 2 SER HA H 0.851 13.881 12.965 1.00 . A A . 2 SER HA 1 1 5 2803 1 1 2 SER HB2 H 1.884 13.235 11.025 1.00 . A A . 2 SER HB2 1 1 5 2804 1 1 2 SER HB3 H 3.269 12.556 11.878 1.00 . A A . 2 SER HB3 1 1 5 2805 1 1 2 SER HG H 1.156 11.298 10.860 1.00 . A A . 2 SER HG 1 1 5 2806 1 1 2 SER N N 2.840 13.992 13.703 1.00 . A A . 2 SER N 1 1 5 2807 1 1 2 SER O O 1.808 12.020 15.231 1.00 . A A . 2 SER O 1 1 5 2808 1 1 2 SER OG O 1.634 11.316 11.693 1.00 . A A . 2 SER OG 1 1 5 2809 1 1 3 ALA C C 0.794 8.969 14.501 1.00 . A A . 3 ALA C 1 1 5 2810 1 1 3 ALA CA C -0.098 10.200 14.685 1.00 . A A . 3 ALA CA 1 1 5 2811 1 1 3 ALA CB C -1.537 9.889 14.271 1.00 . A A . 3 ALA CB 1 1 5 2812 1 1 3 ALA H H -0.079 11.391 12.888 1.00 . A A . 3 ALA H 1 1 5 2813 1 1 3 ALA HA H -0.074 10.535 15.710 1.00 . A A . 3 ALA HA 1 1 5 2814 1 1 3 ALA HB1 H -1.832 8.936 14.683 1.00 . A A . 3 ALA HB1 1 1 5 2815 1 1 3 ALA HB2 H -1.601 9.851 13.192 1.00 . A A . 3 ALA HB2 1 1 5 2816 1 1 3 ALA HB3 H -2.194 10.661 14.643 1.00 . A A . 3 ALA HB3 1 1 5 2817 1 1 3 ALA N N 0.339 11.294 13.769 1.00 . A A . 3 ALA N 1 1 5 2818 1 1 3 ALA O O 1.486 8.833 13.511 1.00 . A A . 3 ALA O 1 1 5 2819 1 1 4 MET C C 0.757 5.592 15.432 1.00 . A A . 4 MET C 1 1 5 2820 1 1 4 MET CA C 1.628 6.846 15.328 1.00 . A A . 4 MET CA 1 1 5 2821 1 1 4 MET CB C 2.603 6.921 16.505 1.00 . A A . 4 MET CB 1 1 5 2822 1 1 4 MET CE C 6.494 8.207 16.589 1.00 . A A . 4 MET CE 1 1 5 2823 1 1 4 MET CG C 3.896 7.610 16.061 1.00 . A A . 4 MET CG 1 1 5 2824 1 1 4 MET H H 0.217 8.198 16.237 1.00 . A A . 4 MET H 1 1 5 2825 1 1 4 MET HA H 2.173 6.854 14.397 1.00 . A A . 4 MET HA 1 1 5 2826 1 1 4 MET HB2 H 2.152 7.484 17.308 1.00 . A A . 4 MET HB2 1 1 5 2827 1 1 4 MET HB3 H 2.829 5.923 16.848 1.00 . A A . 4 MET HB3 1 1 5 2828 1 1 4 MET HE1 H 7.316 7.686 17.058 1.00 . A A . 4 MET HE1 1 1 5 2829 1 1 4 MET HE2 H 6.690 9.267 16.602 1.00 . A A . 4 MET HE2 1 1 5 2830 1 1 4 MET HE3 H 6.385 7.876 15.566 1.00 . A A . 4 MET HE3 1 1 5 2831 1 1 4 MET HG2 H 4.405 6.990 15.338 1.00 . A A . 4 MET HG2 1 1 5 2832 1 1 4 MET HG3 H 3.661 8.565 15.615 1.00 . A A . 4 MET HG3 1 1 5 2833 1 1 4 MET N N 0.782 8.069 15.448 1.00 . A A . 4 MET N 1 1 5 2834 1 1 4 MET O O 0.634 4.995 16.484 1.00 . A A . 4 MET O 1 1 5 2835 1 1 4 MET SD S 4.967 7.862 17.498 1.00 . A A . 4 MET SD 1 1 5 2836 1 1 5 GLY C C -0.122 2.886 13.494 1.00 . A A . 5 GLY C 1 1 5 2837 1 1 5 GLY CA C -0.717 3.973 14.391 1.00 . A A . 5 GLY CA 1 1 5 2838 1 1 5 GLY H H 0.258 5.684 13.513 1.00 . A A . 5 GLY H 1 1 5 2839 1 1 5 GLY HA2 H -0.778 3.610 15.406 1.00 . A A . 5 GLY HA2 1 1 5 2840 1 1 5 GLY HA3 H -1.706 4.224 14.038 1.00 . A A . 5 GLY HA3 1 1 5 2841 1 1 5 GLY N N 0.148 5.188 14.350 1.00 . A A . 5 GLY N 1 1 5 2842 1 1 5 GLY O O 0.371 1.881 13.965 1.00 . A A . 5 GLY O 1 1 5 2843 1 1 6 CYS C C 1.919 1.979 11.429 1.00 . A A . 6 CYS C 1 1 5 2844 1 1 6 CYS CA C 0.395 2.054 11.276 1.00 . A A . 6 CYS CA 1 1 5 2845 1 1 6 CYS CB C 0.008 2.537 9.875 1.00 . A A . 6 CYS CB 1 1 5 2846 1 1 6 CYS H H -0.570 3.896 11.844 1.00 . A A . 6 CYS H 1 1 5 2847 1 1 6 CYS HA H -0.049 1.090 11.468 1.00 . A A . 6 CYS HA 1 1 5 2848 1 1 6 CYS HB2 H -1.039 2.337 9.705 1.00 . A A . 6 CYS HB2 1 1 5 2849 1 1 6 CYS HB3 H 0.185 3.599 9.799 1.00 . A A . 6 CYS HB3 1 1 5 2850 1 1 6 CYS N N -0.166 3.079 12.204 1.00 . A A . 6 CYS N 1 1 5 2851 1 1 6 CYS O O 2.499 0.912 11.422 1.00 . A A . 6 CYS O 1 1 5 2852 1 1 6 CYS SG S 0.989 1.667 8.626 1.00 . A A . 6 CYS SG 1 1 5 2853 1 1 7 ARG C C 4.451 2.400 13.029 1.00 . A A . 7 ARG C 1 1 5 2854 1 1 7 ARG CA C 4.055 3.087 11.717 1.00 . A A . 7 ARG CA 1 1 5 2855 1 1 7 ARG CB C 4.467 4.558 11.737 1.00 . A A . 7 ARG CB 1 1 5 2856 1 1 7 ARG CD C 6.141 5.416 10.088 1.00 . A A . 7 ARG CD 1 1 5 2857 1 1 7 ARG CG C 5.958 4.672 11.413 1.00 . A A . 7 ARG CG 1 1 5 2858 1 1 7 ARG CZ C 4.790 7.308 10.761 1.00 . A A . 7 ARG CZ 1 1 5 2859 1 1 7 ARG H H 2.085 3.953 11.571 1.00 . A A . 7 ARG H 1 1 5 2860 1 1 7 ARG HA H 4.514 2.588 10.879 1.00 . A A . 7 ARG HA 1 1 5 2861 1 1 7 ARG HB2 H 3.894 5.103 11.002 1.00 . A A . 7 ARG HB2 1 1 5 2862 1 1 7 ARG HB3 H 4.282 4.972 12.718 1.00 . A A . 7 ARG HB3 1 1 5 2863 1 1 7 ARG HD2 H 7.131 5.238 9.692 1.00 . A A . 7 ARG HD2 1 1 5 2864 1 1 7 ARG HD3 H 5.388 5.110 9.379 1.00 . A A . 7 ARG HD3 1 1 5 2865 1 1 7 ARG HE H 6.736 7.461 10.403 1.00 . A A . 7 ARG HE 1 1 5 2866 1 1 7 ARG HG2 H 6.457 5.215 12.203 1.00 . A A . 7 ARG HG2 1 1 5 2867 1 1 7 ARG HG3 H 6.385 3.684 11.330 1.00 . A A . 7 ARG HG3 1 1 5 2868 1 1 7 ARG HH11 H 3.902 6.670 9.084 1.00 . A A . 7 ARG HH11 1 1 5 2869 1 1 7 ARG HH12 H 2.873 7.490 10.211 1.00 . A A . 7 ARG HH12 1 1 5 2870 1 1 7 ARG HH21 H 5.404 8.050 12.516 1.00 . A A . 7 ARG HH21 1 1 5 2871 1 1 7 ARG HH22 H 3.724 8.272 12.156 1.00 . A A . 7 ARG HH22 1 1 5 2872 1 1 7 ARG N N 2.570 3.101 11.567 1.00 . A A . 7 ARG N 1 1 5 2873 1 1 7 ARG NE N 5.966 6.855 10.429 1.00 . A A . 7 ARG NE 1 1 5 2874 1 1 7 ARG NH1 N 3.776 7.143 9.956 1.00 . A A . 7 ARG NH1 1 1 5 2875 1 1 7 ARG NH2 N 4.627 7.926 11.900 1.00 . A A . 7 ARG NH2 1 1 5 2876 1 1 7 ARG O O 5.501 1.797 13.131 1.00 . A A . 7 ARG O 1 1 5 2877 1 1 8 HIS C C 3.769 0.321 15.224 1.00 . A A . 8 HIS C 1 1 5 2878 1 1 8 HIS CA C 3.955 1.842 15.333 1.00 . A A . 8 HIS CA 1 1 5 2879 1 1 8 HIS CB C 2.981 2.483 16.347 1.00 . A A . 8 HIS CB 1 1 5 2880 1 1 8 HIS CD2 C 0.731 1.320 17.066 1.00 . A A . 8 HIS CD2 1 1 5 2881 1 1 8 HIS CE1 C 1.573 -0.366 18.134 1.00 . A A . 8 HIS CE1 1 1 5 2882 1 1 8 HIS CG C 2.096 1.446 16.995 1.00 . A A . 8 HIS CG 1 1 5 2883 1 1 8 HIS H H 2.780 2.981 13.930 1.00 . A A . 8 HIS H 1 1 5 2884 1 1 8 HIS HA H 4.972 2.071 15.611 1.00 . A A . 8 HIS HA 1 1 5 2885 1 1 8 HIS HB2 H 3.551 2.986 17.113 1.00 . A A . 8 HIS HB2 1 1 5 2886 1 1 8 HIS HB3 H 2.365 3.206 15.834 1.00 . A A . 8 HIS HB3 1 1 5 2887 1 1 8 HIS HD1 H 3.562 0.155 17.817 1.00 . A A . 8 HIS HD1 1 1 5 2888 1 1 8 HIS HD2 H 0.020 2.005 16.629 1.00 . A A . 8 HIS HD2 1 1 5 2889 1 1 8 HIS HE1 H 1.673 -1.276 18.708 1.00 . A A . 8 HIS HE1 1 1 5 2890 1 1 8 HIS N N 3.621 2.490 14.032 1.00 . A A . 8 HIS N 1 1 5 2891 1 1 8 HIS ND1 N 2.613 0.359 17.683 1.00 . A A . 8 HIS ND1 1 1 5 2892 1 1 8 HIS NE2 N 0.403 0.175 17.785 1.00 . A A . 8 HIS NE2 1 1 5 2893 1 1 8 HIS O O 4.346 -0.440 15.975 1.00 . A A . 8 HIS O 1 1 5 2894 1 1 9 PHE C C 4.085 -2.308 13.961 1.00 . A A . 9 PHE C 1 1 5 2895 1 1 9 PHE CA C 2.746 -1.588 14.138 1.00 . A A . 9 PHE CA 1 1 5 2896 1 1 9 PHE CB C 1.892 -1.728 12.876 1.00 . A A . 9 PHE CB 1 1 5 2897 1 1 9 PHE CD1 C 0.124 -0.725 14.391 1.00 . A A . 9 PHE CD1 1 1 5 2898 1 1 9 PHE CD2 C -0.441 -1.207 12.084 1.00 . A A . 9 PHE CD2 1 1 5 2899 1 1 9 PHE CE1 C -1.174 -0.246 14.609 1.00 . A A . 9 PHE CE1 1 1 5 2900 1 1 9 PHE CE2 C -1.739 -0.727 12.301 1.00 . A A . 9 PHE CE2 1 1 5 2901 1 1 9 PHE CG C 0.492 -1.206 13.127 1.00 . A A . 9 PHE CG 1 1 5 2902 1 1 9 PHE CZ C -2.105 -0.247 13.563 1.00 . A A . 9 PHE CZ 1 1 5 2903 1 1 9 PHE H H 2.512 0.506 13.699 1.00 . A A . 9 PHE H 1 1 5 2904 1 1 9 PHE HA H 2.215 -1.982 14.988 1.00 . A A . 9 PHE HA 1 1 5 2905 1 1 9 PHE HB2 H 2.345 -1.164 12.073 1.00 . A A . 9 PHE HB2 1 1 5 2906 1 1 9 PHE HB3 H 1.838 -2.769 12.594 1.00 . A A . 9 PHE HB3 1 1 5 2907 1 1 9 PHE HD1 H 0.843 -0.723 15.199 1.00 . A A . 9 PHE HD1 1 1 5 2908 1 1 9 PHE HD2 H -0.159 -1.577 11.112 1.00 . A A . 9 PHE HD2 1 1 5 2909 1 1 9 PHE HE1 H -1.458 0.124 15.581 1.00 . A A . 9 PHE HE1 1 1 5 2910 1 1 9 PHE HE2 H -2.457 -0.729 11.493 1.00 . A A . 9 PHE HE2 1 1 5 2911 1 1 9 PHE HZ H -3.106 0.122 13.730 1.00 . A A . 9 PHE HZ 1 1 5 2912 1 1 9 PHE N N 2.968 -0.124 14.294 1.00 . A A . 9 PHE N 1 1 5 2913 1 1 9 PHE O O 5.081 -1.712 13.603 1.00 . A A . 9 PHE O 1 1 5 2914 1 1 10 GLN C C 5.477 -4.952 12.652 1.00 . A A . 10 GLN C 1 1 5 2915 1 1 10 GLN CA C 5.386 -4.351 14.057 1.00 . A A . 10 GLN CA 1 1 5 2916 1 1 10 GLN CB C 5.316 -5.460 15.109 1.00 . A A . 10 GLN CB 1 1 5 2917 1 1 10 GLN CD C 4.610 -5.240 17.495 1.00 . A A . 10 GLN CD 1 1 5 2918 1 1 10 GLN CG C 5.698 -4.892 16.477 1.00 . A A . 10 GLN CG 1 1 5 2919 1 1 10 GLN H H 3.298 -4.047 14.498 1.00 . A A . 10 GLN H 1 1 5 2920 1 1 10 GLN HA H 6.234 -3.714 14.250 1.00 . A A . 10 GLN HA 1 1 5 2921 1 1 10 GLN HB2 H 4.310 -5.854 15.148 1.00 . A A . 10 GLN HB2 1 1 5 2922 1 1 10 GLN HB3 H 6.002 -6.250 14.845 1.00 . A A . 10 GLN HB3 1 1 5 2923 1 1 10 GLN HE21 H 5.734 -6.568 18.454 1.00 . A A . 10 GLN HE21 1 1 5 2924 1 1 10 GLN HE22 H 4.168 -6.358 19.076 1.00 . A A . 10 GLN HE22 1 1 5 2925 1 1 10 GLN HG2 H 6.638 -5.320 16.793 1.00 . A A . 10 GLN HG2 1 1 5 2926 1 1 10 GLN HG3 H 5.795 -3.820 16.408 1.00 . A A . 10 GLN HG3 1 1 5 2927 1 1 10 GLN N N 4.114 -3.588 14.210 1.00 . A A . 10 GLN N 1 1 5 2928 1 1 10 GLN NE2 N 4.858 -6.130 18.418 1.00 . A A . 10 GLN NE2 1 1 5 2929 1 1 10 GLN O O 6.282 -4.541 11.841 1.00 . A A . 10 GLN O 1 1 5 2930 1 1 10 GLN OE1 O 3.525 -4.697 17.451 1.00 . A A . 10 GLN OE1 1 1 5 2931 1 1 11 SER C C 3.707 -5.859 10.066 1.00 . A A . 11 SER C 1 1 5 2932 1 1 11 SER CA C 4.697 -6.553 11.005 1.00 . A A . 11 SER CA 1 1 5 2933 1 1 11 SER CB C 4.291 -8.008 11.232 1.00 . A A . 11 SER CB 1 1 5 2934 1 1 11 SER H H 4.015 -6.244 13.026 1.00 . A A . 11 SER H 1 1 5 2935 1 1 11 SER HA H 5.697 -6.509 10.599 1.00 . A A . 11 SER HA 1 1 5 2936 1 1 11 SER HB2 H 3.805 -8.104 12.189 1.00 . A A . 11 SER HB2 1 1 5 2937 1 1 11 SER HB3 H 3.607 -8.317 10.451 1.00 . A A . 11 SER HB3 1 1 5 2938 1 1 11 SER HG H 5.497 -9.297 12.051 1.00 . A A . 11 SER HG 1 1 5 2939 1 1 11 SER N N 4.657 -5.926 12.358 1.00 . A A . 11 SER N 1 1 5 2940 1 1 11 SER O O 3.128 -4.844 10.399 1.00 . A A . 11 SER O 1 1 5 2941 1 1 11 SER OG O 5.452 -8.829 11.214 1.00 . A A . 11 SER OG 1 1 5 2942 1 1 12 CYS C C 1.129 -6.244 8.210 1.00 . A A . 12 CYS C 1 1 5 2943 1 1 12 CYS CA C 2.558 -5.770 7.930 1.00 . A A . 12 CYS CA 1 1 5 2944 1 1 12 CYS CB C 3.016 -6.246 6.550 1.00 . A A . 12 CYS CB 1 1 5 2945 1 1 12 CYS H H 3.988 -7.216 8.643 1.00 . A A . 12 CYS H 1 1 5 2946 1 1 12 CYS HA H 2.617 -4.695 7.988 1.00 . A A . 12 CYS HA 1 1 5 2947 1 1 12 CYS HB2 H 2.456 -5.726 5.786 1.00 . A A . 12 CYS HB2 1 1 5 2948 1 1 12 CYS HB3 H 4.069 -6.036 6.429 1.00 . A A . 12 CYS HB3 1 1 5 2949 1 1 12 CYS N N 3.510 -6.399 8.892 1.00 . A A . 12 CYS N 1 1 5 2950 1 1 12 CYS O O 0.186 -5.808 7.580 1.00 . A A . 12 CYS O 1 1 5 2951 1 1 12 CYS SG S 2.733 -8.028 6.400 1.00 . A A . 12 CYS SG 1 1 5 2952 1 1 13 SER C C -1.318 -6.479 9.877 1.00 . A A . 13 SER C 1 1 5 2953 1 1 13 SER CA C -0.407 -7.637 9.464 1.00 . A A . 13 SER CA 1 1 5 2954 1 1 13 SER CB C -0.211 -8.605 10.628 1.00 . A A . 13 SER CB 1 1 5 2955 1 1 13 SER H H 1.735 -7.476 9.645 1.00 . A A . 13 SER H 1 1 5 2956 1 1 13 SER HA H -0.821 -8.160 8.617 1.00 . A A . 13 SER HA 1 1 5 2957 1 1 13 SER HB2 H 0.829 -8.629 10.907 1.00 . A A . 13 SER HB2 1 1 5 2958 1 1 13 SER HB3 H -0.802 -8.276 11.473 1.00 . A A . 13 SER HB3 1 1 5 2959 1 1 13 SER HG H 0.152 -10.478 10.249 1.00 . A A . 13 SER HG 1 1 5 2960 1 1 13 SER N N 0.961 -7.135 9.149 1.00 . A A . 13 SER N 1 1 5 2961 1 1 13 SER O O -2.323 -6.213 9.246 1.00 . A A . 13 SER O 1 1 5 2962 1 1 13 SER OG O -0.619 -9.907 10.227 1.00 . A A . 13 SER OG 1 1 5 2963 1 1 14 GLN C C -1.729 -3.491 10.367 1.00 . A A . 14 GLN C 1 1 5 2964 1 1 14 GLN CA C -1.827 -4.640 11.372 1.00 . A A . 14 GLN CA 1 1 5 2965 1 1 14 GLN CB C -1.254 -4.217 12.725 1.00 . A A . 14 GLN CB 1 1 5 2966 1 1 14 GLN CD C -3.149 -4.073 14.350 1.00 . A A . 14 GLN CD 1 1 5 2967 1 1 14 GLN CG C -2.238 -3.272 13.419 1.00 . A A . 14 GLN CG 1 1 5 2968 1 1 14 GLN H H -0.161 -6.010 11.421 1.00 . A A . 14 GLN H 1 1 5 2969 1 1 14 GLN HA H -2.851 -4.955 11.488 1.00 . A A . 14 GLN HA 1 1 5 2970 1 1 14 GLN HB2 H -1.098 -5.092 13.340 1.00 . A A . 14 GLN HB2 1 1 5 2971 1 1 14 GLN HB3 H -0.314 -3.708 12.575 1.00 . A A . 14 GLN HB3 1 1 5 2972 1 1 14 GLN HE21 H -4.818 -3.514 13.430 1.00 . A A . 14 GLN HE21 1 1 5 2973 1 1 14 GLN HE22 H -5.033 -4.556 14.753 1.00 . A A . 14 GLN HE22 1 1 5 2974 1 1 14 GLN HG2 H -1.689 -2.539 13.993 1.00 . A A . 14 GLN HG2 1 1 5 2975 1 1 14 GLN HG3 H -2.839 -2.770 12.675 1.00 . A A . 14 GLN HG3 1 1 5 2976 1 1 14 GLN N N -0.976 -5.782 10.927 1.00 . A A . 14 GLN N 1 1 5 2977 1 1 14 GLN NE2 N -4.440 -4.045 14.162 1.00 . A A . 14 GLN NE2 1 1 5 2978 1 1 14 GLN O O -2.690 -2.795 10.105 1.00 . A A . 14 GLN O 1 1 5 2979 1 1 14 GLN OE1 O -2.681 -4.730 15.259 1.00 . A A . 14 GLN OE1 1 1 5 2980 1 1 15 CYS C C -1.512 -2.228 7.766 1.00 . A A . 15 CYS C 1 1 5 2981 1 1 15 CYS CA C -0.401 -2.184 8.816 1.00 . A A . 15 CYS CA 1 1 5 2982 1 1 15 CYS CB C 0.956 -2.446 8.165 1.00 . A A . 15 CYS CB 1 1 5 2983 1 1 15 CYS H H 0.191 -3.861 10.030 1.00 . A A . 15 CYS H 1 1 5 2984 1 1 15 CYS HA H -0.391 -1.227 9.313 1.00 . A A . 15 CYS HA 1 1 5 2985 1 1 15 CYS HB2 H 1.152 -3.508 8.157 1.00 . A A . 15 CYS HB2 1 1 5 2986 1 1 15 CYS HB3 H 0.947 -2.074 7.151 1.00 . A A . 15 CYS HB3 1 1 5 2987 1 1 15 CYS N N -0.570 -3.288 9.803 1.00 . A A . 15 CYS N 1 1 5 2988 1 1 15 CYS O O -2.123 -1.226 7.452 1.00 . A A . 15 CYS O 1 1 5 2989 1 1 15 CYS SG S 2.251 -1.601 9.106 1.00 . A A . 15 CYS SG 1 1 5 2990 1 1 16 LEU C C -4.127 -4.051 6.777 1.00 . A A . 16 LEU C 1 1 5 2991 1 1 16 LEU CA C -2.836 -3.483 6.177 1.00 . A A . 16 LEU CA 1 1 5 2992 1 1 16 LEU CB C -2.263 -4.428 5.120 1.00 . A A . 16 LEU CB 1 1 5 2993 1 1 16 LEU CD1 C -0.142 -3.103 5.082 1.00 . A A . 16 LEU CD1 1 1 5 2994 1 1 16 LEU CD2 C -0.706 -4.595 3.168 1.00 . A A . 16 LEU CD2 1 1 5 2995 1 1 16 LEU CG C -1.282 -3.657 4.230 1.00 . A A . 16 LEU CG 1 1 5 2996 1 1 16 LEU H H -1.263 -4.176 7.476 1.00 . A A . 16 LEU H 1 1 5 2997 1 1 16 LEU HA H -3.023 -2.515 5.737 1.00 . A A . 16 LEU HA 1 1 5 2998 1 1 16 LEU HB2 H -1.746 -5.242 5.608 1.00 . A A . 16 LEU HB2 1 1 5 2999 1 1 16 LEU HB3 H -3.065 -4.820 4.512 1.00 . A A . 16 LEU HB3 1 1 5 3000 1 1 16 LEU HD11 H -0.008 -3.726 5.954 1.00 . A A . 16 LEU HD11 1 1 5 3001 1 1 16 LEU HD12 H -0.379 -2.096 5.391 1.00 . A A . 16 LEU HD12 1 1 5 3002 1 1 16 LEU HD13 H 0.770 -3.096 4.502 1.00 . A A . 16 LEU HD13 1 1 5 3003 1 1 16 LEU HD21 H -1.502 -4.961 2.540 1.00 . A A . 16 LEU HD21 1 1 5 3004 1 1 16 LEU HD22 H -0.214 -5.426 3.651 1.00 . A A . 16 LEU HD22 1 1 5 3005 1 1 16 LEU HD23 H 0.010 -4.054 2.565 1.00 . A A . 16 LEU HD23 1 1 5 3006 1 1 16 LEU HG H -1.801 -2.840 3.748 1.00 . A A . 16 LEU HG 1 1 5 3007 1 1 16 LEU N N -1.772 -3.381 7.214 1.00 . A A . 16 LEU N 1 1 5 3008 1 1 16 LEU O O -5.124 -4.196 6.098 1.00 . A A . 16 LEU O 1 1 5 3009 1 1 17 SER C C -6.112 -3.789 9.404 1.00 . A A . 17 SER C 1 1 5 3010 1 1 17 SER CA C -5.362 -4.908 8.676 1.00 . A A . 17 SER CA 1 1 5 3011 1 1 17 SER CB C -4.881 -5.965 9.668 1.00 . A A . 17 SER CB 1 1 5 3012 1 1 17 SER H H -3.314 -4.233 8.583 1.00 . A A . 17 SER H 1 1 5 3013 1 1 17 SER HA H -5.995 -5.363 7.930 1.00 . A A . 17 SER HA 1 1 5 3014 1 1 17 SER HB2 H -4.058 -5.575 10.240 1.00 . A A . 17 SER HB2 1 1 5 3015 1 1 17 SER HB3 H -5.690 -6.224 10.336 1.00 . A A . 17 SER HB3 1 1 5 3016 1 1 17 SER HG H -4.982 -7.188 8.159 1.00 . A A . 17 SER HG 1 1 5 3017 1 1 17 SER N N -4.125 -4.363 8.046 1.00 . A A . 17 SER N 1 1 5 3018 1 1 17 SER O O -7.241 -3.954 9.822 1.00 . A A . 17 SER O 1 1 5 3019 1 1 17 SER OG O -4.450 -7.117 8.955 1.00 . A A . 17 SER OG 1 1 5 3020 1 1 18 ALA C C -5.770 -0.191 9.587 1.00 . A A . 18 ALA C 1 1 5 3021 1 1 18 ALA CA C -6.166 -1.514 10.251 1.00 . A A . 18 ALA CA 1 1 5 3022 1 1 18 ALA CB C -5.652 -1.569 11.690 1.00 . A A . 18 ALA CB 1 1 5 3023 1 1 18 ALA H H -4.583 -2.537 9.208 1.00 . A A . 18 ALA H 1 1 5 3024 1 1 18 ALA HA H -7.237 -1.641 10.233 1.00 . A A . 18 ALA HA 1 1 5 3025 1 1 18 ALA HB1 H -5.029 -0.708 11.882 1.00 . A A . 18 ALA HB1 1 1 5 3026 1 1 18 ALA HB2 H -5.075 -2.470 11.831 1.00 . A A . 18 ALA HB2 1 1 5 3027 1 1 18 ALA HB3 H -6.490 -1.566 12.371 1.00 . A A . 18 ALA HB3 1 1 5 3028 1 1 18 ALA N N -5.493 -2.648 9.555 1.00 . A A . 18 ALA N 1 1 5 3029 1 1 18 ALA O O -5.245 0.696 10.229 1.00 . A A . 18 ALA O 1 1 5 3030 1 1 19 PRO C C -6.653 2.283 7.807 1.00 . A A . 19 PRO C 1 1 5 3031 1 1 19 PRO CA C -5.700 1.098 7.530 1.00 . A A . 19 PRO CA 1 1 5 3032 1 1 19 PRO CB C -5.808 0.635 6.080 1.00 . A A . 19 PRO CB 1 1 5 3033 1 1 19 PRO CD C -6.660 -1.154 7.479 1.00 . A A . 19 PRO CD 1 1 5 3034 1 1 19 PRO CG C -6.735 -0.539 6.101 1.00 . A A . 19 PRO CG 1 1 5 3035 1 1 19 PRO HA H -4.683 1.394 7.730 1.00 . A A . 19 PRO HA 1 1 5 3036 1 1 19 PRO HB2 H -6.217 1.426 5.467 1.00 . A A . 19 PRO HB2 1 1 5 3037 1 1 19 PRO HB3 H -4.841 0.334 5.710 1.00 . A A . 19 PRO HB3 1 1 5 3038 1 1 19 PRO HD2 H -7.651 -1.387 7.842 1.00 . A A . 19 PRO HD2 1 1 5 3039 1 1 19 PRO HD3 H -6.043 -2.038 7.465 1.00 . A A . 19 PRO HD3 1 1 5 3040 1 1 19 PRO HG2 H -7.744 -0.215 5.890 1.00 . A A . 19 PRO HG2 1 1 5 3041 1 1 19 PRO HG3 H -6.422 -1.264 5.366 1.00 . A A . 19 PRO HG3 1 1 5 3042 1 1 19 PRO N N -6.034 -0.116 8.310 1.00 . A A . 19 PRO N 1 1 5 3043 1 1 19 PRO O O -6.241 3.419 7.673 1.00 . A A . 19 PRO O 1 1 5 3044 1 1 20 PRO C C -8.492 3.832 9.750 1.00 . A A . 20 PRO C 1 1 5 3045 1 1 20 PRO CA C -8.834 3.137 8.428 1.00 . A A . 20 PRO CA 1 1 5 3046 1 1 20 PRO CB C -10.198 2.462 8.499 1.00 . A A . 20 PRO CB 1 1 5 3047 1 1 20 PRO CD C -8.534 0.712 8.381 1.00 . A A . 20 PRO CD 1 1 5 3048 1 1 20 PRO CG C -9.914 1.048 8.887 1.00 . A A . 20 PRO CG 1 1 5 3049 1 1 20 PRO HA H -8.814 3.843 7.613 1.00 . A A . 20 PRO HA 1 1 5 3050 1 1 20 PRO HB2 H -10.816 2.941 9.245 1.00 . A A . 20 PRO HB2 1 1 5 3051 1 1 20 PRO HB3 H -10.683 2.490 7.535 1.00 . A A . 20 PRO HB3 1 1 5 3052 1 1 20 PRO HD2 H -8.004 0.137 9.124 1.00 . A A . 20 PRO HD2 1 1 5 3053 1 1 20 PRO HD3 H -8.594 0.171 7.452 1.00 . A A . 20 PRO HD3 1 1 5 3054 1 1 20 PRO HG2 H -9.950 0.948 9.962 1.00 . A A . 20 PRO HG2 1 1 5 3055 1 1 20 PRO HG3 H -10.638 0.388 8.431 1.00 . A A . 20 PRO HG3 1 1 5 3056 1 1 20 PRO N N -7.893 2.019 8.171 1.00 . A A . 20 PRO N 1 1 5 3057 1 1 20 PRO O O -8.847 4.973 9.971 1.00 . A A . 20 PRO O 1 1 5 3058 1 1 21 PHE C C -5.989 4.293 11.866 1.00 . A A . 21 PHE C 1 1 5 3059 1 1 21 PHE CA C -7.429 3.781 11.926 1.00 . A A . 21 PHE CA 1 1 5 3060 1 1 21 PHE CB C -7.556 2.658 12.957 1.00 . A A . 21 PHE CB 1 1 5 3061 1 1 21 PHE CD1 C -10.022 2.626 12.445 1.00 . A A . 21 PHE CD1 1 1 5 3062 1 1 21 PHE CD2 C -8.882 0.520 12.821 1.00 . A A . 21 PHE CD2 1 1 5 3063 1 1 21 PHE CE1 C -11.224 1.938 12.239 1.00 . A A . 21 PHE CE1 1 1 5 3064 1 1 21 PHE CE2 C -10.084 -0.168 12.615 1.00 . A A . 21 PHE CE2 1 1 5 3065 1 1 21 PHE CG C -8.852 1.917 12.736 1.00 . A A . 21 PHE CG 1 1 5 3066 1 1 21 PHE CZ C -11.255 0.541 12.325 1.00 . A A . 21 PHE CZ 1 1 5 3067 1 1 21 PHE H H -7.520 2.240 10.423 1.00 . A A . 21 PHE H 1 1 5 3068 1 1 21 PHE HA H -8.107 4.585 12.167 1.00 . A A . 21 PHE HA 1 1 5 3069 1 1 21 PHE HB2 H -6.727 1.976 12.848 1.00 . A A . 21 PHE HB2 1 1 5 3070 1 1 21 PHE HB3 H -7.547 3.081 13.951 1.00 . A A . 21 PHE HB3 1 1 5 3071 1 1 21 PHE HD1 H -9.999 3.705 12.379 1.00 . A A . 21 PHE HD1 1 1 5 3072 1 1 21 PHE HD2 H -7.978 -0.028 13.046 1.00 . A A . 21 PHE HD2 1 1 5 3073 1 1 21 PHE HE1 H -12.129 2.486 12.015 1.00 . A A . 21 PHE HE1 1 1 5 3074 1 1 21 PHE HE2 H -10.107 -1.245 12.680 1.00 . A A . 21 PHE HE2 1 1 5 3075 1 1 21 PHE HZ H -12.182 0.011 12.166 1.00 . A A . 21 PHE HZ 1 1 5 3076 1 1 21 PHE N N -7.800 3.156 10.624 1.00 . A A . 21 PHE N 1 1 5 3077 1 1 21 PHE O O -5.492 4.892 12.799 1.00 . A A . 21 PHE O 1 1 5 3078 1 1 22 VAL C C -3.700 5.249 9.324 1.00 . A A . 22 VAL C 1 1 5 3079 1 1 22 VAL CA C -3.906 4.523 10.657 1.00 . A A . 22 VAL CA 1 1 5 3080 1 1 22 VAL CB C -3.070 3.248 10.717 1.00 . A A . 22 VAL CB 1 1 5 3081 1 1 22 VAL CG1 C -3.430 2.466 11.981 1.00 . A A . 22 VAL CG1 1 1 5 3082 1 1 22 VAL CG2 C -3.363 2.388 9.487 1.00 . A A . 22 VAL CG2 1 1 5 3083 1 1 22 VAL H H -5.732 3.569 10.035 1.00 . A A . 22 VAL H 1 1 5 3084 1 1 22 VAL HA H -3.653 5.171 11.482 1.00 . A A . 22 VAL HA 1 1 5 3085 1 1 22 VAL HB H -2.022 3.508 10.739 1.00 . A A . 22 VAL HB 1 1 5 3086 1 1 22 VAL HG11 H -3.119 3.024 12.852 1.00 . A A . 22 VAL HG11 1 1 5 3087 1 1 22 VAL HG12 H -2.928 1.510 11.969 1.00 . A A . 22 VAL HG12 1 1 5 3088 1 1 22 VAL HG13 H -4.498 2.310 12.016 1.00 . A A . 22 VAL HG13 1 1 5 3089 1 1 22 VAL HG21 H -2.697 2.668 8.684 1.00 . A A . 22 VAL HG21 1 1 5 3090 1 1 22 VAL HG22 H -4.387 2.542 9.176 1.00 . A A . 22 VAL HG22 1 1 5 3091 1 1 22 VAL HG23 H -3.215 1.347 9.731 1.00 . A A . 22 VAL HG23 1 1 5 3092 1 1 22 VAL N N -5.315 4.056 10.776 1.00 . A A . 22 VAL N 1 1 5 3093 1 1 22 VAL O O -4.615 5.394 8.537 1.00 . A A . 22 VAL O 1 1 5 3094 1 1 23 GLN C C -0.977 5.923 7.107 1.00 . A A . 23 GLN C 1 1 5 3095 1 1 23 GLN CA C -2.252 6.447 7.791 1.00 . A A . 23 GLN CA 1 1 5 3096 1 1 23 GLN CB C -2.094 7.915 8.220 1.00 . A A . 23 GLN CB 1 1 5 3097 1 1 23 GLN CD C 0.241 8.758 7.909 1.00 . A A . 23 GLN CD 1 1 5 3098 1 1 23 GLN CG C -1.146 8.659 7.270 1.00 . A A . 23 GLN CG 1 1 5 3099 1 1 23 GLN H H -1.787 5.600 9.721 1.00 . A A . 23 GLN H 1 1 5 3100 1 1 23 GLN HA H -3.098 6.349 7.130 1.00 . A A . 23 GLN HA 1 1 5 3101 1 1 23 GLN HB2 H -3.061 8.395 8.205 1.00 . A A . 23 GLN HB2 1 1 5 3102 1 1 23 GLN HB3 H -1.693 7.952 9.221 1.00 . A A . 23 GLN HB3 1 1 5 3103 1 1 23 GLN HE21 H 1.047 7.382 6.725 1.00 . A A . 23 GLN HE21 1 1 5 3104 1 1 23 GLN HE22 H 2.101 8.063 7.868 1.00 . A A . 23 GLN HE22 1 1 5 3105 1 1 23 GLN HG2 H -1.076 8.121 6.335 1.00 . A A . 23 GLN HG2 1 1 5 3106 1 1 23 GLN HG3 H -1.527 9.652 7.085 1.00 . A A . 23 GLN HG3 1 1 5 3107 1 1 23 GLN N N -2.509 5.718 9.070 1.00 . A A . 23 GLN N 1 1 5 3108 1 1 23 GLN NE2 N 1.210 8.005 7.464 1.00 . A A . 23 GLN NE2 1 1 5 3109 1 1 23 GLN O O -0.798 6.081 5.917 1.00 . A A . 23 GLN O 1 1 5 3110 1 1 23 GLN OE1 O 0.445 9.529 8.827 1.00 . A A . 23 GLN OE1 1 1 5 3111 1 1 24 CYS C C 0.889 3.583 6.349 1.00 . A A . 24 CYS C 1 1 5 3112 1 1 24 CYS CA C 1.173 4.813 7.225 1.00 . A A . 24 CYS CA 1 1 5 3113 1 1 24 CYS CB C 2.097 4.501 8.426 1.00 . A A . 24 CYS CB 1 1 5 3114 1 1 24 CYS H H -0.237 5.207 8.806 1.00 . A A . 24 CYS H 1 1 5 3115 1 1 24 CYS HA H 1.619 5.591 6.620 1.00 . A A . 24 CYS HA 1 1 5 3116 1 1 24 CYS HB2 H 2.958 5.150 8.378 1.00 . A A . 24 CYS HB2 1 1 5 3117 1 1 24 CYS HB3 H 1.563 4.703 9.341 1.00 . A A . 24 CYS HB3 1 1 5 3118 1 1 24 CYS N N -0.086 5.319 7.846 1.00 . A A . 24 CYS N 1 1 5 3119 1 1 24 CYS O O -0.189 3.021 6.370 1.00 . A A . 24 CYS O 1 1 5 3120 1 1 24 CYS SG S 2.670 2.773 8.431 1.00 . A A . 24 CYS SG 1 1 5 3121 1 1 25 GLY C C 3.030 1.285 4.544 1.00 . A A . 25 GLY C 1 1 5 3122 1 1 25 GLY CA C 1.683 1.990 4.689 1.00 . A A . 25 GLY CA 1 1 5 3123 1 1 25 GLY H H 2.717 3.651 5.584 1.00 . A A . 25 GLY H 1 1 5 3124 1 1 25 GLY HA2 H 0.960 1.314 5.123 1.00 . A A . 25 GLY HA2 1 1 5 3125 1 1 25 GLY HA3 H 1.343 2.312 3.718 1.00 . A A . 25 GLY HA3 1 1 5 3126 1 1 25 GLY N N 1.860 3.173 5.579 1.00 . A A . 25 GLY N 1 1 5 3127 1 1 25 GLY O O 4.010 1.696 5.123 1.00 . A A . 25 GLY O 1 1 5 3128 1 1 26 TRP C C 5.178 0.144 2.450 1.00 . A A . 26 TRP C 1 1 5 3129 1 1 26 TRP CA C 4.405 -0.468 3.623 1.00 . A A . 26 TRP CA 1 1 5 3130 1 1 26 TRP CB C 4.040 -1.925 3.341 1.00 . A A . 26 TRP CB 1 1 5 3131 1 1 26 TRP CD1 C 6.099 -3.341 2.966 1.00 . A A . 26 TRP CD1 1 1 5 3132 1 1 26 TRP CD2 C 5.470 -3.286 5.125 1.00 . A A . 26 TRP CD2 1 1 5 3133 1 1 26 TRP CE2 C 6.622 -4.102 5.059 1.00 . A A . 26 TRP CE2 1 1 5 3134 1 1 26 TRP CE3 C 4.870 -3.087 6.380 1.00 . A A . 26 TRP CE3 1 1 5 3135 1 1 26 TRP CG C 5.159 -2.813 3.782 1.00 . A A . 26 TRP CG 1 1 5 3136 1 1 26 TRP CH2 C 6.554 -4.492 7.439 1.00 . A A . 26 TRP CH2 1 1 5 3137 1 1 26 TRP CZ2 C 7.162 -4.699 6.198 1.00 . A A . 26 TRP CZ2 1 1 5 3138 1 1 26 TRP CZ3 C 5.409 -3.686 7.529 1.00 . A A . 26 TRP CZ3 1 1 5 3139 1 1 26 TRP H H 2.302 -0.094 3.307 1.00 . A A . 26 TRP H 1 1 5 3140 1 1 26 TRP HA H 4.981 -0.399 4.531 1.00 . A A . 26 TRP HA 1 1 5 3141 1 1 26 TRP HB2 H 3.141 -2.182 3.881 1.00 . A A . 26 TRP HB2 1 1 5 3142 1 1 26 TRP HB3 H 3.872 -2.057 2.284 1.00 . A A . 26 TRP HB3 1 1 5 3143 1 1 26 TRP HD1 H 6.162 -3.189 1.899 1.00 . A A . 26 TRP HD1 1 1 5 3144 1 1 26 TRP HE1 H 7.740 -4.596 3.373 1.00 . A A . 26 TRP HE1 1 1 5 3145 1 1 26 TRP HE3 H 3.989 -2.468 6.459 1.00 . A A . 26 TRP HE3 1 1 5 3146 1 1 26 TRP HH2 H 6.964 -4.950 8.326 1.00 . A A . 26 TRP HH2 1 1 5 3147 1 1 26 TRP HZ2 H 8.049 -5.313 6.121 1.00 . A A . 26 TRP HZ2 1 1 5 3148 1 1 26 TRP HZ3 H 4.940 -3.527 8.490 1.00 . A A . 26 TRP HZ3 1 1 5 3149 1 1 26 TRP N N 3.099 0.233 3.781 1.00 . A A . 26 TRP N 1 1 5 3150 1 1 26 TRP NE1 N 6.969 -4.106 3.723 1.00 . A A . 26 TRP NE1 1 1 5 3151 1 1 26 TRP O O 4.620 0.428 1.409 1.00 . A A . 26 TRP O 1 1 5 3152 1 1 27 CYS C C 8.495 0.149 1.200 1.00 . A A . 27 CYS C 1 1 5 3153 1 1 27 CYS CA C 7.247 0.981 1.510 1.00 . A A . 27 CYS CA 1 1 5 3154 1 1 27 CYS CB C 7.647 2.362 2.032 1.00 . A A . 27 CYS CB 1 1 5 3155 1 1 27 CYS H H 6.887 0.149 3.467 1.00 . A A . 27 CYS H 1 1 5 3156 1 1 27 CYS HA H 6.639 1.088 0.627 1.00 . A A . 27 CYS HA 1 1 5 3157 1 1 27 CYS HB2 H 6.794 2.829 2.504 1.00 . A A . 27 CYS HB2 1 1 5 3158 1 1 27 CYS HB3 H 8.444 2.258 2.752 1.00 . A A . 27 CYS HB3 1 1 5 3159 1 1 27 CYS N N 6.455 0.369 2.616 1.00 . A A . 27 CYS N 1 1 5 3160 1 1 27 CYS O O 9.506 0.253 1.862 1.00 . A A . 27 CYS O 1 1 5 3161 1 1 27 CYS SG S 8.209 3.391 0.652 1.00 . A A . 27 CYS SG 1 1 5 3162 1 1 28 HIS C C 10.360 -2.070 0.985 1.00 . A A . 28 HIS C 1 1 5 3163 1 1 28 HIS CA C 9.601 -1.495 -0.222 1.00 . A A . 28 HIS CA 1 1 5 3164 1 1 28 HIS CB C 10.505 -0.539 -1.000 1.00 . A A . 28 HIS CB 1 1 5 3165 1 1 28 HIS CD2 C 8.919 0.952 -2.472 1.00 . A A . 28 HIS CD2 1 1 5 3166 1 1 28 HIS CE1 C 9.206 -0.058 -4.367 1.00 . A A . 28 HIS CE1 1 1 5 3167 1 1 28 HIS CG C 9.799 -0.077 -2.244 1.00 . A A . 28 HIS CG 1 1 5 3168 1 1 28 HIS H H 7.602 -0.705 -0.346 1.00 . A A . 28 HIS H 1 1 5 3169 1 1 28 HIS HA H 9.283 -2.293 -0.873 1.00 . A A . 28 HIS HA 1 1 5 3170 1 1 28 HIS HB2 H 10.741 0.315 -0.383 1.00 . A A . 28 HIS HB2 1 1 5 3171 1 1 28 HIS HB3 H 11.418 -1.048 -1.273 1.00 . A A . 28 HIS HB3 1 1 5 3172 1 1 28 HIS HD1 H 10.538 -1.485 -3.646 1.00 . A A . 28 HIS HD1 1 1 5 3173 1 1 28 HIS HD2 H 8.570 1.647 -1.722 1.00 . A A . 28 HIS HD2 1 1 5 3174 1 1 28 HIS HE1 H 9.135 -0.328 -5.410 1.00 . A A . 28 HIS HE1 1 1 5 3175 1 1 28 HIS N N 8.428 -0.659 0.179 1.00 . A A . 28 HIS N 1 1 5 3176 1 1 28 HIS ND1 N 9.967 -0.708 -3.467 1.00 . A A . 28 HIS ND1 1 1 5 3177 1 1 28 HIS NE2 N 8.546 0.962 -3.812 1.00 . A A . 28 HIS NE2 1 1 5 3178 1 1 28 HIS O O 11.506 -2.455 0.860 1.00 . A A . 28 HIS O 1 1 5 3179 1 1 29 ASP C C 9.745 -2.534 4.630 1.00 . A A . 29 ASP C 1 1 5 3180 1 1 29 ASP CA C 10.498 -2.737 3.310 1.00 . A A . 29 ASP CA 1 1 5 3181 1 1 29 ASP CB C 11.849 -2.013 3.358 1.00 . A A . 29 ASP CB 1 1 5 3182 1 1 29 ASP CG C 11.692 -0.551 2.924 1.00 . A A . 29 ASP CG 1 1 5 3183 1 1 29 ASP H H 8.827 -1.864 2.244 1.00 . A A . 29 ASP H 1 1 5 3184 1 1 29 ASP HA H 10.665 -3.789 3.145 1.00 . A A . 29 ASP HA 1 1 5 3185 1 1 29 ASP HB2 H 12.227 -2.048 4.370 1.00 . A A . 29 ASP HB2 1 1 5 3186 1 1 29 ASP HB3 H 12.545 -2.509 2.698 1.00 . A A . 29 ASP HB3 1 1 5 3187 1 1 29 ASP N N 9.754 -2.158 2.143 1.00 . A A . 29 ASP N 1 1 5 3188 1 1 29 ASP O O 9.088 -3.427 5.118 1.00 . A A . 29 ASP O 1 1 5 3189 1 1 29 ASP OD1 O 11.237 0.241 3.732 1.00 . A A . 29 ASP OD1 1 1 5 3190 1 1 29 ASP OD2 O 12.027 -0.252 1.790 1.00 . A A . 29 ASP OD2 1 1 5 3191 1 1 30 LYS C C 7.818 -0.467 6.325 1.00 . A A . 30 LYS C 1 1 5 3192 1 1 30 LYS CA C 9.175 -1.139 6.535 1.00 . A A . 30 LYS CA 1 1 5 3193 1 1 30 LYS CB C 10.118 -0.214 7.306 1.00 . A A . 30 LYS CB 1 1 5 3194 1 1 30 LYS CD C 10.261 0.771 9.599 1.00 . A A . 30 LYS CD 1 1 5 3195 1 1 30 LYS CE C 11.760 0.961 9.832 1.00 . A A . 30 LYS CE 1 1 5 3196 1 1 30 LYS CG C 10.028 -0.516 8.803 1.00 . A A . 30 LYS CG 1 1 5 3197 1 1 30 LYS H H 10.414 -0.675 4.837 1.00 . A A . 30 LYS H 1 1 5 3198 1 1 30 LYS HA H 9.052 -2.067 7.072 1.00 . A A . 30 LYS HA 1 1 5 3199 1 1 30 LYS HB2 H 11.132 -0.372 6.967 1.00 . A A . 30 LYS HB2 1 1 5 3200 1 1 30 LYS HB3 H 9.836 0.814 7.131 1.00 . A A . 30 LYS HB3 1 1 5 3201 1 1 30 LYS HD2 H 9.871 1.612 9.045 1.00 . A A . 30 LYS HD2 1 1 5 3202 1 1 30 LYS HD3 H 9.757 0.701 10.551 1.00 . A A . 30 LYS HD3 1 1 5 3203 1 1 30 LYS HE2 H 12.326 0.284 9.206 1.00 . A A . 30 LYS HE2 1 1 5 3204 1 1 30 LYS HE3 H 12.046 1.983 9.637 1.00 . A A . 30 LYS HE3 1 1 5 3205 1 1 30 LYS HG2 H 9.049 -0.910 9.032 1.00 . A A . 30 LYS HG2 1 1 5 3206 1 1 30 LYS HG3 H 10.781 -1.243 9.070 1.00 . A A . 30 LYS HG3 1 1 5 3207 1 1 30 LYS HZ1 H 11.152 0.969 11.822 1.00 . A A . 30 LYS HZ1 1 1 5 3208 1 1 30 LYS HZ2 H 12.832 1.109 11.609 1.00 . A A . 30 LYS HZ2 1 1 5 3209 1 1 30 LYS HZ3 H 12.067 -0.390 11.384 1.00 . A A . 30 LYS HZ3 1 1 5 3210 1 1 30 LYS N N 9.860 -1.378 5.231 1.00 . A A . 30 LYS N 1 1 5 3211 1 1 30 LYS NZ N 11.969 0.638 11.270 1.00 . A A . 30 LYS NZ 1 1 5 3212 1 1 30 LYS O O 7.453 -0.108 5.223 1.00 . A A . 30 LYS O 1 1 5 3213 1 1 31 CYS C C 5.850 1.862 7.485 1.00 . A A . 31 CYS C 1 1 5 3214 1 1 31 CYS CA C 5.734 0.354 7.253 1.00 . A A . 31 CYS CA 1 1 5 3215 1 1 31 CYS CB C 4.870 -0.295 8.334 1.00 . A A . 31 CYS CB 1 1 5 3216 1 1 31 CYS H H 7.383 -0.592 8.258 1.00 . A A . 31 CYS H 1 1 5 3217 1 1 31 CYS HA H 5.313 0.155 6.280 1.00 . A A . 31 CYS HA 1 1 5 3218 1 1 31 CYS HB2 H 5.253 -1.279 8.560 1.00 . A A . 31 CYS HB2 1 1 5 3219 1 1 31 CYS HB3 H 4.892 0.313 9.226 1.00 . A A . 31 CYS HB3 1 1 5 3220 1 1 31 CYS N N 7.068 -0.294 7.381 1.00 . A A . 31 CYS N 1 1 5 3221 1 1 31 CYS O O 5.992 2.325 8.599 1.00 . A A . 31 CYS O 1 1 5 3222 1 1 31 CYS SG S 3.166 -0.431 7.739 1.00 . A A . 31 CYS SG 1 1 5 3223 1 1 32 VAL C C 5.014 4.757 5.479 1.00 . A A . 32 VAL C 1 1 5 3224 1 1 32 VAL CA C 5.875 4.106 6.562 1.00 . A A . 32 VAL CA 1 1 5 3225 1 1 32 VAL CB C 7.351 4.433 6.336 1.00 . A A . 32 VAL CB 1 1 5 3226 1 1 32 VAL CG1 C 8.219 3.532 7.218 1.00 . A A . 32 VAL CG1 1 1 5 3227 1 1 32 VAL CG2 C 7.698 4.194 4.865 1.00 . A A . 32 VAL CG2 1 1 5 3228 1 1 32 VAL H H 5.661 2.224 5.549 1.00 . A A . 32 VAL H 1 1 5 3229 1 1 32 VAL HA H 5.565 4.426 7.543 1.00 . A A . 32 VAL HA 1 1 5 3230 1 1 32 VAL HB H 7.533 5.467 6.588 1.00 . A A . 32 VAL HB 1 1 5 3231 1 1 32 VAL HG11 H 7.796 3.483 8.210 1.00 . A A . 32 VAL HG11 1 1 5 3232 1 1 32 VAL HG12 H 9.218 3.938 7.273 1.00 . A A . 32 VAL HG12 1 1 5 3233 1 1 32 VAL HG13 H 8.256 2.540 6.793 1.00 . A A . 32 VAL HG13 1 1 5 3234 1 1 32 VAL HG21 H 8.699 3.798 4.791 1.00 . A A . 32 VAL HG21 1 1 5 3235 1 1 32 VAL HG22 H 7.637 5.127 4.325 1.00 . A A . 32 VAL HG22 1 1 5 3236 1 1 32 VAL HG23 H 6.999 3.488 4.441 1.00 . A A . 32 VAL HG23 1 1 5 3237 1 1 32 VAL N N 5.781 2.626 6.434 1.00 . A A . 32 VAL N 1 1 5 3238 1 1 32 VAL O O 4.458 4.085 4.633 1.00 . A A . 32 VAL O 1 1 5 3239 1 1 33 ARG C C 4.895 7.778 3.705 1.00 . A A . 33 ARG C 1 1 5 3240 1 1 33 ARG CA C 4.073 6.721 4.440 1.00 . A A . 33 ARG CA 1 1 5 3241 1 1 33 ARG CB C 2.904 7.367 5.178 1.00 . A A . 33 ARG CB 1 1 5 3242 1 1 33 ARG CD C 0.826 8.404 4.243 1.00 . A A . 33 ARG CD 1 1 5 3243 1 1 33 ARG CG C 1.618 7.105 4.391 1.00 . A A . 33 ARG CG 1 1 5 3244 1 1 33 ARG CZ C -0.409 7.778 2.253 1.00 . A A . 33 ARG CZ 1 1 5 3245 1 1 33 ARG H H 5.351 6.589 6.172 1.00 . A A . 33 ARG H 1 1 5 3246 1 1 33 ARG HA H 3.701 5.989 3.740 1.00 . A A . 33 ARG HA 1 1 5 3247 1 1 33 ARG HB2 H 2.820 6.940 6.166 1.00 . A A . 33 ARG HB2 1 1 5 3248 1 1 33 ARG HB3 H 3.067 8.432 5.255 1.00 . A A . 33 ARG HB3 1 1 5 3249 1 1 33 ARG HD2 H 0.600 8.819 5.215 1.00 . A A . 33 ARG HD2 1 1 5 3250 1 1 33 ARG HD3 H 1.375 9.115 3.646 1.00 . A A . 33 ARG HD3 1 1 5 3251 1 1 33 ARG HE H -1.261 7.912 4.042 1.00 . A A . 33 ARG HE 1 1 5 3252 1 1 33 ARG HG2 H 1.872 6.725 3.410 1.00 . A A . 33 ARG HG2 1 1 5 3253 1 1 33 ARG HG3 H 1.019 6.377 4.913 1.00 . A A . 33 ARG HG3 1 1 5 3254 1 1 33 ARG HH11 H 1.556 8.115 2.053 1.00 . A A . 33 ARG HH11 1 1 5 3255 1 1 33 ARG HH12 H 0.717 7.696 0.598 1.00 . A A . 33 ARG HH12 1 1 5 3256 1 1 33 ARG HH21 H -2.369 7.382 2.147 1.00 . A A . 33 ARG HH21 1 1 5 3257 1 1 33 ARG HH22 H -1.503 7.281 0.651 1.00 . A A . 33 ARG HH22 1 1 5 3258 1 1 33 ARG N N 4.897 6.055 5.487 1.00 . A A . 33 ARG N 1 1 5 3259 1 1 33 ARG NE N -0.426 8.006 3.539 1.00 . A A . 33 ARG NE 1 1 5 3260 1 1 33 ARG NH1 N 0.708 7.871 1.582 1.00 . A A . 33 ARG NH1 1 1 5 3261 1 1 33 ARG NH2 N -1.514 7.456 1.634 1.00 . A A . 33 ARG NH2 1 1 5 3262 1 1 33 ARG O O 6.032 8.041 4.044 1.00 . A A . 33 ARG O 1 1 5 3263 1 1 34 SER C C 5.902 10.289 2.858 1.00 . A A . 34 SER C 1 1 5 3264 1 1 34 SER CA C 5.061 9.419 1.922 1.00 . A A . 34 SER CA 1 1 5 3265 1 1 34 SER CB C 3.973 10.255 1.247 1.00 . A A . 34 SER CB 1 1 5 3266 1 1 34 SER H H 3.407 8.139 2.447 1.00 . A A . 34 SER H 1 1 5 3267 1 1 34 SER HA H 5.686 8.958 1.172 1.00 . A A . 34 SER HA 1 1 5 3268 1 1 34 SER HB2 H 3.282 10.617 1.990 1.00 . A A . 34 SER HB2 1 1 5 3269 1 1 34 SER HB3 H 4.428 11.096 0.742 1.00 . A A . 34 SER HB3 1 1 5 3270 1 1 34 SER HG H 2.436 9.874 0.117 1.00 . A A . 34 SER HG 1 1 5 3271 1 1 34 SER N N 4.324 8.378 2.696 1.00 . A A . 34 SER N 1 1 5 3272 1 1 34 SER O O 7.064 10.544 2.607 1.00 . A A . 34 SER O 1 1 5 3273 1 1 34 SER OG O 3.272 9.445 0.312 1.00 . A A . 34 SER OG 1 1 5 3274 1 1 35 GLU C C 7.459 10.943 5.183 1.00 . A A . 35 GLU C 1 1 5 3275 1 1 35 GLU CA C 6.105 11.594 4.889 1.00 . A A . 35 GLU CA 1 1 5 3276 1 1 35 GLU CB C 5.250 11.658 6.155 1.00 . A A . 35 GLU CB 1 1 5 3277 1 1 35 GLU CD C 3.184 13.046 6.358 1.00 . A A . 35 GLU CD 1 1 5 3278 1 1 35 GLU CG C 4.712 13.079 6.334 1.00 . A A . 35 GLU CG 1 1 5 3279 1 1 35 GLU H H 4.393 10.528 4.127 1.00 . A A . 35 GLU H 1 1 5 3280 1 1 35 GLU HA H 6.241 12.585 4.484 1.00 . A A . 35 GLU HA 1 1 5 3281 1 1 35 GLU HB2 H 4.424 10.968 6.068 1.00 . A A . 35 GLU HB2 1 1 5 3282 1 1 35 GLU HB3 H 5.854 11.395 7.011 1.00 . A A . 35 GLU HB3 1 1 5 3283 1 1 35 GLU HG2 H 5.080 13.491 7.263 1.00 . A A . 35 GLU HG2 1 1 5 3284 1 1 35 GLU HG3 H 5.044 13.695 5.511 1.00 . A A . 35 GLU HG3 1 1 5 3285 1 1 35 GLU N N 5.329 10.745 3.939 1.00 . A A . 35 GLU N 1 1 5 3286 1 1 35 GLU O O 8.433 11.612 5.466 1.00 . A A . 35 GLU O 1 1 5 3287 1 1 35 GLU OE1 O 2.640 12.111 6.922 1.00 . A A . 35 GLU OE1 1 1 5 3288 1 1 35 GLU OE2 O 2.581 13.957 5.815 1.00 . A A . 35 GLU OE2 1 1 5 3289 1 1 36 GLU C C 9.480 8.546 4.057 1.00 . A A . 36 GLU C 1 1 5 3290 1 1 36 GLU CA C 8.820 8.946 5.378 1.00 . A A . 36 GLU CA 1 1 5 3291 1 1 36 GLU CB C 8.444 7.705 6.189 1.00 . A A . 36 GLU CB 1 1 5 3292 1 1 36 GLU CD C 9.454 7.755 8.474 1.00 . A A . 36 GLU CD 1 1 5 3293 1 1 36 GLU CG C 8.213 8.100 7.649 1.00 . A A . 36 GLU CG 1 1 5 3294 1 1 36 GLU H H 6.731 9.122 4.875 1.00 . A A . 36 GLU H 1 1 5 3295 1 1 36 GLU HA H 9.478 9.579 5.953 1.00 . A A . 36 GLU HA 1 1 5 3296 1 1 36 GLU HB2 H 7.542 7.270 5.785 1.00 . A A . 36 GLU HB2 1 1 5 3297 1 1 36 GLU HB3 H 9.247 6.986 6.137 1.00 . A A . 36 GLU HB3 1 1 5 3298 1 1 36 GLU HG2 H 8.024 9.163 7.709 1.00 . A A . 36 GLU HG2 1 1 5 3299 1 1 36 GLU HG3 H 7.364 7.560 8.039 1.00 . A A . 36 GLU HG3 1 1 5 3300 1 1 36 GLU N N 7.528 9.642 5.110 1.00 . A A . 36 GLU N 1 1 5 3301 1 1 36 GLU O O 10.635 8.832 3.817 1.00 . A A . 36 GLU O 1 1 5 3302 1 1 36 GLU OE1 O 10.392 8.535 8.449 1.00 . A A . 36 GLU OE1 1 1 5 3303 1 1 36 GLU OE2 O 9.447 6.717 9.114 1.00 . A A . 36 GLU OE2 1 1 5 3304 1 1 37 CYS C C 9.267 8.632 0.892 1.00 . A A . 37 CYS C 1 1 5 3305 1 1 37 CYS CA C 9.336 7.471 1.888 1.00 . A A . 37 CYS CA 1 1 5 3306 1 1 37 CYS CB C 8.464 6.307 1.417 1.00 . A A . 37 CYS CB 1 1 5 3307 1 1 37 CYS H H 7.821 7.669 3.409 1.00 . A A . 37 CYS H 1 1 5 3308 1 1 37 CYS HA H 10.355 7.142 2.015 1.00 . A A . 37 CYS HA 1 1 5 3309 1 1 37 CYS HB2 H 7.589 6.236 2.045 1.00 . A A . 37 CYS HB2 1 1 5 3310 1 1 37 CYS HB3 H 8.160 6.477 0.394 1.00 . A A . 37 CYS HB3 1 1 5 3311 1 1 37 CYS N N 8.752 7.887 3.197 1.00 . A A . 37 CYS N 1 1 5 3312 1 1 37 CYS O O 8.231 8.910 0.320 1.00 . A A . 37 CYS O 1 1 5 3313 1 1 37 CYS SG S 9.408 4.767 1.519 1.00 . A A . 37 CYS SG 1 1 5 3314 1 1 38 LEU C C 10.637 9.969 -1.693 1.00 . A A . 38 LEU C 1 1 5 3315 1 1 38 LEU CA C 10.352 10.459 -0.271 1.00 . A A . 38 LEU CA 1 1 5 3316 1 1 38 LEU CB C 11.471 11.381 0.212 1.00 . A A . 38 LEU CB 1 1 5 3317 1 1 38 LEU CD1 C 12.029 13.739 0.819 1.00 . A A . 38 LEU CD1 1 1 5 3318 1 1 38 LEU CD2 C 10.073 13.257 -0.657 1.00 . A A . 38 LEU CD2 1 1 5 3319 1 1 38 LEU CG C 10.891 12.759 0.536 1.00 . A A . 38 LEU CG 1 1 5 3320 1 1 38 LEU H H 11.182 9.077 1.160 1.00 . A A . 38 LEU H 1 1 5 3321 1 1 38 LEU HA H 9.406 10.976 -0.232 1.00 . A A . 38 LEU HA 1 1 5 3322 1 1 38 LEU HB2 H 11.925 10.962 1.099 1.00 . A A . 38 LEU HB2 1 1 5 3323 1 1 38 LEU HB3 H 12.216 11.479 -0.562 1.00 . A A . 38 LEU HB3 1 1 5 3324 1 1 38 LEU HD11 H 12.650 13.833 -0.059 1.00 . A A . 38 LEU HD11 1 1 5 3325 1 1 38 LEU HD12 H 12.624 13.373 1.644 1.00 . A A . 38 LEU HD12 1 1 5 3326 1 1 38 LEU HD13 H 11.617 14.705 1.074 1.00 . A A . 38 LEU HD13 1 1 5 3327 1 1 38 LEU HD21 H 9.031 13.320 -0.380 1.00 . A A . 38 LEU HD21 1 1 5 3328 1 1 38 LEU HD22 H 10.185 12.570 -1.483 1.00 . A A . 38 LEU HD22 1 1 5 3329 1 1 38 LEU HD23 H 10.427 14.235 -0.951 1.00 . A A . 38 LEU HD23 1 1 5 3330 1 1 38 LEU HG H 10.254 12.684 1.406 1.00 . A A . 38 LEU HG 1 1 5 3331 1 1 38 LEU N N 10.358 9.315 0.685 1.00 . A A . 38 LEU N 1 1 5 3332 1 1 38 LEU O O 10.800 10.751 -2.607 1.00 . A A . 38 LEU O 1 1 5 3333 1 1 39 SER C C 9.738 8.325 -4.143 1.00 . A A . 39 SER C 1 1 5 3334 1 1 39 SER CA C 10.968 8.146 -3.250 1.00 . A A . 39 SER CA 1 1 5 3335 1 1 39 SER CB C 11.267 6.662 -3.042 1.00 . A A . 39 SER CB 1 1 5 3336 1 1 39 SER H H 10.560 8.065 -1.136 1.00 . A A . 39 SER H 1 1 5 3337 1 1 39 SER HA H 11.825 8.638 -3.685 1.00 . A A . 39 SER HA 1 1 5 3338 1 1 39 SER HB2 H 11.117 6.129 -3.966 1.00 . A A . 39 SER HB2 1 1 5 3339 1 1 39 SER HB3 H 12.294 6.544 -2.724 1.00 . A A . 39 SER HB3 1 1 5 3340 1 1 39 SER HG H 10.920 5.835 -1.316 1.00 . A A . 39 SER HG 1 1 5 3341 1 1 39 SER N N 10.696 8.681 -1.886 1.00 . A A . 39 SER N 1 1 5 3342 1 1 39 SER O O 9.827 8.292 -5.355 1.00 . A A . 39 SER O 1 1 5 3343 1 1 39 SER OG O 10.388 6.142 -2.054 1.00 . A A . 39 SER OG 1 1 5 3344 1 1 40 GLY C C 6.670 7.340 -4.564 1.00 . A A . 40 GLY C 1 1 5 3345 1 1 40 GLY CA C 7.351 8.695 -4.366 1.00 . A A . 40 GLY CA 1 1 5 3346 1 1 40 GLY H H 8.539 8.537 -2.575 1.00 . A A . 40 GLY H 1 1 5 3347 1 1 40 GLY HA2 H 6.679 9.367 -3.851 1.00 . A A . 40 GLY HA2 1 1 5 3348 1 1 40 GLY HA3 H 7.609 9.108 -5.328 1.00 . A A . 40 GLY HA3 1 1 5 3349 1 1 40 GLY N N 8.588 8.515 -3.553 1.00 . A A . 40 GLY N 1 1 5 3350 1 1 40 GLY O O 5.745 7.206 -5.341 1.00 . A A . 40 GLY O 1 1 5 3351 1 1 41 THR C C 5.937 4.506 -2.676 1.00 . A A . 41 THR C 1 1 5 3352 1 1 41 THR CA C 6.499 4.985 -4.018 1.00 . A A . 41 THR CA 1 1 5 3353 1 1 41 THR CB C 7.636 4.072 -4.481 1.00 . A A . 41 THR CB 1 1 5 3354 1 1 41 THR CG2 C 8.687 3.960 -3.375 1.00 . A A . 41 THR CG2 1 1 5 3355 1 1 41 THR H H 7.868 6.460 -3.248 1.00 . A A . 41 THR H 1 1 5 3356 1 1 41 THR HA H 5.721 5.010 -4.764 1.00 . A A . 41 THR HA 1 1 5 3357 1 1 41 THR HB H 8.094 4.488 -5.365 1.00 . A A . 41 THR HB 1 1 5 3358 1 1 41 THR HG1 H 6.472 2.562 -4.098 1.00 . A A . 41 THR HG1 1 1 5 3359 1 1 41 THR HG21 H 8.279 3.399 -2.548 1.00 . A A . 41 THR HG21 1 1 5 3360 1 1 41 THR HG22 H 8.962 4.948 -3.039 1.00 . A A . 41 THR HG22 1 1 5 3361 1 1 41 THR HG23 H 9.559 3.453 -3.759 1.00 . A A . 41 THR HG23 1 1 5 3362 1 1 41 THR N N 7.121 6.332 -3.868 1.00 . A A . 41 THR N 1 1 5 3363 1 1 41 THR O O 6.638 4.440 -1.686 1.00 . A A . 41 THR O 1 1 5 3364 1 1 41 THR OG1 O 7.115 2.784 -4.775 1.00 . A A . 41 THR OG1 1 1 5 3365 1 1 42 TRP C C 3.110 2.537 -1.650 1.00 . A A . 42 TRP C 1 1 5 3366 1 1 42 TRP CA C 4.062 3.702 -1.364 1.00 . A A . 42 TRP CA 1 1 5 3367 1 1 42 TRP CB C 3.293 4.913 -0.833 1.00 . A A . 42 TRP CB 1 1 5 3368 1 1 42 TRP CD1 C 3.314 4.437 1.648 1.00 . A A . 42 TRP CD1 1 1 5 3369 1 1 42 TRP CD2 C 1.247 4.341 0.765 1.00 . A A . 42 TRP CD2 1 1 5 3370 1 1 42 TRP CE2 C 1.111 4.060 2.145 1.00 . A A . 42 TRP CE2 1 1 5 3371 1 1 42 TRP CE3 C 0.086 4.343 -0.030 1.00 . A A . 42 TRP CE3 1 1 5 3372 1 1 42 TRP CG C 2.655 4.575 0.475 1.00 . A A . 42 TRP CG 1 1 5 3373 1 1 42 TRP CH2 C -1.277 3.798 1.913 1.00 . A A . 42 TRP CH2 1 1 5 3374 1 1 42 TRP CZ2 C -0.134 3.792 2.716 1.00 . A A . 42 TRP CZ2 1 1 5 3375 1 1 42 TRP CZ3 C -1.168 4.072 0.542 1.00 . A A . 42 TRP CZ3 1 1 5 3376 1 1 42 TRP H H 4.130 4.238 -3.450 1.00 . A A . 42 TRP H 1 1 5 3377 1 1 42 TRP HA H 4.824 3.407 -0.660 1.00 . A A . 42 TRP HA 1 1 5 3378 1 1 42 TRP HB2 H 3.974 5.738 -0.693 1.00 . A A . 42 TRP HB2 1 1 5 3379 1 1 42 TRP HB3 H 2.529 5.192 -1.542 1.00 . A A . 42 TRP HB3 1 1 5 3380 1 1 42 TRP HD1 H 4.380 4.549 1.787 1.00 . A A . 42 TRP HD1 1 1 5 3381 1 1 42 TRP HE1 H 2.621 3.981 3.584 1.00 . A A . 42 TRP HE1 1 1 5 3382 1 1 42 TRP HE3 H 0.160 4.552 -1.087 1.00 . A A . 42 TRP HE3 1 1 5 3383 1 1 42 TRP HH2 H -2.245 3.591 2.347 1.00 . A A . 42 TRP HH2 1 1 5 3384 1 1 42 TRP HZ2 H -0.213 3.582 3.773 1.00 . A A . 42 TRP HZ2 1 1 5 3385 1 1 42 TRP HZ3 H -2.053 4.076 -0.077 1.00 . A A . 42 TRP HZ3 1 1 5 3386 1 1 42 TRP N N 4.676 4.175 -2.638 1.00 . A A . 42 TRP N 1 1 5 3387 1 1 42 TRP NE1 N 2.401 4.132 2.641 1.00 . A A . 42 TRP NE1 1 1 5 3388 1 1 42 TRP O O 2.297 2.599 -2.551 1.00 . A A . 42 TRP O 1 1 5 3389 1 1 43 THR C C 1.605 -0.126 0.140 1.00 . A A . 43 THR C 1 1 5 3390 1 1 43 THR CA C 2.302 0.311 -1.152 1.00 . A A . 43 THR CA 1 1 5 3391 1 1 43 THR CB C 3.217 -0.800 -1.670 1.00 . A A . 43 THR CB 1 1 5 3392 1 1 43 THR CG2 C 4.394 -0.987 -0.713 1.00 . A A . 43 THR CG2 1 1 5 3393 1 1 43 THR H H 3.870 1.432 -0.180 1.00 . A A . 43 THR H 1 1 5 3394 1 1 43 THR HA H 1.571 0.562 -1.904 1.00 . A A . 43 THR HA 1 1 5 3395 1 1 43 THR HB H 3.591 -0.533 -2.647 1.00 . A A . 43 THR HB 1 1 5 3396 1 1 43 THR HG1 H 3.086 -2.741 -1.600 1.00 . A A . 43 THR HG1 1 1 5 3397 1 1 43 THR HG21 H 4.929 -0.054 -0.615 1.00 . A A . 43 THR HG21 1 1 5 3398 1 1 43 THR HG22 H 5.058 -1.743 -1.102 1.00 . A A . 43 THR HG22 1 1 5 3399 1 1 43 THR HG23 H 4.026 -1.294 0.255 1.00 . A A . 43 THR HG23 1 1 5 3400 1 1 43 THR N N 3.205 1.471 -0.901 1.00 . A A . 43 THR N 1 1 5 3401 1 1 43 THR O O 2.097 0.088 1.232 1.00 . A A . 43 THR O 1 1 5 3402 1 1 43 THR OG1 O 2.481 -2.013 -1.761 1.00 . A A . 43 THR OG1 1 1 5 3403 1 1 44 GLN C C -0.888 -2.579 0.977 1.00 . A A . 44 GLN C 1 1 5 3404 1 1 44 GLN CA C -0.274 -1.200 1.231 1.00 . A A . 44 GLN CA 1 1 5 3405 1 1 44 GLN CB C -1.366 -0.152 1.455 1.00 . A A . 44 GLN CB 1 1 5 3406 1 1 44 GLN CD C -3.084 -1.076 -0.106 1.00 . A A . 44 GLN CD 1 1 5 3407 1 1 44 GLN CG C -2.125 0.088 0.149 1.00 . A A . 44 GLN CG 1 1 5 3408 1 1 44 GLN H H 0.087 -0.906 -0.872 1.00 . A A . 44 GLN H 1 1 5 3409 1 1 44 GLN HA H 0.385 -1.232 2.083 1.00 . A A . 44 GLN HA 1 1 5 3410 1 1 44 GLN HB2 H -2.053 -0.505 2.210 1.00 . A A . 44 GLN HB2 1 1 5 3411 1 1 44 GLN HB3 H -0.915 0.772 1.781 1.00 . A A . 44 GLN HB3 1 1 5 3412 1 1 44 GLN HE21 H -4.025 -0.863 1.629 1.00 . A A . 44 GLN HE21 1 1 5 3413 1 1 44 GLN HE22 H -4.595 -2.123 0.645 1.00 . A A . 44 GLN HE22 1 1 5 3414 1 1 44 GLN HG2 H -2.686 1.007 0.223 1.00 . A A . 44 GLN HG2 1 1 5 3415 1 1 44 GLN HG3 H -1.424 0.161 -0.670 1.00 . A A . 44 GLN HG3 1 1 5 3416 1 1 44 GLN N N 0.462 -0.741 0.019 1.00 . A A . 44 GLN N 1 1 5 3417 1 1 44 GLN NE2 N -3.975 -1.380 0.797 1.00 . A A . 44 GLN NE2 1 1 5 3418 1 1 44 GLN O O -1.940 -2.908 1.489 1.00 . A A . 44 GLN O 1 1 5 3419 1 1 44 GLN OE1 O -3.021 -1.717 -1.137 1.00 . A A . 44 GLN OE1 1 1 5 3420 1 1 45 GLN C C 0.382 -5.737 -0.293 1.00 . A A . 45 GLN C 1 1 5 3421 1 1 45 GLN CA C -0.772 -4.745 -0.109 1.00 . A A . 45 GLN CA 1 1 5 3422 1 1 45 GLN CB C -1.555 -4.583 -1.412 1.00 . A A . 45 GLN CB 1 1 5 3423 1 1 45 GLN CD C -3.493 -5.782 -0.394 1.00 . A A . 45 GLN CD 1 1 5 3424 1 1 45 GLN CG C -2.522 -5.756 -1.576 1.00 . A A . 45 GLN CG 1 1 5 3425 1 1 45 GLN H H 0.610 -3.097 -0.215 1.00 . A A . 45 GLN H 1 1 5 3426 1 1 45 GLN HA H -1.431 -5.071 0.679 1.00 . A A . 45 GLN HA 1 1 5 3427 1 1 45 GLN HB2 H -2.110 -3.656 -1.385 1.00 . A A . 45 GLN HB2 1 1 5 3428 1 1 45 GLN HB3 H -0.868 -4.567 -2.246 1.00 . A A . 45 GLN HB3 1 1 5 3429 1 1 45 GLN HE21 H -3.401 -7.753 -0.180 1.00 . A A . 45 GLN HE21 1 1 5 3430 1 1 45 GLN HE22 H -4.417 -6.951 0.917 1.00 . A A . 45 GLN HE22 1 1 5 3431 1 1 45 GLN HG2 H -3.076 -5.639 -2.496 1.00 . A A . 45 GLN HG2 1 1 5 3432 1 1 45 GLN HG3 H -1.967 -6.680 -1.603 1.00 . A A . 45 GLN HG3 1 1 5 3433 1 1 45 GLN N N -0.235 -3.386 0.186 1.00 . A A . 45 GLN N 1 1 5 3434 1 1 45 GLN NE2 N -3.795 -6.923 0.161 1.00 . A A . 45 GLN NE2 1 1 5 3435 1 1 45 GLN O O 1.052 -5.741 -1.307 1.00 . A A . 45 GLN O 1 1 5 3436 1 1 45 GLN OE1 O -3.982 -4.753 0.028 1.00 . A A . 45 GLN OE1 1 1 5 3437 1 1 46 ILE C C 1.394 -8.849 1.311 1.00 . A A . 46 ILE C 1 1 5 3438 1 1 46 ILE CA C 1.733 -7.561 0.554 1.00 . A A . 46 ILE CA 1 1 5 3439 1 1 46 ILE CB C 2.945 -6.877 1.187 1.00 . A A . 46 ILE CB 1 1 5 3440 1 1 46 ILE CD1 C 5.354 -7.342 0.703 1.00 . A A . 46 ILE CD1 1 1 5 3441 1 1 46 ILE CG1 C 4.079 -7.894 1.340 1.00 . A A . 46 ILE CG1 1 1 5 3442 1 1 46 ILE CG2 C 2.561 -6.333 2.564 1.00 . A A . 46 ILE CG2 1 1 5 3443 1 1 46 ILE H H 0.070 -6.556 1.490 1.00 . A A . 46 ILE H 1 1 5 3444 1 1 46 ILE HA H 1.933 -7.776 -0.484 1.00 . A A . 46 ILE HA 1 1 5 3445 1 1 46 ILE HB H 3.270 -6.063 0.556 1.00 . A A . 46 ILE HB 1 1 5 3446 1 1 46 ILE HD11 H 5.774 -6.577 1.340 1.00 . A A . 46 ILE HD11 1 1 5 3447 1 1 46 ILE HD12 H 5.121 -6.917 -0.262 1.00 . A A . 46 ILE HD12 1 1 5 3448 1 1 46 ILE HD13 H 6.070 -8.141 0.581 1.00 . A A . 46 ILE HD13 1 1 5 3449 1 1 46 ILE HG12 H 4.252 -8.083 2.390 1.00 . A A . 46 ILE HG12 1 1 5 3450 1 1 46 ILE HG13 H 3.804 -8.815 0.850 1.00 . A A . 46 ILE HG13 1 1 5 3451 1 1 46 ILE HG21 H 2.391 -7.157 3.241 1.00 . A A . 46 ILE HG21 1 1 5 3452 1 1 46 ILE HG22 H 1.660 -5.744 2.480 1.00 . A A . 46 ILE HG22 1 1 5 3453 1 1 46 ILE HG23 H 3.362 -5.715 2.943 1.00 . A A . 46 ILE HG23 1 1 5 3454 1 1 46 ILE N N 0.621 -6.575 0.679 1.00 . A A . 46 ILE N 1 1 5 3455 1 1 46 ILE O O 1.712 -9.938 0.876 1.00 . A A . 46 ILE O 1 1 5 3456 1 1 47 CYS C C -1.096 -9.967 3.543 1.00 . A A . 47 CYS C 1 1 5 3457 1 1 47 CYS CA C 0.403 -9.953 3.226 1.00 . A A . 47 CYS CA 1 1 5 3458 1 1 47 CYS CB C 1.227 -9.857 4.514 1.00 . A A . 47 CYS CB 1 1 5 3459 1 1 47 CYS H H 0.510 -7.847 2.779 1.00 . A A . 47 CYS H 1 1 5 3460 1 1 47 CYS HA H 0.679 -10.842 2.680 1.00 . A A . 47 CYS HA 1 1 5 3461 1 1 47 CYS HB2 H 0.844 -10.560 5.240 1.00 . A A . 47 CYS HB2 1 1 5 3462 1 1 47 CYS HB3 H 2.260 -10.093 4.299 1.00 . A A . 47 CYS HB3 1 1 5 3463 1 1 47 CYS N N 0.756 -8.734 2.443 1.00 . A A . 47 CYS N 1 1 5 3464 1 1 47 CYS O O -1.771 -8.963 3.437 1.00 . A A . 47 CYS O 1 1 5 3465 1 1 47 CYS SG S 1.121 -8.179 5.190 1.00 . A A . 47 CYS SG 1 1 5 3466 1 1 48 LEU C C -3.292 -11.056 5.758 1.00 . A A . 48 LEU C 1 1 5 3467 1 1 48 LEU CA C -3.076 -11.175 4.247 1.00 . A A . 48 LEU CA 1 1 5 3468 1 1 48 LEU CB C -3.521 -12.550 3.746 1.00 . A A . 48 LEU CB 1 1 5 3469 1 1 48 LEU CD1 C -3.304 -12.391 1.262 1.00 . A A . 48 LEU CD1 1 1 5 3470 1 1 48 LEU CD2 C -5.278 -13.543 2.272 1.00 . A A . 48 LEU CD2 1 1 5 3471 1 1 48 LEU CG C -4.288 -12.387 2.433 1.00 . A A . 48 LEU CG 1 1 5 3472 1 1 48 LEU H H -1.060 -11.899 4.004 1.00 . A A . 48 LEU H 1 1 5 3473 1 1 48 LEU HA H -3.616 -10.401 3.727 1.00 . A A . 48 LEU HA 1 1 5 3474 1 1 48 LEU HB2 H -2.653 -13.172 3.582 1.00 . A A . 48 LEU HB2 1 1 5 3475 1 1 48 LEU HB3 H -4.162 -13.013 4.481 1.00 . A A . 48 LEU HB3 1 1 5 3476 1 1 48 LEU HD11 H -2.429 -11.816 1.527 1.00 . A A . 48 LEU HD11 1 1 5 3477 1 1 48 LEU HD12 H -3.775 -11.952 0.395 1.00 . A A . 48 LEU HD12 1 1 5 3478 1 1 48 LEU HD13 H -3.014 -13.406 1.040 1.00 . A A . 48 LEU HD13 1 1 5 3479 1 1 48 LEU HD21 H -6.206 -13.294 2.762 1.00 . A A . 48 LEU HD21 1 1 5 3480 1 1 48 LEU HD22 H -4.865 -14.436 2.718 1.00 . A A . 48 LEU HD22 1 1 5 3481 1 1 48 LEU HD23 H -5.460 -13.717 1.222 1.00 . A A . 48 LEU HD23 1 1 5 3482 1 1 48 LEU HG H -4.826 -11.450 2.446 1.00 . A A . 48 LEU HG 1 1 5 3483 1 1 48 LEU N N -1.621 -11.099 3.928 1.00 . A A . 48 LEU N 1 1 5 3484 1 1 48 LEU O O -3.403 -12.085 6.405 1.00 . A A . 48 LEU O 1 1 5 3485 1 1 48 LEU OXT O -3.344 -9.937 6.242 1.00 . A A . 48 LEU OXT 1 1 6 3486 1 1 1 GLY C C -7.722 -3.799 19.364 1.00 . A A . 1 GLY C 1 1 6 3487 1 1 1 GLY CA C -6.876 -4.921 19.968 1.00 . A A . 1 GLY CA 1 1 6 3488 1 1 1 GLY H1 H -4.995 -5.700 19.528 1.00 . A A . 1 GLY H1 1 1 6 3489 1 1 1 GLY H2 H -5.501 -4.469 18.472 1.00 . A A . 1 GLY H2 1 1 6 3490 1 1 1 GLY H3 H -6.171 -6.026 18.349 1.00 . A A . 1 GLY H3 1 1 6 3491 1 1 1 GLY HA2 H -7.504 -5.777 20.172 1.00 . A A . 1 GLY HA2 1 1 6 3492 1 1 1 GLY HA3 H -6.429 -4.574 20.887 1.00 . A A . 1 GLY HA3 1 1 6 3493 1 1 1 GLY N N -5.805 -5.308 19.007 1.00 . A A . 1 GLY N 1 1 6 3494 1 1 1 GLY O O -8.631 -4.039 18.594 1.00 . A A . 1 GLY O 1 1 6 3495 1 1 2 SER C C -7.448 -0.806 17.974 1.00 . A A . 2 SER C 1 1 6 3496 1 1 2 SER CA C -8.211 -1.437 19.141 1.00 . A A . 2 SER CA 1 1 6 3497 1 1 2 SER CB C -8.352 -0.444 20.294 1.00 . A A . 2 SER CB 1 1 6 3498 1 1 2 SER H H -6.687 -2.401 20.322 1.00 . A A . 2 SER H 1 1 6 3499 1 1 2 SER HA H -9.184 -1.773 18.820 1.00 . A A . 2 SER HA 1 1 6 3500 1 1 2 SER HB2 H -7.376 -0.142 20.633 1.00 . A A . 2 SER HB2 1 1 6 3501 1 1 2 SER HB3 H -8.898 0.425 19.953 1.00 . A A . 2 SER HB3 1 1 6 3502 1 1 2 SER HG H -8.634 -1.917 21.535 1.00 . A A . 2 SER HG 1 1 6 3503 1 1 2 SER N N -7.427 -2.574 19.702 1.00 . A A . 2 SER N 1 1 6 3504 1 1 2 SER O O -8.020 -0.150 17.126 1.00 . A A . 2 SER O 1 1 6 3505 1 1 2 SER OG O -9.049 -1.067 21.366 1.00 . A A . 2 SER OG 1 1 6 3506 1 1 3 ALA C C -5.499 1.094 16.774 1.00 . A A . 3 ALA C 1 1 6 3507 1 1 3 ALA CA C -5.352 -0.428 16.809 1.00 . A A . 3 ALA CA 1 1 6 3508 1 1 3 ALA CB C -5.930 -1.047 15.538 1.00 . A A . 3 ALA CB 1 1 6 3509 1 1 3 ALA H H -5.720 -1.543 18.616 1.00 . A A . 3 ALA H 1 1 6 3510 1 1 3 ALA HA H -4.316 -0.705 16.913 1.00 . A A . 3 ALA HA 1 1 6 3511 1 1 3 ALA HB1 H -5.303 -0.792 14.696 1.00 . A A . 3 ALA HB1 1 1 6 3512 1 1 3 ALA HB2 H -6.926 -0.665 15.373 1.00 . A A . 3 ALA HB2 1 1 6 3513 1 1 3 ALA HB3 H -5.971 -2.121 15.646 1.00 . A A . 3 ALA HB3 1 1 6 3514 1 1 3 ALA N N -6.159 -1.007 17.922 1.00 . A A . 3 ALA N 1 1 6 3515 1 1 3 ALA O O -6.526 1.619 16.391 1.00 . A A . 3 ALA O 1 1 6 3516 1 1 4 MET C C -3.293 3.879 16.503 1.00 . A A . 4 MET C 1 1 6 3517 1 1 4 MET CA C -4.556 3.294 17.143 1.00 . A A . 4 MET CA 1 1 6 3518 1 1 4 MET CB C -4.662 3.709 18.610 1.00 . A A . 4 MET CB 1 1 6 3519 1 1 4 MET CE C -6.964 3.993 21.601 1.00 . A A . 4 MET CE 1 1 6 3520 1 1 4 MET CG C -6.012 3.255 19.170 1.00 . A A . 4 MET CG 1 1 6 3521 1 1 4 MET H H -3.657 1.362 17.462 1.00 . A A . 4 MET H 1 1 6 3522 1 1 4 MET HA H -5.434 3.616 16.605 1.00 . A A . 4 MET HA 1 1 6 3523 1 1 4 MET HB2 H -3.864 3.249 19.175 1.00 . A A . 4 MET HB2 1 1 6 3524 1 1 4 MET HB3 H -4.586 4.783 18.688 1.00 . A A . 4 MET HB3 1 1 6 3525 1 1 4 MET HE1 H -7.952 3.558 21.671 1.00 . A A . 4 MET HE1 1 1 6 3526 1 1 4 MET HE2 H -7.001 4.861 20.962 1.00 . A A . 4 MET HE2 1 1 6 3527 1 1 4 MET HE3 H -6.623 4.287 22.584 1.00 . A A . 4 MET HE3 1 1 6 3528 1 1 4 MET HG2 H -6.723 4.065 19.098 1.00 . A A . 4 MET HG2 1 1 6 3529 1 1 4 MET HG3 H -6.371 2.410 18.602 1.00 . A A . 4 MET HG3 1 1 6 3530 1 1 4 MET N N -4.478 1.806 17.162 1.00 . A A . 4 MET N 1 1 6 3531 1 1 4 MET O O -2.799 4.910 16.914 1.00 . A A . 4 MET O 1 1 6 3532 1 1 4 MET SD S -5.819 2.777 20.905 1.00 . A A . 4 MET SD 1 1 6 3533 1 1 5 GLY C C -0.785 2.598 14.164 1.00 . A A . 5 GLY C 1 1 6 3534 1 1 5 GLY CA C -1.539 3.750 14.833 1.00 . A A . 5 GLY CA 1 1 6 3535 1 1 5 GLY H H -3.182 2.400 15.183 1.00 . A A . 5 GLY H 1 1 6 3536 1 1 5 GLY HA2 H -1.819 4.480 14.087 1.00 . A A . 5 GLY HA2 1 1 6 3537 1 1 5 GLY HA3 H -0.900 4.213 15.569 1.00 . A A . 5 GLY HA3 1 1 6 3538 1 1 5 GLY N N -2.768 3.229 15.499 1.00 . A A . 5 GLY N 1 1 6 3539 1 1 5 GLY O O -0.393 1.644 14.806 1.00 . A A . 5 GLY O 1 1 6 3540 1 1 6 CYS C C 1.667 1.800 12.288 1.00 . A A . 6 CYS C 1 1 6 3541 1 1 6 CYS CA C 0.156 1.584 12.175 1.00 . A A . 6 CYS CA 1 1 6 3542 1 1 6 CYS CB C -0.290 1.656 10.711 1.00 . A A . 6 CYS CB 1 1 6 3543 1 1 6 CYS H H -0.899 3.457 12.378 1.00 . A A . 6 CYS H 1 1 6 3544 1 1 6 CYS HA H -0.114 0.630 12.594 1.00 . A A . 6 CYS HA 1 1 6 3545 1 1 6 CYS HB2 H 0.273 0.942 10.130 1.00 . A A . 6 CYS HB2 1 1 6 3546 1 1 6 CYS HB3 H -1.342 1.421 10.647 1.00 . A A . 6 CYS HB3 1 1 6 3547 1 1 6 CYS N N -0.577 2.678 12.878 1.00 . A A . 6 CYS N 1 1 6 3548 1 1 6 CYS O O 2.438 0.860 12.296 1.00 . A A . 6 CYS O 1 1 6 3549 1 1 6 CYS SG S -0.004 3.320 10.062 1.00 . A A . 6 CYS SG 1 1 6 3550 1 1 7 ARG C C 4.113 2.612 13.759 1.00 . A A . 7 ARG C 1 1 6 3551 1 1 7 ARG CA C 3.558 3.295 12.504 1.00 . A A . 7 ARG CA 1 1 6 3552 1 1 7 ARG CB C 3.673 4.816 12.615 1.00 . A A . 7 ARG CB 1 1 6 3553 1 1 7 ARG CD C 4.627 6.763 11.373 1.00 . A A . 7 ARG CD 1 1 6 3554 1 1 7 ARG CG C 4.852 5.302 11.770 1.00 . A A . 7 ARG CG 1 1 6 3555 1 1 7 ARG CZ C 5.114 7.825 9.252 1.00 . A A . 7 ARG CZ 1 1 6 3556 1 1 7 ARG H H 1.462 3.773 12.380 1.00 . A A . 7 ARG H 1 1 6 3557 1 1 7 ARG HA H 4.080 2.949 11.625 1.00 . A A . 7 ARG HA 1 1 6 3558 1 1 7 ARG HB2 H 2.762 5.273 12.258 1.00 . A A . 7 ARG HB2 1 1 6 3559 1 1 7 ARG HB3 H 3.835 5.092 13.645 1.00 . A A . 7 ARG HB3 1 1 6 3560 1 1 7 ARG HD2 H 3.586 6.933 11.139 1.00 . A A . 7 ARG HD2 1 1 6 3561 1 1 7 ARG HD3 H 4.950 7.422 12.164 1.00 . A A . 7 ARG HD3 1 1 6 3562 1 1 7 ARG HE H 6.300 6.448 10.053 1.00 . A A . 7 ARG HE 1 1 6 3563 1 1 7 ARG HG2 H 5.764 5.218 12.343 1.00 . A A . 7 ARG HG2 1 1 6 3564 1 1 7 ARG HG3 H 4.928 4.696 10.879 1.00 . A A . 7 ARG HG3 1 1 6 3565 1 1 7 ARG HH11 H 3.254 7.103 9.087 1.00 . A A . 7 ARG HH11 1 1 6 3566 1 1 7 ARG HH12 H 3.630 8.448 8.062 1.00 . A A . 7 ARG HH12 1 1 6 3567 1 1 7 ARG HH21 H 6.889 8.748 9.207 1.00 . A A . 7 ARG HH21 1 1 6 3568 1 1 7 ARG HH22 H 5.688 9.380 8.131 1.00 . A A . 7 ARG HH22 1 1 6 3569 1 1 7 ARG N N 2.097 3.028 12.383 1.00 . A A . 7 ARG N 1 1 6 3570 1 1 7 ARG NE N 5.474 6.964 10.164 1.00 . A A . 7 ARG NE 1 1 6 3571 1 1 7 ARG NH1 N 3.906 7.790 8.762 1.00 . A A . 7 ARG NH1 1 1 6 3572 1 1 7 ARG NH2 N 5.963 8.722 8.830 1.00 . A A . 7 ARG NH2 1 1 6 3573 1 1 7 ARG O O 5.307 2.479 13.931 1.00 . A A . 7 ARG O 1 1 6 3574 1 1 8 HIS C C 3.513 -0.024 15.738 1.00 . A A . 8 HIS C 1 1 6 3575 1 1 8 HIS CA C 3.718 1.494 15.874 1.00 . A A . 8 HIS CA 1 1 6 3576 1 1 8 HIS CB C 2.855 2.106 16.997 1.00 . A A . 8 HIS CB 1 1 6 3577 1 1 8 HIS CD2 C 1.105 0.274 17.708 1.00 . A A . 8 HIS CD2 1 1 6 3578 1 1 8 HIS CE1 C 2.023 -0.334 19.573 1.00 . A A . 8 HIS CE1 1 1 6 3579 1 1 8 HIS CG C 2.239 1.033 17.859 1.00 . A A . 8 HIS CG 1 1 6 3580 1 1 8 HIS H H 2.289 2.289 14.475 1.00 . A A . 8 HIS H 1 1 6 3581 1 1 8 HIS HA H 4.760 1.716 16.048 1.00 . A A . 8 HIS HA 1 1 6 3582 1 1 8 HIS HB2 H 3.473 2.740 17.611 1.00 . A A . 8 HIS HB2 1 1 6 3583 1 1 8 HIS HB3 H 2.069 2.700 16.553 1.00 . A A . 8 HIS HB3 1 1 6 3584 1 1 8 HIS HD1 H 3.632 0.979 19.453 1.00 . A A . 8 HIS HD1 1 1 6 3585 1 1 8 HIS HD2 H 0.422 0.336 16.872 1.00 . A A . 8 HIS HD2 1 1 6 3586 1 1 8 HIS HE1 H 2.220 -0.840 20.506 1.00 . A A . 8 HIS HE1 1 1 6 3587 1 1 8 HIS N N 3.249 2.173 14.634 1.00 . A A . 8 HIS N 1 1 6 3588 1 1 8 HIS ND1 N 2.808 0.628 19.056 1.00 . A A . 8 HIS ND1 1 1 6 3589 1 1 8 HIS NE2 N 0.970 -0.589 18.791 1.00 . A A . 8 HIS NE2 1 1 6 3590 1 1 8 HIS O O 4.052 -0.804 16.498 1.00 . A A . 8 HIS O 1 1 6 3591 1 1 9 PHE C C 3.829 -2.659 14.531 1.00 . A A . 9 PHE C 1 1 6 3592 1 1 9 PHE CA C 2.497 -1.903 14.585 1.00 . A A . 9 PHE CA 1 1 6 3593 1 1 9 PHE CB C 1.762 -2.009 13.247 1.00 . A A . 9 PHE CB 1 1 6 3594 1 1 9 PHE CD1 C -0.177 -1.146 14.644 1.00 . A A . 9 PHE CD1 1 1 6 3595 1 1 9 PHE CD2 C -0.540 -1.629 12.295 1.00 . A A . 9 PHE CD2 1 1 6 3596 1 1 9 PHE CE1 C -1.519 -0.760 14.769 1.00 . A A . 9 PHE CE1 1 1 6 3597 1 1 9 PHE CE2 C -1.879 -1.242 12.421 1.00 . A A . 9 PHE CE2 1 1 6 3598 1 1 9 PHE CG C 0.314 -1.583 13.403 1.00 . A A . 9 PHE CG 1 1 6 3599 1 1 9 PHE CZ C -2.368 -0.808 13.658 1.00 . A A . 9 PHE CZ 1 1 6 3600 1 1 9 PHE H H 2.314 0.204 14.172 1.00 . A A . 9 PHE H 1 1 6 3601 1 1 9 PHE HA H 1.877 -2.292 15.379 1.00 . A A . 9 PHE HA 1 1 6 3602 1 1 9 PHE HB2 H 2.246 -1.369 12.524 1.00 . A A . 9 PHE HB2 1 1 6 3603 1 1 9 PHE HB3 H 1.798 -3.031 12.899 1.00 . A A . 9 PHE HB3 1 1 6 3604 1 1 9 PHE HD1 H 0.477 -1.107 15.502 1.00 . A A . 9 PHE HD1 1 1 6 3605 1 1 9 PHE HD2 H -0.163 -1.960 11.343 1.00 . A A . 9 PHE HD2 1 1 6 3606 1 1 9 PHE HE1 H -1.896 -0.425 15.722 1.00 . A A . 9 PHE HE1 1 1 6 3607 1 1 9 PHE HE2 H -2.535 -1.279 11.563 1.00 . A A . 9 PHE HE2 1 1 6 3608 1 1 9 PHE HZ H -3.401 -0.509 13.756 1.00 . A A . 9 PHE HZ 1 1 6 3609 1 1 9 PHE N N 2.738 -0.443 14.774 1.00 . A A . 9 PHE N 1 1 6 3610 1 1 9 PHE O O 4.883 -2.090 14.736 1.00 . A A . 9 PHE O 1 1 6 3611 1 1 10 GLN C C 5.529 -4.871 12.750 1.00 . A A . 10 GLN C 1 1 6 3612 1 1 10 GLN CA C 5.056 -4.726 14.201 1.00 . A A . 10 GLN CA 1 1 6 3613 1 1 10 GLN CB C 4.699 -6.092 14.790 1.00 . A A . 10 GLN CB 1 1 6 3614 1 1 10 GLN CD C 5.387 -7.847 16.432 1.00 . A A . 10 GLN CD 1 1 6 3615 1 1 10 GLN CG C 5.789 -6.526 15.772 1.00 . A A . 10 GLN CG 1 1 6 3616 1 1 10 GLN H H 2.931 -4.377 14.103 1.00 . A A . 10 GLN H 1 1 6 3617 1 1 10 GLN HA H 5.821 -4.257 14.799 1.00 . A A . 10 GLN HA 1 1 6 3618 1 1 10 GLN HB2 H 3.752 -6.023 15.309 1.00 . A A . 10 GLN HB2 1 1 6 3619 1 1 10 GLN HB3 H 4.622 -6.819 13.996 1.00 . A A . 10 GLN HB3 1 1 6 3620 1 1 10 GLN HE21 H 5.698 -7.181 18.276 1.00 . A A . 10 GLN HE21 1 1 6 3621 1 1 10 GLN HE22 H 5.165 -8.789 18.165 1.00 . A A . 10 GLN HE22 1 1 6 3622 1 1 10 GLN HG2 H 6.720 -6.658 15.240 1.00 . A A . 10 GLN HG2 1 1 6 3623 1 1 10 GLN HG3 H 5.912 -5.769 16.533 1.00 . A A . 10 GLN HG3 1 1 6 3624 1 1 10 GLN N N 3.791 -3.936 14.262 1.00 . A A . 10 GLN N 1 1 6 3625 1 1 10 GLN NE2 N 5.419 -7.948 17.732 1.00 . A A . 10 GLN NE2 1 1 6 3626 1 1 10 GLN O O 6.529 -4.304 12.355 1.00 . A A . 10 GLN O 1 1 6 3627 1 1 10 GLN OE1 O 5.040 -8.795 15.757 1.00 . A A . 10 GLN OE1 1 1 6 3628 1 1 11 SER C C 4.142 -5.311 9.587 1.00 . A A . 11 SER C 1 1 6 3629 1 1 11 SER CA C 5.239 -5.808 10.532 1.00 . A A . 11 SER CA 1 1 6 3630 1 1 11 SER CB C 5.446 -7.311 10.365 1.00 . A A . 11 SER CB 1 1 6 3631 1 1 11 SER H H 4.021 -6.079 12.292 1.00 . A A . 11 SER H 1 1 6 3632 1 1 11 SER HA H 6.163 -5.286 10.342 1.00 . A A . 11 SER HA 1 1 6 3633 1 1 11 SER HB2 H 5.754 -7.524 9.356 1.00 . A A . 11 SER HB2 1 1 6 3634 1 1 11 SER HB3 H 6.213 -7.643 11.051 1.00 . A A . 11 SER HB3 1 1 6 3635 1 1 11 SER HG H 4.032 -8.560 9.889 1.00 . A A . 11 SER HG 1 1 6 3636 1 1 11 SER N N 4.823 -5.628 11.955 1.00 . A A . 11 SER N 1 1 6 3637 1 1 11 SER O O 3.427 -4.376 9.891 1.00 . A A . 11 SER O 1 1 6 3638 1 1 11 SER OG O 4.225 -7.987 10.636 1.00 . A A . 11 SER OG 1 1 6 3639 1 1 12 CYS C C 1.609 -6.114 7.833 1.00 . A A . 12 CYS C 1 1 6 3640 1 1 12 CYS CA C 2.956 -5.475 7.484 1.00 . A A . 12 CYS CA 1 1 6 3641 1 1 12 CYS CB C 3.440 -5.933 6.100 1.00 . A A . 12 CYS CB 1 1 6 3642 1 1 12 CYS H H 4.592 -6.672 8.210 1.00 . A A . 12 CYS H 1 1 6 3643 1 1 12 CYS HA H 2.877 -4.403 7.505 1.00 . A A . 12 CYS HA 1 1 6 3644 1 1 12 CYS HB2 H 2.913 -5.380 5.338 1.00 . A A . 12 CYS HB2 1 1 6 3645 1 1 12 CYS HB3 H 4.500 -5.741 6.012 1.00 . A A . 12 CYS HB3 1 1 6 3646 1 1 12 CYS N N 4.005 -5.923 8.440 1.00 . A A . 12 CYS N 1 1 6 3647 1 1 12 CYS O O 0.572 -5.699 7.356 1.00 . A A . 12 CYS O 1 1 6 3648 1 1 12 CYS SG S 3.129 -7.707 5.877 1.00 . A A . 12 CYS SG 1 1 6 3649 1 1 13 SER C C -0.691 -6.757 9.490 1.00 . A A . 13 SER C 1 1 6 3650 1 1 13 SER CA C 0.337 -7.792 9.028 1.00 . A A . 13 SER CA 1 1 6 3651 1 1 13 SER CB C 0.703 -8.731 10.177 1.00 . A A . 13 SER CB 1 1 6 3652 1 1 13 SER H H 2.465 -7.448 9.029 1.00 . A A . 13 SER H 1 1 6 3653 1 1 13 SER HA H -0.046 -8.359 8.197 1.00 . A A . 13 SER HA 1 1 6 3654 1 1 13 SER HB2 H 1.631 -8.413 10.622 1.00 . A A . 13 SER HB2 1 1 6 3655 1 1 13 SER HB3 H -0.079 -8.707 10.924 1.00 . A A . 13 SER HB3 1 1 6 3656 1 1 13 SER HG H 1.633 -10.068 9.111 1.00 . A A . 13 SER HG 1 1 6 3657 1 1 13 SER N N 1.617 -7.125 8.658 1.00 . A A . 13 SER N 1 1 6 3658 1 1 13 SER O O -1.742 -6.608 8.900 1.00 . A A . 13 SER O 1 1 6 3659 1 1 13 SER OG O 0.855 -10.053 9.674 1.00 . A A . 13 SER OG 1 1 6 3660 1 1 14 GLN C C -1.206 -3.719 10.220 1.00 . A A . 14 GLN C 1 1 6 3661 1 1 14 GLN CA C -1.358 -5.009 11.028 1.00 . A A . 14 GLN CA 1 1 6 3662 1 1 14 GLN CB C -0.973 -4.771 12.488 1.00 . A A . 14 GLN CB 1 1 6 3663 1 1 14 GLN CD C -2.831 -5.261 14.083 1.00 . A A . 14 GLN CD 1 1 6 3664 1 1 14 GLN CG C -2.164 -4.173 13.241 1.00 . A A . 14 GLN CG 1 1 6 3665 1 1 14 GLN H H 0.459 -6.166 10.996 1.00 . A A . 14 GLN H 1 1 6 3666 1 1 14 GLN HA H -2.370 -5.377 10.966 1.00 . A A . 14 GLN HA 1 1 6 3667 1 1 14 GLN HB2 H -0.691 -5.711 12.942 1.00 . A A . 14 GLN HB2 1 1 6 3668 1 1 14 GLN HB3 H -0.140 -4.086 12.533 1.00 . A A . 14 GLN HB3 1 1 6 3669 1 1 14 GLN HE21 H -1.115 -5.942 14.814 1.00 . A A . 14 GLN HE21 1 1 6 3670 1 1 14 GLN HE22 H -2.505 -6.753 15.353 1.00 . A A . 14 GLN HE22 1 1 6 3671 1 1 14 GLN HG2 H -1.818 -3.379 13.886 1.00 . A A . 14 GLN HG2 1 1 6 3672 1 1 14 GLN HG3 H -2.878 -3.779 12.534 1.00 . A A . 14 GLN HG3 1 1 6 3673 1 1 14 GLN N N -0.395 -6.035 10.536 1.00 . A A . 14 GLN N 1 1 6 3674 1 1 14 GLN NE2 N -2.089 -6.051 14.810 1.00 . A A . 14 GLN NE2 1 1 6 3675 1 1 14 GLN O O -2.154 -2.984 10.014 1.00 . A A . 14 GLN O 1 1 6 3676 1 1 14 GLN OE1 O -4.039 -5.393 14.082 1.00 . A A . 14 GLN OE1 1 1 6 3677 1 1 15 CYS C C -0.716 -2.173 7.758 1.00 . A A . 15 CYS C 1 1 6 3678 1 1 15 CYS CA C 0.208 -2.194 8.978 1.00 . A A . 15 CYS CA 1 1 6 3679 1 1 15 CYS CB C 1.677 -2.257 8.552 1.00 . A A . 15 CYS CB 1 1 6 3680 1 1 15 CYS H H 0.733 -4.046 9.949 1.00 . A A . 15 CYS H 1 1 6 3681 1 1 15 CYS HA H 0.041 -1.323 9.592 1.00 . A A . 15 CYS HA 1 1 6 3682 1 1 15 CYS HB2 H 2.055 -3.256 8.715 1.00 . A A . 15 CYS HB2 1 1 6 3683 1 1 15 CYS HB3 H 1.760 -2.006 7.505 1.00 . A A . 15 CYS HB3 1 1 6 3684 1 1 15 CYS N N -0.016 -3.438 9.767 1.00 . A A . 15 CYS N 1 1 6 3685 1 1 15 CYS O O -1.083 -1.127 7.262 1.00 . A A . 15 CYS O 1 1 6 3686 1 1 15 CYS SG S 2.642 -1.081 9.535 1.00 . A A . 15 CYS SG 1 1 6 3687 1 1 16 LEU C C -3.382 -3.900 6.496 1.00 . A A . 16 LEU C 1 1 6 3688 1 1 16 LEU CA C -2.002 -3.370 6.090 1.00 . A A . 16 LEU CA 1 1 6 3689 1 1 16 LEU CB C -1.323 -4.331 5.114 1.00 . A A . 16 LEU CB 1 1 6 3690 1 1 16 LEU CD1 C 0.946 -3.280 5.208 1.00 . A A . 16 LEU CD1 1 1 6 3691 1 1 16 LEU CD2 C 0.183 -4.429 3.125 1.00 . A A . 16 LEU CD2 1 1 6 3692 1 1 16 LEU CG C -0.260 -3.574 4.313 1.00 . A A . 16 LEU CG 1 1 6 3693 1 1 16 LEU H H -0.793 -4.156 7.691 1.00 . A A . 16 LEU H 1 1 6 3694 1 1 16 LEU HA H -2.090 -2.393 5.644 1.00 . A A . 16 LEU HA 1 1 6 3695 1 1 16 LEU HB2 H -0.855 -5.134 5.666 1.00 . A A . 16 LEU HB2 1 1 6 3696 1 1 16 LEU HB3 H -2.059 -4.737 4.437 1.00 . A A . 16 LEU HB3 1 1 6 3697 1 1 16 LEU HD11 H 1.840 -3.234 4.604 1.00 . A A . 16 LEU HD11 1 1 6 3698 1 1 16 LEU HD12 H 1.049 -4.065 5.943 1.00 . A A . 16 LEU HD12 1 1 6 3699 1 1 16 LEU HD13 H 0.800 -2.334 5.709 1.00 . A A . 16 LEU HD13 1 1 6 3700 1 1 16 LEU HD21 H 1.143 -4.875 3.340 1.00 . A A . 16 LEU HD21 1 1 6 3701 1 1 16 LEU HD22 H 0.264 -3.807 2.245 1.00 . A A . 16 LEU HD22 1 1 6 3702 1 1 16 LEU HD23 H -0.545 -5.208 2.950 1.00 . A A . 16 LEU HD23 1 1 6 3703 1 1 16 LEU HG H -0.676 -2.643 3.956 1.00 . A A . 16 LEU HG 1 1 6 3704 1 1 16 LEU N N -1.098 -3.323 7.274 1.00 . A A . 16 LEU N 1 1 6 3705 1 1 16 LEU O O -4.347 -3.765 5.771 1.00 . A A . 16 LEU O 1 1 6 3706 1 1 17 SER C C -5.650 -3.932 8.713 1.00 . A A . 17 SER C 1 1 6 3707 1 1 17 SER CA C -4.802 -5.043 8.097 1.00 . A A . 17 SER CA 1 1 6 3708 1 1 17 SER CB C -4.472 -6.094 9.155 1.00 . A A . 17 SER CB 1 1 6 3709 1 1 17 SER H H -2.694 -4.607 8.222 1.00 . A A . 17 SER H 1 1 6 3710 1 1 17 SER HA H -5.321 -5.502 7.272 1.00 . A A . 17 SER HA 1 1 6 3711 1 1 17 SER HB2 H -3.806 -6.829 8.738 1.00 . A A . 17 SER HB2 1 1 6 3712 1 1 17 SER HB3 H -3.996 -5.614 9.999 1.00 . A A . 17 SER HB3 1 1 6 3713 1 1 17 SER HG H -6.217 -6.878 8.794 1.00 . A A . 17 SER HG 1 1 6 3714 1 1 17 SER N N -3.483 -4.505 7.651 1.00 . A A . 17 SER N 1 1 6 3715 1 1 17 SER O O -6.825 -4.108 8.968 1.00 . A A . 17 SER O 1 1 6 3716 1 1 17 SER OG O -5.673 -6.732 9.571 1.00 . A A . 17 SER OG 1 1 6 3717 1 1 18 ALA C C -5.426 -0.336 9.019 1.00 . A A . 18 ALA C 1 1 6 3718 1 1 18 ALA CA C -5.856 -1.691 9.584 1.00 . A A . 18 ALA CA 1 1 6 3719 1 1 18 ALA CB C -5.537 -1.778 11.075 1.00 . A A . 18 ALA CB 1 1 6 3720 1 1 18 ALA H H -4.115 -2.670 8.771 1.00 . A A . 18 ALA H 1 1 6 3721 1 1 18 ALA HA H -6.911 -1.848 9.425 1.00 . A A . 18 ALA HA 1 1 6 3722 1 1 18 ALA HB1 H -4.482 -1.970 11.206 1.00 . A A . 18 ALA HB1 1 1 6 3723 1 1 18 ALA HB2 H -6.106 -2.583 11.518 1.00 . A A . 18 ALA HB2 1 1 6 3724 1 1 18 ALA HB3 H -5.797 -0.847 11.553 1.00 . A A . 18 ALA HB3 1 1 6 3725 1 1 18 ALA N N -5.069 -2.794 8.969 1.00 . A A . 18 ALA N 1 1 6 3726 1 1 18 ALA O O -4.991 0.532 9.750 1.00 . A A . 18 ALA O 1 1 6 3727 1 1 19 PRO C C -6.223 2.204 7.352 1.00 . A A . 19 PRO C 1 1 6 3728 1 1 19 PRO CA C -5.217 1.069 7.056 1.00 . A A . 19 PRO CA 1 1 6 3729 1 1 19 PRO CB C -5.197 0.698 5.574 1.00 . A A . 19 PRO CB 1 1 6 3730 1 1 19 PRO CD C -6.088 -1.203 6.787 1.00 . A A . 19 PRO CD 1 1 6 3731 1 1 19 PRO CG C -6.081 -0.503 5.448 1.00 . A A . 19 PRO CG 1 1 6 3732 1 1 19 PRO HA H -4.227 1.373 7.357 1.00 . A A . 19 PRO HA 1 1 6 3733 1 1 19 PRO HB2 H -5.586 1.515 4.981 1.00 . A A . 19 PRO HB2 1 1 6 3734 1 1 19 PRO HB3 H -4.195 0.452 5.262 1.00 . A A . 19 PRO HB3 1 1 6 3735 1 1 19 PRO HD2 H -7.095 -1.497 7.053 1.00 . A A . 19 PRO HD2 1 1 6 3736 1 1 19 PRO HD3 H -5.435 -2.060 6.770 1.00 . A A . 19 PRO HD3 1 1 6 3737 1 1 19 PRO HG2 H -7.080 -0.198 5.175 1.00 . A A . 19 PRO HG2 1 1 6 3738 1 1 19 PRO HG3 H -5.686 -1.169 4.697 1.00 . A A . 19 PRO HG3 1 1 6 3739 1 1 19 PRO N N -5.578 -0.197 7.730 1.00 . A A . 19 PRO N 1 1 6 3740 1 1 19 PRO O O -5.835 3.356 7.361 1.00 . A A . 19 PRO O 1 1 6 3741 1 1 20 PRO C C -8.303 3.433 9.331 1.00 . A A . 20 PRO C 1 1 6 3742 1 1 20 PRO CA C -8.470 2.942 7.891 1.00 . A A . 20 PRO CA 1 1 6 3743 1 1 20 PRO CB C -9.815 2.247 7.717 1.00 . A A . 20 PRO CB 1 1 6 3744 1 1 20 PRO CD C -8.097 0.542 7.616 1.00 . A A . 20 PRO CD 1 1 6 3745 1 1 20 PRO CG C -9.544 0.798 7.959 1.00 . A A . 20 PRO CG 1 1 6 3746 1 1 20 PRO HA H -8.379 3.758 7.192 1.00 . A A . 20 PRO HA 1 1 6 3747 1 1 20 PRO HB2 H -10.527 2.624 8.439 1.00 . A A . 20 PRO HB2 1 1 6 3748 1 1 20 PRO HB3 H -10.186 2.391 6.714 1.00 . A A . 20 PRO HB3 1 1 6 3749 1 1 20 PRO HD2 H -7.642 -0.081 8.373 1.00 . A A . 20 PRO HD2 1 1 6 3750 1 1 20 PRO HD3 H -8.022 0.081 6.649 1.00 . A A . 20 PRO HD3 1 1 6 3751 1 1 20 PRO HG2 H -9.725 0.560 8.998 1.00 . A A . 20 PRO HG2 1 1 6 3752 1 1 20 PRO HG3 H -10.177 0.194 7.328 1.00 . A A . 20 PRO HG3 1 1 6 3753 1 1 20 PRO N N -7.480 1.878 7.595 1.00 . A A . 20 PRO N 1 1 6 3754 1 1 20 PRO O O -8.532 4.587 9.636 1.00 . A A . 20 PRO O 1 1 6 3755 1 1 21 PHE C C -6.331 3.542 11.853 1.00 . A A . 21 PHE C 1 1 6 3756 1 1 21 PHE CA C -7.732 2.968 11.643 1.00 . A A . 21 PHE CA 1 1 6 3757 1 1 21 PHE CB C -7.908 1.682 12.456 1.00 . A A . 21 PHE CB 1 1 6 3758 1 1 21 PHE CD1 C -10.330 1.417 11.811 1.00 . A A . 21 PHE CD1 1 1 6 3759 1 1 21 PHE CD2 C -8.814 -0.437 11.433 1.00 . A A . 21 PHE CD2 1 1 6 3760 1 1 21 PHE CE1 C -11.384 0.663 11.280 1.00 . A A . 21 PHE CE1 1 1 6 3761 1 1 21 PHE CE2 C -9.866 -1.190 10.902 1.00 . A A . 21 PHE CE2 1 1 6 3762 1 1 21 PHE CG C -9.046 0.867 11.888 1.00 . A A . 21 PHE CG 1 1 6 3763 1 1 21 PHE CZ C -11.152 -0.641 10.826 1.00 . A A . 21 PHE CZ 1 1 6 3764 1 1 21 PHE H H -7.737 1.634 9.949 1.00 . A A . 21 PHE H 1 1 6 3765 1 1 21 PHE HA H -8.483 3.689 11.926 1.00 . A A . 21 PHE HA 1 1 6 3766 1 1 21 PHE HB2 H -6.996 1.103 12.414 1.00 . A A . 21 PHE HB2 1 1 6 3767 1 1 21 PHE HB3 H -8.126 1.933 13.484 1.00 . A A . 21 PHE HB3 1 1 6 3768 1 1 21 PHE HD1 H -10.509 2.423 12.163 1.00 . A A . 21 PHE HD1 1 1 6 3769 1 1 21 PHE HD2 H -7.822 -0.860 11.493 1.00 . A A . 21 PHE HD2 1 1 6 3770 1 1 21 PHE HE1 H -12.375 1.087 11.221 1.00 . A A . 21 PHE HE1 1 1 6 3771 1 1 21 PHE HE2 H -9.687 -2.195 10.552 1.00 . A A . 21 PHE HE2 1 1 6 3772 1 1 21 PHE HZ H -11.964 -1.222 10.416 1.00 . A A . 21 PHE HZ 1 1 6 3773 1 1 21 PHE N N -7.911 2.561 10.218 1.00 . A A . 21 PHE N 1 1 6 3774 1 1 21 PHE O O -5.948 3.881 12.955 1.00 . A A . 21 PHE O 1 1 6 3775 1 1 22 VAL C C -3.904 5.243 9.869 1.00 . A A . 22 VAL C 1 1 6 3776 1 1 22 VAL CA C -4.181 4.196 10.956 1.00 . A A . 22 VAL CA 1 1 6 3777 1 1 22 VAL CB C -3.256 2.988 10.796 1.00 . A A . 22 VAL CB 1 1 6 3778 1 1 22 VAL CG1 C -3.766 1.826 11.654 1.00 . A A . 22 VAL CG1 1 1 6 3779 1 1 22 VAL CG2 C -3.223 2.560 9.326 1.00 . A A . 22 VAL CG2 1 1 6 3780 1 1 22 VAL H H -5.883 3.366 9.927 1.00 . A A . 22 VAL H 1 1 6 3781 1 1 22 VAL HA H -4.053 4.629 11.935 1.00 . A A . 22 VAL HA 1 1 6 3782 1 1 22 VAL HB H -2.260 3.257 11.115 1.00 . A A . 22 VAL HB 1 1 6 3783 1 1 22 VAL HG11 H -3.271 0.914 11.354 1.00 . A A . 22 VAL HG11 1 1 6 3784 1 1 22 VAL HG12 H -4.831 1.717 11.520 1.00 . A A . 22 VAL HG12 1 1 6 3785 1 1 22 VAL HG13 H -3.554 2.026 12.694 1.00 . A A . 22 VAL HG13 1 1 6 3786 1 1 22 VAL HG21 H -4.122 2.901 8.833 1.00 . A A . 22 VAL HG21 1 1 6 3787 1 1 22 VAL HG22 H -3.165 1.483 9.265 1.00 . A A . 22 VAL HG22 1 1 6 3788 1 1 22 VAL HG23 H -2.362 2.995 8.843 1.00 . A A . 22 VAL HG23 1 1 6 3789 1 1 22 VAL N N -5.559 3.648 10.808 1.00 . A A . 22 VAL N 1 1 6 3790 1 1 22 VAL O O -4.811 5.757 9.245 1.00 . A A . 22 VAL O 1 1 6 3791 1 1 23 GLN C C -1.113 6.153 7.782 1.00 . A A . 23 GLN C 1 1 6 3792 1 1 23 GLN CA C -2.332 6.591 8.603 1.00 . A A . 23 GLN CA 1 1 6 3793 1 1 23 GLN CB C -2.020 7.863 9.394 1.00 . A A . 23 GLN CB 1 1 6 3794 1 1 23 GLN CD C -1.412 10.264 9.072 1.00 . A A . 23 GLN CD 1 1 6 3795 1 1 23 GLN CG C -1.255 8.851 8.509 1.00 . A A . 23 GLN CG 1 1 6 3796 1 1 23 GLN H H -1.940 5.150 10.162 1.00 . A A . 23 GLN H 1 1 6 3797 1 1 23 GLN HA H -3.181 6.757 7.959 1.00 . A A . 23 GLN HA 1 1 6 3798 1 1 23 GLN HB2 H -2.944 8.318 9.723 1.00 . A A . 23 GLN HB2 1 1 6 3799 1 1 23 GLN HB3 H -1.418 7.613 10.254 1.00 . A A . 23 GLN HB3 1 1 6 3800 1 1 23 GLN HE21 H -1.821 9.635 10.911 1.00 . A A . 23 GLN HE21 1 1 6 3801 1 1 23 GLN HE22 H -1.807 11.321 10.706 1.00 . A A . 23 GLN HE22 1 1 6 3802 1 1 23 GLN HG2 H -0.207 8.583 8.495 1.00 . A A . 23 GLN HG2 1 1 6 3803 1 1 23 GLN HG3 H -1.649 8.818 7.505 1.00 . A A . 23 GLN HG3 1 1 6 3804 1 1 23 GLN N N -2.658 5.570 9.643 1.00 . A A . 23 GLN N 1 1 6 3805 1 1 23 GLN NE2 N -1.704 10.420 10.334 1.00 . A A . 23 GLN NE2 1 1 6 3806 1 1 23 GLN O O -1.117 6.211 6.569 1.00 . A A . 23 GLN O 1 1 6 3807 1 1 23 GLN OE1 O -1.268 11.235 8.357 1.00 . A A . 23 GLN OE1 1 1 6 3808 1 1 24 CYS C C 0.859 4.064 6.832 1.00 . A A . 24 CYS C 1 1 6 3809 1 1 24 CYS CA C 1.156 5.298 7.694 1.00 . A A . 24 CYS CA 1 1 6 3810 1 1 24 CYS CB C 2.191 4.978 8.787 1.00 . A A . 24 CYS CB 1 1 6 3811 1 1 24 CYS H H -0.080 5.702 9.414 1.00 . A A . 24 CYS H 1 1 6 3812 1 1 24 CYS HA H 1.519 6.104 7.072 1.00 . A A . 24 CYS HA 1 1 6 3813 1 1 24 CYS HB2 H 3.183 5.035 8.367 1.00 . A A . 24 CYS HB2 1 1 6 3814 1 1 24 CYS HB3 H 2.100 5.703 9.582 1.00 . A A . 24 CYS HB3 1 1 6 3815 1 1 24 CYS N N -0.066 5.727 8.436 1.00 . A A . 24 CYS N 1 1 6 3816 1 1 24 CYS O O -0.223 3.510 6.869 1.00 . A A . 24 CYS O 1 1 6 3817 1 1 24 CYS SG S 1.923 3.312 9.458 1.00 . A A . 24 CYS SG 1 1 6 3818 1 1 25 GLY C C 2.942 1.764 4.927 1.00 . A A . 25 GLY C 1 1 6 3819 1 1 25 GLY CA C 1.600 2.458 5.171 1.00 . A A . 25 GLY CA 1 1 6 3820 1 1 25 GLY H H 2.672 4.113 6.034 1.00 . A A . 25 GLY H 1 1 6 3821 1 1 25 GLY HA2 H 0.918 1.770 5.650 1.00 . A A . 25 GLY HA2 1 1 6 3822 1 1 25 GLY HA3 H 1.188 2.778 4.225 1.00 . A A . 25 GLY HA3 1 1 6 3823 1 1 25 GLY N N 1.812 3.643 6.051 1.00 . A A . 25 GLY N 1 1 6 3824 1 1 25 GLY O O 3.962 2.179 5.428 1.00 . A A . 25 GLY O 1 1 6 3825 1 1 26 TRP C C 4.900 0.606 2.644 1.00 . A A . 26 TRP C 1 1 6 3826 1 1 26 TRP CA C 4.231 0.000 3.883 1.00 . A A . 26 TRP CA 1 1 6 3827 1 1 26 TRP CB C 3.810 -1.448 3.622 1.00 . A A . 26 TRP CB 1 1 6 3828 1 1 26 TRP CD1 C 5.702 -2.880 2.750 1.00 . A A . 26 TRP CD1 1 1 6 3829 1 1 26 TRP CD2 C 5.580 -2.882 4.996 1.00 . A A . 26 TRP CD2 1 1 6 3830 1 1 26 TRP CE2 C 6.667 -3.718 4.649 1.00 . A A . 26 TRP CE2 1 1 6 3831 1 1 26 TRP CE3 C 5.285 -2.710 6.360 1.00 . A A . 26 TRP CE3 1 1 6 3832 1 1 26 TRP CG C 4.984 -2.360 3.773 1.00 . A A . 26 TRP CG 1 1 6 3833 1 1 26 TRP CH2 C 7.128 -4.181 6.971 1.00 . A A . 26 TRP CH2 1 1 6 3834 1 1 26 TRP CZ2 C 7.435 -4.361 5.619 1.00 . A A . 26 TRP CZ2 1 1 6 3835 1 1 26 TRP CZ3 C 6.055 -3.356 7.341 1.00 . A A . 26 TRP CZ3 1 1 6 3836 1 1 26 TRP H H 2.114 0.396 3.752 1.00 . A A . 26 TRP H 1 1 6 3837 1 1 26 TRP HA H 4.888 0.051 4.737 1.00 . A A . 26 TRP HA 1 1 6 3838 1 1 26 TRP HB2 H 3.045 -1.731 4.330 1.00 . A A . 26 TRP HB2 1 1 6 3839 1 1 26 TRP HB3 H 3.418 -1.532 2.621 1.00 . A A . 26 TRP HB3 1 1 6 3840 1 1 26 TRP HD1 H 5.523 -2.696 1.701 1.00 . A A . 26 TRP HD1 1 1 6 3841 1 1 26 TRP HE1 H 7.360 -4.180 2.738 1.00 . A A . 26 TRP HE1 1 1 6 3842 1 1 26 TRP HE3 H 4.463 -2.076 6.652 1.00 . A A . 26 TRP HE3 1 1 6 3843 1 1 26 TRP HH2 H 7.716 -4.674 7.730 1.00 . A A . 26 TRP HH2 1 1 6 3844 1 1 26 TRP HZ2 H 8.262 -4.992 5.327 1.00 . A A . 26 TRP HZ2 1 1 6 3845 1 1 26 TRP HZ3 H 5.820 -3.217 8.386 1.00 . A A . 26 TRP HZ3 1 1 6 3846 1 1 26 TRP N N 2.950 0.714 4.158 1.00 . A A . 26 TRP N 1 1 6 3847 1 1 26 TRP NE1 N 6.700 -3.685 3.268 1.00 . A A . 26 TRP NE1 1 1 6 3848 1 1 26 TRP O O 4.248 0.901 1.659 1.00 . A A . 26 TRP O 1 1 6 3849 1 1 27 CYS C C 8.240 0.767 1.247 1.00 . A A . 27 CYS C 1 1 6 3850 1 1 27 CYS CA C 6.868 1.410 1.495 1.00 . A A . 27 CYS CA 1 1 6 3851 1 1 27 CYS CB C 7.018 2.895 1.844 1.00 . A A . 27 CYS CB 1 1 6 3852 1 1 27 CYS H H 6.708 0.580 3.484 1.00 . A A . 27 CYS H 1 1 6 3853 1 1 27 CYS HA H 6.246 1.306 0.621 1.00 . A A . 27 CYS HA 1 1 6 3854 1 1 27 CYS HB2 H 6.057 3.380 1.768 1.00 . A A . 27 CYS HB2 1 1 6 3855 1 1 27 CYS HB3 H 7.388 2.988 2.855 1.00 . A A . 27 CYS HB3 1 1 6 3856 1 1 27 CYS N N 6.192 0.810 2.681 1.00 . A A . 27 CYS N 1 1 6 3857 1 1 27 CYS O O 9.231 1.126 1.852 1.00 . A A . 27 CYS O 1 1 6 3858 1 1 27 CYS SG S 8.183 3.684 0.701 1.00 . A A . 27 CYS SG 1 1 6 3859 1 1 28 HIS C C 10.265 -1.555 1.150 1.00 . A A . 28 HIS C 1 1 6 3860 1 1 28 HIS CA C 9.586 -0.829 -0.031 1.00 . A A . 28 HIS CA 1 1 6 3861 1 1 28 HIS CB C 10.482 0.302 -0.537 1.00 . A A . 28 HIS CB 1 1 6 3862 1 1 28 HIS CD2 C 12.650 -1.003 -1.243 1.00 . A A . 28 HIS CD2 1 1 6 3863 1 1 28 HIS CE1 C 12.511 -0.712 -3.385 1.00 . A A . 28 HIS CE1 1 1 6 3864 1 1 28 HIS CG C 11.518 -0.263 -1.470 1.00 . A A . 28 HIS CG 1 1 6 3865 1 1 28 HIS H H 7.479 -0.402 -0.156 1.00 . A A . 28 HIS H 1 1 6 3866 1 1 28 HIS HA H 9.419 -1.527 -0.834 1.00 . A A . 28 HIS HA 1 1 6 3867 1 1 28 HIS HB2 H 9.881 1.029 -1.062 1.00 . A A . 28 HIS HB2 1 1 6 3868 1 1 28 HIS HB3 H 10.972 0.777 0.300 1.00 . A A . 28 HIS HB3 1 1 6 3869 1 1 28 HIS HD1 H 10.753 0.398 -3.331 1.00 . A A . 28 HIS HD1 1 1 6 3870 1 1 28 HIS HD2 H 13.002 -1.320 -0.272 1.00 . A A . 28 HIS HD2 1 1 6 3871 1 1 28 HIS HE1 H 12.719 -0.746 -4.444 1.00 . A A . 28 HIS HE1 1 1 6 3872 1 1 28 HIS N N 8.296 -0.159 0.328 1.00 . A A . 28 HIS N 1 1 6 3873 1 1 28 HIS ND1 N 11.448 -0.089 -2.844 1.00 . A A . 28 HIS ND1 1 1 6 3874 1 1 28 HIS NE2 N 13.277 -1.286 -2.453 1.00 . A A . 28 HIS NE2 1 1 6 3875 1 1 28 HIS O O 11.277 -2.201 0.958 1.00 . A A . 28 HIS O 1 1 6 3876 1 1 29 ASP C C 9.834 -1.801 4.839 1.00 . A A . 29 ASP C 1 1 6 3877 1 1 29 ASP CA C 10.433 -2.195 3.482 1.00 . A A . 29 ASP CA 1 1 6 3878 1 1 29 ASP CB C 11.909 -1.769 3.391 1.00 . A A . 29 ASP CB 1 1 6 3879 1 1 29 ASP CG C 12.578 -1.841 4.769 1.00 . A A . 29 ASP CG 1 1 6 3880 1 1 29 ASP H H 8.938 -0.966 2.521 1.00 . A A . 29 ASP H 1 1 6 3881 1 1 29 ASP HA H 10.357 -3.261 3.342 1.00 . A A . 29 ASP HA 1 1 6 3882 1 1 29 ASP HB2 H 12.423 -2.429 2.712 1.00 . A A . 29 ASP HB2 1 1 6 3883 1 1 29 ASP HB3 H 11.966 -0.756 3.019 1.00 . A A . 29 ASP HB3 1 1 6 3884 1 1 29 ASP N N 9.752 -1.477 2.355 1.00 . A A . 29 ASP N 1 1 6 3885 1 1 29 ASP O O 9.283 -2.620 5.540 1.00 . A A . 29 ASP O 1 1 6 3886 1 1 29 ASP OD1 O 12.428 -0.897 5.529 1.00 . A A . 29 ASP OD1 1 1 6 3887 1 1 29 ASP OD2 O 13.229 -2.837 5.039 1.00 . A A . 29 ASP OD2 1 1 6 3888 1 1 30 LYS C C 7.993 0.394 6.410 1.00 . A A . 30 LYS C 1 1 6 3889 1 1 30 LYS CA C 9.414 -0.149 6.553 1.00 . A A . 30 LYS CA 1 1 6 3890 1 1 30 LYS CB C 10.360 0.948 7.045 1.00 . A A . 30 LYS CB 1 1 6 3891 1 1 30 LYS CD C 11.667 1.772 9.011 1.00 . A A . 30 LYS CD 1 1 6 3892 1 1 30 LYS CE C 11.147 2.621 10.172 1.00 . A A . 30 LYS CE 1 1 6 3893 1 1 30 LYS CG C 10.574 0.803 8.554 1.00 . A A . 30 LYS CG 1 1 6 3894 1 1 30 LYS H H 10.426 0.087 4.662 1.00 . A A . 30 LYS H 1 1 6 3895 1 1 30 LYS HA H 9.429 -0.979 7.240 1.00 . A A . 30 LYS HA 1 1 6 3896 1 1 30 LYS HB2 H 11.309 0.860 6.536 1.00 . A A . 30 LYS HB2 1 1 6 3897 1 1 30 LYS HB3 H 9.928 1.916 6.838 1.00 . A A . 30 LYS HB3 1 1 6 3898 1 1 30 LYS HD2 H 12.532 1.209 9.336 1.00 . A A . 30 LYS HD2 1 1 6 3899 1 1 30 LYS HD3 H 11.945 2.416 8.191 1.00 . A A . 30 LYS HD3 1 1 6 3900 1 1 30 LYS HE2 H 11.050 3.654 9.865 1.00 . A A . 30 LYS HE2 1 1 6 3901 1 1 30 LYS HE3 H 10.200 2.241 10.523 1.00 . A A . 30 LYS HE3 1 1 6 3902 1 1 30 LYS HG2 H 9.653 1.028 9.072 1.00 . A A . 30 LYS HG2 1 1 6 3903 1 1 30 LYS HG3 H 10.876 -0.209 8.779 1.00 . A A . 30 LYS HG3 1 1 6 3904 1 1 30 LYS HZ1 H 12.558 1.521 11.235 1.00 . A A . 30 LYS HZ1 1 1 6 3905 1 1 30 LYS HZ2 H 11.746 2.689 12.164 1.00 . A A . 30 LYS HZ2 1 1 6 3906 1 1 30 LYS HZ3 H 12.950 3.162 11.062 1.00 . A A . 30 LYS HZ3 1 1 6 3907 1 1 30 LYS N N 9.961 -0.563 5.228 1.00 . A A . 30 LYS N 1 1 6 3908 1 1 30 LYS NZ N 12.178 2.489 11.239 1.00 . A A . 30 LYS NZ 1 1 6 3909 1 1 30 LYS O O 7.547 0.727 5.329 1.00 . A A . 30 LYS O 1 1 6 3910 1 1 31 CYS C C 5.916 2.539 7.639 1.00 . A A . 31 CYS C 1 1 6 3911 1 1 31 CYS CA C 5.895 1.023 7.439 1.00 . A A . 31 CYS CA 1 1 6 3912 1 1 31 CYS CB C 5.150 0.337 8.587 1.00 . A A . 31 CYS CB 1 1 6 3913 1 1 31 CYS H H 7.667 0.225 8.362 1.00 . A A . 31 CYS H 1 1 6 3914 1 1 31 CYS HA H 5.436 0.772 6.497 1.00 . A A . 31 CYS HA 1 1 6 3915 1 1 31 CYS HB2 H 5.556 -0.653 8.738 1.00 . A A . 31 CYS HB2 1 1 6 3916 1 1 31 CYS HB3 H 5.266 0.916 9.490 1.00 . A A . 31 CYS HB3 1 1 6 3917 1 1 31 CYS N N 7.283 0.493 7.502 1.00 . A A . 31 CYS N 1 1 6 3918 1 1 31 CYS O O 6.095 3.034 8.734 1.00 . A A . 31 CYS O 1 1 6 3919 1 1 31 CYS SG S 3.391 0.210 8.172 1.00 . A A . 31 CYS SG 1 1 6 3920 1 1 32 VAL C C 4.781 5.355 5.664 1.00 . A A . 32 VAL C 1 1 6 3921 1 1 32 VAL CA C 5.746 4.761 6.688 1.00 . A A . 32 VAL CA 1 1 6 3922 1 1 32 VAL CB C 7.185 5.173 6.376 1.00 . A A . 32 VAL CB 1 1 6 3923 1 1 32 VAL CG1 C 8.138 4.439 7.319 1.00 . A A . 32 VAL CG1 1 1 6 3924 1 1 32 VAL CG2 C 7.515 4.805 4.928 1.00 . A A . 32 VAL CG2 1 1 6 3925 1 1 32 VAL H H 5.597 2.853 5.711 1.00 . A A . 32 VAL H 1 1 6 3926 1 1 32 VAL HA H 5.479 5.071 7.686 1.00 . A A . 32 VAL HA 1 1 6 3927 1 1 32 VAL HB H 7.292 6.240 6.513 1.00 . A A . 32 VAL HB 1 1 6 3928 1 1 32 VAL HG11 H 8.061 3.374 7.153 1.00 . A A . 32 VAL HG11 1 1 6 3929 1 1 32 VAL HG12 H 7.876 4.663 8.343 1.00 . A A . 32 VAL HG12 1 1 6 3930 1 1 32 VAL HG13 H 9.151 4.761 7.129 1.00 . A A . 32 VAL HG13 1 1 6 3931 1 1 32 VAL HG21 H 6.642 4.382 4.454 1.00 . A A . 32 VAL HG21 1 1 6 3932 1 1 32 VAL HG22 H 8.318 4.083 4.915 1.00 . A A . 32 VAL HG22 1 1 6 3933 1 1 32 VAL HG23 H 7.820 5.692 4.393 1.00 . A A . 32 VAL HG23 1 1 6 3934 1 1 32 VAL N N 5.738 3.278 6.582 1.00 . A A . 32 VAL N 1 1 6 3935 1 1 32 VAL O O 4.204 4.649 4.861 1.00 . A A . 32 VAL O 1 1 6 3936 1 1 33 ARG C C 4.441 8.097 3.688 1.00 . A A . 33 ARG C 1 1 6 3937 1 1 33 ARG CA C 3.661 7.265 4.707 1.00 . A A . 33 ARG CA 1 1 6 3938 1 1 33 ARG CB C 2.744 8.154 5.548 1.00 . A A . 33 ARG CB 1 1 6 3939 1 1 33 ARG CD C 0.877 9.747 5.081 1.00 . A A . 33 ARG CD 1 1 6 3940 1 1 33 ARG CG C 1.402 8.330 4.834 1.00 . A A . 33 ARG CG 1 1 6 3941 1 1 33 ARG CZ C -0.162 10.180 2.934 1.00 . A A . 33 ARG CZ 1 1 6 3942 1 1 33 ARG H H 5.066 7.198 6.340 1.00 . A A . 33 ARG H 1 1 6 3943 1 1 33 ARG HA H 3.080 6.508 4.207 1.00 . A A . 33 ARG HA 1 1 6 3944 1 1 33 ARG HB2 H 2.582 7.692 6.512 1.00 . A A . 33 ARG HB2 1 1 6 3945 1 1 33 ARG HB3 H 3.206 9.117 5.684 1.00 . A A . 33 ARG HB3 1 1 6 3946 1 1 33 ARG HD2 H -0.117 9.708 5.504 1.00 . A A . 33 ARG HD2 1 1 6 3947 1 1 33 ARG HD3 H 1.545 10.287 5.733 1.00 . A A . 33 ARG HD3 1 1 6 3948 1 1 33 ARG HE H 1.586 10.967 3.454 1.00 . A A . 33 ARG HE 1 1 6 3949 1 1 33 ARG HG2 H 1.534 8.173 3.774 1.00 . A A . 33 ARG HG2 1 1 6 3950 1 1 33 ARG HG3 H 0.692 7.613 5.217 1.00 . A A . 33 ARG HG3 1 1 6 3951 1 1 33 ARG HH11 H -1.231 11.726 3.625 1.00 . A A . 33 ARG HH11 1 1 6 3952 1 1 33 ARG HH12 H -1.978 10.804 2.362 1.00 . A A . 33 ARG HH12 1 1 6 3953 1 1 33 ARG HH21 H 0.669 8.586 2.054 1.00 . A A . 33 ARG HH21 1 1 6 3954 1 1 33 ARG HH22 H -0.902 9.028 1.474 1.00 . A A . 33 ARG HH22 1 1 6 3955 1 1 33 ARG N N 4.595 6.642 5.683 1.00 . A A . 33 ARG N 1 1 6 3956 1 1 33 ARG NE N 0.847 10.388 3.736 1.00 . A A . 33 ARG NE 1 1 6 3957 1 1 33 ARG NH1 N -1.205 10.965 2.977 1.00 . A A . 33 ARG NH1 1 1 6 3958 1 1 33 ARG NH2 N -0.129 9.188 2.089 1.00 . A A . 33 ARG NH2 1 1 6 3959 1 1 33 ARG O O 5.610 8.377 3.866 1.00 . A A . 33 ARG O 1 1 6 3960 1 1 34 SER C C 5.451 10.302 2.207 1.00 . A A . 34 SER C 1 1 6 3961 1 1 34 SER CA C 4.491 9.293 1.569 1.00 . A A . 34 SER CA 1 1 6 3962 1 1 34 SER CB C 3.366 10.018 0.830 1.00 . A A . 34 SER CB 1 1 6 3963 1 1 34 SER H H 2.859 8.235 2.501 1.00 . A A . 34 SER H 1 1 6 3964 1 1 34 SER HA H 5.022 8.649 0.885 1.00 . A A . 34 SER HA 1 1 6 3965 1 1 34 SER HB2 H 3.772 10.841 0.268 1.00 . A A . 34 SER HB2 1 1 6 3966 1 1 34 SER HB3 H 2.878 9.329 0.155 1.00 . A A . 34 SER HB3 1 1 6 3967 1 1 34 SER HG H 2.426 11.472 1.715 1.00 . A A . 34 SER HG 1 1 6 3968 1 1 34 SER N N 3.800 8.483 2.618 1.00 . A A . 34 SER N 1 1 6 3969 1 1 34 SER O O 6.443 10.686 1.620 1.00 . A A . 34 SER O 1 1 6 3970 1 1 34 SER OG O 2.430 10.515 1.777 1.00 . A A . 34 SER OG 1 1 6 3971 1 1 35 GLU C C 7.474 11.151 4.222 1.00 . A A . 35 GLU C 1 1 6 3972 1 1 35 GLU CA C 6.058 11.717 4.081 1.00 . A A . 35 GLU CA 1 1 6 3973 1 1 35 GLU CB C 5.434 11.937 5.459 1.00 . A A . 35 GLU CB 1 1 6 3974 1 1 35 GLU CD C 5.112 13.792 7.107 1.00 . A A . 35 GLU CD 1 1 6 3975 1 1 35 GLU CG C 5.066 13.414 5.624 1.00 . A A . 35 GLU CG 1 1 6 3976 1 1 35 GLU H H 4.358 10.413 3.861 1.00 . A A . 35 GLU H 1 1 6 3977 1 1 35 GLU HA H 6.077 12.647 3.533 1.00 . A A . 35 GLU HA 1 1 6 3978 1 1 35 GLU HB2 H 4.544 11.331 5.551 1.00 . A A . 35 GLU HB2 1 1 6 3979 1 1 35 GLU HB3 H 6.143 11.657 6.224 1.00 . A A . 35 GLU HB3 1 1 6 3980 1 1 35 GLU HG2 H 5.769 14.022 5.075 1.00 . A A . 35 GLU HG2 1 1 6 3981 1 1 35 GLU HG3 H 4.070 13.582 5.243 1.00 . A A . 35 GLU HG3 1 1 6 3982 1 1 35 GLU N N 5.164 10.733 3.405 1.00 . A A . 35 GLU N 1 1 6 3983 1 1 35 GLU O O 8.450 11.867 4.119 1.00 . A A . 35 GLU O 1 1 6 3984 1 1 35 GLU OE1 O 4.137 13.534 7.794 1.00 . A A . 35 GLU OE1 1 1 6 3985 1 1 35 GLU OE2 O 6.119 14.337 7.528 1.00 . A A . 35 GLU OE2 1 1 6 3986 1 1 36 GLU C C 9.223 8.216 3.553 1.00 . A A . 36 GLU C 1 1 6 3987 1 1 36 GLU CA C 8.960 9.281 4.625 1.00 . A A . 36 GLU CA 1 1 6 3988 1 1 36 GLU CB C 8.957 8.650 6.017 1.00 . A A . 36 GLU CB 1 1 6 3989 1 1 36 GLU CD C 9.627 9.172 8.365 1.00 . A A . 36 GLU CD 1 1 6 3990 1 1 36 GLU CG C 10.007 9.335 6.892 1.00 . A A . 36 GLU CG 1 1 6 3991 1 1 36 GLU H H 6.804 9.309 4.554 1.00 . A A . 36 GLU H 1 1 6 3992 1 1 36 GLU HA H 9.712 10.053 4.576 1.00 . A A . 36 GLU HA 1 1 6 3993 1 1 36 GLU HB2 H 7.980 8.770 6.464 1.00 . A A . 36 GLU HB2 1 1 6 3994 1 1 36 GLU HB3 H 9.189 7.598 5.936 1.00 . A A . 36 GLU HB3 1 1 6 3995 1 1 36 GLU HG2 H 10.974 8.885 6.716 1.00 . A A . 36 GLU HG2 1 1 6 3996 1 1 36 GLU HG3 H 10.050 10.386 6.647 1.00 . A A . 36 GLU HG3 1 1 6 3997 1 1 36 GLU N N 7.600 9.874 4.468 1.00 . A A . 36 GLU N 1 1 6 3998 1 1 36 GLU O O 10.331 7.742 3.402 1.00 . A A . 36 GLU O 1 1 6 3999 1 1 36 GLU OE1 O 8.612 9.722 8.758 1.00 . A A . 36 GLU OE1 1 1 6 4000 1 1 36 GLU OE2 O 10.357 8.500 9.074 1.00 . A A . 36 GLU OE2 1 1 6 4001 1 1 37 CYS C C 9.257 7.395 0.607 1.00 . A A . 37 CYS C 1 1 6 4002 1 1 37 CYS CA C 8.432 6.804 1.753 1.00 . A A . 37 CYS CA 1 1 6 4003 1 1 37 CYS CB C 7.029 6.429 1.274 1.00 . A A . 37 CYS CB 1 1 6 4004 1 1 37 CYS H H 7.332 8.229 2.941 1.00 . A A . 37 CYS H 1 1 6 4005 1 1 37 CYS HA H 8.925 5.938 2.164 1.00 . A A . 37 CYS HA 1 1 6 4006 1 1 37 CYS HB2 H 6.474 5.993 2.091 1.00 . A A . 37 CYS HB2 1 1 6 4007 1 1 37 CYS HB3 H 6.519 7.316 0.926 1.00 . A A . 37 CYS HB3 1 1 6 4008 1 1 37 CYS N N 8.220 7.836 2.809 1.00 . A A . 37 CYS N 1 1 6 4009 1 1 37 CYS O O 8.725 7.930 -0.345 1.00 . A A . 37 CYS O 1 1 6 4010 1 1 37 CYS SG S 7.147 5.233 -0.081 1.00 . A A . 37 CYS SG 1 1 6 4011 1 1 38 LEU C C 11.489 6.912 -1.569 1.00 . A A . 38 LEU C 1 1 6 4012 1 1 38 LEU CA C 11.422 7.869 -0.378 1.00 . A A . 38 LEU CA 1 1 6 4013 1 1 38 LEU CB C 12.801 8.018 0.264 1.00 . A A . 38 LEU CB 1 1 6 4014 1 1 38 LEU CD1 C 13.429 10.134 -0.906 1.00 . A A . 38 LEU CD1 1 1 6 4015 1 1 38 LEU CD2 C 11.923 10.209 1.086 1.00 . A A . 38 LEU CD2 1 1 6 4016 1 1 38 LEU CG C 13.123 9.502 0.453 1.00 . A A . 38 LEU CG 1 1 6 4017 1 1 38 LEU H H 10.964 6.876 1.477 1.00 . A A . 38 LEU H 1 1 6 4018 1 1 38 LEU HA H 11.056 8.835 -0.690 1.00 . A A . 38 LEU HA 1 1 6 4019 1 1 38 LEU HB2 H 12.805 7.523 1.224 1.00 . A A . 38 LEU HB2 1 1 6 4020 1 1 38 LEU HB3 H 13.546 7.569 -0.376 1.00 . A A . 38 LEU HB3 1 1 6 4021 1 1 38 LEU HD11 H 14.451 9.919 -1.182 1.00 . A A . 38 LEU HD11 1 1 6 4022 1 1 38 LEU HD12 H 13.291 11.203 -0.845 1.00 . A A . 38 LEU HD12 1 1 6 4023 1 1 38 LEU HD13 H 12.762 9.727 -1.652 1.00 . A A . 38 LEU HD13 1 1 6 4024 1 1 38 LEU HD21 H 12.248 10.761 1.955 1.00 . A A . 38 LEU HD21 1 1 6 4025 1 1 38 LEU HD22 H 11.186 9.475 1.381 1.00 . A A . 38 LEU HD22 1 1 6 4026 1 1 38 LEU HD23 H 11.486 10.890 0.371 1.00 . A A . 38 LEU HD23 1 1 6 4027 1 1 38 LEU HG H 13.984 9.601 1.098 1.00 . A A . 38 LEU HG 1 1 6 4028 1 1 38 LEU N N 10.556 7.308 0.698 1.00 . A A . 38 LEU N 1 1 6 4029 1 1 38 LEU O O 12.184 7.158 -2.533 1.00 . A A . 38 LEU O 1 1 6 4030 1 1 39 SER C C 10.077 5.463 -3.855 1.00 . A A . 39 SER C 1 1 6 4031 1 1 39 SER CA C 10.803 4.862 -2.649 1.00 . A A . 39 SER CA 1 1 6 4032 1 1 39 SER CB C 10.073 3.619 -2.144 1.00 . A A . 39 SER CB 1 1 6 4033 1 1 39 SER H H 10.214 5.641 -0.727 1.00 . A A . 39 SER H 1 1 6 4034 1 1 39 SER HA H 11.821 4.614 -2.906 1.00 . A A . 39 SER HA 1 1 6 4035 1 1 39 SER HB2 H 10.593 2.734 -2.473 1.00 . A A . 39 SER HB2 1 1 6 4036 1 1 39 SER HB3 H 10.045 3.635 -1.061 1.00 . A A . 39 SER HB3 1 1 6 4037 1 1 39 SER HG H 8.332 2.786 -2.394 1.00 . A A . 39 SER HG 1 1 6 4038 1 1 39 SER N N 10.773 5.824 -1.513 1.00 . A A . 39 SER N 1 1 6 4039 1 1 39 SER O O 10.300 5.074 -4.985 1.00 . A A . 39 SER O 1 1 6 4040 1 1 39 SER OG O 8.750 3.607 -2.664 1.00 . A A . 39 SER OG 1 1 6 4041 1 1 40 GLY C C 7.050 6.504 -4.808 1.00 . A A . 40 GLY C 1 1 6 4042 1 1 40 GLY CA C 8.478 7.046 -4.753 1.00 . A A . 40 GLY CA 1 1 6 4043 1 1 40 GLY H H 9.053 6.713 -2.704 1.00 . A A . 40 GLY H 1 1 6 4044 1 1 40 GLY HA2 H 8.452 8.117 -4.609 1.00 . A A . 40 GLY HA2 1 1 6 4045 1 1 40 GLY HA3 H 8.981 6.820 -5.681 1.00 . A A . 40 GLY HA3 1 1 6 4046 1 1 40 GLY N N 9.214 6.413 -3.623 1.00 . A A . 40 GLY N 1 1 6 4047 1 1 40 GLY O O 6.175 7.098 -5.406 1.00 . A A . 40 GLY O 1 1 6 4048 1 1 41 THR C C 5.041 4.267 -2.840 1.00 . A A . 41 THR C 1 1 6 4049 1 1 41 THR CA C 5.427 4.810 -4.219 1.00 . A A . 41 THR CA 1 1 6 4050 1 1 41 THR CB C 5.486 3.678 -5.246 1.00 . A A . 41 THR CB 1 1 6 4051 1 1 41 THR CG2 C 6.404 2.568 -4.733 1.00 . A A . 41 THR CG2 1 1 6 4052 1 1 41 THR H H 7.521 4.913 -3.715 1.00 . A A . 41 THR H 1 1 6 4053 1 1 41 THR HA H 4.719 5.558 -4.539 1.00 . A A . 41 THR HA 1 1 6 4054 1 1 41 THR HB H 5.873 4.056 -6.179 1.00 . A A . 41 THR HB 1 1 6 4055 1 1 41 THR HG1 H 4.062 2.409 -4.858 1.00 . A A . 41 THR HG1 1 1 6 4056 1 1 41 THR HG21 H 5.888 1.994 -3.978 1.00 . A A . 41 THR HG21 1 1 6 4057 1 1 41 THR HG22 H 7.295 3.005 -4.307 1.00 . A A . 41 THR HG22 1 1 6 4058 1 1 41 THR HG23 H 6.678 1.920 -5.553 1.00 . A A . 41 THR HG23 1 1 6 4059 1 1 41 THR N N 6.803 5.381 -4.191 1.00 . A A . 41 THR N 1 1 6 4060 1 1 41 THR O O 5.621 3.321 -2.346 1.00 . A A . 41 THR O 1 1 6 4061 1 1 41 THR OG1 O 4.180 3.156 -5.450 1.00 . A A . 41 THR OG1 1 1 6 4062 1 1 42 TRP C C 2.528 3.321 -1.046 1.00 . A A . 42 TRP C 1 1 6 4063 1 1 42 TRP CA C 3.616 4.387 -0.879 1.00 . A A . 42 TRP CA 1 1 6 4064 1 1 42 TRP CB C 3.052 5.637 -0.203 1.00 . A A . 42 TRP CB 1 1 6 4065 1 1 42 TRP CD1 C 3.146 5.038 2.247 1.00 . A A . 42 TRP CD1 1 1 6 4066 1 1 42 TRP CD2 C 1.044 5.109 1.452 1.00 . A A . 42 TRP CD2 1 1 6 4067 1 1 42 TRP CE2 C 0.947 4.770 2.822 1.00 . A A . 42 TRP CE2 1 1 6 4068 1 1 42 TRP CE3 C -0.145 5.219 0.711 1.00 . A A . 42 TRP CE3 1 1 6 4069 1 1 42 TRP CG C 2.450 5.273 1.114 1.00 . A A . 42 TRP CG 1 1 6 4070 1 1 42 TRP CH2 C -1.459 4.664 2.684 1.00 . A A . 42 TRP CH2 1 1 6 4071 1 1 42 TRP CZ2 C -0.287 4.549 3.436 1.00 . A A . 42 TRP CZ2 1 1 6 4072 1 1 42 TRP CZ3 C -1.389 4.999 1.324 1.00 . A A . 42 TRP CZ3 1 1 6 4073 1 1 42 TRP H H 3.604 5.618 -2.646 1.00 . A A . 42 TRP H 1 1 6 4074 1 1 42 TRP HA H 4.449 3.999 -0.316 1.00 . A A . 42 TRP HA 1 1 6 4075 1 1 42 TRP HB2 H 3.847 6.351 -0.047 1.00 . A A . 42 TRP HB2 1 1 6 4076 1 1 42 TRP HB3 H 2.293 6.076 -0.834 1.00 . A A . 42 TRP HB3 1 1 6 4077 1 1 42 TRP HD1 H 4.221 5.077 2.346 1.00 . A A . 42 TRP HD1 1 1 6 4078 1 1 42 TRP HE1 H 2.504 4.533 4.186 1.00 . A A . 42 TRP HE1 1 1 6 4079 1 1 42 TRP HE3 H -0.102 5.477 -0.337 1.00 . A A . 42 TRP HE3 1 1 6 4080 1 1 42 TRP HH2 H -2.420 4.495 3.150 1.00 . A A . 42 TRP HH2 1 1 6 4081 1 1 42 TRP HZ2 H -0.335 4.292 4.484 1.00 . A A . 42 TRP HZ2 1 1 6 4082 1 1 42 TRP HZ3 H -2.295 5.088 0.745 1.00 . A A . 42 TRP HZ3 1 1 6 4083 1 1 42 TRP N N 4.058 4.860 -2.222 1.00 . A A . 42 TRP N 1 1 6 4084 1 1 42 TRP NE1 N 2.256 4.739 3.262 1.00 . A A . 42 TRP NE1 1 1 6 4085 1 1 42 TRP O O 1.545 3.534 -1.727 1.00 . A A . 42 TRP O 1 1 6 4086 1 1 43 THR C C 1.102 0.662 0.747 1.00 . A A . 43 THR C 1 1 6 4087 1 1 43 THR CA C 1.653 1.111 -0.609 1.00 . A A . 43 THR CA 1 1 6 4088 1 1 43 THR CB C 2.366 -0.048 -1.310 1.00 . A A . 43 THR CB 1 1 6 4089 1 1 43 THR CG2 C 3.423 -0.651 -0.381 1.00 . A A . 43 THR CG2 1 1 6 4090 1 1 43 THR H H 3.493 1.999 0.095 1.00 . A A . 43 THR H 1 1 6 4091 1 1 43 THR HA H 0.851 1.471 -1.232 1.00 . A A . 43 THR HA 1 1 6 4092 1 1 43 THR HB H 2.845 0.313 -2.206 1.00 . A A . 43 THR HB 1 1 6 4093 1 1 43 THR HG1 H 1.626 -1.370 -2.529 1.00 . A A . 43 THR HG1 1 1 6 4094 1 1 43 THR HG21 H 3.105 -0.542 0.646 1.00 . A A . 43 THR HG21 1 1 6 4095 1 1 43 THR HG22 H 4.363 -0.139 -0.523 1.00 . A A . 43 THR HG22 1 1 6 4096 1 1 43 THR HG23 H 3.545 -1.699 -0.609 1.00 . A A . 43 THR HG23 1 1 6 4097 1 1 43 THR N N 2.691 2.169 -0.447 1.00 . A A . 43 THR N 1 1 6 4098 1 1 43 THR O O 1.664 0.940 1.787 1.00 . A A . 43 THR O 1 1 6 4099 1 1 43 THR OG1 O 1.414 -1.045 -1.652 1.00 . A A . 43 THR OG1 1 1 6 4100 1 1 44 GLN C C -1.266 -1.877 1.783 1.00 . A A . 44 GLN C 1 1 6 4101 1 1 44 GLN CA C -0.602 -0.516 2.007 1.00 . A A . 44 GLN CA 1 1 6 4102 1 1 44 GLN CB C -1.645 0.539 2.385 1.00 . A A . 44 GLN CB 1 1 6 4103 1 1 44 GLN CD C -3.186 2.210 1.353 1.00 . A A . 44 GLN CD 1 1 6 4104 1 1 44 GLN CG C -2.547 0.830 1.184 1.00 . A A . 44 GLN CG 1 1 6 4105 1 1 44 GLN H H -0.432 -0.248 -0.121 1.00 . A A . 44 GLN H 1 1 6 4106 1 1 44 GLN HA H 0.149 -0.586 2.778 1.00 . A A . 44 GLN HA 1 1 6 4107 1 1 44 GLN HB2 H -2.244 0.173 3.207 1.00 . A A . 44 GLN HB2 1 1 6 4108 1 1 44 GLN HB3 H -1.143 1.447 2.684 1.00 . A A . 44 GLN HB3 1 1 6 4109 1 1 44 GLN HE21 H -3.690 1.902 3.248 1.00 . A A . 44 GLN HE21 1 1 6 4110 1 1 44 GLN HE22 H -4.120 3.420 2.621 1.00 . A A . 44 GLN HE22 1 1 6 4111 1 1 44 GLN HG2 H -1.960 0.812 0.278 1.00 . A A . 44 GLN HG2 1 1 6 4112 1 1 44 GLN HG3 H -3.323 0.081 1.126 1.00 . A A . 44 GLN HG3 1 1 6 4113 1 1 44 GLN N N 0.000 -0.036 0.733 1.00 . A A . 44 GLN N 1 1 6 4114 1 1 44 GLN NE2 N -3.710 2.538 2.502 1.00 . A A . 44 GLN NE2 1 1 6 4115 1 1 44 GLN O O -2.154 -2.277 2.509 1.00 . A A . 44 GLN O 1 1 6 4116 1 1 44 GLN OE1 O -3.209 2.999 0.428 1.00 . A A . 44 GLN OE1 1 1 6 4117 1 1 45 GLN C C -0.447 -4.783 -0.305 1.00 . A A . 45 GLN C 1 1 6 4118 1 1 45 GLN CA C -1.429 -3.929 0.502 1.00 . A A . 45 GLN CA 1 1 6 4119 1 1 45 GLN CB C -2.686 -3.636 -0.320 1.00 . A A . 45 GLN CB 1 1 6 4120 1 1 45 GLN CD C -3.049 -3.147 -2.746 1.00 . A A . 45 GLN CD 1 1 6 4121 1 1 45 GLN CG C -2.331 -2.693 -1.473 1.00 . A A . 45 GLN CG 1 1 6 4122 1 1 45 GLN H H -0.116 -2.248 0.208 1.00 . A A . 45 GLN H 1 1 6 4123 1 1 45 GLN HA H -1.696 -4.425 1.422 1.00 . A A . 45 GLN HA 1 1 6 4124 1 1 45 GLN HB2 H -3.081 -4.560 -0.715 1.00 . A A . 45 GLN HB2 1 1 6 4125 1 1 45 GLN HB3 H -3.427 -3.167 0.311 1.00 . A A . 45 GLN HB3 1 1 6 4126 1 1 45 GLN HE21 H -4.531 -1.839 -2.547 1.00 . A A . 45 GLN HE21 1 1 6 4127 1 1 45 GLN HE22 H -4.629 -2.844 -3.911 1.00 . A A . 45 GLN HE22 1 1 6 4128 1 1 45 GLN HG2 H -2.637 -1.688 -1.223 1.00 . A A . 45 GLN HG2 1 1 6 4129 1 1 45 GLN HG3 H -1.264 -2.713 -1.638 1.00 . A A . 45 GLN HG3 1 1 6 4130 1 1 45 GLN N N -0.835 -2.592 0.779 1.00 . A A . 45 GLN N 1 1 6 4131 1 1 45 GLN NE2 N -4.162 -2.561 -3.097 1.00 . A A . 45 GLN NE2 1 1 6 4132 1 1 45 GLN O O -0.272 -4.591 -1.491 1.00 . A A . 45 GLN O 1 1 6 4133 1 1 45 GLN OE1 O -2.592 -4.042 -3.430 1.00 . A A . 45 GLN OE1 1 1 6 4134 1 1 46 ILE C C 1.235 -7.979 0.256 1.00 . A A . 46 ILE C 1 1 6 4135 1 1 46 ILE CA C 1.167 -6.594 -0.396 1.00 . A A . 46 ILE CA 1 1 6 4136 1 1 46 ILE CB C 2.512 -5.878 -0.277 1.00 . A A . 46 ILE CB 1 1 6 4137 1 1 46 ILE CD1 C 4.513 -5.912 -1.776 1.00 . A A . 46 ILE CD1 1 1 6 4138 1 1 46 ILE CG1 C 3.609 -6.759 -0.878 1.00 . A A . 46 ILE CG1 1 1 6 4139 1 1 46 ILE CG2 C 2.825 -5.615 1.196 1.00 . A A . 46 ILE CG2 1 1 6 4140 1 1 46 ILE H H 0.036 -5.864 1.288 1.00 . A A . 46 ILE H 1 1 6 4141 1 1 46 ILE HA H 0.888 -6.682 -1.434 1.00 . A A . 46 ILE HA 1 1 6 4142 1 1 46 ILE HB H 2.468 -4.941 -0.810 1.00 . A A . 46 ILE HB 1 1 6 4143 1 1 46 ILE HD11 H 4.075 -5.840 -2.762 1.00 . A A . 46 ILE HD11 1 1 6 4144 1 1 46 ILE HD12 H 5.486 -6.375 -1.847 1.00 . A A . 46 ILE HD12 1 1 6 4145 1 1 46 ILE HD13 H 4.614 -4.923 -1.355 1.00 . A A . 46 ILE HD13 1 1 6 4146 1 1 46 ILE HG12 H 4.197 -7.194 -0.082 1.00 . A A . 46 ILE HG12 1 1 6 4147 1 1 46 ILE HG13 H 3.159 -7.546 -1.464 1.00 . A A . 46 ILE HG13 1 1 6 4148 1 1 46 ILE HG21 H 1.987 -5.116 1.660 1.00 . A A . 46 ILE HG21 1 1 6 4149 1 1 46 ILE HG22 H 3.702 -4.989 1.271 1.00 . A A . 46 ILE HG22 1 1 6 4150 1 1 46 ILE HG23 H 3.008 -6.553 1.699 1.00 . A A . 46 ILE HG23 1 1 6 4151 1 1 46 ILE N N 0.195 -5.726 0.332 1.00 . A A . 46 ILE N 1 1 6 4152 1 1 46 ILE O O 1.382 -8.984 -0.412 1.00 . A A . 46 ILE O 1 1 6 4153 1 1 47 CYS C C -0.121 -10.113 2.071 1.00 . A A . 47 CYS C 1 1 6 4154 1 1 47 CYS CA C 1.199 -9.356 2.252 1.00 . A A . 47 CYS CA 1 1 6 4155 1 1 47 CYS CB C 1.428 -9.015 3.727 1.00 . A A . 47 CYS CB 1 1 6 4156 1 1 47 CYS H H 1.020 -7.216 2.077 1.00 . A A . 47 CYS H 1 1 6 4157 1 1 47 CYS HA H 2.025 -9.940 1.876 1.00 . A A . 47 CYS HA 1 1 6 4158 1 1 47 CYS HB2 H 0.552 -8.520 4.122 1.00 . A A . 47 CYS HB2 1 1 6 4159 1 1 47 CYS HB3 H 1.608 -9.924 4.282 1.00 . A A . 47 CYS HB3 1 1 6 4160 1 1 47 CYS N N 1.134 -8.038 1.557 1.00 . A A . 47 CYS N 1 1 6 4161 1 1 47 CYS O O -1.190 -9.567 2.251 1.00 . A A . 47 CYS O 1 1 6 4162 1 1 47 CYS SG S 2.862 -7.919 3.882 1.00 . A A . 47 CYS SG 1 1 6 4163 1 1 48 LEU C C -2.138 -12.164 2.788 1.00 . A A . 48 LEU C 1 1 6 4164 1 1 48 LEU CA C -1.296 -12.163 1.509 1.00 . A A . 48 LEU CA 1 1 6 4165 1 1 48 LEU CB C -0.813 -13.578 1.187 1.00 . A A . 48 LEU CB 1 1 6 4166 1 1 48 LEU CD1 C -0.759 -13.362 -1.300 1.00 . A A . 48 LEU CD1 1 1 6 4167 1 1 48 LEU CD2 C -1.284 -15.567 -0.247 1.00 . A A . 48 LEU CD2 1 1 6 4168 1 1 48 LEU CG C -1.449 -14.050 -0.120 1.00 . A A . 48 LEU CG 1 1 6 4169 1 1 48 LEU H H 0.825 -11.784 1.564 1.00 . A A . 48 LEU H 1 1 6 4170 1 1 48 LEU HA H -1.866 -11.772 0.682 1.00 . A A . 48 LEU HA 1 1 6 4171 1 1 48 LEU HB2 H 0.263 -13.575 1.084 1.00 . A A . 48 LEU HB2 1 1 6 4172 1 1 48 LEU HB3 H -1.096 -14.246 1.986 1.00 . A A . 48 LEU HB3 1 1 6 4173 1 1 48 LEU HD11 H 0.312 -13.437 -1.183 1.00 . A A . 48 LEU HD11 1 1 6 4174 1 1 48 LEU HD12 H -1.047 -12.322 -1.328 1.00 . A A . 48 LEU HD12 1 1 6 4175 1 1 48 LEU HD13 H -1.054 -13.844 -2.222 1.00 . A A . 48 LEU HD13 1 1 6 4176 1 1 48 LEU HD21 H -0.266 -15.840 -0.011 1.00 . A A . 48 LEU HD21 1 1 6 4177 1 1 48 LEU HD22 H -1.513 -15.870 -1.258 1.00 . A A . 48 LEU HD22 1 1 6 4178 1 1 48 LEU HD23 H -1.957 -16.062 0.438 1.00 . A A . 48 LEU HD23 1 1 6 4179 1 1 48 LEU HG H -2.499 -13.798 -0.121 1.00 . A A . 48 LEU HG 1 1 6 4180 1 1 48 LEU N N -0.050 -11.366 1.708 1.00 . A A . 48 LEU N 1 1 6 4181 1 1 48 LEU O O -1.920 -11.298 3.621 1.00 . A A . 48 LEU O 1 1 6 4182 1 1 48 LEU OXT O -2.988 -13.030 2.913 1.00 . A A . 48 LEU OXT 1 1 7 4183 1 1 1 GLY C C -5.218 11.760 10.855 1.00 . A A . 1 GLY C 1 1 7 4184 1 1 1 GLY CA C -5.417 12.140 9.387 1.00 . A A . 1 GLY CA 1 1 7 4185 1 1 1 GLY H1 H -6.657 13.809 9.271 1.00 . A A . 1 GLY H1 1 1 7 4186 1 1 1 GLY H2 H -5.207 13.961 8.399 1.00 . A A . 1 GLY H2 1 1 7 4187 1 1 1 GLY H3 H -5.199 14.087 10.093 1.00 . A A . 1 GLY H3 1 1 7 4188 1 1 1 GLY HA2 H -6.277 11.617 8.992 1.00 . A A . 1 GLY HA2 1 1 7 4189 1 1 1 GLY HA3 H -4.538 11.864 8.825 1.00 . A A . 1 GLY HA3 1 1 7 4190 1 1 1 GLY N N -5.636 13.610 9.279 1.00 . A A . 1 GLY N 1 1 7 4191 1 1 1 GLY O O -5.907 12.244 11.731 1.00 . A A . 1 GLY O 1 1 7 4192 1 1 2 SER C C -2.629 10.906 12.981 1.00 . A A . 2 SER C 1 1 7 4193 1 1 2 SER CA C -4.040 10.485 12.543 1.00 . A A . 2 SER CA 1 1 7 4194 1 1 2 SER CB C -4.189 8.963 12.541 1.00 . A A . 2 SER CB 1 1 7 4195 1 1 2 SER H H -3.736 10.515 10.410 1.00 . A A . 2 SER H 1 1 7 4196 1 1 2 SER HA H -4.780 10.925 13.192 1.00 . A A . 2 SER HA 1 1 7 4197 1 1 2 SER HB2 H -5.232 8.701 12.491 1.00 . A A . 2 SER HB2 1 1 7 4198 1 1 2 SER HB3 H -3.676 8.554 11.679 1.00 . A A . 2 SER HB3 1 1 7 4199 1 1 2 SER HG H -4.323 8.400 14.398 1.00 . A A . 2 SER HG 1 1 7 4200 1 1 2 SER N N -4.281 10.895 11.131 1.00 . A A . 2 SER N 1 1 7 4201 1 1 2 SER O O -2.352 12.077 13.149 1.00 . A A . 2 SER O 1 1 7 4202 1 1 2 SER OG O -3.629 8.435 13.736 1.00 . A A . 2 SER OG 1 1 7 4203 1 1 3 ALA C C 0.437 9.065 13.924 1.00 . A A . 3 ALA C 1 1 7 4204 1 1 3 ALA CA C -0.353 10.334 13.594 1.00 . A A . 3 ALA CA 1 1 7 4205 1 1 3 ALA CB C -0.539 11.196 14.845 1.00 . A A . 3 ALA CB 1 1 7 4206 1 1 3 ALA H H -1.967 9.031 13.030 1.00 . A A . 3 ALA H 1 1 7 4207 1 1 3 ALA HA H 0.144 10.902 12.824 1.00 . A A . 3 ALA HA 1 1 7 4208 1 1 3 ALA HB1 H -1.559 11.113 15.191 1.00 . A A . 3 ALA HB1 1 1 7 4209 1 1 3 ALA HB2 H -0.321 12.227 14.606 1.00 . A A . 3 ALA HB2 1 1 7 4210 1 1 3 ALA HB3 H 0.132 10.855 15.619 1.00 . A A . 3 ALA HB3 1 1 7 4211 1 1 3 ALA N N -1.735 9.970 13.168 1.00 . A A . 3 ALA N 1 1 7 4212 1 1 3 ALA O O 1.404 8.735 13.267 1.00 . A A . 3 ALA O 1 1 7 4213 1 1 4 MET C C -0.227 5.907 15.235 1.00 . A A . 4 MET C 1 1 7 4214 1 1 4 MET CA C 0.738 7.094 15.303 1.00 . A A . 4 MET CA 1 1 7 4215 1 1 4 MET CB C 1.218 7.321 16.738 1.00 . A A . 4 MET CB 1 1 7 4216 1 1 4 MET CE C 0.893 9.198 19.746 1.00 . A A . 4 MET CE 1 1 7 4217 1 1 4 MET CG C 0.038 7.759 17.608 1.00 . A A . 4 MET CG 1 1 7 4218 1 1 4 MET H H -0.763 8.631 15.442 1.00 . A A . 4 MET H 1 1 7 4219 1 1 4 MET HA H 1.583 6.933 14.652 1.00 . A A . 4 MET HA 1 1 7 4220 1 1 4 MET HB2 H 1.634 6.402 17.126 1.00 . A A . 4 MET HB2 1 1 7 4221 1 1 4 MET HB3 H 1.975 8.091 16.746 1.00 . A A . 4 MET HB3 1 1 7 4222 1 1 4 MET HE1 H 0.066 9.852 19.502 1.00 . A A . 4 MET HE1 1 1 7 4223 1 1 4 MET HE2 H 1.757 9.486 19.170 1.00 . A A . 4 MET HE2 1 1 7 4224 1 1 4 MET HE3 H 1.122 9.275 20.799 1.00 . A A . 4 MET HE3 1 1 7 4225 1 1 4 MET HG2 H -0.161 8.807 17.444 1.00 . A A . 4 MET HG2 1 1 7 4226 1 1 4 MET HG3 H -0.835 7.179 17.350 1.00 . A A . 4 MET HG3 1 1 7 4227 1 1 4 MET N N 0.023 8.348 14.932 1.00 . A A . 4 MET N 1 1 7 4228 1 1 4 MET O O -0.478 5.240 16.219 1.00 . A A . 4 MET O 1 1 7 4229 1 1 4 MET SD S 0.443 7.490 19.351 1.00 . A A . 4 MET SD 1 1 7 4230 1 1 5 GLY C C -0.978 3.238 13.570 1.00 . A A . 5 GLY C 1 1 7 4231 1 1 5 GLY CA C -1.736 4.511 13.949 1.00 . A A . 5 GLY CA 1 1 7 4232 1 1 5 GLY H H -0.567 6.203 13.301 1.00 . A A . 5 GLY H 1 1 7 4233 1 1 5 GLY HA2 H -2.246 4.361 14.890 1.00 . A A . 5 GLY HA2 1 1 7 4234 1 1 5 GLY HA3 H -2.458 4.737 13.180 1.00 . A A . 5 GLY HA3 1 1 7 4235 1 1 5 GLY N N -0.779 5.648 14.081 1.00 . A A . 5 GLY N 1 1 7 4236 1 1 5 GLY O O -0.708 2.394 14.403 1.00 . A A . 5 GLY O 1 1 7 4237 1 1 6 CYS C C 1.612 2.077 12.068 1.00 . A A . 6 CYS C 1 1 7 4238 1 1 6 CYS CA C 0.109 1.864 11.897 1.00 . A A . 6 CYS CA 1 1 7 4239 1 1 6 CYS CB C -0.251 1.632 10.422 1.00 . A A . 6 CYS CB 1 1 7 4240 1 1 6 CYS H H -0.858 3.782 11.669 1.00 . A A . 6 CYS H 1 1 7 4241 1 1 6 CYS HA H -0.212 1.018 12.487 1.00 . A A . 6 CYS HA 1 1 7 4242 1 1 6 CYS HB2 H 0.373 0.846 10.023 1.00 . A A . 6 CYS HB2 1 1 7 4243 1 1 6 CYS HB3 H -1.287 1.336 10.351 1.00 . A A . 6 CYS HB3 1 1 7 4244 1 1 6 CYS N N -0.633 3.090 12.321 1.00 . A A . 6 CYS N 1 1 7 4245 1 1 6 CYS O O 2.384 1.138 12.091 1.00 . A A . 6 CYS O 1 1 7 4246 1 1 6 CYS SG S 0.009 3.145 9.461 1.00 . A A . 6 CYS SG 1 1 7 4247 1 1 7 ARG C C 3.948 2.971 13.727 1.00 . A A . 7 ARG C 1 1 7 4248 1 1 7 ARG CA C 3.487 3.570 12.395 1.00 . A A . 7 ARG CA 1 1 7 4249 1 1 7 ARG CB C 3.608 5.094 12.415 1.00 . A A . 7 ARG CB 1 1 7 4250 1 1 7 ARG CD C 4.904 5.920 10.447 1.00 . A A . 7 ARG CD 1 1 7 4251 1 1 7 ARG CG C 4.994 5.503 11.916 1.00 . A A . 7 ARG CG 1 1 7 4252 1 1 7 ARG CZ C 4.254 8.054 9.513 1.00 . A A . 7 ARG CZ 1 1 7 4253 1 1 7 ARG H H 1.397 4.046 12.198 1.00 . A A . 7 ARG H 1 1 7 4254 1 1 7 ARG HA H 4.058 3.161 11.576 1.00 . A A . 7 ARG HA 1 1 7 4255 1 1 7 ARG HB2 H 2.853 5.522 11.771 1.00 . A A . 7 ARG HB2 1 1 7 4256 1 1 7 ARG HB3 H 3.469 5.454 13.421 1.00 . A A . 7 ARG HB3 1 1 7 4257 1 1 7 ARG HD2 H 5.776 5.580 9.906 1.00 . A A . 7 ARG HD2 1 1 7 4258 1 1 7 ARG HD3 H 4.005 5.527 9.998 1.00 . A A . 7 ARG HD3 1 1 7 4259 1 1 7 ARG HE H 5.269 7.899 11.211 1.00 . A A . 7 ARG HE 1 1 7 4260 1 1 7 ARG HG2 H 5.358 6.331 12.506 1.00 . A A . 7 ARG HG2 1 1 7 4261 1 1 7 ARG HG3 H 5.671 4.667 12.010 1.00 . A A . 7 ARG HG3 1 1 7 4262 1 1 7 ARG HH11 H 2.441 7.926 10.352 1.00 . A A . 7 ARG HH11 1 1 7 4263 1 1 7 ARG HH12 H 2.507 8.758 8.833 1.00 . A A . 7 ARG HH12 1 1 7 4264 1 1 7 ARG HH21 H 5.927 8.333 8.450 1.00 . A A . 7 ARG HH21 1 1 7 4265 1 1 7 ARG HH22 H 4.481 8.987 7.756 1.00 . A A . 7 ARG HH22 1 1 7 4266 1 1 7 ARG N N 2.035 3.303 12.207 1.00 . A A . 7 ARG N 1 1 7 4267 1 1 7 ARG NE N 4.853 7.407 10.473 1.00 . A A . 7 ARG NE 1 1 7 4268 1 1 7 ARG NH1 N 2.968 8.263 9.571 1.00 . A A . 7 ARG NH1 1 1 7 4269 1 1 7 ARG NH2 N 4.941 8.493 8.494 1.00 . A A . 7 ARG NH2 1 1 7 4270 1 1 7 ARG O O 5.127 2.875 14.005 1.00 . A A . 7 ARG O 1 1 7 4271 1 1 8 HIS C C 3.232 0.436 15.784 1.00 . A A . 8 HIS C 1 1 7 4272 1 1 8 HIS CA C 3.382 1.961 15.862 1.00 . A A . 8 HIS CA 1 1 7 4273 1 1 8 HIS CB C 2.391 2.592 16.859 1.00 . A A . 8 HIS CB 1 1 7 4274 1 1 8 HIS CD2 C 0.689 0.823 17.806 1.00 . A A . 8 HIS CD2 1 1 7 4275 1 1 8 HIS CE1 C 1.793 0.236 19.575 1.00 . A A . 8 HIS CE1 1 1 7 4276 1 1 8 HIS CG C 1.850 1.557 17.812 1.00 . A A . 8 HIS CG 1 1 7 4277 1 1 8 HIS H H 2.075 2.648 14.297 1.00 . A A . 8 HIS H 1 1 7 4278 1 1 8 HIS HA H 4.393 2.227 16.130 1.00 . A A . 8 HIS HA 1 1 7 4279 1 1 8 HIS HB2 H 2.896 3.362 17.422 1.00 . A A . 8 HIS HB2 1 1 7 4280 1 1 8 HIS HB3 H 1.571 3.034 16.311 1.00 . A A . 8 HIS HB3 1 1 7 4281 1 1 8 HIS HD1 H 3.410 1.504 19.244 1.00 . A A . 8 HIS HD1 1 1 7 4282 1 1 8 HIS HD2 H -0.082 0.883 17.049 1.00 . A A . 8 HIS HD2 1 1 7 4283 1 1 8 HIS HE1 H 2.081 -0.253 20.494 1.00 . A A . 8 HIS HE1 1 1 7 4284 1 1 8 HIS N N 3.019 2.563 14.548 1.00 . A A . 8 HIS N 1 1 7 4285 1 1 8 HIS ND1 N 2.538 1.166 18.950 1.00 . A A . 8 HIS ND1 1 1 7 4286 1 1 8 HIS NE2 N 0.655 -0.010 18.920 1.00 . A A . 8 HIS NE2 1 1 7 4287 1 1 8 HIS O O 3.760 -0.293 16.600 1.00 . A A . 8 HIS O 1 1 7 4288 1 1 9 PHE C C 3.678 -2.225 14.660 1.00 . A A . 9 PHE C 1 1 7 4289 1 1 9 PHE CA C 2.322 -1.514 14.665 1.00 . A A . 9 PHE CA 1 1 7 4290 1 1 9 PHE CB C 1.618 -1.683 13.316 1.00 . A A . 9 PHE CB 1 1 7 4291 1 1 9 PHE CD1 C -0.338 -0.731 14.624 1.00 . A A . 9 PHE CD1 1 1 7 4292 1 1 9 PHE CD2 C -0.645 -1.284 12.284 1.00 . A A . 9 PHE CD2 1 1 7 4293 1 1 9 PHE CE1 C -1.671 -0.308 14.699 1.00 . A A . 9 PHE CE1 1 1 7 4294 1 1 9 PHE CE2 C -1.977 -0.860 12.359 1.00 . A A . 9 PHE CE2 1 1 7 4295 1 1 9 PHE CG C 0.177 -1.221 13.414 1.00 . A A . 9 PHE CG 1 1 7 4296 1 1 9 PHE CZ C -2.490 -0.373 13.566 1.00 . A A . 9 PHE CZ 1 1 7 4297 1 1 9 PHE H H 2.096 0.566 14.162 1.00 . A A . 9 PHE H 1 1 7 4298 1 1 9 PHE HA H 1.699 -1.895 15.458 1.00 . A A . 9 PHE HA 1 1 7 4299 1 1 9 PHE HB2 H 2.131 -1.095 12.570 1.00 . A A . 9 PHE HB2 1 1 7 4300 1 1 9 PHE HB3 H 1.640 -2.723 13.027 1.00 . A A . 9 PHE HB3 1 1 7 4301 1 1 9 PHE HD1 H 0.293 -0.681 15.498 1.00 . A A . 9 PHE HD1 1 1 7 4302 1 1 9 PHE HD2 H -0.252 -1.659 11.355 1.00 . A A . 9 PHE HD2 1 1 7 4303 1 1 9 PHE HE1 H -2.065 0.068 15.630 1.00 . A A . 9 PHE HE1 1 1 7 4304 1 1 9 PHE HE2 H -2.609 -0.912 11.484 1.00 . A A . 9 PHE HE2 1 1 7 4305 1 1 9 PHE HZ H -3.518 -0.046 13.624 1.00 . A A . 9 PHE HZ 1 1 7 4306 1 1 9 PHE N N 2.513 -0.044 14.807 1.00 . A A . 9 PHE N 1 1 7 4307 1 1 9 PHE O O 4.700 -1.636 14.958 1.00 . A A . 9 PHE O 1 1 7 4308 1 1 10 GLN C C 5.323 -4.675 12.880 1.00 . A A . 10 GLN C 1 1 7 4309 1 1 10 GLN CA C 4.995 -4.225 14.305 1.00 . A A . 10 GLN CA 1 1 7 4310 1 1 10 GLN CB C 4.774 -5.434 15.213 1.00 . A A . 10 GLN CB 1 1 7 4311 1 1 10 GLN CD C 6.366 -6.201 16.980 1.00 . A A . 10 GLN CD 1 1 7 4312 1 1 10 GLN CG C 5.332 -5.137 16.607 1.00 . A A . 10 GLN CG 1 1 7 4313 1 1 10 GLN H H 2.869 -3.944 14.088 1.00 . A A . 10 GLN H 1 1 7 4314 1 1 10 GLN HA H 5.789 -3.608 14.699 1.00 . A A . 10 GLN HA 1 1 7 4315 1 1 10 GLN HB2 H 3.716 -5.641 15.285 1.00 . A A . 10 GLN HB2 1 1 7 4316 1 1 10 GLN HB3 H 5.281 -6.292 14.799 1.00 . A A . 10 GLN HB3 1 1 7 4317 1 1 10 GLN HE21 H 7.445 -5.932 15.335 1.00 . A A . 10 GLN HE21 1 1 7 4318 1 1 10 GLN HE22 H 8.032 -7.113 16.403 1.00 . A A . 10 GLN HE22 1 1 7 4319 1 1 10 GLN HG2 H 5.801 -4.164 16.608 1.00 . A A . 10 GLN HG2 1 1 7 4320 1 1 10 GLN HG3 H 4.528 -5.152 17.328 1.00 . A A . 10 GLN HG3 1 1 7 4321 1 1 10 GLN N N 3.702 -3.485 14.326 1.00 . A A . 10 GLN N 1 1 7 4322 1 1 10 GLN NE2 N 7.364 -6.434 16.172 1.00 . A A . 10 GLN NE2 1 1 7 4323 1 1 10 GLN O O 6.204 -4.140 12.235 1.00 . A A . 10 GLN O 1 1 7 4324 1 1 10 GLN OE1 O 6.265 -6.827 18.017 1.00 . A A . 10 GLN OE1 1 1 7 4325 1 1 11 SER C C 3.827 -5.597 10.037 1.00 . A A . 11 SER C 1 1 7 4326 1 1 11 SER CA C 4.891 -6.138 10.998 1.00 . A A . 11 SER CA 1 1 7 4327 1 1 11 SER CB C 4.814 -7.661 11.090 1.00 . A A . 11 SER CB 1 1 7 4328 1 1 11 SER H H 3.914 -6.072 12.917 1.00 . A A . 11 SER H 1 1 7 4329 1 1 11 SER HA H 5.877 -5.836 10.678 1.00 . A A . 11 SER HA 1 1 7 4330 1 1 11 SER HB2 H 3.818 -7.958 11.372 1.00 . A A . 11 SER HB2 1 1 7 4331 1 1 11 SER HB3 H 5.057 -8.092 10.128 1.00 . A A . 11 SER HB3 1 1 7 4332 1 1 11 SER HG H 6.576 -7.685 11.917 1.00 . A A . 11 SER HG 1 1 7 4333 1 1 11 SER N N 4.621 -5.654 12.381 1.00 . A A . 11 SER N 1 1 7 4334 1 1 11 SER O O 2.956 -4.844 10.425 1.00 . A A . 11 SER O 1 1 7 4335 1 1 11 SER OG O 5.734 -8.119 12.073 1.00 . A A . 11 SER OG 1 1 7 4336 1 1 12 CYS C C 1.506 -6.081 8.106 1.00 . A A . 12 CYS C 1 1 7 4337 1 1 12 CYS CA C 2.878 -5.469 7.811 1.00 . A A . 12 CYS CA 1 1 7 4338 1 1 12 CYS CB C 3.384 -5.921 6.438 1.00 . A A . 12 CYS CB 1 1 7 4339 1 1 12 CYS H H 4.600 -6.577 8.490 1.00 . A A . 12 CYS H 1 1 7 4340 1 1 12 CYS HA H 2.825 -4.393 7.846 1.00 . A A . 12 CYS HA 1 1 7 4341 1 1 12 CYS HB2 H 2.824 -5.414 5.665 1.00 . A A . 12 CYS HB2 1 1 7 4342 1 1 12 CYS HB3 H 4.431 -5.676 6.341 1.00 . A A . 12 CYS HB3 1 1 7 4343 1 1 12 CYS N N 3.890 -5.970 8.787 1.00 . A A . 12 CYS N 1 1 7 4344 1 1 12 CYS O O 0.519 -5.744 7.483 1.00 . A A . 12 CYS O 1 1 7 4345 1 1 12 CYS SG S 3.163 -7.710 6.263 1.00 . A A . 12 CYS SG 1 1 7 4346 1 1 13 SER C C -0.893 -6.554 9.793 1.00 . A A . 13 SER C 1 1 7 4347 1 1 13 SER CA C 0.126 -7.616 9.371 1.00 . A A . 13 SER CA 1 1 7 4348 1 1 13 SER CB C 0.423 -8.565 10.529 1.00 . A A . 13 SER CB 1 1 7 4349 1 1 13 SER H H 2.243 -7.244 9.538 1.00 . A A . 13 SER H 1 1 7 4350 1 1 13 SER HA H -0.239 -8.173 8.523 1.00 . A A . 13 SER HA 1 1 7 4351 1 1 13 SER HB2 H 1.447 -8.444 10.844 1.00 . A A . 13 SER HB2 1 1 7 4352 1 1 13 SER HB3 H -0.235 -8.338 11.357 1.00 . A A . 13 SER HB3 1 1 7 4353 1 1 13 SER HG H -0.549 -10.250 10.558 1.00 . A A . 13 SER HG 1 1 7 4354 1 1 13 SER N N 1.436 -6.981 9.048 1.00 . A A . 13 SER N 1 1 7 4355 1 1 13 SER O O -1.920 -6.387 9.169 1.00 . A A . 13 SER O 1 1 7 4356 1 1 13 SER OG O 0.221 -9.906 10.100 1.00 . A A . 13 SER OG 1 1 7 4357 1 1 14 GLN C C -1.490 -3.556 10.387 1.00 . A A . 14 GLN C 1 1 7 4358 1 1 14 GLN CA C -1.585 -4.785 11.292 1.00 . A A . 14 GLN CA 1 1 7 4359 1 1 14 GLN CB C -1.163 -4.433 12.719 1.00 . A A . 14 GLN CB 1 1 7 4360 1 1 14 GLN CD C -3.051 -4.475 14.360 1.00 . A A . 14 GLN CD 1 1 7 4361 1 1 14 GLN CG C -2.263 -3.600 13.383 1.00 . A A . 14 GLN CG 1 1 7 4362 1 1 14 GLN H H 0.214 -5.975 11.337 1.00 . A A . 14 GLN H 1 1 7 4363 1 1 14 GLN HA H -2.589 -5.176 11.292 1.00 . A A . 14 GLN HA 1 1 7 4364 1 1 14 GLN HB2 H -1.005 -5.340 13.284 1.00 . A A . 14 GLN HB2 1 1 7 4365 1 1 14 GLN HB3 H -0.248 -3.860 12.693 1.00 . A A . 14 GLN HB3 1 1 7 4366 1 1 14 GLN HE21 H -2.034 -3.865 15.953 1.00 . A A . 14 GLN HE21 1 1 7 4367 1 1 14 GLN HE22 H -3.255 -5.001 16.264 1.00 . A A . 14 GLN HE22 1 1 7 4368 1 1 14 GLN HG2 H -1.815 -2.776 13.918 1.00 . A A . 14 GLN HG2 1 1 7 4369 1 1 14 GLN HG3 H -2.931 -3.218 12.626 1.00 . A A . 14 GLN HG3 1 1 7 4370 1 1 14 GLN N N -0.620 -5.831 10.843 1.00 . A A . 14 GLN N 1 1 7 4371 1 1 14 GLN NE2 N -2.755 -4.445 15.631 1.00 . A A . 14 GLN NE2 1 1 7 4372 1 1 14 GLN O O -2.467 -2.876 10.144 1.00 . A A . 14 GLN O 1 1 7 4373 1 1 14 GLN OE1 O -3.947 -5.194 13.963 1.00 . A A . 14 GLN OE1 1 1 7 4374 1 1 15 CYS C C -1.154 -2.159 7.834 1.00 . A A . 15 CYS C 1 1 7 4375 1 1 15 CYS CA C -0.171 -2.073 9.003 1.00 . A A . 15 CYS CA 1 1 7 4376 1 1 15 CYS CB C 1.270 -2.130 8.503 1.00 . A A . 15 CYS CB 1 1 7 4377 1 1 15 CYS H H 0.456 -3.821 10.097 1.00 . A A . 15 CYS H 1 1 7 4378 1 1 15 CYS HA H -0.331 -1.165 9.562 1.00 . A A . 15 CYS HA 1 1 7 4379 1 1 15 CYS HB2 H 1.628 -3.147 8.551 1.00 . A A . 15 CYS HB2 1 1 7 4380 1 1 15 CYS HB3 H 1.312 -1.782 7.481 1.00 . A A . 15 CYS HB3 1 1 7 4381 1 1 15 CYS N N -0.321 -3.263 9.888 1.00 . A A . 15 CYS N 1 1 7 4382 1 1 15 CYS O O -1.628 -1.159 7.334 1.00 . A A . 15 CYS O 1 1 7 4383 1 1 15 CYS SG S 2.306 -1.074 9.544 1.00 . A A . 15 CYS SG 1 1 7 4384 1 1 16 LEU C C -3.746 -4.076 6.765 1.00 . A A . 16 LEU C 1 1 7 4385 1 1 16 LEU CA C -2.423 -3.492 6.264 1.00 . A A . 16 LEU CA 1 1 7 4386 1 1 16 LEU CB C -1.735 -4.440 5.282 1.00 . A A . 16 LEU CB 1 1 7 4387 1 1 16 LEU CD1 C 0.407 -3.157 5.174 1.00 . A A . 16 LEU CD1 1 1 7 4388 1 1 16 LEU CD2 C -0.338 -4.503 3.208 1.00 . A A . 16 LEU CD2 1 1 7 4389 1 1 16 LEU CG C -0.808 -3.631 4.373 1.00 . A A . 16 LEU CG 1 1 7 4390 1 1 16 LEU H H -1.076 -4.144 7.814 1.00 . A A . 16 LEU H 1 1 7 4391 1 1 16 LEU HA H -2.591 -2.536 5.794 1.00 . A A . 16 LEU HA 1 1 7 4392 1 1 16 LEU HB2 H -1.158 -5.172 5.830 1.00 . A A . 16 LEU HB2 1 1 7 4393 1 1 16 LEU HB3 H -2.478 -4.942 4.681 1.00 . A A . 16 LEU HB3 1 1 7 4394 1 1 16 LEU HD11 H 1.307 -3.349 4.610 1.00 . A A . 16 LEU HD11 1 1 7 4395 1 1 16 LEU HD12 H 0.448 -3.692 6.112 1.00 . A A . 16 LEU HD12 1 1 7 4396 1 1 16 LEU HD13 H 0.320 -2.098 5.367 1.00 . A A . 16 LEU HD13 1 1 7 4397 1 1 16 LEU HD21 H -0.099 -3.876 2.362 1.00 . A A . 16 LEU HD21 1 1 7 4398 1 1 16 LEU HD22 H -1.123 -5.192 2.935 1.00 . A A . 16 LEU HD22 1 1 7 4399 1 1 16 LEU HD23 H 0.540 -5.057 3.505 1.00 . A A . 16 LEU HD23 1 1 7 4400 1 1 16 LEU HG H -1.341 -2.773 3.991 1.00 . A A . 16 LEU HG 1 1 7 4401 1 1 16 LEU N N -1.467 -3.347 7.397 1.00 . A A . 16 LEU N 1 1 7 4402 1 1 16 LEU O O -4.761 -3.992 6.104 1.00 . A A . 16 LEU O 1 1 7 4403 1 1 17 SER C C -5.790 -4.126 9.230 1.00 . A A . 17 SER C 1 1 7 4404 1 1 17 SER CA C -5.018 -5.218 8.486 1.00 . A A . 17 SER CA 1 1 7 4405 1 1 17 SER CB C -4.585 -6.312 9.458 1.00 . A A . 17 SER CB 1 1 7 4406 1 1 17 SER H H -2.925 -4.696 8.466 1.00 . A A . 17 SER H 1 1 7 4407 1 1 17 SER HA H -5.618 -5.638 7.695 1.00 . A A . 17 SER HA 1 1 7 4408 1 1 17 SER HB2 H -3.893 -6.974 8.972 1.00 . A A . 17 SER HB2 1 1 7 4409 1 1 17 SER HB3 H -4.105 -5.858 10.318 1.00 . A A . 17 SER HB3 1 1 7 4410 1 1 17 SER HG H -5.968 -7.647 9.160 1.00 . A A . 17 SER HG 1 1 7 4411 1 1 17 SER N N -3.751 -4.651 7.939 1.00 . A A . 17 SER N 1 1 7 4412 1 1 17 SER O O -6.896 -4.335 9.689 1.00 . A A . 17 SER O 1 1 7 4413 1 1 17 SER OG O -5.725 -7.051 9.873 1.00 . A A . 17 SER OG 1 1 7 4414 1 1 18 ALA C C -5.565 -0.521 9.384 1.00 . A A . 18 ALA C 1 1 7 4415 1 1 18 ALA CA C -5.891 -1.852 10.070 1.00 . A A . 18 ALA CA 1 1 7 4416 1 1 18 ALA CB C -5.312 -1.896 11.484 1.00 . A A . 18 ALA CB 1 1 7 4417 1 1 18 ALA H H -4.314 -2.822 8.983 1.00 . A A . 18 ALA H 1 1 7 4418 1 1 18 ALA HA H -6.956 -2.016 10.100 1.00 . A A . 18 ALA HA 1 1 7 4419 1 1 18 ALA HB1 H -4.990 -2.904 11.708 1.00 . A A . 18 ALA HB1 1 1 7 4420 1 1 18 ALA HB2 H -6.067 -1.594 12.193 1.00 . A A . 18 ALA HB2 1 1 7 4421 1 1 18 ALA HB3 H -4.466 -1.228 11.548 1.00 . A A . 18 ALA HB3 1 1 7 4422 1 1 18 ALA N N -5.208 -2.964 9.355 1.00 . A A . 18 ALA N 1 1 7 4423 1 1 18 ALA O O -5.091 0.407 10.009 1.00 . A A . 18 ALA O 1 1 7 4424 1 1 19 PRO C C -6.586 1.860 7.529 1.00 . A A . 19 PRO C 1 1 7 4425 1 1 19 PRO CA C -5.568 0.723 7.289 1.00 . A A . 19 PRO CA 1 1 7 4426 1 1 19 PRO CB C -5.661 0.213 5.853 1.00 . A A . 19 PRO CB 1 1 7 4427 1 1 19 PRO CD C -6.398 -1.580 7.303 1.00 . A A . 19 PRO CD 1 1 7 4428 1 1 19 PRO CG C -6.530 -1.001 5.917 1.00 . A A . 19 PRO CG 1 1 7 4429 1 1 19 PRO HA H -4.569 1.079 7.472 1.00 . A A . 19 PRO HA 1 1 7 4430 1 1 19 PRO HB2 H -6.109 0.964 5.219 1.00 . A A . 19 PRO HB2 1 1 7 4431 1 1 19 PRO HB3 H -4.683 -0.055 5.486 1.00 . A A . 19 PRO HB3 1 1 7 4432 1 1 19 PRO HD2 H -7.367 -1.872 7.684 1.00 . A A . 19 PRO HD2 1 1 7 4433 1 1 19 PRO HD3 H -5.723 -2.421 7.295 1.00 . A A . 19 PRO HD3 1 1 7 4434 1 1 19 PRO HG2 H -7.557 -0.727 5.725 1.00 . A A . 19 PRO HG2 1 1 7 4435 1 1 19 PRO HG3 H -6.202 -1.726 5.189 1.00 . A A . 19 PRO HG3 1 1 7 4436 1 1 19 PRO N N -5.832 -0.488 8.104 1.00 . A A . 19 PRO N 1 1 7 4437 1 1 19 PRO O O -6.247 3.009 7.329 1.00 . A A . 19 PRO O 1 1 7 4438 1 1 20 PRO C C -8.483 3.428 9.405 1.00 . A A . 20 PRO C 1 1 7 4439 1 1 20 PRO CA C -8.805 2.619 8.143 1.00 . A A . 20 PRO CA 1 1 7 4440 1 1 20 PRO CB C -10.123 1.867 8.290 1.00 . A A . 20 PRO CB 1 1 7 4441 1 1 20 PRO CD C -8.365 0.211 8.209 1.00 . A A . 20 PRO CD 1 1 7 4442 1 1 20 PRO CG C -9.741 0.499 8.752 1.00 . A A . 20 PRO CG 1 1 7 4443 1 1 20 PRO HA H -8.851 3.267 7.283 1.00 . A A . 20 PRO HA 1 1 7 4444 1 1 20 PRO HB2 H -10.750 2.353 9.026 1.00 . A A . 20 PRO HB2 1 1 7 4445 1 1 20 PRO HB3 H -10.630 1.808 7.340 1.00 . A A . 20 PRO HB3 1 1 7 4446 1 1 20 PRO HD2 H -7.783 -0.304 8.955 1.00 . A A . 20 PRO HD2 1 1 7 4447 1 1 20 PRO HD3 H -8.428 -0.371 7.304 1.00 . A A . 20 PRO HD3 1 1 7 4448 1 1 20 PRO HG2 H -9.727 0.467 9.832 1.00 . A A . 20 PRO HG2 1 1 7 4449 1 1 20 PRO HG3 H -10.441 -0.228 8.370 1.00 . A A . 20 PRO HG3 1 1 7 4450 1 1 20 PRO N N -7.802 1.543 7.926 1.00 . A A . 20 PRO N 1 1 7 4451 1 1 20 PRO O O -8.797 4.597 9.496 1.00 . A A . 20 PRO O 1 1 7 4452 1 1 21 PHE C C -6.039 3.956 11.617 1.00 . A A . 21 PHE C 1 1 7 4453 1 1 21 PHE CA C -7.519 3.570 11.623 1.00 . A A . 21 PHE CA 1 1 7 4454 1 1 21 PHE CB C -7.805 2.597 12.767 1.00 . A A . 21 PHE CB 1 1 7 4455 1 1 21 PHE CD1 C -10.262 2.707 12.205 1.00 . A A . 21 PHE CD1 1 1 7 4456 1 1 21 PHE CD2 C -9.275 0.553 12.726 1.00 . A A . 21 PHE CD2 1 1 7 4457 1 1 21 PHE CE1 C -11.505 2.091 12.017 1.00 . A A . 21 PHE CE1 1 1 7 4458 1 1 21 PHE CE2 C -10.518 -0.062 12.539 1.00 . A A . 21 PHE CE2 1 1 7 4459 1 1 21 PHE CG C -9.147 1.937 12.559 1.00 . A A . 21 PHE CG 1 1 7 4460 1 1 21 PHE CZ C -11.633 0.706 12.184 1.00 . A A . 21 PHE CZ 1 1 7 4461 1 1 21 PHE H H -7.607 1.879 10.287 1.00 . A A . 21 PHE H 1 1 7 4462 1 1 21 PHE HA H -8.138 4.447 11.718 1.00 . A A . 21 PHE HA 1 1 7 4463 1 1 21 PHE HB2 H -7.035 1.841 12.796 1.00 . A A . 21 PHE HB2 1 1 7 4464 1 1 21 PHE HB3 H -7.813 3.137 13.703 1.00 . A A . 21 PHE HB3 1 1 7 4465 1 1 21 PHE HD1 H -10.163 3.773 12.076 1.00 . A A . 21 PHE HD1 1 1 7 4466 1 1 21 PHE HD2 H -8.416 -0.040 13.000 1.00 . A A . 21 PHE HD2 1 1 7 4467 1 1 21 PHE HE1 H -12.366 2.683 11.744 1.00 . A A . 21 PHE HE1 1 1 7 4468 1 1 21 PHE HE2 H -10.617 -1.130 12.669 1.00 . A A . 21 PHE HE2 1 1 7 4469 1 1 21 PHE HZ H -12.592 0.230 12.040 1.00 . A A . 21 PHE HZ 1 1 7 4470 1 1 21 PHE N N -7.858 2.821 10.376 1.00 . A A . 21 PHE N 1 1 7 4471 1 1 21 PHE O O -5.424 4.107 12.654 1.00 . A A . 21 PHE O 1 1 7 4472 1 1 22 VAL C C -3.709 5.230 9.096 1.00 . A A . 22 VAL C 1 1 7 4473 1 1 22 VAL CA C -4.014 4.476 10.395 1.00 . A A . 22 VAL CA 1 1 7 4474 1 1 22 VAL CB C -3.278 3.137 10.427 1.00 . A A . 22 VAL CB 1 1 7 4475 1 1 22 VAL CG1 C -3.775 2.301 11.608 1.00 . A A . 22 VAL CG1 1 1 7 4476 1 1 22 VAL CG2 C -3.542 2.381 9.123 1.00 . A A . 22 VAL CG2 1 1 7 4477 1 1 22 VAL H H -5.968 3.980 9.632 1.00 . A A . 22 VAL H 1 1 7 4478 1 1 22 VAL HA H -3.736 5.069 11.251 1.00 . A A . 22 VAL HA 1 1 7 4479 1 1 22 VAL HB H -2.222 3.314 10.533 1.00 . A A . 22 VAL HB 1 1 7 4480 1 1 22 VAL HG11 H -4.793 1.988 11.425 1.00 . A A . 22 VAL HG11 1 1 7 4481 1 1 22 VAL HG12 H -3.735 2.892 12.511 1.00 . A A . 22 VAL HG12 1 1 7 4482 1 1 22 VAL HG13 H -3.147 1.431 11.722 1.00 . A A . 22 VAL HG13 1 1 7 4483 1 1 22 VAL HG21 H -3.260 1.345 9.244 1.00 . A A . 22 VAL HG21 1 1 7 4484 1 1 22 VAL HG22 H -2.959 2.821 8.327 1.00 . A A . 22 VAL HG22 1 1 7 4485 1 1 22 VAL HG23 H -4.592 2.441 8.878 1.00 . A A . 22 VAL HG23 1 1 7 4486 1 1 22 VAL N N -5.458 4.111 10.458 1.00 . A A . 22 VAL N 1 1 7 4487 1 1 22 VAL O O -4.527 5.291 8.199 1.00 . A A . 22 VAL O 1 1 7 4488 1 1 23 GLN C C -0.916 6.036 7.104 1.00 . A A . 23 GLN C 1 1 7 4489 1 1 23 GLN CA C -2.205 6.566 7.743 1.00 . A A . 23 GLN CA 1 1 7 4490 1 1 23 GLN CB C -2.011 8.013 8.191 1.00 . A A . 23 GLN CB 1 1 7 4491 1 1 23 GLN CD C -2.296 10.012 6.716 1.00 . A A . 23 GLN CD 1 1 7 4492 1 1 23 GLN CG C -1.396 8.819 7.044 1.00 . A A . 23 GLN CG 1 1 7 4493 1 1 23 GLN H H -1.894 5.759 9.722 1.00 . A A . 23 GLN H 1 1 7 4494 1 1 23 GLN HA H -3.020 6.510 7.039 1.00 . A A . 23 GLN HA 1 1 7 4495 1 1 23 GLN HB2 H -2.967 8.438 8.460 1.00 . A A . 23 GLN HB2 1 1 7 4496 1 1 23 GLN HB3 H -1.349 8.041 9.043 1.00 . A A . 23 GLN HB3 1 1 7 4497 1 1 23 GLN HE21 H -1.676 10.142 4.834 1.00 . A A . 23 GLN HE21 1 1 7 4498 1 1 23 GLN HE22 H -2.840 11.289 5.296 1.00 . A A . 23 GLN HE22 1 1 7 4499 1 1 23 GLN HG2 H -0.418 9.174 7.336 1.00 . A A . 23 GLN HG2 1 1 7 4500 1 1 23 GLN HG3 H -1.304 8.190 6.172 1.00 . A A . 23 GLN HG3 1 1 7 4501 1 1 23 GLN N N -2.541 5.812 8.987 1.00 . A A . 23 GLN N 1 1 7 4502 1 1 23 GLN NE2 N -2.269 10.523 5.515 1.00 . A A . 23 GLN NE2 1 1 7 4503 1 1 23 GLN O O -0.786 6.004 5.896 1.00 . A A . 23 GLN O 1 1 7 4504 1 1 23 GLN OE1 O -3.031 10.483 7.561 1.00 . A A . 23 GLN OE1 1 1 7 4505 1 1 24 CYS C C 1.035 3.838 6.504 1.00 . A A . 24 CYS C 1 1 7 4506 1 1 24 CYS CA C 1.314 5.121 7.295 1.00 . A A . 24 CYS CA 1 1 7 4507 1 1 24 CYS CB C 2.267 4.884 8.480 1.00 . A A . 24 CYS CB 1 1 7 4508 1 1 24 CYS H H -0.064 5.668 8.866 1.00 . A A . 24 CYS H 1 1 7 4509 1 1 24 CYS HA H 1.733 5.869 6.637 1.00 . A A . 24 CYS HA 1 1 7 4510 1 1 24 CYS HB2 H 3.287 4.962 8.139 1.00 . A A . 24 CYS HB2 1 1 7 4511 1 1 24 CYS HB3 H 2.087 5.637 9.235 1.00 . A A . 24 CYS HB3 1 1 7 4512 1 1 24 CYS N N 0.046 5.631 7.892 1.00 . A A . 24 CYS N 1 1 7 4513 1 1 24 CYS O O 0.032 3.180 6.701 1.00 . A A . 24 CYS O 1 1 7 4514 1 1 24 CYS SG S 2.005 3.241 9.200 1.00 . A A . 24 CYS SG 1 1 7 4515 1 1 25 GLY C C 3.007 1.525 4.612 1.00 . A A . 25 GLY C 1 1 7 4516 1 1 25 GLY CA C 1.686 2.268 4.773 1.00 . A A . 25 GLY CA 1 1 7 4517 1 1 25 GLY H H 2.700 4.047 5.445 1.00 . A A . 25 GLY H 1 1 7 4518 1 1 25 GLY HA2 H 0.966 1.627 5.262 1.00 . A A . 25 GLY HA2 1 1 7 4519 1 1 25 GLY HA3 H 1.315 2.550 3.800 1.00 . A A . 25 GLY HA3 1 1 7 4520 1 1 25 GLY N N 1.905 3.491 5.598 1.00 . A A . 25 GLY N 1 1 7 4521 1 1 25 GLY O O 4.018 1.923 5.146 1.00 . A A . 25 GLY O 1 1 7 4522 1 1 26 TRP C C 5.029 0.290 2.490 1.00 . A A . 26 TRP C 1 1 7 4523 1 1 26 TRP CA C 4.284 -0.300 3.689 1.00 . A A . 26 TRP CA 1 1 7 4524 1 1 26 TRP CB C 3.846 -1.739 3.408 1.00 . A A . 26 TRP CB 1 1 7 4525 1 1 26 TRP CD1 C 5.826 -3.210 2.867 1.00 . A A . 26 TRP CD1 1 1 7 4526 1 1 26 TRP CD2 C 5.327 -3.203 5.061 1.00 . A A . 26 TRP CD2 1 1 7 4527 1 1 26 TRP CE2 C 6.442 -4.057 4.902 1.00 . A A . 26 TRP CE2 1 1 7 4528 1 1 26 TRP CE3 C 4.810 -3.022 6.355 1.00 . A A . 26 TRP CE3 1 1 7 4529 1 1 26 TRP CG C 4.955 -2.677 3.754 1.00 . A A . 26 TRP CG 1 1 7 4530 1 1 26 TRP CH2 C 6.500 -4.518 7.270 1.00 . A A . 26 TRP CH2 1 1 7 4531 1 1 26 TRP CZ2 C 7.025 -4.709 5.989 1.00 . A A . 26 TRP CZ2 1 1 7 4532 1 1 26 TRP CZ3 C 5.393 -3.677 7.453 1.00 . A A . 26 TRP CZ3 1 1 7 4533 1 1 26 TRP H H 2.189 0.145 3.443 1.00 . A A . 26 TRP H 1 1 7 4534 1 1 26 TRP HA H 4.892 -0.256 4.579 1.00 . A A . 26 TRP HA 1 1 7 4535 1 1 26 TRP HB2 H 2.979 -1.973 4.008 1.00 . A A . 26 TRP HB2 1 1 7 4536 1 1 26 TRP HB3 H 3.600 -1.844 2.364 1.00 . A A . 26 TRP HB3 1 1 7 4537 1 1 26 TRP HD1 H 5.830 -3.026 1.803 1.00 . A A . 26 TRP HD1 1 1 7 4538 1 1 26 TRP HE1 H 7.440 -4.536 3.136 1.00 . A A . 26 TRP HE1 1 1 7 4539 1 1 26 TRP HE3 H 3.959 -2.376 6.506 1.00 . A A . 26 TRP HE3 1 1 7 4540 1 1 26 TRP HH2 H 6.944 -5.020 8.117 1.00 . A A . 26 TRP HH2 1 1 7 4541 1 1 26 TRP HZ2 H 7.883 -5.350 5.841 1.00 . A A . 26 TRP HZ2 1 1 7 4542 1 1 26 TRP HZ3 H 4.987 -3.530 8.443 1.00 . A A . 26 TRP HZ3 1 1 7 4543 1 1 26 TRP N N 3.015 0.452 3.877 1.00 . A A . 26 TRP N 1 1 7 4544 1 1 26 TRP NE1 N 6.710 -4.029 3.547 1.00 . A A . 26 TRP NE1 1 1 7 4545 1 1 26 TRP O O 4.430 0.684 1.510 1.00 . A A . 26 TRP O 1 1 7 4546 1 1 27 CYS C C 8.322 0.168 1.088 1.00 . A A . 27 CYS C 1 1 7 4547 1 1 27 CYS CA C 7.087 1.002 1.444 1.00 . A A . 27 CYS CA 1 1 7 4548 1 1 27 CYS CB C 7.501 2.375 1.971 1.00 . A A . 27 CYS CB 1 1 7 4549 1 1 27 CYS H H 6.796 0.101 3.383 1.00 . A A . 27 CYS H 1 1 7 4550 1 1 27 CYS HA H 6.451 1.119 0.582 1.00 . A A . 27 CYS HA 1 1 7 4551 1 1 27 CYS HB2 H 7.044 2.533 2.935 1.00 . A A . 27 CYS HB2 1 1 7 4552 1 1 27 CYS HB3 H 8.575 2.414 2.072 1.00 . A A . 27 CYS HB3 1 1 7 4553 1 1 27 CYS N N 6.327 0.394 2.573 1.00 . A A . 27 CYS N 1 1 7 4554 1 1 27 CYS O O 9.357 0.269 1.714 1.00 . A A . 27 CYS O 1 1 7 4555 1 1 27 CYS SG S 6.950 3.668 0.830 1.00 . A A . 27 CYS SG 1 1 7 4556 1 1 28 HIS C C 10.169 -2.062 0.795 1.00 . A A . 28 HIS C 1 1 7 4557 1 1 28 HIS CA C 9.378 -1.466 -0.382 1.00 . A A . 28 HIS CA 1 1 7 4558 1 1 28 HIS CB C 10.260 -0.500 -1.171 1.00 . A A . 28 HIS CB 1 1 7 4559 1 1 28 HIS CD2 C 10.458 -1.688 -3.507 1.00 . A A . 28 HIS CD2 1 1 7 4560 1 1 28 HIS CE1 C 9.290 -0.287 -4.675 1.00 . A A . 28 HIS CE1 1 1 7 4561 1 1 28 HIS CG C 10.040 -0.705 -2.645 1.00 . A A . 28 HIS CG 1 1 7 4562 1 1 28 HIS H H 7.375 -0.676 -0.431 1.00 . A A . 28 HIS H 1 1 7 4563 1 1 28 HIS HA H 9.037 -2.253 -1.035 1.00 . A A . 28 HIS HA 1 1 7 4564 1 1 28 HIS HB2 H 10.005 0.516 -0.907 1.00 . A A . 28 HIS HB2 1 1 7 4565 1 1 28 HIS HB3 H 11.297 -0.682 -0.934 1.00 . A A . 28 HIS HB3 1 1 7 4566 1 1 28 HIS HD1 H 8.857 0.994 -3.094 1.00 . A A . 28 HIS HD1 1 1 7 4567 1 1 28 HIS HD2 H 11.064 -2.539 -3.232 1.00 . A A . 28 HIS HD2 1 1 7 4568 1 1 28 HIS HE1 H 8.785 0.198 -5.496 1.00 . A A . 28 HIS HE1 1 1 7 4569 1 1 28 HIS N N 8.219 -0.632 0.065 1.00 . A A . 28 HIS N 1 1 7 4570 1 1 28 HIS ND1 N 9.296 0.178 -3.412 1.00 . A A . 28 HIS ND1 1 1 7 4571 1 1 28 HIS NE2 N 9.984 -1.422 -4.788 1.00 . A A . 28 HIS NE2 1 1 7 4572 1 1 28 HIS O O 11.310 -2.448 0.635 1.00 . A A . 28 HIS O 1 1 7 4573 1 1 29 ASP C C 9.638 -2.583 4.441 1.00 . A A . 29 ASP C 1 1 7 4574 1 1 29 ASP CA C 10.362 -2.765 3.104 1.00 . A A . 29 ASP CA 1 1 7 4575 1 1 29 ASP CB C 11.712 -2.043 3.142 1.00 . A A . 29 ASP CB 1 1 7 4576 1 1 29 ASP CG C 11.546 -0.575 2.735 1.00 . A A . 29 ASP CG 1 1 7 4577 1 1 29 ASP H H 8.669 -1.873 2.095 1.00 . A A . 29 ASP H 1 1 7 4578 1 1 29 ASP HA H 10.527 -3.815 2.920 1.00 . A A . 29 ASP HA 1 1 7 4579 1 1 29 ASP HB2 H 12.106 -2.094 4.147 1.00 . A A . 29 ASP HB2 1 1 7 4580 1 1 29 ASP HB3 H 12.398 -2.527 2.464 1.00 . A A . 29 ASP HB3 1 1 7 4581 1 1 29 ASP N N 9.594 -2.167 1.967 1.00 . A A . 29 ASP N 1 1 7 4582 1 1 29 ASP O O 8.915 -3.448 4.878 1.00 . A A . 29 ASP O 1 1 7 4583 1 1 29 ASP OD1 O 10.953 0.168 3.500 1.00 . A A . 29 ASP OD1 1 1 7 4584 1 1 29 ASP OD2 O 12.015 -0.221 1.666 1.00 . A A . 29 ASP OD2 1 1 7 4585 1 1 30 LYS C C 7.853 -0.553 6.283 1.00 . A A . 30 LYS C 1 1 7 4586 1 1 30 LYS CA C 9.193 -1.275 6.437 1.00 . A A . 30 LYS CA 1 1 7 4587 1 1 30 LYS CB C 10.174 -0.409 7.228 1.00 . A A . 30 LYS CB 1 1 7 4588 1 1 30 LYS CD C 11.424 -0.362 9.392 1.00 . A A . 30 LYS CD 1 1 7 4589 1 1 30 LYS CE C 11.172 0.927 10.181 1.00 . A A . 30 LYS CE 1 1 7 4590 1 1 30 LYS CG C 10.131 -0.805 8.706 1.00 . A A . 30 LYS CG 1 1 7 4591 1 1 30 LYS H H 10.458 -0.802 4.759 1.00 . A A . 30 LYS H 1 1 7 4592 1 1 30 LYS HA H 9.052 -2.219 6.938 1.00 . A A . 30 LYS HA 1 1 7 4593 1 1 30 LYS HB2 H 11.172 -0.557 6.845 1.00 . A A . 30 LYS HB2 1 1 7 4594 1 1 30 LYS HB3 H 9.899 0.629 7.128 1.00 . A A . 30 LYS HB3 1 1 7 4595 1 1 30 LYS HD2 H 11.759 -1.137 10.066 1.00 . A A . 30 LYS HD2 1 1 7 4596 1 1 30 LYS HD3 H 12.183 -0.181 8.646 1.00 . A A . 30 LYS HD3 1 1 7 4597 1 1 30 LYS HE2 H 11.753 1.739 9.766 1.00 . A A . 30 LYS HE2 1 1 7 4598 1 1 30 LYS HE3 H 10.122 1.172 10.173 1.00 . A A . 30 LYS HE3 1 1 7 4599 1 1 30 LYS HG2 H 9.287 -0.328 9.182 1.00 . A A . 30 LYS HG2 1 1 7 4600 1 1 30 LYS HG3 H 10.031 -1.877 8.788 1.00 . A A . 30 LYS HG3 1 1 7 4601 1 1 30 LYS HZ1 H 12.469 0.031 11.541 1.00 . A A . 30 LYS HZ1 1 1 7 4602 1 1 30 LYS HZ2 H 10.859 0.120 12.075 1.00 . A A . 30 LYS HZ2 1 1 7 4603 1 1 30 LYS HZ3 H 11.832 1.513 12.067 1.00 . A A . 30 LYS HZ3 1 1 7 4604 1 1 30 LYS N N 9.851 -1.482 5.113 1.00 . A A . 30 LYS N 1 1 7 4605 1 1 30 LYS NZ N 11.616 0.624 11.571 1.00 . A A . 30 LYS NZ 1 1 7 4606 1 1 30 LYS O O 7.468 -0.151 5.203 1.00 . A A . 30 LYS O 1 1 7 4607 1 1 31 CYS C C 6.007 1.811 7.504 1.00 . A A . 31 CYS C 1 1 7 4608 1 1 31 CYS CA C 5.823 0.305 7.301 1.00 . A A . 31 CYS CA 1 1 7 4609 1 1 31 CYS CB C 5.008 -0.297 8.445 1.00 . A A . 31 CYS CB 1 1 7 4610 1 1 31 CYS H H 7.474 -0.723 8.224 1.00 . A A . 31 CYS H 1 1 7 4611 1 1 31 CYS HA H 5.339 0.106 6.358 1.00 . A A . 31 CYS HA 1 1 7 4612 1 1 31 CYS HB2 H 5.119 -1.371 8.440 1.00 . A A . 31 CYS HB2 1 1 7 4613 1 1 31 CYS HB3 H 5.362 0.097 9.386 1.00 . A A . 31 CYS HB3 1 1 7 4614 1 1 31 CYS N N 7.141 -0.388 7.367 1.00 . A A . 31 CYS N 1 1 7 4615 1 1 31 CYS O O 6.233 2.280 8.602 1.00 . A A . 31 CYS O 1 1 7 4616 1 1 31 CYS SG S 3.262 0.127 8.233 1.00 . A A . 31 CYS SG 1 1 7 4617 1 1 32 VAL C C 5.230 4.750 5.502 1.00 . A A . 32 VAL C 1 1 7 4618 1 1 32 VAL CA C 6.078 4.044 6.564 1.00 . A A . 32 VAL CA 1 1 7 4619 1 1 32 VAL CB C 7.562 4.289 6.309 1.00 . A A . 32 VAL CB 1 1 7 4620 1 1 32 VAL CG1 C 8.393 3.379 7.217 1.00 . A A . 32 VAL CG1 1 1 7 4621 1 1 32 VAL CG2 C 7.880 3.979 4.845 1.00 . A A . 32 VAL CG2 1 1 7 4622 1 1 32 VAL H H 5.729 2.166 5.575 1.00 . A A . 32 VAL H 1 1 7 4623 1 1 32 VAL HA H 5.810 4.383 7.552 1.00 . A A . 32 VAL HA 1 1 7 4624 1 1 32 VAL HB H 7.798 5.321 6.522 1.00 . A A . 32 VAL HB 1 1 7 4625 1 1 32 VAL HG11 H 9.439 3.623 7.107 1.00 . A A . 32 VAL HG11 1 1 7 4626 1 1 32 VAL HG12 H 8.231 2.349 6.937 1.00 . A A . 32 VAL HG12 1 1 7 4627 1 1 32 VAL HG13 H 8.094 3.527 8.244 1.00 . A A . 32 VAL HG13 1 1 7 4628 1 1 32 VAL HG21 H 8.895 4.274 4.627 1.00 . A A . 32 VAL HG21 1 1 7 4629 1 1 32 VAL HG22 H 7.201 4.524 4.206 1.00 . A A . 32 VAL HG22 1 1 7 4630 1 1 32 VAL HG23 H 7.766 2.919 4.669 1.00 . A A . 32 VAL HG23 1 1 7 4631 1 1 32 VAL N N 5.911 2.569 6.450 1.00 . A A . 32 VAL N 1 1 7 4632 1 1 32 VAL O O 4.606 4.119 4.671 1.00 . A A . 32 VAL O 1 1 7 4633 1 1 33 ARG C C 5.270 7.787 3.757 1.00 . A A . 33 ARG C 1 1 7 4634 1 1 33 ARG CA C 4.388 6.788 4.510 1.00 . A A . 33 ARG CA 1 1 7 4635 1 1 33 ARG CB C 3.304 7.516 5.303 1.00 . A A . 33 ARG CB 1 1 7 4636 1 1 33 ARG CD C 1.215 8.779 4.750 1.00 . A A . 33 ARG CD 1 1 7 4637 1 1 33 ARG CG C 1.997 7.487 4.506 1.00 . A A . 33 ARG CG 1 1 7 4638 1 1 33 ARG CZ C 0.807 9.606 2.509 1.00 . A A . 33 ARG CZ 1 1 7 4639 1 1 33 ARG H H 5.702 6.545 6.201 1.00 . A A . 33 ARG H 1 1 7 4640 1 1 33 ARG HA H 3.934 6.095 3.820 1.00 . A A . 33 ARG HA 1 1 7 4641 1 1 33 ARG HB2 H 3.160 7.024 6.254 1.00 . A A . 33 ARG HB2 1 1 7 4642 1 1 33 ARG HB3 H 3.601 8.541 5.466 1.00 . A A . 33 ARG HB3 1 1 7 4643 1 1 33 ARG HD2 H 0.603 8.685 5.637 1.00 . A A . 33 ARG HD2 1 1 7 4644 1 1 33 ARG HD3 H 1.889 9.616 4.843 1.00 . A A . 33 ARG HD3 1 1 7 4645 1 1 33 ARG HE H -0.540 8.554 3.521 1.00 . A A . 33 ARG HE 1 1 7 4646 1 1 33 ARG HG2 H 2.224 7.396 3.452 1.00 . A A . 33 ARG HG2 1 1 7 4647 1 1 33 ARG HG3 H 1.403 6.644 4.820 1.00 . A A . 33 ARG HG3 1 1 7 4648 1 1 33 ARG HH11 H 1.738 8.026 1.704 1.00 . A A . 33 ARG HH11 1 1 7 4649 1 1 33 ARG HH12 H 1.872 9.508 0.817 1.00 . A A . 33 ARG HH12 1 1 7 4650 1 1 33 ARG HH21 H -0.022 11.339 3.071 1.00 . A A . 33 ARG HH21 1 1 7 4651 1 1 33 ARG HH22 H 0.876 11.382 1.590 1.00 . A A . 33 ARG HH22 1 1 7 4652 1 1 33 ARG N N 5.195 6.052 5.523 1.00 . A A . 33 ARG N 1 1 7 4653 1 1 33 ARG NE N 0.359 8.943 3.541 1.00 . A A . 33 ARG NE 1 1 7 4654 1 1 33 ARG NH1 N 1.528 8.999 1.606 1.00 . A A . 33 ARG NH1 1 1 7 4655 1 1 33 ARG NH2 N 0.532 10.874 2.380 1.00 . A A . 33 ARG NH2 1 1 7 4656 1 1 33 ARG O O 6.437 7.948 4.059 1.00 . A A . 33 ARG O 1 1 7 4657 1 1 34 SER C C 6.449 10.222 2.916 1.00 . A A . 34 SER C 1 1 7 4658 1 1 34 SER CA C 5.516 9.437 1.990 1.00 . A A . 34 SER CA 1 1 7 4659 1 1 34 SER CB C 4.482 10.368 1.361 1.00 . A A . 34 SER CB 1 1 7 4660 1 1 34 SER H H 3.777 8.292 2.549 1.00 . A A . 34 SER H 1 1 7 4661 1 1 34 SER HA H 6.082 8.939 1.218 1.00 . A A . 34 SER HA 1 1 7 4662 1 1 34 SER HB2 H 3.493 10.067 1.662 1.00 . A A . 34 SER HB2 1 1 7 4663 1 1 34 SER HB3 H 4.664 11.383 1.692 1.00 . A A . 34 SER HB3 1 1 7 4664 1 1 34 SER HG H 5.364 10.781 -0.324 1.00 . A A . 34 SER HG 1 1 7 4665 1 1 34 SER N N 4.718 8.448 2.774 1.00 . A A . 34 SER N 1 1 7 4666 1 1 34 SER O O 7.523 10.636 2.528 1.00 . A A . 34 SER O 1 1 7 4667 1 1 34 SER OG O 4.583 10.293 -0.055 1.00 . A A . 34 SER OG 1 1 7 4668 1 1 35 GLU C C 8.267 10.469 5.232 1.00 . A A . 35 GLU C 1 1 7 4669 1 1 35 GLU CA C 6.916 11.173 5.094 1.00 . A A . 35 GLU CA 1 1 7 4670 1 1 35 GLU CB C 6.161 11.147 6.424 1.00 . A A . 35 GLU CB 1 1 7 4671 1 1 35 GLU CD C 5.327 13.397 7.115 1.00 . A A . 35 GLU CD 1 1 7 4672 1 1 35 GLU CG C 4.978 12.113 6.360 1.00 . A A . 35 GLU CG 1 1 7 4673 1 1 35 GLU H H 5.182 10.076 4.439 1.00 . A A . 35 GLU H 1 1 7 4674 1 1 35 GLU HA H 7.050 12.190 4.764 1.00 . A A . 35 GLU HA 1 1 7 4675 1 1 35 GLU HB2 H 5.800 10.146 6.613 1.00 . A A . 35 GLU HB2 1 1 7 4676 1 1 35 GLU HB3 H 6.826 11.447 7.221 1.00 . A A . 35 GLU HB3 1 1 7 4677 1 1 35 GLU HG2 H 4.760 12.349 5.328 1.00 . A A . 35 GLU HG2 1 1 7 4678 1 1 35 GLU HG3 H 4.112 11.655 6.814 1.00 . A A . 35 GLU HG3 1 1 7 4679 1 1 35 GLU N N 6.049 10.423 4.142 1.00 . A A . 35 GLU N 1 1 7 4680 1 1 35 GLU O O 9.305 11.098 5.281 1.00 . A A . 35 GLU O 1 1 7 4681 1 1 35 GLU OE1 O 6.498 13.741 7.147 1.00 . A A . 35 GLU OE1 1 1 7 4682 1 1 35 GLU OE2 O 4.420 14.013 7.650 1.00 . A A . 35 GLU OE2 1 1 7 4683 1 1 36 GLU C C 10.048 7.983 4.046 1.00 . A A . 36 GLU C 1 1 7 4684 1 1 36 GLU CA C 9.544 8.421 5.424 1.00 . A A . 36 GLU CA 1 1 7 4685 1 1 36 GLU CB C 9.209 7.205 6.287 1.00 . A A . 36 GLU CB 1 1 7 4686 1 1 36 GLU CD C 11.044 6.345 7.750 1.00 . A A . 36 GLU CD 1 1 7 4687 1 1 36 GLU CG C 9.890 7.344 7.650 1.00 . A A . 36 GLU CG 1 1 7 4688 1 1 36 GLU H H 7.413 8.677 5.248 1.00 . A A . 36 GLU H 1 1 7 4689 1 1 36 GLU HA H 10.283 9.031 5.918 1.00 . A A . 36 GLU HA 1 1 7 4690 1 1 36 GLU HB2 H 8.140 7.146 6.422 1.00 . A A . 36 GLU HB2 1 1 7 4691 1 1 36 GLU HB3 H 9.562 6.309 5.800 1.00 . A A . 36 GLU HB3 1 1 7 4692 1 1 36 GLU HG2 H 10.272 8.350 7.760 1.00 . A A . 36 GLU HG2 1 1 7 4693 1 1 36 GLU HG3 H 9.174 7.142 8.431 1.00 . A A . 36 GLU HG3 1 1 7 4694 1 1 36 GLU N N 8.261 9.166 5.291 1.00 . A A . 36 GLU N 1 1 7 4695 1 1 36 GLU O O 11.191 8.200 3.698 1.00 . A A . 36 GLU O 1 1 7 4696 1 1 36 GLU OE1 O 10.814 5.176 7.488 1.00 . A A . 36 GLU OE1 1 1 7 4697 1 1 36 GLU OE2 O 12.138 6.767 8.085 1.00 . A A . 36 GLU OE2 1 1 7 4698 1 1 37 CYS C C 9.033 7.817 0.822 1.00 . A A . 37 CYS C 1 1 7 4699 1 1 37 CYS CA C 9.656 6.930 1.904 1.00 . A A . 37 CYS CA 1 1 7 4700 1 1 37 CYS CB C 9.187 5.476 1.768 1.00 . A A . 37 CYS CB 1 1 7 4701 1 1 37 CYS H H 8.284 7.204 3.549 1.00 . A A . 37 CYS H 1 1 7 4702 1 1 37 CYS HA H 10.732 6.972 1.841 1.00 . A A . 37 CYS HA 1 1 7 4703 1 1 37 CYS HB2 H 9.549 5.070 0.834 1.00 . A A . 37 CYS HB2 1 1 7 4704 1 1 37 CYS HB3 H 9.584 4.895 2.587 1.00 . A A . 37 CYS HB3 1 1 7 4705 1 1 37 CYS N N 9.206 7.370 3.256 1.00 . A A . 37 CYS N 1 1 7 4706 1 1 37 CYS O O 8.110 7.427 0.134 1.00 . A A . 37 CYS O 1 1 7 4707 1 1 37 CYS SG S 7.378 5.395 1.794 1.00 . A A . 37 CYS SG 1 1 7 4708 1 1 38 LEU C C 9.639 9.669 -1.728 1.00 . A A . 38 LEU C 1 1 7 4709 1 1 38 LEU CA C 8.977 9.928 -0.371 1.00 . A A . 38 LEU CA 1 1 7 4710 1 1 38 LEU CB C 9.306 11.336 0.125 1.00 . A A . 38 LEU CB 1 1 7 4711 1 1 38 LEU CD1 C 11.012 12.679 -1.111 1.00 . A A . 38 LEU CD1 1 1 7 4712 1 1 38 LEU CD2 C 11.388 12.081 1.285 1.00 . A A . 38 LEU CD2 1 1 7 4713 1 1 38 LEU CG C 10.802 11.602 -0.045 1.00 . A A . 38 LEU CG 1 1 7 4714 1 1 38 LEU H H 10.281 9.307 1.228 1.00 . A A . 38 LEU H 1 1 7 4715 1 1 38 LEU HA H 7.908 9.805 -0.444 1.00 . A A . 38 LEU HA 1 1 7 4716 1 1 38 LEU HB2 H 8.744 12.060 -0.448 1.00 . A A . 38 LEU HB2 1 1 7 4717 1 1 38 LEU HB3 H 9.043 11.421 1.168 1.00 . A A . 38 LEU HB3 1 1 7 4718 1 1 38 LEU HD11 H 11.385 13.579 -0.644 1.00 . A A . 38 LEU HD11 1 1 7 4719 1 1 38 LEU HD12 H 10.073 12.889 -1.600 1.00 . A A . 38 LEU HD12 1 1 7 4720 1 1 38 LEU HD13 H 11.728 12.329 -1.840 1.00 . A A . 38 LEU HD13 1 1 7 4721 1 1 38 LEU HD21 H 10.635 12.011 2.056 1.00 . A A . 38 LEU HD21 1 1 7 4722 1 1 38 LEU HD22 H 11.710 13.108 1.188 1.00 . A A . 38 LEU HD22 1 1 7 4723 1 1 38 LEU HD23 H 12.232 11.462 1.549 1.00 . A A . 38 LEU HD23 1 1 7 4724 1 1 38 LEU HG H 11.297 10.692 -0.351 1.00 . A A . 38 LEU HG 1 1 7 4725 1 1 38 LEU N N 9.535 9.012 0.665 1.00 . A A . 38 LEU N 1 1 7 4726 1 1 38 LEU O O 9.741 10.551 -2.556 1.00 . A A . 38 LEU O 1 1 7 4727 1 1 39 SER C C 9.677 8.141 -4.386 1.00 . A A . 39 SER C 1 1 7 4728 1 1 39 SER CA C 10.729 8.158 -3.274 1.00 . A A . 39 SER CA 1 1 7 4729 1 1 39 SER CB C 11.350 6.772 -3.099 1.00 . A A . 39 SER CB 1 1 7 4730 1 1 39 SER H H 9.989 7.763 -1.291 1.00 . A A . 39 SER H 1 1 7 4731 1 1 39 SER HA H 11.498 8.881 -3.493 1.00 . A A . 39 SER HA 1 1 7 4732 1 1 39 SER HB2 H 11.548 6.593 -2.055 1.00 . A A . 39 SER HB2 1 1 7 4733 1 1 39 SER HB3 H 10.663 6.023 -3.466 1.00 . A A . 39 SER HB3 1 1 7 4734 1 1 39 SER HG H 13.280 6.981 -3.237 1.00 . A A . 39 SER HG 1 1 7 4735 1 1 39 SER N N 10.084 8.464 -1.967 1.00 . A A . 39 SER N 1 1 7 4736 1 1 39 SER O O 9.989 7.974 -5.548 1.00 . A A . 39 SER O 1 1 7 4737 1 1 39 SER OG O 12.571 6.711 -3.825 1.00 . A A . 39 SER OG 1 1 7 4738 1 1 40 GLY C C 6.731 6.918 -5.162 1.00 . A A . 40 GLY C 1 1 7 4739 1 1 40 GLY CA C 7.359 8.310 -5.074 1.00 . A A . 40 GLY CA 1 1 7 4740 1 1 40 GLY H H 8.197 8.447 -3.097 1.00 . A A . 40 GLY H 1 1 7 4741 1 1 40 GLY HA2 H 6.600 9.033 -4.808 1.00 . A A . 40 GLY HA2 1 1 7 4742 1 1 40 GLY HA3 H 7.783 8.570 -6.032 1.00 . A A . 40 GLY HA3 1 1 7 4743 1 1 40 GLY N N 8.430 8.314 -4.039 1.00 . A A . 40 GLY N 1 1 7 4744 1 1 40 GLY O O 6.062 6.590 -6.121 1.00 . A A . 40 GLY O 1 1 7 4745 1 1 41 THR C C 5.819 4.332 -2.826 1.00 . A A . 41 THR C 1 1 7 4746 1 1 41 THR CA C 6.356 4.724 -4.206 1.00 . A A . 41 THR CA 1 1 7 4747 1 1 41 THR CB C 7.513 3.810 -4.609 1.00 . A A . 41 THR CB 1 1 7 4748 1 1 41 THR CG2 C 8.619 3.895 -3.558 1.00 . A A . 41 THR CG2 1 1 7 4749 1 1 41 THR H H 7.487 6.377 -3.406 1.00 . A A . 41 THR H 1 1 7 4750 1 1 41 THR HA H 5.571 4.669 -4.944 1.00 . A A . 41 THR HA 1 1 7 4751 1 1 41 THR HB H 7.904 4.123 -5.564 1.00 . A A . 41 THR HB 1 1 7 4752 1 1 41 THR HG1 H 6.101 2.494 -4.871 1.00 . A A . 41 THR HG1 1 1 7 4753 1 1 41 THR HG21 H 9.554 3.573 -3.992 1.00 . A A . 41 THR HG21 1 1 7 4754 1 1 41 THR HG22 H 8.371 3.256 -2.723 1.00 . A A . 41 THR HG22 1 1 7 4755 1 1 41 THR HG23 H 8.713 4.915 -3.216 1.00 . A A . 41 THR HG23 1 1 7 4756 1 1 41 THR N N 6.943 6.095 -4.171 1.00 . A A . 41 THR N 1 1 7 4757 1 1 41 THR O O 6.567 4.143 -1.888 1.00 . A A . 41 THR O 1 1 7 4758 1 1 41 THR OG1 O 7.046 2.469 -4.702 1.00 . A A . 41 THR OG1 1 1 7 4759 1 1 42 TRP C C 2.910 2.695 -1.598 1.00 . A A . 42 TRP C 1 1 7 4760 1 1 42 TRP CA C 3.934 3.815 -1.389 1.00 . A A . 42 TRP CA 1 1 7 4761 1 1 42 TRP CB C 3.254 5.083 -0.873 1.00 . A A . 42 TRP CB 1 1 7 4762 1 1 42 TRP CD1 C 3.414 4.704 1.619 1.00 . A A . 42 TRP CD1 1 1 7 4763 1 1 42 TRP CD2 C 1.291 4.681 0.872 1.00 . A A . 42 TRP CD2 1 1 7 4764 1 1 42 TRP CE2 C 1.233 4.461 2.268 1.00 . A A . 42 TRP CE2 1 1 7 4765 1 1 42 TRP CE3 C 0.082 4.713 0.154 1.00 . A A . 42 TRP CE3 1 1 7 4766 1 1 42 TRP CG C 2.687 4.832 0.486 1.00 . A A . 42 TRP CG 1 1 7 4767 1 1 42 TRP CH2 C -1.176 4.314 2.199 1.00 . A A . 42 TRP CH2 1 1 7 4768 1 1 42 TRP CZ2 C 0.016 4.279 2.929 1.00 . A A . 42 TRP CZ2 1 1 7 4769 1 1 42 TRP CZ3 C -1.142 4.530 0.814 1.00 . A A . 42 TRP CZ3 1 1 7 4770 1 1 42 TRP H H 3.946 4.355 -3.474 1.00 . A A . 42 TRP H 1 1 7 4771 1 1 42 TRP HA H 4.704 3.499 -0.702 1.00 . A A . 42 TRP HA 1 1 7 4772 1 1 42 TRP HB2 H 3.978 5.882 -0.816 1.00 . A A . 42 TRP HB2 1 1 7 4773 1 1 42 TRP HB3 H 2.459 5.364 -1.547 1.00 . A A . 42 TRP HB3 1 1 7 4774 1 1 42 TRP HD1 H 4.490 4.765 1.686 1.00 . A A . 42 TRP HD1 1 1 7 4775 1 1 42 TRP HE1 H 2.826 4.357 3.612 1.00 . A A . 42 TRP HE1 1 1 7 4776 1 1 42 TRP HE3 H 0.097 4.879 -0.913 1.00 . A A . 42 TRP HE3 1 1 7 4777 1 1 42 TRP HH2 H -2.120 4.173 2.701 1.00 . A A . 42 TRP HH2 1 1 7 4778 1 1 42 TRP HZ2 H -0.003 4.112 3.995 1.00 . A A . 42 TRP HZ2 1 1 7 4779 1 1 42 TRP HZ3 H -2.065 4.557 0.254 1.00 . A A . 42 TRP HZ3 1 1 7 4780 1 1 42 TRP N N 4.527 4.202 -2.700 1.00 . A A . 42 TRP N 1 1 7 4781 1 1 42 TRP NE1 N 2.552 4.484 2.679 1.00 . A A . 42 TRP NE1 1 1 7 4782 1 1 42 TRP O O 2.091 2.753 -2.495 1.00 . A A . 42 TRP O 1 1 7 4783 1 1 43 THR C C 1.295 0.200 0.355 1.00 . A A . 43 THR C 1 1 7 4784 1 1 43 THR CA C 1.982 0.547 -0.970 1.00 . A A . 43 THR CA 1 1 7 4785 1 1 43 THR CB C 2.832 -0.630 -1.453 1.00 . A A . 43 THR CB 1 1 7 4786 1 1 43 THR CG2 C 4.041 -0.800 -0.530 1.00 . A A . 43 THR CG2 1 1 7 4787 1 1 43 THR H H 3.624 1.629 -0.078 1.00 . A A . 43 THR H 1 1 7 4788 1 1 43 THR HA H 1.249 0.800 -1.720 1.00 . A A . 43 THR HA 1 1 7 4789 1 1 43 THR HB H 3.175 -0.438 -2.457 1.00 . A A . 43 THR HB 1 1 7 4790 1 1 43 THR HG1 H 2.614 -2.541 -1.165 1.00 . A A . 43 THR HG1 1 1 7 4791 1 1 43 THR HG21 H 4.636 0.102 -0.543 1.00 . A A . 43 THR HG21 1 1 7 4792 1 1 43 THR HG22 H 4.641 -1.632 -0.869 1.00 . A A . 43 THR HG22 1 1 7 4793 1 1 43 THR HG23 H 3.699 -0.990 0.478 1.00 . A A . 43 THR HG23 1 1 7 4794 1 1 43 THR N N 2.952 1.667 -0.791 1.00 . A A . 43 THR N 1 1 7 4795 1 1 43 THR O O 1.843 0.389 1.421 1.00 . A A . 43 THR O 1 1 7 4796 1 1 43 THR OG1 O 2.048 -1.815 -1.438 1.00 . A A . 43 THR OG1 1 1 7 4797 1 1 44 GLN C C -1.244 -2.086 1.379 1.00 . A A . 44 GLN C 1 1 7 4798 1 1 44 GLN CA C -0.629 -0.694 1.536 1.00 . A A . 44 GLN CA 1 1 7 4799 1 1 44 GLN CB C -1.722 0.364 1.698 1.00 . A A . 44 GLN CB 1 1 7 4800 1 1 44 GLN CD C -3.891 -0.561 0.865 1.00 . A A . 44 GLN CD 1 1 7 4801 1 1 44 GLN CG C -2.679 0.301 0.506 1.00 . A A . 44 GLN CG 1 1 7 4802 1 1 44 GLN H H -0.322 -0.469 -0.584 1.00 . A A . 44 GLN H 1 1 7 4803 1 1 44 GLN HA H 0.038 -0.672 2.383 1.00 . A A . 44 GLN HA 1 1 7 4804 1 1 44 GLN HB2 H -2.271 0.179 2.611 1.00 . A A . 44 GLN HB2 1 1 7 4805 1 1 44 GLN HB3 H -1.270 1.344 1.743 1.00 . A A . 44 GLN HB3 1 1 7 4806 1 1 44 GLN HE21 H -4.462 0.613 2.362 1.00 . A A . 44 GLN HE21 1 1 7 4807 1 1 44 GLN HE22 H -5.441 -0.747 2.094 1.00 . A A . 44 GLN HE22 1 1 7 4808 1 1 44 GLN HG2 H -3.009 1.300 0.256 1.00 . A A . 44 GLN HG2 1 1 7 4809 1 1 44 GLN HG3 H -2.171 -0.132 -0.341 1.00 . A A . 44 GLN HG3 1 1 7 4810 1 1 44 GLN N N 0.098 -0.320 0.289 1.00 . A A . 44 GLN N 1 1 7 4811 1 1 44 GLN NE2 N -4.662 -0.202 1.856 1.00 . A A . 44 GLN NE2 1 1 7 4812 1 1 44 GLN O O -2.175 -2.449 2.072 1.00 . A A . 44 GLN O 1 1 7 4813 1 1 44 GLN OE1 O -4.140 -1.572 0.238 1.00 . A A . 44 GLN OE1 1 1 7 4814 1 1 45 GLN C C -0.201 -5.164 -0.310 1.00 . A A . 45 GLN C 1 1 7 4815 1 1 45 GLN CA C -1.279 -4.240 0.265 1.00 . A A . 45 GLN CA 1 1 7 4816 1 1 45 GLN CB C -2.421 -4.063 -0.737 1.00 . A A . 45 GLN CB 1 1 7 4817 1 1 45 GLN CD C -4.123 -5.279 -2.104 1.00 . A A . 45 GLN CD 1 1 7 4818 1 1 45 GLN CG C -3.127 -5.403 -0.950 1.00 . A A . 45 GLN CG 1 1 7 4819 1 1 45 GLN H H 0.022 -2.558 -0.077 1.00 . A A . 45 GLN H 1 1 7 4820 1 1 45 GLN HA H -1.661 -4.637 1.192 1.00 . A A . 45 GLN HA 1 1 7 4821 1 1 45 GLN HB2 H -3.127 -3.340 -0.355 1.00 . A A . 45 GLN HB2 1 1 7 4822 1 1 45 GLN HB3 H -2.023 -3.715 -1.679 1.00 . A A . 45 GLN HB3 1 1 7 4823 1 1 45 GLN HE21 H -2.734 -4.799 -3.437 1.00 . A A . 45 GLN HE21 1 1 7 4824 1 1 45 GLN HE22 H -4.319 -4.879 -4.037 1.00 . A A . 45 GLN HE22 1 1 7 4825 1 1 45 GLN HG2 H -2.394 -6.161 -1.186 1.00 . A A . 45 GLN HG2 1 1 7 4826 1 1 45 GLN HG3 H -3.654 -5.680 -0.050 1.00 . A A . 45 GLN HG3 1 1 7 4827 1 1 45 GLN N N -0.729 -2.870 0.470 1.00 . A A . 45 GLN N 1 1 7 4828 1 1 45 GLN NE2 N -3.690 -4.959 -3.292 1.00 . A A . 45 GLN NE2 1 1 7 4829 1 1 45 GLN O O 0.135 -5.091 -1.475 1.00 . A A . 45 GLN O 1 1 7 4830 1 1 45 GLN OE1 O -5.308 -5.477 -1.922 1.00 . A A . 45 GLN OE1 1 1 7 4831 1 1 46 ILE C C 1.345 -8.285 0.767 1.00 . A A . 46 ILE C 1 1 7 4832 1 1 46 ILE CA C 1.394 -6.963 -0.006 1.00 . A A . 46 ILE CA 1 1 7 4833 1 1 46 ILE CB C 2.719 -6.240 0.241 1.00 . A A . 46 ILE CB 1 1 7 4834 1 1 46 ILE CD1 C 4.940 -6.646 -0.826 1.00 . A A . 46 ILE CD1 1 1 7 4835 1 1 46 ILE CG1 C 3.875 -7.234 0.101 1.00 . A A . 46 ILE CG1 1 1 7 4836 1 1 46 ILE CG2 C 2.729 -5.645 1.651 1.00 . A A . 46 ILE CG2 1 1 7 4837 1 1 46 ILE H H 0.055 -6.079 1.433 1.00 . A A . 46 ILE H 1 1 7 4838 1 1 46 ILE HA H 1.265 -7.141 -1.061 1.00 . A A . 46 ILE HA 1 1 7 4839 1 1 46 ILE HB H 2.836 -5.448 -0.483 1.00 . A A . 46 ILE HB 1 1 7 4840 1 1 46 ILE HD11 H 4.785 -5.582 -0.923 1.00 . A A . 46 ILE HD11 1 1 7 4841 1 1 46 ILE HD12 H 4.869 -7.111 -1.798 1.00 . A A . 46 ILE HD12 1 1 7 4842 1 1 46 ILE HD13 H 5.919 -6.830 -0.409 1.00 . A A . 46 ILE HD13 1 1 7 4843 1 1 46 ILE HG12 H 4.306 -7.425 1.072 1.00 . A A . 46 ILE HG12 1 1 7 4844 1 1 46 ILE HG13 H 3.505 -8.158 -0.319 1.00 . A A . 46 ILE HG13 1 1 7 4845 1 1 46 ILE HG21 H 1.979 -4.872 1.720 1.00 . A A . 46 ILE HG21 1 1 7 4846 1 1 46 ILE HG22 H 3.702 -5.223 1.856 1.00 . A A . 46 ILE HG22 1 1 7 4847 1 1 46 ILE HG23 H 2.515 -6.421 2.370 1.00 . A A . 46 ILE HG23 1 1 7 4848 1 1 46 ILE N N 0.342 -6.034 0.497 1.00 . A A . 46 ILE N 1 1 7 4849 1 1 46 ILE O O 1.538 -9.347 0.210 1.00 . A A . 46 ILE O 1 1 7 4850 1 1 47 CYS C C -0.402 -9.651 3.423 1.00 . A A . 47 CYS C 1 1 7 4851 1 1 47 CYS CA C 1.005 -9.485 2.843 1.00 . A A . 47 CYS CA 1 1 7 4852 1 1 47 CYS CB C 2.039 -9.317 3.958 1.00 . A A . 47 CYS CB 1 1 7 4853 1 1 47 CYS H H 0.917 -7.364 2.475 1.00 . A A . 47 CYS H 1 1 7 4854 1 1 47 CYS HA H 1.260 -10.335 2.229 1.00 . A A . 47 CYS HA 1 1 7 4855 1 1 47 CYS HB2 H 2.064 -10.211 4.562 1.00 . A A . 47 CYS HB2 1 1 7 4856 1 1 47 CYS HB3 H 3.014 -9.153 3.521 1.00 . A A . 47 CYS HB3 1 1 7 4857 1 1 47 CYS N N 1.077 -8.229 2.044 1.00 . A A . 47 CYS N 1 1 7 4858 1 1 47 CYS O O -1.002 -8.709 3.900 1.00 . A A . 47 CYS O 1 1 7 4859 1 1 47 CYS SG S 1.600 -7.901 4.997 1.00 . A A . 47 CYS SG 1 1 7 4860 1 1 48 LEU C C -2.234 -11.659 5.327 1.00 . A A . 48 LEU C 1 1 7 4861 1 1 48 LEU CA C -2.306 -11.066 3.918 1.00 . A A . 48 LEU CA 1 1 7 4862 1 1 48 LEU CB C -2.949 -12.057 2.948 1.00 . A A . 48 LEU CB 1 1 7 4863 1 1 48 LEU CD1 C -3.453 -10.453 1.102 1.00 . A A . 48 LEU CD1 1 1 7 4864 1 1 48 LEU CD2 C -4.947 -12.415 1.495 1.00 . A A . 48 LEU CD2 1 1 7 4865 1 1 48 LEU CG C -4.066 -11.362 2.168 1.00 . A A . 48 LEU CG 1 1 7 4866 1 1 48 LEU H H -0.436 -11.587 2.983 1.00 . A A . 48 LEU H 1 1 7 4867 1 1 48 LEU HA H -2.863 -10.143 3.925 1.00 . A A . 48 LEU HA 1 1 7 4868 1 1 48 LEU HB2 H -2.202 -12.421 2.258 1.00 . A A . 48 LEU HB2 1 1 7 4869 1 1 48 LEU HB3 H -3.362 -12.886 3.503 1.00 . A A . 48 LEU HB3 1 1 7 4870 1 1 48 LEU HD11 H -3.683 -9.422 1.330 1.00 . A A . 48 LEU HD11 1 1 7 4871 1 1 48 LEU HD12 H -3.859 -10.708 0.136 1.00 . A A . 48 LEU HD12 1 1 7 4872 1 1 48 LEU HD13 H -2.381 -10.587 1.089 1.00 . A A . 48 LEU HD13 1 1 7 4873 1 1 48 LEU HD21 H -5.387 -13.052 2.248 1.00 . A A . 48 LEU HD21 1 1 7 4874 1 1 48 LEU HD22 H -4.347 -13.012 0.825 1.00 . A A . 48 LEU HD22 1 1 7 4875 1 1 48 LEU HD23 H -5.731 -11.925 0.936 1.00 . A A . 48 LEU HD23 1 1 7 4876 1 1 48 LEU HG H -4.664 -10.769 2.847 1.00 . A A . 48 LEU HG 1 1 7 4877 1 1 48 LEU N N -0.935 -10.841 3.377 1.00 . A A . 48 LEU N 1 1 7 4878 1 1 48 LEU O O -1.357 -12.475 5.562 1.00 . A A . 48 LEU O 1 1 7 4879 1 1 48 LEU OXT O -3.057 -11.290 6.147 1.00 . A A . 48 LEU OXT 1 1 8 4880 1 1 1 GLY C C -6.293 10.593 10.580 1.00 . A A . 1 GLY C 1 1 8 4881 1 1 1 GLY CA C -7.474 9.914 9.883 1.00 . A A . 1 GLY CA 1 1 8 4882 1 1 1 GLY H1 H -6.074 9.722 8.353 1.00 . A A . 1 GLY H1 1 1 8 4883 1 1 1 GLY H2 H -7.625 10.166 7.820 1.00 . A A . 1 GLY H2 1 1 8 4884 1 1 1 GLY H3 H -7.314 8.567 8.302 1.00 . A A . 1 GLY H3 1 1 8 4885 1 1 1 GLY HA2 H -8.321 10.586 9.869 1.00 . A A . 1 GLY HA2 1 1 8 4886 1 1 1 GLY HA3 H -7.737 9.015 10.420 1.00 . A A . 1 GLY HA3 1 1 8 4887 1 1 1 GLY N N -7.093 9.566 8.484 1.00 . A A . 1 GLY N 1 1 8 4888 1 1 1 GLY O O -6.104 11.788 10.479 1.00 . A A . 1 GLY O 1 1 8 4889 1 1 2 SER C C -3.152 9.465 11.997 1.00 . A A . 2 SER C 1 1 8 4890 1 1 2 SER CA C -4.328 10.443 11.989 1.00 . A A . 2 SER CA 1 1 8 4891 1 1 2 SER CB C -4.813 10.708 13.414 1.00 . A A . 2 SER CB 1 1 8 4892 1 1 2 SER H H -5.666 8.877 11.356 1.00 . A A . 2 SER H 1 1 8 4893 1 1 2 SER HA H -4.043 11.371 11.519 1.00 . A A . 2 SER HA 1 1 8 4894 1 1 2 SER HB2 H -4.501 9.901 14.057 1.00 . A A . 2 SER HB2 1 1 8 4895 1 1 2 SER HB3 H -4.388 11.636 13.771 1.00 . A A . 2 SER HB3 1 1 8 4896 1 1 2 SER HG H -6.486 11.544 12.884 1.00 . A A . 2 SER HG 1 1 8 4897 1 1 2 SER N N -5.496 9.840 11.287 1.00 . A A . 2 SER N 1 1 8 4898 1 1 2 SER O O -3.331 8.264 12.038 1.00 . A A . 2 SER O 1 1 8 4899 1 1 2 SER OG O -6.231 10.788 13.418 1.00 . A A . 2 SER OG 1 1 8 4900 1 1 3 ALA C C -0.708 8.266 13.267 1.00 . A A . 3 ALA C 1 1 8 4901 1 1 3 ALA CA C -0.762 9.067 11.962 1.00 . A A . 3 ALA CA 1 1 8 4902 1 1 3 ALA CB C 0.445 10.000 11.855 1.00 . A A . 3 ALA CB 1 1 8 4903 1 1 3 ALA H H -1.826 10.940 11.924 1.00 . A A . 3 ALA H 1 1 8 4904 1 1 3 ALA HA H -0.790 8.403 11.114 1.00 . A A . 3 ALA HA 1 1 8 4905 1 1 3 ALA HB1 H 0.713 10.357 12.837 1.00 . A A . 3 ALA HB1 1 1 8 4906 1 1 3 ALA HB2 H 0.196 10.839 11.221 1.00 . A A . 3 ALA HB2 1 1 8 4907 1 1 3 ALA HB3 H 1.278 9.462 11.427 1.00 . A A . 3 ALA HB3 1 1 8 4908 1 1 3 ALA N N -1.949 9.969 11.958 1.00 . A A . 3 ALA N 1 1 8 4909 1 1 3 ALA O O -1.719 8.010 13.891 1.00 . A A . 3 ALA O 1 1 8 4910 1 1 4 MET C C -0.376 5.890 14.919 1.00 . A A . 4 MET C 1 1 8 4911 1 1 4 MET CA C 0.585 7.082 14.944 1.00 . A A . 4 MET CA 1 1 8 4912 1 1 4 MET CB C 0.203 8.057 16.059 1.00 . A A . 4 MET CB 1 1 8 4913 1 1 4 MET CE C 1.712 11.567 15.381 1.00 . A A . 4 MET CE 1 1 8 4914 1 1 4 MET CG C 1.354 9.035 16.296 1.00 . A A . 4 MET CG 1 1 8 4915 1 1 4 MET H H 1.266 8.086 13.162 1.00 . A A . 4 MET H 1 1 8 4916 1 1 4 MET HA H 1.600 6.746 15.083 1.00 . A A . 4 MET HA 1 1 8 4917 1 1 4 MET HB2 H -0.683 8.605 15.771 1.00 . A A . 4 MET HB2 1 1 8 4918 1 1 4 MET HB3 H 0.008 7.508 16.968 1.00 . A A . 4 MET HB3 1 1 8 4919 1 1 4 MET HE1 H 1.754 12.616 15.638 1.00 . A A . 4 MET HE1 1 1 8 4920 1 1 4 MET HE2 H 1.284 11.459 14.396 1.00 . A A . 4 MET HE2 1 1 8 4921 1 1 4 MET HE3 H 2.710 11.149 15.386 1.00 . A A . 4 MET HE3 1 1 8 4922 1 1 4 MET HG2 H 1.924 8.720 17.157 1.00 . A A . 4 MET HG2 1 1 8 4923 1 1 4 MET HG3 H 1.995 9.054 15.427 1.00 . A A . 4 MET HG3 1 1 8 4924 1 1 4 MET N N 0.463 7.869 13.682 1.00 . A A . 4 MET N 1 1 8 4925 1 1 4 MET O O -0.981 5.546 15.915 1.00 . A A . 4 MET O 1 1 8 4926 1 1 4 MET SD S 0.687 10.692 16.589 1.00 . A A . 4 MET SD 1 1 8 4927 1 1 5 GLY C C -0.666 2.869 13.186 1.00 . A A . 5 GLY C 1 1 8 4928 1 1 5 GLY CA C -1.438 4.083 13.702 1.00 . A A . 5 GLY CA 1 1 8 4929 1 1 5 GLY H H -0.020 5.546 12.996 1.00 . A A . 5 GLY H 1 1 8 4930 1 1 5 GLY HA2 H -1.839 3.868 14.682 1.00 . A A . 5 GLY HA2 1 1 8 4931 1 1 5 GLY HA3 H -2.246 4.307 13.022 1.00 . A A . 5 GLY HA3 1 1 8 4932 1 1 5 GLY N N -0.519 5.254 13.788 1.00 . A A . 5 GLY N 1 1 8 4933 1 1 5 GLY O O -0.333 1.970 13.931 1.00 . A A . 5 GLY O 1 1 8 4934 1 1 6 CYS C C 1.888 1.976 11.392 1.00 . A A . 6 CYS C 1 1 8 4935 1 1 6 CYS CA C 0.388 1.681 11.356 1.00 . A A . 6 CYS CA 1 1 8 4936 1 1 6 CYS CB C -0.102 1.510 9.912 1.00 . A A . 6 CYS CB 1 1 8 4937 1 1 6 CYS H H -0.644 3.576 11.336 1.00 . A A . 6 CYS H 1 1 8 4938 1 1 6 CYS HA H 0.173 0.787 11.921 1.00 . A A . 6 CYS HA 1 1 8 4939 1 1 6 CYS HB2 H 0.502 0.766 9.416 1.00 . A A . 6 CYS HB2 1 1 8 4940 1 1 6 CYS HB3 H -1.133 1.184 9.921 1.00 . A A . 6 CYS HB3 1 1 8 4941 1 1 6 CYS N N -0.373 2.838 11.915 1.00 . A A . 6 CYS N 1 1 8 4942 1 1 6 CYS O O 2.710 1.093 11.256 1.00 . A A . 6 CYS O 1 1 8 4943 1 1 6 CYS SG S 0.023 3.079 9.012 1.00 . A A . 6 CYS SG 1 1 8 4944 1 1 7 ARG C C 4.355 2.966 12.868 1.00 . A A . 7 ARG C 1 1 8 4945 1 1 7 ARG CA C 3.697 3.573 11.624 1.00 . A A . 7 ARG CA 1 1 8 4946 1 1 7 ARG CB C 3.726 5.102 11.693 1.00 . A A . 7 ARG CB 1 1 8 4947 1 1 7 ARG CD C 5.216 5.490 9.720 1.00 . A A . 7 ARG CD 1 1 8 4948 1 1 7 ARG CG C 5.099 5.609 11.241 1.00 . A A . 7 ARG CG 1 1 8 4949 1 1 7 ARG CZ C 4.653 7.796 9.241 1.00 . A A . 7 ARG CZ 1 1 8 4950 1 1 7 ARG H H 1.569 3.913 11.684 1.00 . A A . 7 ARG H 1 1 8 4951 1 1 7 ARG HA H 4.196 3.236 10.730 1.00 . A A . 7 ARG HA 1 1 8 4952 1 1 7 ARG HB2 H 2.961 5.505 11.046 1.00 . A A . 7 ARG HB2 1 1 8 4953 1 1 7 ARG HB3 H 3.544 5.419 12.708 1.00 . A A . 7 ARG HB3 1 1 8 4954 1 1 7 ARG HD2 H 5.999 4.792 9.458 1.00 . A A . 7 ARG HD2 1 1 8 4955 1 1 7 ARG HD3 H 4.275 5.180 9.293 1.00 . A A . 7 ARG HD3 1 1 8 4956 1 1 7 ARG HE H 6.473 7.059 8.948 1.00 . A A . 7 ARG HE 1 1 8 4957 1 1 7 ARG HG2 H 5.212 6.645 11.532 1.00 . A A . 7 ARG HG2 1 1 8 4958 1 1 7 ARG HG3 H 5.873 5.019 11.707 1.00 . A A . 7 ARG HG3 1 1 8 4959 1 1 7 ARG HH11 H 3.835 7.199 7.515 1.00 . A A . 7 ARG HH11 1 1 8 4960 1 1 7 ARG HH12 H 3.100 8.583 8.252 1.00 . A A . 7 ARG HH12 1 1 8 4961 1 1 7 ARG HH21 H 5.259 8.612 10.967 1.00 . A A . 7 ARG HH21 1 1 8 4962 1 1 7 ARG HH22 H 3.906 9.383 10.208 1.00 . A A . 7 ARG HH22 1 1 8 4963 1 1 7 ARG N N 2.250 3.216 11.577 1.00 . A A . 7 ARG N 1 1 8 4964 1 1 7 ARG NE N 5.562 6.861 9.251 1.00 . A A . 7 ARG NE 1 1 8 4965 1 1 7 ARG NH1 N 3.795 7.864 8.260 1.00 . A A . 7 ARG NH1 1 1 8 4966 1 1 7 ARG NH2 N 4.601 8.665 10.214 1.00 . A A . 7 ARG NH2 1 1 8 4967 1 1 7 ARG O O 5.564 2.905 12.970 1.00 . A A . 7 ARG O 1 1 8 4968 1 1 8 HIS C C 3.822 0.421 15.127 1.00 . A A . 8 HIS C 1 1 8 4969 1 1 8 HIS CA C 4.170 1.914 15.043 1.00 . A A . 8 HIS CA 1 1 8 4970 1 1 8 HIS CB C 3.572 2.716 16.215 1.00 . A A . 8 HIS CB 1 1 8 4971 1 1 8 HIS CD2 C 1.311 1.376 16.110 1.00 . A A . 8 HIS CD2 1 1 8 4972 1 1 8 HIS CE1 C 0.835 1.395 18.223 1.00 . A A . 8 HIS CE1 1 1 8 4973 1 1 8 HIS CG C 2.321 2.056 16.738 1.00 . A A . 8 HIS CG 1 1 8 4974 1 1 8 HIS H H 2.600 2.571 13.717 1.00 . A A . 8 HIS H 1 1 8 4975 1 1 8 HIS HA H 5.242 2.039 15.030 1.00 . A A . 8 HIS HA 1 1 8 4976 1 1 8 HIS HB2 H 4.299 2.779 17.010 1.00 . A A . 8 HIS HB2 1 1 8 4977 1 1 8 HIS HB3 H 3.333 3.714 15.874 1.00 . A A . 8 HIS HB3 1 1 8 4978 1 1 8 HIS HD1 H 2.520 2.464 18.807 1.00 . A A . 8 HIS HD1 1 1 8 4979 1 1 8 HIS HD2 H 1.255 1.184 15.048 1.00 . A A . 8 HIS HD2 1 1 8 4980 1 1 8 HIS HE1 H 0.336 1.234 19.167 1.00 . A A . 8 HIS HE1 1 1 8 4981 1 1 8 HIS N N 3.573 2.516 13.815 1.00 . A A . 8 HIS N 1 1 8 4982 1 1 8 HIS ND1 N 1.997 2.057 18.086 1.00 . A A . 8 HIS ND1 1 1 8 4983 1 1 8 HIS NE2 N 0.371 0.960 17.049 1.00 . A A . 8 HIS NE2 1 1 8 4984 1 1 8 HIS O O 4.266 -0.282 16.013 1.00 . A A . 8 HIS O 1 1 8 4985 1 1 9 PHE C C 3.936 -2.376 14.096 1.00 . A A . 9 PHE C 1 1 8 4986 1 1 9 PHE CA C 2.673 -1.518 14.226 1.00 . A A . 9 PHE CA 1 1 8 4987 1 1 9 PHE CB C 1.769 -1.722 13.006 1.00 . A A . 9 PHE CB 1 1 8 4988 1 1 9 PHE CD1 C -0.018 -0.816 14.577 1.00 . A A . 9 PHE CD1 1 1 8 4989 1 1 9 PHE CD2 C -0.623 -1.383 12.298 1.00 . A A . 9 PHE CD2 1 1 8 4990 1 1 9 PHE CE1 C -1.342 -0.431 14.828 1.00 . A A . 9 PHE CE1 1 1 8 4991 1 1 9 PHE CE2 C -1.944 -0.997 12.551 1.00 . A A . 9 PHE CE2 1 1 8 4992 1 1 9 PHE CG C 0.344 -1.295 13.307 1.00 . A A . 9 PHE CG 1 1 8 4993 1 1 9 PHE CZ C -2.304 -0.522 13.816 1.00 . A A . 9 PHE CZ 1 1 8 4994 1 1 9 PHE H H 2.696 0.510 13.493 1.00 . A A . 9 PHE H 1 1 8 4995 1 1 9 PHE HA H 2.144 -1.768 15.129 1.00 . A A . 9 PHE HA 1 1 8 4996 1 1 9 PHE HB2 H 2.148 -1.136 12.183 1.00 . A A . 9 PHE HB2 1 1 8 4997 1 1 9 PHE HB3 H 1.776 -2.767 12.732 1.00 . A A . 9 PHE HB3 1 1 8 4998 1 1 9 PHE HD1 H 0.719 -0.744 15.360 1.00 . A A . 9 PHE HD1 1 1 8 4999 1 1 9 PHE HD2 H -0.348 -1.749 11.324 1.00 . A A . 9 PHE HD2 1 1 8 5000 1 1 9 PHE HE1 H -1.620 -0.065 15.804 1.00 . A A . 9 PHE HE1 1 1 8 5001 1 1 9 PHE HE2 H -2.687 -1.068 11.769 1.00 . A A . 9 PHE HE2 1 1 8 5002 1 1 9 PHE HZ H -3.324 -0.224 14.012 1.00 . A A . 9 PHE HZ 1 1 8 5003 1 1 9 PHE N N 3.038 -0.070 14.204 1.00 . A A . 9 PHE N 1 1 8 5004 1 1 9 PHE O O 5.030 -1.868 13.947 1.00 . A A . 9 PHE O 1 1 8 5005 1 1 10 GLN C C 5.381 -4.725 12.558 1.00 . A A . 10 GLN C 1 1 8 5006 1 1 10 GLN CA C 4.988 -4.561 14.028 1.00 . A A . 10 GLN CA 1 1 8 5007 1 1 10 GLN CB C 4.548 -5.902 14.618 1.00 . A A . 10 GLN CB 1 1 8 5008 1 1 10 GLN CD C 3.533 -6.181 16.884 1.00 . A A . 10 GLN CD 1 1 8 5009 1 1 10 GLN CG C 4.831 -5.917 16.121 1.00 . A A . 10 GLN CG 1 1 8 5010 1 1 10 GLN H H 2.902 -4.064 14.269 1.00 . A A . 10 GLN H 1 1 8 5011 1 1 10 GLN HA H 5.811 -4.163 14.598 1.00 . A A . 10 GLN HA 1 1 8 5012 1 1 10 GLN HB2 H 3.489 -6.040 14.449 1.00 . A A . 10 GLN HB2 1 1 8 5013 1 1 10 GLN HB3 H 5.096 -6.701 14.142 1.00 . A A . 10 GLN HB3 1 1 8 5014 1 1 10 GLN HE21 H 4.449 -7.003 18.442 1.00 . A A . 10 GLN HE21 1 1 8 5015 1 1 10 GLN HE22 H 2.758 -6.918 18.557 1.00 . A A . 10 GLN HE22 1 1 8 5016 1 1 10 GLN HG2 H 5.546 -6.697 16.345 1.00 . A A . 10 GLN HG2 1 1 8 5017 1 1 10 GLN HG3 H 5.235 -4.963 16.421 1.00 . A A . 10 GLN HG3 1 1 8 5018 1 1 10 GLN N N 3.793 -3.674 14.150 1.00 . A A . 10 GLN N 1 1 8 5019 1 1 10 GLN NE2 N 3.585 -6.748 18.058 1.00 . A A . 10 GLN NE2 1 1 8 5020 1 1 10 GLN O O 6.187 -3.981 12.035 1.00 . A A . 10 GLN O 1 1 8 5021 1 1 10 GLN OE1 O 2.460 -5.870 16.407 1.00 . A A . 10 GLN OE1 1 1 8 5022 1 1 11 SER C C 4.027 -5.403 9.557 1.00 . A A . 11 SER C 1 1 8 5023 1 1 11 SER CA C 5.164 -5.904 10.451 1.00 . A A . 11 SER CA 1 1 8 5024 1 1 11 SER CB C 5.341 -7.415 10.303 1.00 . A A . 11 SER CB 1 1 8 5025 1 1 11 SER H H 4.174 -6.285 12.327 1.00 . A A . 11 SER H 1 1 8 5026 1 1 11 SER HA H 6.086 -5.400 10.207 1.00 . A A . 11 SER HA 1 1 8 5027 1 1 11 SER HB2 H 4.375 -7.891 10.269 1.00 . A A . 11 SER HB2 1 1 8 5028 1 1 11 SER HB3 H 5.879 -7.626 9.386 1.00 . A A . 11 SER HB3 1 1 8 5029 1 1 11 SER HG H 5.500 -8.522 11.895 1.00 . A A . 11 SER HG 1 1 8 5030 1 1 11 SER N N 4.820 -5.695 11.887 1.00 . A A . 11 SER N 1 1 8 5031 1 1 11 SER O O 3.422 -4.384 9.821 1.00 . A A . 11 SER O 1 1 8 5032 1 1 11 SER OG O 6.069 -7.914 11.417 1.00 . A A . 11 SER OG 1 1 8 5033 1 1 12 CYS C C 1.298 -6.289 8.019 1.00 . A A . 12 CYS C 1 1 8 5034 1 1 12 CYS CA C 2.629 -5.665 7.594 1.00 . A A . 12 CYS CA 1 1 8 5035 1 1 12 CYS CB C 3.021 -6.143 6.190 1.00 . A A . 12 CYS CB 1 1 8 5036 1 1 12 CYS H H 4.230 -6.928 8.306 1.00 . A A . 12 CYS H 1 1 8 5037 1 1 12 CYS HA H 2.554 -4.589 7.603 1.00 . A A . 12 CYS HA 1 1 8 5038 1 1 12 CYS HB2 H 2.201 -5.963 5.511 1.00 . A A . 12 CYS HB2 1 1 8 5039 1 1 12 CYS HB3 H 3.886 -5.589 5.857 1.00 . A A . 12 CYS HB3 1 1 8 5040 1 1 12 CYS N N 3.731 -6.110 8.501 1.00 . A A . 12 CYS N 1 1 8 5041 1 1 12 CYS O O 0.271 -6.056 7.411 1.00 . A A . 12 CYS O 1 1 8 5042 1 1 12 CYS SG S 3.411 -7.916 6.202 1.00 . A A . 12 CYS SG 1 1 8 5043 1 1 13 SER C C -0.956 -6.656 9.989 1.00 . A A . 13 SER C 1 1 8 5044 1 1 13 SER CA C 0.038 -7.719 9.510 1.00 . A A . 13 SER CA 1 1 8 5045 1 1 13 SER CB C 0.453 -8.627 10.667 1.00 . A A . 13 SER CB 1 1 8 5046 1 1 13 SER H H 2.142 -7.257 9.533 1.00 . A A . 13 SER H 1 1 8 5047 1 1 13 SER HA H -0.393 -8.307 8.716 1.00 . A A . 13 SER HA 1 1 8 5048 1 1 13 SER HB2 H 1.193 -8.129 11.271 1.00 . A A . 13 SER HB2 1 1 8 5049 1 1 13 SER HB3 H -0.412 -8.854 11.275 1.00 . A A . 13 SER HB3 1 1 8 5050 1 1 13 SER HG H 1.884 -9.625 9.805 1.00 . A A . 13 SER HG 1 1 8 5051 1 1 13 SER N N 1.305 -7.080 9.056 1.00 . A A . 13 SER N 1 1 8 5052 1 1 13 SER O O -2.035 -6.513 9.449 1.00 . A A . 13 SER O 1 1 8 5053 1 1 13 SER OG O 1.008 -9.827 10.143 1.00 . A A . 13 SER OG 1 1 8 5054 1 1 14 GLN C C -1.515 -3.638 10.564 1.00 . A A . 14 GLN C 1 1 8 5055 1 1 14 GLN CA C -1.531 -4.852 11.497 1.00 . A A . 14 GLN CA 1 1 8 5056 1 1 14 GLN CB C -0.996 -4.476 12.877 1.00 . A A . 14 GLN CB 1 1 8 5057 1 1 14 GLN CD C -2.769 -4.429 14.642 1.00 . A A . 14 GLN CD 1 1 8 5058 1 1 14 GLN CG C -2.021 -3.597 13.597 1.00 . A A . 14 GLN CG 1 1 8 5059 1 1 14 GLN H H 0.275 -6.026 11.415 1.00 . A A . 14 GLN H 1 1 8 5060 1 1 14 GLN HA H -2.531 -5.246 11.585 1.00 . A A . 14 GLN HA 1 1 8 5061 1 1 14 GLN HB2 H -0.821 -5.372 13.453 1.00 . A A . 14 GLN HB2 1 1 8 5062 1 1 14 GLN HB3 H -0.072 -3.930 12.769 1.00 . A A . 14 GLN HB3 1 1 8 5063 1 1 14 GLN HE21 H -4.557 -4.052 13.867 1.00 . A A . 14 GLN HE21 1 1 8 5064 1 1 14 GLN HE22 H -4.557 -5.048 15.241 1.00 . A A . 14 GLN HE22 1 1 8 5065 1 1 14 GLN HG2 H -1.513 -2.778 14.083 1.00 . A A . 14 GLN HG2 1 1 8 5066 1 1 14 GLN HG3 H -2.727 -3.207 12.879 1.00 . A A . 14 GLN HG3 1 1 8 5067 1 1 14 GLN N N -0.601 -5.902 10.993 1.00 . A A . 14 GLN N 1 1 8 5068 1 1 14 GLN NE2 N -4.070 -4.516 14.578 1.00 . A A . 14 GLN NE2 1 1 8 5069 1 1 14 GLN O O -2.486 -2.919 10.448 1.00 . A A . 14 GLN O 1 1 8 5070 1 1 14 GLN OE1 O -2.164 -5.002 15.525 1.00 . A A . 14 GLN OE1 1 1 8 5071 1 1 15 CYS C C -1.449 -2.295 7.940 1.00 . A A . 15 CYS C 1 1 8 5072 1 1 15 CYS CA C -0.331 -2.235 8.981 1.00 . A A . 15 CYS CA 1 1 8 5073 1 1 15 CYS CB C 1.039 -2.356 8.315 1.00 . A A . 15 CYS CB 1 1 8 5074 1 1 15 CYS H H 0.358 -3.995 10.015 1.00 . A A . 15 CYS H 1 1 8 5075 1 1 15 CYS HA H -0.386 -1.312 9.536 1.00 . A A . 15 CYS HA 1 1 8 5076 1 1 15 CYS HB2 H 1.392 -3.372 8.401 1.00 . A A . 15 CYS HB2 1 1 8 5077 1 1 15 CYS HB3 H 0.960 -2.090 7.271 1.00 . A A . 15 CYS HB3 1 1 8 5078 1 1 15 CYS N N -0.414 -3.403 9.903 1.00 . A A . 15 CYS N 1 1 8 5079 1 1 15 CYS O O -2.090 -1.305 7.648 1.00 . A A . 15 CYS O 1 1 8 5080 1 1 15 CYS SG S 2.207 -1.241 9.135 1.00 . A A . 15 CYS SG 1 1 8 5081 1 1 16 LEU C C -4.019 -4.205 6.959 1.00 . A A . 16 LEU C 1 1 8 5082 1 1 16 LEU CA C -2.770 -3.552 6.354 1.00 . A A . 16 LEU CA 1 1 8 5083 1 1 16 LEU CB C -2.178 -4.414 5.239 1.00 . A A . 16 LEU CB 1 1 8 5084 1 1 16 LEU CD1 C -0.076 -3.066 5.112 1.00 . A A . 16 LEU CD1 1 1 8 5085 1 1 16 LEU CD2 C -0.854 -4.338 3.118 1.00 . A A . 16 LEU CD2 1 1 8 5086 1 1 16 LEU CG C -1.306 -3.535 4.337 1.00 . A A . 16 LEU CG 1 1 8 5087 1 1 16 LEU H H -1.165 -4.237 7.621 1.00 . A A . 16 LEU H 1 1 8 5088 1 1 16 LEU HA H -3.013 -2.575 5.968 1.00 . A A . 16 LEU HA 1 1 8 5089 1 1 16 LEU HB2 H -1.576 -5.200 5.671 1.00 . A A . 16 LEU HB2 1 1 8 5090 1 1 16 LEU HB3 H -2.975 -4.848 4.655 1.00 . A A . 16 LEU HB3 1 1 8 5091 1 1 16 LEU HD11 H 0.174 -3.795 5.869 1.00 . A A . 16 LEU HD11 1 1 8 5092 1 1 16 LEU HD12 H -0.288 -2.116 5.582 1.00 . A A . 16 LEU HD12 1 1 8 5093 1 1 16 LEU HD13 H 0.755 -2.954 4.432 1.00 . A A . 16 LEU HD13 1 1 8 5094 1 1 16 LEU HD21 H -0.316 -3.690 2.441 1.00 . A A . 16 LEU HD21 1 1 8 5095 1 1 16 LEU HD22 H -1.717 -4.745 2.616 1.00 . A A . 16 LEU HD22 1 1 8 5096 1 1 16 LEU HD23 H -0.208 -5.142 3.436 1.00 . A A . 16 LEU HD23 1 1 8 5097 1 1 16 LEU HG H -1.876 -2.677 4.014 1.00 . A A . 16 LEU HG 1 1 8 5098 1 1 16 LEU N N -1.691 -3.447 7.375 1.00 . A A . 16 LEU N 1 1 8 5099 1 1 16 LEU O O -5.054 -4.283 6.327 1.00 . A A . 16 LEU O 1 1 8 5100 1 1 17 SER C C -5.950 -4.211 9.546 1.00 . A A . 17 SER C 1 1 8 5101 1 1 17 SER CA C -5.141 -5.282 8.817 1.00 . A A . 17 SER CA 1 1 8 5102 1 1 17 SER CB C -4.596 -6.294 9.819 1.00 . A A . 17 SER CB 1 1 8 5103 1 1 17 SER H H -3.104 -4.578 8.687 1.00 . A A . 17 SER H 1 1 8 5104 1 1 17 SER HA H -5.747 -5.779 8.077 1.00 . A A . 17 SER HA 1 1 8 5105 1 1 17 SER HB2 H -4.034 -7.049 9.301 1.00 . A A . 17 SER HB2 1 1 8 5106 1 1 17 SER HB3 H -3.951 -5.785 10.525 1.00 . A A . 17 SER HB3 1 1 8 5107 1 1 17 SER HG H -5.732 -6.519 11.382 1.00 . A A . 17 SER HG 1 1 8 5108 1 1 17 SER N N -3.942 -4.659 8.183 1.00 . A A . 17 SER N 1 1 8 5109 1 1 17 SER O O -7.056 -4.445 9.991 1.00 . A A . 17 SER O 1 1 8 5110 1 1 17 SER OG O -5.681 -6.903 10.504 1.00 . A A . 17 SER OG 1 1 8 5111 1 1 18 ALA C C -5.829 -0.606 9.712 1.00 . A A . 18 ALA C 1 1 8 5112 1 1 18 ALA CA C -6.122 -1.950 10.386 1.00 . A A . 18 ALA CA 1 1 8 5113 1 1 18 ALA CB C -5.561 -1.983 11.806 1.00 . A A . 18 ALA CB 1 1 8 5114 1 1 18 ALA H H -4.501 -2.874 9.321 1.00 . A A . 18 ALA H 1 1 8 5115 1 1 18 ALA HA H -7.182 -2.145 10.400 1.00 . A A . 18 ALA HA 1 1 8 5116 1 1 18 ALA HB1 H -6.343 -1.736 12.508 1.00 . A A . 18 ALA HB1 1 1 8 5117 1 1 18 ALA HB2 H -4.757 -1.269 11.893 1.00 . A A . 18 ALA HB2 1 1 8 5118 1 1 18 ALA HB3 H -5.187 -2.975 12.021 1.00 . A A . 18 ALA HB3 1 1 8 5119 1 1 18 ALA N N -5.399 -3.038 9.679 1.00 . A A . 18 ALA N 1 1 8 5120 1 1 18 ALA O O -5.218 0.266 10.296 1.00 . A A . 18 ALA O 1 1 8 5121 1 1 19 PRO C C -6.980 1.911 8.166 1.00 . A A . 19 PRO C 1 1 8 5122 1 1 19 PRO CA C -6.077 0.743 7.706 1.00 . A A . 19 PRO CA 1 1 8 5123 1 1 19 PRO CB C -6.408 0.322 6.277 1.00 . A A . 19 PRO CB 1 1 8 5124 1 1 19 PRO CD C -7.019 -1.517 7.734 1.00 . A A . 19 PRO CD 1 1 8 5125 1 1 19 PRO CG C -7.314 -0.861 6.406 1.00 . A A . 19 PRO CG 1 1 8 5126 1 1 19 PRO HA H -5.042 1.042 7.754 1.00 . A A . 19 PRO HA 1 1 8 5127 1 1 19 PRO HB2 H -6.911 1.127 5.760 1.00 . A A . 19 PRO HB2 1 1 8 5128 1 1 19 PRO HB3 H -5.509 0.042 5.750 1.00 . A A . 19 PRO HB3 1 1 8 5129 1 1 19 PRO HD2 H -7.940 -1.774 8.239 1.00 . A A . 19 PRO HD2 1 1 8 5130 1 1 19 PRO HD3 H -6.404 -2.392 7.597 1.00 . A A . 19 PRO HD3 1 1 8 5131 1 1 19 PRO HG2 H -8.345 -0.542 6.365 1.00 . A A . 19 PRO HG2 1 1 8 5132 1 1 19 PRO HG3 H -7.116 -1.561 5.607 1.00 . A A . 19 PRO HG3 1 1 8 5133 1 1 19 PRO N N -6.282 -0.496 8.491 1.00 . A A . 19 PRO N 1 1 8 5134 1 1 19 PRO O O -6.600 3.053 8.007 1.00 . A A . 19 PRO O 1 1 8 5135 1 1 20 PRO C C -8.510 3.356 10.440 1.00 . A A . 20 PRO C 1 1 8 5136 1 1 20 PRO CA C -9.041 2.722 9.152 1.00 . A A . 20 PRO CA 1 1 8 5137 1 1 20 PRO CB C -10.378 2.031 9.397 1.00 . A A . 20 PRO CB 1 1 8 5138 1 1 20 PRO CD C -8.741 0.302 8.972 1.00 . A A . 20 PRO CD 1 1 8 5139 1 1 20 PRO CG C -10.032 0.608 9.688 1.00 . A A . 20 PRO CG 1 1 8 5140 1 1 20 PRO HA H -9.144 3.463 8.377 1.00 . A A . 20 PRO HA 1 1 8 5141 1 1 20 PRO HB2 H -10.881 2.479 10.243 1.00 . A A . 20 PRO HB2 1 1 8 5142 1 1 20 PRO HB3 H -10.997 2.088 8.515 1.00 . A A . 20 PRO HB3 1 1 8 5143 1 1 20 PRO HD2 H -8.103 -0.289 9.609 1.00 . A A . 20 PRO HD2 1 1 8 5144 1 1 20 PRO HD3 H -8.937 -0.210 8.045 1.00 . A A . 20 PRO HD3 1 1 8 5145 1 1 20 PRO HG2 H -9.905 0.473 10.753 1.00 . A A . 20 PRO HG2 1 1 8 5146 1 1 20 PRO HG3 H -10.813 -0.043 9.323 1.00 . A A . 20 PRO HG3 1 1 8 5147 1 1 20 PRO N N -8.147 1.622 8.712 1.00 . A A . 20 PRO N 1 1 8 5148 1 1 20 PRO O O -8.862 4.465 10.788 1.00 . A A . 20 PRO O 1 1 8 5149 1 1 21 PHE C C -5.645 3.637 12.191 1.00 . A A . 21 PHE C 1 1 8 5150 1 1 21 PHE CA C -7.103 3.226 12.408 1.00 . A A . 21 PHE CA 1 1 8 5151 1 1 21 PHE CB C -7.177 2.091 13.435 1.00 . A A . 21 PHE CB 1 1 8 5152 1 1 21 PHE CD1 C -9.657 2.019 12.968 1.00 . A A . 21 PHE CD1 1 1 8 5153 1 1 21 PHE CD2 C -8.506 -0.050 13.493 1.00 . A A . 21 PHE CD2 1 1 8 5154 1 1 21 PHE CE1 C -10.862 1.316 12.843 1.00 . A A . 21 PHE CE1 1 1 8 5155 1 1 21 PHE CE2 C -9.711 -0.753 13.369 1.00 . A A . 21 PHE CE2 1 1 8 5156 1 1 21 PHE CG C -8.479 1.335 13.293 1.00 . A A . 21 PHE CG 1 1 8 5157 1 1 21 PHE CZ C -10.889 -0.070 13.043 1.00 . A A . 21 PHE CZ 1 1 8 5158 1 1 21 PHE H H -7.388 1.769 10.845 1.00 . A A . 21 PHE H 1 1 8 5159 1 1 21 PHE HA H -7.690 4.067 12.741 1.00 . A A . 21 PHE HA 1 1 8 5160 1 1 21 PHE HB2 H -6.352 1.413 13.276 1.00 . A A . 21 PHE HB2 1 1 8 5161 1 1 21 PHE HB3 H -7.111 2.507 14.430 1.00 . A A . 21 PHE HB3 1 1 8 5162 1 1 21 PHE HD1 H -9.637 3.087 12.812 1.00 . A A . 21 PHE HD1 1 1 8 5163 1 1 21 PHE HD2 H -7.597 -0.578 13.744 1.00 . A A . 21 PHE HD2 1 1 8 5164 1 1 21 PHE HE1 H -11.770 1.843 12.590 1.00 . A A . 21 PHE HE1 1 1 8 5165 1 1 21 PHE HE2 H -9.732 -1.821 13.524 1.00 . A A . 21 PHE HE2 1 1 8 5166 1 1 21 PHE HZ H -11.818 -0.611 12.947 1.00 . A A . 21 PHE HZ 1 1 8 5167 1 1 21 PHE N N -7.662 2.662 11.146 1.00 . A A . 21 PHE N 1 1 8 5168 1 1 21 PHE O O -4.858 3.678 13.115 1.00 . A A . 21 PHE O 1 1 8 5169 1 1 22 VAL C C -3.775 5.254 9.500 1.00 . A A . 22 VAL C 1 1 8 5170 1 1 22 VAL CA C -3.858 4.314 10.707 1.00 . A A . 22 VAL CA 1 1 8 5171 1 1 22 VAL CB C -3.154 2.994 10.404 1.00 . A A . 22 VAL CB 1 1 8 5172 1 1 22 VAL CG1 C -3.397 2.006 11.547 1.00 . A A . 22 VAL CG1 1 1 8 5173 1 1 22 VAL CG2 C -3.709 2.413 9.102 1.00 . A A . 22 VAL CG2 1 1 8 5174 1 1 22 VAL H H -5.917 3.878 10.238 1.00 . A A . 22 VAL H 1 1 8 5175 1 1 22 VAL HA H -3.420 4.776 11.577 1.00 . A A . 22 VAL HA 1 1 8 5176 1 1 22 VAL HB H -2.097 3.168 10.300 1.00 . A A . 22 VAL HB 1 1 8 5177 1 1 22 VAL HG11 H -2.804 1.116 11.387 1.00 . A A . 22 VAL HG11 1 1 8 5178 1 1 22 VAL HG12 H -4.442 1.737 11.577 1.00 . A A . 22 VAL HG12 1 1 8 5179 1 1 22 VAL HG13 H -3.115 2.461 12.485 1.00 . A A . 22 VAL HG13 1 1 8 5180 1 1 22 VAL HG21 H -3.722 1.335 9.166 1.00 . A A . 22 VAL HG21 1 1 8 5181 1 1 22 VAL HG22 H -3.081 2.716 8.277 1.00 . A A . 22 VAL HG22 1 1 8 5182 1 1 22 VAL HG23 H -4.712 2.777 8.944 1.00 . A A . 22 VAL HG23 1 1 8 5183 1 1 22 VAL N N -5.273 3.927 10.974 1.00 . A A . 22 VAL N 1 1 8 5184 1 1 22 VAL O O -4.777 5.701 8.978 1.00 . A A . 22 VAL O 1 1 8 5185 1 1 23 GLN C C -1.220 6.060 7.037 1.00 . A A . 23 GLN C 1 1 8 5186 1 1 23 GLN CA C -2.436 6.463 7.877 1.00 . A A . 23 GLN CA 1 1 8 5187 1 1 23 GLN CB C -2.241 7.860 8.474 1.00 . A A . 23 GLN CB 1 1 8 5188 1 1 23 GLN CD C -2.484 10.062 7.312 1.00 . A A . 23 GLN CD 1 1 8 5189 1 1 23 GLN CG C -1.634 8.795 7.421 1.00 . A A . 23 GLN CG 1 1 8 5190 1 1 23 GLN H H -1.789 5.182 9.487 1.00 . A A . 23 GLN H 1 1 8 5191 1 1 23 GLN HA H -3.331 6.444 7.274 1.00 . A A . 23 GLN HA 1 1 8 5192 1 1 23 GLN HB2 H -3.196 8.250 8.793 1.00 . A A . 23 GLN HB2 1 1 8 5193 1 1 23 GLN HB3 H -1.576 7.798 9.323 1.00 . A A . 23 GLN HB3 1 1 8 5194 1 1 23 GLN HE21 H -4.108 9.092 6.712 1.00 . A A . 23 GLN HE21 1 1 8 5195 1 1 23 GLN HE22 H -4.280 10.774 6.855 1.00 . A A . 23 GLN HE22 1 1 8 5196 1 1 23 GLN HG2 H -0.628 9.059 7.712 1.00 . A A . 23 GLN HG2 1 1 8 5197 1 1 23 GLN HG3 H -1.612 8.296 6.464 1.00 . A A . 23 GLN HG3 1 1 8 5198 1 1 23 GLN N N -2.584 5.555 9.051 1.00 . A A . 23 GLN N 1 1 8 5199 1 1 23 GLN NE2 N -3.727 9.968 6.929 1.00 . A A . 23 GLN NE2 1 1 8 5200 1 1 23 GLN O O -1.236 6.154 5.826 1.00 . A A . 23 GLN O 1 1 8 5201 1 1 23 GLN OE1 O -2.012 11.149 7.580 1.00 . A A . 23 GLN OE1 1 1 8 5202 1 1 24 CYS C C 0.753 3.991 6.025 1.00 . A A . 24 CYS C 1 1 8 5203 1 1 24 CYS CA C 1.047 5.227 6.882 1.00 . A A . 24 CYS CA 1 1 8 5204 1 1 24 CYS CB C 2.144 4.943 7.924 1.00 . A A . 24 CYS CB 1 1 8 5205 1 1 24 CYS H H -0.158 5.556 8.642 1.00 . A A . 24 CYS H 1 1 8 5206 1 1 24 CYS HA H 1.355 6.044 6.249 1.00 . A A . 24 CYS HA 1 1 8 5207 1 1 24 CYS HB2 H 3.111 5.050 7.459 1.00 . A A . 24 CYS HB2 1 1 8 5208 1 1 24 CYS HB3 H 2.058 5.656 8.732 1.00 . A A . 24 CYS HB3 1 1 8 5209 1 1 24 CYS N N -0.161 5.621 7.664 1.00 . A A . 24 CYS N 1 1 8 5210 1 1 24 CYS O O -0.308 3.404 6.101 1.00 . A A . 24 CYS O 1 1 8 5211 1 1 24 CYS SG S 1.985 3.261 8.586 1.00 . A A . 24 CYS SG 1 1 8 5212 1 1 25 GLY C C 2.795 1.642 4.227 1.00 . A A . 25 GLY C 1 1 8 5213 1 1 25 GLY CA C 1.482 2.417 4.325 1.00 . A A . 25 GLY CA 1 1 8 5214 1 1 25 GLY H H 2.532 4.101 5.161 1.00 . A A . 25 GLY H 1 1 8 5215 1 1 25 GLY HA2 H 0.715 1.783 4.746 1.00 . A A . 25 GLY HA2 1 1 8 5216 1 1 25 GLY HA3 H 1.185 2.743 3.341 1.00 . A A . 25 GLY HA3 1 1 8 5217 1 1 25 GLY N N 1.687 3.604 5.205 1.00 . A A . 25 GLY N 1 1 8 5218 1 1 25 GLY O O 3.779 2.004 4.831 1.00 . A A . 25 GLY O 1 1 8 5219 1 1 26 TRP C C 4.933 0.372 2.205 1.00 . A A . 26 TRP C 1 1 8 5220 1 1 26 TRP CA C 4.092 -0.198 3.351 1.00 . A A . 26 TRP CA 1 1 8 5221 1 1 26 TRP CB C 3.645 -1.623 3.030 1.00 . A A . 26 TRP CB 1 1 8 5222 1 1 26 TRP CD1 C 5.549 -3.169 2.416 1.00 . A A . 26 TRP CD1 1 1 8 5223 1 1 26 TRP CD2 C 5.182 -3.075 4.632 1.00 . A A . 26 TRP CD2 1 1 8 5224 1 1 26 TRP CE2 C 6.257 -3.973 4.438 1.00 . A A . 26 TRP CE2 1 1 8 5225 1 1 26 TRP CE3 C 4.748 -2.835 5.946 1.00 . A A . 26 TRP CE3 1 1 8 5226 1 1 26 TRP CG C 4.749 -2.581 3.335 1.00 . A A . 26 TRP CG 1 1 8 5227 1 1 26 TRP CH2 C 6.436 -4.359 6.812 1.00 . A A . 26 TRP CH2 1 1 8 5228 1 1 26 TRP CZ2 C 6.880 -4.611 5.511 1.00 . A A . 26 TRP CZ2 1 1 8 5229 1 1 26 TRP CZ3 C 5.372 -3.472 7.030 1.00 . A A . 26 TRP CZ3 1 1 8 5230 1 1 26 TRP H H 2.022 0.295 2.983 1.00 . A A . 26 TRP H 1 1 8 5231 1 1 26 TRP HA H 4.643 -0.179 4.277 1.00 . A A . 26 TRP HA 1 1 8 5232 1 1 26 TRP HB2 H 2.781 -1.869 3.628 1.00 . A A . 26 TRP HB2 1 1 8 5233 1 1 26 TRP HB3 H 3.389 -1.691 1.985 1.00 . A A . 26 TRP HB3 1 1 8 5234 1 1 26 TRP HD1 H 5.496 -3.019 1.348 1.00 . A A . 26 TRP HD1 1 1 8 5235 1 1 26 TRP HE1 H 7.134 -4.541 2.633 1.00 . A A . 26 TRP HE1 1 1 8 5236 1 1 26 TRP HE3 H 3.930 -2.152 6.122 1.00 . A A . 26 TRP HE3 1 1 8 5237 1 1 26 TRP HH2 H 6.912 -4.848 7.649 1.00 . A A . 26 TRP HH2 1 1 8 5238 1 1 26 TRP HZ2 H 7.698 -5.292 5.338 1.00 . A A . 26 TRP HZ2 1 1 8 5239 1 1 26 TRP HZ3 H 5.031 -3.279 8.036 1.00 . A A . 26 TRP HZ3 1 1 8 5240 1 1 26 TRP N N 2.827 0.580 3.473 1.00 . A A . 26 TRP N 1 1 8 5241 1 1 26 TRP NE1 N 6.445 -3.997 3.070 1.00 . A A . 26 TRP NE1 1 1 8 5242 1 1 26 TRP O O 4.422 0.696 1.148 1.00 . A A . 26 TRP O 1 1 8 5243 1 1 27 CYS C C 8.348 0.266 1.116 1.00 . A A . 27 CYS C 1 1 8 5244 1 1 27 CYS CA C 7.070 1.090 1.326 1.00 . A A . 27 CYS CA 1 1 8 5245 1 1 27 CYS CB C 7.416 2.496 1.812 1.00 . A A . 27 CYS CB 1 1 8 5246 1 1 27 CYS H H 6.613 0.269 3.268 1.00 . A A . 27 CYS H 1 1 8 5247 1 1 27 CYS HA H 6.511 1.152 0.407 1.00 . A A . 27 CYS HA 1 1 8 5248 1 1 27 CYS HB2 H 6.678 2.819 2.530 1.00 . A A . 27 CYS HB2 1 1 8 5249 1 1 27 CYS HB3 H 8.391 2.488 2.277 1.00 . A A . 27 CYS HB3 1 1 8 5250 1 1 27 CYS N N 6.218 0.519 2.408 1.00 . A A . 27 CYS N 1 1 8 5251 1 1 27 CYS O O 9.330 0.420 1.815 1.00 . A A . 27 CYS O 1 1 8 5252 1 1 27 CYS SG S 7.425 3.638 0.406 1.00 . A A . 27 CYS SG 1 1 8 5253 1 1 28 HIS C C 10.202 -2.086 1.018 1.00 . A A . 28 HIS C 1 1 8 5254 1 1 28 HIS CA C 9.545 -1.416 -0.205 1.00 . A A . 28 HIS CA 1 1 8 5255 1 1 28 HIS CB C 10.522 -0.426 -0.839 1.00 . A A . 28 HIS CB 1 1 8 5256 1 1 28 HIS CD2 C 9.424 0.118 -3.162 1.00 . A A . 28 HIS CD2 1 1 8 5257 1 1 28 HIS CE1 C 10.826 -0.942 -4.430 1.00 . A A . 28 HIS CE1 1 1 8 5258 1 1 28 HIS CG C 10.360 -0.448 -2.333 1.00 . A A . 28 HIS CG 1 1 8 5259 1 1 28 HIS H H 7.540 -0.662 -0.432 1.00 . A A . 28 HIS H 1 1 8 5260 1 1 28 HIS HA H 9.283 -2.165 -0.934 1.00 . A A . 28 HIS HA 1 1 8 5261 1 1 28 HIS HB2 H 10.317 0.569 -0.469 1.00 . A A . 28 HIS HB2 1 1 8 5262 1 1 28 HIS HB3 H 11.533 -0.704 -0.583 1.00 . A A . 28 HIS HB3 1 1 8 5263 1 1 28 HIS HD1 H 12.030 -1.632 -2.878 1.00 . A A . 28 HIS HD1 1 1 8 5264 1 1 28 HIS HD2 H 8.586 0.716 -2.837 1.00 . A A . 28 HIS HD2 1 1 8 5265 1 1 28 HIS HE1 H 11.324 -1.353 -5.294 1.00 . A A . 28 HIS HE1 1 1 8 5266 1 1 28 HIS N N 8.341 -0.585 0.126 1.00 . A A . 28 HIS N 1 1 8 5267 1 1 28 HIS ND1 N 11.244 -1.120 -3.163 1.00 . A A . 28 HIS ND1 1 1 8 5268 1 1 28 HIS NE2 N 9.720 -0.195 -4.485 1.00 . A A . 28 HIS NE2 1 1 8 5269 1 1 28 HIS O O 11.268 -2.656 0.890 1.00 . A A . 28 HIS O 1 1 8 5270 1 1 29 ASP C C 9.583 -2.368 4.676 1.00 . A A . 29 ASP C 1 1 8 5271 1 1 29 ASP CA C 10.273 -2.723 3.355 1.00 . A A . 29 ASP CA 1 1 8 5272 1 1 29 ASP CB C 11.723 -2.218 3.366 1.00 . A A . 29 ASP CB 1 1 8 5273 1 1 29 ASP CG C 11.777 -0.753 2.921 1.00 . A A . 29 ASP CG 1 1 8 5274 1 1 29 ASP H H 8.747 -1.609 2.300 1.00 . A A . 29 ASP H 1 1 8 5275 1 1 29 ASP HA H 10.267 -3.792 3.214 1.00 . A A . 29 ASP HA 1 1 8 5276 1 1 29 ASP HB2 H 12.124 -2.305 4.365 1.00 . A A . 29 ASP HB2 1 1 8 5277 1 1 29 ASP HB3 H 12.316 -2.818 2.691 1.00 . A A . 29 ASP HB3 1 1 8 5278 1 1 29 ASP N N 9.610 -2.052 2.188 1.00 . A A . 29 ASP N 1 1 8 5279 1 1 29 ASP O O 9.014 -3.215 5.332 1.00 . A A . 29 ASP O 1 1 8 5280 1 1 29 ASP OD1 O 11.007 0.035 3.448 1.00 . A A . 29 ASP OD1 1 1 8 5281 1 1 29 ASP OD2 O 12.586 -0.445 2.062 1.00 . A A . 29 ASP OD2 1 1 8 5282 1 1 30 LYS C C 7.652 -0.103 6.152 1.00 . A A . 30 LYS C 1 1 8 5283 1 1 30 LYS CA C 9.020 -0.747 6.381 1.00 . A A . 30 LYS CA 1 1 8 5284 1 1 30 LYS CB C 9.984 0.260 7.007 1.00 . A A . 30 LYS CB 1 1 8 5285 1 1 30 LYS CD C 11.069 0.680 9.217 1.00 . A A . 30 LYS CD 1 1 8 5286 1 1 30 LYS CE C 10.965 2.110 9.750 1.00 . A A . 30 LYS CE 1 1 8 5287 1 1 30 LYS CG C 9.761 0.301 8.519 1.00 . A A . 30 LYS CG 1 1 8 5288 1 1 30 LYS H H 10.134 -0.464 4.556 1.00 . A A . 30 LYS H 1 1 8 5289 1 1 30 LYS HA H 8.925 -1.607 7.023 1.00 . A A . 30 LYS HA 1 1 8 5290 1 1 30 LYS HB2 H 11.001 -0.038 6.800 1.00 . A A . 30 LYS HB2 1 1 8 5291 1 1 30 LYS HB3 H 9.802 1.240 6.592 1.00 . A A . 30 LYS HB3 1 1 8 5292 1 1 30 LYS HD2 H 11.250 0.000 10.036 1.00 . A A . 30 LYS HD2 1 1 8 5293 1 1 30 LYS HD3 H 11.883 0.620 8.511 1.00 . A A . 30 LYS HD3 1 1 8 5294 1 1 30 LYS HE2 H 11.740 2.727 9.317 1.00 . A A . 30 LYS HE2 1 1 8 5295 1 1 30 LYS HE3 H 9.990 2.520 9.537 1.00 . A A . 30 LYS HE3 1 1 8 5296 1 1 30 LYS HG2 H 9.003 1.035 8.752 1.00 . A A . 30 LYS HG2 1 1 8 5297 1 1 30 LYS HG3 H 9.440 -0.671 8.863 1.00 . A A . 30 LYS HG3 1 1 8 5298 1 1 30 LYS HZ1 H 12.149 1.751 11.424 1.00 . A A . 30 LYS HZ1 1 1 8 5299 1 1 30 LYS HZ2 H 10.539 1.233 11.589 1.00 . A A . 30 LYS HZ2 1 1 8 5300 1 1 30 LYS HZ3 H 10.916 2.887 11.680 1.00 . A A . 30 LYS HZ3 1 1 8 5301 1 1 30 LYS N N 9.653 -1.132 5.087 1.00 . A A . 30 LYS N 1 1 8 5302 1 1 30 LYS NZ N 11.157 1.986 11.221 1.00 . A A . 30 LYS NZ 1 1 8 5303 1 1 30 LYS O O 7.277 0.209 5.039 1.00 . A A . 30 LYS O 1 1 8 5304 1 1 31 CYS C C 5.667 2.241 7.196 1.00 . A A . 31 CYS C 1 1 8 5305 1 1 31 CYS CA C 5.560 0.720 7.060 1.00 . A A . 31 CYS CA 1 1 8 5306 1 1 31 CYS CB C 4.732 0.133 8.204 1.00 . A A . 31 CYS CB 1 1 8 5307 1 1 31 CYS H H 7.231 -0.164 8.091 1.00 . A A . 31 CYS H 1 1 8 5308 1 1 31 CYS HA H 5.121 0.454 6.113 1.00 . A A . 31 CYS HA 1 1 8 5309 1 1 31 CYS HB2 H 5.185 -0.789 8.539 1.00 . A A . 31 CYS HB2 1 1 8 5310 1 1 31 CYS HB3 H 4.701 0.836 9.024 1.00 . A A . 31 CYS HB3 1 1 8 5311 1 1 31 CYS N N 6.906 0.096 7.204 1.00 . A A . 31 CYS N 1 1 8 5312 1 1 31 CYS O O 5.825 2.771 8.277 1.00 . A A . 31 CYS O 1 1 8 5313 1 1 31 CYS SG S 3.050 -0.198 7.625 1.00 . A A . 31 CYS SG 1 1 8 5314 1 1 32 VAL C C 4.782 5.032 5.057 1.00 . A A . 32 VAL C 1 1 8 5315 1 1 32 VAL CA C 5.666 4.428 6.151 1.00 . A A . 32 VAL CA 1 1 8 5316 1 1 32 VAL CB C 7.140 4.735 5.894 1.00 . A A . 32 VAL CB 1 1 8 5317 1 1 32 VAL CG1 C 7.999 3.966 6.900 1.00 . A A . 32 VAL CG1 1 1 8 5318 1 1 32 VAL CG2 C 7.510 4.299 4.475 1.00 . A A . 32 VAL CG2 1 1 8 5319 1 1 32 VAL H H 5.448 2.491 5.242 1.00 . A A . 32 VAL H 1 1 8 5320 1 1 32 VAL HA H 5.373 4.794 7.123 1.00 . A A . 32 VAL HA 1 1 8 5321 1 1 32 VAL HB H 7.314 5.796 6.007 1.00 . A A . 32 VAL HB 1 1 8 5322 1 1 32 VAL HG11 H 7.519 3.980 7.868 1.00 . A A . 32 VAL HG11 1 1 8 5323 1 1 32 VAL HG12 H 8.971 4.430 6.973 1.00 . A A . 32 VAL HG12 1 1 8 5324 1 1 32 VAL HG13 H 8.112 2.943 6.570 1.00 . A A . 32 VAL HG13 1 1 8 5325 1 1 32 VAL HG21 H 7.345 3.236 4.370 1.00 . A A . 32 VAL HG21 1 1 8 5326 1 1 32 VAL HG22 H 8.551 4.522 4.289 1.00 . A A . 32 VAL HG22 1 1 8 5327 1 1 32 VAL HG23 H 6.896 4.830 3.763 1.00 . A A . 32 VAL HG23 1 1 8 5328 1 1 32 VAL N N 5.576 2.942 6.102 1.00 . A A . 32 VAL N 1 1 8 5329 1 1 32 VAL O O 4.281 4.334 4.199 1.00 . A A . 32 VAL O 1 1 8 5330 1 1 33 ARG C C 4.585 7.804 3.093 1.00 . A A . 33 ARG C 1 1 8 5331 1 1 33 ARG CA C 3.728 6.946 4.027 1.00 . A A . 33 ARG CA 1 1 8 5332 1 1 33 ARG CB C 2.723 7.809 4.788 1.00 . A A . 33 ARG CB 1 1 8 5333 1 1 33 ARG CD C 0.677 9.135 4.236 1.00 . A A . 33 ARG CD 1 1 8 5334 1 1 33 ARG CG C 1.382 7.788 4.053 1.00 . A A . 33 ARG CG 1 1 8 5335 1 1 33 ARG CZ C 0.935 10.550 2.289 1.00 . A A . 33 ARG CZ 1 1 8 5336 1 1 33 ARG H H 4.993 6.873 5.772 1.00 . A A . 33 ARG H 1 1 8 5337 1 1 33 ARG HA H 3.209 6.187 3.465 1.00 . A A . 33 ARG HA 1 1 8 5338 1 1 33 ARG HB2 H 2.594 7.416 5.786 1.00 . A A . 33 ARG HB2 1 1 8 5339 1 1 33 ARG HB3 H 3.083 8.825 4.844 1.00 . A A . 33 ARG HB3 1 1 8 5340 1 1 33 ARG HD2 H -0.347 9.070 3.894 1.00 . A A . 33 ARG HD2 1 1 8 5341 1 1 33 ARG HD3 H 0.713 9.440 5.269 1.00 . A A . 33 ARG HD3 1 1 8 5342 1 1 33 ARG HE H 2.348 10.368 3.671 1.00 . A A . 33 ARG HE 1 1 8 5343 1 1 33 ARG HG2 H 1.551 7.609 2.999 1.00 . A A . 33 ARG HG2 1 1 8 5344 1 1 33 ARG HG3 H 0.762 7.002 4.456 1.00 . A A . 33 ARG HG3 1 1 8 5345 1 1 33 ARG HH11 H 1.430 8.940 1.207 1.00 . A A . 33 ARG HH11 1 1 8 5346 1 1 33 ARG HH12 H 0.596 10.193 0.347 1.00 . A A . 33 ARG HH12 1 1 8 5347 1 1 33 ARG HH21 H 0.322 12.267 3.116 1.00 . A A . 33 ARG HH21 1 1 8 5348 1 1 33 ARG HH22 H -0.033 12.079 1.431 1.00 . A A . 33 ARG HH22 1 1 8 5349 1 1 33 ARG N N 4.583 6.320 5.074 1.00 . A A . 33 ARG N 1 1 8 5350 1 1 33 ARG NE N 1.451 10.089 3.395 1.00 . A A . 33 ARG NE 1 1 8 5351 1 1 33 ARG NH1 N 0.991 9.839 1.195 1.00 . A A . 33 ARG NH1 1 1 8 5352 1 1 33 ARG NH2 N 0.363 11.724 2.277 1.00 . A A . 33 ARG NH2 1 1 8 5353 1 1 33 ARG O O 5.751 8.033 3.341 1.00 . A A . 33 ARG O 1 1 8 5354 1 1 34 SER C C 5.587 10.197 1.812 1.00 . A A . 34 SER C 1 1 8 5355 1 1 34 SER CA C 4.801 9.113 1.066 1.00 . A A . 34 SER CA 1 1 8 5356 1 1 34 SER CB C 3.754 9.744 0.149 1.00 . A A . 34 SER CB 1 1 8 5357 1 1 34 SER H H 3.075 8.077 1.835 1.00 . A A . 34 SER H 1 1 8 5358 1 1 34 SER HA H 5.469 8.496 0.488 1.00 . A A . 34 SER HA 1 1 8 5359 1 1 34 SER HB2 H 3.026 9.002 -0.134 1.00 . A A . 34 SER HB2 1 1 8 5360 1 1 34 SER HB3 H 3.259 10.552 0.671 1.00 . A A . 34 SER HB3 1 1 8 5361 1 1 34 SER HG H 4.971 10.961 -0.760 1.00 . A A . 34 SER HG 1 1 8 5362 1 1 34 SER N N 4.017 8.277 2.019 1.00 . A A . 34 SER N 1 1 8 5363 1 1 34 SER O O 6.549 10.737 1.302 1.00 . A A . 34 SER O 1 1 8 5364 1 1 34 SER OG O 4.393 10.241 -1.020 1.00 . A A . 34 SER OG 1 1 8 5365 1 1 35 GLU C C 7.052 10.979 4.600 1.00 . A A . 35 GLU C 1 1 8 5366 1 1 35 GLU CA C 5.914 11.585 3.769 1.00 . A A . 35 GLU CA 1 1 8 5367 1 1 35 GLU CB C 4.858 12.207 4.683 1.00 . A A . 35 GLU CB 1 1 8 5368 1 1 35 GLU CD C 4.504 14.636 5.145 1.00 . A A . 35 GLU CD 1 1 8 5369 1 1 35 GLU CG C 4.391 13.538 4.088 1.00 . A A . 35 GLU CG 1 1 8 5370 1 1 35 GLU H H 4.404 10.093 3.404 1.00 . A A . 35 GLU H 1 1 8 5371 1 1 35 GLU HA H 6.300 12.333 3.095 1.00 . A A . 35 GLU HA 1 1 8 5372 1 1 35 GLU HB2 H 4.017 11.536 4.769 1.00 . A A . 35 GLU HB2 1 1 8 5373 1 1 35 GLU HB3 H 5.283 12.382 5.659 1.00 . A A . 35 GLU HB3 1 1 8 5374 1 1 35 GLU HG2 H 5.011 13.790 3.239 1.00 . A A . 35 GLU HG2 1 1 8 5375 1 1 35 GLU HG3 H 3.364 13.450 3.771 1.00 . A A . 35 GLU HG3 1 1 8 5376 1 1 35 GLU N N 5.186 10.529 3.009 1.00 . A A . 35 GLU N 1 1 8 5377 1 1 35 GLU O O 7.916 11.683 5.084 1.00 . A A . 35 GLU O 1 1 8 5378 1 1 35 GLU OE1 O 4.281 14.336 6.307 1.00 . A A . 35 GLU OE1 1 1 8 5379 1 1 35 GLU OE2 O 4.811 15.757 4.778 1.00 . A A . 35 GLU OE2 1 1 8 5380 1 1 36 GLU C C 8.958 8.067 4.747 1.00 . A A . 36 GLU C 1 1 8 5381 1 1 36 GLU CA C 8.151 9.061 5.589 1.00 . A A . 36 GLU CA 1 1 8 5382 1 1 36 GLU CB C 7.434 8.343 6.732 1.00 . A A . 36 GLU CB 1 1 8 5383 1 1 36 GLU CD C 8.717 9.152 8.720 1.00 . A A . 36 GLU CD 1 1 8 5384 1 1 36 GLU CG C 7.393 9.255 7.961 1.00 . A A . 36 GLU CG 1 1 8 5385 1 1 36 GLU H H 6.356 9.128 4.388 1.00 . A A . 36 GLU H 1 1 8 5386 1 1 36 GLU HA H 8.800 9.824 5.989 1.00 . A A . 36 GLU HA 1 1 8 5387 1 1 36 GLU HB2 H 6.425 8.101 6.429 1.00 . A A . 36 GLU HB2 1 1 8 5388 1 1 36 GLU HB3 H 7.965 7.435 6.977 1.00 . A A . 36 GLU HB3 1 1 8 5389 1 1 36 GLU HG2 H 7.236 10.276 7.645 1.00 . A A . 36 GLU HG2 1 1 8 5390 1 1 36 GLU HG3 H 6.586 8.949 8.609 1.00 . A A . 36 GLU HG3 1 1 8 5391 1 1 36 GLU N N 7.062 9.686 4.779 1.00 . A A . 36 GLU N 1 1 8 5392 1 1 36 GLU O O 9.981 7.569 5.174 1.00 . A A . 36 GLU O 1 1 8 5393 1 1 36 GLU OE1 O 9.750 9.340 8.098 1.00 . A A . 36 GLU OE1 1 1 8 5394 1 1 36 GLU OE2 O 8.675 8.892 9.911 1.00 . A A . 36 GLU OE2 1 1 8 5395 1 1 37 CYS C C 10.381 7.524 1.943 1.00 . A A . 37 CYS C 1 1 8 5396 1 1 37 CYS CA C 9.264 6.804 2.704 1.00 . A A . 37 CYS CA 1 1 8 5397 1 1 37 CYS CB C 8.230 6.239 1.729 1.00 . A A . 37 CYS CB 1 1 8 5398 1 1 37 CYS H H 7.683 8.177 3.226 1.00 . A A . 37 CYS H 1 1 8 5399 1 1 37 CYS HA H 9.672 6.009 3.308 1.00 . A A . 37 CYS HA 1 1 8 5400 1 1 37 CYS HB2 H 7.377 5.870 2.280 1.00 . A A . 37 CYS HB2 1 1 8 5401 1 1 37 CYS HB3 H 7.912 7.016 1.050 1.00 . A A . 37 CYS HB3 1 1 8 5402 1 1 37 CYS N N 8.511 7.769 3.557 1.00 . A A . 37 CYS N 1 1 8 5403 1 1 37 CYS O O 10.357 8.727 1.777 1.00 . A A . 37 CYS O 1 1 8 5404 1 1 37 CYS SG S 8.970 4.882 0.787 1.00 . A A . 37 CYS SG 1 1 8 5405 1 1 38 LEU C C 11.965 7.997 -0.602 1.00 . A A . 38 LEU C 1 1 8 5406 1 1 38 LEU CA C 12.478 7.433 0.725 1.00 . A A . 38 LEU CA 1 1 8 5407 1 1 38 LEU CB C 13.480 6.306 0.474 1.00 . A A . 38 LEU CB 1 1 8 5408 1 1 38 LEU CD1 C 15.883 5.640 0.627 1.00 . A A . 38 LEU CD1 1 1 8 5409 1 1 38 LEU CD2 C 15.270 8.036 0.274 1.00 . A A . 38 LEU CD2 1 1 8 5410 1 1 38 LEU CG C 14.864 6.731 0.964 1.00 . A A . 38 LEU CG 1 1 8 5411 1 1 38 LEU H H 11.357 5.825 1.623 1.00 . A A . 38 LEU H 1 1 8 5412 1 1 38 LEU HA H 12.936 8.211 1.316 1.00 . A A . 38 LEU HA 1 1 8 5413 1 1 38 LEU HB2 H 13.166 5.419 1.005 1.00 . A A . 38 LEU HB2 1 1 8 5414 1 1 38 LEU HB3 H 13.525 6.095 -0.584 1.00 . A A . 38 LEU HB3 1 1 8 5415 1 1 38 LEU HD11 H 15.702 5.273 -0.372 1.00 . A A . 38 LEU HD11 1 1 8 5416 1 1 38 LEU HD12 H 15.787 4.827 1.333 1.00 . A A . 38 LEU HD12 1 1 8 5417 1 1 38 LEU HD13 H 16.881 6.050 0.684 1.00 . A A . 38 LEU HD13 1 1 8 5418 1 1 38 LEU HD21 H 16.157 7.869 -0.320 1.00 . A A . 38 LEU HD21 1 1 8 5419 1 1 38 LEU HD22 H 15.473 8.789 1.021 1.00 . A A . 38 LEU HD22 1 1 8 5420 1 1 38 LEU HD23 H 14.466 8.370 -0.365 1.00 . A A . 38 LEU HD23 1 1 8 5421 1 1 38 LEU HG H 14.837 6.881 2.034 1.00 . A A . 38 LEU HG 1 1 8 5422 1 1 38 LEU N N 11.359 6.794 1.478 1.00 . A A . 38 LEU N 1 1 8 5423 1 1 38 LEU O O 11.818 9.192 -0.766 1.00 . A A . 38 LEU O 1 1 8 5424 1 1 39 SER C C 9.734 8.100 -2.735 1.00 . A A . 39 SER C 1 1 8 5425 1 1 39 SER CA C 11.184 7.627 -2.867 1.00 . A A . 39 SER CA 1 1 8 5426 1 1 39 SER CB C 11.270 6.414 -3.792 1.00 . A A . 39 SER CB 1 1 8 5427 1 1 39 SER H H 11.814 6.184 -1.395 1.00 . A A . 39 SER H 1 1 8 5428 1 1 39 SER HA H 11.809 8.421 -3.242 1.00 . A A . 39 SER HA 1 1 8 5429 1 1 39 SER HB2 H 11.554 5.544 -3.224 1.00 . A A . 39 SER HB2 1 1 8 5430 1 1 39 SER HB3 H 10.304 6.242 -4.249 1.00 . A A . 39 SER HB3 1 1 8 5431 1 1 39 SER HG H 12.926 7.218 -4.419 1.00 . A A . 39 SER HG 1 1 8 5432 1 1 39 SER N N 11.689 7.143 -1.550 1.00 . A A . 39 SER N 1 1 8 5433 1 1 39 SER O O 9.146 8.042 -1.673 1.00 . A A . 39 SER O 1 1 8 5434 1 1 39 SER OG O 12.246 6.655 -4.797 1.00 . A A . 39 SER OG 1 1 8 5435 1 1 40 GLY C C 6.798 7.863 -3.987 1.00 . A A . 40 GLY C 1 1 8 5436 1 1 40 GLY CA C 7.741 9.039 -3.740 1.00 . A A . 40 GLY CA 1 1 8 5437 1 1 40 GLY H H 9.643 8.603 -4.654 1.00 . A A . 40 GLY H 1 1 8 5438 1 1 40 GLY HA2 H 7.547 9.461 -2.764 1.00 . A A . 40 GLY HA2 1 1 8 5439 1 1 40 GLY HA3 H 7.578 9.793 -4.497 1.00 . A A . 40 GLY HA3 1 1 8 5440 1 1 40 GLY N N 9.152 8.566 -3.806 1.00 . A A . 40 GLY N 1 1 8 5441 1 1 40 GLY O O 5.629 8.038 -4.265 1.00 . A A . 40 GLY O 1 1 8 5442 1 1 41 THR C C 5.789 5.024 -2.798 1.00 . A A . 41 THR C 1 1 8 5443 1 1 41 THR CA C 6.428 5.472 -4.115 1.00 . A A . 41 THR CA 1 1 8 5444 1 1 41 THR CB C 7.366 4.390 -4.653 1.00 . A A . 41 THR CB 1 1 8 5445 1 1 41 THR CG2 C 8.129 4.927 -5.865 1.00 . A A . 41 THR CG2 1 1 8 5446 1 1 41 THR H H 8.243 6.541 -3.662 1.00 . A A . 41 THR H 1 1 8 5447 1 1 41 THR HA H 5.667 5.697 -4.846 1.00 . A A . 41 THR HA 1 1 8 5448 1 1 41 THR HB H 6.790 3.528 -4.949 1.00 . A A . 41 THR HB 1 1 8 5449 1 1 41 THR HG1 H 8.422 4.779 -3.066 1.00 . A A . 41 THR HG1 1 1 8 5450 1 1 41 THR HG21 H 9.024 5.433 -5.532 1.00 . A A . 41 THR HG21 1 1 8 5451 1 1 41 THR HG22 H 7.504 5.621 -6.406 1.00 . A A . 41 THR HG22 1 1 8 5452 1 1 41 THR HG23 H 8.400 4.107 -6.512 1.00 . A A . 41 THR HG23 1 1 8 5453 1 1 41 THR N N 7.297 6.661 -3.887 1.00 . A A . 41 THR N 1 1 8 5454 1 1 41 THR O O 6.380 5.135 -1.742 1.00 . A A . 41 THR O 1 1 8 5455 1 1 41 THR OG1 O 8.288 4.019 -3.638 1.00 . A A . 41 THR OG1 1 1 8 5456 1 1 42 TRP C C 2.940 2.924 -1.908 1.00 . A A . 42 TRP C 1 1 8 5457 1 1 42 TRP CA C 3.908 4.070 -1.600 1.00 . A A . 42 TRP CA 1 1 8 5458 1 1 42 TRP CB C 3.144 5.297 -1.104 1.00 . A A . 42 TRP CB 1 1 8 5459 1 1 42 TRP CD1 C 3.162 4.797 1.368 1.00 . A A . 42 TRP CD1 1 1 8 5460 1 1 42 TRP CD2 C 1.082 4.848 0.512 1.00 . A A . 42 TRP CD2 1 1 8 5461 1 1 42 TRP CE2 C 0.947 4.566 1.891 1.00 . A A . 42 TRP CE2 1 1 8 5462 1 1 42 TRP CE3 C -0.086 4.937 -0.265 1.00 . A A . 42 TRP CE3 1 1 8 5463 1 1 42 TRP CG C 2.500 4.992 0.207 1.00 . A A . 42 TRP CG 1 1 8 5464 1 1 42 TRP CH2 C -1.456 4.469 1.692 1.00 . A A . 42 TRP CH2 1 1 8 5465 1 1 42 TRP CZ2 C -0.304 4.377 2.479 1.00 . A A . 42 TRP CZ2 1 1 8 5466 1 1 42 TRP CZ3 C -1.347 4.747 0.323 1.00 . A A . 42 TRP CZ3 1 1 8 5467 1 1 42 TRP H H 4.126 4.443 -3.713 1.00 . A A . 42 TRP H 1 1 8 5468 1 1 42 TRP HA H 4.635 3.765 -0.866 1.00 . A A . 42 TRP HA 1 1 8 5469 1 1 42 TRP HB2 H 3.827 6.123 -0.981 1.00 . A A . 42 TRP HB2 1 1 8 5470 1 1 42 TRP HB3 H 2.385 5.564 -1.824 1.00 . A A . 42 TRP HB3 1 1 8 5471 1 1 42 TRP HD1 H 4.234 4.834 1.495 1.00 . A A . 42 TRP HD1 1 1 8 5472 1 1 42 TRP HE1 H 2.463 4.369 3.308 1.00 . A A . 42 TRP HE1 1 1 8 5473 1 1 42 TRP HE3 H -0.014 5.151 -1.321 1.00 . A A . 42 TRP HE3 1 1 8 5474 1 1 42 TRP HH2 H -2.429 4.324 2.139 1.00 . A A . 42 TRP HH2 1 1 8 5475 1 1 42 TRP HZ2 H -0.383 4.162 3.535 1.00 . A A . 42 TRP HZ2 1 1 8 5476 1 1 42 TRP HZ3 H -2.239 4.816 -0.284 1.00 . A A . 42 TRP HZ3 1 1 8 5477 1 1 42 TRP N N 4.585 4.522 -2.850 1.00 . A A . 42 TRP N 1 1 8 5478 1 1 42 TRP NE1 N 2.242 4.544 2.370 1.00 . A A . 42 TRP NE1 1 1 8 5479 1 1 42 TRP O O 2.112 3.021 -2.792 1.00 . A A . 42 TRP O 1 1 8 5480 1 1 43 THR C C 1.420 0.264 -0.153 1.00 . A A . 43 THR C 1 1 8 5481 1 1 43 THR CA C 2.106 0.696 -1.451 1.00 . A A . 43 THR CA 1 1 8 5482 1 1 43 THR CB C 3.000 -0.424 -1.985 1.00 . A A . 43 THR CB 1 1 8 5483 1 1 43 THR CG2 C 4.142 -0.682 -1.000 1.00 . A A . 43 THR CG2 1 1 8 5484 1 1 43 THR H H 3.705 1.771 -0.475 1.00 . A A . 43 THR H 1 1 8 5485 1 1 43 THR HA H 1.373 0.969 -2.194 1.00 . A A . 43 THR HA 1 1 8 5486 1 1 43 THR HB H 3.413 -0.133 -2.939 1.00 . A A . 43 THR HB 1 1 8 5487 1 1 43 THR HG1 H 2.599 -2.106 -2.875 1.00 . A A . 43 THR HG1 1 1 8 5488 1 1 43 THR HG21 H 4.766 -1.479 -1.373 1.00 . A A . 43 THR HG21 1 1 8 5489 1 1 43 THR HG22 H 3.732 -0.962 -0.041 1.00 . A A . 43 THR HG22 1 1 8 5490 1 1 43 THR HG23 H 4.732 0.216 -0.891 1.00 . A A . 43 THR HG23 1 1 8 5491 1 1 43 THR N N 3.031 1.837 -1.188 1.00 . A A . 43 THR N 1 1 8 5492 1 1 43 THR O O 1.949 0.441 0.925 1.00 . A A . 43 THR O 1 1 8 5493 1 1 43 THR OG1 O 2.231 -1.607 -2.143 1.00 . A A . 43 THR OG1 1 1 8 5494 1 1 44 GLN C C -1.009 -2.151 0.822 1.00 . A A . 44 GLN C 1 1 8 5495 1 1 44 GLN CA C -0.461 -0.733 0.993 1.00 . A A . 44 GLN CA 1 1 8 5496 1 1 44 GLN CB C -1.602 0.268 1.176 1.00 . A A . 44 GLN CB 1 1 8 5497 1 1 44 GLN CD C -2.439 1.442 3.218 1.00 . A A . 44 GLN CD 1 1 8 5498 1 1 44 GLN CG C -1.237 1.247 2.293 1.00 . A A . 44 GLN CG 1 1 8 5499 1 1 44 GLN H H -0.168 -0.432 -1.121 1.00 . A A . 44 GLN H 1 1 8 5500 1 1 44 GLN HA H 0.204 -0.690 1.841 1.00 . A A . 44 GLN HA 1 1 8 5501 1 1 44 GLN HB2 H -1.757 0.811 0.255 1.00 . A A . 44 GLN HB2 1 1 8 5502 1 1 44 GLN HB3 H -2.506 -0.258 1.443 1.00 . A A . 44 GLN HB3 1 1 8 5503 1 1 44 GLN HE21 H -1.426 0.984 4.863 1.00 . A A . 44 GLN HE21 1 1 8 5504 1 1 44 GLN HE22 H -3.061 1.372 5.102 1.00 . A A . 44 GLN HE22 1 1 8 5505 1 1 44 GLN HG2 H -0.408 0.850 2.861 1.00 . A A . 44 GLN HG2 1 1 8 5506 1 1 44 GLN HG3 H -0.957 2.196 1.863 1.00 . A A . 44 GLN HG3 1 1 8 5507 1 1 44 GLN N N 0.247 -0.297 -0.244 1.00 . A A . 44 GLN N 1 1 8 5508 1 1 44 GLN NE2 N -2.298 1.251 4.500 1.00 . A A . 44 GLN NE2 1 1 8 5509 1 1 44 GLN O O -2.082 -2.472 1.291 1.00 . A A . 44 GLN O 1 1 8 5510 1 1 44 GLN OE1 O -3.518 1.773 2.769 1.00 . A A . 44 GLN OE1 1 1 8 5511 1 1 45 GLN C C 0.429 -5.364 -0.137 1.00 . A A . 45 GLN C 1 1 8 5512 1 1 45 GLN CA C -0.756 -4.403 -0.021 1.00 . A A . 45 GLN CA 1 1 8 5513 1 1 45 GLN CB C -1.554 -4.372 -1.325 1.00 . A A . 45 GLN CB 1 1 8 5514 1 1 45 GLN CD C -2.321 -6.206 -2.836 1.00 . A A . 45 GLN CD 1 1 8 5515 1 1 45 GLN CG C -2.422 -5.628 -1.424 1.00 . A A . 45 GLN CG 1 1 8 5516 1 1 45 GLN H H 0.593 -2.732 -0.199 1.00 . A A . 45 GLN H 1 1 8 5517 1 1 45 GLN HA H -1.398 -4.693 0.794 1.00 . A A . 45 GLN HA 1 1 8 5518 1 1 45 GLN HB2 H -2.185 -3.496 -1.340 1.00 . A A . 45 GLN HB2 1 1 8 5519 1 1 45 GLN HB3 H -0.874 -4.340 -2.162 1.00 . A A . 45 GLN HB3 1 1 8 5520 1 1 45 GLN HE21 H -0.995 -7.593 -2.327 1.00 . A A . 45 GLN HE21 1 1 8 5521 1 1 45 GLN HE22 H -1.453 -7.593 -3.960 1.00 . A A . 45 GLN HE22 1 1 8 5522 1 1 45 GLN HG2 H -2.078 -6.360 -0.708 1.00 . A A . 45 GLN HG2 1 1 8 5523 1 1 45 GLN HG3 H -3.449 -5.372 -1.215 1.00 . A A . 45 GLN HG3 1 1 8 5524 1 1 45 GLN N N -0.275 -3.006 0.164 1.00 . A A . 45 GLN N 1 1 8 5525 1 1 45 GLN NE2 N -1.523 -7.214 -3.060 1.00 . A A . 45 GLN NE2 1 1 8 5526 1 1 45 GLN O O 1.073 -5.458 -1.163 1.00 . A A . 45 GLN O 1 1 8 5527 1 1 45 GLN OE1 O -2.974 -5.734 -3.747 1.00 . A A . 45 GLN OE1 1 1 8 5528 1 1 46 ILE C C 1.529 -8.218 1.837 1.00 . A A . 46 ILE C 1 1 8 5529 1 1 46 ILE CA C 1.833 -7.066 0.877 1.00 . A A . 46 ILE CA 1 1 8 5530 1 1 46 ILE CB C 3.062 -6.283 1.342 1.00 . A A . 46 ILE CB 1 1 8 5531 1 1 46 ILE CD1 C 3.838 -6.022 -1.022 1.00 . A A . 46 ILE CD1 1 1 8 5532 1 1 46 ILE CG1 C 3.466 -5.276 0.261 1.00 . A A . 46 ILE CG1 1 1 8 5533 1 1 46 ILE CG2 C 4.220 -7.252 1.590 1.00 . A A . 46 ILE CG2 1 1 8 5534 1 1 46 ILE H H 0.163 -6.002 1.720 1.00 . A A . 46 ILE H 1 1 8 5535 1 1 46 ILE HA H 1.984 -7.436 -0.125 1.00 . A A . 46 ILE HA 1 1 8 5536 1 1 46 ILE HB H 2.830 -5.759 2.258 1.00 . A A . 46 ILE HB 1 1 8 5537 1 1 46 ILE HD11 H 3.663 -7.079 -0.890 1.00 . A A . 46 ILE HD11 1 1 8 5538 1 1 46 ILE HD12 H 4.882 -5.855 -1.246 1.00 . A A . 46 ILE HD12 1 1 8 5539 1 1 46 ILE HD13 H 3.234 -5.656 -1.839 1.00 . A A . 46 ILE HD13 1 1 8 5540 1 1 46 ILE HG12 H 2.638 -4.609 0.064 1.00 . A A . 46 ILE HG12 1 1 8 5541 1 1 46 ILE HG13 H 4.315 -4.704 0.602 1.00 . A A . 46 ILE HG13 1 1 8 5542 1 1 46 ILE HG21 H 3.976 -8.218 1.173 1.00 . A A . 46 ILE HG21 1 1 8 5543 1 1 46 ILE HG22 H 4.385 -7.352 2.653 1.00 . A A . 46 ILE HG22 1 1 8 5544 1 1 46 ILE HG23 H 5.114 -6.873 1.121 1.00 . A A . 46 ILE HG23 1 1 8 5545 1 1 46 ILE N N 0.707 -6.090 0.909 1.00 . A A . 46 ILE N 1 1 8 5546 1 1 46 ILE O O 1.757 -9.374 1.540 1.00 . A A . 46 ILE O 1 1 8 5547 1 1 47 CYS C C -0.632 -9.641 3.620 1.00 . A A . 47 CYS C 1 1 8 5548 1 1 47 CYS CA C 0.679 -8.945 3.996 1.00 . A A . 47 CYS CA 1 1 8 5549 1 1 47 CYS CB C 0.521 -8.177 5.310 1.00 . A A . 47 CYS CB 1 1 8 5550 1 1 47 CYS H H 0.840 -6.954 3.199 1.00 . A A . 47 CYS H 1 1 8 5551 1 1 47 CYS HA H 1.481 -9.661 4.079 1.00 . A A . 47 CYS HA 1 1 8 5552 1 1 47 CYS HB2 H 0.747 -7.135 5.145 1.00 . A A . 47 CYS HB2 1 1 8 5553 1 1 47 CYS HB3 H -0.496 -8.273 5.659 1.00 . A A . 47 CYS HB3 1 1 8 5554 1 1 47 CYS N N 1.011 -7.896 2.992 1.00 . A A . 47 CYS N 1 1 8 5555 1 1 47 CYS O O -1.664 -9.012 3.496 1.00 . A A . 47 CYS O 1 1 8 5556 1 1 47 CYS SG S 1.651 -8.848 6.554 1.00 . A A . 47 CYS SG 1 1 8 5557 1 1 48 LEU C C -2.413 -12.393 4.299 1.00 . A A . 48 LEU C 1 1 8 5558 1 1 48 LEU CA C -1.852 -11.661 3.077 1.00 . A A . 48 LEU CA 1 1 8 5559 1 1 48 LEU CB C -1.430 -12.662 2.000 1.00 . A A . 48 LEU CB 1 1 8 5560 1 1 48 LEU CD1 C -0.213 -12.406 -0.168 1.00 . A A . 48 LEU CD1 1 1 8 5561 1 1 48 LEU CD2 C -2.710 -12.377 -0.127 1.00 . A A . 48 LEU CD2 1 1 8 5562 1 1 48 LEU CG C -1.443 -11.976 0.634 1.00 . A A . 48 LEU CG 1 1 8 5563 1 1 48 LEU H H 0.238 -11.425 3.549 1.00 . A A . 48 LEU H 1 1 8 5564 1 1 48 LEU HA H -2.584 -10.977 2.677 1.00 . A A . 48 LEU HA 1 1 8 5565 1 1 48 LEU HB2 H -0.434 -13.021 2.216 1.00 . A A . 48 LEU HB2 1 1 8 5566 1 1 48 LEU HB3 H -2.119 -13.492 1.992 1.00 . A A . 48 LEU HB3 1 1 8 5567 1 1 48 LEU HD11 H 0.111 -11.589 -0.795 1.00 . A A . 48 LEU HD11 1 1 8 5568 1 1 48 LEU HD12 H -0.465 -13.255 -0.787 1.00 . A A . 48 LEU HD12 1 1 8 5569 1 1 48 LEU HD13 H 0.582 -12.677 0.509 1.00 . A A . 48 LEU HD13 1 1 8 5570 1 1 48 LEU HD21 H -2.630 -12.053 -1.154 1.00 . A A . 48 LEU HD21 1 1 8 5571 1 1 48 LEU HD22 H -3.568 -11.911 0.333 1.00 . A A . 48 LEU HD22 1 1 8 5572 1 1 48 LEU HD23 H -2.823 -13.450 -0.096 1.00 . A A . 48 LEU HD23 1 1 8 5573 1 1 48 LEU HG H -1.426 -10.904 0.768 1.00 . A A . 48 LEU HG 1 1 8 5574 1 1 48 LEU N N -0.603 -10.933 3.442 1.00 . A A . 48 LEU N 1 1 8 5575 1 1 48 LEU O O -2.944 -11.726 5.173 1.00 . A A . 48 LEU O 1 1 8 5576 1 1 48 LEU OXT O -2.305 -13.608 4.340 1.00 . A A . 48 LEU OXT 1 1 9 5577 1 1 1 GLY C C -6.569 -3.059 18.076 1.00 . A A . 1 GLY C 1 1 9 5578 1 1 1 GLY CA C -7.702 -3.941 17.553 1.00 . A A . 1 GLY CA 1 1 9 5579 1 1 1 GLY H1 H -6.370 -5.456 17.038 1.00 . A A . 1 GLY H1 1 1 9 5580 1 1 1 GLY H2 H -6.812 -4.451 15.741 1.00 . A A . 1 GLY H2 1 1 9 5581 1 1 1 GLY H3 H -7.902 -5.612 16.328 1.00 . A A . 1 GLY H3 1 1 9 5582 1 1 1 GLY HA2 H -8.437 -3.326 17.052 1.00 . A A . 1 GLY HA2 1 1 9 5583 1 1 1 GLY HA3 H -8.166 -4.453 18.381 1.00 . A A . 1 GLY HA3 1 1 9 5584 1 1 1 GLY N N -7.155 -4.941 16.592 1.00 . A A . 1 GLY N 1 1 9 5585 1 1 1 GLY O O -5.461 -3.099 17.580 1.00 . A A . 1 GLY O 1 1 9 5586 1 1 2 SER C C -4.950 -0.765 18.501 1.00 . A A . 2 SER C 1 1 9 5587 1 1 2 SER CA C -5.776 -1.377 19.636 1.00 . A A . 2 SER CA 1 1 9 5588 1 1 2 SER CB C -4.910 -2.290 20.504 1.00 . A A . 2 SER CB 1 1 9 5589 1 1 2 SER H H -7.739 -2.249 19.461 1.00 . A A . 2 SER H 1 1 9 5590 1 1 2 SER HA H -6.215 -0.601 20.242 1.00 . A A . 2 SER HA 1 1 9 5591 1 1 2 SER HB2 H -3.880 -1.989 20.429 1.00 . A A . 2 SER HB2 1 1 9 5592 1 1 2 SER HB3 H -5.231 -2.213 21.535 1.00 . A A . 2 SER HB3 1 1 9 5593 1 1 2 SER HG H -5.887 -3.967 20.356 1.00 . A A . 2 SER HG 1 1 9 5594 1 1 2 SER N N -6.838 -2.263 19.077 1.00 . A A . 2 SER N 1 1 9 5595 1 1 2 SER O O -3.790 -0.441 18.667 1.00 . A A . 2 SER O 1 1 9 5596 1 1 2 SER OG O -5.039 -3.633 20.055 1.00 . A A . 2 SER OG 1 1 9 5597 1 1 3 ALA C C -4.435 1.445 16.506 1.00 . A A . 3 ALA C 1 1 9 5598 1 1 3 ALA CA C -4.799 -0.010 16.200 1.00 . A A . 3 ALA CA 1 1 9 5599 1 1 3 ALA CB C -5.773 -0.083 15.023 1.00 . A A . 3 ALA CB 1 1 9 5600 1 1 3 ALA H H -6.478 -0.870 17.240 1.00 . A A . 3 ALA H 1 1 9 5601 1 1 3 ALA HA H -3.913 -0.586 15.984 1.00 . A A . 3 ALA HA 1 1 9 5602 1 1 3 ALA HB1 H -5.851 0.889 14.559 1.00 . A A . 3 ALA HB1 1 1 9 5603 1 1 3 ALA HB2 H -6.745 -0.390 15.381 1.00 . A A . 3 ALA HB2 1 1 9 5604 1 1 3 ALA HB3 H -5.413 -0.801 14.301 1.00 . A A . 3 ALA HB3 1 1 9 5605 1 1 3 ALA N N -5.541 -0.603 17.349 1.00 . A A . 3 ALA N 1 1 9 5606 1 1 3 ALA O O -5.254 2.335 16.390 1.00 . A A . 3 ALA O 1 1 9 5607 1 1 4 MET C C -1.620 3.521 16.368 1.00 . A A . 4 MET C 1 1 9 5608 1 1 4 MET CA C -2.814 3.090 17.225 1.00 . A A . 4 MET CA 1 1 9 5609 1 1 4 MET CB C -2.425 3.057 18.702 1.00 . A A . 4 MET CB 1 1 9 5610 1 1 4 MET CE C -1.736 4.239 21.768 1.00 . A A . 4 MET CE 1 1 9 5611 1 1 4 MET CG C -3.127 4.199 19.438 1.00 . A A . 4 MET CG 1 1 9 5612 1 1 4 MET H H -2.574 0.962 16.999 1.00 . A A . 4 MET H 1 1 9 5613 1 1 4 MET HA H -3.643 3.765 17.080 1.00 . A A . 4 MET HA 1 1 9 5614 1 1 4 MET HB2 H -2.726 2.112 19.132 1.00 . A A . 4 MET HB2 1 1 9 5615 1 1 4 MET HB3 H -1.356 3.174 18.798 1.00 . A A . 4 MET HB3 1 1 9 5616 1 1 4 MET HE1 H -2.527 3.501 21.795 1.00 . A A . 4 MET HE1 1 1 9 5617 1 1 4 MET HE2 H -1.813 4.876 22.634 1.00 . A A . 4 MET HE2 1 1 9 5618 1 1 4 MET HE3 H -0.774 3.744 21.772 1.00 . A A . 4 MET HE3 1 1 9 5619 1 1 4 MET HG2 H -3.679 4.796 18.728 1.00 . A A . 4 MET HG2 1 1 9 5620 1 1 4 MET HG3 H -3.807 3.791 20.170 1.00 . A A . 4 MET HG3 1 1 9 5621 1 1 4 MET N N -3.218 1.693 16.904 1.00 . A A . 4 MET N 1 1 9 5622 1 1 4 MET O O -0.553 3.802 16.873 1.00 . A A . 4 MET O 1 1 9 5623 1 1 4 MET SD S -1.894 5.234 20.265 1.00 . A A . 4 MET SD 1 1 9 5624 1 1 5 GLY C C -0.226 2.867 13.297 1.00 . A A . 5 GLY C 1 1 9 5625 1 1 5 GLY CA C -0.668 4.020 14.201 1.00 . A A . 5 GLY CA 1 1 9 5626 1 1 5 GLY H H -2.665 3.370 14.685 1.00 . A A . 5 GLY H 1 1 9 5627 1 1 5 GLY HA2 H -0.991 4.850 13.589 1.00 . A A . 5 GLY HA2 1 1 9 5628 1 1 5 GLY HA3 H 0.164 4.330 14.815 1.00 . A A . 5 GLY HA3 1 1 9 5629 1 1 5 GLY N N -1.795 3.589 15.076 1.00 . A A . 5 GLY N 1 1 9 5630 1 1 5 GLY O O 0.274 1.858 13.754 1.00 . A A . 5 GLY O 1 1 9 5631 1 1 6 CYS C C 1.542 1.741 11.185 1.00 . A A . 6 CYS C 1 1 9 5632 1 1 6 CYS CA C 0.029 1.952 11.066 1.00 . A A . 6 CYS CA 1 1 9 5633 1 1 6 CYS CB C -0.356 2.491 9.681 1.00 . A A . 6 CYS CB 1 1 9 5634 1 1 6 CYS H H -0.787 3.847 11.669 1.00 . A A . 6 CYS H 1 1 9 5635 1 1 6 CYS HA H -0.499 1.035 11.270 1.00 . A A . 6 CYS HA 1 1 9 5636 1 1 6 CYS HB2 H -1.389 2.252 9.484 1.00 . A A . 6 CYS HB2 1 1 9 5637 1 1 6 CYS HB3 H -0.233 3.562 9.669 1.00 . A A . 6 CYS HB3 1 1 9 5638 1 1 6 CYS N N -0.394 3.021 12.012 1.00 . A A . 6 CYS N 1 1 9 5639 1 1 6 CYS O O 2.014 0.633 11.347 1.00 . A A . 6 CYS O 1 1 9 5640 1 1 6 CYS SG S 0.679 1.750 8.389 1.00 . A A . 6 CYS SG 1 1 9 5641 1 1 7 ARG C C 4.129 2.114 12.616 1.00 . A A . 7 ARG C 1 1 9 5642 1 1 7 ARG CA C 3.780 2.659 11.231 1.00 . A A . 7 ARG CA 1 1 9 5643 1 1 7 ARG CB C 4.328 4.074 11.045 1.00 . A A . 7 ARG CB 1 1 9 5644 1 1 7 ARG CD C 3.761 6.429 11.643 1.00 . A A . 7 ARG CD 1 1 9 5645 1 1 7 ARG CG C 3.782 4.983 12.145 1.00 . A A . 7 ARG CG 1 1 9 5646 1 1 7 ARG CZ C 2.397 7.404 9.900 1.00 . A A . 7 ARG CZ 1 1 9 5647 1 1 7 ARG H H 1.902 3.685 10.989 1.00 . A A . 7 ARG H 1 1 9 5648 1 1 7 ARG HA H 4.160 2.008 10.460 1.00 . A A . 7 ARG HA 1 1 9 5649 1 1 7 ARG HB2 H 5.407 4.054 11.098 1.00 . A A . 7 ARG HB2 1 1 9 5650 1 1 7 ARG HB3 H 4.024 4.455 10.082 1.00 . A A . 7 ARG HB3 1 1 9 5651 1 1 7 ARG HD2 H 3.779 7.115 12.478 1.00 . A A . 7 ARG HD2 1 1 9 5652 1 1 7 ARG HD3 H 4.596 6.610 10.985 1.00 . A A . 7 ARG HD3 1 1 9 5653 1 1 7 ARG HE H 1.708 6.014 11.139 1.00 . A A . 7 ARG HE 1 1 9 5654 1 1 7 ARG HG2 H 2.779 4.674 12.402 1.00 . A A . 7 ARG HG2 1 1 9 5655 1 1 7 ARG HG3 H 4.416 4.915 13.016 1.00 . A A . 7 ARG HG3 1 1 9 5656 1 1 7 ARG HH11 H 3.981 6.657 8.931 1.00 . A A . 7 ARG HH11 1 1 9 5657 1 1 7 ARG HH12 H 3.193 7.993 8.161 1.00 . A A . 7 ARG HH12 1 1 9 5658 1 1 7 ARG HH21 H 0.802 8.356 10.646 1.00 . A A . 7 ARG HH21 1 1 9 5659 1 1 7 ARG HH22 H 1.393 8.955 9.131 1.00 . A A . 7 ARG HH22 1 1 9 5660 1 1 7 ARG N N 2.302 2.799 11.113 1.00 . A A . 7 ARG N 1 1 9 5661 1 1 7 ARG NE N 2.483 6.560 10.891 1.00 . A A . 7 ARG NE 1 1 9 5662 1 1 7 ARG NH1 N 3.257 7.346 8.921 1.00 . A A . 7 ARG NH1 1 1 9 5663 1 1 7 ARG NH2 N 1.458 8.309 9.892 1.00 . A A . 7 ARG NH2 1 1 9 5664 1 1 7 ARG O O 5.105 1.412 12.791 1.00 . A A . 7 ARG O 1 1 9 5665 1 1 8 HIS C C 3.533 0.383 14.967 1.00 . A A . 8 HIS C 1 1 9 5666 1 1 8 HIS CA C 3.598 1.912 14.971 1.00 . A A . 8 HIS CA 1 1 9 5667 1 1 8 HIS CB C 2.484 2.508 15.840 1.00 . A A . 8 HIS CB 1 1 9 5668 1 1 8 HIS CD2 C 1.286 0.962 17.599 1.00 . A A . 8 HIS CD2 1 1 9 5669 1 1 8 HIS CE1 C 2.902 0.802 19.033 1.00 . A A . 8 HIS CE1 1 1 9 5670 1 1 8 HIS CG C 2.332 1.701 17.104 1.00 . A A . 8 HIS CG 1 1 9 5671 1 1 8 HIS H H 2.539 2.982 13.430 1.00 . A A . 8 HIS H 1 1 9 5672 1 1 8 HIS HA H 4.561 2.251 15.317 1.00 . A A . 8 HIS HA 1 1 9 5673 1 1 8 HIS HB2 H 2.731 3.528 16.092 1.00 . A A . 8 HIS HB2 1 1 9 5674 1 1 8 HIS HB3 H 1.554 2.490 15.290 1.00 . A A . 8 HIS HB3 1 1 9 5675 1 1 8 HIS HD1 H 4.239 1.998 17.979 1.00 . A A . 8 HIS HD1 1 1 9 5676 1 1 8 HIS HD2 H 0.327 0.840 17.119 1.00 . A A . 8 HIS HD2 1 1 9 5677 1 1 8 HIS HE1 H 3.484 0.534 19.903 1.00 . A A . 8 HIS HE1 1 1 9 5678 1 1 8 HIS N N 3.326 2.422 13.599 1.00 . A A . 8 HIS N 1 1 9 5679 1 1 8 HIS ND1 N 3.352 1.585 18.035 1.00 . A A . 8 HIS ND1 1 1 9 5680 1 1 8 HIS NE2 N 1.648 0.395 18.818 1.00 . A A . 8 HIS NE2 1 1 9 5681 1 1 8 HIS O O 4.112 -0.279 15.806 1.00 . A A . 8 HIS O 1 1 9 5682 1 1 9 PHE C C 4.090 -2.285 13.641 1.00 . A A . 9 PHE C 1 1 9 5683 1 1 9 PHE CA C 2.721 -1.666 13.950 1.00 . A A . 9 PHE CA 1 1 9 5684 1 1 9 PHE CB C 1.743 -1.935 12.803 1.00 . A A . 9 PHE CB 1 1 9 5685 1 1 9 PHE CD1 C 0.093 -0.840 14.386 1.00 . A A . 9 PHE CD1 1 1 9 5686 1 1 9 PHE CD2 C -0.556 -1.190 12.077 1.00 . A A . 9 PHE CD2 1 1 9 5687 1 1 9 PHE CE1 C -1.158 -0.263 14.647 1.00 . A A . 9 PHE CE1 1 1 9 5688 1 1 9 PHE CE2 C -1.805 -0.614 12.338 1.00 . A A . 9 PHE CE2 1 1 9 5689 1 1 9 PHE CG C 0.396 -1.305 13.098 1.00 . A A . 9 PHE CG 1 1 9 5690 1 1 9 PHE CZ C -2.105 -0.150 13.624 1.00 . A A . 9 PHE CZ 1 1 9 5691 1 1 9 PHE H H 2.374 0.373 13.356 1.00 . A A . 9 PHE H 1 1 9 5692 1 1 9 PHE HA H 2.326 -2.060 14.871 1.00 . A A . 9 PHE HA 1 1 9 5693 1 1 9 PHE HB2 H 2.141 -1.514 11.890 1.00 . A A . 9 PHE HB2 1 1 9 5694 1 1 9 PHE HB3 H 1.621 -3.000 12.681 1.00 . A A . 9 PHE HB3 1 1 9 5695 1 1 9 PHE HD1 H 0.824 -0.925 15.176 1.00 . A A . 9 PHE HD1 1 1 9 5696 1 1 9 PHE HD2 H -0.326 -1.547 11.085 1.00 . A A . 9 PHE HD2 1 1 9 5697 1 1 9 PHE HE1 H -1.391 0.095 15.638 1.00 . A A . 9 PHE HE1 1 1 9 5698 1 1 9 PHE HE2 H -2.539 -0.528 11.548 1.00 . A A . 9 PHE HE2 1 1 9 5699 1 1 9 PHE HZ H -3.069 0.295 13.827 1.00 . A A . 9 PHE HZ 1 1 9 5700 1 1 9 PHE N N 2.830 -0.182 14.021 1.00 . A A . 9 PHE N 1 1 9 5701 1 1 9 PHE O O 5.008 -1.612 13.218 1.00 . A A . 9 PHE O 1 1 9 5702 1 1 10 GLN C C 5.705 -4.476 12.066 1.00 . A A . 10 GLN C 1 1 9 5703 1 1 10 GLN CA C 5.536 -4.236 13.571 1.00 . A A . 10 GLN CA 1 1 9 5704 1 1 10 GLN CB C 5.464 -5.566 14.322 1.00 . A A . 10 GLN CB 1 1 9 5705 1 1 10 GLN CD C 4.918 -6.300 16.644 1.00 . A A . 10 GLN CD 1 1 9 5706 1 1 10 GLN CG C 5.755 -5.334 15.806 1.00 . A A . 10 GLN CG 1 1 9 5707 1 1 10 GLN H H 3.477 -4.092 14.193 1.00 . A A . 10 GLN H 1 1 9 5708 1 1 10 GLN HA H 6.353 -3.643 13.952 1.00 . A A . 10 GLN HA 1 1 9 5709 1 1 10 GLN HB2 H 4.476 -5.989 14.210 1.00 . A A . 10 GLN HB2 1 1 9 5710 1 1 10 GLN HB3 H 6.196 -6.249 13.917 1.00 . A A . 10 GLN HB3 1 1 9 5711 1 1 10 GLN HE21 H 3.589 -4.921 17.169 1.00 . A A . 10 GLN HE21 1 1 9 5712 1 1 10 GLN HE22 H 3.307 -6.475 17.791 1.00 . A A . 10 GLN HE22 1 1 9 5713 1 1 10 GLN HG2 H 6.805 -5.506 15.998 1.00 . A A . 10 GLN HG2 1 1 9 5714 1 1 10 GLN HG3 H 5.502 -4.319 16.068 1.00 . A A . 10 GLN HG3 1 1 9 5715 1 1 10 GLN N N 4.230 -3.567 13.850 1.00 . A A . 10 GLN N 1 1 9 5716 1 1 10 GLN NE2 N 3.849 -5.862 17.252 1.00 . A A . 10 GLN NE2 1 1 9 5717 1 1 10 GLN O O 6.201 -3.632 11.346 1.00 . A A . 10 GLN O 1 1 9 5718 1 1 10 GLN OE1 O 5.239 -7.467 16.747 1.00 . A A . 10 GLN OE1 1 1 9 5719 1 1 11 SER C C 4.254 -5.333 9.352 1.00 . A A . 11 SER C 1 1 9 5720 1 1 11 SER CA C 5.439 -5.914 10.129 1.00 . A A . 11 SER CA 1 1 9 5721 1 1 11 SER CB C 5.447 -7.439 10.036 1.00 . A A . 11 SER CB 1 1 9 5722 1 1 11 SER H H 4.902 -6.291 12.181 1.00 . A A . 11 SER H 1 1 9 5723 1 1 11 SER HA H 6.369 -5.517 9.749 1.00 . A A . 11 SER HA 1 1 9 5724 1 1 11 SER HB2 H 5.751 -7.857 10.980 1.00 . A A . 11 SER HB2 1 1 9 5725 1 1 11 SER HB3 H 4.453 -7.790 9.791 1.00 . A A . 11 SER HB3 1 1 9 5726 1 1 11 SER HG H 7.250 -7.598 9.320 1.00 . A A . 11 SER HG 1 1 9 5727 1 1 11 SER N N 5.299 -5.621 11.585 1.00 . A A . 11 SER N 1 1 9 5728 1 1 11 SER O O 3.770 -4.259 9.650 1.00 . A A . 11 SER O 1 1 9 5729 1 1 11 SER OG O 6.367 -7.842 9.029 1.00 . A A . 11 SER OG 1 1 9 5730 1 1 12 CYS C C 1.319 -6.121 8.049 1.00 . A A . 12 CYS C 1 1 9 5731 1 1 12 CYS CA C 2.637 -5.513 7.555 1.00 . A A . 12 CYS CA 1 1 9 5732 1 1 12 CYS CB C 2.917 -5.956 6.119 1.00 . A A . 12 CYS CB 1 1 9 5733 1 1 12 CYS H H 4.193 -6.894 8.125 1.00 . A A . 12 CYS H 1 1 9 5734 1 1 12 CYS HA H 2.602 -4.438 7.606 1.00 . A A . 12 CYS HA 1 1 9 5735 1 1 12 CYS HB2 H 2.125 -5.602 5.474 1.00 . A A . 12 CYS HB2 1 1 9 5736 1 1 12 CYS HB3 H 3.859 -5.546 5.791 1.00 . A A . 12 CYS HB3 1 1 9 5737 1 1 12 CYS N N 3.787 -6.032 8.353 1.00 . A A . 12 CYS N 1 1 9 5738 1 1 12 CYS O O 0.257 -5.821 7.536 1.00 . A A . 12 CYS O 1 1 9 5739 1 1 12 CYS SG S 2.986 -7.764 6.049 1.00 . A A . 12 CYS SG 1 1 9 5740 1 1 13 SER C C -0.889 -6.542 9.960 1.00 . A A . 13 SER C 1 1 9 5741 1 1 13 SER CA C 0.126 -7.610 9.542 1.00 . A A . 13 SER CA 1 1 9 5742 1 1 13 SER CB C 0.568 -8.424 10.757 1.00 . A A . 13 SER CB 1 1 9 5743 1 1 13 SER H H 2.243 -7.212 9.427 1.00 . A A . 13 SER H 1 1 9 5744 1 1 13 SER HA H -0.299 -8.263 8.797 1.00 . A A . 13 SER HA 1 1 9 5745 1 1 13 SER HB2 H -0.159 -8.321 11.545 1.00 . A A . 13 SER HB2 1 1 9 5746 1 1 13 SER HB3 H 0.651 -9.466 10.478 1.00 . A A . 13 SER HB3 1 1 9 5747 1 1 13 SER HG H 2.088 -8.468 11.971 1.00 . A A . 13 SER HG 1 1 9 5748 1 1 13 SER N N 1.377 -6.977 9.031 1.00 . A A . 13 SER N 1 1 9 5749 1 1 13 SER O O -1.981 -6.468 9.429 1.00 . A A . 13 SER O 1 1 9 5750 1 1 13 SER OG O 1.824 -7.940 11.214 1.00 . A A . 13 SER OG 1 1 9 5751 1 1 14 GLN C C -1.464 -3.474 10.387 1.00 . A A . 14 GLN C 1 1 9 5752 1 1 14 GLN CA C -1.492 -4.660 11.354 1.00 . A A . 14 GLN CA 1 1 9 5753 1 1 14 GLN CB C -1.002 -4.239 12.736 1.00 . A A . 14 GLN CB 1 1 9 5754 1 1 14 GLN CD C -2.591 -4.207 14.662 1.00 . A A . 14 GLN CD 1 1 9 5755 1 1 14 GLN CG C -2.096 -3.435 13.438 1.00 . A A . 14 GLN CG 1 1 9 5756 1 1 14 GLN H H 0.343 -5.789 11.323 1.00 . A A . 14 GLN H 1 1 9 5757 1 1 14 GLN HA H -2.490 -5.061 11.427 1.00 . A A . 14 GLN HA 1 1 9 5758 1 1 14 GLN HB2 H -0.769 -5.119 13.319 1.00 . A A . 14 GLN HB2 1 1 9 5759 1 1 14 GLN HB3 H -0.118 -3.630 12.635 1.00 . A A . 14 GLN HB3 1 1 9 5760 1 1 14 GLN HE21 H -3.414 -2.614 15.512 1.00 . A A . 14 GLN HE21 1 1 9 5761 1 1 14 GLN HE22 H -3.566 -4.061 16.384 1.00 . A A . 14 GLN HE22 1 1 9 5762 1 1 14 GLN HG2 H -1.699 -2.480 13.749 1.00 . A A . 14 GLN HG2 1 1 9 5763 1 1 14 GLN HG3 H -2.920 -3.278 12.758 1.00 . A A . 14 GLN HG3 1 1 9 5764 1 1 14 GLN N N -0.540 -5.715 10.905 1.00 . A A . 14 GLN N 1 1 9 5765 1 1 14 GLN NE2 N -3.245 -3.575 15.597 1.00 . A A . 14 GLN NE2 1 1 9 5766 1 1 14 GLN O O -2.428 -2.748 10.250 1.00 . A A . 14 GLN O 1 1 9 5767 1 1 14 GLN OE1 O -2.382 -5.399 14.768 1.00 . A A . 14 GLN OE1 1 1 9 5768 1 1 15 CYS C C -1.466 -2.141 7.799 1.00 . A A . 15 CYS C 1 1 9 5769 1 1 15 CYS CA C -0.272 -2.136 8.755 1.00 . A A . 15 CYS CA 1 1 9 5770 1 1 15 CYS CB C 1.024 -2.381 7.986 1.00 . A A . 15 CYS CB 1 1 9 5771 1 1 15 CYS H H 0.401 -3.873 9.840 1.00 . A A . 15 CYS H 1 1 9 5772 1 1 15 CYS HA H -0.214 -1.198 9.281 1.00 . A A . 15 CYS HA 1 1 9 5773 1 1 15 CYS HB2 H 1.090 -3.425 7.724 1.00 . A A . 15 CYS HB2 1 1 9 5774 1 1 15 CYS HB3 H 1.029 -1.785 7.086 1.00 . A A . 15 CYS HB3 1 1 9 5775 1 1 15 CYS N N -0.365 -3.273 9.714 1.00 . A A . 15 CYS N 1 1 9 5776 1 1 15 CYS O O -2.064 -1.117 7.535 1.00 . A A . 15 CYS O 1 1 9 5777 1 1 15 CYS SG S 2.439 -1.926 9.019 1.00 . A A . 15 CYS SG 1 1 9 5778 1 1 16 LEU C C -4.192 -3.964 6.991 1.00 . A A . 16 LEU C 1 1 9 5779 1 1 16 LEU CA C -2.964 -3.336 6.324 1.00 . A A . 16 LEU CA 1 1 9 5780 1 1 16 LEU CB C -2.474 -4.202 5.165 1.00 . A A . 16 LEU CB 1 1 9 5781 1 1 16 LEU CD1 C -0.134 -3.330 5.176 1.00 . A A . 16 LEU CD1 1 1 9 5782 1 1 16 LEU CD2 C -1.151 -4.136 3.043 1.00 . A A . 16 LEU CD2 1 1 9 5783 1 1 16 LEU CG C -1.427 -3.422 4.367 1.00 . A A . 16 LEU CG 1 1 9 5784 1 1 16 LEU H H -1.316 -4.098 7.488 1.00 . A A . 16 LEU H 1 1 9 5785 1 1 16 LEU HA H -3.200 -2.348 5.964 1.00 . A A . 16 LEU HA 1 1 9 5786 1 1 16 LEU HB2 H -2.032 -5.108 5.553 1.00 . A A . 16 LEU HB2 1 1 9 5787 1 1 16 LEU HB3 H -3.304 -4.451 4.522 1.00 . A A . 16 LEU HB3 1 1 9 5788 1 1 16 LEU HD11 H -0.034 -4.208 5.797 1.00 . A A . 16 LEU HD11 1 1 9 5789 1 1 16 LEU HD12 H -0.161 -2.450 5.800 1.00 . A A . 16 LEU HD12 1 1 9 5790 1 1 16 LEU HD13 H 0.708 -3.267 4.503 1.00 . A A . 16 LEU HD13 1 1 9 5791 1 1 16 LEU HD21 H -1.995 -4.006 2.381 1.00 . A A . 16 LEU HD21 1 1 9 5792 1 1 16 LEU HD22 H -0.996 -5.189 3.226 1.00 . A A . 16 LEU HD22 1 1 9 5793 1 1 16 LEU HD23 H -0.268 -3.715 2.585 1.00 . A A . 16 LEU HD23 1 1 9 5794 1 1 16 LEU HG H -1.798 -2.426 4.170 1.00 . A A . 16 LEU HG 1 1 9 5795 1 1 16 LEU N N -1.815 -3.282 7.270 1.00 . A A . 16 LEU N 1 1 9 5796 1 1 16 LEU O O -5.290 -3.887 6.477 1.00 . A A . 16 LEU O 1 1 9 5797 1 1 17 SER C C -6.007 -4.125 9.544 1.00 . A A . 17 SER C 1 1 9 5798 1 1 17 SER CA C -5.198 -5.199 8.812 1.00 . A A . 17 SER CA 1 1 9 5799 1 1 17 SER CB C -4.608 -6.200 9.802 1.00 . A A . 17 SER CB 1 1 9 5800 1 1 17 SER H H -3.131 -4.635 8.536 1.00 . A A . 17 SER H 1 1 9 5801 1 1 17 SER HA H -5.819 -5.713 8.095 1.00 . A A . 17 SER HA 1 1 9 5802 1 1 17 SER HB2 H -3.759 -5.764 10.296 1.00 . A A . 17 SER HB2 1 1 9 5803 1 1 17 SER HB3 H -5.358 -6.459 10.540 1.00 . A A . 17 SER HB3 1 1 9 5804 1 1 17 SER HG H -3.234 -7.397 9.119 1.00 . A A . 17 SER HG 1 1 9 5805 1 1 17 SER N N -4.024 -4.580 8.131 1.00 . A A . 17 SER N 1 1 9 5806 1 1 17 SER O O -7.127 -4.354 9.958 1.00 . A A . 17 SER O 1 1 9 5807 1 1 17 SER OG O -4.193 -7.365 9.102 1.00 . A A . 17 SER OG 1 1 9 5808 1 1 18 ALA C C -5.888 -0.516 9.763 1.00 . A A . 18 ALA C 1 1 9 5809 1 1 18 ALA CA C -6.199 -1.869 10.411 1.00 . A A . 18 ALA CA 1 1 9 5810 1 1 18 ALA CB C -5.683 -1.913 11.848 1.00 . A A . 18 ALA CB 1 1 9 5811 1 1 18 ALA H H -4.549 -2.783 9.369 1.00 . A A . 18 ALA H 1 1 9 5812 1 1 18 ALA HA H -7.259 -2.065 10.392 1.00 . A A . 18 ALA HA 1 1 9 5813 1 1 18 ALA HB1 H -6.128 -2.750 12.365 1.00 . A A . 18 ALA HB1 1 1 9 5814 1 1 18 ALA HB2 H -5.944 -0.996 12.355 1.00 . A A . 18 ALA HB2 1 1 9 5815 1 1 18 ALA HB3 H -4.608 -2.026 11.842 1.00 . A A . 18 ALA HB3 1 1 9 5816 1 1 18 ALA N N -5.454 -2.952 9.707 1.00 . A A . 18 ALA N 1 1 9 5817 1 1 18 ALA O O -5.377 0.380 10.405 1.00 . A A . 18 ALA O 1 1 9 5818 1 1 19 PRO C C -6.950 1.961 8.085 1.00 . A A . 19 PRO C 1 1 9 5819 1 1 19 PRO CA C -5.960 0.827 7.736 1.00 . A A . 19 PRO CA 1 1 9 5820 1 1 19 PRO CB C -6.111 0.396 6.280 1.00 . A A . 19 PRO CB 1 1 9 5821 1 1 19 PRO CD C -6.822 -1.463 7.666 1.00 . A A . 19 PRO CD 1 1 9 5822 1 1 19 PRO CG C -6.986 -0.818 6.310 1.00 . A A . 19 PRO CG 1 1 9 5823 1 1 19 PRO HA H -4.950 1.162 7.901 1.00 . A A . 19 PRO HA 1 1 9 5824 1 1 19 PRO HB2 H -6.579 1.183 5.705 1.00 . A A . 19 PRO HB2 1 1 9 5825 1 1 19 PRO HB3 H -5.149 0.145 5.861 1.00 . A A . 19 PRO HB3 1 1 9 5826 1 1 19 PRO HD2 H -7.784 -1.753 8.064 1.00 . A A . 19 PRO HD2 1 1 9 5827 1 1 19 PRO HD3 H -6.166 -2.317 7.599 1.00 . A A . 19 PRO HD3 1 1 9 5828 1 1 19 PRO HG2 H -8.016 -0.530 6.154 1.00 . A A . 19 PRO HG2 1 1 9 5829 1 1 19 PRO HG3 H -6.679 -1.509 5.542 1.00 . A A . 19 PRO HG3 1 1 9 5830 1 1 19 PRO N N -6.209 -0.420 8.498 1.00 . A A . 19 PRO N 1 1 9 5831 1 1 19 PRO O O -6.591 3.117 7.970 1.00 . A A . 19 PRO O 1 1 9 5832 1 1 20 PRO C C -8.741 3.379 10.141 1.00 . A A . 20 PRO C 1 1 9 5833 1 1 20 PRO CA C -9.131 2.709 8.822 1.00 . A A . 20 PRO CA 1 1 9 5834 1 1 20 PRO CB C -10.464 1.980 8.941 1.00 . A A . 20 PRO CB 1 1 9 5835 1 1 20 PRO CD C -8.744 0.299 8.687 1.00 . A A . 20 PRO CD 1 1 9 5836 1 1 20 PRO CG C -10.107 0.569 9.277 1.00 . A A . 20 PRO CG 1 1 9 5837 1 1 20 PRO HA H -9.177 3.437 8.027 1.00 . A A . 20 PRO HA 1 1 9 5838 1 1 20 PRO HB2 H -11.061 2.418 9.730 1.00 . A A . 20 PRO HB2 1 1 9 5839 1 1 20 PRO HB3 H -10.995 2.014 8.002 1.00 . A A . 20 PRO HB3 1 1 9 5840 1 1 20 PRO HD2 H -8.155 -0.282 9.379 1.00 . A A . 20 PRO HD2 1 1 9 5841 1 1 20 PRO HD3 H -8.838 -0.212 7.743 1.00 . A A . 20 PRO HD3 1 1 9 5842 1 1 20 PRO HG2 H -10.078 0.445 10.350 1.00 . A A . 20 PRO HG2 1 1 9 5843 1 1 20 PRO HG3 H -10.829 -0.106 8.846 1.00 . A A . 20 PRO HG3 1 1 9 5844 1 1 20 PRO N N -8.162 1.635 8.492 1.00 . A A . 20 PRO N 1 1 9 5845 1 1 20 PRO O O -9.219 4.445 10.474 1.00 . A A . 20 PRO O 1 1 9 5846 1 1 21 PHE C C -5.990 3.869 12.061 1.00 . A A . 21 PHE C 1 1 9 5847 1 1 21 PHE CA C -7.433 3.366 12.180 1.00 . A A . 21 PHE CA 1 1 9 5848 1 1 21 PHE CB C -7.516 2.229 13.201 1.00 . A A . 21 PHE CB 1 1 9 5849 1 1 21 PHE CD1 C -10.035 2.255 13.065 1.00 . A A . 21 PHE CD1 1 1 9 5850 1 1 21 PHE CD2 C -8.882 0.123 12.965 1.00 . A A . 21 PHE CD2 1 1 9 5851 1 1 21 PHE CE1 C -11.265 1.595 12.950 1.00 . A A . 21 PHE CE1 1 1 9 5852 1 1 21 PHE CE2 C -10.113 -0.535 12.850 1.00 . A A . 21 PHE CE2 1 1 9 5853 1 1 21 PHE CG C -8.843 1.519 13.071 1.00 . A A . 21 PHE CG 1 1 9 5854 1 1 21 PHE CZ C -11.304 0.201 12.843 1.00 . A A . 21 PHE CZ 1 1 9 5855 1 1 21 PHE H H -7.488 1.908 10.596 1.00 . A A . 21 PHE H 1 1 9 5856 1 1 21 PHE HA H -8.092 4.169 12.465 1.00 . A A . 21 PHE HA 1 1 9 5857 1 1 21 PHE HB2 H -6.714 1.527 13.023 1.00 . A A . 21 PHE HB2 1 1 9 5858 1 1 21 PHE HB3 H -7.423 2.635 14.198 1.00 . A A . 21 PHE HB3 1 1 9 5859 1 1 21 PHE HD1 H -10.004 3.331 13.147 1.00 . A A . 21 PHE HD1 1 1 9 5860 1 1 21 PHE HD2 H -7.962 -0.444 12.968 1.00 . A A . 21 PHE HD2 1 1 9 5861 1 1 21 PHE HE1 H -12.184 2.163 12.946 1.00 . A A . 21 PHE HE1 1 1 9 5862 1 1 21 PHE HE2 H -10.143 -1.613 12.767 1.00 . A A . 21 PHE HE2 1 1 9 5863 1 1 21 PHE HZ H -12.253 -0.308 12.755 1.00 . A A . 21 PHE HZ 1 1 9 5864 1 1 21 PHE N N -7.867 2.764 10.888 1.00 . A A . 21 PHE N 1 1 9 5865 1 1 21 PHE O O -5.301 4.044 13.047 1.00 . A A . 21 PHE O 1 1 9 5866 1 1 22 VAL C C -3.988 5.390 9.391 1.00 . A A . 22 VAL C 1 1 9 5867 1 1 22 VAL CA C -4.122 4.575 10.684 1.00 . A A . 22 VAL CA 1 1 9 5868 1 1 22 VAL CB C -3.287 3.300 10.601 1.00 . A A . 22 VAL CB 1 1 9 5869 1 1 22 VAL CG1 C -3.525 2.447 11.851 1.00 . A A . 22 VAL CG1 1 1 9 5870 1 1 22 VAL CG2 C -3.697 2.509 9.357 1.00 . A A . 22 VAL CG2 1 1 9 5871 1 1 22 VAL H H -6.091 3.942 10.076 1.00 . A A . 22 VAL H 1 1 9 5872 1 1 22 VAL HA H -3.814 5.162 11.535 1.00 . A A . 22 VAL HA 1 1 9 5873 1 1 22 VAL HB H -2.241 3.561 10.537 1.00 . A A . 22 VAL HB 1 1 9 5874 1 1 22 VAL HG11 H -4.532 2.057 11.832 1.00 . A A . 22 VAL HG11 1 1 9 5875 1 1 22 VAL HG12 H -3.391 3.055 12.733 1.00 . A A . 22 VAL HG12 1 1 9 5876 1 1 22 VAL HG13 H -2.822 1.627 11.868 1.00 . A A . 22 VAL HG13 1 1 9 5877 1 1 22 VAL HG21 H -3.424 1.473 9.482 1.00 . A A . 22 VAL HG21 1 1 9 5878 1 1 22 VAL HG22 H -3.191 2.913 8.492 1.00 . A A . 22 VAL HG22 1 1 9 5879 1 1 22 VAL HG23 H -4.765 2.587 9.218 1.00 . A A . 22 VAL HG23 1 1 9 5880 1 1 22 VAL N N -5.524 4.094 10.860 1.00 . A A . 22 VAL N 1 1 9 5881 1 1 22 VAL O O -4.941 5.578 8.662 1.00 . A A . 22 VAL O 1 1 9 5882 1 1 23 GLN C C -1.269 6.321 7.203 1.00 . A A . 23 GLN C 1 1 9 5883 1 1 23 GLN CA C -2.605 6.686 7.867 1.00 . A A . 23 GLN CA 1 1 9 5884 1 1 23 GLN CB C -2.604 8.144 8.358 1.00 . A A . 23 GLN CB 1 1 9 5885 1 1 23 GLN CD C -1.852 10.482 7.877 1.00 . A A . 23 GLN CD 1 1 9 5886 1 1 23 GLN CG C -1.719 9.017 7.458 1.00 . A A . 23 GLN CG 1 1 9 5887 1 1 23 GLN H H -2.053 5.716 9.712 1.00 . A A . 23 GLN H 1 1 9 5888 1 1 23 GLN HA H -3.422 6.531 7.179 1.00 . A A . 23 GLN HA 1 1 9 5889 1 1 23 GLN HB2 H -3.614 8.525 8.343 1.00 . A A . 23 GLN HB2 1 1 9 5890 1 1 23 GLN HB3 H -2.227 8.177 9.369 1.00 . A A . 23 GLN HB3 1 1 9 5891 1 1 23 GLN HE21 H -1.468 10.122 9.792 1.00 . A A . 23 GLN HE21 1 1 9 5892 1 1 23 GLN HE22 H -1.763 11.748 9.403 1.00 . A A . 23 GLN HE22 1 1 9 5893 1 1 23 GLN HG2 H -0.688 8.706 7.558 1.00 . A A . 23 GLN HG2 1 1 9 5894 1 1 23 GLN HG3 H -2.030 8.908 6.430 1.00 . A A . 23 GLN HG3 1 1 9 5895 1 1 23 GLN N N -2.807 5.878 9.106 1.00 . A A . 23 GLN N 1 1 9 5896 1 1 23 GLN NE2 N -1.681 10.812 9.128 1.00 . A A . 23 GLN NE2 1 1 9 5897 1 1 23 GLN O O -0.858 6.933 6.236 1.00 . A A . 23 GLN O 1 1 9 5898 1 1 23 GLN OE1 O -2.114 11.338 7.055 1.00 . A A . 23 GLN OE1 1 1 9 5899 1 1 24 CYS C C 0.542 3.732 6.183 1.00 . A A . 24 CYS C 1 1 9 5900 1 1 24 CYS CA C 0.724 4.946 7.107 1.00 . A A . 24 CYS CA 1 1 9 5901 1 1 24 CYS CB C 1.634 4.648 8.323 1.00 . A A . 24 CYS CB 1 1 9 5902 1 1 24 CYS H H -0.926 4.852 8.494 1.00 . A A . 24 CYS H 1 1 9 5903 1 1 24 CYS HA H 1.130 5.775 6.548 1.00 . A A . 24 CYS HA 1 1 9 5904 1 1 24 CYS HB2 H 2.459 5.346 8.326 1.00 . A A . 24 CYS HB2 1 1 9 5905 1 1 24 CYS HB3 H 1.063 4.784 9.229 1.00 . A A . 24 CYS HB3 1 1 9 5906 1 1 24 CYS N N -0.584 5.334 7.713 1.00 . A A . 24 CYS N 1 1 9 5907 1 1 24 CYS O O -0.517 3.139 6.120 1.00 . A A . 24 CYS O 1 1 9 5908 1 1 24 CYS SG S 2.303 2.953 8.284 1.00 . A A . 24 CYS SG 1 1 9 5909 1 1 25 GLY C C 2.836 1.502 4.474 1.00 . A A . 25 GLY C 1 1 9 5910 1 1 25 GLY CA C 1.472 2.190 4.548 1.00 . A A . 25 GLY CA 1 1 9 5911 1 1 25 GLY H H 2.416 3.856 5.537 1.00 . A A . 25 GLY H 1 1 9 5912 1 1 25 GLY HA2 H 0.735 1.495 4.927 1.00 . A A . 25 GLY HA2 1 1 9 5913 1 1 25 GLY HA3 H 1.186 2.524 3.564 1.00 . A A . 25 GLY HA3 1 1 9 5914 1 1 25 GLY N N 1.571 3.362 5.468 1.00 . A A . 25 GLY N 1 1 9 5915 1 1 25 GLY O O 3.780 1.916 5.112 1.00 . A A . 25 GLY O 1 1 9 5916 1 1 26 TRP C C 5.110 0.359 2.474 1.00 . A A . 26 TRP C 1 1 9 5917 1 1 26 TRP CA C 4.277 -0.232 3.614 1.00 . A A . 26 TRP CA 1 1 9 5918 1 1 26 TRP CB C 3.960 -1.699 3.330 1.00 . A A . 26 TRP CB 1 1 9 5919 1 1 26 TRP CD1 C 5.990 -2.862 2.370 1.00 . A A . 26 TRP CD1 1 1 9 5920 1 1 26 TRP CD2 C 5.897 -2.978 4.614 1.00 . A A . 26 TRP CD2 1 1 9 5921 1 1 26 TRP CE2 C 7.074 -3.655 4.222 1.00 . A A . 26 TRP CE2 1 1 9 5922 1 1 26 TRP CE3 C 5.597 -2.904 5.984 1.00 . A A . 26 TRP CE3 1 1 9 5923 1 1 26 TRP CG C 5.228 -2.484 3.421 1.00 . A A . 26 TRP CG 1 1 9 5924 1 1 26 TRP CH2 C 7.614 -4.154 6.520 1.00 . A A . 26 TRP CH2 1 1 9 5925 1 1 26 TRP CZ2 C 7.927 -4.237 5.159 1.00 . A A . 26 TRP CZ2 1 1 9 5926 1 1 26 TRP CZ3 C 6.451 -3.489 6.931 1.00 . A A . 26 TRP CZ3 1 1 9 5927 1 1 26 TRP H H 2.190 0.124 3.191 1.00 . A A . 26 TRP H 1 1 9 5928 1 1 26 TRP HA H 4.809 -0.148 4.549 1.00 . A A . 26 TRP HA 1 1 9 5929 1 1 26 TRP HB2 H 3.252 -2.065 4.058 1.00 . A A . 26 TRP HB2 1 1 9 5930 1 1 26 TRP HB3 H 3.544 -1.795 2.339 1.00 . A A . 26 TRP HB3 1 1 9 5931 1 1 26 TRP HD1 H 5.778 -2.654 1.331 1.00 . A A . 26 TRP HD1 1 1 9 5932 1 1 26 TRP HE1 H 7.799 -3.940 2.288 1.00 . A A . 26 TRP HE1 1 1 9 5933 1 1 26 TRP HE3 H 4.703 -2.393 6.309 1.00 . A A . 26 TRP HE3 1 1 9 5934 1 1 26 TRP HH2 H 8.268 -4.603 7.253 1.00 . A A . 26 TRP HH2 1 1 9 5935 1 1 26 TRP HZ2 H 8.826 -4.743 4.837 1.00 . A A . 26 TRP HZ2 1 1 9 5936 1 1 26 TRP HZ3 H 6.212 -3.427 7.982 1.00 . A A . 26 TRP HZ3 1 1 9 5937 1 1 26 TRP N N 2.958 0.455 3.706 1.00 . A A . 26 TRP N 1 1 9 5938 1 1 26 TRP NE1 N 7.088 -3.558 2.844 1.00 . A A . 26 TRP NE1 1 1 9 5939 1 1 26 TRP O O 4.586 0.761 1.450 1.00 . A A . 26 TRP O 1 1 9 5940 1 1 27 CYS C C 8.518 0.106 1.359 1.00 . A A . 27 CYS C 1 1 9 5941 1 1 27 CYS CA C 7.264 0.971 1.555 1.00 . A A . 27 CYS CA 1 1 9 5942 1 1 27 CYS CB C 7.643 2.368 2.047 1.00 . A A . 27 CYS CB 1 1 9 5943 1 1 27 CYS H H 6.812 0.080 3.465 1.00 . A A . 27 CYS H 1 1 9 5944 1 1 27 CYS HA H 6.709 1.043 0.634 1.00 . A A . 27 CYS HA 1 1 9 5945 1 1 27 CYS HB2 H 7.096 2.589 2.950 1.00 . A A . 27 CYS HB2 1 1 9 5946 1 1 27 CYS HB3 H 8.702 2.402 2.252 1.00 . A A . 27 CYS HB3 1 1 9 5947 1 1 27 CYS N N 6.407 0.411 2.637 1.00 . A A . 27 CYS N 1 1 9 5948 1 1 27 CYS O O 9.499 0.247 2.060 1.00 . A A . 27 CYS O 1 1 9 5949 1 1 27 CYS SG S 7.235 3.593 0.779 1.00 . A A . 27 CYS SG 1 1 9 5950 1 1 28 HIS C C 10.575 -1.909 1.246 1.00 . A A . 28 HIS C 1 1 9 5951 1 1 28 HIS CA C 9.638 -1.654 0.053 1.00 . A A . 28 HIS CA 1 1 9 5952 1 1 28 HIS CB C 10.395 -0.909 -1.045 1.00 . A A . 28 HIS CB 1 1 9 5953 1 1 28 HIS CD2 C 9.386 0.328 -3.129 1.00 . A A . 28 HIS CD2 1 1 9 5954 1 1 28 HIS CE1 C 7.903 -1.151 -3.687 1.00 . A A . 28 HIS CE1 1 1 9 5955 1 1 28 HIS CG C 9.489 -0.700 -2.226 1.00 . A A . 28 HIS CG 1 1 9 5956 1 1 28 HIS H H 7.669 -0.817 -0.170 1.00 . A A . 28 HIS H 1 1 9 5957 1 1 28 HIS HA H 9.281 -2.591 -0.340 1.00 . A A . 28 HIS HA 1 1 9 5958 1 1 28 HIS HB2 H 10.722 0.050 -0.668 1.00 . A A . 28 HIS HB2 1 1 9 5959 1 1 28 HIS HB3 H 11.253 -1.489 -1.347 1.00 . A A . 28 HIS HB3 1 1 9 5960 1 1 28 HIS HD1 H 8.347 -2.484 -2.152 1.00 . A A . 28 HIS HD1 1 1 9 5961 1 1 28 HIS HD2 H 9.989 1.224 -3.123 1.00 . A A . 28 HIS HD2 1 1 9 5962 1 1 28 HIS HE1 H 7.108 -1.667 -4.205 1.00 . A A . 28 HIS HE1 1 1 9 5963 1 1 28 HIS N N 8.478 -0.761 0.379 1.00 . A A . 28 HIS N 1 1 9 5964 1 1 28 HIS ND1 N 8.534 -1.632 -2.600 1.00 . A A . 28 HIS ND1 1 1 9 5965 1 1 28 HIS NE2 N 8.384 0.041 -4.051 1.00 . A A . 28 HIS NE2 1 1 9 5966 1 1 28 HIS O O 11.775 -1.998 1.071 1.00 . A A . 28 HIS O 1 1 9 5967 1 1 29 ASP C C 10.274 -2.206 4.941 1.00 . A A . 29 ASP C 1 1 9 5968 1 1 29 ASP CA C 10.993 -2.312 3.599 1.00 . A A . 29 ASP CA 1 1 9 5969 1 1 29 ASP CB C 12.070 -1.230 3.521 1.00 . A A . 29 ASP CB 1 1 9 5970 1 1 29 ASP CG C 13.452 -1.886 3.511 1.00 . A A . 29 ASP CG 1 1 9 5971 1 1 29 ASP H H 9.100 -1.988 2.586 1.00 . A A . 29 ASP H 1 1 9 5972 1 1 29 ASP HA H 11.448 -3.284 3.496 1.00 . A A . 29 ASP HA 1 1 9 5973 1 1 29 ASP HB2 H 11.935 -0.649 2.625 1.00 . A A . 29 ASP HB2 1 1 9 5974 1 1 29 ASP HB3 H 11.989 -0.584 4.382 1.00 . A A . 29 ASP HB3 1 1 9 5975 1 1 29 ASP N N 10.069 -2.047 2.446 1.00 . A A . 29 ASP N 1 1 9 5976 1 1 29 ASP O O 10.171 -3.165 5.678 1.00 . A A . 29 ASP O 1 1 9 5977 1 1 29 ASP OD1 O 13.529 -3.066 3.810 1.00 . A A . 29 ASP OD1 1 1 9 5978 1 1 29 ASP OD2 O 14.413 -1.195 3.209 1.00 . A A . 29 ASP OD2 1 1 9 5979 1 1 30 LYS C C 7.739 -0.283 6.432 1.00 . A A . 30 LYS C 1 1 9 5980 1 1 30 LYS CA C 9.138 -0.870 6.603 1.00 . A A . 30 LYS CA 1 1 9 5981 1 1 30 LYS CB C 10.033 0.101 7.371 1.00 . A A . 30 LYS CB 1 1 9 5982 1 1 30 LYS CD C 9.787 0.957 9.704 1.00 . A A . 30 LYS CD 1 1 9 5983 1 1 30 LYS CE C 9.029 0.550 10.970 1.00 . A A . 30 LYS CE 1 1 9 5984 1 1 30 LYS CG C 10.053 -0.282 8.849 1.00 . A A . 30 LYS CG 1 1 9 5985 1 1 30 LYS H H 9.931 -0.266 4.694 1.00 . A A . 30 LYS H 1 1 9 5986 1 1 30 LYS HA H 9.090 -1.813 7.124 1.00 . A A . 30 LYS HA 1 1 9 5987 1 1 30 LYS HB2 H 11.037 0.056 6.973 1.00 . A A . 30 LYS HB2 1 1 9 5988 1 1 30 LYS HB3 H 9.650 1.104 7.265 1.00 . A A . 30 LYS HB3 1 1 9 5989 1 1 30 LYS HD2 H 10.727 1.415 9.977 1.00 . A A . 30 LYS HD2 1 1 9 5990 1 1 30 LYS HD3 H 9.193 1.662 9.143 1.00 . A A . 30 LYS HD3 1 1 9 5991 1 1 30 LYS HE2 H 8.223 1.243 11.163 1.00 . A A . 30 LYS HE2 1 1 9 5992 1 1 30 LYS HE3 H 8.649 -0.455 10.875 1.00 . A A . 30 LYS HE3 1 1 9 5993 1 1 30 LYS HG2 H 9.290 -1.022 9.039 1.00 . A A . 30 LYS HG2 1 1 9 5994 1 1 30 LYS HG3 H 11.020 -0.689 9.102 1.00 . A A . 30 LYS HG3 1 1 9 5995 1 1 30 LYS HZ1 H 10.267 1.604 12.270 1.00 . A A . 30 LYS HZ1 1 1 9 5996 1 1 30 LYS HZ2 H 10.906 0.114 11.761 1.00 . A A . 30 LYS HZ2 1 1 9 5997 1 1 30 LYS HZ3 H 9.660 0.159 12.916 1.00 . A A . 30 LYS HZ3 1 1 9 5998 1 1 30 LYS N N 9.812 -1.038 5.286 1.00 . A A . 30 LYS N 1 1 9 5999 1 1 30 LYS NZ N 10.041 0.612 12.062 1.00 . A A . 30 LYS NZ 1 1 9 6000 1 1 30 LYS O O 7.309 0.024 5.337 1.00 . A A . 30 LYS O 1 1 9 6001 1 1 31 CYS C C 5.714 1.969 7.613 1.00 . A A . 31 CYS C 1 1 9 6002 1 1 31 CYS CA C 5.659 0.450 7.429 1.00 . A A . 31 CYS CA 1 1 9 6003 1 1 31 CYS CB C 4.892 -0.210 8.575 1.00 . A A . 31 CYS CB 1 1 9 6004 1 1 31 CYS H H 7.400 -0.375 8.384 1.00 . A A . 31 CYS H 1 1 9 6005 1 1 31 CYS HA H 5.201 0.200 6.485 1.00 . A A . 31 CYS HA 1 1 9 6006 1 1 31 CYS HB2 H 5.235 -1.226 8.698 1.00 . A A . 31 CYS HB2 1 1 9 6007 1 1 31 CYS HB3 H 5.062 0.342 9.488 1.00 . A A . 31 CYS HB3 1 1 9 6008 1 1 31 CYS N N 7.029 -0.122 7.513 1.00 . A A . 31 CYS N 1 1 9 6009 1 1 31 CYS O O 5.889 2.467 8.709 1.00 . A A . 31 CYS O 1 1 9 6010 1 1 31 CYS SG S 3.123 -0.214 8.194 1.00 . A A . 31 CYS SG 1 1 9 6011 1 1 32 VAL C C 4.763 4.824 5.548 1.00 . A A . 32 VAL C 1 1 9 6012 1 1 32 VAL CA C 5.620 4.193 6.650 1.00 . A A . 32 VAL CA 1 1 9 6013 1 1 32 VAL CB C 7.094 4.553 6.453 1.00 . A A . 32 VAL CB 1 1 9 6014 1 1 32 VAL CG1 C 7.966 3.656 7.333 1.00 . A A . 32 VAL CG1 1 1 9 6015 1 1 32 VAL CG2 C 7.472 4.345 4.985 1.00 . A A . 32 VAL CG2 1 1 9 6016 1 1 32 VAL H H 5.436 2.281 5.676 1.00 . A A . 32 VAL H 1 1 9 6017 1 1 32 VAL HA H 5.287 4.518 7.623 1.00 . A A . 32 VAL HA 1 1 9 6018 1 1 32 VAL HB H 7.250 5.587 6.724 1.00 . A A . 32 VAL HB 1 1 9 6019 1 1 32 VAL HG11 H 8.997 3.968 7.256 1.00 . A A . 32 VAL HG11 1 1 9 6020 1 1 32 VAL HG12 H 7.875 2.630 7.006 1.00 . A A . 32 VAL HG12 1 1 9 6021 1 1 32 VAL HG13 H 7.643 3.735 8.362 1.00 . A A . 32 VAL HG13 1 1 9 6022 1 1 32 VAL HG21 H 8.522 4.107 4.913 1.00 . A A . 32 VAL HG21 1 1 9 6023 1 1 32 VAL HG22 H 7.267 5.248 4.429 1.00 . A A . 32 VAL HG22 1 1 9 6024 1 1 32 VAL HG23 H 6.889 3.532 4.576 1.00 . A A . 32 VAL HG23 1 1 9 6025 1 1 32 VAL N N 5.571 2.706 6.548 1.00 . A A . 32 VAL N 1 1 9 6026 1 1 32 VAL O O 4.234 4.143 4.694 1.00 . A A . 32 VAL O 1 1 9 6027 1 1 33 ARG C C 4.679 7.682 3.630 1.00 . A A . 33 ARG C 1 1 9 6028 1 1 33 ARG CA C 3.800 6.783 4.504 1.00 . A A . 33 ARG CA 1 1 9 6029 1 1 33 ARG CB C 2.765 7.612 5.267 1.00 . A A . 33 ARG CB 1 1 9 6030 1 1 33 ARG CD C 0.701 8.925 4.753 1.00 . A A . 33 ARG CD 1 1 9 6031 1 1 33 ARG CG C 1.449 7.615 4.488 1.00 . A A . 33 ARG CG 1 1 9 6032 1 1 33 ARG CZ C -0.190 8.696 2.508 1.00 . A A . 33 ARG CZ 1 1 9 6033 1 1 33 ARG H H 5.057 6.657 6.252 1.00 . A A . 33 ARG H 1 1 9 6034 1 1 33 ARG HA H 3.301 6.042 3.898 1.00 . A A . 33 ARG HA 1 1 9 6035 1 1 33 ARG HB2 H 2.607 7.179 6.243 1.00 . A A . 33 ARG HB2 1 1 9 6036 1 1 33 ARG HB3 H 3.119 8.624 5.373 1.00 . A A . 33 ARG HB3 1 1 9 6037 1 1 33 ARG HD2 H -0.203 8.734 5.315 1.00 . A A . 33 ARG HD2 1 1 9 6038 1 1 33 ARG HD3 H 1.335 9.619 5.282 1.00 . A A . 33 ARG HD3 1 1 9 6039 1 1 33 ARG HE H 0.574 10.399 3.186 1.00 . A A . 33 ARG HE 1 1 9 6040 1 1 33 ARG HG2 H 1.656 7.524 3.432 1.00 . A A . 33 ARG HG2 1 1 9 6041 1 1 33 ARG HG3 H 0.839 6.784 4.809 1.00 . A A . 33 ARG HG3 1 1 9 6042 1 1 33 ARG HH11 H -2.004 8.782 3.351 1.00 . A A . 33 ARG HH11 1 1 9 6043 1 1 33 ARG HH12 H -1.890 7.821 1.914 1.00 . A A . 33 ARG HH12 1 1 9 6044 1 1 33 ARG HH21 H 1.493 8.429 1.459 1.00 . A A . 33 ARG HH21 1 1 9 6045 1 1 33 ARG HH22 H 0.091 7.620 0.843 1.00 . A A . 33 ARG HH22 1 1 9 6046 1 1 33 ARG N N 4.622 6.120 5.557 1.00 . A A . 33 ARG N 1 1 9 6047 1 1 33 ARG NE N 0.372 9.465 3.402 1.00 . A A . 33 ARG NE 1 1 9 6048 1 1 33 ARG NH1 N -1.461 8.411 2.598 1.00 . A A . 33 ARG NH1 1 1 9 6049 1 1 33 ARG NH2 N 0.520 8.212 1.527 1.00 . A A . 33 ARG NH2 1 1 9 6050 1 1 33 ARG O O 5.856 7.849 3.882 1.00 . A A . 33 ARG O 1 1 9 6051 1 1 34 SER C C 5.858 10.022 2.525 1.00 . A A . 34 SER C 1 1 9 6052 1 1 34 SER CA C 4.912 9.141 1.705 1.00 . A A . 34 SER CA 1 1 9 6053 1 1 34 SER CB C 3.877 10.000 0.979 1.00 . A A . 34 SER CB 1 1 9 6054 1 1 34 SER H H 3.164 8.102 2.419 1.00 . A A . 34 SER H 1 1 9 6055 1 1 34 SER HA H 5.466 8.553 0.991 1.00 . A A . 34 SER HA 1 1 9 6056 1 1 34 SER HB2 H 3.042 10.190 1.632 1.00 . A A . 34 SER HB2 1 1 9 6057 1 1 34 SER HB3 H 4.329 10.941 0.693 1.00 . A A . 34 SER HB3 1 1 9 6058 1 1 34 SER HG H 3.610 8.376 -0.066 1.00 . A A . 34 SER HG 1 1 9 6059 1 1 34 SER N N 4.114 8.256 2.602 1.00 . A A . 34 SER N 1 1 9 6060 1 1 34 SER O O 7.004 10.215 2.171 1.00 . A A . 34 SER O 1 1 9 6061 1 1 34 SER OG O 3.418 9.311 -0.178 1.00 . A A . 34 SER OG 1 1 9 6062 1 1 35 GLU C C 7.576 10.699 4.777 1.00 . A A . 35 GLU C 1 1 9 6063 1 1 35 GLU CA C 6.265 11.423 4.459 1.00 . A A . 35 GLU CA 1 1 9 6064 1 1 35 GLU CB C 5.466 11.677 5.737 1.00 . A A . 35 GLU CB 1 1 9 6065 1 1 35 GLU CD C 5.563 12.846 7.945 1.00 . A A . 35 GLU CD 1 1 9 6066 1 1 35 GLU CG C 6.099 12.834 6.512 1.00 . A A . 35 GLU CG 1 1 9 6067 1 1 35 GLU H H 4.462 10.389 3.889 1.00 . A A . 35 GLU H 1 1 9 6068 1 1 35 GLU HA H 6.463 12.358 3.957 1.00 . A A . 35 GLU HA 1 1 9 6069 1 1 35 GLU HB2 H 4.447 11.928 5.481 1.00 . A A . 35 GLU HB2 1 1 9 6070 1 1 35 GLU HB3 H 5.475 10.788 6.350 1.00 . A A . 35 GLU HB3 1 1 9 6071 1 1 35 GLU HG2 H 7.172 12.710 6.530 1.00 . A A . 35 GLU HG2 1 1 9 6072 1 1 35 GLU HG3 H 5.852 13.767 6.029 1.00 . A A . 35 GLU HG3 1 1 9 6073 1 1 35 GLU N N 5.389 10.557 3.619 1.00 . A A . 35 GLU N 1 1 9 6074 1 1 35 GLU O O 8.570 11.315 5.108 1.00 . A A . 35 GLU O 1 1 9 6075 1 1 35 GLU OE1 O 4.852 11.922 8.299 1.00 . A A . 35 GLU OE1 1 1 9 6076 1 1 35 GLU OE2 O 5.873 13.783 8.663 1.00 . A A . 35 GLU OE2 1 1 9 6077 1 1 36 GLU C C 9.416 8.041 3.691 1.00 . A A . 36 GLU C 1 1 9 6078 1 1 36 GLU CA C 8.839 8.641 4.976 1.00 . A A . 36 GLU CA 1 1 9 6079 1 1 36 GLU CB C 8.418 7.530 5.937 1.00 . A A . 36 GLU CB 1 1 9 6080 1 1 36 GLU CD C 9.885 7.790 7.944 1.00 . A A . 36 GLU CD 1 1 9 6081 1 1 36 GLU CG C 9.653 6.990 6.661 1.00 . A A . 36 GLU CG 1 1 9 6082 1 1 36 GLU H H 6.778 8.918 4.409 1.00 . A A . 36 GLU H 1 1 9 6083 1 1 36 GLU HA H 9.565 9.283 5.452 1.00 . A A . 36 GLU HA 1 1 9 6084 1 1 36 GLU HB2 H 7.717 7.923 6.659 1.00 . A A . 36 GLU HB2 1 1 9 6085 1 1 36 GLU HB3 H 7.953 6.731 5.380 1.00 . A A . 36 GLU HB3 1 1 9 6086 1 1 36 GLU HG2 H 9.497 5.949 6.907 1.00 . A A . 36 GLU HG2 1 1 9 6087 1 1 36 GLU HG3 H 10.516 7.083 6.020 1.00 . A A . 36 GLU HG3 1 1 9 6088 1 1 36 GLU N N 7.589 9.397 4.679 1.00 . A A . 36 GLU N 1 1 9 6089 1 1 36 GLU O O 10.614 7.910 3.539 1.00 . A A . 36 GLU O 1 1 9 6090 1 1 36 GLU OE1 O 8.917 8.055 8.638 1.00 . A A . 36 GLU OE1 1 1 9 6091 1 1 36 GLU OE2 O 11.027 8.124 8.212 1.00 . A A . 36 GLU OE2 1 1 9 6092 1 1 37 CYS C C 9.769 8.169 0.656 1.00 . A A . 37 CYS C 1 1 9 6093 1 1 37 CYS CA C 9.080 7.088 1.493 1.00 . A A . 37 CYS CA 1 1 9 6094 1 1 37 CYS CB C 7.838 6.560 0.776 1.00 . A A . 37 CYS CB 1 1 9 6095 1 1 37 CYS H H 7.610 7.790 2.905 1.00 . A A . 37 CYS H 1 1 9 6096 1 1 37 CYS HA H 9.761 6.277 1.697 1.00 . A A . 37 CYS HA 1 1 9 6097 1 1 37 CYS HB2 H 7.155 7.376 0.590 1.00 . A A . 37 CYS HB2 1 1 9 6098 1 1 37 CYS HB3 H 8.128 6.113 -0.163 1.00 . A A . 37 CYS HB3 1 1 9 6099 1 1 37 CYS N N 8.574 7.677 2.765 1.00 . A A . 37 CYS N 1 1 9 6100 1 1 37 CYS O O 9.132 8.914 -0.060 1.00 . A A . 37 CYS O 1 1 9 6101 1 1 37 CYS SG S 7.026 5.317 1.811 1.00 . A A . 37 CYS SG 1 1 9 6102 1 1 38 LEU C C 11.694 9.015 -1.533 1.00 . A A . 38 LEU C 1 1 9 6103 1 1 38 LEU CA C 11.800 9.302 -0.033 1.00 . A A . 38 LEU CA 1 1 9 6104 1 1 38 LEU CB C 13.251 9.190 0.435 1.00 . A A . 38 LEU CB 1 1 9 6105 1 1 38 LEU CD1 C 14.160 10.509 -1.485 1.00 . A A . 38 LEU CD1 1 1 9 6106 1 1 38 LEU CD2 C 13.255 11.685 0.526 1.00 . A A . 38 LEU CD2 1 1 9 6107 1 1 38 LEU CG C 14.018 10.452 0.037 1.00 . A A . 38 LEU CG 1 1 9 6108 1 1 38 LEU H H 11.561 7.656 1.338 1.00 . A A . 38 LEU H 1 1 9 6109 1 1 38 LEU HA H 11.413 10.283 0.192 1.00 . A A . 38 LEU HA 1 1 9 6110 1 1 38 LEU HB2 H 13.273 9.080 1.509 1.00 . A A . 38 LEU HB2 1 1 9 6111 1 1 38 LEU HB3 H 13.712 8.330 -0.025 1.00 . A A . 38 LEU HB3 1 1 9 6112 1 1 38 LEU HD11 H 13.989 9.525 -1.899 1.00 . A A . 38 LEU HD11 1 1 9 6113 1 1 38 LEU HD12 H 15.156 10.838 -1.741 1.00 . A A . 38 LEU HD12 1 1 9 6114 1 1 38 LEU HD13 H 13.436 11.200 -1.889 1.00 . A A . 38 LEU HD13 1 1 9 6115 1 1 38 LEU HD21 H 12.522 11.387 1.261 1.00 . A A . 38 LEU HD21 1 1 9 6116 1 1 38 LEU HD22 H 12.756 12.156 -0.309 1.00 . A A . 38 LEU HD22 1 1 9 6117 1 1 38 LEU HD23 H 13.948 12.383 0.971 1.00 . A A . 38 LEU HD23 1 1 9 6118 1 1 38 LEU HG H 14.999 10.432 0.488 1.00 . A A . 38 LEU HG 1 1 9 6119 1 1 38 LEU N N 11.067 8.264 0.749 1.00 . A A . 38 LEU N 1 1 9 6120 1 1 38 LEU O O 11.826 9.901 -2.354 1.00 . A A . 38 LEU O 1 1 9 6121 1 1 39 SER C C 10.005 7.941 -3.906 1.00 . A A . 39 SER C 1 1 9 6122 1 1 39 SER CA C 11.344 7.451 -3.346 1.00 . A A . 39 SER CA 1 1 9 6123 1 1 39 SER CB C 11.427 5.926 -3.407 1.00 . A A . 39 SER CB 1 1 9 6124 1 1 39 SER H H 11.352 7.086 -1.221 1.00 . A A . 39 SER H 1 1 9 6125 1 1 39 SER HA H 12.164 7.885 -3.896 1.00 . A A . 39 SER HA 1 1 9 6126 1 1 39 SER HB2 H 11.866 5.550 -2.499 1.00 . A A . 39 SER HB2 1 1 9 6127 1 1 39 SER HB3 H 10.432 5.517 -3.520 1.00 . A A . 39 SER HB3 1 1 9 6128 1 1 39 SER HG H 11.751 4.903 -5.032 1.00 . A A . 39 SER HG 1 1 9 6129 1 1 39 SER N N 11.456 7.787 -1.898 1.00 . A A . 39 SER N 1 1 9 6130 1 1 39 SER O O 9.693 7.734 -5.062 1.00 . A A . 39 SER O 1 1 9 6131 1 1 39 SER OG O 12.240 5.545 -4.510 1.00 . A A . 39 SER OG 1 1 9 6132 1 1 40 GLY C C 6.982 7.902 -3.893 1.00 . A A . 40 GLY C 1 1 9 6133 1 1 40 GLY CA C 7.896 9.091 -3.592 1.00 . A A . 40 GLY CA 1 1 9 6134 1 1 40 GLY H H 9.475 8.750 -2.170 1.00 . A A . 40 GLY H 1 1 9 6135 1 1 40 GLY HA2 H 7.442 9.716 -2.838 1.00 . A A . 40 GLY HA2 1 1 9 6136 1 1 40 GLY HA3 H 8.045 9.664 -4.494 1.00 . A A . 40 GLY HA3 1 1 9 6137 1 1 40 GLY N N 9.209 8.591 -3.099 1.00 . A A . 40 GLY N 1 1 9 6138 1 1 40 GLY O O 5.936 8.048 -4.495 1.00 . A A . 40 GLY O 1 1 9 6139 1 1 41 THR C C 5.895 5.029 -2.442 1.00 . A A . 41 THR C 1 1 9 6140 1 1 41 THR CA C 6.526 5.528 -3.745 1.00 . A A . 41 THR CA 1 1 9 6141 1 1 41 THR CB C 7.490 4.486 -4.312 1.00 . A A . 41 THR CB 1 1 9 6142 1 1 41 THR CG2 C 8.262 5.092 -5.486 1.00 . A A . 41 THR CG2 1 1 9 6143 1 1 41 THR H H 8.218 6.632 -2.998 1.00 . A A . 41 THR H 1 1 9 6144 1 1 41 THR HA H 5.762 5.757 -4.470 1.00 . A A . 41 THR HA 1 1 9 6145 1 1 41 THR HB H 6.933 3.629 -4.656 1.00 . A A . 41 THR HB 1 1 9 6146 1 1 41 THR HG1 H 8.943 3.375 -3.650 1.00 . A A . 41 THR HG1 1 1 9 6147 1 1 41 THR HG21 H 9.207 5.480 -5.135 1.00 . A A . 41 THR HG21 1 1 9 6148 1 1 41 THR HG22 H 7.683 5.892 -5.923 1.00 . A A . 41 THR HG22 1 1 9 6149 1 1 41 THR HG23 H 8.441 4.330 -6.230 1.00 . A A . 41 THR HG23 1 1 9 6150 1 1 41 THR N N 7.370 6.727 -3.480 1.00 . A A . 41 THR N 1 1 9 6151 1 1 41 THR O O 6.487 5.108 -1.384 1.00 . A A . 41 THR O 1 1 9 6152 1 1 41 THR OG1 O 8.402 4.087 -3.298 1.00 . A A . 41 THR OG1 1 1 9 6153 1 1 42 TRP C C 3.074 2.872 -1.636 1.00 . A A . 42 TRP C 1 1 9 6154 1 1 42 TRP CA C 4.025 4.018 -1.280 1.00 . A A . 42 TRP CA 1 1 9 6155 1 1 42 TRP CB C 3.246 5.222 -0.750 1.00 . A A . 42 TRP CB 1 1 9 6156 1 1 42 TRP CD1 C 3.192 4.653 1.710 1.00 . A A . 42 TRP CD1 1 1 9 6157 1 1 42 TRP CD2 C 1.142 4.679 0.781 1.00 . A A . 42 TRP CD2 1 1 9 6158 1 1 42 TRP CE2 C 0.964 4.358 2.147 1.00 . A A . 42 TRP CE2 1 1 9 6159 1 1 42 TRP CE3 C 0.000 4.758 -0.036 1.00 . A A . 42 TRP CE3 1 1 9 6160 1 1 42 TRP CG C 2.565 4.864 0.530 1.00 . A A . 42 TRP CG 1 1 9 6161 1 1 42 TRP CH2 C -1.428 4.208 1.859 1.00 . A A . 42 TRP CH2 1 1 9 6162 1 1 42 TRP CZ2 C -0.303 4.124 2.685 1.00 . A A . 42 TRP CZ2 1 1 9 6163 1 1 42 TRP CZ3 C -1.276 4.523 0.501 1.00 . A A . 42 TRP CZ3 1 1 9 6164 1 1 42 TRP H H 4.238 4.467 -3.377 1.00 . A A . 42 TRP H 1 1 9 6165 1 1 42 TRP HA H 4.753 3.697 -0.554 1.00 . A A . 42 TRP HA 1 1 9 6166 1 1 42 TRP HB2 H 3.928 6.040 -0.574 1.00 . A A . 42 TRP HB2 1 1 9 6167 1 1 42 TRP HB3 H 2.507 5.521 -1.478 1.00 . A A . 42 TRP HB3 1 1 9 6168 1 1 42 TRP HD1 H 4.258 4.709 1.875 1.00 . A A . 42 TRP HD1 1 1 9 6169 1 1 42 TRP HE1 H 2.436 4.163 3.614 1.00 . A A . 42 TRP HE1 1 1 9 6170 1 1 42 TRP HE3 H 0.105 5.000 -1.084 1.00 . A A . 42 TRP HE3 1 1 9 6171 1 1 42 TRP HH2 H -2.412 4.029 2.267 1.00 . A A . 42 TRP HH2 1 1 9 6172 1 1 42 TRP HZ2 H -0.414 3.882 3.731 1.00 . A A . 42 TRP HZ2 1 1 9 6173 1 1 42 TRP HZ3 H -2.146 4.587 -0.136 1.00 . A A . 42 TRP HZ3 1 1 9 6174 1 1 42 TRP N N 4.697 4.519 -2.513 1.00 . A A . 42 TRP N 1 1 9 6175 1 1 42 TRP NE1 N 2.243 4.355 2.672 1.00 . A A . 42 TRP NE1 1 1 9 6176 1 1 42 TRP O O 2.356 2.932 -2.614 1.00 . A A . 42 TRP O 1 1 9 6177 1 1 43 THR C C 1.418 0.225 0.098 1.00 . A A . 43 THR C 1 1 9 6178 1 1 43 THR CA C 2.156 0.681 -1.164 1.00 . A A . 43 THR CA 1 1 9 6179 1 1 43 THR CB C 3.078 -0.428 -1.677 1.00 . A A . 43 THR CB 1 1 9 6180 1 1 43 THR CG2 C 4.293 -0.553 -0.757 1.00 . A A . 43 THR CG2 1 1 9 6181 1 1 43 THR H H 3.651 1.789 -0.069 1.00 . A A . 43 THR H 1 1 9 6182 1 1 43 THR HA H 1.451 0.957 -1.932 1.00 . A A . 43 THR HA 1 1 9 6183 1 1 43 THR HB H 3.411 -0.187 -2.675 1.00 . A A . 43 THR HB 1 1 9 6184 1 1 43 THR HG1 H 1.535 -1.514 -2.153 1.00 . A A . 43 THR HG1 1 1 9 6185 1 1 43 THR HG21 H 4.775 0.409 -0.667 1.00 . A A . 43 THR HG21 1 1 9 6186 1 1 43 THR HG22 H 4.988 -1.267 -1.174 1.00 . A A . 43 THR HG22 1 1 9 6187 1 1 43 THR HG23 H 3.973 -0.888 0.219 1.00 . A A . 43 THR HG23 1 1 9 6188 1 1 43 THR N N 3.063 1.824 -0.854 1.00 . A A . 43 THR N 1 1 9 6189 1 1 43 THR O O 1.854 0.463 1.205 1.00 . A A . 43 THR O 1 1 9 6190 1 1 43 THR OG1 O 2.368 -1.659 -1.698 1.00 . A A . 43 THR OG1 1 1 9 6191 1 1 44 GLN C C -1.124 -2.257 0.808 1.00 . A A . 44 GLN C 1 1 9 6192 1 1 44 GLN CA C -0.468 -0.909 1.122 1.00 . A A . 44 GLN CA 1 1 9 6193 1 1 44 GLN CB C -1.531 0.164 1.369 1.00 . A A . 44 GLN CB 1 1 9 6194 1 1 44 GLN CD C -3.784 -0.380 0.435 1.00 . A A . 44 GLN CD 1 1 9 6195 1 1 44 GLN CG C -2.436 0.280 0.141 1.00 . A A . 44 GLN CG 1 1 9 6196 1 1 44 GLN H H -0.032 -0.614 -0.968 1.00 . A A . 44 GLN H 1 1 9 6197 1 1 44 GLN HA H 0.178 -0.994 1.981 1.00 . A A . 44 GLN HA 1 1 9 6198 1 1 44 GLN HB2 H -2.125 -0.111 2.230 1.00 . A A . 44 GLN HB2 1 1 9 6199 1 1 44 GLN HB3 H -1.051 1.112 1.551 1.00 . A A . 44 GLN HB3 1 1 9 6200 1 1 44 GLN HE21 H -4.189 0.804 1.977 1.00 . A A . 44 GLN HE21 1 1 9 6201 1 1 44 GLN HE22 H -5.373 -0.360 1.624 1.00 . A A . 44 GLN HE22 1 1 9 6202 1 1 44 GLN HG2 H -2.589 1.323 -0.095 1.00 . A A . 44 GLN HG2 1 1 9 6203 1 1 44 GLN HG3 H -1.969 -0.215 -0.698 1.00 . A A . 44 GLN HG3 1 1 9 6204 1 1 44 GLN N N 0.301 -0.431 -0.065 1.00 . A A . 44 GLN N 1 1 9 6205 1 1 44 GLN NE2 N -4.509 0.058 1.428 1.00 . A A . 44 GLN NE2 1 1 9 6206 1 1 44 GLN O O -2.311 -2.440 0.995 1.00 . A A . 44 GLN O 1 1 9 6207 1 1 44 GLN OE1 O -4.181 -1.305 -0.246 1.00 . A A . 44 GLN OE1 1 1 9 6208 1 1 45 GLN C C 0.184 -5.586 -0.033 1.00 . A A . 45 GLN C 1 1 9 6209 1 1 45 GLN CA C -0.931 -4.536 0.001 1.00 . A A . 45 GLN CA 1 1 9 6210 1 1 45 GLN CB C -1.556 -4.368 -1.384 1.00 . A A . 45 GLN CB 1 1 9 6211 1 1 45 GLN CD C -1.008 -3.115 -3.475 1.00 . A A . 45 GLN CD 1 1 9 6212 1 1 45 GLN CG C -0.460 -4.059 -2.405 1.00 . A A . 45 GLN CG 1 1 9 6213 1 1 45 GLN H H 0.596 -3.027 0.187 1.00 . A A . 45 GLN H 1 1 9 6214 1 1 45 GLN HA H -1.687 -4.811 0.717 1.00 . A A . 45 GLN HA 1 1 9 6215 1 1 45 GLN HB2 H -2.064 -5.280 -1.663 1.00 . A A . 45 GLN HB2 1 1 9 6216 1 1 45 GLN HB3 H -2.264 -3.553 -1.362 1.00 . A A . 45 GLN HB3 1 1 9 6217 1 1 45 GLN HE21 H -1.282 -4.560 -4.809 1.00 . A A . 45 GLN HE21 1 1 9 6218 1 1 45 GLN HE22 H -1.716 -3.001 -5.326 1.00 . A A . 45 GLN HE22 1 1 9 6219 1 1 45 GLN HG2 H 0.376 -3.591 -1.906 1.00 . A A . 45 GLN HG2 1 1 9 6220 1 1 45 GLN HG3 H -0.132 -4.976 -2.872 1.00 . A A . 45 GLN HG3 1 1 9 6221 1 1 45 GLN N N -0.358 -3.199 0.331 1.00 . A A . 45 GLN N 1 1 9 6222 1 1 45 GLN NE2 N -1.366 -3.598 -4.633 1.00 . A A . 45 GLN NE2 1 1 9 6223 1 1 45 GLN O O 0.986 -5.625 -0.945 1.00 . A A . 45 GLN O 1 1 9 6224 1 1 45 GLN OE1 O -1.112 -1.924 -3.256 1.00 . A A . 45 GLN OE1 1 1 9 6225 1 1 46 ILE C C 0.832 -8.726 1.716 1.00 . A A . 46 ILE C 1 1 9 6226 1 1 46 ILE CA C 1.317 -7.472 0.983 1.00 . A A . 46 ILE CA 1 1 9 6227 1 1 46 ILE CB C 2.471 -6.819 1.741 1.00 . A A . 46 ILE CB 1 1 9 6228 1 1 46 ILE CD1 C 4.043 -4.879 1.729 1.00 . A A . 46 ILE CD1 1 1 9 6229 1 1 46 ILE CG1 C 2.745 -5.437 1.146 1.00 . A A . 46 ILE CG1 1 1 9 6230 1 1 46 ILE CG2 C 3.728 -7.684 1.615 1.00 . A A . 46 ILE CG2 1 1 9 6231 1 1 46 ILE H H -0.405 -6.382 1.689 1.00 . A A . 46 ILE H 1 1 9 6232 1 1 46 ILE HA H 1.627 -7.716 -0.021 1.00 . A A . 46 ILE HA 1 1 9 6233 1 1 46 ILE HB H 2.208 -6.718 2.783 1.00 . A A . 46 ILE HB 1 1 9 6234 1 1 46 ILE HD11 H 3.855 -3.909 2.164 1.00 . A A . 46 ILE HD11 1 1 9 6235 1 1 46 ILE HD12 H 4.779 -4.785 0.944 1.00 . A A . 46 ILE HD12 1 1 9 6236 1 1 46 ILE HD13 H 4.413 -5.550 2.490 1.00 . A A . 46 ILE HD13 1 1 9 6237 1 1 46 ILE HG12 H 2.835 -5.520 0.072 1.00 . A A . 46 ILE HG12 1 1 9 6238 1 1 46 ILE HG13 H 1.928 -4.773 1.389 1.00 . A A . 46 ILE HG13 1 1 9 6239 1 1 46 ILE HG21 H 3.485 -8.597 1.093 1.00 . A A . 46 ILE HG21 1 1 9 6240 1 1 46 ILE HG22 H 4.102 -7.920 2.599 1.00 . A A . 46 ILE HG22 1 1 9 6241 1 1 46 ILE HG23 H 4.483 -7.145 1.061 1.00 . A A . 46 ILE HG23 1 1 9 6242 1 1 46 ILE N N 0.247 -6.433 0.958 1.00 . A A . 46 ILE N 1 1 9 6243 1 1 46 ILE O O 0.614 -9.761 1.118 1.00 . A A . 46 ILE O 1 1 9 6244 1 1 47 CYS C C -1.256 -9.660 4.205 1.00 . A A . 47 CYS C 1 1 9 6245 1 1 47 CYS CA C 0.204 -9.833 3.778 1.00 . A A . 47 CYS CA 1 1 9 6246 1 1 47 CYS CB C 1.120 -9.900 5.003 1.00 . A A . 47 CYS CB 1 1 9 6247 1 1 47 CYS H H 0.854 -7.800 3.472 1.00 . A A . 47 CYS H 1 1 9 6248 1 1 47 CYS HA H 0.317 -10.728 3.187 1.00 . A A . 47 CYS HA 1 1 9 6249 1 1 47 CYS HB2 H 0.796 -10.702 5.649 1.00 . A A . 47 CYS HB2 1 1 9 6250 1 1 47 CYS HB3 H 2.135 -10.086 4.683 1.00 . A A . 47 CYS HB3 1 1 9 6251 1 1 47 CYS N N 0.668 -8.642 3.008 1.00 . A A . 47 CYS N 1 1 9 6252 1 1 47 CYS O O -1.680 -8.587 4.585 1.00 . A A . 47 CYS O 1 1 9 6253 1 1 47 CYS SG S 1.052 -8.332 5.906 1.00 . A A . 47 CYS SG 1 1 9 6254 1 1 48 LEU C C -3.565 -10.566 6.080 1.00 . A A . 48 LEU C 1 1 9 6255 1 1 48 LEU CA C -3.456 -10.620 4.553 1.00 . A A . 48 LEU CA 1 1 9 6256 1 1 48 LEU CB C -4.115 -11.897 4.014 1.00 . A A . 48 LEU CB 1 1 9 6257 1 1 48 LEU CD1 C -4.129 -10.528 1.891 1.00 . A A . 48 LEU CD1 1 1 9 6258 1 1 48 LEU CD2 C -2.749 -12.607 2.034 1.00 . A A . 48 LEU CD2 1 1 9 6259 1 1 48 LEU CG C -4.055 -11.943 2.477 1.00 . A A . 48 LEU CG 1 1 9 6260 1 1 48 LEU H H -1.658 -11.567 3.842 1.00 . A A . 48 LEU H 1 1 9 6261 1 1 48 LEU HA H -3.917 -9.751 4.110 1.00 . A A . 48 LEU HA 1 1 9 6262 1 1 48 LEU HB2 H -3.601 -12.757 4.415 1.00 . A A . 48 LEU HB2 1 1 9 6263 1 1 48 LEU HB3 H -5.148 -11.923 4.329 1.00 . A A . 48 LEU HB3 1 1 9 6264 1 1 48 LEU HD11 H -4.868 -9.954 2.430 1.00 . A A . 48 LEU HD11 1 1 9 6265 1 1 48 LEU HD12 H -4.407 -10.584 0.849 1.00 . A A . 48 LEU HD12 1 1 9 6266 1 1 48 LEU HD13 H -3.166 -10.051 1.981 1.00 . A A . 48 LEU HD13 1 1 9 6267 1 1 48 LEU HD21 H -2.108 -11.871 1.572 1.00 . A A . 48 LEU HD21 1 1 9 6268 1 1 48 LEU HD22 H -2.967 -13.390 1.322 1.00 . A A . 48 LEU HD22 1 1 9 6269 1 1 48 LEU HD23 H -2.249 -13.033 2.891 1.00 . A A . 48 LEU HD23 1 1 9 6270 1 1 48 LEU HG H -4.891 -12.521 2.109 1.00 . A A . 48 LEU HG 1 1 9 6271 1 1 48 LEU N N -2.025 -10.714 4.148 1.00 . A A . 48 LEU N 1 1 9 6272 1 1 48 LEU O O -4.675 -10.442 6.570 1.00 . A A . 48 LEU O 1 1 9 6273 1 1 48 LEU OXT O -2.538 -10.651 6.731 1.00 . A A . 48 LEU OXT 1 1 10 6274 1 1 1 GLY C C -7.745 -4.415 17.603 1.00 . A A . 1 GLY C 1 1 10 6275 1 1 1 GLY CA C -7.970 -5.864 17.168 1.00 . A A . 1 GLY CA 1 1 10 6276 1 1 1 GLY H1 H -8.794 -5.926 15.257 1.00 . A A . 1 GLY H1 1 1 10 6277 1 1 1 GLY H2 H -7.388 -6.863 15.437 1.00 . A A . 1 GLY H2 1 1 10 6278 1 1 1 GLY H3 H -7.278 -5.171 15.331 1.00 . A A . 1 GLY H3 1 1 10 6279 1 1 1 GLY HA2 H -8.959 -6.182 17.470 1.00 . A A . 1 GLY HA2 1 1 10 6280 1 1 1 GLY HA3 H -7.230 -6.495 17.634 1.00 . A A . 1 GLY HA3 1 1 10 6281 1 1 1 GLY N N -7.848 -5.964 15.686 1.00 . A A . 1 GLY N 1 1 10 6282 1 1 1 GLY O O -8.563 -3.550 17.362 1.00 . A A . 1 GLY O 1 1 10 6283 1 1 2 SER C C -5.338 -2.089 17.770 1.00 . A A . 2 SER C 1 1 10 6284 1 1 2 SER CA C -6.363 -2.750 18.693 1.00 . A A . 2 SER CA 1 1 10 6285 1 1 2 SER CB C -5.800 -2.894 20.106 1.00 . A A . 2 SER CB 1 1 10 6286 1 1 2 SER H H -5.993 -4.855 18.428 1.00 . A A . 2 SER H 1 1 10 6287 1 1 2 SER HA H -7.275 -2.173 18.717 1.00 . A A . 2 SER HA 1 1 10 6288 1 1 2 SER HB2 H -5.382 -3.879 20.230 1.00 . A A . 2 SER HB2 1 1 10 6289 1 1 2 SER HB3 H -5.027 -2.154 20.261 1.00 . A A . 2 SER HB3 1 1 10 6290 1 1 2 SER HG H -6.458 -2.413 21.873 1.00 . A A . 2 SER HG 1 1 10 6291 1 1 2 SER N N -6.641 -4.143 18.243 1.00 . A A . 2 SER N 1 1 10 6292 1 1 2 SER O O -4.573 -2.753 17.098 1.00 . A A . 2 SER O 1 1 10 6293 1 1 2 SER OG O -6.849 -2.709 21.048 1.00 . A A . 2 SER OG 1 1 10 6294 1 1 3 ALA C C -4.054 1.319 17.398 1.00 . A A . 3 ALA C 1 1 10 6295 1 1 3 ALA CA C -4.342 -0.081 16.851 1.00 . A A . 3 ALA CA 1 1 10 6296 1 1 3 ALA CB C -5.034 0.010 15.490 1.00 . A A . 3 ALA CB 1 1 10 6297 1 1 3 ALA H H -5.944 -0.269 18.280 1.00 . A A . 3 ALA H 1 1 10 6298 1 1 3 ALA HA H -3.430 -0.649 16.764 1.00 . A A . 3 ALA HA 1 1 10 6299 1 1 3 ALA HB1 H -5.059 -0.967 15.033 1.00 . A A . 3 ALA HB1 1 1 10 6300 1 1 3 ALA HB2 H -4.489 0.692 14.854 1.00 . A A . 3 ALA HB2 1 1 10 6301 1 1 3 ALA HB3 H -6.044 0.371 15.623 1.00 . A A . 3 ALA HB3 1 1 10 6302 1 1 3 ALA N N -5.317 -0.786 17.730 1.00 . A A . 3 ALA N 1 1 10 6303 1 1 3 ALA O O -4.943 2.012 17.854 1.00 . A A . 3 ALA O 1 1 10 6304 1 1 4 MET C C -1.556 3.825 16.903 1.00 . A A . 4 MET C 1 1 10 6305 1 1 4 MET CA C -2.486 3.099 17.878 1.00 . A A . 4 MET CA 1 1 10 6306 1 1 4 MET CB C -1.782 2.852 19.213 1.00 . A A . 4 MET CB 1 1 10 6307 1 1 4 MET CE C -1.559 -0.237 19.754 1.00 . A A . 4 MET CE 1 1 10 6308 1 1 4 MET CG C -0.463 2.119 18.970 1.00 . A A . 4 MET CG 1 1 10 6309 1 1 4 MET H H -2.117 1.170 16.987 1.00 . A A . 4 MET H 1 1 10 6310 1 1 4 MET HA H -3.385 3.672 18.038 1.00 . A A . 4 MET HA 1 1 10 6311 1 1 4 MET HB2 H -1.585 3.799 19.696 1.00 . A A . 4 MET HB2 1 1 10 6312 1 1 4 MET HB3 H -2.415 2.249 19.847 1.00 . A A . 4 MET HB3 1 1 10 6313 1 1 4 MET HE1 H -2.025 -0.661 20.633 1.00 . A A . 4 MET HE1 1 1 10 6314 1 1 4 MET HE2 H -1.160 -1.030 19.144 1.00 . A A . 4 MET HE2 1 1 10 6315 1 1 4 MET HE3 H -2.291 0.320 19.185 1.00 . A A . 4 MET HE3 1 1 10 6316 1 1 4 MET HG2 H -0.491 1.637 18.004 1.00 . A A . 4 MET HG2 1 1 10 6317 1 1 4 MET HG3 H 0.353 2.826 18.996 1.00 . A A . 4 MET HG3 1 1 10 6318 1 1 4 MET N N -2.821 1.742 17.359 1.00 . A A . 4 MET N 1 1 10 6319 1 1 4 MET O O -0.824 4.720 17.278 1.00 . A A . 4 MET O 1 1 10 6320 1 1 4 MET SD S -0.221 0.871 20.259 1.00 . A A . 4 MET SD 1 1 10 6321 1 1 5 GLY C C -0.083 3.082 13.722 1.00 . A A . 5 GLY C 1 1 10 6322 1 1 5 GLY CA C -0.699 4.126 14.655 1.00 . A A . 5 GLY CA 1 1 10 6323 1 1 5 GLY H H -2.180 2.730 15.367 1.00 . A A . 5 GLY H 1 1 10 6324 1 1 5 GLY HA2 H -1.284 4.827 14.076 1.00 . A A . 5 GLY HA2 1 1 10 6325 1 1 5 GLY HA3 H 0.089 4.652 15.170 1.00 . A A . 5 GLY HA3 1 1 10 6326 1 1 5 GLY N N -1.581 3.451 15.651 1.00 . A A . 5 GLY N 1 1 10 6327 1 1 5 GLY O O 0.572 2.155 14.159 1.00 . A A . 5 GLY O 1 1 10 6328 1 1 6 CYS C C 1.824 2.231 11.603 1.00 . A A . 6 CYS C 1 1 10 6329 1 1 6 CYS CA C 0.298 2.240 11.481 1.00 . A A . 6 CYS CA 1 1 10 6330 1 1 6 CYS CB C -0.142 2.728 10.098 1.00 . A A . 6 CYS CB 1 1 10 6331 1 1 6 CYS H H -0.810 3.979 12.108 1.00 . A A . 6 CYS H 1 1 10 6332 1 1 6 CYS HA H -0.098 1.254 11.668 1.00 . A A . 6 CYS HA 1 1 10 6333 1 1 6 CYS HB2 H -1.184 2.492 9.954 1.00 . A A . 6 CYS HB2 1 1 10 6334 1 1 6 CYS HB3 H -0.005 3.795 10.032 1.00 . A A . 6 CYS HB3 1 1 10 6335 1 1 6 CYS N N -0.282 3.224 12.440 1.00 . A A . 6 CYS N 1 1 10 6336 1 1 6 CYS O O 2.452 1.192 11.572 1.00 . A A . 6 CYS O 1 1 10 6337 1 1 6 CYS SG S 0.835 1.908 8.814 1.00 . A A . 6 CYS SG 1 1 10 6338 1 1 7 ARG C C 4.344 2.566 13.074 1.00 . A A . 7 ARG C 1 1 10 6339 1 1 7 ARG CA C 3.909 3.430 11.888 1.00 . A A . 7 ARG CA 1 1 10 6340 1 1 7 ARG CB C 4.237 4.901 12.146 1.00 . A A . 7 ARG CB 1 1 10 6341 1 1 7 ARG CD C 5.080 6.132 10.140 1.00 . A A . 7 ARG CD 1 1 10 6342 1 1 7 ARG CG C 5.485 5.291 11.353 1.00 . A A . 7 ARG CG 1 1 10 6343 1 1 7 ARG CZ C 3.992 8.049 11.148 1.00 . A A . 7 ARG CZ 1 1 10 6344 1 1 7 ARG H H 1.902 4.208 11.783 1.00 . A A . 7 ARG H 1 1 10 6345 1 1 7 ARG HA H 4.384 3.096 10.980 1.00 . A A . 7 ARG HA 1 1 10 6346 1 1 7 ARG HB2 H 3.404 5.515 11.833 1.00 . A A . 7 ARG HB2 1 1 10 6347 1 1 7 ARG HB3 H 4.420 5.051 13.199 1.00 . A A . 7 ARG HB3 1 1 10 6348 1 1 7 ARG HD2 H 5.800 6.008 9.343 1.00 . A A . 7 ARG HD2 1 1 10 6349 1 1 7 ARG HD3 H 4.093 5.855 9.804 1.00 . A A . 7 ARG HD3 1 1 10 6350 1 1 7 ARG HE H 5.890 8.083 10.560 1.00 . A A . 7 ARG HE 1 1 10 6351 1 1 7 ARG HG2 H 6.148 5.865 11.986 1.00 . A A . 7 ARG HG2 1 1 10 6352 1 1 7 ARG HG3 H 5.991 4.398 11.017 1.00 . A A . 7 ARG HG3 1 1 10 6353 1 1 7 ARG HH11 H 2.830 7.553 9.595 1.00 . A A . 7 ARG HH11 1 1 10 6354 1 1 7 ARG HH12 H 2.035 8.381 10.891 1.00 . A A . 7 ARG HH12 1 1 10 6355 1 1 7 ARG HH21 H 4.900 8.662 12.824 1.00 . A A . 7 ARG HH21 1 1 10 6356 1 1 7 ARG HH22 H 3.206 9.007 12.720 1.00 . A A . 7 ARG HH22 1 1 10 6357 1 1 7 ARG N N 2.425 3.381 11.753 1.00 . A A . 7 ARG N 1 1 10 6358 1 1 7 ARG NE N 5.078 7.539 10.628 1.00 . A A . 7 ARG NE 1 1 10 6359 1 1 7 ARG NH1 N 2.865 7.990 10.493 1.00 . A A . 7 ARG NH1 1 1 10 6360 1 1 7 ARG NH2 N 4.037 8.617 12.321 1.00 . A A . 7 ARG NH2 1 1 10 6361 1 1 7 ARG O O 5.391 1.950 13.058 1.00 . A A . 7 ARG O 1 1 10 6362 1 1 8 HIS C C 3.846 0.202 14.914 1.00 . A A . 8 HIS C 1 1 10 6363 1 1 8 HIS CA C 3.892 1.688 15.289 1.00 . A A . 8 HIS CA 1 1 10 6364 1 1 8 HIS CB C 2.819 2.033 16.329 1.00 . A A . 8 HIS CB 1 1 10 6365 1 1 8 HIS CD2 C 1.786 -0.122 17.421 1.00 . A A . 8 HIS CD2 1 1 10 6366 1 1 8 HIS CE1 C 3.139 -0.304 19.104 1.00 . A A . 8 HIS CE1 1 1 10 6367 1 1 8 HIS CG C 2.680 0.916 17.328 1.00 . A A . 8 HIS CG 1 1 10 6368 1 1 8 HIS H H 2.699 3.017 14.087 1.00 . A A . 8 HIS H 1 1 10 6369 1 1 8 HIS HA H 4.867 1.955 15.660 1.00 . A A . 8 HIS HA 1 1 10 6370 1 1 8 HIS HB2 H 3.100 2.940 16.845 1.00 . A A . 8 HIS HB2 1 1 10 6371 1 1 8 HIS HB3 H 1.874 2.187 15.830 1.00 . A A . 8 HIS HB3 1 1 10 6372 1 1 8 HIS HD1 H 4.288 1.365 18.631 1.00 . A A . 8 HIS HD1 1 1 10 6373 1 1 8 HIS HD2 H 0.979 -0.312 16.728 1.00 . A A . 8 HIS HD2 1 1 10 6374 1 1 8 HIS HE1 H 3.621 -0.656 20.004 1.00 . A A . 8 HIS HE1 1 1 10 6375 1 1 8 HIS N N 3.540 2.515 14.100 1.00 . A A . 8 HIS N 1 1 10 6376 1 1 8 HIS ND1 N 3.534 0.779 18.410 1.00 . A A . 8 HIS ND1 1 1 10 6377 1 1 8 HIS NE2 N 2.077 -0.891 18.544 1.00 . A A . 8 HIS NE2 1 1 10 6378 1 1 8 HIS O O 4.636 -0.592 15.383 1.00 . A A . 8 HIS O 1 1 10 6379 1 1 9 PHE C C 4.214 -2.144 13.284 1.00 . A A . 9 PHE C 1 1 10 6380 1 1 9 PHE CA C 2.829 -1.604 13.657 1.00 . A A . 9 PHE CA 1 1 10 6381 1 1 9 PHE CB C 1.907 -1.601 12.434 1.00 . A A . 9 PHE CB 1 1 10 6382 1 1 9 PHE CD1 C 0.211 -0.847 14.162 1.00 . A A . 9 PHE CD1 1 1 10 6383 1 1 9 PHE CD2 C -0.503 -1.126 11.861 1.00 . A A . 9 PHE CD2 1 1 10 6384 1 1 9 PHE CE1 C -1.088 -0.462 14.517 1.00 . A A . 9 PHE CE1 1 1 10 6385 1 1 9 PHE CE2 C -1.801 -0.740 12.218 1.00 . A A . 9 PHE CE2 1 1 10 6386 1 1 9 PHE CG C 0.506 -1.181 12.832 1.00 . A A . 9 PHE CG 1 1 10 6387 1 1 9 PHE CZ C -2.093 -0.408 13.545 1.00 . A A . 9 PHE CZ 1 1 10 6388 1 1 9 PHE H H 2.302 0.484 13.699 1.00 . A A . 9 PHE H 1 1 10 6389 1 1 9 PHE HA H 2.393 -2.195 14.446 1.00 . A A . 9 PHE HA 1 1 10 6390 1 1 9 PHE HB2 H 2.293 -0.908 11.700 1.00 . A A . 9 PHE HB2 1 1 10 6391 1 1 9 PHE HB3 H 1.876 -2.592 12.008 1.00 . A A . 9 PHE HB3 1 1 10 6392 1 1 9 PHE HD1 H 0.987 -0.889 14.913 1.00 . A A . 9 PHE HD1 1 1 10 6393 1 1 9 PHE HD2 H -0.279 -1.381 10.837 1.00 . A A . 9 PHE HD2 1 1 10 6394 1 1 9 PHE HE1 H -1.314 -0.206 15.541 1.00 . A A . 9 PHE HE1 1 1 10 6395 1 1 9 PHE HE2 H -2.576 -0.698 11.467 1.00 . A A . 9 PHE HE2 1 1 10 6396 1 1 9 PHE HZ H -3.095 -0.110 13.820 1.00 . A A . 9 PHE HZ 1 1 10 6397 1 1 9 PHE N N 2.927 -0.174 14.068 1.00 . A A . 9 PHE N 1 1 10 6398 1 1 9 PHE O O 4.864 -1.642 12.388 1.00 . A A . 9 PHE O 1 1 10 6399 1 1 10 GLN C C 5.995 -4.388 12.260 1.00 . A A . 10 GLN C 1 1 10 6400 1 1 10 GLN CA C 6.011 -3.730 13.644 1.00 . A A . 10 GLN CA 1 1 10 6401 1 1 10 GLN CB C 6.271 -4.772 14.732 1.00 . A A . 10 GLN CB 1 1 10 6402 1 1 10 GLN CD C 7.620 -3.553 16.449 1.00 . A A . 10 GLN CD 1 1 10 6403 1 1 10 GLN CG C 6.231 -4.098 16.105 1.00 . A A . 10 GLN CG 1 1 10 6404 1 1 10 GLN H H 4.129 -3.553 14.680 1.00 . A A . 10 GLN H 1 1 10 6405 1 1 10 GLN HA H 6.765 -2.959 13.685 1.00 . A A . 10 GLN HA 1 1 10 6406 1 1 10 GLN HB2 H 5.512 -5.539 14.685 1.00 . A A . 10 GLN HB2 1 1 10 6407 1 1 10 GLN HB3 H 7.243 -5.217 14.581 1.00 . A A . 10 GLN HB3 1 1 10 6408 1 1 10 GLN HE21 H 6.989 -2.557 18.047 1.00 . A A . 10 GLN HE21 1 1 10 6409 1 1 10 GLN HE22 H 8.650 -2.428 17.719 1.00 . A A . 10 GLN HE22 1 1 10 6410 1 1 10 GLN HG2 H 5.519 -3.286 16.087 1.00 . A A . 10 GLN HG2 1 1 10 6411 1 1 10 GLN HG3 H 5.937 -4.819 16.852 1.00 . A A . 10 GLN HG3 1 1 10 6412 1 1 10 GLN N N 4.669 -3.162 13.962 1.00 . A A . 10 GLN N 1 1 10 6413 1 1 10 GLN NE2 N 7.765 -2.782 17.491 1.00 . A A . 10 GLN NE2 1 1 10 6414 1 1 10 GLN O O 6.603 -3.904 11.325 1.00 . A A . 10 GLN O 1 1 10 6415 1 1 10 GLN OE1 O 8.581 -3.831 15.760 1.00 . A A . 10 GLN OE1 1 1 10 6416 1 1 11 SER C C 4.237 -5.478 9.887 1.00 . A A . 11 SER C 1 1 10 6417 1 1 11 SER CA C 5.250 -6.173 10.799 1.00 . A A . 11 SER CA 1 1 10 6418 1 1 11 SER CB C 4.800 -7.599 11.108 1.00 . A A . 11 SER CB 1 1 10 6419 1 1 11 SER H H 4.821 -5.863 12.888 1.00 . A A . 11 SER H 1 1 10 6420 1 1 11 SER HA H 6.226 -6.184 10.339 1.00 . A A . 11 SER HA 1 1 10 6421 1 1 11 SER HB2 H 3.868 -7.576 11.647 1.00 . A A . 11 SER HB2 1 1 10 6422 1 1 11 SER HB3 H 4.663 -8.141 10.180 1.00 . A A . 11 SER HB3 1 1 10 6423 1 1 11 SER HG H 5.905 -9.132 11.568 1.00 . A A . 11 SER HG 1 1 10 6424 1 1 11 SER N N 5.305 -5.488 12.122 1.00 . A A . 11 SER N 1 1 10 6425 1 1 11 SER O O 3.548 -4.563 10.292 1.00 . A A . 11 SER O 1 1 10 6426 1 1 11 SER OG O 5.786 -8.242 11.905 1.00 . A A . 11 SER OG 1 1 10 6427 1 1 12 CYS C C 1.760 -5.819 7.970 1.00 . A A . 12 CYS C 1 1 10 6428 1 1 12 CYS CA C 3.168 -5.274 7.720 1.00 . A A . 12 CYS CA 1 1 10 6429 1 1 12 CYS CB C 3.653 -5.668 6.327 1.00 . A A . 12 CYS CB 1 1 10 6430 1 1 12 CYS H H 4.702 -6.648 8.353 1.00 . A A . 12 CYS H 1 1 10 6431 1 1 12 CYS HA H 3.183 -4.201 7.826 1.00 . A A . 12 CYS HA 1 1 10 6432 1 1 12 CYS HB2 H 3.004 -5.234 5.581 1.00 . A A . 12 CYS HB2 1 1 10 6433 1 1 12 CYS HB3 H 4.661 -5.308 6.180 1.00 . A A . 12 CYS HB3 1 1 10 6434 1 1 12 CYS N N 4.138 -5.908 8.658 1.00 . A A . 12 CYS N 1 1 10 6435 1 1 12 CYS O O 0.777 -5.257 7.528 1.00 . A A . 12 CYS O 1 1 10 6436 1 1 12 CYS SG S 3.630 -7.472 6.169 1.00 . A A . 12 CYS SG 1 1 10 6437 1 1 13 SER C C -0.662 -6.392 9.385 1.00 . A A . 13 SER C 1 1 10 6438 1 1 13 SER CA C 0.309 -7.493 8.952 1.00 . A A . 13 SER CA 1 1 10 6439 1 1 13 SER CB C 0.535 -8.487 10.091 1.00 . A A . 13 SER CB 1 1 10 6440 1 1 13 SER H H 2.459 -7.351 9.021 1.00 . A A . 13 SER H 1 1 10 6441 1 1 13 SER HA H -0.066 -8.008 8.081 1.00 . A A . 13 SER HA 1 1 10 6442 1 1 13 SER HB2 H 1.581 -8.517 10.343 1.00 . A A . 13 SER HB2 1 1 10 6443 1 1 13 SER HB3 H -0.032 -8.173 10.958 1.00 . A A . 13 SER HB3 1 1 10 6444 1 1 13 SER HG H -0.561 -9.674 9.006 1.00 . A A . 13 SER HG 1 1 10 6445 1 1 13 SER N N 1.654 -6.912 8.675 1.00 . A A . 13 SER N 1 1 10 6446 1 1 13 SER O O -1.681 -6.166 8.762 1.00 . A A . 13 SER O 1 1 10 6447 1 1 13 SER OG O 0.116 -9.781 9.678 1.00 . A A . 13 SER OG 1 1 10 6448 1 1 14 GLN C C -1.196 -3.419 9.980 1.00 . A A . 14 GLN C 1 1 10 6449 1 1 14 GLN CA C -1.258 -4.619 10.927 1.00 . A A . 14 GLN CA 1 1 10 6450 1 1 14 GLN CB C -0.724 -4.240 12.306 1.00 . A A . 14 GLN CB 1 1 10 6451 1 1 14 GLN CD C -2.138 -4.591 14.333 1.00 . A A . 14 GLN CD 1 1 10 6452 1 1 14 GLN CG C -1.858 -3.661 13.152 1.00 . A A . 14 GLN CG 1 1 10 6453 1 1 14 GLN H H 0.473 -5.903 10.938 1.00 . A A . 14 GLN H 1 1 10 6454 1 1 14 GLN HA H -2.268 -4.980 11.013 1.00 . A A . 14 GLN HA 1 1 10 6455 1 1 14 GLN HB2 H -0.323 -5.119 12.790 1.00 . A A . 14 GLN HB2 1 1 10 6456 1 1 14 GLN HB3 H 0.057 -3.501 12.199 1.00 . A A . 14 GLN HB3 1 1 10 6457 1 1 14 GLN HE21 H -1.215 -3.426 15.650 1.00 . A A . 14 GLN HE21 1 1 10 6458 1 1 14 GLN HE22 H -1.885 -4.851 16.286 1.00 . A A . 14 GLN HE22 1 1 10 6459 1 1 14 GLN HG2 H -1.572 -2.686 13.519 1.00 . A A . 14 GLN HG2 1 1 10 6460 1 1 14 GLN HG3 H -2.749 -3.572 12.547 1.00 . A A . 14 GLN HG3 1 1 10 6461 1 1 14 GLN N N -0.354 -5.704 10.451 1.00 . A A . 14 GLN N 1 1 10 6462 1 1 14 GLN NE2 N -1.710 -4.262 15.522 1.00 . A A . 14 GLN NE2 1 1 10 6463 1 1 14 GLN O O -2.173 -2.726 9.772 1.00 . A A . 14 GLN O 1 1 10 6464 1 1 14 GLN OE1 O -2.750 -5.628 14.174 1.00 . A A . 14 GLN OE1 1 1 10 6465 1 1 15 CYS C C -1.038 -2.016 7.438 1.00 . A A . 15 CYS C 1 1 10 6466 1 1 15 CYS CA C 0.085 -2.005 8.481 1.00 . A A . 15 CYS CA 1 1 10 6467 1 1 15 CYS CB C 1.442 -2.197 7.804 1.00 . A A . 15 CYS CB 1 1 10 6468 1 1 15 CYS H H 0.724 -3.734 9.595 1.00 . A A . 15 CYS H 1 1 10 6469 1 1 15 CYS HA H 0.078 -1.078 9.030 1.00 . A A . 15 CYS HA 1 1 10 6470 1 1 15 CYS HB2 H 1.515 -3.206 7.423 1.00 . A A . 15 CYS HB2 1 1 10 6471 1 1 15 CYS HB3 H 1.540 -1.497 6.988 1.00 . A A . 15 CYS HB3 1 1 10 6472 1 1 15 CYS N N -0.050 -3.164 9.409 1.00 . A A . 15 CYS N 1 1 10 6473 1 1 15 CYS O O -1.545 -0.983 7.050 1.00 . A A . 15 CYS O 1 1 10 6474 1 1 15 CYS SG S 2.761 -1.910 9.007 1.00 . A A . 15 CYS SG 1 1 10 6475 1 1 16 LEU C C -3.782 -3.834 6.550 1.00 . A A . 16 LEU C 1 1 10 6476 1 1 16 LEU CA C -2.503 -3.241 5.948 1.00 . A A . 16 LEU CA 1 1 10 6477 1 1 16 LEU CB C -1.954 -4.159 4.855 1.00 . A A . 16 LEU CB 1 1 10 6478 1 1 16 LEU CD1 C 0.264 -3.004 4.919 1.00 . A A . 16 LEU CD1 1 1 10 6479 1 1 16 LEU CD2 C -0.394 -4.328 2.913 1.00 . A A . 16 LEU CD2 1 1 10 6480 1 1 16 LEU CG C -0.906 -3.412 4.025 1.00 . A A . 16 LEU CG 1 1 10 6481 1 1 16 LEU H H -0.995 -3.996 7.292 1.00 . A A . 16 LEU H 1 1 10 6482 1 1 16 LEU HA H -2.697 -2.261 5.542 1.00 . A A . 16 LEU HA 1 1 10 6483 1 1 16 LEU HB2 H -1.499 -5.028 5.310 1.00 . A A . 16 LEU HB2 1 1 10 6484 1 1 16 LEU HB3 H -2.761 -4.473 4.211 1.00 . A A . 16 LEU HB3 1 1 10 6485 1 1 16 LEU HD11 H 1.180 -3.030 4.346 1.00 . A A . 16 LEU HD11 1 1 10 6486 1 1 16 LEU HD12 H 0.339 -3.691 5.749 1.00 . A A . 16 LEU HD12 1 1 10 6487 1 1 16 LEU HD13 H 0.101 -2.004 5.293 1.00 . A A . 16 LEU HD13 1 1 10 6488 1 1 16 LEU HD21 H 0.497 -4.838 3.249 1.00 . A A . 16 LEU HD21 1 1 10 6489 1 1 16 LEU HD22 H -0.161 -3.738 2.039 1.00 . A A . 16 LEU HD22 1 1 10 6490 1 1 16 LEU HD23 H -1.153 -5.054 2.666 1.00 . A A . 16 LEU HD23 1 1 10 6491 1 1 16 LEU HG H -1.353 -2.529 3.591 1.00 . A A . 16 LEU HG 1 1 10 6492 1 1 16 LEU N N -1.421 -3.174 6.974 1.00 . A A . 16 LEU N 1 1 10 6493 1 1 16 LEU O O -4.813 -3.881 5.908 1.00 . A A . 16 LEU O 1 1 10 6494 1 1 17 SER C C -5.726 -3.832 9.179 1.00 . A A . 17 SER C 1 1 10 6495 1 1 17 SER CA C -4.945 -4.891 8.395 1.00 . A A . 17 SER CA 1 1 10 6496 1 1 17 SER CB C -4.417 -5.971 9.335 1.00 . A A . 17 SER CB 1 1 10 6497 1 1 17 SER H H -2.887 -4.256 8.272 1.00 . A A . 17 SER H 1 1 10 6498 1 1 17 SER HA H -5.573 -5.336 7.640 1.00 . A A . 17 SER HA 1 1 10 6499 1 1 17 SER HB2 H -3.562 -5.599 9.868 1.00 . A A . 17 SER HB2 1 1 10 6500 1 1 17 SER HB3 H -5.190 -6.241 10.043 1.00 . A A . 17 SER HB3 1 1 10 6501 1 1 17 SER HG H -4.639 -7.190 7.834 1.00 . A A . 17 SER HG 1 1 10 6502 1 1 17 SER N N -3.727 -4.295 7.769 1.00 . A A . 17 SER N 1 1 10 6503 1 1 17 SER O O -6.814 -4.082 9.659 1.00 . A A . 17 SER O 1 1 10 6504 1 1 17 SER OG O -4.034 -7.110 8.575 1.00 . A A . 17 SER OG 1 1 10 6505 1 1 18 ALA C C -5.667 -0.220 9.432 1.00 . A A . 18 ALA C 1 1 10 6506 1 1 18 ALA CA C -5.909 -1.589 10.074 1.00 . A A . 18 ALA CA 1 1 10 6507 1 1 18 ALA CB C -5.318 -1.633 11.484 1.00 . A A . 18 ALA CB 1 1 10 6508 1 1 18 ALA H H -4.305 -2.464 8.927 1.00 . A A . 18 ALA H 1 1 10 6509 1 1 18 ALA HA H -6.964 -1.807 10.111 1.00 . A A . 18 ALA HA 1 1 10 6510 1 1 18 ALA HB1 H -5.207 -0.627 11.859 1.00 . A A . 18 ALA HB1 1 1 10 6511 1 1 18 ALA HB2 H -4.352 -2.116 11.455 1.00 . A A . 18 ALA HB2 1 1 10 6512 1 1 18 ALA HB3 H -5.978 -2.189 12.133 1.00 . A A . 18 ALA HB3 1 1 10 6513 1 1 18 ALA N N -5.184 -2.651 9.317 1.00 . A A . 18 ALA N 1 1 10 6514 1 1 18 ALA O O -5.159 0.682 10.067 1.00 . A A . 18 ALA O 1 1 10 6515 1 1 19 PRO C C -6.878 2.250 7.888 1.00 . A A . 19 PRO C 1 1 10 6516 1 1 19 PRO CA C -5.877 1.157 7.446 1.00 . A A . 19 PRO CA 1 1 10 6517 1 1 19 PRO CB C -6.093 0.757 5.988 1.00 . A A . 19 PRO CB 1 1 10 6518 1 1 19 PRO CD C -6.661 -1.160 7.358 1.00 . A A . 19 PRO CD 1 1 10 6519 1 1 19 PRO CG C -6.919 -0.488 6.029 1.00 . A A . 19 PRO CG 1 1 10 6520 1 1 19 PRO HA H -4.869 1.517 7.568 1.00 . A A . 19 PRO HA 1 1 10 6521 1 1 19 PRO HB2 H -6.618 1.542 5.460 1.00 . A A . 19 PRO HB2 1 1 10 6522 1 1 19 PRO HB3 H -5.145 0.555 5.511 1.00 . A A . 19 PRO HB3 1 1 10 6523 1 1 19 PRO HD2 H -7.590 -1.499 7.796 1.00 . A A . 19 PRO HD2 1 1 10 6524 1 1 19 PRO HD3 H -5.977 -1.986 7.237 1.00 . A A . 19 PRO HD3 1 1 10 6525 1 1 19 PRO HG2 H -7.966 -0.238 5.931 1.00 . A A . 19 PRO HG2 1 1 10 6526 1 1 19 PRO HG3 H -6.626 -1.149 5.229 1.00 . A A . 19 PRO HG3 1 1 10 6527 1 1 19 PRO N N -6.048 -0.114 8.186 1.00 . A A . 19 PRO N 1 1 10 6528 1 1 19 PRO O O -6.560 3.419 7.793 1.00 . A A . 19 PRO O 1 1 10 6529 1 1 20 PRO C C -8.651 3.478 10.148 1.00 . A A . 20 PRO C 1 1 10 6530 1 1 20 PRO CA C -9.038 2.896 8.784 1.00 . A A . 20 PRO CA 1 1 10 6531 1 1 20 PRO CB C -10.348 2.124 8.878 1.00 . A A . 20 PRO CB 1 1 10 6532 1 1 20 PRO CD C -8.579 0.508 8.527 1.00 . A A . 20 PRO CD 1 1 10 6533 1 1 20 PRO CG C -9.951 0.703 9.118 1.00 . A A . 20 PRO CG 1 1 10 6534 1 1 20 PRO HA H -9.120 3.678 8.046 1.00 . A A . 20 PRO HA 1 1 10 6535 1 1 20 PRO HB2 H -10.943 2.495 9.703 1.00 . A A . 20 PRO HB2 1 1 10 6536 1 1 20 PRO HB3 H -10.898 2.201 7.953 1.00 . A A . 20 PRO HB3 1 1 10 6537 1 1 20 PRO HD2 H -7.962 -0.061 9.206 1.00 . A A . 20 PRO HD2 1 1 10 6538 1 1 20 PRO HD3 H -8.653 0.014 7.574 1.00 . A A . 20 PRO HD3 1 1 10 6539 1 1 20 PRO HG2 H -9.928 0.506 10.181 1.00 . A A . 20 PRO HG2 1 1 10 6540 1 1 20 PRO HG3 H -10.652 0.039 8.637 1.00 . A A . 20 PRO HG3 1 1 10 6541 1 1 20 PRO N N -8.053 1.871 8.355 1.00 . A A . 20 PRO N 1 1 10 6542 1 1 20 PRO O O -9.002 4.592 10.481 1.00 . A A . 20 PRO O 1 1 10 6543 1 1 21 PHE C C -6.111 3.819 12.223 1.00 . A A . 21 PHE C 1 1 10 6544 1 1 21 PHE CA C -7.527 3.245 12.283 1.00 . A A . 21 PHE CA 1 1 10 6545 1 1 21 PHE CB C -7.560 2.026 13.207 1.00 . A A . 21 PHE CB 1 1 10 6546 1 1 21 PHE CD1 C -10.056 1.855 12.895 1.00 . A A . 21 PHE CD1 1 1 10 6547 1 1 21 PHE CD2 C -8.721 -0.166 12.767 1.00 . A A . 21 PHE CD2 1 1 10 6548 1 1 21 PHE CE1 C -11.214 1.105 12.658 1.00 . A A . 21 PHE CE1 1 1 10 6549 1 1 21 PHE CE2 C -9.879 -0.915 12.529 1.00 . A A . 21 PHE CE2 1 1 10 6550 1 1 21 PHE CG C -8.810 1.219 12.949 1.00 . A A . 21 PHE CG 1 1 10 6551 1 1 21 PHE CZ C -11.125 -0.281 12.474 1.00 . A A . 21 PHE CZ 1 1 10 6552 1 1 21 PHE H H -7.658 1.834 10.657 1.00 . A A . 21 PHE H 1 1 10 6553 1 1 21 PHE HA H -8.224 3.991 12.629 1.00 . A A . 21 PHE HA 1 1 10 6554 1 1 21 PHE HB2 H -6.692 1.411 13.020 1.00 . A A . 21 PHE HB2 1 1 10 6555 1 1 21 PHE HB3 H -7.551 2.356 14.236 1.00 . A A . 21 PHE HB3 1 1 10 6556 1 1 21 PHE HD1 H -10.125 2.923 13.037 1.00 . A A . 21 PHE HD1 1 1 10 6557 1 1 21 PHE HD2 H -7.759 -0.655 12.809 1.00 . A A . 21 PHE HD2 1 1 10 6558 1 1 21 PHE HE1 H -12.176 1.594 12.614 1.00 . A A . 21 PHE HE1 1 1 10 6559 1 1 21 PHE HE2 H -9.810 -1.984 12.388 1.00 . A A . 21 PHE HE2 1 1 10 6560 1 1 21 PHE HZ H -12.019 -0.859 12.290 1.00 . A A . 21 PHE HZ 1 1 10 6561 1 1 21 PHE N N -7.932 2.732 10.942 1.00 . A A . 21 PHE N 1 1 10 6562 1 1 21 PHE O O -5.508 4.112 13.236 1.00 . A A . 21 PHE O 1 1 10 6563 1 1 22 VAL C C -4.021 5.336 9.657 1.00 . A A . 22 VAL C 1 1 10 6564 1 1 22 VAL CA C -4.185 4.512 10.938 1.00 . A A . 22 VAL CA 1 1 10 6565 1 1 22 VAL CB C -3.289 3.276 10.895 1.00 . A A . 22 VAL CB 1 1 10 6566 1 1 22 VAL CG1 C -3.669 2.327 12.034 1.00 . A A . 22 VAL CG1 1 1 10 6567 1 1 22 VAL CG2 C -3.478 2.562 9.556 1.00 . A A . 22 VAL CG2 1 1 10 6568 1 1 22 VAL H H -6.065 3.721 10.240 1.00 . A A . 22 VAL H 1 1 10 6569 1 1 22 VAL HA H -3.945 5.109 11.803 1.00 . A A . 22 VAL HA 1 1 10 6570 1 1 22 VAL HB H -2.259 3.576 11.005 1.00 . A A . 22 VAL HB 1 1 10 6571 1 1 22 VAL HG11 H -4.596 1.828 11.792 1.00 . A A . 22 VAL HG11 1 1 10 6572 1 1 22 VAL HG12 H -3.792 2.889 12.948 1.00 . A A . 22 VAL HG12 1 1 10 6573 1 1 22 VAL HG13 H -2.890 1.592 12.166 1.00 . A A . 22 VAL HG13 1 1 10 6574 1 1 22 VAL HG21 H -3.174 1.530 9.653 1.00 . A A . 22 VAL HG21 1 1 10 6575 1 1 22 VAL HG22 H -2.874 3.046 8.802 1.00 . A A . 22 VAL HG22 1 1 10 6576 1 1 22 VAL HG23 H -4.518 2.605 9.268 1.00 . A A . 22 VAL HG23 1 1 10 6577 1 1 22 VAL N N -5.569 3.970 11.047 1.00 . A A . 22 VAL N 1 1 10 6578 1 1 22 VAL O O -4.970 5.594 8.943 1.00 . A A . 22 VAL O 1 1 10 6579 1 1 23 GLN C C -1.316 6.081 7.407 1.00 . A A . 23 GLN C 1 1 10 6580 1 1 23 GLN CA C -2.580 6.563 8.133 1.00 . A A . 23 GLN CA 1 1 10 6581 1 1 23 GLN CB C -2.397 7.997 8.641 1.00 . A A . 23 GLN CB 1 1 10 6582 1 1 23 GLN CD C -2.974 9.785 6.987 1.00 . A A . 23 GLN CD 1 1 10 6583 1 1 23 GLN CG C -1.855 8.886 7.514 1.00 . A A . 23 GLN CG 1 1 10 6584 1 1 23 GLN H H -2.069 5.532 9.959 1.00 . A A . 23 GLN H 1 1 10 6585 1 1 23 GLN HA H -3.434 6.511 7.479 1.00 . A A . 23 GLN HA 1 1 10 6586 1 1 23 GLN HB2 H -3.349 8.382 8.975 1.00 . A A . 23 GLN HB2 1 1 10 6587 1 1 23 GLN HB3 H -1.699 7.999 9.464 1.00 . A A . 23 GLN HB3 1 1 10 6588 1 1 23 GLN HE21 H -1.885 11.442 7.089 1.00 . A A . 23 GLN HE21 1 1 10 6589 1 1 23 GLN HE22 H -3.468 11.649 6.514 1.00 . A A . 23 GLN HE22 1 1 10 6590 1 1 23 GLN HG2 H -1.052 9.498 7.897 1.00 . A A . 23 GLN HG2 1 1 10 6591 1 1 23 GLN HG3 H -1.485 8.271 6.710 1.00 . A A . 23 GLN HG3 1 1 10 6592 1 1 23 GLN N N -2.817 5.751 9.364 1.00 . A A . 23 GLN N 1 1 10 6593 1 1 23 GLN NE2 N -2.758 11.065 6.852 1.00 . A A . 23 GLN NE2 1 1 10 6594 1 1 23 GLN O O -1.207 6.193 6.201 1.00 . A A . 23 GLN O 1 1 10 6595 1 1 23 GLN OE1 O -4.056 9.318 6.692 1.00 . A A . 23 GLN OE1 1 1 10 6596 1 1 24 CYS C C 0.602 3.864 6.583 1.00 . A A . 24 CYS C 1 1 10 6597 1 1 24 CYS CA C 0.893 5.088 7.466 1.00 . A A . 24 CYS CA 1 1 10 6598 1 1 24 CYS CB C 1.855 4.778 8.638 1.00 . A A . 24 CYS CB 1 1 10 6599 1 1 24 CYS H H -0.457 5.485 9.095 1.00 . A A . 24 CYS H 1 1 10 6600 1 1 24 CYS HA H 1.307 5.881 6.860 1.00 . A A . 24 CYS HA 1 1 10 6601 1 1 24 CYS HB2 H 2.696 5.453 8.585 1.00 . A A . 24 CYS HB2 1 1 10 6602 1 1 24 CYS HB3 H 1.337 4.944 9.570 1.00 . A A . 24 CYS HB3 1 1 10 6603 1 1 24 CYS N N -0.358 5.559 8.125 1.00 . A A . 24 CYS N 1 1 10 6604 1 1 24 CYS O O -0.491 3.331 6.577 1.00 . A A . 24 CYS O 1 1 10 6605 1 1 24 CYS SG S 2.477 3.068 8.590 1.00 . A A . 24 CYS SG 1 1 10 6606 1 1 25 GLY C C 2.703 1.504 4.803 1.00 . A A . 25 GLY C 1 1 10 6607 1 1 25 GLY CA C 1.381 2.258 4.932 1.00 . A A . 25 GLY CA 1 1 10 6608 1 1 25 GLY H H 2.443 3.888 5.851 1.00 . A A . 25 GLY H 1 1 10 6609 1 1 25 GLY HA2 H 0.629 1.604 5.350 1.00 . A A . 25 GLY HA2 1 1 10 6610 1 1 25 GLY HA3 H 1.067 2.593 3.959 1.00 . A A . 25 GLY HA3 1 1 10 6611 1 1 25 GLY N N 1.576 3.431 5.832 1.00 . A A . 25 GLY N 1 1 10 6612 1 1 25 GLY O O 3.688 1.859 5.413 1.00 . A A . 25 GLY O 1 1 10 6613 1 1 26 TRP C C 4.837 0.294 2.728 1.00 . A A . 26 TRP C 1 1 10 6614 1 1 26 TRP CA C 4.008 -0.305 3.867 1.00 . A A . 26 TRP CA 1 1 10 6615 1 1 26 TRP CB C 3.555 -1.723 3.517 1.00 . A A . 26 TRP CB 1 1 10 6616 1 1 26 TRP CD1 C 5.327 -3.284 2.621 1.00 . A A . 26 TRP CD1 1 1 10 6617 1 1 26 TRP CD2 C 5.344 -3.149 4.865 1.00 . A A . 26 TRP CD2 1 1 10 6618 1 1 26 TRP CE2 C 6.371 -4.052 4.506 1.00 . A A . 26 TRP CE2 1 1 10 6619 1 1 26 TRP CE3 C 5.140 -2.882 6.229 1.00 . A A . 26 TRP CE3 1 1 10 6620 1 1 26 TRP CG C 4.696 -2.676 3.652 1.00 . A A . 26 TRP CG 1 1 10 6621 1 1 26 TRP CH2 C 6.955 -4.396 6.821 1.00 . A A . 26 TRP CH2 1 1 10 6622 1 1 26 TRP CZ2 C 7.169 -4.671 5.468 1.00 . A A . 26 TRP CZ2 1 1 10 6623 1 1 26 TRP CZ3 C 5.941 -3.502 7.202 1.00 . A A . 26 TRP CZ3 1 1 10 6624 1 1 26 TRP H H 1.934 0.186 3.527 1.00 . A A . 26 TRP H 1 1 10 6625 1 1 26 TRP HA H 4.567 -0.307 4.789 1.00 . A A . 26 TRP HA 1 1 10 6626 1 1 26 TRP HB2 H 2.761 -2.020 4.185 1.00 . A A . 26 TRP HB2 1 1 10 6627 1 1 26 TRP HB3 H 3.190 -1.740 2.503 1.00 . A A . 26 TRP HB3 1 1 10 6628 1 1 26 TRP HD1 H 5.092 -3.154 1.574 1.00 . A A . 26 TRP HD1 1 1 10 6629 1 1 26 TRP HE1 H 6.925 -4.657 2.590 1.00 . A A . 26 TRP HE1 1 1 10 6630 1 1 26 TRP HE3 H 4.363 -2.196 6.527 1.00 . A A . 26 TRP HE3 1 1 10 6631 1 1 26 TRP HH2 H 7.569 -4.870 7.573 1.00 . A A . 26 TRP HH2 1 1 10 6632 1 1 26 TRP HZ2 H 7.947 -5.357 5.170 1.00 . A A . 26 TRP HZ2 1 1 10 6633 1 1 26 TRP HZ3 H 5.778 -3.291 8.248 1.00 . A A . 26 TRP HZ3 1 1 10 6634 1 1 26 TRP N N 2.739 0.463 4.019 1.00 . A A . 26 TRP N 1 1 10 6635 1 1 26 TRP NE1 N 6.321 -4.102 3.127 1.00 . A A . 26 TRP NE1 1 1 10 6636 1 1 26 TRP O O 4.306 0.699 1.715 1.00 . A A . 26 TRP O 1 1 10 6637 1 1 27 CYS C C 8.225 0.107 1.552 1.00 . A A . 27 CYS C 1 1 10 6638 1 1 27 CYS CA C 6.970 0.954 1.796 1.00 . A A . 27 CYS CA 1 1 10 6639 1 1 27 CYS CB C 7.360 2.340 2.306 1.00 . A A . 27 CYS CB 1 1 10 6640 1 1 27 CYS H H 6.550 0.050 3.711 1.00 . A A . 27 CYS H 1 1 10 6641 1 1 27 CYS HA H 6.396 1.046 0.888 1.00 . A A . 27 CYS HA 1 1 10 6642 1 1 27 CYS HB2 H 6.700 2.626 3.112 1.00 . A A . 27 CYS HB2 1 1 10 6643 1 1 27 CYS HB3 H 8.378 2.317 2.666 1.00 . A A . 27 CYS HB3 1 1 10 6644 1 1 27 CYS N N 6.134 0.369 2.884 1.00 . A A . 27 CYS N 1 1 10 6645 1 1 27 CYS O O 9.222 0.235 2.236 1.00 . A A . 27 CYS O 1 1 10 6646 1 1 27 CYS SG S 7.226 3.540 0.960 1.00 . A A . 27 CYS SG 1 1 10 6647 1 1 28 HIS C C 9.886 -2.466 1.376 1.00 . A A . 28 HIS C 1 1 10 6648 1 1 28 HIS CA C 9.359 -1.602 0.206 1.00 . A A . 28 HIS CA 1 1 10 6649 1 1 28 HIS CB C 10.436 -0.611 -0.234 1.00 . A A . 28 HIS CB 1 1 10 6650 1 1 28 HIS CD2 C 10.807 -0.438 -2.831 1.00 . A A . 28 HIS CD2 1 1 10 6651 1 1 28 HIS CE1 C 12.058 -2.188 -3.088 1.00 . A A . 28 HIS CE1 1 1 10 6652 1 1 28 HIS CG C 10.960 -1.003 -1.589 1.00 . A A . 28 HIS CG 1 1 10 6653 1 1 28 HIS H H 7.367 -0.801 0.020 1.00 . A A . 28 HIS H 1 1 10 6654 1 1 28 HIS HA H 9.107 -2.236 -0.628 1.00 . A A . 28 HIS HA 1 1 10 6655 1 1 28 HIS HB2 H 10.012 0.381 -0.286 1.00 . A A . 28 HIS HB2 1 1 10 6656 1 1 28 HIS HB3 H 11.247 -0.619 0.480 1.00 . A A . 28 HIS HB3 1 1 10 6657 1 1 28 HIS HD1 H 12.058 -2.741 -1.082 1.00 . A A . 28 HIS HD1 1 1 10 6658 1 1 28 HIS HD2 H 10.235 0.453 -3.043 1.00 . A A . 28 HIS HD2 1 1 10 6659 1 1 28 HIS HE1 H 12.671 -2.961 -3.529 1.00 . A A . 28 HIS HE1 1 1 10 6660 1 1 28 HIS N N 8.183 -0.740 0.560 1.00 . A A . 28 HIS N 1 1 10 6661 1 1 28 HIS ND1 N 11.762 -2.118 -1.776 1.00 . A A . 28 HIS ND1 1 1 10 6662 1 1 28 HIS NE2 N 11.501 -1.189 -3.776 1.00 . A A . 28 HIS NE2 1 1 10 6663 1 1 28 HIS O O 10.689 -3.349 1.155 1.00 . A A . 28 HIS O 1 1 10 6664 1 1 29 ASP C C 9.557 -2.514 5.078 1.00 . A A . 29 ASP C 1 1 10 6665 1 1 29 ASP CA C 9.974 -3.102 3.723 1.00 . A A . 29 ASP CA 1 1 10 6666 1 1 29 ASP CB C 11.503 -3.083 3.586 1.00 . A A . 29 ASP CB 1 1 10 6667 1 1 29 ASP CG C 12.147 -3.505 4.910 1.00 . A A . 29 ASP CG 1 1 10 6668 1 1 29 ASP H H 8.809 -1.558 2.786 1.00 . A A . 29 ASP H 1 1 10 6669 1 1 29 ASP HA H 9.610 -4.112 3.626 1.00 . A A . 29 ASP HA 1 1 10 6670 1 1 29 ASP HB2 H 11.804 -3.770 2.811 1.00 . A A . 29 ASP HB2 1 1 10 6671 1 1 29 ASP HB3 H 11.830 -2.086 3.331 1.00 . A A . 29 ASP HB3 1 1 10 6672 1 1 29 ASP N N 9.460 -2.254 2.601 1.00 . A A . 29 ASP N 1 1 10 6673 1 1 29 ASP O O 9.208 -3.229 5.996 1.00 . A A . 29 ASP O 1 1 10 6674 1 1 29 ASP OD1 O 12.277 -4.698 5.129 1.00 . A A . 29 ASP OD1 1 1 10 6675 1 1 29 ASP OD2 O 12.497 -2.628 5.683 1.00 . A A . 29 ASP OD2 1 1 10 6676 1 1 30 LYS C C 7.816 -0.036 6.467 1.00 . A A . 30 LYS C 1 1 10 6677 1 1 30 LYS CA C 9.239 -0.594 6.523 1.00 . A A . 30 LYS CA 1 1 10 6678 1 1 30 LYS CB C 10.251 0.535 6.723 1.00 . A A . 30 LYS CB 1 1 10 6679 1 1 30 LYS CD C 10.435 0.426 9.213 1.00 . A A . 30 LYS CD 1 1 10 6680 1 1 30 LYS CE C 11.131 1.330 10.232 1.00 . A A . 30 LYS CE 1 1 10 6681 1 1 30 LYS CG C 9.948 1.267 8.032 1.00 . A A . 30 LYS CG 1 1 10 6682 1 1 30 LYS H H 9.913 -0.656 4.475 1.00 . A A . 30 LYS H 1 1 10 6683 1 1 30 LYS HA H 9.329 -1.313 7.322 1.00 . A A . 30 LYS HA 1 1 10 6684 1 1 30 LYS HB2 H 11.248 0.121 6.764 1.00 . A A . 30 LYS HB2 1 1 10 6685 1 1 30 LYS HB3 H 10.182 1.230 5.900 1.00 . A A . 30 LYS HB3 1 1 10 6686 1 1 30 LYS HD2 H 9.591 -0.061 9.680 1.00 . A A . 30 LYS HD2 1 1 10 6687 1 1 30 LYS HD3 H 11.132 -0.320 8.861 1.00 . A A . 30 LYS HD3 1 1 10 6688 1 1 30 LYS HE2 H 11.992 1.808 9.782 1.00 . A A . 30 LYS HE2 1 1 10 6689 1 1 30 LYS HE3 H 10.443 2.070 10.611 1.00 . A A . 30 LYS HE3 1 1 10 6690 1 1 30 LYS HG2 H 10.456 2.221 8.035 1.00 . A A . 30 LYS HG2 1 1 10 6691 1 1 30 LYS HG3 H 8.884 1.426 8.120 1.00 . A A . 30 LYS HG3 1 1 10 6692 1 1 30 LYS HZ1 H 11.610 0.949 12.221 1.00 . A A . 30 LYS HZ1 1 1 10 6693 1 1 30 LYS HZ2 H 12.489 0.017 11.106 1.00 . A A . 30 LYS HZ2 1 1 10 6694 1 1 30 LYS HZ3 H 10.861 -0.350 11.429 1.00 . A A . 30 LYS HZ3 1 1 10 6695 1 1 30 LYS N N 9.613 -1.217 5.220 1.00 . A A . 30 LYS N 1 1 10 6696 1 1 30 LYS NZ N 11.555 0.418 11.330 1.00 . A A . 30 LYS NZ 1 1 10 6697 1 1 30 LYS O O 7.312 0.306 5.416 1.00 . A A . 30 LYS O 1 1 10 6698 1 1 31 CYS C C 5.794 2.120 7.727 1.00 . A A . 31 CYS C 1 1 10 6699 1 1 31 CYS CA C 5.773 0.593 7.609 1.00 . A A . 31 CYS CA 1 1 10 6700 1 1 31 CYS CB C 5.127 -0.032 8.844 1.00 . A A . 31 CYS CB 1 1 10 6701 1 1 31 CYS H H 7.588 -0.224 8.431 1.00 . A A . 31 CYS H 1 1 10 6702 1 1 31 CYS HA H 5.241 0.289 6.721 1.00 . A A . 31 CYS HA 1 1 10 6703 1 1 31 CYS HB2 H 5.462 -1.054 8.948 1.00 . A A . 31 CYS HB2 1 1 10 6704 1 1 31 CYS HB3 H 5.410 0.531 9.723 1.00 . A A . 31 CYS HB3 1 1 10 6705 1 1 31 CYS N N 7.163 0.059 7.594 1.00 . A A . 31 CYS N 1 1 10 6706 1 1 31 CYS O O 6.042 2.667 8.782 1.00 . A A . 31 CYS O 1 1 10 6707 1 1 31 CYS SG S 3.328 -0.001 8.666 1.00 . A A . 31 CYS SG 1 1 10 6708 1 1 32 VAL C C 4.621 4.857 5.596 1.00 . A A . 32 VAL C 1 1 10 6709 1 1 32 VAL CA C 5.539 4.299 6.688 1.00 . A A . 32 VAL CA 1 1 10 6710 1 1 32 VAL CB C 6.987 4.696 6.410 1.00 . A A . 32 VAL CB 1 1 10 6711 1 1 32 VAL CG1 C 7.927 3.888 7.306 1.00 . A A . 32 VAL CG1 1 1 10 6712 1 1 32 VAL CG2 C 7.312 4.412 4.941 1.00 . A A . 32 VAL CG2 1 1 10 6713 1 1 32 VAL H H 5.339 2.344 5.811 1.00 . A A . 32 VAL H 1 1 10 6714 1 1 32 VAL HA H 5.237 4.656 7.660 1.00 . A A . 32 VAL HA 1 1 10 6715 1 1 32 VAL HB H 7.116 5.748 6.611 1.00 . A A . 32 VAL HB 1 1 10 6716 1 1 32 VAL HG11 H 8.934 4.268 7.208 1.00 . A A . 32 VAL HG11 1 1 10 6717 1 1 32 VAL HG12 H 7.904 2.850 7.010 1.00 . A A . 32 VAL HG12 1 1 10 6718 1 1 32 VAL HG13 H 7.609 3.977 8.333 1.00 . A A . 32 VAL HG13 1 1 10 6719 1 1 32 VAL HG21 H 8.190 3.788 4.880 1.00 . A A . 32 VAL HG21 1 1 10 6720 1 1 32 VAL HG22 H 7.495 5.344 4.427 1.00 . A A . 32 VAL HG22 1 1 10 6721 1 1 32 VAL HG23 H 6.476 3.906 4.481 1.00 . A A . 32 VAL HG23 1 1 10 6722 1 1 32 VAL N N 5.534 2.808 6.649 1.00 . A A . 32 VAL N 1 1 10 6723 1 1 32 VAL O O 4.085 4.124 4.791 1.00 . A A . 32 VAL O 1 1 10 6724 1 1 33 ARG C C 4.409 7.557 3.519 1.00 . A A . 33 ARG C 1 1 10 6725 1 1 33 ARG CA C 3.568 6.746 4.507 1.00 . A A . 33 ARG CA 1 1 10 6726 1 1 33 ARG CB C 2.596 7.654 5.259 1.00 . A A . 33 ARG CB 1 1 10 6727 1 1 33 ARG CD C 0.722 9.151 4.545 1.00 . A A . 33 ARG CD 1 1 10 6728 1 1 33 ARG CG C 1.274 7.726 4.489 1.00 . A A . 33 ARG CG 1 1 10 6729 1 1 33 ARG CZ C 0.147 9.602 2.236 1.00 . A A . 33 ARG CZ 1 1 10 6730 1 1 33 ARG H H 4.889 6.727 6.212 1.00 . A A . 33 ARG H 1 1 10 6731 1 1 33 ARG HA H 3.023 5.971 3.991 1.00 . A A . 33 ARG HA 1 1 10 6732 1 1 33 ARG HB2 H 2.420 7.254 6.247 1.00 . A A . 33 ARG HB2 1 1 10 6733 1 1 33 ARG HB3 H 3.017 8.645 5.339 1.00 . A A . 33 ARG HB3 1 1 10 6734 1 1 33 ARG HD2 H -0.345 9.133 4.726 1.00 . A A . 33 ARG HD2 1 1 10 6735 1 1 33 ARG HD3 H 1.225 9.721 5.310 1.00 . A A . 33 ARG HD3 1 1 10 6736 1 1 33 ARG HE H 1.858 10.201 3.046 1.00 . A A . 33 ARG HE 1 1 10 6737 1 1 33 ARG HG2 H 1.441 7.444 3.460 1.00 . A A . 33 ARG HG2 1 1 10 6738 1 1 33 ARG HG3 H 0.562 7.048 4.935 1.00 . A A . 33 ARG HG3 1 1 10 6739 1 1 33 ARG HH11 H 0.728 7.749 1.752 1.00 . A A . 33 ARG HH11 1 1 10 6740 1 1 33 ARG HH12 H -0.564 8.400 0.801 1.00 . A A . 33 ARG HH12 1 1 10 6741 1 1 33 ARG HH21 H -0.636 11.426 2.494 1.00 . A A . 33 ARG HH21 1 1 10 6742 1 1 33 ARG HH22 H -1.336 10.484 1.221 1.00 . A A . 33 ARG HH22 1 1 10 6743 1 1 33 ARG N N 4.443 6.150 5.557 1.00 . A A . 33 ARG N 1 1 10 6744 1 1 33 ARG NE N 1.014 9.728 3.203 1.00 . A A . 33 ARG NE 1 1 10 6745 1 1 33 ARG NH1 N 0.100 8.498 1.542 1.00 . A A . 33 ARG NH1 1 1 10 6746 1 1 33 ARG NH2 N -0.672 10.580 1.963 1.00 . A A . 33 ARG NH2 1 1 10 6747 1 1 33 ARG O O 5.593 7.745 3.707 1.00 . A A . 33 ARG O 1 1 10 6748 1 1 34 SER C C 5.459 9.873 2.130 1.00 . A A . 34 SER C 1 1 10 6749 1 1 34 SER CA C 4.566 8.827 1.451 1.00 . A A . 34 SER CA 1 1 10 6750 1 1 34 SER CB C 3.495 9.513 0.607 1.00 . A A . 34 SER CB 1 1 10 6751 1 1 34 SER H H 2.851 7.862 2.332 1.00 . A A . 34 SER H 1 1 10 6752 1 1 34 SER HA H 5.159 8.174 0.831 1.00 . A A . 34 SER HA 1 1 10 6753 1 1 34 SER HB2 H 3.957 10.017 -0.226 1.00 . A A . 34 SER HB2 1 1 10 6754 1 1 34 SER HB3 H 2.801 8.772 0.234 1.00 . A A . 34 SER HB3 1 1 10 6755 1 1 34 SER HG H 2.514 11.181 0.834 1.00 . A A . 34 SER HG 1 1 10 6756 1 1 34 SER N N 3.806 8.033 2.464 1.00 . A A . 34 SER N 1 1 10 6757 1 1 34 SER O O 6.585 10.091 1.730 1.00 . A A . 34 SER O 1 1 10 6758 1 1 34 SER OG O 2.806 10.467 1.406 1.00 . A A . 34 SER OG 1 1 10 6759 1 1 35 GLU C C 7.043 10.955 4.451 1.00 . A A . 35 GLU C 1 1 10 6760 1 1 35 GLU CA C 5.784 11.571 3.829 1.00 . A A . 35 GLU CA 1 1 10 6761 1 1 35 GLU CB C 4.870 12.137 4.918 1.00 . A A . 35 GLU CB 1 1 10 6762 1 1 35 GLU CD C 4.216 11.351 7.197 1.00 . A A . 35 GLU CD 1 1 10 6763 1 1 35 GLU CG C 4.244 10.989 5.711 1.00 . A A . 35 GLU CG 1 1 10 6764 1 1 35 GLU H H 4.048 10.349 3.443 1.00 . A A . 35 GLU H 1 1 10 6765 1 1 35 GLU HA H 6.053 12.353 3.136 1.00 . A A . 35 GLU HA 1 1 10 6766 1 1 35 GLU HB2 H 5.448 12.762 5.584 1.00 . A A . 35 GLU HB2 1 1 10 6767 1 1 35 GLU HB3 H 4.087 12.725 4.462 1.00 . A A . 35 GLU HB3 1 1 10 6768 1 1 35 GLU HG2 H 3.236 10.819 5.361 1.00 . A A . 35 GLU HG2 1 1 10 6769 1 1 35 GLU HG3 H 4.830 10.094 5.572 1.00 . A A . 35 GLU HG3 1 1 10 6770 1 1 35 GLU N N 4.963 10.530 3.141 1.00 . A A . 35 GLU N 1 1 10 6771 1 1 35 GLU O O 7.970 11.653 4.810 1.00 . A A . 35 GLU O 1 1 10 6772 1 1 35 GLU OE1 O 3.975 12.508 7.500 1.00 . A A . 35 GLU OE1 1 1 10 6773 1 1 35 GLU OE2 O 4.433 10.465 8.007 1.00 . A A . 35 GLU OE2 1 1 10 6774 1 1 36 GLU C C 8.949 8.057 4.198 1.00 . A A . 36 GLU C 1 1 10 6775 1 1 36 GLU CA C 8.292 9.017 5.192 1.00 . A A . 36 GLU CA 1 1 10 6776 1 1 36 GLU CB C 7.764 8.251 6.402 1.00 . A A . 36 GLU CB 1 1 10 6777 1 1 36 GLU CD C 7.224 10.134 7.951 1.00 . A A . 36 GLU CD 1 1 10 6778 1 1 36 GLU CG C 8.185 8.975 7.678 1.00 . A A . 36 GLU CG 1 1 10 6779 1 1 36 GLU H H 6.330 9.106 4.295 1.00 . A A . 36 GLU H 1 1 10 6780 1 1 36 GLU HA H 8.996 9.769 5.512 1.00 . A A . 36 GLU HA 1 1 10 6781 1 1 36 GLU HB2 H 6.686 8.197 6.354 1.00 . A A . 36 GLU HB2 1 1 10 6782 1 1 36 GLU HB3 H 8.177 7.254 6.405 1.00 . A A . 36 GLU HB3 1 1 10 6783 1 1 36 GLU HG2 H 8.162 8.285 8.507 1.00 . A A . 36 GLU HG2 1 1 10 6784 1 1 36 GLU HG3 H 9.186 9.361 7.558 1.00 . A A . 36 GLU HG3 1 1 10 6785 1 1 36 GLU N N 7.086 9.657 4.587 1.00 . A A . 36 GLU N 1 1 10 6786 1 1 36 GLU O O 10.051 7.592 4.403 1.00 . A A . 36 GLU O 1 1 10 6787 1 1 36 GLU OE1 O 6.717 10.694 6.993 1.00 . A A . 36 GLU OE1 1 1 10 6788 1 1 36 GLU OE2 O 7.014 10.443 9.112 1.00 . A A . 36 GLU OE2 1 1 10 6789 1 1 37 CYS C C 10.009 7.486 1.375 1.00 . A A . 37 CYS C 1 1 10 6790 1 1 37 CYS CA C 8.851 6.819 2.118 1.00 . A A . 37 CYS CA 1 1 10 6791 1 1 37 CYS CB C 7.700 6.521 1.157 1.00 . A A . 37 CYS CB 1 1 10 6792 1 1 37 CYS H H 7.386 8.140 2.987 1.00 . A A . 37 CYS H 1 1 10 6793 1 1 37 CYS HA H 9.181 5.909 2.593 1.00 . A A . 37 CYS HA 1 1 10 6794 1 1 37 CYS HB2 H 7.125 7.422 0.995 1.00 . A A . 37 CYS HB2 1 1 10 6795 1 1 37 CYS HB3 H 8.099 6.174 0.215 1.00 . A A . 37 CYS HB3 1 1 10 6796 1 1 37 CYS N N 8.275 7.755 3.126 1.00 . A A . 37 CYS N 1 1 10 6797 1 1 37 CYS O O 9.877 8.571 0.844 1.00 . A A . 37 CYS O 1 1 10 6798 1 1 37 CYS SG S 6.635 5.244 1.870 1.00 . A A . 37 CYS SG 1 1 10 6799 1 1 38 LEU C C 11.897 7.875 -0.786 1.00 . A A . 38 LEU C 1 1 10 6800 1 1 38 LEU CA C 12.310 7.442 0.621 1.00 . A A . 38 LEU CA 1 1 10 6801 1 1 38 LEU CB C 13.350 6.323 0.557 1.00 . A A . 38 LEU CB 1 1 10 6802 1 1 38 LEU CD1 C 15.180 7.664 1.597 1.00 . A A . 38 LEU CD1 1 1 10 6803 1 1 38 LEU CD2 C 13.457 6.572 3.039 1.00 . A A . 38 LEU CD2 1 1 10 6804 1 1 38 LEU CG C 14.287 6.434 1.760 1.00 . A A . 38 LEU CG 1 1 10 6805 1 1 38 LEU H H 11.230 5.970 1.764 1.00 . A A . 38 LEU H 1 1 10 6806 1 1 38 LEU HA H 12.701 8.280 1.176 1.00 . A A . 38 LEU HA 1 1 10 6807 1 1 38 LEU HB2 H 12.851 5.365 0.574 1.00 . A A . 38 LEU HB2 1 1 10 6808 1 1 38 LEU HB3 H 13.923 6.416 -0.354 1.00 . A A . 38 LEU HB3 1 1 10 6809 1 1 38 LEU HD11 H 14.894 8.201 0.703 1.00 . A A . 38 LEU HD11 1 1 10 6810 1 1 38 LEU HD12 H 16.210 7.353 1.516 1.00 . A A . 38 LEU HD12 1 1 10 6811 1 1 38 LEU HD13 H 15.064 8.310 2.456 1.00 . A A . 38 LEU HD13 1 1 10 6812 1 1 38 LEU HD21 H 13.070 7.578 3.109 1.00 . A A . 38 LEU HD21 1 1 10 6813 1 1 38 LEU HD22 H 14.079 6.366 3.897 1.00 . A A . 38 LEU HD22 1 1 10 6814 1 1 38 LEU HD23 H 12.636 5.871 3.014 1.00 . A A . 38 LEU HD23 1 1 10 6815 1 1 38 LEU HG H 14.902 5.548 1.820 1.00 . A A . 38 LEU HG 1 1 10 6816 1 1 38 LEU N N 11.144 6.845 1.331 1.00 . A A . 38 LEU N 1 1 10 6817 1 1 38 LEU O O 11.831 9.050 -1.090 1.00 . A A . 38 LEU O 1 1 10 6818 1 1 39 SER C C 9.747 7.799 -3.027 1.00 . A A . 39 SER C 1 1 10 6819 1 1 39 SER CA C 11.194 7.300 -3.030 1.00 . A A . 39 SER CA 1 1 10 6820 1 1 39 SER CB C 11.310 6.006 -3.834 1.00 . A A . 39 SER CB 1 1 10 6821 1 1 39 SER H H 11.664 5.995 -1.379 1.00 . A A . 39 SER H 1 1 10 6822 1 1 39 SER HA H 11.853 8.051 -3.437 1.00 . A A . 39 SER HA 1 1 10 6823 1 1 39 SER HB2 H 12.286 5.574 -3.687 1.00 . A A . 39 SER HB2 1 1 10 6824 1 1 39 SER HB3 H 10.554 5.306 -3.500 1.00 . A A . 39 SER HB3 1 1 10 6825 1 1 39 SER HG H 10.914 5.476 -5.665 1.00 . A A . 39 SER HG 1 1 10 6826 1 1 39 SER N N 11.610 6.936 -1.645 1.00 . A A . 39 SER N 1 1 10 6827 1 1 39 SER O O 9.180 8.080 -1.989 1.00 . A A . 39 SER O 1 1 10 6828 1 1 39 SER OG O 11.128 6.296 -5.215 1.00 . A A . 39 SER OG 1 1 10 6829 1 1 40 GLY C C 6.806 7.182 -4.416 1.00 . A A . 40 GLY C 1 1 10 6830 1 1 40 GLY CA C 7.735 8.382 -4.237 1.00 . A A . 40 GLY CA 1 1 10 6831 1 1 40 GLY H H 9.619 7.673 -5.003 1.00 . A A . 40 GLY H 1 1 10 6832 1 1 40 GLY HA2 H 7.490 8.898 -3.319 1.00 . A A . 40 GLY HA2 1 1 10 6833 1 1 40 GLY HA3 H 7.616 9.055 -5.072 1.00 . A A . 40 GLY HA3 1 1 10 6834 1 1 40 GLY N N 9.145 7.908 -4.177 1.00 . A A . 40 GLY N 1 1 10 6835 1 1 40 GLY O O 5.913 7.193 -5.241 1.00 . A A . 40 GLY O 1 1 10 6836 1 1 41 THR C C 5.584 4.519 -2.426 1.00 . A A . 41 THR C 1 1 10 6837 1 1 41 THR CA C 6.141 4.937 -3.789 1.00 . A A . 41 THR CA 1 1 10 6838 1 1 41 THR CB C 7.057 3.849 -4.348 1.00 . A A . 41 THR CB 1 1 10 6839 1 1 41 THR CG2 C 8.246 3.645 -3.408 1.00 . A A . 41 THR CG2 1 1 10 6840 1 1 41 THR H H 7.739 6.149 -2.998 1.00 . A A . 41 THR H 1 1 10 6841 1 1 41 THR HA H 5.337 5.130 -4.480 1.00 . A A . 41 THR HA 1 1 10 6842 1 1 41 THR HB H 7.418 4.146 -5.320 1.00 . A A . 41 THR HB 1 1 10 6843 1 1 41 THR HG1 H 6.158 2.480 -5.395 1.00 . A A . 41 THR HG1 1 1 10 6844 1 1 41 THR HG21 H 8.282 2.612 -3.092 1.00 . A A . 41 THR HG21 1 1 10 6845 1 1 41 THR HG22 H 8.135 4.282 -2.543 1.00 . A A . 41 THR HG22 1 1 10 6846 1 1 41 THR HG23 H 9.161 3.896 -3.925 1.00 . A A . 41 THR HG23 1 1 10 6847 1 1 41 THR N N 7.011 6.142 -3.654 1.00 . A A . 41 THR N 1 1 10 6848 1 1 41 THR O O 6.288 4.484 -1.437 1.00 . A A . 41 THR O 1 1 10 6849 1 1 41 THR OG1 O 6.329 2.635 -4.463 1.00 . A A . 41 THR OG1 1 1 10 6850 1 1 42 TRP C C 2.743 2.601 -1.352 1.00 . A A . 42 TRP C 1 1 10 6851 1 1 42 TRP CA C 3.703 3.767 -1.089 1.00 . A A . 42 TRP CA 1 1 10 6852 1 1 42 TRP CB C 2.941 4.998 -0.595 1.00 . A A . 42 TRP CB 1 1 10 6853 1 1 42 TRP CD1 C 2.932 4.571 1.893 1.00 . A A . 42 TRP CD1 1 1 10 6854 1 1 42 TRP CD2 C 0.873 4.470 0.989 1.00 . A A . 42 TRP CD2 1 1 10 6855 1 1 42 TRP CE2 C 0.723 4.219 2.371 1.00 . A A . 42 TRP CE2 1 1 10 6856 1 1 42 TRP CE3 C -0.279 4.462 0.183 1.00 . A A . 42 TRP CE3 1 1 10 6857 1 1 42 TRP CG C 2.286 4.693 0.711 1.00 . A A . 42 TRP CG 1 1 10 6858 1 1 42 TRP CH2 C -1.663 3.963 2.122 1.00 . A A . 42 TRP CH2 1 1 10 6859 1 1 42 TRP CZ2 C -0.528 3.968 2.937 1.00 . A A . 42 TRP CZ2 1 1 10 6860 1 1 42 TRP CZ3 C -1.540 4.210 0.748 1.00 . A A . 42 TRP CZ3 1 1 10 6861 1 1 42 TRP H H 3.779 4.228 -3.190 1.00 . A A . 42 TRP H 1 1 10 6862 1 1 42 TRP HA H 4.461 3.485 -0.375 1.00 . A A . 42 TRP HA 1 1 10 6863 1 1 42 TRP HB2 H 3.628 5.821 -0.465 1.00 . A A . 42 TRP HB2 1 1 10 6864 1 1 42 TRP HB3 H 2.188 5.271 -1.319 1.00 . A A . 42 TRP HB3 1 1 10 6865 1 1 42 TRP HD1 H 3.998 4.674 2.043 1.00 . A A . 42 TRP HD1 1 1 10 6866 1 1 42 TRP HE1 H 2.214 4.158 3.829 1.00 . A A . 42 TRP HE1 1 1 10 6867 1 1 42 TRP HE3 H -0.195 4.652 -0.877 1.00 . A A . 42 TRP HE3 1 1 10 6868 1 1 42 TRP HH2 H -2.634 3.769 2.552 1.00 . A A . 42 TRP HH2 1 1 10 6869 1 1 42 TRP HZ2 H -0.617 3.779 3.996 1.00 . A A . 42 TRP HZ2 1 1 10 6870 1 1 42 TRP HZ3 H -2.419 4.202 0.121 1.00 . A A . 42 TRP HZ3 1 1 10 6871 1 1 42 TRP N N 4.323 4.194 -2.375 1.00 . A A . 42 TRP N 1 1 10 6872 1 1 42 TRP NE1 N 2.006 4.292 2.880 1.00 . A A . 42 TRP NE1 1 1 10 6873 1 1 42 TRP O O 1.866 2.691 -2.186 1.00 . A A . 42 TRP O 1 1 10 6874 1 1 43 THR C C 1.132 0.034 0.319 1.00 . A A . 43 THR C 1 1 10 6875 1 1 43 THR CA C 1.993 0.344 -0.910 1.00 . A A . 43 THR CA 1 1 10 6876 1 1 43 THR CB C 2.910 -0.838 -1.242 1.00 . A A . 43 THR CB 1 1 10 6877 1 1 43 THR CG2 C 3.991 -0.981 -0.171 1.00 . A A . 43 THR CG2 1 1 10 6878 1 1 43 THR H H 3.621 1.433 0.002 1.00 . A A . 43 THR H 1 1 10 6879 1 1 43 THR HA H 1.359 0.552 -1.756 1.00 . A A . 43 THR HA 1 1 10 6880 1 1 43 THR HB H 3.379 -0.670 -2.200 1.00 . A A . 43 THR HB 1 1 10 6881 1 1 43 THR HG1 H 2.716 -2.747 -1.569 1.00 . A A . 43 THR HG1 1 1 10 6882 1 1 43 THR HG21 H 4.638 -0.117 -0.193 1.00 . A A . 43 THR HG21 1 1 10 6883 1 1 43 THR HG22 H 4.574 -1.871 -0.364 1.00 . A A . 43 THR HG22 1 1 10 6884 1 1 43 THR HG23 H 3.527 -1.060 0.800 1.00 . A A . 43 THR HG23 1 1 10 6885 1 1 43 THR N N 2.904 1.501 -0.662 1.00 . A A . 43 THR N 1 1 10 6886 1 1 43 THR O O 1.574 0.117 1.454 1.00 . A A . 43 THR O 1 1 10 6887 1 1 43 THR OG1 O 2.138 -2.029 -1.297 1.00 . A A . 43 THR OG1 1 1 10 6888 1 1 44 GLN C C -1.515 -2.106 1.048 1.00 . A A . 44 GLN C 1 1 10 6889 1 1 44 GLN CA C -1.025 -0.662 1.204 1.00 . A A . 44 GLN CA 1 1 10 6890 1 1 44 GLN CB C -2.182 0.330 1.050 1.00 . A A . 44 GLN CB 1 1 10 6891 1 1 44 GLN CD C -4.430 0.965 1.928 1.00 . A A . 44 GLN CD 1 1 10 6892 1 1 44 GLN CG C -3.394 -0.156 1.845 1.00 . A A . 44 GLN CG 1 1 10 6893 1 1 44 GLN H H -0.417 -0.390 -0.840 1.00 . A A . 44 GLN H 1 1 10 6894 1 1 44 GLN HA H -0.539 -0.523 2.156 1.00 . A A . 44 GLN HA 1 1 10 6895 1 1 44 GLN HB2 H -1.876 1.298 1.417 1.00 . A A . 44 GLN HB2 1 1 10 6896 1 1 44 GLN HB3 H -2.449 0.410 0.007 1.00 . A A . 44 GLN HB3 1 1 10 6897 1 1 44 GLN HE21 H -5.589 -0.012 3.211 1.00 . A A . 44 GLN HE21 1 1 10 6898 1 1 44 GLN HE22 H -6.145 1.526 2.755 1.00 . A A . 44 GLN HE22 1 1 10 6899 1 1 44 GLN HG2 H -3.828 -1.010 1.348 1.00 . A A . 44 GLN HG2 1 1 10 6900 1 1 44 GLN HG3 H -3.086 -0.435 2.841 1.00 . A A . 44 GLN HG3 1 1 10 6901 1 1 44 GLN N N -0.099 -0.330 0.085 1.00 . A A . 44 GLN N 1 1 10 6902 1 1 44 GLN NE2 N -5.475 0.815 2.695 1.00 . A A . 44 GLN NE2 1 1 10 6903 1 1 44 GLN O O -2.436 -2.539 1.710 1.00 . A A . 44 GLN O 1 1 10 6904 1 1 44 GLN OE1 O -4.288 1.989 1.289 1.00 . A A . 44 GLN OE1 1 1 10 6905 1 1 45 GLN C C -0.113 -5.090 -0.543 1.00 . A A . 45 GLN C 1 1 10 6906 1 1 45 GLN CA C -1.306 -4.271 -0.038 1.00 . A A . 45 GLN CA 1 1 10 6907 1 1 45 GLN CB C -2.401 -4.209 -1.105 1.00 . A A . 45 GLN CB 1 1 10 6908 1 1 45 GLN CD C -1.792 -4.239 -3.531 1.00 . A A . 45 GLN CD 1 1 10 6909 1 1 45 GLN CG C -1.917 -3.362 -2.283 1.00 . A A . 45 GLN CG 1 1 10 6910 1 1 45 GLN H H -0.151 -2.480 -0.344 1.00 . A A . 45 GLN H 1 1 10 6911 1 1 45 GLN HA H -1.700 -4.692 0.873 1.00 . A A . 45 GLN HA 1 1 10 6912 1 1 45 GLN HB2 H -2.627 -5.208 -1.447 1.00 . A A . 45 GLN HB2 1 1 10 6913 1 1 45 GLN HB3 H -3.290 -3.762 -0.685 1.00 . A A . 45 GLN HB3 1 1 10 6914 1 1 45 GLN HE21 H -1.758 -2.698 -4.784 1.00 . A A . 45 GLN HE21 1 1 10 6915 1 1 45 GLN HE22 H -1.647 -4.227 -5.512 1.00 . A A . 45 GLN HE22 1 1 10 6916 1 1 45 GLN HG2 H -2.626 -2.568 -2.470 1.00 . A A . 45 GLN HG2 1 1 10 6917 1 1 45 GLN HG3 H -0.954 -2.936 -2.049 1.00 . A A . 45 GLN HG3 1 1 10 6918 1 1 45 GLN N N -0.894 -2.852 0.174 1.00 . A A . 45 GLN N 1 1 10 6919 1 1 45 GLN NE2 N -1.727 -3.675 -4.706 1.00 . A A . 45 GLN NE2 1 1 10 6920 1 1 45 GLN O O 0.280 -4.988 -1.688 1.00 . A A . 45 GLN O 1 1 10 6921 1 1 45 GLN OE1 O -1.752 -5.450 -3.437 1.00 . A A . 45 GLN OE1 1 1 10 6922 1 1 46 ILE C C 1.691 -8.035 0.640 1.00 . A A . 46 ILE C 1 1 10 6923 1 1 46 ILE CA C 1.638 -6.716 -0.137 1.00 . A A . 46 ILE CA 1 1 10 6924 1 1 46 ILE CB C 2.862 -5.856 0.179 1.00 . A A . 46 ILE CB 1 1 10 6925 1 1 46 ILE CD1 C 4.163 -7.151 -1.518 1.00 . A A . 46 ILE CD1 1 1 10 6926 1 1 46 ILE CG1 C 4.136 -6.669 -0.067 1.00 . A A . 46 ILE CG1 1 1 10 6927 1 1 46 ILE CG2 C 2.818 -5.416 1.643 1.00 . A A . 46 ILE CG2 1 1 10 6928 1 1 46 ILE H H 0.140 -5.965 1.223 1.00 . A A . 46 ILE H 1 1 10 6929 1 1 46 ILE HA H 1.586 -6.905 -1.198 1.00 . A A . 46 ILE HA 1 1 10 6930 1 1 46 ILE HB H 2.862 -4.983 -0.458 1.00 . A A . 46 ILE HB 1 1 10 6931 1 1 46 ILE HD11 H 3.372 -7.869 -1.673 1.00 . A A . 46 ILE HD11 1 1 10 6932 1 1 46 ILE HD12 H 5.116 -7.616 -1.725 1.00 . A A . 46 ILE HD12 1 1 10 6933 1 1 46 ILE HD13 H 4.021 -6.309 -2.180 1.00 . A A . 46 ILE HD13 1 1 10 6934 1 1 46 ILE HG12 H 5.000 -6.048 0.123 1.00 . A A . 46 ILE HG12 1 1 10 6935 1 1 46 ILE HG13 H 4.152 -7.522 0.595 1.00 . A A . 46 ILE HG13 1 1 10 6936 1 1 46 ILE HG21 H 1.790 -5.331 1.963 1.00 . A A . 46 ILE HG21 1 1 10 6937 1 1 46 ILE HG22 H 3.307 -4.459 1.746 1.00 . A A . 46 ILE HG22 1 1 10 6938 1 1 46 ILE HG23 H 3.325 -6.148 2.255 1.00 . A A . 46 ILE HG23 1 1 10 6939 1 1 46 ILE N N 0.469 -5.898 0.302 1.00 . A A . 46 ILE N 1 1 10 6940 1 1 46 ILE O O 1.936 -9.086 0.080 1.00 . A A . 46 ILE O 1 1 10 6941 1 1 47 CYS C C 0.166 -9.974 2.657 1.00 . A A . 47 CYS C 1 1 10 6942 1 1 47 CYS CA C 1.509 -9.244 2.734 1.00 . A A . 47 CYS CA 1 1 10 6943 1 1 47 CYS CB C 1.783 -8.781 4.165 1.00 . A A . 47 CYS CB 1 1 10 6944 1 1 47 CYS H H 1.273 -7.134 2.358 1.00 . A A . 47 CYS H 1 1 10 6945 1 1 47 CYS HA H 2.306 -9.885 2.395 1.00 . A A . 47 CYS HA 1 1 10 6946 1 1 47 CYS HB2 H 0.955 -8.182 4.514 1.00 . A A . 47 CYS HB2 1 1 10 6947 1 1 47 CYS HB3 H 1.897 -9.644 4.805 1.00 . A A . 47 CYS HB3 1 1 10 6948 1 1 47 CYS N N 1.466 -7.990 1.924 1.00 . A A . 47 CYS N 1 1 10 6949 1 1 47 CYS O O -0.860 -9.384 2.383 1.00 . A A . 47 CYS O 1 1 10 6950 1 1 47 CYS SG S 3.299 -7.795 4.202 1.00 . A A . 47 CYS SG 1 1 10 6951 1 1 48 LEU C C -1.974 -11.698 4.069 1.00 . A A . 48 LEU C 1 1 10 6952 1 1 48 LEU CA C -1.114 -12.023 2.844 1.00 . A A . 48 LEU CA 1 1 10 6953 1 1 48 LEU CB C -0.698 -13.494 2.856 1.00 . A A . 48 LEU CB 1 1 10 6954 1 1 48 LEU CD1 C 0.692 -14.859 1.290 1.00 . A A . 48 LEU CD1 1 1 10 6955 1 1 48 LEU CD2 C -1.793 -14.843 1.060 1.00 . A A . 48 LEU CD2 1 1 10 6956 1 1 48 LEU CG C -0.567 -14.000 1.418 1.00 . A A . 48 LEU CG 1 1 10 6957 1 1 48 LEU H H 1.000 -11.715 3.122 1.00 . A A . 48 LEU H 1 1 10 6958 1 1 48 LEU HA H -1.650 -11.797 1.936 1.00 . A A . 48 LEU HA 1 1 10 6959 1 1 48 LEU HB2 H 0.252 -13.595 3.362 1.00 . A A . 48 LEU HB2 1 1 10 6960 1 1 48 LEU HB3 H -1.446 -14.076 3.373 1.00 . A A . 48 LEU HB3 1 1 10 6961 1 1 48 LEU HD11 H 0.505 -15.671 0.605 1.00 . A A . 48 LEU HD11 1 1 10 6962 1 1 48 LEU HD12 H 0.956 -15.258 2.259 1.00 . A A . 48 LEU HD12 1 1 10 6963 1 1 48 LEU HD13 H 1.505 -14.253 0.917 1.00 . A A . 48 LEU HD13 1 1 10 6964 1 1 48 LEU HD21 H -2.099 -14.622 0.047 1.00 . A A . 48 LEU HD21 1 1 10 6965 1 1 48 LEU HD22 H -2.602 -14.611 1.738 1.00 . A A . 48 LEU HD22 1 1 10 6966 1 1 48 LEU HD23 H -1.546 -15.891 1.140 1.00 . A A . 48 LEU HD23 1 1 10 6967 1 1 48 LEU HG H -0.498 -13.157 0.746 1.00 . A A . 48 LEU HG 1 1 10 6968 1 1 48 LEU N N 0.164 -11.257 2.901 1.00 . A A . 48 LEU N 1 1 10 6969 1 1 48 LEU O O -2.781 -10.788 3.977 1.00 . A A . 48 LEU O 1 1 10 6970 1 1 48 LEU OXT O -1.808 -12.364 5.077 1.00 . A A . 48 LEU OXT 1 1 11 6971 1 1 1 GLY C C -5.749 -2.108 21.858 1.00 . A A . 1 GLY C 1 1 11 6972 1 1 1 GLY CA C -6.471 -3.260 21.158 1.00 . A A . 1 GLY CA 1 1 11 6973 1 1 1 GLY H1 H -7.379 -3.669 22.987 1.00 . A A . 1 GLY H1 1 1 11 6974 1 1 1 GLY H2 H -7.914 -4.656 21.713 1.00 . A A . 1 GLY H2 1 1 11 6975 1 1 1 GLY H3 H -8.436 -3.043 21.817 1.00 . A A . 1 GLY H3 1 1 11 6976 1 1 1 GLY HA2 H -5.792 -4.092 21.035 1.00 . A A . 1 GLY HA2 1 1 11 6977 1 1 1 GLY HA3 H -6.816 -2.929 20.189 1.00 . A A . 1 GLY HA3 1 1 11 6978 1 1 1 GLY N N -7.638 -3.690 21.981 1.00 . A A . 1 GLY N 1 1 11 6979 1 1 1 GLY O O -6.330 -1.384 22.642 1.00 . A A . 1 GLY O 1 1 11 6980 1 1 2 SER C C -2.579 -0.373 21.325 1.00 . A A . 2 SER C 1 1 11 6981 1 1 2 SER CA C -3.727 -0.825 22.231 1.00 . A A . 2 SER CA 1 1 11 6982 1 1 2 SER CB C -3.184 -1.430 23.525 1.00 . A A . 2 SER CB 1 1 11 6983 1 1 2 SER H H -4.036 -2.527 20.945 1.00 . A A . 2 SER H 1 1 11 6984 1 1 2 SER HA H -4.380 0.002 22.456 1.00 . A A . 2 SER HA 1 1 11 6985 1 1 2 SER HB2 H -3.054 -2.491 23.402 1.00 . A A . 2 SER HB2 1 1 11 6986 1 1 2 SER HB3 H -2.229 -0.977 23.760 1.00 . A A . 2 SER HB3 1 1 11 6987 1 1 2 SER HG H -4.561 -0.365 24.394 1.00 . A A . 2 SER HG 1 1 11 6988 1 1 2 SER N N -4.486 -1.932 21.581 1.00 . A A . 2 SER N 1 1 11 6989 1 1 2 SER O O -1.424 -0.634 21.593 1.00 . A A . 2 SER O 1 1 11 6990 1 1 2 SER OG O -4.108 -1.191 24.578 1.00 . A A . 2 SER OG 1 1 11 6991 1 1 3 ALA C C -1.903 2.280 19.126 1.00 . A A . 3 ALA C 1 1 11 6992 1 1 3 ALA CA C -1.815 0.765 19.327 1.00 . A A . 3 ALA CA 1 1 11 6993 1 1 3 ALA CB C -2.085 0.037 18.009 1.00 . A A . 3 ALA CB 1 1 11 6994 1 1 3 ALA H H -3.828 0.499 20.050 1.00 . A A . 3 ALA H 1 1 11 6995 1 1 3 ALA HA H -0.845 0.490 19.707 1.00 . A A . 3 ALA HA 1 1 11 6996 1 1 3 ALA HB1 H -3.139 -0.187 17.930 1.00 . A A . 3 ALA HB1 1 1 11 6997 1 1 3 ALA HB2 H -1.518 -0.883 17.983 1.00 . A A . 3 ALA HB2 1 1 11 6998 1 1 3 ALA HB3 H -1.788 0.667 17.185 1.00 . A A . 3 ALA HB3 1 1 11 6999 1 1 3 ALA N N -2.890 0.300 20.250 1.00 . A A . 3 ALA N 1 1 11 7000 1 1 3 ALA O O -2.867 2.912 19.510 1.00 . A A . 3 ALA O 1 1 11 7001 1 1 4 MET C C -1.251 4.632 16.824 1.00 . A A . 4 MET C 1 1 11 7002 1 1 4 MET CA C -0.933 4.337 18.292 1.00 . A A . 4 MET CA 1 1 11 7003 1 1 4 MET CB C 0.473 4.823 18.647 1.00 . A A . 4 MET CB 1 1 11 7004 1 1 4 MET CE C -0.776 7.368 19.117 1.00 . A A . 4 MET CE 1 1 11 7005 1 1 4 MET CG C 0.522 5.204 20.127 1.00 . A A . 4 MET CG 1 1 11 7006 1 1 4 MET H H -0.140 2.337 18.217 1.00 . A A . 4 MET H 1 1 11 7007 1 1 4 MET HA H -1.659 4.806 18.936 1.00 . A A . 4 MET HA 1 1 11 7008 1 1 4 MET HB2 H 1.185 4.033 18.453 1.00 . A A . 4 MET HB2 1 1 11 7009 1 1 4 MET HB3 H 0.719 5.686 18.047 1.00 . A A . 4 MET HB3 1 1 11 7010 1 1 4 MET HE1 H -1.108 8.387 19.256 1.00 . A A . 4 MET HE1 1 1 11 7011 1 1 4 MET HE2 H -1.600 6.695 19.289 1.00 . A A . 4 MET HE2 1 1 11 7012 1 1 4 MET HE3 H -0.413 7.238 18.105 1.00 . A A . 4 MET HE3 1 1 11 7013 1 1 4 MET HG2 H -0.353 4.816 20.628 1.00 . A A . 4 MET HG2 1 1 11 7014 1 1 4 MET HG3 H 1.410 4.784 20.578 1.00 . A A . 4 MET HG3 1 1 11 7015 1 1 4 MET N N -0.906 2.865 18.521 1.00 . A A . 4 MET N 1 1 11 7016 1 1 4 MET O O -1.616 5.736 16.469 1.00 . A A . 4 MET O 1 1 11 7017 1 1 4 MET SD S 0.558 7.007 20.285 1.00 . A A . 4 MET SD 1 1 11 7018 1 1 5 GLY C C -0.668 2.886 13.655 1.00 . A A . 5 GLY C 1 1 11 7019 1 1 5 GLY CA C -1.427 3.891 14.528 1.00 . A A . 5 GLY CA 1 1 11 7020 1 1 5 GLY H H -0.831 2.769 16.270 1.00 . A A . 5 GLY H 1 1 11 7021 1 1 5 GLY HA2 H -2.489 3.779 14.366 1.00 . A A . 5 GLY HA2 1 1 11 7022 1 1 5 GLY HA3 H -1.126 4.892 14.259 1.00 . A A . 5 GLY HA3 1 1 11 7023 1 1 5 GLY N N -1.123 3.655 15.967 1.00 . A A . 5 GLY N 1 1 11 7024 1 1 5 GLY O O -0.264 1.832 14.102 1.00 . A A . 5 GLY O 1 1 11 7025 1 1 6 CYS C C 1.737 2.289 11.796 1.00 . A A . 6 CYS C 1 1 11 7026 1 1 6 CYS CA C 0.239 2.297 11.476 1.00 . A A . 6 CYS CA 1 1 11 7027 1 1 6 CYS CB C -0.022 2.884 10.088 1.00 . A A . 6 CYS CB 1 1 11 7028 1 1 6 CYS H H -0.823 4.067 12.073 1.00 . A A . 6 CYS H 1 1 11 7029 1 1 6 CYS HA H -0.166 1.301 11.538 1.00 . A A . 6 CYS HA 1 1 11 7030 1 1 6 CYS HB2 H -1.075 2.809 9.862 1.00 . A A . 6 CYS HB2 1 1 11 7031 1 1 6 CYS HB3 H 0.271 3.920 10.079 1.00 . A A . 6 CYS HB3 1 1 11 7032 1 1 6 CYS N N -0.483 3.213 12.405 1.00 . A A . 6 CYS N 1 1 11 7033 1 1 6 CYS O O 2.348 1.245 11.925 1.00 . A A . 6 CYS O 1 1 11 7034 1 1 6 CYS SG S 0.915 1.974 8.835 1.00 . A A . 6 CYS SG 1 1 11 7035 1 1 7 ARG C C 4.068 2.804 13.579 1.00 . A A . 7 ARG C 1 1 11 7036 1 1 7 ARG CA C 3.787 3.500 12.243 1.00 . A A . 7 ARG CA 1 1 11 7037 1 1 7 ARG CB C 4.116 4.990 12.328 1.00 . A A . 7 ARG CB 1 1 11 7038 1 1 7 ARG CD C 4.895 6.476 10.475 1.00 . A A . 7 ARG CD 1 1 11 7039 1 1 7 ARG CG C 3.715 5.669 11.018 1.00 . A A . 7 ARG CG 1 1 11 7040 1 1 7 ARG CZ C 3.749 8.164 9.176 1.00 . A A . 7 ARG CZ 1 1 11 7041 1 1 7 ARG H H 1.819 4.272 11.824 1.00 . A A . 7 ARG H 1 1 11 7042 1 1 7 ARG HA H 4.360 3.041 11.452 1.00 . A A . 7 ARG HA 1 1 11 7043 1 1 7 ARG HB2 H 3.569 5.433 13.148 1.00 . A A . 7 ARG HB2 1 1 11 7044 1 1 7 ARG HB3 H 5.175 5.118 12.489 1.00 . A A . 7 ARG HB3 1 1 11 7045 1 1 7 ARG HD2 H 5.155 7.270 11.161 1.00 . A A . 7 ARG HD2 1 1 11 7046 1 1 7 ARG HD3 H 5.744 5.834 10.301 1.00 . A A . 7 ARG HD3 1 1 11 7047 1 1 7 ARG HE H 4.582 6.565 8.346 1.00 . A A . 7 ARG HE 1 1 11 7048 1 1 7 ARG HG2 H 3.432 4.916 10.298 1.00 . A A . 7 ARG HG2 1 1 11 7049 1 1 7 ARG HG3 H 2.879 6.330 11.195 1.00 . A A . 7 ARG HG3 1 1 11 7050 1 1 7 ARG HH11 H 3.374 8.134 11.142 1.00 . A A . 7 ARG HH11 1 1 11 7051 1 1 7 ARG HH12 H 2.745 9.498 10.280 1.00 . A A . 7 ARG HH12 1 1 11 7052 1 1 7 ARG HH21 H 3.966 8.454 7.208 1.00 . A A . 7 ARG HH21 1 1 11 7053 1 1 7 ARG HH22 H 3.080 9.680 8.053 1.00 . A A . 7 ARG HH22 1 1 11 7054 1 1 7 ARG N N 2.331 3.443 11.929 1.00 . A A . 7 ARG N 1 1 11 7055 1 1 7 ARG NE N 4.409 7.040 9.186 1.00 . A A . 7 ARG NE 1 1 11 7056 1 1 7 ARG NH1 N 3.250 8.635 10.286 1.00 . A A . 7 ARG NH1 1 1 11 7057 1 1 7 ARG NH2 N 3.586 8.816 8.059 1.00 . A A . 7 ARG NH2 1 1 11 7058 1 1 7 ARG O O 5.199 2.512 13.910 1.00 . A A . 7 ARG O 1 1 11 7059 1 1 8 HIS C C 3.281 0.327 15.438 1.00 . A A . 8 HIS C 1 1 11 7060 1 1 8 HIS CA C 3.254 1.844 15.650 1.00 . A A . 8 HIS CA 1 1 11 7061 1 1 8 HIS CB C 2.051 2.255 16.510 1.00 . A A . 8 HIS CB 1 1 11 7062 1 1 8 HIS CD2 C 0.940 0.173 17.672 1.00 . A A . 8 HIS CD2 1 1 11 7063 1 1 8 HIS CE1 C 2.084 0.183 19.510 1.00 . A A . 8 HIS CE1 1 1 11 7064 1 1 8 HIS CG C 1.812 1.228 17.589 1.00 . A A . 8 HIS CG 1 1 11 7065 1 1 8 HIS H H 2.139 2.768 14.052 1.00 . A A . 8 HIS H 1 1 11 7066 1 1 8 HIS HA H 4.170 2.178 16.111 1.00 . A A . 8 HIS HA 1 1 11 7067 1 1 8 HIS HB2 H 2.247 3.214 16.965 1.00 . A A . 8 HIS HB2 1 1 11 7068 1 1 8 HIS HB3 H 1.173 2.328 15.885 1.00 . A A . 8 HIS HB3 1 1 11 7069 1 1 8 HIS HD1 H 3.239 1.846 19.029 1.00 . A A . 8 HIS HD1 1 1 11 7070 1 1 8 HIS HD2 H 0.226 -0.106 16.910 1.00 . A A . 8 HIS HD2 1 1 11 7071 1 1 8 HIS HE1 H 2.466 -0.075 20.488 1.00 . A A . 8 HIS HE1 1 1 11 7072 1 1 8 HIS N N 3.046 2.529 14.342 1.00 . A A . 8 HIS N 1 1 11 7073 1 1 8 HIS ND1 N 2.533 1.217 18.774 1.00 . A A . 8 HIS ND1 1 1 11 7074 1 1 8 HIS NE2 N 1.113 -0.487 18.884 1.00 . A A . 8 HIS NE2 1 1 11 7075 1 1 8 HIS O O 4.025 -0.389 16.081 1.00 . A A . 8 HIS O 1 1 11 7076 1 1 9 PHE C C 3.866 -2.165 14.110 1.00 . A A . 9 PHE C 1 1 11 7077 1 1 9 PHE CA C 2.442 -1.632 14.285 1.00 . A A . 9 PHE CA 1 1 11 7078 1 1 9 PHE CB C 1.641 -1.791 12.990 1.00 . A A . 9 PHE CB 1 1 11 7079 1 1 9 PHE CD1 C -0.261 -0.972 14.449 1.00 . A A . 9 PHE CD1 1 1 11 7080 1 1 9 PHE CD2 C -0.540 -0.944 12.041 1.00 . A A . 9 PHE CD2 1 1 11 7081 1 1 9 PHE CE1 C -1.552 -0.452 14.603 1.00 . A A . 9 PHE CE1 1 1 11 7082 1 1 9 PHE CE2 C -1.832 -0.427 12.197 1.00 . A A . 9 PHE CE2 1 1 11 7083 1 1 9 PHE CG C 0.247 -1.220 13.166 1.00 . A A . 9 PHE CG 1 1 11 7084 1 1 9 PHE CZ C -2.338 -0.181 13.477 1.00 . A A . 9 PHE CZ 1 1 11 7085 1 1 9 PHE H H 1.880 0.429 14.036 1.00 . A A . 9 PHE H 1 1 11 7086 1 1 9 PHE HA H 1.945 -2.145 15.092 1.00 . A A . 9 PHE HA 1 1 11 7087 1 1 9 PHE HB2 H 2.144 -1.267 12.191 1.00 . A A . 9 PHE HB2 1 1 11 7088 1 1 9 PHE HB3 H 1.568 -2.838 12.742 1.00 . A A . 9 PHE HB3 1 1 11 7089 1 1 9 PHE HD1 H 0.345 -1.178 15.318 1.00 . A A . 9 PHE HD1 1 1 11 7090 1 1 9 PHE HD2 H -0.151 -1.131 11.052 1.00 . A A . 9 PHE HD2 1 1 11 7091 1 1 9 PHE HE1 H -1.942 -0.263 15.590 1.00 . A A . 9 PHE HE1 1 1 11 7092 1 1 9 PHE HE2 H -2.438 -0.216 11.328 1.00 . A A . 9 PHE HE2 1 1 11 7093 1 1 9 PHE HZ H -3.334 0.220 13.598 1.00 . A A . 9 PHE HZ 1 1 11 7094 1 1 9 PHE N N 2.471 -0.166 14.541 1.00 . A A . 9 PHE N 1 1 11 7095 1 1 9 PHE O O 4.799 -1.415 13.897 1.00 . A A . 9 PHE O 1 1 11 7096 1 1 10 GLN C C 5.595 -4.558 12.610 1.00 . A A . 10 GLN C 1 1 11 7097 1 1 10 GLN CA C 5.404 -4.037 14.037 1.00 . A A . 10 GLN CA 1 1 11 7098 1 1 10 GLN CB C 5.467 -5.188 15.042 1.00 . A A . 10 GLN CB 1 1 11 7099 1 1 10 GLN CD C 7.146 -5.485 16.870 1.00 . A A . 10 GLN CD 1 1 11 7100 1 1 10 GLN CG C 5.948 -4.661 16.395 1.00 . A A . 10 GLN CG 1 1 11 7101 1 1 10 GLN H H 3.273 -4.039 14.370 1.00 . A A . 10 GLN H 1 1 11 7102 1 1 10 GLN HA H 6.157 -3.302 14.273 1.00 . A A . 10 GLN HA 1 1 11 7103 1 1 10 GLN HB2 H 4.486 -5.624 15.153 1.00 . A A . 10 GLN HB2 1 1 11 7104 1 1 10 GLN HB3 H 6.156 -5.940 14.686 1.00 . A A . 10 GLN HB3 1 1 11 7105 1 1 10 GLN HE21 H 6.263 -6.063 18.552 1.00 . A A . 10 GLN HE21 1 1 11 7106 1 1 10 GLN HE22 H 7.839 -6.650 18.321 1.00 . A A . 10 GLN HE22 1 1 11 7107 1 1 10 GLN HG2 H 6.241 -3.626 16.294 1.00 . A A . 10 GLN HG2 1 1 11 7108 1 1 10 GLN HG3 H 5.151 -4.740 17.117 1.00 . A A . 10 GLN HG3 1 1 11 7109 1 1 10 GLN N N 4.039 -3.454 14.198 1.00 . A A . 10 GLN N 1 1 11 7110 1 1 10 GLN NE2 N 7.077 -6.118 18.009 1.00 . A A . 10 GLN NE2 1 1 11 7111 1 1 10 GLN O O 6.206 -3.915 11.781 1.00 . A A . 10 GLN O 1 1 11 7112 1 1 10 GLN OE1 O 8.156 -5.555 16.197 1.00 . A A . 10 GLN OE1 1 1 11 7113 1 1 11 SER C C 4.209 -5.652 9.997 1.00 . A A . 11 SER C 1 1 11 7114 1 1 11 SER CA C 5.233 -6.282 10.946 1.00 . A A . 11 SER CA 1 1 11 7115 1 1 11 SER CB C 4.972 -7.780 11.101 1.00 . A A . 11 SER CB 1 1 11 7116 1 1 11 SER H H 4.590 -6.224 13.003 1.00 . A A . 11 SER H 1 1 11 7117 1 1 11 SER HA H 6.234 -6.118 10.583 1.00 . A A . 11 SER HA 1 1 11 7118 1 1 11 SER HB2 H 4.266 -7.944 11.897 1.00 . A A . 11 SER HB2 1 1 11 7119 1 1 11 SER HB3 H 4.567 -8.170 10.176 1.00 . A A . 11 SER HB3 1 1 11 7120 1 1 11 SER HG H 6.312 -8.406 12.366 1.00 . A A . 11 SER HG 1 1 11 7121 1 1 11 SER N N 5.079 -5.721 12.319 1.00 . A A . 11 SER N 1 1 11 7122 1 1 11 SER O O 3.536 -4.700 10.340 1.00 . A A . 11 SER O 1 1 11 7123 1 1 11 SER OG O 6.192 -8.439 11.414 1.00 . A A . 11 SER OG 1 1 11 7124 1 1 12 CYS C C 1.703 -6.156 8.121 1.00 . A A . 12 CYS C 1 1 11 7125 1 1 12 CYS CA C 3.103 -5.601 7.842 1.00 . A A . 12 CYS CA 1 1 11 7126 1 1 12 CYS CB C 3.599 -6.042 6.462 1.00 . A A . 12 CYS CB 1 1 11 7127 1 1 12 CYS H H 4.636 -6.942 8.548 1.00 . A A . 12 CYS H 1 1 11 7128 1 1 12 CYS HA H 3.103 -4.525 7.905 1.00 . A A . 12 CYS HA 1 1 11 7129 1 1 12 CYS HB2 H 3.077 -5.484 5.698 1.00 . A A . 12 CYS HB2 1 1 11 7130 1 1 12 CYS HB3 H 4.659 -5.851 6.384 1.00 . A A . 12 CYS HB3 1 1 11 7131 1 1 12 CYS N N 4.085 -6.175 8.807 1.00 . A A . 12 CYS N 1 1 11 7132 1 1 12 CYS O O 0.727 -5.745 7.522 1.00 . A A . 12 CYS O 1 1 11 7133 1 1 12 CYS SG S 3.287 -7.811 6.234 1.00 . A A . 12 CYS SG 1 1 11 7134 1 1 13 SER C C -0.744 -6.584 9.686 1.00 . A A . 13 SER C 1 1 11 7135 1 1 13 SER CA C 0.266 -7.683 9.343 1.00 . A A . 13 SER CA 1 1 11 7136 1 1 13 SER CB C 0.514 -8.578 10.557 1.00 . A A . 13 SER CB 1 1 11 7137 1 1 13 SER H H 2.398 -7.410 9.494 1.00 . A A . 13 SER H 1 1 11 7138 1 1 13 SER HA H -0.088 -8.276 8.516 1.00 . A A . 13 SER HA 1 1 11 7139 1 1 13 SER HB2 H 1.553 -8.531 10.836 1.00 . A A . 13 SER HB2 1 1 11 7140 1 1 13 SER HB3 H -0.094 -8.237 11.385 1.00 . A A . 13 SER HB3 1 1 11 7141 1 1 13 SER HG H -0.486 -9.897 9.536 1.00 . A A . 13 SER HG 1 1 11 7142 1 1 13 SER N N 1.598 -7.092 9.025 1.00 . A A . 13 SER N 1 1 11 7143 1 1 13 SER O O -1.759 -6.437 9.033 1.00 . A A . 13 SER O 1 1 11 7144 1 1 13 SER OG O 0.178 -9.919 10.228 1.00 . A A . 13 SER OG 1 1 11 7145 1 1 14 GLN C C -1.304 -3.543 10.124 1.00 . A A . 14 GLN C 1 1 11 7146 1 1 14 GLN CA C -1.432 -4.728 11.087 1.00 . A A . 14 GLN CA 1 1 11 7147 1 1 14 GLN CB C -1.019 -4.318 12.501 1.00 . A A . 14 GLN CB 1 1 11 7148 1 1 14 GLN CD C -2.584 -4.100 14.439 1.00 . A A . 14 GLN CD 1 1 11 7149 1 1 14 GLN CG C -2.121 -3.460 13.129 1.00 . A A . 14 GLN CG 1 1 11 7150 1 1 14 GLN H H 0.343 -5.946 11.222 1.00 . A A . 14 GLN H 1 1 11 7151 1 1 14 GLN HA H -2.444 -5.100 11.092 1.00 . A A . 14 GLN HA 1 1 11 7152 1 1 14 GLN HB2 H -0.866 -5.204 13.100 1.00 . A A . 14 GLN HB2 1 1 11 7153 1 1 14 GLN HB3 H -0.103 -3.749 12.457 1.00 . A A . 14 GLN HB3 1 1 11 7154 1 1 14 GLN HE21 H -2.908 -5.880 13.622 1.00 . A A . 14 GLN HE21 1 1 11 7155 1 1 14 GLN HE22 H -3.236 -5.772 15.284 1.00 . A A . 14 GLN HE22 1 1 11 7156 1 1 14 GLN HG2 H -1.735 -2.473 13.328 1.00 . A A . 14 GLN HG2 1 1 11 7157 1 1 14 GLN HG3 H -2.955 -3.391 12.448 1.00 . A A . 14 GLN HG3 1 1 11 7158 1 1 14 GLN N N -0.480 -5.811 10.705 1.00 . A A . 14 GLN N 1 1 11 7159 1 1 14 GLN NE2 N -2.939 -5.354 14.449 1.00 . A A . 14 GLN NE2 1 1 11 7160 1 1 14 GLN O O -2.268 -2.868 9.825 1.00 . A A . 14 GLN O 1 1 11 7161 1 1 14 GLN OE1 O -2.623 -3.450 15.465 1.00 . A A . 14 GLN OE1 1 1 11 7162 1 1 15 CYS C C -0.995 -2.181 7.595 1.00 . A A . 15 CYS C 1 1 11 7163 1 1 15 CYS CA C 0.070 -2.148 8.694 1.00 . A A . 15 CYS CA 1 1 11 7164 1 1 15 CYS CB C 1.458 -2.362 8.096 1.00 . A A . 15 CYS CB 1 1 11 7165 1 1 15 CYS H H 0.644 -3.847 9.891 1.00 . A A . 15 CYS H 1 1 11 7166 1 1 15 CYS HA H 0.038 -1.210 9.222 1.00 . A A . 15 CYS HA 1 1 11 7167 1 1 15 CYS HB2 H 1.637 -3.419 7.976 1.00 . A A . 15 CYS HB2 1 1 11 7168 1 1 15 CYS HB3 H 1.514 -1.876 7.132 1.00 . A A . 15 CYS HB3 1 1 11 7169 1 1 15 CYS N N -0.121 -3.288 9.637 1.00 . A A . 15 CYS N 1 1 11 7170 1 1 15 CYS O O -1.462 -1.155 7.141 1.00 . A A . 15 CYS O 1 1 11 7171 1 1 15 CYS SG S 2.708 -1.659 9.200 1.00 . A A . 15 CYS SG 1 1 11 7172 1 1 16 LEU C C -3.727 -3.977 6.635 1.00 . A A . 16 LEU C 1 1 11 7173 1 1 16 LEU CA C -2.407 -3.435 6.079 1.00 . A A . 16 LEU CA 1 1 11 7174 1 1 16 LEU CB C -1.822 -4.403 5.050 1.00 . A A . 16 LEU CB 1 1 11 7175 1 1 16 LEU CD1 C 0.399 -3.266 5.165 1.00 . A A . 16 LEU CD1 1 1 11 7176 1 1 16 LEU CD2 C -0.196 -4.639 3.169 1.00 . A A . 16 LEU CD2 1 1 11 7177 1 1 16 LEU CG C -0.741 -3.691 4.238 1.00 . A A . 16 LEU CG 1 1 11 7178 1 1 16 LEU H H -0.986 -4.168 7.529 1.00 . A A . 16 LEU H 1 1 11 7179 1 1 16 LEU HA H -2.559 -2.468 5.627 1.00 . A A . 16 LEU HA 1 1 11 7180 1 1 16 LEU HB2 H -1.392 -5.253 5.560 1.00 . A A . 16 LEU HB2 1 1 11 7181 1 1 16 LEU HB3 H -2.605 -4.739 4.387 1.00 . A A . 16 LEU HB3 1 1 11 7182 1 1 16 LEU HD11 H 1.328 -3.258 4.614 1.00 . A A . 16 LEU HD11 1 1 11 7183 1 1 16 LEU HD12 H 0.474 -3.963 5.987 1.00 . A A . 16 LEU HD12 1 1 11 7184 1 1 16 LEU HD13 H 0.201 -2.277 5.549 1.00 . A A . 16 LEU HD13 1 1 11 7185 1 1 16 LEU HD21 H 0.664 -5.164 3.556 1.00 . A A . 16 LEU HD21 1 1 11 7186 1 1 16 LEU HD22 H 0.092 -4.070 2.297 1.00 . A A . 16 LEU HD22 1 1 11 7187 1 1 16 LEU HD23 H -0.961 -5.352 2.897 1.00 . A A . 16 LEU HD23 1 1 11 7188 1 1 16 LEU HG H -1.163 -2.816 3.765 1.00 . A A . 16 LEU HG 1 1 11 7189 1 1 16 LEU N N -1.378 -3.350 7.156 1.00 . A A . 16 LEU N 1 1 11 7190 1 1 16 LEU O O -4.754 -3.909 5.990 1.00 . A A . 16 LEU O 1 1 11 7191 1 1 17 SER C C -5.712 -3.960 9.179 1.00 . A A . 17 SER C 1 1 11 7192 1 1 17 SER CA C -4.971 -5.056 8.409 1.00 . A A . 17 SER CA 1 1 11 7193 1 1 17 SER CB C -4.523 -6.169 9.355 1.00 . A A . 17 SER CB 1 1 11 7194 1 1 17 SER H H -2.874 -4.560 8.330 1.00 . A A . 17 SER H 1 1 11 7195 1 1 17 SER HA H -5.601 -5.463 7.634 1.00 . A A . 17 SER HA 1 1 11 7196 1 1 17 SER HB2 H -3.610 -5.880 9.848 1.00 . A A . 17 SER HB2 1 1 11 7197 1 1 17 SER HB3 H -5.293 -6.340 10.097 1.00 . A A . 17 SER HB3 1 1 11 7198 1 1 17 SER HG H -5.131 -7.824 8.530 1.00 . A A . 17 SER HG 1 1 11 7199 1 1 17 SER N N -3.711 -4.513 7.823 1.00 . A A . 17 SER N 1 1 11 7200 1 1 17 SER O O -6.825 -4.149 9.628 1.00 . A A . 17 SER O 1 1 11 7201 1 1 17 SER OG O -4.295 -7.358 8.608 1.00 . A A . 17 SER OG 1 1 11 7202 1 1 18 ALA C C -5.433 -0.359 9.440 1.00 . A A . 18 ALA C 1 1 11 7203 1 1 18 ALA CA C -5.780 -1.709 10.072 1.00 . A A . 18 ALA CA 1 1 11 7204 1 1 18 ALA CB C -5.233 -1.791 11.496 1.00 . A A . 18 ALA CB 1 1 11 7205 1 1 18 ALA H H -4.209 -2.682 8.962 1.00 . A A . 18 ALA H 1 1 11 7206 1 1 18 ALA HA H -6.848 -1.858 10.079 1.00 . A A . 18 ALA HA 1 1 11 7207 1 1 18 ALA HB1 H -4.391 -2.465 11.519 1.00 . A A . 18 ALA HB1 1 1 11 7208 1 1 18 ALA HB2 H -6.006 -2.157 12.156 1.00 . A A . 18 ALA HB2 1 1 11 7209 1 1 18 ALA HB3 H -4.920 -0.809 11.817 1.00 . A A . 18 ALA HB3 1 1 11 7210 1 1 18 ALA N N -5.106 -2.815 9.333 1.00 . A A . 18 ALA N 1 1 11 7211 1 1 18 ALA O O -4.997 0.552 10.115 1.00 . A A . 18 ALA O 1 1 11 7212 1 1 19 PRO C C -6.403 2.081 7.662 1.00 . A A . 19 PRO C 1 1 11 7213 1 1 19 PRO CA C -5.362 0.965 7.404 1.00 . A A . 19 PRO CA 1 1 11 7214 1 1 19 PRO CB C -5.388 0.518 5.944 1.00 . A A . 19 PRO CB 1 1 11 7215 1 1 19 PRO CD C -6.159 -1.348 7.283 1.00 . A A . 19 PRO CD 1 1 11 7216 1 1 19 PRO CG C -6.240 -0.711 5.917 1.00 . A A . 19 PRO CG 1 1 11 7217 1 1 19 PRO HA H -4.375 1.323 7.646 1.00 . A A . 19 PRO HA 1 1 11 7218 1 1 19 PRO HB2 H -5.822 1.291 5.324 1.00 . A A . 19 PRO HB2 1 1 11 7219 1 1 19 PRO HB3 H -4.390 0.283 5.607 1.00 . A A . 19 PRO HB3 1 1 11 7220 1 1 19 PRO HD2 H -7.139 -1.669 7.609 1.00 . A A . 19 PRO HD2 1 1 11 7221 1 1 19 PRO HD3 H -5.472 -2.179 7.271 1.00 . A A . 19 PRO HD3 1 1 11 7222 1 1 19 PRO HG2 H -7.262 -0.447 5.685 1.00 . A A . 19 PRO HG2 1 1 11 7223 1 1 19 PRO HG3 H -5.864 -1.401 5.177 1.00 . A A . 19 PRO HG3 1 1 11 7224 1 1 19 PRO N N -5.646 -0.281 8.154 1.00 . A A . 19 PRO N 1 1 11 7225 1 1 19 PRO O O -6.068 3.244 7.549 1.00 . A A . 19 PRO O 1 1 11 7226 1 1 20 PRO C C -8.423 3.460 9.581 1.00 . A A . 20 PRO C 1 1 11 7227 1 1 20 PRO CA C -8.657 2.776 8.232 1.00 . A A . 20 PRO CA 1 1 11 7228 1 1 20 PRO CB C -9.973 2.006 8.231 1.00 . A A . 20 PRO CB 1 1 11 7229 1 1 20 PRO CD C -8.187 0.377 8.163 1.00 . A A . 20 PRO CD 1 1 11 7230 1 1 20 PRO CG C -9.608 0.606 8.603 1.00 . A A . 20 PRO CG 1 1 11 7231 1 1 20 PRO HA H -8.654 3.502 7.433 1.00 . A A . 20 PRO HA 1 1 11 7232 1 1 20 PRO HB2 H -10.653 2.426 8.960 1.00 . A A . 20 PRO HB2 1 1 11 7233 1 1 20 PRO HB3 H -10.418 2.023 7.248 1.00 . A A . 20 PRO HB3 1 1 11 7234 1 1 20 PRO HD2 H -7.652 -0.162 8.928 1.00 . A A . 20 PRO HD2 1 1 11 7235 1 1 20 PRO HD3 H -8.164 -0.160 7.232 1.00 . A A . 20 PRO HD3 1 1 11 7236 1 1 20 PRO HG2 H -9.687 0.477 9.675 1.00 . A A . 20 PRO HG2 1 1 11 7237 1 1 20 PRO HG3 H -10.260 -0.091 8.099 1.00 . A A . 20 PRO HG3 1 1 11 7238 1 1 20 PRO N N -7.632 1.728 7.988 1.00 . A A . 20 PRO N 1 1 11 7239 1 1 20 PRO O O -8.745 4.617 9.765 1.00 . A A . 20 PRO O 1 1 11 7240 1 1 21 PHE C C -6.190 3.942 11.911 1.00 . A A . 21 PHE C 1 1 11 7241 1 1 21 PHE CA C -7.610 3.374 11.858 1.00 . A A . 21 PHE CA 1 1 11 7242 1 1 21 PHE CB C -7.770 2.232 12.863 1.00 . A A . 21 PHE CB 1 1 11 7243 1 1 21 PHE CD1 C -10.240 2.126 12.379 1.00 . A A . 21 PHE CD1 1 1 11 7244 1 1 21 PHE CD2 C -8.971 0.060 12.412 1.00 . A A . 21 PHE CD2 1 1 11 7245 1 1 21 PHE CE1 C -11.404 1.407 12.083 1.00 . A A . 21 PHE CE1 1 1 11 7246 1 1 21 PHE CE2 C -10.135 -0.660 12.116 1.00 . A A . 21 PHE CE2 1 1 11 7247 1 1 21 PHE CG C -9.024 1.453 12.543 1.00 . A A . 21 PHE CG 1 1 11 7248 1 1 21 PHE CZ C -11.352 0.013 11.952 1.00 . A A . 21 PHE CZ 1 1 11 7249 1 1 21 PHE H H -7.609 1.826 10.358 1.00 . A A . 21 PHE H 1 1 11 7250 1 1 21 PHE HA H -8.334 4.147 12.061 1.00 . A A . 21 PHE HA 1 1 11 7251 1 1 21 PHE HB2 H -6.911 1.576 12.803 1.00 . A A . 21 PHE HB2 1 1 11 7252 1 1 21 PHE HB3 H -7.843 2.637 13.860 1.00 . A A . 21 PHE HB3 1 1 11 7253 1 1 21 PHE HD1 H -10.281 3.200 12.480 1.00 . A A . 21 PHE HD1 1 1 11 7254 1 1 21 PHE HD2 H -8.033 -0.459 12.538 1.00 . A A . 21 PHE HD2 1 1 11 7255 1 1 21 PHE HE1 H -12.342 1.926 11.958 1.00 . A A . 21 PHE HE1 1 1 11 7256 1 1 21 PHE HE2 H -10.095 -1.735 12.015 1.00 . A A . 21 PHE HE2 1 1 11 7257 1 1 21 PHE HZ H -12.250 -0.542 11.725 1.00 . A A . 21 PHE HZ 1 1 11 7258 1 1 21 PHE N N -7.863 2.757 10.526 1.00 . A A . 21 PHE N 1 1 11 7259 1 1 21 PHE O O -5.663 4.226 12.970 1.00 . A A . 21 PHE O 1 1 11 7260 1 1 22 VAL C C -3.960 5.515 9.514 1.00 . A A . 22 VAL C 1 1 11 7261 1 1 22 VAL CA C -4.181 4.658 10.764 1.00 . A A . 22 VAL CA 1 1 11 7262 1 1 22 VAL CB C -3.268 3.434 10.745 1.00 . A A . 22 VAL CB 1 1 11 7263 1 1 22 VAL CG1 C -3.674 2.468 11.862 1.00 . A A . 22 VAL CG1 1 1 11 7264 1 1 22 VAL CG2 C -3.391 2.729 9.392 1.00 . A A . 22 VAL CG2 1 1 11 7265 1 1 22 VAL H H -6.009 3.875 9.936 1.00 . A A . 22 VAL H 1 1 11 7266 1 1 22 VAL HA H -3.998 5.239 11.654 1.00 . A A . 22 VAL HA 1 1 11 7267 1 1 22 VAL HB H -2.247 3.750 10.899 1.00 . A A . 22 VAL HB 1 1 11 7268 1 1 22 VAL HG11 H -3.024 1.607 11.846 1.00 . A A . 22 VAL HG11 1 1 11 7269 1 1 22 VAL HG12 H -4.696 2.152 11.711 1.00 . A A . 22 VAL HG12 1 1 11 7270 1 1 22 VAL HG13 H -3.589 2.966 12.817 1.00 . A A . 22 VAL HG13 1 1 11 7271 1 1 22 VAL HG21 H -2.614 3.081 8.729 1.00 . A A . 22 VAL HG21 1 1 11 7272 1 1 22 VAL HG22 H -4.357 2.943 8.961 1.00 . A A . 22 VAL HG22 1 1 11 7273 1 1 22 VAL HG23 H -3.288 1.662 9.531 1.00 . A A . 22 VAL HG23 1 1 11 7274 1 1 22 VAL N N -5.566 4.109 10.778 1.00 . A A . 22 VAL N 1 1 11 7275 1 1 22 VAL O O -4.893 6.027 8.927 1.00 . A A . 22 VAL O 1 1 11 7276 1 1 23 GLN C C -1.187 6.013 7.181 1.00 . A A . 23 GLN C 1 1 11 7277 1 1 23 GLN CA C -2.450 6.514 7.899 1.00 . A A . 23 GLN CA 1 1 11 7278 1 1 23 GLN CB C -2.248 7.932 8.455 1.00 . A A . 23 GLN CB 1 1 11 7279 1 1 23 GLN CD C -0.977 10.073 8.234 1.00 . A A . 23 GLN CD 1 1 11 7280 1 1 23 GLN CG C -1.296 8.738 7.560 1.00 . A A . 23 GLN CG 1 1 11 7281 1 1 23 GLN H H -1.992 5.265 9.596 1.00 . A A . 23 GLN H 1 1 11 7282 1 1 23 GLN HA H -3.295 6.500 7.228 1.00 . A A . 23 GLN HA 1 1 11 7283 1 1 23 GLN HB2 H -3.203 8.435 8.502 1.00 . A A . 23 GLN HB2 1 1 11 7284 1 1 23 GLN HB3 H -1.831 7.867 9.449 1.00 . A A . 23 GLN HB3 1 1 11 7285 1 1 23 GLN HE21 H 0.507 9.327 9.323 1.00 . A A . 23 GLN HE21 1 1 11 7286 1 1 23 GLN HE22 H 0.208 10.982 9.544 1.00 . A A . 23 GLN HE22 1 1 11 7287 1 1 23 GLN HG2 H -0.381 8.183 7.413 1.00 . A A . 23 GLN HG2 1 1 11 7288 1 1 23 GLN HG3 H -1.763 8.921 6.605 1.00 . A A . 23 GLN HG3 1 1 11 7289 1 1 23 GLN N N -2.730 5.682 9.105 1.00 . A A . 23 GLN N 1 1 11 7290 1 1 23 GLN NE2 N -0.007 10.132 9.106 1.00 . A A . 23 GLN NE2 1 1 11 7291 1 1 23 GLN O O -1.099 6.044 5.970 1.00 . A A . 23 GLN O 1 1 11 7292 1 1 23 GLN OE1 O -1.615 11.072 7.965 1.00 . A A . 23 GLN OE1 1 1 11 7293 1 1 24 CYS C C 0.768 3.834 6.427 1.00 . A A . 24 CYS C 1 1 11 7294 1 1 24 CYS CA C 1.051 5.081 7.276 1.00 . A A . 24 CYS CA 1 1 11 7295 1 1 24 CYS CB C 2.005 4.807 8.462 1.00 . A A . 24 CYS CB 1 1 11 7296 1 1 24 CYS H H -0.293 5.557 8.896 1.00 . A A . 24 CYS H 1 1 11 7297 1 1 24 CYS HA H 1.466 5.860 6.651 1.00 . A A . 24 CYS HA 1 1 11 7298 1 1 24 CYS HB2 H 2.866 5.453 8.372 1.00 . A A . 24 CYS HB2 1 1 11 7299 1 1 24 CYS HB3 H 1.495 5.040 9.384 1.00 . A A . 24 CYS HB3 1 1 11 7300 1 1 24 CYS N N -0.207 5.565 7.919 1.00 . A A . 24 CYS N 1 1 11 7301 1 1 24 CYS O O -0.313 3.281 6.452 1.00 . A A . 24 CYS O 1 1 11 7302 1 1 24 CYS SG S 2.578 3.082 8.512 1.00 . A A . 24 CYS SG 1 1 11 7303 1 1 25 GLY C C 2.861 1.479 4.612 1.00 . A A . 25 GLY C 1 1 11 7304 1 1 25 GLY CA C 1.533 2.212 4.789 1.00 . A A . 25 GLY CA 1 1 11 7305 1 1 25 GLY H H 2.594 3.877 5.648 1.00 . A A . 25 GLY H 1 1 11 7306 1 1 25 GLY HA2 H 0.813 1.550 5.247 1.00 . A A . 25 GLY HA2 1 1 11 7307 1 1 25 GLY HA3 H 1.170 2.528 3.824 1.00 . A A . 25 GLY HA3 1 1 11 7308 1 1 25 GLY N N 1.734 3.404 5.661 1.00 . A A . 25 GLY N 1 1 11 7309 1 1 25 GLY O O 3.869 1.860 5.170 1.00 . A A . 25 GLY O 1 1 11 7310 1 1 26 TRP C C 4.900 0.264 2.452 1.00 . A A . 26 TRP C 1 1 11 7311 1 1 26 TRP CA C 4.136 -0.330 3.637 1.00 . A A . 26 TRP CA 1 1 11 7312 1 1 26 TRP CB C 3.680 -1.755 3.321 1.00 . A A . 26 TRP CB 1 1 11 7313 1 1 26 TRP CD1 C 5.565 -3.334 2.738 1.00 . A A . 26 TRP CD1 1 1 11 7314 1 1 26 TRP CD2 C 5.186 -3.215 4.950 1.00 . A A . 26 TRP CD2 1 1 11 7315 1 1 26 TRP CE2 C 6.251 -4.128 4.771 1.00 . A A . 26 TRP CE2 1 1 11 7316 1 1 26 TRP CE3 C 4.748 -2.956 6.259 1.00 . A A . 26 TRP CE3 1 1 11 7317 1 1 26 TRP CG C 4.768 -2.725 3.646 1.00 . A A . 26 TRP CG 1 1 11 7318 1 1 26 TRP CH2 C 6.409 -4.496 7.150 1.00 . A A . 26 TRP CH2 1 1 11 7319 1 1 26 TRP CZ2 C 6.858 -4.764 5.854 1.00 . A A . 26 TRP CZ2 1 1 11 7320 1 1 26 TRP CZ3 C 5.355 -3.593 7.352 1.00 . A A . 26 TRP CZ3 1 1 11 7321 1 1 26 TRP H H 2.045 0.133 3.402 1.00 . A A . 26 TRP H 1 1 11 7322 1 1 26 TRP HA H 4.739 -0.317 4.529 1.00 . A A . 26 TRP HA 1 1 11 7323 1 1 26 TRP HB2 H 2.805 -1.989 3.910 1.00 . A A . 26 TRP HB2 1 1 11 7324 1 1 26 TRP HB3 H 3.436 -1.829 2.274 1.00 . A A . 26 TRP HB3 1 1 11 7325 1 1 26 TRP HD1 H 5.520 -3.192 1.669 1.00 . A A . 26 TRP HD1 1 1 11 7326 1 1 26 TRP HE1 H 7.130 -4.723 2.978 1.00 . A A . 26 TRP HE1 1 1 11 7327 1 1 26 TRP HE3 H 3.939 -2.261 6.423 1.00 . A A . 26 TRP HE3 1 1 11 7328 1 1 26 TRP HH2 H 6.873 -4.982 7.995 1.00 . A A . 26 TRP HH2 1 1 11 7329 1 1 26 TRP HZ2 H 7.669 -5.458 5.692 1.00 . A A . 26 TRP HZ2 1 1 11 7330 1 1 26 TRP HZ3 H 5.009 -3.389 8.354 1.00 . A A . 26 TRP HZ3 1 1 11 7331 1 1 26 TRP N N 2.870 0.427 3.844 1.00 . A A . 26 TRP N 1 1 11 7332 1 1 26 TRP NE1 N 6.446 -4.167 3.405 1.00 . A A . 26 TRP NE1 1 1 11 7333 1 1 26 TRP O O 4.325 0.574 1.427 1.00 . A A . 26 TRP O 1 1 11 7334 1 1 27 CYS C C 8.255 0.263 1.194 1.00 . A A . 27 CYS C 1 1 11 7335 1 1 27 CYS CA C 6.964 1.045 1.462 1.00 . A A . 27 CYS CA 1 1 11 7336 1 1 27 CYS CB C 7.286 2.465 1.929 1.00 . A A . 27 CYS CB 1 1 11 7337 1 1 27 CYS H H 6.636 0.207 3.423 1.00 . A A . 27 CYS H 1 1 11 7338 1 1 27 CYS HA H 6.359 1.085 0.570 1.00 . A A . 27 CYS HA 1 1 11 7339 1 1 27 CYS HB2 H 6.424 2.884 2.428 1.00 . A A . 27 CYS HB2 1 1 11 7340 1 1 27 CYS HB3 H 8.120 2.438 2.614 1.00 . A A . 27 CYS HB3 1 1 11 7341 1 1 27 CYS N N 6.188 0.448 2.586 1.00 . A A . 27 CYS N 1 1 11 7342 1 1 27 CYS O O 9.259 0.451 1.851 1.00 . A A . 27 CYS O 1 1 11 7343 1 1 27 CYS SG S 7.713 3.492 0.501 1.00 . A A . 27 CYS SG 1 1 11 7344 1 1 28 HIS C C 9.977 -2.305 0.940 1.00 . A A . 28 HIS C 1 1 11 7345 1 1 28 HIS CA C 9.446 -1.385 -0.180 1.00 . A A . 28 HIS CA 1 1 11 7346 1 1 28 HIS CB C 10.500 -0.336 -0.542 1.00 . A A . 28 HIS CB 1 1 11 7347 1 1 28 HIS CD2 C 9.158 0.964 -2.389 1.00 . A A . 28 HIS CD2 1 1 11 7348 1 1 28 HIS CE1 C 10.511 0.638 -4.050 1.00 . A A . 28 HIS CE1 1 1 11 7349 1 1 28 HIS CG C 10.205 0.218 -1.908 1.00 . A A . 28 HIS CG 1 1 11 7350 1 1 28 HIS H H 7.408 -0.696 -0.314 1.00 . A A . 28 HIS H 1 1 11 7351 1 1 28 HIS HA H 9.227 -1.974 -1.055 1.00 . A A . 28 HIS HA 1 1 11 7352 1 1 28 HIS HB2 H 10.482 0.464 0.181 1.00 . A A . 28 HIS HB2 1 1 11 7353 1 1 28 HIS HB3 H 11.478 -0.795 -0.546 1.00 . A A . 28 HIS HB3 1 1 11 7354 1 1 28 HIS HD1 H 11.900 -0.474 -2.971 1.00 . A A . 28 HIS HD1 1 1 11 7355 1 1 28 HIS HD2 H 8.312 1.298 -1.807 1.00 . A A . 28 HIS HD2 1 1 11 7356 1 1 28 HIS HE1 H 10.956 0.652 -5.034 1.00 . A A . 28 HIS HE1 1 1 11 7357 1 1 28 HIS N N 8.232 -0.591 0.205 1.00 . A A . 28 HIS N 1 1 11 7358 1 1 28 HIS ND1 N 11.055 0.022 -2.985 1.00 . A A . 28 HIS ND1 1 1 11 7359 1 1 28 HIS NE2 N 9.353 1.228 -3.742 1.00 . A A . 28 HIS NE2 1 1 11 7360 1 1 28 HIS O O 10.828 -3.132 0.685 1.00 . A A . 28 HIS O 1 1 11 7361 1 1 29 ASP C C 9.498 -2.706 4.608 1.00 . A A . 29 ASP C 1 1 11 7362 1 1 29 ASP CA C 10.035 -3.102 3.232 1.00 . A A . 29 ASP CA 1 1 11 7363 1 1 29 ASP CB C 11.556 -2.918 3.212 1.00 . A A . 29 ASP CB 1 1 11 7364 1 1 29 ASP CG C 11.890 -1.426 3.176 1.00 . A A . 29 ASP CG 1 1 11 7365 1 1 29 ASP H H 8.819 -1.541 2.372 1.00 . A A . 29 ASP H 1 1 11 7366 1 1 29 ASP HA H 9.789 -4.128 3.012 1.00 . A A . 29 ASP HA 1 1 11 7367 1 1 29 ASP HB2 H 11.978 -3.359 4.105 1.00 . A A . 29 ASP HB2 1 1 11 7368 1 1 29 ASP HB3 H 11.973 -3.402 2.346 1.00 . A A . 29 ASP HB3 1 1 11 7369 1 1 29 ASP N N 9.507 -2.197 2.160 1.00 . A A . 29 ASP N 1 1 11 7370 1 1 29 ASP O O 9.047 -3.538 5.369 1.00 . A A . 29 ASP O 1 1 11 7371 1 1 29 ASP OD1 O 11.679 -0.814 2.142 1.00 . A A . 29 ASP OD1 1 1 11 7372 1 1 29 ASP OD2 O 12.352 -0.920 4.185 1.00 . A A . 29 ASP OD2 1 1 11 7373 1 1 30 LYS C C 7.727 -0.326 6.196 1.00 . A A . 30 LYS C 1 1 11 7374 1 1 30 LYS CA C 9.086 -1.019 6.293 1.00 . A A . 30 LYS CA 1 1 11 7375 1 1 30 LYS CB C 10.151 -0.043 6.792 1.00 . A A . 30 LYS CB 1 1 11 7376 1 1 30 LYS CD C 9.924 1.418 8.810 1.00 . A A . 30 LYS CD 1 1 11 7377 1 1 30 LYS CE C 11.018 1.799 9.813 1.00 . A A . 30 LYS CE 1 1 11 7378 1 1 30 LYS CG C 10.147 -0.017 8.323 1.00 . A A . 30 LYS CG 1 1 11 7379 1 1 30 LYS H H 9.955 -0.795 4.332 1.00 . A A . 30 LYS H 1 1 11 7380 1 1 30 LYS HA H 9.025 -1.865 6.958 1.00 . A A . 30 LYS HA 1 1 11 7381 1 1 30 LYS HB2 H 11.122 -0.360 6.440 1.00 . A A . 30 LYS HB2 1 1 11 7382 1 1 30 LYS HB3 H 9.938 0.946 6.417 1.00 . A A . 30 LYS HB3 1 1 11 7383 1 1 30 LYS HD2 H 9.959 2.091 7.966 1.00 . A A . 30 LYS HD2 1 1 11 7384 1 1 30 LYS HD3 H 8.958 1.490 9.287 1.00 . A A . 30 LYS HD3 1 1 11 7385 1 1 30 LYS HE2 H 11.895 1.186 9.661 1.00 . A A . 30 LYS HE2 1 1 11 7386 1 1 30 LYS HE3 H 11.268 2.844 9.718 1.00 . A A . 30 LYS HE3 1 1 11 7387 1 1 30 LYS HG2 H 9.351 -0.651 8.690 1.00 . A A . 30 LYS HG2 1 1 11 7388 1 1 30 LYS HG3 H 11.095 -0.378 8.691 1.00 . A A . 30 LYS HG3 1 1 11 7389 1 1 30 LYS HZ1 H 10.741 2.272 11.822 1.00 . A A . 30 LYS HZ1 1 1 11 7390 1 1 30 LYS HZ2 H 10.737 0.605 11.496 1.00 . A A . 30 LYS HZ2 1 1 11 7391 1 1 30 LYS HZ3 H 9.389 1.556 11.090 1.00 . A A . 30 LYS HZ3 1 1 11 7392 1 1 30 LYS N N 9.567 -1.451 4.949 1.00 . A A . 30 LYS N 1 1 11 7393 1 1 30 LYS NZ N 10.426 1.538 11.156 1.00 . A A . 30 LYS NZ 1 1 11 7394 1 1 30 LYS O O 7.236 -0.036 5.123 1.00 . A A . 30 LYS O 1 1 11 7395 1 1 31 CYS C C 5.977 2.136 7.393 1.00 . A A . 31 CYS C 1 1 11 7396 1 1 31 CYS CA C 5.795 0.617 7.315 1.00 . A A . 31 CYS CA 1 1 11 7397 1 1 31 CYS CB C 5.087 0.094 8.564 1.00 . A A . 31 CYS CB 1 1 11 7398 1 1 31 CYS H H 7.540 -0.302 8.171 1.00 . A A . 31 CYS H 1 1 11 7399 1 1 31 CYS HA H 5.236 0.346 6.433 1.00 . A A . 31 CYS HA 1 1 11 7400 1 1 31 CYS HB2 H 5.452 -0.895 8.798 1.00 . A A . 31 CYS HB2 1 1 11 7401 1 1 31 CYS HB3 H 5.285 0.757 9.394 1.00 . A A . 31 CYS HB3 1 1 11 7402 1 1 31 CYS N N 7.121 -0.059 7.320 1.00 . A A . 31 CYS N 1 1 11 7403 1 1 31 CYS O O 6.283 2.683 8.433 1.00 . A A . 31 CYS O 1 1 11 7404 1 1 31 CYS SG S 3.306 0.023 8.257 1.00 . A A . 31 CYS SG 1 1 11 7405 1 1 32 VAL C C 4.971 4.922 5.298 1.00 . A A . 32 VAL C 1 1 11 7406 1 1 32 VAL CA C 5.950 4.297 6.297 1.00 . A A . 32 VAL CA 1 1 11 7407 1 1 32 VAL CB C 7.394 4.538 5.852 1.00 . A A . 32 VAL CB 1 1 11 7408 1 1 32 VAL CG1 C 8.329 3.577 6.591 1.00 . A A . 32 VAL CG1 1 1 11 7409 1 1 32 VAL CG2 C 7.509 4.302 4.343 1.00 . A A . 32 VAL CG2 1 1 11 7410 1 1 32 VAL H H 5.545 2.352 5.471 1.00 . A A . 32 VAL H 1 1 11 7411 1 1 32 VAL HA H 5.794 4.697 7.286 1.00 . A A . 32 VAL HA 1 1 11 7412 1 1 32 VAL HB H 7.674 5.556 6.081 1.00 . A A . 32 VAL HB 1 1 11 7413 1 1 32 VAL HG11 H 8.162 2.570 6.239 1.00 . A A . 32 VAL HG11 1 1 11 7414 1 1 32 VAL HG12 H 8.129 3.625 7.651 1.00 . A A . 32 VAL HG12 1 1 11 7415 1 1 32 VAL HG13 H 9.355 3.859 6.406 1.00 . A A . 32 VAL HG13 1 1 11 7416 1 1 32 VAL HG21 H 6.911 5.033 3.819 1.00 . A A . 32 VAL HG21 1 1 11 7417 1 1 32 VAL HG22 H 7.153 3.311 4.106 1.00 . A A . 32 VAL HG22 1 1 11 7418 1 1 32 VAL HG23 H 8.541 4.398 4.041 1.00 . A A . 32 VAL HG23 1 1 11 7419 1 1 32 VAL N N 5.789 2.816 6.299 1.00 . A A . 32 VAL N 1 1 11 7420 1 1 32 VAL O O 4.275 4.230 4.583 1.00 . A A . 32 VAL O 1 1 11 7421 1 1 33 ARG C C 4.771 7.786 3.322 1.00 . A A . 33 ARG C 1 1 11 7422 1 1 33 ARG CA C 3.989 6.875 4.270 1.00 . A A . 33 ARG CA 1 1 11 7423 1 1 33 ARG CB C 3.000 7.682 5.113 1.00 . A A . 33 ARG CB 1 1 11 7424 1 1 33 ARG CD C 1.050 9.052 4.355 1.00 . A A . 33 ARG CD 1 1 11 7425 1 1 33 ARG CG C 1.628 7.639 4.439 1.00 . A A . 33 ARG CG 1 1 11 7426 1 1 33 ARG CZ C -0.141 9.691 2.346 1.00 . A A . 33 ARG CZ 1 1 11 7427 1 1 33 ARG H H 5.488 6.771 5.816 1.00 . A A . 33 ARG H 1 1 11 7428 1 1 33 ARG HA H 3.458 6.124 3.706 1.00 . A A . 33 ARG HA 1 1 11 7429 1 1 33 ARG HB2 H 2.934 7.251 6.102 1.00 . A A . 33 ARG HB2 1 1 11 7430 1 1 33 ARG HB3 H 3.332 8.706 5.185 1.00 . A A . 33 ARG HB3 1 1 11 7431 1 1 33 ARG HD2 H 0.706 9.377 5.328 1.00 . A A . 33 ARG HD2 1 1 11 7432 1 1 33 ARG HD3 H 1.785 9.739 3.964 1.00 . A A . 33 ARG HD3 1 1 11 7433 1 1 33 ARG HE H -0.811 8.291 3.584 1.00 . A A . 33 ARG HE 1 1 11 7434 1 1 33 ARG HG2 H 1.731 7.233 3.443 1.00 . A A . 33 ARG HG2 1 1 11 7435 1 1 33 ARG HG3 H 0.964 7.014 5.014 1.00 . A A . 33 ARG HG3 1 1 11 7436 1 1 33 ARG HH11 H 1.549 8.957 1.560 1.00 . A A . 33 ARG HH11 1 1 11 7437 1 1 33 ARG HH12 H 0.758 10.182 0.625 1.00 . A A . 33 ARG HH12 1 1 11 7438 1 1 33 ARG HH21 H -1.842 10.602 2.882 1.00 . A A . 33 ARG HH21 1 1 11 7439 1 1 33 ARG HH22 H -1.163 11.112 1.372 1.00 . A A . 33 ARG HH22 1 1 11 7440 1 1 33 ARG N N 4.915 6.224 5.237 1.00 . A A . 33 ARG N 1 1 11 7441 1 1 33 ARG NE N -0.094 8.936 3.409 1.00 . A A . 33 ARG NE 1 1 11 7442 1 1 33 ARG NH1 N 0.794 9.603 1.440 1.00 . A A . 33 ARG NH1 1 1 11 7443 1 1 33 ARG NH2 N -1.125 10.534 2.188 1.00 . A A . 33 ARG NH2 1 1 11 7444 1 1 33 ARG O O 5.966 7.961 3.451 1.00 . A A . 33 ARG O 1 1 11 7445 1 1 34 SER C C 5.656 10.299 2.088 1.00 . A A . 34 SER C 1 1 11 7446 1 1 34 SER CA C 4.793 9.244 1.380 1.00 . A A . 34 SER CA 1 1 11 7447 1 1 34 SER CB C 3.666 9.918 0.600 1.00 . A A . 34 SER CB 1 1 11 7448 1 1 34 SER H H 3.138 8.184 2.275 1.00 . A A . 34 SER H 1 1 11 7449 1 1 34 SER HA H 5.399 8.657 0.709 1.00 . A A . 34 SER HA 1 1 11 7450 1 1 34 SER HB2 H 3.239 9.216 -0.098 1.00 . A A . 34 SER HB2 1 1 11 7451 1 1 34 SER HB3 H 2.900 10.248 1.289 1.00 . A A . 34 SER HB3 1 1 11 7452 1 1 34 SER HG H 4.449 10.726 -0.988 1.00 . A A . 34 SER HG 1 1 11 7453 1 1 34 SER N N 4.102 8.353 2.361 1.00 . A A . 34 SER N 1 1 11 7454 1 1 34 SER O O 6.510 10.912 1.480 1.00 . A A . 34 SER O 1 1 11 7455 1 1 34 SER OG O 4.189 11.030 -0.115 1.00 . A A . 34 SER OG 1 1 11 7456 1 1 35 GLU C C 7.450 10.929 4.781 1.00 . A A . 35 GLU C 1 1 11 7457 1 1 35 GLU CA C 6.253 11.565 4.063 1.00 . A A . 35 GLU CA 1 1 11 7458 1 1 35 GLU CB C 5.296 12.201 5.070 1.00 . A A . 35 GLU CB 1 1 11 7459 1 1 35 GLU CD C 4.442 14.388 5.926 1.00 . A A . 35 GLU CD 1 1 11 7460 1 1 35 GLU CG C 5.166 13.696 4.771 1.00 . A A . 35 GLU CG 1 1 11 7461 1 1 35 GLU H H 4.740 10.044 3.834 1.00 . A A . 35 GLU H 1 1 11 7462 1 1 35 GLU HA H 6.595 12.312 3.364 1.00 . A A . 35 GLU HA 1 1 11 7463 1 1 35 GLU HB2 H 4.327 11.731 4.991 1.00 . A A . 35 GLU HB2 1 1 11 7464 1 1 35 GLU HB3 H 5.682 12.068 6.070 1.00 . A A . 35 GLU HB3 1 1 11 7465 1 1 35 GLU HG2 H 6.150 14.127 4.651 1.00 . A A . 35 GLU HG2 1 1 11 7466 1 1 35 GLU HG3 H 4.600 13.832 3.862 1.00 . A A . 35 GLU HG3 1 1 11 7467 1 1 35 GLU N N 5.439 10.532 3.355 1.00 . A A . 35 GLU N 1 1 11 7468 1 1 35 GLU O O 8.295 11.620 5.315 1.00 . A A . 35 GLU O 1 1 11 7469 1 1 35 GLU OE1 O 3.223 14.427 5.897 1.00 . A A . 35 GLU OE1 1 1 11 7470 1 1 35 GLU OE2 O 5.119 14.867 6.822 1.00 . A A . 35 GLU OE2 1 1 11 7471 1 1 36 GLU C C 9.538 8.193 4.478 1.00 . A A . 36 GLU C 1 1 11 7472 1 1 36 GLU CA C 8.689 8.974 5.486 1.00 . A A . 36 GLU CA 1 1 11 7473 1 1 36 GLU CB C 8.067 8.029 6.516 1.00 . A A . 36 GLU CB 1 1 11 7474 1 1 36 GLU CD C 7.027 8.100 8.786 1.00 . A A . 36 GLU CD 1 1 11 7475 1 1 36 GLU CG C 8.136 8.672 7.902 1.00 . A A . 36 GLU CG 1 1 11 7476 1 1 36 GLU H H 6.848 9.081 4.362 1.00 . A A . 36 GLU H 1 1 11 7477 1 1 36 GLU HA H 9.293 9.715 5.988 1.00 . A A . 36 GLU HA 1 1 11 7478 1 1 36 GLU HB2 H 7.036 7.839 6.254 1.00 . A A . 36 GLU HB2 1 1 11 7479 1 1 36 GLU HB3 H 8.614 7.099 6.525 1.00 . A A . 36 GLU HB3 1 1 11 7480 1 1 36 GLU HG2 H 9.097 8.464 8.348 1.00 . A A . 36 GLU HG2 1 1 11 7481 1 1 36 GLU HG3 H 8.005 9.741 7.811 1.00 . A A . 36 GLU HG3 1 1 11 7482 1 1 36 GLU N N 7.535 9.627 4.799 1.00 . A A . 36 GLU N 1 1 11 7483 1 1 36 GLU O O 10.740 8.089 4.618 1.00 . A A . 36 GLU O 1 1 11 7484 1 1 36 GLU OE1 O 6.797 6.904 8.715 1.00 . A A . 36 GLU OE1 1 1 11 7485 1 1 36 GLU OE2 O 6.426 8.868 9.521 1.00 . A A . 36 GLU OE2 1 1 11 7486 1 1 37 CYS C C 10.536 7.844 1.588 1.00 . A A . 37 CYS C 1 1 11 7487 1 1 37 CYS CA C 9.714 6.881 2.450 1.00 . A A . 37 CYS CA 1 1 11 7488 1 1 37 CYS CB C 8.675 6.149 1.598 1.00 . A A . 37 CYS CB 1 1 11 7489 1 1 37 CYS H H 7.957 7.742 3.361 1.00 . A A . 37 CYS H 1 1 11 7490 1 1 37 CYS HA H 10.359 6.167 2.938 1.00 . A A . 37 CYS HA 1 1 11 7491 1 1 37 CYS HB2 H 7.771 6.010 2.173 1.00 . A A . 37 CYS HB2 1 1 11 7492 1 1 37 CYS HB3 H 8.455 6.734 0.716 1.00 . A A . 37 CYS HB3 1 1 11 7493 1 1 37 CYS N N 8.927 7.647 3.461 1.00 . A A . 37 CYS N 1 1 11 7494 1 1 37 CYS O O 10.254 9.024 1.522 1.00 . A A . 37 CYS O 1 1 11 7495 1 1 37 CYS SG S 9.334 4.536 1.105 1.00 . A A . 37 CYS SG 1 1 11 7496 1 1 38 LEU C C 11.628 8.660 -1.179 1.00 . A A . 38 LEU C 1 1 11 7497 1 1 38 LEU CA C 12.392 8.245 0.082 1.00 . A A . 38 LEU CA 1 1 11 7498 1 1 38 LEU CB C 13.612 7.404 -0.290 1.00 . A A . 38 LEU CB 1 1 11 7499 1 1 38 LEU CD1 C 14.570 6.148 1.644 1.00 . A A . 38 LEU CD1 1 1 11 7500 1 1 38 LEU CD2 C 16.034 7.626 0.261 1.00 . A A . 38 LEU CD2 1 1 11 7501 1 1 38 LEU CG C 14.632 7.452 0.847 1.00 . A A . 38 LEU CG 1 1 11 7502 1 1 38 LEU H H 11.765 6.400 1.003 1.00 . A A . 38 LEU H 1 1 11 7503 1 1 38 LEU HA H 12.702 9.115 0.639 1.00 . A A . 38 LEU HA 1 1 11 7504 1 1 38 LEU HB2 H 13.306 6.381 -0.457 1.00 . A A . 38 LEU HB2 1 1 11 7505 1 1 38 LEU HB3 H 14.061 7.797 -1.189 1.00 . A A . 38 LEU HB3 1 1 11 7506 1 1 38 LEU HD11 H 15.496 5.608 1.524 1.00 . A A . 38 LEU HD11 1 1 11 7507 1 1 38 LEU HD12 H 13.750 5.544 1.282 1.00 . A A . 38 LEU HD12 1 1 11 7508 1 1 38 LEU HD13 H 14.416 6.372 2.689 1.00 . A A . 38 LEU HD13 1 1 11 7509 1 1 38 LEU HD21 H 15.980 8.248 -0.619 1.00 . A A . 38 LEU HD21 1 1 11 7510 1 1 38 LEU HD22 H 16.433 6.658 -0.006 1.00 . A A . 38 LEU HD22 1 1 11 7511 1 1 38 LEU HD23 H 16.676 8.090 0.994 1.00 . A A . 38 LEU HD23 1 1 11 7512 1 1 38 LEU HG H 14.406 8.284 1.499 1.00 . A A . 38 LEU HG 1 1 11 7513 1 1 38 LEU N N 11.551 7.353 0.933 1.00 . A A . 38 LEU N 1 1 11 7514 1 1 38 LEU O O 11.273 9.810 -1.351 1.00 . A A . 38 LEU O 1 1 11 7515 1 1 39 SER C C 9.149 8.234 -3.037 1.00 . A A . 39 SER C 1 1 11 7516 1 1 39 SER CA C 10.647 8.078 -3.317 1.00 . A A . 39 SER CA 1 1 11 7517 1 1 39 SER CB C 10.897 6.900 -4.258 1.00 . A A . 39 SER CB 1 1 11 7518 1 1 39 SER H H 11.679 6.814 -1.910 1.00 . A A . 39 SER H 1 1 11 7519 1 1 39 SER HA H 11.045 8.983 -3.749 1.00 . A A . 39 SER HA 1 1 11 7520 1 1 39 SER HB2 H 11.166 6.029 -3.685 1.00 . A A . 39 SER HB2 1 1 11 7521 1 1 39 SER HB3 H 9.999 6.694 -4.825 1.00 . A A . 39 SER HB3 1 1 11 7522 1 1 39 SER HG H 11.884 6.671 -5.919 1.00 . A A . 39 SER HG 1 1 11 7523 1 1 39 SER N N 11.380 7.734 -2.065 1.00 . A A . 39 SER N 1 1 11 7524 1 1 39 SER O O 8.694 8.059 -1.925 1.00 . A A . 39 SER O 1 1 11 7525 1 1 39 SER OG O 11.964 7.226 -5.140 1.00 . A A . 39 SER OG 1 1 11 7526 1 1 40 GLY C C 6.213 7.381 -4.013 1.00 . A A . 40 GLY C 1 1 11 7527 1 1 40 GLY CA C 6.913 8.730 -3.835 1.00 . A A . 40 GLY CA 1 1 11 7528 1 1 40 GLY H H 8.768 8.699 -4.930 1.00 . A A . 40 GLY H 1 1 11 7529 1 1 40 GLY HA2 H 6.730 9.105 -2.837 1.00 . A A . 40 GLY HA2 1 1 11 7530 1 1 40 GLY HA3 H 6.526 9.431 -4.559 1.00 . A A . 40 GLY HA3 1 1 11 7531 1 1 40 GLY N N 8.380 8.563 -4.041 1.00 . A A . 40 GLY N 1 1 11 7532 1 1 40 GLY O O 5.136 7.298 -4.571 1.00 . A A . 40 GLY O 1 1 11 7533 1 1 41 THR C C 5.488 4.578 -2.384 1.00 . A A . 41 THR C 1 1 11 7534 1 1 41 THR CA C 6.178 4.980 -3.689 1.00 . A A . 41 THR CA 1 1 11 7535 1 1 41 THR CB C 7.332 4.027 -4.001 1.00 . A A . 41 THR CB 1 1 11 7536 1 1 41 THR CG2 C 8.439 4.201 -2.960 1.00 . A A . 41 THR CG2 1 1 11 7537 1 1 41 THR H H 7.682 6.409 -3.098 1.00 . A A . 41 THR H 1 1 11 7538 1 1 41 THR HA H 5.473 4.984 -4.504 1.00 . A A . 41 THR HA 1 1 11 7539 1 1 41 THR HB H 7.727 4.247 -4.981 1.00 . A A . 41 THR HB 1 1 11 7540 1 1 41 THR HG1 H 6.367 2.528 -4.780 1.00 . A A . 41 THR HG1 1 1 11 7541 1 1 41 THR HG21 H 8.912 3.249 -2.774 1.00 . A A . 41 THR HG21 1 1 11 7542 1 1 41 THR HG22 H 8.014 4.578 -2.042 1.00 . A A . 41 THR HG22 1 1 11 7543 1 1 41 THR HG23 H 9.175 4.901 -3.330 1.00 . A A . 41 THR HG23 1 1 11 7544 1 1 41 THR N N 6.814 6.322 -3.545 1.00 . A A . 41 THR N 1 1 11 7545 1 1 41 THR O O 6.052 4.688 -1.314 1.00 . A A . 41 THR O 1 1 11 7546 1 1 41 THR OG1 O 6.858 2.687 -3.971 1.00 . A A . 41 THR OG1 1 1 11 7547 1 1 42 TRP C C 2.587 2.551 -1.516 1.00 . A A . 42 TRP C 1 1 11 7548 1 1 42 TRP CA C 3.555 3.699 -1.219 1.00 . A A . 42 TRP CA 1 1 11 7549 1 1 42 TRP CB C 2.786 4.940 -0.765 1.00 . A A . 42 TRP CB 1 1 11 7550 1 1 42 TRP CD1 C 2.913 4.621 1.733 1.00 . A A . 42 TRP CD1 1 1 11 7551 1 1 42 TRP CD2 C 0.812 4.459 0.946 1.00 . A A . 42 TRP CD2 1 1 11 7552 1 1 42 TRP CE2 C 0.738 4.261 2.345 1.00 . A A . 42 TRP CE2 1 1 11 7553 1 1 42 TRP CE3 C -0.383 4.407 0.205 1.00 . A A . 42 TRP CE3 1 1 11 7554 1 1 42 TRP CG C 2.204 4.686 0.584 1.00 . A A . 42 TRP CG 1 1 11 7555 1 1 42 TRP CH2 C -1.656 3.971 2.234 1.00 . A A . 42 TRP CH2 1 1 11 7556 1 1 42 TRP CZ2 C -0.478 4.019 2.986 1.00 . A A . 42 TRP CZ2 1 1 11 7557 1 1 42 TRP CZ3 C -1.608 4.165 0.846 1.00 . A A . 42 TRP CZ3 1 1 11 7558 1 1 42 TRP H H 3.832 4.027 -3.332 1.00 . A A . 42 TRP H 1 1 11 7559 1 1 42 TRP HA H 4.261 3.406 -0.457 1.00 . A A . 42 TRP HA 1 1 11 7560 1 1 42 TRP HB2 H 3.459 5.784 -0.713 1.00 . A A . 42 TRP HB2 1 1 11 7561 1 1 42 TRP HB3 H 1.994 5.151 -1.467 1.00 . A A . 42 TRP HB3 1 1 11 7562 1 1 42 TRP HD1 H 3.982 4.745 1.818 1.00 . A A . 42 TRP HD1 1 1 11 7563 1 1 42 TRP HE1 H 2.310 4.270 3.718 1.00 . A A . 42 TRP HE1 1 1 11 7564 1 1 42 TRP HE3 H -0.357 4.555 -0.866 1.00 . A A . 42 TRP HE3 1 1 11 7565 1 1 42 TRP HH2 H -2.602 3.784 2.721 1.00 . A A . 42 TRP HH2 1 1 11 7566 1 1 42 TRP HZ2 H -0.509 3.871 4.055 1.00 . A A . 42 TRP HZ2 1 1 11 7567 1 1 42 TRP HZ3 H -2.518 4.126 0.267 1.00 . A A . 42 TRP HZ3 1 1 11 7568 1 1 42 TRP N N 4.272 4.110 -2.460 1.00 . A A . 42 TRP N 1 1 11 7569 1 1 42 TRP NE1 N 2.047 4.367 2.778 1.00 . A A . 42 TRP NE1 1 1 11 7570 1 1 42 TRP O O 1.822 2.599 -2.459 1.00 . A A . 42 TRP O 1 1 11 7571 1 1 43 THR C C 1.053 -0.078 0.368 1.00 . A A . 43 THR C 1 1 11 7572 1 1 43 THR CA C 1.693 0.369 -0.950 1.00 . A A . 43 THR CA 1 1 11 7573 1 1 43 THR CB C 2.580 -0.742 -1.516 1.00 . A A . 43 THR CB 1 1 11 7574 1 1 43 THR CG2 C 3.867 -0.837 -0.697 1.00 . A A . 43 THR CG2 1 1 11 7575 1 1 43 THR H H 3.237 1.501 0.040 1.00 . A A . 43 THR H 1 1 11 7576 1 1 43 THR HA H 0.934 0.634 -1.668 1.00 . A A . 43 THR HA 1 1 11 7577 1 1 43 THR HB H 2.827 -0.520 -2.543 1.00 . A A . 43 THR HB 1 1 11 7578 1 1 43 THR HG1 H 2.518 -2.685 -1.609 1.00 . A A . 43 THR HG1 1 1 11 7579 1 1 43 THR HG21 H 3.624 -1.066 0.329 1.00 . A A . 43 THR HG21 1 1 11 7580 1 1 43 THR HG22 H 4.392 0.106 -0.742 1.00 . A A . 43 THR HG22 1 1 11 7581 1 1 43 THR HG23 H 4.494 -1.618 -1.101 1.00 . A A . 43 THR HG23 1 1 11 7582 1 1 43 THR N N 2.613 1.519 -0.715 1.00 . A A . 43 THR N 1 1 11 7583 1 1 43 THR O O 1.698 -0.138 1.397 1.00 . A A . 43 THR O 1 1 11 7584 1 1 43 THR OG1 O 1.885 -1.980 -1.452 1.00 . A A . 43 THR OG1 1 1 11 7585 1 1 44 GLN C C -1.450 -2.259 1.402 1.00 . A A . 44 GLN C 1 1 11 7586 1 1 44 GLN CA C -0.897 -0.845 1.591 1.00 . A A . 44 GLN CA 1 1 11 7587 1 1 44 GLN CB C -2.036 0.155 1.800 1.00 . A A . 44 GLN CB 1 1 11 7588 1 1 44 GLN CD C -4.207 0.990 0.877 1.00 . A A . 44 GLN CD 1 1 11 7589 1 1 44 GLN CG C -2.997 0.090 0.612 1.00 . A A . 44 GLN CG 1 1 11 7590 1 1 44 GLN H H -0.713 -0.344 -0.497 1.00 . A A . 44 GLN H 1 1 11 7591 1 1 44 GLN HA H -0.217 -0.815 2.428 1.00 . A A . 44 GLN HA 1 1 11 7592 1 1 44 GLN HB2 H -2.569 -0.090 2.708 1.00 . A A . 44 GLN HB2 1 1 11 7593 1 1 44 GLN HB3 H -1.630 1.153 1.878 1.00 . A A . 44 GLN HB3 1 1 11 7594 1 1 44 GLN HE21 H -4.408 0.409 2.765 1.00 . A A . 44 GLN HE21 1 1 11 7595 1 1 44 GLN HE22 H -5.542 1.555 2.235 1.00 . A A . 44 GLN HE22 1 1 11 7596 1 1 44 GLN HG2 H -2.488 0.426 -0.280 1.00 . A A . 44 GLN HG2 1 1 11 7597 1 1 44 GLN HG3 H -3.331 -0.927 0.475 1.00 . A A . 44 GLN HG3 1 1 11 7598 1 1 44 GLN N N -0.213 -0.398 0.344 1.00 . A A . 44 GLN N 1 1 11 7599 1 1 44 GLN NE2 N -4.764 0.984 2.057 1.00 . A A . 44 GLN NE2 1 1 11 7600 1 1 44 GLN O O -2.399 -2.658 2.048 1.00 . A A . 44 GLN O 1 1 11 7601 1 1 44 GLN OE1 O -4.650 1.705 0.000 1.00 . A A . 44 GLN OE1 1 1 11 7602 1 1 45 GLN C C -0.232 -5.277 -0.296 1.00 . A A . 45 GLN C 1 1 11 7603 1 1 45 GLN CA C -1.354 -4.410 0.284 1.00 . A A . 45 GLN CA 1 1 11 7604 1 1 45 GLN CB C -2.491 -4.257 -0.727 1.00 . A A . 45 GLN CB 1 1 11 7605 1 1 45 GLN CD C -4.969 -4.208 -1.020 1.00 . A A . 45 GLN CD 1 1 11 7606 1 1 45 GLN CG C -3.835 -4.357 -0.005 1.00 . A A . 45 GLN CG 1 1 11 7607 1 1 45 GLN H H -0.100 -2.679 0.007 1.00 . A A . 45 GLN H 1 1 11 7608 1 1 45 GLN HA H -1.729 -4.838 1.200 1.00 . A A . 45 GLN HA 1 1 11 7609 1 1 45 GLN HB2 H -2.412 -3.296 -1.214 1.00 . A A . 45 GLN HB2 1 1 11 7610 1 1 45 GLN HB3 H -2.423 -5.042 -1.466 1.00 . A A . 45 GLN HB3 1 1 11 7611 1 1 45 GLN HE21 H -5.000 -2.226 -0.908 1.00 . A A . 45 GLN HE21 1 1 11 7612 1 1 45 GLN HE22 H -6.127 -2.910 -1.977 1.00 . A A . 45 GLN HE22 1 1 11 7613 1 1 45 GLN HG2 H -3.911 -5.317 0.484 1.00 . A A . 45 GLN HG2 1 1 11 7614 1 1 45 GLN HG3 H -3.908 -3.570 0.730 1.00 . A A . 45 GLN HG3 1 1 11 7615 1 1 45 GLN N N -0.863 -3.021 0.519 1.00 . A A . 45 GLN N 1 1 11 7616 1 1 45 GLN NE2 N -5.401 -3.015 -1.327 1.00 . A A . 45 GLN NE2 1 1 11 7617 1 1 45 GLN O O 0.113 -5.167 -1.455 1.00 . A A . 45 GLN O 1 1 11 7618 1 1 45 GLN OE1 O -5.467 -5.186 -1.540 1.00 . A A . 45 GLN OE1 1 1 11 7619 1 1 46 ILE C C 1.455 -8.344 0.744 1.00 . A A . 46 ILE C 1 1 11 7620 1 1 46 ILE CA C 1.439 -7.008 -0.006 1.00 . A A . 46 ILE CA 1 1 11 7621 1 1 46 ILE CB C 2.723 -6.224 0.266 1.00 . A A . 46 ILE CB 1 1 11 7622 1 1 46 ILE CD1 C 4.466 -5.930 -1.500 1.00 . A A . 46 ILE CD1 1 1 11 7623 1 1 46 ILE CG1 C 3.892 -6.893 -0.458 1.00 . A A . 46 ILE CG1 1 1 11 7624 1 1 46 ILE CG2 C 3.001 -6.205 1.771 1.00 . A A . 46 ILE CG2 1 1 11 7625 1 1 46 ILE H H 0.047 -6.211 1.434 1.00 . A A . 46 ILE H 1 1 11 7626 1 1 46 ILE HA H 1.328 -7.174 -1.066 1.00 . A A . 46 ILE HA 1 1 11 7627 1 1 46 ILE HB H 2.608 -5.211 -0.091 1.00 . A A . 46 ILE HB 1 1 11 7628 1 1 46 ILE HD11 H 5.041 -6.485 -2.225 1.00 . A A . 46 ILE HD11 1 1 11 7629 1 1 46 ILE HD12 H 5.103 -5.207 -1.011 1.00 . A A . 46 ILE HD12 1 1 11 7630 1 1 46 ILE HD13 H 3.657 -5.416 -2.000 1.00 . A A . 46 ILE HD13 1 1 11 7631 1 1 46 ILE HG12 H 4.660 -7.149 0.258 1.00 . A A . 46 ILE HG12 1 1 11 7632 1 1 46 ILE HG13 H 3.546 -7.787 -0.952 1.00 . A A . 46 ILE HG13 1 1 11 7633 1 1 46 ILE HG21 H 2.083 -6.009 2.304 1.00 . A A . 46 ILE HG21 1 1 11 7634 1 1 46 ILE HG22 H 3.719 -5.430 1.994 1.00 . A A . 46 ILE HG22 1 1 11 7635 1 1 46 ILE HG23 H 3.399 -7.162 2.075 1.00 . A A . 46 ILE HG23 1 1 11 7636 1 1 46 ILE N N 0.340 -6.138 0.502 1.00 . A A . 46 ILE N 1 1 11 7637 1 1 46 ILE O O 1.732 -9.381 0.176 1.00 . A A . 46 ILE O 1 1 11 7638 1 1 47 CYS C C -0.208 -9.828 3.437 1.00 . A A . 47 CYS C 1 1 11 7639 1 1 47 CYS CA C 1.164 -9.596 2.799 1.00 . A A . 47 CYS CA 1 1 11 7640 1 1 47 CYS CB C 2.227 -9.390 3.878 1.00 . A A . 47 CYS CB 1 1 11 7641 1 1 47 CYS H H 0.942 -7.480 2.458 1.00 . A A . 47 CYS H 1 1 11 7642 1 1 47 CYS HA H 1.434 -10.428 2.169 1.00 . A A . 47 CYS HA 1 1 11 7643 1 1 47 CYS HB2 H 2.226 -10.235 4.551 1.00 . A A . 47 CYS HB2 1 1 11 7644 1 1 47 CYS HB3 H 3.198 -9.300 3.415 1.00 . A A . 47 CYS HB3 1 1 11 7645 1 1 47 CYS N N 1.162 -8.327 2.016 1.00 . A A . 47 CYS N 1 1 11 7646 1 1 47 CYS O O -0.977 -8.909 3.633 1.00 . A A . 47 CYS O 1 1 11 7647 1 1 47 CYS SG S 1.859 -7.879 4.806 1.00 . A A . 47 CYS SG 1 1 11 7648 1 1 48 LEU C C -1.704 -11.290 5.925 1.00 . A A . 48 LEU C 1 1 11 7649 1 1 48 LEU CA C -1.836 -11.334 4.401 1.00 . A A . 48 LEU CA 1 1 11 7650 1 1 48 LEU CB C -2.217 -12.745 3.939 1.00 . A A . 48 LEU CB 1 1 11 7651 1 1 48 LEU CD1 C -2.764 -11.471 1.823 1.00 . A A . 48 LEU CD1 1 1 11 7652 1 1 48 LEU CD2 C -0.931 -13.173 1.834 1.00 . A A . 48 LEU CD2 1 1 11 7653 1 1 48 LEU CG C -2.305 -12.816 2.405 1.00 . A A . 48 LEU CG 1 1 11 7654 1 1 48 LEU H H 0.118 -11.780 3.610 1.00 . A A . 48 LEU H 1 1 11 7655 1 1 48 LEU HA H -2.575 -10.623 4.065 1.00 . A A . 48 LEU HA 1 1 11 7656 1 1 48 LEU HB2 H -1.470 -13.445 4.283 1.00 . A A . 48 LEU HB2 1 1 11 7657 1 1 48 LEU HB3 H -3.175 -13.012 4.361 1.00 . A A . 48 LEU HB3 1 1 11 7658 1 1 48 LEU HD11 H -1.997 -10.728 1.986 1.00 . A A . 48 LEU HD11 1 1 11 7659 1 1 48 LEU HD12 H -3.676 -11.161 2.311 1.00 . A A . 48 LEU HD12 1 1 11 7660 1 1 48 LEU HD13 H -2.942 -11.580 0.763 1.00 . A A . 48 LEU HD13 1 1 11 7661 1 1 48 LEU HD21 H -1.009 -14.077 1.248 1.00 . A A . 48 LEU HD21 1 1 11 7662 1 1 48 LEU HD22 H -0.235 -13.327 2.644 1.00 . A A . 48 LEU HD22 1 1 11 7663 1 1 48 LEU HD23 H -0.581 -12.368 1.205 1.00 . A A . 48 LEU HD23 1 1 11 7664 1 1 48 LEU HG H -3.016 -13.581 2.126 1.00 . A A . 48 LEU HG 1 1 11 7665 1 1 48 LEU N N -0.518 -11.051 3.770 1.00 . A A . 48 LEU N 1 1 11 7666 1 1 48 LEU O O -2.721 -11.375 6.592 1.00 . A A . 48 LEU O 1 1 11 7667 1 1 48 LEU OXT O -0.586 -11.172 6.399 1.00 . A A . 48 LEU OXT 1 1 12 7668 1 1 1 GLY C C -1.628 6.367 20.251 1.00 . A A . 1 GLY C 1 1 12 7669 1 1 1 GLY CA C -1.185 7.782 19.872 1.00 . A A . 1 GLY CA 1 1 12 7670 1 1 1 GLY H1 H -0.831 9.061 21.476 1.00 . A A . 1 GLY H1 1 1 12 7671 1 1 1 GLY H2 H -2.340 8.283 21.531 1.00 . A A . 1 GLY H2 1 1 12 7672 1 1 1 GLY H3 H -2.083 9.569 20.453 1.00 . A A . 1 GLY H3 1 1 12 7673 1 1 1 GLY HA2 H -1.615 8.051 18.917 1.00 . A A . 1 GLY HA2 1 1 12 7674 1 1 1 GLY HA3 H -0.109 7.811 19.803 1.00 . A A . 1 GLY HA3 1 1 12 7675 1 1 1 GLY N N -1.644 8.746 20.912 1.00 . A A . 1 GLY N 1 1 12 7676 1 1 1 GLY O O -2.798 6.107 20.451 1.00 . A A . 1 GLY O 1 1 12 7677 1 1 2 SER C C -2.086 3.491 19.718 1.00 . A A . 2 SER C 1 1 12 7678 1 1 2 SER CA C -1.067 4.052 20.716 1.00 . A A . 2 SER CA 1 1 12 7679 1 1 2 SER CB C -1.682 4.148 22.112 1.00 . A A . 2 SER CB 1 1 12 7680 1 1 2 SER H H 0.235 5.685 20.184 1.00 . A A . 2 SER H 1 1 12 7681 1 1 2 SER HA H -0.186 3.429 20.744 1.00 . A A . 2 SER HA 1 1 12 7682 1 1 2 SER HB2 H -0.899 4.172 22.852 1.00 . A A . 2 SER HB2 1 1 12 7683 1 1 2 SER HB3 H -2.270 5.054 22.185 1.00 . A A . 2 SER HB3 1 1 12 7684 1 1 2 SER HG H -3.079 3.206 23.085 1.00 . A A . 2 SER HG 1 1 12 7685 1 1 2 SER N N -0.702 5.453 20.351 1.00 . A A . 2 SER N 1 1 12 7686 1 1 2 SER O O -3.203 3.961 19.624 1.00 . A A . 2 SER O 1 1 12 7687 1 1 2 SER OG O -2.506 3.012 22.339 1.00 . A A . 2 SER OG 1 1 12 7688 1 1 3 ALA C C -2.950 2.900 16.869 1.00 . A A . 3 ALA C 1 1 12 7689 1 1 3 ALA CA C -2.656 1.897 17.983 1.00 . A A . 3 ALA CA 1 1 12 7690 1 1 3 ALA CB C -3.930 1.596 18.771 1.00 . A A . 3 ALA CB 1 1 12 7691 1 1 3 ALA H H -0.805 2.122 19.065 1.00 . A A . 3 ALA H 1 1 12 7692 1 1 3 ALA HA H -2.252 0.984 17.574 1.00 . A A . 3 ALA HA 1 1 12 7693 1 1 3 ALA HB1 H -3.671 1.305 19.778 1.00 . A A . 3 ALA HB1 1 1 12 7694 1 1 3 ALA HB2 H -4.470 0.795 18.290 1.00 . A A . 3 ALA HB2 1 1 12 7695 1 1 3 ALA HB3 H -4.550 2.481 18.801 1.00 . A A . 3 ALA HB3 1 1 12 7696 1 1 3 ALA N N -1.710 2.487 18.974 1.00 . A A . 3 ALA N 1 1 12 7697 1 1 3 ALA O O -2.639 2.669 15.719 1.00 . A A . 3 ALA O 1 1 12 7698 1 1 4 MET C C -2.650 5.293 15.283 1.00 . A A . 4 MET C 1 1 12 7699 1 1 4 MET CA C -3.873 5.034 16.164 1.00 . A A . 4 MET CA 1 1 12 7700 1 1 4 MET CB C -4.252 6.290 16.949 1.00 . A A . 4 MET CB 1 1 12 7701 1 1 4 MET CE C -6.720 5.303 18.455 1.00 . A A . 4 MET CE 1 1 12 7702 1 1 4 MET CG C -5.617 6.798 16.476 1.00 . A A . 4 MET CG 1 1 12 7703 1 1 4 MET H H -3.796 4.171 18.139 1.00 . A A . 4 MET H 1 1 12 7704 1 1 4 MET HA H -4.708 4.710 15.564 1.00 . A A . 4 MET HA 1 1 12 7705 1 1 4 MET HB2 H -4.299 6.057 18.002 1.00 . A A . 4 MET HB2 1 1 12 7706 1 1 4 MET HB3 H -3.509 7.056 16.783 1.00 . A A . 4 MET HB3 1 1 12 7707 1 1 4 MET HE1 H -6.475 5.260 19.508 1.00 . A A . 4 MET HE1 1 1 12 7708 1 1 4 MET HE2 H -5.992 4.739 17.895 1.00 . A A . 4 MET HE2 1 1 12 7709 1 1 4 MET HE3 H -7.702 4.883 18.290 1.00 . A A . 4 MET HE3 1 1 12 7710 1 1 4 MET HG2 H -5.494 7.739 15.964 1.00 . A A . 4 MET HG2 1 1 12 7711 1 1 4 MET HG3 H -6.055 6.076 15.803 1.00 . A A . 4 MET HG3 1 1 12 7712 1 1 4 MET N N -3.552 4.010 17.204 1.00 . A A . 4 MET N 1 1 12 7713 1 1 4 MET O O -1.840 6.157 15.560 1.00 . A A . 4 MET O 1 1 12 7714 1 1 4 MET SD S -6.704 7.026 17.906 1.00 . A A . 4 MET SD 1 1 12 7715 1 1 5 GLY C C -0.671 3.370 13.092 1.00 . A A . 5 GLY C 1 1 12 7716 1 1 5 GLY CA C -1.336 4.727 13.326 1.00 . A A . 5 GLY CA 1 1 12 7717 1 1 5 GLY H H -3.169 3.847 14.034 1.00 . A A . 5 GLY H 1 1 12 7718 1 1 5 GLY HA2 H -1.668 5.136 12.382 1.00 . A A . 5 GLY HA2 1 1 12 7719 1 1 5 GLY HA3 H -0.628 5.398 13.784 1.00 . A A . 5 GLY HA3 1 1 12 7720 1 1 5 GLY N N -2.506 4.542 14.228 1.00 . A A . 5 GLY N 1 1 12 7721 1 1 5 GLY O O -0.438 2.615 14.016 1.00 . A A . 5 GLY O 1 1 12 7722 1 1 6 CYS C C 1.810 1.859 11.648 1.00 . A A . 6 CYS C 1 1 12 7723 1 1 6 CYS CA C 0.285 1.731 11.588 1.00 . A A . 6 CYS CA 1 1 12 7724 1 1 6 CYS CB C -0.179 1.302 10.186 1.00 . A A . 6 CYS CB 1 1 12 7725 1 1 6 CYS H H -0.559 3.670 11.141 1.00 . A A . 6 CYS H 1 1 12 7726 1 1 6 CYS HA H -0.046 1.003 12.313 1.00 . A A . 6 CYS HA 1 1 12 7727 1 1 6 CYS HB2 H 0.425 0.472 9.851 1.00 . A A . 6 CYS HB2 1 1 12 7728 1 1 6 CYS HB3 H -1.213 0.990 10.235 1.00 . A A . 6 CYS HB3 1 1 12 7729 1 1 6 CYS N N -0.364 3.049 11.867 1.00 . A A . 6 CYS N 1 1 12 7730 1 1 6 CYS O O 2.525 0.881 11.569 1.00 . A A . 6 CYS O 1 1 12 7731 1 1 6 CYS SG S -0.021 2.667 9.004 1.00 . A A . 6 CYS SG 1 1 12 7732 1 1 7 ARG C C 4.303 2.603 13.199 1.00 . A A . 7 ARG C 1 1 12 7733 1 1 7 ARG CA C 3.794 3.221 11.894 1.00 . A A . 7 ARG CA 1 1 12 7734 1 1 7 ARG CB C 4.030 4.732 11.882 1.00 . A A . 7 ARG CB 1 1 12 7735 1 1 7 ARG CD C 5.233 5.868 10.007 1.00 . A A . 7 ARG CD 1 1 12 7736 1 1 7 ARG CG C 5.404 5.029 11.276 1.00 . A A . 7 ARG CG 1 1 12 7737 1 1 7 ARG CZ C 4.399 8.114 9.667 1.00 . A A . 7 ARG CZ 1 1 12 7738 1 1 7 ARG H H 1.725 3.830 11.885 1.00 . A A . 7 ARG H 1 1 12 7739 1 1 7 ARG HA H 4.276 2.763 11.044 1.00 . A A . 7 ARG HA 1 1 12 7740 1 1 7 ARG HB2 H 3.264 5.211 11.290 1.00 . A A . 7 ARG HB2 1 1 12 7741 1 1 7 ARG HB3 H 3.994 5.111 12.892 1.00 . A A . 7 ARG HB3 1 1 12 7742 1 1 7 ARG HD2 H 6.155 5.885 9.441 1.00 . A A . 7 ARG HD2 1 1 12 7743 1 1 7 ARG HD3 H 4.428 5.479 9.403 1.00 . A A . 7 ARG HD3 1 1 12 7744 1 1 7 ARG HE H 5.040 7.470 11.432 1.00 . A A . 7 ARG HE 1 1 12 7745 1 1 7 ARG HG2 H 6.003 5.574 11.992 1.00 . A A . 7 ARG HG2 1 1 12 7746 1 1 7 ARG HG3 H 5.896 4.101 11.027 1.00 . A A . 7 ARG HG3 1 1 12 7747 1 1 7 ARG HH11 H 3.019 6.869 8.926 1.00 . A A . 7 ARG HH11 1 1 12 7748 1 1 7 ARG HH12 H 3.024 8.465 8.256 1.00 . A A . 7 ARG HH12 1 1 12 7749 1 1 7 ARG HH21 H 5.667 9.564 10.212 1.00 . A A . 7 ARG HH21 1 1 12 7750 1 1 7 ARG HH22 H 4.524 9.990 8.983 1.00 . A A . 7 ARG HH22 1 1 12 7751 1 1 7 ARG N N 2.315 3.052 11.809 1.00 . A A . 7 ARG N 1 1 12 7752 1 1 7 ARG NE N 4.894 7.233 10.492 1.00 . A A . 7 ARG NE 1 1 12 7753 1 1 7 ARG NH1 N 3.403 7.790 8.889 1.00 . A A . 7 ARG NH1 1 1 12 7754 1 1 7 ARG NH2 N 4.902 9.317 9.617 1.00 . A A . 7 ARG NH2 1 1 12 7755 1 1 7 ARG O O 5.471 2.301 13.344 1.00 . A A . 7 ARG O 1 1 12 7756 1 1 8 HIS C C 3.543 0.300 15.436 1.00 . A A . 8 HIS C 1 1 12 7757 1 1 8 HIS CA C 3.842 1.807 15.447 1.00 . A A . 8 HIS CA 1 1 12 7758 1 1 8 HIS CB C 3.012 2.562 16.509 1.00 . A A . 8 HIS CB 1 1 12 7759 1 1 8 HIS CD2 C 0.932 1.083 17.160 1.00 . A A . 8 HIS CD2 1 1 12 7760 1 1 8 HIS CE1 C 1.682 0.285 19.030 1.00 . A A . 8 HIS CE1 1 1 12 7761 1 1 8 HIS CG C 2.186 1.611 17.342 1.00 . A A . 8 HIS CG 1 1 12 7762 1 1 8 HIS H H 2.489 2.658 14.004 1.00 . A A . 8 HIS H 1 1 12 7763 1 1 8 HIS HA H 4.894 1.976 15.616 1.00 . A A . 8 HIS HA 1 1 12 7764 1 1 8 HIS HB2 H 3.680 3.110 17.157 1.00 . A A . 8 HIS HB2 1 1 12 7765 1 1 8 HIS HB3 H 2.355 3.260 16.010 1.00 . A A . 8 HIS HB3 1 1 12 7766 1 1 8 HIS HD1 H 3.515 1.269 18.955 1.00 . A A . 8 HIS HD1 1 1 12 7767 1 1 8 HIS HD2 H 0.289 1.285 16.316 1.00 . A A . 8 HIS HD2 1 1 12 7768 1 1 8 HIS HE1 H 1.763 -0.262 19.957 1.00 . A A . 8 HIS HE1 1 1 12 7769 1 1 8 HIS N N 3.426 2.409 14.148 1.00 . A A . 8 HIS N 1 1 12 7770 1 1 8 HIS ND1 N 2.647 1.088 18.541 1.00 . A A . 8 HIS ND1 1 1 12 7771 1 1 8 HIS NE2 N 0.616 0.247 18.227 1.00 . A A . 8 HIS NE2 1 1 12 7772 1 1 8 HIS O O 4.027 -0.446 16.264 1.00 . A A . 8 HIS O 1 1 12 7773 1 1 9 PHE C C 3.699 -2.435 14.385 1.00 . A A . 9 PHE C 1 1 12 7774 1 1 9 PHE CA C 2.416 -1.600 14.438 1.00 . A A . 9 PHE CA 1 1 12 7775 1 1 9 PHE CB C 1.617 -1.764 13.142 1.00 . A A . 9 PHE CB 1 1 12 7776 1 1 9 PHE CD1 C -0.197 -0.670 14.536 1.00 . A A . 9 PHE CD1 1 1 12 7777 1 1 9 PHE CD2 C -0.719 -1.380 12.277 1.00 . A A . 9 PHE CD2 1 1 12 7778 1 1 9 PHE CE1 C -1.510 -0.207 14.692 1.00 . A A . 9 PHE CE1 1 1 12 7779 1 1 9 PHE CE2 C -2.031 -0.919 12.435 1.00 . A A . 9 PHE CE2 1 1 12 7780 1 1 9 PHE CG C 0.200 -1.258 13.326 1.00 . A A . 9 PHE CG 1 1 12 7781 1 1 9 PHE CZ C -2.426 -0.332 13.642 1.00 . A A . 9 PHE CZ 1 1 12 7782 1 1 9 PHE H H 2.367 0.472 13.846 1.00 . A A . 9 PHE H 1 1 12 7783 1 1 9 PHE HA H 1.812 -1.890 15.282 1.00 . A A . 9 PHE HA 1 1 12 7784 1 1 9 PHE HB2 H 2.096 -1.203 12.354 1.00 . A A . 9 PHE HB2 1 1 12 7785 1 1 9 PHE HB3 H 1.589 -2.809 12.869 1.00 . A A . 9 PHE HB3 1 1 12 7786 1 1 9 PHE HD1 H 0.508 -0.572 15.346 1.00 . A A . 9 PHE HD1 1 1 12 7787 1 1 9 PHE HD2 H -0.414 -1.830 11.346 1.00 . A A . 9 PHE HD2 1 1 12 7788 1 1 9 PHE HE1 H -1.815 0.245 15.624 1.00 . A A . 9 PHE HE1 1 1 12 7789 1 1 9 PHE HE2 H -2.737 -1.015 11.623 1.00 . A A . 9 PHE HE2 1 1 12 7790 1 1 9 PHE HZ H -3.438 0.023 13.764 1.00 . A A . 9 PHE HZ 1 1 12 7791 1 1 9 PHE N N 2.748 -0.147 14.504 1.00 . A A . 9 PHE N 1 1 12 7792 1 1 9 PHE O O 4.794 -1.911 14.443 1.00 . A A . 9 PHE O 1 1 12 7793 1 1 10 GLN C C 5.219 -4.797 12.761 1.00 . A A . 10 GLN C 1 1 12 7794 1 1 10 GLN CA C 4.784 -4.598 14.215 1.00 . A A . 10 GLN CA 1 1 12 7795 1 1 10 GLN CB C 4.349 -5.928 14.833 1.00 . A A . 10 GLN CB 1 1 12 7796 1 1 10 GLN CD C 5.322 -6.846 16.946 1.00 . A A . 10 GLN CD 1 1 12 7797 1 1 10 GLN CG C 4.360 -5.811 16.359 1.00 . A A . 10 GLN CG 1 1 12 7798 1 1 10 GLN H H 2.679 -4.132 14.227 1.00 . A A . 10 GLN H 1 1 12 7799 1 1 10 GLN HA H 5.585 -4.165 14.794 1.00 . A A . 10 GLN HA 1 1 12 7800 1 1 10 GLN HB2 H 3.352 -6.171 14.497 1.00 . A A . 10 GLN HB2 1 1 12 7801 1 1 10 GLN HB3 H 5.032 -6.706 14.529 1.00 . A A . 10 GLN HB3 1 1 12 7802 1 1 10 GLN HE21 H 5.013 -6.278 18.824 1.00 . A A . 10 GLN HE21 1 1 12 7803 1 1 10 GLN HE22 H 6.113 -7.556 18.624 1.00 . A A . 10 GLN HE22 1 1 12 7804 1 1 10 GLN HG2 H 4.681 -4.819 16.642 1.00 . A A . 10 GLN HG2 1 1 12 7805 1 1 10 GLN HG3 H 3.366 -5.990 16.742 1.00 . A A . 10 GLN HG3 1 1 12 7806 1 1 10 GLN N N 3.572 -3.730 14.273 1.00 . A A . 10 GLN N 1 1 12 7807 1 1 10 GLN NE2 N 5.496 -6.898 18.238 1.00 . A A . 10 GLN NE2 1 1 12 7808 1 1 10 GLN O O 6.001 -4.034 12.226 1.00 . A A . 10 GLN O 1 1 12 7809 1 1 10 GLN OE1 O 5.921 -7.615 16.221 1.00 . A A . 10 GLN OE1 1 1 12 7810 1 1 11 SER C C 4.068 -5.434 9.752 1.00 . A A . 11 SER C 1 1 12 7811 1 1 11 SER CA C 5.103 -6.059 10.693 1.00 . A A . 11 SER CA 1 1 12 7812 1 1 11 SER CB C 5.120 -7.581 10.536 1.00 . A A . 11 SER CB 1 1 12 7813 1 1 11 SER H H 4.088 -6.417 12.561 1.00 . A A . 11 SER H 1 1 12 7814 1 1 11 SER HA H 6.084 -5.657 10.494 1.00 . A A . 11 SER HA 1 1 12 7815 1 1 11 SER HB2 H 4.266 -7.895 9.961 1.00 . A A . 11 SER HB2 1 1 12 7816 1 1 11 SER HB3 H 6.026 -7.877 10.022 1.00 . A A . 11 SER HB3 1 1 12 7817 1 1 11 SER HG H 4.432 -8.908 11.782 1.00 . A A . 11 SER HG 1 1 12 7818 1 1 11 SER N N 4.718 -5.815 12.113 1.00 . A A . 11 SER N 1 1 12 7819 1 1 11 SER O O 3.443 -4.443 10.074 1.00 . A A . 11 SER O 1 1 12 7820 1 1 11 SER OG O 5.068 -8.190 11.820 1.00 . A A . 11 SER OG 1 1 12 7821 1 1 12 CYS C C 1.512 -6.060 7.868 1.00 . A A . 12 CYS C 1 1 12 7822 1 1 12 CYS CA C 2.891 -5.437 7.633 1.00 . A A . 12 CYS CA 1 1 12 7823 1 1 12 CYS CB C 3.416 -5.804 6.245 1.00 . A A . 12 CYS CB 1 1 12 7824 1 1 12 CYS H H 4.400 -6.801 8.350 1.00 . A A . 12 CYS H 1 1 12 7825 1 1 12 CYS HA H 2.841 -4.364 7.735 1.00 . A A . 12 CYS HA 1 1 12 7826 1 1 12 CYS HB2 H 2.818 -5.311 5.494 1.00 . A A . 12 CYS HB2 1 1 12 7827 1 1 12 CYS HB3 H 4.444 -5.486 6.153 1.00 . A A . 12 CYS HB3 1 1 12 7828 1 1 12 CYS N N 3.885 -6.003 8.592 1.00 . A A . 12 CYS N 1 1 12 7829 1 1 12 CYS O O 0.551 -5.733 7.201 1.00 . A A . 12 CYS O 1 1 12 7830 1 1 12 CYS SG S 3.318 -7.598 6.011 1.00 . A A . 12 CYS SG 1 1 12 7831 1 1 13 SER C C -0.899 -6.549 9.621 1.00 . A A . 13 SER C 1 1 12 7832 1 1 13 SER CA C 0.086 -7.592 9.087 1.00 . A A . 13 SER CA 1 1 12 7833 1 1 13 SER CB C 0.371 -8.657 10.145 1.00 . A A . 13 SER CB 1 1 12 7834 1 1 13 SER H H 2.191 -7.205 9.343 1.00 . A A . 13 SER H 1 1 12 7835 1 1 13 SER HA H -0.301 -8.055 8.192 1.00 . A A . 13 SER HA 1 1 12 7836 1 1 13 SER HB2 H 1.330 -9.109 9.956 1.00 . A A . 13 SER HB2 1 1 12 7837 1 1 13 SER HB3 H 0.380 -8.195 11.124 1.00 . A A . 13 SER HB3 1 1 12 7838 1 1 13 SER HG H -0.205 -10.515 10.095 1.00 . A A . 13 SER HG 1 1 12 7839 1 1 13 SER N N 1.406 -6.955 8.814 1.00 . A A . 13 SER N 1 1 12 7840 1 1 13 SER O O -1.936 -6.299 9.035 1.00 . A A . 13 SER O 1 1 12 7841 1 1 13 SER OG O -0.637 -9.658 10.090 1.00 . A A . 13 SER OG 1 1 12 7842 1 1 14 GLN C C -1.522 -3.661 10.408 1.00 . A A . 14 GLN C 1 1 12 7843 1 1 14 GLN CA C -1.500 -4.906 11.298 1.00 . A A . 14 GLN CA 1 1 12 7844 1 1 14 GLN CB C -0.917 -4.567 12.671 1.00 . A A . 14 GLN CB 1 1 12 7845 1 1 14 GLN CD C -2.272 -4.889 14.745 1.00 . A A . 14 GLN CD 1 1 12 7846 1 1 14 GLN CG C -2.012 -3.967 13.554 1.00 . A A . 14 GLN CG 1 1 12 7847 1 1 14 GLN H H 0.257 -6.147 11.184 1.00 . A A . 14 GLN H 1 1 12 7848 1 1 14 GLN HA H -2.494 -5.308 11.411 1.00 . A A . 14 GLN HA 1 1 12 7849 1 1 14 GLN HB2 H -0.533 -5.464 13.131 1.00 . A A . 14 GLN HB2 1 1 12 7850 1 1 14 GLN HB3 H -0.118 -3.850 12.555 1.00 . A A . 14 GLN HB3 1 1 12 7851 1 1 14 GLN HE21 H -4.212 -5.071 14.361 1.00 . A A . 14 GLN HE21 1 1 12 7852 1 1 14 GLN HE22 H -3.660 -5.922 15.721 1.00 . A A . 14 GLN HE22 1 1 12 7853 1 1 14 GLN HG2 H -1.696 -2.997 13.910 1.00 . A A . 14 GLN HG2 1 1 12 7854 1 1 14 GLN HG3 H -2.919 -3.861 12.978 1.00 . A A . 14 GLN HG3 1 1 12 7855 1 1 14 GLN N N -0.584 -5.934 10.728 1.00 . A A . 14 GLN N 1 1 12 7856 1 1 14 GLN NE2 N -3.481 -5.331 14.960 1.00 . A A . 14 GLN NE2 1 1 12 7857 1 1 14 GLN O O -2.525 -2.981 10.296 1.00 . A A . 14 GLN O 1 1 12 7858 1 1 14 GLN OE1 O -1.368 -5.212 15.488 1.00 . A A . 14 GLN OE1 1 1 12 7859 1 1 15 CYS C C -1.494 -2.188 7.869 1.00 . A A . 15 CYS C 1 1 12 7860 1 1 15 CYS CA C -0.370 -2.147 8.904 1.00 . A A . 15 CYS CA 1 1 12 7861 1 1 15 CYS CB C 0.994 -2.215 8.217 1.00 . A A . 15 CYS CB 1 1 12 7862 1 1 15 CYS H H 0.377 -3.911 9.890 1.00 . A A . 15 CYS H 1 1 12 7863 1 1 15 CYS HA H -0.438 -1.247 9.497 1.00 . A A . 15 CYS HA 1 1 12 7864 1 1 15 CYS HB2 H 1.264 -3.247 8.055 1.00 . A A . 15 CYS HB2 1 1 12 7865 1 1 15 CYS HB3 H 0.944 -1.702 7.267 1.00 . A A . 15 CYS HB3 1 1 12 7866 1 1 15 CYS N N -0.421 -3.352 9.780 1.00 . A A . 15 CYS N 1 1 12 7867 1 1 15 CYS O O -2.241 -1.243 7.713 1.00 . A A . 15 CYS O 1 1 12 7868 1 1 15 CYS SG S 2.236 -1.422 9.268 1.00 . A A . 15 CYS SG 1 1 12 7869 1 1 16 LEU C C -3.947 -4.009 6.716 1.00 . A A . 16 LEU C 1 1 12 7870 1 1 16 LEU CA C -2.690 -3.364 6.124 1.00 . A A . 16 LEU CA 1 1 12 7871 1 1 16 LEU CB C -2.103 -4.241 5.020 1.00 . A A . 16 LEU CB 1 1 12 7872 1 1 16 LEU CD1 C -0.076 -2.773 4.992 1.00 . A A . 16 LEU CD1 1 1 12 7873 1 1 16 LEU CD2 C -0.548 -4.296 3.068 1.00 . A A . 16 LEU CD2 1 1 12 7874 1 1 16 LEU CG C -1.179 -3.400 4.135 1.00 . A A . 16 LEU CG 1 1 12 7875 1 1 16 LEU H H -1.000 -4.022 7.290 1.00 . A A . 16 LEU H 1 1 12 7876 1 1 16 LEU HA H -2.919 -2.386 5.733 1.00 . A A . 16 LEU HA 1 1 12 7877 1 1 16 LEU HB2 H -1.540 -5.050 5.462 1.00 . A A . 16 LEU HB2 1 1 12 7878 1 1 16 LEU HB3 H -2.902 -4.645 4.418 1.00 . A A . 16 LEU HB3 1 1 12 7879 1 1 16 LEU HD11 H -0.466 -1.908 5.507 1.00 . A A . 16 LEU HD11 1 1 12 7880 1 1 16 LEU HD12 H 0.746 -2.473 4.357 1.00 . A A . 16 LEU HD12 1 1 12 7881 1 1 16 LEU HD13 H 0.273 -3.495 5.715 1.00 . A A . 16 LEU HD13 1 1 12 7882 1 1 16 LEU HD21 H -0.146 -3.683 2.275 1.00 . A A . 16 LEU HD21 1 1 12 7883 1 1 16 LEU HD22 H -1.300 -4.959 2.664 1.00 . A A . 16 LEU HD22 1 1 12 7884 1 1 16 LEU HD23 H 0.245 -4.879 3.511 1.00 . A A . 16 LEU HD23 1 1 12 7885 1 1 16 LEU HG H -1.752 -2.617 3.660 1.00 . A A . 16 LEU HG 1 1 12 7886 1 1 16 LEU N N -1.617 -3.272 7.154 1.00 . A A . 16 LEU N 1 1 12 7887 1 1 16 LEU O O -4.968 -4.112 6.063 1.00 . A A . 16 LEU O 1 1 12 7888 1 1 17 SER C C -5.896 -4.018 9.330 1.00 . A A . 17 SER C 1 1 12 7889 1 1 17 SER CA C -5.085 -5.070 8.571 1.00 . A A . 17 SER CA 1 1 12 7890 1 1 17 SER CB C -4.528 -6.117 9.533 1.00 . A A . 17 SER CB 1 1 12 7891 1 1 17 SER H H -3.056 -4.346 8.461 1.00 . A A . 17 SER H 1 1 12 7892 1 1 17 SER HA H -5.695 -5.547 7.820 1.00 . A A . 17 SER HA 1 1 12 7893 1 1 17 SER HB2 H -3.696 -5.702 10.074 1.00 . A A . 17 SER HB2 1 1 12 7894 1 1 17 SER HB3 H -5.300 -6.408 10.233 1.00 . A A . 17 SER HB3 1 1 12 7895 1 1 17 SER HG H -4.864 -7.749 8.529 1.00 . A A . 17 SER HG 1 1 12 7896 1 1 17 SER N N -3.886 -4.439 7.947 1.00 . A A . 17 SER N 1 1 12 7897 1 1 17 SER O O -6.992 -4.272 9.787 1.00 . A A . 17 SER O 1 1 12 7898 1 1 17 SER OG O -4.089 -7.248 8.794 1.00 . A A . 17 SER OG 1 1 12 7899 1 1 18 ALA C C -5.843 -0.411 9.518 1.00 . A A . 18 ALA C 1 1 12 7900 1 1 18 ALA CA C -6.102 -1.762 10.189 1.00 . A A . 18 ALA CA 1 1 12 7901 1 1 18 ALA CB C -5.526 -1.778 11.605 1.00 . A A . 18 ALA CB 1 1 12 7902 1 1 18 ALA H H -4.478 -2.649 9.087 1.00 . A A . 18 ALA H 1 1 12 7903 1 1 18 ALA HA H -7.158 -1.978 10.215 1.00 . A A . 18 ALA HA 1 1 12 7904 1 1 18 ALA HB1 H -4.451 -1.873 11.554 1.00 . A A . 18 ALA HB1 1 1 12 7905 1 1 18 ALA HB2 H -5.935 -2.616 12.150 1.00 . A A . 18 ALA HB2 1 1 12 7906 1 1 18 ALA HB3 H -5.783 -0.859 12.109 1.00 . A A . 18 ALA HB3 1 1 12 7907 1 1 18 ALA N N -5.365 -2.834 9.464 1.00 . A A . 18 ALA N 1 1 12 7908 1 1 18 ALA O O -5.216 0.456 10.091 1.00 . A A . 18 ALA O 1 1 12 7909 1 1 19 PRO C C -7.033 2.128 8.048 1.00 . A A . 19 PRO C 1 1 12 7910 1 1 19 PRO CA C -6.152 0.963 7.540 1.00 . A A . 19 PRO CA 1 1 12 7911 1 1 19 PRO CB C -6.532 0.564 6.116 1.00 . A A . 19 PRO CB 1 1 12 7912 1 1 19 PRO CD C -7.098 -1.293 7.566 1.00 . A A . 19 PRO CD 1 1 12 7913 1 1 19 PRO CG C -7.437 -0.618 6.259 1.00 . A A . 19 PRO CG 1 1 12 7914 1 1 19 PRO HA H -5.116 1.256 7.558 1.00 . A A . 19 PRO HA 1 1 12 7915 1 1 19 PRO HB2 H -7.049 1.378 5.626 1.00 . A A . 19 PRO HB2 1 1 12 7916 1 1 19 PRO HB3 H -5.652 0.287 5.558 1.00 . A A . 19 PRO HB3 1 1 12 7917 1 1 19 PRO HD2 H -8.002 -1.558 8.098 1.00 . A A . 19 PRO HD2 1 1 12 7918 1 1 19 PRO HD3 H -6.490 -2.168 7.394 1.00 . A A . 19 PRO HD3 1 1 12 7919 1 1 19 PRO HG2 H -8.468 -0.293 6.260 1.00 . A A . 19 PRO HG2 1 1 12 7920 1 1 19 PRO HG3 H -7.273 -1.304 5.444 1.00 . A A . 19 PRO HG3 1 1 12 7921 1 1 19 PRO N N -6.335 -0.285 8.314 1.00 . A A . 19 PRO N 1 1 12 7922 1 1 19 PRO O O -6.651 3.270 7.892 1.00 . A A . 19 PRO O 1 1 12 7923 1 1 20 PRO C C -8.476 3.555 10.394 1.00 . A A . 20 PRO C 1 1 12 7924 1 1 20 PRO CA C -9.053 2.936 9.117 1.00 . A A . 20 PRO CA 1 1 12 7925 1 1 20 PRO CB C -10.385 2.250 9.395 1.00 . A A . 20 PRO CB 1 1 12 7926 1 1 20 PRO CD C -8.776 0.516 8.888 1.00 . A A . 20 PRO CD 1 1 12 7927 1 1 20 PRO CG C -10.042 0.818 9.647 1.00 . A A . 20 PRO CG 1 1 12 7928 1 1 20 PRO HA H -9.178 3.688 8.355 1.00 . A A . 20 PRO HA 1 1 12 7929 1 1 20 PRO HB2 H -10.855 2.686 10.266 1.00 . A A . 20 PRO HB2 1 1 12 7930 1 1 20 PRO HB3 H -11.033 2.329 8.537 1.00 . A A . 20 PRO HB3 1 1 12 7931 1 1 20 PRO HD2 H -8.121 -0.090 9.495 1.00 . A A . 20 PRO HD2 1 1 12 7932 1 1 20 PRO HD3 H -9.002 0.020 7.960 1.00 . A A . 20 PRO HD3 1 1 12 7933 1 1 20 PRO HG2 H -9.886 0.660 10.705 1.00 . A A . 20 PRO HG2 1 1 12 7934 1 1 20 PRO HG3 H -10.838 0.182 9.294 1.00 . A A . 20 PRO HG3 1 1 12 7935 1 1 20 PRO N N -8.181 1.837 8.629 1.00 . A A . 20 PRO N 1 1 12 7936 1 1 20 PRO O O -8.658 4.725 10.664 1.00 . A A . 20 PRO O 1 1 12 7937 1 1 21 PHE C C -5.720 3.704 12.200 1.00 . A A . 21 PHE C 1 1 12 7938 1 1 21 PHE CA C -7.187 3.332 12.431 1.00 . A A . 21 PHE CA 1 1 12 7939 1 1 21 PHE CB C -7.292 2.200 13.453 1.00 . A A . 21 PHE CB 1 1 12 7940 1 1 21 PHE CD1 C -9.792 2.393 13.725 1.00 . A A . 21 PHE CD1 1 1 12 7941 1 1 21 PHE CD2 C -8.848 0.253 13.086 1.00 . A A . 21 PHE CD2 1 1 12 7942 1 1 21 PHE CE1 C -11.076 1.835 13.699 1.00 . A A . 21 PHE CE1 1 1 12 7943 1 1 21 PHE CE2 C -10.131 -0.306 13.061 1.00 . A A . 21 PHE CE2 1 1 12 7944 1 1 21 PHE CG C -8.678 1.603 13.419 1.00 . A A . 21 PHE CG 1 1 12 7945 1 1 21 PHE CZ C -11.245 0.484 13.367 1.00 . A A . 21 PHE CZ 1 1 12 7946 1 1 21 PHE H H -7.638 1.841 10.942 1.00 . A A . 21 PHE H 1 1 12 7947 1 1 21 PHE HA H -7.748 4.188 12.768 1.00 . A A . 21 PHE HA 1 1 12 7948 1 1 21 PHE HB2 H -6.567 1.436 13.218 1.00 . A A . 21 PHE HB2 1 1 12 7949 1 1 21 PHE HB3 H -7.096 2.590 14.441 1.00 . A A . 21 PHE HB3 1 1 12 7950 1 1 21 PHE HD1 H -9.661 3.434 13.981 1.00 . A A . 21 PHE HD1 1 1 12 7951 1 1 21 PHE HD2 H -7.989 -0.357 12.849 1.00 . A A . 21 PHE HD2 1 1 12 7952 1 1 21 PHE HE1 H -11.935 2.444 13.935 1.00 . A A . 21 PHE HE1 1 1 12 7953 1 1 21 PHE HE2 H -10.262 -1.347 12.805 1.00 . A A . 21 PHE HE2 1 1 12 7954 1 1 21 PHE HZ H -12.235 0.053 13.349 1.00 . A A . 21 PHE HZ 1 1 12 7955 1 1 21 PHE N N -7.777 2.781 11.178 1.00 . A A . 21 PHE N 1 1 12 7956 1 1 21 PHE O O -4.962 3.884 13.133 1.00 . A A . 21 PHE O 1 1 12 7957 1 1 22 VAL C C -3.782 5.019 9.418 1.00 . A A . 22 VAL C 1 1 12 7958 1 1 22 VAL CA C -3.886 4.162 10.682 1.00 . A A . 22 VAL CA 1 1 12 7959 1 1 22 VAL CB C -3.188 2.821 10.459 1.00 . A A . 22 VAL CB 1 1 12 7960 1 1 22 VAL CG1 C -3.545 1.861 11.593 1.00 . A A . 22 VAL CG1 1 1 12 7961 1 1 22 VAL CG2 C -3.648 2.229 9.125 1.00 . A A . 22 VAL CG2 1 1 12 7962 1 1 22 VAL H H -5.933 3.656 10.225 1.00 . A A . 22 VAL H 1 1 12 7963 1 1 22 VAL HA H -3.445 4.669 11.524 1.00 . A A . 22 VAL HA 1 1 12 7964 1 1 22 VAL HB H -2.120 2.971 10.437 1.00 . A A . 22 VAL HB 1 1 12 7965 1 1 22 VAL HG11 H -4.617 1.735 11.636 1.00 . A A . 22 VAL HG11 1 1 12 7966 1 1 22 VAL HG12 H -3.192 2.263 12.530 1.00 . A A . 22 VAL HG12 1 1 12 7967 1 1 22 VAL HG13 H -3.078 0.904 11.413 1.00 . A A . 22 VAL HG13 1 1 12 7968 1 1 22 VAL HG21 H -3.326 1.201 9.056 1.00 . A A . 22 VAL HG21 1 1 12 7969 1 1 22 VAL HG22 H -3.219 2.797 8.312 1.00 . A A . 22 VAL HG22 1 1 12 7970 1 1 22 VAL HG23 H -4.726 2.274 9.065 1.00 . A A . 22 VAL HG23 1 1 12 7971 1 1 22 VAL N N -5.309 3.811 10.965 1.00 . A A . 22 VAL N 1 1 12 7972 1 1 22 VAL O O -4.757 5.265 8.738 1.00 . A A . 22 VAL O 1 1 12 7973 1 1 23 GLN C C -1.152 5.874 7.117 1.00 . A A . 23 GLN C 1 1 12 7974 1 1 23 GLN CA C -2.419 6.298 7.873 1.00 . A A . 23 GLN CA 1 1 12 7975 1 1 23 GLN CB C -2.312 7.747 8.377 1.00 . A A . 23 GLN CB 1 1 12 7976 1 1 23 GLN CD C -0.804 9.170 9.780 1.00 . A A . 23 GLN CD 1 1 12 7977 1 1 23 GLN CG C -0.850 8.107 8.681 1.00 . A A . 23 GLN CG 1 1 12 7978 1 1 23 GLN H H -1.828 5.248 9.660 1.00 . A A . 23 GLN H 1 1 12 7979 1 1 23 GLN HA H -3.282 6.200 7.232 1.00 . A A . 23 GLN HA 1 1 12 7980 1 1 23 GLN HB2 H -2.694 8.416 7.621 1.00 . A A . 23 GLN HB2 1 1 12 7981 1 1 23 GLN HB3 H -2.899 7.855 9.278 1.00 . A A . 23 GLN HB3 1 1 12 7982 1 1 23 GLN HE21 H -0.345 7.874 11.212 1.00 . A A . 23 GLN HE21 1 1 12 7983 1 1 23 GLN HE22 H -0.490 9.488 11.715 1.00 . A A . 23 GLN HE22 1 1 12 7984 1 1 23 GLN HG2 H -0.321 7.223 9.008 1.00 . A A . 23 GLN HG2 1 1 12 7985 1 1 23 GLN HG3 H -0.383 8.495 7.787 1.00 . A A . 23 GLN HG3 1 1 12 7986 1 1 23 GLN N N -2.598 5.466 9.098 1.00 . A A . 23 GLN N 1 1 12 7987 1 1 23 GLN NE2 N -0.523 8.814 11.004 1.00 . A A . 23 GLN NE2 1 1 12 7988 1 1 23 GLN O O -1.061 6.019 5.914 1.00 . A A . 23 GLN O 1 1 12 7989 1 1 23 GLN OE1 O -1.025 10.337 9.523 1.00 . A A . 23 GLN OE1 1 1 12 7990 1 1 24 CYS C C 0.846 3.699 6.260 1.00 . A A . 24 CYS C 1 1 12 7991 1 1 24 CYS CA C 1.086 4.947 7.119 1.00 . A A . 24 CYS CA 1 1 12 7992 1 1 24 CYS CB C 2.102 4.683 8.245 1.00 . A A . 24 CYS CB 1 1 12 7993 1 1 24 CYS H H -0.248 5.257 8.779 1.00 . A A . 24 CYS H 1 1 12 7994 1 1 24 CYS HA H 1.442 5.752 6.497 1.00 . A A . 24 CYS HA 1 1 12 7995 1 1 24 CYS HB2 H 3.100 4.841 7.866 1.00 . A A . 24 CYS HB2 1 1 12 7996 1 1 24 CYS HB3 H 1.918 5.374 9.056 1.00 . A A . 24 CYS HB3 1 1 12 7997 1 1 24 CYS N N -0.167 5.361 7.809 1.00 . A A . 24 CYS N 1 1 12 7998 1 1 24 CYS O O -0.226 3.125 6.255 1.00 . A A . 24 CYS O 1 1 12 7999 1 1 24 CYS SG S 1.966 2.984 8.864 1.00 . A A . 24 CYS SG 1 1 12 8000 1 1 25 GLY C C 3.057 1.412 4.536 1.00 . A A . 25 GLY C 1 1 12 8001 1 1 25 GLY CA C 1.701 2.102 4.641 1.00 . A A . 25 GLY CA 1 1 12 8002 1 1 25 GLY H H 2.687 3.787 5.544 1.00 . A A . 25 GLY H 1 1 12 8003 1 1 25 GLY HA2 H 0.977 1.421 5.065 1.00 . A A . 25 GLY HA2 1 1 12 8004 1 1 25 GLY HA3 H 1.381 2.410 3.661 1.00 . A A . 25 GLY HA3 1 1 12 8005 1 1 25 GLY N N 1.840 3.295 5.525 1.00 . A A . 25 GLY N 1 1 12 8006 1 1 25 GLY O O 4.013 1.825 5.150 1.00 . A A . 25 GLY O 1 1 12 8007 1 1 26 TRP C C 5.279 0.333 2.525 1.00 . A A . 26 TRP C 1 1 12 8008 1 1 26 TRP CA C 4.471 -0.323 3.647 1.00 . A A . 26 TRP CA 1 1 12 8009 1 1 26 TRP CB C 4.127 -1.772 3.303 1.00 . A A . 26 TRP CB 1 1 12 8010 1 1 26 TRP CD1 C 6.194 -3.194 2.994 1.00 . A A . 26 TRP CD1 1 1 12 8011 1 1 26 TRP CD2 C 5.474 -3.157 5.124 1.00 . A A . 26 TRP CD2 1 1 12 8012 1 1 26 TRP CE2 C 6.620 -3.982 5.098 1.00 . A A . 26 TRP CE2 1 1 12 8013 1 1 26 TRP CE3 C 4.823 -2.965 6.353 1.00 . A A . 26 TRP CE3 1 1 12 8014 1 1 26 TRP CG C 5.222 -2.670 3.776 1.00 . A A . 26 TRP CG 1 1 12 8015 1 1 26 TRP CH2 C 6.447 -4.395 7.468 1.00 . A A . 26 TRP CH2 1 1 12 8016 1 1 26 TRP CZ2 C 7.107 -4.595 6.252 1.00 . A A . 26 TRP CZ2 1 1 12 8017 1 1 26 TRP CZ3 C 5.307 -3.581 7.519 1.00 . A A . 26 TRP CZ3 1 1 12 8018 1 1 26 TRP H H 2.377 0.040 3.270 1.00 . A A . 26 TRP H 1 1 12 8019 1 1 26 TRP HA H 5.011 -0.278 4.580 1.00 . A A . 26 TRP HA 1 1 12 8020 1 1 26 TRP HB2 H 3.203 -2.047 3.789 1.00 . A A . 26 TRP HB2 1 1 12 8021 1 1 26 TRP HB3 H 4.014 -1.873 2.236 1.00 . A A . 26 TRP HB3 1 1 12 8022 1 1 26 TRP HD1 H 6.301 -3.031 1.932 1.00 . A A . 26 TRP HD1 1 1 12 8023 1 1 26 TRP HE1 H 7.807 -4.466 3.454 1.00 . A A . 26 TRP HE1 1 1 12 8024 1 1 26 TRP HE3 H 3.948 -2.337 6.401 1.00 . A A . 26 TRP HE3 1 1 12 8025 1 1 26 TRP HH2 H 6.815 -4.867 8.367 1.00 . A A . 26 TRP HH2 1 1 12 8026 1 1 26 TRP HZ2 H 7.988 -5.220 6.207 1.00 . A A . 26 TRP HZ2 1 1 12 8027 1 1 26 TRP HZ3 H 4.798 -3.426 8.459 1.00 . A A . 26 TRP HZ3 1 1 12 8028 1 1 26 TRP N N 3.157 0.368 3.767 1.00 . A A . 26 TRP N 1 1 12 8029 1 1 26 TRP NE1 N 7.024 -3.973 3.778 1.00 . A A . 26 TRP NE1 1 1 12 8030 1 1 26 TRP O O 4.745 0.695 1.493 1.00 . A A . 26 TRP O 1 1 12 8031 1 1 27 CYS C C 8.730 0.522 1.485 1.00 . A A . 27 CYS C 1 1 12 8032 1 1 27 CYS CA C 7.371 1.203 1.680 1.00 . A A . 27 CYS CA 1 1 12 8033 1 1 27 CYS CB C 7.563 2.620 2.217 1.00 . A A . 27 CYS CB 1 1 12 8034 1 1 27 CYS H H 6.966 0.260 3.577 1.00 . A A . 27 CYS H 1 1 12 8035 1 1 27 CYS HA H 6.831 1.239 0.748 1.00 . A A . 27 CYS HA 1 1 12 8036 1 1 27 CYS HB2 H 6.773 2.843 2.916 1.00 . A A . 27 CYS HB2 1 1 12 8037 1 1 27 CYS HB3 H 8.516 2.687 2.721 1.00 . A A . 27 CYS HB3 1 1 12 8038 1 1 27 CYS N N 6.556 0.529 2.729 1.00 . A A . 27 CYS N 1 1 12 8039 1 1 27 CYS O O 9.673 0.767 2.210 1.00 . A A . 27 CYS O 1 1 12 8040 1 1 27 CYS SG S 7.515 3.813 0.858 1.00 . A A . 27 CYS SG 1 1 12 8041 1 1 28 HIS C C 10.740 -1.702 1.396 1.00 . A A . 28 HIS C 1 1 12 8042 1 1 28 HIS CA C 10.137 -0.979 0.180 1.00 . A A . 28 HIS CA 1 1 12 8043 1 1 28 HIS CB C 11.061 0.157 -0.260 1.00 . A A . 28 HIS CB 1 1 12 8044 1 1 28 HIS CD2 C 12.554 -1.545 -1.595 1.00 . A A . 28 HIS CD2 1 1 12 8045 1 1 28 HIS CE1 C 14.463 -0.554 -1.337 1.00 . A A . 28 HIS CE1 1 1 12 8046 1 1 28 HIS CG C 12.320 -0.416 -0.849 1.00 . A A . 28 HIS CG 1 1 12 8047 1 1 28 HIS H H 8.067 -0.454 -0.104 1.00 . A A . 28 HIS H 1 1 12 8048 1 1 28 HIS HA H 10.011 -1.670 -0.637 1.00 . A A . 28 HIS HA 1 1 12 8049 1 1 28 HIS HB2 H 10.560 0.762 -1.001 1.00 . A A . 28 HIS HB2 1 1 12 8050 1 1 28 HIS HB3 H 11.311 0.768 0.595 1.00 . A A . 28 HIS HB3 1 1 12 8051 1 1 28 HIS HD1 H 13.727 1.033 -0.211 1.00 . A A . 28 HIS HD1 1 1 12 8052 1 1 28 HIS HD2 H 11.801 -2.257 -1.897 1.00 . A A . 28 HIS HD2 1 1 12 8053 1 1 28 HIS HE1 H 15.516 -0.318 -1.389 1.00 . A A . 28 HIS HE1 1 1 12 8054 1 1 28 HIS N N 8.839 -0.300 0.480 1.00 . A A . 28 HIS N 1 1 12 8055 1 1 28 HIS ND1 N 13.553 0.199 -0.697 1.00 . A A . 28 HIS ND1 1 1 12 8056 1 1 28 HIS NE2 N 13.908 -1.630 -1.903 1.00 . A A . 28 HIS NE2 1 1 12 8057 1 1 28 HIS O O 11.858 -2.172 1.330 1.00 . A A . 28 HIS O 1 1 12 8058 1 1 29 ASP C C 9.803 -2.361 4.933 1.00 . A A . 29 ASP C 1 1 12 8059 1 1 29 ASP CA C 10.647 -2.530 3.667 1.00 . A A . 29 ASP CA 1 1 12 8060 1 1 29 ASP CB C 12.036 -1.907 3.874 1.00 . A A . 29 ASP CB 1 1 12 8061 1 1 29 ASP CG C 12.013 -0.415 3.523 1.00 . A A . 29 ASP CG 1 1 12 8062 1 1 29 ASP H H 9.138 -1.448 2.556 1.00 . A A . 29 ASP H 1 1 12 8063 1 1 29 ASP HA H 10.756 -3.577 3.438 1.00 . A A . 29 ASP HA 1 1 12 8064 1 1 29 ASP HB2 H 12.326 -2.026 4.908 1.00 . A A . 29 ASP HB2 1 1 12 8065 1 1 29 ASP HB3 H 12.752 -2.412 3.242 1.00 . A A . 29 ASP HB3 1 1 12 8066 1 1 29 ASP N N 10.041 -1.815 2.497 1.00 . A A . 29 ASP N 1 1 12 8067 1 1 29 ASP O O 9.048 -3.236 5.299 1.00 . A A . 29 ASP O 1 1 12 8068 1 1 29 ASP OD1 O 11.564 0.362 4.350 1.00 . A A . 29 ASP OD1 1 1 12 8069 1 1 29 ASP OD2 O 12.446 -0.076 2.434 1.00 . A A . 29 ASP OD2 1 1 12 8070 1 1 30 LYS C C 7.825 -0.380 6.607 1.00 . A A . 30 LYS C 1 1 12 8071 1 1 30 LYS CA C 9.164 -1.069 6.884 1.00 . A A . 30 LYS CA 1 1 12 8072 1 1 30 LYS CB C 10.058 -0.204 7.778 1.00 . A A . 30 LYS CB 1 1 12 8073 1 1 30 LYS CD C 11.277 1.967 7.569 1.00 . A A . 30 LYS CD 1 1 12 8074 1 1 30 LYS CE C 11.364 2.525 8.991 1.00 . A A . 30 LYS CE 1 1 12 8075 1 1 30 LYS CG C 9.929 1.266 7.380 1.00 . A A . 30 LYS CG 1 1 12 8076 1 1 30 LYS H H 10.574 -0.575 5.331 1.00 . A A . 30 LYS H 1 1 12 8077 1 1 30 LYS HA H 8.991 -2.021 7.359 1.00 . A A . 30 LYS HA 1 1 12 8078 1 1 30 LYS HB2 H 9.755 -0.323 8.808 1.00 . A A . 30 LYS HB2 1 1 12 8079 1 1 30 LYS HB3 H 11.085 -0.516 7.666 1.00 . A A . 30 LYS HB3 1 1 12 8080 1 1 30 LYS HD2 H 12.077 1.258 7.409 1.00 . A A . 30 LYS HD2 1 1 12 8081 1 1 30 LYS HD3 H 11.366 2.776 6.861 1.00 . A A . 30 LYS HD3 1 1 12 8082 1 1 30 LYS HE2 H 10.390 2.858 9.322 1.00 . A A . 30 LYS HE2 1 1 12 8083 1 1 30 LYS HE3 H 11.758 1.779 9.664 1.00 . A A . 30 LYS HE3 1 1 12 8084 1 1 30 LYS HG2 H 9.628 1.336 6.344 1.00 . A A . 30 LYS HG2 1 1 12 8085 1 1 30 LYS HG3 H 9.189 1.741 8.005 1.00 . A A . 30 LYS HG3 1 1 12 8086 1 1 30 LYS HZ1 H 13.183 3.367 8.432 1.00 . A A . 30 LYS HZ1 1 1 12 8087 1 1 30 LYS HZ2 H 12.520 4.027 9.850 1.00 . A A . 30 LYS HZ2 1 1 12 8088 1 1 30 LYS HZ3 H 11.869 4.435 8.335 1.00 . A A . 30 LYS HZ3 1 1 12 8089 1 1 30 LYS N N 9.943 -1.262 5.624 1.00 . A A . 30 LYS N 1 1 12 8090 1 1 30 LYS NZ N 12.305 3.674 8.894 1.00 . A A . 30 LYS NZ 1 1 12 8091 1 1 30 LYS O O 7.484 -0.083 5.478 1.00 . A A . 30 LYS O 1 1 12 8092 1 1 31 CYS C C 5.813 2.024 7.601 1.00 . A A . 31 CYS C 1 1 12 8093 1 1 31 CYS CA C 5.725 0.499 7.453 1.00 . A A . 31 CYS CA 1 1 12 8094 1 1 31 CYS CB C 4.859 -0.091 8.565 1.00 . A A . 31 CYS CB 1 1 12 8095 1 1 31 CYS H H 7.350 -0.411 8.532 1.00 . A A . 31 CYS H 1 1 12 8096 1 1 31 CYS HA H 5.311 0.239 6.493 1.00 . A A . 31 CYS HA 1 1 12 8097 1 1 31 CYS HB2 H 5.162 -1.110 8.754 1.00 . A A . 31 CYS HB2 1 1 12 8098 1 1 31 CYS HB3 H 4.981 0.493 9.465 1.00 . A A . 31 CYS HB3 1 1 12 8099 1 1 31 CYS N N 7.057 -0.146 7.636 1.00 . A A . 31 CYS N 1 1 12 8100 1 1 31 CYS O O 5.912 2.550 8.691 1.00 . A A . 31 CYS O 1 1 12 8101 1 1 31 CYS SG S 3.120 -0.065 8.060 1.00 . A A . 31 CYS SG 1 1 12 8102 1 1 32 VAL C C 4.908 4.797 5.458 1.00 . A A . 32 VAL C 1 1 12 8103 1 1 32 VAL CA C 5.801 4.221 6.566 1.00 . A A . 32 VAL CA 1 1 12 8104 1 1 32 VAL CB C 7.272 4.598 6.345 1.00 . A A . 32 VAL CB 1 1 12 8105 1 1 32 VAL CG1 C 8.177 3.606 7.076 1.00 . A A . 32 VAL CG1 1 1 12 8106 1 1 32 VAL CG2 C 7.598 4.574 4.849 1.00 . A A . 32 VAL CG2 1 1 12 8107 1 1 32 VAL H H 5.655 2.282 5.642 1.00 . A A . 32 VAL H 1 1 12 8108 1 1 32 VAL HA H 5.470 4.569 7.532 1.00 . A A . 32 VAL HA 1 1 12 8109 1 1 32 VAL HB H 7.446 5.590 6.736 1.00 . A A . 32 VAL HB 1 1 12 8110 1 1 32 VAL HG11 H 7.988 2.608 6.709 1.00 . A A . 32 VAL HG11 1 1 12 8111 1 1 32 VAL HG12 H 7.971 3.644 8.136 1.00 . A A . 32 VAL HG12 1 1 12 8112 1 1 32 VAL HG13 H 9.211 3.864 6.901 1.00 . A A . 32 VAL HG13 1 1 12 8113 1 1 32 VAL HG21 H 8.555 4.096 4.696 1.00 . A A . 32 VAL HG21 1 1 12 8114 1 1 32 VAL HG22 H 7.635 5.585 4.472 1.00 . A A . 32 VAL HG22 1 1 12 8115 1 1 32 VAL HG23 H 6.833 4.023 4.325 1.00 . A A . 32 VAL HG23 1 1 12 8116 1 1 32 VAL N N 5.752 2.732 6.507 1.00 . A A . 32 VAL N 1 1 12 8117 1 1 32 VAL O O 4.405 4.074 4.621 1.00 . A A . 32 VAL O 1 1 12 8118 1 1 33 ARG C C 4.684 7.553 3.439 1.00 . A A . 33 ARG C 1 1 12 8119 1 1 33 ARG CA C 3.843 6.684 4.382 1.00 . A A . 33 ARG CA 1 1 12 8120 1 1 33 ARG CB C 2.816 7.528 5.139 1.00 . A A . 33 ARG CB 1 1 12 8121 1 1 33 ARG CD C 0.731 8.821 4.656 1.00 . A A . 33 ARG CD 1 1 12 8122 1 1 33 ARG CG C 1.493 7.525 4.369 1.00 . A A . 33 ARG CG 1 1 12 8123 1 1 33 ARG CZ C 0.188 9.754 2.490 1.00 . A A . 33 ARG CZ 1 1 12 8124 1 1 33 ARG H H 5.117 6.658 6.122 1.00 . A A . 33 ARG H 1 1 12 8125 1 1 33 ARG HA H 3.342 5.907 3.826 1.00 . A A . 33 ARG HA 1 1 12 8126 1 1 33 ARG HB2 H 2.662 7.109 6.122 1.00 . A A . 33 ARG HB2 1 1 12 8127 1 1 33 ARG HB3 H 3.174 8.541 5.233 1.00 . A A . 33 ARG HB3 1 1 12 8128 1 1 33 ARG HD2 H -0.330 8.623 4.726 1.00 . A A . 33 ARG HD2 1 1 12 8129 1 1 33 ARG HD3 H 1.092 9.279 5.564 1.00 . A A . 33 ARG HD3 1 1 12 8130 1 1 33 ARG HE H 1.841 10.239 3.476 1.00 . A A . 33 ARG HE 1 1 12 8131 1 1 33 ARG HG2 H 1.694 7.451 3.310 1.00 . A A . 33 ARG HG2 1 1 12 8132 1 1 33 ARG HG3 H 0.896 6.682 4.682 1.00 . A A . 33 ARG HG3 1 1 12 8133 1 1 33 ARG HH11 H 0.889 8.091 1.625 1.00 . A A . 33 ARG HH11 1 1 12 8134 1 1 33 ARG HH12 H -0.415 8.874 0.797 1.00 . A A . 33 ARG HH12 1 1 12 8135 1 1 33 ARG HH21 H -0.708 11.428 3.124 1.00 . A A . 33 ARG HH21 1 1 12 8136 1 1 33 ARG HH22 H -1.321 10.765 1.647 1.00 . A A . 33 ARG HH22 1 1 12 8137 1 1 33 ARG N N 4.706 6.085 5.442 1.00 . A A . 33 ARG N 1 1 12 8138 1 1 33 ARG NE N 1.022 9.701 3.491 1.00 . A A . 33 ARG NE 1 1 12 8139 1 1 33 ARG NH1 N 0.223 8.835 1.565 1.00 . A A . 33 ARG NH1 1 1 12 8140 1 1 33 ARG NH2 N -0.682 10.724 2.414 1.00 . A A . 33 ARG NH2 1 1 12 8141 1 1 33 ARG O O 5.812 7.891 3.734 1.00 . A A . 33 ARG O 1 1 12 8142 1 1 34 SER C C 5.679 9.846 2.075 1.00 . A A . 34 SER C 1 1 12 8143 1 1 34 SER CA C 4.911 8.747 1.337 1.00 . A A . 34 SER CA 1 1 12 8144 1 1 34 SER CB C 3.853 9.357 0.418 1.00 . A A . 34 SER CB 1 1 12 8145 1 1 34 SER H H 3.234 7.617 2.084 1.00 . A A . 34 SER H 1 1 12 8146 1 1 34 SER HA H 5.587 8.135 0.761 1.00 . A A . 34 SER HA 1 1 12 8147 1 1 34 SER HB2 H 2.880 9.255 0.869 1.00 . A A . 34 SER HB2 1 1 12 8148 1 1 34 SER HB3 H 4.070 10.408 0.270 1.00 . A A . 34 SER HB3 1 1 12 8149 1 1 34 SER HG H 4.285 9.249 -1.476 1.00 . A A . 34 SER HG 1 1 12 8150 1 1 34 SER N N 4.144 7.907 2.304 1.00 . A A . 34 SER N 1 1 12 8151 1 1 34 SER O O 6.792 10.181 1.720 1.00 . A A . 34 SER O 1 1 12 8152 1 1 34 SER OG O 3.864 8.678 -0.830 1.00 . A A . 34 SER OG 1 1 12 8153 1 1 35 GLU C C 7.113 10.954 4.434 1.00 . A A . 35 GLU C 1 1 12 8154 1 1 35 GLU CA C 5.798 11.483 3.854 1.00 . A A . 35 GLU CA 1 1 12 8155 1 1 35 GLU CB C 4.832 11.865 4.976 1.00 . A A . 35 GLU CB 1 1 12 8156 1 1 35 GLU CD C 4.031 14.228 4.927 1.00 . A A . 35 GLU CD 1 1 12 8157 1 1 35 GLU CG C 5.126 13.292 5.440 1.00 . A A . 35 GLU CG 1 1 12 8158 1 1 35 GLU H H 4.199 10.122 3.367 1.00 . A A . 35 GLU H 1 1 12 8159 1 1 35 GLU HA H 5.981 12.334 3.219 1.00 . A A . 35 GLU HA 1 1 12 8160 1 1 35 GLU HB2 H 3.816 11.807 4.612 1.00 . A A . 35 GLU HB2 1 1 12 8161 1 1 35 GLU HB3 H 4.956 11.186 5.806 1.00 . A A . 35 GLU HB3 1 1 12 8162 1 1 35 GLU HG2 H 5.151 13.321 6.520 1.00 . A A . 35 GLU HG2 1 1 12 8163 1 1 35 GLU HG3 H 6.081 13.609 5.049 1.00 . A A . 35 GLU HG3 1 1 12 8164 1 1 35 GLU N N 5.098 10.408 3.097 1.00 . A A . 35 GLU N 1 1 12 8165 1 1 35 GLU O O 8.022 11.705 4.729 1.00 . A A . 35 GLU O 1 1 12 8166 1 1 35 GLU OE1 O 3.023 14.354 5.603 1.00 . A A . 35 GLU OE1 1 1 12 8167 1 1 35 GLU OE2 O 4.218 14.802 3.867 1.00 . A A . 35 GLU OE2 1 1 12 8168 1 1 36 GLU C C 9.220 8.293 4.092 1.00 . A A . 36 GLU C 1 1 12 8169 1 1 36 GLU CA C 8.474 9.086 5.166 1.00 . A A . 36 GLU CA 1 1 12 8170 1 1 36 GLU CB C 8.011 8.157 6.285 1.00 . A A . 36 GLU CB 1 1 12 8171 1 1 36 GLU CD C 10.177 7.281 7.173 1.00 . A A . 36 GLU CD 1 1 12 8172 1 1 36 GLU CG C 9.003 8.223 7.447 1.00 . A A . 36 GLU CG 1 1 12 8173 1 1 36 GLU H H 6.474 9.076 4.361 1.00 . A A . 36 GLU H 1 1 12 8174 1 1 36 GLU HA H 9.102 9.864 5.567 1.00 . A A . 36 GLU HA 1 1 12 8175 1 1 36 GLU HB2 H 7.033 8.463 6.626 1.00 . A A . 36 GLU HB2 1 1 12 8176 1 1 36 GLU HB3 H 7.962 7.146 5.913 1.00 . A A . 36 GLU HB3 1 1 12 8177 1 1 36 GLU HG2 H 9.368 9.235 7.549 1.00 . A A . 36 GLU HG2 1 1 12 8178 1 1 36 GLU HG3 H 8.509 7.923 8.359 1.00 . A A . 36 GLU HG3 1 1 12 8179 1 1 36 GLU N N 7.219 9.664 4.603 1.00 . A A . 36 GLU N 1 1 12 8180 1 1 36 GLU O O 10.385 7.979 4.235 1.00 . A A . 36 GLU O 1 1 12 8181 1 1 36 GLU OE1 O 10.006 6.367 6.385 1.00 . A A . 36 GLU OE1 1 1 12 8182 1 1 36 GLU OE2 O 11.227 7.489 7.759 1.00 . A A . 36 GLU OE2 1 1 12 8183 1 1 37 CYS C C 10.259 8.073 1.220 1.00 . A A . 37 CYS C 1 1 12 8184 1 1 37 CYS CA C 9.232 7.190 1.934 1.00 . A A . 37 CYS CA 1 1 12 8185 1 1 37 CYS CB C 8.113 6.786 0.971 1.00 . A A . 37 CYS CB 1 1 12 8186 1 1 37 CYS H H 7.619 8.227 2.920 1.00 . A A . 37 CYS H 1 1 12 8187 1 1 37 CYS HA H 9.706 6.309 2.339 1.00 . A A . 37 CYS HA 1 1 12 8188 1 1 37 CYS HB2 H 7.530 7.658 0.712 1.00 . A A . 37 CYS HB2 1 1 12 8189 1 1 37 CYS HB3 H 8.544 6.365 0.075 1.00 . A A . 37 CYS HB3 1 1 12 8190 1 1 37 CYS N N 8.558 7.965 3.015 1.00 . A A . 37 CYS N 1 1 12 8191 1 1 37 CYS O O 10.131 9.281 1.180 1.00 . A A . 37 CYS O 1 1 12 8192 1 1 37 CYS SG S 7.041 5.559 1.762 1.00 . A A . 37 CYS SG 1 1 12 8193 1 1 38 LEU C C 11.745 8.850 -1.354 1.00 . A A . 38 LEU C 1 1 12 8194 1 1 38 LEU CA C 12.313 8.290 -0.048 1.00 . A A . 38 LEU CA 1 1 12 8195 1 1 38 LEU CB C 13.450 7.311 -0.332 1.00 . A A . 38 LEU CB 1 1 12 8196 1 1 38 LEU CD1 C 14.647 5.441 0.814 1.00 . A A . 38 LEU CD1 1 1 12 8197 1 1 38 LEU CD2 C 15.157 7.810 1.417 1.00 . A A . 38 LEU CD2 1 1 12 8198 1 1 38 LEU CG C 14.054 6.840 0.990 1.00 . A A . 38 LEU CG 1 1 12 8199 1 1 38 LEU H H 11.365 6.507 0.705 1.00 . A A . 38 LEU H 1 1 12 8200 1 1 38 LEU HA H 12.664 9.089 0.584 1.00 . A A . 38 LEU HA 1 1 12 8201 1 1 38 LEU HB2 H 13.066 6.461 -0.878 1.00 . A A . 38 LEU HB2 1 1 12 8202 1 1 38 LEU HB3 H 14.211 7.802 -0.919 1.00 . A A . 38 LEU HB3 1 1 12 8203 1 1 38 LEU HD11 H 14.713 4.954 1.776 1.00 . A A . 38 LEU HD11 1 1 12 8204 1 1 38 LEU HD12 H 15.633 5.518 0.382 1.00 . A A . 38 LEU HD12 1 1 12 8205 1 1 38 LEU HD13 H 14.012 4.860 0.161 1.00 . A A . 38 LEU HD13 1 1 12 8206 1 1 38 LEU HD21 H 15.359 7.687 2.469 1.00 . A A . 38 LEU HD21 1 1 12 8207 1 1 38 LEU HD22 H 14.835 8.825 1.228 1.00 . A A . 38 LEU HD22 1 1 12 8208 1 1 38 LEU HD23 H 16.054 7.608 0.850 1.00 . A A . 38 LEU HD23 1 1 12 8209 1 1 38 LEU HG H 13.284 6.811 1.747 1.00 . A A . 38 LEU HG 1 1 12 8210 1 1 38 LEU N N 11.278 7.482 0.660 1.00 . A A . 38 LEU N 1 1 12 8211 1 1 38 LEU O O 11.610 10.046 -1.520 1.00 . A A . 38 LEU O 1 1 12 8212 1 1 39 SER C C 9.324 8.558 -3.486 1.00 . A A . 39 SER C 1 1 12 8213 1 1 39 SER CA C 10.850 8.481 -3.573 1.00 . A A . 39 SER CA 1 1 12 8214 1 1 39 SER CB C 11.279 7.441 -4.607 1.00 . A A . 39 SER CB 1 1 12 8215 1 1 39 SER H H 11.525 7.035 -2.126 1.00 . A A . 39 SER H 1 1 12 8216 1 1 39 SER HA H 11.264 9.445 -3.825 1.00 . A A . 39 SER HA 1 1 12 8217 1 1 39 SER HB2 H 12.115 6.877 -4.230 1.00 . A A . 39 SER HB2 1 1 12 8218 1 1 39 SER HB3 H 10.454 6.769 -4.805 1.00 . A A . 39 SER HB3 1 1 12 8219 1 1 39 SER HG H 12.455 7.674 -6.140 1.00 . A A . 39 SER HG 1 1 12 8220 1 1 39 SER N N 11.410 7.995 -2.280 1.00 . A A . 39 SER N 1 1 12 8221 1 1 39 SER O O 8.751 8.507 -2.416 1.00 . A A . 39 SER O 1 1 12 8222 1 1 39 SER OG O 11.664 8.103 -5.805 1.00 . A A . 39 SER OG 1 1 12 8223 1 1 40 GLY C C 6.579 7.361 -4.739 1.00 . A A . 40 GLY C 1 1 12 8224 1 1 40 GLY CA C 7.171 8.763 -4.576 1.00 . A A . 40 GLY CA 1 1 12 8225 1 1 40 GLY H H 9.138 8.722 -5.457 1.00 . A A . 40 GLY H 1 1 12 8226 1 1 40 GLY HA2 H 6.852 9.183 -3.633 1.00 . A A . 40 GLY HA2 1 1 12 8227 1 1 40 GLY HA3 H 6.830 9.390 -5.385 1.00 . A A . 40 GLY HA3 1 1 12 8228 1 1 40 GLY N N 8.659 8.682 -4.603 1.00 . A A . 40 GLY N 1 1 12 8229 1 1 40 GLY O O 5.765 7.118 -5.608 1.00 . A A . 40 GLY O 1 1 12 8230 1 1 41 THR C C 5.877 4.596 -2.668 1.00 . A A . 41 THR C 1 1 12 8231 1 1 41 THR CA C 6.440 5.050 -4.018 1.00 . A A . 41 THR CA 1 1 12 8232 1 1 41 THR CB C 7.637 4.186 -4.419 1.00 . A A . 41 THR CB 1 1 12 8233 1 1 41 THR CG2 C 8.670 4.182 -3.292 1.00 . A A . 41 THR CG2 1 1 12 8234 1 1 41 THR H H 7.639 6.652 -3.216 1.00 . A A . 41 THR H 1 1 12 8235 1 1 41 THR HA H 5.679 5.001 -4.781 1.00 . A A . 41 THR HA 1 1 12 8236 1 1 41 THR HB H 8.088 4.588 -5.314 1.00 . A A . 41 THR HB 1 1 12 8237 1 1 41 THR HG1 H 7.972 2.313 -4.820 1.00 . A A . 41 THR HG1 1 1 12 8238 1 1 41 THR HG21 H 8.374 3.470 -2.536 1.00 . A A . 41 THR HG21 1 1 12 8239 1 1 41 THR HG22 H 8.730 5.167 -2.853 1.00 . A A . 41 THR HG22 1 1 12 8240 1 1 41 THR HG23 H 9.635 3.906 -3.689 1.00 . A A . 41 THR HG23 1 1 12 8241 1 1 41 THR N N 6.982 6.436 -3.910 1.00 . A A . 41 THR N 1 1 12 8242 1 1 41 THR O O 6.565 4.595 -1.666 1.00 . A A . 41 THR O 1 1 12 8243 1 1 41 THR OG1 O 7.197 2.857 -4.665 1.00 . A A . 41 THR OG1 1 1 12 8244 1 1 42 TRP C C 3.072 2.581 -1.613 1.00 . A A . 42 TRP C 1 1 12 8245 1 1 42 TRP CA C 4.021 3.756 -1.353 1.00 . A A . 42 TRP CA 1 1 12 8246 1 1 42 TRP CB C 3.249 4.974 -0.839 1.00 . A A . 42 TRP CB 1 1 12 8247 1 1 42 TRP CD1 C 3.254 4.582 1.657 1.00 . A A . 42 TRP CD1 1 1 12 8248 1 1 42 TRP CD2 C 1.205 4.376 0.750 1.00 . A A . 42 TRP CD2 1 1 12 8249 1 1 42 TRP CE2 C 1.061 4.139 2.136 1.00 . A A . 42 TRP CE2 1 1 12 8250 1 1 42 TRP CE3 C 0.056 4.306 -0.058 1.00 . A A . 42 TRP CE3 1 1 12 8251 1 1 42 TRP CG C 2.606 4.655 0.471 1.00 . A A . 42 TRP CG 1 1 12 8252 1 1 42 TRP CH2 C -1.312 3.777 1.885 1.00 . A A . 42 TRP CH2 1 1 12 8253 1 1 42 TRP CZ2 C -0.181 3.844 2.701 1.00 . A A . 42 TRP CZ2 1 1 12 8254 1 1 42 TRP CZ3 C -1.194 4.008 0.507 1.00 . A A . 42 TRP CZ3 1 1 12 8255 1 1 42 TRP H H 4.095 4.219 -3.456 1.00 . A A . 42 TRP H 1 1 12 8256 1 1 42 TRP HA H 4.786 3.476 -0.646 1.00 . A A . 42 TRP HA 1 1 12 8257 1 1 42 TRP HB2 H 3.928 5.802 -0.708 1.00 . A A . 42 TRP HB2 1 1 12 8258 1 1 42 TRP HB3 H 2.486 5.245 -1.555 1.00 . A A . 42 TRP HB3 1 1 12 8259 1 1 42 TRP HD1 H 4.311 4.739 1.805 1.00 . A A . 42 TRP HD1 1 1 12 8260 1 1 42 TRP HE1 H 2.550 4.167 3.597 1.00 . A A . 42 TRP HE1 1 1 12 8261 1 1 42 TRP HE3 H 0.137 4.481 -1.121 1.00 . A A . 42 TRP HE3 1 1 12 8262 1 1 42 TRP HH2 H -2.276 3.549 2.314 1.00 . A A . 42 TRP HH2 1 1 12 8263 1 1 42 TRP HZ2 H -0.265 3.666 3.763 1.00 . A A . 42 TRP HZ2 1 1 12 8264 1 1 42 TRP HZ3 H -2.070 3.957 -0.123 1.00 . A A . 42 TRP HZ3 1 1 12 8265 1 1 42 TRP N N 4.631 4.210 -2.636 1.00 . A A . 42 TRP N 1 1 12 8266 1 1 42 TRP NE1 N 2.338 4.277 2.647 1.00 . A A . 42 TRP NE1 1 1 12 8267 1 1 42 TRP O O 2.191 2.658 -2.447 1.00 . A A . 42 TRP O 1 1 12 8268 1 1 43 THR C C 1.557 0.011 0.143 1.00 . A A . 43 THR C 1 1 12 8269 1 1 43 THR CA C 2.346 0.321 -1.130 1.00 . A A . 43 THR CA 1 1 12 8270 1 1 43 THR CB C 3.280 -0.840 -1.486 1.00 . A A . 43 THR CB 1 1 12 8271 1 1 43 THR CG2 C 4.404 -0.938 -0.455 1.00 . A A . 43 THR CG2 1 1 12 8272 1 1 43 THR H H 3.959 1.445 -0.241 1.00 . A A . 43 THR H 1 1 12 8273 1 1 43 THR HA H 1.672 0.514 -1.950 1.00 . A A . 43 THR HA 1 1 12 8274 1 1 43 THR HB H 3.707 -0.671 -2.462 1.00 . A A . 43 THR HB 1 1 12 8275 1 1 43 THR HG1 H 1.626 -1.842 -1.705 1.00 . A A . 43 THR HG1 1 1 12 8276 1 1 43 THR HG21 H 5.000 -1.816 -0.654 1.00 . A A . 43 THR HG21 1 1 12 8277 1 1 43 THR HG22 H 3.979 -1.011 0.536 1.00 . A A . 43 THR HG22 1 1 12 8278 1 1 43 THR HG23 H 5.027 -0.058 -0.515 1.00 . A A . 43 THR HG23 1 1 12 8279 1 1 43 THR N N 3.243 1.493 -0.910 1.00 . A A . 43 THR N 1 1 12 8280 1 1 43 THR O O 2.071 0.091 1.242 1.00 . A A . 43 THR O 1 1 12 8281 1 1 43 THR OG1 O 2.539 -2.052 -1.497 1.00 . A A . 43 THR OG1 1 1 12 8282 1 1 44 GLN C C -1.213 -2.004 1.032 1.00 . A A . 44 GLN C 1 1 12 8283 1 1 44 GLN CA C -0.515 -0.655 1.207 1.00 . A A . 44 GLN CA 1 1 12 8284 1 1 44 GLN CB C -1.544 0.472 1.291 1.00 . A A . 44 GLN CB 1 1 12 8285 1 1 44 GLN CD C -3.448 0.716 2.893 1.00 . A A . 44 GLN CD 1 1 12 8286 1 1 44 GLN CG C -1.925 0.707 2.755 1.00 . A A . 44 GLN CG 1 1 12 8287 1 1 44 GLN H H -0.088 -0.399 -0.889 1.00 . A A . 44 GLN H 1 1 12 8288 1 1 44 GLN HA H 0.098 -0.660 2.093 1.00 . A A . 44 GLN HA 1 1 12 8289 1 1 44 GLN HB2 H -1.122 1.376 0.878 1.00 . A A . 44 GLN HB2 1 1 12 8290 1 1 44 GLN HB3 H -2.426 0.198 0.732 1.00 . A A . 44 GLN HB3 1 1 12 8291 1 1 44 GLN HE21 H -3.489 2.436 3.886 1.00 . A A . 44 GLN HE21 1 1 12 8292 1 1 44 GLN HE22 H -5.004 1.722 3.608 1.00 . A A . 44 GLN HE22 1 1 12 8293 1 1 44 GLN HG2 H -1.512 -0.084 3.364 1.00 . A A . 44 GLN HG2 1 1 12 8294 1 1 44 GLN HG3 H -1.530 1.656 3.081 1.00 . A A . 44 GLN HG3 1 1 12 8295 1 1 44 GLN N N 0.309 -0.342 0.006 1.00 . A A . 44 GLN N 1 1 12 8296 1 1 44 GLN NE2 N -4.029 1.707 3.513 1.00 . A A . 44 GLN NE2 1 1 12 8297 1 1 44 GLN O O -2.226 -2.273 1.647 1.00 . A A . 44 GLN O 1 1 12 8298 1 1 44 GLN OE1 O -4.118 -0.187 2.432 1.00 . A A . 44 GLN OE1 1 1 12 8299 1 1 45 GLN C C -0.268 -5.219 -0.419 1.00 . A A . 45 GLN C 1 1 12 8300 1 1 45 GLN CA C -1.318 -4.189 0.002 1.00 . A A . 45 GLN CA 1 1 12 8301 1 1 45 GLN CB C -2.335 -3.971 -1.120 1.00 . A A . 45 GLN CB 1 1 12 8302 1 1 45 GLN CD C -2.712 -2.808 -3.302 1.00 . A A . 45 GLN CD 1 1 12 8303 1 1 45 GLN CG C -1.654 -3.272 -2.300 1.00 . A A . 45 GLN CG 1 1 12 8304 1 1 45 GLN H H 0.139 -2.626 -0.284 1.00 . A A . 45 GLN H 1 1 12 8305 1 1 45 GLN HA H -1.822 -4.506 0.901 1.00 . A A . 45 GLN HA 1 1 12 8306 1 1 45 GLN HB2 H -2.725 -4.926 -1.444 1.00 . A A . 45 GLN HB2 1 1 12 8307 1 1 45 GLN HB3 H -3.145 -3.356 -0.759 1.00 . A A . 45 GLN HB3 1 1 12 8308 1 1 45 GLN HE21 H -2.485 -0.884 -2.868 1.00 . A A . 45 GLN HE21 1 1 12 8309 1 1 45 GLN HE22 H -3.641 -1.226 -4.063 1.00 . A A . 45 GLN HE22 1 1 12 8310 1 1 45 GLN HG2 H -1.100 -2.417 -1.938 1.00 . A A . 45 GLN HG2 1 1 12 8311 1 1 45 GLN HG3 H -0.978 -3.959 -2.784 1.00 . A A . 45 GLN HG3 1 1 12 8312 1 1 45 GLN N N -0.680 -2.857 0.202 1.00 . A A . 45 GLN N 1 1 12 8313 1 1 45 GLN NE2 N -2.968 -1.534 -3.421 1.00 . A A . 45 GLN NE2 1 1 12 8314 1 1 45 GLN O O 0.168 -5.248 -1.553 1.00 . A A . 45 GLN O 1 1 12 8315 1 1 45 GLN OE1 O -3.311 -3.613 -3.989 1.00 . A A . 45 GLN OE1 1 1 12 8316 1 1 46 ILE C C 0.956 -8.351 1.002 1.00 . A A . 46 ILE C 1 1 12 8317 1 1 46 ILE CA C 1.150 -7.105 0.133 1.00 . A A . 46 ILE CA 1 1 12 8318 1 1 46 ILE CB C 2.503 -6.454 0.418 1.00 . A A . 46 ILE CB 1 1 12 8319 1 1 46 ILE CD1 C 4.651 -6.783 -0.814 1.00 . A A . 46 ILE CD1 1 1 12 8320 1 1 46 ILE CG1 C 3.618 -7.450 0.095 1.00 . A A . 46 ILE CG1 1 1 12 8321 1 1 46 ILE CG2 C 2.583 -6.061 1.894 1.00 . A A . 46 ILE CG2 1 1 12 8322 1 1 46 ILE H H -0.234 -6.033 1.391 1.00 . A A . 46 ILE H 1 1 12 8323 1 1 46 ILE HA H 1.078 -7.362 -0.911 1.00 . A A . 46 ILE HA 1 1 12 8324 1 1 46 ILE HB H 2.614 -5.572 -0.197 1.00 . A A . 46 ILE HB 1 1 12 8325 1 1 46 ILE HD11 H 4.473 -7.076 -1.839 1.00 . A A . 46 ILE HD11 1 1 12 8326 1 1 46 ILE HD12 H 5.643 -7.092 -0.519 1.00 . A A . 46 ILE HD12 1 1 12 8327 1 1 46 ILE HD13 H 4.567 -5.710 -0.727 1.00 . A A . 46 ILE HD13 1 1 12 8328 1 1 46 ILE HG12 H 4.094 -7.766 1.011 1.00 . A A . 46 ILE HG12 1 1 12 8329 1 1 46 ILE HG13 H 3.199 -8.307 -0.410 1.00 . A A . 46 ILE HG13 1 1 12 8330 1 1 46 ILE HG21 H 2.604 -6.952 2.503 1.00 . A A . 46 ILE HG21 1 1 12 8331 1 1 46 ILE HG22 H 1.721 -5.465 2.156 1.00 . A A . 46 ILE HG22 1 1 12 8332 1 1 46 ILE HG23 H 3.482 -5.487 2.064 1.00 . A A . 46 ILE HG23 1 1 12 8333 1 1 46 ILE N N 0.136 -6.071 0.484 1.00 . A A . 46 ILE N 1 1 12 8334 1 1 46 ILE O O 1.082 -9.469 0.543 1.00 . A A . 46 ILE O 1 1 12 8335 1 1 47 CYS C C -0.855 -9.181 3.939 1.00 . A A . 47 CYS C 1 1 12 8336 1 1 47 CYS CA C 0.458 -9.329 3.164 1.00 . A A . 47 CYS CA 1 1 12 8337 1 1 47 CYS CB C 1.653 -9.289 4.121 1.00 . A A . 47 CYS CB 1 1 12 8338 1 1 47 CYS H H 0.563 -7.252 2.607 1.00 . A A . 47 CYS H 1 1 12 8339 1 1 47 CYS HA H 0.466 -10.251 2.604 1.00 . A A . 47 CYS HA 1 1 12 8340 1 1 47 CYS HB2 H 1.700 -10.211 4.680 1.00 . A A . 47 CYS HB2 1 1 12 8341 1 1 47 CYS HB3 H 2.564 -9.167 3.553 1.00 . A A . 47 CYS HB3 1 1 12 8342 1 1 47 CYS N N 0.655 -8.163 2.257 1.00 . A A . 47 CYS N 1 1 12 8343 1 1 47 CYS O O -1.238 -8.095 4.326 1.00 . A A . 47 CYS O 1 1 12 8344 1 1 47 CYS SG S 1.465 -7.897 5.267 1.00 . A A . 47 CYS SG 1 1 12 8345 1 1 48 LEU C C -2.684 -10.825 6.300 1.00 . A A . 48 LEU C 1 1 12 8346 1 1 48 LEU CA C -2.830 -10.174 4.923 1.00 . A A . 48 LEU CA 1 1 12 8347 1 1 48 LEU CB C -3.838 -10.941 4.070 1.00 . A A . 48 LEU CB 1 1 12 8348 1 1 48 LEU CD1 C -3.986 -9.495 2.036 1.00 . A A . 48 LEU CD1 1 1 12 8349 1 1 48 LEU CD2 C -6.027 -10.629 2.919 1.00 . A A . 48 LEU CD2 1 1 12 8350 1 1 48 LEU CG C -4.713 -9.950 3.304 1.00 . A A . 48 LEU CG 1 1 12 8351 1 1 48 LEU H H -1.224 -11.130 3.852 1.00 . A A . 48 LEU H 1 1 12 8352 1 1 48 LEU HA H -3.138 -9.146 5.022 1.00 . A A . 48 LEU HA 1 1 12 8353 1 1 48 LEU HB2 H -3.311 -11.574 3.371 1.00 . A A . 48 LEU HB2 1 1 12 8354 1 1 48 LEU HB3 H -4.461 -11.550 4.708 1.00 . A A . 48 LEU HB3 1 1 12 8355 1 1 48 LEU HD11 H -3.527 -10.349 1.559 1.00 . A A . 48 LEU HD11 1 1 12 8356 1 1 48 LEU HD12 H -3.224 -8.776 2.296 1.00 . A A . 48 LEU HD12 1 1 12 8357 1 1 48 LEU HD13 H -4.694 -9.041 1.358 1.00 . A A . 48 LEU HD13 1 1 12 8358 1 1 48 LEU HD21 H -5.815 -11.550 2.398 1.00 . A A . 48 LEU HD21 1 1 12 8359 1 1 48 LEU HD22 H -6.597 -9.974 2.277 1.00 . A A . 48 LEU HD22 1 1 12 8360 1 1 48 LEU HD23 H -6.595 -10.843 3.812 1.00 . A A . 48 LEU HD23 1 1 12 8361 1 1 48 LEU HG H -4.917 -9.093 3.928 1.00 . A A . 48 LEU HG 1 1 12 8362 1 1 48 LEU N N -1.547 -10.262 4.172 1.00 . A A . 48 LEU N 1 1 12 8363 1 1 48 LEU O O -1.558 -11.082 6.696 1.00 . A A . 48 LEU O 1 1 12 8364 1 1 48 LEU OXT O -3.699 -11.054 6.936 1.00 . A A . 48 LEU OXT 1 1 13 8365 1 1 1 GLY C C -7.569 10.098 13.729 1.00 . A A . 1 GLY C 1 1 13 8366 1 1 1 GLY CA C -8.880 10.574 14.357 1.00 . A A . 1 GLY CA 1 1 13 8367 1 1 1 GLY H1 H -9.721 10.359 16.250 1.00 . A A . 1 GLY H1 1 1 13 8368 1 1 1 GLY H2 H -8.254 9.528 16.046 1.00 . A A . 1 GLY H2 1 1 13 8369 1 1 1 GLY H3 H -9.679 8.925 15.346 1.00 . A A . 1 GLY H3 1 1 13 8370 1 1 1 GLY HA2 H -9.689 10.435 13.655 1.00 . A A . 1 GLY HA2 1 1 13 8371 1 1 1 GLY HA3 H -8.794 11.621 14.608 1.00 . A A . 1 GLY HA3 1 1 13 8372 1 1 1 GLY N N -9.155 9.787 15.593 1.00 . A A . 1 GLY N 1 1 13 8373 1 1 1 GLY O O -7.556 9.226 12.882 1.00 . A A . 1 GLY O 1 1 13 8374 1 1 2 SER C C -4.365 9.430 14.585 1.00 . A A . 2 SER C 1 1 13 8375 1 1 2 SER CA C -5.158 10.241 13.557 1.00 . A A . 2 SER CA 1 1 13 8376 1 1 2 SER CB C -4.434 11.544 13.222 1.00 . A A . 2 SER CB 1 1 13 8377 1 1 2 SER H H -6.496 11.364 14.818 1.00 . A A . 2 SER H 1 1 13 8378 1 1 2 SER HA H -5.312 9.664 12.659 1.00 . A A . 2 SER HA 1 1 13 8379 1 1 2 SER HB2 H -4.931 12.369 13.704 1.00 . A A . 2 SER HB2 1 1 13 8380 1 1 2 SER HB3 H -3.412 11.488 13.573 1.00 . A A . 2 SER HB3 1 1 13 8381 1 1 2 SER HG H -4.716 12.651 11.647 1.00 . A A . 2 SER HG 1 1 13 8382 1 1 2 SER N N -6.466 10.663 14.134 1.00 . A A . 2 SER N 1 1 13 8383 1 1 2 SER O O -4.401 8.216 14.593 1.00 . A A . 2 SER O 1 1 13 8384 1 1 2 SER OG O -4.456 11.742 11.815 1.00 . A A . 2 SER OG 1 1 13 8385 1 1 3 ALA C C -1.732 8.556 15.812 1.00 . A A . 3 ALA C 1 1 13 8386 1 1 3 ALA CA C -2.855 9.355 16.481 1.00 . A A . 3 ALA CA 1 1 13 8387 1 1 3 ALA CB C -3.854 8.413 17.154 1.00 . A A . 3 ALA CB 1 1 13 8388 1 1 3 ALA H H -3.632 11.070 15.430 1.00 . A A . 3 ALA H 1 1 13 8389 1 1 3 ALA HA H -2.449 10.041 17.206 1.00 . A A . 3 ALA HA 1 1 13 8390 1 1 3 ALA HB1 H -4.837 8.572 16.736 1.00 . A A . 3 ALA HB1 1 1 13 8391 1 1 3 ALA HB2 H -3.878 8.613 18.215 1.00 . A A . 3 ALA HB2 1 1 13 8392 1 1 3 ALA HB3 H -3.554 7.389 16.986 1.00 . A A . 3 ALA HB3 1 1 13 8393 1 1 3 ALA N N -3.648 10.090 15.453 1.00 . A A . 3 ALA N 1 1 13 8394 1 1 3 ALA O O -1.342 8.832 14.695 1.00 . A A . 3 ALA O 1 1 13 8395 1 1 4 MET C C -0.474 5.270 15.922 1.00 . A A . 4 MET C 1 1 13 8396 1 1 4 MET CA C -0.111 6.758 15.891 1.00 . A A . 4 MET CA 1 1 13 8397 1 1 4 MET CB C 1.107 7.033 16.773 1.00 . A A . 4 MET CB 1 1 13 8398 1 1 4 MET CE C 2.683 10.150 18.250 1.00 . A A . 4 MET CE 1 1 13 8399 1 1 4 MET CG C 1.690 8.403 16.423 1.00 . A A . 4 MET CG 1 1 13 8400 1 1 4 MET H H -1.538 7.367 17.389 1.00 . A A . 4 MET H 1 1 13 8401 1 1 4 MET HA H 0.086 7.078 14.882 1.00 . A A . 4 MET HA 1 1 13 8402 1 1 4 MET HB2 H 0.809 7.022 17.811 1.00 . A A . 4 MET HB2 1 1 13 8403 1 1 4 MET HB3 H 1.853 6.272 16.604 1.00 . A A . 4 MET HB3 1 1 13 8404 1 1 4 MET HE1 H 1.604 10.166 18.306 1.00 . A A . 4 MET HE1 1 1 13 8405 1 1 4 MET HE2 H 3.027 11.028 17.727 1.00 . A A . 4 MET HE2 1 1 13 8406 1 1 4 MET HE3 H 3.101 10.141 19.247 1.00 . A A . 4 MET HE3 1 1 13 8407 1 1 4 MET HG2 H 1.907 8.443 15.366 1.00 . A A . 4 MET HG2 1 1 13 8408 1 1 4 MET HG3 H 0.977 9.174 16.674 1.00 . A A . 4 MET HG3 1 1 13 8409 1 1 4 MET N N -1.210 7.571 16.489 1.00 . A A . 4 MET N 1 1 13 8410 1 1 4 MET O O -0.432 4.633 16.955 1.00 . A A . 4 MET O 1 1 13 8411 1 1 4 MET SD S 3.217 8.666 17.361 1.00 . A A . 4 MET SD 1 1 13 8412 1 1 5 GLY C C -0.316 2.545 13.728 1.00 . A A . 5 GLY C 1 1 13 8413 1 1 5 GLY CA C -1.188 3.268 14.759 1.00 . A A . 5 GLY CA 1 1 13 8414 1 1 5 GLY H H -0.850 5.246 13.972 1.00 . A A . 5 GLY H 1 1 13 8415 1 1 5 GLY HA2 H -1.027 2.833 15.735 1.00 . A A . 5 GLY HA2 1 1 13 8416 1 1 5 GLY HA3 H -2.226 3.163 14.484 1.00 . A A . 5 GLY HA3 1 1 13 8417 1 1 5 GLY N N -0.825 4.714 14.794 1.00 . A A . 5 GLY N 1 1 13 8418 1 1 5 GLY O O 0.537 1.751 14.069 1.00 . A A . 5 GLY O 1 1 13 8419 1 1 6 CYS C C 1.779 2.402 11.679 1.00 . A A . 6 CYS C 1 1 13 8420 1 1 6 CYS CA C 0.294 2.147 11.415 1.00 . A A . 6 CYS CA 1 1 13 8421 1 1 6 CYS CB C -0.151 2.780 10.092 1.00 . A A . 6 CYS CB 1 1 13 8422 1 1 6 CYS H H -1.213 3.462 12.217 1.00 . A A . 6 CYS H 1 1 13 8423 1 1 6 CYS HA H 0.093 1.090 11.402 1.00 . A A . 6 CYS HA 1 1 13 8424 1 1 6 CYS HB2 H -1.213 2.647 9.974 1.00 . A A . 6 CYS HB2 1 1 13 8425 1 1 6 CYS HB3 H 0.082 3.833 10.100 1.00 . A A . 6 CYS HB3 1 1 13 8426 1 1 6 CYS N N -0.524 2.817 12.468 1.00 . A A . 6 CYS N 1 1 13 8427 1 1 6 CYS O O 2.584 1.493 11.671 1.00 . A A . 6 CYS O 1 1 13 8428 1 1 6 CYS SG S 0.695 1.979 8.708 1.00 . A A . 6 CYS SG 1 1 13 8429 1 1 7 ARG C C 3.979 3.259 13.536 1.00 . A A . 7 ARG C 1 1 13 8430 1 1 7 ARG CA C 3.578 3.927 12.220 1.00 . A A . 7 ARG CA 1 1 13 8431 1 1 7 ARG CB C 3.656 5.448 12.341 1.00 . A A . 7 ARG CB 1 1 13 8432 1 1 7 ARG CD C 3.402 7.522 10.974 1.00 . A A . 7 ARG CD 1 1 13 8433 1 1 7 ARG CG C 3.856 6.061 10.955 1.00 . A A . 7 ARG CG 1 1 13 8434 1 1 7 ARG CZ C 2.018 8.203 9.113 1.00 . A A . 7 ARG CZ 1 1 13 8435 1 1 7 ARG H H 1.482 4.349 11.949 1.00 . A A . 7 ARG H 1 1 13 8436 1 1 7 ARG HA H 4.207 3.584 11.413 1.00 . A A . 7 ARG HA 1 1 13 8437 1 1 7 ARG HB2 H 2.740 5.823 12.773 1.00 . A A . 7 ARG HB2 1 1 13 8438 1 1 7 ARG HB3 H 4.489 5.716 12.973 1.00 . A A . 7 ARG HB3 1 1 13 8439 1 1 7 ARG HD2 H 3.254 7.854 11.992 1.00 . A A . 7 ARG HD2 1 1 13 8440 1 1 7 ARG HD3 H 4.125 8.147 10.474 1.00 . A A . 7 ARG HD3 1 1 13 8441 1 1 7 ARG HE H 1.340 7.045 10.577 1.00 . A A . 7 ARG HE 1 1 13 8442 1 1 7 ARG HG2 H 4.901 6.010 10.687 1.00 . A A . 7 ARG HG2 1 1 13 8443 1 1 7 ARG HG3 H 3.271 5.514 10.231 1.00 . A A . 7 ARG HG3 1 1 13 8444 1 1 7 ARG HH11 H 3.942 7.949 8.622 1.00 . A A . 7 ARG HH11 1 1 13 8445 1 1 7 ARG HH12 H 2.994 8.861 7.495 1.00 . A A . 7 ARG HH12 1 1 13 8446 1 1 7 ARG HH21 H 0.070 8.608 9.342 1.00 . A A . 7 ARG HH21 1 1 13 8447 1 1 7 ARG HH22 H 0.802 9.237 7.903 1.00 . A A . 7 ARG HH22 1 1 13 8448 1 1 7 ARG N N 2.147 3.628 11.933 1.00 . A A . 7 ARG N 1 1 13 8449 1 1 7 ARG NE N 2.114 7.536 10.229 1.00 . A A . 7 ARG NE 1 1 13 8450 1 1 7 ARG NH1 N 3.066 8.348 8.350 1.00 . A A . 7 ARG NH1 1 1 13 8451 1 1 7 ARG NH2 N 0.874 8.723 8.758 1.00 . A A . 7 ARG NH2 1 1 13 8452 1 1 7 ARG O O 5.145 3.072 13.822 1.00 . A A . 7 ARG O 1 1 13 8453 1 1 8 HIS C C 3.462 0.720 15.416 1.00 . A A . 8 HIS C 1 1 13 8454 1 1 8 HIS CA C 3.320 2.231 15.633 1.00 . A A . 8 HIS CA 1 1 13 8455 1 1 8 HIS CB C 2.119 2.546 16.531 1.00 . A A . 8 HIS CB 1 1 13 8456 1 1 8 HIS CD2 C 1.488 0.363 17.851 1.00 . A A . 8 HIS CD2 1 1 13 8457 1 1 8 HIS CE1 C 2.525 0.805 19.701 1.00 . A A . 8 HIS CE1 1 1 13 8458 1 1 8 HIS CG C 2.089 1.587 17.689 1.00 . A A . 8 HIS CG 1 1 13 8459 1 1 8 HIS H H 2.080 3.055 14.077 1.00 . A A . 8 HIS H 1 1 13 8460 1 1 8 HIS HA H 4.221 2.639 16.062 1.00 . A A . 8 HIS HA 1 1 13 8461 1 1 8 HIS HB2 H 2.202 3.556 16.903 1.00 . A A . 8 HIS HB2 1 1 13 8462 1 1 8 HIS HB3 H 1.206 2.447 15.960 1.00 . A A . 8 HIS HB3 1 1 13 8463 1 1 8 HIS HD1 H 3.271 2.649 19.088 1.00 . A A . 8 HIS HD1 1 1 13 8464 1 1 8 HIS HD2 H 0.890 -0.142 17.105 1.00 . A A . 8 HIS HD2 1 1 13 8465 1 1 8 HIS HE1 H 2.919 0.730 20.704 1.00 . A A . 8 HIS HE1 1 1 13 8466 1 1 8 HIS N N 3.012 2.895 14.335 1.00 . A A . 8 HIS N 1 1 13 8467 1 1 8 HIS ND1 N 2.743 1.849 18.881 1.00 . A A . 8 HIS ND1 1 1 13 8468 1 1 8 HIS NE2 N 1.766 -0.130 19.124 1.00 . A A . 8 HIS NE2 1 1 13 8469 1 1 8 HIS O O 3.937 0.000 16.273 1.00 . A A . 8 HIS O 1 1 13 8470 1 1 9 PHE C C 4.632 -1.579 13.683 1.00 . A A . 9 PHE C 1 1 13 8471 1 1 9 PHE CA C 3.175 -1.222 13.991 1.00 . A A . 9 PHE CA 1 1 13 8472 1 1 9 PHE CB C 2.292 -1.464 12.761 1.00 . A A . 9 PHE CB 1 1 13 8473 1 1 9 PHE CD1 C 0.450 -0.876 14.400 1.00 . A A . 9 PHE CD1 1 1 13 8474 1 1 9 PHE CD2 C -0.108 -1.129 12.053 1.00 . A A . 9 PHE CD2 1 1 13 8475 1 1 9 PHE CE1 C -0.891 -0.584 14.685 1.00 . A A . 9 PHE CE1 1 1 13 8476 1 1 9 PHE CE2 C -1.447 -0.836 12.340 1.00 . A A . 9 PHE CE2 1 1 13 8477 1 1 9 PHE CG C 0.844 -1.149 13.082 1.00 . A A . 9 PHE CG 1 1 13 8478 1 1 9 PHE CZ C -1.838 -0.564 13.655 1.00 . A A . 9 PHE CZ 1 1 13 8479 1 1 9 PHE H H 2.683 0.837 13.594 1.00 . A A . 9 PHE H 1 1 13 8480 1 1 9 PHE HA H 2.811 -1.800 14.827 1.00 . A A . 9 PHE HA 1 1 13 8481 1 1 9 PHE HB2 H 2.624 -0.828 11.955 1.00 . A A . 9 PHE HB2 1 1 13 8482 1 1 9 PHE HB3 H 2.374 -2.498 12.459 1.00 . A A . 9 PHE HB3 1 1 13 8483 1 1 9 PHE HD1 H 1.180 -0.891 15.195 1.00 . A A . 9 PHE HD1 1 1 13 8484 1 1 9 PHE HD2 H 0.193 -1.338 11.037 1.00 . A A . 9 PHE HD2 1 1 13 8485 1 1 9 PHE HE1 H -1.193 -0.374 15.700 1.00 . A A . 9 PHE HE1 1 1 13 8486 1 1 9 PHE HE2 H -2.178 -0.822 11.544 1.00 . A A . 9 PHE HE2 1 1 13 8487 1 1 9 PHE HZ H -2.872 -0.339 13.876 1.00 . A A . 9 PHE HZ 1 1 13 8488 1 1 9 PHE N N 3.058 0.238 14.272 1.00 . A A . 9 PHE N 1 1 13 8489 1 1 9 PHE O O 5.481 -0.716 13.575 1.00 . A A . 9 PHE O 1 1 13 8490 1 1 10 GLN C C 6.399 -4.037 11.939 1.00 . A A . 10 GLN C 1 1 13 8491 1 1 10 GLN CA C 6.339 -3.243 13.245 1.00 . A A . 10 GLN CA 1 1 13 8492 1 1 10 GLN CB C 6.763 -4.118 14.425 1.00 . A A . 10 GLN CB 1 1 13 8493 1 1 10 GLN CD C 6.302 -6.255 15.635 1.00 . A A . 10 GLN CD 1 1 13 8494 1 1 10 GLN CG C 6.041 -5.466 14.351 1.00 . A A . 10 GLN CG 1 1 13 8495 1 1 10 GLN H H 4.237 -3.525 13.635 1.00 . A A . 10 GLN H 1 1 13 8496 1 1 10 GLN HA H 6.973 -2.372 13.185 1.00 . A A . 10 GLN HA 1 1 13 8497 1 1 10 GLN HB2 H 7.831 -4.278 14.386 1.00 . A A . 10 GLN HB2 1 1 13 8498 1 1 10 GLN HB3 H 6.506 -3.624 15.350 1.00 . A A . 10 GLN HB3 1 1 13 8499 1 1 10 GLN HE21 H 6.933 -7.876 14.678 1.00 . A A . 10 GLN HE21 1 1 13 8500 1 1 10 GLN HE22 H 6.930 -7.988 16.371 1.00 . A A . 10 GLN HE22 1 1 13 8501 1 1 10 GLN HG2 H 4.978 -5.299 14.240 1.00 . A A . 10 GLN HG2 1 1 13 8502 1 1 10 GLN HG3 H 6.409 -6.027 13.506 1.00 . A A . 10 GLN HG3 1 1 13 8503 1 1 10 GLN N N 4.933 -2.842 13.543 1.00 . A A . 10 GLN N 1 1 13 8504 1 1 10 GLN NE2 N 6.759 -7.474 15.555 1.00 . A A . 10 GLN NE2 1 1 13 8505 1 1 10 GLN O O 7.352 -3.950 11.191 1.00 . A A . 10 GLN O 1 1 13 8506 1 1 10 GLN OE1 O 6.086 -5.758 16.723 1.00 . A A . 10 GLN OE1 1 1 13 8507 1 1 11 SER C C 4.286 -5.130 9.459 1.00 . A A . 11 SER C 1 1 13 8508 1 1 11 SER CA C 5.392 -5.613 10.399 1.00 . A A . 11 SER CA 1 1 13 8509 1 1 11 SER CB C 5.130 -7.051 10.844 1.00 . A A . 11 SER CB 1 1 13 8510 1 1 11 SER H H 4.628 -4.871 12.274 1.00 . A A . 11 SER H 1 1 13 8511 1 1 11 SER HA H 6.353 -5.549 9.915 1.00 . A A . 11 SER HA 1 1 13 8512 1 1 11 SER HB2 H 4.182 -7.107 11.353 1.00 . A A . 11 SER HB2 1 1 13 8513 1 1 11 SER HB3 H 5.107 -7.697 9.975 1.00 . A A . 11 SER HB3 1 1 13 8514 1 1 11 SER HG H 7.001 -7.172 11.366 1.00 . A A . 11 SER HG 1 1 13 8515 1 1 11 SER N N 5.389 -4.813 11.658 1.00 . A A . 11 SER N 1 1 13 8516 1 1 11 SER O O 3.702 -4.082 9.657 1.00 . A A . 11 SER O 1 1 13 8517 1 1 11 SER OG O 6.162 -7.464 11.731 1.00 . A A . 11 SER OG 1 1 13 8518 1 1 12 CYS C C 1.571 -6.021 7.924 1.00 . A A . 12 CYS C 1 1 13 8519 1 1 12 CYS CA C 2.929 -5.474 7.477 1.00 . A A . 12 CYS CA 1 1 13 8520 1 1 12 CYS CB C 3.336 -6.103 6.146 1.00 . A A . 12 CYS CB 1 1 13 8521 1 1 12 CYS H H 4.481 -6.725 8.296 1.00 . A A . 12 CYS H 1 1 13 8522 1 1 12 CYS HA H 2.894 -4.400 7.384 1.00 . A A . 12 CYS HA 1 1 13 8523 1 1 12 CYS HB2 H 2.606 -5.854 5.390 1.00 . A A . 12 CYS HB2 1 1 13 8524 1 1 12 CYS HB3 H 4.305 -5.726 5.850 1.00 . A A . 12 CYS HB3 1 1 13 8525 1 1 12 CYS N N 3.996 -5.886 8.436 1.00 . A A . 12 CYS N 1 1 13 8526 1 1 12 CYS O O 0.534 -5.578 7.472 1.00 . A A . 12 CYS O 1 1 13 8527 1 1 12 CYS SG S 3.420 -7.901 6.337 1.00 . A A . 12 CYS SG 1 1 13 8528 1 1 13 SER C C -0.678 -6.449 9.705 1.00 . A A . 13 SER C 1 1 13 8529 1 1 13 SER CA C 0.275 -7.563 9.267 1.00 . A A . 13 SER CA 1 1 13 8530 1 1 13 SER CB C 0.641 -8.454 10.452 1.00 . A A . 13 SER CB 1 1 13 8531 1 1 13 SER H H 2.415 -7.334 9.152 1.00 . A A . 13 SER H 1 1 13 8532 1 1 13 SER HA H -0.175 -8.155 8.487 1.00 . A A . 13 SER HA 1 1 13 8533 1 1 13 SER HB2 H 1.322 -7.931 11.102 1.00 . A A . 13 SER HB2 1 1 13 8534 1 1 13 SER HB3 H -0.256 -8.708 11.002 1.00 . A A . 13 SER HB3 1 1 13 8535 1 1 13 SER HG H 2.140 -9.399 9.650 1.00 . A A . 13 SER HG 1 1 13 8536 1 1 13 SER N N 1.568 -6.986 8.803 1.00 . A A . 13 SER N 1 1 13 8537 1 1 13 SER O O -1.748 -6.288 9.156 1.00 . A A . 13 SER O 1 1 13 8538 1 1 13 SER OG O 1.268 -9.636 9.973 1.00 . A A . 13 SER OG 1 1 13 8539 1 1 14 GLN C C -1.132 -3.401 10.167 1.00 . A A . 14 GLN C 1 1 13 8540 1 1 14 GLN CA C -1.197 -4.576 11.144 1.00 . A A . 14 GLN CA 1 1 13 8541 1 1 14 GLN CB C -0.662 -4.167 12.516 1.00 . A A . 14 GLN CB 1 1 13 8542 1 1 14 GLN CD C -2.605 -4.545 14.041 1.00 . A A . 14 GLN CD 1 1 13 8543 1 1 14 GLN CG C -1.777 -3.486 13.311 1.00 . A A . 14 GLN CG 1 1 13 8544 1 1 14 GLN H H 0.568 -5.815 11.116 1.00 . A A . 14 GLN H 1 1 13 8545 1 1 14 GLN HA H -2.211 -4.932 11.237 1.00 . A A . 14 GLN HA 1 1 13 8546 1 1 14 GLN HB2 H -0.324 -5.046 13.046 1.00 . A A . 14 GLN HB2 1 1 13 8547 1 1 14 GLN HB3 H 0.162 -3.481 12.392 1.00 . A A . 14 GLN HB3 1 1 13 8548 1 1 14 GLN HE21 H -1.516 -4.461 15.700 1.00 . A A . 14 GLN HE21 1 1 13 8549 1 1 14 GLN HE22 H -2.809 -5.562 15.734 1.00 . A A . 14 GLN HE22 1 1 13 8550 1 1 14 GLN HG2 H -1.342 -2.808 14.031 1.00 . A A . 14 GLN HG2 1 1 13 8551 1 1 14 GLN HG3 H -2.415 -2.934 12.637 1.00 . A A . 14 GLN HG3 1 1 13 8552 1 1 14 GLN N N -0.300 -5.674 10.685 1.00 . A A . 14 GLN N 1 1 13 8553 1 1 14 GLN NE2 N -2.284 -4.884 15.260 1.00 . A A . 14 GLN NE2 1 1 13 8554 1 1 14 GLN O O -2.110 -2.715 9.939 1.00 . A A . 14 GLN O 1 1 13 8555 1 1 14 GLN OE1 O -3.557 -5.068 13.498 1.00 . A A . 14 GLN OE1 1 1 13 8556 1 1 15 CYS C C -1.027 -2.079 7.624 1.00 . A A . 15 CYS C 1 1 13 8557 1 1 15 CYS CA C 0.137 -2.039 8.617 1.00 . A A . 15 CYS CA 1 1 13 8558 1 1 15 CYS CB C 1.468 -2.286 7.900 1.00 . A A . 15 CYS CB 1 1 13 8559 1 1 15 CYS H H 0.785 -3.736 9.778 1.00 . A A . 15 CYS H 1 1 13 8560 1 1 15 CYS HA H 0.164 -1.095 9.137 1.00 . A A . 15 CYS HA 1 1 13 8561 1 1 15 CYS HB2 H 2.202 -2.628 8.613 1.00 . A A . 15 CYS HB2 1 1 13 8562 1 1 15 CYS HB3 H 1.331 -3.038 7.137 1.00 . A A . 15 CYS HB3 1 1 13 8563 1 1 15 CYS N N 0.011 -3.167 9.584 1.00 . A A . 15 CYS N 1 1 13 8564 1 1 15 CYS O O -1.528 -1.058 7.196 1.00 . A A . 15 CYS O 1 1 13 8565 1 1 15 CYS SG S 2.047 -0.750 7.132 1.00 . A A . 15 CYS SG 1 1 13 8566 1 1 16 LEU C C -3.845 -3.939 6.960 1.00 . A A . 16 LEU C 1 1 13 8567 1 1 16 LEU CA C -2.590 -3.365 6.285 1.00 . A A . 16 LEU CA 1 1 13 8568 1 1 16 LEU CB C -2.085 -4.318 5.201 1.00 . A A . 16 LEU CB 1 1 13 8569 1 1 16 LEU CD1 C 0.215 -3.415 4.822 1.00 . A A . 16 LEU CD1 1 1 13 8570 1 1 16 LEU CD2 C -1.106 -4.314 2.901 1.00 . A A . 16 LEU CD2 1 1 13 8571 1 1 16 LEU CG C -1.188 -3.552 4.226 1.00 . A A . 16 LEU CG 1 1 13 8572 1 1 16 LEU H H -1.039 -4.065 7.608 1.00 . A A . 16 LEU H 1 1 13 8573 1 1 16 LEU HA H -2.805 -2.402 5.850 1.00 . A A . 16 LEU HA 1 1 13 8574 1 1 16 LEU HB2 H -1.520 -5.118 5.659 1.00 . A A . 16 LEU HB2 1 1 13 8575 1 1 16 LEU HB3 H -2.925 -4.731 4.664 1.00 . A A . 16 LEU HB3 1 1 13 8576 1 1 16 LEU HD11 H 0.379 -4.205 5.539 1.00 . A A . 16 LEU HD11 1 1 13 8577 1 1 16 LEU HD12 H 0.306 -2.457 5.312 1.00 . A A . 16 LEU HD12 1 1 13 8578 1 1 16 LEU HD13 H 0.949 -3.487 4.033 1.00 . A A . 16 LEU HD13 1 1 13 8579 1 1 16 LEU HD21 H -0.424 -3.806 2.236 1.00 . A A . 16 LEU HD21 1 1 13 8580 1 1 16 LEU HD22 H -2.086 -4.355 2.451 1.00 . A A . 16 LEU HD22 1 1 13 8581 1 1 16 LEU HD23 H -0.751 -5.317 3.085 1.00 . A A . 16 LEU HD23 1 1 13 8582 1 1 16 LEU HG H -1.602 -2.569 4.054 1.00 . A A . 16 LEU HG 1 1 13 8583 1 1 16 LEU N N -1.459 -3.255 7.252 1.00 . A A . 16 LEU N 1 1 13 8584 1 1 16 LEU O O -4.927 -3.888 6.409 1.00 . A A . 16 LEU O 1 1 13 8585 1 1 17 SER C C -5.674 -4.009 9.599 1.00 . A A . 17 SER C 1 1 13 8586 1 1 17 SER CA C -4.916 -5.079 8.817 1.00 . A A . 17 SER CA 1 1 13 8587 1 1 17 SER CB C -4.367 -6.132 9.776 1.00 . A A . 17 SER CB 1 1 13 8588 1 1 17 SER H H -2.836 -4.539 8.569 1.00 . A A . 17 SER H 1 1 13 8589 1 1 17 SER HA H -5.565 -5.547 8.095 1.00 . A A . 17 SER HA 1 1 13 8590 1 1 17 SER HB2 H -3.739 -6.818 9.239 1.00 . A A . 17 SER HB2 1 1 13 8591 1 1 17 SER HB3 H -3.788 -5.644 10.551 1.00 . A A . 17 SER HB3 1 1 13 8592 1 1 17 SER HG H -5.082 -7.525 10.930 1.00 . A A . 17 SER HG 1 1 13 8593 1 1 17 SER N N -3.716 -4.495 8.138 1.00 . A A . 17 SER N 1 1 13 8594 1 1 17 SER O O -6.714 -4.270 10.172 1.00 . A A . 17 SER O 1 1 13 8595 1 1 17 SER OG O -5.450 -6.847 10.359 1.00 . A A . 17 SER OG 1 1 13 8596 1 1 18 ALA C C -5.741 -0.401 9.697 1.00 . A A . 18 ALA C 1 1 13 8597 1 1 18 ALA CA C -5.870 -1.747 10.411 1.00 . A A . 18 ALA CA 1 1 13 8598 1 1 18 ALA CB C -5.152 -1.720 11.759 1.00 . A A . 18 ALA CB 1 1 13 8599 1 1 18 ALA H H -4.318 -2.615 9.191 1.00 . A A . 18 ALA H 1 1 13 8600 1 1 18 ALA HA H -6.906 -2.006 10.550 1.00 . A A . 18 ALA HA 1 1 13 8601 1 1 18 ALA HB1 H -4.899 -2.730 12.051 1.00 . A A . 18 ALA HB1 1 1 13 8602 1 1 18 ALA HB2 H -5.800 -1.282 12.503 1.00 . A A . 18 ALA HB2 1 1 13 8603 1 1 18 ALA HB3 H -4.249 -1.134 11.674 1.00 . A A . 18 ALA HB3 1 1 13 8604 1 1 18 ALA N N -5.166 -2.812 9.645 1.00 . A A . 18 ALA N 1 1 13 8605 1 1 18 ALA O O -5.210 0.545 10.242 1.00 . A A . 18 ALA O 1 1 13 8606 1 1 19 PRO C C -7.190 1.950 8.143 1.00 . A A . 19 PRO C 1 1 13 8607 1 1 19 PRO CA C -6.184 0.873 7.676 1.00 . A A . 19 PRO CA 1 1 13 8608 1 1 19 PRO CB C -6.502 0.390 6.262 1.00 . A A . 19 PRO CB 1 1 13 8609 1 1 19 PRO CD C -6.883 -1.472 7.768 1.00 . A A . 19 PRO CD 1 1 13 8610 1 1 19 PRO CG C -7.273 -0.881 6.434 1.00 . A A . 19 PRO CG 1 1 13 8611 1 1 19 PRO HA H -5.185 1.277 7.694 1.00 . A A . 19 PRO HA 1 1 13 8612 1 1 19 PRO HB2 H -7.100 1.126 5.742 1.00 . A A . 19 PRO HB2 1 1 13 8613 1 1 19 PRO HB3 H -5.591 0.196 5.718 1.00 . A A . 19 PRO HB3 1 1 13 8614 1 1 19 PRO HD2 H -7.762 -1.812 8.300 1.00 . A A . 19 PRO HD2 1 1 13 8615 1 1 19 PRO HD3 H -6.186 -2.283 7.633 1.00 . A A . 19 PRO HD3 1 1 13 8616 1 1 19 PRO HG2 H -8.332 -0.674 6.409 1.00 . A A . 19 PRO HG2 1 1 13 8617 1 1 19 PRO HG3 H -7.017 -1.572 5.645 1.00 . A A . 19 PRO HG3 1 1 13 8618 1 1 19 PRO N N -6.238 -0.365 8.488 1.00 . A A . 19 PRO N 1 1 13 8619 1 1 19 PRO O O -6.930 3.123 7.961 1.00 . A A . 19 PRO O 1 1 13 8620 1 1 20 PRO C C -8.825 3.250 10.454 1.00 . A A . 20 PRO C 1 1 13 8621 1 1 20 PRO CA C -9.300 2.567 9.169 1.00 . A A . 20 PRO CA 1 1 13 8622 1 1 20 PRO CB C -10.561 1.752 9.426 1.00 . A A . 20 PRO CB 1 1 13 8623 1 1 20 PRO CD C -8.763 0.186 9.004 1.00 . A A . 20 PRO CD 1 1 13 8624 1 1 20 PRO CG C -10.080 0.368 9.718 1.00 . A A . 20 PRO CG 1 1 13 8625 1 1 20 PRO HA H -9.481 3.294 8.394 1.00 . A A . 20 PRO HA 1 1 13 8626 1 1 20 PRO HB2 H -11.097 2.152 10.276 1.00 . A A . 20 PRO HB2 1 1 13 8627 1 1 20 PRO HB3 H -11.190 1.747 8.551 1.00 . A A . 20 PRO HB3 1 1 13 8628 1 1 20 PRO HD2 H -8.063 -0.326 9.646 1.00 . A A . 20 PRO HD2 1 1 13 8629 1 1 20 PRO HD3 H -8.908 -0.358 8.088 1.00 . A A . 20 PRO HD3 1 1 13 8630 1 1 20 PRO HG2 H -9.944 0.245 10.784 1.00 . A A . 20 PRO HG2 1 1 13 8631 1 1 20 PRO HG3 H -10.792 -0.354 9.351 1.00 . A A . 20 PRO HG3 1 1 13 8632 1 1 20 PRO N N -8.309 1.555 8.718 1.00 . A A . 20 PRO N 1 1 13 8633 1 1 20 PRO O O -9.248 4.342 10.778 1.00 . A A . 20 PRO O 1 1 13 8634 1 1 21 PHE C C -6.087 3.869 12.239 1.00 . A A . 21 PHE C 1 1 13 8635 1 1 21 PHE CA C -7.461 3.232 12.456 1.00 . A A . 21 PHE CA 1 1 13 8636 1 1 21 PHE CB C -7.351 2.073 13.447 1.00 . A A . 21 PHE CB 1 1 13 8637 1 1 21 PHE CD1 C -9.859 1.820 13.409 1.00 . A A . 21 PHE CD1 1 1 13 8638 1 1 21 PHE CD2 C -8.482 -0.172 13.283 1.00 . A A . 21 PHE CD2 1 1 13 8639 1 1 21 PHE CE1 C -11.011 1.027 13.346 1.00 . A A . 21 PHE CE1 1 1 13 8640 1 1 21 PHE CE2 C -9.634 -0.965 13.221 1.00 . A A . 21 PHE CE2 1 1 13 8641 1 1 21 PHE CG C -8.594 1.220 13.378 1.00 . A A . 21 PHE CG 1 1 13 8642 1 1 21 PHE CZ C -10.898 -0.365 13.252 1.00 . A A . 21 PHE CZ 1 1 13 8643 1 1 21 PHE H H -7.629 1.734 10.914 1.00 . A A . 21 PHE H 1 1 13 8644 1 1 21 PHE HA H -8.165 3.962 12.821 1.00 . A A . 21 PHE HA 1 1 13 8645 1 1 21 PHE HB2 H -6.488 1.470 13.200 1.00 . A A . 21 PHE HB2 1 1 13 8646 1 1 21 PHE HB3 H -7.240 2.464 14.447 1.00 . A A . 21 PHE HB3 1 1 13 8647 1 1 21 PHE HD1 H -9.945 2.894 13.482 1.00 . A A . 21 PHE HD1 1 1 13 8648 1 1 21 PHE HD2 H -7.506 -0.634 13.258 1.00 . A A . 21 PHE HD2 1 1 13 8649 1 1 21 PHE HE1 H -11.988 1.489 13.370 1.00 . A A . 21 PHE HE1 1 1 13 8650 1 1 21 PHE HE2 H -9.546 -2.038 13.148 1.00 . A A . 21 PHE HE2 1 1 13 8651 1 1 21 PHE HZ H -11.787 -0.977 13.205 1.00 . A A . 21 PHE HZ 1 1 13 8652 1 1 21 PHE N N -7.955 2.616 11.191 1.00 . A A . 21 PHE N 1 1 13 8653 1 1 21 PHE O O -5.450 4.313 13.173 1.00 . A A . 21 PHE O 1 1 13 8654 1 1 22 VAL C C -4.207 5.198 9.410 1.00 . A A . 22 VAL C 1 1 13 8655 1 1 22 VAL CA C -4.278 4.519 10.782 1.00 . A A . 22 VAL CA 1 1 13 8656 1 1 22 VAL CB C -3.304 3.347 10.832 1.00 . A A . 22 VAL CB 1 1 13 8657 1 1 22 VAL CG1 C -3.528 2.533 12.110 1.00 . A A . 22 VAL CG1 1 1 13 8658 1 1 22 VAL CG2 C -3.524 2.447 9.614 1.00 . A A . 22 VAL CG2 1 1 13 8659 1 1 22 VAL H H -6.137 3.547 10.277 1.00 . A A . 22 VAL H 1 1 13 8660 1 1 22 VAL HA H -4.039 5.223 11.562 1.00 . A A . 22 VAL HA 1 1 13 8661 1 1 22 VAL HB H -2.299 3.732 10.819 1.00 . A A . 22 VAL HB 1 1 13 8662 1 1 22 VAL HG11 H -2.695 1.860 12.258 1.00 . A A . 22 VAL HG11 1 1 13 8663 1 1 22 VAL HG12 H -4.438 1.960 12.017 1.00 . A A . 22 VAL HG12 1 1 13 8664 1 1 22 VAL HG13 H -3.606 3.200 12.955 1.00 . A A . 22 VAL HG13 1 1 13 8665 1 1 22 VAL HG21 H -2.852 2.741 8.823 1.00 . A A . 22 VAL HG21 1 1 13 8666 1 1 22 VAL HG22 H -4.546 2.544 9.276 1.00 . A A . 22 VAL HG22 1 1 13 8667 1 1 22 VAL HG23 H -3.331 1.420 9.888 1.00 . A A . 22 VAL HG23 1 1 13 8668 1 1 22 VAL N N -5.617 3.914 11.022 1.00 . A A . 22 VAL N 1 1 13 8669 1 1 22 VAL O O -5.193 5.323 8.710 1.00 . A A . 22 VAL O 1 1 13 8670 1 1 23 GLN C C -1.580 5.870 7.013 1.00 . A A . 23 GLN C 1 1 13 8671 1 1 23 GLN CA C -2.878 6.318 7.706 1.00 . A A . 23 GLN CA 1 1 13 8672 1 1 23 GLN CB C -2.825 7.814 8.041 1.00 . A A . 23 GLN CB 1 1 13 8673 1 1 23 GLN CD C -2.636 10.020 6.871 1.00 . A A . 23 GLN CD 1 1 13 8674 1 1 23 GLN CG C -2.116 8.581 6.917 1.00 . A A . 23 GLN CG 1 1 13 8675 1 1 23 GLN H H -2.262 5.528 9.614 1.00 . A A . 23 GLN H 1 1 13 8676 1 1 23 GLN HA H -3.729 6.115 7.076 1.00 . A A . 23 GLN HA 1 1 13 8677 1 1 23 GLN HB2 H -3.832 8.191 8.151 1.00 . A A . 23 GLN HB2 1 1 13 8678 1 1 23 GLN HB3 H -2.286 7.957 8.965 1.00 . A A . 23 GLN HB3 1 1 13 8679 1 1 23 GLN HE21 H -0.823 10.828 6.932 1.00 . A A . 23 GLN HE21 1 1 13 8680 1 1 23 GLN HE22 H -2.109 11.933 6.862 1.00 . A A . 23 GLN HE22 1 1 13 8681 1 1 23 GLN HG2 H -1.051 8.589 7.104 1.00 . A A . 23 GLN HG2 1 1 13 8682 1 1 23 GLN HG3 H -2.311 8.099 5.971 1.00 . A A . 23 GLN HG3 1 1 13 8683 1 1 23 GLN N N -3.037 5.640 9.027 1.00 . A A . 23 GLN N 1 1 13 8684 1 1 23 GLN NE2 N -1.786 11.009 6.890 1.00 . A A . 23 GLN NE2 1 1 13 8685 1 1 23 GLN O O -1.478 5.895 5.802 1.00 . A A . 23 GLN O 1 1 13 8686 1 1 23 GLN OE1 O -3.828 10.244 6.816 1.00 . A A . 23 GLN OE1 1 1 13 8687 1 1 24 CYS C C 0.467 3.784 6.274 1.00 . A A . 24 CYS C 1 1 13 8688 1 1 24 CYS CA C 0.698 5.047 7.124 1.00 . A A . 24 CYS CA 1 1 13 8689 1 1 24 CYS CB C 1.667 4.827 8.309 1.00 . A A . 24 CYS CB 1 1 13 8690 1 1 24 CYS H H -0.670 5.468 8.736 1.00 . A A . 24 CYS H 1 1 13 8691 1 1 24 CYS HA H 1.071 5.841 6.496 1.00 . A A . 24 CYS HA 1 1 13 8692 1 1 24 CYS HB2 H 2.496 5.513 8.215 1.00 . A A . 24 CYS HB2 1 1 13 8693 1 1 24 CYS HB3 H 1.147 5.037 9.232 1.00 . A A . 24 CYS HB3 1 1 13 8694 1 1 24 CYS N N -0.583 5.474 7.761 1.00 . A A . 24 CYS N 1 1 13 8695 1 1 24 CYS O O -0.593 3.190 6.303 1.00 . A A . 24 CYS O 1 1 13 8696 1 1 24 CYS SG S 2.317 3.131 8.361 1.00 . A A . 24 CYS SG 1 1 13 8697 1 1 25 GLY C C 2.610 1.455 4.504 1.00 . A A . 25 GLY C 1 1 13 8698 1 1 25 GLY CA C 1.278 2.193 4.623 1.00 . A A . 25 GLY CA 1 1 13 8699 1 1 25 GLY H H 2.285 3.899 5.475 1.00 . A A . 25 GLY H 1 1 13 8700 1 1 25 GLY HA2 H 0.537 1.535 5.050 1.00 . A A . 25 GLY HA2 1 1 13 8701 1 1 25 GLY HA3 H 0.958 2.505 3.640 1.00 . A A . 25 GLY HA3 1 1 13 8702 1 1 25 GLY N N 1.444 3.391 5.499 1.00 . A A . 25 GLY N 1 1 13 8703 1 1 25 GLY O O 3.586 1.824 5.114 1.00 . A A . 25 GLY O 1 1 13 8704 1 1 26 TRP C C 4.753 0.298 2.440 1.00 . A A . 26 TRP C 1 1 13 8705 1 1 26 TRP CA C 3.947 -0.330 3.581 1.00 . A A . 26 TRP CA 1 1 13 8706 1 1 26 TRP CB C 3.535 -1.759 3.229 1.00 . A A . 26 TRP CB 1 1 13 8707 1 1 26 TRP CD1 C 5.468 -3.095 2.304 1.00 . A A . 26 TRP CD1 1 1 13 8708 1 1 26 TRP CD2 C 5.288 -3.258 4.539 1.00 . A A . 26 TRP CD2 1 1 13 8709 1 1 26 TRP CE2 C 6.398 -4.048 4.164 1.00 . A A . 26 TRP CE2 1 1 13 8710 1 1 26 TRP CE3 C 4.953 -3.188 5.902 1.00 . A A . 26 TRP CE3 1 1 13 8711 1 1 26 TRP CG C 4.716 -2.664 3.342 1.00 . A A . 26 TRP CG 1 1 13 8712 1 1 26 TRP CH2 C 6.805 -4.664 6.460 1.00 . A A . 26 TRP CH2 1 1 13 8713 1 1 26 TRP CZ2 C 7.151 -4.745 5.108 1.00 . A A . 26 TRP CZ2 1 1 13 8714 1 1 26 TRP CZ3 C 5.708 -3.887 6.855 1.00 . A A . 26 TRP CZ3 1 1 13 8715 1 1 26 TRP H H 1.866 0.120 3.231 1.00 . A A . 26 TRP H 1 1 13 8716 1 1 26 TRP HA H 4.508 -0.315 4.501 1.00 . A A . 26 TRP HA 1 1 13 8717 1 1 26 TRP HB2 H 2.764 -2.088 3.911 1.00 . A A . 26 TRP HB2 1 1 13 8718 1 1 26 TRP HB3 H 3.156 -1.787 2.219 1.00 . A A . 26 TRP HB3 1 1 13 8719 1 1 26 TRP HD1 H 5.313 -2.838 1.266 1.00 . A A . 26 TRP HD1 1 1 13 8720 1 1 26 TRP HE1 H 7.150 -4.362 2.245 1.00 . A A . 26 TRP HE1 1 1 13 8721 1 1 26 TRP HE3 H 4.110 -2.590 6.215 1.00 . A A . 26 TRP HE3 1 1 13 8722 1 1 26 TRP HH2 H 7.383 -5.200 7.198 1.00 . A A . 26 TRP HH2 1 1 13 8723 1 1 26 TRP HZ2 H 7.996 -5.341 4.797 1.00 . A A . 26 TRP HZ2 1 1 13 8724 1 1 26 TRP HZ3 H 5.443 -3.824 7.901 1.00 . A A . 26 TRP HZ3 1 1 13 8725 1 1 26 TRP N N 2.664 0.412 3.727 1.00 . A A . 26 TRP N 1 1 13 8726 1 1 26 TRP NE1 N 6.467 -3.918 2.790 1.00 . A A . 26 TRP NE1 1 1 13 8727 1 1 26 TRP O O 4.198 0.723 1.447 1.00 . A A . 26 TRP O 1 1 13 8728 1 1 27 CYS C C 8.085 0.186 1.132 1.00 . A A . 27 CYS C 1 1 13 8729 1 1 27 CYS CA C 6.851 1.025 1.487 1.00 . A A . 27 CYS CA 1 1 13 8730 1 1 27 CYS CB C 7.279 2.373 2.067 1.00 . A A . 27 CYS CB 1 1 13 8731 1 1 27 CYS H H 6.489 0.064 3.388 1.00 . A A . 27 CYS H 1 1 13 8732 1 1 27 CYS HA H 6.240 1.184 0.613 1.00 . A A . 27 CYS HA 1 1 13 8733 1 1 27 CYS HB2 H 6.822 2.504 3.036 1.00 . A A . 27 CYS HB2 1 1 13 8734 1 1 27 CYS HB3 H 8.354 2.393 2.171 1.00 . A A . 27 CYS HB3 1 1 13 8735 1 1 27 CYS N N 6.050 0.390 2.575 1.00 . A A . 27 CYS N 1 1 13 8736 1 1 27 CYS O O 9.113 0.273 1.772 1.00 . A A . 27 CYS O 1 1 13 8737 1 1 27 CYS SG S 6.753 3.710 0.968 1.00 . A A . 27 CYS SG 1 1 13 8738 1 1 28 HIS C C 10.018 -1.964 0.764 1.00 . A A . 28 HIS C 1 1 13 8739 1 1 28 HIS CA C 9.136 -1.430 -0.383 1.00 . A A . 28 HIS CA 1 1 13 8740 1 1 28 HIS CB C 9.950 -0.489 -1.273 1.00 . A A . 28 HIS CB 1 1 13 8741 1 1 28 HIS CD2 C 10.207 -1.490 -3.690 1.00 . A A . 28 HIS CD2 1 1 13 8742 1 1 28 HIS CE1 C 8.479 -0.557 -4.606 1.00 . A A . 28 HIS CE1 1 1 13 8743 1 1 28 HIS CG C 9.604 -0.732 -2.717 1.00 . A A . 28 HIS CG 1 1 13 8744 1 1 28 HIS H H 7.146 -0.604 -0.418 1.00 . A A . 28 HIS H 1 1 13 8745 1 1 28 HIS HA H 8.771 -2.251 -0.978 1.00 . A A . 28 HIS HA 1 1 13 8746 1 1 28 HIS HB2 H 9.725 0.535 -1.016 1.00 . A A . 28 HIS HB2 1 1 13 8747 1 1 28 HIS HB3 H 11.004 -0.673 -1.121 1.00 . A A . 28 HIS HB3 1 1 13 8748 1 1 28 HIS HD1 H 7.860 0.458 -2.897 1.00 . A A . 28 HIS HD1 1 1 13 8749 1 1 28 HIS HD2 H 11.099 -2.083 -3.552 1.00 . A A . 28 HIS HD2 1 1 13 8750 1 1 28 HIS HE1 H 7.730 -0.259 -5.323 1.00 . A A . 28 HIS HE1 1 1 13 8751 1 1 28 HIS N N 7.986 -0.589 0.088 1.00 . A A . 28 HIS N 1 1 13 8752 1 1 28 HIS ND1 N 8.503 -0.145 -3.323 1.00 . A A . 28 HIS ND1 1 1 13 8753 1 1 28 HIS NE2 N 9.494 -1.378 -4.880 1.00 . A A . 28 HIS NE2 1 1 13 8754 1 1 28 HIS O O 11.162 -2.305 0.541 1.00 . A A . 28 HIS O 1 1 13 8755 1 1 29 ASP C C 9.737 -2.404 4.450 1.00 . A A . 29 ASP C 1 1 13 8756 1 1 29 ASP CA C 10.387 -2.603 3.075 1.00 . A A . 29 ASP CA 1 1 13 8757 1 1 29 ASP CB C 11.711 -1.831 2.995 1.00 . A A . 29 ASP CB 1 1 13 8758 1 1 29 ASP CG C 11.459 -0.379 2.578 1.00 . A A . 29 ASP CG 1 1 13 8759 1 1 29 ASP H H 8.596 -1.807 2.155 1.00 . A A . 29 ASP H 1 1 13 8760 1 1 29 ASP HA H 10.576 -3.653 2.910 1.00 . A A . 29 ASP HA 1 1 13 8761 1 1 29 ASP HB2 H 12.190 -1.846 3.963 1.00 . A A . 29 ASP HB2 1 1 13 8762 1 1 29 ASP HB3 H 12.357 -2.303 2.270 1.00 . A A . 29 ASP HB3 1 1 13 8763 1 1 29 ASP N N 9.522 -2.065 1.973 1.00 . A A . 29 ASP N 1 1 13 8764 1 1 29 ASP O O 9.280 -3.344 5.066 1.00 . A A . 29 ASP O 1 1 13 8765 1 1 29 ASP OD1 O 10.885 0.352 3.368 1.00 . A A . 29 ASP OD1 1 1 13 8766 1 1 29 ASP OD2 O 11.843 -0.024 1.475 1.00 . A A . 29 ASP OD2 1 1 13 8767 1 1 30 LYS C C 7.685 -0.424 6.156 1.00 . A A . 30 LYS C 1 1 13 8768 1 1 30 LYS CA C 9.110 -0.961 6.291 1.00 . A A . 30 LYS CA 1 1 13 8769 1 1 30 LYS CB C 10.015 0.080 6.951 1.00 . A A . 30 LYS CB 1 1 13 8770 1 1 30 LYS CD C 10.923 0.856 9.146 1.00 . A A . 30 LYS CD 1 1 13 8771 1 1 30 LYS CE C 9.855 1.880 9.534 1.00 . A A . 30 LYS CE 1 1 13 8772 1 1 30 LYS CG C 10.266 -0.312 8.409 1.00 . A A . 30 LYS CG 1 1 13 8773 1 1 30 LYS H H 10.102 -0.452 4.448 1.00 . A A . 30 LYS H 1 1 13 8774 1 1 30 LYS HA H 9.115 -1.870 6.871 1.00 . A A . 30 LYS HA 1 1 13 8775 1 1 30 LYS HB2 H 10.956 0.128 6.422 1.00 . A A . 30 LYS HB2 1 1 13 8776 1 1 30 LYS HB3 H 9.534 1.047 6.919 1.00 . A A . 30 LYS HB3 1 1 13 8777 1 1 30 LYS HD2 H 11.413 0.489 10.037 1.00 . A A . 30 LYS HD2 1 1 13 8778 1 1 30 LYS HD3 H 11.652 1.324 8.502 1.00 . A A . 30 LYS HD3 1 1 13 8779 1 1 30 LYS HE2 H 9.695 2.580 8.724 1.00 . A A . 30 LYS HE2 1 1 13 8780 1 1 30 LYS HE3 H 8.933 1.383 9.792 1.00 . A A . 30 LYS HE3 1 1 13 8781 1 1 30 LYS HG2 H 9.326 -0.555 8.883 1.00 . A A . 30 LYS HG2 1 1 13 8782 1 1 30 LYS HG3 H 10.920 -1.170 8.443 1.00 . A A . 30 LYS HG3 1 1 13 8783 1 1 30 LYS HZ1 H 11.251 3.122 10.449 1.00 . A A . 30 LYS HZ1 1 1 13 8784 1 1 30 LYS HZ2 H 10.670 1.877 11.448 1.00 . A A . 30 LYS HZ2 1 1 13 8785 1 1 30 LYS HZ3 H 9.694 3.227 11.112 1.00 . A A . 30 LYS HZ3 1 1 13 8786 1 1 30 LYS N N 9.713 -1.198 4.948 1.00 . A A . 30 LYS N 1 1 13 8787 1 1 30 LYS NZ N 10.409 2.579 10.726 1.00 . A A . 30 LYS NZ 1 1 13 8788 1 1 30 LYS O O 7.226 -0.110 5.076 1.00 . A A . 30 LYS O 1 1 13 8789 1 1 31 CYS C C 5.579 1.708 7.491 1.00 . A A . 31 CYS C 1 1 13 8790 1 1 31 CYS CA C 5.591 0.202 7.195 1.00 . A A . 31 CYS CA 1 1 13 8791 1 1 31 CYS CB C 4.852 -0.583 8.284 1.00 . A A . 31 CYS CB 1 1 13 8792 1 1 31 CYS H H 7.377 -0.573 8.111 1.00 . A A . 31 CYS H 1 1 13 8793 1 1 31 CYS HA H 5.152 0.001 6.232 1.00 . A A . 31 CYS HA 1 1 13 8794 1 1 31 CYS HB2 H 4.757 -1.615 7.979 1.00 . A A . 31 CYS HB2 1 1 13 8795 1 1 31 CYS HB3 H 5.414 -0.532 9.205 1.00 . A A . 31 CYS HB3 1 1 13 8796 1 1 31 CYS N N 6.985 -0.315 7.251 1.00 . A A . 31 CYS N 1 1 13 8797 1 1 31 CYS O O 5.715 2.133 8.620 1.00 . A A . 31 CYS O 1 1 13 8798 1 1 31 CYS SG S 3.205 0.119 8.545 1.00 . A A . 31 CYS SG 1 1 13 8799 1 1 32 VAL C C 4.599 4.630 5.510 1.00 . A A . 32 VAL C 1 1 13 8800 1 1 32 VAL CA C 5.394 3.990 6.654 1.00 . A A . 32 VAL CA 1 1 13 8801 1 1 32 VAL CB C 6.859 4.431 6.596 1.00 . A A . 32 VAL CB 1 1 13 8802 1 1 32 VAL CG1 C 7.711 3.532 7.494 1.00 . A A . 32 VAL CG1 1 1 13 8803 1 1 32 VAL CG2 C 7.364 4.329 5.154 1.00 . A A . 32 VAL CG2 1 1 13 8804 1 1 32 VAL H H 5.311 2.131 5.573 1.00 . A A . 32 VAL H 1 1 13 8805 1 1 32 VAL HA H 4.964 4.249 7.609 1.00 . A A . 32 VAL HA 1 1 13 8806 1 1 32 VAL HB H 6.940 5.453 6.935 1.00 . A A . 32 VAL HB 1 1 13 8807 1 1 32 VAL HG11 H 7.731 2.532 7.085 1.00 . A A . 32 VAL HG11 1 1 13 8808 1 1 32 VAL HG12 H 7.288 3.508 8.486 1.00 . A A . 32 VAL HG12 1 1 13 8809 1 1 32 VAL HG13 H 8.717 3.921 7.541 1.00 . A A . 32 VAL HG13 1 1 13 8810 1 1 32 VAL HG21 H 7.369 5.311 4.705 1.00 . A A . 32 VAL HG21 1 1 13 8811 1 1 32 VAL HG22 H 6.712 3.678 4.590 1.00 . A A . 32 VAL HG22 1 1 13 8812 1 1 32 VAL HG23 H 8.366 3.926 5.151 1.00 . A A . 32 VAL HG23 1 1 13 8813 1 1 32 VAL N N 5.417 2.508 6.472 1.00 . A A . 32 VAL N 1 1 13 8814 1 1 32 VAL O O 4.165 3.961 4.598 1.00 . A A . 32 VAL O 1 1 13 8815 1 1 33 ARG C C 4.565 7.414 3.569 1.00 . A A . 33 ARG C 1 1 13 8816 1 1 33 ARG CA C 3.635 6.551 4.426 1.00 . A A . 33 ARG CA 1 1 13 8817 1 1 33 ARG CB C 2.562 7.407 5.097 1.00 . A A . 33 ARG CB 1 1 13 8818 1 1 33 ARG CD C 0.496 8.596 4.345 1.00 . A A . 33 ARG CD 1 1 13 8819 1 1 33 ARG CG C 1.255 7.269 4.315 1.00 . A A . 33 ARG CG 1 1 13 8820 1 1 33 ARG CZ C -0.276 9.117 2.110 1.00 . A A . 33 ARG CZ 1 1 13 8821 1 1 33 ARG H H 4.752 6.460 6.272 1.00 . A A . 33 ARG H 1 1 13 8822 1 1 33 ARG HA H 3.169 5.793 3.817 1.00 . A A . 33 ARG HA 1 1 13 8823 1 1 33 ARG HB2 H 2.415 7.069 6.112 1.00 . A A . 33 ARG HB2 1 1 13 8824 1 1 33 ARG HB3 H 2.869 8.441 5.101 1.00 . A A . 33 ARG HB3 1 1 13 8825 1 1 33 ARG HD2 H -0.007 8.718 5.295 1.00 . A A . 33 ARG HD2 1 1 13 8826 1 1 33 ARG HD3 H 1.170 9.419 4.166 1.00 . A A . 33 ARG HD3 1 1 13 8827 1 1 33 ARG HE H -1.305 7.958 3.353 1.00 . A A . 33 ARG HE 1 1 13 8828 1 1 33 ARG HG2 H 1.477 7.004 3.290 1.00 . A A . 33 ARG HG2 1 1 13 8829 1 1 33 ARG HG3 H 0.647 6.497 4.761 1.00 . A A . 33 ARG HG3 1 1 13 8830 1 1 33 ARG HH11 H 1.584 8.407 1.896 1.00 . A A . 33 ARG HH11 1 1 13 8831 1 1 33 ARG HH12 H 1.036 9.463 0.637 1.00 . A A . 33 ARG HH12 1 1 13 8832 1 1 33 ARG HH21 H -2.087 9.970 2.057 1.00 . A A . 33 ARG HH21 1 1 13 8833 1 1 33 ARG HH22 H -1.042 10.347 0.728 1.00 . A A . 33 ARG HH22 1 1 13 8834 1 1 33 ARG N N 4.400 5.917 5.536 1.00 . A A . 33 ARG N 1 1 13 8835 1 1 33 ARG NE N -0.493 8.494 3.237 1.00 . A A . 33 ARG NE 1 1 13 8836 1 1 33 ARG NH1 N 0.871 8.985 1.501 1.00 . A A . 33 ARG NH1 1 1 13 8837 1 1 33 ARG NH2 N -1.208 9.870 1.591 1.00 . A A . 33 ARG NH2 1 1 13 8838 1 1 33 ARG O O 5.679 7.707 3.949 1.00 . A A . 33 ARG O 1 1 13 8839 1 1 34 SER C C 5.759 9.676 2.302 1.00 . A A . 34 SER C 1 1 13 8840 1 1 34 SER CA C 4.969 8.632 1.505 1.00 . A A . 34 SER CA 1 1 13 8841 1 1 34 SER CB C 3.988 9.314 0.554 1.00 . A A . 34 SER CB 1 1 13 8842 1 1 34 SER H H 3.218 7.539 2.120 1.00 . A A . 34 SER H 1 1 13 8843 1 1 34 SER HA H 5.642 8.003 0.944 1.00 . A A . 34 SER HA 1 1 13 8844 1 1 34 SER HB2 H 3.786 8.668 -0.284 1.00 . A A . 34 SER HB2 1 1 13 8845 1 1 34 SER HB3 H 3.064 9.520 1.078 1.00 . A A . 34 SER HB3 1 1 13 8846 1 1 34 SER HG H 5.311 10.303 -0.475 1.00 . A A . 34 SER HG 1 1 13 8847 1 1 34 SER N N 4.117 7.802 2.407 1.00 . A A . 34 SER N 1 1 13 8848 1 1 34 SER O O 6.937 9.873 2.084 1.00 . A A . 34 SER O 1 1 13 8849 1 1 34 SER OG O 4.560 10.527 0.079 1.00 . A A . 34 SER OG 1 1 13 8850 1 1 35 GLU C C 7.035 10.765 4.748 1.00 . A A . 35 GLU C 1 1 13 8851 1 1 35 GLU CA C 5.842 11.387 4.015 1.00 . A A . 35 GLU CA 1 1 13 8852 1 1 35 GLU CB C 4.808 11.907 5.014 1.00 . A A . 35 GLU CB 1 1 13 8853 1 1 35 GLU CD C 3.488 13.956 5.555 1.00 . A A . 35 GLU CD 1 1 13 8854 1 1 35 GLU CG C 4.822 13.436 5.015 1.00 . A A . 35 GLU CG 1 1 13 8855 1 1 35 GLU H H 4.168 10.185 3.376 1.00 . A A . 35 GLU H 1 1 13 8856 1 1 35 GLU HA H 6.171 12.191 3.376 1.00 . A A . 35 GLU HA 1 1 13 8857 1 1 35 GLU HB2 H 3.827 11.553 4.731 1.00 . A A . 35 GLU HB2 1 1 13 8858 1 1 35 GLU HB3 H 5.051 11.545 6.002 1.00 . A A . 35 GLU HB3 1 1 13 8859 1 1 35 GLU HG2 H 5.628 13.789 5.641 1.00 . A A . 35 GLU HG2 1 1 13 8860 1 1 35 GLU HG3 H 4.964 13.796 4.007 1.00 . A A . 35 GLU HG3 1 1 13 8861 1 1 35 GLU N N 5.121 10.352 3.216 1.00 . A A . 35 GLU N 1 1 13 8862 1 1 35 GLU O O 7.914 11.459 5.222 1.00 . A A . 35 GLU O 1 1 13 8863 1 1 35 GLU OE1 O 2.467 13.627 4.975 1.00 . A A . 35 GLU OE1 1 1 13 8864 1 1 35 GLU OE2 O 3.511 14.675 6.541 1.00 . A A . 35 GLU OE2 1 1 13 8865 1 1 36 GLU C C 8.994 7.909 4.583 1.00 . A A . 36 GLU C 1 1 13 8866 1 1 36 GLU CA C 8.216 8.805 5.551 1.00 . A A . 36 GLU CA 1 1 13 8867 1 1 36 GLU CB C 7.570 7.965 6.654 1.00 . A A . 36 GLU CB 1 1 13 8868 1 1 36 GLU CD C 8.749 8.095 8.854 1.00 . A A . 36 GLU CD 1 1 13 8869 1 1 36 GLU CG C 8.661 7.340 7.527 1.00 . A A . 36 GLU CG 1 1 13 8870 1 1 36 GLU H H 6.360 8.920 4.460 1.00 . A A . 36 GLU H 1 1 13 8871 1 1 36 GLU HA H 8.868 9.545 5.987 1.00 . A A . 36 GLU HA 1 1 13 8872 1 1 36 GLU HB2 H 6.938 8.596 7.262 1.00 . A A . 36 GLU HB2 1 1 13 8873 1 1 36 GLU HB3 H 6.976 7.182 6.207 1.00 . A A . 36 GLU HB3 1 1 13 8874 1 1 36 GLU HG2 H 8.422 6.304 7.715 1.00 . A A . 36 GLU HG2 1 1 13 8875 1 1 36 GLU HG3 H 9.611 7.403 7.015 1.00 . A A . 36 GLU HG3 1 1 13 8876 1 1 36 GLU N N 7.077 9.464 4.847 1.00 . A A . 36 GLU N 1 1 13 8877 1 1 36 GLU O O 10.102 7.495 4.861 1.00 . A A . 36 GLU O 1 1 13 8878 1 1 36 GLU OE1 O 8.278 9.221 8.904 1.00 . A A . 36 GLU OE1 1 1 13 8879 1 1 36 GLU OE2 O 9.285 7.538 9.797 1.00 . A A . 36 GLU OE2 1 1 13 8880 1 1 37 CYS C C 10.303 7.500 1.836 1.00 . A A . 37 CYS C 1 1 13 8881 1 1 37 CYS CA C 9.133 6.738 2.466 1.00 . A A . 37 CYS CA 1 1 13 8882 1 1 37 CYS CB C 8.081 6.398 1.407 1.00 . A A . 37 CYS CB 1 1 13 8883 1 1 37 CYS H H 7.530 7.951 3.242 1.00 . A A . 37 CYS H 1 1 13 8884 1 1 37 CYS HA H 9.481 5.836 2.942 1.00 . A A . 37 CYS HA 1 1 13 8885 1 1 37 CYS HB2 H 7.635 7.309 1.036 1.00 . A A . 37 CYS HB2 1 1 13 8886 1 1 37 CYS HB3 H 8.549 5.870 0.590 1.00 . A A . 37 CYS HB3 1 1 13 8887 1 1 37 CYS N N 8.423 7.608 3.449 1.00 . A A . 37 CYS N 1 1 13 8888 1 1 37 CYS O O 10.223 8.689 1.595 1.00 . A A . 37 CYS O 1 1 13 8889 1 1 37 CYS SG S 6.797 5.354 2.142 1.00 . A A . 37 CYS SG 1 1 13 8890 1 1 38 LEU C C 12.227 7.947 -0.481 1.00 . A A . 38 LEU C 1 1 13 8891 1 1 38 LEU CA C 12.560 7.520 0.951 1.00 . A A . 38 LEU CA 1 1 13 8892 1 1 38 LEU CB C 13.683 6.482 0.950 1.00 . A A . 38 LEU CB 1 1 13 8893 1 1 38 LEU CD1 C 14.546 5.168 2.890 1.00 . A A . 38 LEU CD1 1 1 13 8894 1 1 38 LEU CD2 C 15.864 7.093 2.003 1.00 . A A . 38 LEU CD2 1 1 13 8895 1 1 38 LEU CG C 14.454 6.562 2.269 1.00 . A A . 38 LEU CG 1 1 13 8896 1 1 38 LEU H H 11.436 5.870 1.767 1.00 . A A . 38 LEU H 1 1 13 8897 1 1 38 LEU HA H 12.848 8.374 1.544 1.00 . A A . 38 LEU HA 1 1 13 8898 1 1 38 LEU HB2 H 13.261 5.494 0.839 1.00 . A A . 38 LEU HB2 1 1 13 8899 1 1 38 LEU HB3 H 14.355 6.681 0.130 1.00 . A A . 38 LEU HB3 1 1 13 8900 1 1 38 LEU HD11 H 15.101 5.222 3.816 1.00 . A A . 38 LEU HD11 1 1 13 8901 1 1 38 LEU HD12 H 15.052 4.502 2.207 1.00 . A A . 38 LEU HD12 1 1 13 8902 1 1 38 LEU HD13 H 13.552 4.795 3.087 1.00 . A A . 38 LEU HD13 1 1 13 8903 1 1 38 LEU HD21 H 16.193 6.769 1.026 1.00 . A A . 38 LEU HD21 1 1 13 8904 1 1 38 LEU HD22 H 16.540 6.714 2.754 1.00 . A A . 38 LEU HD22 1 1 13 8905 1 1 38 LEU HD23 H 15.854 8.172 2.039 1.00 . A A . 38 LEU HD23 1 1 13 8906 1 1 38 LEU HG H 13.938 7.226 2.947 1.00 . A A . 38 LEU HG 1 1 13 8907 1 1 38 LEU N N 11.390 6.828 1.567 1.00 . A A . 38 LEU N 1 1 13 8908 1 1 38 LEU O O 12.280 9.112 -0.822 1.00 . A A . 38 LEU O 1 1 13 8909 1 1 39 SER C C 10.113 7.905 -2.807 1.00 . A A . 39 SER C 1 1 13 8910 1 1 39 SER CA C 11.543 7.362 -2.728 1.00 . A A . 39 SER CA 1 1 13 8911 1 1 39 SER CB C 11.666 6.050 -3.502 1.00 . A A . 39 SER CB 1 1 13 8912 1 1 39 SER H H 11.843 6.077 -1.026 1.00 . A A . 39 SER H 1 1 13 8913 1 1 39 SER HA H 12.242 8.085 -3.115 1.00 . A A . 39 SER HA 1 1 13 8914 1 1 39 SER HB2 H 11.235 5.248 -2.927 1.00 . A A . 39 SER HB2 1 1 13 8915 1 1 39 SER HB3 H 11.142 6.138 -4.444 1.00 . A A . 39 SER HB3 1 1 13 8916 1 1 39 SER HG H 13.266 6.098 -4.608 1.00 . A A . 39 SER HG 1 1 13 8917 1 1 39 SER N N 11.880 7.011 -1.321 1.00 . A A . 39 SER N 1 1 13 8918 1 1 39 SER O O 9.484 8.167 -1.801 1.00 . A A . 39 SER O 1 1 13 8919 1 1 39 SER OG O 13.041 5.772 -3.734 1.00 . A A . 39 SER OG 1 1 13 8920 1 1 40 GLY C C 7.247 7.453 -4.413 1.00 . A A . 40 GLY C 1 1 13 8921 1 1 40 GLY CA C 8.210 8.606 -4.130 1.00 . A A . 40 GLY CA 1 1 13 8922 1 1 40 GLY H H 10.121 7.862 -4.791 1.00 . A A . 40 GLY H 1 1 13 8923 1 1 40 GLY HA2 H 7.923 9.101 -3.213 1.00 . A A . 40 GLY HA2 1 1 13 8924 1 1 40 GLY HA3 H 8.173 9.310 -4.946 1.00 . A A . 40 GLY HA3 1 1 13 8925 1 1 40 GLY N N 9.597 8.078 -3.992 1.00 . A A . 40 GLY N 1 1 13 8926 1 1 40 GLY O O 6.384 7.549 -5.262 1.00 . A A . 40 GLY O 1 1 13 8927 1 1 41 THR C C 5.865 4.722 -2.625 1.00 . A A . 41 THR C 1 1 13 8928 1 1 41 THR CA C 6.473 5.205 -3.947 1.00 . A A . 41 THR CA 1 1 13 8929 1 1 41 THR CB C 7.358 4.120 -4.559 1.00 . A A . 41 THR CB 1 1 13 8930 1 1 41 THR CG2 C 8.450 3.729 -3.562 1.00 . A A . 41 THR CG2 1 1 13 8931 1 1 41 THR H H 8.088 6.301 -3.030 1.00 . A A . 41 THR H 1 1 13 8932 1 1 41 THR HA H 5.693 5.479 -4.640 1.00 . A A . 41 THR HA 1 1 13 8933 1 1 41 THR HB H 7.818 4.494 -5.460 1.00 . A A . 41 THR HB 1 1 13 8934 1 1 41 THR HG1 H 7.076 2.196 -4.665 1.00 . A A . 41 THR HG1 1 1 13 8935 1 1 41 THR HG21 H 9.420 3.858 -4.020 1.00 . A A . 41 THR HG21 1 1 13 8936 1 1 41 THR HG22 H 8.323 2.696 -3.274 1.00 . A A . 41 THR HG22 1 1 13 8937 1 1 41 THR HG23 H 8.381 4.358 -2.686 1.00 . A A . 41 THR HG23 1 1 13 8938 1 1 41 THR N N 7.385 6.361 -3.710 1.00 . A A . 41 THR N 1 1 13 8939 1 1 41 THR O O 6.537 4.635 -1.616 1.00 . A A . 41 THR O 1 1 13 8940 1 1 41 THR OG1 O 6.563 2.983 -4.867 1.00 . A A . 41 THR OG1 1 1 13 8941 1 1 42 TRP C C 2.977 2.783 -1.698 1.00 . A A . 42 TRP C 1 1 13 8942 1 1 42 TRP CA C 3.945 3.923 -1.375 1.00 . A A . 42 TRP CA 1 1 13 8943 1 1 42 TRP CB C 3.185 5.134 -0.830 1.00 . A A . 42 TRP CB 1 1 13 8944 1 1 42 TRP CD1 C 3.173 4.427 1.597 1.00 . A A . 42 TRP CD1 1 1 13 8945 1 1 42 TRP CD2 C 1.100 4.725 0.773 1.00 . A A . 42 TRP CD2 1 1 13 8946 1 1 42 TRP CE2 C 0.948 4.337 2.126 1.00 . A A . 42 TRP CE2 1 1 13 8947 1 1 42 TRP CE3 C -0.061 4.976 0.020 1.00 . A A . 42 TRP CE3 1 1 13 8948 1 1 42 TRP CG C 2.524 4.774 0.463 1.00 . A A . 42 TRP CG 1 1 13 8949 1 1 42 TRP CH2 C -1.456 4.456 1.946 1.00 . A A . 42 TRP CH2 1 1 13 8950 1 1 42 TRP CZ2 C -0.314 4.203 2.709 1.00 . A A . 42 TRP CZ2 1 1 13 8951 1 1 42 TRP CZ3 C -1.331 4.842 0.605 1.00 . A A . 42 TRP CZ3 1 1 13 8952 1 1 42 TRP H H 4.078 4.482 -3.452 1.00 . A A . 42 TRP H 1 1 13 8953 1 1 42 TRP HA H 4.687 3.599 -0.662 1.00 . A A . 42 TRP HA 1 1 13 8954 1 1 42 TRP HB2 H 3.876 5.948 -0.663 1.00 . A A . 42 TRP HB2 1 1 13 8955 1 1 42 TRP HB3 H 2.435 5.440 -1.545 1.00 . A A . 42 TRP HB3 1 1 13 8956 1 1 42 TRP HD1 H 4.244 4.363 1.713 1.00 . A A . 42 TRP HD1 1 1 13 8957 1 1 42 TRP HE1 H 2.449 3.896 3.503 1.00 . A A . 42 TRP HE1 1 1 13 8958 1 1 42 TRP HE3 H 0.025 5.274 -1.014 1.00 . A A . 42 TRP HE3 1 1 13 8959 1 1 42 TRP HH2 H -2.436 4.354 2.390 1.00 . A A . 42 TRP HH2 1 1 13 8960 1 1 42 TRP HZ2 H -0.406 3.905 3.744 1.00 . A A . 42 TRP HZ2 1 1 13 8961 1 1 42 TRP HZ3 H -2.215 5.037 0.017 1.00 . A A . 42 TRP HZ3 1 1 13 8962 1 1 42 TRP N N 4.599 4.405 -2.626 1.00 . A A . 42 TRP N 1 1 13 8963 1 1 42 TRP NE1 N 2.239 4.168 2.585 1.00 . A A . 42 TRP NE1 1 1 13 8964 1 1 42 TRP O O 2.174 2.878 -2.606 1.00 . A A . 42 TRP O 1 1 13 8965 1 1 43 THR C C 1.343 0.199 0.031 1.00 . A A . 43 THR C 1 1 13 8966 1 1 43 THR CA C 2.123 0.566 -1.234 1.00 . A A . 43 THR CA 1 1 13 8967 1 1 43 THR CB C 3.034 -0.587 -1.660 1.00 . A A . 43 THR CB 1 1 13 8968 1 1 43 THR CG2 C 4.135 -0.783 -0.618 1.00 . A A . 43 THR CG2 1 1 13 8969 1 1 43 THR H H 3.697 1.648 -0.237 1.00 . A A . 43 THR H 1 1 13 8970 1 1 43 THR HA H 1.444 0.813 -2.036 1.00 . A A . 43 THR HA 1 1 13 8971 1 1 43 THR HB H 3.484 -0.356 -2.613 1.00 . A A . 43 THR HB 1 1 13 8972 1 1 43 THR HG1 H 2.230 -2.019 -2.701 1.00 . A A . 43 THR HG1 1 1 13 8973 1 1 43 THR HG21 H 3.689 -1.003 0.340 1.00 . A A . 43 THR HG21 1 1 13 8974 1 1 43 THR HG22 H 4.724 0.120 -0.543 1.00 . A A . 43 THR HG22 1 1 13 8975 1 1 43 THR HG23 H 4.771 -1.603 -0.917 1.00 . A A . 43 THR HG23 1 1 13 8976 1 1 43 THR N N 3.043 1.707 -0.964 1.00 . A A . 43 THR N 1 1 13 8977 1 1 43 THR O O 1.806 0.389 1.139 1.00 . A A . 43 THR O 1 1 13 8978 1 1 43 THR OG1 O 2.267 -1.777 -1.773 1.00 . A A . 43 THR OG1 1 1 13 8979 1 1 44 GLN C C -1.255 -2.101 0.863 1.00 . A A . 44 GLN C 1 1 13 8980 1 1 44 GLN CA C -0.646 -0.714 1.066 1.00 . A A . 44 GLN CA 1 1 13 8981 1 1 44 GLN CB C -1.742 0.349 1.169 1.00 . A A . 44 GLN CB 1 1 13 8982 1 1 44 GLN CD C -3.400 -0.719 -0.365 1.00 . A A . 44 GLN CD 1 1 13 8983 1 1 44 GLN CG C -2.468 0.478 -0.172 1.00 . A A . 44 GLN CG 1 1 13 8984 1 1 44 GLN H H -0.191 -0.481 -1.027 1.00 . A A . 44 GLN H 1 1 13 8985 1 1 44 GLN HA H -0.035 -0.697 1.954 1.00 . A A . 44 GLN HA 1 1 13 8986 1 1 44 GLN HB2 H -2.450 0.060 1.933 1.00 . A A . 44 GLN HB2 1 1 13 8987 1 1 44 GLN HB3 H -1.300 1.299 1.429 1.00 . A A . 44 GLN HB3 1 1 13 8988 1 1 44 GLN HE21 H -4.286 -0.493 1.396 1.00 . A A . 44 GLN HE21 1 1 13 8989 1 1 44 GLN HE22 H -4.850 -1.794 0.463 1.00 . A A . 44 GLN HE22 1 1 13 8990 1 1 44 GLN HG2 H -3.046 1.390 -0.180 1.00 . A A . 44 GLN HG2 1 1 13 8991 1 1 44 GLN HG3 H -1.746 0.503 -0.973 1.00 . A A . 44 GLN HG3 1 1 13 8992 1 1 44 GLN N N 0.162 -0.330 -0.126 1.00 . A A . 44 GLN N 1 1 13 8993 1 1 44 GLN NE2 N -4.249 -1.027 0.576 1.00 . A A . 44 GLN NE2 1 1 13 8994 1 1 44 GLN O O -2.249 -2.450 1.469 1.00 . A A . 44 GLN O 1 1 13 8995 1 1 44 GLN OE1 O -3.356 -1.380 -1.384 1.00 . A A . 44 GLN OE1 1 1 13 8996 1 1 45 GLN C C -0.068 -5.236 -0.538 1.00 . A A . 45 GLN C 1 1 13 8997 1 1 45 GLN CA C -1.207 -4.262 -0.229 1.00 . A A . 45 GLN CA 1 1 13 8998 1 1 45 GLN CB C -2.125 -4.110 -1.442 1.00 . A A . 45 GLN CB 1 1 13 8999 1 1 45 GLN CD C -3.718 -5.901 -0.744 1.00 . A A . 45 GLN CD 1 1 13 9000 1 1 45 GLN CG C -2.710 -5.474 -1.810 1.00 . A A . 45 GLN CG 1 1 13 9001 1 1 45 GLN H H 0.136 -2.595 -0.465 1.00 . A A . 45 GLN H 1 1 13 9002 1 1 45 GLN HA H -1.775 -4.600 0.623 1.00 . A A . 45 GLN HA 1 1 13 9003 1 1 45 GLN HB2 H -2.926 -3.426 -1.203 1.00 . A A . 45 GLN HB2 1 1 13 9004 1 1 45 GLN HB3 H -1.558 -3.726 -2.276 1.00 . A A . 45 GLN HB3 1 1 13 9005 1 1 45 GLN HE21 H -4.893 -4.327 -1.026 1.00 . A A . 45 GLN HE21 1 1 13 9006 1 1 45 GLN HE22 H -5.415 -5.418 0.166 1.00 . A A . 45 GLN HE22 1 1 13 9007 1 1 45 GLN HG2 H -3.204 -5.405 -2.769 1.00 . A A . 45 GLN HG2 1 1 13 9008 1 1 45 GLN HG3 H -1.916 -6.203 -1.865 1.00 . A A . 45 GLN HG3 1 1 13 9009 1 1 45 GLN N N -0.665 -2.896 0.013 1.00 . A A . 45 GLN N 1 1 13 9010 1 1 45 GLN NE2 N -4.762 -5.153 -0.516 1.00 . A A . 45 GLN NE2 1 1 13 9011 1 1 45 GLN O O 0.487 -5.236 -1.620 1.00 . A A . 45 GLN O 1 1 13 9012 1 1 45 GLN OE1 O -3.554 -6.926 -0.111 1.00 . A A . 45 GLN OE1 1 1 13 9013 1 1 46 ILE C C 1.165 -8.313 0.988 1.00 . A A . 46 ILE C 1 1 13 9014 1 1 46 ILE CA C 1.387 -7.043 0.161 1.00 . A A . 46 ILE CA 1 1 13 9015 1 1 46 ILE CB C 2.671 -6.325 0.593 1.00 . A A . 46 ILE CB 1 1 13 9016 1 1 46 ILE CD1 C 5.028 -6.664 1.347 1.00 . A A . 46 ILE CD1 1 1 13 9017 1 1 46 ILE CG1 C 3.789 -7.355 0.776 1.00 . A A . 46 ILE CG1 1 1 13 9018 1 1 46 ILE CG2 C 2.454 -5.580 1.915 1.00 . A A . 46 ILE CG2 1 1 13 9019 1 1 46 ILE H H -0.176 -6.052 1.267 1.00 . A A . 46 ILE H 1 1 13 9020 1 1 46 ILE HA H 1.442 -7.287 -0.887 1.00 . A A . 46 ILE HA 1 1 13 9021 1 1 46 ILE HB H 2.959 -5.618 -0.171 1.00 . A A . 46 ILE HB 1 1 13 9022 1 1 46 ILE HD11 H 4.861 -6.434 2.389 1.00 . A A . 46 ILE HD11 1 1 13 9023 1 1 46 ILE HD12 H 5.216 -5.752 0.802 1.00 . A A . 46 ILE HD12 1 1 13 9024 1 1 46 ILE HD13 H 5.880 -7.321 1.256 1.00 . A A . 46 ILE HD13 1 1 13 9025 1 1 46 ILE HG12 H 3.459 -8.127 1.456 1.00 . A A . 46 ILE HG12 1 1 13 9026 1 1 46 ILE HG13 H 4.033 -7.795 -0.179 1.00 . A A . 46 ILE HG13 1 1 13 9027 1 1 46 ILE HG21 H 2.838 -4.575 1.827 1.00 . A A . 46 ILE HG21 1 1 13 9028 1 1 46 ILE HG22 H 2.977 -6.095 2.707 1.00 . A A . 46 ILE HG22 1 1 13 9029 1 1 46 ILE HG23 H 1.401 -5.542 2.147 1.00 . A A . 46 ILE HG23 1 1 13 9030 1 1 46 ILE N N 0.284 -6.067 0.402 1.00 . A A . 46 ILE N 1 1 13 9031 1 1 46 ILE O O 1.150 -9.410 0.464 1.00 . A A . 46 ILE O 1 1 13 9032 1 1 47 CYS C C -0.701 -9.765 3.136 1.00 . A A . 47 CYS C 1 1 13 9033 1 1 47 CYS CA C 0.781 -9.379 3.128 1.00 . A A . 47 CYS CA 1 1 13 9034 1 1 47 CYS CB C 1.237 -8.954 4.524 1.00 . A A . 47 CYS CB 1 1 13 9035 1 1 47 CYS H H 1.013 -7.285 2.679 1.00 . A A . 47 CYS H 1 1 13 9036 1 1 47 CYS HA H 1.383 -10.202 2.778 1.00 . A A . 47 CYS HA 1 1 13 9037 1 1 47 CYS HB2 H 0.706 -8.060 4.819 1.00 . A A . 47 CYS HB2 1 1 13 9038 1 1 47 CYS HB3 H 1.031 -9.746 5.228 1.00 . A A . 47 CYS HB3 1 1 13 9039 1 1 47 CYS N N 0.996 -8.176 2.274 1.00 . A A . 47 CYS N 1 1 13 9040 1 1 47 CYS O O -1.568 -8.946 2.903 1.00 . A A . 47 CYS O 1 1 13 9041 1 1 47 CYS SG S 3.016 -8.619 4.494 1.00 . A A . 47 CYS SG 1 1 13 9042 1 1 48 LEU C C -2.982 -11.339 4.847 1.00 . A A . 48 LEU C 1 1 13 9043 1 1 48 LEU CA C -2.421 -11.448 3.428 1.00 . A A . 48 LEU CA 1 1 13 9044 1 1 48 LEU CB C -2.392 -12.907 2.972 1.00 . A A . 48 LEU CB 1 1 13 9045 1 1 48 LEU CD1 C -1.596 -13.844 0.798 1.00 . A A . 48 LEU CD1 1 1 13 9046 1 1 48 LEU CD2 C -4.044 -13.602 1.233 1.00 . A A . 48 LEU CD2 1 1 13 9047 1 1 48 LEU CG C -2.664 -12.980 1.469 1.00 . A A . 48 LEU CG 1 1 13 9048 1 1 48 LEU H H -0.280 -11.651 3.590 1.00 . A A . 48 LEU H 1 1 13 9049 1 1 48 LEU HA H -3.009 -10.859 2.743 1.00 . A A . 48 LEU HA 1 1 13 9050 1 1 48 LEU HB2 H -1.420 -13.330 3.183 1.00 . A A . 48 LEU HB2 1 1 13 9051 1 1 48 LEU HB3 H -3.149 -13.465 3.501 1.00 . A A . 48 LEU HB3 1 1 13 9052 1 1 48 LEU HD11 H -0.927 -14.239 1.548 1.00 . A A . 48 LEU HD11 1 1 13 9053 1 1 48 LEU HD12 H -1.036 -13.243 0.097 1.00 . A A . 48 LEU HD12 1 1 13 9054 1 1 48 LEU HD13 H -2.070 -14.660 0.273 1.00 . A A . 48 LEU HD13 1 1 13 9055 1 1 48 LEU HD21 H -4.134 -13.897 0.198 1.00 . A A . 48 LEU HD21 1 1 13 9056 1 1 48 LEU HD22 H -4.810 -12.878 1.469 1.00 . A A . 48 LEU HD22 1 1 13 9057 1 1 48 LEU HD23 H -4.161 -14.469 1.866 1.00 . A A . 48 LEU HD23 1 1 13 9058 1 1 48 LEU HG H -2.638 -11.985 1.050 1.00 . A A . 48 LEU HG 1 1 13 9059 1 1 48 LEU N N -0.996 -11.007 3.404 1.00 . A A . 48 LEU N 1 1 13 9060 1 1 48 LEU O O -2.315 -10.753 5.683 1.00 . A A . 48 LEU O 1 1 13 9061 1 1 48 LEU OXT O -4.068 -11.847 5.075 1.00 . A A . 48 LEU OXT 1 1 14 9062 1 1 1 GLY C C -1.417 6.967 17.363 1.00 . A A . 1 GLY C 1 1 14 9063 1 1 1 GLY CA C -2.218 7.373 16.126 1.00 . A A . 1 GLY CA 1 1 14 9064 1 1 1 GLY H1 H -1.063 8.133 14.567 1.00 . A A . 1 GLY H1 1 1 14 9065 1 1 1 GLY H2 H -0.809 8.906 16.060 1.00 . A A . 1 GLY H2 1 1 14 9066 1 1 1 GLY H3 H -2.219 9.221 15.164 1.00 . A A . 1 GLY H3 1 1 14 9067 1 1 1 GLY HA2 H -3.206 7.692 16.424 1.00 . A A . 1 GLY HA2 1 1 14 9068 1 1 1 GLY HA3 H -2.298 6.527 15.460 1.00 . A A . 1 GLY HA3 1 1 14 9069 1 1 1 GLY N N -1.525 8.493 15.427 1.00 . A A . 1 GLY N 1 1 14 9070 1 1 1 GLY O O -0.684 5.999 17.350 1.00 . A A . 1 GLY O 1 1 14 9071 1 1 2 SER C C -1.208 5.976 20.180 1.00 . A A . 2 SER C 1 1 14 9072 1 1 2 SER CA C -0.793 7.359 19.672 1.00 . A A . 2 SER CA 1 1 14 9073 1 1 2 SER CB C -1.178 8.437 20.683 1.00 . A A . 2 SER CB 1 1 14 9074 1 1 2 SER H H -2.145 8.479 18.423 1.00 . A A . 2 SER H 1 1 14 9075 1 1 2 SER HA H 0.269 7.391 19.486 1.00 . A A . 2 SER HA 1 1 14 9076 1 1 2 SER HB2 H -2.246 8.431 20.828 1.00 . A A . 2 SER HB2 1 1 14 9077 1 1 2 SER HB3 H -0.688 8.233 21.627 1.00 . A A . 2 SER HB3 1 1 14 9078 1 1 2 SER HG H 0.137 9.847 20.437 1.00 . A A . 2 SER HG 1 1 14 9079 1 1 2 SER N N -1.549 7.702 18.433 1.00 . A A . 2 SER N 1 1 14 9080 1 1 2 SER O O -0.556 5.394 21.025 1.00 . A A . 2 SER O 1 1 14 9081 1 1 2 SER OG O -0.779 9.707 20.188 1.00 . A A . 2 SER OG 1 1 14 9082 1 1 3 ALA C C -2.171 3.010 19.221 1.00 . A A . 3 ALA C 1 1 14 9083 1 1 3 ALA CA C -2.741 4.099 20.133 1.00 . A A . 3 ALA CA 1 1 14 9084 1 1 3 ALA CB C -4.265 4.139 20.033 1.00 . A A . 3 ALA CB 1 1 14 9085 1 1 3 ALA H H -2.800 5.931 18.994 1.00 . A A . 3 ALA H 1 1 14 9086 1 1 3 ALA HA H -2.443 3.930 21.155 1.00 . A A . 3 ALA HA 1 1 14 9087 1 1 3 ALA HB1 H -4.634 3.157 19.772 1.00 . A A . 3 ALA HB1 1 1 14 9088 1 1 3 ALA HB2 H -4.560 4.847 19.273 1.00 . A A . 3 ALA HB2 1 1 14 9089 1 1 3 ALA HB3 H -4.681 4.436 20.984 1.00 . A A . 3 ALA HB3 1 1 14 9090 1 1 3 ALA N N -2.287 5.445 19.674 1.00 . A A . 3 ALA N 1 1 14 9091 1 1 3 ALA O O -1.169 2.394 19.525 1.00 . A A . 3 ALA O 1 1 14 9092 1 1 4 MET C C -1.905 2.348 15.835 1.00 . A A . 4 MET C 1 1 14 9093 1 1 4 MET CA C -2.295 1.718 17.174 1.00 . A A . 4 MET CA 1 1 14 9094 1 1 4 MET CB C -3.466 0.753 16.991 1.00 . A A . 4 MET CB 1 1 14 9095 1 1 4 MET CE C -4.413 -0.796 20.355 1.00 . A A . 4 MET CE 1 1 14 9096 1 1 4 MET CG C -3.284 -0.452 17.914 1.00 . A A . 4 MET CG 1 1 14 9097 1 1 4 MET H H -3.609 3.275 17.877 1.00 . A A . 4 MET H 1 1 14 9098 1 1 4 MET HA H -1.454 1.201 17.609 1.00 . A A . 4 MET HA 1 1 14 9099 1 1 4 MET HB2 H -4.390 1.259 17.235 1.00 . A A . 4 MET HB2 1 1 14 9100 1 1 4 MET HB3 H -3.500 0.418 15.965 1.00 . A A . 4 MET HB3 1 1 14 9101 1 1 4 MET HE1 H -3.965 0.171 20.537 1.00 . A A . 4 MET HE1 1 1 14 9102 1 1 4 MET HE2 H -3.703 -1.571 20.592 1.00 . A A . 4 MET HE2 1 1 14 9103 1 1 4 MET HE3 H -5.292 -0.913 20.975 1.00 . A A . 4 MET HE3 1 1 14 9104 1 1 4 MET HG2 H -2.883 -1.281 17.350 1.00 . A A . 4 MET HG2 1 1 14 9105 1 1 4 MET HG3 H -2.604 -0.196 18.712 1.00 . A A . 4 MET HG3 1 1 14 9106 1 1 4 MET N N -2.802 2.767 18.105 1.00 . A A . 4 MET N 1 1 14 9107 1 1 4 MET O O -2.380 1.954 14.789 1.00 . A A . 4 MET O 1 1 14 9108 1 1 4 MET SD S -4.887 -0.919 18.613 1.00 . A A . 4 MET SD 1 1 14 9109 1 1 5 GLY C C -0.041 2.945 13.633 1.00 . A A . 5 GLY C 1 1 14 9110 1 1 5 GLY CA C -0.626 3.986 14.591 1.00 . A A . 5 GLY CA 1 1 14 9111 1 1 5 GLY H H -0.673 3.631 16.714 1.00 . A A . 5 GLY H 1 1 14 9112 1 1 5 GLY HA2 H -1.483 4.457 14.133 1.00 . A A . 5 GLY HA2 1 1 14 9113 1 1 5 GLY HA3 H 0.123 4.732 14.804 1.00 . A A . 5 GLY HA3 1 1 14 9114 1 1 5 GLY N N -1.043 3.327 15.860 1.00 . A A . 5 GLY N 1 1 14 9115 1 1 5 GLY O O 0.545 1.964 14.046 1.00 . A A . 5 GLY O 1 1 14 9116 1 1 6 CYS C C 1.878 2.281 11.326 1.00 . A A . 6 CYS C 1 1 14 9117 1 1 6 CYS CA C 0.350 2.187 11.362 1.00 . A A . 6 CYS CA 1 1 14 9118 1 1 6 CYS CB C -0.261 2.617 10.027 1.00 . A A . 6 CYS CB 1 1 14 9119 1 1 6 CYS H H -0.671 3.954 12.045 1.00 . A A . 6 CYS H 1 1 14 9120 1 1 6 CYS HA H 0.038 1.184 11.604 1.00 . A A . 6 CYS HA 1 1 14 9121 1 1 6 CYS HB2 H -1.304 2.344 10.009 1.00 . A A . 6 CYS HB2 1 1 14 9122 1 1 6 CYS HB3 H -0.170 3.686 9.918 1.00 . A A . 6 CYS HB3 1 1 14 9123 1 1 6 CYS N N -0.196 3.155 12.354 1.00 . A A . 6 CYS N 1 1 14 9124 1 1 6 CYS O O 2.567 1.287 11.206 1.00 . A A . 6 CYS O 1 1 14 9125 1 1 6 CYS SG S 0.591 1.792 8.659 1.00 . A A . 6 CYS SG 1 1 14 9126 1 1 7 ARG C C 4.494 2.900 12.645 1.00 . A A . 7 ARG C 1 1 14 9127 1 1 7 ARG CA C 3.899 3.612 11.430 1.00 . A A . 7 ARG CA 1 1 14 9128 1 1 7 ARG CB C 4.155 5.119 11.504 1.00 . A A . 7 ARG CB 1 1 14 9129 1 1 7 ARG CD C 4.610 7.174 10.154 1.00 . A A . 7 ARG CD 1 1 14 9130 1 1 7 ARG CG C 4.396 5.661 10.095 1.00 . A A . 7 ARG CG 1 1 14 9131 1 1 7 ARG CZ C 2.236 7.501 10.500 1.00 . A A . 7 ARG CZ 1 1 14 9132 1 1 7 ARG H H 1.844 4.256 11.548 1.00 . A A . 7 ARG H 1 1 14 9133 1 1 7 ARG HA H 4.310 3.210 10.516 1.00 . A A . 7 ARG HA 1 1 14 9134 1 1 7 ARG HB2 H 3.296 5.608 11.938 1.00 . A A . 7 ARG HB2 1 1 14 9135 1 1 7 ARG HB3 H 5.025 5.307 12.115 1.00 . A A . 7 ARG HB3 1 1 14 9136 1 1 7 ARG HD2 H 4.894 7.473 11.153 1.00 . A A . 7 ARG HD2 1 1 14 9137 1 1 7 ARG HD3 H 5.362 7.476 9.442 1.00 . A A . 7 ARG HD3 1 1 14 9138 1 1 7 ARG HE H 3.225 8.360 9.008 1.00 . A A . 7 ARG HE 1 1 14 9139 1 1 7 ARG HG2 H 5.272 5.189 9.673 1.00 . A A . 7 ARG HG2 1 1 14 9140 1 1 7 ARG HG3 H 3.541 5.446 9.479 1.00 . A A . 7 ARG HG3 1 1 14 9141 1 1 7 ARG HH11 H 3.079 8.046 12.233 1.00 . A A . 7 ARG HH11 1 1 14 9142 1 1 7 ARG HH12 H 1.442 7.491 12.338 1.00 . A A . 7 ARG HH12 1 1 14 9143 1 1 7 ARG HH21 H 1.146 6.895 8.934 1.00 . A A . 7 ARG HH21 1 1 14 9144 1 1 7 ARG HH22 H 0.347 6.838 10.469 1.00 . A A . 7 ARG HH22 1 1 14 9145 1 1 7 ARG N N 2.415 3.466 11.443 1.00 . A A . 7 ARG N 1 1 14 9146 1 1 7 ARG NE N 3.295 7.768 9.787 1.00 . A A . 7 ARG NE 1 1 14 9147 1 1 7 ARG NH1 N 2.253 7.694 11.790 1.00 . A A . 7 ARG NH1 1 1 14 9148 1 1 7 ARG NH2 N 1.159 7.043 9.924 1.00 . A A . 7 ARG NH2 1 1 14 9149 1 1 7 ARG O O 5.681 2.650 12.714 1.00 . A A . 7 ARG O 1 1 14 9150 1 1 8 HIS C C 4.210 0.350 14.550 1.00 . A A . 8 HIS C 1 1 14 9151 1 1 8 HIS CA C 4.176 1.861 14.812 1.00 . A A . 8 HIS CA 1 1 14 9152 1 1 8 HIS CB C 3.168 2.210 15.915 1.00 . A A . 8 HIS CB 1 1 14 9153 1 1 8 HIS CD2 C 2.375 0.065 17.213 1.00 . A A . 8 HIS CD2 1 1 14 9154 1 1 8 HIS CE1 C 3.864 0.076 18.787 1.00 . A A . 8 HIS CE1 1 1 14 9155 1 1 8 HIS CG C 3.184 1.152 16.987 1.00 . A A . 8 HIS CG 1 1 14 9156 1 1 8 HIS H H 2.717 2.773 13.516 1.00 . A A . 8 HIS H 1 1 14 9157 1 1 8 HIS HA H 5.157 2.221 15.078 1.00 . A A . 8 HIS HA 1 1 14 9158 1 1 8 HIS HB2 H 3.429 3.163 16.349 1.00 . A A . 8 HIS HB2 1 1 14 9159 1 1 8 HIS HB3 H 2.177 2.271 15.488 1.00 . A A . 8 HIS HB3 1 1 14 9160 1 1 8 HIS HD1 H 4.853 1.786 18.128 1.00 . A A . 8 HIS HD1 1 1 14 9161 1 1 8 HIS HD2 H 1.532 -0.221 16.602 1.00 . A A . 8 HIS HD2 1 1 14 9162 1 1 8 HIS HE1 H 4.437 -0.186 19.663 1.00 . A A . 8 HIS HE1 1 1 14 9163 1 1 8 HIS N N 3.672 2.566 13.599 1.00 . A A . 8 HIS N 1 1 14 9164 1 1 8 HIS ND1 N 4.127 1.139 18.004 1.00 . A A . 8 HIS ND1 1 1 14 9165 1 1 8 HIS NE2 N 2.806 -0.613 18.350 1.00 . A A . 8 HIS NE2 1 1 14 9166 1 1 8 HIS O O 5.015 -0.368 15.108 1.00 . A A . 8 HIS O 1 1 14 9167 1 1 9 PHE C C 4.715 -2.051 12.954 1.00 . A A . 9 PHE C 1 1 14 9168 1 1 9 PHE CA C 3.325 -1.592 13.403 1.00 . A A . 9 PHE CA 1 1 14 9169 1 1 9 PHE CB C 2.311 -1.751 12.269 1.00 . A A . 9 PHE CB 1 1 14 9170 1 1 9 PHE CD1 C 0.733 -0.849 14.035 1.00 . A A . 9 PHE CD1 1 1 14 9171 1 1 9 PHE CD2 C -0.086 -1.143 11.770 1.00 . A A . 9 PHE CD2 1 1 14 9172 1 1 9 PHE CE1 C -0.524 -0.376 14.428 1.00 . A A . 9 PHE CE1 1 1 14 9173 1 1 9 PHE CE2 C -1.343 -0.669 12.165 1.00 . A A . 9 PHE CE2 1 1 14 9174 1 1 9 PHE CG C 0.954 -1.234 12.704 1.00 . A A . 9 PHE CG 1 1 14 9175 1 1 9 PHE CZ C -1.562 -0.285 13.493 1.00 . A A . 9 PHE CZ 1 1 14 9176 1 1 9 PHE H H 2.702 0.465 13.263 1.00 . A A . 9 PHE H 1 1 14 9177 1 1 9 PHE HA H 3.004 -2.151 14.268 1.00 . A A . 9 PHE HA 1 1 14 9178 1 1 9 PHE HB2 H 2.648 -1.192 11.408 1.00 . A A . 9 PHE HB2 1 1 14 9179 1 1 9 PHE HB3 H 2.229 -2.795 12.006 1.00 . A A . 9 PHE HB3 1 1 14 9180 1 1 9 PHE HD1 H 1.533 -0.917 14.756 1.00 . A A . 9 PHE HD1 1 1 14 9181 1 1 9 PHE HD2 H 0.081 -1.437 10.745 1.00 . A A . 9 PHE HD2 1 1 14 9182 1 1 9 PHE HE1 H -0.693 -0.079 15.452 1.00 . A A . 9 PHE HE1 1 1 14 9183 1 1 9 PHE HE2 H -2.145 -0.600 11.445 1.00 . A A . 9 PHE HE2 1 1 14 9184 1 1 9 PHE HZ H -2.533 0.080 13.796 1.00 . A A . 9 PHE HZ 1 1 14 9185 1 1 9 PHE N N 3.342 -0.133 13.703 1.00 . A A . 9 PHE N 1 1 14 9186 1 1 9 PHE O O 5.362 -1.407 12.153 1.00 . A A . 9 PHE O 1 1 14 9187 1 1 10 GLN C C 6.433 -4.518 11.813 1.00 . A A . 10 GLN C 1 1 14 9188 1 1 10 GLN CA C 6.530 -3.649 13.069 1.00 . A A . 10 GLN CA 1 1 14 9189 1 1 10 GLN CB C 7.018 -4.476 14.260 1.00 . A A . 10 GLN CB 1 1 14 9190 1 1 10 GLN CD C 6.927 -6.754 15.284 1.00 . A A . 10 GLN CD 1 1 14 9191 1 1 10 GLN CG C 6.210 -5.773 14.355 1.00 . A A . 10 GLN CG 1 1 14 9192 1 1 10 GLN H H 4.645 -3.661 14.114 1.00 . A A . 10 GLN H 1 1 14 9193 1 1 10 GLN HA H 7.198 -2.819 12.901 1.00 . A A . 10 GLN HA 1 1 14 9194 1 1 10 GLN HB2 H 8.063 -4.712 14.131 1.00 . A A . 10 GLN HB2 1 1 14 9195 1 1 10 GLN HB3 H 6.887 -3.907 15.170 1.00 . A A . 10 GLN HB3 1 1 14 9196 1 1 10 GLN HE21 H 8.469 -7.004 14.059 1.00 . A A . 10 GLN HE21 1 1 14 9197 1 1 10 GLN HE22 H 8.543 -7.884 15.509 1.00 . A A . 10 GLN HE22 1 1 14 9198 1 1 10 GLN HG2 H 5.226 -5.556 14.747 1.00 . A A . 10 GLN HG2 1 1 14 9199 1 1 10 GLN HG3 H 6.117 -6.214 13.374 1.00 . A A . 10 GLN HG3 1 1 14 9200 1 1 10 GLN N N 5.181 -3.157 13.467 1.00 . A A . 10 GLN N 1 1 14 9201 1 1 10 GLN NE2 N 8.074 -7.255 14.921 1.00 . A A . 10 GLN NE2 1 1 14 9202 1 1 10 GLN O O 7.367 -4.622 11.043 1.00 . A A . 10 GLN O 1 1 14 9203 1 1 10 GLN OE1 O 6.438 -7.067 16.351 1.00 . A A . 10 GLN OE1 1 1 14 9204 1 1 11 SER C C 4.089 -5.427 9.462 1.00 . A A . 11 SER C 1 1 14 9205 1 1 11 SER CA C 5.152 -6.010 10.397 1.00 . A A . 11 SER CA 1 1 14 9206 1 1 11 SER CB C 4.703 -7.364 10.942 1.00 . A A . 11 SER CB 1 1 14 9207 1 1 11 SER H H 4.567 -5.049 12.236 1.00 . A A . 11 SER H 1 1 14 9208 1 1 11 SER HA H 6.093 -6.114 9.881 1.00 . A A . 11 SER HA 1 1 14 9209 1 1 11 SER HB2 H 3.947 -7.218 11.697 1.00 . A A . 11 SER HB2 1 1 14 9210 1 1 11 SER HB3 H 4.293 -7.958 10.136 1.00 . A A . 11 SER HB3 1 1 14 9211 1 1 11 SER HG H 5.535 -8.909 11.781 1.00 . A A . 11 SER HG 1 1 14 9212 1 1 11 SER N N 5.309 -5.145 11.602 1.00 . A A . 11 SER N 1 1 14 9213 1 1 11 SER O O 3.338 -4.548 9.835 1.00 . A A . 11 SER O 1 1 14 9214 1 1 11 SER OG O 5.817 -8.030 11.519 1.00 . A A . 11 SER OG 1 1 14 9215 1 1 12 CYS C C 1.618 -5.944 7.636 1.00 . A A . 12 CYS C 1 1 14 9216 1 1 12 CYS CA C 3.001 -5.381 7.298 1.00 . A A . 12 CYS CA 1 1 14 9217 1 1 12 CYS CB C 3.455 -5.861 5.919 1.00 . A A . 12 CYS CB 1 1 14 9218 1 1 12 CYS H H 4.632 -6.620 7.969 1.00 . A A . 12 CYS H 1 1 14 9219 1 1 12 CYS HA H 2.985 -4.303 7.326 1.00 . A A . 12 CYS HA 1 1 14 9220 1 1 12 CYS HB2 H 2.835 -5.409 5.159 1.00 . A A . 12 CYS HB2 1 1 14 9221 1 1 12 CYS HB3 H 4.484 -5.574 5.759 1.00 . A A . 12 CYS HB3 1 1 14 9222 1 1 12 CYS N N 4.019 -5.910 8.252 1.00 . A A . 12 CYS N 1 1 14 9223 1 1 12 CYS O O 0.623 -5.558 7.057 1.00 . A A . 12 CYS O 1 1 14 9224 1 1 12 CYS SG S 3.309 -7.663 5.826 1.00 . A A . 12 CYS SG 1 1 14 9225 1 1 13 SER C C -0.701 -6.333 9.465 1.00 . A A . 13 SER C 1 1 14 9226 1 1 13 SER CA C 0.226 -7.434 8.944 1.00 . A A . 13 SER CA 1 1 14 9227 1 1 13 SER CB C 0.531 -8.447 10.047 1.00 . A A . 13 SER CB 1 1 14 9228 1 1 13 SER H H 2.360 -7.150 9.030 1.00 . A A . 13 SER H 1 1 14 9229 1 1 13 SER HA H -0.219 -7.933 8.097 1.00 . A A . 13 SER HA 1 1 14 9230 1 1 13 SER HB2 H 1.133 -7.980 10.809 1.00 . A A . 13 SER HB2 1 1 14 9231 1 1 13 SER HB3 H -0.397 -8.793 10.483 1.00 . A A . 13 SER HB3 1 1 14 9232 1 1 13 SER HG H 1.587 -10.071 10.218 1.00 . A A . 13 SER HG 1 1 14 9233 1 1 13 SER N N 1.547 -6.852 8.572 1.00 . A A . 13 SER N 1 1 14 9234 1 1 13 SER O O -1.751 -6.078 8.910 1.00 . A A . 13 SER O 1 1 14 9235 1 1 13 SER OG O 1.247 -9.542 9.492 1.00 . A A . 13 SER OG 1 1 14 9236 1 1 14 GLN C C -1.229 -3.414 10.089 1.00 . A A . 14 GLN C 1 1 14 9237 1 1 14 GLN CA C -1.174 -4.583 11.076 1.00 . A A . 14 GLN CA 1 1 14 9238 1 1 14 GLN CB C -0.487 -4.154 12.374 1.00 . A A . 14 GLN CB 1 1 14 9239 1 1 14 GLN CD C -2.002 -4.428 14.343 1.00 . A A . 14 GLN CD 1 1 14 9240 1 1 14 GLN CG C -1.501 -3.450 13.279 1.00 . A A . 14 GLN CG 1 1 14 9241 1 1 14 GLN H H 0.537 -5.890 10.955 1.00 . A A . 14 GLN H 1 1 14 9242 1 1 14 GLN HA H -2.165 -4.950 11.286 1.00 . A A . 14 GLN HA 1 1 14 9243 1 1 14 GLN HB2 H -0.096 -5.026 12.879 1.00 . A A . 14 GLN HB2 1 1 14 9244 1 1 14 GLN HB3 H 0.322 -3.476 12.147 1.00 . A A . 14 GLN HB3 1 1 14 9245 1 1 14 GLN HE21 H -3.443 -3.217 14.976 1.00 . A A . 14 GLN HE21 1 1 14 9246 1 1 14 GLN HE22 H -3.342 -4.709 15.781 1.00 . A A . 14 GLN HE22 1 1 14 9247 1 1 14 GLN HG2 H -1.028 -2.605 13.758 1.00 . A A . 14 GLN HG2 1 1 14 9248 1 1 14 GLN HG3 H -2.336 -3.108 12.685 1.00 . A A . 14 GLN HG3 1 1 14 9249 1 1 14 GLN N N -0.317 -5.673 10.525 1.00 . A A . 14 GLN N 1 1 14 9250 1 1 14 GLN NE2 N -3.013 -4.090 15.096 1.00 . A A . 14 GLN NE2 1 1 14 9251 1 1 14 GLN O O -2.224 -2.726 9.977 1.00 . A A . 14 GLN O 1 1 14 9252 1 1 14 GLN OE1 O -1.469 -5.510 14.493 1.00 . A A . 14 GLN OE1 1 1 14 9253 1 1 15 CYS C C -1.393 -2.118 7.504 1.00 . A A . 15 CYS C 1 1 14 9254 1 1 15 CYS CA C -0.146 -2.066 8.391 1.00 . A A . 15 CYS CA 1 1 14 9255 1 1 15 CYS CB C 1.115 -2.294 7.555 1.00 . A A . 15 CYS CB 1 1 14 9256 1 1 15 CYS H H 0.628 -3.756 9.479 1.00 . A A . 15 CYS H 1 1 14 9257 1 1 15 CYS HA H -0.084 -1.119 8.902 1.00 . A A . 15 CYS HA 1 1 14 9258 1 1 15 CYS HB2 H 1.149 -3.323 7.228 1.00 . A A . 15 CYS HB2 1 1 14 9259 1 1 15 CYS HB3 H 1.096 -1.644 6.693 1.00 . A A . 15 CYS HB3 1 1 14 9260 1 1 15 CYS N N -0.163 -3.188 9.372 1.00 . A A . 15 CYS N 1 1 14 9261 1 1 15 CYS O O -2.085 -1.134 7.331 1.00 . A A . 15 CYS O 1 1 14 9262 1 1 15 CYS SG S 2.579 -1.928 8.554 1.00 . A A . 15 CYS SG 1 1 14 9263 1 1 16 LEU C C -4.048 -4.003 6.813 1.00 . A A . 16 LEU C 1 1 14 9264 1 1 16 LEU CA C -2.877 -3.370 6.055 1.00 . A A . 16 LEU CA 1 1 14 9265 1 1 16 LEU CB C -2.429 -4.271 4.904 1.00 . A A . 16 LEU CB 1 1 14 9266 1 1 16 LEU CD1 C -0.534 -2.671 4.610 1.00 . A A . 16 LEU CD1 1 1 14 9267 1 1 16 LEU CD2 C -1.016 -4.367 2.845 1.00 . A A . 16 LEU CD2 1 1 14 9268 1 1 16 LEU CG C -1.641 -3.440 3.889 1.00 . A A . 16 LEU CG 1 1 14 9269 1 1 16 LEU H H -1.108 -4.037 7.085 1.00 . A A . 16 LEU H 1 1 14 9270 1 1 16 LEU HA H -3.155 -2.400 5.674 1.00 . A A . 16 LEU HA 1 1 14 9271 1 1 16 LEU HB2 H -1.800 -5.061 5.289 1.00 . A A . 16 LEU HB2 1 1 14 9272 1 1 16 LEU HB3 H -3.295 -4.700 4.422 1.00 . A A . 16 LEU HB3 1 1 14 9273 1 1 16 LEU HD11 H -0.106 -3.296 5.381 1.00 . A A . 16 LEU HD11 1 1 14 9274 1 1 16 LEU HD12 H -0.947 -1.780 5.059 1.00 . A A . 16 LEU HD12 1 1 14 9275 1 1 16 LEU HD13 H 0.234 -2.396 3.902 1.00 . A A . 16 LEU HD13 1 1 14 9276 1 1 16 LEU HD21 H -1.795 -4.924 2.344 1.00 . A A . 16 LEU HD21 1 1 14 9277 1 1 16 LEU HD22 H -0.340 -5.053 3.333 1.00 . A A . 16 LEU HD22 1 1 14 9278 1 1 16 LEU HD23 H -0.472 -3.778 2.121 1.00 . A A . 16 LEU HD23 1 1 14 9279 1 1 16 LEU HG H -2.307 -2.742 3.403 1.00 . A A . 16 LEU HG 1 1 14 9280 1 1 16 LEU N N -1.681 -3.258 6.937 1.00 . A A . 16 LEU N 1 1 14 9281 1 1 16 LEU O O -5.124 -4.177 6.275 1.00 . A A . 16 LEU O 1 1 14 9282 1 1 17 SER C C -5.626 -3.922 9.744 1.00 . A A . 17 SER C 1 1 14 9283 1 1 17 SER CA C -4.966 -4.966 8.838 1.00 . A A . 17 SER CA 1 1 14 9284 1 1 17 SER CB C -4.309 -6.064 9.672 1.00 . A A . 17 SER CB 1 1 14 9285 1 1 17 SER H H -2.981 -4.201 8.479 1.00 . A A . 17 SER H 1 1 14 9286 1 1 17 SER HA H -5.695 -5.399 8.171 1.00 . A A . 17 SER HA 1 1 14 9287 1 1 17 SER HB2 H -3.407 -5.687 10.120 1.00 . A A . 17 SER HB2 1 1 14 9288 1 1 17 SER HB3 H -4.991 -6.378 10.452 1.00 . A A . 17 SER HB3 1 1 14 9289 1 1 17 SER HG H -3.542 -7.825 9.364 1.00 . A A . 17 SER HG 1 1 14 9290 1 1 17 SER N N -3.854 -4.347 8.058 1.00 . A A . 17 SER N 1 1 14 9291 1 1 17 SER O O -6.631 -4.182 10.375 1.00 . A A . 17 SER O 1 1 14 9292 1 1 17 SER OG O -3.992 -7.166 8.831 1.00 . A A . 17 SER OG 1 1 14 9293 1 1 18 ALA C C -5.528 -0.316 10.005 1.00 . A A . 18 ALA C 1 1 14 9294 1 1 18 ALA CA C -5.675 -1.685 10.672 1.00 . A A . 18 ALA CA 1 1 14 9295 1 1 18 ALA CB C -4.882 -1.733 11.977 1.00 . A A . 18 ALA CB 1 1 14 9296 1 1 18 ALA H H -4.263 -2.551 9.291 1.00 . A A . 18 ALA H 1 1 14 9297 1 1 18 ALA HA H -6.714 -1.900 10.863 1.00 . A A . 18 ALA HA 1 1 14 9298 1 1 18 ALA HB1 H -3.977 -1.154 11.871 1.00 . A A . 18 ALA HB1 1 1 14 9299 1 1 18 ALA HB2 H -4.630 -2.757 12.209 1.00 . A A . 18 ALA HB2 1 1 14 9300 1 1 18 ALA HB3 H -5.480 -1.320 12.777 1.00 . A A . 18 ALA HB3 1 1 14 9301 1 1 18 ALA N N -5.073 -2.743 9.809 1.00 . A A . 18 ALA N 1 1 14 9302 1 1 18 ALA O O -5.023 0.616 10.598 1.00 . A A . 18 ALA O 1 1 14 9303 1 1 19 PRO C C -6.935 2.069 8.477 1.00 . A A . 19 PRO C 1 1 14 9304 1 1 19 PRO CA C -5.907 1.014 8.010 1.00 . A A . 19 PRO CA 1 1 14 9305 1 1 19 PRO CB C -6.183 0.574 6.575 1.00 . A A . 19 PRO CB 1 1 14 9306 1 1 19 PRO CD C -6.596 -1.334 8.010 1.00 . A A . 19 PRO CD 1 1 14 9307 1 1 19 PRO CG C -6.959 -0.698 6.689 1.00 . A A . 19 PRO CG 1 1 14 9308 1 1 19 PRO HA H -4.911 1.422 8.070 1.00 . A A . 19 PRO HA 1 1 14 9309 1 1 19 PRO HB2 H -6.763 1.327 6.060 1.00 . A A . 19 PRO HB2 1 1 14 9310 1 1 19 PRO HB3 H -5.255 0.394 6.054 1.00 . A A . 19 PRO HB3 1 1 14 9311 1 1 19 PRO HD2 H -7.482 -1.702 8.508 1.00 . A A . 19 PRO HD2 1 1 14 9312 1 1 19 PRO HD3 H -5.885 -2.132 7.862 1.00 . A A . 19 PRO HD3 1 1 14 9313 1 1 19 PRO HG2 H -8.018 -0.486 6.656 1.00 . A A . 19 PRO HG2 1 1 14 9314 1 1 19 PRO HG3 H -6.693 -1.363 5.883 1.00 . A A . 19 PRO HG3 1 1 14 9315 1 1 19 PRO N N -5.981 -0.247 8.782 1.00 . A A . 19 PRO N 1 1 14 9316 1 1 19 PRO O O -6.685 3.248 8.325 1.00 . A A . 19 PRO O 1 1 14 9317 1 1 20 PRO C C -8.614 3.343 10.747 1.00 . A A . 20 PRO C 1 1 14 9318 1 1 20 PRO CA C -9.074 2.642 9.466 1.00 . A A . 20 PRO CA 1 1 14 9319 1 1 20 PRO CB C -10.324 1.805 9.716 1.00 . A A . 20 PRO CB 1 1 14 9320 1 1 20 PRO CD C -8.512 0.268 9.271 1.00 . A A . 20 PRO CD 1 1 14 9321 1 1 20 PRO CG C -9.821 0.428 10.001 1.00 . A A . 20 PRO CG 1 1 14 9322 1 1 20 PRO HA H -9.264 3.363 8.687 1.00 . A A . 20 PRO HA 1 1 14 9323 1 1 20 PRO HB2 H -10.870 2.193 10.565 1.00 . A A . 20 PRO HB2 1 1 14 9324 1 1 20 PRO HB3 H -10.951 1.794 8.838 1.00 . A A . 20 PRO HB3 1 1 14 9325 1 1 20 PRO HD2 H -7.810 -0.259 9.896 1.00 . A A . 20 PRO HD2 1 1 14 9326 1 1 20 PRO HD3 H -8.661 -0.253 8.341 1.00 . A A . 20 PRO HD3 1 1 14 9327 1 1 20 PRO HG2 H -9.667 0.307 11.065 1.00 . A A . 20 PRO HG2 1 1 14 9328 1 1 20 PRO HG3 H -10.528 -0.304 9.644 1.00 . A A . 20 PRO HG3 1 1 14 9329 1 1 20 PRO N N -8.064 1.649 9.019 1.00 . A A . 20 PRO N 1 1 14 9330 1 1 20 PRO O O -9.044 4.438 11.053 1.00 . A A . 20 PRO O 1 1 14 9331 1 1 21 PHE C C -5.842 3.928 12.538 1.00 . A A . 21 PHE C 1 1 14 9332 1 1 21 PHE CA C -7.253 3.374 12.750 1.00 . A A . 21 PHE CA 1 1 14 9333 1 1 21 PHE CB C -7.235 2.258 13.798 1.00 . A A . 21 PHE CB 1 1 14 9334 1 1 21 PHE CD1 C -9.739 2.147 13.532 1.00 . A A . 21 PHE CD1 1 1 14 9335 1 1 21 PHE CD2 C -8.508 0.084 13.863 1.00 . A A . 21 PHE CD2 1 1 14 9336 1 1 21 PHE CE1 C -10.936 1.422 13.467 1.00 . A A . 21 PHE CE1 1 1 14 9337 1 1 21 PHE CE2 C -9.704 -0.640 13.799 1.00 . A A . 21 PHE CE2 1 1 14 9338 1 1 21 PHE CG C -8.525 1.478 13.730 1.00 . A A . 21 PHE CG 1 1 14 9339 1 1 21 PHE CZ C -10.918 0.028 13.601 1.00 . A A . 21 PHE CZ 1 1 14 9340 1 1 21 PHE H H -7.399 1.849 11.231 1.00 . A A . 21 PHE H 1 1 14 9341 1 1 21 PHE HA H -7.925 4.159 13.057 1.00 . A A . 21 PHE HA 1 1 14 9342 1 1 21 PHE HB2 H -6.404 1.597 13.605 1.00 . A A . 21 PHE HB2 1 1 14 9343 1 1 21 PHE HB3 H -7.129 2.692 14.781 1.00 . A A . 21 PHE HB3 1 1 14 9344 1 1 21 PHE HD1 H -9.753 3.222 13.431 1.00 . A A . 21 PHE HD1 1 1 14 9345 1 1 21 PHE HD2 H -7.571 -0.433 14.016 1.00 . A A . 21 PHE HD2 1 1 14 9346 1 1 21 PHE HE1 H -11.871 1.938 13.316 1.00 . A A . 21 PHE HE1 1 1 14 9347 1 1 21 PHE HE2 H -9.691 -1.716 13.902 1.00 . A A . 21 PHE HE2 1 1 14 9348 1 1 21 PHE HZ H -11.841 -0.530 13.550 1.00 . A A . 21 PHE HZ 1 1 14 9349 1 1 21 PHE N N -7.740 2.730 11.496 1.00 . A A . 21 PHE N 1 1 14 9350 1 1 21 PHE O O -5.110 4.162 13.478 1.00 . A A . 21 PHE O 1 1 14 9351 1 1 22 VAL C C -4.059 5.471 9.739 1.00 . A A . 22 VAL C 1 1 14 9352 1 1 22 VAL CA C -4.085 4.668 11.042 1.00 . A A . 22 VAL CA 1 1 14 9353 1 1 22 VAL CB C -3.202 3.430 10.910 1.00 . A A . 22 VAL CB 1 1 14 9354 1 1 22 VAL CG1 C -3.405 2.517 12.121 1.00 . A A . 22 VAL CG1 1 1 14 9355 1 1 22 VAL CG2 C -3.580 2.675 9.634 1.00 . A A . 22 VAL CG2 1 1 14 9356 1 1 22 VAL H H -6.057 3.937 10.562 1.00 . A A . 22 VAL H 1 1 14 9357 1 1 22 VAL HA H -3.747 5.274 11.867 1.00 . A A . 22 VAL HA 1 1 14 9358 1 1 22 VAL HB H -2.167 3.734 10.858 1.00 . A A . 22 VAL HB 1 1 14 9359 1 1 22 VAL HG11 H -2.631 1.764 12.137 1.00 . A A . 22 VAL HG11 1 1 14 9360 1 1 22 VAL HG12 H -4.371 2.039 12.055 1.00 . A A . 22 VAL HG12 1 1 14 9361 1 1 22 VAL HG13 H -3.354 3.104 13.027 1.00 . A A . 22 VAL HG13 1 1 14 9362 1 1 22 VAL HG21 H -3.385 1.621 9.768 1.00 . A A . 22 VAL HG21 1 1 14 9363 1 1 22 VAL HG22 H -2.992 3.046 8.808 1.00 . A A . 22 VAL HG22 1 1 14 9364 1 1 22 VAL HG23 H -4.629 2.824 9.425 1.00 . A A . 22 VAL HG23 1 1 14 9365 1 1 22 VAL N N -5.453 4.136 11.308 1.00 . A A . 22 VAL N 1 1 14 9366 1 1 22 VAL O O -5.084 5.761 9.152 1.00 . A A . 22 VAL O 1 1 14 9367 1 1 23 GLN C C -1.456 6.289 7.308 1.00 . A A . 23 GLN C 1 1 14 9368 1 1 23 GLN CA C -2.778 6.613 8.019 1.00 . A A . 23 GLN CA 1 1 14 9369 1 1 23 GLN CB C -2.817 8.078 8.466 1.00 . A A . 23 GLN CB 1 1 14 9370 1 1 23 GLN CD C -2.808 10.395 7.524 1.00 . A A . 23 GLN CD 1 1 14 9371 1 1 23 GLN CG C -2.252 8.979 7.363 1.00 . A A . 23 GLN CG 1 1 14 9372 1 1 23 GLN H H -2.079 5.583 9.777 1.00 . A A . 23 GLN H 1 1 14 9373 1 1 23 GLN HA H -3.615 6.402 7.372 1.00 . A A . 23 GLN HA 1 1 14 9374 1 1 23 GLN HB2 H -3.839 8.362 8.672 1.00 . A A . 23 GLN HB2 1 1 14 9375 1 1 23 GLN HB3 H -2.225 8.196 9.361 1.00 . A A . 23 GLN HB3 1 1 14 9376 1 1 23 GLN HE21 H -4.677 9.861 7.116 1.00 . A A . 23 GLN HE21 1 1 14 9377 1 1 23 GLN HE22 H -4.450 11.509 7.454 1.00 . A A . 23 GLN HE22 1 1 14 9378 1 1 23 GLN HG2 H -1.173 9.004 7.437 1.00 . A A . 23 GLN HG2 1 1 14 9379 1 1 23 GLN HG3 H -2.537 8.590 6.397 1.00 . A A . 23 GLN HG3 1 1 14 9380 1 1 23 GLN N N -2.888 5.829 9.284 1.00 . A A . 23 GLN N 1 1 14 9381 1 1 23 GLN NE2 N -4.084 10.606 7.349 1.00 . A A . 23 GLN NE2 1 1 14 9382 1 1 23 GLN O O -1.055 6.967 6.382 1.00 . A A . 23 GLN O 1 1 14 9383 1 1 23 GLN OE1 O -2.074 11.319 7.809 1.00 . A A . 23 GLN OE1 1 1 14 9384 1 1 24 CYS C C 0.338 3.686 6.156 1.00 . A A . 24 CYS C 1 1 14 9385 1 1 24 CYS CA C 0.519 4.910 7.067 1.00 . A A . 24 CYS CA 1 1 14 9386 1 1 24 CYS CB C 1.507 4.670 8.232 1.00 . A A . 24 CYS CB 1 1 14 9387 1 1 24 CYS H H -1.104 4.716 8.473 1.00 . A A . 24 CYS H 1 1 14 9388 1 1 24 CYS HA H 0.859 5.749 6.478 1.00 . A A . 24 CYS HA 1 1 14 9389 1 1 24 CYS HB2 H 2.329 5.364 8.135 1.00 . A A . 24 CYS HB2 1 1 14 9390 1 1 24 CYS HB3 H 1.003 4.860 9.167 1.00 . A A . 24 CYS HB3 1 1 14 9391 1 1 24 CYS N N -0.772 5.258 7.729 1.00 . A A . 24 CYS N 1 1 14 9392 1 1 24 CYS O O -0.721 3.095 6.092 1.00 . A A . 24 CYS O 1 1 14 9393 1 1 24 CYS SG S 2.174 2.977 8.238 1.00 . A A . 24 CYS SG 1 1 14 9394 1 1 25 GLY C C 2.611 1.442 4.438 1.00 . A A . 25 GLY C 1 1 14 9395 1 1 25 GLY CA C 1.265 2.165 4.503 1.00 . A A . 25 GLY CA 1 1 14 9396 1 1 25 GLY H H 2.201 3.831 5.493 1.00 . A A . 25 GLY H 1 1 14 9397 1 1 25 GLY HA2 H 0.505 1.484 4.858 1.00 . A A . 25 GLY HA2 1 1 14 9398 1 1 25 GLY HA3 H 1.002 2.518 3.517 1.00 . A A . 25 GLY HA3 1 1 14 9399 1 1 25 GLY N N 1.364 3.325 5.436 1.00 . A A . 25 GLY N 1 1 14 9400 1 1 25 GLY O O 3.554 1.803 5.112 1.00 . A A . 25 GLY O 1 1 14 9401 1 1 26 TRP C C 4.867 0.318 2.447 1.00 . A A . 26 TRP C 1 1 14 9402 1 1 26 TRP CA C 3.993 -0.327 3.524 1.00 . A A . 26 TRP CA 1 1 14 9403 1 1 26 TRP CB C 3.575 -1.738 3.104 1.00 . A A . 26 TRP CB 1 1 14 9404 1 1 26 TRP CD1 C 5.332 -3.423 2.423 1.00 . A A . 26 TRP CD1 1 1 14 9405 1 1 26 TRP CD2 C 5.267 -3.089 4.644 1.00 . A A . 26 TRP CD2 1 1 14 9406 1 1 26 TRP CE2 C 6.278 -4.048 4.409 1.00 . A A . 26 TRP CE2 1 1 14 9407 1 1 26 TRP CE3 C 5.018 -2.696 5.968 1.00 . A A . 26 TRP CE3 1 1 14 9408 1 1 26 TRP CG C 4.682 -2.707 3.369 1.00 . A A . 26 TRP CG 1 1 14 9409 1 1 26 TRP CH2 C 6.759 -4.199 6.769 1.00 . A A . 26 TRP CH2 1 1 14 9410 1 1 26 TRP CZ2 C 7.019 -4.601 5.455 1.00 . A A . 26 TRP CZ2 1 1 14 9411 1 1 26 TRP CZ3 C 5.761 -3.248 7.025 1.00 . A A . 26 TRP CZ3 1 1 14 9412 1 1 26 TRP H H 1.934 0.144 3.092 1.00 . A A . 26 TRP H 1 1 14 9413 1 1 26 TRP HA H 4.503 -0.353 4.474 1.00 . A A . 26 TRP HA 1 1 14 9414 1 1 26 TRP HB2 H 2.700 -2.033 3.666 1.00 . A A . 26 TRP HB2 1 1 14 9415 1 1 26 TRP HB3 H 3.342 -1.741 2.053 1.00 . A A . 26 TRP HB3 1 1 14 9416 1 1 26 TRP HD1 H 5.143 -3.380 1.361 1.00 . A A . 26 TRP HD1 1 1 14 9417 1 1 26 TRP HE1 H 6.887 -4.837 2.579 1.00 . A A . 26 TRP HE1 1 1 14 9418 1 1 26 TRP HE3 H 4.252 -1.964 6.173 1.00 . A A . 26 TRP HE3 1 1 14 9419 1 1 26 TRP HH2 H 7.328 -4.621 7.584 1.00 . A A . 26 TRP HH2 1 1 14 9420 1 1 26 TRP HZ2 H 7.786 -5.333 5.252 1.00 . A A . 26 TRP HZ2 1 1 14 9421 1 1 26 TRP HZ3 H 5.563 -2.939 8.041 1.00 . A A . 26 TRP HZ3 1 1 14 9422 1 1 26 TRP N N 2.707 0.420 3.632 1.00 . A A . 26 TRP N 1 1 14 9423 1 1 26 TRP NE1 N 6.281 -4.221 3.040 1.00 . A A . 26 TRP NE1 1 1 14 9424 1 1 26 TRP O O 4.392 0.686 1.390 1.00 . A A . 26 TRP O 1 1 14 9425 1 1 27 CYS C C 8.310 0.322 1.495 1.00 . A A . 27 CYS C 1 1 14 9426 1 1 27 CYS CA C 7.016 1.120 1.687 1.00 . A A . 27 CYS CA 1 1 14 9427 1 1 27 CYS CB C 7.327 2.497 2.270 1.00 . A A . 27 CYS CB 1 1 14 9428 1 1 27 CYS H H 6.507 0.193 3.567 1.00 . A A . 27 CYS H 1 1 14 9429 1 1 27 CYS HA H 6.494 1.227 0.749 1.00 . A A . 27 CYS HA 1 1 14 9430 1 1 27 CYS HB2 H 6.550 2.774 2.965 1.00 . A A . 27 CYS HB2 1 1 14 9431 1 1 27 CYS HB3 H 8.275 2.463 2.787 1.00 . A A . 27 CYS HB3 1 1 14 9432 1 1 27 CYS N N 6.138 0.480 2.707 1.00 . A A . 27 CYS N 1 1 14 9433 1 1 27 CYS O O 9.260 0.467 2.238 1.00 . A A . 27 CYS O 1 1 14 9434 1 1 27 CYS SG S 7.409 3.722 0.943 1.00 . A A . 27 CYS SG 1 1 14 9435 1 1 28 HIS C C 10.142 -2.092 1.390 1.00 . A A . 28 HIS C 1 1 14 9436 1 1 28 HIS CA C 9.589 -1.301 0.181 1.00 . A A . 28 HIS CA 1 1 14 9437 1 1 28 HIS CB C 10.614 -0.265 -0.275 1.00 . A A . 28 HIS CB 1 1 14 9438 1 1 28 HIS CD2 C 11.703 -1.495 -2.326 1.00 . A A . 28 HIS CD2 1 1 14 9439 1 1 28 HIS CE1 C 11.032 -0.154 -3.891 1.00 . A A . 28 HIS CE1 1 1 14 9440 1 1 28 HIS CG C 10.968 -0.509 -1.716 1.00 . A A . 28 HIS CG 1 1 14 9441 1 1 28 HIS H H 7.580 -0.574 -0.112 1.00 . A A . 28 HIS H 1 1 14 9442 1 1 28 HIS HA H 9.392 -1.978 -0.634 1.00 . A A . 28 HIS HA 1 1 14 9443 1 1 28 HIS HB2 H 10.194 0.724 -0.169 1.00 . A A . 28 HIS HB2 1 1 14 9444 1 1 28 HIS HB3 H 11.503 -0.345 0.333 1.00 . A A . 28 HIS HB3 1 1 14 9445 1 1 28 HIS HD1 H 10.005 1.143 -2.628 1.00 . A A . 28 HIS HD1 1 1 14 9446 1 1 28 HIS HD2 H 12.178 -2.322 -1.819 1.00 . A A . 28 HIS HD2 1 1 14 9447 1 1 28 HIS HE1 H 10.864 0.300 -4.856 1.00 . A A . 28 HIS HE1 1 1 14 9448 1 1 28 HIS N N 8.357 -0.498 0.480 1.00 . A A . 28 HIS N 1 1 14 9449 1 1 28 HIS ND1 N 10.550 0.336 -2.733 1.00 . A A . 28 HIS ND1 1 1 14 9450 1 1 28 HIS NE2 N 11.741 -1.269 -3.699 1.00 . A A . 28 HIS NE2 1 1 14 9451 1 1 28 HIS O O 11.089 -2.838 1.239 1.00 . A A . 28 HIS O 1 1 14 9452 1 1 29 ASP C C 9.556 -2.257 5.051 1.00 . A A . 29 ASP C 1 1 14 9453 1 1 29 ASP CA C 10.156 -2.738 3.727 1.00 . A A . 29 ASP CA 1 1 14 9454 1 1 29 ASP CB C 11.670 -2.480 3.709 1.00 . A A . 29 ASP CB 1 1 14 9455 1 1 29 ASP CG C 11.960 -1.042 3.263 1.00 . A A . 29 ASP CG 1 1 14 9456 1 1 29 ASP H H 8.834 -1.376 2.714 1.00 . A A . 29 ASP H 1 1 14 9457 1 1 29 ASP HA H 9.966 -3.792 3.594 1.00 . A A . 29 ASP HA 1 1 14 9458 1 1 29 ASP HB2 H 12.070 -2.632 4.701 1.00 . A A . 29 ASP HB2 1 1 14 9459 1 1 29 ASP HB3 H 12.143 -3.168 3.024 1.00 . A A . 29 ASP HB3 1 1 14 9460 1 1 29 ASP N N 9.596 -1.963 2.576 1.00 . A A . 29 ASP N 1 1 14 9461 1 1 29 ASP O O 8.994 -3.026 5.803 1.00 . A A . 29 ASP O 1 1 14 9462 1 1 29 ASP OD1 O 11.262 -0.150 3.713 1.00 . A A . 29 ASP OD1 1 1 14 9463 1 1 29 ASP OD2 O 12.877 -0.860 2.479 1.00 . A A . 29 ASP OD2 1 1 14 9464 1 1 30 LYS C C 7.696 0.026 6.419 1.00 . A A . 30 LYS C 1 1 14 9465 1 1 30 LYS CA C 9.126 -0.476 6.628 1.00 . A A . 30 LYS CA 1 1 14 9466 1 1 30 LYS CB C 10.052 0.677 7.016 1.00 . A A . 30 LYS CB 1 1 14 9467 1 1 30 LYS CD C 10.602 2.338 8.798 1.00 . A A . 30 LYS CD 1 1 14 9468 1 1 30 LYS CE C 10.825 2.202 10.306 1.00 . A A . 30 LYS CE 1 1 14 9469 1 1 30 LYS CG C 9.583 1.295 8.335 1.00 . A A . 30 LYS CG 1 1 14 9470 1 1 30 LYS H H 10.147 -0.391 4.734 1.00 . A A . 30 LYS H 1 1 14 9471 1 1 30 LYS HA H 9.150 -1.240 7.389 1.00 . A A . 30 LYS HA 1 1 14 9472 1 1 30 LYS HB2 H 11.060 0.304 7.132 1.00 . A A . 30 LYS HB2 1 1 14 9473 1 1 30 LYS HB3 H 10.035 1.429 6.242 1.00 . A A . 30 LYS HB3 1 1 14 9474 1 1 30 LYS HD2 H 11.537 2.182 8.280 1.00 . A A . 30 LYS HD2 1 1 14 9475 1 1 30 LYS HD3 H 10.230 3.328 8.579 1.00 . A A . 30 LYS HD3 1 1 14 9476 1 1 30 LYS HE2 H 10.426 3.065 10.823 1.00 . A A . 30 LYS HE2 1 1 14 9477 1 1 30 LYS HE3 H 10.370 1.296 10.675 1.00 . A A . 30 LYS HE3 1 1 14 9478 1 1 30 LYS HG2 H 8.622 1.769 8.188 1.00 . A A . 30 LYS HG2 1 1 14 9479 1 1 30 LYS HG3 H 9.494 0.523 9.084 1.00 . A A . 30 LYS HG3 1 1 14 9480 1 1 30 LYS HZ1 H 12.534 1.933 11.464 1.00 . A A . 30 LYS HZ1 1 1 14 9481 1 1 30 LYS HZ2 H 12.726 3.044 10.193 1.00 . A A . 30 LYS HZ2 1 1 14 9482 1 1 30 LYS HZ3 H 12.686 1.376 9.870 1.00 . A A . 30 LYS HZ3 1 1 14 9483 1 1 30 LYS N N 9.681 -0.996 5.349 1.00 . A A . 30 LYS N 1 1 14 9484 1 1 30 LYS NZ N 12.304 2.135 10.471 1.00 . A A . 30 LYS NZ 1 1 14 9485 1 1 30 LYS O O 7.243 0.189 5.302 1.00 . A A . 30 LYS O 1 1 14 9486 1 1 31 CYS C C 5.542 2.285 7.442 1.00 . A A . 31 CYS C 1 1 14 9487 1 1 31 CYS CA C 5.581 0.759 7.334 1.00 . A A . 31 CYS CA 1 1 14 9488 1 1 31 CYS CB C 4.813 0.117 8.490 1.00 . A A . 31 CYS CB 1 1 14 9489 1 1 31 CYS H H 7.362 0.131 8.373 1.00 . A A . 31 CYS H 1 1 14 9490 1 1 31 CYS HA H 5.167 0.436 6.393 1.00 . A A . 31 CYS HA 1 1 14 9491 1 1 31 CYS HB2 H 5.222 -0.862 8.695 1.00 . A A . 31 CYS HB2 1 1 14 9492 1 1 31 CYS HB3 H 4.902 0.736 9.371 1.00 . A A . 31 CYS HB3 1 1 14 9493 1 1 31 CYS N N 6.980 0.270 7.481 1.00 . A A . 31 CYS N 1 1 14 9494 1 1 31 CYS O O 5.681 2.846 8.511 1.00 . A A . 31 CYS O 1 1 14 9495 1 1 31 CYS SG S 3.069 -0.039 8.036 1.00 . A A . 31 CYS SG 1 1 14 9496 1 1 32 VAL C C 4.351 4.975 5.306 1.00 . A A . 32 VAL C 1 1 14 9497 1 1 32 VAL CA C 5.309 4.452 6.381 1.00 . A A . 32 VAL CA 1 1 14 9498 1 1 32 VAL CB C 6.745 4.904 6.096 1.00 . A A . 32 VAL CB 1 1 14 9499 1 1 32 VAL CG1 C 7.725 4.043 6.897 1.00 . A A . 32 VAL CG1 1 1 14 9500 1 1 32 VAL CG2 C 7.042 4.758 4.602 1.00 . A A . 32 VAL CG2 1 1 14 9501 1 1 32 VAL H H 5.245 2.490 5.489 1.00 . A A . 32 VAL H 1 1 14 9502 1 1 32 VAL HA H 5.001 4.793 7.358 1.00 . A A . 32 VAL HA 1 1 14 9503 1 1 32 VAL HB H 6.859 5.939 6.388 1.00 . A A . 32 VAL HB 1 1 14 9504 1 1 32 VAL HG11 H 7.666 3.019 6.556 1.00 . A A . 32 VAL HG11 1 1 14 9505 1 1 32 VAL HG12 H 7.474 4.089 7.945 1.00 . A A . 32 VAL HG12 1 1 14 9506 1 1 32 VAL HG13 H 8.730 4.412 6.751 1.00 . A A . 32 VAL HG13 1 1 14 9507 1 1 32 VAL HG21 H 7.093 5.736 4.148 1.00 . A A . 32 VAL HG21 1 1 14 9508 1 1 32 VAL HG22 H 6.256 4.185 4.135 1.00 . A A . 32 VAL HG22 1 1 14 9509 1 1 32 VAL HG23 H 7.986 4.250 4.470 1.00 . A A . 32 VAL HG23 1 1 14 9510 1 1 32 VAL N N 5.355 2.962 6.342 1.00 . A A . 32 VAL N 1 1 14 9511 1 1 32 VAL O O 3.844 4.223 4.497 1.00 . A A . 32 VAL O 1 1 14 9512 1 1 33 ARG C C 3.951 7.674 3.258 1.00 . A A . 33 ARG C 1 1 14 9513 1 1 33 ARG CA C 3.175 6.816 4.259 1.00 . A A . 33 ARG CA 1 1 14 9514 1 1 33 ARG CB C 2.173 7.667 5.037 1.00 . A A . 33 ARG CB 1 1 14 9515 1 1 33 ARG CD C 0.348 9.236 4.372 1.00 . A A . 33 ARG CD 1 1 14 9516 1 1 33 ARG CG C 0.891 7.815 4.216 1.00 . A A . 33 ARG CG 1 1 14 9517 1 1 33 ARG CZ C -0.715 9.124 2.200 1.00 . A A . 33 ARG CZ 1 1 14 9518 1 1 33 ARG H H 4.519 6.849 5.946 1.00 . A A . 33 ARG H 1 1 14 9519 1 1 33 ARG HA H 2.660 6.020 3.747 1.00 . A A . 33 ARG HA 1 1 14 9520 1 1 33 ARG HB2 H 1.946 7.188 5.978 1.00 . A A . 33 ARG HB2 1 1 14 9521 1 1 33 ARG HB3 H 2.593 8.644 5.222 1.00 . A A . 33 ARG HB3 1 1 14 9522 1 1 33 ARG HD2 H -0.589 9.223 4.911 1.00 . A A . 33 ARG HD2 1 1 14 9523 1 1 33 ARG HD3 H 1.068 9.861 4.879 1.00 . A A . 33 ARG HD3 1 1 14 9524 1 1 33 ARG HE H 0.652 10.491 2.649 1.00 . A A . 33 ARG HE 1 1 14 9525 1 1 33 ARG HG2 H 1.108 7.622 3.175 1.00 . A A . 33 ARG HG2 1 1 14 9526 1 1 33 ARG HG3 H 0.154 7.108 4.567 1.00 . A A . 33 ARG HG3 1 1 14 9527 1 1 33 ARG HH11 H -2.279 10.184 2.857 1.00 . A A . 33 ARG HH11 1 1 14 9528 1 1 33 ARG HH12 H -2.631 9.007 1.637 1.00 . A A . 33 ARG HH12 1 1 14 9529 1 1 33 ARG HH21 H 0.651 7.924 1.362 1.00 . A A . 33 ARG HH21 1 1 14 9530 1 1 33 ARG HH22 H -0.972 7.727 0.789 1.00 . A A . 33 ARG HH22 1 1 14 9531 1 1 33 ARG N N 4.100 6.256 5.288 1.00 . A A . 33 ARG N 1 1 14 9532 1 1 33 ARG NE N 0.143 9.723 2.979 1.00 . A A . 33 ARG NE 1 1 14 9533 1 1 33 ARG NH1 N -1.973 9.465 2.234 1.00 . A A . 33 ARG NH1 1 1 14 9534 1 1 33 ARG NH2 N -0.314 8.185 1.387 1.00 . A A . 33 ARG NH2 1 1 14 9535 1 1 33 ARG O O 5.057 8.098 3.520 1.00 . A A . 33 ARG O 1 1 14 9536 1 1 34 SER C C 4.862 9.895 1.715 1.00 . A A . 34 SER C 1 1 14 9537 1 1 34 SER CA C 4.075 8.745 1.076 1.00 . A A . 34 SER CA 1 1 14 9538 1 1 34 SER CB C 2.955 9.295 0.194 1.00 . A A . 34 SER CB 1 1 14 9539 1 1 34 SER H H 2.488 7.560 1.926 1.00 . A A . 34 SER H 1 1 14 9540 1 1 34 SER HA H 4.732 8.125 0.485 1.00 . A A . 34 SER HA 1 1 14 9541 1 1 34 SER HB2 H 2.511 8.492 -0.371 1.00 . A A . 34 SER HB2 1 1 14 9542 1 1 34 SER HB3 H 2.199 9.753 0.818 1.00 . A A . 34 SER HB3 1 1 14 9543 1 1 34 SER HG H 4.298 9.893 -1.079 1.00 . A A . 34 SER HG 1 1 14 9544 1 1 34 SER N N 3.380 7.922 2.111 1.00 . A A . 34 SER N 1 1 14 9545 1 1 34 SER O O 5.877 10.322 1.202 1.00 . A A . 34 SER O 1 1 14 9546 1 1 34 SER OG O 3.493 10.256 -0.704 1.00 . A A . 34 SER OG 1 1 14 9547 1 1 35 GLU C C 6.417 11.034 4.149 1.00 . A A . 35 GLU C 1 1 14 9548 1 1 35 GLU CA C 5.133 11.536 3.479 1.00 . A A . 35 GLU CA 1 1 14 9549 1 1 35 GLU CB C 4.163 12.089 4.523 1.00 . A A . 35 GLU CB 1 1 14 9550 1 1 35 GLU CD C 3.567 14.352 3.638 1.00 . A A . 35 GLU CD 1 1 14 9551 1 1 35 GLU CG C 4.391 13.595 4.682 1.00 . A A . 35 GLU CG 1 1 14 9552 1 1 35 GLU H H 3.580 10.057 3.225 1.00 . A A . 35 GLU H 1 1 14 9553 1 1 35 GLU HA H 5.364 12.300 2.753 1.00 . A A . 35 GLU HA 1 1 14 9554 1 1 35 GLU HB2 H 3.147 11.910 4.201 1.00 . A A . 35 GLU HB2 1 1 14 9555 1 1 35 GLU HB3 H 4.334 11.600 5.470 1.00 . A A . 35 GLU HB3 1 1 14 9556 1 1 35 GLU HG2 H 4.088 13.902 5.673 1.00 . A A . 35 GLU HG2 1 1 14 9557 1 1 35 GLU HG3 H 5.438 13.817 4.540 1.00 . A A . 35 GLU HG3 1 1 14 9558 1 1 35 GLU N N 4.404 10.407 2.825 1.00 . A A . 35 GLU N 1 1 14 9559 1 1 35 GLU O O 7.376 11.766 4.296 1.00 . A A . 35 GLU O 1 1 14 9560 1 1 35 GLU OE1 O 3.993 14.400 2.495 1.00 . A A . 35 GLU OE1 1 1 14 9561 1 1 35 GLU OE2 O 2.524 14.872 3.999 1.00 . A A . 35 GLU OE2 1 1 14 9562 1 1 36 GLU C C 8.385 8.272 4.292 1.00 . A A . 36 GLU C 1 1 14 9563 1 1 36 GLU CA C 7.668 9.252 5.221 1.00 . A A . 36 GLU CA 1 1 14 9564 1 1 36 GLU CB C 7.150 8.526 6.459 1.00 . A A . 36 GLU CB 1 1 14 9565 1 1 36 GLU CD C 5.616 10.221 7.462 1.00 . A A . 36 GLU CD 1 1 14 9566 1 1 36 GLU CG C 6.975 9.530 7.595 1.00 . A A . 36 GLU CG 1 1 14 9567 1 1 36 GLU H H 5.661 9.221 4.432 1.00 . A A . 36 GLU H 1 1 14 9568 1 1 36 GLU HA H 8.329 10.053 5.512 1.00 . A A . 36 GLU HA 1 1 14 9569 1 1 36 GLU HB2 H 6.200 8.064 6.234 1.00 . A A . 36 GLU HB2 1 1 14 9570 1 1 36 GLU HB3 H 7.860 7.770 6.756 1.00 . A A . 36 GLU HB3 1 1 14 9571 1 1 36 GLU HG2 H 7.025 9.012 8.541 1.00 . A A . 36 GLU HG2 1 1 14 9572 1 1 36 GLU HG3 H 7.759 10.269 7.543 1.00 . A A . 36 GLU HG3 1 1 14 9573 1 1 36 GLU N N 6.445 9.796 4.558 1.00 . A A . 36 GLU N 1 1 14 9574 1 1 36 GLU O O 9.458 7.786 4.590 1.00 . A A . 36 GLU O 1 1 14 9575 1 1 36 GLU OE1 O 4.707 9.598 6.939 1.00 . A A . 36 GLU OE1 1 1 14 9576 1 1 36 GLU OE2 O 5.509 11.359 7.885 1.00 . A A . 36 GLU OE2 1 1 14 9577 1 1 37 CYS C C 9.657 7.663 1.566 1.00 . A A . 37 CYS C 1 1 14 9578 1 1 37 CYS CA C 8.431 7.021 2.219 1.00 . A A . 37 CYS CA 1 1 14 9579 1 1 37 CYS CB C 7.358 6.740 1.166 1.00 . A A . 37 CYS CB 1 1 14 9580 1 1 37 CYS H H 6.928 8.376 2.958 1.00 . A A . 37 CYS H 1 1 14 9581 1 1 37 CYS HA H 8.703 6.107 2.722 1.00 . A A . 37 CYS HA 1 1 14 9582 1 1 37 CYS HB2 H 6.712 7.600 1.075 1.00 . A A . 37 CYS HB2 1 1 14 9583 1 1 37 CYS HB3 H 7.829 6.542 0.216 1.00 . A A . 37 CYS HB3 1 1 14 9584 1 1 37 CYS N N 7.795 7.975 3.171 1.00 . A A . 37 CYS N 1 1 14 9585 1 1 37 CYS O O 9.542 8.411 0.616 1.00 . A A . 37 CYS O 1 1 14 9586 1 1 37 CYS SG S 6.380 5.302 1.667 1.00 . A A . 37 CYS SG 1 1 14 9587 1 1 38 LEU C C 12.314 7.334 0.088 1.00 . A A . 38 LEU C 1 1 14 9588 1 1 38 LEU CA C 12.048 7.978 1.454 1.00 . A A . 38 LEU CA 1 1 14 9589 1 1 38 LEU CB C 13.176 7.717 2.479 1.00 . A A . 38 LEU CB 1 1 14 9590 1 1 38 LEU CD1 C 13.223 5.310 1.738 1.00 . A A . 38 LEU CD1 1 1 14 9591 1 1 38 LEU CD2 C 14.935 6.923 0.867 1.00 . A A . 38 LEU CD2 1 1 14 9592 1 1 38 LEU CG C 14.075 6.535 2.076 1.00 . A A . 38 LEU CG 1 1 14 9593 1 1 38 LEU H H 10.907 6.770 2.827 1.00 . A A . 38 LEU H 1 1 14 9594 1 1 38 LEU HA H 11.909 9.042 1.335 1.00 . A A . 38 LEU HA 1 1 14 9595 1 1 38 LEU HB2 H 13.786 8.603 2.562 1.00 . A A . 38 LEU HB2 1 1 14 9596 1 1 38 LEU HB3 H 12.732 7.506 3.441 1.00 . A A . 38 LEU HB3 1 1 14 9597 1 1 38 LEU HD11 H 12.188 5.518 1.965 1.00 . A A . 38 LEU HD11 1 1 14 9598 1 1 38 LEU HD12 H 13.558 4.466 2.324 1.00 . A A . 38 LEU HD12 1 1 14 9599 1 1 38 LEU HD13 H 13.323 5.081 0.688 1.00 . A A . 38 LEU HD13 1 1 14 9600 1 1 38 LEU HD21 H 15.980 6.820 1.121 1.00 . A A . 38 LEU HD21 1 1 14 9601 1 1 38 LEU HD22 H 14.730 7.948 0.596 1.00 . A A . 38 LEU HD22 1 1 14 9602 1 1 38 LEU HD23 H 14.701 6.275 0.035 1.00 . A A . 38 LEU HD23 1 1 14 9603 1 1 38 LEU HG H 14.724 6.290 2.906 1.00 . A A . 38 LEU HG 1 1 14 9604 1 1 38 LEU N N 10.828 7.377 2.062 1.00 . A A . 38 LEU N 1 1 14 9605 1 1 38 LEU O O 13.093 7.829 -0.703 1.00 . A A . 38 LEU O 1 1 14 9606 1 1 39 SER C C 11.229 6.376 -2.629 1.00 . A A . 39 SER C 1 1 14 9607 1 1 39 SER CA C 11.872 5.558 -1.507 1.00 . A A . 39 SER CA 1 1 14 9608 1 1 39 SER CB C 11.179 4.202 -1.371 1.00 . A A . 39 SER CB 1 1 14 9609 1 1 39 SER H H 11.037 5.856 0.457 1.00 . A A . 39 SER H 1 1 14 9610 1 1 39 SER HA H 12.923 5.417 -1.696 1.00 . A A . 39 SER HA 1 1 14 9611 1 1 39 SER HB2 H 11.723 3.585 -0.674 1.00 . A A . 39 SER HB2 1 1 14 9612 1 1 39 SER HB3 H 10.169 4.348 -1.008 1.00 . A A . 39 SER HB3 1 1 14 9613 1 1 39 SER HG H 11.943 3.821 -3.118 1.00 . A A . 39 SER HG 1 1 14 9614 1 1 39 SER N N 11.664 6.235 -0.194 1.00 . A A . 39 SER N 1 1 14 9615 1 1 39 SER O O 11.820 6.595 -3.667 1.00 . A A . 39 SER O 1 1 14 9616 1 1 39 SER OG O 11.152 3.562 -2.640 1.00 . A A . 39 SER OG 1 1 14 9617 1 1 40 GLY C C 8.057 6.920 -3.923 1.00 . A A . 40 GLY C 1 1 14 9618 1 1 40 GLY CA C 9.341 7.630 -3.484 1.00 . A A . 40 GLY CA 1 1 14 9619 1 1 40 GLY H H 9.561 6.640 -1.584 1.00 . A A . 40 GLY H 1 1 14 9620 1 1 40 GLY HA2 H 9.098 8.608 -3.091 1.00 . A A . 40 GLY HA2 1 1 14 9621 1 1 40 GLY HA3 H 9.997 7.737 -4.334 1.00 . A A . 40 GLY HA3 1 1 14 9622 1 1 40 GLY N N 10.021 6.828 -2.428 1.00 . A A . 40 GLY N 1 1 14 9623 1 1 40 GLY O O 7.316 7.412 -4.749 1.00 . A A . 40 GLY O 1 1 14 9624 1 1 41 THR C C 5.859 4.467 -2.518 1.00 . A A . 41 THR C 1 1 14 9625 1 1 41 THR CA C 6.552 5.025 -3.764 1.00 . A A . 41 THR CA 1 1 14 9626 1 1 41 THR CB C 7.038 3.887 -4.662 1.00 . A A . 41 THR CB 1 1 14 9627 1 1 41 THR CG2 C 8.023 3.010 -3.887 1.00 . A A . 41 THR CG2 1 1 14 9628 1 1 41 THR H H 8.398 5.383 -2.711 1.00 . A A . 41 THR H 1 1 14 9629 1 1 41 THR HA H 5.884 5.668 -4.313 1.00 . A A . 41 THR HA 1 1 14 9630 1 1 41 THR HB H 7.532 4.296 -5.528 1.00 . A A . 41 THR HB 1 1 14 9631 1 1 41 THR HG1 H 5.490 3.561 -5.794 1.00 . A A . 41 THR HG1 1 1 14 9632 1 1 41 THR HG21 H 8.359 3.538 -3.006 1.00 . A A . 41 THR HG21 1 1 14 9633 1 1 41 THR HG22 H 8.871 2.781 -4.514 1.00 . A A . 41 THR HG22 1 1 14 9634 1 1 41 THR HG23 H 7.534 2.093 -3.592 1.00 . A A . 41 THR HG23 1 1 14 9635 1 1 41 THR N N 7.788 5.765 -3.376 1.00 . A A . 41 THR N 1 1 14 9636 1 1 41 THR O O 6.496 3.963 -1.618 1.00 . A A . 41 THR O 1 1 14 9637 1 1 41 THR OG1 O 5.926 3.103 -5.072 1.00 . A A . 41 THR OG1 1 1 14 9638 1 1 42 TRP C C 2.935 2.854 -1.671 1.00 . A A . 42 TRP C 1 1 14 9639 1 1 42 TRP CA C 3.825 4.035 -1.271 1.00 . A A . 42 TRP CA 1 1 14 9640 1 1 42 TRP CB C 2.970 5.211 -0.793 1.00 . A A . 42 TRP CB 1 1 14 9641 1 1 42 TRP CD1 C 2.858 4.651 1.665 1.00 . A A . 42 TRP CD1 1 1 14 9642 1 1 42 TRP CD2 C 0.837 4.613 0.679 1.00 . A A . 42 TRP CD2 1 1 14 9643 1 1 42 TRP CE2 C 0.630 4.289 2.040 1.00 . A A . 42 TRP CE2 1 1 14 9644 1 1 42 TRP CE3 C -0.283 4.657 -0.170 1.00 . A A . 42 TRP CE3 1 1 14 9645 1 1 42 TRP CG C 2.262 4.839 0.468 1.00 . A A . 42 TRP CG 1 1 14 9646 1 1 42 TRP CH2 C -1.746 4.070 1.686 1.00 . A A . 42 TRP CH2 1 1 14 9647 1 1 42 TRP CZ2 C -0.644 4.020 2.543 1.00 . A A . 42 TRP CZ2 1 1 14 9648 1 1 42 TRP CZ3 C -1.567 4.386 0.332 1.00 . A A . 42 TRP CZ3 1 1 14 9649 1 1 42 TRP H H 4.064 4.969 -3.198 1.00 . A A . 42 TRP H 1 1 14 9650 1 1 42 TRP HA H 4.517 3.744 -0.497 1.00 . A A . 42 TRP HA 1 1 14 9651 1 1 42 TRP HB2 H 3.605 6.064 -0.608 1.00 . A A . 42 TRP HB2 1 1 14 9652 1 1 42 TRP HB3 H 2.246 5.460 -1.554 1.00 . A A . 42 TRP HB3 1 1 14 9653 1 1 42 TRP HD1 H 3.916 4.741 1.862 1.00 . A A . 42 TRP HD1 1 1 14 9654 1 1 42 TRP HE1 H 2.063 4.142 3.544 1.00 . A A . 42 TRP HE1 1 1 14 9655 1 1 42 TRP HE3 H -0.155 4.899 -1.214 1.00 . A A . 42 TRP HE3 1 1 14 9656 1 1 42 TRP HH2 H -2.736 3.863 2.065 1.00 . A A . 42 TRP HH2 1 1 14 9657 1 1 42 TRP HZ2 H -0.776 3.777 3.587 1.00 . A A . 42 TRP HZ2 1 1 14 9658 1 1 42 TRP HZ3 H -2.419 4.424 -0.329 1.00 . A A . 42 TRP HZ3 1 1 14 9659 1 1 42 TRP N N 4.559 4.557 -2.461 1.00 . A A . 42 TRP N 1 1 14 9660 1 1 42 TRP NE1 N 1.892 4.326 2.599 1.00 . A A . 42 TRP NE1 1 1 14 9661 1 1 42 TRP O O 2.158 2.940 -2.600 1.00 . A A . 42 TRP O 1 1 14 9662 1 1 43 THR C C 1.418 0.096 -0.089 1.00 . A A . 43 THR C 1 1 14 9663 1 1 43 THR CA C 2.190 0.575 -1.323 1.00 . A A . 43 THR CA 1 1 14 9664 1 1 43 THR CB C 3.169 -0.500 -1.802 1.00 . A A . 43 THR CB 1 1 14 9665 1 1 43 THR CG2 C 4.292 -0.671 -0.780 1.00 . A A . 43 THR CG2 1 1 14 9666 1 1 43 THR H H 3.668 1.700 -0.225 1.00 . A A . 43 THR H 1 1 14 9667 1 1 43 THR HA H 1.506 0.828 -2.117 1.00 . A A . 43 THR HA 1 1 14 9668 1 1 43 THR HB H 3.592 -0.203 -2.750 1.00 . A A . 43 THR HB 1 1 14 9669 1 1 43 THR HG1 H 2.413 -2.147 -1.096 1.00 . A A . 43 THR HG1 1 1 14 9670 1 1 43 THR HG21 H 4.971 -1.441 -1.116 1.00 . A A . 43 THR HG21 1 1 14 9671 1 1 43 THR HG22 H 3.872 -0.955 0.175 1.00 . A A . 43 THR HG22 1 1 14 9672 1 1 43 THR HG23 H 4.829 0.260 -0.674 1.00 . A A . 43 THR HG23 1 1 14 9673 1 1 43 THR N N 3.038 1.752 -0.975 1.00 . A A . 43 THR N 1 1 14 9674 1 1 43 THR O O 1.944 0.040 1.007 1.00 . A A . 43 THR O 1 1 14 9675 1 1 43 THR OG1 O 2.477 -1.730 -1.958 1.00 . A A . 43 THR OG1 1 1 14 9676 1 1 44 GLN C C -1.192 -2.115 0.638 1.00 . A A . 44 GLN C 1 1 14 9677 1 1 44 GLN CA C -0.637 -0.715 0.906 1.00 . A A . 44 GLN CA 1 1 14 9678 1 1 44 GLN CB C -1.774 0.297 1.034 1.00 . A A . 44 GLN CB 1 1 14 9679 1 1 44 GLN CD C -2.937 -0.052 3.219 1.00 . A A . 44 GLN CD 1 1 14 9680 1 1 44 GLN CG C -1.875 0.770 2.486 1.00 . A A . 44 GLN CG 1 1 14 9681 1 1 44 GLN H H -0.240 -0.189 -1.145 1.00 . A A . 44 GLN H 1 1 14 9682 1 1 44 GLN HA H -0.039 -0.712 1.804 1.00 . A A . 44 GLN HA 1 1 14 9683 1 1 44 GLN HB2 H -1.577 1.143 0.391 1.00 . A A . 44 GLN HB2 1 1 14 9684 1 1 44 GLN HB3 H -2.705 -0.167 0.745 1.00 . A A . 44 GLN HB3 1 1 14 9685 1 1 44 GLN HE21 H -4.315 0.210 1.814 1.00 . A A . 44 GLN HE21 1 1 14 9686 1 1 44 GLN HE22 H -4.803 -0.727 3.144 1.00 . A A . 44 GLN HE22 1 1 14 9687 1 1 44 GLN HG2 H -0.918 0.641 2.973 1.00 . A A . 44 GLN HG2 1 1 14 9688 1 1 44 GLN HG3 H -2.151 1.814 2.507 1.00 . A A . 44 GLN HG3 1 1 14 9689 1 1 44 GLN N N 0.169 -0.245 -0.257 1.00 . A A . 44 GLN N 1 1 14 9690 1 1 44 GLN NE2 N -4.116 -0.202 2.680 1.00 . A A . 44 GLN NE2 1 1 14 9691 1 1 44 GLN O O -2.199 -2.509 1.190 1.00 . A A . 44 GLN O 1 1 14 9692 1 1 44 GLN OE1 O -2.691 -0.563 4.293 1.00 . A A . 44 GLN OE1 1 1 14 9693 1 1 45 GLN C C 0.140 -5.200 -0.717 1.00 . A A . 45 GLN C 1 1 14 9694 1 1 45 GLN CA C -1.038 -4.245 -0.501 1.00 . A A . 45 GLN CA 1 1 14 9695 1 1 45 GLN CB C -1.854 -4.100 -1.787 1.00 . A A . 45 GLN CB 1 1 14 9696 1 1 45 GLN CD C -3.044 -6.291 -1.945 1.00 . A A . 45 GLN CD 1 1 14 9697 1 1 45 GLN CG C -3.202 -4.805 -1.621 1.00 . A A . 45 GLN CG 1 1 14 9698 1 1 45 GLN H H 0.270 -2.538 -0.640 1.00 . A A . 45 GLN H 1 1 14 9699 1 1 45 GLN HA H -1.670 -4.599 0.298 1.00 . A A . 45 GLN HA 1 1 14 9700 1 1 45 GLN HB2 H -2.017 -3.052 -1.991 1.00 . A A . 45 GLN HB2 1 1 14 9701 1 1 45 GLN HB3 H -1.315 -4.548 -2.607 1.00 . A A . 45 GLN HB3 1 1 14 9702 1 1 45 GLN HE21 H -4.999 -6.634 -1.993 1.00 . A A . 45 GLN HE21 1 1 14 9703 1 1 45 GLN HE22 H -4.017 -7.985 -2.298 1.00 . A A . 45 GLN HE22 1 1 14 9704 1 1 45 GLN HG2 H -3.544 -4.691 -0.603 1.00 . A A . 45 GLN HG2 1 1 14 9705 1 1 45 GLN HG3 H -3.922 -4.366 -2.294 1.00 . A A . 45 GLN HG3 1 1 14 9706 1 1 45 GLN N N -0.543 -2.871 -0.205 1.00 . A A . 45 GLN N 1 1 14 9707 1 1 45 GLN NE2 N -4.109 -7.032 -2.091 1.00 . A A . 45 GLN NE2 1 1 14 9708 1 1 45 GLN O O 0.783 -5.186 -1.747 1.00 . A A . 45 GLN O 1 1 14 9709 1 1 45 GLN OE1 O -1.939 -6.784 -2.066 1.00 . A A . 45 GLN OE1 1 1 14 9710 1 1 46 ILE C C 1.273 -8.264 0.902 1.00 . A A . 46 ILE C 1 1 14 9711 1 1 46 ILE CA C 1.554 -6.991 0.097 1.00 . A A . 46 ILE CA 1 1 14 9712 1 1 46 ILE CB C 2.776 -6.258 0.654 1.00 . A A . 46 ILE CB 1 1 14 9713 1 1 46 ILE CD1 C 4.899 -6.616 -0.619 1.00 . A A . 46 ILE CD1 1 1 14 9714 1 1 46 ILE CG1 C 4.014 -7.147 0.510 1.00 . A A . 46 ILE CG1 1 1 14 9715 1 1 46 ILE CG2 C 2.552 -5.938 2.133 1.00 . A A . 46 ILE CG2 1 1 14 9716 1 1 46 ILE H H -0.112 -6.030 1.069 1.00 . A A . 46 ILE H 1 1 14 9717 1 1 46 ILE HA H 1.710 -7.231 -0.942 1.00 . A A . 46 ILE HA 1 1 14 9718 1 1 46 ILE HB H 2.924 -5.339 0.105 1.00 . A A . 46 ILE HB 1 1 14 9719 1 1 46 ILE HD11 H 5.675 -5.989 -0.205 1.00 . A A . 46 ILE HD11 1 1 14 9720 1 1 46 ILE HD12 H 4.297 -6.038 -1.306 1.00 . A A . 46 ILE HD12 1 1 14 9721 1 1 46 ILE HD13 H 5.349 -7.445 -1.145 1.00 . A A . 46 ILE HD13 1 1 14 9722 1 1 46 ILE HG12 H 4.570 -7.141 1.436 1.00 . A A . 46 ILE HG12 1 1 14 9723 1 1 46 ILE HG13 H 3.708 -8.157 0.281 1.00 . A A . 46 ILE HG13 1 1 14 9724 1 1 46 ILE HG21 H 2.575 -6.852 2.706 1.00 . A A . 46 ILE HG21 1 1 14 9725 1 1 46 ILE HG22 H 1.592 -5.459 2.257 1.00 . A A . 46 ILE HG22 1 1 14 9726 1 1 46 ILE HG23 H 3.332 -5.275 2.479 1.00 . A A . 46 ILE HG23 1 1 14 9727 1 1 46 ILE N N 0.423 -6.033 0.247 1.00 . A A . 46 ILE N 1 1 14 9728 1 1 46 ILE O O 1.493 -9.365 0.440 1.00 . A A . 46 ILE O 1 1 14 9729 1 1 47 CYS C C -0.869 -9.147 3.631 1.00 . A A . 47 CYS C 1 1 14 9730 1 1 47 CYS CA C 0.489 -9.312 2.943 1.00 . A A . 47 CYS CA 1 1 14 9731 1 1 47 CYS CB C 1.615 -9.362 3.977 1.00 . A A . 47 CYS CB 1 1 14 9732 1 1 47 CYS H H 0.617 -7.219 2.456 1.00 . A A . 47 CYS H 1 1 14 9733 1 1 47 CYS HA H 0.501 -10.209 2.341 1.00 . A A . 47 CYS HA 1 1 14 9734 1 1 47 CYS HB2 H 1.562 -10.292 4.525 1.00 . A A . 47 CYS HB2 1 1 14 9735 1 1 47 CYS HB3 H 2.569 -9.293 3.476 1.00 . A A . 47 CYS HB3 1 1 14 9736 1 1 47 CYS N N 0.787 -8.116 2.104 1.00 . A A . 47 CYS N 1 1 14 9737 1 1 47 CYS O O -1.179 -8.102 4.167 1.00 . A A . 47 CYS O 1 1 14 9738 1 1 47 CYS SG S 1.437 -7.975 5.129 1.00 . A A . 47 CYS SG 1 1 14 9739 1 1 48 LEU C C -2.860 -9.851 5.777 1.00 . A A . 48 LEU C 1 1 14 9740 1 1 48 LEU CA C -3.020 -10.065 4.270 1.00 . A A . 48 LEU CA 1 1 14 9741 1 1 48 LEU CB C -3.704 -11.404 3.989 1.00 . A A . 48 LEU CB 1 1 14 9742 1 1 48 LEU CD1 C -4.125 -11.536 1.531 1.00 . A A . 48 LEU CD1 1 1 14 9743 1 1 48 LEU CD2 C -5.922 -12.176 3.144 1.00 . A A . 48 LEU CD2 1 1 14 9744 1 1 48 LEU CG C -4.751 -11.224 2.890 1.00 . A A . 48 LEU CG 1 1 14 9745 1 1 48 LEU H H -1.414 -11.002 3.178 1.00 . A A . 48 LEU H 1 1 14 9746 1 1 48 LEU HA H -3.591 -9.261 3.834 1.00 . A A . 48 LEU HA 1 1 14 9747 1 1 48 LEU HB2 H -2.965 -12.124 3.669 1.00 . A A . 48 LEU HB2 1 1 14 9748 1 1 48 LEU HB3 H -4.186 -11.758 4.889 1.00 . A A . 48 LEU HB3 1 1 14 9749 1 1 48 LEU HD11 H -3.219 -10.960 1.410 1.00 . A A . 48 LEU HD11 1 1 14 9750 1 1 48 LEU HD12 H -4.821 -11.280 0.746 1.00 . A A . 48 LEU HD12 1 1 14 9751 1 1 48 LEU HD13 H -3.891 -12.590 1.476 1.00 . A A . 48 LEU HD13 1 1 14 9752 1 1 48 LEU HD21 H -6.814 -11.783 2.676 1.00 . A A . 48 LEU HD21 1 1 14 9753 1 1 48 LEU HD22 H -6.087 -12.270 4.207 1.00 . A A . 48 LEU HD22 1 1 14 9754 1 1 48 LEU HD23 H -5.694 -13.146 2.728 1.00 . A A . 48 LEU HD23 1 1 14 9755 1 1 48 LEU HG H -5.107 -10.203 2.895 1.00 . A A . 48 LEU HG 1 1 14 9756 1 1 48 LEU N N -1.682 -10.168 3.618 1.00 . A A . 48 LEU N 1 1 14 9757 1 1 48 LEU O O -1.783 -9.449 6.187 1.00 . A A . 48 LEU O 1 1 14 9758 1 1 48 LEU OXT O -3.816 -10.093 6.496 1.00 . A A . 48 LEU OXT 1 1 15 9759 1 1 1 GLY C C -5.224 -1.034 22.956 1.00 . A A . 1 GLY C 1 1 15 9760 1 1 1 GLY CA C -6.619 -0.723 23.499 1.00 . A A . 1 GLY CA 1 1 15 9761 1 1 1 GLY H1 H -8.254 -1.972 23.820 1.00 . A A . 1 GLY H1 1 1 15 9762 1 1 1 GLY H2 H -7.091 -2.021 25.057 1.00 . A A . 1 GLY H2 1 1 15 9763 1 1 1 GLY H3 H -6.793 -2.797 23.576 1.00 . A A . 1 GLY H3 1 1 15 9764 1 1 1 GLY HA2 H -7.237 -0.327 22.706 1.00 . A A . 1 GLY HA2 1 1 15 9765 1 1 1 GLY HA3 H -6.540 0.003 24.292 1.00 . A A . 1 GLY HA3 1 1 15 9766 1 1 1 GLY N N -7.236 -1.973 24.028 1.00 . A A . 1 GLY N 1 1 15 9767 1 1 1 GLY O O -4.353 -1.482 23.674 1.00 . A A . 1 GLY O 1 1 15 9768 1 1 2 SER C C -3.497 -0.321 19.785 1.00 . A A . 2 SER C 1 1 15 9769 1 1 2 SER CA C -3.664 -1.081 21.104 1.00 . A A . 2 SER CA 1 1 15 9770 1 1 2 SER CB C -3.648 -2.589 20.862 1.00 . A A . 2 SER CB 1 1 15 9771 1 1 2 SER H H -5.720 -0.437 21.129 1.00 . A A . 2 SER H 1 1 15 9772 1 1 2 SER HA H -2.884 -0.810 21.797 1.00 . A A . 2 SER HA 1 1 15 9773 1 1 2 SER HB2 H -4.225 -2.822 19.984 1.00 . A A . 2 SER HB2 1 1 15 9774 1 1 2 SER HB3 H -2.627 -2.919 20.718 1.00 . A A . 2 SER HB3 1 1 15 9775 1 1 2 SER HG H -4.224 -4.193 21.802 1.00 . A A . 2 SER HG 1 1 15 9776 1 1 2 SER N N -5.005 -0.799 21.692 1.00 . A A . 2 SER N 1 1 15 9777 1 1 2 SER O O -4.155 0.671 19.543 1.00 . A A . 2 SER O 1 1 15 9778 1 1 2 SER OG O -4.219 -3.250 21.984 1.00 . A A . 2 SER OG 1 1 15 9779 1 1 3 ALA C C -2.329 1.434 17.860 1.00 . A A . 3 ALA C 1 1 15 9780 1 1 3 ALA CA C -2.417 -0.076 17.633 1.00 . A A . 3 ALA CA 1 1 15 9781 1 1 3 ALA CB C -3.649 -0.422 16.798 1.00 . A A . 3 ALA CB 1 1 15 9782 1 1 3 ALA H H -2.099 -1.578 19.147 1.00 . A A . 3 ALA H 1 1 15 9783 1 1 3 ALA HA H -1.525 -0.438 17.145 1.00 . A A . 3 ALA HA 1 1 15 9784 1 1 3 ALA HB1 H -3.669 -1.484 16.608 1.00 . A A . 3 ALA HB1 1 1 15 9785 1 1 3 ALA HB2 H -3.608 0.111 15.859 1.00 . A A . 3 ALA HB2 1 1 15 9786 1 1 3 ALA HB3 H -4.541 -0.135 17.336 1.00 . A A . 3 ALA HB3 1 1 15 9787 1 1 3 ALA N N -2.622 -0.777 18.933 1.00 . A A . 3 ALA N 1 1 15 9788 1 1 3 ALA O O -3.316 2.139 17.794 1.00 . A A . 3 ALA O 1 1 15 9789 1 1 4 MET C C -0.718 4.121 17.044 1.00 . A A . 4 MET C 1 1 15 9790 1 1 4 MET CA C -1.009 3.402 18.364 1.00 . A A . 4 MET CA 1 1 15 9791 1 1 4 MET CB C 0.174 3.533 19.324 1.00 . A A . 4 MET CB 1 1 15 9792 1 1 4 MET CE C 0.437 3.297 23.328 1.00 . A A . 4 MET CE 1 1 15 9793 1 1 4 MET CG C -0.247 3.058 20.716 1.00 . A A . 4 MET CG 1 1 15 9794 1 1 4 MET H H -0.372 1.351 18.182 1.00 . A A . 4 MET H 1 1 15 9795 1 1 4 MET HA H -1.900 3.801 18.821 1.00 . A A . 4 MET HA 1 1 15 9796 1 1 4 MET HB2 H 0.994 2.926 18.968 1.00 . A A . 4 MET HB2 1 1 15 9797 1 1 4 MET HB3 H 0.484 4.565 19.376 1.00 . A A . 4 MET HB3 1 1 15 9798 1 1 4 MET HE1 H 0.193 3.811 24.248 1.00 . A A . 4 MET HE1 1 1 15 9799 1 1 4 MET HE2 H 1.485 3.050 23.323 1.00 . A A . 4 MET HE2 1 1 15 9800 1 1 4 MET HE3 H -0.145 2.389 23.252 1.00 . A A . 4 MET HE3 1 1 15 9801 1 1 4 MET HG2 H -1.299 2.814 20.711 1.00 . A A . 4 MET HG2 1 1 15 9802 1 1 4 MET HG3 H 0.325 2.181 20.985 1.00 . A A . 4 MET HG3 1 1 15 9803 1 1 4 MET N N -1.156 1.937 18.132 1.00 . A A . 4 MET N 1 1 15 9804 1 1 4 MET O O -0.258 5.246 17.027 1.00 . A A . 4 MET O 1 1 15 9805 1 1 4 MET SD S 0.062 4.372 21.922 1.00 . A A . 4 MET SD 1 1 15 9806 1 1 5 GLY C C 0.048 3.171 13.721 1.00 . A A . 5 GLY C 1 1 15 9807 1 1 5 GLY CA C -0.726 4.131 14.623 1.00 . A A . 5 GLY CA 1 1 15 9808 1 1 5 GLY H H -1.357 2.577 15.974 1.00 . A A . 5 GLY H 1 1 15 9809 1 1 5 GLY HA2 H -1.667 4.385 14.157 1.00 . A A . 5 GLY HA2 1 1 15 9810 1 1 5 GLY HA3 H -0.144 5.028 14.772 1.00 . A A . 5 GLY HA3 1 1 15 9811 1 1 5 GLY N N -0.985 3.482 15.939 1.00 . A A . 5 GLY N 1 1 15 9812 1 1 5 GLY O O 1.015 2.560 14.131 1.00 . A A . 5 GLY O 1 1 15 9813 1 1 6 CYS C C 1.861 2.325 11.688 1.00 . A A . 6 CYS C 1 1 15 9814 1 1 6 CYS CA C 0.350 2.116 11.561 1.00 . A A . 6 CYS CA 1 1 15 9815 1 1 6 CYS CB C -0.152 2.506 10.167 1.00 . A A . 6 CYS CB 1 1 15 9816 1 1 6 CYS H H -1.146 3.537 12.181 1.00 . A A . 6 CYS H 1 1 15 9817 1 1 6 CYS HA H 0.093 1.089 11.772 1.00 . A A . 6 CYS HA 1 1 15 9818 1 1 6 CYS HB2 H -1.172 2.174 10.051 1.00 . A A . 6 CYS HB2 1 1 15 9819 1 1 6 CYS HB3 H -0.110 3.577 10.057 1.00 . A A . 6 CYS HB3 1 1 15 9820 1 1 6 CYS N N -0.367 3.033 12.492 1.00 . A A . 6 CYS N 1 1 15 9821 1 1 6 CYS O O 2.647 1.437 11.424 1.00 . A A . 6 CYS O 1 1 15 9822 1 1 6 CYS SG S 0.872 1.725 8.895 1.00 . A A . 6 CYS SG 1 1 15 9823 1 1 7 ARG C C 4.292 2.969 13.443 1.00 . A A . 7 ARG C 1 1 15 9824 1 1 7 ARG CA C 3.729 3.766 12.261 1.00 . A A . 7 ARG CA 1 1 15 9825 1 1 7 ARG CB C 3.825 5.266 12.541 1.00 . A A . 7 ARG CB 1 1 15 9826 1 1 7 ARG CD C 4.507 7.077 10.962 1.00 . A A . 7 ARG CD 1 1 15 9827 1 1 7 ARG CG C 3.420 6.052 11.293 1.00 . A A . 7 ARG CG 1 1 15 9828 1 1 7 ARG CZ C 2.832 8.806 10.694 1.00 . A A . 7 ARG CZ 1 1 15 9829 1 1 7 ARG H H 1.618 4.193 12.318 1.00 . A A . 7 ARG H 1 1 15 9830 1 1 7 ARG HA H 4.260 3.525 11.353 1.00 . A A . 7 ARG HA 1 1 15 9831 1 1 7 ARG HB2 H 3.164 5.521 13.357 1.00 . A A . 7 ARG HB2 1 1 15 9832 1 1 7 ARG HB3 H 4.839 5.518 12.809 1.00 . A A . 7 ARG HB3 1 1 15 9833 1 1 7 ARG HD2 H 5.390 6.893 11.559 1.00 . A A . 7 ARG HD2 1 1 15 9834 1 1 7 ARG HD3 H 4.749 7.043 9.910 1.00 . A A . 7 ARG HD3 1 1 15 9835 1 1 7 ARG HE H 4.328 8.960 11.991 1.00 . A A . 7 ARG HE 1 1 15 9836 1 1 7 ARG HG2 H 3.298 5.371 10.462 1.00 . A A . 7 ARG HG2 1 1 15 9837 1 1 7 ARG HG3 H 2.488 6.565 11.477 1.00 . A A . 7 ARG HG3 1 1 15 9838 1 1 7 ARG HH11 H 3.801 9.346 9.027 1.00 . A A . 7 ARG HH11 1 1 15 9839 1 1 7 ARG HH12 H 2.088 9.602 9.015 1.00 . A A . 7 ARG HH12 1 1 15 9840 1 1 7 ARG HH21 H 1.615 8.362 12.218 1.00 . A A . 7 ARG HH21 1 1 15 9841 1 1 7 ARG HH22 H 0.849 9.044 10.823 1.00 . A A . 7 ARG HH22 1 1 15 9842 1 1 7 ARG N N 2.271 3.495 12.103 1.00 . A A . 7 ARG N 1 1 15 9843 1 1 7 ARG NE N 3.910 8.397 11.305 1.00 . A A . 7 ARG NE 1 1 15 9844 1 1 7 ARG NH1 N 2.914 9.289 9.484 1.00 . A A . 7 ARG NH1 1 1 15 9845 1 1 7 ARG NH2 N 1.676 8.731 11.291 1.00 . A A . 7 ARG NH2 1 1 15 9846 1 1 7 ARG O O 5.487 2.812 13.586 1.00 . A A . 7 ARG O 1 1 15 9847 1 1 8 HIS C C 3.708 0.188 15.223 1.00 . A A . 8 HIS C 1 1 15 9848 1 1 8 HIS CA C 3.916 1.690 15.470 1.00 . A A . 8 HIS CA 1 1 15 9849 1 1 8 HIS CB C 3.061 2.201 16.647 1.00 . A A . 8 HIS CB 1 1 15 9850 1 1 8 HIS CD2 C 1.578 0.191 17.477 1.00 . A A . 8 HIS CD2 1 1 15 9851 1 1 8 HIS CE1 C 2.721 -0.345 19.237 1.00 . A A . 8 HIS CE1 1 1 15 9852 1 1 8 HIS CG C 2.638 1.061 17.542 1.00 . A A . 8 HIS CG 1 1 15 9853 1 1 8 HIS H H 2.476 2.614 14.161 1.00 . A A . 8 HIS H 1 1 15 9854 1 1 8 HIS HA H 4.957 1.897 15.656 1.00 . A A . 8 HIS HA 1 1 15 9855 1 1 8 HIS HB2 H 3.638 2.908 17.224 1.00 . A A . 8 HIS HB2 1 1 15 9856 1 1 8 HIS HB3 H 2.182 2.693 16.258 1.00 . A A . 8 HIS HB3 1 1 15 9857 1 1 8 HIS HD1 H 4.170 1.131 19.003 1.00 . A A . 8 HIS HD1 1 1 15 9858 1 1 8 HIS HD2 H 0.817 0.194 16.710 1.00 . A A . 8 HIS HD2 1 1 15 9859 1 1 8 HIS HE1 H 3.055 -0.842 20.136 1.00 . A A . 8 HIS HE1 1 1 15 9860 1 1 8 HIS N N 3.436 2.472 14.294 1.00 . A A . 8 HIS N 1 1 15 9861 1 1 8 HIS ND1 N 3.354 0.701 18.673 1.00 . A A . 8 HIS ND1 1 1 15 9862 1 1 8 HIS NE2 N 1.633 -0.696 18.547 1.00 . A A . 8 HIS NE2 1 1 15 9863 1 1 8 HIS O O 4.139 -0.643 15.996 1.00 . A A . 8 HIS O 1 1 15 9864 1 1 9 PHE C C 4.147 -2.322 13.633 1.00 . A A . 9 PHE C 1 1 15 9865 1 1 9 PHE CA C 2.813 -1.607 13.867 1.00 . A A . 9 PHE CA 1 1 15 9866 1 1 9 PHE CB C 1.955 -1.621 12.600 1.00 . A A . 9 PHE CB 1 1 15 9867 1 1 9 PHE CD1 C 0.257 -0.592 14.176 1.00 . A A . 9 PHE CD1 1 1 15 9868 1 1 9 PHE CD2 C -0.444 -1.205 11.937 1.00 . A A . 9 PHE CD2 1 1 15 9869 1 1 9 PHE CE1 C -1.037 -0.136 14.457 1.00 . A A . 9 PHE CE1 1 1 15 9870 1 1 9 PHE CE2 C -1.738 -0.749 12.218 1.00 . A A . 9 PHE CE2 1 1 15 9871 1 1 9 PHE CG C 0.556 -1.128 12.914 1.00 . A A . 9 PHE CG 1 1 15 9872 1 1 9 PHE CZ C -2.034 -0.215 13.478 1.00 . A A . 9 PHE CZ 1 1 15 9873 1 1 9 PHE H H 2.705 0.522 13.541 1.00 . A A . 9 PHE H 1 1 15 9874 1 1 9 PHE HA H 2.276 -2.069 14.681 1.00 . A A . 9 PHE HA 1 1 15 9875 1 1 9 PHE HB2 H 2.403 -0.978 11.857 1.00 . A A . 9 PHE HB2 1 1 15 9876 1 1 9 PHE HB3 H 1.901 -2.629 12.215 1.00 . A A . 9 PHE HB3 1 1 15 9877 1 1 9 PHE HD1 H 1.025 -0.532 14.932 1.00 . A A . 9 PHE HD1 1 1 15 9878 1 1 9 PHE HD2 H -0.218 -1.617 10.965 1.00 . A A . 9 PHE HD2 1 1 15 9879 1 1 9 PHE HE1 H -1.266 0.276 15.428 1.00 . A A . 9 PHE HE1 1 1 15 9880 1 1 9 PHE HE2 H -2.509 -0.809 11.464 1.00 . A A . 9 PHE HE2 1 1 15 9881 1 1 9 PHE HZ H -3.032 0.138 13.694 1.00 . A A . 9 PHE HZ 1 1 15 9882 1 1 9 PHE N N 3.048 -0.163 14.154 1.00 . A A . 9 PHE N 1 1 15 9883 1 1 9 PHE O O 5.025 -1.815 12.963 1.00 . A A . 9 PHE O 1 1 15 9884 1 1 10 GLN C C 5.708 -4.747 12.560 1.00 . A A . 10 GLN C 1 1 15 9885 1 1 10 GLN CA C 5.588 -4.239 14.000 1.00 . A A . 10 GLN CA 1 1 15 9886 1 1 10 GLN CB C 5.504 -5.413 14.975 1.00 . A A . 10 GLN CB 1 1 15 9887 1 1 10 GLN CD C 6.974 -4.344 16.692 1.00 . A A . 10 GLN CD 1 1 15 9888 1 1 10 GLN CG C 5.574 -4.894 16.413 1.00 . A A . 10 GLN CG 1 1 15 9889 1 1 10 GLN H H 3.590 -3.884 14.725 1.00 . A A . 10 GLN H 1 1 15 9890 1 1 10 GLN HA H 6.428 -3.612 14.250 1.00 . A A . 10 GLN HA 1 1 15 9891 1 1 10 GLN HB2 H 4.571 -5.937 14.825 1.00 . A A . 10 GLN HB2 1 1 15 9892 1 1 10 GLN HB3 H 6.328 -6.088 14.797 1.00 . A A . 10 GLN HB3 1 1 15 9893 1 1 10 GLN HE21 H 6.355 -2.466 16.870 1.00 . A A . 10 GLN HE21 1 1 15 9894 1 1 10 GLN HE22 H 8.024 -2.703 17.078 1.00 . A A . 10 GLN HE22 1 1 15 9895 1 1 10 GLN HG2 H 4.844 -4.109 16.549 1.00 . A A . 10 GLN HG2 1 1 15 9896 1 1 10 GLN HG3 H 5.364 -5.702 17.098 1.00 . A A . 10 GLN HG3 1 1 15 9897 1 1 10 GLN N N 4.308 -3.494 14.186 1.00 . A A . 10 GLN N 1 1 15 9898 1 1 10 GLN NE2 N 7.131 -3.065 16.897 1.00 . A A . 10 GLN NE2 1 1 15 9899 1 1 10 GLN O O 6.276 -4.096 11.706 1.00 . A A . 10 GLN O 1 1 15 9900 1 1 10 GLN OE1 O 7.935 -5.087 16.725 1.00 . A A . 10 GLN OE1 1 1 15 9901 1 1 11 SER C C 4.328 -5.692 9.974 1.00 . A A . 11 SER C 1 1 15 9902 1 1 11 SER CA C 5.264 -6.463 10.906 1.00 . A A . 11 SER CA 1 1 15 9903 1 1 11 SER CB C 4.813 -7.916 11.037 1.00 . A A . 11 SER CB 1 1 15 9904 1 1 11 SER H H 4.728 -6.417 12.991 1.00 . A A . 11 SER H 1 1 15 9905 1 1 11 SER HA H 6.278 -6.421 10.542 1.00 . A A . 11 SER HA 1 1 15 9906 1 1 11 SER HB2 H 4.896 -8.230 12.064 1.00 . A A . 11 SER HB2 1 1 15 9907 1 1 11 SER HB3 H 3.782 -8.002 10.720 1.00 . A A . 11 SER HB3 1 1 15 9908 1 1 11 SER HG H 6.214 -9.246 10.809 1.00 . A A . 11 SER HG 1 1 15 9909 1 1 11 SER N N 5.180 -5.909 12.287 1.00 . A A . 11 SER N 1 1 15 9910 1 1 11 SER O O 3.887 -4.603 10.285 1.00 . A A . 11 SER O 1 1 15 9911 1 1 11 SER OG O 5.641 -8.740 10.228 1.00 . A A . 11 SER OG 1 1 15 9912 1 1 12 CYS C C 1.676 -6.060 8.049 1.00 . A A . 12 CYS C 1 1 15 9913 1 1 12 CYS CA C 3.107 -5.538 7.893 1.00 . A A . 12 CYS CA 1 1 15 9914 1 1 12 CYS CB C 3.660 -5.839 6.495 1.00 . A A . 12 CYS CB 1 1 15 9915 1 1 12 CYS H H 4.380 -7.125 8.600 1.00 . A A . 12 CYS H 1 1 15 9916 1 1 12 CYS HA H 3.137 -4.475 8.076 1.00 . A A . 12 CYS HA 1 1 15 9917 1 1 12 CYS HB2 H 3.235 -5.143 5.787 1.00 . A A . 12 CYS HB2 1 1 15 9918 1 1 12 CYS HB3 H 4.734 -5.727 6.505 1.00 . A A . 12 CYS HB3 1 1 15 9919 1 1 12 CYS N N 4.017 -6.246 8.834 1.00 . A A . 12 CYS N 1 1 15 9920 1 1 12 CYS O O 0.753 -5.564 7.433 1.00 . A A . 12 CYS O 1 1 15 9921 1 1 12 CYS SG S 3.236 -7.529 6.001 1.00 . A A . 12 CYS SG 1 1 15 9922 1 1 13 SER C C -0.828 -6.471 9.526 1.00 . A A . 13 SER C 1 1 15 9923 1 1 13 SER CA C 0.109 -7.594 9.075 1.00 . A A . 13 SER CA 1 1 15 9924 1 1 13 SER CB C 0.248 -8.653 10.168 1.00 . A A . 13 SER CB 1 1 15 9925 1 1 13 SER H H 2.238 -7.436 9.369 1.00 . A A . 13 SER H 1 1 15 9926 1 1 13 SER HA H -0.254 -8.045 8.165 1.00 . A A . 13 SER HA 1 1 15 9927 1 1 13 SER HB2 H 0.825 -9.483 9.797 1.00 . A A . 13 SER HB2 1 1 15 9928 1 1 13 SER HB3 H 0.751 -8.222 11.024 1.00 . A A . 13 SER HB3 1 1 15 9929 1 1 13 SER HG H -1.078 -10.060 10.391 1.00 . A A . 13 SER HG 1 1 15 9930 1 1 13 SER N N 1.482 -7.053 8.876 1.00 . A A . 13 SER N 1 1 15 9931 1 1 13 SER O O -1.798 -6.157 8.865 1.00 . A A . 13 SER O 1 1 15 9932 1 1 13 SER OG O -1.044 -9.112 10.543 1.00 . A A . 13 SER OG 1 1 15 9933 1 1 14 GLN C C -1.323 -3.563 10.161 1.00 . A A . 14 GLN C 1 1 15 9934 1 1 14 GLN CA C -1.408 -4.746 11.127 1.00 . A A . 14 GLN CA 1 1 15 9935 1 1 14 GLN CB C -0.840 -4.361 12.494 1.00 . A A . 14 GLN CB 1 1 15 9936 1 1 14 GLN CD C -2.489 -4.399 14.371 1.00 . A A . 14 GLN CD 1 1 15 9937 1 1 14 GLN CG C -1.877 -3.540 13.263 1.00 . A A . 14 GLN CG 1 1 15 9938 1 1 14 GLN H H 0.254 -6.119 11.156 1.00 . A A . 14 GLN H 1 1 15 9939 1 1 14 GLN HA H -2.427 -5.080 11.231 1.00 . A A . 14 GLN HA 1 1 15 9940 1 1 14 GLN HB2 H -0.602 -5.256 13.050 1.00 . A A . 14 GLN HB2 1 1 15 9941 1 1 14 GLN HB3 H 0.055 -3.772 12.359 1.00 . A A . 14 GLN HB3 1 1 15 9942 1 1 14 GLN HE21 H -2.838 -5.946 13.176 1.00 . A A . 14 GLN HE21 1 1 15 9943 1 1 14 GLN HE22 H -3.305 -6.159 14.793 1.00 . A A . 14 GLN HE22 1 1 15 9944 1 1 14 GLN HG2 H -1.399 -2.675 13.700 1.00 . A A . 14 GLN HG2 1 1 15 9945 1 1 14 GLN HG3 H -2.655 -3.219 12.587 1.00 . A A . 14 GLN HG3 1 1 15 9946 1 1 14 GLN N N -0.539 -5.856 10.641 1.00 . A A . 14 GLN N 1 1 15 9947 1 1 14 GLN NE2 N -2.913 -5.601 14.090 1.00 . A A . 14 GLN NE2 1 1 15 9948 1 1 14 GLN O O -2.278 -2.841 9.957 1.00 . A A . 14 GLN O 1 1 15 9949 1 1 14 GLN OE1 O -2.585 -3.970 15.504 1.00 . A A . 14 GLN OE1 1 1 15 9950 1 1 15 CYS C C -1.140 -2.237 7.569 1.00 . A A . 15 CYS C 1 1 15 9951 1 1 15 CYS CA C -0.015 -2.231 8.609 1.00 . A A . 15 CYS CA 1 1 15 9952 1 1 15 CYS CB C 1.336 -2.480 7.940 1.00 . A A . 15 CYS CB 1 1 15 9953 1 1 15 CYS H H 0.575 -3.961 9.747 1.00 . A A . 15 CYS H 1 1 15 9954 1 1 15 CYS HA H 0.005 -1.291 9.138 1.00 . A A . 15 CYS HA 1 1 15 9955 1 1 15 CYS HB2 H 1.464 -3.539 7.771 1.00 . A A . 15 CYS HB2 1 1 15 9956 1 1 15 CYS HB3 H 1.371 -1.959 6.995 1.00 . A A . 15 CYS HB3 1 1 15 9957 1 1 15 CYS N N -0.178 -3.364 9.565 1.00 . A A . 15 CYS N 1 1 15 9958 1 1 15 CYS O O -1.641 -1.202 7.180 1.00 . A A . 15 CYS O 1 1 15 9959 1 1 15 CYS SG S 2.664 -1.876 9.011 1.00 . A A . 15 CYS SG 1 1 15 9960 1 1 16 LEU C C -3.901 -4.047 6.708 1.00 . A A . 16 LEU C 1 1 15 9961 1 1 16 LEU CA C -2.627 -3.456 6.095 1.00 . A A . 16 LEU CA 1 1 15 9962 1 1 16 LEU CB C -2.085 -4.366 4.993 1.00 . A A . 16 LEU CB 1 1 15 9963 1 1 16 LEU CD1 C 0.067 -3.091 4.946 1.00 . A A . 16 LEU CD1 1 1 15 9964 1 1 16 LEU CD2 C -0.604 -4.475 2.982 1.00 . A A . 16 LEU CD2 1 1 15 9965 1 1 16 LEU CG C -1.117 -3.576 4.108 1.00 . A A . 16 LEU CG 1 1 15 9966 1 1 16 LEU H H -1.119 -4.219 7.436 1.00 . A A . 16 LEU H 1 1 15 9967 1 1 16 LEU HA H -2.823 -2.474 5.697 1.00 . A A . 16 LEU HA 1 1 15 9968 1 1 16 LEU HB2 H -1.568 -5.204 5.438 1.00 . A A . 16 LEU HB2 1 1 15 9969 1 1 16 LEU HB3 H -2.906 -4.727 4.390 1.00 . A A . 16 LEU HB3 1 1 15 9970 1 1 16 LEU HD11 H -0.118 -2.082 5.280 1.00 . A A . 16 LEU HD11 1 1 15 9971 1 1 16 LEU HD12 H 0.965 -3.114 4.345 1.00 . A A . 16 LEU HD12 1 1 15 9972 1 1 16 LEU HD13 H 0.192 -3.738 5.802 1.00 . A A . 16 LEU HD13 1 1 15 9973 1 1 16 LEU HD21 H -1.405 -5.111 2.636 1.00 . A A . 16 LEU HD21 1 1 15 9974 1 1 16 LEU HD22 H 0.208 -5.085 3.349 1.00 . A A . 16 LEU HD22 1 1 15 9975 1 1 16 LEU HD23 H -0.253 -3.862 2.164 1.00 . A A . 16 LEU HD23 1 1 15 9976 1 1 16 LEU HG H -1.630 -2.725 3.686 1.00 . A A . 16 LEU HG 1 1 15 9977 1 1 16 LEU N N -1.538 -3.394 7.114 1.00 . A A . 16 LEU N 1 1 15 9978 1 1 16 LEU O O -4.932 -4.112 6.070 1.00 . A A . 16 LEU O 1 1 15 9979 1 1 17 SER C C -5.851 -3.963 9.296 1.00 . A A . 17 SER C 1 1 15 9980 1 1 17 SER CA C -5.053 -5.061 8.583 1.00 . A A . 17 SER CA 1 1 15 9981 1 1 17 SER CB C -4.519 -6.080 9.589 1.00 . A A . 17 SER CB 1 1 15 9982 1 1 17 SER H H -2.999 -4.416 8.439 1.00 . A A . 17 SER H 1 1 15 9983 1 1 17 SER HA H -5.668 -5.555 7.848 1.00 . A A . 17 SER HA 1 1 15 9984 1 1 17 SER HB2 H -3.552 -5.768 9.941 1.00 . A A . 17 SER HB2 1 1 15 9985 1 1 17 SER HB3 H -5.200 -6.149 10.428 1.00 . A A . 17 SER HB3 1 1 15 9986 1 1 17 SER HG H -5.242 -7.555 8.545 1.00 . A A . 17 SER HG 1 1 15 9987 1 1 17 SER N N -3.840 -4.477 7.939 1.00 . A A . 17 SER N 1 1 15 9988 1 1 17 SER O O -6.986 -4.161 9.682 1.00 . A A . 17 SER O 1 1 15 9989 1 1 17 SER OG O -4.399 -7.347 8.955 1.00 . A A . 17 SER OG 1 1 15 9990 1 1 18 ALA C C -5.623 -0.352 9.526 1.00 . A A . 18 ALA C 1 1 15 9991 1 1 18 ALA CA C -5.997 -1.698 10.155 1.00 . A A . 18 ALA CA 1 1 15 9992 1 1 18 ALA CB C -5.537 -1.758 11.612 1.00 . A A . 18 ALA CB 1 1 15 9993 1 1 18 ALA H H -4.353 -2.668 9.151 1.00 . A A . 18 ALA H 1 1 15 9994 1 1 18 ALA HA H -7.062 -1.857 10.098 1.00 . A A . 18 ALA HA 1 1 15 9995 1 1 18 ALA HB1 H -5.909 -2.663 12.070 1.00 . A A . 18 ALA HB1 1 1 15 9996 1 1 18 ALA HB2 H -5.921 -0.901 12.145 1.00 . A A . 18 ALA HB2 1 1 15 9997 1 1 18 ALA HB3 H -4.458 -1.752 11.650 1.00 . A A . 18 ALA HB3 1 1 15 9998 1 1 18 ALA N N -5.269 -2.808 9.471 1.00 . A A . 18 ALA N 1 1 15 9999 1 1 18 ALA O O -5.094 0.519 10.188 1.00 . A A . 18 ALA O 1 1 15 10000 1 1 19 PRO C C -6.575 2.175 7.835 1.00 . A A . 19 PRO C 1 1 15 10001 1 1 19 PRO CA C -5.606 1.012 7.513 1.00 . A A . 19 PRO CA 1 1 15 10002 1 1 19 PRO CB C -5.728 0.592 6.051 1.00 . A A . 19 PRO CB 1 1 15 10003 1 1 19 PRO CD C -6.537 -1.252 7.404 1.00 . A A . 19 PRO CD 1 1 15 10004 1 1 19 PRO CG C -6.641 -0.594 6.048 1.00 . A A . 19 PRO CG 1 1 15 10005 1 1 19 PRO HA H -4.591 1.316 7.709 1.00 . A A . 19 PRO HA 1 1 15 10006 1 1 19 PRO HB2 H -6.154 1.396 5.466 1.00 . A A . 19 PRO HB2 1 1 15 10007 1 1 19 PRO HB3 H -4.763 0.313 5.659 1.00 . A A . 19 PRO HB3 1 1 15 10008 1 1 19 PRO HD2 H -7.520 -1.510 7.774 1.00 . A A . 19 PRO HD2 1 1 15 10009 1 1 19 PRO HD3 H -5.910 -2.127 7.350 1.00 . A A . 19 PRO HD3 1 1 15 10010 1 1 19 PRO HG2 H -7.657 -0.275 5.865 1.00 . A A . 19 PRO HG2 1 1 15 10011 1 1 19 PRO HG3 H -6.333 -1.291 5.285 1.00 . A A . 19 PRO HG3 1 1 15 10012 1 1 19 PRO N N -5.912 -0.234 8.258 1.00 . A A . 19 PRO N 1 1 15 10013 1 1 19 PRO O O -6.185 3.320 7.718 1.00 . A A . 19 PRO O 1 1 15 10014 1 1 20 PRO C C -8.434 3.662 9.829 1.00 . A A . 20 PRO C 1 1 15 10015 1 1 20 PRO CA C -8.767 2.978 8.502 1.00 . A A . 20 PRO CA 1 1 15 10016 1 1 20 PRO CB C -10.116 2.271 8.576 1.00 . A A . 20 PRO CB 1 1 15 10017 1 1 20 PRO CD C -8.421 0.558 8.394 1.00 . A A . 20 PRO CD 1 1 15 10018 1 1 20 PRO CG C -9.797 0.856 8.932 1.00 . A A . 20 PRO CG 1 1 15 10019 1 1 20 PRO HA H -8.775 3.697 7.698 1.00 . A A . 20 PRO HA 1 1 15 10020 1 1 20 PRO HB2 H -10.733 2.723 9.341 1.00 . A A . 20 PRO HB2 1 1 15 10021 1 1 20 PRO HB3 H -10.613 2.307 7.619 1.00 . A A . 20 PRO HB3 1 1 15 10022 1 1 20 PRO HD2 H -7.867 -0.027 9.111 1.00 . A A . 20 PRO HD2 1 1 15 10023 1 1 20 PRO HD3 H -8.490 0.042 7.452 1.00 . A A . 20 PRO HD3 1 1 15 10024 1 1 20 PRO HG2 H -9.808 0.736 10.007 1.00 . A A . 20 PRO HG2 1 1 15 10025 1 1 20 PRO HG3 H -10.515 0.191 8.479 1.00 . A A . 20 PRO HG3 1 1 15 10026 1 1 20 PRO N N -7.806 1.881 8.208 1.00 . A A . 20 PRO N 1 1 15 10027 1 1 20 PRO O O -8.756 4.816 10.039 1.00 . A A . 20 PRO O 1 1 15 10028 1 1 21 PHE C C -5.996 4.063 12.028 1.00 . A A . 21 PHE C 1 1 15 10029 1 1 21 PHE CA C -7.450 3.593 12.039 1.00 . A A . 21 PHE CA 1 1 15 10030 1 1 21 PHE CB C -7.644 2.487 13.084 1.00 . A A . 21 PHE CB 1 1 15 10031 1 1 21 PHE CD1 C -10.133 2.319 12.720 1.00 . A A . 21 PHE CD1 1 1 15 10032 1 1 21 PHE CD2 C -8.786 0.314 12.511 1.00 . A A . 21 PHE CD2 1 1 15 10033 1 1 21 PHE CE1 C -11.283 1.577 12.423 1.00 . A A . 21 PHE CE1 1 1 15 10034 1 1 21 PHE CE2 C -9.935 -0.428 12.215 1.00 . A A . 21 PHE CE2 1 1 15 10035 1 1 21 PHE CG C -8.885 1.688 12.763 1.00 . A A . 21 PHE CG 1 1 15 10036 1 1 21 PHE CZ C -11.184 0.204 12.171 1.00 . A A . 21 PHE CZ 1 1 15 10037 1 1 21 PHE H H -7.543 2.039 10.546 1.00 . A A . 21 PHE H 1 1 15 10038 1 1 21 PHE HA H -8.112 4.418 12.251 1.00 . A A . 21 PHE HA 1 1 15 10039 1 1 21 PHE HB2 H -6.784 1.835 13.078 1.00 . A A . 21 PHE HB2 1 1 15 10040 1 1 21 PHE HB3 H -7.748 2.934 14.061 1.00 . A A . 21 PHE HB3 1 1 15 10041 1 1 21 PHE HD1 H -10.209 3.379 12.913 1.00 . A A . 21 PHE HD1 1 1 15 10042 1 1 21 PHE HD2 H -7.821 -0.173 12.546 1.00 . A A . 21 PHE HD2 1 1 15 10043 1 1 21 PHE HE1 H -12.246 2.064 12.390 1.00 . A A . 21 PHE HE1 1 1 15 10044 1 1 21 PHE HE2 H -9.859 -1.488 12.020 1.00 . A A . 21 PHE HE2 1 1 15 10045 1 1 21 PHE HZ H -12.071 -0.369 11.942 1.00 . A A . 21 PHE HZ 1 1 15 10046 1 1 21 PHE N N -7.796 2.968 10.729 1.00 . A A . 21 PHE N 1 1 15 10047 1 1 21 PHE O O -5.389 4.256 13.063 1.00 . A A . 21 PHE O 1 1 15 10048 1 1 22 VAL C C -3.772 5.605 9.605 1.00 . A A . 22 VAL C 1 1 15 10049 1 1 22 VAL CA C -4.006 4.685 10.805 1.00 . A A . 22 VAL CA 1 1 15 10050 1 1 22 VAL CB C -3.202 3.399 10.643 1.00 . A A . 22 VAL CB 1 1 15 10051 1 1 22 VAL CG1 C -3.496 2.459 11.813 1.00 . A A . 22 VAL CG1 1 1 15 10052 1 1 22 VAL CG2 C -3.597 2.718 9.331 1.00 . A A . 22 VAL CG2 1 1 15 10053 1 1 22 VAL H H -5.927 4.073 10.043 1.00 . A A . 22 VAL H 1 1 15 10054 1 1 22 VAL HA H -3.724 5.180 11.720 1.00 . A A . 22 VAL HA 1 1 15 10055 1 1 22 VAL HB H -2.149 3.636 10.626 1.00 . A A . 22 VAL HB 1 1 15 10056 1 1 22 VAL HG11 H -3.474 3.016 12.738 1.00 . A A . 22 VAL HG11 1 1 15 10057 1 1 22 VAL HG12 H -2.751 1.678 11.844 1.00 . A A . 22 VAL HG12 1 1 15 10058 1 1 22 VAL HG13 H -4.474 2.017 11.682 1.00 . A A . 22 VAL HG13 1 1 15 10059 1 1 22 VAL HG21 H -3.481 1.648 9.429 1.00 . A A . 22 VAL HG21 1 1 15 10060 1 1 22 VAL HG22 H -2.962 3.076 8.534 1.00 . A A . 22 VAL HG22 1 1 15 10061 1 1 22 VAL HG23 H -4.627 2.948 9.102 1.00 . A A . 22 VAL HG23 1 1 15 10062 1 1 22 VAL N N -5.425 4.239 10.868 1.00 . A A . 22 VAL N 1 1 15 10063 1 1 22 VAL O O -4.674 5.907 8.850 1.00 . A A . 22 VAL O 1 1 15 10064 1 1 23 GLN C C -0.886 6.547 7.676 1.00 . A A . 23 GLN C 1 1 15 10065 1 1 23 GLN CA C -2.238 6.941 8.281 1.00 . A A . 23 GLN CA 1 1 15 10066 1 1 23 GLN CB C -2.168 8.344 8.883 1.00 . A A . 23 GLN CB 1 1 15 10067 1 1 23 GLN CD C -2.853 10.434 7.698 1.00 . A A . 23 GLN CD 1 1 15 10068 1 1 23 GLN CG C -1.778 9.350 7.797 1.00 . A A . 23 GLN CG 1 1 15 10069 1 1 23 GLN H H -1.847 5.781 10.051 1.00 . A A . 23 GLN H 1 1 15 10070 1 1 23 GLN HA H -3.016 6.893 7.536 1.00 . A A . 23 GLN HA 1 1 15 10071 1 1 23 GLN HB2 H -3.134 8.609 9.289 1.00 . A A . 23 GLN HB2 1 1 15 10072 1 1 23 GLN HB3 H -1.429 8.364 9.669 1.00 . A A . 23 GLN HB3 1 1 15 10073 1 1 23 GLN HE21 H -1.633 11.772 6.883 1.00 . A A . 23 GLN HE21 1 1 15 10074 1 1 23 GLN HE22 H -3.227 12.299 7.130 1.00 . A A . 23 GLN HE22 1 1 15 10075 1 1 23 GLN HG2 H -0.830 9.803 8.048 1.00 . A A . 23 GLN HG2 1 1 15 10076 1 1 23 GLN HG3 H -1.694 8.841 6.848 1.00 . A A . 23 GLN HG3 1 1 15 10077 1 1 23 GLN N N -2.556 6.045 9.429 1.00 . A A . 23 GLN N 1 1 15 10078 1 1 23 GLN NE2 N -2.546 11.598 7.195 1.00 . A A . 23 GLN NE2 1 1 15 10079 1 1 23 GLN O O -0.252 7.320 6.986 1.00 . A A . 23 GLN O 1 1 15 10080 1 1 23 GLN OE1 O -3.985 10.219 8.085 1.00 . A A . 23 GLN OE1 1 1 15 10081 1 1 24 CYS C C 0.662 3.646 6.516 1.00 . A A . 24 CYS C 1 1 15 10082 1 1 24 CYS CA C 0.867 4.898 7.384 1.00 . A A . 24 CYS CA 1 1 15 10083 1 1 24 CYS CB C 1.739 4.640 8.635 1.00 . A A . 24 CYS CB 1 1 15 10084 1 1 24 CYS H H -0.969 4.741 8.497 1.00 . A A . 24 CYS H 1 1 15 10085 1 1 24 CYS HA H 1.307 5.687 6.790 1.00 . A A . 24 CYS HA 1 1 15 10086 1 1 24 CYS HB2 H 2.545 5.358 8.652 1.00 . A A . 24 CYS HB2 1 1 15 10087 1 1 24 CYS HB3 H 1.135 4.779 9.519 1.00 . A A . 24 CYS HB3 1 1 15 10088 1 1 24 CYS N N -0.441 5.347 7.935 1.00 . A A . 24 CYS N 1 1 15 10089 1 1 24 CYS O O -0.333 2.957 6.623 1.00 . A A . 24 CYS O 1 1 15 10090 1 1 24 CYS SG S 2.451 2.966 8.652 1.00 . A A . 24 CYS SG 1 1 15 10091 1 1 25 GLY C C 2.817 1.472 4.646 1.00 . A A . 25 GLY C 1 1 15 10092 1 1 25 GLY CA C 1.463 2.171 4.760 1.00 . A A . 25 GLY CA 1 1 15 10093 1 1 25 GLY H H 2.385 3.938 5.577 1.00 . A A . 25 GLY H 1 1 15 10094 1 1 25 GLY HA2 H 0.735 1.488 5.178 1.00 . A A . 25 GLY HA2 1 1 15 10095 1 1 25 GLY HA3 H 1.140 2.488 3.780 1.00 . A A . 25 GLY HA3 1 1 15 10096 1 1 25 GLY N N 1.595 3.360 5.650 1.00 . A A . 25 GLY N 1 1 15 10097 1 1 25 GLY O O 3.784 1.881 5.249 1.00 . A A . 25 GLY O 1 1 15 10098 1 1 26 TRP C C 4.992 0.315 2.581 1.00 . A A . 26 TRP C 1 1 15 10099 1 1 26 TRP CA C 4.197 -0.299 3.737 1.00 . A A . 26 TRP CA 1 1 15 10100 1 1 26 TRP CB C 3.800 -1.744 3.420 1.00 . A A . 26 TRP CB 1 1 15 10101 1 1 26 TRP CD1 C 5.708 -3.318 2.890 1.00 . A A . 26 TRP CD1 1 1 15 10102 1 1 26 TRP CD2 C 5.336 -3.129 5.101 1.00 . A A . 26 TRP CD2 1 1 15 10103 1 1 26 TRP CE2 C 6.409 -4.038 4.946 1.00 . A A . 26 TRP CE2 1 1 15 10104 1 1 26 TRP CE3 C 4.904 -2.832 6.403 1.00 . A A . 26 TRP CE3 1 1 15 10105 1 1 26 TRP CG C 4.908 -2.685 3.780 1.00 . A A . 26 TRP CG 1 1 15 10106 1 1 26 TRP CH2 C 6.581 -4.330 7.336 1.00 . A A . 26 TRP CH2 1 1 15 10107 1 1 26 TRP CZ2 C 7.026 -4.634 6.047 1.00 . A A . 26 TRP CZ2 1 1 15 10108 1 1 26 TRP CZ3 C 5.523 -3.429 7.515 1.00 . A A . 26 TRP CZ3 1 1 15 10109 1 1 26 TRP H H 2.103 0.102 3.396 1.00 . A A . 26 TRP H 1 1 15 10110 1 1 26 TRP HA H 4.759 -0.258 4.656 1.00 . A A . 26 TRP HA 1 1 15 10111 1 1 26 TRP HB2 H 2.918 -2.002 3.988 1.00 . A A . 26 TRP HB2 1 1 15 10112 1 1 26 TRP HB3 H 3.584 -1.832 2.370 1.00 . A A . 26 TRP HB3 1 1 15 10113 1 1 26 TRP HD1 H 5.661 -3.213 1.816 1.00 . A A . 26 TRP HD1 1 1 15 10114 1 1 26 TRP HE1 H 7.287 -4.685 3.171 1.00 . A A . 26 TRP HE1 1 1 15 10115 1 1 26 TRP HE3 H 4.093 -2.137 6.549 1.00 . A A . 26 TRP HE3 1 1 15 10116 1 1 26 TRP HH2 H 7.055 -4.786 8.194 1.00 . A A . 26 TRP HH2 1 1 15 10117 1 1 26 TRP HZ2 H 7.843 -5.328 5.903 1.00 . A A . 26 TRP HZ2 1 1 15 10118 1 1 26 TRP HZ3 H 5.180 -3.196 8.514 1.00 . A A . 26 TRP HZ3 1 1 15 10119 1 1 26 TRP N N 2.896 0.420 3.880 1.00 . A A . 26 TRP N 1 1 15 10120 1 1 26 TRP NE1 N 6.599 -4.121 3.581 1.00 . A A . 26 TRP NE1 1 1 15 10121 1 1 26 TRP O O 4.431 0.749 1.592 1.00 . A A . 26 TRP O 1 1 15 10122 1 1 27 CYS C C 8.396 0.196 1.369 1.00 . A A . 27 CYS C 1 1 15 10123 1 1 27 CYS CA C 7.098 0.978 1.597 1.00 . A A . 27 CYS CA 1 1 15 10124 1 1 27 CYS CB C 7.411 2.394 2.085 1.00 . A A . 27 CYS CB 1 1 15 10125 1 1 27 CYS H H 6.735 0.033 3.502 1.00 . A A . 27 CYS H 1 1 15 10126 1 1 27 CYS HA H 6.520 1.024 0.688 1.00 . A A . 27 CYS HA 1 1 15 10127 1 1 27 CYS HB2 H 6.735 2.654 2.887 1.00 . A A . 27 CYS HB2 1 1 15 10128 1 1 27 CYS HB3 H 8.427 2.434 2.446 1.00 . A A . 27 CYS HB3 1 1 15 10129 1 1 27 CYS N N 6.293 0.374 2.696 1.00 . A A . 27 CYS N 1 1 15 10130 1 1 27 CYS O O 9.386 0.398 2.042 1.00 . A A . 27 CYS O 1 1 15 10131 1 1 27 CYS SG S 7.208 3.567 0.722 1.00 . A A . 27 CYS SG 1 1 15 10132 1 1 28 HIS C C 10.149 -2.339 1.217 1.00 . A A . 28 HIS C 1 1 15 10133 1 1 28 HIS CA C 9.626 -1.463 0.057 1.00 . A A . 28 HIS CA 1 1 15 10134 1 1 28 HIS CB C 10.670 -0.408 -0.305 1.00 . A A . 28 HIS CB 1 1 15 10135 1 1 28 HIS CD2 C 11.341 -0.797 -2.815 1.00 . A A . 28 HIS CD2 1 1 15 10136 1 1 28 HIS CE1 C 10.106 0.739 -3.714 1.00 . A A . 28 HIS CE1 1 1 15 10137 1 1 28 HIS CG C 10.663 -0.182 -1.791 1.00 . A A . 28 HIS CG 1 1 15 10138 1 1 28 HIS H H 7.589 -0.790 -0.145 1.00 . A A . 28 HIS H 1 1 15 10139 1 1 28 HIS HA H 9.437 -2.078 -0.808 1.00 . A A . 28 HIS HA 1 1 15 10140 1 1 28 HIS HB2 H 10.435 0.517 0.202 1.00 . A A . 28 HIS HB2 1 1 15 10141 1 1 28 HIS HB3 H 11.647 -0.749 0.003 1.00 . A A . 28 HIS HB3 1 1 15 10142 1 1 28 HIS HD1 H 9.276 1.413 -1.928 1.00 . A A . 28 HIS HD1 1 1 15 10143 1 1 28 HIS HD2 H 12.041 -1.612 -2.696 1.00 . A A . 28 HIS HD2 1 1 15 10144 1 1 28 HIS HE1 H 9.630 1.386 -4.436 1.00 . A A . 28 HIS HE1 1 1 15 10145 1 1 28 HIS N N 8.399 -0.671 0.394 1.00 . A A . 28 HIS N 1 1 15 10146 1 1 28 HIS ND1 N 9.881 0.795 -2.388 1.00 . A A . 28 HIS ND1 1 1 15 10147 1 1 28 HIS NE2 N 10.987 -0.215 -4.028 1.00 . A A . 28 HIS NE2 1 1 15 10148 1 1 28 HIS O O 11.010 -3.165 1.001 1.00 . A A . 28 HIS O 1 1 15 10149 1 1 29 ASP C C 9.638 -2.569 4.895 1.00 . A A . 29 ASP C 1 1 15 10150 1 1 29 ASP CA C 10.179 -3.045 3.543 1.00 . A A . 29 ASP CA 1 1 15 10151 1 1 29 ASP CB C 11.706 -2.891 3.526 1.00 . A A . 29 ASP CB 1 1 15 10152 1 1 29 ASP CG C 12.089 -1.407 3.511 1.00 . A A . 29 ASP CG 1 1 15 10153 1 1 29 ASP H H 8.963 -1.535 2.602 1.00 . A A . 29 ASP H 1 1 15 10154 1 1 29 ASP HA H 9.914 -4.078 3.378 1.00 . A A . 29 ASP HA 1 1 15 10155 1 1 29 ASP HB2 H 12.116 -3.353 4.413 1.00 . A A . 29 ASP HB2 1 1 15 10156 1 1 29 ASP HB3 H 12.115 -3.377 2.656 1.00 . A A . 29 ASP HB3 1 1 15 10157 1 1 29 ASP N N 9.660 -2.191 2.425 1.00 . A A . 29 ASP N 1 1 15 10158 1 1 29 ASP O O 9.201 -3.357 5.707 1.00 . A A . 29 ASP O 1 1 15 10159 1 1 29 ASP OD1 O 11.232 -0.588 3.222 1.00 . A A . 29 ASP OD1 1 1 15 10160 1 1 29 ASP OD2 O 13.240 -1.113 3.795 1.00 . A A . 29 ASP OD2 1 1 15 10161 1 1 30 LYS C C 7.797 -0.193 6.332 1.00 . A A . 30 LYS C 1 1 15 10162 1 1 30 LYS CA C 9.195 -0.786 6.469 1.00 . A A . 30 LYS CA 1 1 15 10163 1 1 30 LYS CB C 10.196 0.294 6.879 1.00 . A A . 30 LYS CB 1 1 15 10164 1 1 30 LYS CD C 11.728 0.411 8.850 1.00 . A A . 30 LYS CD 1 1 15 10165 1 1 30 LYS CE C 11.905 1.481 9.931 1.00 . A A . 30 LYS CE 1 1 15 10166 1 1 30 LYS CG C 10.265 0.370 8.405 1.00 . A A . 30 LYS CG 1 1 15 10167 1 1 30 LYS H H 10.062 -0.670 4.496 1.00 . A A . 30 LYS H 1 1 15 10168 1 1 30 LYS HA H 9.190 -1.579 7.200 1.00 . A A . 30 LYS HA 1 1 15 10169 1 1 30 LYS HB2 H 11.172 0.049 6.484 1.00 . A A . 30 LYS HB2 1 1 15 10170 1 1 30 LYS HB3 H 9.877 1.248 6.487 1.00 . A A . 30 LYS HB3 1 1 15 10171 1 1 30 LYS HD2 H 12.011 -0.553 9.248 1.00 . A A . 30 LYS HD2 1 1 15 10172 1 1 30 LYS HD3 H 12.357 0.650 8.005 1.00 . A A . 30 LYS HD3 1 1 15 10173 1 1 30 LYS HE2 H 12.190 2.424 9.482 1.00 . A A . 30 LYS HE2 1 1 15 10174 1 1 30 LYS HE3 H 10.997 1.594 10.501 1.00 . A A . 30 LYS HE3 1 1 15 10175 1 1 30 LYS HG2 H 9.758 1.262 8.743 1.00 . A A . 30 LYS HG2 1 1 15 10176 1 1 30 LYS HG3 H 9.787 -0.500 8.829 1.00 . A A . 30 LYS HG3 1 1 15 10177 1 1 30 LYS HZ1 H 12.782 -0.008 11.091 1.00 . A A . 30 LYS HZ1 1 1 15 10178 1 1 30 LYS HZ2 H 13.073 1.570 11.652 1.00 . A A . 30 LYS HZ2 1 1 15 10179 1 1 30 LYS HZ3 H 13.896 0.985 10.285 1.00 . A A . 30 LYS HZ3 1 1 15 10180 1 1 30 LYS N N 9.687 -1.292 5.155 1.00 . A A . 30 LYS N 1 1 15 10181 1 1 30 LYS NZ N 12.996 0.968 10.805 1.00 . A A . 30 LYS NZ 1 1 15 10182 1 1 30 LYS O O 7.321 0.065 5.245 1.00 . A A . 30 LYS O 1 1 15 10183 1 1 31 CYS C C 5.823 2.124 7.509 1.00 . A A . 31 CYS C 1 1 15 10184 1 1 31 CYS CA C 5.764 0.601 7.370 1.00 . A A . 31 CYS CA 1 1 15 10185 1 1 31 CYS CB C 5.017 -0.024 8.547 1.00 . A A . 31 CYS CB 1 1 15 10186 1 1 31 CYS H H 7.536 -0.190 8.300 1.00 . A A . 31 CYS H 1 1 15 10187 1 1 31 CYS HA H 5.285 0.327 6.443 1.00 . A A . 31 CYS HA 1 1 15 10188 1 1 31 CYS HB2 H 5.417 -1.006 8.747 1.00 . A A . 31 CYS HB2 1 1 15 10189 1 1 31 CYS HB3 H 5.134 0.599 9.421 1.00 . A A . 31 CYS HB3 1 1 15 10190 1 1 31 CYS N N 7.133 0.025 7.433 1.00 . A A . 31 CYS N 1 1 15 10191 1 1 31 CYS O O 6.025 2.657 8.582 1.00 . A A . 31 CYS O 1 1 15 10192 1 1 31 CYS SG S 3.261 -0.160 8.132 1.00 . A A . 31 CYS SG 1 1 15 10193 1 1 32 VAL C C 4.710 4.877 5.427 1.00 . A A . 32 VAL C 1 1 15 10194 1 1 32 VAL CA C 5.681 4.310 6.467 1.00 . A A . 32 VAL CA 1 1 15 10195 1 1 32 VAL CB C 7.122 4.671 6.114 1.00 . A A . 32 VAL CB 1 1 15 10196 1 1 32 VAL CG1 C 8.078 3.926 7.048 1.00 . A A . 32 VAL CG1 1 1 15 10197 1 1 32 VAL CG2 C 7.404 4.264 4.666 1.00 . A A . 32 VAL CG2 1 1 15 10198 1 1 32 VAL H H 5.480 2.366 5.574 1.00 . A A . 32 VAL H 1 1 15 10199 1 1 32 VAL HA H 5.436 4.671 7.453 1.00 . A A . 32 VAL HA 1 1 15 10200 1 1 32 VAL HB H 7.266 5.734 6.227 1.00 . A A . 32 VAL HB 1 1 15 10201 1 1 32 VAL HG11 H 7.649 3.876 8.038 1.00 . A A . 32 VAL HG11 1 1 15 10202 1 1 32 VAL HG12 H 9.022 4.449 7.092 1.00 . A A . 32 VAL HG12 1 1 15 10203 1 1 32 VAL HG13 H 8.240 2.925 6.675 1.00 . A A . 32 VAL HG13 1 1 15 10204 1 1 32 VAL HG21 H 6.596 4.601 4.035 1.00 . A A . 32 VAL HG21 1 1 15 10205 1 1 32 VAL HG22 H 7.486 3.189 4.604 1.00 . A A . 32 VAL HG22 1 1 15 10206 1 1 32 VAL HG23 H 8.329 4.716 4.339 1.00 . A A . 32 VAL HG23 1 1 15 10207 1 1 32 VAL N N 5.643 2.823 6.425 1.00 . A A . 32 VAL N 1 1 15 10208 1 1 32 VAL O O 4.156 4.149 4.627 1.00 . A A . 32 VAL O 1 1 15 10209 1 1 33 ARG C C 4.310 7.623 3.425 1.00 . A A . 33 ARG C 1 1 15 10210 1 1 33 ARG CA C 3.553 6.748 4.425 1.00 . A A . 33 ARG CA 1 1 15 10211 1 1 33 ARG CB C 2.559 7.581 5.232 1.00 . A A . 33 ARG CB 1 1 15 10212 1 1 33 ARG CD C 0.602 9.004 4.600 1.00 . A A . 33 ARG CD 1 1 15 10213 1 1 33 ARG CG C 1.218 7.607 4.498 1.00 . A A . 33 ARG CG 1 1 15 10214 1 1 33 ARG CZ C -0.759 9.578 2.680 1.00 . A A . 33 ARG CZ 1 1 15 10215 1 1 33 ARG H H 4.944 6.742 6.075 1.00 . A A . 33 ARG H 1 1 15 10216 1 1 33 ARG HA H 3.031 5.961 3.905 1.00 . A A . 33 ARG HA 1 1 15 10217 1 1 33 ARG HB2 H 2.430 7.141 6.210 1.00 . A A . 33 ARG HB2 1 1 15 10218 1 1 33 ARG HB3 H 2.932 8.590 5.335 1.00 . A A . 33 ARG HB3 1 1 15 10219 1 1 33 ARG HD2 H 0.384 9.243 5.631 1.00 . A A . 33 ARG HD2 1 1 15 10220 1 1 33 ARG HD3 H 1.264 9.740 4.171 1.00 . A A . 33 ARG HD3 1 1 15 10221 1 1 33 ARG HE H -1.404 8.381 4.125 1.00 . A A . 33 ARG HE 1 1 15 10222 1 1 33 ARG HG2 H 1.373 7.355 3.458 1.00 . A A . 33 ARG HG2 1 1 15 10223 1 1 33 ARG HG3 H 0.549 6.887 4.946 1.00 . A A . 33 ARG HG3 1 1 15 10224 1 1 33 ARG HH11 H 0.689 8.540 1.766 1.00 . A A . 33 ARG HH11 1 1 15 10225 1 1 33 ARG HH12 H -0.063 9.776 0.814 1.00 . A A . 33 ARG HH12 1 1 15 10226 1 1 33 ARG HH21 H -2.234 10.764 3.330 1.00 . A A . 33 ARG HH21 1 1 15 10227 1 1 33 ARG HH22 H -1.718 11.036 1.699 1.00 . A A . 33 ARG HH22 1 1 15 10228 1 1 33 ARG N N 4.493 6.165 5.425 1.00 . A A . 33 ARG N 1 1 15 10229 1 1 33 ARG NE N -0.655 8.924 3.805 1.00 . A A . 33 ARG NE 1 1 15 10230 1 1 33 ARG NH1 N 0.016 9.274 1.675 1.00 . A A . 33 ARG NH1 1 1 15 10231 1 1 33 ARG NH2 N -1.639 10.534 2.560 1.00 . A A . 33 ARG NH2 1 1 15 10232 1 1 33 ARG O O 5.459 7.957 3.622 1.00 . A A . 33 ARG O 1 1 15 10233 1 1 34 SER C C 5.289 9.852 1.927 1.00 . A A . 34 SER C 1 1 15 10234 1 1 34 SER CA C 4.329 8.828 1.304 1.00 . A A . 34 SER CA 1 1 15 10235 1 1 34 SER CB C 3.179 9.545 0.597 1.00 . A A . 34 SER CB 1 1 15 10236 1 1 34 SER H H 2.742 7.690 2.217 1.00 . A A . 34 SER H 1 1 15 10237 1 1 34 SER HA H 4.855 8.205 0.599 1.00 . A A . 34 SER HA 1 1 15 10238 1 1 34 SER HB2 H 2.376 8.850 0.418 1.00 . A A . 34 SER HB2 1 1 15 10239 1 1 34 SER HB3 H 2.821 10.353 1.222 1.00 . A A . 34 SER HB3 1 1 15 10240 1 1 34 SER HG H 4.349 9.492 -0.957 1.00 . A A . 34 SER HG 1 1 15 10241 1 1 34 SER N N 3.668 7.985 2.348 1.00 . A A . 34 SER N 1 1 15 10242 1 1 34 SER O O 6.454 9.906 1.588 1.00 . A A . 34 SER O 1 1 15 10243 1 1 34 SER OG O 3.639 10.059 -0.647 1.00 . A A . 34 SER OG 1 1 15 10244 1 1 35 GLU C C 6.903 11.066 4.129 1.00 . A A . 35 GLU C 1 1 15 10245 1 1 35 GLU CA C 5.691 11.704 3.437 1.00 . A A . 35 GLU CA 1 1 15 10246 1 1 35 GLU CB C 4.808 12.418 4.460 1.00 . A A . 35 GLU CB 1 1 15 10247 1 1 35 GLU CD C 3.297 14.386 4.760 1.00 . A A . 35 GLU CD 1 1 15 10248 1 1 35 GLU CG C 4.453 13.812 3.939 1.00 . A A . 35 GLU CG 1 1 15 10249 1 1 35 GLU H H 3.861 10.624 3.067 1.00 . A A . 35 GLU H 1 1 15 10250 1 1 35 GLU HA H 6.020 12.409 2.690 1.00 . A A . 35 GLU HA 1 1 15 10251 1 1 35 GLU HB2 H 3.904 11.848 4.616 1.00 . A A . 35 GLU HB2 1 1 15 10252 1 1 35 GLU HB3 H 5.342 12.512 5.394 1.00 . A A . 35 GLU HB3 1 1 15 10253 1 1 35 GLU HG2 H 5.314 14.460 4.025 1.00 . A A . 35 GLU HG2 1 1 15 10254 1 1 35 GLU HG3 H 4.156 13.744 2.903 1.00 . A A . 35 GLU HG3 1 1 15 10255 1 1 35 GLU N N 4.807 10.673 2.817 1.00 . A A . 35 GLU N 1 1 15 10256 1 1 35 GLU O O 7.877 11.733 4.419 1.00 . A A . 35 GLU O 1 1 15 10257 1 1 35 GLU OE1 O 3.215 14.066 5.934 1.00 . A A . 35 GLU OE1 1 1 15 10258 1 1 35 GLU OE2 O 2.514 15.134 4.199 1.00 . A A . 35 GLU OE2 1 1 15 10259 1 1 36 GLU C C 8.670 8.083 4.188 1.00 . A A . 36 GLU C 1 1 15 10260 1 1 36 GLU CA C 8.030 9.150 5.083 1.00 . A A . 36 GLU CA 1 1 15 10261 1 1 36 GLU CB C 7.456 8.518 6.351 1.00 . A A . 36 GLU CB 1 1 15 10262 1 1 36 GLU CD C 6.937 9.147 8.715 1.00 . A A . 36 GLU CD 1 1 15 10263 1 1 36 GLU CG C 7.943 9.299 7.575 1.00 . A A . 36 GLU CG 1 1 15 10264 1 1 36 GLU H H 6.072 9.259 4.171 1.00 . A A . 36 GLU H 1 1 15 10265 1 1 36 GLU HA H 8.760 9.897 5.350 1.00 . A A . 36 GLU HA 1 1 15 10266 1 1 36 GLU HB2 H 6.376 8.544 6.310 1.00 . A A . 36 GLU HB2 1 1 15 10267 1 1 36 GLU HB3 H 7.790 7.495 6.425 1.00 . A A . 36 GLU HB3 1 1 15 10268 1 1 36 GLU HG2 H 8.904 8.913 7.887 1.00 . A A . 36 GLU HG2 1 1 15 10269 1 1 36 GLU HG3 H 8.041 10.342 7.320 1.00 . A A . 36 GLU HG3 1 1 15 10270 1 1 36 GLU N N 6.864 9.791 4.403 1.00 . A A . 36 GLU N 1 1 15 10271 1 1 36 GLU O O 9.686 7.506 4.528 1.00 . A A . 36 GLU O 1 1 15 10272 1 1 36 GLU OE1 O 6.972 8.123 9.377 1.00 . A A . 36 GLU OE1 1 1 15 10273 1 1 36 GLU OE2 O 6.148 10.058 8.909 1.00 . A A . 36 GLU OE2 1 1 15 10274 1 1 37 CYS C C 9.964 7.317 1.508 1.00 . A A . 37 CYS C 1 1 15 10275 1 1 37 CYS CA C 8.676 6.786 2.142 1.00 . A A . 37 CYS CA 1 1 15 10276 1 1 37 CYS CB C 7.611 6.548 1.070 1.00 . A A . 37 CYS CB 1 1 15 10277 1 1 37 CYS H H 7.274 8.289 2.793 1.00 . A A . 37 CYS H 1 1 15 10278 1 1 37 CYS HA H 8.870 5.872 2.681 1.00 . A A . 37 CYS HA 1 1 15 10279 1 1 37 CYS HB2 H 7.050 7.457 0.912 1.00 . A A . 37 CYS HB2 1 1 15 10280 1 1 37 CYS HB3 H 8.089 6.256 0.147 1.00 . A A . 37 CYS HB3 1 1 15 10281 1 1 37 CYS N N 8.092 7.815 3.051 1.00 . A A . 37 CYS N 1 1 15 10282 1 1 37 CYS O O 10.062 8.478 1.163 1.00 . A A . 37 CYS O 1 1 15 10283 1 1 37 CYS SG S 6.488 5.234 1.610 1.00 . A A . 37 CYS SG 1 1 15 10284 1 1 38 LEU C C 11.942 7.577 -0.635 1.00 . A A . 38 LEU C 1 1 15 10285 1 1 38 LEU CA C 12.224 6.945 0.729 1.00 . A A . 38 LEU CA 1 1 15 10286 1 1 38 LEU CB C 13.073 5.683 0.570 1.00 . A A . 38 LEU CB 1 1 15 10287 1 1 38 LEU CD1 C 15.103 6.630 1.679 1.00 . A A . 38 LEU CD1 1 1 15 10288 1 1 38 LEU CD2 C 13.228 5.725 3.060 1.00 . A A . 38 LEU CD2 1 1 15 10289 1 1 38 LEU CG C 14.020 5.552 1.763 1.00 . A A . 38 LEU CG 1 1 15 10290 1 1 38 LEU H H 10.852 5.545 1.628 1.00 . A A . 38 LEU H 1 1 15 10291 1 1 38 LEU HA H 12.723 7.648 1.378 1.00 . A A . 38 LEU HA 1 1 15 10292 1 1 38 LEU HB2 H 12.427 4.819 0.525 1.00 . A A . 38 LEU HB2 1 1 15 10293 1 1 38 LEU HB3 H 13.650 5.750 -0.340 1.00 . A A . 38 LEU HB3 1 1 15 10294 1 1 38 LEU HD11 H 14.725 7.553 2.095 1.00 . A A . 38 LEU HD11 1 1 15 10295 1 1 38 LEU HD12 H 15.377 6.787 0.646 1.00 . A A . 38 LEU HD12 1 1 15 10296 1 1 38 LEU HD13 H 15.971 6.312 2.238 1.00 . A A . 38 LEU HD13 1 1 15 10297 1 1 38 LEU HD21 H 12.824 6.726 3.105 1.00 . A A . 38 LEU HD21 1 1 15 10298 1 1 38 LEU HD22 H 13.881 5.561 3.905 1.00 . A A . 38 LEU HD22 1 1 15 10299 1 1 38 LEU HD23 H 12.419 5.009 3.086 1.00 . A A . 38 LEU HD23 1 1 15 10300 1 1 38 LEU HG H 14.483 4.575 1.748 1.00 . A A . 38 LEU HG 1 1 15 10301 1 1 38 LEU N N 10.950 6.479 1.347 1.00 . A A . 38 LEU N 1 1 15 10302 1 1 38 LEU O O 12.225 8.737 -0.864 1.00 . A A . 38 LEU O 1 1 15 10303 1 1 39 SER C C 9.603 7.786 -2.967 1.00 . A A . 39 SER C 1 1 15 10304 1 1 39 SER CA C 11.076 7.380 -2.888 1.00 . A A . 39 SER CA 1 1 15 10305 1 1 39 SER CB C 11.371 6.240 -3.862 1.00 . A A . 39 SER CB 1 1 15 10306 1 1 39 SER H H 11.158 5.893 -1.333 1.00 . A A . 39 SER H 1 1 15 10307 1 1 39 SER HA H 11.713 8.223 -3.103 1.00 . A A . 39 SER HA 1 1 15 10308 1 1 39 SER HB2 H 11.986 5.500 -3.377 1.00 . A A . 39 SER HB2 1 1 15 10309 1 1 39 SER HB3 H 10.440 5.783 -4.172 1.00 . A A . 39 SER HB3 1 1 15 10310 1 1 39 SER HG H 12.833 7.231 -4.676 1.00 . A A . 39 SER HG 1 1 15 10311 1 1 39 SER N N 11.382 6.824 -1.540 1.00 . A A . 39 SER N 1 1 15 10312 1 1 39 SER O O 8.834 7.548 -2.056 1.00 . A A . 39 SER O 1 1 15 10313 1 1 39 SER OG O 12.061 6.755 -4.992 1.00 . A A . 39 SER OG 1 1 15 10314 1 1 40 GLY C C 6.906 7.574 -4.428 1.00 . A A . 40 GLY C 1 1 15 10315 1 1 40 GLY CA C 7.776 8.808 -4.182 1.00 . A A . 40 GLY CA 1 1 15 10316 1 1 40 GLY H H 9.834 8.576 -4.774 1.00 . A A . 40 GLY H 1 1 15 10317 1 1 40 GLY HA2 H 7.458 9.301 -3.274 1.00 . A A . 40 GLY HA2 1 1 15 10318 1 1 40 GLY HA3 H 7.674 9.487 -5.016 1.00 . A A . 40 GLY HA3 1 1 15 10319 1 1 40 GLY N N 9.200 8.393 -4.049 1.00 . A A . 40 GLY N 1 1 15 10320 1 1 40 GLY O O 6.191 7.492 -5.407 1.00 . A A . 40 GLY O 1 1 15 10321 1 1 41 THR C C 5.541 4.922 -2.402 1.00 . A A . 41 THR C 1 1 15 10322 1 1 41 THR CA C 6.141 5.379 -3.739 1.00 . A A . 41 THR CA 1 1 15 10323 1 1 41 THR CB C 7.114 4.330 -4.276 1.00 . A A . 41 THR CB 1 1 15 10324 1 1 41 THR CG2 C 8.219 4.079 -3.247 1.00 . A A . 41 THR CG2 1 1 15 10325 1 1 41 THR H H 7.548 6.692 -2.767 1.00 . A A . 41 THR H 1 1 15 10326 1 1 41 THR HA H 5.359 5.558 -4.460 1.00 . A A . 41 THR HA 1 1 15 10327 1 1 41 THR HB H 7.558 4.688 -5.193 1.00 . A A . 41 THR HB 1 1 15 10328 1 1 41 THR HG1 H 5.531 3.346 -4.828 1.00 . A A . 41 THR HG1 1 1 15 10329 1 1 41 THR HG21 H 9.182 4.248 -3.704 1.00 . A A . 41 THR HG21 1 1 15 10330 1 1 41 THR HG22 H 8.160 3.058 -2.899 1.00 . A A . 41 THR HG22 1 1 15 10331 1 1 41 THR HG23 H 8.092 4.751 -2.412 1.00 . A A . 41 THR HG23 1 1 15 10332 1 1 41 THR N N 6.964 6.609 -3.549 1.00 . A A . 41 THR N 1 1 15 10333 1 1 41 THR O O 6.162 5.023 -1.363 1.00 . A A . 41 THR O 1 1 15 10334 1 1 41 THR OG1 O 6.413 3.120 -4.527 1.00 . A A . 41 THR OG1 1 1 15 10335 1 1 42 TRP C C 2.753 2.772 -1.474 1.00 . A A . 42 TRP C 1 1 15 10336 1 1 42 TRP CA C 3.687 3.947 -1.169 1.00 . A A . 42 TRP CA 1 1 15 10337 1 1 42 TRP CB C 2.886 5.151 -0.668 1.00 . A A . 42 TRP CB 1 1 15 10338 1 1 42 TRP CD1 C 2.983 4.548 1.780 1.00 . A A . 42 TRP CD1 1 1 15 10339 1 1 42 TRP CD2 C 0.875 4.754 1.022 1.00 . A A . 42 TRP CD2 1 1 15 10340 1 1 42 TRP CE2 C 0.784 4.415 2.392 1.00 . A A . 42 TRP CE2 1 1 15 10341 1 1 42 TRP CE3 C -0.320 4.941 0.304 1.00 . A A . 42 TRP CE3 1 1 15 10342 1 1 42 TRP CG C 2.283 4.829 0.659 1.00 . A A . 42 TRP CG 1 1 15 10343 1 1 42 TRP CH2 C -1.627 4.458 2.300 1.00 . A A . 42 TRP CH2 1 1 15 10344 1 1 42 TRP CZ2 C -0.449 4.268 3.028 1.00 . A A . 42 TRP CZ2 1 1 15 10345 1 1 42 TRP CZ3 C -1.563 4.795 0.941 1.00 . A A . 42 TRP CZ3 1 1 15 10346 1 1 42 TRP H H 3.857 4.344 -3.280 1.00 . A A . 42 TRP H 1 1 15 10347 1 1 42 TRP HA H 4.430 3.665 -0.440 1.00 . A A . 42 TRP HA 1 1 15 10348 1 1 42 TRP HB2 H 3.541 6.004 -0.566 1.00 . A A . 42 TRP HB2 1 1 15 10349 1 1 42 TRP HB3 H 2.103 5.380 -1.373 1.00 . A A . 42 TRP HB3 1 1 15 10350 1 1 42 TRP HD1 H 4.060 4.520 1.858 1.00 . A A . 42 TRP HD1 1 1 15 10351 1 1 42 TRP HE1 H 2.346 4.073 3.726 1.00 . A A . 42 TRP HE1 1 1 15 10352 1 1 42 TRP HE3 H -0.281 5.201 -0.743 1.00 . A A . 42 TRP HE3 1 1 15 10353 1 1 42 TRP HH2 H -2.586 4.347 2.785 1.00 . A A . 42 TRP HH2 1 1 15 10354 1 1 42 TRP HZ2 H -0.493 4.009 4.075 1.00 . A A . 42 TRP HZ2 1 1 15 10355 1 1 42 TRP HZ3 H -2.474 4.941 0.381 1.00 . A A . 42 TRP HZ3 1 1 15 10356 1 1 42 TRP N N 4.336 4.416 -2.428 1.00 . A A . 42 TRP N 1 1 15 10357 1 1 42 TRP NE1 N 2.095 4.302 2.809 1.00 . A A . 42 TRP NE1 1 1 15 10358 1 1 42 TRP O O 1.976 2.819 -2.406 1.00 . A A . 42 TRP O 1 1 15 10359 1 1 43 THR C C 1.151 0.141 0.275 1.00 . A A . 43 THR C 1 1 15 10360 1 1 43 THR CA C 1.922 0.552 -0.984 1.00 . A A . 43 THR CA 1 1 15 10361 1 1 43 THR CB C 2.852 -0.576 -1.437 1.00 . A A . 43 THR CB 1 1 15 10362 1 1 43 THR CG2 C 3.960 -0.783 -0.405 1.00 . A A . 43 THR CG2 1 1 15 10363 1 1 43 THR H H 3.451 1.682 0.045 1.00 . A A . 43 THR H 1 1 15 10364 1 1 43 THR HA H 1.234 0.796 -1.777 1.00 . A A . 43 THR HA 1 1 15 10365 1 1 43 THR HB H 3.294 -0.318 -2.387 1.00 . A A . 43 THR HB 1 1 15 10366 1 1 43 THR HG1 H 2.608 -2.380 -2.124 1.00 . A A . 43 THR HG1 1 1 15 10367 1 1 43 THR HG21 H 3.522 -0.889 0.577 1.00 . A A . 43 THR HG21 1 1 15 10368 1 1 43 THR HG22 H 4.622 0.071 -0.413 1.00 . A A . 43 THR HG22 1 1 15 10369 1 1 43 THR HG23 H 4.518 -1.674 -0.649 1.00 . A A . 43 THR HG23 1 1 15 10370 1 1 43 THR N N 2.818 1.713 -0.706 1.00 . A A . 43 THR N 1 1 15 10371 1 1 43 THR O O 1.650 0.211 1.383 1.00 . A A . 43 THR O 1 1 15 10372 1 1 43 THR OG1 O 2.103 -1.775 -1.575 1.00 . A A . 43 THR OG1 1 1 15 10373 1 1 44 GLN C C -1.392 -2.148 1.057 1.00 . A A . 44 GLN C 1 1 15 10374 1 1 44 GLN CA C -0.891 -0.718 1.270 1.00 . A A . 44 GLN CA 1 1 15 10375 1 1 44 GLN CB C -2.064 0.262 1.308 1.00 . A A . 44 GLN CB 1 1 15 10376 1 1 44 GLN CD C -3.177 0.300 3.543 1.00 . A A . 44 GLN CD 1 1 15 10377 1 1 44 GLN CG C -2.107 0.957 2.670 1.00 . A A . 44 GLN CG 1 1 15 10378 1 1 44 GLN H H -0.446 -0.340 -0.801 1.00 . A A . 44 GLN H 1 1 15 10379 1 1 44 GLN HA H -0.320 -0.649 2.182 1.00 . A A . 44 GLN HA 1 1 15 10380 1 1 44 GLN HB2 H -1.940 1.001 0.530 1.00 . A A . 44 GLN HB2 1 1 15 10381 1 1 44 GLN HB3 H -2.987 -0.276 1.152 1.00 . A A . 44 GLN HB3 1 1 15 10382 1 1 44 GLN HE21 H -4.630 0.579 2.220 1.00 . A A . 44 GLN HE21 1 1 15 10383 1 1 44 GLN HE22 H -5.095 -0.196 3.657 1.00 . A A . 44 GLN HE22 1 1 15 10384 1 1 44 GLN HG2 H -1.142 0.867 3.150 1.00 . A A . 44 GLN HG2 1 1 15 10385 1 1 44 GLN HG3 H -2.346 2.000 2.534 1.00 . A A . 44 GLN HG3 1 1 15 10386 1 1 44 GLN N N -0.069 -0.292 0.103 1.00 . A A . 44 GLN N 1 1 15 10387 1 1 44 GLN NE2 N -4.402 0.220 3.103 1.00 . A A . 44 GLN NE2 1 1 15 10388 1 1 44 GLN O O -2.323 -2.594 1.699 1.00 . A A . 44 GLN O 1 1 15 10389 1 1 44 GLN OE1 O -2.894 -0.146 4.638 1.00 . A A . 44 GLN OE1 1 1 15 10390 1 1 45 GLN C C -0.048 -5.096 -0.649 1.00 . A A . 45 GLN C 1 1 15 10391 1 1 45 GLN CA C -1.213 -4.275 -0.089 1.00 . A A . 45 GLN CA 1 1 15 10392 1 1 45 GLN CB C -2.329 -4.159 -1.130 1.00 . A A . 45 GLN CB 1 1 15 10393 1 1 45 GLN CD C -4.331 -5.601 -1.520 1.00 . A A . 45 GLN CD 1 1 15 10394 1 1 45 GLN CG C -3.644 -4.658 -0.531 1.00 . A A . 45 GLN CG 1 1 15 10395 1 1 45 GLN H H -0.026 -2.494 -0.342 1.00 . A A . 45 GLN H 1 1 15 10396 1 1 45 GLN HA H -1.594 -4.722 0.814 1.00 . A A . 45 GLN HA 1 1 15 10397 1 1 45 GLN HB2 H -2.436 -3.125 -1.427 1.00 . A A . 45 GLN HB2 1 1 15 10398 1 1 45 GLN HB3 H -2.079 -4.757 -1.993 1.00 . A A . 45 GLN HB3 1 1 15 10399 1 1 45 GLN HE21 H -2.872 -6.947 -1.466 1.00 . A A . 45 GLN HE21 1 1 15 10400 1 1 45 GLN HE22 H -4.176 -7.332 -2.482 1.00 . A A . 45 GLN HE22 1 1 15 10401 1 1 45 GLN HG2 H -3.442 -5.186 0.391 1.00 . A A . 45 GLN HG2 1 1 15 10402 1 1 45 GLN HG3 H -4.292 -3.817 -0.330 1.00 . A A . 45 GLN HG3 1 1 15 10403 1 1 45 GLN N N -0.778 -2.871 0.161 1.00 . A A . 45 GLN N 1 1 15 10404 1 1 45 GLN NE2 N -3.744 -6.719 -1.851 1.00 . A A . 45 GLN NE2 1 1 15 10405 1 1 45 GLN O O 0.303 -4.988 -1.807 1.00 . A A . 45 GLN O 1 1 15 10406 1 1 45 GLN OE1 O -5.411 -5.318 -1.999 1.00 . A A . 45 GLN OE1 1 1 15 10407 1 1 46 ILE C C 1.751 -8.066 0.486 1.00 . A A . 46 ILE C 1 1 15 10408 1 1 46 ILE CA C 1.684 -6.759 -0.314 1.00 . A A . 46 ILE CA 1 1 15 10409 1 1 46 ILE CB C 2.933 -5.909 -0.081 1.00 . A A . 46 ILE CB 1 1 15 10410 1 1 46 ILE CD1 C 5.193 -5.873 -1.143 1.00 . A A . 46 ILE CD1 1 1 15 10411 1 1 46 ILE CG1 C 4.181 -6.738 -0.389 1.00 . A A . 46 ILE CG1 1 1 15 10412 1 1 46 ILE CG2 C 2.978 -5.444 1.376 1.00 . A A . 46 ILE CG2 1 1 15 10413 1 1 46 ILE H H 0.244 -5.996 1.094 1.00 . A A . 46 ILE H 1 1 15 10414 1 1 46 ILE HA H 1.575 -6.970 -1.367 1.00 . A A . 46 ILE HA 1 1 15 10415 1 1 46 ILE HB H 2.904 -5.045 -0.731 1.00 . A A . 46 ILE HB 1 1 15 10416 1 1 46 ILE HD11 H 4.671 -5.239 -1.845 1.00 . A A . 46 ILE HD11 1 1 15 10417 1 1 46 ILE HD12 H 5.883 -6.509 -1.676 1.00 . A A . 46 ILE HD12 1 1 15 10418 1 1 46 ILE HD13 H 5.737 -5.260 -0.440 1.00 . A A . 46 ILE HD13 1 1 15 10419 1 1 46 ILE HG12 H 4.620 -7.085 0.535 1.00 . A A . 46 ILE HG12 1 1 15 10420 1 1 46 ILE HG13 H 3.908 -7.585 -1.000 1.00 . A A . 46 ILE HG13 1 1 15 10421 1 1 46 ILE HG21 H 3.348 -4.431 1.417 1.00 . A A . 46 ILE HG21 1 1 15 10422 1 1 46 ILE HG22 H 3.635 -6.090 1.939 1.00 . A A . 46 ILE HG22 1 1 15 10423 1 1 46 ILE HG23 H 1.985 -5.483 1.797 1.00 . A A . 46 ILE HG23 1 1 15 10424 1 1 46 ILE N N 0.548 -5.922 0.166 1.00 . A A . 46 ILE N 1 1 15 10425 1 1 46 ILE O O 2.048 -9.117 -0.045 1.00 . A A . 46 ILE O 1 1 15 10426 1 1 47 CYS C C 0.309 -9.279 3.540 1.00 . A A . 47 CYS C 1 1 15 10427 1 1 47 CYS CA C 1.526 -9.229 2.611 1.00 . A A . 47 CYS CA 1 1 15 10428 1 1 47 CYS CB C 2.815 -9.110 3.434 1.00 . A A . 47 CYS CB 1 1 15 10429 1 1 47 CYS H H 1.243 -7.140 2.167 1.00 . A A . 47 CYS H 1 1 15 10430 1 1 47 CYS HA H 1.563 -10.112 1.993 1.00 . A A . 47 CYS HA 1 1 15 10431 1 1 47 CYS HB2 H 2.752 -9.761 4.293 1.00 . A A . 47 CYS HB2 1 1 15 10432 1 1 47 CYS HB3 H 3.658 -9.400 2.824 1.00 . A A . 47 CYS HB3 1 1 15 10433 1 1 47 CYS N N 1.477 -8.000 1.762 1.00 . A A . 47 CYS N 1 1 15 10434 1 1 47 CYS O O -0.359 -8.288 3.758 1.00 . A A . 47 CYS O 1 1 15 10435 1 1 47 CYS SG S 3.037 -7.399 3.995 1.00 . A A . 47 CYS SG 1 1 15 10436 1 1 48 LEU C C -0.827 -9.885 6.358 1.00 . A A . 48 LEU C 1 1 15 10437 1 1 48 LEU CA C -1.149 -10.537 5.010 1.00 . A A . 48 LEU CA 1 1 15 10438 1 1 48 LEU CB C -1.378 -12.040 5.183 1.00 . A A . 48 LEU CB 1 1 15 10439 1 1 48 LEU CD1 C -1.496 -13.465 3.132 1.00 . A A . 48 LEU CD1 1 1 15 10440 1 1 48 LEU CD2 C -3.451 -13.340 4.680 1.00 . A A . 48 LEU CD2 1 1 15 10441 1 1 48 LEU CG C -2.292 -12.551 4.066 1.00 . A A . 48 LEU CG 1 1 15 10442 1 1 48 LEU H H 0.574 -11.213 3.906 1.00 . A A . 48 LEU H 1 1 15 10443 1 1 48 LEU HA H -2.021 -10.079 4.569 1.00 . A A . 48 LEU HA 1 1 15 10444 1 1 48 LEU HB2 H -0.429 -12.556 5.138 1.00 . A A . 48 LEU HB2 1 1 15 10445 1 1 48 LEU HB3 H -1.843 -12.225 6.139 1.00 . A A . 48 LEU HB3 1 1 15 10446 1 1 48 LEU HD11 H -0.487 -13.093 3.038 1.00 . A A . 48 LEU HD11 1 1 15 10447 1 1 48 LEU HD12 H -1.966 -13.481 2.159 1.00 . A A . 48 LEU HD12 1 1 15 10448 1 1 48 LEU HD13 H -1.477 -14.466 3.538 1.00 . A A . 48 LEU HD13 1 1 15 10449 1 1 48 LEU HD21 H -4.172 -12.652 5.099 1.00 . A A . 48 LEU HD21 1 1 15 10450 1 1 48 LEU HD22 H -3.075 -13.987 5.458 1.00 . A A . 48 LEU HD22 1 1 15 10451 1 1 48 LEU HD23 H -3.926 -13.936 3.914 1.00 . A A . 48 LEU HD23 1 1 15 10452 1 1 48 LEU HG H -2.680 -11.712 3.507 1.00 . A A . 48 LEU HG 1 1 15 10453 1 1 48 LEU N N 0.021 -10.426 4.093 1.00 . A A . 48 LEU N 1 1 15 10454 1 1 48 LEU O O 0.345 -9.802 6.688 1.00 . A A . 48 LEU O 1 1 15 10455 1 1 48 LEU OXT O -1.756 -9.483 7.037 1.00 . A A . 48 LEU OXT 1 1 16 10456 1 1 1 GLY C C 3.522 12.170 14.042 1.00 . A A . 1 GLY C 1 1 16 10457 1 1 1 GLY CA C 4.442 11.470 13.041 1.00 . A A . 1 GLY CA 1 1 16 10458 1 1 1 GLY H1 H 5.003 11.870 11.075 1.00 . A A . 1 GLY H1 1 1 16 10459 1 1 1 GLY H2 H 5.603 12.986 12.207 1.00 . A A . 1 GLY H2 1 1 16 10460 1 1 1 GLY H3 H 3.968 13.033 11.747 1.00 . A A . 1 GLY H3 1 1 16 10461 1 1 1 GLY HA2 H 3.943 10.601 12.637 1.00 . A A . 1 GLY HA2 1 1 16 10462 1 1 1 GLY HA3 H 5.348 11.165 13.544 1.00 . A A . 1 GLY HA3 1 1 16 10463 1 1 1 GLY N N 4.780 12.411 11.934 1.00 . A A . 1 GLY N 1 1 16 10464 1 1 1 GLY O O 3.966 12.916 14.891 1.00 . A A . 1 GLY O 1 1 16 10465 1 1 2 SER C C 0.393 11.550 15.556 1.00 . A A . 2 SER C 1 1 16 10466 1 1 2 SER CA C 1.298 12.595 14.897 1.00 . A A . 2 SER CA 1 1 16 10467 1 1 2 SER CB C 0.473 13.548 14.035 1.00 . A A . 2 SER CB 1 1 16 10468 1 1 2 SER H H 1.901 11.334 13.257 1.00 . A A . 2 SER H 1 1 16 10469 1 1 2 SER HA H 1.841 13.150 15.645 1.00 . A A . 2 SER HA 1 1 16 10470 1 1 2 SER HB2 H 1.128 14.128 13.405 1.00 . A A . 2 SER HB2 1 1 16 10471 1 1 2 SER HB3 H -0.205 12.977 13.415 1.00 . A A . 2 SER HB3 1 1 16 10472 1 1 2 SER HG H -0.493 13.947 15.677 1.00 . A A . 2 SER HG 1 1 16 10473 1 1 2 SER N N 2.242 11.937 13.949 1.00 . A A . 2 SER N 1 1 16 10474 1 1 2 SER O O 0.267 11.497 16.764 1.00 . A A . 2 SER O 1 1 16 10475 1 1 2 SER OG O -0.262 14.426 14.877 1.00 . A A . 2 SER OG 1 1 16 10476 1 1 3 ALA C C -0.353 8.414 15.681 1.00 . A A . 3 ALA C 1 1 16 10477 1 1 3 ALA CA C -1.141 9.686 15.353 1.00 . A A . 3 ALA CA 1 1 16 10478 1 1 3 ALA CB C -2.177 9.410 14.263 1.00 . A A . 3 ALA CB 1 1 16 10479 1 1 3 ALA H H -0.128 10.783 13.801 1.00 . A A . 3 ALA H 1 1 16 10480 1 1 3 ALA HA H -1.630 10.064 16.237 1.00 . A A . 3 ALA HA 1 1 16 10481 1 1 3 ALA HB1 H -3.038 10.043 14.418 1.00 . A A . 3 ALA HB1 1 1 16 10482 1 1 3 ALA HB2 H -2.478 8.374 14.305 1.00 . A A . 3 ALA HB2 1 1 16 10483 1 1 3 ALA HB3 H -1.745 9.621 13.296 1.00 . A A . 3 ALA HB3 1 1 16 10484 1 1 3 ALA N N -0.240 10.722 14.773 1.00 . A A . 3 ALA N 1 1 16 10485 1 1 3 ALA O O 0.779 8.247 15.273 1.00 . A A . 3 ALA O 1 1 16 10486 1 1 4 MET C C -1.038 5.046 16.256 1.00 . A A . 4 MET C 1 1 16 10487 1 1 4 MET CA C -0.244 6.251 16.774 1.00 . A A . 4 MET CA 1 1 16 10488 1 1 4 MET CB C -0.194 6.248 18.302 1.00 . A A . 4 MET CB 1 1 16 10489 1 1 4 MET CE C 1.540 9.037 20.789 1.00 . A A . 4 MET CE 1 1 16 10490 1 1 4 MET CG C 0.511 7.517 18.789 1.00 . A A . 4 MET CG 1 1 16 10491 1 1 4 MET H H -1.862 7.670 16.733 1.00 . A A . 4 MET H 1 1 16 10492 1 1 4 MET HA H 0.756 6.247 16.371 1.00 . A A . 4 MET HA 1 1 16 10493 1 1 4 MET HB2 H -1.200 6.222 18.695 1.00 . A A . 4 MET HB2 1 1 16 10494 1 1 4 MET HB3 H 0.349 5.382 18.645 1.00 . A A . 4 MET HB3 1 1 16 10495 1 1 4 MET HE1 H 0.775 9.764 20.551 1.00 . A A . 4 MET HE1 1 1 16 10496 1 1 4 MET HE2 H 2.388 9.183 20.139 1.00 . A A . 4 MET HE2 1 1 16 10497 1 1 4 MET HE3 H 1.852 9.159 21.817 1.00 . A A . 4 MET HE3 1 1 16 10498 1 1 4 MET HG2 H 1.433 7.648 18.241 1.00 . A A . 4 MET HG2 1 1 16 10499 1 1 4 MET HG3 H -0.129 8.369 18.624 1.00 . A A . 4 MET HG3 1 1 16 10500 1 1 4 MET N N -0.948 7.514 16.416 1.00 . A A . 4 MET N 1 1 16 10501 1 1 4 MET O O -1.903 4.527 16.934 1.00 . A A . 4 MET O 1 1 16 10502 1 1 4 MET SD S 0.877 7.369 20.556 1.00 . A A . 4 MET SD 1 1 16 10503 1 1 5 GLY C C -0.542 2.448 13.858 1.00 . A A . 5 GLY C 1 1 16 10504 1 1 5 GLY CA C -1.510 3.443 14.502 1.00 . A A . 5 GLY CA 1 1 16 10505 1 1 5 GLY H H -0.063 5.041 14.525 1.00 . A A . 5 GLY H 1 1 16 10506 1 1 5 GLY HA2 H -2.052 2.953 15.299 1.00 . A A . 5 GLY HA2 1 1 16 10507 1 1 5 GLY HA3 H -2.209 3.792 13.757 1.00 . A A . 5 GLY HA3 1 1 16 10508 1 1 5 GLY N N -0.759 4.605 15.058 1.00 . A A . 5 GLY N 1 1 16 10509 1 1 5 GLY O O 0.232 1.794 14.529 1.00 . A A . 5 GLY O 1 1 16 10510 1 1 6 CYS C C 1.783 1.660 12.178 1.00 . A A . 6 CYS C 1 1 16 10511 1 1 6 CYS CA C 0.316 1.353 11.866 1.00 . A A . 6 CYS CA 1 1 16 10512 1 1 6 CYS CB C 0.034 1.547 10.380 1.00 . A A . 6 CYS CB 1 1 16 10513 1 1 6 CYS H H -1.229 2.846 12.038 1.00 . A A . 6 CYS H 1 1 16 10514 1 1 6 CYS HA H 0.076 0.346 12.154 1.00 . A A . 6 CYS HA 1 1 16 10515 1 1 6 CYS HB2 H 0.694 0.917 9.802 1.00 . A A . 6 CYS HB2 1 1 16 10516 1 1 6 CYS HB3 H -0.992 1.284 10.169 1.00 . A A . 6 CYS HB3 1 1 16 10517 1 1 6 CYS N N -0.590 2.317 12.559 1.00 . A A . 6 CYS N 1 1 16 10518 1 1 6 CYS O O 2.589 0.766 12.337 1.00 . A A . 6 CYS O 1 1 16 10519 1 1 6 CYS SG S 0.313 3.278 9.944 1.00 . A A . 6 CYS SG 1 1 16 10520 1 1 7 ARG C C 3.982 2.589 13.888 1.00 . A A . 7 ARG C 1 1 16 10521 1 1 7 ARG CA C 3.559 3.249 12.572 1.00 . A A . 7 ARG CA 1 1 16 10522 1 1 7 ARG CB C 3.593 4.774 12.688 1.00 . A A . 7 ARG CB 1 1 16 10523 1 1 7 ARG CD C 2.797 6.756 11.393 1.00 . A A . 7 ARG CD 1 1 16 10524 1 1 7 ARG CG C 3.478 5.390 11.296 1.00 . A A . 7 ARG CG 1 1 16 10525 1 1 7 ARG CZ C 4.584 7.709 10.070 1.00 . A A . 7 ARG CZ 1 1 16 10526 1 1 7 ARG H H 1.480 3.623 12.138 1.00 . A A . 7 ARG H 1 1 16 10527 1 1 7 ARG HA H 4.202 2.927 11.767 1.00 . A A . 7 ARG HA 1 1 16 10528 1 1 7 ARG HB2 H 2.770 5.108 13.303 1.00 . A A . 7 ARG HB2 1 1 16 10529 1 1 7 ARG HB3 H 4.525 5.079 13.134 1.00 . A A . 7 ARG HB3 1 1 16 10530 1 1 7 ARG HD2 H 2.042 6.853 10.626 1.00 . A A . 7 ARG HD2 1 1 16 10531 1 1 7 ARG HD3 H 2.364 6.894 12.371 1.00 . A A . 7 ARG HD3 1 1 16 10532 1 1 7 ARG HE H 4.093 8.411 11.861 1.00 . A A . 7 ARG HE 1 1 16 10533 1 1 7 ARG HG2 H 4.464 5.508 10.873 1.00 . A A . 7 ARG HG2 1 1 16 10534 1 1 7 ARG HG3 H 2.891 4.744 10.666 1.00 . A A . 7 ARG HG3 1 1 16 10535 1 1 7 ARG HH11 H 2.979 7.851 8.879 1.00 . A A . 7 ARG HH11 1 1 16 10536 1 1 7 ARG HH12 H 4.508 7.751 8.070 1.00 . A A . 7 ARG HH12 1 1 16 10537 1 1 7 ARG HH21 H 6.347 7.547 11.001 1.00 . A A . 7 ARG HH21 1 1 16 10538 1 1 7 ARG HH22 H 6.414 7.578 9.271 1.00 . A A . 7 ARG HH22 1 1 16 10539 1 1 7 ARG N N 2.140 2.911 12.268 1.00 . A A . 7 ARG N 1 1 16 10540 1 1 7 ARG NE N 3.892 7.741 11.175 1.00 . A A . 7 ARG NE 1 1 16 10541 1 1 7 ARG NH1 N 3.976 7.775 8.917 1.00 . A A . 7 ARG NH1 1 1 16 10542 1 1 7 ARG NH2 N 5.883 7.604 10.118 1.00 . A A . 7 ARG NH2 1 1 16 10543 1 1 7 ARG O O 5.152 2.478 14.191 1.00 . A A . 7 ARG O 1 1 16 10544 1 1 8 HIS C C 3.193 -0.036 15.830 1.00 . A A . 8 HIS C 1 1 16 10545 1 1 8 HIS CA C 3.370 1.486 15.962 1.00 . A A . 8 HIS CA 1 1 16 10546 1 1 8 HIS CB C 2.390 2.111 16.978 1.00 . A A . 8 HIS CB 1 1 16 10547 1 1 8 HIS CD2 C 0.295 0.560 17.337 1.00 . A A . 8 HIS CD2 1 1 16 10548 1 1 8 HIS CE1 C 0.966 -0.472 19.119 1.00 . A A . 8 HIS CE1 1 1 16 10549 1 1 8 HIS CG C 1.536 1.060 17.642 1.00 . A A . 8 HIS CG 1 1 16 10550 1 1 8 HIS H H 2.095 2.243 14.403 1.00 . A A . 8 HIS H 1 1 16 10551 1 1 8 HIS HA H 4.385 1.718 16.244 1.00 . A A . 8 HIS HA 1 1 16 10552 1 1 8 HIS HB2 H 2.951 2.637 17.734 1.00 . A A . 8 HIS HB2 1 1 16 10553 1 1 8 HIS HB3 H 1.750 2.813 16.462 1.00 . A A . 8 HIS HB3 1 1 16 10554 1 1 8 HIS HD1 H 2.794 0.512 19.255 1.00 . A A . 8 HIS HD1 1 1 16 10555 1 1 8 HIS HD2 H -0.311 0.869 16.499 1.00 . A A . 8 HIS HD2 1 1 16 10556 1 1 8 HIS HE1 H 1.008 -1.132 19.973 1.00 . A A . 8 HIS HE1 1 1 16 10557 1 1 8 HIS N N 3.033 2.144 14.669 1.00 . A A . 8 HIS N 1 1 16 10558 1 1 8 HIS ND1 N 1.946 0.387 18.782 1.00 . A A . 8 HIS ND1 1 1 16 10559 1 1 8 HIS NE2 N -0.063 -0.408 18.272 1.00 . A A . 8 HIS NE2 1 1 16 10560 1 1 8 HIS O O 3.718 -0.804 16.611 1.00 . A A . 8 HIS O 1 1 16 10561 1 1 9 PHE C C 3.585 -2.666 14.551 1.00 . A A . 9 PHE C 1 1 16 10562 1 1 9 PHE CA C 2.242 -1.936 14.650 1.00 . A A . 9 PHE CA 1 1 16 10563 1 1 9 PHE CB C 1.493 -2.050 13.322 1.00 . A A . 9 PHE CB 1 1 16 10564 1 1 9 PHE CD1 C -0.403 -1.081 14.694 1.00 . A A . 9 PHE CD1 1 1 16 10565 1 1 9 PHE CD2 C -0.831 -1.760 12.408 1.00 . A A . 9 PHE CD2 1 1 16 10566 1 1 9 PHE CE1 C -1.740 -0.685 14.825 1.00 . A A . 9 PHE CE1 1 1 16 10567 1 1 9 PHE CE2 C -2.166 -1.366 12.537 1.00 . A A . 9 PHE CE2 1 1 16 10568 1 1 9 PHE CG C 0.051 -1.619 13.483 1.00 . A A . 9 PHE CG 1 1 16 10569 1 1 9 PHE CZ C -2.622 -0.828 13.746 1.00 . A A . 9 PHE CZ 1 1 16 10570 1 1 9 PHE H H 2.044 0.168 14.224 1.00 . A A . 9 PHE H 1 1 16 10571 1 1 9 PHE HA H 1.643 -2.342 15.449 1.00 . A A . 9 PHE HA 1 1 16 10572 1 1 9 PHE HB2 H 1.973 -1.420 12.588 1.00 . A A . 9 PHE HB2 1 1 16 10573 1 1 9 PHE HB3 H 1.522 -3.074 12.984 1.00 . A A . 9 PHE HB3 1 1 16 10574 1 1 9 PHE HD1 H 0.278 -0.971 15.525 1.00 . A A . 9 PHE HD1 1 1 16 10575 1 1 9 PHE HD2 H -0.477 -2.172 11.476 1.00 . A A . 9 PHE HD2 1 1 16 10576 1 1 9 PHE HE1 H -2.092 -0.270 15.756 1.00 . A A . 9 PHE HE1 1 1 16 10577 1 1 9 PHE HE2 H -2.846 -1.475 11.703 1.00 . A A . 9 PHE HE2 1 1 16 10578 1 1 9 PHE HZ H -3.653 -0.522 13.846 1.00 . A A . 9 PHE HZ 1 1 16 10579 1 1 9 PHE N N 2.456 -0.470 14.842 1.00 . A A . 9 PHE N 1 1 16 10580 1 1 9 PHE O O 4.616 -2.147 14.929 1.00 . A A . 9 PHE O 1 1 16 10581 1 1 10 GLN C C 5.105 -4.965 12.417 1.00 . A A . 10 GLN C 1 1 16 10582 1 1 10 GLN CA C 4.858 -4.624 13.892 1.00 . A A . 10 GLN CA 1 1 16 10583 1 1 10 GLN CB C 4.683 -5.898 14.732 1.00 . A A . 10 GLN CB 1 1 16 10584 1 1 10 GLN CD C 3.094 -7.665 15.503 1.00 . A A . 10 GLN CD 1 1 16 10585 1 1 10 GLN CG C 3.225 -6.368 14.703 1.00 . A A . 10 GLN CG 1 1 16 10586 1 1 10 GLN H H 2.739 -4.263 13.723 1.00 . A A . 10 GLN H 1 1 16 10587 1 1 10 GLN HA H 5.677 -4.040 14.281 1.00 . A A . 10 GLN HA 1 1 16 10588 1 1 10 GLN HB2 H 5.317 -6.677 14.333 1.00 . A A . 10 GLN HB2 1 1 16 10589 1 1 10 GLN HB3 H 4.971 -5.694 15.752 1.00 . A A . 10 GLN HB3 1 1 16 10590 1 1 10 GLN HE21 H 1.122 -7.523 15.684 1.00 . A A . 10 GLN HE21 1 1 16 10591 1 1 10 GLN HE22 H 1.822 -8.884 16.417 1.00 . A A . 10 GLN HE22 1 1 16 10592 1 1 10 GLN HG2 H 2.594 -5.607 15.142 1.00 . A A . 10 GLN HG2 1 1 16 10593 1 1 10 GLN HG3 H 2.920 -6.545 13.684 1.00 . A A . 10 GLN HG3 1 1 16 10594 1 1 10 GLN N N 3.581 -3.864 14.031 1.00 . A A . 10 GLN N 1 1 16 10595 1 1 10 GLN NE2 N 1.915 -8.056 15.901 1.00 . A A . 10 GLN NE2 1 1 16 10596 1 1 10 GLN O O 5.583 -4.145 11.658 1.00 . A A . 10 GLN O 1 1 16 10597 1 1 10 GLN OE1 O 4.076 -8.329 15.771 1.00 . A A . 10 GLN OE1 1 1 16 10598 1 1 11 SER C C 3.982 -5.845 9.670 1.00 . A A . 11 SER C 1 1 16 10599 1 1 11 SER CA C 5.012 -6.532 10.570 1.00 . A A . 11 SER CA 1 1 16 10600 1 1 11 SER CB C 4.835 -8.048 10.520 1.00 . A A . 11 SER CB 1 1 16 10601 1 1 11 SER H H 4.404 -6.814 12.617 1.00 . A A . 11 SER H 1 1 16 10602 1 1 11 SER HA H 6.012 -6.270 10.267 1.00 . A A . 11 SER HA 1 1 16 10603 1 1 11 SER HB2 H 4.312 -8.320 9.619 1.00 . A A . 11 SER HB2 1 1 16 10604 1 1 11 SER HB3 H 5.807 -8.523 10.526 1.00 . A A . 11 SER HB3 1 1 16 10605 1 1 11 SER HG H 3.154 -8.501 11.390 1.00 . A A . 11 SER HG 1 1 16 10606 1 1 11 SER N N 4.787 -6.162 11.999 1.00 . A A . 11 SER N 1 1 16 10607 1 1 11 SER O O 3.126 -5.116 10.130 1.00 . A A . 11 SER O 1 1 16 10608 1 1 11 SER OG O 4.079 -8.472 11.646 1.00 . A A . 11 SER OG 1 1 16 10609 1 1 12 CYS C C 1.696 -6.037 7.635 1.00 . A A . 12 CYS C 1 1 16 10610 1 1 12 CYS CA C 3.091 -5.436 7.451 1.00 . A A . 12 CYS CA 1 1 16 10611 1 1 12 CYS CB C 3.621 -5.753 6.053 1.00 . A A . 12 CYS CB 1 1 16 10612 1 1 12 CYS H H 4.762 -6.664 8.040 1.00 . A A . 12 CYS H 1 1 16 10613 1 1 12 CYS HA H 3.066 -4.370 7.603 1.00 . A A . 12 CYS HA 1 1 16 10614 1 1 12 CYS HB2 H 2.910 -5.412 5.315 1.00 . A A . 12 CYS HB2 1 1 16 10615 1 1 12 CYS HB3 H 4.565 -5.251 5.904 1.00 . A A . 12 CYS HB3 1 1 16 10616 1 1 12 CYS N N 4.062 -6.074 8.388 1.00 . A A . 12 CYS N 1 1 16 10617 1 1 12 CYS O O 0.736 -5.599 7.031 1.00 . A A . 12 CYS O 1 1 16 10618 1 1 12 CYS SG S 3.855 -7.542 5.886 1.00 . A A . 12 CYS SG 1 1 16 10619 1 1 13 SER C C -0.768 -6.644 9.179 1.00 . A A . 13 SER C 1 1 16 10620 1 1 13 SER CA C 0.242 -7.673 8.664 1.00 . A A . 13 SER CA 1 1 16 10621 1 1 13 SER CB C 0.481 -8.758 9.712 1.00 . A A . 13 SER CB 1 1 16 10622 1 1 13 SER H H 2.361 -7.386 8.930 1.00 . A A . 13 SER H 1 1 16 10623 1 1 13 SER HA H -0.109 -8.116 7.748 1.00 . A A . 13 SER HA 1 1 16 10624 1 1 13 SER HB2 H 0.797 -8.305 10.636 1.00 . A A . 13 SER HB2 1 1 16 10625 1 1 13 SER HB3 H -0.439 -9.306 9.877 1.00 . A A . 13 SER HB3 1 1 16 10626 1 1 13 SER HG H 1.450 -9.672 8.293 1.00 . A A . 13 SER HG 1 1 16 10627 1 1 13 SER N N 1.576 -7.042 8.457 1.00 . A A . 13 SER N 1 1 16 10628 1 1 13 SER O O -1.768 -6.378 8.547 1.00 . A A . 13 SER O 1 1 16 10629 1 1 13 SER OG O 1.497 -9.639 9.252 1.00 . A A . 13 SER OG 1 1 16 10630 1 1 14 GLN C C -1.375 -3.752 10.072 1.00 . A A . 14 GLN C 1 1 16 10631 1 1 14 GLN CA C -1.468 -5.054 10.864 1.00 . A A . 14 GLN CA 1 1 16 10632 1 1 14 GLN CB C -1.025 -4.823 12.309 1.00 . A A . 14 GLN CB 1 1 16 10633 1 1 14 GLN CD C -2.927 -5.207 13.883 1.00 . A A . 14 GLN CD 1 1 16 10634 1 1 14 GLN CG C -2.158 -4.151 13.088 1.00 . A A . 14 GLN CG 1 1 16 10635 1 1 14 GLN H H 0.299 -6.288 10.815 1.00 . A A . 14 GLN H 1 1 16 10636 1 1 14 GLN HA H -2.476 -5.437 10.844 1.00 . A A . 14 GLN HA 1 1 16 10637 1 1 14 GLN HB2 H -0.781 -5.769 12.767 1.00 . A A . 14 GLN HB2 1 1 16 10638 1 1 14 GLN HB3 H -0.155 -4.182 12.319 1.00 . A A . 14 GLN HB3 1 1 16 10639 1 1 14 GLN HE21 H -4.155 -3.886 14.714 1.00 . A A . 14 GLN HE21 1 1 16 10640 1 1 14 GLN HE22 H -4.414 -5.502 15.165 1.00 . A A . 14 GLN HE22 1 1 16 10641 1 1 14 GLN HG2 H -1.745 -3.419 13.766 1.00 . A A . 14 GLN HG2 1 1 16 10642 1 1 14 GLN HG3 H -2.830 -3.664 12.397 1.00 . A A . 14 GLN HG3 1 1 16 10643 1 1 14 GLN N N -0.515 -6.063 10.319 1.00 . A A . 14 GLN N 1 1 16 10644 1 1 14 GLN NE2 N -3.914 -4.834 14.651 1.00 . A A . 14 GLN NE2 1 1 16 10645 1 1 14 GLN O O -2.358 -3.076 9.845 1.00 . A A . 14 GLN O 1 1 16 10646 1 1 14 GLN OE1 O -2.627 -6.381 13.807 1.00 . A A . 14 GLN OE1 1 1 16 10647 1 1 15 CYS C C -1.022 -2.081 7.725 1.00 . A A . 15 CYS C 1 1 16 10648 1 1 15 CYS CA C -0.030 -2.125 8.888 1.00 . A A . 15 CYS CA 1 1 16 10649 1 1 15 CYS CB C 1.408 -2.160 8.372 1.00 . A A . 15 CYS CB 1 1 16 10650 1 1 15 CYS H H 0.589 -3.947 9.854 1.00 . A A . 15 CYS H 1 1 16 10651 1 1 15 CYS HA H -0.168 -1.272 9.534 1.00 . A A . 15 CYS HA 1 1 16 10652 1 1 15 CYS HB2 H 1.774 -3.175 8.402 1.00 . A A . 15 CYS HB2 1 1 16 10653 1 1 15 CYS HB3 H 1.435 -1.794 7.357 1.00 . A A . 15 CYS HB3 1 1 16 10654 1 1 15 CYS N N -0.193 -3.390 9.656 1.00 . A A . 15 CYS N 1 1 16 10655 1 1 15 CYS O O -1.503 -1.032 7.346 1.00 . A A . 15 CYS O 1 1 16 10656 1 1 15 CYS SG S 2.448 -1.112 9.419 1.00 . A A . 15 CYS SG 1 1 16 10657 1 1 16 LEU C C -3.604 -3.906 6.421 1.00 . A A . 16 LEU C 1 1 16 10658 1 1 16 LEU CA C -2.291 -3.225 6.015 1.00 . A A . 16 LEU CA 1 1 16 10659 1 1 16 LEU CB C -1.578 -4.005 4.913 1.00 . A A . 16 LEU CB 1 1 16 10660 1 1 16 LEU CD1 C 0.572 -2.794 5.316 1.00 . A A . 16 LEU CD1 1 1 16 10661 1 1 16 LEU CD2 C 0.133 -3.839 3.102 1.00 . A A . 16 LEU CD2 1 1 16 10662 1 1 16 LEU CG C -0.506 -3.113 4.282 1.00 . A A . 16 LEU CG 1 1 16 10663 1 1 16 LEU H H -0.930 -4.048 7.470 1.00 . A A . 16 LEU H 1 1 16 10664 1 1 16 LEU HA H -2.483 -2.219 5.682 1.00 . A A . 16 LEU HA 1 1 16 10665 1 1 16 LEU HB2 H -1.116 -4.887 5.335 1.00 . A A . 16 LEU HB2 1 1 16 10666 1 1 16 LEU HB3 H -2.292 -4.298 4.157 1.00 . A A . 16 LEU HB3 1 1 16 10667 1 1 16 LEU HD11 H 0.362 -1.838 5.771 1.00 . A A . 16 LEU HD11 1 1 16 10668 1 1 16 LEU HD12 H 1.536 -2.756 4.829 1.00 . A A . 16 LEU HD12 1 1 16 10669 1 1 16 LEU HD13 H 0.581 -3.561 6.075 1.00 . A A . 16 LEU HD13 1 1 16 10670 1 1 16 LEU HD21 H -0.625 -4.390 2.575 1.00 . A A . 16 LEU HD21 1 1 16 10671 1 1 16 LEU HD22 H 0.889 -4.521 3.463 1.00 . A A . 16 LEU HD22 1 1 16 10672 1 1 16 LEU HD23 H 0.584 -3.119 2.436 1.00 . A A . 16 LEU HD23 1 1 16 10673 1 1 16 LEU HG H -0.959 -2.194 3.939 1.00 . A A . 16 LEU HG 1 1 16 10674 1 1 16 LEU N N -1.330 -3.212 7.153 1.00 . A A . 16 LEU N 1 1 16 10675 1 1 16 LEU O O -4.551 -3.944 5.663 1.00 . A A . 16 LEU O 1 1 16 10676 1 1 17 SER C C -5.842 -4.084 8.757 1.00 . A A . 17 SER C 1 1 16 10677 1 1 17 SER CA C -4.935 -5.099 8.061 1.00 . A A . 17 SER CA 1 1 16 10678 1 1 17 SER CB C -4.504 -6.179 9.050 1.00 . A A . 17 SER CB 1 1 16 10679 1 1 17 SER H H -2.903 -4.391 8.218 1.00 . A A . 17 SER H 1 1 16 10680 1 1 17 SER HA H -5.445 -5.547 7.222 1.00 . A A . 17 SER HA 1 1 16 10681 1 1 17 SER HB2 H -3.782 -6.825 8.587 1.00 . A A . 17 SER HB2 1 1 16 10682 1 1 17 SER HB3 H -4.062 -5.710 9.919 1.00 . A A . 17 SER HB3 1 1 16 10683 1 1 17 SER HG H -6.282 -6.900 8.725 1.00 . A A . 17 SER HG 1 1 16 10684 1 1 17 SER N N -3.673 -4.436 7.616 1.00 . A A . 17 SER N 1 1 16 10685 1 1 17 SER O O -6.998 -4.347 9.025 1.00 . A A . 17 SER O 1 1 16 10686 1 1 17 SER OG O -5.637 -6.945 9.433 1.00 . A A . 17 SER OG 1 1 16 10687 1 1 18 ALA C C -5.784 -0.504 9.213 1.00 . A A . 18 ALA C 1 1 16 10688 1 1 18 ALA CA C -6.152 -1.893 9.741 1.00 . A A . 18 ALA CA 1 1 16 10689 1 1 18 ALA CB C -5.795 -2.027 11.222 1.00 . A A . 18 ALA CB 1 1 16 10690 1 1 18 ALA H H -4.388 -2.734 8.841 1.00 . A A . 18 ALA H 1 1 16 10691 1 1 18 ALA HA H -7.201 -2.090 9.593 1.00 . A A . 18 ALA HA 1 1 16 10692 1 1 18 ALA HB1 H -6.222 -2.938 11.615 1.00 . A A . 18 ALA HB1 1 1 16 10693 1 1 18 ALA HB2 H -6.186 -1.181 11.766 1.00 . A A . 18 ALA HB2 1 1 16 10694 1 1 18 ALA HB3 H -4.720 -2.060 11.332 1.00 . A A . 18 ALA HB3 1 1 16 10695 1 1 18 ALA N N -5.324 -2.924 9.058 1.00 . A A . 18 ALA N 1 1 16 10696 1 1 18 ALA O O -5.179 0.289 9.905 1.00 . A A . 18 ALA O 1 1 16 10697 1 1 19 PRO C C -6.769 2.187 7.829 1.00 . A A . 19 PRO C 1 1 16 10698 1 1 19 PRO CA C -5.882 1.026 7.320 1.00 . A A . 19 PRO CA 1 1 16 10699 1 1 19 PRO CB C -6.153 0.742 5.845 1.00 . A A . 19 PRO CB 1 1 16 10700 1 1 19 PRO CD C -6.898 -1.191 7.102 1.00 . A A . 19 PRO CD 1 1 16 10701 1 1 19 PRO CG C -7.106 -0.410 5.827 1.00 . A A . 19 PRO CG 1 1 16 10702 1 1 19 PRO HA H -4.843 1.279 7.443 1.00 . A A . 19 PRO HA 1 1 16 10703 1 1 19 PRO HB2 H -6.600 1.607 5.375 1.00 . A A . 19 PRO HB2 1 1 16 10704 1 1 19 PRO HB3 H -5.238 0.471 5.341 1.00 . A A . 19 PRO HB3 1 1 16 10705 1 1 19 PRO HD2 H -7.850 -1.463 7.536 1.00 . A A . 19 PRO HD2 1 1 16 10706 1 1 19 PRO HD3 H -6.303 -2.071 6.912 1.00 . A A . 19 PRO HD3 1 1 16 10707 1 1 19 PRO HG2 H -8.121 -0.046 5.773 1.00 . A A . 19 PRO HG2 1 1 16 10708 1 1 19 PRO HG3 H -6.899 -1.044 4.978 1.00 . A A . 19 PRO HG3 1 1 16 10709 1 1 19 PRO N N -6.169 -0.269 7.983 1.00 . A A . 19 PRO N 1 1 16 10710 1 1 19 PRO O O -6.345 3.325 7.770 1.00 . A A . 19 PRO O 1 1 16 10711 1 1 20 PRO C C -8.348 3.555 10.115 1.00 . A A . 20 PRO C 1 1 16 10712 1 1 20 PRO CA C -8.846 2.998 8.777 1.00 . A A . 20 PRO CA 1 1 16 10713 1 1 20 PRO CB C -10.210 2.334 8.931 1.00 . A A . 20 PRO CB 1 1 16 10714 1 1 20 PRO CD C -8.616 0.585 8.434 1.00 . A A . 20 PRO CD 1 1 16 10715 1 1 20 PRO CG C -9.920 0.884 9.131 1.00 . A A . 20 PRO CG 1 1 16 10716 1 1 20 PRO HA H -8.902 3.783 8.041 1.00 . A A . 20 PRO HA 1 1 16 10717 1 1 20 PRO HB2 H -10.727 2.738 9.792 1.00 . A A . 20 PRO HB2 1 1 16 10718 1 1 20 PRO HB3 H -10.801 2.473 8.039 1.00 . A A . 20 PRO HB3 1 1 16 10719 1 1 20 PRO HD2 H -8.023 -0.076 9.043 1.00 . A A . 20 PRO HD2 1 1 16 10720 1 1 20 PRO HD3 H -8.795 0.154 7.465 1.00 . A A . 20 PRO HD3 1 1 16 10721 1 1 20 PRO HG2 H -9.834 0.668 10.186 1.00 . A A . 20 PRO HG2 1 1 16 10722 1 1 20 PRO HG3 H -10.707 0.287 8.696 1.00 . A A . 20 PRO HG3 1 1 16 10723 1 1 20 PRO N N -7.967 1.900 8.298 1.00 . A A . 20 PRO N 1 1 16 10724 1 1 20 PRO O O -8.477 4.730 10.391 1.00 . A A . 20 PRO O 1 1 16 10725 1 1 21 PHE C C -5.813 3.664 12.125 1.00 . A A . 21 PHE C 1 1 16 10726 1 1 21 PHE CA C -7.272 3.227 12.259 1.00 . A A . 21 PHE CA 1 1 16 10727 1 1 21 PHE CB C -7.384 2.040 13.213 1.00 . A A . 21 PHE CB 1 1 16 10728 1 1 21 PHE CD1 C -9.871 2.107 12.809 1.00 . A A . 21 PHE CD1 1 1 16 10729 1 1 21 PHE CD2 C -8.781 -0.048 13.035 1.00 . A A . 21 PHE CD2 1 1 16 10730 1 1 21 PHE CE1 C -11.100 1.466 12.625 1.00 . A A . 21 PHE CE1 1 1 16 10731 1 1 21 PHE CE2 C -10.011 -0.688 12.850 1.00 . A A . 21 PHE CE2 1 1 16 10732 1 1 21 PHE CG C -8.711 1.350 13.014 1.00 . A A . 21 PHE CG 1 1 16 10733 1 1 21 PHE CZ C -11.171 0.067 12.644 1.00 . A A . 21 PHE CZ 1 1 16 10734 1 1 21 PHE H H -7.677 1.783 10.707 1.00 . A A . 21 PHE H 1 1 16 10735 1 1 21 PHE HA H -7.881 4.044 12.611 1.00 . A A . 21 PHE HA 1 1 16 10736 1 1 21 PHE HB2 H -6.584 1.343 13.016 1.00 . A A . 21 PHE HB2 1 1 16 10737 1 1 21 PHE HB3 H -7.311 2.390 14.233 1.00 . A A . 21 PHE HB3 1 1 16 10738 1 1 21 PHE HD1 H -9.815 3.185 12.793 1.00 . A A . 21 PHE HD1 1 1 16 10739 1 1 21 PHE HD2 H -7.887 -0.631 13.193 1.00 . A A . 21 PHE HD2 1 1 16 10740 1 1 21 PHE HE1 H -11.995 2.050 12.465 1.00 . A A . 21 PHE HE1 1 1 16 10741 1 1 21 PHE HE2 H -10.066 -1.768 12.865 1.00 . A A . 21 PHE HE2 1 1 16 10742 1 1 21 PHE HZ H -12.120 -0.427 12.502 1.00 . A A . 21 PHE HZ 1 1 16 10743 1 1 21 PHE N N -7.777 2.727 10.945 1.00 . A A . 21 PHE N 1 1 16 10744 1 1 21 PHE O O -5.122 3.861 13.104 1.00 . A A . 21 PHE O 1 1 16 10745 1 1 22 VAL C C -3.797 5.180 9.530 1.00 . A A . 22 VAL C 1 1 16 10746 1 1 22 VAL CA C -3.922 4.230 10.727 1.00 . A A . 22 VAL CA 1 1 16 10747 1 1 22 VAL CB C -3.167 2.929 10.468 1.00 . A A . 22 VAL CB 1 1 16 10748 1 1 22 VAL CG1 C -3.443 1.945 11.608 1.00 . A A . 22 VAL CG1 1 1 16 10749 1 1 22 VAL CG2 C -3.637 2.319 9.147 1.00 . A A . 22 VAL CG2 1 1 16 10750 1 1 22 VAL H H -5.911 3.645 10.142 1.00 . A A . 22 VAL H 1 1 16 10751 1 1 22 VAL HA H -3.545 4.701 11.621 1.00 . A A . 22 VAL HA 1 1 16 10752 1 1 22 VAL HB H -2.112 3.132 10.418 1.00 . A A . 22 VAL HB 1 1 16 10753 1 1 22 VAL HG11 H -2.905 1.025 11.428 1.00 . A A . 22 VAL HG11 1 1 16 10754 1 1 22 VAL HG12 H -4.503 1.739 11.658 1.00 . A A . 22 VAL HG12 1 1 16 10755 1 1 22 VAL HG13 H -3.117 2.376 12.542 1.00 . A A . 22 VAL HG13 1 1 16 10756 1 1 22 VAL HG21 H -3.470 1.252 9.164 1.00 . A A . 22 VAL HG21 1 1 16 10757 1 1 22 VAL HG22 H -3.083 2.756 8.331 1.00 . A A . 22 VAL HG22 1 1 16 10758 1 1 22 VAL HG23 H -4.690 2.516 9.013 1.00 . A A . 22 VAL HG23 1 1 16 10759 1 1 22 VAL N N -5.338 3.813 10.919 1.00 . A A . 22 VAL N 1 1 16 10760 1 1 22 VAL O O -4.780 5.668 9.007 1.00 . A A . 22 VAL O 1 1 16 10761 1 1 23 GLN C C -1.134 6.000 7.168 1.00 . A A . 23 GLN C 1 1 16 10762 1 1 23 GLN CA C -2.404 6.378 7.943 1.00 . A A . 23 GLN CA 1 1 16 10763 1 1 23 GLN CB C -2.277 7.768 8.580 1.00 . A A . 23 GLN CB 1 1 16 10764 1 1 23 GLN CD C -1.961 10.145 7.867 1.00 . A A . 23 GLN CD 1 1 16 10765 1 1 23 GLN CG C -1.483 8.706 7.663 1.00 . A A . 23 GLN CG 1 1 16 10766 1 1 23 GLN H H -1.815 5.054 9.539 1.00 . A A . 23 GLN H 1 1 16 10767 1 1 23 GLN HA H -3.264 6.347 7.293 1.00 . A A . 23 GLN HA 1 1 16 10768 1 1 23 GLN HB2 H -3.265 8.177 8.738 1.00 . A A . 23 GLN HB2 1 1 16 10769 1 1 23 GLN HB3 H -1.770 7.682 9.529 1.00 . A A . 23 GLN HB3 1 1 16 10770 1 1 23 GLN HE21 H -3.741 9.822 7.049 1.00 . A A . 23 GLN HE21 1 1 16 10771 1 1 23 GLN HE22 H -3.471 11.407 7.595 1.00 . A A . 23 GLN HE22 1 1 16 10772 1 1 23 GLN HG2 H -0.432 8.637 7.904 1.00 . A A . 23 GLN HG2 1 1 16 10773 1 1 23 GLN HG3 H -1.636 8.420 6.633 1.00 . A A . 23 GLN HG3 1 1 16 10774 1 1 23 GLN N N -2.595 5.453 9.099 1.00 . A A . 23 GLN N 1 1 16 10775 1 1 23 GLN NE2 N -3.157 10.487 7.471 1.00 . A A . 23 GLN NE2 1 1 16 10776 1 1 23 GLN O O -1.095 6.065 5.955 1.00 . A A . 23 GLN O 1 1 16 10777 1 1 23 GLN OE1 O -1.238 10.969 8.391 1.00 . A A . 23 GLN OE1 1 1 16 10778 1 1 24 CYS C C 0.935 3.976 6.299 1.00 . A A . 24 CYS C 1 1 16 10779 1 1 24 CYS CA C 1.164 5.228 7.160 1.00 . A A . 24 CYS CA 1 1 16 10780 1 1 24 CYS CB C 2.174 4.962 8.293 1.00 . A A . 24 CYS CB 1 1 16 10781 1 1 24 CYS H H -0.151 5.563 8.837 1.00 . A A . 24 CYS H 1 1 16 10782 1 1 24 CYS HA H 1.509 6.045 6.545 1.00 . A A . 24 CYS HA 1 1 16 10783 1 1 24 CYS HB2 H 3.178 5.129 7.934 1.00 . A A . 24 CYS HB2 1 1 16 10784 1 1 24 CYS HB3 H 1.974 5.638 9.111 1.00 . A A . 24 CYS HB3 1 1 16 10785 1 1 24 CYS N N -0.099 5.608 7.859 1.00 . A A . 24 CYS N 1 1 16 10786 1 1 24 CYS O O -0.125 3.382 6.316 1.00 . A A . 24 CYS O 1 1 16 10787 1 1 24 CYS SG S 2.028 3.254 8.884 1.00 . A A . 24 CYS SG 1 1 16 10788 1 1 25 GLY C C 3.116 1.632 4.627 1.00 . A A . 25 GLY C 1 1 16 10789 1 1 25 GLY CA C 1.776 2.368 4.688 1.00 . A A . 25 GLY CA 1 1 16 10790 1 1 25 GLY H H 2.769 4.072 5.555 1.00 . A A . 25 GLY H 1 1 16 10791 1 1 25 GLY HA2 H 1.022 1.715 5.105 1.00 . A A . 25 GLY HA2 1 1 16 10792 1 1 25 GLY HA3 H 1.487 2.666 3.692 1.00 . A A . 25 GLY HA3 1 1 16 10793 1 1 25 GLY N N 1.923 3.576 5.550 1.00 . A A . 25 GLY N 1 1 16 10794 1 1 25 GLY O O 4.082 2.047 5.228 1.00 . A A . 25 GLY O 1 1 16 10795 1 1 26 TRP C C 5.298 0.407 2.651 1.00 . A A . 26 TRP C 1 1 16 10796 1 1 26 TRP CA C 4.490 -0.184 3.808 1.00 . A A . 26 TRP CA 1 1 16 10797 1 1 26 TRP CB C 4.098 -1.638 3.527 1.00 . A A . 26 TRP CB 1 1 16 10798 1 1 26 TRP CD1 C 6.071 -3.143 3.029 1.00 . A A . 26 TRP CD1 1 1 16 10799 1 1 26 TRP CD2 C 5.605 -3.026 5.226 1.00 . A A . 26 TRP CD2 1 1 16 10800 1 1 26 TRP CE2 C 6.709 -3.898 5.091 1.00 . A A . 26 TRP CE2 1 1 16 10801 1 1 26 TRP CE3 C 5.109 -2.779 6.517 1.00 . A A . 26 TRP CE3 1 1 16 10802 1 1 26 TRP CG C 5.217 -2.560 3.902 1.00 . A A . 26 TRP CG 1 1 16 10803 1 1 26 TRP CH2 C 6.795 -4.249 7.476 1.00 . A A . 26 TRP CH2 1 1 16 10804 1 1 26 TRP CZ2 C 7.300 -4.505 6.200 1.00 . A A . 26 TRP CZ2 1 1 16 10805 1 1 26 TRP CZ3 C 5.702 -3.387 7.635 1.00 . A A . 26 TRP CZ3 1 1 16 10806 1 1 26 TRP H H 2.408 0.229 3.410 1.00 . A A . 26 TRP H 1 1 16 10807 1 1 26 TRP HA H 5.036 -0.113 4.735 1.00 . A A . 26 TRP HA 1 1 16 10808 1 1 26 TRP HB2 H 3.224 -1.889 4.105 1.00 . A A . 26 TRP HB2 1 1 16 10809 1 1 26 TRP HB3 H 3.877 -1.754 2.480 1.00 . A A . 26 TRP HB3 1 1 16 10810 1 1 26 TRP HD1 H 6.064 -3.010 1.956 1.00 . A A . 26 TRP HD1 1 1 16 10811 1 1 26 TRP HE1 H 7.679 -4.470 3.338 1.00 . A A . 26 TRP HE1 1 1 16 10812 1 1 26 TRP HE3 H 4.271 -2.114 6.648 1.00 . A A . 26 TRP HE3 1 1 16 10813 1 1 26 TRP HH2 H 7.248 -4.714 8.339 1.00 . A A . 26 TRP HH2 1 1 16 10814 1 1 26 TRP HZ2 H 8.143 -5.168 6.071 1.00 . A A . 26 TRP HZ2 1 1 16 10815 1 1 26 TRP HZ3 H 5.311 -3.191 8.623 1.00 . A A . 26 TRP HZ3 1 1 16 10816 1 1 26 TRP N N 3.194 0.552 3.899 1.00 . A A . 26 TRP N 1 1 16 10817 1 1 26 TRP NE1 N 6.958 -3.938 3.734 1.00 . A A . 26 TRP NE1 1 1 16 10818 1 1 26 TRP O O 4.756 0.749 1.617 1.00 . A A . 26 TRP O 1 1 16 10819 1 1 27 CYS C C 8.733 0.493 1.550 1.00 . A A . 27 CYS C 1 1 16 10820 1 1 27 CYS CA C 7.385 1.198 1.734 1.00 . A A . 27 CYS CA 1 1 16 10821 1 1 27 CYS CB C 7.596 2.627 2.224 1.00 . A A . 27 CYS CB 1 1 16 10822 1 1 27 CYS H H 7.004 0.332 3.674 1.00 . A A . 27 CYS H 1 1 16 10823 1 1 27 CYS HA H 6.832 1.207 0.811 1.00 . A A . 27 CYS HA 1 1 16 10824 1 1 27 CYS HB2 H 6.785 2.891 2.886 1.00 . A A . 27 CYS HB2 1 1 16 10825 1 1 27 CYS HB3 H 8.531 2.690 2.761 1.00 . A A . 27 CYS HB3 1 1 16 10826 1 1 27 CYS N N 6.581 0.578 2.824 1.00 . A A . 27 CYS N 1 1 16 10827 1 1 27 CYS O O 9.692 0.762 2.246 1.00 . A A . 27 CYS O 1 1 16 10828 1 1 27 CYS SG S 7.623 3.782 0.831 1.00 . A A . 27 CYS SG 1 1 16 10829 1 1 28 HIS C C 10.640 -1.904 1.492 1.00 . A A . 28 HIS C 1 1 16 10830 1 1 28 HIS CA C 10.096 -1.099 0.296 1.00 . A A . 28 HIS CA 1 1 16 10831 1 1 28 HIS CB C 11.077 0.011 -0.082 1.00 . A A . 28 HIS CB 1 1 16 10832 1 1 28 HIS CD2 C 13.360 -0.365 -1.329 1.00 . A A . 28 HIS CD2 1 1 16 10833 1 1 28 HIS CE1 C 12.616 -1.515 -3.008 1.00 . A A . 28 HIS CE1 1 1 16 10834 1 1 28 HIS CG C 12.002 -0.486 -1.157 1.00 . A A . 28 HIS CG 1 1 16 10835 1 1 28 HIS H H 8.029 -0.556 0.027 1.00 . A A . 28 HIS H 1 1 16 10836 1 1 28 HIS HA H 9.963 -1.752 -0.552 1.00 . A A . 28 HIS HA 1 1 16 10837 1 1 28 HIS HB2 H 10.529 0.868 -0.445 1.00 . A A . 28 HIS HB2 1 1 16 10838 1 1 28 HIS HB3 H 11.653 0.292 0.787 1.00 . A A . 28 HIS HB3 1 1 16 10839 1 1 28 HIS HD1 H 10.622 -1.482 -2.417 1.00 . A A . 28 HIS HD1 1 1 16 10840 1 1 28 HIS HD2 H 14.027 0.156 -0.659 1.00 . A A . 28 HIS HD2 1 1 16 10841 1 1 28 HIS HE1 H 12.566 -2.085 -3.924 1.00 . A A . 28 HIS HE1 1 1 16 10842 1 1 28 HIS N N 8.814 -0.383 0.587 1.00 . A A . 28 HIS N 1 1 16 10843 1 1 28 HIS ND1 N 11.550 -1.223 -2.241 1.00 . A A . 28 HIS ND1 1 1 16 10844 1 1 28 HIS NE2 N 13.745 -1.016 -2.497 1.00 . A A . 28 HIS NE2 1 1 16 10845 1 1 28 HIS O O 11.626 -2.600 1.350 1.00 . A A . 28 HIS O 1 1 16 10846 1 1 29 ASP C C 9.924 -2.242 5.128 1.00 . A A . 29 ASP C 1 1 16 10847 1 1 29 ASP CA C 10.592 -2.632 3.805 1.00 . A A . 29 ASP CA 1 1 16 10848 1 1 29 ASP CB C 12.087 -2.294 3.860 1.00 . A A . 29 ASP CB 1 1 16 10849 1 1 29 ASP CG C 12.300 -0.810 3.547 1.00 . A A . 29 ASP CG 1 1 16 10850 1 1 29 ASP H H 9.247 -1.289 2.781 1.00 . A A . 29 ASP H 1 1 16 10851 1 1 29 ASP HA H 10.467 -3.687 3.621 1.00 . A A . 29 ASP HA 1 1 16 10852 1 1 29 ASP HB2 H 12.464 -2.507 4.850 1.00 . A A . 29 ASP HB2 1 1 16 10853 1 1 29 ASP HB3 H 12.621 -2.894 3.138 1.00 . A A . 29 ASP HB3 1 1 16 10854 1 1 29 ASP N N 10.042 -1.839 2.658 1.00 . A A . 29 ASP N 1 1 16 10855 1 1 29 ASP O O 9.361 -3.070 5.813 1.00 . A A . 29 ASP O 1 1 16 10856 1 1 29 ASP OD1 O 12.068 0.001 4.429 1.00 . A A . 29 ASP OD1 1 1 16 10857 1 1 29 ASP OD2 O 12.689 -0.510 2.430 1.00 . A A . 29 ASP OD2 1 1 16 10858 1 1 30 LYS C C 8.017 0.053 6.578 1.00 . A A . 30 LYS C 1 1 16 10859 1 1 30 LYS CA C 9.391 -0.572 6.806 1.00 . A A . 30 LYS CA 1 1 16 10860 1 1 30 LYS CB C 10.365 0.463 7.374 1.00 . A A . 30 LYS CB 1 1 16 10861 1 1 30 LYS CD C 9.806 -0.058 9.758 1.00 . A A . 30 LYS CD 1 1 16 10862 1 1 30 LYS CE C 9.961 0.586 11.138 1.00 . A A . 30 LYS CE 1 1 16 10863 1 1 30 LYS CG C 9.817 1.033 8.685 1.00 . A A . 30 LYS CG 1 1 16 10864 1 1 30 LYS H H 10.479 -0.343 4.954 1.00 . A A . 30 LYS H 1 1 16 10865 1 1 30 LYS HA H 9.312 -1.412 7.477 1.00 . A A . 30 LYS HA 1 1 16 10866 1 1 30 LYS HB2 H 11.320 -0.007 7.557 1.00 . A A . 30 LYS HB2 1 1 16 10867 1 1 30 LYS HB3 H 10.491 1.265 6.662 1.00 . A A . 30 LYS HB3 1 1 16 10868 1 1 30 LYS HD2 H 8.870 -0.596 9.714 1.00 . A A . 30 LYS HD2 1 1 16 10869 1 1 30 LYS HD3 H 10.624 -0.741 9.586 1.00 . A A . 30 LYS HD3 1 1 16 10870 1 1 30 LYS HE2 H 10.926 1.069 11.221 1.00 . A A . 30 LYS HE2 1 1 16 10871 1 1 30 LYS HE3 H 9.168 1.294 11.315 1.00 . A A . 30 LYS HE3 1 1 16 10872 1 1 30 LYS HG2 H 10.446 1.849 9.010 1.00 . A A . 30 LYS HG2 1 1 16 10873 1 1 30 LYS HG3 H 8.813 1.394 8.529 1.00 . A A . 30 LYS HG3 1 1 16 10874 1 1 30 LYS HZ1 H 9.886 -0.176 13.074 1.00 . A A . 30 LYS HZ1 1 1 16 10875 1 1 30 LYS HZ2 H 10.657 -1.198 11.958 1.00 . A A . 30 LYS HZ2 1 1 16 10876 1 1 30 LYS HZ3 H 8.965 -1.052 11.952 1.00 . A A . 30 LYS HZ3 1 1 16 10877 1 1 30 LYS N N 10.004 -0.996 5.509 1.00 . A A . 30 LYS N 1 1 16 10878 1 1 30 LYS NZ N 9.859 -0.545 12.104 1.00 . A A . 30 LYS NZ 1 1 16 10879 1 1 30 LYS O O 7.660 0.415 5.473 1.00 . A A . 30 LYS O 1 1 16 10880 1 1 31 CYS C C 5.960 2.304 7.600 1.00 . A A . 31 CYS C 1 1 16 10881 1 1 31 CYS CA C 5.887 0.782 7.467 1.00 . A A . 31 CYS CA 1 1 16 10882 1 1 31 CYS CB C 5.056 0.186 8.603 1.00 . A A . 31 CYS CB 1 1 16 10883 1 1 31 CYS H H 7.546 -0.117 8.500 1.00 . A A . 31 CYS H 1 1 16 10884 1 1 31 CYS HA H 5.459 0.507 6.517 1.00 . A A . 31 CYS HA 1 1 16 10885 1 1 31 CYS HB2 H 5.382 -0.825 8.799 1.00 . A A . 31 CYS HB2 1 1 16 10886 1 1 31 CYS HB3 H 5.181 0.784 9.494 1.00 . A A . 31 CYS HB3 1 1 16 10887 1 1 31 CYS N N 7.239 0.182 7.620 1.00 . A A . 31 CYS N 1 1 16 10888 1 1 31 CYS O O 6.078 2.845 8.682 1.00 . A A . 31 CYS O 1 1 16 10889 1 1 31 CYS SG S 3.310 0.175 8.125 1.00 . A A . 31 CYS SG 1 1 16 10890 1 1 32 VAL C C 5.032 5.020 5.401 1.00 . A A . 32 VAL C 1 1 16 10891 1 1 32 VAL CA C 5.911 4.481 6.530 1.00 . A A . 32 VAL CA 1 1 16 10892 1 1 32 VAL CB C 7.381 4.849 6.309 1.00 . A A . 32 VAL CB 1 1 16 10893 1 1 32 VAL CG1 C 8.269 3.951 7.172 1.00 . A A . 32 VAL CG1 1 1 16 10894 1 1 32 VAL CG2 C 7.741 4.650 4.834 1.00 . A A . 32 VAL CG2 1 1 16 10895 1 1 32 VAL H H 5.762 2.530 5.645 1.00 . A A . 32 VAL H 1 1 16 10896 1 1 32 VAL HA H 5.572 4.850 7.486 1.00 . A A . 32 VAL HA 1 1 16 10897 1 1 32 VAL HB H 7.538 5.882 6.584 1.00 . A A . 32 VAL HB 1 1 16 10898 1 1 32 VAL HG11 H 7.882 3.924 8.181 1.00 . A A . 32 VAL HG11 1 1 16 10899 1 1 32 VAL HG12 H 9.276 4.345 7.184 1.00 . A A . 32 VAL HG12 1 1 16 10900 1 1 32 VAL HG13 H 8.279 2.952 6.763 1.00 . A A . 32 VAL HG13 1 1 16 10901 1 1 32 VAL HG21 H 8.804 4.491 4.741 1.00 . A A . 32 VAL HG21 1 1 16 10902 1 1 32 VAL HG22 H 7.457 5.529 4.273 1.00 . A A . 32 VAL HG22 1 1 16 10903 1 1 32 VAL HG23 H 7.212 3.791 4.449 1.00 . A A . 32 VAL HG23 1 1 16 10904 1 1 32 VAL N N 5.871 2.994 6.500 1.00 . A A . 32 VAL N 1 1 16 10905 1 1 32 VAL O O 4.513 4.265 4.601 1.00 . A A . 32 VAL O 1 1 16 10906 1 1 33 ARG C C 4.810 7.796 3.329 1.00 . A A . 33 ARG C 1 1 16 10907 1 1 33 ARG CA C 4.001 6.856 4.224 1.00 . A A . 33 ARG CA 1 1 16 10908 1 1 33 ARG CB C 2.875 7.611 4.928 1.00 . A A . 33 ARG CB 1 1 16 10909 1 1 33 ARG CD C 0.463 8.230 4.700 1.00 . A A . 33 ARG CD 1 1 16 10910 1 1 33 ARG CG C 1.535 7.213 4.303 1.00 . A A . 33 ARG CG 1 1 16 10911 1 1 33 ARG CZ C -0.316 9.095 2.576 1.00 . A A . 33 ARG CZ 1 1 16 10912 1 1 33 ARG H H 5.275 6.908 5.964 1.00 . A A . 33 ARG H 1 1 16 10913 1 1 33 ARG HA H 3.587 6.052 3.637 1.00 . A A . 33 ARG HA 1 1 16 10914 1 1 33 ARG HB2 H 2.873 7.360 5.979 1.00 . A A . 33 ARG HB2 1 1 16 10915 1 1 33 ARG HB3 H 3.022 8.674 4.811 1.00 . A A . 33 ARG HB3 1 1 16 10916 1 1 33 ARG HD2 H -0.039 7.913 5.605 1.00 . A A . 33 ARG HD2 1 1 16 10917 1 1 33 ARG HD3 H 0.901 9.206 4.832 1.00 . A A . 33 ARG HD3 1 1 16 10918 1 1 33 ARG HE H -1.248 7.627 3.536 1.00 . A A . 33 ARG HE 1 1 16 10919 1 1 33 ARG HG2 H 1.634 7.193 3.227 1.00 . A A . 33 ARG HG2 1 1 16 10920 1 1 33 ARG HG3 H 1.250 6.234 4.656 1.00 . A A . 33 ARG HG3 1 1 16 10921 1 1 33 ARG HH11 H -1.312 10.580 3.479 1.00 . A A . 33 ARG HH11 1 1 16 10922 1 1 33 ARG HH12 H -0.671 10.952 1.913 1.00 . A A . 33 ARG HH12 1 1 16 10923 1 1 33 ARG HH21 H 0.719 7.810 1.440 1.00 . A A . 33 ARG HH21 1 1 16 10924 1 1 33 ARG HH22 H 0.479 9.384 0.759 1.00 . A A . 33 ARG HH22 1 1 16 10925 1 1 33 ARG N N 4.854 6.307 5.316 1.00 . A A . 33 ARG N 1 1 16 10926 1 1 33 ARG NE N -0.490 8.249 3.555 1.00 . A A . 33 ARG NE 1 1 16 10927 1 1 33 ARG NH1 N -0.804 10.303 2.662 1.00 . A A . 33 ARG NH1 1 1 16 10928 1 1 33 ARG NH2 N 0.345 8.735 1.508 1.00 . A A . 33 ARG NH2 1 1 16 10929 1 1 33 ARG O O 5.962 8.081 3.586 1.00 . A A . 33 ARG O 1 1 16 10930 1 1 34 SER C C 5.784 10.189 2.131 1.00 . A A . 34 SER C 1 1 16 10931 1 1 34 SER CA C 4.932 9.189 1.345 1.00 . A A . 34 SER CA 1 1 16 10932 1 1 34 SER CB C 3.834 9.913 0.569 1.00 . A A . 34 SER CB 1 1 16 10933 1 1 34 SER H H 3.279 8.020 2.088 1.00 . A A . 34 SER H 1 1 16 10934 1 1 34 SER HA H 5.549 8.624 0.664 1.00 . A A . 34 SER HA 1 1 16 10935 1 1 34 SER HB2 H 2.883 9.449 0.767 1.00 . A A . 34 SER HB2 1 1 16 10936 1 1 34 SER HB3 H 3.798 10.948 0.882 1.00 . A A . 34 SER HB3 1 1 16 10937 1 1 34 SER HG H 5.066 9.814 -0.935 1.00 . A A . 34 SER HG 1 1 16 10938 1 1 34 SER N N 4.209 8.272 2.273 1.00 . A A . 34 SER N 1 1 16 10939 1 1 34 SER O O 6.821 10.628 1.675 1.00 . A A . 34 SER O 1 1 16 10940 1 1 34 SER OG O 4.112 9.836 -0.822 1.00 . A A . 34 SER OG 1 1 16 10941 1 1 35 GLU C C 7.517 10.940 4.459 1.00 . A A . 35 GLU C 1 1 16 10942 1 1 35 GLU CA C 6.146 11.527 4.117 1.00 . A A . 35 GLU CA 1 1 16 10943 1 1 35 GLU CB C 5.325 11.748 5.388 1.00 . A A . 35 GLU CB 1 1 16 10944 1 1 35 GLU CD C 5.186 13.185 7.428 1.00 . A A . 35 GLU CD 1 1 16 10945 1 1 35 GLU CG C 5.645 13.126 5.970 1.00 . A A . 35 GLU CG 1 1 16 10946 1 1 35 GLU H H 4.516 10.191 3.660 1.00 . A A . 35 GLU H 1 1 16 10947 1 1 35 GLU HA H 6.256 12.458 3.584 1.00 . A A . 35 GLU HA 1 1 16 10948 1 1 35 GLU HB2 H 4.272 11.690 5.151 1.00 . A A . 35 GLU HB2 1 1 16 10949 1 1 35 GLU HB3 H 5.574 10.987 6.114 1.00 . A A . 35 GLU HB3 1 1 16 10950 1 1 35 GLU HG2 H 6.710 13.299 5.919 1.00 . A A . 35 GLU HG2 1 1 16 10951 1 1 35 GLU HG3 H 5.129 13.886 5.401 1.00 . A A . 35 GLU HG3 1 1 16 10952 1 1 35 GLU N N 5.355 10.555 3.309 1.00 . A A . 35 GLU N 1 1 16 10953 1 1 35 GLU O O 8.470 11.657 4.688 1.00 . A A . 35 GLU O 1 1 16 10954 1 1 35 GLU OE1 O 5.195 12.151 8.074 1.00 . A A . 35 GLU OE1 1 1 16 10955 1 1 35 GLU OE2 O 4.835 14.266 7.874 1.00 . A A . 35 GLU OE2 1 1 16 10956 1 1 36 GLU C C 9.560 8.390 3.577 1.00 . A A . 36 GLU C 1 1 16 10957 1 1 36 GLU CA C 8.933 9.010 4.830 1.00 . A A . 36 GLU CA 1 1 16 10958 1 1 36 GLU CB C 8.599 7.932 5.863 1.00 . A A . 36 GLU CB 1 1 16 10959 1 1 36 GLU CD C 10.156 8.796 7.618 1.00 . A A . 36 GLU CD 1 1 16 10960 1 1 36 GLU CG C 8.691 8.528 7.270 1.00 . A A . 36 GLU CG 1 1 16 10961 1 1 36 GLU H H 6.843 9.079 4.313 1.00 . A A . 36 GLU H 1 1 16 10962 1 1 36 GLU HA H 9.601 9.739 5.263 1.00 . A A . 36 GLU HA 1 1 16 10963 1 1 36 GLU HB2 H 7.598 7.567 5.692 1.00 . A A . 36 GLU HB2 1 1 16 10964 1 1 36 GLU HB3 H 9.301 7.115 5.775 1.00 . A A . 36 GLU HB3 1 1 16 10965 1 1 36 GLU HG2 H 8.136 9.455 7.306 1.00 . A A . 36 GLU HG2 1 1 16 10966 1 1 36 GLU HG3 H 8.276 7.831 7.984 1.00 . A A . 36 GLU HG3 1 1 16 10967 1 1 36 GLU N N 7.624 9.641 4.498 1.00 . A A . 36 GLU N 1 1 16 10968 1 1 36 GLU O O 10.766 8.304 3.454 1.00 . A A . 36 GLU O 1 1 16 10969 1 1 36 GLU OE1 O 11.005 8.485 6.800 1.00 . A A . 36 GLU OE1 1 1 16 10970 1 1 36 GLU OE2 O 10.404 9.309 8.698 1.00 . A A . 36 GLU OE2 1 1 16 10971 1 1 37 CYS C C 9.993 8.442 0.552 1.00 . A A . 37 CYS C 1 1 16 10972 1 1 37 CYS CA C 9.320 7.358 1.398 1.00 . A A . 37 CYS CA 1 1 16 10973 1 1 37 CYS CB C 8.121 6.773 0.649 1.00 . A A . 37 CYS CB 1 1 16 10974 1 1 37 CYS H H 7.786 8.044 2.750 1.00 . A A . 37 CYS H 1 1 16 10975 1 1 37 CYS HA H 10.022 6.576 1.640 1.00 . A A . 37 CYS HA 1 1 16 10976 1 1 37 CYS HB2 H 7.439 7.570 0.387 1.00 . A A . 37 CYS HB2 1 1 16 10977 1 1 37 CYS HB3 H 8.462 6.284 -0.252 1.00 . A A . 37 CYS HB3 1 1 16 10978 1 1 37 CYS N N 8.755 7.964 2.639 1.00 . A A . 37 CYS N 1 1 16 10979 1 1 37 CYS O O 9.336 9.214 -0.119 1.00 . A A . 37 CYS O 1 1 16 10980 1 1 37 CYS SG S 7.265 5.573 1.701 1.00 . A A . 37 CYS SG 1 1 16 10981 1 1 38 LEU C C 11.497 9.511 -1.674 1.00 . A A . 38 LEU C 1 1 16 10982 1 1 38 LEU CA C 12.002 9.545 -0.231 1.00 . A A . 38 LEU CA 1 1 16 10983 1 1 38 LEU CB C 13.481 9.159 -0.171 1.00 . A A . 38 LEU CB 1 1 16 10984 1 1 38 LEU CD1 C 15.145 9.374 1.678 1.00 . A A . 38 LEU CD1 1 1 16 10985 1 1 38 LEU CD2 C 15.084 11.079 -0.142 1.00 . A A . 38 LEU CD2 1 1 16 10986 1 1 38 LEU CG C 14.235 10.146 0.724 1.00 . A A . 38 LEU CG 1 1 16 10987 1 1 38 LEU H H 11.810 7.878 1.121 1.00 . A A . 38 LEU H 1 1 16 10988 1 1 38 LEU HA H 11.856 10.524 0.200 1.00 . A A . 38 LEU HA 1 1 16 10989 1 1 38 LEU HB2 H 13.574 8.162 0.233 1.00 . A A . 38 LEU HB2 1 1 16 10990 1 1 38 LEU HB3 H 13.901 9.185 -1.164 1.00 . A A . 38 LEU HB3 1 1 16 10991 1 1 38 LEU HD11 H 15.433 8.437 1.223 1.00 . A A . 38 LEU HD11 1 1 16 10992 1 1 38 LEU HD12 H 14.617 9.178 2.600 1.00 . A A . 38 LEU HD12 1 1 16 10993 1 1 38 LEU HD13 H 16.028 9.959 1.887 1.00 . A A . 38 LEU HD13 1 1 16 10994 1 1 38 LEU HD21 H 14.530 11.354 -1.028 1.00 . A A . 38 LEU HD21 1 1 16 10995 1 1 38 LEU HD22 H 15.996 10.575 -0.430 1.00 . A A . 38 LEU HD22 1 1 16 10996 1 1 38 LEU HD23 H 15.327 11.969 0.419 1.00 . A A . 38 LEU HD23 1 1 16 10997 1 1 38 LEU HG H 13.524 10.727 1.295 1.00 . A A . 38 LEU HG 1 1 16 10998 1 1 38 LEU N N 11.297 8.509 0.575 1.00 . A A . 38 LEU N 1 1 16 10999 1 1 38 LEU O O 11.239 10.534 -2.278 1.00 . A A . 38 LEU O 1 1 16 11000 1 1 39 SER C C 9.326 8.358 -3.656 1.00 . A A . 39 SER C 1 1 16 11001 1 1 39 SER CA C 10.852 8.230 -3.630 1.00 . A A . 39 SER CA 1 1 16 11002 1 1 39 SER CB C 11.278 6.837 -4.092 1.00 . A A . 39 SER CB 1 1 16 11003 1 1 39 SER H H 11.557 7.529 -1.720 1.00 . A A . 39 SER H 1 1 16 11004 1 1 39 SER HA H 11.308 8.983 -4.254 1.00 . A A . 39 SER HA 1 1 16 11005 1 1 39 SER HB2 H 10.521 6.422 -4.736 1.00 . A A . 39 SER HB2 1 1 16 11006 1 1 39 SER HB3 H 12.210 6.909 -4.636 1.00 . A A . 39 SER HB3 1 1 16 11007 1 1 39 SER HG H 11.604 5.101 -3.270 1.00 . A A . 39 SER HG 1 1 16 11008 1 1 39 SER N N 11.348 8.338 -2.229 1.00 . A A . 39 SER N 1 1 16 11009 1 1 39 SER O O 8.709 8.732 -2.678 1.00 . A A . 39 SER O 1 1 16 11010 1 1 39 SER OG O 11.441 5.995 -2.957 1.00 . A A . 39 SER OG 1 1 16 11011 1 1 40 GLY C C 6.629 6.741 -4.892 1.00 . A A . 40 GLY C 1 1 16 11012 1 1 40 GLY CA C 7.228 8.147 -4.843 1.00 . A A . 40 GLY CA 1 1 16 11013 1 1 40 GLY H H 9.226 7.744 -5.542 1.00 . A A . 40 GLY H 1 1 16 11014 1 1 40 GLY HA2 H 6.856 8.670 -3.975 1.00 . A A . 40 GLY HA2 1 1 16 11015 1 1 40 GLY HA3 H 6.949 8.686 -5.737 1.00 . A A . 40 GLY HA3 1 1 16 11016 1 1 40 GLY N N 8.712 8.047 -4.764 1.00 . A A . 40 GLY N 1 1 16 11017 1 1 40 GLY O O 5.913 6.391 -5.809 1.00 . A A . 40 GLY O 1 1 16 11018 1 1 41 THR C C 5.721 4.247 -2.546 1.00 . A A . 41 THR C 1 1 16 11019 1 1 41 THR CA C 6.375 4.544 -3.898 1.00 . A A . 41 THR CA 1 1 16 11020 1 1 41 THR CB C 7.590 3.638 -4.118 1.00 . A A . 41 THR CB 1 1 16 11021 1 1 41 THR CG2 C 8.631 3.904 -3.031 1.00 . A A . 41 THR CG2 1 1 16 11022 1 1 41 THR H H 7.504 6.234 -3.184 1.00 . A A . 41 THR H 1 1 16 11023 1 1 41 THR HA H 5.666 4.409 -4.698 1.00 . A A . 41 THR HA 1 1 16 11024 1 1 41 THR HB H 8.023 3.847 -5.084 1.00 . A A . 41 THR HB 1 1 16 11025 1 1 41 THR HG1 H 7.351 1.952 -3.177 1.00 . A A . 41 THR HG1 1 1 16 11026 1 1 41 THR HG21 H 9.560 4.214 -3.489 1.00 . A A . 41 THR HG21 1 1 16 11027 1 1 41 THR HG22 H 8.795 3.001 -2.460 1.00 . A A . 41 THR HG22 1 1 16 11028 1 1 41 THR HG23 H 8.277 4.685 -2.375 1.00 . A A . 41 THR HG23 1 1 16 11029 1 1 41 THR N N 6.923 5.931 -3.912 1.00 . A A . 41 THR N 1 1 16 11030 1 1 41 THR O O 6.313 4.440 -1.502 1.00 . A A . 41 THR O 1 1 16 11031 1 1 41 THR OG1 O 7.181 2.278 -4.064 1.00 . A A . 41 THR OG1 1 1 16 11032 1 1 42 TRP C C 2.817 2.321 -1.480 1.00 . A A . 42 TRP C 1 1 16 11033 1 1 42 TRP CA C 3.809 3.470 -1.275 1.00 . A A . 42 TRP CA 1 1 16 11034 1 1 42 TRP CB C 3.073 4.758 -0.907 1.00 . A A . 42 TRP CB 1 1 16 11035 1 1 42 TRP CD1 C 3.284 4.497 1.596 1.00 . A A . 42 TRP CD1 1 1 16 11036 1 1 42 TRP CD2 C 1.146 4.673 0.920 1.00 . A A . 42 TRP CD2 1 1 16 11037 1 1 42 TRP CE2 C 1.117 4.533 2.327 1.00 . A A . 42 TRP CE2 1 1 16 11038 1 1 42 TRP CE3 C -0.077 4.804 0.239 1.00 . A A . 42 TRP CE3 1 1 16 11039 1 1 42 TRP CG C 2.534 4.646 0.481 1.00 . A A . 42 TRP CG 1 1 16 11040 1 1 42 TRP CH2 C -1.292 4.653 2.342 1.00 . A A . 42 TRP CH2 1 1 16 11041 1 1 42 TRP CZ2 C -0.085 4.522 3.034 1.00 . A A . 42 TRP CZ2 1 1 16 11042 1 1 42 TRP CZ3 C -1.289 4.794 0.948 1.00 . A A . 42 TRP CZ3 1 1 16 11043 1 1 42 TRP H H 4.045 3.632 -3.411 1.00 . A A . 42 TRP H 1 1 16 11044 1 1 42 TRP HA H 4.524 3.220 -0.508 1.00 . A A . 42 TRP HA 1 1 16 11045 1 1 42 TRP HB2 H 3.756 5.593 -0.959 1.00 . A A . 42 TRP HB2 1 1 16 11046 1 1 42 TRP HB3 H 2.256 4.917 -1.597 1.00 . A A . 42 TRP HB3 1 1 16 11047 1 1 42 TRP HD1 H 4.363 4.439 1.625 1.00 . A A . 42 TRP HD1 1 1 16 11048 1 1 42 TRP HE1 H 2.736 4.320 3.623 1.00 . A A . 42 TRP HE1 1 1 16 11049 1 1 42 TRP HE3 H -0.085 4.912 -0.836 1.00 . A A . 42 TRP HE3 1 1 16 11050 1 1 42 TRP HH2 H -2.227 4.647 2.882 1.00 . A A . 42 TRP HH2 1 1 16 11051 1 1 42 TRP HZ2 H -0.083 4.412 4.107 1.00 . A A . 42 TRP HZ2 1 1 16 11052 1 1 42 TRP HZ3 H -2.224 4.896 0.415 1.00 . A A . 42 TRP HZ3 1 1 16 11053 1 1 42 TRP N N 4.503 3.779 -2.558 1.00 . A A . 42 TRP N 1 1 16 11054 1 1 42 TRP NE1 N 2.444 4.428 2.693 1.00 . A A . 42 TRP NE1 1 1 16 11055 1 1 42 TRP O O 2.005 2.345 -2.383 1.00 . A A . 42 TRP O 1 1 16 11056 1 1 43 THR C C 1.123 -0.034 0.466 1.00 . A A . 43 THR C 1 1 16 11057 1 1 43 THR CA C 1.939 0.166 -0.814 1.00 . A A . 43 THR CA 1 1 16 11058 1 1 43 THR CB C 2.838 -1.041 -1.071 1.00 . A A . 43 THR CB 1 1 16 11059 1 1 43 THR CG2 C 3.970 -1.052 -0.043 1.00 . A A . 43 THR CG2 1 1 16 11060 1 1 43 THR H H 3.543 1.305 0.069 1.00 . A A . 43 THR H 1 1 16 11061 1 1 43 THR HA H 1.286 0.326 -1.657 1.00 . A A . 43 THR HA 1 1 16 11062 1 1 43 THR HB H 3.259 -0.976 -2.062 1.00 . A A . 43 THR HB 1 1 16 11063 1 1 43 THR HG1 H 2.635 -2.912 -0.571 1.00 . A A . 43 THR HG1 1 1 16 11064 1 1 43 THR HG21 H 4.709 -0.311 -0.311 1.00 . A A . 43 THR HG21 1 1 16 11065 1 1 43 THR HG22 H 4.430 -2.029 -0.021 1.00 . A A . 43 THR HG22 1 1 16 11066 1 1 43 THR HG23 H 3.569 -0.821 0.932 1.00 . A A . 43 THR HG23 1 1 16 11067 1 1 43 THR N N 2.878 1.312 -0.654 1.00 . A A . 43 THR N 1 1 16 11068 1 1 43 THR O O 1.617 0.144 1.563 1.00 . A A . 43 THR O 1 1 16 11069 1 1 43 THR OG1 O 2.074 -2.234 -0.955 1.00 . A A . 43 THR OG1 1 1 16 11070 1 1 44 GLN C C -1.647 -1.988 1.485 1.00 . A A . 44 GLN C 1 1 16 11071 1 1 44 GLN CA C -0.964 -0.619 1.548 1.00 . A A . 44 GLN CA 1 1 16 11072 1 1 44 GLN CB C -2.004 0.503 1.513 1.00 . A A . 44 GLN CB 1 1 16 11073 1 1 44 GLN CD C -2.335 0.202 3.969 1.00 . A A . 44 GLN CD 1 1 16 11074 1 1 44 GLN CG C -2.033 1.216 2.866 1.00 . A A . 44 GLN CG 1 1 16 11075 1 1 44 GLN H H -0.501 -0.546 -0.556 1.00 . A A . 44 GLN H 1 1 16 11076 1 1 44 GLN HA H -0.366 -0.537 2.441 1.00 . A A . 44 GLN HA 1 1 16 11077 1 1 44 GLN HB2 H -1.745 1.210 0.740 1.00 . A A . 44 GLN HB2 1 1 16 11078 1 1 44 GLN HB3 H -2.979 0.085 1.309 1.00 . A A . 44 GLN HB3 1 1 16 11079 1 1 44 GLN HE21 H -0.760 0.716 5.063 1.00 . A A . 44 GLN HE21 1 1 16 11080 1 1 44 GLN HE22 H -1.725 -0.519 5.713 1.00 . A A . 44 GLN HE22 1 1 16 11081 1 1 44 GLN HG2 H -1.073 1.676 3.051 1.00 . A A . 44 GLN HG2 1 1 16 11082 1 1 44 GLN HG3 H -2.802 1.974 2.857 1.00 . A A . 44 GLN HG3 1 1 16 11083 1 1 44 GLN N N -0.122 -0.406 0.336 1.00 . A A . 44 GLN N 1 1 16 11084 1 1 44 GLN NE2 N -1.542 0.127 5.000 1.00 . A A . 44 GLN NE2 1 1 16 11085 1 1 44 GLN O O -2.619 -2.238 2.169 1.00 . A A . 44 GLN O 1 1 16 11086 1 1 44 GLN OE1 O -3.303 -0.529 3.892 1.00 . A A . 44 GLN OE1 1 1 16 11087 1 1 45 GLN C C -0.752 -5.251 0.048 1.00 . A A . 45 GLN C 1 1 16 11088 1 1 45 GLN CA C -1.768 -4.231 0.578 1.00 . A A . 45 GLN CA 1 1 16 11089 1 1 45 GLN CB C -2.918 -4.056 -0.415 1.00 . A A . 45 GLN CB 1 1 16 11090 1 1 45 GLN CD C -4.853 -4.108 1.163 1.00 . A A . 45 GLN CD 1 1 16 11091 1 1 45 GLN CG C -4.124 -4.867 0.053 1.00 . A A . 45 GLN CG 1 1 16 11092 1 1 45 GLN H H -0.360 -2.664 0.134 1.00 . A A . 45 GLN H 1 1 16 11093 1 1 45 GLN HA H -2.154 -4.540 1.535 1.00 . A A . 45 GLN HA 1 1 16 11094 1 1 45 GLN HB2 H -3.186 -3.010 -0.474 1.00 . A A . 45 GLN HB2 1 1 16 11095 1 1 45 GLN HB3 H -2.608 -4.403 -1.389 1.00 . A A . 45 GLN HB3 1 1 16 11096 1 1 45 GLN HE21 H -6.323 -3.495 -0.024 1.00 . A A . 45 GLN HE21 1 1 16 11097 1 1 45 GLN HE22 H -6.438 -2.991 1.593 1.00 . A A . 45 GLN HE22 1 1 16 11098 1 1 45 GLN HG2 H -4.795 -5.023 -0.778 1.00 . A A . 45 GLN HG2 1 1 16 11099 1 1 45 GLN HG3 H -3.790 -5.820 0.432 1.00 . A A . 45 GLN HG3 1 1 16 11100 1 1 45 GLN N N -1.145 -2.880 0.673 1.00 . A A . 45 GLN N 1 1 16 11101 1 1 45 GLN NE2 N -5.963 -3.479 0.888 1.00 . A A . 45 GLN NE2 1 1 16 11102 1 1 45 GLN O O -0.467 -5.305 -1.131 1.00 . A A . 45 GLN O 1 1 16 11103 1 1 45 GLN OE1 O -4.408 -4.086 2.293 1.00 . A A . 45 GLN OE1 1 1 16 11104 1 1 46 ILE C C 0.709 -8.317 1.411 1.00 . A A . 46 ILE C 1 1 16 11105 1 1 46 ILE CA C 0.764 -7.105 0.471 1.00 . A A . 46 ILE CA 1 1 16 11106 1 1 46 ILE CB C 2.138 -6.422 0.516 1.00 . A A . 46 ILE CB 1 1 16 11107 1 1 46 ILE CD1 C 4.094 -7.294 -0.773 1.00 . A A . 46 ILE CD1 1 1 16 11108 1 1 46 ILE CG1 C 3.245 -7.480 0.485 1.00 . A A . 46 ILE CG1 1 1 16 11109 1 1 46 ILE CG2 C 2.270 -5.588 1.790 1.00 . A A . 46 ILE CG2 1 1 16 11110 1 1 46 ILE H H -0.476 -6.021 1.855 1.00 . A A . 46 ILE H 1 1 16 11111 1 1 46 ILE HA H 0.544 -7.412 -0.539 1.00 . A A . 46 ILE HA 1 1 16 11112 1 1 46 ILE HB H 2.240 -5.774 -0.343 1.00 . A A . 46 ILE HB 1 1 16 11113 1 1 46 ILE HD11 H 4.509 -6.297 -0.784 1.00 . A A . 46 ILE HD11 1 1 16 11114 1 1 46 ILE HD12 H 3.476 -7.436 -1.648 1.00 . A A . 46 ILE HD12 1 1 16 11115 1 1 46 ILE HD13 H 4.896 -8.018 -0.778 1.00 . A A . 46 ILE HD13 1 1 16 11116 1 1 46 ILE HG12 H 3.869 -7.373 1.361 1.00 . A A . 46 ILE HG12 1 1 16 11117 1 1 46 ILE HG13 H 2.807 -8.465 0.475 1.00 . A A . 46 ILE HG13 1 1 16 11118 1 1 46 ILE HG21 H 3.315 -5.408 1.996 1.00 . A A . 46 ILE HG21 1 1 16 11119 1 1 46 ILE HG22 H 1.827 -6.119 2.618 1.00 . A A . 46 ILE HG22 1 1 16 11120 1 1 46 ILE HG23 H 1.764 -4.644 1.654 1.00 . A A . 46 ILE HG23 1 1 16 11121 1 1 46 ILE N N -0.218 -6.072 0.915 1.00 . A A . 46 ILE N 1 1 16 11122 1 1 46 ILE O O 0.870 -9.446 0.992 1.00 . A A . 46 ILE O 1 1 16 11123 1 1 47 CYS C C -1.023 -9.425 4.119 1.00 . A A . 47 CYS C 1 1 16 11124 1 1 47 CYS CA C 0.422 -9.222 3.650 1.00 . A A . 47 CYS CA 1 1 16 11125 1 1 47 CYS CB C 1.308 -8.796 4.827 1.00 . A A . 47 CYS CB 1 1 16 11126 1 1 47 CYS H H 0.360 -7.170 2.998 1.00 . A A . 47 CYS H 1 1 16 11127 1 1 47 CYS HA H 0.808 -10.125 3.203 1.00 . A A . 47 CYS HA 1 1 16 11128 1 1 47 CYS HB2 H 0.773 -8.086 5.441 1.00 . A A . 47 CYS HB2 1 1 16 11129 1 1 47 CYS HB3 H 1.558 -9.665 5.419 1.00 . A A . 47 CYS HB3 1 1 16 11130 1 1 47 CYS N N 0.485 -8.088 2.680 1.00 . A A . 47 CYS N 1 1 16 11131 1 1 47 CYS O O -1.622 -8.546 4.706 1.00 . A A . 47 CYS O 1 1 16 11132 1 1 47 CYS SG S 2.833 -8.029 4.213 1.00 . A A . 47 CYS SG 1 1 16 11133 1 1 48 LEU C C -3.034 -11.166 5.797 1.00 . A A . 48 LEU C 1 1 16 11134 1 1 48 LEU CA C -2.995 -10.819 4.307 1.00 . A A . 48 LEU CA 1 1 16 11135 1 1 48 LEU CB C -3.478 -12.004 3.469 1.00 . A A . 48 LEU CB 1 1 16 11136 1 1 48 LEU CD1 C -3.809 -11.903 0.993 1.00 . A A . 48 LEU CD1 1 1 16 11137 1 1 48 LEU CD2 C -5.784 -12.117 2.510 1.00 . A A . 48 LEU CD2 1 1 16 11138 1 1 48 LEU CG C -4.391 -11.499 2.349 1.00 . A A . 48 LEU CG 1 1 16 11139 1 1 48 LEU H H -1.093 -11.274 3.395 1.00 . A A . 48 LEU H 1 1 16 11140 1 1 48 LEU HA H -3.607 -9.953 4.106 1.00 . A A . 48 LEU HA 1 1 16 11141 1 1 48 LEU HB2 H -2.626 -12.512 3.038 1.00 . A A . 48 LEU HB2 1 1 16 11142 1 1 48 LEU HB3 H -4.026 -12.689 4.096 1.00 . A A . 48 LEU HB3 1 1 16 11143 1 1 48 LEU HD11 H -4.032 -12.942 0.802 1.00 . A A . 48 LEU HD11 1 1 16 11144 1 1 48 LEU HD12 H -2.738 -11.761 1.005 1.00 . A A . 48 LEU HD12 1 1 16 11145 1 1 48 LEU HD13 H -4.246 -11.292 0.218 1.00 . A A . 48 LEU HD13 1 1 16 11146 1 1 48 LEU HD21 H -5.739 -13.169 2.271 1.00 . A A . 48 LEU HD21 1 1 16 11147 1 1 48 LEU HD22 H -6.475 -11.625 1.842 1.00 . A A . 48 LEU HD22 1 1 16 11148 1 1 48 LEU HD23 H -6.118 -11.993 3.529 1.00 . A A . 48 LEU HD23 1 1 16 11149 1 1 48 LEU HG H -4.465 -10.422 2.403 1.00 . A A . 48 LEU HG 1 1 16 11150 1 1 48 LEU N N -1.589 -10.575 3.869 1.00 . A A . 48 LEU N 1 1 16 11151 1 1 48 LEU O O -4.047 -10.894 6.420 1.00 . A A . 48 LEU O 1 1 16 11152 1 1 48 LEU OXT O -2.053 -11.697 6.289 1.00 . A A . 48 LEU OXT 1 1 17 11153 1 1 1 GLY C C -10.089 -2.941 18.179 1.00 . A A . 1 GLY C 1 1 17 11154 1 1 1 GLY CA C -11.004 -2.278 19.210 1.00 . A A . 1 GLY CA 1 1 17 11155 1 1 1 GLY H1 H -9.364 -1.617 20.310 1.00 . A A . 1 GLY H1 1 1 17 11156 1 1 1 GLY H2 H -10.829 -0.864 20.728 1.00 . A A . 1 GLY H2 1 1 17 11157 1 1 1 GLY H3 H -10.032 -0.439 19.289 1.00 . A A . 1 GLY H3 1 1 17 11158 1 1 1 GLY HA2 H -11.354 -3.020 19.913 1.00 . A A . 1 GLY HA2 1 1 17 11159 1 1 1 GLY HA3 H -11.849 -1.835 18.705 1.00 . A A . 1 GLY HA3 1 1 17 11160 1 1 1 GLY N N -10.250 -1.220 19.939 1.00 . A A . 1 GLY N 1 1 17 11161 1 1 1 GLY O O -10.378 -4.008 17.674 1.00 . A A . 1 GLY O 1 1 17 11162 1 1 2 SER C C -6.615 -2.497 17.159 1.00 . A A . 2 SER C 1 1 17 11163 1 1 2 SER CA C -8.058 -2.914 16.858 1.00 . A A . 2 SER CA 1 1 17 11164 1 1 2 SER CB C -8.514 -2.351 15.513 1.00 . A A . 2 SER CB 1 1 17 11165 1 1 2 SER H H -8.774 -1.457 18.277 1.00 . A A . 2 SER H 1 1 17 11166 1 1 2 SER HA H -8.148 -3.989 16.857 1.00 . A A . 2 SER HA 1 1 17 11167 1 1 2 SER HB2 H -9.585 -2.233 15.515 1.00 . A A . 2 SER HB2 1 1 17 11168 1 1 2 SER HB3 H -8.049 -1.389 15.349 1.00 . A A . 2 SER HB3 1 1 17 11169 1 1 2 SER HG H -7.191 -3.223 14.382 1.00 . A A . 2 SER HG 1 1 17 11170 1 1 2 SER N N -8.989 -2.318 17.859 1.00 . A A . 2 SER N 1 1 17 11171 1 1 2 SER O O -5.744 -3.326 17.328 1.00 . A A . 2 SER O 1 1 17 11172 1 1 2 SER OG O -8.146 -3.253 14.477 1.00 . A A . 2 SER OG 1 1 17 11173 1 1 3 ALA C C -4.915 0.768 17.595 1.00 . A A . 3 ALA C 1 1 17 11174 1 1 3 ALA CA C -4.964 -0.759 17.515 1.00 . A A . 3 ALA CA 1 1 17 11175 1 1 3 ALA CB C -4.129 -1.264 16.340 1.00 . A A . 3 ALA CB 1 1 17 11176 1 1 3 ALA H H -7.068 -0.564 17.087 1.00 . A A . 3 ALA H 1 1 17 11177 1 1 3 ALA HA H -4.606 -1.195 18.435 1.00 . A A . 3 ALA HA 1 1 17 11178 1 1 3 ALA HB1 H -4.618 -2.116 15.892 1.00 . A A . 3 ALA HB1 1 1 17 11179 1 1 3 ALA HB2 H -3.149 -1.554 16.692 1.00 . A A . 3 ALA HB2 1 1 17 11180 1 1 3 ALA HB3 H -4.030 -0.479 15.605 1.00 . A A . 3 ALA HB3 1 1 17 11181 1 1 3 ALA N N -6.353 -1.220 17.227 1.00 . A A . 3 ALA N 1 1 17 11182 1 1 3 ALA O O -5.900 1.415 17.890 1.00 . A A . 3 ALA O 1 1 17 11183 1 1 4 MET C C -3.194 3.404 16.061 1.00 . A A . 4 MET C 1 1 17 11184 1 1 4 MET CA C -3.669 2.837 17.402 1.00 . A A . 4 MET CA 1 1 17 11185 1 1 4 MET CB C -2.635 3.109 18.495 1.00 . A A . 4 MET CB 1 1 17 11186 1 1 4 MET CE C -2.865 0.462 20.537 1.00 . A A . 4 MET CE 1 1 17 11187 1 1 4 MET CG C -3.313 3.051 19.864 1.00 . A A . 4 MET CG 1 1 17 11188 1 1 4 MET H H -2.992 0.812 17.101 1.00 . A A . 4 MET H 1 1 17 11189 1 1 4 MET HA H -4.617 3.270 17.679 1.00 . A A . 4 MET HA 1 1 17 11190 1 1 4 MET HB2 H -1.855 2.362 18.446 1.00 . A A . 4 MET HB2 1 1 17 11191 1 1 4 MET HB3 H -2.206 4.089 18.348 1.00 . A A . 4 MET HB3 1 1 17 11192 1 1 4 MET HE1 H -2.122 -0.020 19.916 1.00 . A A . 4 MET HE1 1 1 17 11193 1 1 4 MET HE2 H -3.787 0.552 19.986 1.00 . A A . 4 MET HE2 1 1 17 11194 1 1 4 MET HE3 H -3.036 -0.126 21.428 1.00 . A A . 4 MET HE3 1 1 17 11195 1 1 4 MET HG2 H -3.449 4.053 20.242 1.00 . A A . 4 MET HG2 1 1 17 11196 1 1 4 MET HG3 H -4.275 2.570 19.769 1.00 . A A . 4 MET HG3 1 1 17 11197 1 1 4 MET N N -3.775 1.351 17.336 1.00 . A A . 4 MET N 1 1 17 11198 1 1 4 MET O O -3.975 3.913 15.282 1.00 . A A . 4 MET O 1 1 17 11199 1 1 4 MET SD S -2.277 2.108 21.009 1.00 . A A . 4 MET SD 1 1 17 11200 1 1 5 GLY C C -0.759 2.761 13.674 1.00 . A A . 5 GLY C 1 1 17 11201 1 1 5 GLY CA C -1.405 3.877 14.498 1.00 . A A . 5 GLY CA 1 1 17 11202 1 1 5 GLY H H -1.302 2.922 16.429 1.00 . A A . 5 GLY H 1 1 17 11203 1 1 5 GLY HA2 H -2.224 4.308 13.941 1.00 . A A . 5 GLY HA2 1 1 17 11204 1 1 5 GLY HA3 H -0.668 4.640 14.702 1.00 . A A . 5 GLY HA3 1 1 17 11205 1 1 5 GLY N N -1.920 3.330 15.787 1.00 . A A . 5 GLY N 1 1 17 11206 1 1 5 GLY O O -0.471 1.691 14.172 1.00 . A A . 5 GLY O 1 1 17 11207 1 1 6 CYS C C 1.596 1.865 11.860 1.00 . A A . 6 CYS C 1 1 17 11208 1 1 6 CYS CA C 0.101 1.975 11.544 1.00 . A A . 6 CYS CA 1 1 17 11209 1 1 6 CYS CB C -0.129 2.481 10.117 1.00 . A A . 6 CYS CB 1 1 17 11210 1 1 6 CYS H H -0.767 3.878 12.037 1.00 . A A . 6 CYS H 1 1 17 11211 1 1 6 CYS HA H -0.384 1.023 11.681 1.00 . A A . 6 CYS HA 1 1 17 11212 1 1 6 CYS HB2 H -1.153 2.293 9.837 1.00 . A A . 6 CYS HB2 1 1 17 11213 1 1 6 CYS HB3 H 0.062 3.539 10.076 1.00 . A A . 6 CYS HB3 1 1 17 11214 1 1 6 CYS N N -0.528 3.009 12.413 1.00 . A A . 6 CYS N 1 1 17 11215 1 1 6 CYS O O 2.158 0.788 11.873 1.00 . A A . 6 CYS O 1 1 17 11216 1 1 6 CYS SG S 0.968 1.618 8.961 1.00 . A A . 6 CYS SG 1 1 17 11217 1 1 7 ARG C C 3.911 2.049 13.697 1.00 . A A . 7 ARG C 1 1 17 11218 1 1 7 ARG CA C 3.696 2.912 12.453 1.00 . A A . 7 ARG CA 1 1 17 11219 1 1 7 ARG CB C 4.106 4.361 12.725 1.00 . A A . 7 ARG CB 1 1 17 11220 1 1 7 ARG CD C 4.347 6.309 11.169 1.00 . A A . 7 ARG CD 1 1 17 11221 1 1 7 ARG CG C 4.869 4.912 11.518 1.00 . A A . 7 ARG CG 1 1 17 11222 1 1 7 ARG CZ C 2.102 7.220 11.139 1.00 . A A . 7 ARG CZ 1 1 17 11223 1 1 7 ARG H H 1.772 3.829 12.121 1.00 . A A . 7 ARG H 1 1 17 11224 1 1 7 ARG HA H 4.256 2.520 11.617 1.00 . A A . 7 ARG HA 1 1 17 11225 1 1 7 ARG HB2 H 3.223 4.958 12.900 1.00 . A A . 7 ARG HB2 1 1 17 11226 1 1 7 ARG HB3 H 4.743 4.397 13.596 1.00 . A A . 7 ARG HB3 1 1 17 11227 1 1 7 ARG HD2 H 4.628 7.017 11.937 1.00 . A A . 7 ARG HD2 1 1 17 11228 1 1 7 ARG HD3 H 4.725 6.624 10.210 1.00 . A A . 7 ARG HD3 1 1 17 11229 1 1 7 ARG HE H 2.465 5.271 11.056 1.00 . A A . 7 ARG HE 1 1 17 11230 1 1 7 ARG HG2 H 5.922 4.969 11.753 1.00 . A A . 7 ARG HG2 1 1 17 11231 1 1 7 ARG HG3 H 4.726 4.256 10.672 1.00 . A A . 7 ARG HG3 1 1 17 11232 1 1 7 ARG HH11 H 2.780 7.852 12.913 1.00 . A A . 7 ARG HH11 1 1 17 11233 1 1 7 ARG HH12 H 1.567 8.846 12.177 1.00 . A A . 7 ARG HH12 1 1 17 11234 1 1 7 ARG HH21 H 1.249 6.835 9.370 1.00 . A A . 7 ARG HH21 1 1 17 11235 1 1 7 ARG HH22 H 0.700 8.269 10.170 1.00 . A A . 7 ARG HH22 1 1 17 11236 1 1 7 ARG N N 2.243 2.968 12.126 1.00 . A A . 7 ARG N 1 1 17 11237 1 1 7 ARG NE N 2.866 6.163 11.112 1.00 . A A . 7 ARG NE 1 1 17 11238 1 1 7 ARG NH1 N 2.155 8.036 12.155 1.00 . A A . 7 ARG NH1 1 1 17 11239 1 1 7 ARG NH2 N 1.287 7.461 10.148 1.00 . A A . 7 ARG NH2 1 1 17 11240 1 1 7 ARG O O 4.901 1.356 13.824 1.00 . A A . 7 ARG O 1 1 17 11241 1 1 8 HIS C C 3.105 -0.230 15.488 1.00 . A A . 8 HIS C 1 1 17 11242 1 1 8 HIS CA C 3.124 1.258 15.849 1.00 . A A . 8 HIS CA 1 1 17 11243 1 1 8 HIS CB C 1.910 1.618 16.709 1.00 . A A . 8 HIS CB 1 1 17 11244 1 1 8 HIS CD2 C 0.824 -0.445 17.922 1.00 . A A . 8 HIS CD2 1 1 17 11245 1 1 8 HIS CE1 C 2.116 -0.506 19.660 1.00 . A A . 8 HIS CE1 1 1 17 11246 1 1 8 HIS CG C 1.725 0.582 17.785 1.00 . A A . 8 HIS CG 1 1 17 11247 1 1 8 HIS H H 2.188 2.643 14.490 1.00 . A A . 8 HIS H 1 1 17 11248 1 1 8 HIS HA H 4.034 1.510 16.370 1.00 . A A . 8 HIS HA 1 1 17 11249 1 1 8 HIS HB2 H 2.066 2.585 17.163 1.00 . A A . 8 HIS HB2 1 1 17 11250 1 1 8 HIS HB3 H 1.027 1.652 16.087 1.00 . A A . 8 HIS HB3 1 1 17 11251 1 1 8 HIS HD1 H 3.286 1.125 19.109 1.00 . A A . 8 HIS HD1 1 1 17 11252 1 1 8 HIS HD2 H 0.039 -0.683 17.220 1.00 . A A . 8 HIS HD2 1 1 17 11253 1 1 8 HIS HE1 H 2.565 -0.791 20.600 1.00 . A A . 8 HIS HE1 1 1 17 11254 1 1 8 HIS N N 2.982 2.081 14.615 1.00 . A A . 8 HIS N 1 1 17 11255 1 1 8 HIS ND1 N 2.540 0.524 18.904 1.00 . A A . 8 HIS ND1 1 1 17 11256 1 1 8 HIS NE2 N 1.073 -1.131 19.107 1.00 . A A . 8 HIS NE2 1 1 17 11257 1 1 8 HIS O O 3.790 -1.034 16.087 1.00 . A A . 8 HIS O 1 1 17 11258 1 1 9 PHE C C 3.671 -2.552 13.805 1.00 . A A . 9 PHE C 1 1 17 11259 1 1 9 PHE CA C 2.261 -2.035 14.108 1.00 . A A . 9 PHE CA 1 1 17 11260 1 1 9 PHE CB C 1.388 -2.050 12.850 1.00 . A A . 9 PHE CB 1 1 17 11261 1 1 9 PHE CD1 C -0.323 -1.113 14.471 1.00 . A A . 9 PHE CD1 1 1 17 11262 1 1 9 PHE CD2 C -0.882 -1.218 12.113 1.00 . A A . 9 PHE CD2 1 1 17 11263 1 1 9 PHE CE1 C -1.578 -0.558 14.745 1.00 . A A . 9 PHE CE1 1 1 17 11264 1 1 9 PHE CE2 C -2.138 -0.664 12.389 1.00 . A A . 9 PHE CE2 1 1 17 11265 1 1 9 PHE CG C 0.029 -1.444 13.154 1.00 . A A . 9 PHE CG 1 1 17 11266 1 1 9 PHE CZ C -2.486 -0.334 13.704 1.00 . A A . 9 PHE CZ 1 1 17 11267 1 1 9 PHE H H 1.780 0.064 14.037 1.00 . A A . 9 PHE H 1 1 17 11268 1 1 9 PHE HA H 1.802 -2.624 14.885 1.00 . A A . 9 PHE HA 1 1 17 11269 1 1 9 PHE HB2 H 1.871 -1.477 12.071 1.00 . A A . 9 PHE HB2 1 1 17 11270 1 1 9 PHE HB3 H 1.257 -3.068 12.517 1.00 . A A . 9 PHE HB3 1 1 17 11271 1 1 9 PHE HD1 H 0.377 -1.282 15.276 1.00 . A A . 9 PHE HD1 1 1 17 11272 1 1 9 PHE HD2 H -0.614 -1.468 11.098 1.00 . A A . 9 PHE HD2 1 1 17 11273 1 1 9 PHE HE1 H -1.847 -0.305 15.760 1.00 . A A . 9 PHE HE1 1 1 17 11274 1 1 9 PHE HE2 H -2.839 -0.490 11.586 1.00 . A A . 9 PHE HE2 1 1 17 11275 1 1 9 PHE HZ H -3.455 0.092 13.915 1.00 . A A . 9 PHE HZ 1 1 17 11276 1 1 9 PHE N N 2.324 -0.601 14.509 1.00 . A A . 9 PHE N 1 1 17 11277 1 1 9 PHE O O 4.395 -1.982 13.012 1.00 . A A . 9 PHE O 1 1 17 11278 1 1 10 GLN C C 5.565 -4.711 12.772 1.00 . A A . 10 GLN C 1 1 17 11279 1 1 10 GLN CA C 5.438 -4.168 14.199 1.00 . A A . 10 GLN CA 1 1 17 11280 1 1 10 GLN CB C 5.594 -5.302 15.214 1.00 . A A . 10 GLN CB 1 1 17 11281 1 1 10 GLN CD C 6.123 -5.155 17.651 1.00 . A A . 10 GLN CD 1 1 17 11282 1 1 10 GLN CG C 6.666 -4.926 16.240 1.00 . A A . 10 GLN CG 1 1 17 11283 1 1 10 GLN H H 3.473 -4.060 15.082 1.00 . A A . 10 GLN H 1 1 17 11284 1 1 10 GLN HA H 6.183 -3.410 14.380 1.00 . A A . 10 GLN HA 1 1 17 11285 1 1 10 GLN HB2 H 4.652 -5.466 15.718 1.00 . A A . 10 GLN HB2 1 1 17 11286 1 1 10 GLN HB3 H 5.891 -6.205 14.702 1.00 . A A . 10 GLN HB3 1 1 17 11287 1 1 10 GLN HE21 H 4.331 -4.409 17.235 1.00 . A A . 10 GLN HE21 1 1 17 11288 1 1 10 GLN HE22 H 4.539 -4.952 18.829 1.00 . A A . 10 GLN HE22 1 1 17 11289 1 1 10 GLN HG2 H 7.542 -5.539 16.086 1.00 . A A . 10 GLN HG2 1 1 17 11290 1 1 10 GLN HG3 H 6.928 -3.885 16.121 1.00 . A A . 10 GLN HG3 1 1 17 11291 1 1 10 GLN N N 4.070 -3.621 14.440 1.00 . A A . 10 GLN N 1 1 17 11292 1 1 10 GLN NE2 N 4.896 -4.810 17.928 1.00 . A A . 10 GLN NE2 1 1 17 11293 1 1 10 GLN O O 6.195 -4.111 11.925 1.00 . A A . 10 GLN O 1 1 17 11294 1 1 10 GLN OE1 O 6.823 -5.653 18.511 1.00 . A A . 10 GLN OE1 1 1 17 11295 1 1 11 SER C C 4.102 -5.732 10.185 1.00 . A A . 11 SER C 1 1 17 11296 1 1 11 SER CA C 5.078 -6.428 11.135 1.00 . A A . 11 SER CA 1 1 17 11297 1 1 11 SER CB C 4.701 -7.900 11.305 1.00 . A A . 11 SER CB 1 1 17 11298 1 1 11 SER H H 4.481 -6.317 13.203 1.00 . A A . 11 SER H 1 1 17 11299 1 1 11 SER HA H 6.087 -6.348 10.764 1.00 . A A . 11 SER HA 1 1 17 11300 1 1 11 SER HB2 H 4.883 -8.205 12.322 1.00 . A A . 11 SER HB2 1 1 17 11301 1 1 11 SER HB3 H 3.653 -8.030 11.075 1.00 . A A . 11 SER HB3 1 1 17 11302 1 1 11 SER HG H 6.301 -8.208 10.237 1.00 . A A . 11 SER HG 1 1 17 11303 1 1 11 SER N N 4.980 -5.845 12.504 1.00 . A A . 11 SER N 1 1 17 11304 1 1 11 SER O O 3.614 -4.653 10.457 1.00 . A A . 11 SER O 1 1 17 11305 1 1 11 SER OG O 5.494 -8.693 10.430 1.00 . A A . 11 SER OG 1 1 17 11306 1 1 12 CYS C C 1.450 -6.211 8.352 1.00 . A A . 12 CYS C 1 1 17 11307 1 1 12 CYS CA C 2.878 -5.725 8.092 1.00 . A A . 12 CYS CA 1 1 17 11308 1 1 12 CYS CB C 3.361 -6.213 6.727 1.00 . A A . 12 CYS CB 1 1 17 11309 1 1 12 CYS H H 4.227 -7.211 8.871 1.00 . A A . 12 CYS H 1 1 17 11310 1 1 12 CYS HA H 2.932 -4.650 8.142 1.00 . A A . 12 CYS HA 1 1 17 11311 1 1 12 CYS HB2 H 2.767 -5.754 5.949 1.00 . A A . 12 CYS HB2 1 1 17 11312 1 1 12 CYS HB3 H 4.398 -5.946 6.593 1.00 . A A . 12 CYS HB3 1 1 17 11313 1 1 12 CYS N N 3.819 -6.343 9.068 1.00 . A A . 12 CYS N 1 1 17 11314 1 1 12 CYS O O 0.491 -5.658 7.849 1.00 . A A . 12 CYS O 1 1 17 11315 1 1 12 CYS SG S 3.186 -8.013 6.643 1.00 . A A . 12 CYS SG 1 1 17 11316 1 1 13 SER C C -1.034 -6.657 9.734 1.00 . A A . 13 SER C 1 1 17 11317 1 1 13 SER CA C -0.054 -7.789 9.411 1.00 . A A . 13 SER CA 1 1 17 11318 1 1 13 SER CB C 0.132 -8.697 10.625 1.00 . A A . 13 SER CB 1 1 17 11319 1 1 13 SER H H 2.094 -7.686 9.513 1.00 . A A . 13 SER H 1 1 17 11320 1 1 13 SER HA H -0.411 -8.367 8.574 1.00 . A A . 13 SER HA 1 1 17 11321 1 1 13 SER HB2 H 0.645 -8.159 11.405 1.00 . A A . 13 SER HB2 1 1 17 11322 1 1 13 SER HB3 H -0.836 -9.018 10.987 1.00 . A A . 13 SER HB3 1 1 17 11323 1 1 13 SER HG H 0.795 -9.966 9.306 1.00 . A A . 13 SER HG 1 1 17 11324 1 1 13 SER N N 1.306 -7.251 9.126 1.00 . A A . 13 SER N 1 1 17 11325 1 1 13 SER O O -2.020 -6.471 9.050 1.00 . A A . 13 SER O 1 1 17 11326 1 1 13 SER OG O 0.909 -9.828 10.250 1.00 . A A . 13 SER OG 1 1 17 11327 1 1 14 GLN C C -1.518 -3.602 10.184 1.00 . A A . 14 GLN C 1 1 17 11328 1 1 14 GLN CA C -1.712 -4.793 11.122 1.00 . A A . 14 GLN CA 1 1 17 11329 1 1 14 GLN CB C -1.359 -4.405 12.557 1.00 . A A . 14 GLN CB 1 1 17 11330 1 1 14 GLN CD C -3.281 -4.709 14.119 1.00 . A A . 14 GLN CD 1 1 17 11331 1 1 14 GLN CG C -2.562 -3.716 13.206 1.00 . A A . 14 GLN CG 1 1 17 11332 1 1 14 GLN H H 0.021 -6.065 11.312 1.00 . A A . 14 GLN H 1 1 17 11333 1 1 14 GLN HA H -2.732 -5.139 11.080 1.00 . A A . 14 GLN HA 1 1 17 11334 1 1 14 GLN HB2 H -1.105 -5.293 13.118 1.00 . A A . 14 GLN HB2 1 1 17 11335 1 1 14 GLN HB3 H -0.517 -3.729 12.553 1.00 . A A . 14 GLN HB3 1 1 17 11336 1 1 14 GLN HE21 H -3.047 -6.237 12.872 1.00 . A A . 14 GLN HE21 1 1 17 11337 1 1 14 GLN HE22 H -3.868 -6.597 14.314 1.00 . A A . 14 GLN HE22 1 1 17 11338 1 1 14 GLN HG2 H -2.224 -2.869 13.786 1.00 . A A . 14 GLN HG2 1 1 17 11339 1 1 14 GLN HG3 H -3.243 -3.378 12.437 1.00 . A A . 14 GLN HG3 1 1 17 11340 1 1 14 GLN N N -0.777 -5.901 10.768 1.00 . A A . 14 GLN N 1 1 17 11341 1 1 14 GLN NE2 N -3.409 -5.951 13.736 1.00 . A A . 14 GLN NE2 1 1 17 11342 1 1 14 GLN O O -2.441 -2.862 9.906 1.00 . A A . 14 GLN O 1 1 17 11343 1 1 14 GLN OE1 O -3.729 -4.354 15.190 1.00 . A A . 14 GLN OE1 1 1 17 11344 1 1 15 CYS C C -1.173 -2.214 7.702 1.00 . A A . 15 CYS C 1 1 17 11345 1 1 15 CYS CA C -0.086 -2.259 8.773 1.00 . A A . 15 CYS CA 1 1 17 11346 1 1 15 CYS CB C 1.273 -2.541 8.136 1.00 . A A . 15 CYS CB 1 1 17 11347 1 1 15 CYS H H 0.409 -4.012 9.926 1.00 . A A . 15 CYS H 1 1 17 11348 1 1 15 CYS HA H -0.054 -1.332 9.323 1.00 . A A . 15 CYS HA 1 1 17 11349 1 1 15 CYS HB2 H 1.397 -3.606 8.009 1.00 . A A . 15 CYS HB2 1 1 17 11350 1 1 15 CYS HB3 H 1.325 -2.054 7.172 1.00 . A A . 15 CYS HB3 1 1 17 11351 1 1 15 CYS N N -0.326 -3.406 9.692 1.00 . A A . 15 CYS N 1 1 17 11352 1 1 15 CYS O O -1.569 -1.158 7.246 1.00 . A A . 15 CYS O 1 1 17 11353 1 1 15 CYS SG S 2.586 -1.904 9.203 1.00 . A A . 15 CYS SG 1 1 17 11354 1 1 16 LEU C C -4.043 -3.849 6.825 1.00 . A A . 16 LEU C 1 1 17 11355 1 1 16 LEU CA C -2.707 -3.377 6.238 1.00 . A A . 16 LEU CA 1 1 17 11356 1 1 16 LEU CB C -2.187 -4.361 5.189 1.00 . A A . 16 LEU CB 1 1 17 11357 1 1 16 LEU CD1 C 0.107 -3.355 5.310 1.00 . A A . 16 LEU CD1 1 1 17 11358 1 1 16 LEU CD2 C -0.571 -4.659 3.303 1.00 . A A . 16 LEU CD2 1 1 17 11359 1 1 16 LEU CG C -1.061 -3.699 4.385 1.00 . A A . 16 LEU CG 1 1 17 11360 1 1 16 LEU H H -1.314 -4.194 7.663 1.00 . A A . 16 LEU H 1 1 17 11361 1 1 16 LEU HA H -2.818 -2.398 5.798 1.00 . A A . 16 LEU HA 1 1 17 11362 1 1 16 LEU HB2 H -1.809 -5.245 5.681 1.00 . A A . 16 LEU HB2 1 1 17 11363 1 1 16 LEU HB3 H -2.991 -4.633 4.523 1.00 . A A . 16 LEU HB3 1 1 17 11364 1 1 16 LEU HD11 H 1.037 -3.461 4.771 1.00 . A A . 16 LEU HD11 1 1 17 11365 1 1 16 LEU HD12 H 0.106 -4.025 6.157 1.00 . A A . 16 LEU HD12 1 1 17 11366 1 1 16 LEU HD13 H 0.006 -2.337 5.656 1.00 . A A . 16 LEU HD13 1 1 17 11367 1 1 16 LEU HD21 H -1.420 -5.132 2.833 1.00 . A A . 16 LEU HD21 1 1 17 11368 1 1 16 LEU HD22 H 0.060 -5.413 3.749 1.00 . A A . 16 LEU HD22 1 1 17 11369 1 1 16 LEU HD23 H -0.008 -4.110 2.562 1.00 . A A . 16 LEU HD23 1 1 17 11370 1 1 16 LEU HG H -1.431 -2.794 3.925 1.00 . A A . 16 LEU HG 1 1 17 11371 1 1 16 LEU N N -1.653 -3.353 7.289 1.00 . A A . 16 LEU N 1 1 17 11372 1 1 16 LEU O O -5.084 -3.696 6.218 1.00 . A A . 16 LEU O 1 1 17 11373 1 1 17 SER C C -6.164 -3.706 9.035 1.00 . A A . 17 SER C 1 1 17 11374 1 1 17 SER CA C -5.300 -4.890 8.626 1.00 . A A . 17 SER CA 1 1 17 11375 1 1 17 SER CB C -4.883 -5.638 9.886 1.00 . A A . 17 SER CB 1 1 17 11376 1 1 17 SER H H -3.175 -4.531 8.479 1.00 . A A . 17 SER H 1 1 17 11377 1 1 17 SER HA H -5.835 -5.547 7.960 1.00 . A A . 17 SER HA 1 1 17 11378 1 1 17 SER HB2 H -5.629 -6.372 10.133 1.00 . A A . 17 SER HB2 1 1 17 11379 1 1 17 SER HB3 H -3.938 -6.124 9.720 1.00 . A A . 17 SER HB3 1 1 17 11380 1 1 17 SER HG H -4.692 -5.213 11.774 1.00 . A A . 17 SER HG 1 1 17 11381 1 1 17 SER N N -4.026 -4.417 8.003 1.00 . A A . 17 SER N 1 1 17 11382 1 1 17 SER O O -7.367 -3.814 9.168 1.00 . A A . 17 SER O 1 1 17 11383 1 1 17 SER OG O -4.772 -4.713 10.959 1.00 . A A . 17 SER OG 1 1 17 11384 1 1 18 ALA C C -5.764 -0.123 9.136 1.00 . A A . 18 ALA C 1 1 17 11385 1 1 18 ALA CA C -6.337 -1.411 9.727 1.00 . A A . 18 ALA CA 1 1 17 11386 1 1 18 ALA CB C -6.177 -1.441 11.245 1.00 . A A . 18 ALA CB 1 1 17 11387 1 1 18 ALA H H -4.581 -2.527 9.196 1.00 . A A . 18 ALA H 1 1 17 11388 1 1 18 ALA HA H -7.376 -1.522 9.464 1.00 . A A . 18 ALA HA 1 1 17 11389 1 1 18 ALA HB1 H -6.018 -0.441 11.613 1.00 . A A . 18 ALA HB1 1 1 17 11390 1 1 18 ALA HB2 H -5.326 -2.061 11.501 1.00 . A A . 18 ALA HB2 1 1 17 11391 1 1 18 ALA HB3 H -7.067 -1.856 11.693 1.00 . A A . 18 ALA HB3 1 1 17 11392 1 1 18 ALA N N -5.554 -2.586 9.278 1.00 . A A . 18 ALA N 1 1 17 11393 1 1 18 ALA O O -5.257 0.720 9.847 1.00 . A A . 18 ALA O 1 1 17 11394 1 1 19 PRO C C -6.272 2.419 7.342 1.00 . A A . 19 PRO C 1 1 17 11395 1 1 19 PRO CA C -5.378 1.178 7.125 1.00 . A A . 19 PRO CA 1 1 17 11396 1 1 19 PRO CB C -5.368 0.743 5.661 1.00 . A A . 19 PRO CB 1 1 17 11397 1 1 19 PRO CD C -6.472 -1.003 6.927 1.00 . A A . 19 PRO CD 1 1 17 11398 1 1 19 PRO CG C -6.370 -0.362 5.563 1.00 . A A . 19 PRO CG 1 1 17 11399 1 1 19 PRO HA H -4.369 1.395 7.437 1.00 . A A . 19 PRO HA 1 1 17 11400 1 1 19 PRO HB2 H -5.655 1.569 5.026 1.00 . A A . 19 PRO HB2 1 1 17 11401 1 1 19 PRO HB3 H -4.390 0.379 5.385 1.00 . A A . 19 PRO HB3 1 1 17 11402 1 1 19 PRO HD2 H -7.507 -1.183 7.183 1.00 . A A . 19 PRO HD2 1 1 17 11403 1 1 19 PRO HD3 H -5.908 -1.922 6.957 1.00 . A A . 19 PRO HD3 1 1 17 11404 1 1 19 PRO HG2 H -7.328 0.035 5.261 1.00 . A A . 19 PRO HG2 1 1 17 11405 1 1 19 PRO HG3 H -6.036 -1.096 4.846 1.00 . A A . 19 PRO HG3 1 1 17 11406 1 1 19 PRO N N -5.877 -0.018 7.840 1.00 . A A . 19 PRO N 1 1 17 11407 1 1 19 PRO O O -5.773 3.527 7.289 1.00 . A A . 19 PRO O 1 1 17 11408 1 1 20 PRO C C -8.228 3.995 9.183 1.00 . A A . 20 PRO C 1 1 17 11409 1 1 20 PRO CA C -8.444 3.406 7.786 1.00 . A A . 20 PRO CA 1 1 17 11410 1 1 20 PRO CB C -9.849 2.831 7.657 1.00 . A A . 20 PRO CB 1 1 17 11411 1 1 20 PRO CD C -8.306 0.967 7.669 1.00 . A A . 20 PRO CD 1 1 17 11412 1 1 20 PRO CG C -9.713 1.386 8.008 1.00 . A A . 20 PRO CG 1 1 17 11413 1 1 20 PRO HA H -8.277 4.152 7.025 1.00 . A A . 20 PRO HA 1 1 17 11414 1 1 20 PRO HB2 H -10.520 3.327 8.346 1.00 . A A . 20 PRO HB2 1 1 17 11415 1 1 20 PRO HB3 H -10.206 2.932 6.645 1.00 . A A . 20 PRO HB3 1 1 17 11416 1 1 20 PRO HD2 H -7.911 0.343 8.455 1.00 . A A . 20 PRO HD2 1 1 17 11417 1 1 20 PRO HD3 H -8.286 0.452 6.726 1.00 . A A . 20 PRO HD3 1 1 17 11418 1 1 20 PRO HG2 H -9.894 1.248 9.066 1.00 . A A . 20 PRO HG2 1 1 17 11419 1 1 20 PRO HG3 H -10.414 0.799 7.435 1.00 . A A . 20 PRO HG3 1 1 17 11420 1 1 20 PRO N N -7.558 2.233 7.577 1.00 . A A . 20 PRO N 1 1 17 11421 1 1 20 PRO O O -8.444 5.169 9.414 1.00 . A A . 20 PRO O 1 1 17 11422 1 1 21 PHE C C -6.146 4.182 11.660 1.00 . A A . 21 PHE C 1 1 17 11423 1 1 21 PHE CA C -7.587 3.696 11.502 1.00 . A A . 21 PHE CA 1 1 17 11424 1 1 21 PHE CB C -7.846 2.496 12.418 1.00 . A A . 21 PHE CB 1 1 17 11425 1 1 21 PHE CD1 C -10.215 2.438 11.566 1.00 . A A . 21 PHE CD1 1 1 17 11426 1 1 21 PHE CD2 C -9.028 0.344 11.850 1.00 . A A . 21 PHE CD2 1 1 17 11427 1 1 21 PHE CE1 C -11.340 1.740 11.114 1.00 . A A . 21 PHE CE1 1 1 17 11428 1 1 21 PHE CE2 C -10.153 -0.356 11.398 1.00 . A A . 21 PHE CE2 1 1 17 11429 1 1 21 PHE CG C -9.060 1.740 11.935 1.00 . A A . 21 PHE CG 1 1 17 11430 1 1 21 PHE CZ C -11.309 0.343 11.029 1.00 . A A . 21 PHE CZ 1 1 17 11431 1 1 21 PHE H H -7.647 2.243 9.910 1.00 . A A . 21 PHE H 1 1 17 11432 1 1 21 PHE HA H -8.281 4.490 11.729 1.00 . A A . 21 PHE HA 1 1 17 11433 1 1 21 PHE HB2 H -6.987 1.842 12.403 1.00 . A A . 21 PHE HB2 1 1 17 11434 1 1 21 PHE HB3 H -8.017 2.844 13.426 1.00 . A A . 21 PHE HB3 1 1 17 11435 1 1 21 PHE HD1 H -10.237 3.517 11.631 1.00 . A A . 21 PHE HD1 1 1 17 11436 1 1 21 PHE HD2 H -8.134 -0.194 12.136 1.00 . A A . 21 PHE HD2 1 1 17 11437 1 1 21 PHE HE1 H -12.231 2.279 10.830 1.00 . A A . 21 PHE HE1 1 1 17 11438 1 1 21 PHE HE2 H -10.128 -1.432 11.332 1.00 . A A . 21 PHE HE2 1 1 17 11439 1 1 21 PHE HZ H -12.176 -0.197 10.680 1.00 . A A . 21 PHE HZ 1 1 17 11440 1 1 21 PHE N N -7.810 3.186 10.117 1.00 . A A . 21 PHE N 1 1 17 11441 1 1 21 PHE O O -5.720 4.551 12.736 1.00 . A A . 21 PHE O 1 1 17 11442 1 1 22 VAL C C -3.629 5.550 9.517 1.00 . A A . 22 VAL C 1 1 17 11443 1 1 22 VAL CA C -3.976 4.638 10.696 1.00 . A A . 22 VAL CA 1 1 17 11444 1 1 22 VAL CB C -3.152 3.353 10.646 1.00 . A A . 22 VAL CB 1 1 17 11445 1 1 22 VAL CG1 C -3.583 2.426 11.786 1.00 . A A . 22 VAL CG1 1 1 17 11446 1 1 22 VAL CG2 C -3.386 2.653 9.305 1.00 . A A . 22 VAL CG2 1 1 17 11447 1 1 22 VAL H H -5.750 3.875 9.739 1.00 . A A . 22 VAL H 1 1 17 11448 1 1 22 VAL HA H -3.808 5.147 11.631 1.00 . A A . 22 VAL HA 1 1 17 11449 1 1 22 VAL HB H -2.105 3.594 10.754 1.00 . A A . 22 VAL HB 1 1 17 11450 1 1 22 VAL HG11 H -4.336 1.740 11.427 1.00 . A A . 22 VAL HG11 1 1 17 11451 1 1 22 VAL HG12 H -3.991 3.014 12.595 1.00 . A A . 22 VAL HG12 1 1 17 11452 1 1 22 VAL HG13 H -2.729 1.869 12.141 1.00 . A A . 22 VAL HG13 1 1 17 11453 1 1 22 VAL HG21 H -3.371 1.584 9.451 1.00 . A A . 22 VAL HG21 1 1 17 11454 1 1 22 VAL HG22 H -2.604 2.933 8.613 1.00 . A A . 22 VAL HG22 1 1 17 11455 1 1 22 VAL HG23 H -4.344 2.951 8.906 1.00 . A A . 22 VAL HG23 1 1 17 11456 1 1 22 VAL N N -5.390 4.180 10.598 1.00 . A A . 22 VAL N 1 1 17 11457 1 1 22 VAL O O -4.471 5.877 8.704 1.00 . A A . 22 VAL O 1 1 17 11458 1 1 23 GLN C C -0.653 6.419 7.707 1.00 . A A . 23 GLN C 1 1 17 11459 1 1 23 GLN CA C -1.998 6.860 8.293 1.00 . A A . 23 GLN CA 1 1 17 11460 1 1 23 GLN CB C -1.880 8.251 8.917 1.00 . A A . 23 GLN CB 1 1 17 11461 1 1 23 GLN CD C -1.856 10.584 8.019 1.00 . A A . 23 GLN CD 1 1 17 11462 1 1 23 GLN CG C -1.208 9.202 7.923 1.00 . A A . 23 GLN CG 1 1 17 11463 1 1 23 GLN H H -1.731 5.692 10.085 1.00 . A A . 23 GLN H 1 1 17 11464 1 1 23 GLN HA H -2.758 6.864 7.528 1.00 . A A . 23 GLN HA 1 1 17 11465 1 1 23 GLN HB2 H -2.865 8.621 9.162 1.00 . A A . 23 GLN HB2 1 1 17 11466 1 1 23 GLN HB3 H -1.283 8.194 9.815 1.00 . A A . 23 GLN HB3 1 1 17 11467 1 1 23 GLN HE21 H -3.457 10.064 6.965 1.00 . A A . 23 GLN HE21 1 1 17 11468 1 1 23 GLN HE22 H -3.435 11.673 7.504 1.00 . A A . 23 GLN HE22 1 1 17 11469 1 1 23 GLN HG2 H -0.155 9.280 8.156 1.00 . A A . 23 GLN HG2 1 1 17 11470 1 1 23 GLN HG3 H -1.328 8.820 6.921 1.00 . A A . 23 GLN HG3 1 1 17 11471 1 1 23 GLN N N -2.395 5.966 9.418 1.00 . A A . 23 GLN N 1 1 17 11472 1 1 23 GLN NE2 N -3.011 10.791 7.449 1.00 . A A . 23 GLN NE2 1 1 17 11473 1 1 23 GLN O O -0.039 7.132 6.939 1.00 . A A . 23 GLN O 1 1 17 11474 1 1 23 GLN OE1 O -1.304 11.486 8.618 1.00 . A A . 23 GLN OE1 1 1 17 11475 1 1 24 CYS C C 0.883 3.524 6.647 1.00 . A A . 24 CYS C 1 1 17 11476 1 1 24 CYS CA C 1.110 4.770 7.515 1.00 . A A . 24 CYS CA 1 1 17 11477 1 1 24 CYS CB C 1.977 4.497 8.766 1.00 . A A . 24 CYS CB 1 1 17 11478 1 1 24 CYS H H -0.702 4.687 8.678 1.00 . A A . 24 CYS H 1 1 17 11479 1 1 24 CYS HA H 1.567 5.549 6.920 1.00 . A A . 24 CYS HA 1 1 17 11480 1 1 24 CYS HB2 H 2.818 5.174 8.759 1.00 . A A . 24 CYS HB2 1 1 17 11481 1 1 24 CYS HB3 H 1.388 4.687 9.649 1.00 . A A . 24 CYS HB3 1 1 17 11482 1 1 24 CYS N N -0.192 5.249 8.059 1.00 . A A . 24 CYS N 1 1 17 11483 1 1 24 CYS O O -0.146 2.881 6.722 1.00 . A A . 24 CYS O 1 1 17 11484 1 1 24 CYS SG S 2.610 2.791 8.815 1.00 . A A . 24 CYS SG 1 1 17 11485 1 1 25 GLY C C 3.019 1.316 4.751 1.00 . A A . 25 GLY C 1 1 17 11486 1 1 25 GLY CA C 1.669 2.013 4.916 1.00 . A A . 25 GLY CA 1 1 17 11487 1 1 25 GLY H H 2.643 3.742 5.757 1.00 . A A . 25 GLY H 1 1 17 11488 1 1 25 GLY HA2 H 0.957 1.326 5.352 1.00 . A A . 25 GLY HA2 1 1 17 11489 1 1 25 GLY HA3 H 1.315 2.335 3.951 1.00 . A A . 25 GLY HA3 1 1 17 11490 1 1 25 GLY N N 1.828 3.197 5.810 1.00 . A A . 25 GLY N 1 1 17 11491 1 1 25 GLY O O 4.006 1.721 5.324 1.00 . A A . 25 GLY O 1 1 17 11492 1 1 26 TRP C C 5.126 0.210 2.603 1.00 . A A . 26 TRP C 1 1 17 11493 1 1 26 TRP CA C 4.367 -0.440 3.767 1.00 . A A . 26 TRP CA 1 1 17 11494 1 1 26 TRP CB C 3.954 -1.869 3.412 1.00 . A A . 26 TRP CB 1 1 17 11495 1 1 26 TRP CD1 C 5.884 -3.379 2.796 1.00 . A A . 26 TRP CD1 1 1 17 11496 1 1 26 TRP CD2 C 5.469 -3.367 5.007 1.00 . A A . 26 TRP CD2 1 1 17 11497 1 1 26 TRP CE2 C 6.554 -4.252 4.804 1.00 . A A . 26 TRP CE2 1 1 17 11498 1 1 26 TRP CE3 C 5.007 -3.176 6.320 1.00 . A A . 26 TRP CE3 1 1 17 11499 1 1 26 TRP CG C 5.061 -2.827 3.717 1.00 . A A . 26 TRP CG 1 1 17 11500 1 1 26 TRP CH2 C 6.685 -4.725 7.166 1.00 . A A . 26 TRP CH2 1 1 17 11501 1 1 26 TRP CZ2 C 7.158 -4.924 5.867 1.00 . A A . 26 TRP CZ2 1 1 17 11502 1 1 26 TRP CZ3 C 5.613 -3.851 7.394 1.00 . A A . 26 TRP CZ3 1 1 17 11503 1 1 26 TRP H H 2.263 -0.039 3.505 1.00 . A A . 26 TRP H 1 1 17 11504 1 1 26 TRP HA H 4.958 -0.430 4.669 1.00 . A A . 26 TRP HA 1 1 17 11505 1 1 26 TRP HB2 H 3.081 -2.141 3.986 1.00 . A A . 26 TRP HB2 1 1 17 11506 1 1 26 TRP HB3 H 3.719 -1.920 2.361 1.00 . A A . 26 TRP HB3 1 1 17 11507 1 1 26 TRP HD1 H 5.854 -3.191 1.733 1.00 . A A . 26 TRP HD1 1 1 17 11508 1 1 26 TRP HE1 H 7.471 -4.750 2.999 1.00 . A A . 26 TRP HE1 1 1 17 11509 1 1 26 TRP HE3 H 4.185 -2.504 6.504 1.00 . A A . 26 TRP HE3 1 1 17 11510 1 1 26 TRP HH2 H 7.147 -5.241 7.994 1.00 . A A . 26 TRP HH2 1 1 17 11511 1 1 26 TRP HZ2 H 7.984 -5.596 5.687 1.00 . A A . 26 TRP HZ2 1 1 17 11512 1 1 26 TRP HZ3 H 5.248 -3.698 8.400 1.00 . A A . 26 TRP HZ3 1 1 17 11513 1 1 26 TRP N N 3.073 0.275 3.968 1.00 . A A . 26 TRP N 1 1 17 11514 1 1 26 TRP NE1 N 6.770 -4.225 3.440 1.00 . A A . 26 TRP NE1 1 1 17 11515 1 1 26 TRP O O 4.548 0.551 1.585 1.00 . A A . 26 TRP O 1 1 17 11516 1 1 27 CYS C C 8.525 0.369 1.416 1.00 . A A . 27 CYS C 1 1 17 11517 1 1 27 CYS CA C 7.178 1.066 1.652 1.00 . A A . 27 CYS CA 1 1 17 11518 1 1 27 CYS CB C 7.398 2.495 2.147 1.00 . A A . 27 CYS CB 1 1 17 11519 1 1 27 CYS H H 6.859 0.153 3.582 1.00 . A A . 27 CYS H 1 1 17 11520 1 1 27 CYS HA H 6.598 1.081 0.744 1.00 . A A . 27 CYS HA 1 1 17 11521 1 1 27 CYS HB2 H 6.579 2.778 2.789 1.00 . A A . 27 CYS HB2 1 1 17 11522 1 1 27 CYS HB3 H 8.323 2.546 2.701 1.00 . A A . 27 CYS HB3 1 1 17 11523 1 1 27 CYS N N 6.410 0.412 2.750 1.00 . A A . 27 CYS N 1 1 17 11524 1 1 27 CYS O O 9.501 0.622 2.095 1.00 . A A . 27 CYS O 1 1 17 11525 1 1 27 CYS SG S 7.473 3.633 0.742 1.00 . A A . 27 CYS SG 1 1 17 11526 1 1 28 HIS C C 10.368 -2.131 1.180 1.00 . A A . 28 HIS C 1 1 17 11527 1 1 28 HIS CA C 9.853 -1.188 0.074 1.00 . A A . 28 HIS CA 1 1 17 11528 1 1 28 HIS CB C 10.864 -0.068 -0.163 1.00 . A A . 28 HIS CB 1 1 17 11529 1 1 28 HIS CD2 C 9.582 0.862 -2.260 1.00 . A A . 28 HIS CD2 1 1 17 11530 1 1 28 HIS CE1 C 9.703 2.974 -1.789 1.00 . A A . 28 HIS CE1 1 1 17 11531 1 1 28 HIS CG C 10.262 0.968 -1.072 1.00 . A A . 28 HIS CG 1 1 17 11532 1 1 28 HIS H H 7.780 -0.636 -0.115 1.00 . A A . 28 HIS H 1 1 17 11533 1 1 28 HIS HA H 9.720 -1.740 -0.841 1.00 . A A . 28 HIS HA 1 1 17 11534 1 1 28 HIS HB2 H 11.124 0.389 0.780 1.00 . A A . 28 HIS HB2 1 1 17 11535 1 1 28 HIS HB3 H 11.751 -0.477 -0.622 1.00 . A A . 28 HIS HB3 1 1 17 11536 1 1 28 HIS HD1 H 10.749 2.733 -0.008 1.00 . A A . 28 HIS HD1 1 1 17 11537 1 1 28 HIS HD2 H 9.353 -0.065 -2.765 1.00 . A A . 28 HIS HD2 1 1 17 11538 1 1 28 HIS HE1 H 9.598 4.047 -1.838 1.00 . A A . 28 HIS HE1 1 1 17 11539 1 1 28 HIS N N 8.582 -0.479 0.427 1.00 . A A . 28 HIS N 1 1 17 11540 1 1 28 HIS ND1 N 10.327 2.323 -0.791 1.00 . A A . 28 HIS ND1 1 1 17 11541 1 1 28 HIS NE2 N 9.230 2.131 -2.711 1.00 . A A . 28 HIS NE2 1 1 17 11542 1 1 28 HIS O O 11.262 -2.913 0.933 1.00 . A A . 28 HIS O 1 1 17 11543 1 1 29 ASP C C 9.764 -2.663 4.817 1.00 . A A . 29 ASP C 1 1 17 11544 1 1 29 ASP CA C 10.341 -3.020 3.442 1.00 . A A . 29 ASP CA 1 1 17 11545 1 1 29 ASP CB C 11.866 -2.843 3.467 1.00 . A A . 29 ASP CB 1 1 17 11546 1 1 29 ASP CG C 12.221 -1.353 3.477 1.00 . A A . 29 ASP CG 1 1 17 11547 1 1 29 ASP H H 9.107 -1.472 2.578 1.00 . A A . 29 ASP H 1 1 17 11548 1 1 29 ASP HA H 10.100 -4.041 3.192 1.00 . A A . 29 ASP HA 1 1 17 11549 1 1 29 ASP HB2 H 12.262 -3.308 4.360 1.00 . A A . 29 ASP HB2 1 1 17 11550 1 1 29 ASP HB3 H 12.304 -3.312 2.602 1.00 . A A . 29 ASP HB3 1 1 17 11551 1 1 29 ASP N N 9.833 -2.092 2.378 1.00 . A A . 29 ASP N 1 1 17 11552 1 1 29 ASP O O 9.256 -3.509 5.522 1.00 . A A . 29 ASP O 1 1 17 11553 1 1 29 ASP OD1 O 12.081 -0.722 2.443 1.00 . A A . 29 ASP OD1 1 1 17 11554 1 1 29 ASP OD2 O 12.631 -0.871 4.519 1.00 . A A . 29 ASP OD2 1 1 17 11555 1 1 30 LYS C C 7.989 -0.329 6.439 1.00 . A A . 30 LYS C 1 1 17 11556 1 1 30 LYS CA C 9.339 -1.036 6.562 1.00 . A A . 30 LYS CA 1 1 17 11557 1 1 30 LYS CB C 10.392 -0.085 7.131 1.00 . A A . 30 LYS CB 1 1 17 11558 1 1 30 LYS CD C 10.779 -0.574 9.552 1.00 . A A . 30 LYS CD 1 1 17 11559 1 1 30 LYS CE C 11.605 0.308 10.490 1.00 . A A . 30 LYS CE 1 1 17 11560 1 1 30 LYS CG C 10.017 0.309 8.562 1.00 . A A . 30 LYS CG 1 1 17 11561 1 1 30 LYS H H 10.293 -0.756 4.648 1.00 . A A . 30 LYS H 1 1 17 11562 1 1 30 LYS HA H 9.248 -1.905 7.195 1.00 . A A . 30 LYS HA 1 1 17 11563 1 1 30 LYS HB2 H 11.355 -0.575 7.133 1.00 . A A . 30 LYS HB2 1 1 17 11564 1 1 30 LYS HB3 H 10.442 0.803 6.517 1.00 . A A . 30 LYS HB3 1 1 17 11565 1 1 30 LYS HD2 H 10.075 -1.156 10.129 1.00 . A A . 30 LYS HD2 1 1 17 11566 1 1 30 LYS HD3 H 11.437 -1.236 9.010 1.00 . A A . 30 LYS HD3 1 1 17 11567 1 1 30 LYS HE2 H 12.316 0.894 9.923 1.00 . A A . 30 LYS HE2 1 1 17 11568 1 1 30 LYS HE3 H 10.961 0.952 11.068 1.00 . A A . 30 LYS HE3 1 1 17 11569 1 1 30 LYS HG2 H 10.275 1.345 8.728 1.00 . A A . 30 LYS HG2 1 1 17 11570 1 1 30 LYS HG3 H 8.956 0.176 8.706 1.00 . A A . 30 LYS HG3 1 1 17 11571 1 1 30 LYS HZ1 H 12.381 -0.238 12.343 1.00 . A A . 30 LYS HZ1 1 1 17 11572 1 1 30 LYS HZ2 H 13.270 -0.825 11.019 1.00 . A A . 30 LYS HZ2 1 1 17 11573 1 1 30 LYS HZ3 H 11.784 -1.539 11.433 1.00 . A A . 30 LYS HZ3 1 1 17 11574 1 1 30 LYS N N 9.861 -1.425 5.218 1.00 . A A . 30 LYS N 1 1 17 11575 1 1 30 LYS NZ N 12.313 -0.645 11.389 1.00 . A A . 30 LYS NZ 1 1 17 11576 1 1 30 LYS O O 7.669 0.250 5.420 1.00 . A A . 30 LYS O 1 1 17 11577 1 1 31 CYS C C 6.017 1.801 7.608 1.00 . A A . 31 CYS C 1 1 17 11578 1 1 31 CYS CA C 5.867 0.288 7.425 1.00 . A A . 31 CYS CA 1 1 17 11579 1 1 31 CYS CB C 5.083 -0.315 8.589 1.00 . A A . 31 CYS CB 1 1 17 11580 1 1 31 CYS H H 7.476 -0.852 8.285 1.00 . A A . 31 CYS H 1 1 17 11581 1 1 31 CYS HA H 5.369 0.069 6.493 1.00 . A A . 31 CYS HA 1 1 17 11582 1 1 31 CYS HB2 H 5.417 -1.326 8.763 1.00 . A A . 31 CYS HB2 1 1 17 11583 1 1 31 CYS HB3 H 5.244 0.277 9.477 1.00 . A A . 31 CYS HB3 1 1 17 11584 1 1 31 CYS N N 7.197 -0.377 7.475 1.00 . A A . 31 CYS N 1 1 17 11585 1 1 31 CYS O O 6.231 2.290 8.700 1.00 . A A . 31 CYS O 1 1 17 11586 1 1 31 CYS SG S 3.320 -0.324 8.183 1.00 . A A . 31 CYS SG 1 1 17 11587 1 1 32 VAL C C 5.065 4.661 5.609 1.00 . A A . 32 VAL C 1 1 17 11588 1 1 32 VAL CA C 6.008 4.023 6.634 1.00 . A A . 32 VAL CA 1 1 17 11589 1 1 32 VAL CB C 7.472 4.337 6.311 1.00 . A A . 32 VAL CB 1 1 17 11590 1 1 32 VAL CG1 C 8.381 3.330 7.023 1.00 . A A . 32 VAL CG1 1 1 17 11591 1 1 32 VAL CG2 C 7.699 4.244 4.802 1.00 . A A . 32 VAL CG2 1 1 17 11592 1 1 32 VAL H H 5.710 2.120 5.679 1.00 . A A . 32 VAL H 1 1 17 11593 1 1 32 VAL HA H 5.766 4.360 7.630 1.00 . A A . 32 VAL HA 1 1 17 11594 1 1 32 VAL HB H 7.709 5.334 6.652 1.00 . A A . 32 VAL HB 1 1 17 11595 1 1 32 VAL HG11 H 8.302 2.368 6.535 1.00 . A A . 32 VAL HG11 1 1 17 11596 1 1 32 VAL HG12 H 8.076 3.236 8.054 1.00 . A A . 32 VAL HG12 1 1 17 11597 1 1 32 VAL HG13 H 9.404 3.672 6.979 1.00 . A A . 32 VAL HG13 1 1 17 11598 1 1 32 VAL HG21 H 8.756 4.154 4.601 1.00 . A A . 32 VAL HG21 1 1 17 11599 1 1 32 VAL HG22 H 7.316 5.135 4.325 1.00 . A A . 32 VAL HG22 1 1 17 11600 1 1 32 VAL HG23 H 7.184 3.379 4.415 1.00 . A A . 32 VAL HG23 1 1 17 11601 1 1 32 VAL N N 5.891 2.541 6.546 1.00 . A A . 32 VAL N 1 1 17 11602 1 1 32 VAL O O 4.425 3.975 4.837 1.00 . A A . 32 VAL O 1 1 17 11603 1 1 33 ARG C C 4.836 7.473 3.630 1.00 . A A . 33 ARG C 1 1 17 11604 1 1 33 ARG CA C 4.045 6.613 4.616 1.00 . A A . 33 ARG CA 1 1 17 11605 1 1 33 ARG CB C 3.113 7.480 5.460 1.00 . A A . 33 ARG CB 1 1 17 11606 1 1 33 ARG CD C 1.005 8.785 5.146 1.00 . A A . 33 ARG CD 1 1 17 11607 1 1 33 ARG CG C 1.712 7.461 4.849 1.00 . A A . 33 ARG CG 1 1 17 11608 1 1 33 ARG CZ C 0.450 9.782 3.011 1.00 . A A . 33 ARG CZ 1 1 17 11609 1 1 33 ARG H H 5.474 6.502 6.229 1.00 . A A . 33 ARG H 1 1 17 11610 1 1 33 ARG HA H 3.472 5.868 4.088 1.00 . A A . 33 ARG HA 1 1 17 11611 1 1 33 ARG HB2 H 3.074 7.095 6.468 1.00 . A A . 33 ARG HB2 1 1 17 11612 1 1 33 ARG HB3 H 3.482 8.493 5.475 1.00 . A A . 33 ARG HB3 1 1 17 11613 1 1 33 ARG HD2 H -0.062 8.631 5.231 1.00 . A A . 33 ARG HD2 1 1 17 11614 1 1 33 ARG HD3 H 1.397 9.226 6.049 1.00 . A A . 33 ARG HD3 1 1 17 11615 1 1 33 ARG HE H 2.171 10.132 3.936 1.00 . A A . 33 ARG HE 1 1 17 11616 1 1 33 ARG HG2 H 1.788 7.324 3.779 1.00 . A A . 33 ARG HG2 1 1 17 11617 1 1 33 ARG HG3 H 1.144 6.649 5.276 1.00 . A A . 33 ARG HG3 1 1 17 11618 1 1 33 ARG HH11 H 0.806 7.967 2.244 1.00 . A A . 33 ARG HH11 1 1 17 11619 1 1 33 ARG HH12 H -0.390 8.909 1.417 1.00 . A A . 33 ARG HH12 1 1 17 11620 1 1 33 ARG HH21 H -0.109 11.629 3.550 1.00 . A A . 33 ARG HH21 1 1 17 11621 1 1 33 ARG HH22 H -0.906 10.981 2.154 1.00 . A A . 33 ARG HH22 1 1 17 11622 1 1 33 ARG N N 4.960 5.959 5.597 1.00 . A A . 33 ARG N 1 1 17 11623 1 1 33 ARG NE N 1.316 9.655 3.979 1.00 . A A . 33 ARG NE 1 1 17 11624 1 1 33 ARG NH1 N 0.275 8.810 2.157 1.00 . A A . 33 ARG NH1 1 1 17 11625 1 1 33 ARG NH2 N -0.243 10.883 2.896 1.00 . A A . 33 ARG NH2 1 1 17 11626 1 1 33 ARG O O 6.036 7.632 3.747 1.00 . A A . 33 ARG O 1 1 17 11627 1 1 34 SER C C 5.809 9.861 2.374 1.00 . A A . 34 SER C 1 1 17 11628 1 1 34 SER CA C 4.879 8.881 1.656 1.00 . A A . 34 SER CA 1 1 17 11629 1 1 34 SER CB C 3.776 9.636 0.910 1.00 . A A . 34 SER CB 1 1 17 11630 1 1 34 SER H H 3.202 7.886 2.580 1.00 . A A . 34 SER H 1 1 17 11631 1 1 34 SER HA H 5.438 8.268 0.967 1.00 . A A . 34 SER HA 1 1 17 11632 1 1 34 SER HB2 H 3.764 10.665 1.227 1.00 . A A . 34 SER HB2 1 1 17 11633 1 1 34 SER HB3 H 3.969 9.591 -0.153 1.00 . A A . 34 SER HB3 1 1 17 11634 1 1 34 SER HG H 1.904 9.295 0.507 1.00 . A A . 34 SER HG 1 1 17 11635 1 1 34 SER N N 4.170 8.029 2.655 1.00 . A A . 34 SER N 1 1 17 11636 1 1 34 SER O O 6.877 10.185 1.895 1.00 . A A . 34 SER O 1 1 17 11637 1 1 34 SER OG O 2.517 9.042 1.201 1.00 . A A . 34 SER OG 1 1 17 11638 1 1 35 GLU C C 7.610 10.634 4.625 1.00 . A A . 35 GLU C 1 1 17 11639 1 1 35 GLU CA C 6.270 11.290 4.275 1.00 . A A . 35 GLU CA 1 1 17 11640 1 1 35 GLU CB C 5.483 11.611 5.546 1.00 . A A . 35 GLU CB 1 1 17 11641 1 1 35 GLU CD C 6.530 12.414 7.667 1.00 . A A . 35 GLU CD 1 1 17 11642 1 1 35 GLU CG C 6.117 12.813 6.250 1.00 . A A . 35 GLU CG 1 1 17 11643 1 1 35 GLU H H 4.545 10.056 3.892 1.00 . A A . 35 GLU H 1 1 17 11644 1 1 35 GLU HA H 6.427 12.188 3.701 1.00 . A A . 35 GLU HA 1 1 17 11645 1 1 35 GLU HB2 H 4.461 11.842 5.285 1.00 . A A . 35 GLU HB2 1 1 17 11646 1 1 35 GLU HB3 H 5.503 10.759 6.207 1.00 . A A . 35 GLU HB3 1 1 17 11647 1 1 35 GLU HG2 H 6.988 13.136 5.697 1.00 . A A . 35 GLU HG2 1 1 17 11648 1 1 35 GLU HG3 H 5.402 13.620 6.299 1.00 . A A . 35 GLU HG3 1 1 17 11649 1 1 35 GLU N N 5.411 10.333 3.523 1.00 . A A . 35 GLU N 1 1 17 11650 1 1 35 GLU O O 8.555 11.297 5.003 1.00 . A A . 35 GLU O 1 1 17 11651 1 1 35 GLU OE1 O 6.661 11.226 7.912 1.00 . A A . 35 GLU OE1 1 1 17 11652 1 1 35 GLU OE2 O 6.705 13.302 8.485 1.00 . A A . 35 GLU OE2 1 1 17 11653 1 1 36 GLU C C 9.528 7.937 3.591 1.00 . A A . 36 GLU C 1 1 17 11654 1 1 36 GLU CA C 8.977 8.644 4.830 1.00 . A A . 36 GLU CA 1 1 17 11655 1 1 36 GLU CB C 8.616 7.630 5.915 1.00 . A A . 36 GLU CB 1 1 17 11656 1 1 36 GLU CD C 10.841 7.944 7.008 1.00 . A A . 36 GLU CD 1 1 17 11657 1 1 36 GLU CG C 9.326 8.005 7.217 1.00 . A A . 36 GLU CG 1 1 17 11658 1 1 36 GLU H H 6.924 8.820 4.198 1.00 . A A . 36 GLU H 1 1 17 11659 1 1 36 GLU HA H 9.699 9.349 5.213 1.00 . A A . 36 GLU HA 1 1 17 11660 1 1 36 GLU HB2 H 7.546 7.637 6.070 1.00 . A A . 36 GLU HB2 1 1 17 11661 1 1 36 GLU HB3 H 8.929 6.644 5.606 1.00 . A A . 36 GLU HB3 1 1 17 11662 1 1 36 GLU HG2 H 9.042 9.007 7.505 1.00 . A A . 36 GLU HG2 1 1 17 11663 1 1 36 GLU HG3 H 9.043 7.313 7.994 1.00 . A A . 36 GLU HG3 1 1 17 11664 1 1 36 GLU N N 7.698 9.339 4.504 1.00 . A A . 36 GLU N 1 1 17 11665 1 1 36 GLU O O 10.702 7.636 3.507 1.00 . A A . 36 GLU O 1 1 17 11666 1 1 36 GLU OE1 O 11.285 7.069 6.283 1.00 . A A . 36 GLU OE1 1 1 17 11667 1 1 36 GLU OE2 O 11.532 8.773 7.577 1.00 . A A . 36 GLU OE2 1 1 17 11668 1 1 37 CYS C C 10.059 7.944 0.578 1.00 . A A . 37 CYS C 1 1 17 11669 1 1 37 CYS CA C 9.177 6.989 1.391 1.00 . A A . 37 CYS CA 1 1 17 11670 1 1 37 CYS CB C 7.913 6.630 0.606 1.00 . A A . 37 CYS CB 1 1 17 11671 1 1 37 CYS H H 7.748 7.927 2.710 1.00 . A A . 37 CYS H 1 1 17 11672 1 1 37 CYS HA H 9.722 6.094 1.645 1.00 . A A . 37 CYS HA 1 1 17 11673 1 1 37 CYS HB2 H 7.320 7.520 0.453 1.00 . A A . 37 CYS HB2 1 1 17 11674 1 1 37 CYS HB3 H 8.190 6.213 -0.350 1.00 . A A . 37 CYS HB3 1 1 17 11675 1 1 37 CYS N N 8.691 7.674 2.624 1.00 . A A . 37 CYS N 1 1 17 11676 1 1 37 CYS O O 9.775 9.119 0.463 1.00 . A A . 37 CYS O 1 1 17 11677 1 1 37 CYS SG S 6.945 5.415 1.536 1.00 . A A . 37 CYS SG 1 1 17 11678 1 1 38 LEU C C 11.218 9.117 -1.811 1.00 . A A . 38 LEU C 1 1 17 11679 1 1 38 LEU CA C 12.028 8.330 -0.780 1.00 . A A . 38 LEU CA 1 1 17 11680 1 1 38 LEU CB C 12.999 7.377 -1.478 1.00 . A A . 38 LEU CB 1 1 17 11681 1 1 38 LEU CD1 C 15.159 6.174 -1.114 1.00 . A A . 38 LEU CD1 1 1 17 11682 1 1 38 LEU CD2 C 15.130 8.666 -1.272 1.00 . A A . 38 LEU CD2 1 1 17 11683 1 1 38 LEU CG C 14.360 7.436 -0.783 1.00 . A A . 38 LEU CG 1 1 17 11684 1 1 38 LEU H H 11.341 6.499 0.126 1.00 . A A . 38 LEU H 1 1 17 11685 1 1 38 LEU HA H 12.570 9.000 -0.133 1.00 . A A . 38 LEU HA 1 1 17 11686 1 1 38 LEU HB2 H 12.612 6.369 -1.429 1.00 . A A . 38 LEU HB2 1 1 17 11687 1 1 38 LEU HB3 H 13.112 7.669 -2.510 1.00 . A A . 38 LEU HB3 1 1 17 11688 1 1 38 LEU HD11 H 14.844 5.790 -2.073 1.00 . A A . 38 LEU HD11 1 1 17 11689 1 1 38 LEU HD12 H 14.985 5.428 -0.353 1.00 . A A . 38 LEU HD12 1 1 17 11690 1 1 38 LEU HD13 H 16.212 6.414 -1.150 1.00 . A A . 38 LEU HD13 1 1 17 11691 1 1 38 LEU HD21 H 14.784 9.541 -0.744 1.00 . A A . 38 LEU HD21 1 1 17 11692 1 1 38 LEU HD22 H 14.964 8.796 -2.332 1.00 . A A . 38 LEU HD22 1 1 17 11693 1 1 38 LEU HD23 H 16.185 8.528 -1.088 1.00 . A A . 38 LEU HD23 1 1 17 11694 1 1 38 LEU HG H 14.218 7.500 0.286 1.00 . A A . 38 LEU HG 1 1 17 11695 1 1 38 LEU N N 11.128 7.448 0.019 1.00 . A A . 38 LEU N 1 1 17 11696 1 1 38 LEU O O 10.992 10.303 -1.664 1.00 . A A . 38 LEU O 1 1 17 11697 1 1 39 SER C C 8.504 9.195 -3.510 1.00 . A A . 39 SER C 1 1 17 11698 1 1 39 SER CA C 9.985 9.184 -3.894 1.00 . A A . 39 SER CA 1 1 17 11699 1 1 39 SER CB C 10.197 8.380 -5.176 1.00 . A A . 39 SER CB 1 1 17 11700 1 1 39 SER H H 10.973 7.514 -2.956 1.00 . A A . 39 SER H 1 1 17 11701 1 1 39 SER HA H 10.349 10.191 -4.026 1.00 . A A . 39 SER HA 1 1 17 11702 1 1 39 SER HB2 H 10.696 7.455 -4.945 1.00 . A A . 39 SER HB2 1 1 17 11703 1 1 39 SER HB3 H 9.237 8.165 -5.627 1.00 . A A . 39 SER HB3 1 1 17 11704 1 1 39 SER HG H 11.551 9.724 -5.558 1.00 . A A . 39 SER HG 1 1 17 11705 1 1 39 SER N N 10.779 8.470 -2.855 1.00 . A A . 39 SER N 1 1 17 11706 1 1 39 SER O O 8.151 9.024 -2.360 1.00 . A A . 39 SER O 1 1 17 11707 1 1 39 SER OG O 10.999 9.134 -6.075 1.00 . A A . 39 SER OG 1 1 17 11708 1 1 40 GLY C C 5.619 7.990 -4.270 1.00 . A A . 40 GLY C 1 1 17 11709 1 1 40 GLY CA C 6.179 9.408 -4.151 1.00 . A A . 40 GLY CA 1 1 17 11710 1 1 40 GLY H H 7.941 9.523 -5.385 1.00 . A A . 40 GLY H 1 1 17 11711 1 1 40 GLY HA2 H 6.031 9.773 -3.144 1.00 . A A . 40 GLY HA2 1 1 17 11712 1 1 40 GLY HA3 H 5.668 10.054 -4.849 1.00 . A A . 40 GLY HA3 1 1 17 11713 1 1 40 GLY N N 7.636 9.391 -4.463 1.00 . A A . 40 GLY N 1 1 17 11714 1 1 40 GLY O O 4.489 7.791 -4.672 1.00 . A A . 40 GLY O 1 1 17 11715 1 1 41 THR C C 5.536 5.067 -2.633 1.00 . A A . 41 THR C 1 1 17 11716 1 1 41 THR CA C 5.909 5.597 -4.021 1.00 . A A . 41 THR CA 1 1 17 11717 1 1 41 THR CB C 7.081 4.805 -4.605 1.00 . A A . 41 THR CB 1 1 17 11718 1 1 41 THR CG2 C 8.220 4.749 -3.587 1.00 . A A . 41 THR CG2 1 1 17 11719 1 1 41 THR H H 7.308 7.184 -3.605 1.00 . A A . 41 THR H 1 1 17 11720 1 1 41 THR HA H 5.061 5.541 -4.685 1.00 . A A . 41 THR HA 1 1 17 11721 1 1 41 THR HB H 7.431 5.287 -5.504 1.00 . A A . 41 THR HB 1 1 17 11722 1 1 41 THR HG1 H 7.100 3.204 -5.710 1.00 . A A . 41 THR HG1 1 1 17 11723 1 1 41 THR HG21 H 7.914 4.159 -2.736 1.00 . A A . 41 THR HG21 1 1 17 11724 1 1 41 THR HG22 H 8.464 5.750 -3.264 1.00 . A A . 41 THR HG22 1 1 17 11725 1 1 41 THR HG23 H 9.089 4.297 -4.044 1.00 . A A . 41 THR HG23 1 1 17 11726 1 1 41 THR N N 6.399 7.003 -3.925 1.00 . A A . 41 THR N 1 1 17 11727 1 1 41 THR O O 6.320 5.115 -1.705 1.00 . A A . 41 THR O 1 1 17 11728 1 1 41 THR OG1 O 6.651 3.486 -4.910 1.00 . A A . 41 THR OG1 1 1 17 11729 1 1 42 TRP C C 2.936 2.859 -1.390 1.00 . A A . 42 TRP C 1 1 17 11730 1 1 42 TRP CA C 3.900 4.029 -1.166 1.00 . A A . 42 TRP CA 1 1 17 11731 1 1 42 TRP CB C 3.191 5.210 -0.498 1.00 . A A . 42 TRP CB 1 1 17 11732 1 1 42 TRP CD1 C 3.239 4.572 1.949 1.00 . A A . 42 TRP CD1 1 1 17 11733 1 1 42 TRP CD2 C 1.166 4.522 1.078 1.00 . A A . 42 TRP CD2 1 1 17 11734 1 1 42 TRP CE2 C 1.042 4.156 2.439 1.00 . A A . 42 TRP CE2 1 1 17 11735 1 1 42 TRP CE3 C -0.001 4.569 0.294 1.00 . A A . 42 TRP CE3 1 1 17 11736 1 1 42 TRP CG C 2.570 4.781 0.792 1.00 . A A . 42 TRP CG 1 1 17 11737 1 1 42 TRP CH2 C -1.348 3.898 2.208 1.00 . A A . 42 TRP CH2 1 1 17 11738 1 1 42 TRP CZ2 C -0.197 3.845 3.002 1.00 . A A . 42 TRP CZ2 1 1 17 11739 1 1 42 TRP CZ3 C -1.249 4.258 0.857 1.00 . A A . 42 TRP CZ3 1 1 17 11740 1 1 42 TRP H H 3.728 4.540 -3.252 1.00 . A A . 42 TRP H 1 1 17 11741 1 1 42 TRP HA H 4.748 3.719 -0.577 1.00 . A A . 42 TRP HA 1 1 17 11742 1 1 42 TRP HB2 H 3.908 5.993 -0.304 1.00 . A A . 42 TRP HB2 1 1 17 11743 1 1 42 TRP HB3 H 2.424 5.584 -1.159 1.00 . A A . 42 TRP HB3 1 1 17 11744 1 1 42 TRP HD1 H 4.305 4.679 2.085 1.00 . A A . 42 TRP HD1 1 1 17 11745 1 1 42 TRP HE1 H 2.564 3.996 3.860 1.00 . A A . 42 TRP HE1 1 1 17 11746 1 1 42 TRP HE3 H 0.064 4.846 -0.747 1.00 . A A . 42 TRP HE3 1 1 17 11747 1 1 42 TRP HH2 H -2.310 3.660 2.635 1.00 . A A . 42 TRP HH2 1 1 17 11748 1 1 42 TRP HZ2 H -0.268 3.569 4.044 1.00 . A A . 42 TRP HZ2 1 1 17 11749 1 1 42 TRP HZ3 H -2.138 4.298 0.245 1.00 . A A . 42 TRP HZ3 1 1 17 11750 1 1 42 TRP N N 4.342 4.564 -2.487 1.00 . A A . 42 TRP N 1 1 17 11751 1 1 42 TRP NE1 N 2.335 4.203 2.929 1.00 . A A . 42 TRP NE1 1 1 17 11752 1 1 42 TRP O O 2.027 2.947 -2.191 1.00 . A A . 42 TRP O 1 1 17 11753 1 1 43 THR C C 1.590 0.135 0.397 1.00 . A A . 43 THR C 1 1 17 11754 1 1 43 THR CA C 2.207 0.602 -0.923 1.00 . A A . 43 THR CA 1 1 17 11755 1 1 43 THR CB C 3.088 -0.499 -1.517 1.00 . A A . 43 THR CB 1 1 17 11756 1 1 43 THR CG2 C 4.208 -0.847 -0.537 1.00 . A A . 43 THR CG2 1 1 17 11757 1 1 43 THR H H 3.868 1.689 -0.064 1.00 . A A . 43 THR H 1 1 17 11758 1 1 43 THR HA H 1.432 0.866 -1.623 1.00 . A A . 43 THR HA 1 1 17 11759 1 1 43 THR HB H 3.520 -0.152 -2.443 1.00 . A A . 43 THR HB 1 1 17 11760 1 1 43 THR HG1 H 2.845 -2.426 -1.615 1.00 . A A . 43 THR HG1 1 1 17 11761 1 1 43 THR HG21 H 3.781 -1.093 0.423 1.00 . A A . 43 THR HG21 1 1 17 11762 1 1 43 THR HG22 H 4.870 0.000 -0.432 1.00 . A A . 43 THR HG22 1 1 17 11763 1 1 43 THR HG23 H 4.763 -1.694 -0.912 1.00 . A A . 43 THR HG23 1 1 17 11764 1 1 43 THR N N 3.125 1.759 -0.706 1.00 . A A . 43 THR N 1 1 17 11765 1 1 43 THR O O 2.164 0.289 1.455 1.00 . A A . 43 THR O 1 1 17 11766 1 1 43 THR OG1 O 2.297 -1.653 -1.766 1.00 . A A . 43 THR OG1 1 1 17 11767 1 1 44 GLN C C -0.844 -2.316 1.318 1.00 . A A . 44 GLN C 1 1 17 11768 1 1 44 GLN CA C -0.242 -0.933 1.572 1.00 . A A . 44 GLN CA 1 1 17 11769 1 1 44 GLN CB C -1.339 0.089 1.868 1.00 . A A . 44 GLN CB 1 1 17 11770 1 1 44 GLN CD C -3.738 0.358 1.225 1.00 . A A . 44 GLN CD 1 1 17 11771 1 1 44 GLN CG C -2.320 0.135 0.695 1.00 . A A . 44 GLN CG 1 1 17 11772 1 1 44 GLN H H -0.016 -0.559 -0.536 1.00 . A A . 44 GLN H 1 1 17 11773 1 1 44 GLN HA H 0.460 -0.972 2.390 1.00 . A A . 44 GLN HA 1 1 17 11774 1 1 44 GLN HB2 H -1.863 -0.197 2.767 1.00 . A A . 44 GLN HB2 1 1 17 11775 1 1 44 GLN HB3 H -0.896 1.064 2.001 1.00 . A A . 44 GLN HB3 1 1 17 11776 1 1 44 GLN HE21 H -3.157 1.591 2.669 1.00 . A A . 44 GLN HE21 1 1 17 11777 1 1 44 GLN HE22 H -4.827 1.298 2.594 1.00 . A A . 44 GLN HE22 1 1 17 11778 1 1 44 GLN HG2 H -2.051 0.945 0.033 1.00 . A A . 44 GLN HG2 1 1 17 11779 1 1 44 GLN HG3 H -2.282 -0.800 0.155 1.00 . A A . 44 GLN HG3 1 1 17 11780 1 1 44 GLN N N 0.424 -0.442 0.333 1.00 . A A . 44 GLN N 1 1 17 11781 1 1 44 GLN NE2 N -3.923 1.148 2.247 1.00 . A A . 44 GLN NE2 1 1 17 11782 1 1 44 GLN O O -1.864 -2.673 1.872 1.00 . A A . 44 GLN O 1 1 17 11783 1 1 44 GLN OE1 O -4.687 -0.191 0.703 1.00 . A A . 44 GLN OE1 1 1 17 11784 1 1 45 GLN C C 0.421 -5.409 -0.121 1.00 . A A . 45 GLN C 1 1 17 11785 1 1 45 GLN CA C -0.739 -4.460 0.190 1.00 . A A . 45 GLN CA 1 1 17 11786 1 1 45 GLN CB C -1.630 -4.286 -1.041 1.00 . A A . 45 GLN CB 1 1 17 11787 1 1 45 GLN CD C -3.947 -3.788 -1.828 1.00 . A A . 45 GLN CD 1 1 17 11788 1 1 45 GLN CG C -3.034 -3.865 -0.603 1.00 . A A . 45 GLN CG 1 1 17 11789 1 1 45 GLN H H 0.610 -2.786 0.052 1.00 . A A . 45 GLN H 1 1 17 11790 1 1 45 GLN HA H -1.319 -4.830 1.018 1.00 . A A . 45 GLN HA 1 1 17 11791 1 1 45 GLN HB2 H -1.210 -3.525 -1.683 1.00 . A A . 45 GLN HB2 1 1 17 11792 1 1 45 GLN HB3 H -1.687 -5.219 -1.579 1.00 . A A . 45 GLN HB3 1 1 17 11793 1 1 45 GLN HE21 H -5.543 -4.465 -0.861 1.00 . A A . 45 GLN HE21 1 1 17 11794 1 1 45 GLN HE22 H -5.788 -4.103 -2.501 1.00 . A A . 45 GLN HE22 1 1 17 11795 1 1 45 GLN HG2 H -3.426 -4.593 0.094 1.00 . A A . 45 GLN HG2 1 1 17 11796 1 1 45 GLN HG3 H -2.990 -2.897 -0.129 1.00 . A A . 45 GLN HG3 1 1 17 11797 1 1 45 GLN N N -0.213 -3.097 0.484 1.00 . A A . 45 GLN N 1 1 17 11798 1 1 45 GLN NE2 N -5.197 -4.149 -1.721 1.00 . A A . 45 GLN NE2 1 1 17 11799 1 1 45 GLN O O 0.995 -5.373 -1.190 1.00 . A A . 45 GLN O 1 1 17 11800 1 1 45 GLN OE1 O -3.517 -3.396 -2.895 1.00 . A A . 45 GLN OE1 1 1 17 11801 1 1 46 ILE C C 1.693 -8.512 1.345 1.00 . A A . 46 ILE C 1 1 17 11802 1 1 46 ILE CA C 1.892 -7.212 0.556 1.00 . A A . 46 ILE CA 1 1 17 11803 1 1 46 ILE CB C 3.152 -6.480 1.027 1.00 . A A . 46 ILE CB 1 1 17 11804 1 1 46 ILE CD1 C 5.297 -7.067 -0.107 1.00 . A A . 46 ILE CD1 1 1 17 11805 1 1 46 ILE CG1 C 4.336 -7.449 1.018 1.00 . A A . 46 ILE CG1 1 1 17 11806 1 1 46 ILE CG2 C 2.946 -5.946 2.447 1.00 . A A . 46 ILE CG2 1 1 17 11807 1 1 46 ILE H H 0.292 -6.273 1.660 1.00 . A A . 46 ILE H 1 1 17 11808 1 1 46 ILE HA H 1.969 -7.425 -0.498 1.00 . A A . 46 ILE HA 1 1 17 11809 1 1 46 ILE HB H 3.357 -5.654 0.362 1.00 . A A . 46 ILE HB 1 1 17 11810 1 1 46 ILE HD11 H 4.734 -6.704 -0.955 1.00 . A A . 46 ILE HD11 1 1 17 11811 1 1 46 ILE HD12 H 5.871 -7.934 -0.401 1.00 . A A . 46 ILE HD12 1 1 17 11812 1 1 46 ILE HD13 H 5.967 -6.293 0.237 1.00 . A A . 46 ILE HD13 1 1 17 11813 1 1 46 ILE HG12 H 4.850 -7.397 1.966 1.00 . A A . 46 ILE HG12 1 1 17 11814 1 1 46 ILE HG13 H 3.978 -8.455 0.856 1.00 . A A . 46 ILE HG13 1 1 17 11815 1 1 46 ILE HG21 H 2.211 -6.549 2.957 1.00 . A A . 46 ILE HG21 1 1 17 11816 1 1 46 ILE HG22 H 2.604 -4.922 2.401 1.00 . A A . 46 ILE HG22 1 1 17 11817 1 1 46 ILE HG23 H 3.881 -5.988 2.984 1.00 . A A . 46 ILE HG23 1 1 17 11818 1 1 46 ILE N N 0.769 -6.260 0.805 1.00 . A A . 46 ILE N 1 1 17 11819 1 1 46 ILE O O 2.126 -9.568 0.928 1.00 . A A . 46 ILE O 1 1 17 11820 1 1 47 CYS C C -0.620 -10.126 3.224 1.00 . A A . 47 CYS C 1 1 17 11821 1 1 47 CYS CA C 0.846 -9.689 3.287 1.00 . A A . 47 CYS CA 1 1 17 11822 1 1 47 CYS CB C 1.233 -9.300 4.716 1.00 . A A . 47 CYS CB 1 1 17 11823 1 1 47 CYS H H 0.714 -7.595 2.810 1.00 . A A . 47 CYS H 1 1 17 11824 1 1 47 CYS HA H 1.490 -10.478 2.933 1.00 . A A . 47 CYS HA 1 1 17 11825 1 1 47 CYS HB2 H 0.461 -8.677 5.143 1.00 . A A . 47 CYS HB2 1 1 17 11826 1 1 47 CYS HB3 H 1.345 -10.193 5.314 1.00 . A A . 47 CYS HB3 1 1 17 11827 1 1 47 CYS N N 1.053 -8.451 2.482 1.00 . A A . 47 CYS N 1 1 17 11828 1 1 47 CYS O O -1.490 -9.503 3.799 1.00 . A A . 47 CYS O 1 1 17 11829 1 1 47 CYS SG S 2.800 -8.389 4.696 1.00 . A A . 47 CYS SG 1 1 17 11830 1 1 48 LEU C C -2.576 -12.750 3.484 1.00 . A A . 48 LEU C 1 1 17 11831 1 1 48 LEU CA C -2.306 -11.676 2.427 1.00 . A A . 48 LEU CA 1 1 17 11832 1 1 48 LEU CB C -2.422 -12.264 1.020 1.00 . A A . 48 LEU CB 1 1 17 11833 1 1 48 LEU CD1 C -1.165 -10.566 -0.316 1.00 . A A . 48 LEU CD1 1 1 17 11834 1 1 48 LEU CD2 C -3.186 -11.672 -1.284 1.00 . A A . 48 LEU CD2 1 1 17 11835 1 1 48 LEU CG C -2.551 -11.131 -0.001 1.00 . A A . 48 LEU CG 1 1 17 11836 1 1 48 LEU H H -0.181 -11.684 2.073 1.00 . A A . 48 LEU H 1 1 17 11837 1 1 48 LEU HA H -2.995 -10.853 2.541 1.00 . A A . 48 LEU HA 1 1 17 11838 1 1 48 LEU HB2 H -1.540 -12.848 0.802 1.00 . A A . 48 LEU HB2 1 1 17 11839 1 1 48 LEU HB3 H -3.295 -12.897 0.965 1.00 . A A . 48 LEU HB3 1 1 17 11840 1 1 48 LEU HD11 H -0.539 -11.350 -0.718 1.00 . A A . 48 LEU HD11 1 1 17 11841 1 1 48 LEU HD12 H -0.719 -10.177 0.588 1.00 . A A . 48 LEU HD12 1 1 17 11842 1 1 48 LEU HD13 H -1.257 -9.772 -1.042 1.00 . A A . 48 LEU HD13 1 1 17 11843 1 1 48 LEU HD21 H -2.425 -12.136 -1.894 1.00 . A A . 48 LEU HD21 1 1 17 11844 1 1 48 LEU HD22 H -3.639 -10.858 -1.832 1.00 . A A . 48 LEU HD22 1 1 17 11845 1 1 48 LEU HD23 H -3.941 -12.402 -1.033 1.00 . A A . 48 LEU HD23 1 1 17 11846 1 1 48 LEU HG H -3.173 -10.349 0.409 1.00 . A A . 48 LEU HG 1 1 17 11847 1 1 48 LEU N N -0.898 -11.196 2.529 1.00 . A A . 48 LEU N 1 1 17 11848 1 1 48 LEU O O -3.058 -12.399 4.548 1.00 . A A . 48 LEU O 1 1 17 11849 1 1 48 LEU OXT O -2.298 -13.906 3.209 1.00 . A A . 48 LEU OXT 1 1 18 11850 1 1 1 GLY C C -8.043 7.217 17.134 1.00 . A A . 1 GLY C 1 1 18 11851 1 1 1 GLY CA C -9.112 8.055 17.833 1.00 . A A . 1 GLY CA 1 1 18 11852 1 1 1 GLY H1 H -7.557 9.419 18.074 1.00 . A A . 1 GLY H1 1 1 18 11853 1 1 1 GLY H2 H -8.308 8.960 19.528 1.00 . A A . 1 GLY H2 1 1 18 11854 1 1 1 GLY H3 H -9.086 10.038 18.469 1.00 . A A . 1 GLY H3 1 1 18 11855 1 1 1 GLY HA2 H -9.634 7.445 18.556 1.00 . A A . 1 GLY HA2 1 1 18 11856 1 1 1 GLY HA3 H -9.812 8.423 17.099 1.00 . A A . 1 GLY HA3 1 1 18 11857 1 1 1 GLY N N -8.467 9.205 18.528 1.00 . A A . 1 GLY N 1 1 18 11858 1 1 1 GLY O O -7.686 7.468 16.000 1.00 . A A . 1 GLY O 1 1 18 11859 1 1 2 SER C C -5.458 6.244 16.444 1.00 . A A . 2 SER C 1 1 18 11860 1 1 2 SER CA C -6.478 5.367 17.172 1.00 . A A . 2 SER CA 1 1 18 11861 1 1 2 SER CB C -7.231 4.481 16.183 1.00 . A A . 2 SER CB 1 1 18 11862 1 1 2 SER H H -7.827 6.034 18.714 1.00 . A A . 2 SER H 1 1 18 11863 1 1 2 SER HA H -5.990 4.759 17.917 1.00 . A A . 2 SER HA 1 1 18 11864 1 1 2 SER HB2 H -6.677 3.572 16.018 1.00 . A A . 2 SER HB2 1 1 18 11865 1 1 2 SER HB3 H -8.204 4.238 16.588 1.00 . A A . 2 SER HB3 1 1 18 11866 1 1 2 SER HG H -7.414 6.112 15.139 1.00 . A A . 2 SER HG 1 1 18 11867 1 1 2 SER N N -7.527 6.220 17.801 1.00 . A A . 2 SER N 1 1 18 11868 1 1 2 SER O O -5.016 5.931 15.355 1.00 . A A . 2 SER O 1 1 18 11869 1 1 2 SER OG O -7.376 5.171 14.951 1.00 . A A . 2 SER OG 1 1 18 11870 1 1 3 ALA C C -2.768 7.513 16.166 1.00 . A A . 3 ALA C 1 1 18 11871 1 1 3 ALA CA C -4.093 8.249 16.386 1.00 . A A . 3 ALA CA 1 1 18 11872 1 1 3 ALA CB C -3.918 9.407 17.372 1.00 . A A . 3 ALA CB 1 1 18 11873 1 1 3 ALA H H -5.454 7.575 17.915 1.00 . A A . 3 ALA H 1 1 18 11874 1 1 3 ALA HA H -4.480 8.617 15.451 1.00 . A A . 3 ALA HA 1 1 18 11875 1 1 3 ALA HB1 H -4.266 9.103 18.348 1.00 . A A . 3 ALA HB1 1 1 18 11876 1 1 3 ALA HB2 H -4.492 10.257 17.034 1.00 . A A . 3 ALA HB2 1 1 18 11877 1 1 3 ALA HB3 H -2.875 9.678 17.431 1.00 . A A . 3 ALA HB3 1 1 18 11878 1 1 3 ALA N N -5.083 7.343 17.038 1.00 . A A . 3 ALA N 1 1 18 11879 1 1 3 ALA O O -2.724 6.300 16.114 1.00 . A A . 3 ALA O 1 1 18 11880 1 1 4 MET C C -0.289 7.006 14.398 1.00 . A A . 4 MET C 1 1 18 11881 1 1 4 MET CA C -0.361 7.585 15.814 1.00 . A A . 4 MET CA 1 1 18 11882 1 1 4 MET CB C -0.277 6.470 16.860 1.00 . A A . 4 MET CB 1 1 18 11883 1 1 4 MET CE C -0.026 5.586 19.818 1.00 . A A . 4 MET CE 1 1 18 11884 1 1 4 MET CG C 1.105 6.487 17.514 1.00 . A A . 4 MET CG 1 1 18 11885 1 1 4 MET H H -1.745 9.215 16.074 1.00 . A A . 4 MET H 1 1 18 11886 1 1 4 MET HA H 0.435 8.295 15.969 1.00 . A A . 4 MET HA 1 1 18 11887 1 1 4 MET HB2 H -1.035 6.627 17.614 1.00 . A A . 4 MET HB2 1 1 18 11888 1 1 4 MET HB3 H -0.437 5.515 16.382 1.00 . A A . 4 MET HB3 1 1 18 11889 1 1 4 MET HE1 H 0.407 5.685 20.805 1.00 . A A . 4 MET HE1 1 1 18 11890 1 1 4 MET HE2 H -0.804 4.841 19.844 1.00 . A A . 4 MET HE2 1 1 18 11891 1 1 4 MET HE3 H -0.446 6.532 19.506 1.00 . A A . 4 MET HE3 1 1 18 11892 1 1 4 MET HG2 H 1.866 6.418 16.752 1.00 . A A . 4 MET HG2 1 1 18 11893 1 1 4 MET HG3 H 1.232 7.407 18.065 1.00 . A A . 4 MET HG3 1 1 18 11894 1 1 4 MET N N -1.686 8.238 16.033 1.00 . A A . 4 MET N 1 1 18 11895 1 1 4 MET O O 0.416 7.510 13.547 1.00 . A A . 4 MET O 1 1 18 11896 1 1 4 MET SD S 1.257 5.081 18.645 1.00 . A A . 4 MET SD 1 1 18 11897 1 1 5 GLY C C -0.426 3.928 12.854 1.00 . A A . 5 GLY C 1 1 18 11898 1 1 5 GLY CA C -0.983 5.350 12.776 1.00 . A A . 5 GLY CA 1 1 18 11899 1 1 5 GLY H H -1.577 5.560 14.836 1.00 . A A . 5 GLY H 1 1 18 11900 1 1 5 GLY HA2 H -1.986 5.323 12.372 1.00 . A A . 5 GLY HA2 1 1 18 11901 1 1 5 GLY HA3 H -0.353 5.945 12.133 1.00 . A A . 5 GLY HA3 1 1 18 11902 1 1 5 GLY N N -1.013 5.952 14.138 1.00 . A A . 5 GLY N 1 1 18 11903 1 1 5 GLY O O -0.148 3.417 13.920 1.00 . A A . 5 GLY O 1 1 18 11904 1 1 6 CYS C C 1.819 1.931 11.787 1.00 . A A . 6 CYS C 1 1 18 11905 1 1 6 CYS CA C 0.289 1.899 11.740 1.00 . A A . 6 CYS CA 1 1 18 11906 1 1 6 CYS CB C -0.212 1.205 10.457 1.00 . A A . 6 CYS CB 1 1 18 11907 1 1 6 CYS H H -0.483 3.725 10.892 1.00 . A A . 6 CYS H 1 1 18 11908 1 1 6 CYS HA H -0.087 1.370 12.604 1.00 . A A . 6 CYS HA 1 1 18 11909 1 1 6 CYS HB2 H 0.394 0.332 10.269 1.00 . A A . 6 CYS HB2 1 1 18 11910 1 1 6 CYS HB3 H -1.238 0.896 10.601 1.00 . A A . 6 CYS HB3 1 1 18 11911 1 1 6 CYS N N -0.257 3.289 11.730 1.00 . A A . 6 CYS N 1 1 18 11912 1 1 6 CYS O O 2.467 0.905 11.828 1.00 . A A . 6 CYS O 1 1 18 11913 1 1 6 CYS SG S -0.116 2.307 9.016 1.00 . A A . 6 CYS SG 1 1 18 11914 1 1 7 ARG C C 4.369 2.477 13.142 1.00 . A A . 7 ARG C 1 1 18 11915 1 1 7 ARG CA C 3.891 3.178 11.870 1.00 . A A . 7 ARG CA 1 1 18 11916 1 1 7 ARG CB C 4.212 4.671 11.932 1.00 . A A . 7 ARG CB 1 1 18 11917 1 1 7 ARG CD C 4.766 6.578 10.418 1.00 . A A . 7 ARG CD 1 1 18 11918 1 1 7 ARG CG C 3.919 5.314 10.577 1.00 . A A . 7 ARG CG 1 1 18 11919 1 1 7 ARG CZ C 2.840 7.938 9.857 1.00 . A A . 7 ARG CZ 1 1 18 11920 1 1 7 ARG H H 1.868 3.918 11.783 1.00 . A A . 7 ARG H 1 1 18 11921 1 1 7 ARG HA H 4.339 2.732 10.996 1.00 . A A . 7 ARG HA 1 1 18 11922 1 1 7 ARG HB2 H 3.603 5.138 12.692 1.00 . A A . 7 ARG HB2 1 1 18 11923 1 1 7 ARG HB3 H 5.256 4.806 12.173 1.00 . A A . 7 ARG HB3 1 1 18 11924 1 1 7 ARG HD2 H 4.891 7.068 11.374 1.00 . A A . 7 ARG HD2 1 1 18 11925 1 1 7 ARG HD3 H 5.725 6.338 9.987 1.00 . A A . 7 ARG HD3 1 1 18 11926 1 1 7 ARG HE H 4.343 7.641 8.593 1.00 . A A . 7 ARG HE 1 1 18 11927 1 1 7 ARG HG2 H 4.159 4.616 9.787 1.00 . A A . 7 ARG HG2 1 1 18 11928 1 1 7 ARG HG3 H 2.875 5.576 10.523 1.00 . A A . 7 ARG HG3 1 1 18 11929 1 1 7 ARG HH11 H 3.068 7.424 11.780 1.00 . A A . 7 ARG HH11 1 1 18 11930 1 1 7 ARG HH12 H 1.591 8.240 11.392 1.00 . A A . 7 ARG HH12 1 1 18 11931 1 1 7 ARG HH21 H 2.342 8.566 8.024 1.00 . A A . 7 ARG HH21 1 1 18 11932 1 1 7 ARG HH22 H 1.180 8.887 9.267 1.00 . A A . 7 ARG HH22 1 1 18 11933 1 1 7 ARG N N 2.404 3.098 11.802 1.00 . A A . 7 ARG N 1 1 18 11934 1 1 7 ARG NE N 3.990 7.443 9.485 1.00 . A A . 7 ARG NE 1 1 18 11935 1 1 7 ARG NH1 N 2.472 7.861 11.108 1.00 . A A . 7 ARG NH1 1 1 18 11936 1 1 7 ARG NH2 N 2.060 8.507 8.981 1.00 . A A . 7 ARG NH2 1 1 18 11937 1 1 7 ARG O O 5.471 1.967 13.214 1.00 . A A . 7 ARG O 1 1 18 11938 1 1 8 HIS C C 3.774 0.259 15.270 1.00 . A A . 8 HIS C 1 1 18 11939 1 1 8 HIS CA C 3.914 1.780 15.421 1.00 . A A . 8 HIS CA 1 1 18 11940 1 1 8 HIS CB C 2.918 2.341 16.451 1.00 . A A . 8 HIS CB 1 1 18 11941 1 1 8 HIS CD2 C 1.604 0.370 17.593 1.00 . A A . 8 HIS CD2 1 1 18 11942 1 1 8 HIS CE1 C 2.829 0.158 19.366 1.00 . A A . 8 HIS CE1 1 1 18 11943 1 1 8 HIS CG C 2.602 1.309 17.502 1.00 . A A . 8 HIS CG 1 1 18 11944 1 1 8 HIS H H 2.653 2.864 14.056 1.00 . A A . 8 HIS H 1 1 18 11945 1 1 8 HIS HA H 4.922 2.043 15.700 1.00 . A A . 8 HIS HA 1 1 18 11946 1 1 8 HIS HB2 H 3.349 3.211 16.926 1.00 . A A . 8 HIS HB2 1 1 18 11947 1 1 8 HIS HB3 H 2.007 2.627 15.947 1.00 . A A . 8 HIS HB3 1 1 18 11948 1 1 8 HIS HD1 H 4.165 1.678 18.883 1.00 . A A . 8 HIS HD1 1 1 18 11949 1 1 8 HIS HD2 H 0.825 0.218 16.859 1.00 . A A . 8 HIS HD2 1 1 18 11950 1 1 8 HIS HE1 H 3.222 -0.187 20.311 1.00 . A A . 8 HIS HE1 1 1 18 11951 1 1 8 HIS N N 3.536 2.448 14.145 1.00 . A A . 8 HIS N 1 1 18 11952 1 1 8 HIS ND1 N 3.371 1.156 18.644 1.00 . A A . 8 HIS ND1 1 1 18 11953 1 1 8 HIS NE2 N 1.749 -0.355 18.770 1.00 . A A . 8 HIS NE2 1 1 18 11954 1 1 8 HIS O O 4.400 -0.506 15.977 1.00 . A A . 8 HIS O 1 1 18 11955 1 1 9 PHE C C 4.121 -2.336 13.984 1.00 . A A . 9 PHE C 1 1 18 11956 1 1 9 PHE CA C 2.766 -1.642 14.152 1.00 . A A . 9 PHE CA 1 1 18 11957 1 1 9 PHE CB C 1.940 -1.751 12.869 1.00 . A A . 9 PHE CB 1 1 18 11958 1 1 9 PHE CD1 C 0.179 -0.673 14.344 1.00 . A A . 9 PHE CD1 1 1 18 11959 1 1 9 PHE CD2 C -0.413 -1.301 12.079 1.00 . A A . 9 PHE CD2 1 1 18 11960 1 1 9 PHE CE1 C -1.121 -0.199 14.552 1.00 . A A . 9 PHE CE1 1 1 18 11961 1 1 9 PHE CE2 C -1.713 -0.828 12.287 1.00 . A A . 9 PHE CE2 1 1 18 11962 1 1 9 PHE CG C 0.536 -1.226 13.104 1.00 . A A . 9 PHE CG 1 1 18 11963 1 1 9 PHE CZ C -2.067 -0.277 13.524 1.00 . A A . 9 PHE CZ 1 1 18 11964 1 1 9 PHE H H 2.460 0.457 13.799 1.00 . A A . 9 PHE H 1 1 18 11965 1 1 9 PHE HA H 2.221 -2.070 14.978 1.00 . A A . 9 PHE HA 1 1 18 11966 1 1 9 PHE HB2 H 2.412 -1.172 12.089 1.00 . A A . 9 PHE HB2 1 1 18 11967 1 1 9 PHE HB3 H 1.888 -2.786 12.564 1.00 . A A . 9 PHE HB3 1 1 18 11968 1 1 9 PHE HD1 H 0.908 -0.609 15.136 1.00 . A A . 9 PHE HD1 1 1 18 11969 1 1 9 PHE HD2 H -0.141 -1.721 11.126 1.00 . A A . 9 PHE HD2 1 1 18 11970 1 1 9 PHE HE1 H -1.394 0.224 15.506 1.00 . A A . 9 PHE HE1 1 1 18 11971 1 1 9 PHE HE2 H -2.443 -0.887 11.493 1.00 . A A . 9 PHE HE2 1 1 18 11972 1 1 9 PHE HZ H -3.070 0.087 13.685 1.00 . A A . 9 PHE HZ 1 1 18 11973 1 1 9 PHE N N 2.955 -0.178 14.354 1.00 . A A . 9 PHE N 1 1 18 11974 1 1 9 PHE O O 5.101 -1.726 13.606 1.00 . A A . 9 PHE O 1 1 18 11975 1 1 10 GLN C C 5.718 -4.723 12.664 1.00 . A A . 10 GLN C 1 1 18 11976 1 1 10 GLN CA C 5.473 -4.345 14.128 1.00 . A A . 10 GLN CA 1 1 18 11977 1 1 10 GLN CB C 5.310 -5.604 14.985 1.00 . A A . 10 GLN CB 1 1 18 11978 1 1 10 GLN CD C 6.164 -4.692 17.151 1.00 . A A . 10 GLN CD 1 1 18 11979 1 1 10 GLN CG C 4.929 -5.209 16.412 1.00 . A A . 10 GLN CG 1 1 18 11980 1 1 10 GLN H H 3.379 -4.079 14.572 1.00 . A A . 10 GLN H 1 1 18 11981 1 1 10 GLN HA H 6.289 -3.748 14.504 1.00 . A A . 10 GLN HA 1 1 18 11982 1 1 10 GLN HB2 H 4.533 -6.226 14.566 1.00 . A A . 10 GLN HB2 1 1 18 11983 1 1 10 GLN HB3 H 6.240 -6.151 15.001 1.00 . A A . 10 GLN HB3 1 1 18 11984 1 1 10 GLN HE21 H 5.154 -4.215 18.792 1.00 . A A . 10 GLN HE21 1 1 18 11985 1 1 10 GLN HE22 H 6.820 -3.891 18.846 1.00 . A A . 10 GLN HE22 1 1 18 11986 1 1 10 GLN HG2 H 4.175 -4.437 16.384 1.00 . A A . 10 GLN HG2 1 1 18 11987 1 1 10 GLN HG3 H 4.539 -6.073 16.932 1.00 . A A . 10 GLN HG3 1 1 18 11988 1 1 10 GLN N N 4.181 -3.609 14.266 1.00 . A A . 10 GLN N 1 1 18 11989 1 1 10 GLN NE2 N 6.036 -4.229 18.363 1.00 . A A . 10 GLN NE2 1 1 18 11990 1 1 10 GLN O O 6.539 -4.134 11.991 1.00 . A A . 10 GLN O 1 1 18 11991 1 1 10 GLN OE1 O 7.258 -4.712 16.620 1.00 . A A . 10 GLN OE1 1 1 18 11992 1 1 11 SER C C 4.091 -5.559 9.872 1.00 . A A . 11 SER C 1 1 18 11993 1 1 11 SER CA C 5.211 -6.122 10.750 1.00 . A A . 11 SER CA 1 1 18 11994 1 1 11 SER CB C 5.156 -7.648 10.780 1.00 . A A . 11 SER CB 1 1 18 11995 1 1 11 SER H H 4.358 -6.169 12.727 1.00 . A A . 11 SER H 1 1 18 11996 1 1 11 SER HA H 6.174 -5.794 10.391 1.00 . A A . 11 SER HA 1 1 18 11997 1 1 11 SER HB2 H 4.737 -7.978 11.715 1.00 . A A . 11 SER HB2 1 1 18 11998 1 1 11 SER HB3 H 4.535 -8.000 9.966 1.00 . A A . 11 SER HB3 1 1 18 11999 1 1 11 SER HG H 6.515 -8.996 11.132 1.00 . A A . 11 SER HG 1 1 18 12000 1 1 11 SER N N 5.015 -5.705 12.168 1.00 . A A . 11 SER N 1 1 18 12001 1 1 11 SER O O 3.301 -4.743 10.303 1.00 . A A . 11 SER O 1 1 18 12002 1 1 11 SER OG O 6.473 -8.168 10.647 1.00 . A A . 11 SER OG 1 1 18 12003 1 1 12 CYS C C 1.595 -6.084 8.126 1.00 . A A . 12 CYS C 1 1 18 12004 1 1 12 CYS CA C 2.946 -5.480 7.736 1.00 . A A . 12 CYS CA 1 1 18 12005 1 1 12 CYS CB C 3.357 -5.944 6.336 1.00 . A A . 12 CYS CB 1 1 18 12006 1 1 12 CYS H H 4.663 -6.648 8.314 1.00 . A A . 12 CYS H 1 1 18 12007 1 1 12 CYS HA H 2.904 -4.403 7.771 1.00 . A A . 12 CYS HA 1 1 18 12008 1 1 12 CYS HB2 H 2.747 -5.444 5.598 1.00 . A A . 12 CYS HB2 1 1 18 12009 1 1 12 CYS HB3 H 4.396 -5.698 6.166 1.00 . A A . 12 CYS HB3 1 1 18 12010 1 1 12 CYS N N 4.016 -5.990 8.641 1.00 . A A . 12 CYS N 1 1 18 12011 1 1 12 CYS O O 0.554 -5.663 7.659 1.00 . A A . 12 CYS O 1 1 18 12012 1 1 12 CYS SG S 3.129 -7.735 6.194 1.00 . A A . 12 CYS SG 1 1 18 12013 1 1 13 SER C C -0.704 -6.667 9.799 1.00 . A A . 13 SER C 1 1 18 12014 1 1 13 SER CA C 0.328 -7.720 9.383 1.00 . A A . 13 SER CA 1 1 18 12015 1 1 13 SER CB C 0.701 -8.602 10.572 1.00 . A A . 13 SER CB 1 1 18 12016 1 1 13 SER H H 2.458 -7.404 9.330 1.00 . A A . 13 SER H 1 1 18 12017 1 1 13 SER HA H -0.060 -8.330 8.583 1.00 . A A . 13 SER HA 1 1 18 12018 1 1 13 SER HB2 H 1.588 -9.168 10.340 1.00 . A A . 13 SER HB2 1 1 18 12019 1 1 13 SER HB3 H 0.891 -7.979 11.436 1.00 . A A . 13 SER HB3 1 1 18 12020 1 1 13 SER HG H -1.191 -9.042 10.659 1.00 . A A . 13 SER HG 1 1 18 12021 1 1 13 SER N N 1.606 -7.076 8.972 1.00 . A A . 13 SER N 1 1 18 12022 1 1 13 SER O O -1.757 -6.557 9.208 1.00 . A A . 13 SER O 1 1 18 12023 1 1 13 SER OG O -0.367 -9.499 10.843 1.00 . A A . 13 SER OG 1 1 18 12024 1 1 14 GLN C C -1.375 -3.655 10.302 1.00 . A A . 14 GLN C 1 1 18 12025 1 1 14 GLN CA C -1.396 -4.855 11.251 1.00 . A A . 14 GLN CA 1 1 18 12026 1 1 14 GLN CB C -0.938 -4.442 12.651 1.00 . A A . 14 GLN CB 1 1 18 12027 1 1 14 GLN CD C -2.762 -4.779 14.332 1.00 . A A . 14 GLN CD 1 1 18 12028 1 1 14 GLN CG C -2.099 -3.772 13.389 1.00 . A A . 14 GLN CG 1 1 18 12029 1 1 14 GLN H H 0.441 -5.988 11.276 1.00 . A A . 14 GLN H 1 1 18 12030 1 1 14 GLN HA H -2.386 -5.276 11.302 1.00 . A A . 14 GLN HA 1 1 18 12031 1 1 14 GLN HB2 H -0.619 -5.317 13.198 1.00 . A A . 14 GLN HB2 1 1 18 12032 1 1 14 GLN HB3 H -0.116 -3.746 12.571 1.00 . A A . 14 GLN HB3 1 1 18 12033 1 1 14 GLN HE21 H -1.335 -4.652 15.707 1.00 . A A . 14 GLN HE21 1 1 18 12034 1 1 14 GLN HE22 H -2.605 -5.715 16.078 1.00 . A A . 14 GLN HE22 1 1 18 12035 1 1 14 GLN HG2 H -1.726 -2.934 13.961 1.00 . A A . 14 GLN HG2 1 1 18 12036 1 1 14 GLN HG3 H -2.826 -3.422 12.672 1.00 . A A . 14 GLN HG3 1 1 18 12037 1 1 14 GLN N N -0.414 -5.891 10.808 1.00 . A A . 14 GLN N 1 1 18 12038 1 1 14 GLN NE2 N -2.185 -5.074 15.466 1.00 . A A . 14 GLN NE2 1 1 18 12039 1 1 14 GLN O O -2.378 -2.996 10.095 1.00 . A A . 14 GLN O 1 1 18 12040 1 1 14 GLN OE1 O -3.817 -5.302 14.035 1.00 . A A . 14 GLN OE1 1 1 18 12041 1 1 15 CYS C C -1.299 -2.235 7.789 1.00 . A A . 15 CYS C 1 1 18 12042 1 1 15 CYS CA C -0.151 -2.204 8.794 1.00 . A A . 15 CYS CA 1 1 18 12043 1 1 15 CYS CB C 1.181 -2.381 8.071 1.00 . A A . 15 CYS CB 1 1 18 12044 1 1 15 CYS H H 0.554 -3.908 9.910 1.00 . A A . 15 CYS H 1 1 18 12045 1 1 15 CYS HA H -0.152 -1.275 9.341 1.00 . A A . 15 CYS HA 1 1 18 12046 1 1 15 CYS HB2 H 1.334 -3.425 7.847 1.00 . A A . 15 CYS HB2 1 1 18 12047 1 1 15 CYS HB3 H 1.169 -1.813 7.152 1.00 . A A . 15 CYS HB3 1 1 18 12048 1 1 15 CYS N N -0.241 -3.365 9.727 1.00 . A A . 15 CYS N 1 1 18 12049 1 1 15 CYS O O -1.808 -1.208 7.383 1.00 . A A . 15 CYS O 1 1 18 12050 1 1 15 CYS SG S 2.524 -1.786 9.125 1.00 . A A . 15 CYS SG 1 1 18 12051 1 1 16 LEU C C -4.078 -4.072 7.007 1.00 . A A . 16 LEU C 1 1 18 12052 1 1 16 LEU CA C -2.808 -3.480 6.378 1.00 . A A . 16 LEU CA 1 1 18 12053 1 1 16 LEU CB C -2.264 -4.378 5.267 1.00 . A A . 16 LEU CB 1 1 18 12054 1 1 16 LEU CD1 C 0.066 -3.457 5.171 1.00 . A A . 16 LEU CD1 1 1 18 12055 1 1 16 LEU CD2 C -1.029 -4.297 3.094 1.00 . A A . 16 LEU CD2 1 1 18 12056 1 1 16 LEU CG C -1.264 -3.581 4.423 1.00 . A A . 16 LEU CG 1 1 18 12057 1 1 16 LEU H H -1.274 -4.219 7.700 1.00 . A A . 16 LEU H 1 1 18 12058 1 1 16 LEU HA H -3.017 -2.500 5.979 1.00 . A A . 16 LEU HA 1 1 18 12059 1 1 16 LEU HB2 H -1.769 -5.234 5.705 1.00 . A A . 16 LEU HB2 1 1 18 12060 1 1 16 LEU HB3 H -3.077 -4.711 4.640 1.00 . A A . 16 LEU HB3 1 1 18 12061 1 1 16 LEU HD11 H 0.217 -2.430 5.467 1.00 . A A . 16 LEU HD11 1 1 18 12062 1 1 16 LEU HD12 H 0.873 -3.767 4.522 1.00 . A A . 16 LEU HD12 1 1 18 12063 1 1 16 LEU HD13 H 0.047 -4.086 6.048 1.00 . A A . 16 LEU HD13 1 1 18 12064 1 1 16 LEU HD21 H -0.544 -5.244 3.273 1.00 . A A . 16 LEU HD21 1 1 18 12065 1 1 16 LEU HD22 H -0.401 -3.685 2.461 1.00 . A A . 16 LEU HD22 1 1 18 12066 1 1 16 LEU HD23 H -1.977 -4.464 2.605 1.00 . A A . 16 LEU HD23 1 1 18 12067 1 1 16 LEU HG H -1.660 -2.594 4.236 1.00 . A A . 16 LEU HG 1 1 18 12068 1 1 16 LEU N N -1.703 -3.401 7.371 1.00 . A A . 16 LEU N 1 1 18 12069 1 1 16 LEU O O -5.148 -3.998 6.434 1.00 . A A . 16 LEU O 1 1 18 12070 1 1 17 SER C C -6.054 -4.135 9.465 1.00 . A A . 17 SER C 1 1 18 12071 1 1 17 SER CA C -5.208 -5.235 8.812 1.00 . A A . 17 SER CA 1 1 18 12072 1 1 17 SER CB C -4.705 -6.213 9.871 1.00 . A A . 17 SER CB 1 1 18 12073 1 1 17 SER H H -3.116 -4.711 8.635 1.00 . A A . 17 SER H 1 1 18 12074 1 1 17 SER HA H -5.794 -5.765 8.076 1.00 . A A . 17 SER HA 1 1 18 12075 1 1 17 SER HB2 H -3.742 -6.589 9.585 1.00 . A A . 17 SER HB2 1 1 18 12076 1 1 17 SER HB3 H -4.625 -5.703 10.822 1.00 . A A . 17 SER HB3 1 1 18 12077 1 1 17 SER HG H -6.002 -7.280 10.854 1.00 . A A . 17 SER HG 1 1 18 12078 1 1 17 SER N N -3.983 -4.655 8.177 1.00 . A A . 17 SER N 1 1 18 12079 1 1 17 SER O O -7.192 -4.356 9.830 1.00 . A A . 17 SER O 1 1 18 12080 1 1 17 SER OG O -5.617 -7.298 9.976 1.00 . A A . 17 SER OG 1 1 18 12081 1 1 18 ALA C C -6.000 -0.521 9.580 1.00 . A A . 18 ALA C 1 1 18 12082 1 1 18 ALA CA C -6.312 -1.860 10.251 1.00 . A A . 18 ALA CA 1 1 18 12083 1 1 18 ALA CB C -5.872 -1.840 11.716 1.00 . A A . 18 ALA CB 1 1 18 12084 1 1 18 ALA H H -4.594 -2.788 9.324 1.00 . A A . 18 ALA H 1 1 18 12085 1 1 18 ALA HA H -7.366 -2.077 10.187 1.00 . A A . 18 ALA HA 1 1 18 12086 1 1 18 ALA HB1 H -6.520 -2.480 12.295 1.00 . A A . 18 ALA HB1 1 1 18 12087 1 1 18 ALA HB2 H -5.931 -0.831 12.094 1.00 . A A . 18 ALA HB2 1 1 18 12088 1 1 18 ALA HB3 H -4.855 -2.195 11.792 1.00 . A A . 18 ALA HB3 1 1 18 12089 1 1 18 ALA N N -5.517 -2.955 9.618 1.00 . A A . 18 ALA N 1 1 18 12090 1 1 18 ALA O O -5.448 0.370 10.191 1.00 . A A . 18 ALA O 1 1 18 12091 1 1 19 PRO C C -7.107 1.956 7.929 1.00 . A A . 19 PRO C 1 1 18 12092 1 1 19 PRO CA C -6.143 0.806 7.550 1.00 . A A . 19 PRO CA 1 1 18 12093 1 1 19 PRO CB C -6.360 0.361 6.105 1.00 . A A . 19 PRO CB 1 1 18 12094 1 1 19 PRO CD C -7.035 -1.476 7.539 1.00 . A A . 19 PRO CD 1 1 18 12095 1 1 19 PRO CG C -7.245 -0.843 6.183 1.00 . A A . 19 PRO CG 1 1 18 12096 1 1 19 PRO HA H -5.123 1.130 7.670 1.00 . A A . 19 PRO HA 1 1 18 12097 1 1 19 PRO HB2 H -6.842 1.148 5.541 1.00 . A A . 19 PRO HB2 1 1 18 12098 1 1 19 PRO HB3 H -5.418 0.095 5.650 1.00 . A A . 19 PRO HB3 1 1 18 12099 1 1 19 PRO HD2 H -7.984 -1.747 7.980 1.00 . A A . 19 PRO HD2 1 1 18 12100 1 1 19 PRO HD3 H -6.393 -2.339 7.458 1.00 . A A . 19 PRO HD3 1 1 18 12101 1 1 19 PRO HG2 H -8.277 -0.549 6.063 1.00 . A A . 19 PRO HG2 1 1 18 12102 1 1 19 PRO HG3 H -6.974 -1.548 5.412 1.00 . A A . 19 PRO HG3 1 1 18 12103 1 1 19 PRO N N -6.374 -0.432 8.333 1.00 . A A . 19 PRO N 1 1 18 12104 1 1 19 PRO O O -6.742 3.106 7.786 1.00 . A A . 19 PRO O 1 1 18 12105 1 1 20 PRO C C -8.847 3.402 10.062 1.00 . A A . 20 PRO C 1 1 18 12106 1 1 20 PRO CA C -9.254 2.728 8.748 1.00 . A A . 20 PRO CA 1 1 18 12107 1 1 20 PRO CB C -10.591 2.010 8.892 1.00 . A A . 20 PRO CB 1 1 18 12108 1 1 20 PRO CD C -8.886 0.314 8.618 1.00 . A A . 20 PRO CD 1 1 18 12109 1 1 20 PRO CG C -10.242 0.594 9.216 1.00 . A A . 20 PRO CG 1 1 18 12110 1 1 20 PRO HA H -9.313 3.456 7.953 1.00 . A A . 20 PRO HA 1 1 18 12111 1 1 20 PRO HB2 H -11.165 2.451 9.695 1.00 . A A . 20 PRO HB2 1 1 18 12112 1 1 20 PRO HB3 H -11.143 2.052 7.967 1.00 . A A . 20 PRO HB3 1 1 18 12113 1 1 20 PRO HD2 H -8.286 -0.254 9.313 1.00 . A A . 20 PRO HD2 1 1 18 12114 1 1 20 PRO HD3 H -8.991 -0.213 7.686 1.00 . A A . 20 PRO HD3 1 1 18 12115 1 1 20 PRO HG2 H -10.211 0.460 10.288 1.00 . A A . 20 PRO HG2 1 1 18 12116 1 1 20 PRO HG3 H -10.972 -0.071 8.783 1.00 . A A . 20 PRO HG3 1 1 18 12117 1 1 20 PRO N N -8.303 1.646 8.389 1.00 . A A . 20 PRO N 1 1 18 12118 1 1 20 PRO O O -9.363 4.442 10.420 1.00 . A A . 20 PRO O 1 1 18 12119 1 1 21 PHE C C -6.030 3.881 11.972 1.00 . A A . 21 PHE C 1 1 18 12120 1 1 21 PHE CA C -7.493 3.443 12.069 1.00 . A A . 21 PHE CA 1 1 18 12121 1 1 21 PHE CB C -7.648 2.342 13.117 1.00 . A A . 21 PHE CB 1 1 18 12122 1 1 21 PHE CD1 C -10.099 2.489 12.542 1.00 . A A . 21 PHE CD1 1 1 18 12123 1 1 21 PHE CD2 C -9.218 0.392 13.380 1.00 . A A . 21 PHE CD2 1 1 18 12124 1 1 21 PHE CE1 C -11.373 1.916 12.445 1.00 . A A . 21 PHE CE1 1 1 18 12125 1 1 21 PHE CE2 C -10.490 -0.182 13.283 1.00 . A A . 21 PHE CE2 1 1 18 12126 1 1 21 PHE CG C -9.022 1.726 13.009 1.00 . A A . 21 PHE CG 1 1 18 12127 1 1 21 PHE CZ C -11.568 0.580 12.816 1.00 . A A . 21 PHE CZ 1 1 18 12128 1 1 21 PHE H H -7.520 1.986 10.479 1.00 . A A . 21 PHE H 1 1 18 12129 1 1 21 PHE HA H -8.124 4.282 12.317 1.00 . A A . 21 PHE HA 1 1 18 12130 1 1 21 PHE HB2 H -6.899 1.581 12.952 1.00 . A A . 21 PHE HB2 1 1 18 12131 1 1 21 PHE HB3 H -7.520 2.763 14.102 1.00 . A A . 21 PHE HB3 1 1 18 12132 1 1 21 PHE HD1 H -9.947 3.520 12.255 1.00 . A A . 21 PHE HD1 1 1 18 12133 1 1 21 PHE HD2 H -8.387 -0.196 13.739 1.00 . A A . 21 PHE HD2 1 1 18 12134 1 1 21 PHE HE1 H -12.204 2.505 12.085 1.00 . A A . 21 PHE HE1 1 1 18 12135 1 1 21 PHE HE2 H -10.641 -1.213 13.569 1.00 . A A . 21 PHE HE2 1 1 18 12136 1 1 21 PHE HZ H -12.550 0.138 12.744 1.00 . A A . 21 PHE HZ 1 1 18 12137 1 1 21 PHE N N -7.927 2.824 10.783 1.00 . A A . 21 PHE N 1 1 18 12138 1 1 21 PHE O O -5.390 4.165 12.966 1.00 . A A . 21 PHE O 1 1 18 12139 1 1 22 VAL C C -3.879 5.160 9.351 1.00 . A A . 22 VAL C 1 1 18 12140 1 1 22 VAL CA C -4.069 4.343 10.631 1.00 . A A . 22 VAL CA 1 1 18 12141 1 1 22 VAL CB C -3.291 3.031 10.550 1.00 . A A . 22 VAL CB 1 1 18 12142 1 1 22 VAL CG1 C -3.736 2.104 11.682 1.00 . A A . 22 VAL CG1 1 1 18 12143 1 1 22 VAL CG2 C -3.566 2.357 9.202 1.00 . A A . 22 VAL CG2 1 1 18 12144 1 1 22 VAL H H -6.023 3.693 9.995 1.00 . A A . 22 VAL H 1 1 18 12145 1 1 22 VAL HA H -3.747 4.908 11.491 1.00 . A A . 22 VAL HA 1 1 18 12146 1 1 22 VAL HB H -2.236 3.232 10.645 1.00 . A A . 22 VAL HB 1 1 18 12147 1 1 22 VAL HG11 H -3.113 1.222 11.691 1.00 . A A . 22 VAL HG11 1 1 18 12148 1 1 22 VAL HG12 H -4.765 1.818 11.529 1.00 . A A . 22 VAL HG12 1 1 18 12149 1 1 22 VAL HG13 H -3.644 2.619 12.627 1.00 . A A . 22 VAL HG13 1 1 18 12150 1 1 22 VAL HG21 H -3.664 1.291 9.346 1.00 . A A . 22 VAL HG21 1 1 18 12151 1 1 22 VAL HG22 H -2.746 2.554 8.527 1.00 . A A . 22 VAL HG22 1 1 18 12152 1 1 22 VAL HG23 H -4.480 2.751 8.783 1.00 . A A . 22 VAL HG23 1 1 18 12153 1 1 22 VAL N N -5.494 3.931 10.784 1.00 . A A . 22 VAL N 1 1 18 12154 1 1 22 VAL O O -4.769 5.269 8.531 1.00 . A A . 22 VAL O 1 1 18 12155 1 1 23 GLN C C -1.192 6.071 7.244 1.00 . A A . 23 GLN C 1 1 18 12156 1 1 23 GLN CA C -2.466 6.550 7.951 1.00 . A A . 23 GLN CA 1 1 18 12157 1 1 23 GLN CB C -2.291 7.981 8.466 1.00 . A A . 23 GLN CB 1 1 18 12158 1 1 23 GLN CD C -3.045 9.542 6.664 1.00 . A A . 23 GLN CD 1 1 18 12159 1 1 23 GLN CG C -1.827 8.893 7.326 1.00 . A A . 23 GLN CG 1 1 18 12160 1 1 23 GLN H H -2.019 5.637 9.852 1.00 . A A . 23 GLN H 1 1 18 12161 1 1 23 GLN HA H -3.311 6.500 7.283 1.00 . A A . 23 GLN HA 1 1 18 12162 1 1 23 GLN HB2 H -3.234 8.341 8.853 1.00 . A A . 23 GLN HB2 1 1 18 12163 1 1 23 GLN HB3 H -1.553 7.992 9.252 1.00 . A A . 23 GLN HB3 1 1 18 12164 1 1 23 GLN HE21 H -3.746 7.830 5.946 1.00 . A A . 23 GLN HE21 1 1 18 12165 1 1 23 GLN HE22 H -4.674 9.202 5.581 1.00 . A A . 23 GLN HE22 1 1 18 12166 1 1 23 GLN HG2 H -1.180 9.662 7.721 1.00 . A A . 23 GLN HG2 1 1 18 12167 1 1 23 GLN HG3 H -1.290 8.313 6.594 1.00 . A A . 23 GLN HG3 1 1 18 12168 1 1 23 GLN N N -2.721 5.737 9.175 1.00 . A A . 23 GLN N 1 1 18 12169 1 1 23 GLN NE2 N -3.892 8.796 6.009 1.00 . A A . 23 GLN NE2 1 1 18 12170 1 1 23 GLN O O -0.988 6.324 6.073 1.00 . A A . 23 GLN O 1 1 18 12171 1 1 23 GLN OE1 O -3.227 10.742 6.743 1.00 . A A . 23 GLN OE1 1 1 18 12172 1 1 24 CYS C C 0.650 3.709 6.388 1.00 . A A . 24 CYS C 1 1 18 12173 1 1 24 CYS CA C 0.930 4.907 7.306 1.00 . A A . 24 CYS CA 1 1 18 12174 1 1 24 CYS CB C 1.860 4.545 8.485 1.00 . A A . 24 CYS CB 1 1 18 12175 1 1 24 CYS H H -0.504 5.193 8.889 1.00 . A A . 24 CYS H 1 1 18 12176 1 1 24 CYS HA H 1.374 5.707 6.731 1.00 . A A . 24 CYS HA 1 1 18 12177 1 1 24 CYS HB2 H 2.868 4.842 8.242 1.00 . A A . 24 CYS HB2 1 1 18 12178 1 1 24 CYS HB3 H 1.536 5.086 9.362 1.00 . A A . 24 CYS HB3 1 1 18 12179 1 1 24 CYS N N -0.330 5.386 7.945 1.00 . A A . 24 CYS N 1 1 18 12180 1 1 24 CYS O O -0.440 3.171 6.358 1.00 . A A . 24 CYS O 1 1 18 12181 1 1 24 CYS SG S 1.841 2.763 8.843 1.00 . A A . 24 CYS SG 1 1 18 12182 1 1 25 GLY C C 2.807 1.465 4.532 1.00 . A A . 25 GLY C 1 1 18 12183 1 1 25 GLY CA C 1.455 2.150 4.706 1.00 . A A . 25 GLY CA 1 1 18 12184 1 1 25 GLY H H 2.497 3.760 5.680 1.00 . A A . 25 GLY H 1 1 18 12185 1 1 25 GLY HA2 H 0.740 1.454 5.122 1.00 . A A . 25 GLY HA2 1 1 18 12186 1 1 25 GLY HA3 H 1.106 2.505 3.750 1.00 . A A . 25 GLY HA3 1 1 18 12187 1 1 25 GLY N N 1.632 3.301 5.637 1.00 . A A . 25 GLY N 1 1 18 12188 1 1 25 GLY O O 3.782 1.859 5.131 1.00 . A A . 25 GLY O 1 1 18 12189 1 1 26 TRP C C 4.977 0.469 2.417 1.00 . A A . 26 TRP C 1 1 18 12190 1 1 26 TRP CA C 4.214 -0.219 3.555 1.00 . A A . 26 TRP CA 1 1 18 12191 1 1 26 TRP CB C 3.891 -1.675 3.210 1.00 . A A . 26 TRP CB 1 1 18 12192 1 1 26 TRP CD1 C 5.949 -3.078 2.770 1.00 . A A . 26 TRP CD1 1 1 18 12193 1 1 26 TRP CD2 C 5.435 -2.944 4.955 1.00 . A A . 26 TRP CD2 1 1 18 12194 1 1 26 TRP CE2 C 6.597 -3.741 4.861 1.00 . A A . 26 TRP CE2 1 1 18 12195 1 1 26 TRP CE3 C 4.896 -2.702 6.229 1.00 . A A . 26 TRP CE3 1 1 18 12196 1 1 26 TRP CG C 5.044 -2.532 3.616 1.00 . A A . 26 TRP CG 1 1 18 12197 1 1 26 TRP CH2 C 6.662 -4.029 7.255 1.00 . A A . 26 TRP CH2 1 1 18 12198 1 1 26 TRP CZ2 C 7.209 -4.278 5.993 1.00 . A A . 26 TRP CZ2 1 1 18 12199 1 1 26 TRP CZ3 C 5.506 -3.243 7.373 1.00 . A A . 26 TRP CZ3 1 1 18 12200 1 1 26 TRP H H 2.103 0.124 3.237 1.00 . A A . 26 TRP H 1 1 18 12201 1 1 26 TRP HA H 4.780 -0.171 4.472 1.00 . A A . 26 TRP HA 1 1 18 12202 1 1 26 TRP HB2 H 3.006 -1.983 3.745 1.00 . A A . 26 TRP HB2 1 1 18 12203 1 1 26 TRP HB3 H 3.724 -1.770 2.151 1.00 . A A . 26 TRP HB3 1 1 18 12204 1 1 26 TRP HD1 H 5.951 -2.969 1.695 1.00 . A A . 26 TRP HD1 1 1 18 12205 1 1 26 TRP HE1 H 7.635 -4.285 3.139 1.00 . A A . 26 TRP HE1 1 1 18 12206 1 1 26 TRP HE3 H 4.005 -2.098 6.328 1.00 . A A . 26 TRP HE3 1 1 18 12207 1 1 26 TRP HH2 H 7.128 -4.442 8.137 1.00 . A A . 26 TRP HH2 1 1 18 12208 1 1 26 TRP HZ2 H 8.106 -4.875 5.894 1.00 . A A . 26 TRP HZ2 1 1 18 12209 1 1 26 TRP HZ3 H 5.084 -3.050 8.349 1.00 . A A . 26 TRP HZ3 1 1 18 12210 1 1 26 TRP N N 2.893 0.446 3.728 1.00 . A A . 26 TRP N 1 1 18 12211 1 1 26 TRP NE1 N 6.872 -3.794 3.510 1.00 . A A . 26 TRP NE1 1 1 18 12212 1 1 26 TRP O O 4.401 0.847 1.414 1.00 . A A . 26 TRP O 1 1 18 12213 1 1 27 CYS C C 8.364 0.697 1.188 1.00 . A A . 27 CYS C 1 1 18 12214 1 1 27 CYS CA C 7.018 1.370 1.487 1.00 . A A . 27 CYS CA 1 1 18 12215 1 1 27 CYS CB C 7.244 2.786 2.021 1.00 . A A . 27 CYS CB 1 1 18 12216 1 1 27 CYS H H 6.719 0.388 3.395 1.00 . A A . 27 CYS H 1 1 18 12217 1 1 27 CYS HA H 6.422 1.417 0.591 1.00 . A A . 27 CYS HA 1 1 18 12218 1 1 27 CYS HB2 H 6.427 3.058 2.673 1.00 . A A . 27 CYS HB2 1 1 18 12219 1 1 27 CYS HB3 H 8.173 2.820 2.571 1.00 . A A . 27 CYS HB3 1 1 18 12220 1 1 27 CYS N N 6.263 0.671 2.570 1.00 . A A . 27 CYS N 1 1 18 12221 1 1 27 CYS O O 9.352 0.929 1.855 1.00 . A A . 27 CYS O 1 1 18 12222 1 1 27 CYS SG S 7.322 3.947 0.633 1.00 . A A . 27 CYS SG 1 1 18 12223 1 1 28 HIS C C 10.465 -1.324 0.947 1.00 . A A . 28 HIS C 1 1 18 12224 1 1 28 HIS CA C 9.686 -0.762 -0.250 1.00 . A A . 28 HIS CA 1 1 18 12225 1 1 28 HIS CB C 10.490 0.348 -0.925 1.00 . A A . 28 HIS CB 1 1 18 12226 1 1 28 HIS CD2 C 12.663 -0.280 -2.260 1.00 . A A . 28 HIS CD2 1 1 18 12227 1 1 28 HIS CE1 C 11.723 -1.240 -3.958 1.00 . A A . 28 HIS CE1 1 1 18 12228 1 1 28 HIS CG C 11.308 -0.226 -2.048 1.00 . A A . 28 HIS CG 1 1 18 12229 1 1 28 HIS H H 7.601 -0.234 -0.383 1.00 . A A . 28 HIS H 1 1 18 12230 1 1 28 HIS HA H 9.486 -1.545 -0.963 1.00 . A A . 28 HIS HA 1 1 18 12231 1 1 28 HIS HB2 H 9.814 1.094 -1.317 1.00 . A A . 28 HIS HB2 1 1 18 12232 1 1 28 HIS HB3 H 11.147 0.806 -0.200 1.00 . A A . 28 HIS HB3 1 1 18 12233 1 1 28 HIS HD1 H 9.768 -0.971 -3.296 1.00 . A A . 28 HIS HD1 1 1 18 12234 1 1 28 HIS HD2 H 13.414 0.116 -1.591 1.00 . A A . 28 HIS HD2 1 1 18 12235 1 1 28 HIS HE1 H 11.569 -1.755 -4.895 1.00 . A A . 28 HIS HE1 1 1 18 12236 1 1 28 HIS N N 8.409 -0.096 0.155 1.00 . A A . 28 HIS N 1 1 18 12237 1 1 28 HIS ND1 N 10.728 -0.844 -3.143 1.00 . A A . 28 HIS ND1 1 1 18 12238 1 1 28 HIS NE2 N 12.924 -0.920 -3.467 1.00 . A A . 28 HIS NE2 1 1 18 12239 1 1 28 HIS O O 11.652 -1.568 0.849 1.00 . A A . 28 HIS O 1 1 18 12240 1 1 29 ASP C C 9.771 -2.080 4.521 1.00 . A A . 29 ASP C 1 1 18 12241 1 1 29 ASP CA C 10.595 -2.111 3.231 1.00 . A A . 29 ASP CA 1 1 18 12242 1 1 29 ASP CB C 11.839 -1.234 3.388 1.00 . A A . 29 ASP CB 1 1 18 12243 1 1 29 ASP CG C 11.506 0.223 3.051 1.00 . A A . 29 ASP CG 1 1 18 12244 1 1 29 ASP H H 8.875 -1.364 2.148 1.00 . A A . 29 ASP H 1 1 18 12245 1 1 29 ASP HA H 10.899 -3.124 3.014 1.00 . A A . 29 ASP HA 1 1 18 12246 1 1 29 ASP HB2 H 12.181 -1.298 4.411 1.00 . A A . 29 ASP HB2 1 1 18 12247 1 1 29 ASP HB3 H 12.616 -1.588 2.727 1.00 . A A . 29 ASP HB3 1 1 18 12248 1 1 29 ASP N N 9.834 -1.549 2.070 1.00 . A A . 29 ASP N 1 1 18 12249 1 1 29 ASP O O 9.046 -3.001 4.815 1.00 . A A . 29 ASP O 1 1 18 12250 1 1 29 ASP OD1 O 10.744 0.823 3.791 1.00 . A A . 29 ASP OD1 1 1 18 12251 1 1 29 ASP OD2 O 12.018 0.714 2.058 1.00 . A A . 29 ASP OD2 1 1 18 12252 1 1 30 LYS C C 7.794 -0.279 6.408 1.00 . A A . 30 LYS C 1 1 18 12253 1 1 30 LYS CA C 9.144 -0.982 6.593 1.00 . A A . 30 LYS CA 1 1 18 12254 1 1 30 LYS CB C 10.049 -0.202 7.554 1.00 . A A . 30 LYS CB 1 1 18 12255 1 1 30 LYS CD C 11.111 2.033 7.890 1.00 . A A . 30 LYS CD 1 1 18 12256 1 1 30 LYS CE C 10.777 2.607 9.271 1.00 . A A . 30 LYS CE 1 1 18 12257 1 1 30 LYS CG C 9.889 1.303 7.330 1.00 . A A . 30 LYS CG 1 1 18 12258 1 1 30 LYS H H 10.511 -0.317 5.067 1.00 . A A . 30 LYS H 1 1 18 12259 1 1 30 LYS HA H 8.989 -1.978 6.976 1.00 . A A . 30 LYS HA 1 1 18 12260 1 1 30 LYS HB2 H 9.780 -0.444 8.572 1.00 . A A . 30 LYS HB2 1 1 18 12261 1 1 30 LYS HB3 H 11.078 -0.480 7.381 1.00 . A A . 30 LYS HB3 1 1 18 12262 1 1 30 LYS HD2 H 11.935 1.340 7.978 1.00 . A A . 30 LYS HD2 1 1 18 12263 1 1 30 LYS HD3 H 11.387 2.838 7.226 1.00 . A A . 30 LYS HD3 1 1 18 12264 1 1 30 LYS HE2 H 11.475 3.394 9.526 1.00 . A A . 30 LYS HE2 1 1 18 12265 1 1 30 LYS HE3 H 9.765 2.980 9.288 1.00 . A A . 30 LYS HE3 1 1 18 12266 1 1 30 LYS HG2 H 9.801 1.503 6.271 1.00 . A A . 30 LYS HG2 1 1 18 12267 1 1 30 LYS HG3 H 9.002 1.650 7.837 1.00 . A A . 30 LYS HG3 1 1 18 12268 1 1 30 LYS HZ1 H 11.778 1.583 10.784 1.00 . A A . 30 LYS HZ1 1 1 18 12269 1 1 30 LYS HZ2 H 10.975 0.571 9.681 1.00 . A A . 30 LYS HZ2 1 1 18 12270 1 1 30 LYS HZ3 H 10.091 1.434 10.848 1.00 . A A . 30 LYS HZ3 1 1 18 12271 1 1 30 LYS N N 9.902 -1.043 5.309 1.00 . A A . 30 LYS N 1 1 18 12272 1 1 30 LYS NZ N 10.916 1.462 10.216 1.00 . A A . 30 LYS NZ 1 1 18 12273 1 1 30 LYS O O 7.432 0.132 5.320 1.00 . A A . 30 LYS O 1 1 18 12274 1 1 31 CYS C C 5.826 2.019 7.489 1.00 . A A . 31 CYS C 1 1 18 12275 1 1 31 CYS CA C 5.706 0.495 7.386 1.00 . A A . 31 CYS CA 1 1 18 12276 1 1 31 CYS CB C 4.936 -0.052 8.585 1.00 . A A . 31 CYS CB 1 1 18 12277 1 1 31 CYS H H 7.358 -0.510 8.330 1.00 . A A . 31 CYS H 1 1 18 12278 1 1 31 CYS HA H 5.206 0.216 6.473 1.00 . A A . 31 CYS HA 1 1 18 12279 1 1 31 CYS HB2 H 5.291 -1.045 8.819 1.00 . A A . 31 CYS HB2 1 1 18 12280 1 1 31 CYS HB3 H 5.091 0.594 9.437 1.00 . A A . 31 CYS HB3 1 1 18 12281 1 1 31 CYS N N 7.043 -0.158 7.471 1.00 . A A . 31 CYS N 1 1 18 12282 1 1 31 CYS O O 6.056 2.564 8.550 1.00 . A A . 31 CYS O 1 1 18 12283 1 1 31 CYS SG S 3.173 -0.118 8.191 1.00 . A A . 31 CYS SG 1 1 18 12284 1 1 32 VAL C C 4.787 4.786 5.382 1.00 . A A . 32 VAL C 1 1 18 12285 1 1 32 VAL CA C 5.736 4.195 6.429 1.00 . A A . 32 VAL CA 1 1 18 12286 1 1 32 VAL CB C 7.189 4.521 6.089 1.00 . A A . 32 VAL CB 1 1 18 12287 1 1 32 VAL CG1 C 8.117 3.618 6.902 1.00 . A A . 32 VAL CG1 1 1 18 12288 1 1 32 VAL CG2 C 7.430 4.288 4.595 1.00 . A A . 32 VAL CG2 1 1 18 12289 1 1 32 VAL H H 5.457 2.248 5.555 1.00 . A A . 32 VAL H 1 1 18 12290 1 1 32 VAL HA H 5.492 4.567 7.412 1.00 . A A . 32 VAL HA 1 1 18 12291 1 1 32 VAL HB H 7.389 5.553 6.331 1.00 . A A . 32 VAL HB 1 1 18 12292 1 1 32 VAL HG11 H 7.987 2.592 6.588 1.00 . A A . 32 VAL HG11 1 1 18 12293 1 1 32 VAL HG12 H 7.878 3.707 7.951 1.00 . A A . 32 VAL HG12 1 1 18 12294 1 1 32 VAL HG13 H 9.143 3.917 6.741 1.00 . A A . 32 VAL HG13 1 1 18 12295 1 1 32 VAL HG21 H 8.433 4.595 4.340 1.00 . A A . 32 VAL HG21 1 1 18 12296 1 1 32 VAL HG22 H 6.720 4.866 4.023 1.00 . A A . 32 VAL HG22 1 1 18 12297 1 1 32 VAL HG23 H 7.305 3.240 4.371 1.00 . A A . 32 VAL HG23 1 1 18 12298 1 1 32 VAL N N 5.653 2.708 6.397 1.00 . A A . 32 VAL N 1 1 18 12299 1 1 32 VAL O O 4.177 4.071 4.614 1.00 . A A . 32 VAL O 1 1 18 12300 1 1 33 ARG C C 4.510 7.577 3.364 1.00 . A A . 33 ARG C 1 1 18 12301 1 1 33 ARG CA C 3.734 6.686 4.334 1.00 . A A . 33 ARG CA 1 1 18 12302 1 1 33 ARG CB C 2.732 7.510 5.141 1.00 . A A . 33 ARG CB 1 1 18 12303 1 1 33 ARG CD C 0.732 8.875 4.513 1.00 . A A . 33 ARG CD 1 1 18 12304 1 1 33 ARG CG C 1.377 7.490 4.433 1.00 . A A . 33 ARG CG 1 1 18 12305 1 1 33 ARG CZ C -0.206 9.064 2.287 1.00 . A A . 33 ARG CZ 1 1 18 12306 1 1 33 ARG H H 5.146 6.650 5.965 1.00 . A A . 33 ARG H 1 1 18 12307 1 1 33 ARG HA H 3.213 5.912 3.793 1.00 . A A . 33 ARG HA 1 1 18 12308 1 1 33 ARG HB2 H 2.631 7.088 6.130 1.00 . A A . 33 ARG HB2 1 1 18 12309 1 1 33 ARG HB3 H 3.080 8.527 5.216 1.00 . A A . 33 ARG HB3 1 1 18 12310 1 1 33 ARG HD2 H 0.374 9.064 5.515 1.00 . A A . 33 ARG HD2 1 1 18 12311 1 1 33 ARG HD3 H 1.433 9.637 4.211 1.00 . A A . 33 ARG HD3 1 1 18 12312 1 1 33 ARG HE H -1.306 8.599 3.873 1.00 . A A . 33 ARG HE 1 1 18 12313 1 1 33 ARG HG2 H 1.517 7.216 3.397 1.00 . A A . 33 ARG HG2 1 1 18 12314 1 1 33 ARG HG3 H 0.733 6.768 4.912 1.00 . A A . 33 ARG HG3 1 1 18 12315 1 1 33 ARG HH11 H 0.419 7.209 1.870 1.00 . A A . 33 ARG HH11 1 1 18 12316 1 1 33 ARG HH12 H 0.388 8.308 0.533 1.00 . A A . 33 ARG HH12 1 1 18 12317 1 1 33 ARG HH21 H -0.786 10.976 2.407 1.00 . A A . 33 ARG HH21 1 1 18 12318 1 1 33 ARG HH22 H -0.293 10.439 0.836 1.00 . A A . 33 ARG HH22 1 1 18 12319 1 1 33 ARG N N 4.651 6.081 5.340 1.00 . A A . 33 ARG N 1 1 18 12320 1 1 33 ARG NE N -0.406 8.820 3.554 1.00 . A A . 33 ARG NE 1 1 18 12321 1 1 33 ARG NH1 N 0.235 8.120 1.502 1.00 . A A . 33 ARG NH1 1 1 18 12322 1 1 33 ARG NH2 N -0.447 10.252 1.806 1.00 . A A . 33 ARG NH2 1 1 18 12323 1 1 33 ARG O O 5.684 7.833 3.537 1.00 . A A . 33 ARG O 1 1 18 12324 1 1 34 SER C C 5.490 9.898 2.019 1.00 . A A . 34 SER C 1 1 18 12325 1 1 34 SER CA C 4.537 8.911 1.336 1.00 . A A . 34 SER CA 1 1 18 12326 1 1 34 SER CB C 3.403 9.664 0.641 1.00 . A A . 34 SER CB 1 1 18 12327 1 1 34 SER H H 2.908 7.812 2.225 1.00 . A A . 34 SER H 1 1 18 12328 1 1 34 SER HA H 5.069 8.311 0.617 1.00 . A A . 34 SER HA 1 1 18 12329 1 1 34 SER HB2 H 2.545 9.704 1.292 1.00 . A A . 34 SER HB2 1 1 18 12330 1 1 34 SER HB3 H 3.727 10.670 0.415 1.00 . A A . 34 SER HB3 1 1 18 12331 1 1 34 SER HG H 2.143 9.212 -0.769 1.00 . A A . 34 SER HG 1 1 18 12332 1 1 34 SER N N 3.855 8.042 2.339 1.00 . A A . 34 SER N 1 1 18 12333 1 1 34 SER O O 6.557 10.191 1.516 1.00 . A A . 34 SER O 1 1 18 12334 1 1 34 SER OG O 3.051 8.984 -0.556 1.00 . A A . 34 SER OG 1 1 18 12335 1 1 35 GLU C C 7.309 10.735 4.285 1.00 . A A . 35 GLU C 1 1 18 12336 1 1 35 GLU CA C 5.998 11.398 3.850 1.00 . A A . 35 GLU CA 1 1 18 12337 1 1 35 GLU CB C 5.200 11.860 5.069 1.00 . A A . 35 GLU CB 1 1 18 12338 1 1 35 GLU CD C 5.237 13.547 6.911 1.00 . A A . 35 GLU CD 1 1 18 12339 1 1 35 GLU CG C 5.643 13.271 5.463 1.00 . A A . 35 GLU CG 1 1 18 12340 1 1 35 GLU H H 4.246 10.181 3.540 1.00 . A A . 35 GLU H 1 1 18 12341 1 1 35 GLU HA H 6.202 12.240 3.207 1.00 . A A . 35 GLU HA 1 1 18 12342 1 1 35 GLU HB2 H 4.146 11.867 4.828 1.00 . A A . 35 GLU HB2 1 1 18 12343 1 1 35 GLU HB3 H 5.377 11.185 5.893 1.00 . A A . 35 GLU HB3 1 1 18 12344 1 1 35 GLU HG2 H 6.717 13.350 5.367 1.00 . A A . 35 GLU HG2 1 1 18 12345 1 1 35 GLU HG3 H 5.169 13.992 4.814 1.00 . A A . 35 GLU HG3 1 1 18 12346 1 1 35 GLU N N 5.112 10.421 3.153 1.00 . A A . 35 GLU N 1 1 18 12347 1 1 35 GLU O O 8.364 11.334 4.226 1.00 . A A . 35 GLU O 1 1 18 12348 1 1 35 GLU OE1 O 5.081 12.591 7.654 1.00 . A A . 35 GLU OE1 1 1 18 12349 1 1 35 GLU OE2 O 5.089 14.708 7.254 1.00 . A A . 35 GLU OE2 1 1 18 12350 1 1 36 GLU C C 9.077 7.957 4.037 1.00 . A A . 36 GLU C 1 1 18 12351 1 1 36 GLU CA C 8.507 8.821 5.166 1.00 . A A . 36 GLU CA 1 1 18 12352 1 1 36 GLU CB C 8.088 7.945 6.346 1.00 . A A . 36 GLU CB 1 1 18 12353 1 1 36 GLU CD C 9.835 7.979 8.131 1.00 . A A . 36 GLU CD 1 1 18 12354 1 1 36 GLU CG C 8.524 8.607 7.654 1.00 . A A . 36 GLU CG 1 1 18 12355 1 1 36 GLU H H 6.397 9.037 4.770 1.00 . A A . 36 GLU H 1 1 18 12356 1 1 36 GLU HA H 9.238 9.546 5.489 1.00 . A A . 36 GLU HA 1 1 18 12357 1 1 36 GLU HB2 H 7.015 7.825 6.341 1.00 . A A . 36 GLU HB2 1 1 18 12358 1 1 36 GLU HB3 H 8.560 6.979 6.260 1.00 . A A . 36 GLU HB3 1 1 18 12359 1 1 36 GLU HG2 H 8.668 9.665 7.491 1.00 . A A . 36 GLU HG2 1 1 18 12360 1 1 36 GLU HG3 H 7.763 8.458 8.403 1.00 . A A . 36 GLU HG3 1 1 18 12361 1 1 36 GLU N N 7.256 9.506 4.724 1.00 . A A . 36 GLU N 1 1 18 12362 1 1 36 GLU O O 10.141 7.383 4.161 1.00 . A A . 36 GLU O 1 1 18 12363 1 1 36 GLU OE1 O 10.128 6.872 7.709 1.00 . A A . 36 GLU OE1 1 1 18 12364 1 1 36 GLU OE2 O 10.525 8.616 8.911 1.00 . A A . 36 GLU OE2 1 1 18 12365 1 1 37 CYS C C 10.094 7.707 1.155 1.00 . A A . 37 CYS C 1 1 18 12366 1 1 37 CYS CA C 8.889 7.026 1.809 1.00 . A A . 37 CYS CA 1 1 18 12367 1 1 37 CYS CB C 7.724 6.938 0.824 1.00 . A A . 37 CYS CB 1 1 18 12368 1 1 37 CYS H H 7.522 8.325 2.857 1.00 . A A . 37 CYS H 1 1 18 12369 1 1 37 CYS HA H 9.155 6.040 2.156 1.00 . A A . 37 CYS HA 1 1 18 12370 1 1 37 CYS HB2 H 7.219 7.891 0.778 1.00 . A A . 37 CYS HB2 1 1 18 12371 1 1 37 CYS HB3 H 8.100 6.681 -0.155 1.00 . A A . 37 CYS HB3 1 1 18 12372 1 1 37 CYS N N 8.381 7.858 2.939 1.00 . A A . 37 CYS N 1 1 18 12373 1 1 37 CYS O O 9.970 8.735 0.520 1.00 . A A . 37 CYS O 1 1 18 12374 1 1 37 CYS SG S 6.563 5.665 1.379 1.00 . A A . 37 CYS SG 1 1 18 12375 1 1 38 LEU C C 12.219 8.045 -0.791 1.00 . A A . 38 LEU C 1 1 18 12376 1 1 38 LEU CA C 12.470 7.755 0.690 1.00 . A A . 38 LEU CA 1 1 18 12377 1 1 38 LEU CB C 13.574 6.710 0.855 1.00 . A A . 38 LEU CB 1 1 18 12378 1 1 38 LEU CD1 C 15.300 8.511 0.918 1.00 . A A . 38 LEU CD1 1 1 18 12379 1 1 38 LEU CD2 C 14.190 7.768 3.029 1.00 . A A . 38 LEU CD2 1 1 18 12380 1 1 38 LEU CG C 14.720 7.310 1.668 1.00 . A A . 38 LEU CG 1 1 18 12381 1 1 38 LEU H H 11.338 6.309 1.820 1.00 . A A . 38 LEU H 1 1 18 12382 1 1 38 LEU HA H 12.739 8.659 1.211 1.00 . A A . 38 LEU HA 1 1 18 12383 1 1 38 LEU HB2 H 13.178 5.846 1.370 1.00 . A A . 38 LEU HB2 1 1 18 12384 1 1 38 LEU HB3 H 13.939 6.414 -0.117 1.00 . A A . 38 LEU HB3 1 1 18 12385 1 1 38 LEU HD11 H 14.511 9.010 0.375 1.00 . A A . 38 LEU HD11 1 1 18 12386 1 1 38 LEU HD12 H 16.054 8.172 0.224 1.00 . A A . 38 LEU HD12 1 1 18 12387 1 1 38 LEU HD13 H 15.742 9.198 1.624 1.00 . A A . 38 LEU HD13 1 1 18 12388 1 1 38 LEU HD21 H 14.970 7.673 3.769 1.00 . A A . 38 LEU HD21 1 1 18 12389 1 1 38 LEU HD22 H 13.347 7.155 3.312 1.00 . A A . 38 LEU HD22 1 1 18 12390 1 1 38 LEU HD23 H 13.878 8.801 2.964 1.00 . A A . 38 LEU HD23 1 1 18 12391 1 1 38 LEU HG H 15.490 6.567 1.809 1.00 . A A . 38 LEU HG 1 1 18 12392 1 1 38 LEU N N 11.259 7.139 1.304 1.00 . A A . 38 LEU N 1 1 18 12393 1 1 38 LEU O O 12.392 9.157 -1.254 1.00 . A A . 38 LEU O 1 1 18 12394 1 1 39 SER C C 10.283 8.132 -3.161 1.00 . A A . 39 SER C 1 1 18 12395 1 1 39 SER CA C 11.548 7.287 -2.987 1.00 . A A . 39 SER CA 1 1 18 12396 1 1 39 SER CB C 11.358 5.892 -3.580 1.00 . A A . 39 SER CB 1 1 18 12397 1 1 39 SER H H 11.677 6.170 -1.149 1.00 . A A . 39 SER H 1 1 18 12398 1 1 39 SER HA H 12.392 7.774 -3.451 1.00 . A A . 39 SER HA 1 1 18 12399 1 1 39 SER HB2 H 10.311 5.642 -3.594 1.00 . A A . 39 SER HB2 1 1 18 12400 1 1 39 SER HB3 H 11.744 5.876 -4.591 1.00 . A A . 39 SER HB3 1 1 18 12401 1 1 39 SER HG H 12.554 4.372 -3.365 1.00 . A A . 39 SER HG 1 1 18 12402 1 1 39 SER N N 11.812 7.059 -1.539 1.00 . A A . 39 SER N 1 1 18 12403 1 1 39 SER O O 9.979 8.984 -2.350 1.00 . A A . 39 SER O 1 1 18 12404 1 1 39 SER OG O 12.054 4.944 -2.780 1.00 . A A . 39 SER OG 1 1 18 12405 1 1 40 GLY C C 7.116 7.749 -4.617 1.00 . A A . 40 GLY C 1 1 18 12406 1 1 40 GLY CA C 8.299 8.697 -4.428 1.00 . A A . 40 GLY CA 1 1 18 12407 1 1 40 GLY H H 9.801 7.212 -4.853 1.00 . A A . 40 GLY H 1 1 18 12408 1 1 40 GLY HA2 H 8.122 9.332 -3.571 1.00 . A A . 40 GLY HA2 1 1 18 12409 1 1 40 GLY HA3 H 8.412 9.306 -5.311 1.00 . A A . 40 GLY HA3 1 1 18 12410 1 1 40 GLY N N 9.542 7.903 -4.209 1.00 . A A . 40 GLY N 1 1 18 12411 1 1 40 GLY O O 6.170 8.055 -5.316 1.00 . A A . 40 GLY O 1 1 18 12412 1 1 41 THR C C 5.586 5.119 -2.783 1.00 . A A . 41 THR C 1 1 18 12413 1 1 41 THR CA C 6.037 5.635 -4.154 1.00 . A A . 41 THR CA 1 1 18 12414 1 1 41 THR CB C 6.606 4.495 -5.001 1.00 . A A . 41 THR CB 1 1 18 12415 1 1 41 THR CG2 C 7.851 3.919 -4.323 1.00 . A A . 41 THR CG2 1 1 18 12416 1 1 41 THR H H 7.933 6.371 -3.445 1.00 . A A . 41 THR H 1 1 18 12417 1 1 41 THR HA H 5.212 6.098 -4.671 1.00 . A A . 41 THR HA 1 1 18 12418 1 1 41 THR HB H 6.876 4.872 -5.975 1.00 . A A . 41 THR HB 1 1 18 12419 1 1 41 THR HG1 H 5.809 2.794 -4.492 1.00 . A A . 41 THR HG1 1 1 18 12420 1 1 41 THR HG21 H 7.771 2.844 -4.274 1.00 . A A . 41 THR HG21 1 1 18 12421 1 1 41 THR HG22 H 7.935 4.319 -3.323 1.00 . A A . 41 THR HG22 1 1 18 12422 1 1 41 THR HG23 H 8.729 4.189 -4.893 1.00 . A A . 41 THR HG23 1 1 18 12423 1 1 41 THR N N 7.161 6.600 -4.003 1.00 . A A . 41 THR N 1 1 18 12424 1 1 41 THR O O 6.334 5.129 -1.826 1.00 . A A . 41 THR O 1 1 18 12425 1 1 41 THR OG1 O 5.626 3.476 -5.143 1.00 . A A . 41 THR OG1 1 1 18 12426 1 1 42 TRP C C 2.854 3.017 -1.658 1.00 . A A . 42 TRP C 1 1 18 12427 1 1 42 TRP CA C 3.845 4.154 -1.390 1.00 . A A . 42 TRP CA 1 1 18 12428 1 1 42 TRP CB C 3.140 5.353 -0.754 1.00 . A A . 42 TRP CB 1 1 18 12429 1 1 42 TRP CD1 C 3.105 4.596 1.658 1.00 . A A . 42 TRP CD1 1 1 18 12430 1 1 42 TRP CD2 C 1.042 4.827 0.793 1.00 . A A . 42 TRP CD2 1 1 18 12431 1 1 42 TRP CE2 C 0.875 4.410 2.134 1.00 . A A . 42 TRP CE2 1 1 18 12432 1 1 42 TRP CE3 C -0.112 5.043 0.017 1.00 . A A . 42 TRP CE3 1 1 18 12433 1 1 42 TRP CG C 2.468 4.939 0.516 1.00 . A A . 42 TRP CG 1 1 18 12434 1 1 42 TRP CH2 C -1.526 4.436 1.904 1.00 . A A . 42 TRP CH2 1 1 18 12435 1 1 42 TRP CZ2 C -0.390 4.216 2.689 1.00 . A A . 42 TRP CZ2 1 1 18 12436 1 1 42 TRP CZ3 C -1.387 4.848 0.572 1.00 . A A . 42 TRP CZ3 1 1 18 12437 1 1 42 TRP H H 3.783 4.679 -3.478 1.00 . A A . 42 TRP H 1 1 18 12438 1 1 42 TRP HA H 4.654 3.818 -0.762 1.00 . A A . 42 TRP HA 1 1 18 12439 1 1 42 TRP HB2 H 3.866 6.123 -0.538 1.00 . A A . 42 TRP HB2 1 1 18 12440 1 1 42 TRP HB3 H 2.402 5.741 -1.441 1.00 . A A . 42 TRP HB3 1 1 18 12441 1 1 42 TRP HD1 H 4.175 4.574 1.798 1.00 . A A . 42 TRP HD1 1 1 18 12442 1 1 42 TRP HE1 H 2.362 4.010 3.540 1.00 . A A . 42 TRP HE1 1 1 18 12443 1 1 42 TRP HE3 H -0.016 5.360 -1.010 1.00 . A A . 42 TRP HE3 1 1 18 12444 1 1 42 TRP HH2 H -2.510 4.288 2.324 1.00 . A A . 42 TRP HH2 1 1 18 12445 1 1 42 TRP HZ2 H -0.492 3.898 3.715 1.00 . A A . 42 TRP HZ2 1 1 18 12446 1 1 42 TRP HZ3 H -2.267 5.017 -0.033 1.00 . A A . 42 TRP HZ3 1 1 18 12447 1 1 42 TRP N N 4.364 4.673 -2.689 1.00 . A A . 42 TRP N 1 1 18 12448 1 1 42 TRP NE1 N 2.162 4.287 2.621 1.00 . A A . 42 TRP NE1 1 1 18 12449 1 1 42 TRP O O 2.081 3.073 -2.594 1.00 . A A . 42 TRP O 1 1 18 12450 1 1 43 THR C C 1.215 0.422 0.171 1.00 . A A . 43 THR C 1 1 18 12451 1 1 43 THR CA C 1.923 0.852 -1.119 1.00 . A A . 43 THR CA 1 1 18 12452 1 1 43 THR CB C 2.798 -0.281 -1.652 1.00 . A A . 43 THR CB 1 1 18 12453 1 1 43 THR CG2 C 3.888 -0.608 -0.631 1.00 . A A . 43 THR CG2 1 1 18 12454 1 1 43 THR H H 3.505 1.932 -0.114 1.00 . A A . 43 THR H 1 1 18 12455 1 1 43 THR HA H 1.199 1.136 -1.867 1.00 . A A . 43 THR HA 1 1 18 12456 1 1 43 THR HB H 3.258 0.023 -2.580 1.00 . A A . 43 THR HB 1 1 18 12457 1 1 43 THR HG1 H 2.201 -1.772 -2.749 1.00 . A A . 43 THR HG1 1 1 18 12458 1 1 43 THR HG21 H 4.346 -1.554 -0.881 1.00 . A A . 43 THR HG21 1 1 18 12459 1 1 43 THR HG22 H 3.450 -0.669 0.354 1.00 . A A . 43 THR HG22 1 1 18 12460 1 1 43 THR HG23 H 4.638 0.169 -0.645 1.00 . A A . 43 THR HG23 1 1 18 12461 1 1 43 THR N N 2.870 1.978 -0.864 1.00 . A A . 43 THR N 1 1 18 12462 1 1 43 THR O O 1.696 0.646 1.265 1.00 . A A . 43 THR O 1 1 18 12463 1 1 43 THR OG1 O 1.995 -1.431 -1.877 1.00 . A A . 43 THR OG1 1 1 18 12464 1 1 44 GLN C C -1.259 -2.059 1.002 1.00 . A A . 44 GLN C 1 1 18 12465 1 1 44 GLN CA C -0.667 -0.668 1.252 1.00 . A A . 44 GLN CA 1 1 18 12466 1 1 44 GLN CB C -1.776 0.367 1.467 1.00 . A A . 44 GLN CB 1 1 18 12467 1 1 44 GLN CD C -3.557 -0.513 -0.053 1.00 . A A . 44 GLN CD 1 1 18 12468 1 1 44 GLN CG C -2.534 0.603 0.156 1.00 . A A . 44 GLN CG 1 1 18 12469 1 1 44 GLN H H -0.285 -0.384 -0.850 1.00 . A A . 44 GLN H 1 1 18 12470 1 1 44 GLN HA H -0.012 -0.688 2.109 1.00 . A A . 44 GLN HA 1 1 18 12471 1 1 44 GLN HB2 H -2.464 0.005 2.218 1.00 . A A . 44 GLN HB2 1 1 18 12472 1 1 44 GLN HB3 H -1.340 1.297 1.799 1.00 . A A . 44 GLN HB3 1 1 18 12473 1 1 44 GLN HE21 H -4.366 -0.302 1.749 1.00 . A A . 44 GLN HE21 1 1 18 12474 1 1 44 GLN HE22 H -5.056 -1.514 0.780 1.00 . A A . 44 GLN HE22 1 1 18 12475 1 1 44 GLN HG2 H -3.043 1.555 0.204 1.00 . A A . 44 GLN HG2 1 1 18 12476 1 1 44 GLN HG3 H -1.837 0.610 -0.667 1.00 . A A . 44 GLN HG3 1 1 18 12477 1 1 44 GLN N N 0.077 -0.208 0.044 1.00 . A A . 44 GLN N 1 1 18 12478 1 1 44 GLN NE2 N -4.396 -0.800 0.905 1.00 . A A . 44 GLN NE2 1 1 18 12479 1 1 44 GLN O O -2.337 -2.381 1.463 1.00 . A A . 44 GLN O 1 1 18 12480 1 1 44 GLN OE1 O -3.595 -1.131 -1.098 1.00 . A A . 44 GLN OE1 1 1 18 12481 1 1 45 GLN C C 0.112 -5.219 -0.226 1.00 . A A . 45 GLN C 1 1 18 12482 1 1 45 GLN CA C -1.062 -4.259 -0.008 1.00 . A A . 45 GLN CA 1 1 18 12483 1 1 45 GLN CB C -1.890 -4.122 -1.288 1.00 . A A . 45 GLN CB 1 1 18 12484 1 1 45 GLN CD C -3.275 -5.360 -2.959 1.00 . A A . 45 GLN CD 1 1 18 12485 1 1 45 GLN CG C -2.350 -5.506 -1.749 1.00 . A A . 45 GLN CG 1 1 18 12486 1 1 45 GLN H H 0.313 -2.602 -0.081 1.00 . A A . 45 GLN H 1 1 18 12487 1 1 45 GLN HA H -1.686 -4.606 0.798 1.00 . A A . 45 GLN HA 1 1 18 12488 1 1 45 GLN HB2 H -2.753 -3.502 -1.092 1.00 . A A . 45 GLN HB2 1 1 18 12489 1 1 45 GLN HB3 H -1.287 -3.669 -2.060 1.00 . A A . 45 GLN HB3 1 1 18 12490 1 1 45 GLN HE21 H -4.459 -6.857 -2.411 1.00 . A A . 45 GLN HE21 1 1 18 12491 1 1 45 GLN HE22 H -4.892 -6.082 -3.858 1.00 . A A . 45 GLN HE22 1 1 18 12492 1 1 45 GLN HG2 H -1.490 -6.099 -2.021 1.00 . A A . 45 GLN HG2 1 1 18 12493 1 1 45 GLN HG3 H -2.884 -5.993 -0.948 1.00 . A A . 45 GLN HG3 1 1 18 12494 1 1 45 GLN N N -0.554 -2.886 0.276 1.00 . A A . 45 GLN N 1 1 18 12495 1 1 45 GLN NE2 N -4.293 -6.166 -3.087 1.00 . A A . 45 GLN NE2 1 1 18 12496 1 1 45 GLN O O 0.779 -5.177 -1.241 1.00 . A A . 45 GLN O 1 1 18 12497 1 1 45 GLN OE1 O -3.070 -4.504 -3.797 1.00 . A A . 45 GLN OE1 1 1 18 12498 1 1 46 ILE C C 1.214 -8.347 1.300 1.00 . A A . 46 ILE C 1 1 18 12499 1 1 46 ILE CA C 1.506 -7.037 0.563 1.00 . A A . 46 ILE CA 1 1 18 12500 1 1 46 ILE CB C 2.711 -6.333 1.188 1.00 . A A . 46 ILE CB 1 1 18 12501 1 1 46 ILE CD1 C 4.059 -8.022 -0.071 1.00 . A A . 46 ILE CD1 1 1 18 12502 1 1 46 ILE CG1 C 3.886 -7.313 1.272 1.00 . A A . 46 ILE CG1 1 1 18 12503 1 1 46 ILE CG2 C 2.354 -5.850 2.595 1.00 . A A . 46 ILE CG2 1 1 18 12504 1 1 46 ILE H H -0.176 -6.098 1.532 1.00 . A A . 46 ILE H 1 1 18 12505 1 1 46 ILE HA H 1.696 -7.228 -0.481 1.00 . A A . 46 ILE HA 1 1 18 12506 1 1 46 ILE HB H 2.990 -5.486 0.577 1.00 . A A . 46 ILE HB 1 1 18 12507 1 1 46 ILE HD11 H 3.601 -9.000 -0.023 1.00 . A A . 46 ILE HD11 1 1 18 12508 1 1 46 ILE HD12 H 5.111 -8.127 -0.289 1.00 . A A . 46 ILE HD12 1 1 18 12509 1 1 46 ILE HD13 H 3.586 -7.441 -0.848 1.00 . A A . 46 ILE HD13 1 1 18 12510 1 1 46 ILE HG12 H 4.789 -6.771 1.514 1.00 . A A . 46 ILE HG12 1 1 18 12511 1 1 46 ILE HG13 H 3.689 -8.044 2.041 1.00 . A A . 46 ILE HG13 1 1 18 12512 1 1 46 ILE HG21 H 2.960 -4.991 2.845 1.00 . A A . 46 ILE HG21 1 1 18 12513 1 1 46 ILE HG22 H 2.542 -6.641 3.305 1.00 . A A . 46 ILE HG22 1 1 18 12514 1 1 46 ILE HG23 H 1.310 -5.576 2.630 1.00 . A A . 46 ILE HG23 1 1 18 12515 1 1 46 ILE N N 0.372 -6.081 0.720 1.00 . A A . 46 ILE N 1 1 18 12516 1 1 46 ILE O O 1.429 -9.423 0.777 1.00 . A A . 46 ILE O 1 1 18 12517 1 1 47 CYS C C -1.006 -9.508 3.784 1.00 . A A . 47 CYS C 1 1 18 12518 1 1 47 CYS CA C 0.437 -9.520 3.269 1.00 . A A . 47 CYS CA 1 1 18 12519 1 1 47 CYS CB C 1.427 -9.516 4.435 1.00 . A A . 47 CYS CB 1 1 18 12520 1 1 47 CYS H H 0.568 -7.395 2.920 1.00 . A A . 47 CYS H 1 1 18 12521 1 1 47 CYS HA H 0.606 -10.385 2.647 1.00 . A A . 47 CYS HA 1 1 18 12522 1 1 47 CYS HB2 H 1.190 -10.325 5.111 1.00 . A A . 47 CYS HB2 1 1 18 12523 1 1 47 CYS HB3 H 2.429 -9.647 4.055 1.00 . A A . 47 CYS HB3 1 1 18 12524 1 1 47 CYS N N 0.732 -8.271 2.510 1.00 . A A . 47 CYS N 1 1 18 12525 1 1 47 CYS O O -1.509 -8.496 4.231 1.00 . A A . 47 CYS O 1 1 18 12526 1 1 47 CYS SG S 1.319 -7.940 5.320 1.00 . A A . 47 CYS SG 1 1 18 12527 1 1 48 LEU C C -3.190 -11.626 5.413 1.00 . A A . 48 LEU C 1 1 18 12528 1 1 48 LEU CA C -3.085 -10.685 4.210 1.00 . A A . 48 LEU CA 1 1 18 12529 1 1 48 LEU CB C -3.888 -11.233 3.029 1.00 . A A . 48 LEU CB 1 1 18 12530 1 1 48 LEU CD1 C -4.340 -10.578 0.663 1.00 . A A . 48 LEU CD1 1 1 18 12531 1 1 48 LEU CD2 C -5.673 -9.568 2.519 1.00 . A A . 48 LEU CD2 1 1 18 12532 1 1 48 LEU CG C -4.292 -10.081 2.109 1.00 . A A . 48 LEU CG 1 1 18 12533 1 1 48 LEU H H -1.251 -11.432 3.361 1.00 . A A . 48 LEU H 1 1 18 12534 1 1 48 LEU HA H -3.435 -9.698 4.470 1.00 . A A . 48 LEU HA 1 1 18 12535 1 1 48 LEU HB2 H -3.283 -11.938 2.479 1.00 . A A . 48 LEU HB2 1 1 18 12536 1 1 48 LEU HB3 H -4.776 -11.726 3.395 1.00 . A A . 48 LEU HB3 1 1 18 12537 1 1 48 LEU HD11 H -4.874 -11.516 0.623 1.00 . A A . 48 LEU HD11 1 1 18 12538 1 1 48 LEU HD12 H -3.334 -10.722 0.298 1.00 . A A . 48 LEU HD12 1 1 18 12539 1 1 48 LEU HD13 H -4.845 -9.849 0.048 1.00 . A A . 48 LEU HD13 1 1 18 12540 1 1 48 LEU HD21 H -6.163 -10.306 3.135 1.00 . A A . 48 LEU HD21 1 1 18 12541 1 1 48 LEU HD22 H -6.266 -9.385 1.635 1.00 . A A . 48 LEU HD22 1 1 18 12542 1 1 48 LEU HD23 H -5.564 -8.648 3.075 1.00 . A A . 48 LEU HD23 1 1 18 12543 1 1 48 LEU HG H -3.568 -9.282 2.192 1.00 . A A . 48 LEU HG 1 1 18 12544 1 1 48 LEU N N -1.676 -10.628 3.725 1.00 . A A . 48 LEU N 1 1 18 12545 1 1 48 LEU O O -2.954 -12.810 5.236 1.00 . A A . 48 LEU O 1 1 18 12546 1 1 48 LEU OXT O -3.507 -11.147 6.489 1.00 . A A . 48 LEU OXT 1 1 19 12547 1 1 1 GLY C C -3.813 9.021 15.531 1.00 . A A . 1 GLY C 1 1 19 12548 1 1 1 GLY CA C -2.744 10.108 15.410 1.00 . A A . 1 GLY CA 1 1 19 12549 1 1 1 GLY H1 H -0.709 9.951 14.998 1.00 . A A . 1 GLY H1 1 1 19 12550 1 1 1 GLY H2 H -1.699 9.926 13.618 1.00 . A A . 1 GLY H2 1 1 19 12551 1 1 1 GLY H3 H -1.599 8.558 14.620 1.00 . A A . 1 GLY H3 1 1 19 12552 1 1 1 GLY HA2 H -2.392 10.379 16.395 1.00 . A A . 1 GLY HA2 1 1 19 12553 1 1 1 GLY HA3 H -3.169 10.974 14.928 1.00 . A A . 1 GLY HA3 1 1 19 12554 1 1 1 GLY N N -1.602 9.597 14.601 1.00 . A A . 1 GLY N 1 1 19 12555 1 1 1 GLY O O -3.514 7.846 15.604 1.00 . A A . 1 GLY O 1 1 19 12556 1 1 2 SER C C -5.962 7.553 16.939 1.00 . A A . 2 SER C 1 1 19 12557 1 1 2 SER CA C -6.153 8.398 15.673 1.00 . A A . 2 SER CA 1 1 19 12558 1 1 2 SER CB C -6.033 7.531 14.420 1.00 . A A . 2 SER CB 1 1 19 12559 1 1 2 SER H H -5.280 10.360 15.495 1.00 . A A . 2 SER H 1 1 19 12560 1 1 2 SER HA H -7.114 8.888 15.691 1.00 . A A . 2 SER HA 1 1 19 12561 1 1 2 SER HB2 H -4.994 7.380 14.182 1.00 . A A . 2 SER HB2 1 1 19 12562 1 1 2 SER HB3 H -6.502 6.573 14.600 1.00 . A A . 2 SER HB3 1 1 19 12563 1 1 2 SER HG H -6.616 9.134 13.480 1.00 . A A . 2 SER HG 1 1 19 12564 1 1 2 SER N N -5.061 9.406 15.555 1.00 . A A . 2 SER N 1 1 19 12565 1 1 2 SER O O -6.367 7.941 18.018 1.00 . A A . 2 SER O 1 1 19 12566 1 1 2 SER OG O -6.671 8.187 13.331 1.00 . A A . 2 SER OG 1 1 19 12567 1 1 3 ALA C C -3.665 5.154 18.148 1.00 . A A . 3 ALA C 1 1 19 12568 1 1 3 ALA CA C -5.141 5.545 18.026 1.00 . A A . 3 ALA CA 1 1 19 12569 1 1 3 ALA CB C -6.002 4.304 17.782 1.00 . A A . 3 ALA CB 1 1 19 12570 1 1 3 ALA H H -5.029 6.105 15.947 1.00 . A A . 3 ALA H 1 1 19 12571 1 1 3 ALA HA H -5.471 6.055 18.916 1.00 . A A . 3 ALA HA 1 1 19 12572 1 1 3 ALA HB1 H -6.731 4.211 18.574 1.00 . A A . 3 ALA HB1 1 1 19 12573 1 1 3 ALA HB2 H -5.373 3.425 17.768 1.00 . A A . 3 ALA HB2 1 1 19 12574 1 1 3 ALA HB3 H -6.510 4.398 16.835 1.00 . A A . 3 ALA HB3 1 1 19 12575 1 1 3 ALA N N -5.350 6.404 16.823 1.00 . A A . 3 ALA N 1 1 19 12576 1 1 3 ALA O O -2.934 5.692 18.954 1.00 . A A . 3 ALA O 1 1 19 12577 1 1 4 MET C C -1.139 3.911 16.045 1.00 . A A . 4 MET C 1 1 19 12578 1 1 4 MET CA C -1.797 3.787 17.422 1.00 . A A . 4 MET CA 1 1 19 12579 1 1 4 MET CB C -1.830 2.321 17.876 1.00 . A A . 4 MET CB 1 1 19 12580 1 1 4 MET CE C -4.653 1.186 15.127 1.00 . A A . 4 MET CE 1 1 19 12581 1 1 4 MET CG C -3.048 1.606 17.277 1.00 . A A . 4 MET CG 1 1 19 12582 1 1 4 MET H H -3.832 3.796 16.709 1.00 . A A . 4 MET H 1 1 19 12583 1 1 4 MET HA H -1.262 4.382 18.146 1.00 . A A . 4 MET HA 1 1 19 12584 1 1 4 MET HB2 H -0.928 1.825 17.550 1.00 . A A . 4 MET HB2 1 1 19 12585 1 1 4 MET HB3 H -1.891 2.282 18.954 1.00 . A A . 4 MET HB3 1 1 19 12586 1 1 4 MET HE1 H -4.702 0.212 14.659 1.00 . A A . 4 MET HE1 1 1 19 12587 1 1 4 MET HE2 H -5.077 1.922 14.463 1.00 . A A . 4 MET HE2 1 1 19 12588 1 1 4 MET HE3 H -5.211 1.174 16.053 1.00 . A A . 4 MET HE3 1 1 19 12589 1 1 4 MET HG2 H -3.080 0.588 17.636 1.00 . A A . 4 MET HG2 1 1 19 12590 1 1 4 MET HG3 H -3.949 2.121 17.575 1.00 . A A . 4 MET HG3 1 1 19 12591 1 1 4 MET N N -3.225 4.218 17.352 1.00 . A A . 4 MET N 1 1 19 12592 1 1 4 MET O O 0.046 3.697 15.890 1.00 . A A . 4 MET O 1 1 19 12593 1 1 4 MET SD S -2.926 1.604 15.471 1.00 . A A . 4 MET SD 1 1 19 12594 1 1 5 GLY C C -0.676 3.080 13.254 1.00 . A A . 5 GLY C 1 1 19 12595 1 1 5 GLY CA C -1.319 4.401 13.679 1.00 . A A . 5 GLY CA 1 1 19 12596 1 1 5 GLY H H -2.855 4.432 15.190 1.00 . A A . 5 GLY H 1 1 19 12597 1 1 5 GLY HA2 H -2.101 4.663 12.981 1.00 . A A . 5 GLY HA2 1 1 19 12598 1 1 5 GLY HA3 H -0.568 5.176 13.686 1.00 . A A . 5 GLY HA3 1 1 19 12599 1 1 5 GLY N N -1.901 4.260 15.044 1.00 . A A . 5 GLY N 1 1 19 12600 1 1 5 GLY O O -0.418 2.214 14.066 1.00 . A A . 5 GLY O 1 1 19 12601 1 1 6 CYS C C 1.745 1.762 11.598 1.00 . A A . 6 CYS C 1 1 19 12602 1 1 6 CYS CA C 0.222 1.655 11.513 1.00 . A A . 6 CYS CA 1 1 19 12603 1 1 6 CYS CB C -0.237 1.448 10.059 1.00 . A A . 6 CYS CB 1 1 19 12604 1 1 6 CYS H H -0.623 3.635 11.359 1.00 . A A . 6 CYS H 1 1 19 12605 1 1 6 CYS HA H -0.119 0.832 12.119 1.00 . A A . 6 CYS HA 1 1 19 12606 1 1 6 CYS HB2 H 0.364 0.675 9.605 1.00 . A A . 6 CYS HB2 1 1 19 12607 1 1 6 CYS HB3 H -1.272 1.143 10.054 1.00 . A A . 6 CYS HB3 1 1 19 12608 1 1 6 CYS N N -0.411 2.922 11.987 1.00 . A A . 6 CYS N 1 1 19 12609 1 1 6 CYS O O 2.448 0.772 11.542 1.00 . A A . 6 CYS O 1 1 19 12610 1 1 6 CYS SG S -0.059 2.976 9.099 1.00 . A A . 6 CYS SG 1 1 19 12611 1 1 7 ARG C C 4.234 2.335 13.094 1.00 . A A . 7 ARG C 1 1 19 12612 1 1 7 ARG CA C 3.741 3.101 11.864 1.00 . A A . 7 ARG CA 1 1 19 12613 1 1 7 ARG CB C 3.981 4.604 12.028 1.00 . A A . 7 ARG CB 1 1 19 12614 1 1 7 ARG CD C 4.982 6.238 10.421 1.00 . A A . 7 ARG CD 1 1 19 12615 1 1 7 ARG CG C 3.801 5.299 10.676 1.00 . A A . 7 ARG CG 1 1 19 12616 1 1 7 ARG CZ C 3.411 8.006 9.898 1.00 . A A . 7 ARG CZ 1 1 19 12617 1 1 7 ARG H H 1.681 3.736 11.812 1.00 . A A . 7 ARG H 1 1 19 12618 1 1 7 ARG HA H 4.227 2.741 10.971 1.00 . A A . 7 ARG HA 1 1 19 12619 1 1 7 ARG HB2 H 3.274 5.006 12.739 1.00 . A A . 7 ARG HB2 1 1 19 12620 1 1 7 ARG HB3 H 4.986 4.771 12.385 1.00 . A A . 7 ARG HB3 1 1 19 12621 1 1 7 ARG HD2 H 5.773 6.048 11.133 1.00 . A A . 7 ARG HD2 1 1 19 12622 1 1 7 ARG HD3 H 5.346 6.118 9.413 1.00 . A A . 7 ARG HD3 1 1 19 12623 1 1 7 ARG HE H 4.847 8.221 11.253 1.00 . A A . 7 ARG HE 1 1 19 12624 1 1 7 ARG HG2 H 3.755 4.556 9.893 1.00 . A A . 7 ARG HG2 1 1 19 12625 1 1 7 ARG HG3 H 2.884 5.870 10.685 1.00 . A A . 7 ARG HG3 1 1 19 12626 1 1 7 ARG HH11 H 4.460 8.199 8.204 1.00 . A A . 7 ARG HH11 1 1 19 12627 1 1 7 ARG HH12 H 2.776 8.589 8.090 1.00 . A A . 7 ARG HH12 1 1 19 12628 1 1 7 ARG HH21 H 2.122 7.898 11.427 1.00 . A A . 7 ARG HH21 1 1 19 12629 1 1 7 ARG HH22 H 1.451 8.418 9.916 1.00 . A A . 7 ARG HH22 1 1 19 12630 1 1 7 ARG N N 2.263 2.949 11.754 1.00 . A A . 7 ARG N 1 1 19 12631 1 1 7 ARG NE N 4.435 7.612 10.604 1.00 . A A . 7 ARG NE 1 1 19 12632 1 1 7 ARG NH1 N 3.561 8.287 8.632 1.00 . A A . 7 ARG NH1 1 1 19 12633 1 1 7 ARG NH2 N 2.236 8.117 10.458 1.00 . A A . 7 ARG NH2 1 1 19 12634 1 1 7 ARG O O 5.370 1.907 13.163 1.00 . A A . 7 ARG O 1 1 19 12635 1 1 8 HIS C C 3.723 -0.104 15.001 1.00 . A A . 8 HIS C 1 1 19 12636 1 1 8 HIS CA C 3.770 1.400 15.285 1.00 . A A . 8 HIS CA 1 1 19 12637 1 1 8 HIS CB C 2.728 1.807 16.339 1.00 . A A . 8 HIS CB 1 1 19 12638 1 1 8 HIS CD2 C 1.542 -0.210 17.543 1.00 . A A . 8 HIS CD2 1 1 19 12639 1 1 8 HIS CE1 C 3.026 -0.578 19.078 1.00 . A A . 8 HIS CE1 1 1 19 12640 1 1 8 HIS CG C 2.547 0.707 17.354 1.00 . A A . 8 HIS CG 1 1 19 12641 1 1 8 HIS H H 2.462 2.497 13.974 1.00 . A A . 8 HIS H 1 1 19 12642 1 1 8 HIS HA H 4.756 1.695 15.607 1.00 . A A . 8 HIS HA 1 1 19 12643 1 1 8 HIS HB2 H 3.060 2.703 16.841 1.00 . A A . 8 HIS HB2 1 1 19 12644 1 1 8 HIS HB3 H 1.784 2.000 15.850 1.00 . A A . 8 HIS HB3 1 1 19 12645 1 1 8 HIS HD1 H 4.324 0.937 18.486 1.00 . A A . 8 HIS HD1 1 1 19 12646 1 1 8 HIS HD2 H 0.651 -0.288 16.939 1.00 . A A . 8 HIS HD2 1 1 19 12647 1 1 8 HIS HE1 H 3.549 -0.997 19.925 1.00 . A A . 8 HIS HE1 1 1 19 12648 1 1 8 HIS N N 3.375 2.150 14.059 1.00 . A A . 8 HIS N 1 1 19 12649 1 1 8 HIS ND1 N 3.483 0.453 18.345 1.00 . A A . 8 HIS ND1 1 1 19 12650 1 1 8 HIS NE2 N 1.848 -1.021 18.632 1.00 . A A . 8 HIS NE2 1 1 19 12651 1 1 8 HIS O O 4.481 -0.876 15.553 1.00 . A A . 8 HIS O 1 1 19 12652 1 1 9 PHE C C 4.133 -2.533 13.500 1.00 . A A . 9 PHE C 1 1 19 12653 1 1 9 PHE CA C 2.742 -1.971 13.810 1.00 . A A . 9 PHE CA 1 1 19 12654 1 1 9 PHE CB C 1.843 -2.033 12.573 1.00 . A A . 9 PHE CB 1 1 19 12655 1 1 9 PHE CD1 C 0.141 -1.128 14.220 1.00 . A A . 9 PHE CD1 1 1 19 12656 1 1 9 PHE CD2 C -0.519 -1.442 11.908 1.00 . A A . 9 PHE CD2 1 1 19 12657 1 1 9 PHE CE1 C -1.143 -0.661 14.522 1.00 . A A . 9 PHE CE1 1 1 19 12658 1 1 9 PHE CE2 C -1.803 -0.975 12.211 1.00 . A A . 9 PHE CE2 1 1 19 12659 1 1 9 PHE CG C 0.456 -1.520 12.911 1.00 . A A . 9 PHE CG 1 1 19 12660 1 1 9 PHE CZ C -2.116 -0.585 13.519 1.00 . A A . 9 PHE CZ 1 1 19 12661 1 1 9 PHE H H 2.240 0.119 13.702 1.00 . A A . 9 PHE H 1 1 19 12662 1 1 9 PHE HA H 2.288 -2.513 14.624 1.00 . A A . 9 PHE HA 1 1 19 12663 1 1 9 PHE HB2 H 2.269 -1.422 11.790 1.00 . A A . 9 PHE HB2 1 1 19 12664 1 1 9 PHE HB3 H 1.773 -3.055 12.231 1.00 . A A . 9 PHE HB3 1 1 19 12665 1 1 9 PHE HD1 H 0.889 -1.183 14.996 1.00 . A A . 9 PHE HD1 1 1 19 12666 1 1 9 PHE HD2 H -0.279 -1.740 10.899 1.00 . A A . 9 PHE HD2 1 1 19 12667 1 1 9 PHE HE1 H -1.383 -0.362 15.532 1.00 . A A . 9 PHE HE1 1 1 19 12668 1 1 9 PHE HE2 H -2.554 -0.917 11.437 1.00 . A A . 9 PHE HE2 1 1 19 12669 1 1 9 PHE HZ H -3.107 -0.224 13.753 1.00 . A A . 9 PHE HZ 1 1 19 12670 1 1 9 PHE N N 2.840 -0.522 14.138 1.00 . A A . 9 PHE N 1 1 19 12671 1 1 9 PHE O O 4.952 -1.885 12.878 1.00 . A A . 9 PHE O 1 1 19 12672 1 1 10 GLN C C 5.818 -4.900 12.258 1.00 . A A . 10 GLN C 1 1 19 12673 1 1 10 GLN CA C 5.749 -4.332 13.678 1.00 . A A . 10 GLN CA 1 1 19 12674 1 1 10 GLN CB C 5.886 -5.452 14.710 1.00 . A A . 10 GLN CB 1 1 19 12675 1 1 10 GLN CD C 6.499 -5.013 17.091 1.00 . A A . 10 GLN CD 1 1 19 12676 1 1 10 GLN CG C 7.038 -5.129 15.665 1.00 . A A . 10 GLN CG 1 1 19 12677 1 1 10 GLN H H 3.736 -4.233 14.442 1.00 . A A . 10 GLN H 1 1 19 12678 1 1 10 GLN HA H 6.526 -3.599 13.828 1.00 . A A . 10 GLN HA 1 1 19 12679 1 1 10 GLN HB2 H 4.966 -5.539 15.270 1.00 . A A . 10 GLN HB2 1 1 19 12680 1 1 10 GLN HB3 H 6.091 -6.384 14.205 1.00 . A A . 10 GLN HB3 1 1 19 12681 1 1 10 GLN HE21 H 8.189 -5.631 17.932 1.00 . A A . 10 GLN HE21 1 1 19 12682 1 1 10 GLN HE22 H 6.938 -5.253 19.014 1.00 . A A . 10 GLN HE22 1 1 19 12683 1 1 10 GLN HG2 H 7.774 -5.918 15.619 1.00 . A A . 10 GLN HG2 1 1 19 12684 1 1 10 GLN HG3 H 7.493 -4.194 15.376 1.00 . A A . 10 GLN HG3 1 1 19 12685 1 1 10 GLN N N 4.409 -3.730 13.938 1.00 . A A . 10 GLN N 1 1 19 12686 1 1 10 GLN NE2 N 7.274 -5.325 18.095 1.00 . A A . 10 GLN NE2 1 1 19 12687 1 1 10 GLN O O 6.720 -4.598 11.502 1.00 . A A . 10 GLN O 1 1 19 12688 1 1 10 GLN OE1 O 5.364 -4.633 17.296 1.00 . A A . 10 GLN OE1 1 1 19 12689 1 1 11 SER C C 3.913 -5.578 9.605 1.00 . A A . 11 SER C 1 1 19 12690 1 1 11 SER CA C 4.899 -6.313 10.518 1.00 . A A . 11 SER CA 1 1 19 12691 1 1 11 SER CB C 4.471 -7.768 10.706 1.00 . A A . 11 SER CB 1 1 19 12692 1 1 11 SER H H 4.158 -5.961 12.512 1.00 . A A . 11 SER H 1 1 19 12693 1 1 11 SER HA H 5.894 -6.273 10.108 1.00 . A A . 11 SER HA 1 1 19 12694 1 1 11 SER HB2 H 3.498 -7.804 11.166 1.00 . A A . 11 SER HB2 1 1 19 12695 1 1 11 SER HB3 H 4.429 -8.256 9.741 1.00 . A A . 11 SER HB3 1 1 19 12696 1 1 11 SER HG H 5.031 -9.269 11.808 1.00 . A A . 11 SER HG 1 1 19 12697 1 1 11 SER N N 4.876 -5.725 11.889 1.00 . A A . 11 SER N 1 1 19 12698 1 1 11 SER O O 3.371 -4.551 9.961 1.00 . A A . 11 SER O 1 1 19 12699 1 1 11 SER OG O 5.410 -8.428 11.544 1.00 . A A . 11 SER OG 1 1 19 12700 1 1 12 CYS C C 1.304 -5.932 7.749 1.00 . A A . 12 CYS C 1 1 19 12701 1 1 12 CYS CA C 2.732 -5.427 7.494 1.00 . A A . 12 CYS CA 1 1 19 12702 1 1 12 CYS CB C 3.253 -5.788 6.083 1.00 . A A . 12 CYS CB 1 1 19 12703 1 1 12 CYS H H 4.129 -6.926 8.163 1.00 . A A . 12 CYS H 1 1 19 12704 1 1 12 CYS HA H 2.773 -4.358 7.633 1.00 . A A . 12 CYS HA 1 1 19 12705 1 1 12 CYS HB2 H 3.400 -4.878 5.521 1.00 . A A . 12 CYS HB2 1 1 19 12706 1 1 12 CYS HB3 H 4.203 -6.295 6.180 1.00 . A A . 12 CYS HB3 1 1 19 12707 1 1 12 CYS N N 3.680 -6.097 8.429 1.00 . A A . 12 CYS N 1 1 19 12708 1 1 12 CYS O O 0.338 -5.315 7.348 1.00 . A A . 12 CYS O 1 1 19 12709 1 1 12 CYS SG S 2.095 -6.858 5.177 1.00 . A A . 12 CYS SG 1 1 19 12710 1 1 13 SER C C -1.081 -6.481 9.267 1.00 . A A . 13 SER C 1 1 19 12711 1 1 13 SER CA C -0.195 -7.585 8.688 1.00 . A A . 13 SER CA 1 1 19 12712 1 1 13 SER CB C 0.018 -8.699 9.714 1.00 . A A . 13 SER CB 1 1 19 12713 1 1 13 SER H H 1.960 -7.531 8.727 1.00 . A A . 13 SER H 1 1 19 12714 1 1 13 SER HA H -0.632 -7.989 7.789 1.00 . A A . 13 SER HA 1 1 19 12715 1 1 13 SER HB2 H 0.700 -8.363 10.477 1.00 . A A . 13 SER HB2 1 1 19 12716 1 1 13 SER HB3 H -0.930 -8.953 10.168 1.00 . A A . 13 SER HB3 1 1 19 12717 1 1 13 SER HG H 1.460 -9.964 9.390 1.00 . A A . 13 SER HG 1 1 19 12718 1 1 13 SER N N 1.168 -7.048 8.412 1.00 . A A . 13 SER N 1 1 19 12719 1 1 13 SER O O -2.111 -6.147 8.719 1.00 . A A . 13 SER O 1 1 19 12720 1 1 13 SER OG O 0.567 -9.837 9.063 1.00 . A A . 13 SER OG 1 1 19 12721 1 1 14 GLN C C -1.525 -3.598 10.074 1.00 . A A . 14 GLN C 1 1 19 12722 1 1 14 GLN CA C -1.498 -4.828 10.988 1.00 . A A . 14 GLN CA 1 1 19 12723 1 1 14 GLN CB C -0.784 -4.504 12.299 1.00 . A A . 14 GLN CB 1 1 19 12724 1 1 14 GLN CD C -2.351 -4.834 14.218 1.00 . A A . 14 GLN CD 1 1 19 12725 1 1 14 GLN CG C -1.755 -3.806 13.255 1.00 . A A . 14 GLN CG 1 1 19 12726 1 1 14 GLN H H 0.153 -6.197 10.794 1.00 . A A . 14 GLN H 1 1 19 12727 1 1 14 GLN HA H -2.498 -5.172 11.190 1.00 . A A . 14 GLN HA 1 1 19 12728 1 1 14 GLN HB2 H -0.429 -5.420 12.751 1.00 . A A . 14 GLN HB2 1 1 19 12729 1 1 14 GLN HB3 H 0.054 -3.852 12.101 1.00 . A A . 14 GLN HB3 1 1 19 12730 1 1 14 GLN HE21 H -4.230 -4.348 13.797 1.00 . A A . 14 GLN HE21 1 1 19 12731 1 1 14 GLN HE22 H -4.040 -5.587 14.942 1.00 . A A . 14 GLN HE22 1 1 19 12732 1 1 14 GLN HG2 H -1.226 -3.051 13.814 1.00 . A A . 14 GLN HG2 1 1 19 12733 1 1 14 GLN HG3 H -2.549 -3.346 12.686 1.00 . A A . 14 GLN HG3 1 1 19 12734 1 1 14 GLN N N -0.684 -5.913 10.371 1.00 . A A . 14 GLN N 1 1 19 12735 1 1 14 GLN NE2 N -3.647 -4.931 14.329 1.00 . A A . 14 GLN NE2 1 1 19 12736 1 1 14 GLN O O -2.519 -2.907 9.974 1.00 . A A . 14 GLN O 1 1 19 12737 1 1 14 GLN OE1 O -1.630 -5.556 14.877 1.00 . A A . 14 GLN OE1 1 1 19 12738 1 1 15 CYS C C -1.599 -2.110 7.578 1.00 . A A . 15 CYS C 1 1 19 12739 1 1 15 CYS CA C -0.389 -2.130 8.515 1.00 . A A . 15 CYS CA 1 1 19 12740 1 1 15 CYS CB C 0.902 -2.292 7.712 1.00 . A A . 15 CYS CB 1 1 19 12741 1 1 15 CYS H H 0.359 -3.886 9.516 1.00 . A A . 15 CYS H 1 1 19 12742 1 1 15 CYS HA H -0.347 -1.222 9.095 1.00 . A A . 15 CYS HA 1 1 19 12743 1 1 15 CYS HB2 H 1.013 -3.324 7.413 1.00 . A A . 15 CYS HB2 1 1 19 12744 1 1 15 CYS HB3 H 0.860 -1.665 6.834 1.00 . A A . 15 CYS HB3 1 1 19 12745 1 1 15 CYS N N -0.435 -3.319 9.414 1.00 . A A . 15 CYS N 1 1 19 12746 1 1 15 CYS O O -2.180 -1.074 7.325 1.00 . A A . 15 CYS O 1 1 19 12747 1 1 15 CYS SG S 2.313 -1.805 8.735 1.00 . A A . 15 CYS SG 1 1 19 12748 1 1 16 LEU C C -4.335 -3.980 6.785 1.00 . A A . 16 LEU C 1 1 19 12749 1 1 16 LEU CA C -3.144 -3.274 6.126 1.00 . A A . 16 LEU CA 1 1 19 12750 1 1 16 LEU CB C -2.652 -4.045 4.900 1.00 . A A . 16 LEU CB 1 1 19 12751 1 1 16 LEU CD1 C -0.287 -3.275 4.622 1.00 . A A . 16 LEU CD1 1 1 19 12752 1 1 16 LEU CD2 C -1.727 -3.583 2.622 1.00 . A A . 16 LEU CD2 1 1 19 12753 1 1 16 LEU CG C -1.713 -3.151 4.086 1.00 . A A . 16 LEU CG 1 1 19 12754 1 1 16 LEU H H -1.494 -4.068 7.263 1.00 . A A . 16 LEU H 1 1 19 12755 1 1 16 LEU HA H -3.418 -2.271 5.840 1.00 . A A . 16 LEU HA 1 1 19 12756 1 1 16 LEU HB2 H -2.122 -4.931 5.221 1.00 . A A . 16 LEU HB2 1 1 19 12757 1 1 16 LEU HB3 H -3.496 -4.329 4.290 1.00 . A A . 16 LEU HB3 1 1 19 12758 1 1 16 LEU HD11 H -0.286 -3.118 5.689 1.00 . A A . 16 LEU HD11 1 1 19 12759 1 1 16 LEU HD12 H 0.340 -2.535 4.148 1.00 . A A . 16 LEU HD12 1 1 19 12760 1 1 16 LEU HD13 H 0.094 -4.262 4.403 1.00 . A A . 16 LEU HD13 1 1 19 12761 1 1 16 LEU HD21 H -2.091 -2.771 2.009 1.00 . A A . 16 LEU HD21 1 1 19 12762 1 1 16 LEU HD22 H -2.371 -4.442 2.505 1.00 . A A . 16 LEU HD22 1 1 19 12763 1 1 16 LEU HD23 H -0.725 -3.841 2.319 1.00 . A A . 16 LEU HD23 1 1 19 12764 1 1 16 LEU HG H -2.037 -2.123 4.163 1.00 . A A . 16 LEU HG 1 1 19 12765 1 1 16 LEU N N -1.978 -3.242 7.054 1.00 . A A . 16 LEU N 1 1 19 12766 1 1 16 LEU O O -5.395 -4.100 6.202 1.00 . A A . 16 LEU O 1 1 19 12767 1 1 17 SER C C -6.059 -4.089 9.560 1.00 . A A . 17 SER C 1 1 19 12768 1 1 17 SER CA C -5.308 -5.108 8.698 1.00 . A A . 17 SER CA 1 1 19 12769 1 1 17 SER CB C -4.658 -6.182 9.569 1.00 . A A . 17 SER CB 1 1 19 12770 1 1 17 SER H H -3.318 -4.312 8.460 1.00 . A A . 17 SER H 1 1 19 12771 1 1 17 SER HA H -5.975 -5.564 7.982 1.00 . A A . 17 SER HA 1 1 19 12772 1 1 17 SER HB2 H -3.746 -5.801 9.991 1.00 . A A . 17 SER HB2 1 1 19 12773 1 1 17 SER HB3 H -5.335 -6.455 10.368 1.00 . A A . 17 SER HB3 1 1 19 12774 1 1 17 SER HG H -4.079 -7.010 7.907 1.00 . A A . 17 SER HG 1 1 19 12775 1 1 17 SER N N -4.176 -4.431 8.000 1.00 . A A . 17 SER N 1 1 19 12776 1 1 17 SER O O -7.103 -4.373 10.114 1.00 . A A . 17 SER O 1 1 19 12777 1 1 17 SER OG O -4.364 -7.320 8.770 1.00 . A A . 17 SER OG 1 1 19 12778 1 1 18 ALA C C -6.002 -0.484 9.793 1.00 . A A . 18 ALA C 1 1 19 12779 1 1 18 ALA CA C -6.199 -1.842 10.475 1.00 . A A . 18 ALA CA 1 1 19 12780 1 1 18 ALA CB C -5.492 -1.872 11.830 1.00 . A A . 18 ALA CB 1 1 19 12781 1 1 18 ALA H H -4.692 -2.695 9.203 1.00 . A A . 18 ALA H 1 1 19 12782 1 1 18 ALA HA H -7.248 -2.060 10.595 1.00 . A A . 18 ALA HA 1 1 19 12783 1 1 18 ALA HB1 H -5.149 -0.880 12.080 1.00 . A A . 18 ALA HB1 1 1 19 12784 1 1 18 ALA HB2 H -4.647 -2.543 11.780 1.00 . A A . 18 ALA HB2 1 1 19 12785 1 1 18 ALA HB3 H -6.180 -2.216 12.588 1.00 . A A . 18 ALA HB3 1 1 19 12786 1 1 18 ALA N N -5.531 -2.899 9.664 1.00 . A A . 18 ALA N 1 1 19 12787 1 1 18 ALA O O -5.409 0.416 10.351 1.00 . A A . 18 ALA O 1 1 19 12788 1 1 19 PRO C C -7.302 1.980 8.296 1.00 . A A . 19 PRO C 1 1 19 12789 1 1 19 PRO CA C -6.380 0.846 7.794 1.00 . A A . 19 PRO CA 1 1 19 12790 1 1 19 PRO CB C -6.758 0.409 6.381 1.00 . A A . 19 PRO CB 1 1 19 12791 1 1 19 PRO CD C -7.226 -1.451 7.863 1.00 . A A . 19 PRO CD 1 1 19 12792 1 1 19 PRO CG C -7.612 -0.806 6.552 1.00 . A A . 19 PRO CG 1 1 19 12793 1 1 19 PRO HA H -5.357 1.181 7.796 1.00 . A A . 19 PRO HA 1 1 19 12794 1 1 19 PRO HB2 H -7.313 1.193 5.884 1.00 . A A . 19 PRO HB2 1 1 19 12795 1 1 19 PRO HB3 H -5.873 0.160 5.817 1.00 . A A . 19 PRO HB3 1 1 19 12796 1 1 19 PRO HD2 H -8.108 -1.754 8.409 1.00 . A A . 19 PRO HD2 1 1 19 12797 1 1 19 PRO HD3 H -6.577 -2.296 7.691 1.00 . A A . 19 PRO HD3 1 1 19 12798 1 1 19 PRO HG2 H -8.655 -0.523 6.567 1.00 . A A . 19 PRO HG2 1 1 19 12799 1 1 19 PRO HG3 H -7.432 -1.496 5.743 1.00 . A A . 19 PRO HG3 1 1 19 12800 1 1 19 PRO N N -6.504 -0.398 8.589 1.00 . A A . 19 PRO N 1 1 19 12801 1 1 19 PRO O O -6.971 3.135 8.118 1.00 . A A . 19 PRO O 1 1 19 12802 1 1 20 PRO C C -8.776 3.365 10.653 1.00 . A A . 20 PRO C 1 1 19 12803 1 1 20 PRO CA C -9.335 2.720 9.380 1.00 . A A . 20 PRO CA 1 1 19 12804 1 1 20 PRO CB C -10.641 1.988 9.668 1.00 . A A . 20 PRO CB 1 1 19 12805 1 1 20 PRO CD C -8.964 0.311 9.183 1.00 . A A . 20 PRO CD 1 1 19 12806 1 1 20 PRO CG C -10.246 0.572 9.933 1.00 . A A . 20 PRO CG 1 1 19 12807 1 1 20 PRO HA H -9.490 3.463 8.613 1.00 . A A . 20 PRO HA 1 1 19 12808 1 1 20 PRO HB2 H -11.124 2.416 10.537 1.00 . A A . 20 PRO HB2 1 1 19 12809 1 1 20 PRO HB3 H -11.295 2.034 8.812 1.00 . A A . 20 PRO HB3 1 1 19 12810 1 1 20 PRO HD2 H -8.285 -0.252 9.805 1.00 . A A . 20 PRO HD2 1 1 19 12811 1 1 20 PRO HD3 H -9.167 -0.215 8.267 1.00 . A A . 20 PRO HD3 1 1 19 12812 1 1 20 PRO HG2 H -10.090 0.428 10.993 1.00 . A A . 20 PRO HG2 1 1 19 12813 1 1 20 PRO HG3 H -11.016 -0.097 9.580 1.00 . A A . 20 PRO HG3 1 1 19 12814 1 1 20 PRO N N -8.428 1.651 8.897 1.00 . A A . 20 PRO N 1 1 19 12815 1 1 20 PRO O O -9.226 4.410 11.078 1.00 . A A . 20 PRO O 1 1 19 12816 1 1 21 PHE C C -5.755 3.735 12.286 1.00 . A A . 21 PHE C 1 1 19 12817 1 1 21 PHE CA C -7.216 3.335 12.510 1.00 . A A . 21 PHE CA 1 1 19 12818 1 1 21 PHE CB C -7.305 2.219 13.551 1.00 . A A . 21 PHE CB 1 1 19 12819 1 1 21 PHE CD1 C -9.818 2.398 13.510 1.00 . A A . 21 PHE CD1 1 1 19 12820 1 1 21 PHE CD2 C -8.803 0.197 13.456 1.00 . A A . 21 PHE CD2 1 1 19 12821 1 1 21 PHE CE1 C -11.089 1.813 13.468 1.00 . A A . 21 PHE CE1 1 1 19 12822 1 1 21 PHE CE2 C -10.074 -0.389 13.414 1.00 . A A . 21 PHE CE2 1 1 19 12823 1 1 21 PHE CG C -8.675 1.590 13.506 1.00 . A A . 21 PHE CG 1 1 19 12824 1 1 21 PHE CZ C -11.217 0.419 13.419 1.00 . A A . 21 PHE CZ 1 1 19 12825 1 1 21 PHE H H -7.449 1.908 10.908 1.00 . A A . 21 PHE H 1 1 19 12826 1 1 21 PHE HA H -7.794 4.185 12.832 1.00 . A A . 21 PHE HA 1 1 19 12827 1 1 21 PHE HB2 H -6.556 1.469 13.339 1.00 . A A . 21 PHE HB2 1 1 19 12828 1 1 21 PHE HB3 H -7.131 2.631 14.535 1.00 . A A . 21 PHE HB3 1 1 19 12829 1 1 21 PHE HD1 H -9.720 3.473 13.548 1.00 . A A . 21 PHE HD1 1 1 19 12830 1 1 21 PHE HD2 H -7.921 -0.425 13.453 1.00 . A A . 21 PHE HD2 1 1 19 12831 1 1 21 PHE HE1 H -11.971 2.436 13.472 1.00 . A A . 21 PHE HE1 1 1 19 12832 1 1 21 PHE HE2 H -10.172 -1.463 13.376 1.00 . A A . 21 PHE HE2 1 1 19 12833 1 1 21 PHE HZ H -12.197 -0.032 13.385 1.00 . A A . 21 PHE HZ 1 1 19 12834 1 1 21 PHE N N -7.798 2.751 11.265 1.00 . A A . 21 PHE N 1 1 19 12835 1 1 21 PHE O O -5.003 3.910 13.223 1.00 . A A . 21 PHE O 1 1 19 12836 1 1 22 VAL C C -3.825 5.188 9.587 1.00 . A A . 22 VAL C 1 1 19 12837 1 1 22 VAL CA C -3.924 4.257 10.798 1.00 . A A . 22 VAL CA 1 1 19 12838 1 1 22 VAL CB C -3.208 2.936 10.516 1.00 . A A . 22 VAL CB 1 1 19 12839 1 1 22 VAL CG1 C -3.505 1.940 11.638 1.00 . A A . 22 VAL CG1 1 1 19 12840 1 1 22 VAL CG2 C -3.700 2.363 9.186 1.00 . A A . 22 VAL CG2 1 1 19 12841 1 1 22 VAL H H -5.957 3.726 10.309 1.00 . A A . 22 VAL H 1 1 19 12842 1 1 22 VAL HA H -3.495 4.725 11.669 1.00 . A A . 22 VAL HA 1 1 19 12843 1 1 22 VAL HB H -2.146 3.109 10.463 1.00 . A A . 22 VAL HB 1 1 19 12844 1 1 22 VAL HG11 H -3.033 0.997 11.413 1.00 . A A . 22 VAL HG11 1 1 19 12845 1 1 22 VAL HG12 H -4.572 1.799 11.720 1.00 . A A . 22 VAL HG12 1 1 19 12846 1 1 22 VAL HG13 H -3.119 2.323 12.571 1.00 . A A . 22 VAL HG13 1 1 19 12847 1 1 22 VAL HG21 H -4.767 2.201 9.238 1.00 . A A . 22 VAL HG21 1 1 19 12848 1 1 22 VAL HG22 H -3.202 1.424 8.992 1.00 . A A . 22 VAL HG22 1 1 19 12849 1 1 22 VAL HG23 H -3.479 3.058 8.390 1.00 . A A . 22 VAL HG23 1 1 19 12850 1 1 22 VAL N N -5.342 3.875 11.057 1.00 . A A . 22 VAL N 1 1 19 12851 1 1 22 VAL O O -4.815 5.691 9.094 1.00 . A A . 22 VAL O 1 1 19 12852 1 1 23 GLN C C -1.240 5.893 7.105 1.00 . A A . 23 GLN C 1 1 19 12853 1 1 23 GLN CA C -2.458 6.323 7.929 1.00 . A A . 23 GLN CA 1 1 19 12854 1 1 23 GLN CB C -2.232 7.717 8.522 1.00 . A A . 23 GLN CB 1 1 19 12855 1 1 23 GLN CD C -2.981 9.298 6.735 1.00 . A A . 23 GLN CD 1 1 19 12856 1 1 23 GLN CG C -1.762 8.681 7.424 1.00 . A A . 23 GLN CG 1 1 19 12857 1 1 23 GLN H H -1.848 5.006 9.523 1.00 . A A . 23 GLN H 1 1 19 12858 1 1 23 GLN HA H -3.347 6.322 7.320 1.00 . A A . 23 GLN HA 1 1 19 12859 1 1 23 GLN HB2 H -3.158 8.080 8.946 1.00 . A A . 23 GLN HB2 1 1 19 12860 1 1 23 GLN HB3 H -1.480 7.662 9.295 1.00 . A A . 23 GLN HB3 1 1 19 12861 1 1 23 GLN HE21 H -2.601 8.440 4.985 1.00 . A A . 23 GLN HE21 1 1 19 12862 1 1 23 GLN HE22 H -3.986 9.421 5.027 1.00 . A A . 23 GLN HE22 1 1 19 12863 1 1 23 GLN HG2 H -1.162 9.465 7.865 1.00 . A A . 23 GLN HG2 1 1 19 12864 1 1 23 GLN HG3 H -1.171 8.148 6.695 1.00 . A A . 23 GLN HG3 1 1 19 12865 1 1 23 GLN N N -2.631 5.423 9.107 1.00 . A A . 23 GLN N 1 1 19 12866 1 1 23 GLN NE2 N -3.209 9.030 5.478 1.00 . A A . 23 GLN NE2 1 1 19 12867 1 1 23 GLN O O -1.252 5.951 5.891 1.00 . A A . 23 GLN O 1 1 19 12868 1 1 23 GLN OE1 O -3.734 10.028 7.346 1.00 . A A . 23 GLN OE1 1 1 19 12869 1 1 24 CYS C C 0.738 3.832 6.133 1.00 . A A . 24 CYS C 1 1 19 12870 1 1 24 CYS CA C 1.030 5.069 6.985 1.00 . A A . 24 CYS CA 1 1 19 12871 1 1 24 CYS CB C 2.112 4.787 8.040 1.00 . A A . 24 CYS CB 1 1 19 12872 1 1 24 CYS H H -0.181 5.450 8.728 1.00 . A A . 24 CYS H 1 1 19 12873 1 1 24 CYS HA H 1.350 5.880 6.347 1.00 . A A . 24 CYS HA 1 1 19 12874 1 1 24 CYS HB2 H 3.085 4.871 7.583 1.00 . A A . 24 CYS HB2 1 1 19 12875 1 1 24 CYS HB3 H 2.029 5.512 8.837 1.00 . A A . 24 CYS HB3 1 1 19 12876 1 1 24 CYS N N -0.183 5.478 7.749 1.00 . A A . 24 CYS N 1 1 19 12877 1 1 24 CYS O O -0.302 3.213 6.239 1.00 . A A . 24 CYS O 1 1 19 12878 1 1 24 CYS SG S 1.918 3.119 8.725 1.00 . A A . 24 CYS SG 1 1 19 12879 1 1 25 GLY C C 2.790 1.556 4.293 1.00 . A A . 25 GLY C 1 1 19 12880 1 1 25 GLY CA C 1.470 2.310 4.388 1.00 . A A . 25 GLY CA 1 1 19 12881 1 1 25 GLY H H 2.477 4.016 5.215 1.00 . A A . 25 GLY H 1 1 19 12882 1 1 25 GLY HA2 H 0.709 1.658 4.798 1.00 . A A . 25 GLY HA2 1 1 19 12883 1 1 25 GLY HA3 H 1.175 2.638 3.406 1.00 . A A . 25 GLY HA3 1 1 19 12884 1 1 25 GLY N N 1.655 3.486 5.280 1.00 . A A . 25 GLY N 1 1 19 12885 1 1 25 GLY O O 3.761 1.911 4.926 1.00 . A A . 25 GLY O 1 1 19 12886 1 1 26 TRP C C 4.953 0.373 2.264 1.00 . A A . 26 TRP C 1 1 19 12887 1 1 26 TRP CA C 4.108 -0.244 3.385 1.00 . A A . 26 TRP CA 1 1 19 12888 1 1 26 TRP CB C 3.651 -1.664 3.035 1.00 . A A . 26 TRP CB 1 1 19 12889 1 1 26 TRP CD1 C 5.488 -3.362 2.658 1.00 . A A . 26 TRP CD1 1 1 19 12890 1 1 26 TRP CD2 C 4.999 -3.080 4.835 1.00 . A A . 26 TRP CD2 1 1 19 12891 1 1 26 TRP CE2 C 6.026 -4.050 4.773 1.00 . A A . 26 TRP CE2 1 1 19 12892 1 1 26 TRP CE3 C 4.505 -2.717 6.098 1.00 . A A . 26 TRP CE3 1 1 19 12893 1 1 26 TRP CG C 4.674 -2.659 3.480 1.00 . A A . 26 TRP CG 1 1 19 12894 1 1 26 TRP CH2 C 6.041 -4.268 7.176 1.00 . A A . 26 TRP CH2 1 1 19 12895 1 1 26 TRP CZ2 C 6.544 -4.640 5.927 1.00 . A A . 26 TRP CZ2 1 1 19 12896 1 1 26 TRP CZ3 C 5.024 -3.308 7.262 1.00 . A A . 26 TRP CZ3 1 1 19 12897 1 1 26 TRP H H 2.049 0.253 2.995 1.00 . A A . 26 TRP H 1 1 19 12898 1 1 26 TRP HA H 4.648 -0.243 4.318 1.00 . A A . 26 TRP HA 1 1 19 12899 1 1 26 TRP HB2 H 2.717 -1.869 3.538 1.00 . A A . 26 TRP HB2 1 1 19 12900 1 1 26 TRP HB3 H 3.502 -1.748 1.970 1.00 . A A . 26 TRP HB3 1 1 19 12901 1 1 26 TRP HD1 H 5.508 -3.291 1.582 1.00 . A A . 26 TRP HD1 1 1 19 12902 1 1 26 TRP HE1 H 6.968 -4.802 3.075 1.00 . A A . 26 TRP HE1 1 1 19 12903 1 1 26 TRP HE3 H 3.723 -1.976 6.173 1.00 . A A . 26 TRP HE3 1 1 19 12904 1 1 26 TRP HH2 H 6.436 -4.720 8.075 1.00 . A A . 26 TRP HH2 1 1 19 12905 1 1 26 TRP HZ2 H 7.328 -5.380 5.855 1.00 . A A . 26 TRP HZ2 1 1 19 12906 1 1 26 TRP HZ3 H 4.636 -3.020 8.229 1.00 . A A . 26 TRP HZ3 1 1 19 12907 1 1 26 TRP N N 2.841 0.522 3.510 1.00 . A A . 26 TRP N 1 1 19 12908 1 1 26 TRP NE1 N 6.291 -4.188 3.425 1.00 . A A . 26 TRP NE1 1 1 19 12909 1 1 26 TRP O O 4.458 0.689 1.199 1.00 . A A . 26 TRP O 1 1 19 12910 1 1 27 CYS C C 8.375 0.431 1.262 1.00 . A A . 27 CYS C 1 1 19 12911 1 1 27 CYS CA C 7.066 1.204 1.444 1.00 . A A . 27 CYS CA 1 1 19 12912 1 1 27 CYS CB C 7.348 2.617 1.957 1.00 . A A . 27 CYS CB 1 1 19 12913 1 1 27 CYS H H 6.606 0.348 3.372 1.00 . A A . 27 CYS H 1 1 19 12914 1 1 27 CYS HA H 6.527 1.255 0.512 1.00 . A A . 27 CYS HA 1 1 19 12915 1 1 27 CYS HB2 H 6.616 2.880 2.706 1.00 . A A . 27 CYS HB2 1 1 19 12916 1 1 27 CYS HB3 H 8.335 2.651 2.394 1.00 . A A . 27 CYS HB3 1 1 19 12917 1 1 27 CYS N N 6.220 0.581 2.501 1.00 . A A . 27 CYS N 1 1 19 12918 1 1 27 CYS O O 9.333 0.622 1.985 1.00 . A A . 27 CYS O 1 1 19 12919 1 1 27 CYS SG S 7.253 3.797 0.586 1.00 . A A . 27 CYS SG 1 1 19 12920 1 1 28 HIS C C 10.190 -1.992 1.201 1.00 . A A . 28 HIS C 1 1 19 12921 1 1 28 HIS CA C 9.668 -1.199 -0.012 1.00 . A A . 28 HIS CA 1 1 19 12922 1 1 28 HIS CB C 10.693 -0.147 -0.426 1.00 . A A . 28 HIS CB 1 1 19 12923 1 1 28 HIS CD2 C 11.499 -1.673 -2.408 1.00 . A A . 28 HIS CD2 1 1 19 12924 1 1 28 HIS CE1 C 11.972 -0.111 -3.832 1.00 . A A . 28 HIS CE1 1 1 19 12925 1 1 28 HIS CG C 11.222 -0.476 -1.794 1.00 . A A . 28 HIS CG 1 1 19 12926 1 1 28 HIS H H 7.640 -0.530 -0.303 1.00 . A A . 28 HIS H 1 1 19 12927 1 1 28 HIS HA H 9.495 -1.868 -0.839 1.00 . A A . 28 HIS HA 1 1 19 12928 1 1 28 HIS HB2 H 10.224 0.826 -0.445 1.00 . A A . 28 HIS HB2 1 1 19 12929 1 1 28 HIS HB3 H 11.508 -0.141 0.282 1.00 . A A . 28 HIS HB3 1 1 19 12930 1 1 28 HIS HD1 H 11.444 1.472 -2.590 1.00 . A A . 28 HIS HD1 1 1 19 12931 1 1 28 HIS HD2 H 11.369 -2.647 -1.960 1.00 . A A . 28 HIS HD2 1 1 19 12932 1 1 28 HIS HE1 H 12.285 0.406 -4.726 1.00 . A A . 28 HIS HE1 1 1 19 12933 1 1 28 HIS N N 8.425 -0.418 0.275 1.00 . A A . 28 HIS N 1 1 19 12934 1 1 28 HIS ND1 N 11.530 0.505 -2.721 1.00 . A A . 28 HIS ND1 1 1 19 12935 1 1 28 HIS NE2 N 11.973 -1.439 -3.696 1.00 . A A . 28 HIS NE2 1 1 19 12936 1 1 28 HIS O O 11.205 -2.651 1.098 1.00 . A A . 28 HIS O 1 1 19 12937 1 1 29 ASP C C 9.326 -2.420 4.803 1.00 . A A . 29 ASP C 1 1 19 12938 1 1 29 ASP CA C 10.062 -2.758 3.497 1.00 . A A . 29 ASP CA 1 1 19 12939 1 1 29 ASP CB C 11.550 -2.388 3.619 1.00 . A A . 29 ASP CB 1 1 19 12940 1 1 29 ASP CG C 11.757 -0.907 3.294 1.00 . A A . 29 ASP CG 1 1 19 12941 1 1 29 ASP H H 8.711 -1.451 2.429 1.00 . A A . 29 ASP H 1 1 19 12942 1 1 29 ASP HA H 9.972 -3.811 3.290 1.00 . A A . 29 ASP HA 1 1 19 12943 1 1 29 ASP HB2 H 11.883 -2.583 4.628 1.00 . A A . 29 ASP HB2 1 1 19 12944 1 1 29 ASP HB3 H 12.127 -2.989 2.932 1.00 . A A . 29 ASP HB3 1 1 19 12945 1 1 29 ASP N N 9.534 -1.966 2.338 1.00 . A A . 29 ASP N 1 1 19 12946 1 1 29 ASP O O 8.604 -3.235 5.340 1.00 . A A . 29 ASP O 1 1 19 12947 1 1 29 ASP OD1 O 10.920 -0.112 3.692 1.00 . A A . 29 ASP OD1 1 1 19 12948 1 1 29 ASP OD2 O 12.748 -0.594 2.656 1.00 . A A . 29 ASP OD2 1 1 19 12949 1 1 30 LYS C C 7.499 -0.227 6.388 1.00 . A A . 30 LYS C 1 1 19 12950 1 1 30 LYS CA C 8.856 -0.889 6.626 1.00 . A A . 30 LYS CA 1 1 19 12951 1 1 30 LYS CB C 9.816 0.089 7.306 1.00 . A A . 30 LYS CB 1 1 19 12952 1 1 30 LYS CD C 10.765 0.730 9.521 1.00 . A A . 30 LYS CD 1 1 19 12953 1 1 30 LYS CE C 10.497 2.224 9.707 1.00 . A A . 30 LYS CE 1 1 19 12954 1 1 30 LYS CG C 9.569 0.088 8.816 1.00 . A A . 30 LYS CG 1 1 19 12955 1 1 30 LYS H H 10.127 -0.604 4.906 1.00 . A A . 30 LYS H 1 1 19 12956 1 1 30 LYS HA H 8.738 -1.767 7.239 1.00 . A A . 30 LYS HA 1 1 19 12957 1 1 30 LYS HB2 H 10.834 -0.212 7.107 1.00 . A A . 30 LYS HB2 1 1 19 12958 1 1 30 LYS HB3 H 9.651 1.082 6.918 1.00 . A A . 30 LYS HB3 1 1 19 12959 1 1 30 LYS HD2 H 10.907 0.264 10.486 1.00 . A A . 30 LYS HD2 1 1 19 12960 1 1 30 LYS HD3 H 11.652 0.598 8.922 1.00 . A A . 30 LYS HD3 1 1 19 12961 1 1 30 LYS HE2 H 11.425 2.779 9.684 1.00 . A A . 30 LYS HE2 1 1 19 12962 1 1 30 LYS HE3 H 9.822 2.583 8.946 1.00 . A A . 30 LYS HE3 1 1 19 12963 1 1 30 LYS HG2 H 8.674 0.652 9.036 1.00 . A A . 30 LYS HG2 1 1 19 12964 1 1 30 LYS HG3 H 9.451 -0.928 9.163 1.00 . A A . 30 LYS HG3 1 1 19 12965 1 1 30 LYS HZ1 H 10.568 2.155 11.787 1.00 . A A . 30 LYS HZ1 1 1 19 12966 1 1 30 LYS HZ2 H 9.094 1.629 11.124 1.00 . A A . 30 LYS HZ2 1 1 19 12967 1 1 30 LYS HZ3 H 9.466 3.286 11.169 1.00 . A A . 30 LYS HZ3 1 1 19 12968 1 1 30 LYS N N 9.524 -1.244 5.337 1.00 . A A . 30 LYS N 1 1 19 12969 1 1 30 LYS NZ N 9.858 2.332 11.048 1.00 . A A . 30 LYS NZ 1 1 19 12970 1 1 30 LYS O O 7.104 0.033 5.268 1.00 . A A . 30 LYS O 1 1 19 12971 1 1 31 CYS C C 5.566 2.207 7.419 1.00 . A A . 31 CYS C 1 1 19 12972 1 1 31 CYS CA C 5.444 0.685 7.302 1.00 . A A . 31 CYS CA 1 1 19 12973 1 1 31 CYS CB C 4.622 0.120 8.461 1.00 . A A . 31 CYS CB 1 1 19 12974 1 1 31 CYS H H 7.121 -0.178 8.337 1.00 . A A . 31 CYS H 1 1 19 12975 1 1 31 CYS HA H 4.992 0.411 6.362 1.00 . A A . 31 CYS HA 1 1 19 12976 1 1 31 CYS HB2 H 5.002 -0.854 8.731 1.00 . A A . 31 CYS HB2 1 1 19 12977 1 1 31 CYS HB3 H 4.695 0.782 9.311 1.00 . A A . 31 CYS HB3 1 1 19 12978 1 1 31 CYS N N 6.781 0.044 7.446 1.00 . A A . 31 CYS N 1 1 19 12979 1 1 31 CYS O O 5.728 2.749 8.494 1.00 . A A . 31 CYS O 1 1 19 12980 1 1 31 CYS SG S 2.890 -0.031 7.960 1.00 . A A . 31 CYS SG 1 1 19 12981 1 1 32 VAL C C 4.716 4.971 5.226 1.00 . A A . 32 VAL C 1 1 19 12982 1 1 32 VAL CA C 5.584 4.381 6.341 1.00 . A A . 32 VAL CA 1 1 19 12983 1 1 32 VAL CB C 7.059 4.678 6.079 1.00 . A A . 32 VAL CB 1 1 19 12984 1 1 32 VAL CG1 C 7.930 3.827 7.006 1.00 . A A . 32 VAL CG1 1 1 19 12985 1 1 32 VAL CG2 C 7.386 4.347 4.620 1.00 . A A . 32 VAL CG2 1 1 19 12986 1 1 32 VAL H H 5.349 2.433 5.464 1.00 . A A . 32 VAL H 1 1 19 12987 1 1 32 VAL HA H 5.288 4.770 7.302 1.00 . A A . 32 VAL HA 1 1 19 12988 1 1 32 VAL HB H 7.252 5.724 6.264 1.00 . A A . 32 VAL HB 1 1 19 12989 1 1 32 VAL HG11 H 7.566 3.911 8.020 1.00 . A A . 32 VAL HG11 1 1 19 12990 1 1 32 VAL HG12 H 8.951 4.176 6.961 1.00 . A A . 32 VAL HG12 1 1 19 12991 1 1 32 VAL HG13 H 7.889 2.795 6.692 1.00 . A A . 32 VAL HG13 1 1 19 12992 1 1 32 VAL HG21 H 8.428 4.548 4.429 1.00 . A A . 32 VAL HG21 1 1 19 12993 1 1 32 VAL HG22 H 6.776 4.955 3.968 1.00 . A A . 32 VAL HG22 1 1 19 12994 1 1 32 VAL HG23 H 7.179 3.303 4.435 1.00 . A A . 32 VAL HG23 1 1 19 12995 1 1 32 VAL N N 5.482 2.895 6.316 1.00 . A A . 32 VAL N 1 1 19 12996 1 1 32 VAL O O 4.209 4.256 4.384 1.00 . A A . 32 VAL O 1 1 19 12997 1 1 33 ARG C C 4.590 7.718 3.196 1.00 . A A . 33 ARG C 1 1 19 12998 1 1 33 ARG CA C 3.711 6.873 4.125 1.00 . A A . 33 ARG CA 1 1 19 12999 1 1 33 ARG CB C 2.677 7.739 4.852 1.00 . A A . 33 ARG CB 1 1 19 13000 1 1 33 ARG CD C 1.115 9.348 3.748 1.00 . A A . 33 ARG CD 1 1 19 13001 1 1 33 ARG CG C 1.414 7.867 3.994 1.00 . A A . 33 ARG CG 1 1 19 13002 1 1 33 ARG CZ C -0.650 9.559 2.101 1.00 . A A . 33 ARG CZ 1 1 19 13003 1 1 33 ARG H H 4.961 6.830 5.882 1.00 . A A . 33 ARG H 1 1 19 13004 1 1 33 ARG HA H 3.210 6.102 3.561 1.00 . A A . 33 ARG HA 1 1 19 13005 1 1 33 ARG HB2 H 2.425 7.279 5.796 1.00 . A A . 33 ARG HB2 1 1 19 13006 1 1 33 ARG HB3 H 3.085 8.719 5.032 1.00 . A A . 33 ARG HB3 1 1 19 13007 1 1 33 ARG HD2 H 1.277 9.917 4.653 1.00 . A A . 33 ARG HD2 1 1 19 13008 1 1 33 ARG HD3 H 1.730 9.729 2.948 1.00 . A A . 33 ARG HD3 1 1 19 13009 1 1 33 ARG HE H -1.020 9.308 4.037 1.00 . A A . 33 ARG HE 1 1 19 13010 1 1 33 ARG HG2 H 1.569 7.367 3.048 1.00 . A A . 33 ARG HG2 1 1 19 13011 1 1 33 ARG HG3 H 0.580 7.414 4.509 1.00 . A A . 33 ARG HG3 1 1 19 13012 1 1 33 ARG HH11 H 0.497 8.056 1.445 1.00 . A A . 33 ARG HH11 1 1 19 13013 1 1 33 ARG HH12 H -0.397 8.904 0.227 1.00 . A A . 33 ARG HH12 1 1 19 13014 1 1 33 ARG HH21 H -1.873 11.102 2.464 1.00 . A A . 33 ARG HH21 1 1 19 13015 1 1 33 ARG HH22 H -1.738 10.628 0.803 1.00 . A A . 33 ARG HH22 1 1 19 13016 1 1 33 ARG N N 4.543 6.263 5.201 1.00 . A A . 33 ARG N 1 1 19 13017 1 1 33 ARG NE N -0.322 9.396 3.354 1.00 . A A . 33 ARG NE 1 1 19 13018 1 1 33 ARG NH1 N -0.143 8.780 1.187 1.00 . A A . 33 ARG NH1 1 1 19 13019 1 1 33 ARG NH2 N -1.486 10.504 1.763 1.00 . A A . 33 ARG NH2 1 1 19 13020 1 1 33 ARG O O 5.768 7.912 3.438 1.00 . A A . 33 ARG O 1 1 19 13021 1 1 34 SER C C 5.709 10.039 1.913 1.00 . A A . 34 SER C 1 1 19 13022 1 1 34 SER CA C 4.831 9.030 1.168 1.00 . A A . 34 SER CA 1 1 19 13023 1 1 34 SER CB C 3.797 9.756 0.310 1.00 . A A . 34 SER CB 1 1 19 13024 1 1 34 SER H H 3.084 8.032 1.948 1.00 . A A . 34 SER H 1 1 19 13025 1 1 34 SER HA H 5.438 8.392 0.546 1.00 . A A . 34 SER HA 1 1 19 13026 1 1 34 SER HB2 H 2.842 9.749 0.809 1.00 . A A . 34 SER HB2 1 1 19 13027 1 1 34 SER HB3 H 4.113 10.779 0.157 1.00 . A A . 34 SER HB3 1 1 19 13028 1 1 34 SER HG H 4.270 9.520 -1.563 1.00 . A A . 34 SER HG 1 1 19 13029 1 1 34 SER N N 4.031 8.210 2.127 1.00 . A A . 34 SER N 1 1 19 13030 1 1 34 SER O O 6.823 10.317 1.517 1.00 . A A . 34 SER O 1 1 19 13031 1 1 34 SER OG O 3.676 9.093 -0.941 1.00 . A A . 34 SER OG 1 1 19 13032 1 1 35 GLU C C 7.259 10.941 4.357 1.00 . A A . 35 GLU C 1 1 19 13033 1 1 35 GLU CA C 6.020 11.597 3.742 1.00 . A A . 35 GLU CA 1 1 19 13034 1 1 35 GLU CB C 5.084 12.107 4.838 1.00 . A A . 35 GLU CB 1 1 19 13035 1 1 35 GLU CD C 3.228 13.740 5.205 1.00 . A A . 35 GLU CD 1 1 19 13036 1 1 35 GLU CG C 4.517 13.466 4.428 1.00 . A A . 35 GLU CG 1 1 19 13037 1 1 35 GLU H H 4.311 10.368 3.282 1.00 . A A . 35 GLU H 1 1 19 13038 1 1 35 GLU HA H 6.308 12.415 3.099 1.00 . A A . 35 GLU HA 1 1 19 13039 1 1 35 GLU HB2 H 4.276 11.403 4.977 1.00 . A A . 35 GLU HB2 1 1 19 13040 1 1 35 GLU HB3 H 5.634 12.212 5.762 1.00 . A A . 35 GLU HB3 1 1 19 13041 1 1 35 GLU HG2 H 5.240 14.239 4.645 1.00 . A A . 35 GLU HG2 1 1 19 13042 1 1 35 GLU HG3 H 4.302 13.461 3.370 1.00 . A A . 35 GLU HG3 1 1 19 13043 1 1 35 GLU N N 5.214 10.598 2.983 1.00 . A A . 35 GLU N 1 1 19 13044 1 1 35 GLU O O 8.178 11.611 4.787 1.00 . A A . 35 GLU O 1 1 19 13045 1 1 35 GLU OE1 O 3.204 13.455 6.392 1.00 . A A . 35 GLU OE1 1 1 19 13046 1 1 35 GLU OE2 O 2.288 14.228 4.600 1.00 . A A . 35 GLU OE2 1 1 19 13047 1 1 36 GLU C C 9.175 8.076 3.954 1.00 . A A . 36 GLU C 1 1 19 13048 1 1 36 GLU CA C 8.483 8.957 4.999 1.00 . A A . 36 GLU CA 1 1 19 13049 1 1 36 GLU CB C 7.924 8.108 6.140 1.00 . A A . 36 GLU CB 1 1 19 13050 1 1 36 GLU CD C 8.180 7.813 8.612 1.00 . A A . 36 GLU CD 1 1 19 13051 1 1 36 GLU CG C 8.154 8.831 7.470 1.00 . A A . 36 GLU CG 1 1 19 13052 1 1 36 GLU H H 6.549 9.111 4.057 1.00 . A A . 36 GLU H 1 1 19 13053 1 1 36 GLU HA H 9.176 9.686 5.390 1.00 . A A . 36 GLU HA 1 1 19 13054 1 1 36 GLU HB2 H 6.865 7.956 5.990 1.00 . A A . 36 GLU HB2 1 1 19 13055 1 1 36 GLU HB3 H 8.428 7.155 6.159 1.00 . A A . 36 GLU HB3 1 1 19 13056 1 1 36 GLU HG2 H 9.098 9.356 7.435 1.00 . A A . 36 GLU HG2 1 1 19 13057 1 1 36 GLU HG3 H 7.356 9.537 7.639 1.00 . A A . 36 GLU HG3 1 1 19 13058 1 1 36 GLU N N 7.298 9.638 4.406 1.00 . A A . 36 GLU N 1 1 19 13059 1 1 36 GLU O O 10.283 7.619 4.152 1.00 . A A . 36 GLU O 1 1 19 13060 1 1 36 GLU OE1 O 7.841 6.666 8.366 1.00 . A A . 36 GLU OE1 1 1 19 13061 1 1 36 GLU OE2 O 8.541 8.195 9.713 1.00 . A A . 36 GLU OE2 1 1 19 13062 1 1 37 CYS C C 10.335 7.737 1.139 1.00 . A A . 37 CYS C 1 1 19 13063 1 1 37 CYS CA C 9.171 6.984 1.794 1.00 . A A . 37 CYS CA 1 1 19 13064 1 1 37 CYS CB C 8.066 6.711 0.772 1.00 . A A . 37 CYS CB 1 1 19 13065 1 1 37 CYS H H 7.642 8.211 2.696 1.00 . A A . 37 CYS H 1 1 19 13066 1 1 37 CYS HA H 9.516 6.055 2.221 1.00 . A A . 37 CYS HA 1 1 19 13067 1 1 37 CYS HB2 H 7.574 7.638 0.516 1.00 . A A . 37 CYS HB2 1 1 19 13068 1 1 37 CYS HB3 H 8.497 6.274 -0.115 1.00 . A A . 37 CYS HB3 1 1 19 13069 1 1 37 CYS N N 8.536 7.834 2.842 1.00 . A A . 37 CYS N 1 1 19 13070 1 1 37 CYS O O 10.249 8.918 0.872 1.00 . A A . 37 CYS O 1 1 19 13071 1 1 37 CYS SG S 6.857 5.565 1.483 1.00 . A A . 37 CYS SG 1 1 19 13072 1 1 38 LEU C C 12.141 8.506 -1.002 1.00 . A A . 38 LEU C 1 1 19 13073 1 1 38 LEU CA C 12.590 7.742 0.247 1.00 . A A . 38 LEU CA 1 1 19 13074 1 1 38 LEU CB C 13.551 6.610 -0.128 1.00 . A A . 38 LEU CB 1 1 19 13075 1 1 38 LEU CD1 C 15.778 5.865 0.731 1.00 . A A . 38 LEU CD1 1 1 19 13076 1 1 38 LEU CD2 C 15.645 7.507 -1.149 1.00 . A A . 38 LEU CD2 1 1 19 13077 1 1 38 LEU CG C 14.990 7.045 0.155 1.00 . A A . 38 LEU CG 1 1 19 13078 1 1 38 LEU H H 11.474 6.110 1.105 1.00 . A A . 38 LEU H 1 1 19 13079 1 1 38 LEU HA H 13.064 8.410 0.949 1.00 . A A . 38 LEU HA 1 1 19 13080 1 1 38 LEU HB2 H 13.317 5.733 0.458 1.00 . A A . 38 LEU HB2 1 1 19 13081 1 1 38 LEU HB3 H 13.446 6.380 -1.177 1.00 . A A . 38 LEU HB3 1 1 19 13082 1 1 38 LEU HD11 H 16.780 5.870 0.327 1.00 . A A . 38 LEU HD11 1 1 19 13083 1 1 38 LEU HD12 H 15.288 4.941 0.468 1.00 . A A . 38 LEU HD12 1 1 19 13084 1 1 38 LEU HD13 H 15.825 5.955 1.807 1.00 . A A . 38 LEU HD13 1 1 19 13085 1 1 38 LEU HD21 H 15.039 7.198 -1.986 1.00 . A A . 38 LEU HD21 1 1 19 13086 1 1 38 LEU HD22 H 16.628 7.067 -1.234 1.00 . A A . 38 LEU HD22 1 1 19 13087 1 1 38 LEU HD23 H 15.733 8.584 -1.145 1.00 . A A . 38 LEU HD23 1 1 19 13088 1 1 38 LEU HG H 14.988 7.857 0.867 1.00 . A A . 38 LEU HG 1 1 19 13089 1 1 38 LEU N N 11.422 7.062 0.881 1.00 . A A . 38 LEU N 1 1 19 13090 1 1 38 LEU O O 12.095 9.720 -1.016 1.00 . A A . 38 LEU O 1 1 19 13091 1 1 39 SER C C 9.853 8.788 -3.215 1.00 . A A . 39 SER C 1 1 19 13092 1 1 39 SER CA C 11.353 8.498 -3.292 1.00 . A A . 39 SER CA 1 1 19 13093 1 1 39 SER CB C 11.654 7.518 -4.426 1.00 . A A . 39 SER CB 1 1 19 13094 1 1 39 SER H H 11.842 6.828 -2.020 1.00 . A A . 39 SER H 1 1 19 13095 1 1 39 SER HA H 11.907 9.411 -3.438 1.00 . A A . 39 SER HA 1 1 19 13096 1 1 39 SER HB2 H 12.374 6.790 -4.094 1.00 . A A . 39 SER HB2 1 1 19 13097 1 1 39 SER HB3 H 10.741 7.012 -4.714 1.00 . A A . 39 SER HB3 1 1 19 13098 1 1 39 SER HG H 13.143 8.203 -5.474 1.00 . A A . 39 SER HG 1 1 19 13099 1 1 39 SER N N 11.803 7.807 -2.051 1.00 . A A . 39 SER N 1 1 19 13100 1 1 39 SER O O 9.188 8.418 -2.267 1.00 . A A . 39 SER O 1 1 19 13101 1 1 39 SER OG O 12.186 8.230 -5.535 1.00 . A A . 39 SER OG 1 1 19 13102 1 1 40 GLY C C 7.056 8.491 -4.498 1.00 . A A . 40 GLY C 1 1 19 13103 1 1 40 GLY CA C 7.854 9.756 -4.180 1.00 . A A . 40 GLY CA 1 1 19 13104 1 1 40 GLY H H 9.863 9.737 -4.960 1.00 . A A . 40 GLY H 1 1 19 13105 1 1 40 GLY HA2 H 7.580 10.120 -3.199 1.00 . A A . 40 GLY HA2 1 1 19 13106 1 1 40 GLY HA3 H 7.634 10.512 -4.918 1.00 . A A . 40 GLY HA3 1 1 19 13107 1 1 40 GLY N N 9.312 9.447 -4.203 1.00 . A A . 40 GLY N 1 1 19 13108 1 1 40 GLY O O 6.251 8.466 -5.408 1.00 . A A . 40 GLY O 1 1 19 13109 1 1 41 THR C C 6.001 5.593 -2.699 1.00 . A A . 41 THR C 1 1 19 13110 1 1 41 THR CA C 6.524 6.175 -4.015 1.00 . A A . 41 THR CA 1 1 19 13111 1 1 41 THR CB C 7.545 5.232 -4.651 1.00 . A A . 41 THR CB 1 1 19 13112 1 1 41 THR CG2 C 8.528 4.750 -3.585 1.00 . A A . 41 THR CG2 1 1 19 13113 1 1 41 THR H H 7.924 7.479 -3.025 1.00 . A A . 41 THR H 1 1 19 13114 1 1 41 THR HA H 5.708 6.353 -4.699 1.00 . A A . 41 THR HA 1 1 19 13115 1 1 41 THR HB H 8.085 5.754 -5.424 1.00 . A A . 41 THR HB 1 1 19 13116 1 1 41 THR HG1 H 6.509 3.594 -4.491 1.00 . A A . 41 THR HG1 1 1 19 13117 1 1 41 THR HG21 H 7.990 4.229 -2.808 1.00 . A A . 41 THR HG21 1 1 19 13118 1 1 41 THR HG22 H 9.042 5.601 -3.159 1.00 . A A . 41 THR HG22 1 1 19 13119 1 1 41 THR HG23 H 9.248 4.082 -4.035 1.00 . A A . 41 THR HG23 1 1 19 13120 1 1 41 THR N N 7.271 7.438 -3.755 1.00 . A A . 41 THR N 1 1 19 13121 1 1 41 THR O O 6.639 5.687 -1.669 1.00 . A A . 41 THR O 1 1 19 13122 1 1 41 THR OG1 O 6.868 4.117 -5.212 1.00 . A A . 41 THR OG1 1 1 19 13123 1 1 42 TRP C C 3.381 3.212 -1.846 1.00 . A A . 42 TRP C 1 1 19 13124 1 1 42 TRP CA C 4.265 4.410 -1.484 1.00 . A A . 42 TRP CA 1 1 19 13125 1 1 42 TRP CB C 3.433 5.544 -0.883 1.00 . A A . 42 TRP CB 1 1 19 13126 1 1 42 TRP CD1 C 3.183 4.879 1.539 1.00 . A A . 42 TRP CD1 1 1 19 13127 1 1 42 TRP CD2 C 1.267 4.674 0.381 1.00 . A A . 42 TRP CD2 1 1 19 13128 1 1 42 TRP CE2 C 0.981 4.277 1.708 1.00 . A A . 42 TRP CE2 1 1 19 13129 1 1 42 TRP CE3 C 0.225 4.637 -0.564 1.00 . A A . 42 TRP CE3 1 1 19 13130 1 1 42 TRP CG C 2.671 5.051 0.302 1.00 . A A . 42 TRP CG 1 1 19 13131 1 1 42 TRP CH2 C -1.322 3.831 1.132 1.00 . A A . 42 TRP CH2 1 1 19 13132 1 1 42 TRP CZ2 C -0.299 3.861 2.084 1.00 . A A . 42 TRP CZ2 1 1 19 13133 1 1 42 TRP CZ3 C -1.061 4.219 -0.189 1.00 . A A . 42 TRP CZ3 1 1 19 13134 1 1 42 TRP H H 4.345 4.938 -3.570 1.00 . A A . 42 TRP H 1 1 19 13135 1 1 42 TRP HA H 5.048 4.117 -0.802 1.00 . A A . 42 TRP HA 1 1 19 13136 1 1 42 TRP HB2 H 4.090 6.345 -0.577 1.00 . A A . 42 TRP HB2 1 1 19 13137 1 1 42 TRP HB3 H 2.742 5.911 -1.627 1.00 . A A . 42 TRP HB3 1 1 19 13138 1 1 42 TRP HD1 H 4.207 5.070 1.829 1.00 . A A . 42 TRP HD1 1 1 19 13139 1 1 42 TRP HE1 H 2.295 4.224 3.330 1.00 . A A . 42 TRP HE1 1 1 19 13140 1 1 42 TRP HE3 H 0.415 4.935 -1.585 1.00 . A A . 42 TRP HE3 1 1 19 13141 1 1 42 TRP HH2 H -2.314 3.508 1.413 1.00 . A A . 42 TRP HH2 1 1 19 13142 1 1 42 TRP HZ2 H -0.495 3.562 3.103 1.00 . A A . 42 TRP HZ2 1 1 19 13143 1 1 42 TRP HZ3 H -1.853 4.195 -0.923 1.00 . A A . 42 TRP HZ3 1 1 19 13144 1 1 42 TRP N N 4.842 4.998 -2.728 1.00 . A A . 42 TRP N 1 1 19 13145 1 1 42 TRP NE1 N 2.182 4.424 2.377 1.00 . A A . 42 TRP NE1 1 1 19 13146 1 1 42 TRP O O 2.633 3.259 -2.802 1.00 . A A . 42 TRP O 1 1 19 13147 1 1 43 THR C C 1.941 0.385 -0.196 1.00 . A A . 43 THR C 1 1 19 13148 1 1 43 THR CA C 2.608 0.959 -1.447 1.00 . A A . 43 THR CA 1 1 19 13149 1 1 43 THR CB C 3.565 -0.064 -2.068 1.00 . A A . 43 THR CB 1 1 19 13150 1 1 43 THR CG2 C 4.549 -0.562 -1.011 1.00 . A A . 43 THR CG2 1 1 19 13151 1 1 43 THR H H 4.067 2.100 -0.334 1.00 . A A . 43 THR H 1 1 19 13152 1 1 43 THR HA H 1.860 1.240 -2.171 1.00 . A A . 43 THR HA 1 1 19 13153 1 1 43 THR HB H 4.113 0.399 -2.874 1.00 . A A . 43 THR HB 1 1 19 13154 1 1 43 THR HG1 H 2.041 -0.813 -3.017 1.00 . A A . 43 THR HG1 1 1 19 13155 1 1 43 THR HG21 H 4.004 -0.899 -0.141 1.00 . A A . 43 THR HG21 1 1 19 13156 1 1 43 THR HG22 H 5.213 0.243 -0.729 1.00 . A A . 43 THR HG22 1 1 19 13157 1 1 43 THR HG23 H 5.127 -1.380 -1.413 1.00 . A A . 43 THR HG23 1 1 19 13158 1 1 43 THR N N 3.457 2.137 -1.105 1.00 . A A . 43 THR N 1 1 19 13159 1 1 43 THR O O 2.175 0.821 0.915 1.00 . A A . 43 THR O 1 1 19 13160 1 1 43 THR OG1 O 2.816 -1.161 -2.570 1.00 . A A . 43 THR OG1 1 1 19 13161 1 1 44 GLN C C 0.215 -2.696 0.542 1.00 . A A . 44 GLN C 1 1 19 13162 1 1 44 GLN CA C 0.414 -1.202 0.793 1.00 . A A . 44 GLN CA 1 1 19 13163 1 1 44 GLN CB C -0.929 -0.475 0.892 1.00 . A A . 44 GLN CB 1 1 19 13164 1 1 44 GLN CD C -2.918 -1.084 -0.489 1.00 . A A . 44 GLN CD 1 1 19 13165 1 1 44 GLN CG C -1.563 -0.376 -0.495 1.00 . A A . 44 GLN CG 1 1 19 13166 1 1 44 GLN H H 0.926 -0.926 -1.276 1.00 . A A . 44 GLN H 1 1 19 13167 1 1 44 GLN HA H 0.987 -1.046 1.694 1.00 . A A . 44 GLN HA 1 1 19 13168 1 1 44 GLN HB2 H -1.587 -1.021 1.552 1.00 . A A . 44 GLN HB2 1 1 19 13169 1 1 44 GLN HB3 H -0.770 0.518 1.284 1.00 . A A . 44 GLN HB3 1 1 19 13170 1 1 44 GLN HE21 H -3.531 -0.200 1.179 1.00 . A A . 44 GLN HE21 1 1 19 13171 1 1 44 GLN HE22 H -4.637 -1.284 0.484 1.00 . A A . 44 GLN HE22 1 1 19 13172 1 1 44 GLN HG2 H -1.702 0.665 -0.754 1.00 . A A . 44 GLN HG2 1 1 19 13173 1 1 44 GLN HG3 H -0.919 -0.844 -1.221 1.00 . A A . 44 GLN HG3 1 1 19 13174 1 1 44 GLN N N 1.103 -0.591 -0.373 1.00 . A A . 44 GLN N 1 1 19 13175 1 1 44 GLN NE2 N -3.765 -0.836 0.471 1.00 . A A . 44 GLN NE2 1 1 19 13176 1 1 44 GLN O O -0.873 -3.150 0.246 1.00 . A A . 44 GLN O 1 1 19 13177 1 1 44 GLN OE1 O -3.207 -1.874 -1.365 1.00 . A A . 44 GLN OE1 1 1 19 13178 1 1 45 GLN C C 0.642 -5.624 1.690 1.00 . A A . 45 GLN C 1 1 19 13179 1 1 45 GLN CA C 1.143 -4.929 0.422 1.00 . A A . 45 GLN CA 1 1 19 13180 1 1 45 GLN CB C 2.559 -5.391 0.076 1.00 . A A . 45 GLN CB 1 1 19 13181 1 1 45 GLN CD C 3.349 -7.606 -0.768 1.00 . A A . 45 GLN CD 1 1 19 13182 1 1 45 GLN CG C 2.502 -6.374 -1.094 1.00 . A A . 45 GLN CG 1 1 19 13183 1 1 45 GLN H H 2.132 -3.076 0.891 1.00 . A A . 45 GLN H 1 1 19 13184 1 1 45 GLN HA H 0.479 -5.127 -0.404 1.00 . A A . 45 GLN HA 1 1 19 13185 1 1 45 GLN HB2 H 3.158 -4.535 -0.200 1.00 . A A . 45 GLN HB2 1 1 19 13186 1 1 45 GLN HB3 H 3.000 -5.878 0.933 1.00 . A A . 45 GLN HB3 1 1 19 13187 1 1 45 GLN HE21 H 1.828 -8.869 -0.943 1.00 . A A . 45 GLN HE21 1 1 19 13188 1 1 45 GLN HE22 H 3.316 -9.578 -0.542 1.00 . A A . 45 GLN HE22 1 1 19 13189 1 1 45 GLN HG2 H 1.478 -6.673 -1.264 1.00 . A A . 45 GLN HG2 1 1 19 13190 1 1 45 GLN HG3 H 2.891 -5.899 -1.982 1.00 . A A . 45 GLN HG3 1 1 19 13191 1 1 45 GLN N N 1.263 -3.464 0.654 1.00 . A A . 45 GLN N 1 1 19 13192 1 1 45 GLN NE2 N 2.784 -8.782 -0.749 1.00 . A A . 45 GLN NE2 1 1 19 13193 1 1 45 GLN O O 1.166 -5.427 2.769 1.00 . A A . 45 GLN O 1 1 19 13194 1 1 45 GLN OE1 O 4.535 -7.496 -0.528 1.00 . A A . 45 GLN OE1 1 1 19 13195 1 1 46 ILE C C -0.211 -8.477 2.953 1.00 . A A . 46 ILE C 1 1 19 13196 1 1 46 ILE CA C -0.923 -7.136 2.760 1.00 . A A . 46 ILE CA 1 1 19 13197 1 1 46 ILE CB C -2.403 -7.362 2.442 1.00 . A A . 46 ILE CB 1 1 19 13198 1 1 46 ILE CD1 C -2.855 -7.617 4.888 1.00 . A A . 46 ILE CD1 1 1 19 13199 1 1 46 ILE CG1 C -3.027 -8.262 3.512 1.00 . A A . 46 ILE CG1 1 1 19 13200 1 1 46 ILE CG2 C -2.536 -8.039 1.076 1.00 . A A . 46 ILE CG2 1 1 19 13201 1 1 46 ILE H H -0.782 -6.565 0.688 1.00 . A A . 46 ILE H 1 1 19 13202 1 1 46 ILE HA H -0.825 -6.524 3.642 1.00 . A A . 46 ILE HA 1 1 19 13203 1 1 46 ILE HB H -2.917 -6.412 2.423 1.00 . A A . 46 ILE HB 1 1 19 13204 1 1 46 ILE HD11 H -3.207 -8.297 5.650 1.00 . A A . 46 ILE HD11 1 1 19 13205 1 1 46 ILE HD12 H -3.429 -6.703 4.931 1.00 . A A . 46 ILE HD12 1 1 19 13206 1 1 46 ILE HD13 H -1.812 -7.396 5.056 1.00 . A A . 46 ILE HD13 1 1 19 13207 1 1 46 ILE HG12 H -4.079 -8.391 3.302 1.00 . A A . 46 ILE HG12 1 1 19 13208 1 1 46 ILE HG13 H -2.538 -9.224 3.503 1.00 . A A . 46 ILE HG13 1 1 19 13209 1 1 46 ILE HG21 H -2.777 -7.299 0.329 1.00 . A A . 46 ILE HG21 1 1 19 13210 1 1 46 ILE HG22 H -3.320 -8.780 1.117 1.00 . A A . 46 ILE HG22 1 1 19 13211 1 1 46 ILE HG23 H -1.601 -8.518 0.821 1.00 . A A . 46 ILE HG23 1 1 19 13212 1 1 46 ILE N N -0.376 -6.429 1.567 1.00 . A A . 46 ILE N 1 1 19 13213 1 1 46 ILE O O 0.047 -9.197 2.009 1.00 . A A . 46 ILE O 1 1 19 13214 1 1 47 CYS C C -0.212 -11.194 4.772 1.00 . A A . 47 CYS C 1 1 19 13215 1 1 47 CYS CA C 0.808 -10.107 4.426 1.00 . A A . 47 CYS CA 1 1 19 13216 1 1 47 CYS CB C 1.727 -9.830 5.614 1.00 . A A . 47 CYS CB 1 1 19 13217 1 1 47 CYS H H -0.107 -8.218 4.916 1.00 . A A . 47 CYS H 1 1 19 13218 1 1 47 CYS HA H 1.392 -10.396 3.566 1.00 . A A . 47 CYS HA 1 1 19 13219 1 1 47 CYS HB2 H 1.151 -9.413 6.427 1.00 . A A . 47 CYS HB2 1 1 19 13220 1 1 47 CYS HB3 H 2.188 -10.753 5.935 1.00 . A A . 47 CYS HB3 1 1 19 13221 1 1 47 CYS N N 0.111 -8.815 4.170 1.00 . A A . 47 CYS N 1 1 19 13222 1 1 47 CYS O O -1.337 -10.912 5.131 1.00 . A A . 47 CYS O 1 1 19 13223 1 1 47 CYS SG S 3.014 -8.655 5.123 1.00 . A A . 47 CYS SG 1 1 19 13224 1 1 48 LEU C C -0.455 -14.138 6.359 1.00 . A A . 48 LEU C 1 1 19 13225 1 1 48 LEU CA C -0.777 -13.543 4.986 1.00 . A A . 48 LEU CA 1 1 19 13226 1 1 48 LEU CB C -0.557 -14.580 3.884 1.00 . A A . 48 LEU CB 1 1 19 13227 1 1 48 LEU CD1 C -1.019 -13.155 1.884 1.00 . A A . 48 LEU CD1 1 1 19 13228 1 1 48 LEU CD2 C -1.650 -15.573 1.868 1.00 . A A . 48 LEU CD2 1 1 19 13229 1 1 48 LEU CG C -1.533 -14.318 2.736 1.00 . A A . 48 LEU CG 1 1 19 13230 1 1 48 LEU H H 1.084 -12.646 4.372 1.00 . A A . 48 LEU H 1 1 19 13231 1 1 48 LEU HA H -1.794 -13.185 4.957 1.00 . A A . 48 LEU HA 1 1 19 13232 1 1 48 LEU HB2 H 0.458 -14.507 3.518 1.00 . A A . 48 LEU HB2 1 1 19 13233 1 1 48 LEU HB3 H -0.727 -15.570 4.280 1.00 . A A . 48 LEU HB3 1 1 19 13234 1 1 48 LEU HD11 H -0.793 -12.315 2.522 1.00 . A A . 48 LEU HD11 1 1 19 13235 1 1 48 LEU HD12 H -1.777 -12.871 1.169 1.00 . A A . 48 LEU HD12 1 1 19 13236 1 1 48 LEU HD13 H -0.125 -13.461 1.360 1.00 . A A . 48 LEU HD13 1 1 19 13237 1 1 48 LEU HD21 H -1.466 -15.316 0.835 1.00 . A A . 48 LEU HD21 1 1 19 13238 1 1 48 LEU HD22 H -2.642 -15.987 1.965 1.00 . A A . 48 LEU HD22 1 1 19 13239 1 1 48 LEU HD23 H -0.921 -16.303 2.192 1.00 . A A . 48 LEU HD23 1 1 19 13240 1 1 48 LEU HG H -2.503 -14.065 3.140 1.00 . A A . 48 LEU HG 1 1 19 13241 1 1 48 LEU N N 0.173 -12.438 4.666 1.00 . A A . 48 LEU N 1 1 19 13242 1 1 48 LEU O O 0.437 -13.623 7.013 1.00 . A A . 48 LEU O 1 1 19 13243 1 1 48 LEU OXT O -1.110 -15.097 6.734 1.00 . A A . 48 LEU OXT 1 1 20 13244 1 1 1 GLY C C 0.906 12.976 13.318 1.00 . A A . 1 GLY C 1 1 20 13245 1 1 1 GLY CA C 1.123 13.396 11.864 1.00 . A A . 1 GLY CA 1 1 20 13246 1 1 1 GLY H1 H 2.873 14.008 10.912 1.00 . A A . 1 GLY H1 1 1 20 13247 1 1 1 GLY H2 H 2.663 12.322 10.963 1.00 . A A . 1 GLY H2 1 1 20 13248 1 1 1 GLY H3 H 3.132 13.165 12.361 1.00 . A A . 1 GLY H3 1 1 20 13249 1 1 1 GLY HA2 H 0.855 14.437 11.744 1.00 . A A . 1 GLY HA2 1 1 20 13250 1 1 1 GLY HA3 H 0.505 12.788 11.222 1.00 . A A . 1 GLY HA3 1 1 20 13251 1 1 1 GLY N N 2.556 13.208 11.497 1.00 . A A . 1 GLY N 1 1 20 13252 1 1 1 GLY O O 1.758 13.168 14.164 1.00 . A A . 1 GLY O 1 1 20 13253 1 1 2 SER C C -0.822 10.473 15.061 1.00 . A A . 2 SER C 1 1 20 13254 1 1 2 SER CA C -0.503 11.970 15.018 1.00 . A A . 2 SER CA 1 1 20 13255 1 1 2 SER CB C -1.717 12.788 15.452 1.00 . A A . 2 SER CB 1 1 20 13256 1 1 2 SER H H -0.901 12.259 12.918 1.00 . A A . 2 SER H 1 1 20 13257 1 1 2 SER HA H 0.339 12.195 15.653 1.00 . A A . 2 SER HA 1 1 20 13258 1 1 2 SER HB2 H -2.114 13.324 14.605 1.00 . A A . 2 SER HB2 1 1 20 13259 1 1 2 SER HB3 H -2.477 12.124 15.843 1.00 . A A . 2 SER HB3 1 1 20 13260 1 1 2 SER HG H -1.998 13.728 17.131 1.00 . A A . 2 SER HG 1 1 20 13261 1 1 2 SER N N -0.228 12.403 13.616 1.00 . A A . 2 SER N 1 1 20 13262 1 1 2 SER O O -0.211 9.718 15.791 1.00 . A A . 2 SER O 1 1 20 13263 1 1 2 SER OG O -1.322 13.720 16.450 1.00 . A A . 2 SER OG 1 1 20 13264 1 1 3 ALA C C -0.868 7.730 14.279 1.00 . A A . 3 ALA C 1 1 20 13265 1 1 3 ALA CA C -2.135 8.588 14.286 1.00 . A A . 3 ALA CA 1 1 20 13266 1 1 3 ALA CB C -2.930 8.378 12.997 1.00 . A A . 3 ALA CB 1 1 20 13267 1 1 3 ALA H H -2.261 10.662 13.705 1.00 . A A . 3 ALA H 1 1 20 13268 1 1 3 ALA HA H -2.749 8.352 15.140 1.00 . A A . 3 ALA HA 1 1 20 13269 1 1 3 ALA HB1 H -2.276 7.994 12.229 1.00 . A A . 3 ALA HB1 1 1 20 13270 1 1 3 ALA HB2 H -3.351 9.319 12.676 1.00 . A A . 3 ALA HB2 1 1 20 13271 1 1 3 ALA HB3 H -3.726 7.671 13.178 1.00 . A A . 3 ALA HB3 1 1 20 13272 1 1 3 ALA N N -1.778 10.038 14.286 1.00 . A A . 3 ALA N 1 1 20 13273 1 1 3 ALA O O -0.128 7.705 13.315 1.00 . A A . 3 ALA O 1 1 20 13274 1 1 4 MET C C 0.214 4.691 15.482 1.00 . A A . 4 MET C 1 1 20 13275 1 1 4 MET CA C 0.606 6.169 15.400 1.00 . A A . 4 MET CA 1 1 20 13276 1 1 4 MET CB C 1.342 6.600 16.668 1.00 . A A . 4 MET CB 1 1 20 13277 1 1 4 MET CE C -0.343 5.248 20.045 1.00 . A A . 4 MET CE 1 1 20 13278 1 1 4 MET CG C 0.357 6.663 17.836 1.00 . A A . 4 MET CG 1 1 20 13279 1 1 4 MET H H -1.222 7.059 16.114 1.00 . A A . 4 MET H 1 1 20 13280 1 1 4 MET HA H 1.227 6.344 14.537 1.00 . A A . 4 MET HA 1 1 20 13281 1 1 4 MET HB2 H 2.121 5.885 16.892 1.00 . A A . 4 MET HB2 1 1 20 13282 1 1 4 MET HB3 H 1.781 7.574 16.517 1.00 . A A . 4 MET HB3 1 1 20 13283 1 1 4 MET HE1 H -0.336 4.182 19.864 1.00 . A A . 4 MET HE1 1 1 20 13284 1 1 4 MET HE2 H -1.221 5.681 19.594 1.00 . A A . 4 MET HE2 1 1 20 13285 1 1 4 MET HE3 H -0.356 5.437 21.109 1.00 . A A . 4 MET HE3 1 1 20 13286 1 1 4 MET HG2 H 0.072 7.690 18.011 1.00 . A A . 4 MET HG2 1 1 20 13287 1 1 4 MET HG3 H -0.521 6.081 17.597 1.00 . A A . 4 MET HG3 1 1 20 13288 1 1 4 MET N N -0.613 7.025 15.347 1.00 . A A . 4 MET N 1 1 20 13289 1 1 4 MET O O 0.634 3.975 16.371 1.00 . A A . 4 MET O 1 1 20 13290 1 1 4 MET SD S 1.141 5.990 19.321 1.00 . A A . 4 MET SD 1 1 20 13291 1 1 5 GLY C C -0.208 2.027 13.526 1.00 . A A . 5 GLY C 1 1 20 13292 1 1 5 GLY CA C -0.999 2.796 14.586 1.00 . A A . 5 GLY CA 1 1 20 13293 1 1 5 GLY H H -0.912 4.819 13.852 1.00 . A A . 5 GLY H 1 1 20 13294 1 1 5 GLY HA2 H -0.798 2.380 15.562 1.00 . A A . 5 GLY HA2 1 1 20 13295 1 1 5 GLY HA3 H -2.053 2.720 14.368 1.00 . A A . 5 GLY HA3 1 1 20 13296 1 1 5 GLY N N -0.586 4.227 14.561 1.00 . A A . 5 GLY N 1 1 20 13297 1 1 5 GLY O O 0.502 1.090 13.826 1.00 . A A . 5 GLY O 1 1 20 13298 1 1 6 CYS C C 1.932 1.768 11.504 1.00 . A A . 6 CYS C 1 1 20 13299 1 1 6 CYS CA C 0.432 1.723 11.208 1.00 . A A . 6 CYS CA 1 1 20 13300 1 1 6 CYS CB C 0.099 2.497 9.933 1.00 . A A . 6 CYS CB 1 1 20 13301 1 1 6 CYS H H -0.888 3.189 12.075 1.00 . A A . 6 CYS H 1 1 20 13302 1 1 6 CYS HA H 0.096 0.704 11.118 1.00 . A A . 6 CYS HA 1 1 20 13303 1 1 6 CYS HB2 H -0.962 2.438 9.749 1.00 . A A . 6 CYS HB2 1 1 20 13304 1 1 6 CYS HB3 H 0.387 3.530 10.052 1.00 . A A . 6 CYS HB3 1 1 20 13305 1 1 6 CYS N N -0.318 2.425 12.290 1.00 . A A . 6 CYS N 1 1 20 13306 1 1 6 CYS O O 2.609 0.760 11.482 1.00 . A A . 6 CYS O 1 1 20 13307 1 1 6 CYS SG S 0.985 1.779 8.530 1.00 . A A . 6 CYS SG 1 1 20 13308 1 1 7 ARG C C 4.205 2.353 13.444 1.00 . A A . 7 ARG C 1 1 20 13309 1 1 7 ARG CA C 3.911 3.029 12.101 1.00 . A A . 7 ARG CA 1 1 20 13310 1 1 7 ARG CB C 4.200 4.530 12.179 1.00 . A A . 7 ARG CB 1 1 20 13311 1 1 7 ARG CD C 4.386 5.891 10.088 1.00 . A A . 7 ARG CD 1 1 20 13312 1 1 7 ARG CG C 5.123 4.934 11.026 1.00 . A A . 7 ARG CG 1 1 20 13313 1 1 7 ARG CZ C 3.987 8.277 10.163 1.00 . A A . 7 ARG CZ 1 1 20 13314 1 1 7 ARG H H 1.891 3.728 11.814 1.00 . A A . 7 ARG H 1 1 20 13315 1 1 7 ARG HA H 4.495 2.580 11.314 1.00 . A A . 7 ARG HA 1 1 20 13316 1 1 7 ARG HB2 H 3.273 5.081 12.109 1.00 . A A . 7 ARG HB2 1 1 20 13317 1 1 7 ARG HB3 H 4.683 4.755 13.117 1.00 . A A . 7 ARG HB3 1 1 20 13318 1 1 7 ARG HD2 H 4.876 5.921 9.123 1.00 . A A . 7 ARG HD2 1 1 20 13319 1 1 7 ARG HD3 H 3.355 5.593 9.978 1.00 . A A . 7 ARG HD3 1 1 20 13320 1 1 7 ARG HE H 4.878 7.298 11.641 1.00 . A A . 7 ARG HE 1 1 20 13321 1 1 7 ARG HG2 H 6.001 5.424 11.423 1.00 . A A . 7 ARG HG2 1 1 20 13322 1 1 7 ARG HG3 H 5.421 4.052 10.477 1.00 . A A . 7 ARG HG3 1 1 20 13323 1 1 7 ARG HH11 H 5.373 8.285 8.718 1.00 . A A . 7 ARG HH11 1 1 20 13324 1 1 7 ARG HH12 H 4.195 9.552 8.633 1.00 . A A . 7 ARG HH12 1 1 20 13325 1 1 7 ARG HH21 H 2.495 8.521 11.475 1.00 . A A . 7 ARG HH21 1 1 20 13326 1 1 7 ARG HH22 H 2.563 9.684 10.193 1.00 . A A . 7 ARG HH22 1 1 20 13327 1 1 7 ARG N N 2.455 2.928 11.792 1.00 . A A . 7 ARG N 1 1 20 13328 1 1 7 ARG NE N 4.466 7.219 10.756 1.00 . A A . 7 ARG NE 1 1 20 13329 1 1 7 ARG NH1 N 4.563 8.741 9.088 1.00 . A A . 7 ARG NH1 1 1 20 13330 1 1 7 ARG NH2 N 2.933 8.875 10.648 1.00 . A A . 7 ARG NH2 1 1 20 13331 1 1 7 ARG O O 5.343 2.096 13.786 1.00 . A A . 7 ARG O 1 1 20 13332 1 1 8 HIS C C 3.261 -0.116 15.383 1.00 . A A . 8 HIS C 1 1 20 13333 1 1 8 HIS CA C 3.395 1.403 15.528 1.00 . A A . 8 HIS CA 1 1 20 13334 1 1 8 HIS CB C 2.288 1.966 16.428 1.00 . A A . 8 HIS CB 1 1 20 13335 1 1 8 HIS CD2 C 1.299 -0.089 17.739 1.00 . A A . 8 HIS CD2 1 1 20 13336 1 1 8 HIS CE1 C 2.251 0.266 19.653 1.00 . A A . 8 HIS CE1 1 1 20 13337 1 1 8 HIS CG C 2.059 1.046 17.600 1.00 . A A . 8 HIS CG 1 1 20 13338 1 1 8 HIS H H 2.276 2.280 13.909 1.00 . A A . 8 HIS H 1 1 20 13339 1 1 8 HIS HA H 4.363 1.659 15.929 1.00 . A A . 8 HIS HA 1 1 20 13340 1 1 8 HIS HB2 H 2.580 2.940 16.788 1.00 . A A . 8 HIS HB2 1 1 20 13341 1 1 8 HIS HB3 H 1.374 2.053 15.857 1.00 . A A . 8 HIS HB3 1 1 20 13342 1 1 8 HIS HD1 H 3.265 1.986 19.066 1.00 . A A . 8 HIS HD1 1 1 20 13343 1 1 8 HIS HD2 H 0.697 -0.533 16.961 1.00 . A A . 8 HIS HD2 1 1 20 13344 1 1 8 HIS HE1 H 2.559 0.168 20.683 1.00 . A A . 8 HIS HE1 1 1 20 13345 1 1 8 HIS N N 3.184 2.064 14.207 1.00 . A A . 8 HIS N 1 1 20 13346 1 1 8 HIS ND1 N 2.658 1.254 18.834 1.00 . A A . 8 HIS ND1 1 1 20 13347 1 1 8 HIS NE2 N 1.422 -0.579 19.036 1.00 . A A . 8 HIS NE2 1 1 20 13348 1 1 8 HIS O O 3.715 -0.873 16.218 1.00 . A A . 8 HIS O 1 1 20 13349 1 1 9 PHE C C 3.838 -2.681 13.861 1.00 . A A . 9 PHE C 1 1 20 13350 1 1 9 PHE CA C 2.476 -2.034 14.133 1.00 . A A . 9 PHE CA 1 1 20 13351 1 1 9 PHE CB C 1.558 -2.165 12.919 1.00 . A A . 9 PHE CB 1 1 20 13352 1 1 9 PHE CD1 C -0.179 -1.263 14.534 1.00 . A A . 9 PHE CD1 1 1 20 13353 1 1 9 PHE CD2 C -0.651 -1.227 12.158 1.00 . A A . 9 PHE CD2 1 1 20 13354 1 1 9 PHE CE1 C -1.427 -0.676 14.787 1.00 . A A . 9 PHE CE1 1 1 20 13355 1 1 9 PHE CE2 C -1.897 -0.642 12.409 1.00 . A A . 9 PHE CE2 1 1 20 13356 1 1 9 PHE CG C 0.210 -1.537 13.214 1.00 . A A . 9 PHE CG 1 1 20 13357 1 1 9 PHE CZ C -2.285 -0.365 13.724 1.00 . A A . 9 PHE CZ 1 1 20 13358 1 1 9 PHE H H 2.280 0.059 13.666 1.00 . A A . 9 PHE H 1 1 20 13359 1 1 9 PHE HA H 2.013 -2.481 14.998 1.00 . A A . 9 PHE HA 1 1 20 13360 1 1 9 PHE HB2 H 2.008 -1.661 12.076 1.00 . A A . 9 PHE HB2 1 1 20 13361 1 1 9 PHE HB3 H 1.424 -3.208 12.680 1.00 . A A . 9 PHE HB3 1 1 20 13362 1 1 9 PHE HD1 H 0.482 -1.498 15.353 1.00 . A A . 9 PHE HD1 1 1 20 13363 1 1 9 PHE HD2 H -0.353 -1.442 11.147 1.00 . A A . 9 PHE HD2 1 1 20 13364 1 1 9 PHE HE1 H -1.728 -0.466 15.801 1.00 . A A . 9 PHE HE1 1 1 20 13365 1 1 9 PHE HE2 H -2.558 -0.405 11.588 1.00 . A A . 9 PHE HE2 1 1 20 13366 1 1 9 PHE HZ H -3.246 0.088 13.921 1.00 . A A . 9 PHE HZ 1 1 20 13367 1 1 9 PHE N N 2.639 -0.566 14.330 1.00 . A A . 9 PHE N 1 1 20 13368 1 1 9 PHE O O 4.751 -2.047 13.369 1.00 . A A . 9 PHE O 1 1 20 13369 1 1 10 GLN C C 5.531 -4.850 12.464 1.00 . A A . 10 GLN C 1 1 20 13370 1 1 10 GLN CA C 5.289 -4.619 13.961 1.00 . A A . 10 GLN CA 1 1 20 13371 1 1 10 GLN CB C 5.171 -5.951 14.702 1.00 . A A . 10 GLN CB 1 1 20 13372 1 1 10 GLN CD C 6.105 -5.468 16.968 1.00 . A A . 10 GLN CD 1 1 20 13373 1 1 10 GLN CG C 4.821 -5.692 16.169 1.00 . A A . 10 GLN CG 1 1 20 13374 1 1 10 GLN H H 3.238 -4.423 14.593 1.00 . A A . 10 GLN H 1 1 20 13375 1 1 10 GLN HA H 6.094 -4.038 14.384 1.00 . A A . 10 GLN HA 1 1 20 13376 1 1 10 GLN HB2 H 4.393 -6.548 14.247 1.00 . A A . 10 GLN HB2 1 1 20 13377 1 1 10 GLN HB3 H 6.110 -6.480 14.646 1.00 . A A . 10 GLN HB3 1 1 20 13378 1 1 10 GLN HE21 H 6.325 -7.387 17.421 1.00 . A A . 10 GLN HE21 1 1 20 13379 1 1 10 GLN HE22 H 7.525 -6.356 18.035 1.00 . A A . 10 GLN HE22 1 1 20 13380 1 1 10 GLN HG2 H 4.193 -4.815 16.240 1.00 . A A . 10 GLN HG2 1 1 20 13381 1 1 10 GLN HG3 H 4.294 -6.545 16.571 1.00 . A A . 10 GLN HG3 1 1 20 13382 1 1 10 GLN N N 3.984 -3.934 14.189 1.00 . A A . 10 GLN N 1 1 20 13383 1 1 10 GLN NE2 N 6.700 -6.488 17.520 1.00 . A A . 10 GLN NE2 1 1 20 13384 1 1 10 GLN O O 6.309 -4.156 11.840 1.00 . A A . 10 GLN O 1 1 20 13385 1 1 10 GLN OE1 O 6.571 -4.352 17.093 1.00 . A A . 10 GLN OE1 1 1 20 13386 1 1 11 SER C C 4.004 -5.420 9.589 1.00 . A A . 11 SER C 1 1 20 13387 1 1 11 SER CA C 5.089 -6.095 10.431 1.00 . A A . 11 SER CA 1 1 20 13388 1 1 11 SER CB C 4.995 -7.614 10.296 1.00 . A A . 11 SER CB 1 1 20 13389 1 1 11 SER H H 4.261 -6.377 12.402 1.00 . A A . 11 SER H 1 1 20 13390 1 1 11 SER HA H 6.066 -5.760 10.122 1.00 . A A . 11 SER HA 1 1 20 13391 1 1 11 SER HB2 H 5.536 -8.081 11.100 1.00 . A A . 11 SER HB2 1 1 20 13392 1 1 11 SER HB3 H 3.957 -7.913 10.341 1.00 . A A . 11 SER HB3 1 1 20 13393 1 1 11 SER HG H 6.151 -7.314 8.756 1.00 . A A . 11 SER HG 1 1 20 13394 1 1 11 SER N N 4.880 -5.822 11.883 1.00 . A A . 11 SER N 1 1 20 13395 1 1 11 SER O O 3.544 -4.340 9.898 1.00 . A A . 11 SER O 1 1 20 13396 1 1 11 SER OG O 5.564 -8.013 9.054 1.00 . A A . 11 SER OG 1 1 20 13397 1 1 12 CYS C C 1.167 -5.985 8.024 1.00 . A A . 12 CYS C 1 1 20 13398 1 1 12 CYS CA C 2.553 -5.449 7.650 1.00 . A A . 12 CYS CA 1 1 20 13399 1 1 12 CYS CB C 2.926 -5.877 6.231 1.00 . A A . 12 CYS CB 1 1 20 13400 1 1 12 CYS H H 3.991 -6.920 8.288 1.00 . A A . 12 CYS H 1 1 20 13401 1 1 12 CYS HA H 2.577 -4.377 7.726 1.00 . A A . 12 CYS HA 1 1 20 13402 1 1 12 CYS HB2 H 2.197 -5.492 5.534 1.00 . A A . 12 CYS HB2 1 1 20 13403 1 1 12 CYS HB3 H 3.903 -5.487 5.982 1.00 . A A . 12 CYS HB3 1 1 20 13404 1 1 12 CYS N N 3.600 -6.051 8.521 1.00 . A A . 12 CYS N 1 1 20 13405 1 1 12 CYS O O 0.156 -5.485 7.574 1.00 . A A . 12 CYS O 1 1 20 13406 1 1 12 CYS SG S 2.958 -7.684 6.132 1.00 . A A . 12 CYS SG 1 1 20 13407 1 1 13 SER C C -1.162 -6.467 9.687 1.00 . A A . 13 SER C 1 1 20 13408 1 1 13 SER CA C -0.206 -7.573 9.236 1.00 . A A . 13 SER CA 1 1 20 13409 1 1 13 SER CB C 0.096 -8.512 10.406 1.00 . A A . 13 SER CB 1 1 20 13410 1 1 13 SER H H 1.941 -7.393 9.189 1.00 . A A . 13 SER H 1 1 20 13411 1 1 13 SER HA H -0.635 -8.131 8.419 1.00 . A A . 13 SER HA 1 1 20 13412 1 1 13 SER HB2 H -0.507 -8.235 11.254 1.00 . A A . 13 SER HB2 1 1 20 13413 1 1 13 SER HB3 H -0.139 -9.529 10.120 1.00 . A A . 13 SER HB3 1 1 20 13414 1 1 13 SER HG H 1.520 -8.153 11.682 1.00 . A A . 13 SER HG 1 1 20 13415 1 1 13 SER N N 1.115 -7.001 8.840 1.00 . A A . 13 SER N 1 1 20 13416 1 1 13 SER O O -2.221 -6.279 9.121 1.00 . A A . 13 SER O 1 1 20 13417 1 1 13 SER OG O 1.470 -8.410 10.758 1.00 . A A . 13 SER OG 1 1 20 13418 1 1 14 GLN C C -1.599 -3.416 10.313 1.00 . A A . 14 GLN C 1 1 20 13419 1 1 14 GLN CA C -1.697 -4.659 11.207 1.00 . A A . 14 GLN CA 1 1 20 13420 1 1 14 GLN CB C -1.189 -4.358 12.615 1.00 . A A . 14 GLN CB 1 1 20 13421 1 1 14 GLN CD C -2.384 -4.389 14.807 1.00 . A A . 14 GLN CD 1 1 20 13422 1 1 14 GLN CG C -2.306 -3.713 13.436 1.00 . A A . 14 GLN CG 1 1 20 13423 1 1 14 GLN H H 0.051 -5.917 11.157 1.00 . A A . 14 GLN H 1 1 20 13424 1 1 14 GLN HA H -2.715 -5.006 11.255 1.00 . A A . 14 GLN HA 1 1 20 13425 1 1 14 GLN HB2 H -0.879 -5.278 13.088 1.00 . A A . 14 GLN HB2 1 1 20 13426 1 1 14 GLN HB3 H -0.352 -3.686 12.557 1.00 . A A . 14 GLN HB3 1 1 20 13427 1 1 14 GLN HE21 H -4.192 -5.146 14.491 1.00 . A A . 14 GLN HE21 1 1 20 13428 1 1 14 GLN HE22 H -3.508 -5.506 16.002 1.00 . A A . 14 GLN HE22 1 1 20 13429 1 1 14 GLN HG2 H -2.097 -2.663 13.563 1.00 . A A . 14 GLN HG2 1 1 20 13430 1 1 14 GLN HG3 H -3.249 -3.832 12.923 1.00 . A A . 14 GLN HG3 1 1 20 13431 1 1 14 GLN N N -0.803 -5.742 10.709 1.00 . A A . 14 GLN N 1 1 20 13432 1 1 14 GLN NE2 N -3.450 -5.070 15.127 1.00 . A A . 14 GLN NE2 1 1 20 13433 1 1 14 GLN O O -2.557 -2.692 10.137 1.00 . A A . 14 GLN O 1 1 20 13434 1 1 14 GLN OE1 O -1.464 -4.295 15.596 1.00 . A A . 14 GLN OE1 1 1 20 13435 1 1 15 CYS C C -1.318 -2.027 7.717 1.00 . A A . 15 CYS C 1 1 20 13436 1 1 15 CYS CA C -0.300 -1.970 8.859 1.00 . A A . 15 CYS CA 1 1 20 13437 1 1 15 CYS CB C 1.121 -2.066 8.310 1.00 . A A . 15 CYS CB 1 1 20 13438 1 1 15 CYS H H 0.312 -3.762 9.896 1.00 . A A . 15 CYS H 1 1 20 13439 1 1 15 CYS HA H -0.415 -1.059 9.423 1.00 . A A . 15 CYS HA 1 1 20 13440 1 1 15 CYS HB2 H 1.461 -3.087 8.382 1.00 . A A . 15 CYS HB2 1 1 20 13441 1 1 15 CYS HB3 H 1.127 -1.760 7.273 1.00 . A A . 15 CYS HB3 1 1 20 13442 1 1 15 CYS N N -0.451 -3.165 9.744 1.00 . A A . 15 CYS N 1 1 20 13443 1 1 15 CYS O O -1.768 -1.014 7.219 1.00 . A A . 15 CYS O 1 1 20 13444 1 1 15 CYS SG S 2.231 -0.996 9.261 1.00 . A A . 15 CYS SG 1 1 20 13445 1 1 16 LEU C C -3.994 -3.895 6.721 1.00 . A A . 16 LEU C 1 1 20 13446 1 1 16 LEU CA C -2.671 -3.337 6.188 1.00 . A A . 16 LEU CA 1 1 20 13447 1 1 16 LEU CB C -2.032 -4.321 5.205 1.00 . A A . 16 LEU CB 1 1 20 13448 1 1 16 LEU CD1 C 0.132 -3.071 5.223 1.00 . A A . 16 LEU CD1 1 1 20 13449 1 1 16 LEU CD2 C -0.442 -4.544 3.291 1.00 . A A . 16 LEU CD2 1 1 20 13450 1 1 16 LEU CG C -1.007 -3.584 4.341 1.00 . A A . 16 LEU CG 1 1 20 13451 1 1 16 LEU H H -1.307 -4.012 7.712 1.00 . A A . 16 LEU H 1 1 20 13452 1 1 16 LEU HA H -2.827 -2.383 5.707 1.00 . A A . 16 LEU HA 1 1 20 13453 1 1 16 LEU HB2 H -1.539 -5.110 5.755 1.00 . A A . 16 LEU HB2 1 1 20 13454 1 1 16 LEU HB3 H -2.796 -4.745 4.572 1.00 . A A . 16 LEU HB3 1 1 20 13455 1 1 16 LEU HD11 H 1.069 -3.172 4.695 1.00 . A A . 16 LEU HD11 1 1 20 13456 1 1 16 LEU HD12 H 0.169 -3.648 6.136 1.00 . A A . 16 LEU HD12 1 1 20 13457 1 1 16 LEU HD13 H -0.036 -2.032 5.461 1.00 . A A . 16 LEU HD13 1 1 20 13458 1 1 16 LEU HD21 H 0.597 -4.745 3.509 1.00 . A A . 16 LEU HD21 1 1 20 13459 1 1 16 LEU HD22 H -0.522 -4.095 2.311 1.00 . A A . 16 LEU HD22 1 1 20 13460 1 1 16 LEU HD23 H -0.999 -5.468 3.309 1.00 . A A . 16 LEU HD23 1 1 20 13461 1 1 16 LEU HG H -1.485 -2.750 3.850 1.00 . A A . 16 LEU HG 1 1 20 13462 1 1 16 LEU N N -1.684 -3.209 7.298 1.00 . A A . 16 LEU N 1 1 20 13463 1 1 16 LEU O O -5.002 -3.880 6.044 1.00 . A A . 16 LEU O 1 1 20 13464 1 1 17 SER C C -6.049 -3.842 9.217 1.00 . A A . 17 SER C 1 1 20 13465 1 1 17 SER CA C -5.257 -4.943 8.506 1.00 . A A . 17 SER CA 1 1 20 13466 1 1 17 SER CB C -4.806 -6.011 9.501 1.00 . A A . 17 SER CB 1 1 20 13467 1 1 17 SER H H -3.174 -4.389 8.463 1.00 . A A . 17 SER H 1 1 20 13468 1 1 17 SER HA H -5.856 -5.394 7.730 1.00 . A A . 17 SER HA 1 1 20 13469 1 1 17 SER HB2 H -3.979 -5.639 10.080 1.00 . A A . 17 SER HB2 1 1 20 13470 1 1 17 SER HB3 H -5.626 -6.253 10.166 1.00 . A A . 17 SER HB3 1 1 20 13471 1 1 17 SER HG H -3.477 -7.059 8.540 1.00 . A A . 17 SER HG 1 1 20 13472 1 1 17 SER N N -3.998 -4.386 7.932 1.00 . A A . 17 SER N 1 1 20 13473 1 1 17 SER O O -7.200 -4.019 9.564 1.00 . A A . 17 SER O 1 1 20 13474 1 1 17 SER OG O -4.396 -7.173 8.792 1.00 . A A . 17 SER OG 1 1 20 13475 1 1 18 ALA C C -5.748 -0.255 9.504 1.00 . A A . 18 ALA C 1 1 20 13476 1 1 18 ALA CA C -6.167 -1.596 10.114 1.00 . A A . 18 ALA CA 1 1 20 13477 1 1 18 ALA CB C -5.742 -1.681 11.580 1.00 . A A . 18 ALA CB 1 1 20 13478 1 1 18 ALA H H -4.516 -2.580 9.145 1.00 . A A . 18 ALA H 1 1 20 13479 1 1 18 ALA HA H -7.234 -1.732 10.030 1.00 . A A . 18 ALA HA 1 1 20 13480 1 1 18 ALA HB1 H -6.459 -2.275 12.129 1.00 . A A . 18 ALA HB1 1 1 20 13481 1 1 18 ALA HB2 H -5.700 -0.687 12.003 1.00 . A A . 18 ALA HB2 1 1 20 13482 1 1 18 ALA HB3 H -4.768 -2.142 11.647 1.00 . A A . 18 ALA HB3 1 1 20 13483 1 1 18 ALA N N -5.444 -2.705 9.433 1.00 . A A . 18 ALA N 1 1 20 13484 1 1 18 ALA O O -5.209 0.597 10.179 1.00 . A A . 18 ALA O 1 1 20 13485 1 1 19 PRO C C -6.629 2.293 7.832 1.00 . A A . 19 PRO C 1 1 20 13486 1 1 19 PRO CA C -5.686 1.116 7.496 1.00 . A A . 19 PRO CA 1 1 20 13487 1 1 19 PRO CB C -5.816 0.711 6.030 1.00 . A A . 19 PRO CB 1 1 20 13488 1 1 19 PRO CD C -6.664 -1.123 7.368 1.00 . A A . 19 PRO CD 1 1 20 13489 1 1 19 PRO CG C -6.757 -0.452 6.018 1.00 . A A . 19 PRO CG 1 1 20 13490 1 1 19 PRO HA H -4.664 1.396 7.695 1.00 . A A . 19 PRO HA 1 1 20 13491 1 1 19 PRO HB2 H -6.223 1.531 5.453 1.00 . A A . 19 PRO HB2 1 1 20 13492 1 1 19 PRO HB3 H -4.858 0.414 5.635 1.00 . A A . 19 PRO HB3 1 1 20 13493 1 1 19 PRO HD2 H -7.651 -1.368 7.736 1.00 . A A . 19 PRO HD2 1 1 20 13494 1 1 19 PRO HD3 H -6.053 -2.009 7.309 1.00 . A A . 19 PRO HD3 1 1 20 13495 1 1 19 PRO HG2 H -7.765 -0.108 5.839 1.00 . A A . 19 PRO HG2 1 1 20 13496 1 1 19 PRO HG3 H -6.466 -1.150 5.248 1.00 . A A . 19 PRO HG3 1 1 20 13497 1 1 19 PRO N N -6.023 -0.124 8.233 1.00 . A A . 19 PRO N 1 1 20 13498 1 1 19 PRO O O -6.214 3.432 7.737 1.00 . A A . 19 PRO O 1 1 20 13499 1 1 20 PRO C C -8.421 3.754 9.877 1.00 . A A . 20 PRO C 1 1 20 13500 1 1 20 PRO CA C -8.793 3.131 8.531 1.00 . A A . 20 PRO CA 1 1 20 13501 1 1 20 PRO CB C -10.162 2.460 8.594 1.00 . A A . 20 PRO CB 1 1 20 13502 1 1 20 PRO CD C -8.513 0.708 8.374 1.00 . A A . 20 PRO CD 1 1 20 13503 1 1 20 PRO CG C -9.882 1.031 8.916 1.00 . A A . 20 PRO CG 1 1 20 13504 1 1 20 PRO HA H -8.781 3.874 7.750 1.00 . A A . 20 PRO HA 1 1 20 13505 1 1 20 PRO HB2 H -10.763 2.913 9.371 1.00 . A A . 20 PRO HB2 1 1 20 13506 1 1 20 PRO HB3 H -10.661 2.533 7.643 1.00 . A A . 20 PRO HB3 1 1 20 13507 1 1 20 PRO HD2 H -7.977 0.098 9.082 1.00 . A A . 20 PRO HD2 1 1 20 13508 1 1 20 PRO HD3 H -8.593 0.208 7.424 1.00 . A A . 20 PRO HD3 1 1 20 13509 1 1 20 PRO HG2 H -9.900 0.885 9.987 1.00 . A A . 20 PRO HG2 1 1 20 13510 1 1 20 PRO HG3 H -10.618 0.396 8.444 1.00 . A A . 20 PRO HG3 1 1 20 13511 1 1 20 PRO N N -7.865 2.019 8.208 1.00 . A A . 20 PRO N 1 1 20 13512 1 1 20 PRO O O -8.668 4.918 10.123 1.00 . A A . 20 PRO O 1 1 20 13513 1 1 21 PHE C C -5.986 4.054 12.015 1.00 . A A . 21 PHE C 1 1 20 13514 1 1 21 PHE CA C -7.426 3.534 12.075 1.00 . A A . 21 PHE CA 1 1 20 13515 1 1 21 PHE CB C -7.535 2.350 13.038 1.00 . A A . 21 PHE CB 1 1 20 13516 1 1 21 PHE CD1 C -10.033 2.324 12.694 1.00 . A A . 21 PHE CD1 1 1 20 13517 1 1 21 PHE CD2 C -8.829 0.221 12.645 1.00 . A A . 21 PHE CD2 1 1 20 13518 1 1 21 PHE CE1 C -11.233 1.643 12.460 1.00 . A A . 21 PHE CE1 1 1 20 13519 1 1 21 PHE CE2 C -10.028 -0.461 12.411 1.00 . A A . 21 PHE CE2 1 1 20 13520 1 1 21 PHE CG C -8.830 1.613 12.787 1.00 . A A . 21 PHE CG 1 1 20 13521 1 1 21 PHE CZ C -11.231 0.251 12.318 1.00 . A A . 21 PHE CZ 1 1 20 13522 1 1 21 PHE H H -7.631 2.053 10.524 1.00 . A A . 21 PHE H 1 1 20 13523 1 1 21 PHE HA H -8.100 4.320 12.377 1.00 . A A . 21 PHE HA 1 1 20 13524 1 1 21 PHE HB2 H -6.703 1.680 12.878 1.00 . A A . 21 PHE HB2 1 1 20 13525 1 1 21 PHE HB3 H -7.518 2.710 14.056 1.00 . A A . 21 PHE HB3 1 1 20 13526 1 1 21 PHE HD1 H -10.035 3.399 12.804 1.00 . A A . 21 PHE HD1 1 1 20 13527 1 1 21 PHE HD2 H -7.901 -0.328 12.716 1.00 . A A . 21 PHE HD2 1 1 20 13528 1 1 21 PHE HE1 H -12.160 2.192 12.387 1.00 . A A . 21 PHE HE1 1 1 20 13529 1 1 21 PHE HE2 H -10.026 -1.535 12.299 1.00 . A A . 21 PHE HE2 1 1 20 13530 1 1 21 PHE HZ H -12.157 -0.276 12.139 1.00 . A A . 21 PHE HZ 1 1 20 13531 1 1 21 PHE N N -7.823 2.988 10.746 1.00 . A A . 21 PHE N 1 1 20 13532 1 1 21 PHE O O -5.435 4.506 12.999 1.00 . A A . 21 PHE O 1 1 20 13533 1 1 22 VAL C C -3.822 5.235 9.394 1.00 . A A . 22 VAL C 1 1 20 13534 1 1 22 VAL CA C -3.975 4.479 10.720 1.00 . A A . 22 VAL CA 1 1 20 13535 1 1 22 VAL CB C -3.118 3.215 10.718 1.00 . A A . 22 VAL CB 1 1 20 13536 1 1 22 VAL CG1 C -3.442 2.360 11.947 1.00 . A A . 22 VAL CG1 1 1 20 13537 1 1 22 VAL CG2 C -3.408 2.408 9.451 1.00 . A A . 22 VAL CG2 1 1 20 13538 1 1 22 VAL H H -5.843 3.624 10.083 1.00 . A A . 22 VAL H 1 1 20 13539 1 1 22 VAL HA H -3.705 5.110 11.552 1.00 . A A . 22 VAL HA 1 1 20 13540 1 1 22 VAL HB H -2.077 3.494 10.737 1.00 . A A . 22 VAL HB 1 1 20 13541 1 1 22 VAL HG11 H -4.017 1.497 11.645 1.00 . A A . 22 VAL HG11 1 1 20 13542 1 1 22 VAL HG12 H -4.015 2.944 12.652 1.00 . A A . 22 VAL HG12 1 1 20 13543 1 1 22 VAL HG13 H -2.523 2.035 12.412 1.00 . A A . 22 VAL HG13 1 1 20 13544 1 1 22 VAL HG21 H -2.945 2.890 8.603 1.00 . A A . 22 VAL HG21 1 1 20 13545 1 1 22 VAL HG22 H -4.475 2.354 9.296 1.00 . A A . 22 VAL HG22 1 1 20 13546 1 1 22 VAL HG23 H -3.010 1.411 9.560 1.00 . A A . 22 VAL HG23 1 1 20 13547 1 1 22 VAL N N -5.377 3.992 10.861 1.00 . A A . 22 VAL N 1 1 20 13548 1 1 22 VAL O O -4.778 5.416 8.666 1.00 . A A . 22 VAL O 1 1 20 13549 1 1 23 GLN C C -1.109 6.081 7.122 1.00 . A A . 23 GLN C 1 1 20 13550 1 1 23 GLN CA C -2.458 6.420 7.783 1.00 . A A . 23 GLN CA 1 1 20 13551 1 1 23 GLN CB C -2.551 7.909 8.168 1.00 . A A . 23 GLN CB 1 1 20 13552 1 1 23 GLN CD C -1.252 9.923 8.895 1.00 . A A . 23 GLN CD 1 1 20 13553 1 1 23 GLN CG C -1.159 8.558 8.208 1.00 . A A . 23 GLN CG 1 1 20 13554 1 1 23 GLN H H -1.871 5.529 9.664 1.00 . A A . 23 GLN H 1 1 20 13555 1 1 23 GLN HA H -3.262 6.174 7.109 1.00 . A A . 23 GLN HA 1 1 20 13556 1 1 23 GLN HB2 H -3.160 8.425 7.440 1.00 . A A . 23 GLN HB2 1 1 20 13557 1 1 23 GLN HB3 H -3.010 7.996 9.141 1.00 . A A . 23 GLN HB3 1 1 20 13558 1 1 23 GLN HE21 H -2.326 9.241 10.420 1.00 . A A . 23 GLN HE21 1 1 20 13559 1 1 23 GLN HE22 H -1.967 10.900 10.469 1.00 . A A . 23 GLN HE22 1 1 20 13560 1 1 23 GLN HG2 H -0.480 7.922 8.757 1.00 . A A . 23 GLN HG2 1 1 20 13561 1 1 23 GLN HG3 H -0.794 8.689 7.199 1.00 . A A . 23 GLN HG3 1 1 20 13562 1 1 23 GLN N N -2.635 5.679 9.069 1.00 . A A . 23 GLN N 1 1 20 13563 1 1 23 GLN NE2 N -1.902 10.030 10.021 1.00 . A A . 23 GLN NE2 1 1 20 13564 1 1 23 GLN O O -0.774 6.613 6.083 1.00 . A A . 23 GLN O 1 1 20 13565 1 1 23 GLN OE1 O -0.728 10.901 8.400 1.00 . A A . 23 GLN OE1 1 1 20 13566 1 1 24 CYS C C 0.806 3.611 6.189 1.00 . A A . 24 CYS C 1 1 20 13567 1 1 24 CYS CA C 0.973 4.856 7.079 1.00 . A A . 24 CYS CA 1 1 20 13568 1 1 24 CYS CB C 1.934 4.639 8.273 1.00 . A A . 24 CYS CB 1 1 20 13569 1 1 24 CYS H H -0.614 4.776 8.538 1.00 . A A . 24 CYS H 1 1 20 13570 1 1 24 CYS HA H 1.323 5.684 6.479 1.00 . A A . 24 CYS HA 1 1 20 13571 1 1 24 CYS HB2 H 2.752 5.339 8.198 1.00 . A A . 24 CYS HB2 1 1 20 13572 1 1 24 CYS HB3 H 1.399 4.826 9.192 1.00 . A A . 24 CYS HB3 1 1 20 13573 1 1 24 CYS N N -0.336 5.204 7.703 1.00 . A A . 24 CYS N 1 1 20 13574 1 1 24 CYS O O -0.253 3.016 6.131 1.00 . A A . 24 CYS O 1 1 20 13575 1 1 24 CYS SG S 2.611 2.954 8.308 1.00 . A A . 24 CYS SG 1 1 20 13576 1 1 25 GLY C C 3.098 1.353 4.506 1.00 . A A . 25 GLY C 1 1 20 13577 1 1 25 GLY CA C 1.739 2.044 4.585 1.00 . A A . 25 GLY CA 1 1 20 13578 1 1 25 GLY H H 2.675 3.734 5.539 1.00 . A A . 25 GLY H 1 1 20 13579 1 1 25 GLY HA2 H 1.005 1.353 4.976 1.00 . A A . 25 GLY HA2 1 1 20 13580 1 1 25 GLY HA3 H 1.444 2.361 3.599 1.00 . A A . 25 GLY HA3 1 1 20 13581 1 1 25 GLY N N 1.836 3.230 5.486 1.00 . A A . 25 GLY N 1 1 20 13582 1 1 25 GLY O O 4.041 1.755 5.153 1.00 . A A . 25 GLY O 1 1 20 13583 1 1 26 TRP C C 5.361 0.242 2.516 1.00 . A A . 26 TRP C 1 1 20 13584 1 1 26 TRP CA C 4.516 -0.395 3.620 1.00 . A A . 26 TRP CA 1 1 20 13585 1 1 26 TRP CB C 4.154 -1.835 3.248 1.00 . A A . 26 TRP CB 1 1 20 13586 1 1 26 TRP CD1 C 6.115 -3.315 2.631 1.00 . A A . 26 TRP CD1 1 1 20 13587 1 1 26 TRP CD2 C 5.795 -3.156 4.847 1.00 . A A . 26 TRP CD2 1 1 20 13588 1 1 26 TRP CE2 C 6.909 -4.005 4.664 1.00 . A A . 26 TRP CE2 1 1 20 13589 1 1 26 TRP CE3 C 5.374 -2.885 6.152 1.00 . A A . 26 TRP CE3 1 1 20 13590 1 1 26 TRP CG C 5.309 -2.733 3.549 1.00 . A A . 26 TRP CG 1 1 20 13591 1 1 26 TRP CH2 C 7.148 -4.279 7.050 1.00 . A A . 26 TRP CH2 1 1 20 13592 1 1 26 TRP CZ2 C 7.583 -4.564 5.751 1.00 . A A . 26 TRP CZ2 1 1 20 13593 1 1 26 TRP CZ3 C 6.049 -3.444 7.249 1.00 . A A . 26 TRP CZ3 1 1 20 13594 1 1 26 TRP H H 2.436 0.001 3.211 1.00 . A A . 26 TRP H 1 1 20 13595 1 1 26 TRP HA H 5.039 -0.373 4.562 1.00 . A A . 26 TRP HA 1 1 20 13596 1 1 26 TRP HB2 H 3.296 -2.149 3.823 1.00 . A A . 26 TRP HB2 1 1 20 13597 1 1 26 TRP HB3 H 3.919 -1.888 2.197 1.00 . A A . 26 TRP HB3 1 1 20 13598 1 1 26 TRP HD1 H 6.029 -3.208 1.559 1.00 . A A . 26 TRP HD1 1 1 20 13599 1 1 26 TRP HE1 H 7.773 -4.598 2.862 1.00 . A A . 26 TRP HE1 1 1 20 13600 1 1 26 TRP HE3 H 4.526 -2.241 6.310 1.00 . A A . 26 TRP HE3 1 1 20 13601 1 1 26 TRP HH2 H 7.659 -4.696 7.901 1.00 . A A . 26 TRP HH2 1 1 20 13602 1 1 26 TRP HZ2 H 8.433 -5.209 5.591 1.00 . A A . 26 TRP HZ2 1 1 20 13603 1 1 26 TRP HZ3 H 5.721 -3.233 8.253 1.00 . A A . 26 TRP HZ3 1 1 20 13604 1 1 26 TRP N N 3.209 0.314 3.726 1.00 . A A . 26 TRP N 1 1 20 13605 1 1 26 TRP NE1 N 7.068 -4.073 3.293 1.00 . A A . 26 TRP NE1 1 1 20 13606 1 1 26 TRP O O 4.871 0.550 1.448 1.00 . A A . 26 TRP O 1 1 20 13607 1 1 27 CYS C C 8.820 0.361 1.585 1.00 . A A . 27 CYS C 1 1 20 13608 1 1 27 CYS CA C 7.481 1.093 1.727 1.00 . A A . 27 CYS CA 1 1 20 13609 1 1 27 CYS CB C 7.700 2.519 2.231 1.00 . A A . 27 CYS CB 1 1 20 13610 1 1 27 CYS H H 7.005 0.215 3.639 1.00 . A A . 27 CYS H 1 1 20 13611 1 1 27 CYS HA H 6.964 1.118 0.781 1.00 . A A . 27 CYS HA 1 1 20 13612 1 1 27 CYS HB2 H 6.786 2.886 2.674 1.00 . A A . 27 CYS HB2 1 1 20 13613 1 1 27 CYS HB3 H 8.485 2.522 2.973 1.00 . A A . 27 CYS HB3 1 1 20 13614 1 1 27 CYS N N 6.625 0.458 2.769 1.00 . A A . 27 CYS N 1 1 20 13615 1 1 27 CYS O O 9.755 0.590 2.327 1.00 . A A . 27 CYS O 1 1 20 13616 1 1 27 CYS SG S 8.172 3.593 0.850 1.00 . A A . 27 CYS SG 1 1 20 13617 1 1 28 HIS C C 10.672 -2.122 1.508 1.00 . A A . 28 HIS C 1 1 20 13618 1 1 28 HIS CA C 10.191 -1.237 0.337 1.00 . A A . 28 HIS CA 1 1 20 13619 1 1 28 HIS CB C 11.219 -0.140 0.059 1.00 . A A . 28 HIS CB 1 1 20 13620 1 1 28 HIS CD2 C 10.852 1.293 -2.112 1.00 . A A . 28 HIS CD2 1 1 20 13621 1 1 28 HIS CE1 C 11.568 -0.145 -3.565 1.00 . A A . 28 HIS CE1 1 1 20 13622 1 1 28 HIS CG C 11.231 0.176 -1.411 1.00 . A A . 28 HIS CG 1 1 20 13623 1 1 28 HIS H H 8.152 -0.629 0.009 1.00 . A A . 28 HIS H 1 1 20 13624 1 1 28 HIS HA H 10.080 -1.839 -0.549 1.00 . A A . 28 HIS HA 1 1 20 13625 1 1 28 HIS HB2 H 10.957 0.748 0.615 1.00 . A A . 28 HIS HB2 1 1 20 13626 1 1 28 HIS HB3 H 12.198 -0.478 0.362 1.00 . A A . 28 HIS HB3 1 1 20 13627 1 1 28 HIS HD1 H 12.026 -1.631 -2.181 1.00 . A A . 28 HIS HD1 1 1 20 13628 1 1 28 HIS HD2 H 10.447 2.194 -1.676 1.00 . A A . 28 HIS HD2 1 1 20 13629 1 1 28 HIS HE1 H 11.849 -0.618 -4.495 1.00 . A A . 28 HIS HE1 1 1 20 13630 1 1 28 HIS N N 8.919 -0.493 0.604 1.00 . A A . 28 HIS N 1 1 20 13631 1 1 28 HIS ND1 N 11.685 -0.729 -2.358 1.00 . A A . 28 HIS ND1 1 1 20 13632 1 1 28 HIS NE2 N 11.065 1.088 -3.472 1.00 . A A . 28 HIS NE2 1 1 20 13633 1 1 28 HIS O O 11.571 -2.917 1.325 1.00 . A A . 28 HIS O 1 1 20 13634 1 1 29 ASP C C 10.036 -2.522 5.167 1.00 . A A . 29 ASP C 1 1 20 13635 1 1 29 ASP CA C 10.610 -2.917 3.799 1.00 . A A . 29 ASP CA 1 1 20 13636 1 1 29 ASP CB C 12.135 -2.740 3.815 1.00 . A A . 29 ASP CB 1 1 20 13637 1 1 29 ASP CG C 12.496 -1.280 3.526 1.00 . A A . 29 ASP CG 1 1 20 13638 1 1 29 ASP H H 9.380 -1.404 2.857 1.00 . A A . 29 ASP H 1 1 20 13639 1 1 29 ASP HA H 10.372 -3.946 3.583 1.00 . A A . 29 ASP HA 1 1 20 13640 1 1 29 ASP HB2 H 12.514 -3.015 4.789 1.00 . A A . 29 ASP HB2 1 1 20 13641 1 1 29 ASP HB3 H 12.583 -3.376 3.067 1.00 . A A . 29 ASP HB3 1 1 20 13642 1 1 29 ASP N N 10.110 -2.031 2.694 1.00 . A A . 29 ASP N 1 1 20 13643 1 1 29 ASP O O 9.820 -3.364 6.015 1.00 . A A . 29 ASP O 1 1 20 13644 1 1 29 ASP OD1 O 12.124 -0.432 4.320 1.00 . A A . 29 ASP OD1 1 1 20 13645 1 1 29 ASP OD2 O 13.136 -1.037 2.516 1.00 . A A . 29 ASP OD2 1 1 20 13646 1 1 30 LYS C C 7.900 -0.224 6.640 1.00 . A A . 30 LYS C 1 1 20 13647 1 1 30 LYS CA C 9.288 -0.857 6.753 1.00 . A A . 30 LYS CA 1 1 20 13648 1 1 30 LYS CB C 10.293 0.168 7.283 1.00 . A A . 30 LYS CB 1 1 20 13649 1 1 30 LYS CD C 9.698 1.651 9.206 1.00 . A A . 30 LYS CD 1 1 20 13650 1 1 30 LYS CE C 9.630 1.753 10.731 1.00 . A A . 30 LYS CE 1 1 20 13651 1 1 30 LYS CG C 10.177 0.255 8.807 1.00 . A A . 30 LYS CG 1 1 20 13652 1 1 30 LYS H H 10.016 -0.581 4.735 1.00 . A A . 30 LYS H 1 1 20 13653 1 1 30 LYS HA H 9.258 -1.709 7.414 1.00 . A A . 30 LYS HA 1 1 20 13654 1 1 30 LYS HB2 H 11.294 -0.136 7.013 1.00 . A A . 30 LYS HB2 1 1 20 13655 1 1 30 LYS HB3 H 10.081 1.135 6.853 1.00 . A A . 30 LYS HB3 1 1 20 13656 1 1 30 LYS HD2 H 10.387 2.391 8.824 1.00 . A A . 30 LYS HD2 1 1 20 13657 1 1 30 LYS HD3 H 8.717 1.825 8.793 1.00 . A A . 30 LYS HD3 1 1 20 13658 1 1 30 LYS HE2 H 9.372 2.760 11.028 1.00 . A A . 30 LYS HE2 1 1 20 13659 1 1 30 LYS HE3 H 8.916 1.047 11.125 1.00 . A A . 30 LYS HE3 1 1 20 13660 1 1 30 LYS HG2 H 9.469 -0.483 9.157 1.00 . A A . 30 LYS HG2 1 1 20 13661 1 1 30 LYS HG3 H 11.143 0.068 9.252 1.00 . A A . 30 LYS HG3 1 1 20 13662 1 1 30 LYS HZ1 H 11.115 0.374 11.211 1.00 . A A . 30 LYS HZ1 1 1 20 13663 1 1 30 LYS HZ2 H 11.145 1.782 12.161 1.00 . A A . 30 LYS HZ2 1 1 20 13664 1 1 30 LYS HZ3 H 11.705 1.824 10.557 1.00 . A A . 30 LYS HZ3 1 1 20 13665 1 1 30 LYS N N 9.816 -1.259 5.413 1.00 . A A . 30 LYS N 1 1 20 13666 1 1 30 LYS NZ N 11.002 1.408 11.200 1.00 . A A . 30 LYS NZ 1 1 20 13667 1 1 30 LYS O O 7.486 0.215 5.585 1.00 . A A . 30 LYS O 1 1 20 13668 1 1 31 CYS C C 5.959 1.977 7.774 1.00 . A A . 31 CYS C 1 1 20 13669 1 1 31 CYS CA C 5.826 0.450 7.710 1.00 . A A . 31 CYS CA 1 1 20 13670 1 1 31 CYS CB C 5.140 -0.086 8.973 1.00 . A A . 31 CYS CB 1 1 20 13671 1 1 31 CYS H H 7.546 -0.519 8.572 1.00 . A A . 31 CYS H 1 1 20 13672 1 1 31 CYS HA H 5.281 0.147 6.830 1.00 . A A . 31 CYS HA 1 1 20 13673 1 1 31 CYS HB2 H 5.894 -0.428 9.668 1.00 . A A . 31 CYS HB2 1 1 20 13674 1 1 31 CYS HB3 H 4.560 0.697 9.428 1.00 . A A . 31 CYS HB3 1 1 20 13675 1 1 31 CYS N N 7.183 -0.165 7.733 1.00 . A A . 31 CYS N 1 1 20 13676 1 1 31 CYS O O 6.235 2.543 8.814 1.00 . A A . 31 CYS O 1 1 20 13677 1 1 31 CYS SG S 4.057 -1.473 8.551 1.00 . A A . 31 CYS SG 1 1 20 13678 1 1 32 VAL C C 5.015 4.736 5.559 1.00 . A A . 32 VAL C 1 1 20 13679 1 1 32 VAL CA C 5.894 4.134 6.660 1.00 . A A . 32 VAL CA 1 1 20 13680 1 1 32 VAL CB C 7.369 4.406 6.369 1.00 . A A . 32 VAL CB 1 1 20 13681 1 1 32 VAL CG1 C 8.243 3.551 7.291 1.00 . A A . 32 VAL CG1 1 1 20 13682 1 1 32 VAL CG2 C 7.668 4.054 4.909 1.00 . A A . 32 VAL CG2 1 1 20 13683 1 1 32 VAL H H 5.559 2.171 5.842 1.00 . A A . 32 VAL H 1 1 20 13684 1 1 32 VAL HA H 5.625 4.541 7.622 1.00 . A A . 32 VAL HA 1 1 20 13685 1 1 32 VAL HB H 7.583 5.451 6.541 1.00 . A A . 32 VAL HB 1 1 20 13686 1 1 32 VAL HG11 H 7.938 3.699 8.316 1.00 . A A . 32 VAL HG11 1 1 20 13687 1 1 32 VAL HG12 H 9.277 3.842 7.178 1.00 . A A . 32 VAL HG12 1 1 20 13688 1 1 32 VAL HG13 H 8.132 2.509 7.030 1.00 . A A . 32 VAL HG13 1 1 20 13689 1 1 32 VAL HG21 H 6.955 4.548 4.266 1.00 . A A . 32 VAL HG21 1 1 20 13690 1 1 32 VAL HG22 H 7.594 2.986 4.774 1.00 . A A . 32 VAL HG22 1 1 20 13691 1 1 32 VAL HG23 H 8.666 4.381 4.656 1.00 . A A . 32 VAL HG23 1 1 20 13692 1 1 32 VAL N N 5.770 2.646 6.668 1.00 . A A . 32 VAL N 1 1 20 13693 1 1 32 VAL O O 4.409 4.028 4.779 1.00 . A A . 32 VAL O 1 1 20 13694 1 1 33 ARG C C 4.951 7.645 3.599 1.00 . A A . 33 ARG C 1 1 20 13695 1 1 33 ARG CA C 4.103 6.682 4.438 1.00 . A A . 33 ARG CA 1 1 20 13696 1 1 33 ARG CB C 3.024 7.444 5.211 1.00 . A A . 33 ARG CB 1 1 20 13697 1 1 33 ARG CD C 1.052 8.852 4.614 1.00 . A A . 33 ARG CD 1 1 20 13698 1 1 33 ARG CG C 1.741 7.506 4.380 1.00 . A A . 33 ARG CG 1 1 20 13699 1 1 33 ARG CZ C 0.290 9.007 2.322 1.00 . A A . 33 ARG CZ 1 1 20 13700 1 1 33 ARG H H 5.438 6.590 6.127 1.00 . A A . 33 ARG H 1 1 20 13701 1 1 33 ARG HA H 3.647 5.935 3.809 1.00 . A A . 33 ARG HA 1 1 20 13702 1 1 33 ARG HB2 H 2.823 6.935 6.142 1.00 . A A . 33 ARG HB2 1 1 20 13703 1 1 33 ARG HB3 H 3.366 8.447 5.416 1.00 . A A . 33 ARG HB3 1 1 20 13704 1 1 33 ARG HD2 H 0.046 8.700 4.982 1.00 . A A . 33 ARG HD2 1 1 20 13705 1 1 33 ARG HD3 H 1.621 9.451 5.308 1.00 . A A . 33 ARG HD3 1 1 20 13706 1 1 33 ARG HE H 1.562 10.311 3.114 1.00 . A A . 33 ARG HE 1 1 20 13707 1 1 33 ARG HG2 H 1.984 7.401 3.332 1.00 . A A . 33 ARG HG2 1 1 20 13708 1 1 33 ARG HG3 H 1.079 6.707 4.677 1.00 . A A . 33 ARG HG3 1 1 20 13709 1 1 33 ARG HH11 H -1.435 9.666 3.098 1.00 . A A . 33 ARG HH11 1 1 20 13710 1 1 33 ARG HH12 H -1.570 8.779 1.616 1.00 . A A . 33 ARG HH12 1 1 20 13711 1 1 33 ARG HH21 H 1.842 8.231 1.325 1.00 . A A . 33 ARG HH21 1 1 20 13712 1 1 33 ARG HH22 H 0.285 7.967 0.611 1.00 . A A . 33 ARG HH22 1 1 20 13713 1 1 33 ARG N N 4.941 6.037 5.488 1.00 . A A . 33 ARG N 1 1 20 13714 1 1 33 ARG NE N 1.026 9.507 3.277 1.00 . A A . 33 ARG NE 1 1 20 13715 1 1 33 ARG NH1 N -1.006 9.163 2.348 1.00 . A A . 33 ARG NH1 1 1 20 13716 1 1 33 ARG NH2 N 0.850 8.351 1.343 1.00 . A A . 33 ARG NH2 1 1 20 13717 1 1 33 ARG O O 6.116 7.867 3.875 1.00 . A A . 33 ARG O 1 1 20 13718 1 1 34 SER C C 5.962 10.116 2.607 1.00 . A A . 34 SER C 1 1 20 13719 1 1 34 SER CA C 5.152 9.164 1.723 1.00 . A A . 34 SER CA 1 1 20 13720 1 1 34 SER CB C 4.098 9.936 0.928 1.00 . A A . 34 SER CB 1 1 20 13721 1 1 34 SER H H 3.440 8.025 2.369 1.00 . A A . 34 SER H 1 1 20 13722 1 1 34 SER HA H 5.801 8.625 1.052 1.00 . A A . 34 SER HA 1 1 20 13723 1 1 34 SER HB2 H 3.511 10.542 1.597 1.00 . A A . 34 SER HB2 1 1 20 13724 1 1 34 SER HB3 H 4.590 10.574 0.205 1.00 . A A . 34 SER HB3 1 1 20 13725 1 1 34 SER HG H 3.559 8.919 -0.640 1.00 . A A . 34 SER HG 1 1 20 13726 1 1 34 SER N N 4.378 8.218 2.575 1.00 . A A . 34 SER N 1 1 20 13727 1 1 34 SER O O 7.057 10.516 2.268 1.00 . A A . 34 SER O 1 1 20 13728 1 1 34 SER OG O 3.246 9.015 0.262 1.00 . A A . 34 SER OG 1 1 20 13729 1 1 35 GLU C C 7.614 10.937 4.816 1.00 . A A . 35 GLU C 1 1 20 13730 1 1 35 GLU CA C 6.163 11.398 4.655 1.00 . A A . 35 GLU CA 1 1 20 13731 1 1 35 GLU CB C 5.419 11.307 5.988 1.00 . A A . 35 GLU CB 1 1 20 13732 1 1 35 GLU CD C 6.385 12.076 8.160 1.00 . A A . 35 GLU CD 1 1 20 13733 1 1 35 GLU CG C 5.750 12.531 6.845 1.00 . A A . 35 GLU CG 1 1 20 13734 1 1 35 GLU H H 4.543 10.138 3.996 1.00 . A A . 35 GLU H 1 1 20 13735 1 1 35 GLU HA H 6.126 12.408 4.280 1.00 . A A . 35 GLU HA 1 1 20 13736 1 1 35 GLU HB2 H 4.354 11.274 5.804 1.00 . A A . 35 GLU HB2 1 1 20 13737 1 1 35 GLU HB3 H 5.721 10.412 6.509 1.00 . A A . 35 GLU HB3 1 1 20 13738 1 1 35 GLU HG2 H 6.441 13.167 6.311 1.00 . A A . 35 GLU HG2 1 1 20 13739 1 1 35 GLU HG3 H 4.844 13.078 7.055 1.00 . A A . 35 GLU HG3 1 1 20 13740 1 1 35 GLU N N 5.428 10.476 3.743 1.00 . A A . 35 GLU N 1 1 20 13741 1 1 35 GLU O O 8.537 11.723 4.740 1.00 . A A . 35 GLU O 1 1 20 13742 1 1 35 GLU OE1 O 5.741 11.331 8.881 1.00 . A A . 35 GLU OE1 1 1 20 13743 1 1 35 GLU OE2 O 7.505 12.483 8.426 1.00 . A A . 35 GLU OE2 1 1 20 13744 1 1 36 GLU C C 9.794 8.760 3.842 1.00 . A A . 36 GLU C 1 1 20 13745 1 1 36 GLU CA C 9.214 9.160 5.201 1.00 . A A . 36 GLU CA 1 1 20 13746 1 1 36 GLU CB C 9.087 7.939 6.113 1.00 . A A . 36 GLU CB 1 1 20 13747 1 1 36 GLU CD C 11.455 7.947 6.905 1.00 . A A . 36 GLU CD 1 1 20 13748 1 1 36 GLU CG C 10.406 7.165 6.113 1.00 . A A . 36 GLU CG 1 1 20 13749 1 1 36 GLU H H 7.065 9.047 5.094 1.00 . A A . 36 GLU H 1 1 20 13750 1 1 36 GLU HA H 9.835 9.907 5.670 1.00 . A A . 36 GLU HA 1 1 20 13751 1 1 36 GLU HB2 H 8.860 8.264 7.118 1.00 . A A . 36 GLU HB2 1 1 20 13752 1 1 36 GLU HB3 H 8.295 7.299 5.753 1.00 . A A . 36 GLU HB3 1 1 20 13753 1 1 36 GLU HG2 H 10.256 6.196 6.568 1.00 . A A . 36 GLU HG2 1 1 20 13754 1 1 36 GLU HG3 H 10.748 7.037 5.097 1.00 . A A . 36 GLU HG3 1 1 20 13755 1 1 36 GLU N N 7.823 9.667 5.037 1.00 . A A . 36 GLU N 1 1 20 13756 1 1 36 GLU O O 10.944 9.020 3.547 1.00 . A A . 36 GLU O 1 1 20 13757 1 1 36 GLU OE1 O 11.182 9.085 7.249 1.00 . A A . 36 GLU OE1 1 1 20 13758 1 1 36 GLU OE2 O 12.513 7.393 7.155 1.00 . A A . 36 GLU OE2 1 1 20 13759 1 1 37 CYS C C 9.428 8.893 0.692 1.00 . A A . 37 CYS C 1 1 20 13760 1 1 37 CYS CA C 9.521 7.720 1.672 1.00 . A A . 37 CYS CA 1 1 20 13761 1 1 37 CYS CB C 8.611 6.572 1.231 1.00 . A A . 37 CYS CB 1 1 20 13762 1 1 37 CYS H H 8.080 7.932 3.267 1.00 . A A . 37 CYS H 1 1 20 13763 1 1 37 CYS HA H 10.540 7.374 1.750 1.00 . A A . 37 CYS HA 1 1 20 13764 1 1 37 CYS HB2 H 7.649 6.668 1.714 1.00 . A A . 37 CYS HB2 1 1 20 13765 1 1 37 CYS HB3 H 8.478 6.609 0.159 1.00 . A A . 37 CYS HB3 1 1 20 13766 1 1 37 CYS N N 9.007 8.131 3.011 1.00 . A A . 37 CYS N 1 1 20 13767 1 1 37 CYS O O 8.370 9.450 0.473 1.00 . A A . 37 CYS O 1 1 20 13768 1 1 37 CYS SG S 9.366 4.991 1.692 1.00 . A A . 37 CYS SG 1 1 20 13769 1 1 38 LEU C C 10.495 9.902 -2.297 1.00 . A A . 38 LEU C 1 1 20 13770 1 1 38 LEU CA C 10.507 10.418 -0.857 1.00 . A A . 38 LEU CA 1 1 20 13771 1 1 38 LEU CB C 11.792 11.196 -0.581 1.00 . A A . 38 LEU CB 1 1 20 13772 1 1 38 LEU CD1 C 10.501 13.285 -1.030 1.00 . A A . 38 LEU CD1 1 1 20 13773 1 1 38 LEU CD2 C 10.745 12.441 1.308 1.00 . A A . 38 LEU CD2 1 1 20 13774 1 1 38 LEU CG C 11.440 12.583 -0.047 1.00 . A A . 38 LEU CG 1 1 20 13775 1 1 38 LEU H H 11.374 8.817 0.298 1.00 . A A . 38 LEU H 1 1 20 13776 1 1 38 LEU HA H 9.650 11.048 -0.674 1.00 . A A . 38 LEU HA 1 1 20 13777 1 1 38 LEU HB2 H 12.384 10.665 0.151 1.00 . A A . 38 LEU HB2 1 1 20 13778 1 1 38 LEU HB3 H 12.355 11.296 -1.496 1.00 . A A . 38 LEU HB3 1 1 20 13779 1 1 38 LEU HD11 H 9.611 13.607 -0.510 1.00 . A A . 38 LEU HD11 1 1 20 13780 1 1 38 LEU HD12 H 10.229 12.600 -1.820 1.00 . A A . 38 LEU HD12 1 1 20 13781 1 1 38 LEU HD13 H 11.001 14.144 -1.454 1.00 . A A . 38 LEU HD13 1 1 20 13782 1 1 38 LEU HD21 H 10.330 11.447 1.396 1.00 . A A . 38 LEU HD21 1 1 20 13783 1 1 38 LEU HD22 H 9.954 13.171 1.384 1.00 . A A . 38 LEU HD22 1 1 20 13784 1 1 38 LEU HD23 H 11.462 12.602 2.099 1.00 . A A . 38 LEU HD23 1 1 20 13785 1 1 38 LEU HG H 12.343 13.165 0.068 1.00 . A A . 38 LEU HG 1 1 20 13786 1 1 38 LEU N N 10.530 9.277 0.104 1.00 . A A . 38 LEU N 1 1 20 13787 1 1 38 LEU O O 10.446 10.666 -3.240 1.00 . A A . 38 LEU O 1 1 20 13788 1 1 39 SER C C 9.097 7.886 -4.360 1.00 . A A . 39 SER C 1 1 20 13789 1 1 39 SER CA C 10.533 8.054 -3.861 1.00 . A A . 39 SER CA 1 1 20 13790 1 1 39 SER CB C 11.219 6.692 -3.749 1.00 . A A . 39 SER CB 1 1 20 13791 1 1 39 SER H H 10.580 8.010 -1.705 1.00 . A A . 39 SER H 1 1 20 13792 1 1 39 SER HA H 11.091 8.693 -4.526 1.00 . A A . 39 SER HA 1 1 20 13793 1 1 39 SER HB2 H 10.754 6.111 -2.968 1.00 . A A . 39 SER HB2 1 1 20 13794 1 1 39 SER HB3 H 11.124 6.165 -4.690 1.00 . A A . 39 SER HB3 1 1 20 13795 1 1 39 SER HG H 12.874 7.708 -3.846 1.00 . A A . 39 SER HG 1 1 20 13796 1 1 39 SER N N 10.540 8.611 -2.477 1.00 . A A . 39 SER N 1 1 20 13797 1 1 39 SER O O 8.823 7.073 -5.220 1.00 . A A . 39 SER O 1 1 20 13798 1 1 39 SER OG O 12.592 6.886 -3.437 1.00 . A A . 39 SER OG 1 1 20 13799 1 1 40 GLY C C 6.400 7.028 -4.362 1.00 . A A . 40 GLY C 1 1 20 13800 1 1 40 GLY CA C 6.759 8.511 -4.274 1.00 . A A . 40 GLY CA 1 1 20 13801 1 1 40 GLY H H 8.411 9.290 -3.131 1.00 . A A . 40 GLY H 1 1 20 13802 1 1 40 GLY HA2 H 6.108 9.002 -3.563 1.00 . A A . 40 GLY HA2 1 1 20 13803 1 1 40 GLY HA3 H 6.643 8.965 -5.245 1.00 . A A . 40 GLY HA3 1 1 20 13804 1 1 40 GLY N N 8.175 8.642 -3.827 1.00 . A A . 40 GLY N 1 1 20 13805 1 1 40 GLY O O 5.534 6.628 -5.114 1.00 . A A . 40 GLY O 1 1 20 13806 1 1 41 THR C C 6.053 4.338 -2.341 1.00 . A A . 41 THR C 1 1 20 13807 1 1 41 THR CA C 6.784 4.750 -3.622 1.00 . A A . 41 THR CA 1 1 20 13808 1 1 41 THR CB C 8.165 4.096 -3.694 1.00 . A A . 41 THR CB 1 1 20 13809 1 1 41 THR CG2 C 8.029 2.579 -3.567 1.00 . A A . 41 THR CG2 1 1 20 13810 1 1 41 THR H H 7.761 6.560 -2.998 1.00 . A A . 41 THR H 1 1 20 13811 1 1 41 THR HA H 6.204 4.490 -4.493 1.00 . A A . 41 THR HA 1 1 20 13812 1 1 41 THR HB H 8.779 4.465 -2.887 1.00 . A A . 41 THR HB 1 1 20 13813 1 1 41 THR HG1 H 8.090 4.426 -5.610 1.00 . A A . 41 THR HG1 1 1 20 13814 1 1 41 THR HG21 H 6.995 2.325 -3.388 1.00 . A A . 41 THR HG21 1 1 20 13815 1 1 41 THR HG22 H 8.633 2.232 -2.742 1.00 . A A . 41 THR HG22 1 1 20 13816 1 1 41 THR HG23 H 8.363 2.111 -4.481 1.00 . A A . 41 THR HG23 1 1 20 13817 1 1 41 THR N N 7.068 6.211 -3.595 1.00 . A A . 41 THR N 1 1 20 13818 1 1 41 THR O O 6.608 4.371 -1.263 1.00 . A A . 41 THR O 1 1 20 13819 1 1 41 THR OG1 O 8.775 4.415 -4.937 1.00 . A A . 41 THR OG1 1 1 20 13820 1 1 42 TRP C C 3.128 2.370 -1.537 1.00 . A A . 42 TRP C 1 1 20 13821 1 1 42 TRP CA C 4.052 3.551 -1.229 1.00 . A A . 42 TRP CA 1 1 20 13822 1 1 42 TRP CB C 3.233 4.784 -0.841 1.00 . A A . 42 TRP CB 1 1 20 13823 1 1 42 TRP CD1 C 3.281 4.502 1.668 1.00 . A A . 42 TRP CD1 1 1 20 13824 1 1 42 TRP CD2 C 1.200 4.366 0.823 1.00 . A A . 42 TRP CD2 1 1 20 13825 1 1 42 TRP CE2 C 1.083 4.190 2.222 1.00 . A A . 42 TRP CE2 1 1 20 13826 1 1 42 TRP CE3 C 0.026 4.323 0.049 1.00 . A A . 42 TRP CE3 1 1 20 13827 1 1 42 TRP CG C 2.606 4.561 0.497 1.00 . A A . 42 TRP CG 1 1 20 13828 1 1 42 TRP CH2 C -1.311 3.940 2.048 1.00 . A A . 42 TRP CH2 1 1 20 13829 1 1 42 TRP CZ2 C -0.155 3.980 2.832 1.00 . A A . 42 TRP CZ2 1 1 20 13830 1 1 42 TRP CZ3 C -1.222 4.112 0.659 1.00 . A A . 42 TRP CZ3 1 1 20 13831 1 1 42 TRP H H 4.373 3.939 -3.326 1.00 . A A . 42 TRP H 1 1 20 13832 1 1 42 TRP HA H 4.733 3.298 -0.432 1.00 . A A . 42 TRP HA 1 1 20 13833 1 1 42 TRP HB2 H 3.879 5.648 -0.794 1.00 . A A . 42 TRP HB2 1 1 20 13834 1 1 42 TRP HB3 H 2.460 4.950 -1.577 1.00 . A A . 42 TRP HB3 1 1 20 13835 1 1 42 TRP HD1 H 4.349 4.609 1.784 1.00 . A A . 42 TRP HD1 1 1 20 13836 1 1 42 TRP HE1 H 2.611 4.194 3.642 1.00 . A A . 42 TRP HE1 1 1 20 13837 1 1 42 TRP HE3 H 0.084 4.455 -1.022 1.00 . A A . 42 TRP HE3 1 1 20 13838 1 1 42 TRP HH2 H -2.274 3.778 2.512 1.00 . A A . 42 TRP HH2 1 1 20 13839 1 1 42 TRP HZ2 H -0.220 3.848 3.902 1.00 . A A . 42 TRP HZ2 1 1 20 13840 1 1 42 TRP HZ3 H -2.117 4.082 0.056 1.00 . A A . 42 TRP HZ3 1 1 20 13841 1 1 42 TRP N N 4.809 3.956 -2.448 1.00 . A A . 42 TRP N 1 1 20 13842 1 1 42 TRP NE1 N 2.379 4.280 2.693 1.00 . A A . 42 TRP NE1 1 1 20 13843 1 1 42 TRP O O 2.219 2.470 -2.335 1.00 . A A . 42 TRP O 1 1 20 13844 1 1 43 THR C C 1.721 -0.293 0.132 1.00 . A A . 43 THR C 1 1 20 13845 1 1 43 THR CA C 2.485 0.065 -1.144 1.00 . A A . 43 THR CA 1 1 20 13846 1 1 43 THR CB C 3.450 -1.058 -1.527 1.00 . A A . 43 THR CB 1 1 20 13847 1 1 43 THR CG2 C 4.577 -1.141 -0.495 1.00 . A A . 43 THR CG2 1 1 20 13848 1 1 43 THR H H 4.089 1.198 -0.255 1.00 . A A . 43 THR H 1 1 20 13849 1 1 43 THR HA H 1.801 0.257 -1.954 1.00 . A A . 43 THR HA 1 1 20 13850 1 1 43 THR HB H 3.872 -0.856 -2.498 1.00 . A A . 43 THR HB 1 1 20 13851 1 1 43 THR HG1 H 3.393 -2.999 -1.637 1.00 . A A . 43 THR HG1 1 1 20 13852 1 1 43 THR HG21 H 4.153 -1.182 0.496 1.00 . A A . 43 THR HG21 1 1 20 13853 1 1 43 THR HG22 H 5.209 -0.269 -0.581 1.00 . A A . 43 THR HG22 1 1 20 13854 1 1 43 THR HG23 H 5.163 -2.031 -0.673 1.00 . A A . 43 THR HG23 1 1 20 13855 1 1 43 THR N N 3.353 1.254 -0.900 1.00 . A A . 43 THR N 1 1 20 13856 1 1 43 THR O O 2.286 -0.358 1.207 1.00 . A A . 43 THR O 1 1 20 13857 1 1 43 THR OG1 O 2.748 -2.292 -1.562 1.00 . A A . 43 THR OG1 1 1 20 13858 1 1 44 GLN C C -1.106 -2.186 1.027 1.00 . A A . 44 GLN C 1 1 20 13859 1 1 44 GLN CA C -0.350 -0.871 1.242 1.00 . A A . 44 GLN CA 1 1 20 13860 1 1 44 GLN CB C -1.332 0.287 1.423 1.00 . A A . 44 GLN CB 1 1 20 13861 1 1 44 GLN CD C -3.487 0.858 0.294 1.00 . A A . 44 GLN CD 1 1 20 13862 1 1 44 GLN CG C -1.991 0.617 0.082 1.00 . A A . 44 GLN CG 1 1 20 13863 1 1 44 GLN H H 0.002 -0.463 -0.846 1.00 . A A . 44 GLN H 1 1 20 13864 1 1 44 GLN HA H 0.294 -0.944 2.103 1.00 . A A . 44 GLN HA 1 1 20 13865 1 1 44 GLN HB2 H -2.091 0.004 2.139 1.00 . A A . 44 GLN HB2 1 1 20 13866 1 1 44 GLN HB3 H -0.801 1.155 1.785 1.00 . A A . 44 GLN HB3 1 1 20 13867 1 1 44 GLN HE21 H -3.268 1.448 2.177 1.00 . A A . 44 GLN HE21 1 1 20 13868 1 1 44 GLN HE22 H -4.864 1.445 1.600 1.00 . A A . 44 GLN HE22 1 1 20 13869 1 1 44 GLN HG2 H -1.537 1.506 -0.332 1.00 . A A . 44 GLN HG2 1 1 20 13870 1 1 44 GLN HG3 H -1.854 -0.207 -0.601 1.00 . A A . 44 GLN HG3 1 1 20 13871 1 1 44 GLN N N 0.442 -0.522 0.028 1.00 . A A . 44 GLN N 1 1 20 13872 1 1 44 GLN NE2 N -3.908 1.286 1.453 1.00 . A A . 44 GLN NE2 1 1 20 13873 1 1 44 GLN O O -2.214 -2.358 1.495 1.00 . A A . 44 GLN O 1 1 20 13874 1 1 44 GLN OE1 O -4.281 0.653 -0.603 1.00 . A A . 44 GLN OE1 1 1 20 13875 1 1 45 GLN C C -0.171 -5.504 -0.232 1.00 . A A . 45 GLN C 1 1 20 13876 1 1 45 GLN CA C -1.200 -4.418 0.090 1.00 . A A . 45 GLN CA 1 1 20 13877 1 1 45 GLN CB C -2.118 -4.172 -1.109 1.00 . A A . 45 GLN CB 1 1 20 13878 1 1 45 GLN CD C -3.568 -6.016 -1.972 1.00 . A A . 45 GLN CD 1 1 20 13879 1 1 45 GLN CG C -3.433 -4.926 -0.907 1.00 . A A . 45 GLN CG 1 1 20 13880 1 1 45 GLN H H 0.381 -2.958 -0.039 1.00 . A A . 45 GLN H 1 1 20 13881 1 1 45 GLN HA H -1.787 -4.696 0.950 1.00 . A A . 45 GLN HA 1 1 20 13882 1 1 45 GLN HB2 H -2.319 -3.113 -1.198 1.00 . A A . 45 GLN HB2 1 1 20 13883 1 1 45 GLN HB3 H -1.637 -4.525 -2.009 1.00 . A A . 45 GLN HB3 1 1 20 13884 1 1 45 GLN HE21 H -3.263 -4.771 -3.490 1.00 . A A . 45 GLN HE21 1 1 20 13885 1 1 45 GLN HE22 H -3.527 -6.391 -3.922 1.00 . A A . 45 GLN HE22 1 1 20 13886 1 1 45 GLN HG2 H -3.441 -5.378 0.075 1.00 . A A . 45 GLN HG2 1 1 20 13887 1 1 45 GLN HG3 H -4.259 -4.238 -0.992 1.00 . A A . 45 GLN HG3 1 1 20 13888 1 1 45 GLN N N -0.514 -3.115 0.327 1.00 . A A . 45 GLN N 1 1 20 13889 1 1 45 GLN NE2 N -3.443 -5.700 -3.232 1.00 . A A . 45 GLN NE2 1 1 20 13890 1 1 45 GLN O O 0.375 -5.555 -1.316 1.00 . A A . 45 GLN O 1 1 20 13891 1 1 45 GLN OE1 O -3.791 -7.167 -1.656 1.00 . A A . 45 GLN OE1 1 1 20 13892 1 1 46 ILE C C 0.732 -8.696 1.275 1.00 . A A . 46 ILE C 1 1 20 13893 1 1 46 ILE CA C 1.091 -7.458 0.454 1.00 . A A . 46 ILE CA 1 1 20 13894 1 1 46 ILE CB C 2.432 -6.888 0.918 1.00 . A A . 46 ILE CB 1 1 20 13895 1 1 46 ILE CD1 C 4.082 -5.049 0.529 1.00 . A A . 46 ILE CD1 1 1 20 13896 1 1 46 ILE CG1 C 2.634 -5.498 0.312 1.00 . A A . 46 ILE CG1 1 1 20 13897 1 1 46 ILE CG2 C 3.562 -7.811 0.462 1.00 . A A . 46 ILE CG2 1 1 20 13898 1 1 46 ILE H H -0.355 -6.314 1.570 1.00 . A A . 46 ILE H 1 1 20 13899 1 1 46 ILE HA H 1.135 -7.698 -0.596 1.00 . A A . 46 ILE HA 1 1 20 13900 1 1 46 ILE HB H 2.439 -6.818 1.996 1.00 . A A . 46 ILE HB 1 1 20 13901 1 1 46 ILE HD11 H 4.351 -5.189 1.565 1.00 . A A . 46 ILE HD11 1 1 20 13902 1 1 46 ILE HD12 H 4.177 -4.006 0.270 1.00 . A A . 46 ILE HD12 1 1 20 13903 1 1 46 ILE HD13 H 4.738 -5.635 -0.097 1.00 . A A . 46 ILE HD13 1 1 20 13904 1 1 46 ILE HG12 H 2.422 -5.534 -0.747 1.00 . A A . 46 ILE HG12 1 1 20 13905 1 1 46 ILE HG13 H 1.967 -4.797 0.789 1.00 . A A . 46 ILE HG13 1 1 20 13906 1 1 46 ILE HG21 H 4.237 -7.989 1.286 1.00 . A A . 46 ILE HG21 1 1 20 13907 1 1 46 ILE HG22 H 4.101 -7.346 -0.350 1.00 . A A . 46 ILE HG22 1 1 20 13908 1 1 46 ILE HG23 H 3.147 -8.750 0.128 1.00 . A A . 46 ILE HG23 1 1 20 13909 1 1 46 ILE N N 0.098 -6.373 0.703 1.00 . A A . 46 ILE N 1 1 20 13910 1 1 46 ILE O O 0.548 -9.775 0.747 1.00 . A A . 46 ILE O 1 1 20 13911 1 1 47 CYS C C -1.124 -9.558 3.995 1.00 . A A . 47 CYS C 1 1 20 13912 1 1 47 CYS CA C 0.291 -9.712 3.430 1.00 . A A . 47 CYS CA 1 1 20 13913 1 1 47 CYS CB C 1.322 -9.682 4.557 1.00 . A A . 47 CYS CB 1 1 20 13914 1 1 47 CYS H H 0.788 -7.668 2.969 1.00 . A A . 47 CYS H 1 1 20 13915 1 1 47 CYS HA H 0.377 -10.632 2.875 1.00 . A A . 47 CYS HA 1 1 20 13916 1 1 47 CYS HB2 H 1.195 -10.551 5.183 1.00 . A A . 47 CYS HB2 1 1 20 13917 1 1 47 CYS HB3 H 2.315 -9.683 4.134 1.00 . A A . 47 CYS HB3 1 1 20 13918 1 1 47 CYS N N 0.633 -8.547 2.567 1.00 . A A . 47 CYS N 1 1 20 13919 1 1 47 CYS O O -1.754 -8.531 3.844 1.00 . A A . 47 CYS O 1 1 20 13920 1 1 47 CYS SG S 1.090 -8.184 5.546 1.00 . A A . 47 CYS SG 1 1 20 13921 1 1 48 LEU C C -2.932 -9.997 6.673 1.00 . A A . 48 LEU C 1 1 20 13922 1 1 48 LEU CA C -2.997 -10.485 5.223 1.00 . A A . 48 LEU CA 1 1 20 13923 1 1 48 LEU CB C -3.545 -11.911 5.161 1.00 . A A . 48 LEU CB 1 1 20 13924 1 1 48 LEU CD1 C -4.160 -13.400 3.252 1.00 . A A . 48 LEU CD1 1 1 20 13925 1 1 48 LEU CD2 C -5.909 -12.009 4.367 1.00 . A A . 48 LEU CD2 1 1 20 13926 1 1 48 LEU CG C -4.443 -12.059 3.933 1.00 . A A . 48 LEU CG 1 1 20 13927 1 1 48 LEU H H -1.099 -11.391 4.759 1.00 . A A . 48 LEU H 1 1 20 13928 1 1 48 LEU HA H -3.613 -9.827 4.630 1.00 . A A . 48 LEU HA 1 1 20 13929 1 1 48 LEU HB2 H -2.722 -12.609 5.093 1.00 . A A . 48 LEU HB2 1 1 20 13930 1 1 48 LEU HB3 H -4.118 -12.117 6.052 1.00 . A A . 48 LEU HB3 1 1 20 13931 1 1 48 LEU HD11 H -3.449 -13.959 3.842 1.00 . A A . 48 LEU HD11 1 1 20 13932 1 1 48 LEU HD12 H -3.754 -13.225 2.267 1.00 . A A . 48 LEU HD12 1 1 20 13933 1 1 48 LEU HD13 H -5.080 -13.961 3.169 1.00 . A A . 48 LEU HD13 1 1 20 13934 1 1 48 LEU HD21 H -6.355 -11.089 4.019 1.00 . A A . 48 LEU HD21 1 1 20 13935 1 1 48 LEU HD22 H -5.967 -12.053 5.444 1.00 . A A . 48 LEU HD22 1 1 20 13936 1 1 48 LEU HD23 H -6.439 -12.849 3.943 1.00 . A A . 48 LEU HD23 1 1 20 13937 1 1 48 LEU HG H -4.242 -11.255 3.241 1.00 . A A . 48 LEU HG 1 1 20 13938 1 1 48 LEU N N -1.624 -10.572 4.648 1.00 . A A . 48 LEU N 1 1 20 13939 1 1 48 LEU O O -1.984 -9.304 7.003 1.00 . A A . 48 LEU O 1 1 20 13940 1 1 48 LEU OXT O -3.833 -10.325 7.428 1.00 . A A . 48 LEU OXT 1 1 stop_ save_
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