NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
585829 | 2mpi | 19979 | cing | 4-filtered-FRED | STAR | entry | full | 473 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2mpi # This FRED archive file contains, for PDB entry <2mpi>: # # - Coordinates and sequence information from the PDB mmCIF file # - NMR restraints from the PDB MR file # # In this file, the coordinates and NMR restraints share the same atom names, # and in this way can differ from the data deposited at the wwPDB. To achieve # this aim, the NMR restraints were parsed from their original format files, and # the coordinates and NMR restraints information were subsequently harmonized. # # Due to the complexity of this harmonization process and the filtering process # used in creating these files, the NMR restraints information in these files # may differ significantly from that in the originally deposited file. Other # modifications could have occurred to the NMR restraints information, or data # could have been lost because of parsing or conversion errors. The PDB file # remains the authoritative reference for the atomic coordinates and the # originally deposited restraints files remain the primary reference for these # data. # # This file is generated at the BioMagResBank (BMRB) in collaboration with the # PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and # the CMBI/IMM group at the Radboud University of Nijmegen. # # Several software packages were used to produce this file: # # - Wattos (BMRB and CMBI/IMM). # - FormatConverter and NMRStarExport (PDBe). # - CCPN framework (http://www.ccpn.ac.uk/). # # More information about this process can be found in the references below. # Please cite the original reference for this PDB entry. # # JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL # Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED # containing converted and filtered sets of experimental NMR restraints and # coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12. # # WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL # Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy: # development of a software pipeline. Proteins 59, 687-696. # # JF Doreleijers, WF Vranken, C Schulte, J Lin, JR Wedell, CJ Penkett, GW Vuister, # G Vriend, JL Markley, and EL Ulrich (2009). The NMR Restraints Grid at BMRB for # 5,266 Protein and Nucleic Acid PDB Entries. J Biomol. NMR 45, 389?396. save_Conversion_project_for_entry_Name_1 _Study_list.Sf_category study_list _Study_list.Entry_ID 1 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project for entry 1" NMR . 1 1 stop_ save_ save_originalConstraints_1 _Entry.PDB_coordinate_file_version . _Entry.Sf_category entry_information _Entry.ID 1 _Entry.Title "Data for entry 1" _Entry.NMR_STAR_version 3.1.0.8 _Entry.Experimental_method NMR _Entry.Details . save_ save_assembly_2mpi _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 2mpi _Assembly.Number_of_components 2 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all disulfide bound" _Assembly.Molecular_mass 5692.37 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 $insulin_chain_A A . 1 1 2 . 2 $insulin_chain_B B . 1 1 stop_ save_ save_insulin_chain_A _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "insulin chain A" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code GIVEQCCTSICSLYQLENYCN _Entity.Number_of_monomers 21 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 ILE . 1 1 3 VAL . 1 1 4 GLU . 1 1 5 GLN . 1 1 6 CYS . 1 1 7 CYS . 1 1 8 THR . 1 1 9 SER . 1 1 10 ILE . 1 1 11 CYS . 1 1 12 SER . 1 1 13 LEU . 1 1 14 TYR . 1 1 15 GLN . 1 1 16 LEU . 1 1 17 GLU . 1 1 18 ASN . 1 1 19 TYR . 1 1 20 CYS . 1 1 21 ASN . 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 ILE 2 2 1 1 VAL 3 3 1 1 GLU 4 4 1 1 GLN 5 5 1 1 CYS 6 6 1 1 CYS 7 7 1 1 THR 8 8 1 1 SER 9 9 1 1 ILE 10 10 1 1 CYS 11 11 1 1 SER 12 12 1 1 LEU 13 13 1 1 TYR 14 14 1 1 GLN 15 15 1 1 LEU 16 16 1 1 GLU 17 17 1 1 ASN 18 18 1 1 TYR 19 19 1 1 CYS 20 20 1 1 ASN 21 21 1 1 stop_ save_ save_insulin_chain_B _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 2 _Entity.Name "insulin chain B" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code FVNQHLCGSDLVEALYLVCGERGGFYTKPT _Entity.Number_of_monomers 30 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 PHE . 1 2 2 VAL . 1 2 3 ASN . 1 2 4 GLN . 1 2 5 HIS . 1 2 6 LEU . 1 2 7 CYS . 1 2 8 GLY . 1 2 9 SER . 1 2 10 ASP . 1 2 11 LEU . 1 2 12 VAL . 1 2 13 GLU . 1 2 14 ALA . 1 2 15 LEU . 1 2 16 TYR . 1 2 17 LEU . 1 2 18 VAL . 1 2 19 CYS . 1 2 20 GLY . 1 2 21 GLU . 1 2 22 ARG . 1 2 23 GLY . 1 2 24 GLY . 1 2 25 PHE . 1 2 26 TYR . 1 2 27 THR . 1 2 28 LYS . 1 2 29 PRO . 1 2 30 THR . 1 2 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 PHE 1 1 1 2 VAL 2 2 1 2 ASN 3 3 1 2 GLN 4 4 1 2 HIS 5 5 1 2 LEU 6 6 1 2 CYS 7 7 1 2 GLY 8 8 1 2 SER 9 9 1 2 ASP 10 10 1 2 LEU 11 11 1 2 VAL 12 12 1 2 GLU 13 13 1 2 ALA 14 14 1 2 LEU 15 15 1 2 TYR 16 16 1 2 LEU 17 17 1 2 VAL 18 18 1 2 CYS 19 19 1 2 GLY 20 20 1 2 GLU 21 21 1 2 ARG 22 22 1 2 GLY 23 23 1 2 GLY 24 24 1 2 PHE 25 25 1 2 TYR 26 26 1 2 THR 27 27 1 2 LYS 28 28 1 2 PRO 29 29 1 2 THR 30 30 1 2 stop_ save_ save_CNS/XPLOR_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 121 1 . . . 1 1 122 1 . . . 1 1 123 1 . . . 1 1 124 1 . . . 1 1 125 1 . . . 1 1 126 1 . . . 1 1 127 1 . . . 1 1 128 1 . . . 1 1 129 1 . . . 1 1 130 1 . . . 1 1 131 1 . . . 1 1 132 1 . . . 1 1 133 1 . . . 1 1 134 1 . . . 1 1 135 1 . . . 1 1 136 1 . . . 1 1 137 1 . . . 1 1 138 1 . . . 1 1 139 1 . . . 1 1 140 1 . . . 1 1 141 1 . . . 1 1 142 1 . . . 1 1 143 1 . . . 1 1 144 1 . . . 1 1 145 1 . . . 1 1 146 1 . . . 1 1 147 1 . . . 1 1 148 1 . . . 1 1 149 1 . . . 1 1 150 1 . . . 1 1 151 1 . . . 1 1 152 1 . . . 1 1 153 1 . . . 1 1 154 1 . . . 1 1 155 1 . . . 1 1 156 1 . . . 1 1 157 1 . . . 1 1 158 1 . . . 1 1 159 1 . . . 1 1 160 1 . . . 1 1 161 1 . . . 1 1 162 1 . . . 1 1 163 1 . . . 1 1 164 1 . . . 1 1 165 1 . . . 1 1 166 1 . . . 1 1 167 1 . . . 1 1 168 1 . . . 1 1 169 1 . . . 1 1 170 1 . . . 1 1 171 1 . . . 1 1 172 1 . . . 1 1 173 1 . . . 1 1 174 1 . . . 1 1 175 1 . . . 1 1 176 1 . . . 1 1 177 1 . . . 1 1 178 1 . . . 1 1 179 1 . . . 1 1 180 1 . . . 1 1 181 1 . . . 1 1 182 1 . . . 1 1 183 1 . . . 1 1 184 1 . . . 1 1 185 1 . . . 1 1 186 1 . . . 1 1 187 1 . . . 1 1 188 1 . . . 1 1 189 1 . . . 1 1 190 1 . . . 1 1 191 1 . . . 1 1 192 1 . . . 1 1 193 1 . . . 1 1 194 1 . . . 1 1 195 1 . . . 1 1 196 1 . . . 1 1 197 1 . . . 1 1 198 1 . . . 1 1 199 1 . . . 1 1 200 1 . . . 1 1 201 1 . . . 1 1 202 1 . . . 1 1 203 1 . . . 1 1 204 1 . . . 1 1 205 1 . . . 1 1 206 1 . . . 1 1 207 1 . . . 1 1 208 1 . . . 1 1 209 1 . . . 1 1 210 1 . . . 1 1 211 1 . . . 1 1 212 1 . . . 1 1 213 1 . . . 1 1 214 1 . . . 1 1 215 1 . . . 1 1 216 1 . . . 1 1 217 1 . . . 1 1 218 1 . . . 1 1 219 1 . . . 1 1 220 1 . . . 1 1 221 1 . . . 1 1 222 1 . . . 1 1 223 1 . . . 1 1 224 1 . . . 1 1 225 1 . . . 1 1 226 1 . . . 1 1 227 1 . . . 1 1 228 1 . . . 1 1 229 1 . . . 1 1 230 1 . . . 1 1 231 1 . . . 1 1 232 1 . . . 1 1 233 1 . . . 1 1 234 1 . . . 1 1 235 1 . . . 1 1 236 1 . . . 1 1 237 1 . . . 1 1 238 1 . . . 1 1 239 1 . . . 1 1 240 1 . . . 1 1 241 1 . . . 1 1 242 1 . . . 1 1 243 1 . . . 1 1 244 1 . . . 1 1 245 1 . . . 1 1 246 1 . . . 1 1 247 1 . . . 1 1 248 1 . . . 1 1 249 1 . . . 1 1 250 1 . . . 1 1 251 1 . . . 1 1 252 1 . . . 1 1 253 1 . . . 1 1 254 1 . . . 1 1 255 1 . . . 1 1 256 1 . . . 1 1 257 1 . . . 1 1 258 1 . . . 1 1 259 1 . . . 1 1 260 1 . . . 1 1 261 1 . . . 1 1 262 1 . . . 1 1 263 1 . . . 1 1 264 1 . . . 1 1 265 1 . . . 1 1 266 1 . . . 1 1 267 1 . . . 1 1 268 1 . . . 1 1 269 1 . . . 1 1 270 1 . . . 1 1 271 1 . . . 1 1 272 1 . . . 1 1 273 1 . . . 1 1 274 1 . . . 1 1 275 1 . . . 1 1 276 1 . . . 1 1 277 1 . . . 1 1 278 1 . . . 1 1 279 1 . . . 1 1 280 1 . . . 1 1 281 1 . . . 1 1 282 1 . . . 1 1 283 1 . . . 1 1 284 1 . . . 1 1 285 1 . . . 1 1 286 1 . . . 1 1 287 1 . . . 1 1 288 1 . . . 1 1 289 1 . . . 1 1 290 1 . . . 1 1 291 1 . . . 1 1 292 1 . . . 1 1 293 1 . . . 1 1 294 1 . . . 1 1 295 1 . . . 1 1 296 1 . . . 1 1 297 1 . . . 1 1 298 1 . . . 1 1 299 1 . . . 1 1 300 1 . . . 1 1 301 1 . . . 1 1 302 1 . . . 1 1 303 1 . . . 1 1 304 1 . . . 1 1 305 1 . . . 1 1 306 1 . . . 1 1 307 1 . . . 1 1 308 1 . . . 1 1 309 1 . . . 1 1 310 1 . . . 1 1 311 1 . . . 1 1 312 1 . . . 1 1 313 1 . . . 1 1 314 1 . . . 1 1 315 1 . . . 1 1 316 1 . . . 1 1 317 1 . . . 1 1 318 1 . . . 1 1 319 1 . . . 1 1 320 1 . . . 1 1 321 1 . . . 1 1 322 1 . . . 1 1 323 1 . . . 1 1 324 1 . . . 1 1 325 1 . . . 1 1 326 1 . . . 1 1 327 1 . . . 1 1 328 1 . . . 1 1 329 1 . . . 1 1 330 1 . . . 1 1 331 1 . . . 1 1 332 1 . . . 1 1 333 1 . . . 1 1 334 1 . . . 1 1 335 1 . . . 1 1 336 1 . . . 1 1 337 1 . . . 1 1 338 1 . . . 1 1 339 1 . . . 1 1 340 1 . . . 1 1 341 1 . . . 1 1 342 1 . . . 1 1 343 1 . . . 1 1 344 1 . . . 1 1 345 1 . . . 1 1 346 1 . . . 1 1 347 1 . . . 1 1 348 1 . . . 1 1 349 1 . . . 1 1 350 1 . . . 1 1 351 1 . . . 1 1 352 1 . . . 1 1 353 1 . . . 1 1 354 1 . . . 1 1 355 1 . . . 1 1 356 1 . . . 1 1 357 1 . . . 1 1 358 1 . . . 1 1 359 1 . . . 1 1 360 1 . . . 1 1 361 1 . . . 1 1 362 1 . . . 1 1 363 1 . . . 1 1 364 1 . . . 1 1 365 1 . . . 1 1 366 1 . . . 1 1 367 1 . . . 1 1 368 1 . . . 1 1 369 1 . . . 1 1 370 1 . . . 1 1 371 1 . . . 1 1 372 1 . . . 1 1 373 1 . . . 1 1 374 1 . . . 1 1 375 1 . . . 1 1 376 1 . . . 1 1 377 1 . . . 1 1 378 1 . . . 1 1 379 1 . . . 1 1 380 1 . . . 1 1 381 1 . . . 1 1 382 1 . . . 1 1 383 1 . . . 1 1 384 1 . . . 1 1 385 1 . . . 1 1 386 1 . . . 1 1 387 1 . . . 1 1 388 1 . . . 1 1 389 1 . . . 1 1 390 1 . . . 1 1 391 1 . . . 1 1 392 1 . . . 1 1 393 1 . . . 1 1 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 ILE HA . 2 . HA 1 1 1 1 2 1 1 5 GLN QB . 5 . HB* 1 1 2 1 1 1 1 2 ILE MG . 2 . HG2* 1 1 2 1 2 1 1 3 VAL HA . 3 . HA 1 1 3 1 1 1 1 3 VAL HA . 3 . HA 1 1 3 1 2 1 1 7 CYS QB . 7 . HB* 1 1 4 1 1 1 1 3 VAL HA . 3 . HA 1 1 4 1 2 2 2 11 LEU MD1 . 32 . HD1* 1 1 5 1 1 1 1 3 VAL HA . 3 . HA 1 1 5 1 2 2 2 11 LEU MD2 . 32 . HD2* 1 1 6 1 1 1 1 2 ILE MG . 2 . HG2* 1 1 6 1 2 1 1 3 VAL H . 3 . HN 1 1 7 1 1 1 1 3 VAL MG1 . 3 . HG1* 1 1 7 1 2 1 1 4 GLU HA . 4 . HA 1 1 8 1 1 1 1 3 VAL MG2 . 3 . HG2* 1 1 8 1 2 1 1 4 GLU HA . 4 . HA 1 1 9 1 1 1 1 6 CYS HA . 6 . HA 1 1 9 1 2 1 1 7 CYS QB . 7 . HB* 1 1 10 1 1 1 1 6 CYS HA . 6 . HA 1 1 10 1 2 1 1 11 CYS QB . 11 . HB* 1 1 11 1 1 1 1 6 CYS HB3 . 6 . HB1 1 1 11 1 2 1 1 16 LEU HG . 16 . HG 1 1 12 1 1 1 1 6 CYS HB3 . 6 . HB1 1 1 12 1 2 2 2 6 LEU MD1 . 27 . HD1* 1 1 13 1 1 1 1 6 CYS HB3 . 6 . HB1 1 1 13 1 2 2 2 6 LEU MD2 . 27 . HD2* 1 1 14 1 1 1 1 6 CYS HB2 . 6 . HB2 1 1 14 1 2 1 1 16 LEU HG . 16 . HG 1 1 15 1 1 1 1 6 CYS HB2 . 6 . HB2 1 1 15 1 2 2 2 6 LEU MD1 . 27 . HD1* 1 1 16 1 1 1 1 6 CYS HB2 . 6 . HB2 1 1 16 1 2 2 2 6 LEU MD2 . 27 . HD2* 1 1 17 1 1 1 1 7 CYS HA . 7 . HA 1 1 17 1 2 2 2 5 HIS HB3 . 26 . HB1 1 1 18 1 1 1 1 7 CYS HA . 7 . HA 1 1 18 1 2 2 2 6 LEU MD1 . 27 . HD1* 1 1 19 1 1 1 1 7 CYS HA . 7 . HA 1 1 19 1 2 2 2 6 LEU MD2 . 27 . HD2* 1 1 20 1 1 1 1 3 VAL MG1 . 3 . HG1* 1 1 20 1 2 1 1 7 CYS QB . 7 . HB* 1 1 21 1 1 1 1 3 VAL MG2 . 3 . HG2* 1 1 21 1 2 1 1 7 CYS QB . 7 . HB* 1 1 22 1 1 1 1 7 CYS QB . 7 . HB* 1 1 22 1 2 1 1 8 THR MG . 8 . HG2* 1 1 23 1 1 1 1 7 CYS QB . 7 . HB* 1 1 23 1 2 2 2 6 LEU MD1 . 27 . HD1* 1 1 24 1 1 1 1 7 CYS QB . 7 . HB* 1 1 24 1 2 2 2 6 LEU MD2 . 27 . HD2* 1 1 25 1 1 1 1 7 CYS QB . 7 . HB* 1 1 25 1 2 2 2 11 LEU MD1 . 32 . HD1* 1 1 26 1 1 1 1 7 CYS QB . 7 . HB* 1 1 26 1 2 2 2 11 LEU MD2 . 32 . HD2* 1 1 27 1 1 1 1 11 CYS QB . 11 . HB* 1 1 27 1 2 1 1 15 GLN HB3 . 15 . HB1 1 1 28 1 1 1 1 11 CYS QB . 11 . HB* 1 1 28 1 2 1 1 15 GLN HB2 . 15 . HB2 1 1 29 1 1 1 1 11 CYS QB . 11 . HB* 1 1 29 1 2 1 1 15 GLN QG . 15 . HG* 1 1 30 1 1 1 1 11 CYS QB . 11 . HB* 1 1 30 1 2 2 2 6 LEU MD1 . 27 . HD1* 1 1 31 1 1 1 1 11 CYS QB . 11 . HB* 1 1 31 1 2 2 2 6 LEU MD2 . 27 . HD2* 1 1 32 1 1 1 1 10 ILE MG . 10 . HG2* 1 1 32 1 2 1 1 12 SER HA . 12 . HA 1 1 33 1 1 1 1 12 SER HA . 12 . HA 1 1 33 1 2 1 1 13 LEU QB . 13 . HB* 1 1 34 1 1 1 1 12 SER HA . 12 . HA 1 1 34 1 2 2 2 2 VAL MG1 . 23 . HG1* 1 1 35 1 1 1 1 12 SER HA . 12 . HA 1 1 35 1 2 2 2 2 VAL MG2 . 23 . HG2* 1 1 36 1 1 1 1 13 LEU HA . 13 . HA 1 1 36 1 2 1 1 16 LEU HB3 . 16 . HB1 1 1 37 1 1 1 1 13 LEU HA . 13 . HA 1 1 37 1 2 1 1 16 LEU HB2 . 16 . HB2 1 1 38 1 1 1 1 13 LEU HG . 13 . HG 1 1 38 1 2 2 2 18 VAL MG1 . 39 . HG1* 1 1 39 1 1 1 1 13 LEU HG . 13 . HG 1 1 39 1 2 2 2 18 VAL MG2 . 39 . HG2* 1 1 40 1 1 1 1 13 LEU QB . 13 . HB* 1 1 40 1 2 1 1 14 TYR HA . 14 . HA 1 1 41 1 1 1 1 14 TYR HA . 14 . HA 1 1 41 1 2 1 1 17 GLU HB3 . 17 . HB1 1 1 42 1 1 1 1 14 TYR HA . 14 . HA 1 1 42 1 2 1 1 17 GLU HB2 . 17 . HB2 1 1 43 1 1 1 1 14 TYR HA . 14 . HA 1 1 43 1 2 1 1 17 GLU QG . 17 . HG* 1 1 44 1 1 1 1 15 GLN HA . 15 . HA 1 1 44 1 2 1 1 18 ASN QB . 18 . HB* 1 1 45 1 1 1 1 14 TYR QB . 14 . HB* 1 1 45 1 2 1 1 15 GLN H . 15 . HN 1 1 46 1 1 1 1 15 GLN H . 15 . HN 1 1 46 1 2 1 1 16 LEU H . 16 . HN 1 1 47 1 1 1 1 15 GLN HA . 15 . HA 1 1 47 1 2 1 1 16 LEU H . 16 . HN 1 1 48 1 1 1 1 15 GLN HB3 . 15 . HB1 1 1 48 1 2 1 1 16 LEU H . 16 . HN 1 1 49 1 1 1 1 15 GLN HB2 . 15 . HB2 1 1 49 1 2 1 1 16 LEU H . 16 . HN 1 1 50 1 1 1 1 16 LEU MD1 . 16 . HD1* 1 1 50 1 2 1 1 17 GLU H . 17 . HN 1 1 51 1 1 1 1 16 LEU MD2 . 16 . HD2* 1 1 51 1 2 1 1 17 GLU H . 17 . HN 1 1 52 1 1 1 1 16 LEU H . 16 . HN 1 1 52 1 2 1 1 17 GLU H . 17 . HN 1 1 53 1 1 1 1 2 ILE MD . 2 . HD1* 1 1 53 1 2 1 1 19 TYR HA . 19 . HA 1 1 54 1 1 1 1 2 ILE MD . 2 . HD1* 1 1 54 1 2 1 1 19 TYR HB3 . 19 . HB1 1 1 55 1 1 1 1 19 TYR HB3 . 19 . HB1 1 1 55 1 2 2 2 15 LEU QD . 36 . HD1* 1 1 56 1 1 1 1 2 ILE MD . 2 . HD1* 1 1 56 1 2 1 1 19 TYR HB2 . 19 . HB2 1 1 57 1 1 1 1 19 TYR HB2 . 19 . HB2 1 1 57 1 2 2 2 15 LEU QD . 36 . HD1* 1 1 58 1 1 1 1 2 ILE MD . 2 . HD1* 1 1 58 1 2 1 1 19 TYR QD . 19 . HD* 1 1 59 1 1 1 1 16 LEU HA . 16 . HA 1 1 59 1 2 1 1 19 TYR QD . 19 . HD* 1 1 60 1 1 1 1 19 TYR QD . 19 . HD* 1 1 60 1 2 2 2 15 LEU QD . 36 . HD1* 1 1 61 1 1 1 1 2 ILE HA . 2 . HA 1 1 61 1 2 1 1 19 TYR QE . 19 . HE* 1 1 62 1 1 1 1 2 ILE MD . 2 . HD1* 1 1 62 1 2 1 1 19 TYR QE . 19 . HE* 1 1 63 1 1 1 1 2 ILE MG . 2 . HG2* 1 1 63 1 2 1 1 19 TYR QE . 19 . HE* 1 1 64 1 1 1 1 16 LEU MD1 . 16 . HD1* 1 1 64 1 2 1 1 19 TYR QE . 19 . HE* 1 1 65 1 1 1 1 16 LEU MD2 . 16 . HD2* 1 1 65 1 2 1 1 19 TYR QE . 19 . HE* 1 1 66 1 1 1 1 19 TYR QE . 19 . HE* 1 1 66 1 2 2 2 15 LEU QD . 36 . HD1* 1 1 67 1 1 1 1 18 ASN HA . 18 . HA 1 1 67 1 2 1 1 19 TYR H . 19 . HN 1 1 68 1 1 1 1 18 ASN QB . 18 . HB* 1 1 68 1 2 1 1 19 TYR H . 19 . HN 1 1 69 1 1 1 1 19 TYR H . 19 . HN 1 1 69 1 2 1 1 20 CYS H . 20 . HN 1 1 70 1 1 1 1 20 CYS HA . 20 . HA 1 1 70 1 2 2 2 19 CYS HB3 . 40 . HB1 1 1 71 1 1 1 1 20 CYS HA . 20 . HA 1 1 71 1 2 2 2 19 CYS HB2 . 40 . HB2 1 1 72 1 1 1 1 19 TYR HA . 19 . HA 1 1 72 1 2 1 1 20 CYS H . 20 . HN 1 1 73 1 1 1 1 20 CYS HA . 20 . HA 1 1 73 1 2 1 1 21 ASN H . 21 . HN 1 1 74 1 1 1 1 20 CYS HB3 . 20 . HB1 1 1 74 1 2 1 1 21 ASN H . 21 . HN 1 1 75 1 1 1 1 20 CYS HB2 . 20 . HB2 1 1 75 1 2 1 1 21 ASN H . 21 . HN 1 1 76 1 1 1 1 13 LEU QD . 13 . HD1* 1 1 76 1 2 2 2 1 PHE QD . 22 . HD* 1 1 77 1 1 1 1 13 LEU QD . 13 . HD1* 1 1 77 1 2 2 2 1 PHE QE . 22 . HE* 1 1 78 1 1 1 1 10 ILE MD . 10 . HD1* 1 1 78 1 2 2 2 3 ASN HA . 24 . HA 1 1 79 1 1 1 1 10 ILE MG . 10 . HG2* 1 1 79 1 2 2 2 3 ASN HA . 24 . HA 1 1 80 1 1 1 1 10 ILE MD . 10 . HD1* 1 1 80 1 2 2 2 5 HIS HA . 26 . HA 1 1 81 1 1 2 2 5 HIS HB3 . 26 . HB1 1 1 81 1 2 2 2 6 LEU QB . 27 . HB* 1 1 82 1 1 2 2 5 HIS HB2 . 26 . HB2 1 1 82 1 2 2 2 6 LEU QB . 27 . HB* 1 1 83 1 1 1 1 10 ILE MD . 10 . HD1* 1 1 83 1 2 2 2 5 HIS HD2 . 26 . HD2 1 1 84 1 1 2 2 6 LEU HA . 27 . HA 1 1 84 1 2 2 2 10 ASP HB3 . 31 . HB1 1 1 85 1 1 2 2 6 LEU HA . 27 . HA 1 1 85 1 2 2 2 10 ASP HB2 . 31 . HB2 1 1 86 1 1 1 1 7 CYS QB . 7 . HB* 1 1 86 1 2 2 2 7 CYS HA . 28 . HA 1 1 87 1 1 2 2 6 LEU MD2 . 27 . HD2* 1 1 87 1 2 2 2 7 CYS HA . 28 . HA 1 1 88 1 1 2 2 7 CYS HA . 28 . HA 1 1 88 1 2 2 2 11 LEU QB . 32 . HB* 1 1 89 1 1 2 2 7 CYS HA . 28 . HA 1 1 89 1 2 2 2 11 LEU MD1 . 32 . HD1* 1 1 90 1 1 2 2 7 CYS HA . 28 . HA 1 1 90 1 2 2 2 11 LEU MD2 . 32 . HD2* 1 1 91 1 1 2 2 6 LEU HA . 27 . HA 1 1 91 1 2 2 2 7 CYS H . 28 . HN 1 1 92 1 1 2 2 9 SER HA . 30 . HA 1 1 92 1 2 2 2 12 VAL HB . 33 . HB 1 1 93 1 1 2 2 9 SER HA . 30 . HA 1 1 93 1 2 2 2 12 VAL QG . 33 . HG1* 1 1 94 1 1 2 2 6 LEU MD2 . 27 . HD2* 1 1 94 1 2 2 2 10 ASP HA . 31 . HA 1 1 95 1 1 2 2 10 ASP HA . 31 . HA 1 1 95 1 2 2 2 13 GLU HB3 . 34 . HB1 1 1 96 1 1 2 2 10 ASP HA . 31 . HA 1 1 96 1 2 2 2 13 GLU HB2 . 34 . HB2 1 1 97 1 1 2 2 6 LEU MD1 . 27 . HD1* 1 1 97 1 2 2 2 10 ASP HB3 . 31 . HB1 1 1 98 1 1 2 2 6 LEU MD2 . 27 . HD2* 1 1 98 1 2 2 2 10 ASP HB3 . 31 . HB1 1 1 99 1 1 2 2 6 LEU MD1 . 27 . HD1* 1 1 99 1 2 2 2 10 ASP HB2 . 31 . HB2 1 1 100 1 1 2 2 6 LEU MD2 . 27 . HD2* 1 1 100 1 2 2 2 10 ASP HB2 . 31 . HB2 1 1 101 1 1 2 2 6 LEU QB . 27 . HB* 1 1 101 1 2 2 2 11 LEU HA . 32 . HA 1 1 102 1 1 2 2 6 LEU MD1 . 27 . HD1* 1 1 102 1 2 2 2 11 LEU HA . 32 . HA 1 1 103 1 1 2 2 6 LEU MD2 . 27 . HD2* 1 1 103 1 2 2 2 11 LEU HA . 32 . HA 1 1 104 1 1 2 2 11 LEU HA . 32 . HA 1 1 104 1 2 2 2 14 ALA MB . 35 . HB* 1 1 105 1 1 2 2 11 LEU HA . 32 . HA 1 1 105 1 2 2 2 15 LEU HB2 . 36 . HB2 1 1 106 1 1 2 2 6 LEU MD1 . 27 . HD1* 1 1 106 1 2 2 2 11 LEU HG . 32 . HG 1 1 107 1 1 2 2 6 LEU MD2 . 27 . HD2* 1 1 107 1 2 2 2 11 LEU HG . 32 . HG 1 1 108 1 1 2 2 11 LEU HG . 32 . HG 1 1 108 1 2 2 2 15 LEU QD . 36 . HD1* 1 1 109 1 1 2 2 12 VAL HA . 33 . HA 1 1 109 1 2 2 2 15 LEU QD . 36 . HD1* 1 1 110 1 1 2 2 12 VAL HA . 33 . HA 1 1 110 1 2 2 2 15 LEU HG . 36 . HG 1 1 111 1 1 2 2 11 LEU HA . 32 . HA 1 1 111 1 2 2 2 12 VAL H . 33 . HN 1 1 112 1 1 2 2 12 VAL H . 33 . HN 1 1 112 1 2 2 2 13 GLU H . 34 . HN 1 1 113 1 1 2 2 13 GLU HA . 34 . HA 1 1 113 1 2 2 2 16 TYR QB . 37 . HB* 1 1 114 1 1 2 2 10 ASP HA . 31 . HA 1 1 114 1 2 2 2 13 GLU H . 34 . HN 1 1 115 1 1 2 2 12 VAL HA . 33 . HA 1 1 115 1 2 2 2 13 GLU H . 34 . HN 1 1 116 1 1 2 2 12 VAL HB . 33 . HB 1 1 116 1 2 2 2 13 GLU H . 34 . HN 1 1 117 1 1 2 2 12 VAL QG . 33 . HG1* 1 1 117 1 2 2 2 13 GLU H . 34 . HN 1 1 118 1 1 2 2 13 GLU H . 34 . HN 1 1 118 1 2 2 2 14 ALA MB . 35 . HB* 1 1 119 1 1 2 2 13 GLU H . 34 . HN 1 1 119 1 2 2 2 14 ALA H . 35 . HN 1 1 120 1 1 2 2 14 ALA HA . 35 . HA 1 1 120 1 2 2 2 17 LEU HB3 . 38 . HB1 1 1 121 1 1 2 2 14 ALA HA . 35 . HA 1 1 121 1 2 2 2 17 LEU HB2 . 38 . HB2 1 1 122 1 1 2 2 13 GLU HB3 . 34 . HB1 1 1 122 1 2 2 2 14 ALA H . 35 . HN 1 1 123 1 1 2 2 13 GLU HB2 . 34 . HB2 1 1 123 1 2 2 2 14 ALA H . 35 . HN 1 1 124 1 1 2 2 14 ALA H . 35 . HN 1 1 124 1 2 2 2 15 LEU QD . 36 . HD2* 1 1 125 1 1 2 2 14 ALA H . 35 . HN 1 1 125 1 2 2 2 17 LEU H . 38 . HN 1 1 126 1 1 2 2 15 LEU HA . 36 . HA 1 1 126 1 2 2 2 18 VAL HB . 39 . HB 1 1 127 1 1 2 2 15 LEU HA . 36 . HA 1 1 127 1 2 2 2 18 VAL MG1 . 39 . HG1* 1 1 128 1 1 2 2 15 LEU HA . 36 . HA 1 1 128 1 2 2 2 18 VAL MG2 . 39 . HG2* 1 1 129 1 1 2 2 12 VAL HA . 33 . HA 1 1 129 1 2 2 2 15 LEU H . 36 . HN 1 1 130 1 1 2 2 14 ALA HA . 35 . HA 1 1 130 1 2 2 2 15 LEU H . 36 . HN 1 1 131 1 1 2 2 14 ALA MB . 35 . HB* 1 1 131 1 2 2 2 15 LEU H . 36 . HN 1 1 132 1 1 2 2 14 ALA H . 35 . HN 1 1 132 1 2 2 2 15 LEU H . 36 . HN 1 1 133 1 1 2 2 15 LEU H . 36 . HN 1 1 133 1 2 2 2 16 TYR H . 37 . HN 1 1 134 1 1 2 2 15 LEU H . 36 . HN 1 1 134 1 2 2 2 18 VAL MG1 . 39 . HG1* 1 1 135 1 1 2 2 15 LEU H . 36 . HN 1 1 135 1 2 2 2 18 VAL MG2 . 39 . HG2* 1 1 136 1 1 2 2 16 TYR HA . 37 . HA 1 1 136 1 2 2 2 19 CYS HB3 . 40 . HB1 1 1 137 1 1 2 2 16 TYR HA . 37 . HA 1 1 137 1 2 2 2 19 CYS HB2 . 40 . HB2 1 1 138 1 1 2 2 13 GLU HA . 34 . HA 1 1 138 1 2 2 2 16 TYR QD . 37 . HD* 1 1 139 1 1 2 2 16 TYR QD . 37 . HD* 1 1 139 1 2 2 2 17 LEU MD2 . 38 . HD2* 1 1 140 1 1 2 2 13 GLU HA . 34 . HA 1 1 140 1 2 2 2 16 TYR H . 37 . HN 1 1 141 1 1 2 2 15 LEU HA . 36 . HA 1 1 141 1 2 2 2 16 TYR H . 37 . HN 1 1 142 1 1 2 2 15 LEU HB3 . 36 . HB1 1 1 142 1 2 2 2 16 TYR H . 37 . HN 1 1 143 1 1 2 2 15 LEU HB2 . 36 . HB2 1 1 143 1 2 2 2 16 TYR H . 37 . HN 1 1 144 1 1 2 2 16 TYR H . 37 . HN 1 1 144 1 2 2 2 17 LEU MD2 . 38 . HD2* 1 1 145 1 1 2 2 16 TYR H . 37 . HN 1 1 145 1 2 2 2 17 LEU H . 38 . HN 1 1 146 1 1 2 2 16 TYR HA . 37 . HA 1 1 146 1 2 2 2 17 LEU H . 38 . HN 1 1 147 1 1 2 2 16 TYR QB . 37 . HB* 1 1 147 1 2 2 2 17 LEU H . 38 . HN 1 1 148 1 1 2 2 17 LEU H . 38 . HN 1 1 148 1 2 2 2 18 VAL H . 39 . HN 1 1 149 1 1 2 2 15 LEU HA . 36 . HA 1 1 149 1 2 2 2 18 VAL H . 39 . HN 1 1 150 1 1 2 2 17 LEU HA . 38 . HA 1 1 150 1 2 2 2 18 VAL H . 39 . HN 1 1 151 1 1 2 2 18 VAL H . 39 . HN 1 1 151 1 2 2 2 19 CYS H . 40 . HN 1 1 152 1 1 1 1 20 CYS HB3 . 20 . HB1 1 1 152 1 2 2 2 19 CYS HA . 40 . HA 1 1 153 1 1 1 1 20 CYS HB2 . 20 . HB2 1 1 153 1 2 2 2 19 CYS HA . 40 . HA 1 1 154 1 1 2 2 18 VAL MG2 . 39 . HG2* 1 1 154 1 2 2 2 19 CYS HA . 40 . HA 1 1 155 1 1 2 2 19 CYS HA . 40 . HA 1 1 155 1 2 2 2 22 ARG HB3 . 43 . HB1 1 1 156 1 1 2 2 19 CYS HA . 40 . HA 1 1 156 1 2 2 2 22 ARG HB2 . 43 . HB2 1 1 157 1 1 2 2 19 CYS HA . 40 . HA 1 1 157 1 2 2 2 22 ARG QD . 43 . HD* 1 1 158 1 1 2 2 19 CYS HA . 40 . HA 1 1 158 1 2 2 2 22 ARG QG . 43 . HG* 1 1 159 1 1 2 2 18 VAL HB . 39 . HB 1 1 159 1 2 2 2 19 CYS H . 40 . HN 1 1 160 1 1 2 2 18 VAL MG2 . 39 . HG2* 1 1 160 1 2 2 2 19 CYS H . 40 . HN 1 1 161 1 1 2 2 19 CYS H . 40 . HN 1 1 161 1 2 2 2 20 GLY QA . 41 . HA* 1 1 162 1 1 2 2 19 CYS H . 40 . HN 1 1 162 1 2 2 2 20 GLY H . 41 . HN 1 1 163 1 1 2 2 29 PRO HA . 50 . HA 1 1 163 1 2 2 2 30 THR H . 51 . HN 1 1 164 1 1 2 2 29 PRO HG2 . 50 . HG2 1 1 164 1 2 2 2 30 THR H . 51 . HN 1 1 165 1 1 1 1 1 GLY QA . 1 . HA* 1 1 165 1 2 1 1 2 ILE H . 2 . HN 1 1 166 1 1 1 1 2 ILE H . 2 . HN 1 1 166 1 2 1 1 3 VAL H . 3 . HN 1 1 167 1 1 1 1 2 ILE MD . 2 . HD1* 1 1 167 1 2 1 1 3 VAL H . 3 . HN 1 1 168 1 1 1 1 4 GLU HA . 4 . HA 1 1 168 1 2 1 1 8 THR HB . 8 . HB 1 1 169 1 1 1 1 3 VAL MG1 . 3 . HG1* 1 1 169 1 2 1 1 4 GLU QG . 4 . HG* 1 1 170 1 1 1 1 3 VAL MG2 . 3 . HG2* 1 1 170 1 2 1 1 4 GLU QG . 4 . HG* 1 1 171 1 1 1 1 3 VAL HA . 3 . HA 1 1 171 1 2 1 1 4 GLU H . 4 . HN 1 1 172 1 1 1 1 3 VAL HB . 3 . HB 1 1 172 1 2 1 1 4 GLU H . 4 . HN 1 1 173 1 1 1 1 3 VAL H . 3 . HN 1 1 173 1 2 1 1 4 GLU H . 4 . HN 1 1 174 1 1 1 1 4 GLU H . 4 . HN 1 1 174 1 2 1 1 5 GLN H . 5 . HN 1 1 175 1 1 1 1 4 GLU HA . 4 . HA 1 1 175 1 2 1 1 5 GLN H . 5 . HN 1 1 176 1 1 1 1 4 GLU QB . 4 . HB* 1 1 176 1 2 1 1 5 GLN H . 5 . HN 1 1 177 1 1 1 1 4 GLU QG . 4 . HG* 1 1 177 1 2 1 1 5 GLN H . 5 . HN 1 1 178 1 1 1 1 5 GLN HA . 5 . HA 1 1 178 1 2 1 1 6 CYS H . 6 . HN 1 1 179 1 1 1 1 5 GLN QB . 5 . HB* 1 1 179 1 2 1 1 6 CYS H . 6 . HN 1 1 180 1 1 1 1 3 VAL HA . 3 . HA 1 1 180 1 2 1 1 7 CYS H . 7 . HN 1 1 181 1 1 1 1 6 CYS HB3 . 6 . HB1 1 1 181 1 2 1 1 7 CYS H . 7 . HN 1 1 182 1 1 1 1 7 CYS H . 7 . HN 1 1 182 1 2 1 1 8 THR MG . 8 . HG2* 1 1 183 1 1 1 1 7 CYS H . 7 . HN 1 1 183 1 2 1 1 8 THR H . 8 . HN 1 1 184 1 1 1 1 4 GLU HA . 4 . HA 1 1 184 1 2 1 1 8 THR H . 8 . HN 1 1 185 1 1 1 1 7 CYS HA . 7 . HA 1 1 185 1 2 1 1 8 THR H . 8 . HN 1 1 186 1 1 1 1 9 SER HA . 9 . HA 1 1 186 1 2 1 1 10 ILE H . 10 . HN 1 1 187 1 1 1 1 11 CYS HA . 11 . HA 1 1 187 1 2 1 1 12 SER H . 12 . HN 1 1 188 1 1 1 1 11 CYS QB . 11 . HB* 1 1 188 1 2 1 1 12 SER H . 12 . HN 1 1 189 1 1 1 1 12 SER H . 12 . HN 1 1 189 1 2 1 1 15 GLN HB3 . 15 . HB1 1 1 190 1 1 1 1 12 SER H . 12 . HN 1 1 190 1 2 1 1 15 GLN HB2 . 15 . HB2 1 1 191 1 1 1 1 12 SER H . 12 . HN 1 1 191 1 2 1 1 15 GLN QG . 15 . HG* 1 1 192 1 1 1 1 12 SER HA . 12 . HA 1 1 192 1 2 1 1 13 LEU H . 13 . HN 1 1 193 1 1 1 1 12 SER HB3 . 12 . HB1 1 1 193 1 2 1 1 13 LEU H . 13 . HN 1 1 194 1 1 1 1 12 SER HB2 . 12 . HB2 1 1 194 1 2 1 1 13 LEU H . 13 . HN 1 1 195 1 1 1 1 13 LEU H . 13 . HN 1 1 195 1 2 1 1 14 TYR H . 14 . HN 1 1 196 1 1 1 1 13 LEU HA . 13 . HA 1 1 196 1 2 1 1 14 TYR H . 14 . HN 1 1 197 1 1 1 1 13 LEU QB . 13 . HB* 1 1 197 1 2 1 1 14 TYR H . 14 . HN 1 1 198 1 1 1 1 13 LEU QD . 13 . HD1* 1 1 198 1 2 1 1 14 TYR H . 14 . HN 1 1 199 1 1 1 1 12 SER HA . 12 . HA 1 1 199 1 2 1 1 15 GLN H . 15 . HN 1 1 200 1 1 1 1 12 SER HB3 . 12 . HB1 1 1 200 1 2 1 1 15 GLN H . 15 . HN 1 1 201 1 1 1 1 12 SER HB2 . 12 . HB2 1 1 201 1 2 1 1 15 GLN H . 15 . HN 1 1 202 1 1 1 1 14 TYR HA . 14 . HA 1 1 202 1 2 1 1 15 GLN H . 15 . HN 1 1 203 1 1 1 1 16 LEU HA . 16 . HA 1 1 203 1 2 2 2 15 LEU QD . 36 . HD1* 1 1 204 1 1 1 1 13 LEU HA . 13 . HA 1 1 204 1 2 1 1 16 LEU H . 16 . HN 1 1 205 1 1 1 1 13 LEU QB . 13 . HB* 1 1 205 1 2 1 1 16 LEU H . 16 . HN 1 1 206 1 1 1 1 13 LEU HA . 13 . HA 1 1 206 1 2 1 1 17 GLU H . 17 . HN 1 1 207 1 1 1 1 16 LEU HB3 . 16 . HB1 1 1 207 1 2 1 1 17 GLU H . 17 . HN 1 1 208 1 1 1 1 16 LEU HB2 . 16 . HB2 1 1 208 1 2 1 1 17 GLU H . 17 . HN 1 1 209 1 1 1 1 16 LEU HG . 16 . HG 1 1 209 1 2 1 1 17 GLU H . 17 . HN 1 1 210 1 1 1 1 17 GLU H . 17 . HN 1 1 210 1 2 1 1 18 ASN H . 18 . HN 1 1 211 1 1 1 1 14 TYR HA . 14 . HA 1 1 211 1 2 1 1 18 ASN H . 18 . HN 1 1 212 1 1 1 1 15 GLN HA . 15 . HA 1 1 212 1 2 1 1 18 ASN H . 18 . HN 1 1 213 1 1 1 1 17 GLU HB3 . 17 . HB1 1 1 213 1 2 1 1 18 ASN H . 18 . HN 1 1 214 1 1 1 1 17 GLU HB2 . 17 . HB2 1 1 214 1 2 1 1 18 ASN H . 18 . HN 1 1 215 1 1 1 1 18 ASN H . 18 . HN 1 1 215 1 2 1 1 19 TYR H . 19 . HN 1 1 216 1 1 1 1 2 ILE MG . 2 . HG2* 1 1 216 1 2 1 1 19 TYR HB3 . 19 . HB1 1 1 217 1 1 1 1 16 LEU HG . 16 . HG 1 1 217 1 2 1 1 19 TYR HB3 . 19 . HB1 1 1 218 1 1 1 1 2 ILE MG . 2 . HG2* 1 1 218 1 2 1 1 19 TYR HB2 . 19 . HB2 1 1 219 1 1 1 1 16 LEU HG . 16 . HG 1 1 219 1 2 1 1 19 TYR HB2 . 19 . HB2 1 1 220 1 1 1 1 2 ILE MG . 2 . HG2* 1 1 220 1 2 1 1 19 TYR QD . 19 . HD* 1 1 221 1 1 1 1 16 LEU MD1 . 16 . HD1* 1 1 221 1 2 1 1 19 TYR QD . 19 . HD* 1 1 222 1 1 1 1 16 LEU MD2 . 16 . HD2* 1 1 222 1 2 1 1 19 TYR QD . 19 . HD* 1 1 223 1 1 1 1 16 LEU HA . 16 . HA 1 1 223 1 2 1 1 19 TYR QE . 19 . HE* 1 1 224 1 1 1 1 19 TYR QE . 19 . HE* 1 1 224 1 2 2 2 15 LEU HA . 36 . HA 1 1 225 1 1 1 1 16 LEU HA . 16 . HA 1 1 225 1 2 1 1 19 TYR H . 19 . HN 1 1 226 1 1 1 1 20 CYS H . 20 . HN 1 1 226 1 2 1 1 21 ASN H . 21 . HN 1 1 227 1 1 2 2 1 PHE HA . 22 . HA 1 1 227 1 2 2 2 2 VAL MG1 . 23 . HG1* 1 1 228 1 1 2 2 1 PHE HA . 22 . HA 1 1 228 1 2 2 2 2 VAL MG2 . 23 . HG2* 1 1 229 1 1 1 1 13 LEU QD . 13 . HD1* 1 1 229 1 2 2 2 1 PHE QB . 22 . HB* 1 1 230 1 1 2 2 1 PHE QE . 22 . HE* 1 1 230 1 2 2 2 2 VAL H . 23 . HN 1 1 231 1 1 2 2 1 PHE HA . 22 . HA 1 1 231 1 2 2 2 2 VAL H . 23 . HN 1 1 232 1 1 2 2 1 PHE QB . 22 . HB* 1 1 232 1 2 2 2 2 VAL H . 23 . HN 1 1 233 1 1 2 2 2 VAL H . 23 . HN 1 1 233 1 2 2 2 3 ASN H . 24 . HN 1 1 234 1 1 1 1 10 ILE MG . 10 . HG2* 1 1 234 1 2 2 2 3 ASN QB . 24 . HB* 1 1 235 1 1 2 2 2 VAL MG1 . 23 . HG1* 1 1 235 1 2 2 2 3 ASN QB . 24 . HB* 1 1 236 1 1 2 2 2 VAL MG2 . 23 . HG2* 1 1 236 1 2 2 2 3 ASN QB . 24 . HB* 1 1 237 1 1 2 2 2 VAL HA . 23 . HA 1 1 237 1 2 2 2 3 ASN H . 24 . HN 1 1 238 1 1 2 2 2 VAL HB . 23 . HB 1 1 238 1 2 2 2 3 ASN H . 24 . HN 1 1 239 1 1 2 2 2 VAL MG1 . 23 . HG1* 1 1 239 1 2 2 2 3 ASN H . 24 . HN 1 1 240 1 1 2 2 2 VAL MG2 . 23 . HG2* 1 1 240 1 2 2 2 3 ASN H . 24 . HN 1 1 241 1 1 1 1 10 ILE MD . 10 . HD1* 1 1 241 1 2 2 2 4 GLN HA . 25 . HA 1 1 242 1 1 1 1 10 ILE MD . 10 . HD1* 1 1 242 1 2 2 2 4 GLN QB . 25 . HB* 1 1 243 1 1 1 1 10 ILE MD . 10 . HD1* 1 1 243 1 2 2 2 4 GLN H . 25 . HN 1 1 244 1 1 1 1 10 ILE MG . 10 . HG2* 1 1 244 1 2 2 2 4 GLN H . 25 . HN 1 1 245 1 1 2 2 3 ASN HA . 24 . HA 1 1 245 1 2 2 2 4 GLN H . 25 . HN 1 1 246 1 1 2 2 3 ASN QB . 24 . HB* 1 1 246 1 2 2 2 4 GLN H . 25 . HN 1 1 247 1 1 1 1 10 ILE MD . 10 . HD1* 1 1 247 1 2 2 2 5 HIS HE1 . 26 . HE1 1 1 248 1 1 1 1 10 ILE MG . 10 . HG2* 1 1 248 1 2 2 2 5 HIS HE1 . 26 . HE1 1 1 249 1 1 1 1 10 ILE MD . 10 . HD1* 1 1 249 1 2 2 2 5 HIS H . 26 . HN 1 1 250 1 1 1 1 10 ILE MG . 10 . HG2* 1 1 250 1 2 2 2 5 HIS H . 26 . HN 1 1 251 1 1 2 2 4 GLN HA . 25 . HA 1 1 251 1 2 2 2 5 HIS H . 26 . HN 1 1 252 1 1 2 2 4 GLN QB . 25 . HB* 1 1 252 1 2 2 2 5 HIS H . 26 . HN 1 1 253 1 1 2 2 4 GLN QG . 25 . HG* 1 1 253 1 2 2 2 5 HIS H . 26 . HN 1 1 254 1 1 1 1 7 CYS HA . 7 . HA 1 1 254 1 2 2 2 6 LEU H . 27 . HN 1 1 255 1 1 2 2 5 HIS HA . 26 . HA 1 1 255 1 2 2 2 6 LEU H . 27 . HN 1 1 256 1 1 2 2 7 CYS H . 28 . HN 1 1 256 1 2 2 2 10 ASP HB3 . 31 . HB1 1 1 257 1 1 2 2 7 CYS H . 28 . HN 1 1 257 1 2 2 2 10 ASP HB2 . 31 . HB2 1 1 258 1 1 2 2 7 CYS HA . 28 . HA 1 1 258 1 2 2 2 8 GLY H . 29 . HN 1 1 259 1 1 2 2 8 GLY QA . 29 . HA* 1 1 259 1 2 2 2 9 SER H . 30 . HN 1 1 260 1 1 2 2 9 SER HA . 30 . HA 1 1 260 1 2 2 2 10 ASP H . 31 . HN 1 1 261 1 1 2 2 10 ASP H . 31 . HN 1 1 261 1 2 2 2 13 GLU HB3 . 34 . HB1 1 1 262 1 1 2 2 10 ASP H . 31 . HN 1 1 262 1 2 2 2 13 GLU HB2 . 34 . HB2 1 1 263 1 1 2 2 12 VAL HA . 33 . HA 1 1 263 1 2 2 2 15 LEU HB3 . 36 . HB1 1 1 264 1 1 2 2 12 VAL HA . 33 . HA 1 1 264 1 2 2 2 15 LEU HB2 . 36 . HB2 1 1 265 1 1 2 2 9 SER HA . 30 . HA 1 1 265 1 2 2 2 12 VAL H . 33 . HN 1 1 266 1 1 2 2 9 SER QB . 30 . HB* 1 1 266 1 2 2 2 12 VAL H . 33 . HN 1 1 267 1 1 2 2 14 ALA HA . 35 . HA 1 1 267 1 2 2 2 17 LEU MD1 . 38 . HD1* 1 1 268 1 1 2 2 14 ALA HA . 35 . HA 1 1 268 1 2 2 2 17 LEU MD2 . 38 . HD2* 1 1 269 1 1 2 2 14 ALA MB . 35 . HB* 1 1 269 1 2 2 2 15 LEU QD . 36 . HD2* 1 1 270 1 1 2 2 14 ALA MB . 35 . HB* 1 1 270 1 2 2 2 17 LEU MD1 . 38 . HD1* 1 1 271 1 1 2 2 14 ALA MB . 35 . HB* 1 1 271 1 2 2 2 17 LEU MD2 . 38 . HD2* 1 1 272 1 1 2 2 11 LEU HA . 32 . HA 1 1 272 1 2 2 2 14 ALA H . 35 . HN 1 1 273 1 1 2 2 13 GLU HA . 34 . HA 1 1 273 1 2 2 2 14 ALA H . 35 . HN 1 1 274 1 1 2 2 13 GLU QG . 34 . HG* 1 1 274 1 2 2 2 14 ALA H . 35 . HN 1 1 275 1 1 2 2 14 ALA H . 35 . HN 1 1 275 1 2 2 2 17 LEU MD2 . 38 . HD2* 1 1 276 1 1 2 2 12 VAL QG . 33 . HG1* 1 1 276 1 2 2 2 16 TYR QB . 37 . HB* 1 1 277 1 1 2 2 16 TYR H . 37 . HN 1 1 277 1 2 2 2 18 VAL MG1 . 39 . HG1* 1 1 278 1 1 2 2 16 TYR H . 37 . HN 1 1 278 1 2 2 2 18 VAL MG2 . 39 . HG2* 1 1 279 1 1 2 2 14 ALA HA . 35 . HA 1 1 279 1 2 2 2 17 LEU H . 38 . HN 1 1 280 1 1 2 2 17 LEU HB3 . 38 . HB1 1 1 280 1 2 2 2 18 VAL H . 39 . HN 1 1 281 1 1 2 2 17 LEU HB2 . 38 . HB2 1 1 281 1 2 2 2 18 VAL H . 39 . HN 1 1 282 1 1 2 2 17 LEU MD1 . 38 . HD1* 1 1 282 1 2 2 2 18 VAL H . 39 . HN 1 1 283 1 1 2 2 17 LEU MD2 . 38 . HD2* 1 1 283 1 2 2 2 18 VAL H . 39 . HN 1 1 284 1 1 2 2 17 LEU HG . 38 . HG 1 1 284 1 2 2 2 18 VAL H . 39 . HN 1 1 285 1 1 2 2 16 TYR HA . 37 . HA 1 1 285 1 2 2 2 19 CYS H . 40 . HN 1 1 286 1 1 2 2 18 VAL HA . 39 . HA 1 1 286 1 2 2 2 19 CYS H . 40 . HN 1 1 287 1 1 2 2 17 LEU HA . 38 . HA 1 1 287 1 2 2 2 20 GLY H . 41 . HN 1 1 288 1 1 2 2 19 CYS HA . 40 . HA 1 1 288 1 2 2 2 20 GLY H . 41 . HN 1 1 289 1 1 2 2 19 CYS HB3 . 40 . HB1 1 1 289 1 2 2 2 20 GLY H . 41 . HN 1 1 290 1 1 2 2 19 CYS HB2 . 40 . HB2 1 1 290 1 2 2 2 20 GLY H . 41 . HN 1 1 291 1 1 2 2 20 GLY H . 41 . HN 1 1 291 1 2 2 2 21 GLU H . 42 . HN 1 1 292 1 1 2 2 20 GLY QA . 41 . HA* 1 1 292 1 2 2 2 21 GLU HA . 42 . HA 1 1 293 1 1 2 2 21 GLU HA . 42 . HA 1 1 293 1 2 2 2 22 ARG H . 43 . HN 1 1 294 1 1 2 2 21 GLU QB . 42 . HB* 1 1 294 1 2 2 2 22 ARG H . 43 . HN 1 1 295 1 1 2 2 21 GLU QG . 42 . HG* 1 1 295 1 2 2 2 22 ARG H . 43 . HN 1 1 296 1 1 2 2 21 GLU H . 42 . HN 1 1 296 1 2 2 2 22 ARG H . 43 . HN 1 1 297 1 1 2 2 22 ARG HA . 43 . HA 1 1 297 1 2 2 2 23 GLY H . 44 . HN 1 1 298 1 1 2 2 22 ARG HB3 . 43 . HB1 1 1 298 1 2 2 2 23 GLY H . 44 . HN 1 1 299 1 1 2 2 22 ARG HB2 . 43 . HB2 1 1 299 1 2 2 2 23 GLY H . 44 . HN 1 1 300 1 1 2 2 23 GLY QA . 44 . HA* 1 1 300 1 2 2 2 24 GLY H . 45 . HN 1 1 301 1 1 2 2 24 GLY QA . 45 . HA* 1 1 301 1 2 2 2 25 PHE H . 46 . HN 1 1 302 1 1 2 2 12 VAL QG . 33 . HG1* 1 1 302 1 2 2 2 26 TYR QE . 47 . HE* 1 1 303 1 1 2 2 12 VAL QG . 33 . HG1* 1 1 303 1 2 2 2 26 TYR QD . 47 . HD* 1 1 304 1 1 2 2 15 LEU QD . 36 . HD1* 1 1 304 1 2 2 2 26 TYR QD . 47 . HD* 1 1 305 1 1 2 2 25 PHE HA . 46 . HA 1 1 305 1 2 2 2 26 TYR H . 47 . HN 1 1 306 1 1 2 2 25 PHE QB . 46 . HB1 1 1 306 1 2 2 2 26 TYR H . 47 . HN 1 1 307 1 1 2 2 25 PHE QD . 46 . HD* 1 1 307 1 2 2 2 26 TYR H . 47 . HN 1 1 308 1 1 2 2 26 TYR H . 47 . HN 1 1 308 1 2 2 2 27 THR H . 48 . HN 1 1 309 1 1 2 2 26 TYR HA . 47 . HA 1 1 309 1 2 2 2 27 THR H . 48 . HN 1 1 310 1 1 2 2 26 TYR HB3 . 47 . HB1 1 1 310 1 2 2 2 27 THR H . 48 . HN 1 1 311 1 1 2 2 26 TYR HB2 . 47 . HB2 1 1 311 1 2 2 2 27 THR H . 48 . HN 1 1 312 1 1 2 2 26 TYR QD . 47 . HD* 1 1 312 1 2 2 2 27 THR H . 48 . HN 1 1 313 1 1 2 2 27 THR H . 48 . HN 1 1 313 1 2 2 2 28 LYS H . 49 . HN 1 1 314 1 1 2 2 28 LYS HA . 49 . HA 1 1 314 1 2 2 2 29 PRO QD . 50 . HD* 1 1 315 1 1 2 2 27 THR HA . 48 . HA 1 1 315 1 2 2 2 28 LYS H . 49 . HN 1 1 316 1 1 2 2 27 THR HB . 48 . HB 1 1 316 1 2 2 2 28 LYS H . 49 . HN 1 1 317 1 1 2 2 27 THR MG . 48 . HG2* 1 1 317 1 2 2 2 28 LYS H . 49 . HN 1 1 318 1 1 2 2 28 LYS H . 49 . HN 1 1 318 1 2 2 2 29 PRO QB . 50 . HB* 1 1 319 1 1 2 2 29 PRO QB . 50 . HB* 1 1 319 1 2 2 2 30 THR H . 51 . HN 1 1 320 1 1 1 1 3 VAL H . 3 . HN 1 1 320 1 2 1 1 3 VAL MG2 . 3 . HG2* 1 1 321 1 1 1 1 6 CYS H . 6 . HN 1 1 321 1 2 1 1 6 CYS HB3 . 6 . HB1 1 1 322 1 1 1 1 6 CYS H . 6 . HN 1 1 322 1 2 1 1 6 CYS HB2 . 6 . HB2 1 1 323 1 1 1 1 12 SER HA . 12 . HA 1 1 323 1 2 1 1 12 SER HB3 . 12 . HB1 1 1 324 1 1 1 1 12 SER HA . 12 . HA 1 1 324 1 2 1 1 12 SER HB2 . 12 . HB2 1 1 325 1 1 1 1 12 SER H . 12 . HN 1 1 325 1 2 1 1 12 SER HB3 . 12 . HB1 1 1 326 1 1 1 1 12 SER H . 12 . HN 1 1 326 1 2 1 1 12 SER HB2 . 12 . HB2 1 1 327 1 1 1 1 15 GLN H . 15 . HN 1 1 327 1 2 1 1 15 GLN HB3 . 15 . HB1 1 1 328 1 1 1 1 15 GLN H . 15 . HN 1 1 328 1 2 1 1 15 GLN HB2 . 15 . HB2 1 1 329 1 1 1 1 16 LEU H . 16 . HN 1 1 329 1 2 1 1 16 LEU HB3 . 16 . HB1 1 1 330 1 1 1 1 16 LEU H . 16 . HN 1 1 330 1 2 1 1 16 LEU HB2 . 16 . HB2 1 1 331 1 1 1 1 17 GLU H . 17 . HN 1 1 331 1 2 1 1 17 GLU HB3 . 17 . HB1 1 1 332 1 1 1 1 17 GLU H . 17 . HN 1 1 332 1 2 1 1 17 GLU HB2 . 17 . HB2 1 1 333 1 1 1 1 19 TYR H . 19 . HN 1 1 333 1 2 1 1 19 TYR HB3 . 19 . HB1 1 1 334 1 1 1 1 19 TYR H . 19 . HN 1 1 334 1 2 1 1 19 TYR HB2 . 19 . HB2 1 1 335 1 1 1 1 20 CYS H . 20 . HN 1 1 335 1 2 1 1 20 CYS HB3 . 20 . HB1 1 1 336 1 1 1 1 20 CYS H . 20 . HN 1 1 336 1 2 1 1 20 CYS HB2 . 20 . HB2 1 1 337 1 1 2 2 5 HIS H . 26 . HN 1 1 337 1 2 2 2 5 HIS HB3 . 26 . HB1 1 1 338 1 1 2 2 5 HIS H . 26 . HN 1 1 338 1 2 2 2 5 HIS HB2 . 26 . HB2 1 1 339 1 1 2 2 7 CYS H . 28 . HN 1 1 339 1 2 2 2 7 CYS HB3 . 28 . HB1 1 1 340 1 1 2 2 7 CYS H . 28 . HN 1 1 340 1 2 2 2 7 CYS HB2 . 28 . HB2 1 1 341 1 1 2 2 10 ASP H . 31 . HN 1 1 341 1 2 2 2 10 ASP HB3 . 31 . HB1 1 1 342 1 1 2 2 10 ASP H . 31 . HN 1 1 342 1 2 2 2 10 ASP HB2 . 31 . HB2 1 1 343 1 1 2 2 13 GLU H . 34 . HN 1 1 343 1 2 2 2 13 GLU HB3 . 34 . HB1 1 1 344 1 1 2 2 13 GLU H . 34 . HN 1 1 344 1 2 2 2 13 GLU HB2 . 34 . HB2 1 1 345 1 1 2 2 15 LEU H . 36 . HN 1 1 345 1 2 2 2 15 LEU HB3 . 36 . HB1 1 1 346 1 1 2 2 15 LEU H . 36 . HN 1 1 346 1 2 2 2 15 LEU HB2 . 36 . HB2 1 1 347 1 1 2 2 17 LEU H . 38 . HN 1 1 347 1 2 2 2 17 LEU HB3 . 38 . HB1 1 1 348 1 1 2 2 17 LEU H . 38 . HN 1 1 348 1 2 2 2 17 LEU HB2 . 38 . HB2 1 1 349 1 1 2 2 18 VAL H . 39 . HN 1 1 349 1 2 2 2 18 VAL MG2 . 39 . HG2* 1 1 350 1 1 2 2 19 CYS H . 40 . HN 1 1 350 1 2 2 2 19 CYS HB3 . 40 . HB1 1 1 351 1 1 2 2 19 CYS H . 40 . HN 1 1 351 1 2 2 2 19 CYS HB2 . 40 . HB2 1 1 352 1 1 2 2 22 ARG HA . 43 . HA 1 1 352 1 2 2 2 22 ARG HB2 . 43 . HB2 1 1 353 1 1 2 2 22 ARG H . 43 . HN 1 1 353 1 2 2 2 22 ARG HB3 . 43 . HB1 1 1 354 1 1 2 2 22 ARG H . 43 . HN 1 1 354 1 2 2 2 22 ARG HB2 . 43 . HB2 1 1 355 1 1 2 2 25 PHE HA . 46 . HA 1 1 355 1 2 2 2 25 PHE QB . 46 . HB1 1 1 356 1 1 2 2 25 PHE H . 46 . HN 1 1 356 1 2 2 2 25 PHE QB . 46 . HB1 1 1 357 1 1 2 2 26 TYR HA . 47 . HA 1 1 357 1 2 2 2 26 TYR HB2 . 47 . HB2 1 1 358 1 1 2 2 26 TYR H . 47 . HN 1 1 358 1 2 2 2 26 TYR HB3 . 47 . HB1 1 1 359 1 1 2 2 26 TYR H . 47 . HN 1 1 359 1 2 2 2 26 TYR HB2 . 47 . HB2 1 1 360 1 1 1 1 2 ILE HA . 2 . HA 1 1 360 1 2 1 1 2 ILE MD . 2 . HD1* 1 1 361 1 1 1 1 3 VAL HA . 3 . HA 1 1 361 1 2 1 1 3 VAL HB . 3 . HB 1 1 362 1 1 1 1 3 VAL H . 3 . HN 1 1 362 1 2 1 1 3 VAL HB . 3 . HB 1 1 363 1 1 1 1 10 ILE HA . 10 . HA 1 1 363 1 2 1 1 10 ILE MD . 10 . HD1* 1 1 364 1 1 1 1 14 TYR HA . 14 . HA 1 1 364 1 2 1 1 14 TYR QD . 14 . HD* 1 1 365 1 1 1 1 16 LEU HA . 16 . HA 1 1 365 1 2 1 1 16 LEU MD1 . 16 . HD1* 1 1 366 1 1 1 1 16 LEU HA . 16 . HA 1 1 366 1 2 1 1 16 LEU HG . 16 . HG 1 1 367 1 1 1 1 16 LEU H . 16 . HN 1 1 367 1 2 1 1 16 LEU MD1 . 16 . HD1* 1 1 368 1 1 1 1 16 LEU H . 16 . HN 1 1 368 1 2 1 1 16 LEU MD2 . 16 . HD2* 1 1 369 1 1 1 1 16 LEU H . 16 . HN 1 1 369 1 2 1 1 16 LEU HG . 16 . HG 1 1 370 1 1 1 1 19 TYR HA . 19 . HA 1 1 370 1 2 1 1 19 TYR QD . 19 . HD* 1 1 371 1 1 1 1 19 TYR HB3 . 19 . HB1 1 1 371 1 2 1 1 19 TYR QD . 19 . HD* 1 1 372 1 1 1 1 19 TYR HB2 . 19 . HB2 1 1 372 1 2 1 1 19 TYR QD . 19 . HD* 1 1 373 1 1 2 2 1 PHE HA . 22 . HA 1 1 373 1 2 2 2 1 PHE QE . 22 . HE* 1 1 374 1 1 2 2 6 LEU HA . 27 . HA 1 1 374 1 2 2 2 6 LEU HG . 27 . HG 1 1 375 1 1 2 2 11 LEU HA . 32 . HA 1 1 375 1 2 2 2 11 LEU MD1 . 32 . HD1* 1 1 376 1 1 2 2 11 LEU HA . 32 . HA 1 1 376 1 2 2 2 11 LEU HG . 32 . HG 1 1 377 1 1 2 2 12 VAL H . 33 . HN 1 1 377 1 2 2 2 12 VAL HB . 33 . HB 1 1 378 1 1 2 2 15 LEU HA . 36 . HA 1 1 378 1 2 2 2 15 LEU HG . 36 . HG 1 1 379 1 1 2 2 15 LEU H . 36 . HN 1 1 379 1 2 2 2 15 LEU HG . 36 . HG 1 1 380 1 1 2 2 16 TYR HA . 37 . HA 1 1 380 1 2 2 2 16 TYR QD . 37 . HD* 1 1 381 1 1 2 2 16 TYR H . 37 . HN 1 1 381 1 2 2 2 16 TYR QB . 37 . HB* 1 1 382 1 1 2 2 17 LEU HA . 38 . HA 1 1 382 1 2 2 2 17 LEU MD2 . 38 . HD2* 1 1 383 1 1 2 2 17 LEU HA . 38 . HA 1 1 383 1 2 2 2 17 LEU HG . 38 . HG 1 1 384 1 1 2 2 17 LEU H . 38 . HN 1 1 384 1 2 2 2 17 LEU HG . 38 . HG 1 1 385 1 1 2 2 18 VAL HA . 39 . HA 1 1 385 1 2 2 2 18 VAL HB . 39 . HB 1 1 386 1 1 2 2 18 VAL H . 39 . HN 1 1 386 1 2 2 2 18 VAL HB . 39 . HB 1 1 387 1 1 2 2 26 TYR HB3 . 47 . HB1 1 1 387 1 2 2 2 26 TYR QD . 47 . HD* 1 1 388 1 1 2 2 26 TYR HB2 . 47 . HB2 1 1 388 1 2 2 2 26 TYR QD . 47 . HD* 1 1 389 1 1 2 2 27 THR HA . 48 . HA 1 1 389 1 2 2 2 27 THR MG . 48 . HG2* 1 1 390 1 1 2 2 28 LYS HA . 49 . HA 1 1 390 1 2 2 2 28 LYS QD . 49 . HD* 1 1 391 1 1 2 2 29 PRO HA . 50 . HA 1 1 391 1 2 2 2 29 PRO QD . 50 . HD* 1 1 392 1 1 2 2 29 PRO HA . 50 . HA 1 1 392 1 2 2 2 29 PRO HG2 . 50 . HG2 1 1 393 1 1 2 2 30 THR H . 51 . HN 1 1 393 1 2 2 2 30 THR HB . 51 . HB 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 . . . . . 4.4 1.0 4.4 1 1 2 1 . . . . . 6.0 1.0 6.0 1 1 3 1 . . . . . 6.0 1.0 6.0 1 1 4 1 . . . . . 3.7 1.0 3.7 1 1 5 1 . . . . . 3.7 1.0 3.7 1 1 6 1 . . . . . 4.4 1.0 4.4 1 1 7 1 . . . . . 6.5 1.5 6.5 1 1 8 1 . . . . . 4.4 1.0 4.4 1 1 9 1 . . . . . 6.0 1.0 6.0 1 1 10 1 . . . . . 4.4 1.0 4.4 1 1 11 1 . . . . . 6.0 1.0 6.0 1 1 12 1 . . . . . 4.7 2.0 4.7 1 1 13 1 . . . . . 4.7 2.0 4.7 1 1 14 1 . . . . . 6.0 1.0 6.0 1 1 15 1 . . . . . 4.7 2.0 4.7 1 1 16 1 . . . . . 4.7 2.0 4.7 1 1 17 1 . . . . . 4.7 1.3 4.7 1 1 18 1 . . . . . 6.0 1.0 6.0 1 1 19 1 . . . . . 6.0 1.0 6.0 1 1 20 1 . . . . . 5.4 2.0 5.4 1 1 21 1 . . . . . 5.4 2.0 5.4 1 1 22 1 . . . . . 7.0 2.0 7.0 1 1 23 1 . . . . . 7.0 2.0 7.0 1 1 24 1 . . . . . 7.5 2.0 7.5 1 1 25 1 . . . . . 7.0 2.0 7.0 1 1 26 1 . . . . . 7.0 2.0 7.0 1 1 27 1 . . . . . 5.4 2.0 5.4 1 1 28 1 . . . . . 5.4 2.0 5.4 1 1 29 1 . . . . . 5.4 2.0 5.4 1 1 30 1 . . . . . 7.0 2.0 7.0 1 1 31 1 . . . . . 7.0 2.0 7.0 1 1 32 1 . . . . . 6.0 1.0 6.0 1 1 33 1 . . . . . 6.0 1.0 6.0 1 1 34 1 . . . . . 4.4 1.0 4.4 1 1 35 1 . . . . . 4.4 1.0 4.4 1 1 36 1 . . . . . 6.0 1.0 6.0 1 1 37 1 . . . . . 6.0 1.0 6.0 1 1 38 1 . . . . . 4.4 1.0 4.4 1 1 39 1 . . . . . 4.4 1.0 4.4 1 1 40 1 . . . . . 6.0 1.0 6.0 1 1 41 1 . . . . . 4.4 1.0 4.4 1 1 42 1 . . . . . 4.4 1.0 4.4 1 1 43 1 . . . . . 6.0 1.0 6.0 1 1 44 1 . . . . . 6.0 1.0 6.0 1 1 45 1 . . . . . 6.0 1.0 6.0 1 1 46 1 . . . . . 5.0 0.0 5.0 1 1 47 1 . . . . . 5.0 0.0 5.0 1 1 48 1 . . . . . 6.0 1.0 6.0 1 1 49 1 . . . . . 6.0 1.0 6.0 1 1 50 1 . . . . . 6.0 1.0 6.0 1 1 51 1 . . . . . 6.0 1.0 6.0 1 1 52 1 . . . . . 5.0 0.0 5.0 1 1 53 1 . . . . . 6.0 1.0 6.0 1 1 54 1 . . . . . 5.4 2.0 5.4 1 1 55 1 . . . . . 5.4 2.0 5.4 1 1 56 1 . . . . . 5.4 2.0 5.4 1 1 57 1 . . . . . 5.4 2.0 5.4 1 1 58 1 . . . . . 5.7 3.0 5.7 1 1 59 1 . . . . . 4.7 2.0 4.7 1 1 60 1 . . . . . 5.7 3.0 5.7 1 1 61 1 . . . . . 7.0 2.0 7.0 1 1 62 1 . . . . . 8.0 3.0 8.0 1 1 63 1 . . . . . 8.0 3.0 8.0 1 1 64 1 . . . . . 6.4 3.0 6.4 1 1 65 1 . . . . . 6.4 3.0 6.4 1 1 66 1 . . . . . 8.0 3.0 8.0 1 1 67 1 . . . . . 5.0 0.0 5.0 1 1 68 1 . . . . . 4.4 1.0 4.4 1 1 69 1 . . . . . 3.4 0.4 3.4 1 1 70 1 . . . . . 6.0 1.0 6.0 1 1 71 1 . . . . . 6.0 1.0 6.0 1 1 72 1 . . . . . 5.0 0.0 5.0 1 1 73 1 . . . . . 2.7 0.4 2.7 1 1 74 1 . . . . . 6.0 1.0 6.0 1 1 75 1 . . . . . 6.0 1.0 6.0 1 1 76 1 . . . . . 6.4 3.0 6.4 1 1 77 1 . . . . . 6.4 3.0 6.4 1 1 78 1 . . . . . 6.0 1.0 6.0 1 1 79 1 . . . . . 4.4 1.0 4.4 1 1 80 1 . . . . . 4.4 1.0 4.4 1 1 81 1 . . . . . 7.0 2.0 7.0 1 1 82 1 . . . . . 7.0 2.0 7.0 1 1 83 1 . . . . . 6.0 1.0 6.0 1 1 84 1 . . . . . 4.4 1.0 4.4 1 1 85 1 . . . . . 4.4 1.0 4.4 1 1 86 1 . . . . . 4.4 1.0 4.4 1 1 87 1 . . . . . 6.5 1.5 6.5 1 1 88 1 . . . . . 6.0 1.0 6.0 1 1 89 1 . . . . . 4.4 1.0 4.4 1 1 90 1 . . . . . 5.3 1.0 5.3 1 1 91 1 . . . . . 5.0 0.0 5.0 1 1 92 1 . . . . . 5.0 0.0 5.0 1 1 93 1 . . . . . 4.4 1.0 4.4 1 1 94 1 . . . . . 7.0 2.0 7.0 1 1 95 1 . . . . . 3.7 1.0 3.7 1 1 96 1 . . . . . 3.7 1.0 3.7 1 1 97 1 . . . . . 6.3 2.0 6.3 1 1 98 1 . . . . . 5.4 2.0 5.4 1 1 99 1 . . . . . 6.3 2.0 6.3 1 1 100 1 . . . . . 5.4 2.0 5.4 1 1 101 1 . . . . . 6.0 1.0 6.0 1 1 102 1 . . . . . 5.0 1.6 5.0 1 1 103 1 . . . . . 4.4 1.0 4.4 1 1 104 1 . . . . . 4.4 1.0 4.4 1 1 105 1 . . . . . 6.0 1.0 6.0 1 1 106 1 . . . . . 4.4 1.0 4.4 1 1 107 1 . . . . . 4.4 1.0 4.4 1 1 108 1 . . . . . 5.3 1.0 5.3 1 1 109 1 . . . . . . 1.6 5.0 1 1 110 1 . . . . . 5.0 0.0 5.0 1 1 111 1 . . . . . 5.0 0.0 5.0 1 1 112 1 . . . . . 3.4 0.4 3.4 1 1 113 1 . . . . . 3.7 1.0 3.7 1 1 114 1 . . . . . 5.0 0.0 5.0 1 1 115 1 . . . . . 5.0 0.0 5.0 1 1 116 1 . . . . . 5.0 2.0 5.0 1 1 117 1 . . . . . . 1.6 4.4 1 1 118 1 . . . . . 6.0 1.0 6.0 1 1 119 1 . . . . . 3.4 0.4 3.4 1 1 120 1 . . . . . 4.4 1.0 4.4 1 1 121 1 . . . . . 4.4 1.0 4.4 1 1 122 1 . . . . . 3.7 1.0 3.7 1 1 123 1 . . . . . 3.7 1.0 3.7 1 1 124 1 . . . . . 6.0 1.0 6.0 1 1 125 1 . . . . . 5.0 0.0 5.0 1 1 126 1 . . . . . 5.0 0.0 5.0 1 1 127 1 . . . . . 4.4 1.0 4.4 1 1 128 1 . . . . . 4.4 1.0 4.4 1 1 129 1 . . . . . 5.0 0.0 5.0 1 1 130 1 . . . . . 5.0 0.0 5.0 1 1 131 1 . . . . . 3.7 1.0 3.7 1 1 132 1 . . . . . 3.4 0.4 3.4 1 1 133 1 . . . . . 3.4 0.4 3.4 1 1 134 1 . . . . . 6.0 1.0 6.0 1 1 135 1 . . . . . 6.0 1.0 6.0 1 1 136 1 . . . . . 6.0 1.0 6.0 1 1 137 1 . . . . . 6.0 1.0 6.0 1 1 138 1 . . . . . 4.7 2.0 4.7 1 1 139 1 . . . . . 6.0 1.0 6.0 1 1 140 1 . . . . . 3.4 0.4 3.4 1 1 141 1 . . . . . 3.4 0.4 3.4 1 1 142 1 . . . . . 6.0 1.0 6.0 1 1 143 1 . . . . . 6.0 1.0 6.0 1 1 144 1 . . . . . 6.0 1.0 6.0 1 1 145 1 . . . . . 3.4 0.4 3.4 1 1 146 1 . . . . . 5.0 0.0 5.0 1 1 147 1 . . . . . 3.7 1.0 3.7 1 1 148 1 . . . . . 5.0 0.0 5.0 1 1 149 1 . . . . . 5.0 0.0 5.0 1 1 150 1 . . . . . 5.0 0.0 5.0 1 1 151 1 . . . . . 3.4 0.4 3.4 1 1 152 1 . . . . . 6.0 1.0 6.0 1 1 153 1 . . . . . 6.0 1.0 6.0 1 1 154 1 . . . . . 4.4 1.0 4.4 1 1 155 1 . . . . . 6.0 1.0 6.0 1 1 156 1 . . . . . 6.0 1.0 6.0 1 1 157 1 . . . . . 6.0 1.0 6.0 1 1 158 1 . . . . . 6.0 1.0 6.0 1 1 159 1 . . . . . 5.0 0.0 5.0 1 1 160 1 . . . . . 4.4 1.0 4.4 1 1 161 1 . . . . . 6.0 1.0 6.0 1 1 162 1 . . . . . 5.0 0.0 5.0 1 1 163 1 . . . . . 2.7 0.4 2.7 1 1 164 1 . . . . . 5.0 0.0 5.0 1 1 165 1 . . . . . 3.7 1.0 3.7 1 1 166 1 . . . . . 2.7 0.4 2.7 1 1 167 1 . . . . . 6.0 1.0 6.0 1 1 168 1 . . . . . 5.0 0.0 5.0 1 1 169 1 . . . . . 5.4 2.0 5.4 1 1 170 1 . . . . . 5.4 2.0 5.4 1 1 171 1 . . . . . 3.4 0.4 3.4 1 1 172 1 . . . . . 4.3 1.3 4.3 1 1 173 1 . . . . . 3.4 0.4 3.4 1 1 174 1 . . . . . 5.0 0.0 5.0 1 1 175 1 . . . . . 3.4 0.4 3.4 1 1 176 1 . . . . . 6.0 1.0 6.0 1 1 177 1 . . . . . 6.0 1.0 6.0 1 1 178 1 . . . . . 5.0 2.0 5.0 1 1 179 1 . . . . . 4.4 1.0 4.4 1 1 180 1 . . . . . 5.0 0.0 5.0 1 1 181 1 . . . . . 6.0 1.0 6.0 1 1 182 1 . . . . . 6.0 1.0 6.0 1 1 183 1 . . . . . 3.4 0.4 3.4 1 1 184 1 . . . . . 5.0 0.0 5.0 1 1 185 1 . . . . . 5.0 0.0 5.0 1 1 186 1 . . . . . 3.4 0.4 3.4 1 1 187 1 . . . . . 2.7 0.4 2.7 1 1 188 1 . . . . . 6.0 1.0 6.0 1 1 189 1 . . . . . 4.4 1.0 4.4 1 1 190 1 . . . . . 4.4 1.0 4.4 1 1 191 1 . . . . . 6.0 1.0 6.0 1 1 192 1 . . . . . 3.4 0.4 3.4 1 1 193 1 . . . . . 4.4 1.0 4.4 1 1 194 1 . . . . . 4.4 1.0 4.4 1 1 195 1 . . . . . 3.4 0.4 3.4 1 1 196 1 . . . . . 5.0 0.0 5.0 1 1 197 1 . . . . . 3.7 1.0 3.7 1 1 198 1 . . . . . 6.0 1.0 6.0 1 1 199 1 . . . . . 5.0 0.0 5.0 1 1 200 1 . . . . . 4.4 1.0 4.4 1 1 201 1 . . . . . 4.4 1.0 4.4 1 1 202 1 . . . . . 3.7 0.3 3.7 1 1 203 1 . . . . . 4.4 1.0 4.4 1 1 204 1 . . . . . 3.4 0.4 3.4 1 1 205 1 . . . . . 6.0 1.0 6.0 1 1 206 1 . . . . . 5.0 0.0 5.0 1 1 207 1 . . . . . 4.4 1.0 4.4 1 1 208 1 . . . . . 4.4 1.0 4.4 1 1 209 1 . . . . . 5.0 0.0 5.0 1 1 210 1 . . . . . 2.7 0.4 2.7 1 1 211 1 . . . . . 5.0 0.0 5.0 1 1 212 1 . . . . . 3.4 0.4 3.4 1 1 213 1 . . . . . 4.4 1.0 4.4 1 1 214 1 . . . . . 4.4 1.0 4.4 1 1 215 1 . . . . . 2.7 0.4 2.7 1 1 216 1 . . . . . 7.0 2.0 7.0 1 1 217 1 . . . . . 6.0 1.0 6.0 1 1 218 1 . . . . . 7.0 2.0 7.0 1 1 219 1 . . . . . 6.0 1.0 6.0 1 1 220 1 . . . . . 6.4 3.0 6.4 1 1 221 1 . . . . . 6.4 3.0 6.4 1 1 222 1 . . . . . 6.4 3.0 6.4 1 1 223 1 . . . . . 7.0 2.0 7.0 1 1 224 1 . . . . . 7.0 2.0 7.0 1 1 225 1 . . . . . 3.0 0.3 3.0 1 1 226 1 . . . . . 3.4 0.4 3.4 1 1 227 1 . . . . . 6.0 1.0 6.0 1 1 228 1 . . . . . 6.5 1.0 6.5 1 1 229 1 . . . . . 7.0 2.0 7.0 1 1 230 1 . . . . . 7.0 2.0 7.0 1 1 231 1 . . . . . 3.4 0.4 3.4 1 1 232 1 . . . . . 4.4 1.0 4.4 1 1 233 1 . . . . . 5.0 0.0 5.0 1 1 234 1 . . . . . 7.0 2.0 7.0 1 1 235 1 . . . . . 7.0 2.0 7.0 1 1 236 1 . . . . . 7.0 2.0 7.0 1 1 237 1 . . . . . 2.7 0.4 2.7 1 1 238 1 . . . . . 3.4 0.4 3.4 1 1 239 1 . . . . . 3.7 1.0 3.7 1 1 240 1 . . . . . 4.4 1.0 4.4 1 1 241 1 . . . . . 6.0 1.0 6.0 1 1 242 1 . . . . . 7.0 2.0 7.0 1 1 243 1 . . . . . 6.0 1.0 6.0 1 1 244 1 . . . . . 4.4 1.0 4.4 1 1 245 1 . . . . . 3.4 0.4 3.4 1 1 246 1 . . . . . 4.4 1.0 4.4 1 1 247 1 . . . . . 3.7 1.0 3.7 1 1 248 1 . . . . . 6.0 1.0 6.0 1 1 249 1 . . . . . 6.0 1.0 6.0 1 1 250 1 . . . . . 6.5 1.5 6.5 1 1 251 1 . . . . . 2.7 0.4 2.7 1 1 252 1 . . . . . 3.7 0.3 3.7 1 1 253 1 . . . . . 3.7 1.0 3.7 1 1 254 1 . . . . . 5.0 0.0 5.0 1 1 255 1 . . . . . 5.0 0.0 5.0 1 1 256 1 . . . . . 5.0 1.6 5.0 1 1 257 1 . . . . . 4.4 1.0 4.4 1 1 258 1 . . . . . 5.0 0.0 5.0 1 1 259 1 . . . . . 6.0 1.0 6.0 1 1 260 1 . . . . . 4.3 1.3 4.3 1 1 261 1 . . . . . 6.0 1.0 6.0 1 1 262 1 . . . . . 5.3 1.0 5.3 1 1 263 1 . . . . . 6.0 1.0 6.0 1 1 264 1 . . . . . 6.0 1.0 6.0 1 1 265 1 . . . . . 5.0 0.0 5.0 1 1 266 1 . . . . . 6.0 1.0 6.0 1 1 267 1 . . . . . 3.7 1.0 3.7 1 1 268 1 . . . . . 3.7 1.0 3.7 1 1 269 1 . . . . . 6.3 2.0 6.3 1 1 270 1 . . . . . 5.4 2.0 5.4 1 1 271 1 . . . . . 6.3 2.0 6.3 1 1 272 1 . . . . . 3.4 0.4 3.4 1 1 273 1 . . . . . 4.3 1.3 4.3 1 1 274 1 . . . . . 5.0 1.6 5.0 1 1 275 1 . . . . . 5.3 1.0 5.3 1 1 276 1 . . . . . 7.0 2.0 7.0 1 1 277 1 . . . . . 6.0 1.0 6.0 1 1 278 1 . . . . . 6.0 1.0 6.0 1 1 279 1 . . . . . 3.4 0.4 3.4 1 1 280 1 . . . . . 4.4 1.0 4.4 1 1 281 1 . . . . . 4.4 1.0 4.4 1 1 282 1 . . . . . 5.3 1.0 5.3 1 1 283 1 . . . . . 5.3 1.9 5.3 1 1 284 1 . . . . . 3.4 0.4 3.4 1 1 285 1 . . . . . 5.0 0.0 5.0 1 1 286 1 . . . . . 4.3 1.3 4.3 1 1 287 1 . . . . . 3.4 0.4 3.4 1 1 288 1 . . . . . 3.4 0.4 3.4 1 1 289 1 . . . . . 4.4 1.0 4.4 1 1 290 1 . . . . . 4.4 1.0 4.4 1 1 291 1 . . . . . 3.4 0.4 3.4 1 1 292 1 . . . . . 6.0 1.0 6.0 1 1 293 1 . . . . . 3.4 0.4 3.4 1 1 294 1 . . . . . 4.4 1.0 4.4 1 1 295 1 . . . . . 4.4 1.0 4.4 1 1 296 1 . . . . . 3.4 0.4 3.4 1 1 297 1 . . . . . 2.7 0.4 2.7 1 1 298 1 . . . . . 4.4 1.0 4.4 1 1 299 1 . . . . . 4.4 1.0 4.4 1 1 300 1 . . . . . 4.4 1.0 4.4 1 1 301 1 . . . . . 3.7 1.0 3.7 1 1 302 1 . . . . . 8.0 3.0 8.0 1 1 303 1 . . . . . 8.0 3.0 8.0 1 1 304 1 . . . . . 8.0 3.0 8.0 1 1 305 1 . . . . . 3.7 0.7 3.7 1 1 306 1 . . . . . 4.4 1.0 4.4 1 1 307 1 . . . . . 7.0 2.0 7.0 1 1 308 1 . . . . . 3.7 0.7 3.7 1 1 309 1 . . . . . 3.4 0.0 3.4 1 1 310 1 . . . . . 5.0 1.6 5.0 1 1 311 1 . . . . . 4.7 1.3 4.7 1 1 312 1 . . . . . 7.0 2.0 7.0 1 1 313 1 . . . . . 2.7 0.4 2.7 1 1 314 1 . . . . . 4.4 1.0 4.4 1 1 315 1 . . . . . 3.4 0.4 3.4 1 1 316 1 . . . . . 3.4 0.4 3.4 1 1 317 1 . . . . . 4.4 1.0 4.4 1 1 318 1 . . . . . 6.0 1.0 6.0 1 1 319 1 . . . . . 4.4 1.0 4.4 1 1 320 1 . . . . . 4.3 0.0 4.3 1 1 321 1 . . . . . 4.3 1.3 4.3 1 1 322 1 . . . . . 4.3 0.0 4.3 1 1 323 1 . . . . . 2.7 0.0 2.7 1 1 324 1 . . . . . 2.7 0.0 2.7 1 1 325 1 . . . . . 4.3 0.0 4.3 1 1 326 1 . . . . . 4.3 0.0 4.3 1 1 327 1 . . . . . 3.7 0.3 3.7 1 1 328 1 . . . . . 4.3 0.0 4.3 1 1 329 1 . . . . . 3.7 0.3 3.7 1 1 330 1 . . . . . 4.3 0.0 4.3 1 1 331 1 . . . . . 3.4 0.0 3.4 1 1 332 1 . . . . . 4.3 0.0 4.3 1 1 333 1 . . . . . 4.3 0.9 4.3 1 1 334 1 . . . . . 4.3 0.0 4.3 1 1 335 1 . . . . . 3.7 0.3 3.7 1 1 336 1 . . . . . 4.3 0.0 4.3 1 1 337 1 . . . . . 3.4 0.0 3.4 1 1 338 1 . . . . . 4.3 0.0 4.3 1 1 339 1 . . . . . 4.3 1.8 4.3 1 1 340 1 . . . . . 4.3 1.8 4.3 1 1 341 1 . . . . . 4.3 0.9 4.3 1 1 342 1 . . . . . 4.3 0.0 4.3 1 1 343 1 . . . . . 3.4 0.0 3.4 1 1 344 1 . . . . . 4.3 0.0 4.3 1 1 345 1 . . . . . 3.7 0.3 3.7 1 1 346 1 . . . . . 4.3 0.0 4.3 1 1 347 1 . . . . . 4.3 0.9 4.3 1 1 348 1 . . . . . 4.3 0.0 4.3 1 1 349 1 . . . . . 4.3 0.0 4.3 1 1 350 1 . . . . . 3.7 0.3 3.7 1 1 351 1 . . . . . 4.3 0.0 4.3 1 1 352 1 . . . . . 2.7 0.0 2.7 1 1 353 1 . . . . . 2.7 0.0 2.7 1 1 354 1 . . . . . 4.3 0.0 4.3 1 1 355 1 . . . . . . 0.0 2.7 1 1 356 1 . . . . . 3.4 0.7 3.4 1 1 357 1 . . . . . 2.7 0.0 2.7 1 1 358 1 . . . . . 3.4 0.0 3.4 1 1 359 1 . . . . . 4.3 0.0 4.3 1 1 360 1 . . . . . 4.4 1.0 4.4 1 1 361 1 . . . . . 2.7 0.0 2.7 1 1 362 1 . . . . . 3.7 0.3 3.7 1 1 363 1 . . . . . 4.4 1.0 4.4 1 1 364 1 . . . . . 5.4 2.0 5.4 1 1 365 1 . . . . . 3.7 1.0 3.7 1 1 366 1 . . . . . 3.7 0.3 3.7 1 1 367 1 . . . . . 4.4 1.0 4.4 1 1 368 1 . . . . . 5.3 1.0 5.3 1 1 369 1 . . . . . 3.7 0.3 3.7 1 1 370 1 . . . . . 5.4 2.0 5.4 1 1 371 1 . . . . . 5.7 3.0 5.7 1 1 372 1 . . . . . 5.7 3.0 5.7 1 1 373 1 . . . . . 6.3 2.0 6.3 1 1 374 1 . . . . . 3.7 0.3 3.7 1 1 375 1 . . . . . 3.7 1.0 3.7 1 1 376 1 . . . . . 3.4 0.0 3.4 1 1 377 1 . . . . . 3.7 0.3 3.7 1 1 378 1 . . . . . 4.3 0.0 4.3 1 1 379 1 . . . . . 3.7 1.0 3.7 1 1 380 1 . . . . . 5.4 2.0 5.4 1 1 381 1 . . . . . 3.7 1.0 3.7 1 1 382 1 . . . . . 3.7 1.0 3.7 1 1 383 1 . . . . . 3.4 0.0 3.4 1 1 384 1 . . . . . 5.0 0.0 5.0 1 1 385 1 . . . . . 2.7 0.0 2.7 1 1 386 1 . . . . . 3.7 0.3 3.7 1 1 387 1 . . . . . 5.7 3.0 5.7 1 1 388 1 . . . . . 5.7 3.0 5.7 1 1 389 1 . . . . . 3.7 1.0 3.7 1 1 390 1 . . . . . 4.4 1.0 4.4 1 1 391 1 . . . . . 3.7 1.0 3.7 1 1 392 1 . . . . . 4.4 1.0 4.4 1 1 393 1 . . . . . 4.3 0.0 4.3 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_4_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 2 _Distance_constraint_list.Constraint_type "hydrogen bond" _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 2 2 1 . . . 1 2 3 1 . . . 1 2 4 1 . . . 1 2 5 1 . . . 1 2 6 1 . . . 1 2 7 1 . . . 1 2 8 1 . . . 1 2 9 1 . . . 1 2 10 1 . . . 1 2 11 1 . . . 1 2 12 1 . . . 1 2 13 1 . . . 1 2 14 1 . . . 1 2 15 1 . . . 1 2 16 1 . . . 1 2 17 1 . . . 1 2 18 1 . . . 1 2 19 1 . . . 1 2 20 1 . . . 1 2 21 1 . . . 1 2 22 1 . . . 1 2 23 1 . . . 1 2 24 1 . . . 1 2 25 1 . . . 1 2 26 1 . . . 1 2 27 1 . . . 1 2 28 1 . . . 1 2 29 1 . . . 1 2 30 1 . . . 1 2 31 1 . . . 1 2 32 1 . . . 1 2 33 1 . . . 1 2 34 1 . . . 1 2 35 1 . . . 1 2 36 1 . . . 1 2 37 1 . . . 1 2 38 1 . . . 1 2 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 12 SER O . 12 . O 1 2 1 1 2 1 1 14 TYR H . 14 . HN 1 2 2 1 1 1 1 12 SER O . 12 . O 1 2 2 1 2 1 1 14 TYR N . 14 . N 1 2 3 1 1 1 1 12 SER O . 12 . O 1 2 3 1 2 1 1 15 GLN H . 15 . HN 1 2 4 1 1 1 1 12 SER O . 12 . O 1 2 4 1 2 1 1 15 GLN N . 15 . N 1 2 5 1 1 1 1 12 SER O . 12 . O 1 2 5 1 2 1 1 16 LEU H . 16 . HN 1 2 6 1 1 1 1 12 SER O . 12 . O 1 2 6 1 2 1 1 16 LEU N . 16 . N 1 2 7 1 1 1 1 13 LEU O . 13 . O 1 2 7 1 2 1 1 17 GLU H . 17 . HN 1 2 8 1 1 1 1 13 LEU O . 13 . O 1 2 8 1 2 1 1 17 GLU N . 17 . N 1 2 9 1 1 1 1 14 TYR O . 14 . O 1 2 9 1 2 1 1 17 GLU H . 17 . HN 1 2 10 1 1 1 1 14 TYR O . 14 . O 1 2 10 1 2 1 1 17 GLU N . 17 . N 1 2 11 1 1 1 1 15 GLN O . 15 . O 1 2 11 1 2 1 1 18 ASN H . 18 . HN 1 2 12 1 1 1 1 15 GLN O . 15 . O 1 2 12 1 2 1 1 18 ASN N . 18 . N 1 2 13 1 1 1 1 16 LEU O . 16 . O 1 2 13 1 2 1 1 19 TYR H . 19 . HN 1 2 14 1 1 1 1 16 LEU O . 16 . O 1 2 14 1 2 1 1 19 TYR N . 19 . N 1 2 15 1 1 1 1 17 GLU O . 17 . O 1 2 15 1 2 1 1 20 CYS H . 20 . HN 1 2 16 1 1 1 1 17 GLU O . 17 . O 1 2 16 1 2 1 1 20 CYS N . 20 . N 1 2 17 1 1 2 2 7 CYS O . 28 . O 1 2 17 1 2 2 2 10 ASP H . 31 . HN 1 2 18 1 1 2 2 7 CYS O . 28 . O 1 2 18 1 2 2 2 10 ASP N . 31 . N 1 2 19 1 1 2 2 7 CYS O . 28 . O 1 2 19 1 2 2 2 11 LEU H . 32 . HN 1 2 20 1 1 2 2 7 CYS O . 28 . O 1 2 20 1 2 2 2 11 LEU N . 32 . N 1 2 21 1 1 2 2 8 GLY O . 29 . O 1 2 21 1 2 2 2 11 LEU H . 32 . HN 1 2 22 1 1 2 2 8 GLY O . 29 . O 1 2 22 1 2 2 2 11 LEU N . 32 . N 1 2 23 1 1 2 2 8 GLY O . 29 . O 1 2 23 1 2 2 2 12 VAL H . 33 . HN 1 2 24 1 1 2 2 8 GLY O . 29 . O 1 2 24 1 2 2 2 12 VAL N . 33 . N 1 2 25 1 1 2 2 9 SER O . 30 . O 1 2 25 1 2 2 2 13 GLU H . 34 . HN 1 2 26 1 1 2 2 9 SER O . 30 . O 1 2 26 1 2 2 2 13 GLU N . 34 . N 1 2 27 1 1 2 2 10 ASP O . 31 . O 1 2 27 1 2 2 2 14 ALA H . 35 . HN 1 2 28 1 1 2 2 10 ASP O . 31 . O 1 2 28 1 2 2 2 14 ALA N . 35 . N 1 2 29 1 1 2 2 11 LEU O . 32 . O 1 2 29 1 2 2 2 15 LEU H . 36 . HN 1 2 30 1 1 2 2 11 LEU O . 32 . O 1 2 30 1 2 2 2 15 LEU N . 36 . N 1 2 31 1 1 2 2 12 VAL O . 33 . O 1 2 31 1 2 2 2 16 TYR H . 37 . HN 1 2 32 1 1 2 2 12 VAL O . 33 . O 1 2 32 1 2 2 2 16 TYR N . 37 . N 1 2 33 1 1 2 2 13 GLU O . 34 . O 1 2 33 1 2 2 2 17 LEU H . 38 . HN 1 2 34 1 1 2 2 13 GLU O . 34 . O 1 2 34 1 2 2 2 17 LEU N . 38 . N 1 2 35 1 1 2 2 14 ALA O . 35 . O 1 2 35 1 2 2 2 18 VAL H . 39 . HN 1 2 36 1 1 2 2 14 ALA O . 35 . O 1 2 36 1 2 2 2 18 VAL N . 39 . N 1 2 37 1 1 2 2 15 LEU O . 36 . O 1 2 37 1 2 2 2 19 CYS H . 40 . HN 1 2 38 1 1 2 2 15 LEU O . 36 . O 1 2 38 1 2 2 2 19 CYS N . 40 . N 1 2 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 2.6 0.3 2.6 1 2 2 1 . . . . . 3.3 0.6 3.3 1 2 3 1 . . . . . 2.6 0.3 2.6 1 2 4 1 . . . . . 3.3 0.6 3.3 1 2 5 1 . . . . . 2.6 0.3 2.6 1 2 6 1 . . . . . 3.3 0.6 3.3 1 2 7 1 . . . . . 2.6 0.3 2.6 1 2 8 1 . . . . . 3.3 0.6 3.3 1 2 9 1 . . . . . 2.6 0.3 2.6 1 2 10 1 . . . . . 3.3 0.6 3.3 1 2 11 1 . . . . . 2.6 0.3 2.6 1 2 12 1 . . . . . 3.3 0.6 3.3 1 2 13 1 . . . . . 2.6 0.3 2.6 1 2 14 1 . . . . . 3.3 0.6 3.3 1 2 15 1 . . . . . 2.6 0.3 2.6 1 2 16 1 . . . . . 3.3 0.6 3.3 1 2 17 1 . . . . . 2.6 0.3 2.6 1 2 18 1 . . . . . 3.3 0.6 3.3 1 2 19 1 . . . . . 2.6 0.3 2.6 1 2 20 1 . . . . . 3.3 0.6 3.3 1 2 21 1 . . . . . 2.6 0.3 2.6 1 2 22 1 . . . . . 3.3 0.6 3.3 1 2 23 1 . . . . . 2.6 0.3 2.6 1 2 24 1 . . . . . 3.3 0.6 3.3 1 2 25 1 . . . . . 2.6 0.3 2.6 1 2 26 1 . . . . . 3.3 0.6 3.3 1 2 27 1 . . . . . 2.6 0.3 2.6 1 2 28 1 . . . . . 3.3 0.6 3.3 1 2 29 1 . . . . . 2.6 0.3 2.6 1 2 30 1 . . . . . 3.3 0.6 3.3 1 2 31 1 . . . . . 2.6 0.3 2.6 1 2 32 1 . . . . . 3.3 0.6 3.3 1 2 33 1 . . . . . 2.6 0.3 2.6 1 2 34 1 . . . . . 3.3 0.6 3.3 1 2 35 1 . . . . . 2.6 0.3 2.6 1 2 36 1 . . . . . 3.3 0.6 3.3 1 2 37 1 . . . . . 2.6 0.3 2.6 1 2 38 1 . . . . . 3.3 0.6 3.3 1 2 stop_ save_ save_CNS/XPLOR_dihedral_3 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID 1 _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID . _Torsion_angle_constraint_list.Block_ID . loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 . 1 1 1 GLY C 1 1 2 ILE N 1 1 2 ILE CA 1 1 2 ILE C -105.0 -25.0 . 1 . C . 2 . N . 2 . CA . 2 . C 1 1 2 . 1 1 2 ILE C 1 1 3 VAL N 1 1 3 VAL CA 1 1 3 VAL C -105.0 -25.0 . 2 . C . 3 . N . 3 . CA . 3 . C 1 1 3 . 1 1 3 VAL C 1 1 4 GLU N 1 1 4 GLU CA 1 1 4 GLU C -105.0 -25.0 . 3 . C . 4 . N . 4 . CA . 4 . C 1 1 4 . 1 1 4 GLU C 1 1 5 GLN N 1 1 5 GLN CA 1 1 5 GLN C -105.0 -25.0 . 4 . C . 5 . N . 5 . CA . 5 . C 1 1 5 . 1 1 5 GLN C 1 1 6 CYS N 1 1 6 CYS CA 1 1 6 CYS C -105.0 -25.0 . 5 . C . 6 . N . 6 . CA . 6 . C 1 1 6 . 1 1 12 SER C 1 1 13 LEU N 1 1 13 LEU CA 1 1 13 LEU C -105.0 -25.0 . 12 . C . 13 . N . 13 . CA . 13 . C 1 1 7 . 1 1 13 LEU C 1 1 14 TYR N 1 1 14 TYR CA 1 1 14 TYR C -105.0 -25.0 . 13 . C . 14 . N . 14 . CA . 14 . C 1 1 8 . 1 1 14 TYR C 1 1 15 GLN N 1 1 15 GLN CA 1 1 15 GLN C -105.0 -25.0 . 14 . C . 15 . N . 15 . CA . 15 . C 1 1 9 . 1 1 15 GLN C 1 1 16 LEU N 1 1 16 LEU CA 1 1 16 LEU C -105.0 -25.0 . 15 . C . 16 . N . 16 . CA . 16 . C 1 1 10 . 1 1 16 LEU C 1 1 17 GLU N 1 1 17 GLU CA 1 1 17 GLU C -105.0 -25.0 . 16 . C . 17 . N . 17 . CA . 17 . C 1 1 11 . 2 2 9 SER C 2 2 10 ASP N 2 2 10 ASP CA 2 2 10 ASP C -105.0 -25.0 . 30 . C . 31 . N . 31 . CA . 31 . C 1 1 12 . 2 2 10 ASP C 2 2 11 LEU N 2 2 11 LEU CA 2 2 11 LEU C -105.0 -25.0 . 31 . C . 32 . N . 32 . CA . 32 . C 1 1 13 . 2 2 11 LEU C 2 2 12 VAL N 2 2 12 VAL CA 2 2 12 VAL C -105.0 -25.0 . 32 . C . 33 . N . 33 . CA . 33 . C 1 1 14 . 2 2 12 VAL C 2 2 13 GLU N 2 2 13 GLU CA 2 2 13 GLU C -105.0 -25.0 . 33 . C . 34 . N . 34 . CA . 34 . C 1 1 15 . 2 2 13 GLU C 2 2 14 ALA N 2 2 14 ALA CA 2 2 14 ALA C -105.0 -25.0 . 34 . C . 35 . N . 35 . CA . 35 . C 1 1 16 . 2 2 14 ALA C 2 2 15 LEU N 2 2 15 LEU CA 2 2 15 LEU C -105.0 -25.0 . 35 . C . 36 . N . 36 . CA . 36 . C 1 1 17 . 2 2 15 LEU C 2 2 16 TYR N 2 2 16 TYR CA 2 2 16 TYR C -105.0 -25.0 . 36 . C . 37 . N . 37 . CA . 37 . C 1 1 18 . 2 2 16 TYR C 2 2 17 LEU N 2 2 17 LEU CA 2 2 17 LEU C -105.0 -25.0 . 37 . C . 38 . N . 38 . CA . 38 . C 1 1 19 . 2 2 17 LEU C 2 2 18 VAL N 2 2 18 VAL CA 2 2 18 VAL C -105.0 -25.0 . 38 . C . 39 . N . 39 . CA . 39 . C 1 1 20 . 1 1 9 SER C 1 1 10 ILE N 1 1 10 ILE CA 1 1 10 ILE C -160.0 -80.0 . 9 . C . 10 . N . 10 . CA . 10 . C 1 1 21 . 1 1 11 CYS C 1 1 12 SER N 1 1 12 SER CA 1 1 12 SER C -160.0 -80.0 . 11 . C . 12 . N . 12 . CA . 12 . C 1 1 22 . 2 2 1 PHE C 2 2 2 VAL N 2 2 2 VAL CA 2 2 2 VAL C -160.0 -80.0 . 22 . C . 23 . N . 23 . CA . 23 . C 1 1 23 . 2 2 3 ASN C 2 2 4 GLN N 2 2 4 GLN CA 2 2 4 GLN C -160.0 -80.0 . 24 . C . 25 . N . 25 . CA . 25 . C 1 1 24 . 2 2 5 HIS C 2 2 6 LEU N 2 2 6 LEU CA 2 2 6 LEU C -160.0 -80.0 . 26 . C . 27 . N . 27 . CA . 27 . C 1 1 25 . 1 1 3 VAL N 1 1 3 VAL CA 1 1 3 VAL CB 1 1 3 VAL CG1 -100.0 -20.0 . 3 . N . 3 . CA . 3 . CB . 3 . CG1 1 1 26 . 1 1 6 CYS N 1 1 6 CYS CA 1 1 6 CYS CB 1 1 6 CYS SG -100.0 -20.0 . 6 . N . 6 . CA . 6 . CB . 6 . SG 1 1 27 . 1 1 15 GLN N 1 1 15 GLN CA 1 1 15 GLN CB 1 1 15 GLN CG -100.0 -20.0 . 15 . N . 15 . CA . 15 . CB . 15 . CG 1 1 28 . 1 1 16 LEU N 1 1 16 LEU CA 1 1 16 LEU CB 1 1 16 LEU CG -100.0 -20.0 . 16 . N . 16 . CA . 16 . CB . 16 . CG 1 1 29 . 1 1 17 GLU N 1 1 17 GLU CA 1 1 17 GLU CB 1 1 17 GLU CG -100.0 -20.0 . 17 . N . 17 . CA . 17 . CB . 17 . CG 1 1 30 . 1 1 19 TYR N 1 1 19 TYR CA 1 1 19 TYR CB 1 1 19 TYR CG -100.0 -20.0 . 19 . N . 19 . CA . 19 . CB . 19 . CG 1 1 31 . 1 1 20 CYS N 1 1 20 CYS CA 1 1 20 CYS CB 1 1 20 CYS SG -100.0 -20.0 . 20 . N . 20 . CA . 20 . CB . 20 . SG 1 1 32 . 2 2 7 CYS N 2 2 7 CYS CA 2 2 7 CYS CB 2 2 7 CYS SG -100.0 -20.0 . 28 . N . 28 . CA . 28 . CB . 28 . SG 1 1 33 . 2 2 10 ASP N 2 2 10 ASP CA 2 2 10 ASP CB 2 2 10 ASP CG -100.0 -20.0 . 31 . N . 31 . CA . 31 . CB . 31 . CG 1 1 34 . 2 2 12 VAL N 2 2 12 VAL CA 2 2 12 VAL CB 2 2 12 VAL CG1 -100.0 -20.0 . 33 . N . 33 . CA . 33 . CB . 33 . CG1 1 1 35 . 2 2 13 GLU N 2 2 13 GLU CA 2 2 13 GLU CB 2 2 13 GLU CG -100.0 -20.0 . 34 . N . 34 . CA . 34 . CB . 34 . CG 1 1 36 . 2 2 15 LEU N 2 2 15 LEU CA 2 2 15 LEU CB 2 2 15 LEU CG -100.0 -20.0 . 36 . N . 36 . CA . 36 . CB . 36 . CG 1 1 37 . 2 2 17 LEU N 2 2 17 LEU CA 2 2 17 LEU CB 2 2 17 LEU CG -100.0 -20.0 . 38 . N . 38 . CA . 38 . CB . 38 . CG 1 1 38 . 2 2 18 VAL N 2 2 18 VAL CA 2 2 18 VAL CB 2 2 18 VAL CG1 -100.0 -20.0 . 39 . N . 39 . CA . 39 . CB . 39 . CG1 1 1 39 . 2 2 19 CYS N 2 2 19 CYS CA 2 2 19 CYS CB 2 2 19 CYS SG -100.0 -20.0 . 40 . N . 40 . CA . 40 . CB . 40 . SG 1 1 40 . 2 2 5 HIS N 2 2 5 HIS CA 2 2 5 HIS CB 2 2 5 HIS CG 140.0 220.0 . 26 . N . 26 . CA . 26 . CB . 26 . CG 1 1 41 . 1 1 12 SER N 1 1 12 SER CA 1 1 12 SER CB 1 1 12 SER OG 20.0 100.0 . 12 . N . 12 . CA . 12 . CB . 12 . OG 1 1 42 . 2 2 15 LEU CA 2 2 15 LEU CB 2 2 15 LEU CG 2 2 15 LEU CD1 -100.0 -20.0 . 36 . CA . 36 . CB . 36 . CG . 36 . CD1 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 -5.764 6.377 5.061 1.00 . A A . 1 GLY C 1 1 1 2 1 1 1 GLY CA C -7.102 6.866 5.507 1.00 . A A . 1 GLY CA 1 1 1 3 1 1 1 GLY H1 H -7.003 8.971 5.304 1.00 . A A . 1 GLY H1 1 1 1 4 1 1 1 GLY H2 H -8.590 8.364 5.345 1.00 . A A . 1 GLY H2 1 1 1 5 1 1 1 GLY H3 H -7.646 8.185 3.943 1.00 . A A . 1 GLY H3 1 1 1 6 1 1 1 GLY HA2 H -6.660 6.973 6.369 1.00 . A A . 1 GLY HA2 1 1 1 7 1 1 1 GLY HA3 H -8.014 6.137 5.549 1.00 . A A . 1 GLY HA3 1 1 1 8 1 1 1 GLY N N -7.627 8.204 4.983 1.00 . A A . 1 GLY N 1 1 1 9 1 1 1 GLY O O -4.740 6.757 5.596 1.00 . A A . 1 GLY O 1 1 1 10 1 1 2 ILE C C -3.930 5.860 2.422 1.00 . A A . 2 ILE C 1 1 1 11 1 1 2 ILE CA C -4.427 4.998 3.585 1.00 . A A . 2 ILE CA 1 1 1 12 1 1 2 ILE CB C -4.605 3.556 3.108 1.00 . A A . 2 ILE CB 1 1 1 13 1 1 2 ILE CD1 C -4.907 1.202 3.895 1.00 . A A . 2 ILE CD1 1 1 1 14 1 1 2 ILE CG1 C -5.021 2.676 4.290 1.00 . A A . 2 ILE CG1 1 1 1 15 1 1 2 ILE CG2 C -3.283 3.045 2.535 1.00 . A A . 2 ILE CG2 1 1 1 16 1 1 2 ILE H H -6.568 5.229 3.655 1.00 . A A . 2 ILE H 1 1 1 17 1 1 2 ILE HA H -3.704 5.025 4.387 1.00 . A A . 2 ILE HA 1 1 1 18 1 1 2 ILE HB H -5.367 3.521 2.343 1.00 . A A . 2 ILE HB 1 1 1 19 1 1 2 ILE HD11 H -3.898 0.993 3.569 1.00 . A A . 2 ILE HD11 1 1 1 20 1 1 2 ILE HD12 H -5.595 0.990 3.091 1.00 . A A . 2 ILE HD12 1 1 1 21 1 1 2 ILE HD13 H -5.146 0.582 4.746 1.00 . A A . 2 ILE HD13 1 1 1 22 1 1 2 ILE HG12 H -4.374 2.875 5.132 1.00 . A A . 2 ILE HG12 1 1 1 23 1 1 2 ILE HG13 H -6.043 2.896 4.560 1.00 . A A . 2 ILE HG13 1 1 1 24 1 1 2 ILE HG21 H -3.483 2.306 1.773 1.00 . A A . 2 ILE HG21 1 1 1 25 1 1 2 ILE HG22 H -2.698 2.598 3.325 1.00 . A A . 2 ILE HG22 1 1 1 26 1 1 2 ILE HG23 H -2.735 3.869 2.102 1.00 . A A . 2 ILE HG23 1 1 1 27 1 1 2 ILE N N -5.733 5.524 4.074 1.00 . A A . 2 ILE N 1 1 1 28 1 1 2 ILE O O -2.745 6.065 2.250 1.00 . A A . 2 ILE O 1 1 1 29 1 1 3 VAL C C -3.776 8.501 0.992 1.00 . A A . 3 VAL C 1 1 1 30 1 1 3 VAL CA C -4.407 7.213 0.470 1.00 . A A . 3 VAL CA 1 1 1 31 1 1 3 VAL CB C -5.630 7.557 -0.380 1.00 . A A . 3 VAL CB 1 1 1 32 1 1 3 VAL CG1 C -6.434 6.287 -0.649 1.00 . A A . 3 VAL CG1 1 1 1 33 1 1 3 VAL CG2 C -6.508 8.562 0.370 1.00 . A A . 3 VAL CG2 1 1 1 34 1 1 3 VAL H H -5.778 6.188 1.777 1.00 . A A . 3 VAL H 1 1 1 35 1 1 3 VAL HA H -3.689 6.678 -0.128 1.00 . A A . 3 VAL HA 1 1 1 36 1 1 3 VAL HB H -5.308 7.985 -1.318 1.00 . A A . 3 VAL HB 1 1 1 37 1 1 3 VAL HG11 H -7.330 6.294 -0.045 1.00 . A A . 3 VAL HG11 1 1 1 38 1 1 3 VAL HG12 H -5.838 5.422 -0.397 1.00 . A A . 3 VAL HG12 1 1 1 39 1 1 3 VAL HG13 H -6.704 6.247 -1.693 1.00 . A A . 3 VAL HG13 1 1 1 40 1 1 3 VAL HG21 H -7.546 8.376 0.137 1.00 . A A . 3 VAL HG21 1 1 1 41 1 1 3 VAL HG22 H -6.245 9.565 0.070 1.00 . A A . 3 VAL HG22 1 1 1 42 1 1 3 VAL HG23 H -6.353 8.451 1.433 1.00 . A A . 3 VAL HG23 1 1 1 43 1 1 3 VAL N N -4.827 6.366 1.622 1.00 . A A . 3 VAL N 1 1 1 44 1 1 3 VAL O O -2.941 9.104 0.349 1.00 . A A . 3 VAL O 1 1 1 45 1 1 4 GLU C C -2.252 9.887 3.362 1.00 . A A . 4 GLU C 1 1 1 46 1 1 4 GLU CA C -3.612 10.179 2.724 1.00 . A A . 4 GLU CA 1 1 1 47 1 1 4 GLU CB C -4.568 10.728 3.787 1.00 . A A . 4 GLU CB 1 1 1 48 1 1 4 GLU CD C -6.980 11.197 4.248 1.00 . A A . 4 GLU CD 1 1 1 49 1 1 4 GLU CG C -6.008 10.342 3.433 1.00 . A A . 4 GLU CG 1 1 1 50 1 1 4 GLU H H -4.854 8.422 2.645 1.00 . A A . 4 GLU H 1 1 1 51 1 1 4 GLU HA H -3.491 10.910 1.938 1.00 . A A . 4 GLU HA 1 1 1 52 1 1 4 GLU HB2 H -4.310 10.314 4.750 1.00 . A A . 4 GLU HB2 1 1 1 53 1 1 4 GLU HB3 H -4.485 11.804 3.823 1.00 . A A . 4 GLU HB3 1 1 1 54 1 1 4 GLU HG2 H -6.177 10.508 2.378 1.00 . A A . 4 GLU HG2 1 1 1 55 1 1 4 GLU HG3 H -6.167 9.299 3.663 1.00 . A A . 4 GLU HG3 1 1 1 56 1 1 4 GLU N N -4.176 8.926 2.151 1.00 . A A . 4 GLU N 1 1 1 57 1 1 4 GLU O O -1.624 10.759 3.928 1.00 . A A . 4 GLU O 1 1 1 58 1 1 4 GLU OE1 O -6.716 11.405 5.421 1.00 . A A . 4 GLU OE1 1 1 1 59 1 1 4 GLU OE2 O -7.972 11.629 3.685 1.00 . A A . 4 GLU OE2 1 1 1 60 1 1 5 GLN C C 0.573 8.175 2.769 1.00 . A A . 5 GLN C 1 1 1 61 1 1 5 GLN CA C -0.472 8.328 3.879 1.00 . A A . 5 GLN CA 1 1 1 62 1 1 5 GLN CB C -0.588 7.014 4.654 1.00 . A A . 5 GLN CB 1 1 1 63 1 1 5 GLN CD C -0.046 6.814 7.087 1.00 . A A . 5 GLN CD 1 1 1 64 1 1 5 GLN CG C -1.086 7.296 6.073 1.00 . A A . 5 GLN CG 1 1 1 65 1 1 5 GLN H H -2.312 7.978 2.815 1.00 . A A . 5 GLN H 1 1 1 66 1 1 5 GLN HA H -0.170 9.117 4.552 1.00 . A A . 5 GLN HA 1 1 1 67 1 1 5 GLN HB2 H -1.285 6.360 4.150 1.00 . A A . 5 GLN HB2 1 1 1 68 1 1 5 GLN HB3 H 0.380 6.539 4.703 1.00 . A A . 5 GLN HB3 1 1 1 69 1 1 5 GLN HE21 H -0.655 4.925 7.030 1.00 . A A . 5 GLN HE21 1 1 1 70 1 1 5 GLN HE22 H 0.647 5.235 8.073 1.00 . A A . 5 GLN HE22 1 1 1 71 1 1 5 GLN HG2 H -1.243 8.358 6.194 1.00 . A A . 5 GLN HG2 1 1 1 72 1 1 5 GLN HG3 H -2.016 6.773 6.238 1.00 . A A . 5 GLN HG3 1 1 1 73 1 1 5 GLN N N -1.792 8.669 3.276 1.00 . A A . 5 GLN N 1 1 1 74 1 1 5 GLN NE2 N -0.015 5.553 7.425 1.00 . A A . 5 GLN NE2 1 1 1 75 1 1 5 GLN O O 1.673 8.683 2.866 1.00 . A A . 5 GLN O 1 1 1 76 1 1 5 GLN OE1 O 0.748 7.593 7.578 1.00 . A A . 5 GLN OE1 1 1 1 77 1 1 6 CYS C C 0.932 8.294 -0.511 1.00 . A A . 6 CYS C 1 1 1 78 1 1 6 CYS CA C 1.216 7.287 0.606 1.00 . A A . 6 CYS CA 1 1 1 79 1 1 6 CYS CB C 1.085 5.868 0.047 1.00 . A A . 6 CYS CB 1 1 1 80 1 1 6 CYS H H -0.650 7.072 1.659 1.00 . A A . 6 CYS H 1 1 1 81 1 1 6 CYS HA H 2.219 7.435 0.978 1.00 . A A . 6 CYS HA 1 1 1 82 1 1 6 CYS HB2 H 0.040 5.624 -0.074 1.00 . A A . 6 CYS HB2 1 1 1 83 1 1 6 CYS HB3 H 1.581 5.811 -0.910 1.00 . A A . 6 CYS HB3 1 1 1 84 1 1 6 CYS N N 0.240 7.476 1.717 1.00 . A A . 6 CYS N 1 1 1 85 1 1 6 CYS O O 1.830 8.750 -1.189 1.00 . A A . 6 CYS O 1 1 1 86 1 1 6 CYS SG S 1.847 4.690 1.191 1.00 . A A . 6 CYS SG 1 1 1 87 1 1 7 CYS C C -0.214 11.019 -1.382 1.00 . A A . 7 CYS C 1 1 1 88 1 1 7 CYS CA C -0.647 9.610 -1.796 1.00 . A A . 7 CYS CA 1 1 1 89 1 1 7 CYS CB C -2.154 9.597 -2.036 1.00 . A A . 7 CYS CB 1 1 1 90 1 1 7 CYS H H -1.022 8.256 -0.161 1.00 . A A . 7 CYS H 1 1 1 91 1 1 7 CYS HA H -0.134 9.325 -2.705 1.00 . A A . 7 CYS HA 1 1 1 92 1 1 7 CYS HB2 H -2.554 8.634 -1.753 1.00 . A A . 7 CYS HB2 1 1 1 93 1 1 7 CYS HB3 H -2.620 10.368 -1.440 1.00 . A A . 7 CYS HB3 1 1 1 94 1 1 7 CYS N N -0.310 8.639 -0.714 1.00 . A A . 7 CYS N 1 1 1 95 1 1 7 CYS O O -0.176 11.927 -2.187 1.00 . A A . 7 CYS O 1 1 1 96 1 1 7 CYS SG S -2.498 9.898 -3.786 1.00 . A A . 7 CYS SG 1 1 1 97 1 1 8 THR C C 2.067 12.594 0.412 1.00 . A A . 8 THR C 1 1 1 98 1 1 8 THR CA C 0.541 12.565 0.319 1.00 . A A . 8 THR CA 1 1 1 99 1 1 8 THR CB C -0.066 12.865 1.693 1.00 . A A . 8 THR CB 1 1 1 100 1 1 8 THR CG2 C 0.633 12.021 2.758 1.00 . A A . 8 THR CG2 1 1 1 101 1 1 8 THR H H 0.072 10.469 0.504 1.00 . A A . 8 THR H 1 1 1 102 1 1 8 THR HA H 0.210 13.307 -0.393 1.00 . A A . 8 THR HA 1 1 1 103 1 1 8 THR HB H -1.118 12.623 1.682 1.00 . A A . 8 THR HB 1 1 1 104 1 1 8 THR HG1 H -0.743 14.681 1.855 1.00 . A A . 8 THR HG1 1 1 1 105 1 1 8 THR HG21 H 1.678 12.292 2.804 1.00 . A A . 8 THR HG21 1 1 1 106 1 1 8 THR HG22 H 0.543 10.975 2.504 1.00 . A A . 8 THR HG22 1 1 1 107 1 1 8 THR HG23 H 0.173 12.199 3.718 1.00 . A A . 8 THR HG23 1 1 1 108 1 1 8 THR N N 0.110 11.212 -0.134 1.00 . A A . 8 THR N 1 1 1 109 1 1 8 THR O O 2.701 13.595 0.144 1.00 . A A . 8 THR O 1 1 1 110 1 1 8 THR OG1 O 0.100 14.244 1.992 1.00 . A A . 8 THR OG1 1 1 1 111 1 1 9 SER C C 4.625 10.114 0.285 1.00 . A A . 9 SER C 1 1 1 112 1 1 9 SER CA C 4.143 11.432 0.888 1.00 . A A . 9 SER CA 1 1 1 113 1 1 9 SER CB C 4.559 11.501 2.358 1.00 . A A . 9 SER CB 1 1 1 114 1 1 9 SER H H 2.124 10.697 0.986 1.00 . A A . 9 SER H 1 1 1 115 1 1 9 SER HA H 4.579 12.259 0.347 1.00 . A A . 9 SER HA 1 1 1 116 1 1 9 SER HB2 H 3.778 11.088 2.975 1.00 . A A . 9 SER HB2 1 1 1 117 1 1 9 SER HB3 H 5.467 10.930 2.500 1.00 . A A . 9 SER HB3 1 1 1 118 1 1 9 SER HG H 4.154 13.081 3.419 1.00 . A A . 9 SER HG 1 1 1 119 1 1 9 SER N N 2.659 11.492 0.783 1.00 . A A . 9 SER N 1 1 1 120 1 1 9 SER O O 3.873 9.167 0.163 1.00 . A A . 9 SER O 1 1 1 121 1 1 9 SER OG O 4.775 12.858 2.721 1.00 . A A . 9 SER OG 1 1 1 122 1 1 10 ILE C C 6.686 7.775 0.424 1.00 . A A . 10 ILE C 1 1 1 123 1 1 10 ILE CA C 6.381 8.778 -0.690 1.00 . A A . 10 ILE CA 1 1 1 124 1 1 10 ILE CB C 7.651 9.071 -1.485 1.00 . A A . 10 ILE CB 1 1 1 125 1 1 10 ILE CD1 C 6.283 9.991 -3.360 1.00 . A A . 10 ILE CD1 1 1 1 126 1 1 10 ILE CG1 C 7.419 10.290 -2.380 1.00 . A A . 10 ILE CG1 1 1 1 127 1 1 10 ILE CG2 C 7.992 7.862 -2.352 1.00 . A A . 10 ILE CG2 1 1 1 128 1 1 10 ILE H H 6.461 10.813 0.009 1.00 . A A . 10 ILE H 1 1 1 129 1 1 10 ILE HA H 5.633 8.363 -1.350 1.00 . A A . 10 ILE HA 1 1 1 130 1 1 10 ILE HB H 8.466 9.269 -0.804 1.00 . A A . 10 ILE HB 1 1 1 131 1 1 10 ILE HD11 H 5.970 10.907 -3.839 1.00 . A A . 10 ILE HD11 1 1 1 132 1 1 10 ILE HD12 H 5.449 9.561 -2.824 1.00 . A A . 10 ILE HD12 1 1 1 133 1 1 10 ILE HD13 H 6.628 9.293 -4.109 1.00 . A A . 10 ILE HD13 1 1 1 134 1 1 10 ILE HG12 H 7.153 11.139 -1.768 1.00 . A A . 10 ILE HG12 1 1 1 135 1 1 10 ILE HG13 H 8.320 10.510 -2.932 1.00 . A A . 10 ILE HG13 1 1 1 136 1 1 10 ILE HG21 H 8.534 8.187 -3.227 1.00 . A A . 10 ILE HG21 1 1 1 137 1 1 10 ILE HG22 H 7.079 7.369 -2.656 1.00 . A A . 10 ILE HG22 1 1 1 138 1 1 10 ILE HG23 H 8.599 7.175 -1.784 1.00 . A A . 10 ILE HG23 1 1 1 139 1 1 10 ILE N N 5.867 10.040 -0.095 1.00 . A A . 10 ILE N 1 1 1 140 1 1 10 ILE O O 7.737 7.805 1.032 1.00 . A A . 10 ILE O 1 1 1 141 1 1 11 CYS C C 6.930 4.785 1.266 1.00 . A A . 11 CYS C 1 1 1 142 1 1 11 CYS CA C 5.993 5.883 1.772 1.00 . A A . 11 CYS CA 1 1 1 143 1 1 11 CYS CB C 4.653 5.260 2.167 1.00 . A A . 11 CYS CB 1 1 1 144 1 1 11 CYS H H 4.927 6.886 0.194 1.00 . A A . 11 CYS H 1 1 1 145 1 1 11 CYS HA H 6.433 6.366 2.632 1.00 . A A . 11 CYS HA 1 1 1 146 1 1 11 CYS HB2 H 4.826 4.425 2.831 1.00 . A A . 11 CYS HB2 1 1 1 147 1 1 11 CYS HB3 H 4.045 5.999 2.668 1.00 . A A . 11 CYS HB3 1 1 1 148 1 1 11 CYS N N 5.768 6.889 0.697 1.00 . A A . 11 CYS N 1 1 1 149 1 1 11 CYS O O 7.084 4.585 0.077 1.00 . A A . 11 CYS O 1 1 1 150 1 1 11 CYS SG S 3.801 4.683 0.679 1.00 . A A . 11 CYS SG 1 1 1 151 1 1 12 SER C C 7.683 1.677 1.586 1.00 . A A . 12 SER C 1 1 1 152 1 1 12 SER CA C 8.473 2.975 1.739 1.00 . A A . 12 SER CA 1 1 1 153 1 1 12 SER CB C 9.561 2.789 2.798 1.00 . A A . 12 SER CB 1 1 1 154 1 1 12 SER H H 7.407 4.243 3.114 1.00 . A A . 12 SER H 1 1 1 155 1 1 12 SER HA H 8.930 3.229 0.794 1.00 . A A . 12 SER HA 1 1 1 156 1 1 12 SER HB2 H 10.183 1.950 2.535 1.00 . A A . 12 SER HB2 1 1 1 157 1 1 12 SER HB3 H 10.168 3.683 2.849 1.00 . A A . 12 SER HB3 1 1 1 158 1 1 12 SER HG H 9.029 1.604 4.247 1.00 . A A . 12 SER HG 1 1 1 159 1 1 12 SER N N 7.551 4.067 2.162 1.00 . A A . 12 SER N 1 1 1 160 1 1 12 SER O O 6.751 1.411 2.324 1.00 . A A . 12 SER O 1 1 1 161 1 1 12 SER OG O 8.952 2.542 4.059 1.00 . A A . 12 SER OG 1 1 1 162 1 1 13 LEU C C 7.135 -1.100 1.791 1.00 . A A . 13 LEU C 1 1 1 163 1 1 13 LEU CA C 7.313 -0.413 0.438 1.00 . A A . 13 LEU CA 1 1 1 164 1 1 13 LEU CB C 8.107 -1.323 -0.499 1.00 . A A . 13 LEU CB 1 1 1 165 1 1 13 LEU CD1 C 6.732 -2.045 -2.453 1.00 . A A . 13 LEU CD1 1 1 1 166 1 1 13 LEU CD2 C 7.948 -3.743 -1.086 1.00 . A A . 13 LEU CD2 1 1 1 167 1 1 13 LEU CG C 7.187 -2.417 -1.042 1.00 . A A . 13 LEU CG 1 1 1 168 1 1 13 LEU H H 8.797 1.096 0.050 1.00 . A A . 13 LEU H 1 1 1 169 1 1 13 LEU HA H 6.344 -0.210 0.007 1.00 . A A . 13 LEU HA 1 1 1 170 1 1 13 LEU HB2 H 8.500 -0.741 -1.320 1.00 . A A . 13 LEU HB2 1 1 1 171 1 1 13 LEU HB3 H 8.922 -1.778 0.044 1.00 . A A . 13 LEU HB3 1 1 1 172 1 1 13 LEU HD11 H 6.683 -2.935 -3.062 1.00 . A A . 13 LEU HD11 1 1 1 173 1 1 13 LEU HD12 H 7.436 -1.350 -2.886 1.00 . A A . 13 LEU HD12 1 1 1 174 1 1 13 LEU HD13 H 5.755 -1.585 -2.406 1.00 . A A . 13 LEU HD13 1 1 1 175 1 1 13 LEU HD21 H 7.427 -4.476 -0.488 1.00 . A A . 13 LEU HD21 1 1 1 176 1 1 13 LEU HD22 H 8.943 -3.600 -0.693 1.00 . A A . 13 LEU HD22 1 1 1 177 1 1 13 LEU HD23 H 8.009 -4.090 -2.107 1.00 . A A . 13 LEU HD23 1 1 1 178 1 1 13 LEU HG H 6.322 -2.515 -0.399 1.00 . A A . 13 LEU HG 1 1 1 179 1 1 13 LEU N N 8.045 0.865 0.634 1.00 . A A . 13 LEU N 1 1 1 180 1 1 13 LEU O O 6.225 -1.881 1.985 1.00 . A A . 13 LEU O 1 1 1 181 1 1 14 TYR C C 6.650 -0.852 4.790 1.00 . A A . 14 TYR C 1 1 1 182 1 1 14 TYR CA C 7.859 -1.448 4.071 1.00 . A A . 14 TYR CA 1 1 1 183 1 1 14 TYR CB C 9.122 -1.196 4.895 1.00 . A A . 14 TYR CB 1 1 1 184 1 1 14 TYR CD1 C 9.682 -3.638 5.498 1.00 . A A . 14 TYR CD1 1 1 1 185 1 1 14 TYR CD2 C 9.026 -2.132 7.294 1.00 . A A . 14 TYR CD2 1 1 1 186 1 1 14 TYR CE1 C 9.820 -4.675 6.430 1.00 . A A . 14 TYR CE1 1 1 1 187 1 1 14 TYR CE2 C 9.168 -3.180 8.213 1.00 . A A . 14 TYR CE2 1 1 1 188 1 1 14 TYR CG C 9.284 -2.344 5.918 1.00 . A A . 14 TYR CG 1 1 1 189 1 1 14 TYR CZ C 9.565 -4.446 7.781 1.00 . A A . 14 TYR CZ 1 1 1 190 1 1 14 TYR H H 8.718 -0.177 2.560 1.00 . A A . 14 TYR H 1 1 1 191 1 1 14 TYR HA H 7.716 -2.512 3.949 1.00 . A A . 14 TYR HA 1 1 1 192 1 1 14 TYR HB2 H 9.980 -1.147 4.222 1.00 . A A . 14 TYR HB2 1 1 1 193 1 1 14 TYR HB3 H 9.029 -0.240 5.405 1.00 . A A . 14 TYR HB3 1 1 1 194 1 1 14 TYR HD1 H 9.880 -3.845 4.465 1.00 . A A . 14 TYR HD1 1 1 1 195 1 1 14 TYR HD2 H 8.713 -1.174 7.651 1.00 . A A . 14 TYR HD2 1 1 1 196 1 1 14 TYR HE1 H 10.124 -5.657 6.099 1.00 . A A . 14 TYR HE1 1 1 1 197 1 1 14 TYR HE2 H 8.971 -3.007 9.260 1.00 . A A . 14 TYR HE2 1 1 1 198 1 1 14 TYR HH H 10.622 -5.752 8.687 1.00 . A A . 14 TYR HH 1 1 1 199 1 1 14 TYR N N 7.992 -0.813 2.732 1.00 . A A . 14 TYR N 1 1 1 200 1 1 14 TYR O O 5.976 -1.521 5.548 1.00 . A A . 14 TYR O 1 1 1 201 1 1 14 TYR OH O 9.704 -5.473 8.693 1.00 . A A . 14 TYR OH 1 1 1 202 1 1 15 GLN C C 3.921 0.350 4.683 1.00 . A A . 15 GLN C 1 1 1 203 1 1 15 GLN CA C 5.182 1.018 5.216 1.00 . A A . 15 GLN CA 1 1 1 204 1 1 15 GLN CB C 5.144 2.519 4.914 1.00 . A A . 15 GLN CB 1 1 1 205 1 1 15 GLN CD C 4.963 2.993 7.362 1.00 . A A . 15 GLN CD 1 1 1 206 1 1 15 GLN CG C 5.751 3.294 6.086 1.00 . A A . 15 GLN CG 1 1 1 207 1 1 15 GLN H H 6.908 0.922 3.931 1.00 . A A . 15 GLN H 1 1 1 208 1 1 15 GLN HA H 5.243 0.859 6.283 1.00 . A A . 15 GLN HA 1 1 1 209 1 1 15 GLN HB2 H 5.712 2.720 4.017 1.00 . A A . 15 GLN HB2 1 1 1 210 1 1 15 GLN HB3 H 4.121 2.832 4.770 1.00 . A A . 15 GLN HB3 1 1 1 211 1 1 15 GLN HE21 H 3.195 3.114 6.467 1.00 . A A . 15 GLN HE21 1 1 1 212 1 1 15 GLN HE22 H 3.145 2.760 8.126 1.00 . A A . 15 GLN HE22 1 1 1 213 1 1 15 GLN HG2 H 6.782 2.996 6.219 1.00 . A A . 15 GLN HG2 1 1 1 214 1 1 15 GLN HG3 H 5.706 4.353 5.880 1.00 . A A . 15 GLN HG3 1 1 1 215 1 1 15 GLN N N 6.360 0.398 4.552 1.00 . A A . 15 GLN N 1 1 1 216 1 1 15 GLN NE2 N 3.659 2.953 7.314 1.00 . A A . 15 GLN NE2 1 1 1 217 1 1 15 GLN O O 2.968 0.132 5.405 1.00 . A A . 15 GLN O 1 1 1 218 1 1 15 GLN OE1 O 5.539 2.792 8.413 1.00 . A A . 15 GLN OE1 1 1 1 219 1 1 16 LEU C C 2.583 -2.043 3.531 1.00 . A A . 16 LEU C 1 1 1 220 1 1 16 LEU CA C 2.719 -0.679 2.867 1.00 . A A . 16 LEU CA 1 1 1 221 1 1 16 LEU CB C 2.892 -0.863 1.366 1.00 . A A . 16 LEU CB 1 1 1 222 1 1 16 LEU CD1 C 1.546 1.226 1.149 1.00 . A A . 16 LEU CD1 1 1 1 223 1 1 16 LEU CD2 C 4.036 1.327 0.980 1.00 . A A . 16 LEU CD2 1 1 1 224 1 1 16 LEU CG C 2.794 0.489 0.671 1.00 . A A . 16 LEU CG 1 1 1 225 1 1 16 LEU H H 4.695 0.164 2.862 1.00 . A A . 16 LEU H 1 1 1 226 1 1 16 LEU HA H 1.836 -0.090 3.065 1.00 . A A . 16 LEU HA 1 1 1 227 1 1 16 LEU HB2 H 3.857 -1.304 1.166 1.00 . A A . 16 LEU HB2 1 1 1 228 1 1 16 LEU HB3 H 2.114 -1.510 0.994 1.00 . A A . 16 LEU HB3 1 1 1 229 1 1 16 LEU HD11 H 0.692 0.571 1.069 1.00 . A A . 16 LEU HD11 1 1 1 230 1 1 16 LEU HD12 H 1.387 2.100 0.535 1.00 . A A . 16 LEU HD12 1 1 1 231 1 1 16 LEU HD13 H 1.676 1.527 2.177 1.00 . A A . 16 LEU HD13 1 1 1 232 1 1 16 LEU HD21 H 4.910 0.693 0.969 1.00 . A A . 16 LEU HD21 1 1 1 233 1 1 16 LEU HD22 H 3.932 1.779 1.956 1.00 . A A . 16 LEU HD22 1 1 1 234 1 1 16 LEU HD23 H 4.143 2.101 0.234 1.00 . A A . 16 LEU HD23 1 1 1 235 1 1 16 LEU HG H 2.725 0.325 -0.384 1.00 . A A . 16 LEU HG 1 1 1 236 1 1 16 LEU N N 3.912 -0.002 3.428 1.00 . A A . 16 LEU N 1 1 1 237 1 1 16 LEU O O 1.499 -2.516 3.792 1.00 . A A . 16 LEU O 1 1 1 238 1 1 17 GLU C C 2.628 -3.865 5.672 1.00 . A A . 17 GLU C 1 1 1 239 1 1 17 GLU CA C 3.595 -3.992 4.498 1.00 . A A . 17 GLU CA 1 1 1 240 1 1 17 GLU CB C 4.980 -4.396 5.004 1.00 . A A . 17 GLU CB 1 1 1 241 1 1 17 GLU CD C 5.925 -4.738 2.714 1.00 . A A . 17 GLU CD 1 1 1 242 1 1 17 GLU CG C 5.601 -5.415 4.046 1.00 . A A . 17 GLU CG 1 1 1 243 1 1 17 GLU H H 4.547 -2.275 3.628 1.00 . A A . 17 GLU H 1 1 1 244 1 1 17 GLU HA H 3.229 -4.733 3.802 1.00 . A A . 17 GLU HA 1 1 1 245 1 1 17 GLU HB2 H 5.611 -3.521 5.054 1.00 . A A . 17 GLU HB2 1 1 1 246 1 1 17 GLU HB3 H 4.891 -4.830 5.983 1.00 . A A . 17 GLU HB3 1 1 1 247 1 1 17 GLU HG2 H 6.508 -5.810 4.480 1.00 . A A . 17 GLU HG2 1 1 1 248 1 1 17 GLU HG3 H 4.903 -6.221 3.877 1.00 . A A . 17 GLU HG3 1 1 1 249 1 1 17 GLU N N 3.678 -2.674 3.828 1.00 . A A . 17 GLU N 1 1 1 250 1 1 17 GLU O O 1.872 -4.768 5.974 1.00 . A A . 17 GLU O 1 1 1 251 1 1 17 GLU OE1 O 5.050 -4.077 2.179 1.00 . A A . 17 GLU OE1 1 1 1 252 1 1 17 GLU OE2 O 7.043 -4.892 2.251 1.00 . A A . 17 GLU OE2 1 1 1 253 1 1 18 ASN C C 0.288 -2.310 6.946 1.00 . A A . 18 ASN C 1 1 1 254 1 1 18 ASN CA C 1.706 -2.537 7.476 1.00 . A A . 18 ASN CA 1 1 1 255 1 1 18 ASN CB C 2.150 -1.318 8.286 1.00 . A A . 18 ASN CB 1 1 1 256 1 1 18 ASN CG C 1.335 -1.240 9.577 1.00 . A A . 18 ASN CG 1 1 1 257 1 1 18 ASN H H 3.249 -2.011 6.057 1.00 . A A . 18 ASN H 1 1 1 258 1 1 18 ASN HA H 1.720 -3.414 8.106 1.00 . A A . 18 ASN HA 1 1 1 259 1 1 18 ASN HB2 H 3.199 -1.408 8.526 1.00 . A A . 18 ASN HB2 1 1 1 260 1 1 18 ASN HB3 H 1.989 -0.422 7.706 1.00 . A A . 18 ASN HB3 1 1 1 261 1 1 18 ASN HD21 H 2.263 -2.778 10.420 1.00 . A A . 18 ASN HD21 1 1 1 262 1 1 18 ASN HD22 H 1.055 -2.053 11.366 1.00 . A A . 18 ASN HD22 1 1 1 263 1 1 18 ASN N N 2.636 -2.735 6.328 1.00 . A A . 18 ASN N 1 1 1 264 1 1 18 ASN ND2 N 1.571 -2.095 10.534 1.00 . A A . 18 ASN ND2 1 1 1 265 1 1 18 ASN O O -0.687 -2.502 7.645 1.00 . A A . 18 ASN O 1 1 1 266 1 1 18 ASN OD1 O 0.475 -0.393 9.717 1.00 . A A . 18 ASN OD1 1 1 1 267 1 1 19 TYR C C -1.987 -2.951 5.161 1.00 . A A . 19 TYR C 1 1 1 268 1 1 19 TYR CA C -1.179 -1.653 5.128 1.00 . A A . 19 TYR CA 1 1 1 269 1 1 19 TYR CB C -1.032 -1.175 3.677 1.00 . A A . 19 TYR CB 1 1 1 270 1 1 19 TYR CD1 C 0.284 0.816 4.721 1.00 . A A . 19 TYR CD1 1 1 1 271 1 1 19 TYR CD2 C -0.910 1.197 2.631 1.00 . A A . 19 TYR CD2 1 1 1 272 1 1 19 TYR CE1 C 0.712 2.147 4.703 1.00 . A A . 19 TYR CE1 1 1 1 273 1 1 19 TYR CE2 C -0.468 2.524 2.634 1.00 . A A . 19 TYR CE2 1 1 1 274 1 1 19 TYR CG C -0.543 0.308 3.674 1.00 . A A . 19 TYR CG 1 1 1 275 1 1 19 TYR CZ C 0.339 2.996 3.666 1.00 . A A . 19 TYR CZ 1 1 1 276 1 1 19 TYR H H 0.969 -1.749 5.171 1.00 . A A . 19 TYR H 1 1 1 277 1 1 19 TYR HA H -1.690 -0.896 5.706 1.00 . A A . 19 TYR HA 1 1 1 278 1 1 19 TYR HB2 H -0.316 -1.831 3.160 1.00 . A A . 19 TYR HB2 1 1 1 279 1 1 19 TYR HB3 H -2.002 -1.260 3.175 1.00 . A A . 19 TYR HB3 1 1 1 280 1 1 19 TYR HD1 H 0.590 0.201 5.541 1.00 . A A . 19 TYR HD1 1 1 1 281 1 1 19 TYR HD2 H -1.528 0.874 1.830 1.00 . A A . 19 TYR HD2 1 1 1 282 1 1 19 TYR HE1 H 1.338 2.516 5.499 1.00 . A A . 19 TYR HE1 1 1 1 283 1 1 19 TYR HE2 H -0.756 3.185 1.830 1.00 . A A . 19 TYR HE2 1 1 1 284 1 1 19 TYR HH H 1.487 4.385 4.293 1.00 . A A . 19 TYR HH 1 1 1 285 1 1 19 TYR N N 0.169 -1.898 5.713 1.00 . A A . 19 TYR N 1 1 1 286 1 1 19 TYR O O -3.199 -2.943 5.073 1.00 . A A . 19 TYR O 1 1 1 287 1 1 19 TYR OH O 0.766 4.307 3.664 1.00 . A A . 19 TYR OH 1 1 1 288 1 1 20 CYS C C -2.245 -5.796 6.784 1.00 . A A . 20 CYS C 1 1 1 289 1 1 20 CYS CA C -2.055 -5.365 5.329 1.00 . A A . 20 CYS CA 1 1 1 290 1 1 20 CYS CB C -1.248 -6.426 4.581 1.00 . A A . 20 CYS CB 1 1 1 291 1 1 20 CYS H H -0.347 -4.054 5.359 1.00 . A A . 20 CYS H 1 1 1 292 1 1 20 CYS HA H -3.020 -5.249 4.859 1.00 . A A . 20 CYS HA 1 1 1 293 1 1 20 CYS HB2 H -0.379 -6.694 5.164 1.00 . A A . 20 CYS HB2 1 1 1 294 1 1 20 CYS HB3 H -1.860 -7.301 4.424 1.00 . A A . 20 CYS HB3 1 1 1 295 1 1 20 CYS N N -1.324 -4.068 5.289 1.00 . A A . 20 CYS N 1 1 1 296 1 1 20 CYS O O -1.915 -6.902 7.162 1.00 . A A . 20 CYS O 1 1 1 297 1 1 20 CYS SG S -0.722 -5.761 2.983 1.00 . A A . 20 CYS SG 1 1 1 298 1 1 21 ASN C C -4.462 -5.609 9.267 1.00 . A A . 21 ASN C 1 1 1 299 1 1 21 ASN CA C -2.985 -5.287 9.033 1.00 . A A . 21 ASN CA 1 1 1 300 1 1 21 ASN CB C -2.572 -4.109 9.917 1.00 . A A . 21 ASN CB 1 1 1 301 1 1 21 ASN CG C -2.081 -4.631 11.269 1.00 . A A . 21 ASN CG 1 1 1 302 1 1 21 ASN H H -3.033 -4.042 7.277 1.00 . A A . 21 ASN H 1 1 1 303 1 1 21 ASN HA H -2.384 -6.150 9.280 1.00 . A A . 21 ASN HA 1 1 1 304 1 1 21 ASN HB2 H -1.778 -3.558 9.434 1.00 . A A . 21 ASN HB2 1 1 1 305 1 1 21 ASN HB3 H -3.420 -3.460 10.071 1.00 . A A . 21 ASN HB3 1 1 1 306 1 1 21 ASN HD21 H -3.202 -6.269 11.202 1.00 . A A . 21 ASN HD21 1 1 1 307 1 1 21 ASN HD22 H -2.238 -6.105 12.590 1.00 . A A . 21 ASN HD22 1 1 1 308 1 1 21 ASN N N -2.775 -4.929 7.602 1.00 . A A . 21 ASN N 1 1 1 309 1 1 21 ASN ND2 N -2.546 -5.762 11.725 1.00 . A A . 21 ASN ND2 1 1 1 310 1 1 21 ASN O O -5.280 -4.727 9.061 1.00 . A A . 21 ASN O 1 1 1 311 1 1 21 ASN OXT O -4.751 -6.731 9.649 1.00 . A A . 21 ASN OXT 1 1 1 312 1 1 21 ASN OD1 O -1.268 -4.003 11.917 1.00 . A A . 21 ASN OD1 1 1 1 313 2 2 1 PHE C C 10.453 1.214 -3.387 1.00 . B B . 22 PHE C 1 1 1 314 2 2 1 PHE CA C 11.293 -0.016 -3.750 1.00 . B B . 22 PHE CA 1 1 1 315 2 2 1 PHE CB C 11.155 -0.305 -5.248 1.00 . B B . 22 PHE CB 1 1 1 316 2 2 1 PHE CD1 C 8.768 0.216 -5.873 1.00 . B B . 22 PHE CD1 1 1 1 317 2 2 1 PHE CD2 C 9.405 -2.101 -5.528 1.00 . B B . 22 PHE CD2 1 1 1 318 2 2 1 PHE CE1 C 7.458 -0.188 -6.163 1.00 . B B . 22 PHE CE1 1 1 1 319 2 2 1 PHE CE2 C 8.095 -2.504 -5.817 1.00 . B B . 22 PHE CE2 1 1 1 320 2 2 1 PHE CG C 9.742 -0.740 -5.555 1.00 . B B . 22 PHE CG 1 1 1 321 2 2 1 PHE CZ C 7.121 -1.548 -6.134 1.00 . B B . 22 PHE CZ 1 1 1 322 2 2 1 PHE H1 H 10.897 -0.993 -1.954 1.00 . B B . 22 PHE H1 1 1 1 323 2 2 1 PHE H2 H 11.398 -2.024 -3.208 1.00 . B B . 22 PHE H2 1 1 1 324 2 2 1 PHE H3 H 9.823 -1.387 -3.206 1.00 . B B . 22 PHE H3 1 1 1 325 2 2 1 PHE HA H 12.330 0.175 -3.515 1.00 . B B . 22 PHE HA 1 1 1 326 2 2 1 PHE HB2 H 11.386 0.589 -5.809 1.00 . B B . 22 PHE HB2 1 1 1 327 2 2 1 PHE HB3 H 11.841 -1.091 -5.527 1.00 . B B . 22 PHE HB3 1 1 1 328 2 2 1 PHE HD1 H 9.028 1.264 -5.894 1.00 . B B . 22 PHE HD1 1 1 1 329 2 2 1 PHE HD2 H 10.155 -2.838 -5.283 1.00 . B B . 22 PHE HD2 1 1 1 330 2 2 1 PHE HE1 H 6.708 0.550 -6.407 1.00 . B B . 22 PHE HE1 1 1 1 331 2 2 1 PHE HE2 H 7.835 -3.552 -5.795 1.00 . B B . 22 PHE HE2 1 1 1 332 2 2 1 PHE HZ H 6.111 -1.858 -6.358 1.00 . B B . 22 PHE HZ 1 1 1 333 2 2 1 PHE N N 10.817 -1.194 -2.971 1.00 . B B . 22 PHE N 1 1 1 334 2 2 1 PHE O O 9.239 1.180 -3.421 1.00 . B B . 22 PHE O 1 1 1 335 2 2 2 VAL C C 10.611 4.617 -3.730 1.00 . B B . 23 VAL C 1 1 1 336 2 2 2 VAL CA C 10.331 3.534 -2.682 1.00 . B B . 23 VAL CA 1 1 1 337 2 2 2 VAL CB C 10.772 4.012 -1.287 1.00 . B B . 23 VAL CB 1 1 1 338 2 2 2 VAL CG1 C 12.125 4.711 -1.377 1.00 . B B . 23 VAL CG1 1 1 1 339 2 2 2 VAL CG2 C 9.742 4.978 -0.686 1.00 . B B . 23 VAL CG2 1 1 1 340 2 2 2 VAL H H 12.071 2.308 -3.024 1.00 . B B . 23 VAL H 1 1 1 341 2 2 2 VAL HA H 9.274 3.312 -2.669 1.00 . B B . 23 VAL HA 1 1 1 342 2 2 2 VAL HB H 10.863 3.160 -0.646 1.00 . B B . 23 VAL HB 1 1 1 343 2 2 2 VAL HG11 H 12.003 5.760 -1.150 1.00 . B B . 23 VAL HG11 1 1 1 344 2 2 2 VAL HG12 H 12.521 4.600 -2.374 1.00 . B B . 23 VAL HG12 1 1 1 345 2 2 2 VAL HG13 H 12.805 4.266 -0.665 1.00 . B B . 23 VAL HG13 1 1 1 346 2 2 2 VAL HG21 H 10.057 5.996 -0.865 1.00 . B B . 23 VAL HG21 1 1 1 347 2 2 2 VAL HG22 H 9.670 4.813 0.377 1.00 . B B . 23 VAL HG22 1 1 1 348 2 2 2 VAL HG23 H 8.779 4.812 -1.145 1.00 . B B . 23 VAL HG23 1 1 1 349 2 2 2 VAL N N 11.091 2.301 -3.043 1.00 . B B . 23 VAL N 1 1 1 350 2 2 2 VAL O O 11.199 4.358 -4.760 1.00 . B B . 23 VAL O 1 1 1 351 2 2 3 ASN C C 9.309 6.909 -5.506 1.00 . B B . 24 ASN C 1 1 1 352 2 2 3 ASN CA C 10.395 6.943 -4.429 1.00 . B B . 24 ASN CA 1 1 1 353 2 2 3 ASN CB C 11.778 6.838 -5.078 1.00 . B B . 24 ASN CB 1 1 1 354 2 2 3 ASN CG C 12.829 6.566 -3.999 1.00 . B B . 24 ASN CG 1 1 1 355 2 2 3 ASN H H 9.708 5.980 -2.640 1.00 . B B . 24 ASN H 1 1 1 356 2 2 3 ASN HA H 10.327 7.878 -3.891 1.00 . B B . 24 ASN HA 1 1 1 357 2 2 3 ASN HB2 H 11.780 6.036 -5.801 1.00 . B B . 24 ASN HB2 1 1 1 358 2 2 3 ASN HB3 H 12.010 7.768 -5.575 1.00 . B B . 24 ASN HB3 1 1 1 359 2 2 3 ASN HD21 H 13.453 4.872 -4.826 1.00 . B B . 24 ASN HD21 1 1 1 360 2 2 3 ASN HD22 H 14.247 5.315 -3.392 1.00 . B B . 24 ASN HD22 1 1 1 361 2 2 3 ASN N N 10.182 5.818 -3.471 1.00 . B B . 24 ASN N 1 1 1 362 2 2 3 ASN ND2 N 13.571 5.495 -4.080 1.00 . B B . 24 ASN ND2 1 1 1 363 2 2 3 ASN O O 9.548 7.218 -6.656 1.00 . B B . 24 ASN O 1 1 1 364 2 2 3 ASN OD1 O 12.979 7.339 -3.073 1.00 . B B . 24 ASN OD1 1 1 1 365 2 2 4 GLN C C 5.720 7.010 -5.439 1.00 . B B . 25 GLN C 1 1 1 366 2 2 4 GLN CA C 6.993 6.499 -6.119 1.00 . B B . 25 GLN CA 1 1 1 367 2 2 4 GLN CB C 6.786 5.058 -6.594 1.00 . B B . 25 GLN CB 1 1 1 368 2 2 4 GLN CD C 7.081 3.481 -8.507 1.00 . B B . 25 GLN CD 1 1 1 369 2 2 4 GLN CG C 7.217 4.936 -8.057 1.00 . B B . 25 GLN CG 1 1 1 370 2 2 4 GLN H H 7.944 6.310 -4.197 1.00 . B B . 25 GLN H 1 1 1 371 2 2 4 GLN HA H 7.230 7.129 -6.963 1.00 . B B . 25 GLN HA 1 1 1 372 2 2 4 GLN HB2 H 7.378 4.390 -5.986 1.00 . B B . 25 GLN HB2 1 1 1 373 2 2 4 GLN HB3 H 5.743 4.796 -6.505 1.00 . B B . 25 GLN HB3 1 1 1 374 2 2 4 GLN HE21 H 8.590 3.589 -9.793 1.00 . B B . 25 GLN HE21 1 1 1 375 2 2 4 GLN HE22 H 7.819 2.079 -9.704 1.00 . B B . 25 GLN HE22 1 1 1 376 2 2 4 GLN HG2 H 6.588 5.564 -8.671 1.00 . B B . 25 GLN HG2 1 1 1 377 2 2 4 GLN HG3 H 8.245 5.247 -8.157 1.00 . B B . 25 GLN HG3 1 1 1 378 2 2 4 GLN N N 8.111 6.545 -5.133 1.00 . B B . 25 GLN N 1 1 1 379 2 2 4 GLN NE2 N 7.897 3.011 -9.410 1.00 . B B . 25 GLN NE2 1 1 1 380 2 2 4 GLN O O 5.716 7.302 -4.260 1.00 . B B . 25 GLN O 1 1 1 381 2 2 4 GLN OE1 O 6.223 2.763 -8.033 1.00 . B B . 25 GLN OE1 1 1 1 382 2 2 5 HIS C C 2.220 6.733 -5.946 1.00 . B B . 26 HIS C 1 1 1 383 2 2 5 HIS CA C 3.387 7.632 -5.529 1.00 . B B . 26 HIS CA 1 1 1 384 2 2 5 HIS CB C 3.132 9.068 -5.988 1.00 . B B . 26 HIS CB 1 1 1 385 2 2 5 HIS CD2 C 1.832 10.935 -4.698 1.00 . B B . 26 HIS CD2 1 1 1 386 2 2 5 HIS CE1 C 2.715 10.589 -2.742 1.00 . B B . 26 HIS CE1 1 1 1 387 2 2 5 HIS CG C 2.713 9.896 -4.808 1.00 . B B . 26 HIS CG 1 1 1 388 2 2 5 HIS H H 4.652 6.896 -7.114 1.00 . B B . 26 HIS H 1 1 1 389 2 2 5 HIS HA H 3.492 7.610 -4.454 1.00 . B B . 26 HIS HA 1 1 1 390 2 2 5 HIS HB2 H 4.036 9.477 -6.414 1.00 . B B . 26 HIS HB2 1 1 1 391 2 2 5 HIS HB3 H 2.347 9.076 -6.729 1.00 . B B . 26 HIS HB3 1 1 1 392 2 2 5 HIS HD2 H 1.234 11.342 -5.500 1.00 . B B . 26 HIS HD2 1 1 1 393 2 2 5 HIS HE1 H 2.953 10.676 -1.692 1.00 . B B . 26 HIS HE1 1 1 1 394 2 2 5 HIS HE2 H 1.303 12.109 -3.013 1.00 . B B . 26 HIS HE2 1 1 1 395 2 2 5 HIS N N 4.639 7.130 -6.163 1.00 . B B . 26 HIS N 1 1 1 396 2 2 5 HIS ND1 N 3.264 9.685 -3.562 1.00 . B B . 26 HIS ND1 1 1 1 397 2 2 5 HIS NE2 N 1.832 11.376 -3.391 1.00 . B B . 26 HIS NE2 1 1 1 398 2 2 5 HIS O O 2.388 5.816 -6.726 1.00 . B B . 26 HIS O 1 1 1 399 2 2 6 LEU C C -1.450 6.777 -5.527 1.00 . B B . 27 LEU C 1 1 1 400 2 2 6 LEU CA C -0.108 6.089 -5.815 1.00 . B B . 27 LEU CA 1 1 1 401 2 2 6 LEU CB C -0.038 4.771 -5.032 1.00 . B B . 27 LEU CB 1 1 1 402 2 2 6 LEU CD1 C 0.449 6.119 -2.975 1.00 . B B . 27 LEU CD1 1 1 1 403 2 2 6 LEU CD2 C 0.784 3.648 -2.974 1.00 . B B . 27 LEU CD2 1 1 1 404 2 2 6 LEU CG C 0.881 4.916 -3.818 1.00 . B B . 27 LEU CG 1 1 1 405 2 2 6 LEU H H 0.912 7.701 -4.796 1.00 . B B . 27 LEU H 1 1 1 406 2 2 6 LEU HA H -0.045 5.873 -6.871 1.00 . B B . 27 LEU HA 1 1 1 407 2 2 6 LEU HB2 H -1.025 4.499 -4.695 1.00 . B B . 27 LEU HB2 1 1 1 408 2 2 6 LEU HB3 H 0.346 3.994 -5.677 1.00 . B B . 27 LEU HB3 1 1 1 409 2 2 6 LEU HD11 H 1.311 6.729 -2.751 1.00 . B B . 27 LEU HD11 1 1 1 410 2 2 6 LEU HD12 H 0.005 5.772 -2.054 1.00 . B B . 27 LEU HD12 1 1 1 411 2 2 6 LEU HD13 H -0.273 6.704 -3.524 1.00 . B B . 27 LEU HD13 1 1 1 412 2 2 6 LEU HD21 H 1.449 3.729 -2.129 1.00 . B B . 27 LEU HD21 1 1 1 413 2 2 6 LEU HD22 H 1.063 2.797 -3.576 1.00 . B B . 27 LEU HD22 1 1 1 414 2 2 6 LEU HD23 H -0.231 3.527 -2.626 1.00 . B B . 27 LEU HD23 1 1 1 415 2 2 6 LEU HG H 1.900 5.054 -4.149 1.00 . B B . 27 LEU HG 1 1 1 416 2 2 6 LEU N N 1.039 6.967 -5.432 1.00 . B B . 27 LEU N 1 1 1 417 2 2 6 LEU O O -1.512 7.963 -5.321 1.00 . B B . 27 LEU O 1 1 1 418 2 2 7 CYS C C -4.872 5.676 -6.130 1.00 . B B . 28 CYS C 1 1 1 419 2 2 7 CYS CA C -3.905 6.499 -5.284 1.00 . B B . 28 CYS CA 1 1 1 420 2 2 7 CYS CB C -4.085 7.991 -5.618 1.00 . B B . 28 CYS CB 1 1 1 421 2 2 7 CYS H H -2.389 5.049 -5.714 1.00 . B B . 28 CYS H 1 1 1 422 2 2 7 CYS HA H -4.143 6.342 -4.241 1.00 . B B . 28 CYS HA 1 1 1 423 2 2 7 CYS HB2 H -3.242 8.350 -6.183 1.00 . B B . 28 CYS HB2 1 1 1 424 2 2 7 CYS HB3 H -4.983 8.115 -6.205 1.00 . B B . 28 CYS HB3 1 1 1 425 2 2 7 CYS N N -2.510 6.001 -5.532 1.00 . B B . 28 CYS N 1 1 1 426 2 2 7 CYS O O -4.510 5.135 -7.155 1.00 . B B . 28 CYS O 1 1 1 427 2 2 7 CYS SG S -4.247 8.936 -4.074 1.00 . B B . 28 CYS SG 1 1 1 428 2 2 8 GLY C C -6.468 3.422 -6.859 1.00 . B B . 29 GLY C 1 1 1 429 2 2 8 GLY CA C -7.085 4.771 -6.482 1.00 . B B . 29 GLY CA 1 1 1 430 2 2 8 GLY H H -6.369 6.006 -4.871 1.00 . B B . 29 GLY H 1 1 1 431 2 2 8 GLY HA2 H -7.969 4.610 -5.881 1.00 . B B . 29 GLY HA2 1 1 1 432 2 2 8 GLY HA3 H -7.351 5.305 -7.381 1.00 . B B . 29 GLY HA3 1 1 1 433 2 2 8 GLY N N -6.098 5.568 -5.704 1.00 . B B . 29 GLY N 1 1 1 434 2 2 8 GLY O O -6.105 2.633 -6.008 1.00 . B B . 29 GLY O 1 1 1 435 2 2 9 SER C C -4.298 1.762 -8.128 1.00 . B B . 30 SER C 1 1 1 436 2 2 9 SER CA C -5.764 1.852 -8.564 1.00 . B B . 30 SER CA 1 1 1 437 2 2 9 SER CB C -5.849 1.743 -10.087 1.00 . B B . 30 SER CB 1 1 1 438 2 2 9 SER H H -6.650 3.801 -8.798 1.00 . B B . 30 SER H 1 1 1 439 2 2 9 SER HA H -6.321 1.042 -8.116 1.00 . B B . 30 SER HA 1 1 1 440 2 2 9 SER HB2 H -4.866 1.580 -10.495 1.00 . B B . 30 SER HB2 1 1 1 441 2 2 9 SER HB3 H -6.490 0.912 -10.352 1.00 . B B . 30 SER HB3 1 1 1 442 2 2 9 SER HG H -5.662 3.430 -11.037 1.00 . B B . 30 SER HG 1 1 1 443 2 2 9 SER N N -6.349 3.151 -8.129 1.00 . B B . 30 SER N 1 1 1 444 2 2 9 SER O O -3.890 0.801 -7.507 1.00 . B B . 30 SER O 1 1 1 445 2 2 9 SER OG O -6.379 2.952 -10.615 1.00 . B B . 30 SER OG 1 1 1 446 2 2 10 ASP C C -1.943 2.211 -6.611 1.00 . B B . 31 ASP C 1 1 1 447 2 2 10 ASP CA C -2.060 2.694 -8.055 1.00 . B B . 31 ASP CA 1 1 1 448 2 2 10 ASP CB C -1.430 4.083 -8.171 1.00 . B B . 31 ASP CB 1 1 1 449 2 2 10 ASP CG C -1.752 4.680 -9.542 1.00 . B B . 31 ASP CG 1 1 1 450 2 2 10 ASP H H -3.842 3.510 -8.959 1.00 . B B . 31 ASP H 1 1 1 451 2 2 10 ASP HA H -1.535 2.008 -8.704 1.00 . B B . 31 ASP HA 1 1 1 452 2 2 10 ASP HB2 H -1.824 4.722 -7.397 1.00 . B B . 31 ASP HB2 1 1 1 453 2 2 10 ASP HB3 H -0.359 4.002 -8.058 1.00 . B B . 31 ASP HB3 1 1 1 454 2 2 10 ASP N N -3.499 2.745 -8.452 1.00 . B B . 31 ASP N 1 1 1 455 2 2 10 ASP O O -1.053 1.457 -6.271 1.00 . B B . 31 ASP O 1 1 1 456 2 2 10 ASP OD1 O -1.987 3.911 -10.460 1.00 . B B . 31 ASP OD1 1 1 1 457 2 2 10 ASP OD2 O -1.758 5.895 -9.651 1.00 . B B . 31 ASP OD2 1 1 1 458 2 2 11 LEU C C -3.062 0.691 -4.274 1.00 . B B . 32 LEU C 1 1 1 459 2 2 11 LEU CA C -2.754 2.186 -4.339 1.00 . B B . 32 LEU CA 1 1 1 460 2 2 11 LEU CB C -3.764 2.967 -3.495 1.00 . B B . 32 LEU CB 1 1 1 461 2 2 11 LEU CD1 C -2.795 4.927 -2.286 1.00 . B B . 32 LEU CD1 1 1 1 462 2 2 11 LEU CD2 C -4.037 3.170 -1.021 1.00 . B B . 32 LEU CD2 1 1 1 463 2 2 11 LEU CG C -3.097 3.430 -2.199 1.00 . B B . 32 LEU CG 1 1 1 464 2 2 11 LEU H H -3.546 3.241 -6.043 1.00 . B B . 32 LEU H 1 1 1 465 2 2 11 LEU HA H -1.756 2.360 -3.964 1.00 . B B . 32 LEU HA 1 1 1 466 2 2 11 LEU HB2 H -4.106 3.828 -4.051 1.00 . B B . 32 LEU HB2 1 1 1 467 2 2 11 LEU HB3 H -4.605 2.333 -3.259 1.00 . B B . 32 LEU HB3 1 1 1 468 2 2 11 LEU HD11 H -2.849 5.245 -3.317 1.00 . B B . 32 LEU HD11 1 1 1 469 2 2 11 LEU HD12 H -1.805 5.118 -1.901 1.00 . B B . 32 LEU HD12 1 1 1 470 2 2 11 LEU HD13 H -3.521 5.474 -1.702 1.00 . B B . 32 LEU HD13 1 1 1 471 2 2 11 LEU HD21 H -3.985 3.998 -0.330 1.00 . B B . 32 LEU HD21 1 1 1 472 2 2 11 LEU HD22 H -3.741 2.261 -0.519 1.00 . B B . 32 LEU HD22 1 1 1 473 2 2 11 LEU HD23 H -5.049 3.067 -1.385 1.00 . B B . 32 LEU HD23 1 1 1 474 2 2 11 LEU HG H -2.175 2.885 -2.054 1.00 . B B . 32 LEU HG 1 1 1 475 2 2 11 LEU N N -2.831 2.634 -5.755 1.00 . B B . 32 LEU N 1 1 1 476 2 2 11 LEU O O -2.188 -0.120 -4.040 1.00 . B B . 32 LEU O 1 1 1 477 2 2 12 VAL C C -3.607 -1.900 -5.288 1.00 . B B . 33 VAL C 1 1 1 478 2 2 12 VAL CA C -4.631 -1.136 -4.451 1.00 . B B . 33 VAL CA 1 1 1 479 2 2 12 VAL CB C -6.027 -1.353 -5.034 1.00 . B B . 33 VAL CB 1 1 1 480 2 2 12 VAL CG1 C -7.047 -0.559 -4.222 1.00 . B B . 33 VAL CG1 1 1 1 481 2 2 12 VAL CG2 C -6.051 -0.874 -6.487 1.00 . B B . 33 VAL CG2 1 1 1 482 2 2 12 VAL H H -4.984 0.977 -4.688 1.00 . B B . 33 VAL H 1 1 1 483 2 2 12 VAL HA H -4.602 -1.488 -3.430 1.00 . B B . 33 VAL HA 1 1 1 484 2 2 12 VAL HB H -6.274 -2.404 -4.994 1.00 . B B . 33 VAL HB 1 1 1 485 2 2 12 VAL HG11 H -6.579 -0.190 -3.320 1.00 . B B . 33 VAL HG11 1 1 1 486 2 2 12 VAL HG12 H -7.876 -1.200 -3.962 1.00 . B B . 33 VAL HG12 1 1 1 487 2 2 12 VAL HG13 H -7.404 0.274 -4.809 1.00 . B B . 33 VAL HG13 1 1 1 488 2 2 12 VAL HG21 H -7.046 -0.991 -6.889 1.00 . B B . 33 VAL HG21 1 1 1 489 2 2 12 VAL HG22 H -5.356 -1.460 -7.070 1.00 . B B . 33 VAL HG22 1 1 1 490 2 2 12 VAL HG23 H -5.766 0.166 -6.528 1.00 . B B . 33 VAL HG23 1 1 1 491 2 2 12 VAL N N -4.291 0.313 -4.491 1.00 . B B . 33 VAL N 1 1 1 492 2 2 12 VAL O O -3.332 -3.059 -5.049 1.00 . B B . 33 VAL O 1 1 1 493 2 2 13 GLU C C -0.721 -2.056 -6.341 1.00 . B B . 34 GLU C 1 1 1 494 2 2 13 GLU CA C -2.027 -1.928 -7.121 1.00 . B B . 34 GLU CA 1 1 1 495 2 2 13 GLU CB C -1.792 -1.100 -8.385 1.00 . B B . 34 GLU CB 1 1 1 496 2 2 13 GLU CD C -2.430 -0.824 -10.785 1.00 . B B . 34 GLU CD 1 1 1 497 2 2 13 GLU CG C -2.578 -1.709 -9.547 1.00 . B B . 34 GLU CG 1 1 1 498 2 2 13 GLU H H -3.273 -0.317 -6.439 1.00 . B B . 34 GLU H 1 1 1 499 2 2 13 GLU HA H -2.382 -2.911 -7.393 1.00 . B B . 34 GLU HA 1 1 1 500 2 2 13 GLU HB2 H -2.123 -0.085 -8.217 1.00 . B B . 34 GLU HB2 1 1 1 501 2 2 13 GLU HB3 H -0.741 -1.101 -8.624 1.00 . B B . 34 GLU HB3 1 1 1 502 2 2 13 GLU HG2 H -2.195 -2.697 -9.761 1.00 . B B . 34 GLU HG2 1 1 1 503 2 2 13 GLU HG3 H -3.622 -1.778 -9.279 1.00 . B B . 34 GLU HG3 1 1 1 504 2 2 13 GLU N N -3.038 -1.252 -6.268 1.00 . B B . 34 GLU N 1 1 1 505 2 2 13 GLU O O -0.235 -3.143 -6.107 1.00 . B B . 34 GLU O 1 1 1 506 2 2 13 GLU OE1 O -1.449 -0.103 -10.860 1.00 . B B . 34 GLU OE1 1 1 1 507 2 2 13 GLU OE2 O -3.301 -0.881 -11.638 1.00 . B B . 34 GLU OE2 1 1 1 508 2 2 14 ALA C C 0.863 -1.874 -3.893 1.00 . B B . 35 ALA C 1 1 1 509 2 2 14 ALA CA C 1.114 -1.035 -5.146 1.00 . B B . 35 ALA CA 1 1 1 510 2 2 14 ALA CB C 1.557 0.373 -4.744 1.00 . B B . 35 ALA CB 1 1 1 511 2 2 14 ALA H H -0.565 -0.085 -6.107 1.00 . B B . 35 ALA H 1 1 1 512 2 2 14 ALA HA H 1.879 -1.501 -5.751 1.00 . B B . 35 ALA HA 1 1 1 513 2 2 14 ALA HB1 H 0.721 0.903 -4.311 1.00 . B B . 35 ALA HB1 1 1 1 514 2 2 14 ALA HB2 H 1.907 0.903 -5.617 1.00 . B B . 35 ALA HB2 1 1 1 515 2 2 14 ALA HB3 H 2.355 0.306 -4.019 1.00 . B B . 35 ALA HB3 1 1 1 516 2 2 14 ALA N N -0.154 -0.957 -5.922 1.00 . B B . 35 ALA N 1 1 1 517 2 2 14 ALA O O 1.662 -2.706 -3.513 1.00 . B B . 35 ALA O 1 1 1 518 2 2 15 LEU C C -0.658 -3.929 -2.396 1.00 . B B . 36 LEU C 1 1 1 519 2 2 15 LEU CA C -0.599 -2.444 -2.038 1.00 . B B . 36 LEU CA 1 1 1 520 2 2 15 LEU CB C -1.980 -2.002 -1.538 1.00 . B B . 36 LEU CB 1 1 1 521 2 2 15 LEU CD1 C -1.560 -1.202 0.785 1.00 . B B . 36 LEU CD1 1 1 1 522 2 2 15 LEU CD2 C -0.749 0.160 -1.150 1.00 . B B . 36 LEU CD2 1 1 1 523 2 2 15 LEU CG C -1.864 -0.763 -0.644 1.00 . B B . 36 LEU CG 1 1 1 524 2 2 15 LEU H H -0.888 -0.992 -3.598 1.00 . B B . 36 LEU H 1 1 1 525 2 2 15 LEU HA H 0.144 -2.273 -1.270 1.00 . B B . 36 LEU HA 1 1 1 526 2 2 15 LEU HB2 H -2.608 -1.772 -2.386 1.00 . B B . 36 LEU HB2 1 1 1 527 2 2 15 LEU HB3 H -2.426 -2.807 -0.973 1.00 . B B . 36 LEU HB3 1 1 1 528 2 2 15 LEU HD11 H -0.701 -0.663 1.154 1.00 . B B . 36 LEU HD11 1 1 1 529 2 2 15 LEU HD12 H -1.354 -2.262 0.799 1.00 . B B . 36 LEU HD12 1 1 1 530 2 2 15 LEU HD13 H -2.413 -0.992 1.410 1.00 . B B . 36 LEU HD13 1 1 1 531 2 2 15 LEU HD21 H -0.705 1.045 -0.532 1.00 . B B . 36 LEU HD21 1 1 1 532 2 2 15 LEU HD22 H -0.953 0.446 -2.171 1.00 . B B . 36 LEU HD22 1 1 1 533 2 2 15 LEU HD23 H 0.197 -0.359 -1.104 1.00 . B B . 36 LEU HD23 1 1 1 534 2 2 15 LEU HG H -2.805 -0.230 -0.657 1.00 . B B . 36 LEU HG 1 1 1 535 2 2 15 LEU N N -0.259 -1.663 -3.260 1.00 . B B . 36 LEU N 1 1 1 536 2 2 15 LEU O O -0.414 -4.794 -1.576 1.00 . B B . 36 LEU O 1 1 1 537 2 2 16 TYR C C 0.279 -6.182 -4.439 1.00 . B B . 37 TYR C 1 1 1 538 2 2 16 TYR CA C -1.102 -5.643 -4.056 1.00 . B B . 37 TYR CA 1 1 1 539 2 2 16 TYR CB C -2.036 -5.732 -5.265 1.00 . B B . 37 TYR CB 1 1 1 540 2 2 16 TYR CD1 C -0.980 -7.471 -6.848 1.00 . B B . 37 TYR CD1 1 1 1 541 2 2 16 TYR CD2 C -2.825 -8.182 -5.428 1.00 . B B . 37 TYR CD2 1 1 1 542 2 2 16 TYR CE1 C -0.901 -8.765 -7.378 1.00 . B B . 37 TYR CE1 1 1 1 543 2 2 16 TYR CE2 C -2.733 -9.471 -5.970 1.00 . B B . 37 TYR CE2 1 1 1 544 2 2 16 TYR CG C -1.948 -7.157 -5.862 1.00 . B B . 37 TYR CG 1 1 1 545 2 2 16 TYR CZ C -1.776 -9.760 -6.942 1.00 . B B . 37 TYR CZ 1 1 1 546 2 2 16 TYR H H -1.197 -3.501 -4.250 1.00 . B B . 37 TYR H 1 1 1 547 2 2 16 TYR HA H -1.507 -6.236 -3.249 1.00 . B B . 37 TYR HA 1 1 1 548 2 2 16 TYR HB2 H -3.054 -5.503 -4.943 1.00 . B B . 37 TYR HB2 1 1 1 549 2 2 16 TYR HB3 H -1.734 -4.990 -6.002 1.00 . B B . 37 TYR HB3 1 1 1 550 2 2 16 TYR HD1 H -0.290 -6.729 -7.196 1.00 . B B . 37 TYR HD1 1 1 1 551 2 2 16 TYR HD2 H -3.567 -7.990 -4.679 1.00 . B B . 37 TYR HD2 1 1 1 552 2 2 16 TYR HE1 H -0.161 -8.992 -8.131 1.00 . B B . 37 TYR HE1 1 1 1 553 2 2 16 TYR HE2 H -3.406 -10.245 -5.632 1.00 . B B . 37 TYR HE2 1 1 1 554 2 2 16 TYR HH H -0.908 -11.071 -8.026 1.00 . B B . 37 TYR HH 1 1 1 555 2 2 16 TYR N N -0.998 -4.222 -3.619 1.00 . B B . 37 TYR N 1 1 1 556 2 2 16 TYR O O 0.467 -7.374 -4.582 1.00 . B B . 37 TYR O 1 1 1 557 2 2 16 TYR OH O -1.691 -11.032 -7.471 1.00 . B B . 37 TYR OH 1 1 1 558 2 2 17 LEU C C 3.394 -6.086 -3.685 1.00 . B B . 38 LEU C 1 1 1 559 2 2 17 LEU CA C 2.612 -5.811 -4.964 1.00 . B B . 38 LEU CA 1 1 1 560 2 2 17 LEU CB C 3.371 -4.763 -5.788 1.00 . B B . 38 LEU CB 1 1 1 561 2 2 17 LEU CD1 C 3.173 -2.753 -7.250 1.00 . B B . 38 LEU CD1 1 1 1 562 2 2 17 LEU CD2 C 1.468 -4.567 -7.387 1.00 . B B . 38 LEU CD2 1 1 1 563 2 2 17 LEU CG C 2.393 -3.797 -6.449 1.00 . B B . 38 LEU CG 1 1 1 564 2 2 17 LEU H H 1.081 -4.369 -4.470 1.00 . B B . 38 LEU H 1 1 1 565 2 2 17 LEU HA H 2.524 -6.720 -5.535 1.00 . B B . 38 LEU HA 1 1 1 566 2 2 17 LEU HB2 H 4.035 -4.210 -5.139 1.00 . B B . 38 LEU HB2 1 1 1 567 2 2 17 LEU HB3 H 3.951 -5.260 -6.551 1.00 . B B . 38 LEU HB3 1 1 1 568 2 2 17 LEU HD11 H 3.955 -3.241 -7.812 1.00 . B B . 38 LEU HD11 1 1 1 569 2 2 17 LEU HD12 H 3.611 -2.033 -6.574 1.00 . B B . 38 LEU HD12 1 1 1 570 2 2 17 LEU HD13 H 2.504 -2.247 -7.930 1.00 . B B . 38 LEU HD13 1 1 1 571 2 2 17 LEU HD21 H 2.059 -5.113 -8.106 1.00 . B B . 38 LEU HD21 1 1 1 572 2 2 17 LEU HD22 H 0.822 -3.872 -7.903 1.00 . B B . 38 LEU HD22 1 1 1 573 2 2 17 LEU HD23 H 0.869 -5.257 -6.813 1.00 . B B . 38 LEU HD23 1 1 1 574 2 2 17 LEU HG H 1.812 -3.307 -5.690 1.00 . B B . 38 LEU HG 1 1 1 575 2 2 17 LEU N N 1.248 -5.324 -4.599 1.00 . B B . 38 LEU N 1 1 1 576 2 2 17 LEU O O 4.066 -7.089 -3.552 1.00 . B B . 38 LEU O 1 1 1 577 2 2 18 VAL C C 3.455 -6.583 -0.719 1.00 . B B . 39 VAL C 1 1 1 578 2 2 18 VAL CA C 4.040 -5.381 -1.464 1.00 . B B . 39 VAL CA 1 1 1 579 2 2 18 VAL CB C 3.898 -4.107 -0.622 1.00 . B B . 39 VAL CB 1 1 1 580 2 2 18 VAL CG1 C 4.003 -2.889 -1.541 1.00 . B B . 39 VAL CG1 1 1 1 581 2 2 18 VAL CG2 C 2.539 -4.089 0.084 1.00 . B B . 39 VAL CG2 1 1 1 582 2 2 18 VAL H H 2.760 -4.392 -2.876 1.00 . B B . 39 VAL H 1 1 1 583 2 2 18 VAL HA H 5.085 -5.560 -1.671 1.00 . B B . 39 VAL HA 1 1 1 584 2 2 18 VAL HB H 4.687 -4.070 0.111 1.00 . B B . 39 VAL HB 1 1 1 585 2 2 18 VAL HG11 H 4.472 -2.075 -1.009 1.00 . B B . 39 VAL HG11 1 1 1 586 2 2 18 VAL HG12 H 3.014 -2.590 -1.857 1.00 . B B . 39 VAL HG12 1 1 1 587 2 2 18 VAL HG13 H 4.596 -3.142 -2.408 1.00 . B B . 39 VAL HG13 1 1 1 588 2 2 18 VAL HG21 H 2.391 -5.021 0.608 1.00 . B B . 39 VAL HG21 1 1 1 589 2 2 18 VAL HG22 H 1.755 -3.957 -0.646 1.00 . B B . 39 VAL HG22 1 1 1 590 2 2 18 VAL HG23 H 2.515 -3.275 0.790 1.00 . B B . 39 VAL HG23 1 1 1 591 2 2 18 VAL N N 3.309 -5.192 -2.741 1.00 . B B . 39 VAL N 1 1 1 592 2 2 18 VAL O O 4.166 -7.347 -0.097 1.00 . B B . 39 VAL O 1 1 1 593 2 2 19 CYS C C 1.123 -8.964 -1.107 1.00 . B B . 40 CYS C 1 1 1 594 2 2 19 CYS CA C 1.528 -7.905 -0.081 1.00 . B B . 40 CYS CA 1 1 1 595 2 2 19 CYS CB C 0.286 -7.421 0.670 1.00 . B B . 40 CYS CB 1 1 1 596 2 2 19 CYS H H 1.609 -6.125 -1.290 1.00 . B B . 40 CYS H 1 1 1 597 2 2 19 CYS HA H 2.229 -8.332 0.620 1.00 . B B . 40 CYS HA 1 1 1 598 2 2 19 CYS HB2 H -0.106 -6.540 0.186 1.00 . B B . 40 CYS HB2 1 1 1 599 2 2 19 CYS HB3 H -0.463 -8.198 0.666 1.00 . B B . 40 CYS HB3 1 1 1 600 2 2 19 CYS N N 2.163 -6.754 -0.781 1.00 . B B . 40 CYS N 1 1 1 601 2 2 19 CYS O O 0.320 -9.834 -0.833 1.00 . B B . 40 CYS O 1 1 1 602 2 2 19 CYS SG S 0.733 -7.023 2.377 1.00 . B B . 40 CYS SG 1 1 1 603 2 2 20 GLY C C 1.608 -11.309 -2.810 1.00 . B B . 41 GLY C 1 1 1 604 2 2 20 GLY CA C 1.318 -9.900 -3.333 1.00 . B B . 41 GLY CA 1 1 1 605 2 2 20 GLY H H 2.317 -8.187 -2.492 1.00 . B B . 41 GLY H 1 1 1 606 2 2 20 GLY HA2 H 0.267 -9.813 -3.574 1.00 . B B . 41 GLY HA2 1 1 1 607 2 2 20 GLY HA3 H 1.907 -9.721 -4.219 1.00 . B B . 41 GLY HA3 1 1 1 608 2 2 20 GLY N N 1.672 -8.897 -2.290 1.00 . B B . 41 GLY N 1 1 1 609 2 2 20 GLY O O 0.743 -11.973 -2.274 1.00 . B B . 41 GLY O 1 1 1 610 2 2 21 GLU C C 2.810 -13.243 -0.987 1.00 . B B . 42 GLU C 1 1 1 611 2 2 21 GLU CA C 3.166 -13.132 -2.468 1.00 . B B . 42 GLU CA 1 1 1 612 2 2 21 GLU CB C 4.666 -13.373 -2.654 1.00 . B B . 42 GLU CB 1 1 1 613 2 2 21 GLU CD C 6.583 -14.835 -2.004 1.00 . B B . 42 GLU CD 1 1 1 614 2 2 21 GLU CG C 5.061 -14.687 -1.978 1.00 . B B . 42 GLU CG 1 1 1 615 2 2 21 GLU H H 3.504 -11.217 -3.391 1.00 . B B . 42 GLU H 1 1 1 616 2 2 21 GLU HA H 2.613 -13.868 -3.024 1.00 . B B . 42 GLU HA 1 1 1 617 2 2 21 GLU HB2 H 4.893 -13.427 -3.709 1.00 . B B . 42 GLU HB2 1 1 1 618 2 2 21 GLU HB3 H 5.220 -12.560 -2.208 1.00 . B B . 42 GLU HB3 1 1 1 619 2 2 21 GLU HG2 H 4.715 -14.683 -0.954 1.00 . B B . 42 GLU HG2 1 1 1 620 2 2 21 GLU HG3 H 4.611 -15.514 -2.507 1.00 . B B . 42 GLU HG3 1 1 1 621 2 2 21 GLU N N 2.820 -11.769 -2.958 1.00 . B B . 42 GLU N 1 1 1 622 2 2 21 GLU O O 1.722 -13.646 -0.625 1.00 . B B . 42 GLU O 1 1 1 623 2 2 21 GLU OE1 O 7.119 -15.053 -3.077 1.00 . B B . 42 GLU OE1 1 1 1 624 2 2 21 GLU OE2 O 7.187 -14.727 -0.949 1.00 . B B . 42 GLU OE2 1 1 1 625 2 2 22 ARG C C 2.081 -12.344 1.623 1.00 . B B . 43 ARG C 1 1 1 626 2 2 22 ARG CA C 3.449 -12.961 1.330 1.00 . B B . 43 ARG CA 1 1 1 627 2 2 22 ARG CB C 4.529 -12.185 2.085 1.00 . B B . 43 ARG CB 1 1 1 628 2 2 22 ARG CD C 5.364 -9.847 2.362 1.00 . B B . 43 ARG CD 1 1 1 629 2 2 22 ARG CG C 4.796 -10.861 1.368 1.00 . B B . 43 ARG CG 1 1 1 630 2 2 22 ARG CZ C 6.177 -10.510 4.544 1.00 . B B . 43 ARG CZ 1 1 1 631 2 2 22 ARG H H 4.588 -12.565 -0.453 1.00 . B B . 43 ARG H 1 1 1 632 2 2 22 ARG HA H 3.457 -13.993 1.648 1.00 . B B . 43 ARG HA 1 1 1 633 2 2 22 ARG HB2 H 4.193 -11.990 3.093 1.00 . B B . 43 ARG HB2 1 1 1 634 2 2 22 ARG HB3 H 5.438 -12.767 2.112 1.00 . B B . 43 ARG HB3 1 1 1 635 2 2 22 ARG HD2 H 5.855 -9.050 1.823 1.00 . B B . 43 ARG HD2 1 1 1 636 2 2 22 ARG HD3 H 4.562 -9.438 2.958 1.00 . B B . 43 ARG HD3 1 1 1 637 2 2 22 ARG HE H 7.124 -10.982 2.864 1.00 . B B . 43 ARG HE 1 1 1 638 2 2 22 ARG HG2 H 5.506 -11.021 0.569 1.00 . B B . 43 ARG HG2 1 1 1 639 2 2 22 ARG HG3 H 3.873 -10.480 0.957 1.00 . B B . 43 ARG HG3 1 1 1 640 2 2 22 ARG HH11 H 4.181 -10.629 4.432 1.00 . B B . 43 ARG HH11 1 1 1 641 2 2 22 ARG HH12 H 4.839 -10.559 6.033 1.00 . B B . 43 ARG HH12 1 1 1 642 2 2 22 ARG HH21 H 8.133 -10.393 4.956 1.00 . B B . 43 ARG HH21 1 1 1 643 2 2 22 ARG HH22 H 7.078 -10.424 6.330 1.00 . B B . 43 ARG HH22 1 1 1 644 2 2 22 ARG N N 3.722 -12.886 -0.132 1.00 . B B . 43 ARG N 1 1 1 645 2 2 22 ARG NE N 6.349 -10.525 3.251 1.00 . B B . 43 ARG NE 1 1 1 646 2 2 22 ARG NH1 N 4.972 -10.571 5.042 1.00 . B B . 43 ARG NH1 1 1 1 647 2 2 22 ARG NH2 N 7.210 -10.438 5.338 1.00 . B B . 43 ARG NH2 1 1 1 648 2 2 22 ARG O O 1.437 -11.795 0.751 1.00 . B B . 43 ARG O 1 1 1 649 2 2 23 GLY C C -0.795 -12.854 2.847 1.00 . B B . 44 GLY C 1 1 1 650 2 2 23 GLY CA C 0.302 -11.844 3.185 1.00 . B B . 44 GLY CA 1 1 1 651 2 2 23 GLY H H 2.163 -12.873 3.535 1.00 . B B . 44 GLY H 1 1 1 652 2 2 23 GLY HA2 H 0.271 -11.613 4.241 1.00 . B B . 44 GLY HA2 1 1 1 653 2 2 23 GLY HA3 H 0.147 -10.943 2.612 1.00 . B B . 44 GLY HA3 1 1 1 654 2 2 23 GLY N N 1.630 -12.427 2.844 1.00 . B B . 44 GLY N 1 1 1 655 2 2 23 GLY O O -1.141 -13.699 3.648 1.00 . B B . 44 GLY O 1 1 1 656 2 2 24 GLY C C -3.787 -13.085 1.485 1.00 . B B . 45 GLY C 1 1 1 657 2 2 24 GLY CA C -2.418 -13.737 1.283 1.00 . B B . 45 GLY CA 1 1 1 658 2 2 24 GLY H H -1.052 -12.089 1.032 1.00 . B B . 45 GLY H 1 1 1 659 2 2 24 GLY HA2 H -2.298 -14.014 0.245 1.00 . B B . 45 GLY HA2 1 1 1 660 2 2 24 GLY HA3 H -2.349 -14.619 1.901 1.00 . B B . 45 GLY HA3 1 1 1 661 2 2 24 GLY N N -1.345 -12.777 1.666 1.00 . B B . 45 GLY N 1 1 1 662 2 2 24 GLY O O -4.761 -13.748 1.782 1.00 . B B . 45 GLY O 1 1 1 663 2 2 25 PHE C C -5.098 -9.684 0.948 1.00 . B B . 46 PHE C 1 1 1 664 2 2 25 PHE CA C -5.181 -11.106 1.506 1.00 . B B . 46 PHE CA 1 1 1 665 2 2 25 PHE CB C -5.531 -11.048 2.995 1.00 . B B . 46 PHE CB 1 1 1 666 2 2 25 PHE CD1 C -7.942 -10.938 2.028 1.00 . B B . 46 PHE CD1 1 1 1 667 2 2 25 PHE CD2 C -7.680 -11.468 4.393 1.00 . B B . 46 PHE CD2 1 1 1 668 2 2 25 PHE CE1 C -9.331 -11.037 2.172 1.00 . B B . 46 PHE CE1 1 1 1 669 2 2 25 PHE CE2 C -9.072 -11.562 4.513 1.00 . B B . 46 PHE CE2 1 1 1 670 2 2 25 PHE CG C -7.081 -11.153 3.146 1.00 . B B . 46 PHE CG 1 1 1 671 2 2 25 PHE CZ C -9.893 -11.347 3.408 1.00 . B B . 46 PHE CZ 1 1 1 672 2 2 25 PHE H H -3.074 -11.276 1.082 1.00 . B B . 46 PHE H 1 1 1 673 2 2 25 PHE HA H -5.947 -11.653 0.978 1.00 . B B . 46 PHE HA 1 1 1 674 2 2 25 PHE HB2 H -5.021 -11.880 3.508 1.00 . B B . 46 PHE HB2 1 1 1 675 2 2 25 PHE HB3 H -5.163 -10.098 3.408 1.00 . B B . 46 PHE HB3 1 1 1 676 2 2 25 PHE HD1 H -7.549 -10.700 1.058 1.00 . B B . 46 PHE HD1 1 1 1 677 2 2 25 PHE HD2 H -7.085 -11.641 5.256 1.00 . B B . 46 PHE HD2 1 1 1 678 2 2 25 PHE HE1 H -9.972 -10.871 1.319 1.00 . B B . 46 PHE HE1 1 1 1 679 2 2 25 PHE HE2 H -9.513 -11.803 5.469 1.00 . B B . 46 PHE HE2 1 1 1 680 2 2 25 PHE HZ H -10.966 -11.422 3.510 1.00 . B B . 46 PHE HZ 1 1 1 681 2 2 25 PHE N N -3.871 -11.793 1.324 1.00 . B B . 46 PHE N 1 1 1 682 2 2 25 PHE O O -4.303 -9.391 0.078 1.00 . B B . 46 PHE O 1 1 1 683 2 2 26 TYR C C -6.194 -6.436 2.095 1.00 . B B . 47 TYR C 1 1 1 684 2 2 26 TYR CA C -5.898 -7.396 0.941 1.00 . B B . 47 TYR CA 1 1 1 685 2 2 26 TYR CB C -6.958 -7.235 -0.153 1.00 . B B . 47 TYR CB 1 1 1 686 2 2 26 TYR CD1 C -5.983 -4.877 -0.659 1.00 . B B . 47 TYR CD1 1 1 1 687 2 2 26 TYR CD2 C -8.406 -5.130 -0.617 1.00 . B B . 47 TYR CD2 1 1 1 688 2 2 26 TYR CE1 C -6.142 -3.518 -0.956 1.00 . B B . 47 TYR CE1 1 1 1 689 2 2 26 TYR CE2 C -8.542 -3.769 -0.914 1.00 . B B . 47 TYR CE2 1 1 1 690 2 2 26 TYR CG C -7.121 -5.718 -0.484 1.00 . B B . 47 TYR CG 1 1 1 691 2 2 26 TYR CZ C -7.415 -2.968 -1.084 1.00 . B B . 47 TYR CZ 1 1 1 692 2 2 26 TYR H H -6.555 -9.058 2.141 1.00 . B B . 47 TYR H 1 1 1 693 2 2 26 TYR HA H -4.927 -7.175 0.534 1.00 . B B . 47 TYR HA 1 1 1 694 2 2 26 TYR HB2 H -6.633 -7.804 -1.040 1.00 . B B . 47 TYR HB2 1 1 1 695 2 2 26 TYR HB3 H -7.905 -7.658 0.209 1.00 . B B . 47 TYR HB3 1 1 1 696 2 2 26 TYR HD1 H -4.987 -5.261 -0.564 1.00 . B B . 47 TYR HD1 1 1 1 697 2 2 26 TYR HD2 H -9.289 -5.710 -0.486 1.00 . B B . 47 TYR HD2 1 1 1 698 2 2 26 TYR HE1 H -5.272 -2.892 -1.087 1.00 . B B . 47 TYR HE1 1 1 1 699 2 2 26 TYR HE2 H -9.527 -3.337 -1.014 1.00 . B B . 47 TYR HE2 1 1 1 700 2 2 26 TYR HH H -7.653 -1.152 -0.547 1.00 . B B . 47 TYR HH 1 1 1 701 2 2 26 TYR N N -5.921 -8.799 1.442 1.00 . B B . 47 TYR N 1 1 1 702 2 2 26 TYR O O -5.308 -6.030 2.821 1.00 . B B . 47 TYR O 1 1 1 703 2 2 26 TYR OH O -7.560 -1.628 -1.376 1.00 . B B . 47 TYR OH 1 1 1 704 2 2 27 THR C C -9.304 -5.074 3.526 1.00 . B B . 48 THR C 1 1 1 705 2 2 27 THR CA C -7.786 -5.138 3.377 1.00 . B B . 48 THR CA 1 1 1 706 2 2 27 THR CB C -7.247 -3.741 3.062 1.00 . B B . 48 THR CB 1 1 1 707 2 2 27 THR CG2 C -7.803 -2.739 4.074 1.00 . B B . 48 THR CG2 1 1 1 708 2 2 27 THR H H -8.127 -6.413 1.674 1.00 . B B . 48 THR H 1 1 1 709 2 2 27 THR HA H -7.353 -5.492 4.295 1.00 . B B . 48 THR HA 1 1 1 710 2 2 27 THR HB H -7.554 -3.452 2.069 1.00 . B B . 48 THR HB 1 1 1 711 2 2 27 THR HG1 H -5.569 -4.435 3.760 1.00 . B B . 48 THR HG1 1 1 1 712 2 2 27 THR HG21 H -7.392 -2.948 5.050 1.00 . B B . 48 THR HG21 1 1 1 713 2 2 27 THR HG22 H -8.880 -2.825 4.111 1.00 . B B . 48 THR HG22 1 1 1 714 2 2 27 THR HG23 H -7.532 -1.738 3.775 1.00 . B B . 48 THR HG23 1 1 1 715 2 2 27 THR N N -7.431 -6.072 2.270 1.00 . B B . 48 THR N 1 1 1 716 2 2 27 THR O O -9.830 -4.963 4.616 1.00 . B B . 48 THR O 1 1 1 717 2 2 27 THR OG1 O -5.828 -3.754 3.135 1.00 . B B . 48 THR OG1 1 1 1 718 2 2 28 LYS C C -11.932 -3.679 2.923 1.00 . B B . 49 LYS C 1 1 1 719 2 2 28 LYS CA C -11.496 -5.086 2.503 1.00 . B B . 49 LYS CA 1 1 1 720 2 2 28 LYS CB C -12.000 -6.103 3.528 1.00 . B B . 49 LYS CB 1 1 1 721 2 2 28 LYS CD C -13.953 -7.525 4.169 1.00 . B B . 49 LYS CD 1 1 1 722 2 2 28 LYS CE C -15.176 -8.272 3.633 1.00 . B B . 49 LYS CE 1 1 1 723 2 2 28 LYS CG C -13.318 -6.709 3.041 1.00 . B B . 49 LYS CG 1 1 1 724 2 2 28 LYS H H -9.559 -5.232 1.574 1.00 . B B . 49 LYS H 1 1 1 725 2 2 28 LYS HA H -11.909 -5.317 1.532 1.00 . B B . 49 LYS HA 1 1 1 726 2 2 28 LYS HB2 H -11.265 -6.887 3.648 1.00 . B B . 49 LYS HB2 1 1 1 727 2 2 28 LYS HB3 H -12.159 -5.611 4.476 1.00 . B B . 49 LYS HB3 1 1 1 728 2 2 28 LYS HD2 H -13.233 -8.236 4.547 1.00 . B B . 49 LYS HD2 1 1 1 729 2 2 28 LYS HD3 H -14.259 -6.863 4.965 1.00 . B B . 49 LYS HD3 1 1 1 730 2 2 28 LYS HE2 H -15.840 -8.509 4.451 1.00 . B B . 49 LYS HE2 1 1 1 731 2 2 28 LYS HE3 H -15.693 -7.648 2.918 1.00 . B B . 49 LYS HE3 1 1 1 732 2 2 28 LYS HG2 H -13.991 -5.916 2.747 1.00 . B B . 49 LYS HG2 1 1 1 733 2 2 28 LYS HG3 H -13.128 -7.353 2.196 1.00 . B B . 49 LYS HG3 1 1 1 734 2 2 28 LYS HZ1 H -15.121 -10.348 3.482 1.00 . B B . 49 LYS HZ1 1 1 1 735 2 2 28 LYS HZ2 H -13.697 -9.579 2.967 1.00 . B B . 49 LYS HZ2 1 1 1 736 2 2 28 LYS HZ3 H -15.085 -9.546 1.988 1.00 . B B . 49 LYS HZ3 1 1 1 737 2 2 28 LYS N N -10.009 -5.143 2.436 1.00 . B B . 49 LYS N 1 1 1 738 2 2 28 LYS NZ N -14.737 -9.531 2.967 1.00 . B B . 49 LYS NZ 1 1 1 739 2 2 28 LYS O O -12.348 -3.470 4.045 1.00 . B B . 49 LYS O 1 1 1 740 2 2 29 PRO C C -13.715 -1.183 2.202 1.00 . B B . 50 PRO C 1 1 1 741 2 2 29 PRO CA C -12.193 -1.351 2.239 1.00 . B B . 50 PRO CA 1 1 1 742 2 2 29 PRO CB C -11.530 -0.601 1.081 1.00 . B B . 50 PRO CB 1 1 1 743 2 2 29 PRO CD C -11.316 -3.024 0.645 1.00 . B B . 50 PRO CD 1 1 1 744 2 2 29 PRO CG C -11.302 -1.644 -0.037 1.00 . B B . 50 PRO CG 1 1 1 745 2 2 29 PRO HA H -11.792 -1.010 3.174 1.00 . B B . 50 PRO HA 1 1 1 746 2 2 29 PRO HB2 H -12.182 0.189 0.730 1.00 . B B . 50 PRO HB2 1 1 1 747 2 2 29 PRO HB3 H -10.583 -0.191 1.395 1.00 . B B . 50 PRO HB3 1 1 1 748 2 2 29 PRO HD2 H -11.980 -3.696 0.122 1.00 . B B . 50 PRO HD2 1 1 1 749 2 2 29 PRO HD3 H -10.320 -3.432 0.696 1.00 . B B . 50 PRO HD3 1 1 1 750 2 2 29 PRO HG2 H -12.094 -1.580 -0.770 1.00 . B B . 50 PRO HG2 1 1 1 751 2 2 29 PRO HG3 H -10.345 -1.480 -0.508 1.00 . B B . 50 PRO HG3 1 1 1 752 2 2 29 PRO N N -11.822 -2.754 2.003 1.00 . B B . 50 PRO N 1 1 1 753 2 2 29 PRO O O -14.446 -2.115 1.931 1.00 . B B . 50 PRO O 1 1 1 754 2 2 30 THR C C -16.373 -0.917 3.186 1.00 . B B . 51 THR C 1 1 1 755 2 2 30 THR CA C -15.669 0.227 2.452 1.00 . B B . 51 THR CA 1 1 1 756 2 2 30 THR CB C -16.156 0.281 1.003 1.00 . B B . 51 THR CB 1 1 1 757 2 2 30 THR CG2 C -15.237 1.193 0.188 1.00 . B B . 51 THR CG2 1 1 1 758 2 2 30 THR H H -13.590 0.737 2.687 1.00 . B B . 51 THR H 1 1 1 759 2 2 30 THR HA H -15.894 1.162 2.943 1.00 . B B . 51 THR HA 1 1 1 760 2 2 30 THR HB H -17.161 0.673 0.976 1.00 . B B . 51 THR HB 1 1 1 761 2 2 30 THR HG1 H -17.052 -1.316 0.349 1.00 . B B . 51 THR HG1 1 1 1 762 2 2 30 THR HG21 H -14.238 0.783 0.181 1.00 . B B . 51 THR HG21 1 1 1 763 2 2 30 THR HG22 H -15.220 2.177 0.634 1.00 . B B . 51 THR HG22 1 1 1 764 2 2 30 THR HG23 H -15.605 1.264 -0.825 1.00 . B B . 51 THR HG23 1 1 1 765 2 2 30 THR N N -14.197 -0.001 2.472 1.00 . B B . 51 THR N 1 1 1 766 2 2 30 THR O O -17.005 -1.721 2.521 1.00 . B B . 51 THR O 1 1 1 767 2 2 30 THR OXT O -16.266 -0.969 4.401 1.00 . B B . 51 THR OXT 1 1 1 768 2 2 30 THR OG1 O -16.142 -1.027 0.450 1.00 . B B . 51 THR OG1 1 1 2 769 1 1 1 GLY C C -3.443 5.293 6.902 1.00 . A A . 1 GLY C 1 1 2 770 1 1 1 GLY CA C -4.283 5.946 7.947 1.00 . A A . 1 GLY CA 1 1 2 771 1 1 1 GLY H1 H -6.153 5.039 8.343 1.00 . A A . 1 GLY H1 1 1 2 772 1 1 1 GLY H2 H -5.314 5.511 9.742 1.00 . A A . 1 GLY H2 1 1 2 773 1 1 1 GLY H3 H -4.827 4.129 8.884 1.00 . A A . 1 GLY H3 1 1 2 774 1 1 1 GLY HA2 H -4.749 6.330 7.181 1.00 . A A . 1 GLY HA2 1 1 2 775 1 1 1 GLY HA3 H -3.825 6.754 8.654 1.00 . A A . 1 GLY HA3 1 1 2 776 1 1 1 GLY N N -5.219 5.088 8.797 1.00 . A A . 1 GLY N 1 1 2 777 1 1 1 GLY O O -2.259 5.544 6.797 1.00 . A A . 1 GLY O 1 1 2 778 1 1 2 ILE C C -3.049 4.719 3.864 1.00 . A A . 2 ILE C 1 1 2 779 1 1 2 ILE CA C -3.246 3.760 5.038 1.00 . A A . 2 ILE CA 1 1 2 780 1 1 2 ILE CB C -4.006 2.518 4.565 1.00 . A A . 2 ILE CB 1 1 2 781 1 1 2 ILE CD1 C -2.491 0.925 5.758 1.00 . A A . 2 ILE CD1 1 1 2 782 1 1 2 ILE CG1 C -3.931 1.430 5.640 1.00 . A A . 2 ILE CG1 1 1 2 783 1 1 2 ILE CG2 C -3.380 1.998 3.271 1.00 . A A . 2 ILE CG2 1 1 2 784 1 1 2 ILE H H -4.987 4.258 6.203 1.00 . A A . 2 ILE H 1 1 2 785 1 1 2 ILE HA H -2.284 3.467 5.430 1.00 . A A . 2 ILE HA 1 1 2 786 1 1 2 ILE HB H -5.039 2.777 4.385 1.00 . A A . 2 ILE HB 1 1 2 787 1 1 2 ILE HD11 H -1.856 1.728 6.102 1.00 . A A . 2 ILE HD11 1 1 2 788 1 1 2 ILE HD12 H -2.149 0.583 4.793 1.00 . A A . 2 ILE HD12 1 1 2 789 1 1 2 ILE HD13 H -2.453 0.109 6.464 1.00 . A A . 2 ILE HD13 1 1 2 790 1 1 2 ILE HG12 H -4.249 1.838 6.588 1.00 . A A . 2 ILE HG12 1 1 2 791 1 1 2 ILE HG13 H -4.577 0.609 5.366 1.00 . A A . 2 ILE HG13 1 1 2 792 1 1 2 ILE HG21 H -3.336 0.919 3.301 1.00 . A A . 2 ILE HG21 1 1 2 793 1 1 2 ILE HG22 H -2.383 2.397 3.167 1.00 . A A . 2 ILE HG22 1 1 2 794 1 1 2 ILE HG23 H -3.983 2.310 2.432 1.00 . A A . 2 ILE HG23 1 1 2 795 1 1 2 ILE N N -4.030 4.444 6.103 1.00 . A A . 2 ILE N 1 1 2 796 1 1 2 ILE O O -1.940 5.080 3.523 1.00 . A A . 2 ILE O 1 1 2 797 1 1 3 VAL C C -3.592 7.461 2.618 1.00 . A A . 3 VAL C 1 1 2 798 1 1 3 VAL CA C -3.990 6.079 2.095 1.00 . A A . 3 VAL CA 1 1 2 799 1 1 3 VAL CB C -5.329 6.167 1.355 1.00 . A A . 3 VAL CB 1 1 2 800 1 1 3 VAL CG1 C -5.937 4.770 1.239 1.00 . A A . 3 VAL CG1 1 1 2 801 1 1 3 VAL CG2 C -6.296 7.071 2.127 1.00 . A A . 3 VAL CG2 1 1 2 802 1 1 3 VAL H H -5.003 4.839 3.538 1.00 . A A . 3 VAL H 1 1 2 803 1 1 3 VAL HA H -3.229 5.718 1.419 1.00 . A A . 3 VAL HA 1 1 2 804 1 1 3 VAL HB H -5.166 6.572 0.366 1.00 . A A . 3 VAL HB 1 1 2 805 1 1 3 VAL HG11 H -6.082 4.527 0.198 1.00 . A A . 3 VAL HG11 1 1 2 806 1 1 3 VAL HG12 H -6.888 4.749 1.750 1.00 . A A . 3 VAL HG12 1 1 2 807 1 1 3 VAL HG13 H -5.271 4.049 1.689 1.00 . A A . 3 VAL HG13 1 1 2 808 1 1 3 VAL HG21 H -6.317 8.050 1.670 1.00 . A A . 3 VAL HG21 1 1 2 809 1 1 3 VAL HG22 H -5.965 7.160 3.152 1.00 . A A . 3 VAL HG22 1 1 2 810 1 1 3 VAL HG23 H -7.286 6.642 2.105 1.00 . A A . 3 VAL HG23 1 1 2 811 1 1 3 VAL N N -4.117 5.139 3.244 1.00 . A A . 3 VAL N 1 1 2 812 1 1 3 VAL O O -3.192 8.331 1.869 1.00 . A A . 3 VAL O 1 1 2 813 1 1 4 GLU C C -1.857 8.992 4.852 1.00 . A A . 4 GLU C 1 1 2 814 1 1 4 GLU CA C -3.341 8.987 4.481 1.00 . A A . 4 GLU CA 1 1 2 815 1 1 4 GLU CB C -4.185 9.235 5.732 1.00 . A A . 4 GLU CB 1 1 2 816 1 1 4 GLU CD C -6.466 8.987 6.725 1.00 . A A . 4 GLU CD 1 1 2 817 1 1 4 GLU CG C -5.576 8.627 5.534 1.00 . A A . 4 GLU CG 1 1 2 818 1 1 4 GLU H H -4.031 6.950 4.483 1.00 . A A . 4 GLU H 1 1 2 819 1 1 4 GLU HA H -3.534 9.765 3.757 1.00 . A A . 4 GLU HA 1 1 2 820 1 1 4 GLU HB2 H -3.707 8.777 6.586 1.00 . A A . 4 GLU HB2 1 1 2 821 1 1 4 GLU HB3 H -4.280 10.298 5.898 1.00 . A A . 4 GLU HB3 1 1 2 822 1 1 4 GLU HG2 H -6.014 9.016 4.626 1.00 . A A . 4 GLU HG2 1 1 2 823 1 1 4 GLU HG3 H -5.494 7.552 5.461 1.00 . A A . 4 GLU HG3 1 1 2 824 1 1 4 GLU N N -3.704 7.667 3.900 1.00 . A A . 4 GLU N 1 1 2 825 1 1 4 GLU O O -1.299 10.013 5.203 1.00 . A A . 4 GLU O 1 1 2 826 1 1 4 GLU OE1 O -6.503 10.153 7.080 1.00 . A A . 4 GLU OE1 1 1 2 827 1 1 4 GLU OE2 O -7.095 8.089 7.262 1.00 . A A . 4 GLU OE2 1 1 2 828 1 1 5 GLN C C 1.064 7.885 3.837 1.00 . A A . 5 GLN C 1 1 2 829 1 1 5 GLN CA C 0.236 7.805 5.120 1.00 . A A . 5 GLN CA 1 1 2 830 1 1 5 GLN CB C 0.543 6.489 5.839 1.00 . A A . 5 GLN CB 1 1 2 831 1 1 5 GLN CD C 1.743 6.884 7.996 1.00 . A A . 5 GLN CD 1 1 2 832 1 1 5 GLN CG C 0.372 6.677 7.348 1.00 . A A . 5 GLN CG 1 1 2 833 1 1 5 GLN H H -1.679 7.048 4.487 1.00 . A A . 5 GLN H 1 1 2 834 1 1 5 GLN HA H 0.485 8.635 5.764 1.00 . A A . 5 GLN HA 1 1 2 835 1 1 5 GLN HB2 H -0.134 5.722 5.491 1.00 . A A . 5 GLN HB2 1 1 2 836 1 1 5 GLN HB3 H 1.560 6.194 5.629 1.00 . A A . 5 GLN HB3 1 1 2 837 1 1 5 GLN HE21 H 2.152 4.943 8.082 1.00 . A A . 5 GLN HE21 1 1 2 838 1 1 5 GLN HE22 H 3.359 5.967 8.696 1.00 . A A . 5 GLN HE22 1 1 2 839 1 1 5 GLN HG2 H -0.250 7.540 7.536 1.00 . A A . 5 GLN HG2 1 1 2 840 1 1 5 GLN HG3 H -0.093 5.799 7.770 1.00 . A A . 5 GLN HG3 1 1 2 841 1 1 5 GLN N N -1.212 7.860 4.775 1.00 . A A . 5 GLN N 1 1 2 842 1 1 5 GLN NE2 N 2.479 5.845 8.282 1.00 . A A . 5 GLN NE2 1 1 2 843 1 1 5 GLN O O 1.966 8.690 3.718 1.00 . A A . 5 GLN O 1 1 2 844 1 1 5 GLN OE1 O 2.148 8.002 8.245 1.00 . A A . 5 GLN OE1 1 1 2 845 1 1 6 CYS C C 0.946 8.121 0.655 1.00 . A A . 6 CYS C 1 1 2 846 1 1 6 CYS CA C 1.541 7.080 1.605 1.00 . A A . 6 CYS CA 1 1 2 847 1 1 6 CYS CB C 1.486 5.703 0.940 1.00 . A A . 6 CYS CB 1 1 2 848 1 1 6 CYS H H 0.037 6.411 2.994 1.00 . A A . 6 CYS H 1 1 2 849 1 1 6 CYS HA H 2.569 7.335 1.815 1.00 . A A . 6 CYS HA 1 1 2 850 1 1 6 CYS HB2 H 0.500 5.281 1.066 1.00 . A A . 6 CYS HB2 1 1 2 851 1 1 6 CYS HB3 H 1.701 5.804 -0.113 1.00 . A A . 6 CYS HB3 1 1 2 852 1 1 6 CYS N N 0.767 7.054 2.877 1.00 . A A . 6 CYS N 1 1 2 853 1 1 6 CYS O O 1.544 9.138 0.387 1.00 . A A . 6 CYS O 1 1 2 854 1 1 6 CYS SG S 2.711 4.610 1.703 1.00 . A A . 6 CYS SG 1 1 2 855 1 1 7 CYS C C -0.630 10.283 -0.326 1.00 . A A . 7 CYS C 1 1 2 856 1 1 7 CYS CA C -0.840 8.844 -0.813 1.00 . A A . 7 CYS CA 1 1 2 857 1 1 7 CYS CB C -2.335 8.564 -0.936 1.00 . A A . 7 CYS CB 1 1 2 858 1 1 7 CYS H H -0.691 7.039 0.355 1.00 . A A . 7 CYS H 1 1 2 859 1 1 7 CYS HA H -0.380 8.731 -1.784 1.00 . A A . 7 CYS HA 1 1 2 860 1 1 7 CYS HB2 H -2.514 7.504 -0.819 1.00 . A A . 7 CYS HB2 1 1 2 861 1 1 7 CYS HB3 H -2.869 9.107 -0.170 1.00 . A A . 7 CYS HB3 1 1 2 862 1 1 7 CYS N N -0.223 7.871 0.134 1.00 . A A . 7 CYS N 1 1 2 863 1 1 7 CYS O O -0.628 11.212 -1.109 1.00 . A A . 7 CYS O 1 1 2 864 1 1 7 CYS SG S -2.904 9.101 -2.567 1.00 . A A . 7 CYS SG 1 1 2 865 1 1 8 THR C C 1.152 12.352 1.056 1.00 . A A . 8 THR C 1 1 2 866 1 1 8 THR CA C -0.248 11.872 1.457 1.00 . A A . 8 THR CA 1 1 2 867 1 1 8 THR CB C -0.393 11.893 2.985 1.00 . A A . 8 THR CB 1 1 2 868 1 1 8 THR CG2 C 0.893 11.385 3.645 1.00 . A A . 8 THR CG2 1 1 2 869 1 1 8 THR H H -0.461 9.729 1.576 1.00 . A A . 8 THR H 1 1 2 870 1 1 8 THR HA H -0.987 12.525 1.018 1.00 . A A . 8 THR HA 1 1 2 871 1 1 8 THR HB H -1.215 11.256 3.275 1.00 . A A . 8 THR HB 1 1 2 872 1 1 8 THR HG1 H -1.543 13.454 3.142 1.00 . A A . 8 THR HG1 1 1 2 873 1 1 8 THR HG21 H 1.584 12.207 3.765 1.00 . A A . 8 THR HG21 1 1 2 874 1 1 8 THR HG22 H 1.342 10.625 3.023 1.00 . A A . 8 THR HG22 1 1 2 875 1 1 8 THR HG23 H 0.660 10.967 4.613 1.00 . A A . 8 THR HG23 1 1 2 876 1 1 8 THR N N -0.455 10.484 0.952 1.00 . A A . 8 THR N 1 1 2 877 1 1 8 THR O O 1.398 13.532 0.903 1.00 . A A . 8 THR O 1 1 2 878 1 1 8 THR OG1 O -0.652 13.222 3.415 1.00 . A A . 8 THR OG1 1 1 2 879 1 1 9 SER C C 4.121 10.623 -0.183 1.00 . A A . 9 SER C 1 1 2 880 1 1 9 SER CA C 3.452 11.824 0.498 1.00 . A A . 9 SER CA 1 1 2 881 1 1 9 SER CB C 4.231 12.221 1.755 1.00 . A A . 9 SER CB 1 1 2 882 1 1 9 SER H H 1.842 10.495 1.017 1.00 . A A . 9 SER H 1 1 2 883 1 1 9 SER HA H 3.418 12.658 -0.189 1.00 . A A . 9 SER HA 1 1 2 884 1 1 9 SER HB2 H 4.026 11.519 2.545 1.00 . A A . 9 SER HB2 1 1 2 885 1 1 9 SER HB3 H 5.290 12.219 1.543 1.00 . A A . 9 SER HB3 1 1 2 886 1 1 9 SER HG H 4.080 14.142 1.482 1.00 . A A . 9 SER HG 1 1 2 887 1 1 9 SER N N 2.067 11.440 0.887 1.00 . A A . 9 SER N 1 1 2 888 1 1 9 SER O O 3.456 9.745 -0.690 1.00 . A A . 9 SER O 1 1 2 889 1 1 9 SER OG O 3.823 13.520 2.167 1.00 . A A . 9 SER OG 1 1 2 890 1 1 10 ILE C C 6.678 8.490 0.213 1.00 . A A . 10 ILE C 1 1 2 891 1 1 10 ILE CA C 6.082 9.402 -0.862 1.00 . A A . 10 ILE CA 1 1 2 892 1 1 10 ILE CB C 7.182 9.895 -1.800 1.00 . A A . 10 ILE CB 1 1 2 893 1 1 10 ILE CD1 C 5.590 10.961 -3.407 1.00 . A A . 10 ILE CD1 1 1 2 894 1 1 10 ILE CG1 C 6.748 11.216 -2.437 1.00 . A A . 10 ILE CG1 1 1 2 895 1 1 10 ILE CG2 C 7.410 8.858 -2.899 1.00 . A A . 10 ILE CG2 1 1 2 896 1 1 10 ILE H H 5.961 11.272 0.196 1.00 . A A . 10 ILE H 1 1 2 897 1 1 10 ILE HA H 5.348 8.849 -1.429 1.00 . A A . 10 ILE HA 1 1 2 898 1 1 10 ILE HB H 8.096 10.041 -1.243 1.00 . A A . 10 ILE HB 1 1 2 899 1 1 10 ILE HD11 H 5.902 10.257 -4.165 1.00 . A A . 10 ILE HD11 1 1 2 900 1 1 10 ILE HD12 H 5.302 11.890 -3.877 1.00 . A A . 10 ILE HD12 1 1 2 901 1 1 10 ILE HD13 H 4.749 10.556 -2.865 1.00 . A A . 10 ILE HD13 1 1 2 902 1 1 10 ILE HG12 H 6.428 11.899 -1.663 1.00 . A A . 10 ILE HG12 1 1 2 903 1 1 10 ILE HG13 H 7.578 11.647 -2.976 1.00 . A A . 10 ILE HG13 1 1 2 904 1 1 10 ILE HG21 H 6.573 8.175 -2.928 1.00 . A A . 10 ILE HG21 1 1 2 905 1 1 10 ILE HG22 H 8.316 8.309 -2.692 1.00 . A A . 10 ILE HG22 1 1 2 906 1 1 10 ILE HG23 H 7.500 9.357 -3.852 1.00 . A A . 10 ILE HG23 1 1 2 907 1 1 10 ILE N N 5.422 10.564 -0.208 1.00 . A A . 10 ILE N 1 1 2 908 1 1 10 ILE O O 7.570 8.874 0.944 1.00 . A A . 10 ILE O 1 1 2 909 1 1 11 CYS C C 7.725 5.391 0.702 1.00 . A A . 11 CYS C 1 1 2 910 1 1 11 CYS CA C 6.720 6.347 1.347 1.00 . A A . 11 CYS CA 1 1 2 911 1 1 11 CYS CB C 5.573 5.545 1.976 1.00 . A A . 11 CYS CB 1 1 2 912 1 1 11 CYS H H 5.466 7.000 -0.283 1.00 . A A . 11 CYS H 1 1 2 913 1 1 11 CYS HA H 7.219 6.918 2.118 1.00 . A A . 11 CYS HA 1 1 2 914 1 1 11 CYS HB2 H 5.977 4.686 2.490 1.00 . A A . 11 CYS HB2 1 1 2 915 1 1 11 CYS HB3 H 5.045 6.168 2.682 1.00 . A A . 11 CYS HB3 1 1 2 916 1 1 11 CYS N N 6.186 7.284 0.316 1.00 . A A . 11 CYS N 1 1 2 917 1 1 11 CYS O O 7.899 5.376 -0.501 1.00 . A A . 11 CYS O 1 1 2 918 1 1 11 CYS SG S 4.423 4.984 0.695 1.00 . A A . 11 CYS SG 1 1 2 919 1 1 12 SER C C 8.846 2.220 0.985 1.00 . A A . 12 SER C 1 1 2 920 1 1 12 SER CA C 9.395 3.648 0.927 1.00 . A A . 12 SER CA 1 1 2 921 1 1 12 SER CB C 10.688 3.730 1.740 1.00 . A A . 12 SER CB 1 1 2 922 1 1 12 SER H H 8.243 4.629 2.461 1.00 . A A . 12 SER H 1 1 2 923 1 1 12 SER HA H 9.600 3.913 -0.100 1.00 . A A . 12 SER HA 1 1 2 924 1 1 12 SER HB2 H 11.507 3.345 1.157 1.00 . A A . 12 SER HB2 1 1 2 925 1 1 12 SER HB3 H 10.885 4.763 1.996 1.00 . A A . 12 SER HB3 1 1 2 926 1 1 12 SER HG H 10.812 3.500 3.667 1.00 . A A . 12 SER HG 1 1 2 927 1 1 12 SER N N 8.395 4.597 1.494 1.00 . A A . 12 SER N 1 1 2 928 1 1 12 SER O O 8.062 1.877 1.848 1.00 . A A . 12 SER O 1 1 2 929 1 1 12 SER OG O 10.550 2.954 2.923 1.00 . A A . 12 SER OG 1 1 2 930 1 1 13 LEU C C 8.833 -0.596 1.487 1.00 . A A . 13 LEU C 1 1 2 931 1 1 13 LEU CA C 8.758 -0.023 0.071 1.00 . A A . 13 LEU CA 1 1 2 932 1 1 13 LEU CB C 9.621 -0.869 -0.865 1.00 . A A . 13 LEU CB 1 1 2 933 1 1 13 LEU CD1 C 8.360 -0.858 -3.021 1.00 . A A . 13 LEU CD1 1 1 2 934 1 1 13 LEU CD2 C 9.458 -2.955 -2.225 1.00 . A A . 13 LEU CD2 1 1 2 935 1 1 13 LEU CG C 8.719 -1.689 -1.787 1.00 . A A . 13 LEU CG 1 1 2 936 1 1 13 LEU H H 9.889 1.677 -0.616 1.00 . A A . 13 LEU H 1 1 2 937 1 1 13 LEU HA H 7.734 -0.041 -0.269 1.00 . A A . 13 LEU HA 1 1 2 938 1 1 13 LEU HB2 H 10.251 -0.222 -1.458 1.00 . A A . 13 LEU HB2 1 1 2 939 1 1 13 LEU HB3 H 10.237 -1.537 -0.282 1.00 . A A . 13 LEU HB3 1 1 2 940 1 1 13 LEU HD11 H 7.286 -0.808 -3.122 1.00 . A A . 13 LEU HD11 1 1 2 941 1 1 13 LEU HD12 H 8.784 -1.317 -3.901 1.00 . A A . 13 LEU HD12 1 1 2 942 1 1 13 LEU HD13 H 8.757 0.141 -2.909 1.00 . A A . 13 LEU HD13 1 1 2 943 1 1 13 LEU HD21 H 10.130 -2.717 -3.036 1.00 . A A . 13 LEU HD21 1 1 2 944 1 1 13 LEU HD22 H 8.743 -3.694 -2.554 1.00 . A A . 13 LEU HD22 1 1 2 945 1 1 13 LEU HD23 H 10.024 -3.347 -1.392 1.00 . A A . 13 LEU HD23 1 1 2 946 1 1 13 LEU HG H 7.816 -1.961 -1.259 1.00 . A A . 13 LEU HG 1 1 2 947 1 1 13 LEU N N 9.255 1.382 0.071 1.00 . A A . 13 LEU N 1 1 2 948 1 1 13 LEU O O 8.064 -1.460 1.857 1.00 . A A . 13 LEU O 1 1 2 949 1 1 14 TYR C C 8.557 -0.339 4.419 1.00 . A A . 14 TYR C 1 1 2 950 1 1 14 TYR CA C 9.858 -0.639 3.676 1.00 . A A . 14 TYR CA 1 1 2 951 1 1 14 TYR CB C 11.031 0.048 4.383 1.00 . A A . 14 TYR CB 1 1 2 952 1 1 14 TYR CD1 C 10.860 -1.536 6.415 1.00 . A A . 14 TYR CD1 1 1 2 953 1 1 14 TYR CD2 C 10.917 0.864 6.823 1.00 . A A . 14 TYR CD2 1 1 2 954 1 1 14 TYR CE1 C 10.774 -1.759 7.796 1.00 . A A . 14 TYR CE1 1 1 2 955 1 1 14 TYR CE2 C 10.829 0.623 8.199 1.00 . A A . 14 TYR CE2 1 1 2 956 1 1 14 TYR CG C 10.935 -0.213 5.906 1.00 . A A . 14 TYR CG 1 1 2 957 1 1 14 TYR CZ C 10.759 -0.683 8.684 1.00 . A A . 14 TYR CZ 1 1 2 958 1 1 14 TYR H H 10.355 0.582 1.972 1.00 . A A . 14 TYR H 1 1 2 959 1 1 14 TYR HA H 10.023 -1.707 3.653 1.00 . A A . 14 TYR HA 1 1 2 960 1 1 14 TYR HB2 H 11.964 -0.346 3.979 1.00 . A A . 14 TYR HB2 1 1 2 961 1 1 14 TYR HB3 H 10.991 1.116 4.178 1.00 . A A . 14 TYR HB3 1 1 2 962 1 1 14 TYR HD1 H 10.865 -2.383 5.756 1.00 . A A . 14 TYR HD1 1 1 2 963 1 1 14 TYR HD2 H 10.963 1.874 6.479 1.00 . A A . 14 TYR HD2 1 1 2 964 1 1 14 TYR HE1 H 10.717 -2.769 8.175 1.00 . A A . 14 TYR HE1 1 1 2 965 1 1 14 TYR HE2 H 10.817 1.453 8.889 1.00 . A A . 14 TYR HE2 1 1 2 966 1 1 14 TYR HH H 10.212 -1.741 10.175 1.00 . A A . 14 TYR HH 1 1 2 967 1 1 14 TYR N N 9.747 -0.120 2.285 1.00 . A A . 14 TYR N 1 1 2 968 1 1 14 TYR O O 8.005 -1.183 5.096 1.00 . A A . 14 TYR O 1 1 2 969 1 1 14 TYR OH O 10.674 -0.911 10.042 1.00 . A A . 14 TYR OH 1 1 2 970 1 1 15 GLN C C 5.663 0.319 4.461 1.00 . A A . 15 GLN C 1 1 2 971 1 1 15 GLN CA C 6.789 1.215 4.975 1.00 . A A . 15 GLN CA 1 1 2 972 1 1 15 GLN CB C 6.450 2.678 4.684 1.00 . A A . 15 GLN CB 1 1 2 973 1 1 15 GLN CD C 6.101 4.606 6.228 1.00 . A A . 15 GLN CD 1 1 2 974 1 1 15 GLN CG C 7.113 3.575 5.730 1.00 . A A . 15 GLN CG 1 1 2 975 1 1 15 GLN H H 8.517 1.520 3.730 1.00 . A A . 15 GLN H 1 1 2 976 1 1 15 GLN HA H 6.903 1.074 6.039 1.00 . A A . 15 GLN HA 1 1 2 977 1 1 15 GLN HB2 H 6.811 2.942 3.700 1.00 . A A . 15 GLN HB2 1 1 2 978 1 1 15 GLN HB3 H 5.380 2.814 4.723 1.00 . A A . 15 GLN HB3 1 1 2 979 1 1 15 GLN HE21 H 5.064 3.283 7.282 1.00 . A A . 15 GLN HE21 1 1 2 980 1 1 15 GLN HE22 H 4.480 4.876 7.342 1.00 . A A . 15 GLN HE22 1 1 2 981 1 1 15 GLN HG2 H 7.452 2.971 6.559 1.00 . A A . 15 GLN HG2 1 1 2 982 1 1 15 GLN HG3 H 7.955 4.084 5.287 1.00 . A A . 15 GLN HG3 1 1 2 983 1 1 15 GLN N N 8.058 0.858 4.287 1.00 . A A . 15 GLN N 1 1 2 984 1 1 15 GLN NE2 N 5.135 4.224 7.016 1.00 . A A . 15 GLN NE2 1 1 2 985 1 1 15 GLN O O 4.980 -0.331 5.226 1.00 . A A . 15 GLN O 1 1 2 986 1 1 15 GLN OE1 O 6.188 5.771 5.894 1.00 . A A . 15 GLN OE1 1 1 2 987 1 1 16 LEU C C 4.519 -1.995 3.194 1.00 . A A . 16 LEU C 1 1 2 988 1 1 16 LEU CA C 4.379 -0.586 2.627 1.00 . A A . 16 LEU CA 1 1 2 989 1 1 16 LEU CB C 4.477 -0.644 1.105 1.00 . A A . 16 LEU CB 1 1 2 990 1 1 16 LEU CD1 C 3.121 1.475 1.303 1.00 . A A . 16 LEU CD1 1 1 2 991 1 1 16 LEU CD2 C 5.476 1.558 0.458 1.00 . A A . 16 LEU CD2 1 1 2 992 1 1 16 LEU CG C 4.190 0.731 0.494 1.00 . A A . 16 LEU CG 1 1 2 993 1 1 16 LEU H H 6.023 0.801 2.566 1.00 . A A . 16 LEU H 1 1 2 994 1 1 16 LEU HA H 3.420 -0.181 2.911 1.00 . A A . 16 LEU HA 1 1 2 995 1 1 16 LEU HB2 H 5.471 -0.959 0.822 1.00 . A A . 16 LEU HB2 1 1 2 996 1 1 16 LEU HB3 H 3.757 -1.354 0.729 1.00 . A A . 16 LEU HB3 1 1 2 997 1 1 16 LEU HD11 H 2.393 0.769 1.673 1.00 . A A . 16 LEU HD11 1 1 2 998 1 1 16 LEU HD12 H 2.630 2.199 0.670 1.00 . A A . 16 LEU HD12 1 1 2 999 1 1 16 LEU HD13 H 3.586 1.982 2.135 1.00 . A A . 16 LEU HD13 1 1 2 1000 1 1 16 LEU HD21 H 5.481 2.254 1.284 1.00 . A A . 16 LEU HD21 1 1 2 1001 1 1 16 LEU HD22 H 5.528 2.104 -0.473 1.00 . A A . 16 LEU HD22 1 1 2 1002 1 1 16 LEU HD23 H 6.329 0.900 0.537 1.00 . A A . 16 LEU HD23 1 1 2 1003 1 1 16 LEU HG H 3.833 0.588 -0.505 1.00 . A A . 16 LEU HG 1 1 2 1004 1 1 16 LEU N N 5.463 0.274 3.172 1.00 . A A . 16 LEU N 1 1 2 1005 1 1 16 LEU O O 3.547 -2.645 3.517 1.00 . A A . 16 LEU O 1 1 2 1006 1 1 17 GLU C C 5.081 -3.930 5.177 1.00 . A A . 17 GLU C 1 1 2 1007 1 1 17 GLU CA C 5.906 -3.833 3.894 1.00 . A A . 17 GLU CA 1 1 2 1008 1 1 17 GLU CB C 7.384 -4.060 4.207 1.00 . A A . 17 GLU CB 1 1 2 1009 1 1 17 GLU CD C 8.884 -5.998 3.714 1.00 . A A . 17 GLU CD 1 1 2 1010 1 1 17 GLU CG C 8.022 -4.896 3.095 1.00 . A A . 17 GLU CG 1 1 2 1011 1 1 17 GLU H H 6.497 -1.934 3.077 1.00 . A A . 17 GLU H 1 1 2 1012 1 1 17 GLU HA H 5.564 -4.571 3.184 1.00 . A A . 17 GLU HA 1 1 2 1013 1 1 17 GLU HB2 H 7.887 -3.107 4.274 1.00 . A A . 17 GLU HB2 1 1 2 1014 1 1 17 GLU HB3 H 7.475 -4.579 5.144 1.00 . A A . 17 GLU HB3 1 1 2 1015 1 1 17 GLU HG2 H 7.246 -5.342 2.490 1.00 . A A . 17 GLU HG2 1 1 2 1016 1 1 17 GLU HG3 H 8.641 -4.263 2.477 1.00 . A A . 17 GLU HG3 1 1 2 1017 1 1 17 GLU N N 5.722 -2.473 3.331 1.00 . A A . 17 GLU N 1 1 2 1018 1 1 17 GLU O O 4.535 -4.965 5.504 1.00 . A A . 17 GLU O 1 1 2 1019 1 1 17 GLU OE1 O 8.320 -6.898 4.314 1.00 . A A . 17 GLU OE1 1 1 2 1020 1 1 17 GLU OE2 O 10.094 -5.922 3.579 1.00 . A A . 17 GLU OE2 1 1 2 1021 1 1 18 ASN C C 2.687 -2.841 6.798 1.00 . A A . 18 ASN C 1 1 2 1022 1 1 18 ASN CA C 4.176 -2.852 7.154 1.00 . A A . 18 ASN CA 1 1 2 1023 1 1 18 ASN CB C 4.511 -1.605 7.977 1.00 . A A . 18 ASN CB 1 1 2 1024 1 1 18 ASN CG C 4.998 -2.019 9.366 1.00 . A A . 18 ASN CG 1 1 2 1025 1 1 18 ASN H H 5.422 -2.018 5.602 1.00 . A A . 18 ASN H 1 1 2 1026 1 1 18 ASN HA H 4.407 -3.738 7.727 1.00 . A A . 18 ASN HA 1 1 2 1027 1 1 18 ASN HB2 H 5.285 -1.041 7.476 1.00 . A A . 18 ASN HB2 1 1 2 1028 1 1 18 ASN HB3 H 3.627 -0.993 8.076 1.00 . A A . 18 ASN HB3 1 1 2 1029 1 1 18 ASN HD21 H 3.734 -0.823 10.322 1.00 . A A . 18 ASN HD21 1 1 2 1030 1 1 18 ASN HD22 H 4.757 -1.743 11.317 1.00 . A A . 18 ASN HD22 1 1 2 1031 1 1 18 ASN N N 4.978 -2.844 5.897 1.00 . A A . 18 ASN N 1 1 2 1032 1 1 18 ASN ND2 N 4.451 -1.484 10.423 1.00 . A A . 18 ASN ND2 1 1 2 1033 1 1 18 ASN O O 1.845 -3.231 7.582 1.00 . A A . 18 ASN O 1 1 2 1034 1 1 18 ASN OD1 O 5.888 -2.837 9.491 1.00 . A A . 18 ASN OD1 1 1 2 1035 1 1 19 TYR C C 0.405 -3.779 5.023 1.00 . A A . 19 TYR C 1 1 2 1036 1 1 19 TYR CA C 0.933 -2.351 5.187 1.00 . A A . 19 TYR CA 1 1 2 1037 1 1 19 TYR CB C 0.831 -1.622 3.843 1.00 . A A . 19 TYR CB 1 1 2 1038 1 1 19 TYR CD1 C 2.171 0.402 4.790 1.00 . A A . 19 TYR CD1 1 1 2 1039 1 1 19 TYR CD2 C 0.137 0.856 3.528 1.00 . A A . 19 TYR CD2 1 1 2 1040 1 1 19 TYR CE1 C 2.355 1.778 4.961 1.00 . A A . 19 TYR CE1 1 1 2 1041 1 1 19 TYR CE2 C 0.344 2.226 3.707 1.00 . A A . 19 TYR CE2 1 1 2 1042 1 1 19 TYR CG C 1.047 -0.092 4.063 1.00 . A A . 19 TYR CG 1 1 2 1043 1 1 19 TYR CZ C 1.449 2.687 4.419 1.00 . A A . 19 TYR CZ 1 1 2 1044 1 1 19 TYR H H 3.060 -2.090 5.002 1.00 . A A . 19 TYR H 1 1 2 1045 1 1 19 TYR HA H 0.347 -1.829 5.928 1.00 . A A . 19 TYR HA 1 1 2 1046 1 1 19 TYR HB2 H 1.593 -2.035 3.164 1.00 . A A . 19 TYR HB2 1 1 2 1047 1 1 19 TYR HB3 H -0.159 -1.813 3.409 1.00 . A A . 19 TYR HB3 1 1 2 1048 1 1 19 TYR HD1 H 2.885 -0.262 5.234 1.00 . A A . 19 TYR HD1 1 1 2 1049 1 1 19 TYR HD2 H -0.722 0.543 2.988 1.00 . A A . 19 TYR HD2 1 1 2 1050 1 1 19 TYR HE1 H 3.211 2.137 5.509 1.00 . A A . 19 TYR HE1 1 1 2 1051 1 1 19 TYR HE2 H -0.359 2.930 3.288 1.00 . A A . 19 TYR HE2 1 1 2 1052 1 1 19 TYR HH H 1.432 4.261 5.499 1.00 . A A . 19 TYR HH 1 1 2 1053 1 1 19 TYR N N 2.361 -2.396 5.614 1.00 . A A . 19 TYR N 1 1 2 1054 1 1 19 TYR O O -0.787 -4.008 4.975 1.00 . A A . 19 TYR O 1 1 2 1055 1 1 19 TYR OH O 1.645 4.042 4.589 1.00 . A A . 19 TYR OH 1 1 2 1056 1 1 20 CYS C C 0.468 -6.737 6.124 1.00 . A A . 20 CYS C 1 1 2 1057 1 1 20 CYS CA C 0.835 -6.150 4.761 1.00 . A A . 20 CYS CA 1 1 2 1058 1 1 20 CYS CB C 1.963 -6.976 4.137 1.00 . A A . 20 CYS CB 1 1 2 1059 1 1 20 CYS H H 2.241 -4.531 4.967 1.00 . A A . 20 CYS H 1 1 2 1060 1 1 20 CYS HA H -0.030 -6.177 4.115 1.00 . A A . 20 CYS HA 1 1 2 1061 1 1 20 CYS HB2 H 2.653 -7.285 4.908 1.00 . A A . 20 CYS HB2 1 1 2 1062 1 1 20 CYS HB3 H 1.546 -7.848 3.657 1.00 . A A . 20 CYS HB3 1 1 2 1063 1 1 20 CYS N N 1.285 -4.739 4.930 1.00 . A A . 20 CYS N 1 1 2 1064 1 1 20 CYS O O 0.926 -7.798 6.499 1.00 . A A . 20 CYS O 1 1 2 1065 1 1 20 CYS SG S 2.840 -5.974 2.910 1.00 . A A . 20 CYS SG 1 1 2 1066 1 1 21 ASN C C -2.270 -6.786 8.239 1.00 . A A . 21 ASN C 1 1 2 1067 1 1 21 ASN CA C -0.756 -6.570 8.207 1.00 . A A . 21 ASN CA 1 1 2 1068 1 1 21 ASN CB C -0.365 -5.552 9.280 1.00 . A A . 21 ASN CB 1 1 2 1069 1 1 21 ASN CG C -0.195 -6.263 10.624 1.00 . A A . 21 ASN CG 1 1 2 1070 1 1 21 ASN H H -0.714 -5.201 6.545 1.00 . A A . 21 ASN H 1 1 2 1071 1 1 21 ASN HA H -0.253 -7.507 8.398 1.00 . A A . 21 ASN HA 1 1 2 1072 1 1 21 ASN HB2 H 0.564 -5.076 9.003 1.00 . A A . 21 ASN HB2 1 1 2 1073 1 1 21 ASN HB3 H -1.140 -4.806 9.366 1.00 . A A . 21 ASN HB3 1 1 2 1074 1 1 21 ASN HD21 H 0.988 -4.858 11.377 1.00 . A A . 21 ASN HD21 1 1 2 1075 1 1 21 ASN HD22 H 0.664 -6.164 12.412 1.00 . A A . 21 ASN HD22 1 1 2 1076 1 1 21 ASN N N -0.356 -6.054 6.868 1.00 . A A . 21 ASN N 1 1 2 1077 1 1 21 ASN ND2 N 0.547 -5.716 11.548 1.00 . A A . 21 ASN ND2 1 1 2 1078 1 1 21 ASN O O -2.805 -7.240 7.241 1.00 . A A . 21 ASN O 1 1 2 1079 1 1 21 ASN OXT O -2.869 -6.494 9.260 1.00 . A A . 21 ASN OXT 1 1 2 1080 1 1 21 ASN OD1 O -0.742 -7.327 10.836 1.00 . A A . 21 ASN OD1 1 1 2 1081 2 2 1 PHE C C 8.030 0.733 -6.056 1.00 . B B . 22 PHE C 1 1 2 1082 2 2 1 PHE CA C 8.800 -0.453 -6.640 1.00 . B B . 22 PHE CA 1 1 2 1083 2 2 1 PHE CB C 9.984 0.059 -7.463 1.00 . B B . 22 PHE CB 1 1 2 1084 2 2 1 PHE CD1 C 11.591 -1.270 -6.048 1.00 . B B . 22 PHE CD1 1 1 2 1085 2 2 1 PHE CD2 C 12.069 1.071 -6.472 1.00 . B B . 22 PHE CD2 1 1 2 1086 2 2 1 PHE CE1 C 12.761 -1.371 -5.284 1.00 . B B . 22 PHE CE1 1 1 2 1087 2 2 1 PHE CE2 C 13.239 0.971 -5.708 1.00 . B B . 22 PHE CE2 1 1 2 1088 2 2 1 PHE CG C 11.246 -0.049 -6.642 1.00 . B B . 22 PHE CG 1 1 2 1089 2 2 1 PHE CZ C 13.585 -0.250 -5.114 1.00 . B B . 22 PHE CZ 1 1 2 1090 2 2 1 PHE H1 H 7.070 -1.564 -6.963 1.00 . B B . 22 PHE H1 1 1 2 1091 2 2 1 PHE H2 H 8.408 -2.086 -7.869 1.00 . B B . 22 PHE H2 1 1 2 1092 2 2 1 PHE H3 H 7.579 -0.672 -8.312 1.00 . B B . 22 PHE H3 1 1 2 1093 2 2 1 PHE HA H 9.164 -1.074 -5.835 1.00 . B B . 22 PHE HA 1 1 2 1094 2 2 1 PHE HB2 H 10.084 -0.536 -8.359 1.00 . B B . 22 PHE HB2 1 1 2 1095 2 2 1 PHE HB3 H 9.817 1.091 -7.732 1.00 . B B . 22 PHE HB3 1 1 2 1096 2 2 1 PHE HD1 H 10.956 -2.134 -6.180 1.00 . B B . 22 PHE HD1 1 1 2 1097 2 2 1 PHE HD2 H 11.802 2.012 -6.931 1.00 . B B . 22 PHE HD2 1 1 2 1098 2 2 1 PHE HE1 H 13.027 -2.312 -4.826 1.00 . B B . 22 PHE HE1 1 1 2 1099 2 2 1 PHE HE2 H 13.874 1.834 -5.577 1.00 . B B . 22 PHE HE2 1 1 2 1100 2 2 1 PHE HZ H 14.487 -0.328 -4.525 1.00 . B B . 22 PHE HZ 1 1 2 1101 2 2 1 PHE N N 7.896 -1.254 -7.512 1.00 . B B . 22 PHE N 1 1 2 1102 2 2 1 PHE O O 6.817 0.721 -5.979 1.00 . B B . 22 PHE O 1 1 2 1103 2 2 2 VAL C C 8.477 4.206 -5.787 1.00 . B B . 23 VAL C 1 1 2 1104 2 2 2 VAL CA C 8.035 2.938 -5.053 1.00 . B B . 23 VAL CA 1 1 2 1105 2 2 2 VAL CB C 8.371 3.025 -3.552 1.00 . B B . 23 VAL CB 1 1 2 1106 2 2 2 VAL CG1 C 9.651 3.837 -3.325 1.00 . B B . 23 VAL CG1 1 1 2 1107 2 2 2 VAL CG2 C 7.207 3.684 -2.807 1.00 . B B . 23 VAL CG2 1 1 2 1108 2 2 2 VAL H H 9.702 1.743 -5.706 1.00 . B B . 23 VAL H 1 1 2 1109 2 2 2 VAL HA H 6.971 2.828 -5.167 1.00 . B B . 23 VAL HA 1 1 2 1110 2 2 2 VAL HB H 8.517 2.030 -3.169 1.00 . B B . 23 VAL HB 1 1 2 1111 2 2 2 VAL HG11 H 10.258 3.350 -2.576 1.00 . B B . 23 VAL HG11 1 1 2 1112 2 2 2 VAL HG12 H 9.393 4.830 -2.987 1.00 . B B . 23 VAL HG12 1 1 2 1113 2 2 2 VAL HG13 H 10.205 3.904 -4.249 1.00 . B B . 23 VAL HG13 1 1 2 1114 2 2 2 VAL HG21 H 6.356 3.763 -3.467 1.00 . B B . 23 VAL HG21 1 1 2 1115 2 2 2 VAL HG22 H 7.501 4.670 -2.479 1.00 . B B . 23 VAL HG22 1 1 2 1116 2 2 2 VAL HG23 H 6.943 3.083 -1.949 1.00 . B B . 23 VAL HG23 1 1 2 1117 2 2 2 VAL N N 8.725 1.755 -5.638 1.00 . B B . 23 VAL N 1 1 2 1118 2 2 2 VAL O O 8.879 4.165 -6.932 1.00 . B B . 23 VAL O 1 1 2 1119 2 2 3 ASN C C 7.589 7.210 -6.508 1.00 . B B . 24 ASN C 1 1 2 1120 2 2 3 ASN CA C 8.779 6.626 -5.743 1.00 . B B . 24 ASN CA 1 1 2 1121 2 2 3 ASN CB C 9.958 6.427 -6.698 1.00 . B B . 24 ASN CB 1 1 2 1122 2 2 3 ASN CG C 10.829 7.685 -6.698 1.00 . B B . 24 ASN CG 1 1 2 1123 2 2 3 ASN H H 8.045 5.302 -4.210 1.00 . B B . 24 ASN H 1 1 2 1124 2 2 3 ASN HA H 9.068 7.313 -4.961 1.00 . B B . 24 ASN HA 1 1 2 1125 2 2 3 ASN HB2 H 10.546 5.580 -6.374 1.00 . B B . 24 ASN HB2 1 1 2 1126 2 2 3 ASN HB3 H 9.587 6.248 -7.696 1.00 . B B . 24 ASN HB3 1 1 2 1127 2 2 3 ASN HD21 H 12.308 6.834 -5.682 1.00 . B B . 24 ASN HD21 1 1 2 1128 2 2 3 ASN HD22 H 12.560 8.458 -6.108 1.00 . B B . 24 ASN HD22 1 1 2 1129 2 2 3 ASN N N 8.386 5.322 -5.125 1.00 . B B . 24 ASN N 1 1 2 1130 2 2 3 ASN ND2 N 11.996 7.656 -6.115 1.00 . B B . 24 ASN ND2 1 1 2 1131 2 2 3 ASN O O 7.696 8.232 -7.157 1.00 . B B . 24 ASN O 1 1 2 1132 2 2 3 ASN OD1 O 10.443 8.704 -7.234 1.00 . B B . 24 ASN OD1 1 1 2 1133 2 2 4 GLN C C 4.146 7.353 -6.119 1.00 . B B . 25 GLN C 1 1 2 1134 2 2 4 GLN CA C 5.251 7.094 -7.141 1.00 . B B . 25 GLN CA 1 1 2 1135 2 2 4 GLN CB C 4.772 6.056 -8.157 1.00 . B B . 25 GLN CB 1 1 2 1136 2 2 4 GLN CD C 5.600 7.483 -10.036 1.00 . B B . 25 GLN CD 1 1 2 1137 2 2 4 GLN CG C 4.383 6.753 -9.463 1.00 . B B . 25 GLN CG 1 1 2 1138 2 2 4 GLN H H 6.385 5.756 -5.894 1.00 . B B . 25 GLN H 1 1 2 1139 2 2 4 GLN HA H 5.499 8.014 -7.649 1.00 . B B . 25 GLN HA 1 1 2 1140 2 2 4 GLN HB2 H 5.566 5.349 -8.347 1.00 . B B . 25 GLN HB2 1 1 2 1141 2 2 4 GLN HB3 H 3.914 5.535 -7.759 1.00 . B B . 25 GLN HB3 1 1 2 1142 2 2 4 GLN HE21 H 4.790 9.285 -9.838 1.00 . B B . 25 GLN HE21 1 1 2 1143 2 2 4 GLN HE22 H 6.354 9.261 -10.495 1.00 . B B . 25 GLN HE22 1 1 2 1144 2 2 4 GLN HG2 H 4.037 6.016 -10.173 1.00 . B B . 25 GLN HG2 1 1 2 1145 2 2 4 GLN HG3 H 3.596 7.466 -9.271 1.00 . B B . 25 GLN HG3 1 1 2 1146 2 2 4 GLN N N 6.452 6.574 -6.429 1.00 . B B . 25 GLN N 1 1 2 1147 2 2 4 GLN NE2 N 5.579 8.784 -10.131 1.00 . B B . 25 GLN NE2 1 1 2 1148 2 2 4 GLN O O 4.103 6.739 -5.071 1.00 . B B . 25 GLN O 1 1 2 1149 2 2 4 GLN OE1 O 6.577 6.862 -10.402 1.00 . B B . 25 GLN OE1 1 1 2 1150 2 2 5 HIS C C 1.128 7.409 -5.570 1.00 . B B . 26 HIS C 1 1 2 1151 2 2 5 HIS CA C 2.158 8.536 -5.440 1.00 . B B . 26 HIS CA 1 1 2 1152 2 2 5 HIS CB C 1.519 9.883 -5.784 1.00 . B B . 26 HIS CB 1 1 2 1153 2 2 5 HIS CD2 C 0.441 11.640 -4.170 1.00 . B B . 26 HIS CD2 1 1 2 1154 2 2 5 HIS CE1 C 1.834 11.381 -2.519 1.00 . B B . 26 HIS CE1 1 1 2 1155 2 2 5 HIS CG C 1.344 10.674 -4.521 1.00 . B B . 26 HIS CG 1 1 2 1156 2 2 5 HIS H H 3.297 8.742 -7.256 1.00 . B B . 26 HIS H 1 1 2 1157 2 2 5 HIS HA H 2.555 8.560 -4.434 1.00 . B B . 26 HIS HA 1 1 2 1158 2 2 5 HIS HB2 H 2.160 10.424 -6.465 1.00 . B B . 26 HIS HB2 1 1 2 1159 2 2 5 HIS HB3 H 0.557 9.719 -6.244 1.00 . B B . 26 HIS HB3 1 1 2 1160 2 2 5 HIS HD2 H -0.375 11.992 -4.784 1.00 . B B . 26 HIS HD2 1 1 2 1161 2 2 5 HIS HE1 H 2.339 11.500 -1.572 1.00 . B B . 26 HIS HE1 1 1 2 1162 2 2 5 HIS HE2 H 0.284 12.785 -2.391 1.00 . B B . 26 HIS HE2 1 1 2 1163 2 2 5 HIS N N 3.250 8.254 -6.408 1.00 . B B . 26 HIS N 1 1 2 1164 2 2 5 HIS ND1 N 2.216 10.519 -3.466 1.00 . B B . 26 HIS ND1 1 1 2 1165 2 2 5 HIS NE2 N 0.750 12.091 -2.903 1.00 . B B . 26 HIS NE2 1 1 2 1166 2 2 5 HIS O O 1.159 6.659 -6.525 1.00 . B B . 26 HIS O 1 1 2 1167 2 2 6 LEU C C -2.000 6.315 -3.908 1.00 . B B . 27 LEU C 1 1 2 1168 2 2 6 LEU CA C -0.758 6.135 -4.787 1.00 . B B . 27 LEU CA 1 1 2 1169 2 2 6 LEU CB C -0.102 4.795 -4.426 1.00 . B B . 27 LEU CB 1 1 2 1170 2 2 6 LEU CD1 C 0.900 5.875 -2.379 1.00 . B B . 27 LEU CD1 1 1 2 1171 2 2 6 LEU CD2 C 1.680 3.642 -3.133 1.00 . B B . 27 LEU CD2 1 1 2 1172 2 2 6 LEU CG C 1.178 5.003 -3.606 1.00 . B B . 27 LEU CG 1 1 2 1173 2 2 6 LEU H H 0.198 7.850 -3.860 1.00 . B B . 27 LEU H 1 1 2 1174 2 2 6 LEU HA H -1.071 6.092 -5.818 1.00 . B B . 27 LEU HA 1 1 2 1175 2 2 6 LEU HB2 H -0.798 4.205 -3.850 1.00 . B B . 27 LEU HB2 1 1 2 1176 2 2 6 LEU HB3 H 0.143 4.266 -5.335 1.00 . B B . 27 LEU HB3 1 1 2 1177 2 2 6 LEU HD11 H 1.791 6.431 -2.126 1.00 . B B . 27 LEU HD11 1 1 2 1178 2 2 6 LEU HD12 H 0.622 5.246 -1.547 1.00 . B B . 27 LEU HD12 1 1 2 1179 2 2 6 LEU HD13 H 0.100 6.559 -2.591 1.00 . B B . 27 LEU HD13 1 1 2 1180 2 2 6 LEU HD21 H 2.574 3.380 -3.673 1.00 . B B . 27 LEU HD21 1 1 2 1181 2 2 6 LEU HD22 H 0.917 2.898 -3.312 1.00 . B B . 27 LEU HD22 1 1 2 1182 2 2 6 LEU HD23 H 1.895 3.688 -2.075 1.00 . B B . 27 LEU HD23 1 1 2 1183 2 2 6 LEU HG H 1.931 5.471 -4.222 1.00 . B B . 27 LEU HG 1 1 2 1184 2 2 6 LEU N N 0.226 7.253 -4.637 1.00 . B B . 27 LEU N 1 1 2 1185 2 2 6 LEU O O -1.922 6.567 -2.723 1.00 . B B . 27 LEU O 1 1 2 1186 2 2 7 CYS C C -5.348 5.080 -4.160 1.00 . B B . 28 CYS C 1 1 2 1187 2 2 7 CYS CA C -4.419 6.215 -3.718 1.00 . B B . 28 CYS CA 1 1 2 1188 2 2 7 CYS CB C -5.110 7.559 -3.976 1.00 . B B . 28 CYS CB 1 1 2 1189 2 2 7 CYS H H -3.181 5.883 -5.436 1.00 . B B . 28 CYS H 1 1 2 1190 2 2 7 CYS HA H -4.198 6.112 -2.665 1.00 . B B . 28 CYS HA 1 1 2 1191 2 2 7 CYS HB2 H -4.688 8.015 -4.859 1.00 . B B . 28 CYS HB2 1 1 2 1192 2 2 7 CYS HB3 H -6.166 7.394 -4.128 1.00 . B B . 28 CYS HB3 1 1 2 1193 2 2 7 CYS N N -3.151 6.124 -4.489 1.00 . B B . 28 CYS N 1 1 2 1194 2 2 7 CYS O O -5.238 4.569 -5.258 1.00 . B B . 28 CYS O 1 1 2 1195 2 2 7 CYS SG S -4.872 8.664 -2.561 1.00 . B B . 28 CYS SG 1 1 2 1196 2 2 8 GLY C C -6.523 2.513 -4.497 1.00 . B B . 29 GLY C 1 1 2 1197 2 2 8 GLY CA C -7.217 3.600 -3.669 1.00 . B B . 29 GLY CA 1 1 2 1198 2 2 8 GLY H H -6.330 5.128 -2.438 1.00 . B B . 29 GLY H 1 1 2 1199 2 2 8 GLY HA2 H -7.609 3.161 -2.762 1.00 . B B . 29 GLY HA2 1 1 2 1200 2 2 8 GLY HA3 H -8.032 4.014 -4.243 1.00 . B B . 29 GLY HA3 1 1 2 1201 2 2 8 GLY N N -6.263 4.692 -3.313 1.00 . B B . 29 GLY N 1 1 2 1202 2 2 8 GLY O O -5.642 1.821 -4.026 1.00 . B B . 29 GLY O 1 1 2 1203 2 2 9 SER C C -4.802 1.352 -6.530 1.00 . B B . 30 SER C 1 1 2 1204 2 2 9 SER CA C -6.330 1.301 -6.596 1.00 . B B . 30 SER CA 1 1 2 1205 2 2 9 SER CB C -6.777 1.522 -8.040 1.00 . B B . 30 SER CB 1 1 2 1206 2 2 9 SER H H -7.656 2.913 -6.073 1.00 . B B . 30 SER H 1 1 2 1207 2 2 9 SER HA H -6.666 0.329 -6.267 1.00 . B B . 30 SER HA 1 1 2 1208 2 2 9 SER HB2 H -6.821 2.577 -8.247 1.00 . B B . 30 SER HB2 1 1 2 1209 2 2 9 SER HB3 H -6.067 1.055 -8.711 1.00 . B B . 30 SER HB3 1 1 2 1210 2 2 9 SER HG H -8.380 1.203 -9.095 1.00 . B B . 30 SER HG 1 1 2 1211 2 2 9 SER N N -6.934 2.350 -5.725 1.00 . B B . 30 SER N 1 1 2 1212 2 2 9 SER O O -4.168 0.427 -6.063 1.00 . B B . 30 SER O 1 1 2 1213 2 2 9 SER OG O -8.066 0.953 -8.223 1.00 . B B . 30 SER OG 1 1 2 1214 2 2 10 ASP C C -2.201 1.984 -5.638 1.00 . B B . 31 ASP C 1 1 2 1215 2 2 10 ASP CA C -2.713 2.493 -6.983 1.00 . B B . 31 ASP CA 1 1 2 1216 2 2 10 ASP CB C -2.260 3.940 -7.181 1.00 . B B . 31 ASP CB 1 1 2 1217 2 2 10 ASP CG C -3.103 4.602 -8.272 1.00 . B B . 31 ASP CG 1 1 2 1218 2 2 10 ASP H H -4.729 3.142 -7.396 1.00 . B B . 31 ASP H 1 1 2 1219 2 2 10 ASP HA H -2.308 1.880 -7.775 1.00 . B B . 31 ASP HA 1 1 2 1220 2 2 10 ASP HB2 H -2.376 4.479 -6.256 1.00 . B B . 31 ASP HB2 1 1 2 1221 2 2 10 ASP HB3 H -1.220 3.952 -7.475 1.00 . B B . 31 ASP HB3 1 1 2 1222 2 2 10 ASP N N -4.203 2.411 -7.010 1.00 . B B . 31 ASP N 1 1 2 1223 2 2 10 ASP O O -1.199 1.303 -5.563 1.00 . B B . 31 ASP O 1 1 2 1224 2 2 10 ASP OD1 O -2.910 4.264 -9.429 1.00 . B B . 31 ASP OD1 1 1 2 1225 2 2 10 ASP OD2 O -3.924 5.437 -7.933 1.00 . B B . 31 ASP OD2 1 1 2 1226 2 2 11 LEU C C -2.555 0.296 -3.193 1.00 . B B . 32 LEU C 1 1 2 1227 2 2 11 LEU CA C -2.431 1.819 -3.239 1.00 . B B . 32 LEU CA 1 1 2 1228 2 2 11 LEU CB C -3.294 2.443 -2.142 1.00 . B B . 32 LEU CB 1 1 2 1229 2 2 11 LEU CD1 C -2.145 4.454 -1.204 1.00 . B B . 32 LEU CD1 1 1 2 1230 2 2 11 LEU CD2 C -3.078 2.720 0.329 1.00 . B B . 32 LEU CD2 1 1 2 1231 2 2 11 LEU CG C -2.394 2.958 -1.017 1.00 . B B . 32 LEU CG 1 1 2 1232 2 2 11 LEU H H -3.695 2.846 -4.650 1.00 . B B . 32 LEU H 1 1 2 1233 2 2 11 LEU HA H -1.397 2.097 -3.091 1.00 . B B . 32 LEU HA 1 1 2 1234 2 2 11 LEU HB2 H -3.862 3.264 -2.554 1.00 . B B . 32 LEU HB2 1 1 2 1235 2 2 11 LEU HB3 H -3.969 1.699 -1.747 1.00 . B B . 32 LEU HB3 1 1 2 1236 2 2 11 LEU HD11 H -2.270 4.960 -0.258 1.00 . B B . 32 LEU HD11 1 1 2 1237 2 2 11 LEU HD12 H -2.851 4.850 -1.919 1.00 . B B . 32 LEU HD12 1 1 2 1238 2 2 11 LEU HD13 H -1.140 4.610 -1.565 1.00 . B B . 32 LEU HD13 1 1 2 1239 2 2 11 LEU HD21 H -3.583 1.765 0.312 1.00 . B B . 32 LEU HD21 1 1 2 1240 2 2 11 LEU HD22 H -3.799 3.504 0.511 1.00 . B B . 32 LEU HD22 1 1 2 1241 2 2 11 LEU HD23 H -2.338 2.721 1.115 1.00 . B B . 32 LEU HD23 1 1 2 1242 2 2 11 LEU HG H -1.450 2.432 -1.042 1.00 . B B . 32 LEU HG 1 1 2 1243 2 2 11 LEU N N -2.885 2.301 -4.573 1.00 . B B . 32 LEU N 1 1 2 1244 2 2 11 LEU O O -1.571 -0.413 -3.263 1.00 . B B . 32 LEU O 1 1 2 1245 2 2 12 VAL C C -3.023 -2.319 -4.123 1.00 . B B . 33 VAL C 1 1 2 1246 2 2 12 VAL CA C -3.920 -1.700 -3.053 1.00 . B B . 33 VAL CA 1 1 2 1247 2 2 12 VAL CB C -5.378 -2.068 -3.333 1.00 . B B . 33 VAL CB 1 1 2 1248 2 2 12 VAL CG1 C -6.287 -1.323 -2.357 1.00 . B B . 33 VAL CG1 1 1 2 1249 2 2 12 VAL CG2 C -5.742 -1.679 -4.768 1.00 . B B . 33 VAL CG2 1 1 2 1250 2 2 12 VAL H H -4.538 0.367 -3.040 1.00 . B B . 33 VAL H 1 1 2 1251 2 2 12 VAL HA H -3.632 -2.072 -2.081 1.00 . B B . 33 VAL HA 1 1 2 1252 2 2 12 VAL HB H -5.510 -3.133 -3.202 1.00 . B B . 33 VAL HB 1 1 2 1253 2 2 12 VAL HG11 H -6.786 -0.517 -2.875 1.00 . B B . 33 VAL HG11 1 1 2 1254 2 2 12 VAL HG12 H -5.694 -0.921 -1.550 1.00 . B B . 33 VAL HG12 1 1 2 1255 2 2 12 VAL HG13 H -7.023 -2.005 -1.958 1.00 . B B . 33 VAL HG13 1 1 2 1256 2 2 12 VAL HG21 H -4.923 -1.926 -5.428 1.00 . B B . 33 VAL HG21 1 1 2 1257 2 2 12 VAL HG22 H -5.934 -0.617 -4.816 1.00 . B B . 33 VAL HG22 1 1 2 1258 2 2 12 VAL HG23 H -6.626 -2.219 -5.074 1.00 . B B . 33 VAL HG23 1 1 2 1259 2 2 12 VAL N N -3.753 -0.218 -3.088 1.00 . B B . 33 VAL N 1 1 2 1260 2 2 12 VAL O O -2.555 -3.432 -3.993 1.00 . B B . 33 VAL O 1 1 2 1261 2 2 13 GLU C C -0.435 -1.994 -5.810 1.00 . B B . 34 GLU C 1 1 2 1262 2 2 13 GLU CA C -1.891 -2.118 -6.255 1.00 . B B . 34 GLU CA 1 1 2 1263 2 2 13 GLU CB C -2.110 -1.308 -7.534 1.00 . B B . 34 GLU CB 1 1 2 1264 2 2 13 GLU CD C -4.366 -1.367 -8.610 1.00 . B B . 34 GLU CD 1 1 2 1265 2 2 13 GLU CG C -3.023 -2.087 -8.483 1.00 . B B . 34 GLU CG 1 1 2 1266 2 2 13 GLU H H -3.150 -0.692 -5.256 1.00 . B B . 34 GLU H 1 1 2 1267 2 2 13 GLU HA H -2.126 -3.156 -6.439 1.00 . B B . 34 GLU HA 1 1 2 1268 2 2 13 GLU HB2 H -2.570 -0.363 -7.286 1.00 . B B . 34 GLU HB2 1 1 2 1269 2 2 13 GLU HB3 H -1.160 -1.132 -8.014 1.00 . B B . 34 GLU HB3 1 1 2 1270 2 2 13 GLU HG2 H -2.557 -2.155 -9.455 1.00 . B B . 34 GLU HG2 1 1 2 1271 2 2 13 GLU HG3 H -3.185 -3.080 -8.092 1.00 . B B . 34 GLU HG3 1 1 2 1272 2 2 13 GLU N N -2.769 -1.592 -5.178 1.00 . B B . 34 GLU N 1 1 2 1273 2 2 13 GLU O O 0.262 -2.978 -5.668 1.00 . B B . 34 GLU O 1 1 2 1274 2 2 13 GLU OE1 O -4.486 -0.530 -9.489 1.00 . B B . 34 GLU OE1 1 1 2 1275 2 2 13 GLU OE2 O -5.253 -1.666 -7.827 1.00 . B B . 34 GLU OE2 1 1 2 1276 2 2 14 ALA C C 1.636 -1.447 -3.850 1.00 . B B . 35 ALA C 1 1 2 1277 2 2 14 ALA CA C 1.435 -0.623 -5.120 1.00 . B B . 35 ALA CA 1 1 2 1278 2 2 14 ALA CB C 1.701 0.854 -4.821 1.00 . B B . 35 ALA CB 1 1 2 1279 2 2 14 ALA H H -0.555 -0.012 -5.678 1.00 . B B . 35 ALA H 1 1 2 1280 2 2 14 ALA HA H 2.108 -0.966 -5.892 1.00 . B B . 35 ALA HA 1 1 2 1281 2 2 14 ALA HB1 H 2.672 1.130 -5.206 1.00 . B B . 35 ALA HB1 1 1 2 1282 2 2 14 ALA HB2 H 1.677 1.015 -3.753 1.00 . B B . 35 ALA HB2 1 1 2 1283 2 2 14 ALA HB3 H 0.941 1.460 -5.293 1.00 . B B . 35 ALA HB3 1 1 2 1284 2 2 14 ALA N N 0.027 -0.795 -5.572 1.00 . B B . 35 ALA N 1 1 2 1285 2 2 14 ALA O O 2.656 -2.079 -3.653 1.00 . B B . 35 ALA O 1 1 2 1286 2 2 15 LEU C C 0.827 -3.719 -2.084 1.00 . B B . 36 LEU C 1 1 2 1287 2 2 15 LEU CA C 0.742 -2.235 -1.735 1.00 . B B . 36 LEU CA 1 1 2 1288 2 2 15 LEU CB C -0.531 -1.989 -0.919 1.00 . B B . 36 LEU CB 1 1 2 1289 2 2 15 LEU CD1 C 0.121 -0.721 1.119 1.00 . B B . 36 LEU CD1 1 1 2 1290 2 2 15 LEU CD2 C 0.317 0.391 -1.102 1.00 . B B . 36 LEU CD2 1 1 2 1291 2 2 15 LEU CG C -0.503 -0.600 -0.264 1.00 . B B . 36 LEU CG 1 1 2 1292 2 2 15 LEU H H -0.160 -0.938 -3.191 1.00 . B B . 36 LEU H 1 1 2 1293 2 2 15 LEU HA H 1.609 -1.933 -1.165 1.00 . B B . 36 LEU HA 1 1 2 1294 2 2 15 LEU HB2 H -1.389 -2.057 -1.571 1.00 . B B . 36 LEU HB2 1 1 2 1295 2 2 15 LEU HB3 H -0.609 -2.742 -0.149 1.00 . B B . 36 LEU HB3 1 1 2 1296 2 2 15 LEU HD11 H -0.654 -0.916 1.845 1.00 . B B . 36 LEU HD11 1 1 2 1297 2 2 15 LEU HD12 H 0.625 0.200 1.363 1.00 . B B . 36 LEU HD12 1 1 2 1298 2 2 15 LEU HD13 H 0.831 -1.534 1.122 1.00 . B B . 36 LEU HD13 1 1 2 1299 2 2 15 LEU HD21 H 1.299 -0.018 -1.286 1.00 . B B . 36 LEU HD21 1 1 2 1300 2 2 15 LEU HD22 H 0.411 1.323 -0.565 1.00 . B B . 36 LEU HD22 1 1 2 1301 2 2 15 LEU HD23 H -0.182 0.569 -2.043 1.00 . B B . 36 LEU HD23 1 1 2 1302 2 2 15 LEU HG H -1.516 -0.236 -0.165 1.00 . B B . 36 LEU HG 1 1 2 1303 2 2 15 LEU N N 0.653 -1.450 -2.996 1.00 . B B . 36 LEU N 1 1 2 1304 2 2 15 LEU O O 1.470 -4.502 -1.412 1.00 . B B . 36 LEU O 1 1 2 1305 2 2 16 TYR C C 1.497 -5.877 -4.232 1.00 . B B . 37 TYR C 1 1 2 1306 2 2 16 TYR CA C 0.166 -5.530 -3.557 1.00 . B B . 37 TYR CA 1 1 2 1307 2 2 16 TYR CB C -0.987 -5.758 -4.538 1.00 . B B . 37 TYR CB 1 1 2 1308 2 2 16 TYR CD1 C -0.758 -8.309 -4.221 1.00 . B B . 37 TYR CD1 1 1 2 1309 2 2 16 TYR CD2 C -0.988 -7.445 -6.485 1.00 . B B . 37 TYR CD2 1 1 2 1310 2 2 16 TYR CE1 C -0.689 -9.610 -4.734 1.00 . B B . 37 TYR CE1 1 1 2 1311 2 2 16 TYR CE2 C -0.919 -8.752 -6.982 1.00 . B B . 37 TYR CE2 1 1 2 1312 2 2 16 TYR CG C -0.910 -7.200 -5.094 1.00 . B B . 37 TYR CG 1 1 2 1313 2 2 16 TYR CZ C -0.771 -9.830 -6.109 1.00 . B B . 37 TYR CZ 1 1 2 1314 2 2 16 TYR H H -0.349 -3.445 -3.645 1.00 . B B . 37 TYR H 1 1 2 1315 2 2 16 TYR HA H 0.028 -6.161 -2.691 1.00 . B B . 37 TYR HA 1 1 2 1316 2 2 16 TYR HB2 H -1.930 -5.592 -4.014 1.00 . B B . 37 TYR HB2 1 1 2 1317 2 2 16 TYR HB3 H -0.912 -5.033 -5.345 1.00 . B B . 37 TYR HB3 1 1 2 1318 2 2 16 TYR HD1 H -0.686 -8.170 -3.158 1.00 . B B . 37 TYR HD1 1 1 2 1319 2 2 16 TYR HD2 H -1.097 -6.637 -7.176 1.00 . B B . 37 TYR HD2 1 1 2 1320 2 2 16 TYR HE1 H -0.574 -10.447 -4.062 1.00 . B B . 37 TYR HE1 1 1 2 1321 2 2 16 TYR HE2 H -0.980 -8.928 -8.045 1.00 . B B . 37 TYR HE2 1 1 2 1322 2 2 16 TYR HH H -1.556 -11.535 -6.452 1.00 . B B . 37 TYR HH 1 1 2 1323 2 2 16 TYR N N 0.164 -4.103 -3.135 1.00 . B B . 37 TYR N 1 1 2 1324 2 2 16 TYR O O 1.892 -7.025 -4.283 1.00 . B B . 37 TYR O 1 1 2 1325 2 2 16 TYR OH O -0.706 -11.116 -6.605 1.00 . B B . 37 TYR OH 1 1 2 1326 2 2 17 LEU C C 4.545 -5.461 -4.305 1.00 . B B . 38 LEU C 1 1 2 1327 2 2 17 LEU CA C 3.509 -5.205 -5.394 1.00 . B B . 38 LEU CA 1 1 2 1328 2 2 17 LEU CB C 3.979 -4.034 -6.266 1.00 . B B . 38 LEU CB 1 1 2 1329 2 2 17 LEU CD1 C 3.268 -2.078 -7.640 1.00 . B B . 38 LEU CD1 1 1 2 1330 2 2 17 LEU CD2 C 1.771 -4.063 -7.440 1.00 . B B . 38 LEU CD2 1 1 2 1331 2 2 17 LEU CG C 2.787 -3.189 -6.705 1.00 . B B . 38 LEU CG 1 1 2 1332 2 2 17 LEU H H 1.878 -3.982 -4.682 1.00 . B B . 38 LEU H 1 1 2 1333 2 2 17 LEU HA H 3.402 -6.086 -6.004 1.00 . B B . 38 LEU HA 1 1 2 1334 2 2 17 LEU HB2 H 4.663 -3.420 -5.700 1.00 . B B . 38 LEU HB2 1 1 2 1335 2 2 17 LEU HB3 H 4.484 -4.420 -7.140 1.00 . B B . 38 LEU HB3 1 1 2 1336 2 2 17 LEU HD11 H 4.164 -1.631 -7.237 1.00 . B B . 38 LEU HD11 1 1 2 1337 2 2 17 LEU HD12 H 2.499 -1.325 -7.729 1.00 . B B . 38 LEU HD12 1 1 2 1338 2 2 17 LEU HD13 H 3.479 -2.493 -8.615 1.00 . B B . 38 LEU HD13 1 1 2 1339 2 2 17 LEU HD21 H 2.217 -4.452 -8.342 1.00 . B B . 38 LEU HD21 1 1 2 1340 2 2 17 LEU HD22 H 0.905 -3.467 -7.695 1.00 . B B . 38 LEU HD22 1 1 2 1341 2 2 17 LEU HD23 H 1.470 -4.881 -6.804 1.00 . B B . 38 LEU HD23 1 1 2 1342 2 2 17 LEU HG H 2.328 -2.752 -5.838 1.00 . B B . 38 LEU HG 1 1 2 1343 2 2 17 LEU N N 2.201 -4.901 -4.741 1.00 . B B . 38 LEU N 1 1 2 1344 2 2 17 LEU O O 5.207 -6.480 -4.286 1.00 . B B . 38 LEU O 1 1 2 1345 2 2 18 VAL C C 5.383 -6.064 -1.601 1.00 . B B . 39 VAL C 1 1 2 1346 2 2 18 VAL CA C 5.660 -4.727 -2.289 1.00 . B B . 39 VAL CA 1 1 2 1347 2 2 18 VAL CB C 5.503 -3.580 -1.285 1.00 . B B . 39 VAL CB 1 1 2 1348 2 2 18 VAL CG1 C 5.334 -2.262 -2.043 1.00 . B B . 39 VAL CG1 1 1 2 1349 2 2 18 VAL CG2 C 4.266 -3.817 -0.411 1.00 . B B . 39 VAL CG2 1 1 2 1350 2 2 18 VAL H H 4.129 -3.734 -3.424 1.00 . B B . 39 VAL H 1 1 2 1351 2 2 18 VAL HA H 6.663 -4.724 -2.690 1.00 . B B . 39 VAL HA 1 1 2 1352 2 2 18 VAL HB H 6.380 -3.524 -0.660 1.00 . B B . 39 VAL HB 1 1 2 1353 2 2 18 VAL HG11 H 6.055 -1.544 -1.684 1.00 . B B . 39 VAL HG11 1 1 2 1354 2 2 18 VAL HG12 H 4.337 -1.880 -1.882 1.00 . B B . 39 VAL HG12 1 1 2 1355 2 2 18 VAL HG13 H 5.489 -2.432 -3.098 1.00 . B B . 39 VAL HG13 1 1 2 1356 2 2 18 VAL HG21 H 3.375 -3.718 -1.013 1.00 . B B . 39 VAL HG21 1 1 2 1357 2 2 18 VAL HG22 H 4.246 -3.090 0.385 1.00 . B B . 39 VAL HG22 1 1 2 1358 2 2 18 VAL HG23 H 4.306 -4.809 0.013 1.00 . B B . 39 VAL HG23 1 1 2 1359 2 2 18 VAL N N 4.680 -4.544 -3.390 1.00 . B B . 39 VAL N 1 1 2 1360 2 2 18 VAL O O 6.277 -6.721 -1.105 1.00 . B B . 39 VAL O 1 1 2 1361 2 2 19 CYS C C 3.064 -8.660 -1.900 1.00 . B B . 40 CYS C 1 1 2 1362 2 2 19 CYS CA C 3.786 -7.749 -0.902 1.00 . B B . 40 CYS CA 1 1 2 1363 2 2 19 CYS CB C 2.862 -7.467 0.283 1.00 . B B . 40 CYS CB 1 1 2 1364 2 2 19 CYS H H 3.438 -5.911 -1.965 1.00 . B B . 40 CYS H 1 1 2 1365 2 2 19 CYS HA H 4.683 -8.233 -0.552 1.00 . B B . 40 CYS HA 1 1 2 1366 2 2 19 CYS HB2 H 2.329 -6.543 0.112 1.00 . B B . 40 CYS HB2 1 1 2 1367 2 2 19 CYS HB3 H 2.154 -8.275 0.389 1.00 . B B . 40 CYS HB3 1 1 2 1368 2 2 19 CYS N N 4.141 -6.463 -1.562 1.00 . B B . 40 CYS N 1 1 2 1369 2 2 19 CYS O O 2.118 -9.341 -1.559 1.00 . B B . 40 CYS O 1 1 2 1370 2 2 19 CYS SG S 3.846 -7.324 1.795 1.00 . B B . 40 CYS SG 1 1 2 1371 2 2 20 GLY C C 2.770 -10.986 -3.637 1.00 . B B . 41 GLY C 1 1 2 1372 2 2 20 GLY CA C 2.836 -9.543 -4.145 1.00 . B B . 41 GLY CA 1 1 2 1373 2 2 20 GLY H H 4.264 -8.118 -3.387 1.00 . B B . 41 GLY H 1 1 2 1374 2 2 20 GLY HA2 H 1.834 -9.179 -4.326 1.00 . B B . 41 GLY HA2 1 1 2 1375 2 2 20 GLY HA3 H 3.400 -9.515 -5.064 1.00 . B B . 41 GLY HA3 1 1 2 1376 2 2 20 GLY N N 3.501 -8.677 -3.129 1.00 . B B . 41 GLY N 1 1 2 1377 2 2 20 GLY O O 1.850 -11.718 -3.941 1.00 . B B . 41 GLY O 1 1 2 1378 2 2 21 GLU C C 2.809 -12.903 -1.135 1.00 . B B . 42 GLU C 1 1 2 1379 2 2 21 GLU CA C 3.733 -12.802 -2.352 1.00 . B B . 42 GLU CA 1 1 2 1380 2 2 21 GLU CB C 5.153 -13.199 -1.947 1.00 . B B . 42 GLU CB 1 1 2 1381 2 2 21 GLU CD C 7.164 -12.215 -0.838 1.00 . B B . 42 GLU CD 1 1 2 1382 2 2 21 GLU CG C 5.636 -12.281 -0.823 1.00 . B B . 42 GLU CG 1 1 2 1383 2 2 21 GLU H H 4.477 -10.799 -2.639 1.00 . B B . 42 GLU H 1 1 2 1384 2 2 21 GLU HA H 3.381 -13.468 -3.125 1.00 . B B . 42 GLU HA 1 1 2 1385 2 2 21 GLU HB2 H 5.156 -14.224 -1.604 1.00 . B B . 42 GLU HB2 1 1 2 1386 2 2 21 GLU HB3 H 5.810 -13.101 -2.798 1.00 . B B . 42 GLU HB3 1 1 2 1387 2 2 21 GLU HG2 H 5.231 -11.290 -0.970 1.00 . B B . 42 GLU HG2 1 1 2 1388 2 2 21 GLU HG3 H 5.304 -12.669 0.128 1.00 . B B . 42 GLU HG3 1 1 2 1389 2 2 21 GLU N N 3.741 -11.403 -2.870 1.00 . B B . 42 GLU N 1 1 2 1390 2 2 21 GLU O O 2.755 -13.918 -0.469 1.00 . B B . 42 GLU O 1 1 2 1391 2 2 21 GLU OE1 O 7.774 -13.164 -1.302 1.00 . B B . 42 GLU OE1 1 1 2 1392 2 2 21 GLU OE2 O 7.699 -11.216 -0.385 1.00 . B B . 42 GLU OE2 1 1 2 1393 2 2 22 ARG C C -0.285 -11.769 -0.163 1.00 . B B . 43 ARG C 1 1 2 1394 2 2 22 ARG CA C 1.162 -11.903 0.333 1.00 . B B . 43 ARG CA 1 1 2 1395 2 2 22 ARG CB C 1.535 -10.761 1.303 1.00 . B B . 43 ARG CB 1 1 2 1396 2 2 22 ARG CD C -0.072 -8.945 0.686 1.00 . B B . 43 ARG CD 1 1 2 1397 2 2 22 ARG CG C 0.293 -9.978 1.754 1.00 . B B . 43 ARG CG 1 1 2 1398 2 2 22 ARG CZ C -2.181 -7.955 0.030 1.00 . B B . 43 ARG CZ 1 1 2 1399 2 2 22 ARG H H 2.137 -11.052 -1.388 1.00 . B B . 43 ARG H 1 1 2 1400 2 2 22 ARG HA H 1.276 -12.851 0.838 1.00 . B B . 43 ARG HA 1 1 2 1401 2 2 22 ARG HB2 H 2.021 -11.180 2.171 1.00 . B B . 43 ARG HB2 1 1 2 1402 2 2 22 ARG HB3 H 2.218 -10.087 0.808 1.00 . B B . 43 ARG HB3 1 1 2 1403 2 2 22 ARG HD2 H 0.165 -7.955 1.047 1.00 . B B . 43 ARG HD2 1 1 2 1404 2 2 22 ARG HD3 H 0.492 -9.144 -0.214 1.00 . B B . 43 ARG HD3 1 1 2 1405 2 2 22 ARG HE H -1.996 -9.885 0.456 1.00 . B B . 43 ARG HE 1 1 2 1406 2 2 22 ARG HG2 H -0.533 -10.661 1.893 1.00 . B B . 43 ARG HG2 1 1 2 1407 2 2 22 ARG HG3 H 0.504 -9.473 2.684 1.00 . B B . 43 ARG HG3 1 1 2 1408 2 2 22 ARG HH11 H -1.293 -6.780 1.386 1.00 . B B . 43 ARG HH11 1 1 2 1409 2 2 22 ARG HH12 H -2.462 -6.002 0.371 1.00 . B B . 43 ARG HH12 1 1 2 1410 2 2 22 ARG HH21 H -3.214 -8.879 -1.413 1.00 . B B . 43 ARG HH21 1 1 2 1411 2 2 22 ARG HH22 H -3.547 -7.191 -1.217 1.00 . B B . 43 ARG HH22 1 1 2 1412 2 2 22 ARG N N 2.081 -11.861 -0.839 1.00 . B B . 43 ARG N 1 1 2 1413 2 2 22 ARG NE N -1.528 -9.027 0.387 1.00 . B B . 43 ARG NE 1 1 2 1414 2 2 22 ARG NH1 N -1.962 -6.824 0.643 1.00 . B B . 43 ARG NH1 1 1 2 1415 2 2 22 ARG NH2 N -3.049 -8.013 -0.942 1.00 . B B . 43 ARG NH2 1 1 2 1416 2 2 22 ARG O O -0.577 -11.001 -1.057 1.00 . B B . 43 ARG O 1 1 2 1417 2 2 23 GLY C C -3.424 -11.660 1.015 1.00 . B B . 44 GLY C 1 1 2 1418 2 2 23 GLY CA C -2.610 -12.432 -0.024 1.00 . B B . 44 GLY CA 1 1 2 1419 2 2 23 GLY H H -0.932 -13.128 1.133 1.00 . B B . 44 GLY H 1 1 2 1420 2 2 23 GLY HA2 H -2.664 -11.924 -0.977 1.00 . B B . 44 GLY HA2 1 1 2 1421 2 2 23 GLY HA3 H -3.014 -13.428 -0.123 1.00 . B B . 44 GLY HA3 1 1 2 1422 2 2 23 GLY N N -1.189 -12.514 0.413 1.00 . B B . 44 GLY N 1 1 2 1423 2 2 23 GLY O O -3.083 -11.620 2.181 1.00 . B B . 44 GLY O 1 1 2 1424 2 2 24 GLY C C -6.755 -10.141 1.013 1.00 . B B . 45 GLY C 1 1 2 1425 2 2 24 GLY CA C -5.335 -10.275 1.566 1.00 . B B . 45 GLY CA 1 1 2 1426 2 2 24 GLY H H -4.755 -11.090 -0.342 1.00 . B B . 45 GLY H 1 1 2 1427 2 2 24 GLY HA2 H -5.362 -10.795 2.513 1.00 . B B . 45 GLY HA2 1 1 2 1428 2 2 24 GLY HA3 H -4.913 -9.292 1.705 1.00 . B B . 45 GLY HA3 1 1 2 1429 2 2 24 GLY N N -4.498 -11.045 0.602 1.00 . B B . 45 GLY N 1 1 2 1430 2 2 24 GLY O O -7.220 -10.978 0.264 1.00 . B B . 45 GLY O 1 1 2 1431 2 2 25 PHE C C -9.232 -7.443 0.966 1.00 . B B . 46 PHE C 1 1 2 1432 2 2 25 PHE CA C -8.837 -8.918 0.870 1.00 . B B . 46 PHE CA 1 1 2 1433 2 2 25 PHE CB C -9.792 -9.754 1.716 1.00 . B B . 46 PHE CB 1 1 2 1434 2 2 25 PHE CD1 C -10.216 -11.821 0.202 1.00 . B B . 46 PHE CD1 1 1 2 1435 2 2 25 PHE CD2 C -12.010 -10.189 0.435 1.00 . B B . 46 PHE CD2 1 1 2 1436 2 2 25 PHE CE1 C -11.032 -12.578 -0.648 1.00 . B B . 46 PHE CE1 1 1 2 1437 2 2 25 PHE CE2 C -12.808 -10.961 -0.419 1.00 . B B . 46 PHE CE2 1 1 2 1438 2 2 25 PHE CG C -10.692 -10.605 0.767 1.00 . B B . 46 PHE CG 1 1 2 1439 2 2 25 PHE CZ C -12.321 -12.151 -0.955 1.00 . B B . 46 PHE CZ 1 1 2 1440 2 2 25 PHE H H -7.058 -8.435 1.982 1.00 . B B . 46 PHE H 1 1 2 1441 2 2 25 PHE HA H -8.891 -9.243 -0.155 1.00 . B B . 46 PHE HA 1 1 2 1442 2 2 25 PHE HB2 H -9.191 -10.395 2.376 1.00 . B B . 46 PHE HB2 1 1 2 1443 2 2 25 PHE HB3 H -10.400 -9.079 2.333 1.00 . B B . 46 PHE HB3 1 1 2 1444 2 2 25 PHE HD1 H -9.230 -12.178 0.407 1.00 . B B . 46 PHE HD1 1 1 2 1445 2 2 25 PHE HD2 H -12.414 -9.277 0.818 1.00 . B B . 46 PHE HD2 1 1 2 1446 2 2 25 PHE HE1 H -10.658 -13.500 -1.069 1.00 . B B . 46 PHE HE1 1 1 2 1447 2 2 25 PHE HE2 H -13.808 -10.634 -0.660 1.00 . B B . 46 PHE HE2 1 1 2 1448 2 2 25 PHE HZ H -12.944 -12.742 -1.611 1.00 . B B . 46 PHE HZ 1 1 2 1449 2 2 25 PHE N N -7.449 -9.098 1.376 1.00 . B B . 46 PHE N 1 1 2 1450 2 2 25 PHE O O -10.382 -7.112 1.176 1.00 . B B . 46 PHE O 1 1 2 1451 2 2 26 TYR C C -9.694 -4.757 -0.118 1.00 . B B . 47 TYR C 1 1 2 1452 2 2 26 TYR CA C -8.611 -5.103 0.908 1.00 . B B . 47 TYR CA 1 1 2 1453 2 2 26 TYR CB C -7.344 -4.288 0.622 1.00 . B B . 47 TYR CB 1 1 2 1454 2 2 26 TYR CD1 C -8.583 -2.470 2.039 1.00 . B B . 47 TYR CD1 1 1 2 1455 2 2 26 TYR CD2 C -6.641 -1.794 0.729 1.00 . B B . 47 TYR CD2 1 1 2 1456 2 2 26 TYR CE1 C -8.722 -1.150 2.488 1.00 . B B . 47 TYR CE1 1 1 2 1457 2 2 26 TYR CE2 C -6.802 -0.482 1.192 1.00 . B B . 47 TYR CE2 1 1 2 1458 2 2 26 TYR CG C -7.527 -2.823 1.140 1.00 . B B . 47 TYR CG 1 1 2 1459 2 2 26 TYR CZ C -7.836 -0.163 2.066 1.00 . B B . 47 TYR CZ 1 1 2 1460 2 2 26 TYR H H -7.367 -6.844 0.655 1.00 . B B . 47 TYR H 1 1 2 1461 2 2 26 TYR HA H -8.968 -4.882 1.898 1.00 . B B . 47 TYR HA 1 1 2 1462 2 2 26 TYR HB2 H -6.495 -4.781 1.123 1.00 . B B . 47 TYR HB2 1 1 2 1463 2 2 26 TYR HB3 H -7.162 -4.295 -0.462 1.00 . B B . 47 TYR HB3 1 1 2 1464 2 2 26 TYR HD1 H -9.290 -3.196 2.388 1.00 . B B . 47 TYR HD1 1 1 2 1465 2 2 26 TYR HD2 H -5.841 -1.998 0.060 1.00 . B B . 47 TYR HD2 1 1 2 1466 2 2 26 TYR HE1 H -9.523 -0.896 3.167 1.00 . B B . 47 TYR HE1 1 1 2 1467 2 2 26 TYR HE2 H -6.118 0.288 0.868 1.00 . B B . 47 TYR HE2 1 1 2 1468 2 2 26 TYR HH H -8.035 1.109 3.474 1.00 . B B . 47 TYR HH 1 1 2 1469 2 2 26 TYR N N -8.289 -6.556 0.819 1.00 . B B . 47 TYR N 1 1 2 1470 2 2 26 TYR O O -10.354 -3.741 -0.021 1.00 . B B . 47 TYR O 1 1 2 1471 2 2 26 TYR OH O -7.982 1.133 2.516 1.00 . B B . 47 TYR OH 1 1 2 1472 2 2 27 THR C C -12.302 -5.283 -1.474 1.00 . B B . 48 THR C 1 1 2 1473 2 2 27 THR CA C -10.923 -5.325 -2.133 1.00 . B B . 48 THR CA 1 1 2 1474 2 2 27 THR CB C -10.889 -6.434 -3.190 1.00 . B B . 48 THR CB 1 1 2 1475 2 2 27 THR CG2 C -12.163 -6.384 -4.037 1.00 . B B . 48 THR CG2 1 1 2 1476 2 2 27 THR H H -9.339 -6.410 -1.154 1.00 . B B . 48 THR H 1 1 2 1477 2 2 27 THR HA H -10.722 -4.376 -2.601 1.00 . B B . 48 THR HA 1 1 2 1478 2 2 27 THR HB H -10.825 -7.394 -2.702 1.00 . B B . 48 THR HB 1 1 2 1479 2 2 27 THR HG1 H -9.899 -6.755 -4.834 1.00 . B B . 48 THR HG1 1 1 2 1480 2 2 27 THR HG21 H -12.439 -5.355 -4.211 1.00 . B B . 48 THR HG21 1 1 2 1481 2 2 27 THR HG22 H -12.962 -6.889 -3.515 1.00 . B B . 48 THR HG22 1 1 2 1482 2 2 27 THR HG23 H -11.985 -6.875 -4.983 1.00 . B B . 48 THR HG23 1 1 2 1483 2 2 27 THR N N -9.883 -5.598 -1.099 1.00 . B B . 48 THR N 1 1 2 1484 2 2 27 THR O O -13.211 -4.632 -1.948 1.00 . B B . 48 THR O 1 1 2 1485 2 2 27 THR OG1 O -9.756 -6.252 -4.028 1.00 . B B . 48 THR OG1 1 1 2 1486 2 2 28 LYS C C -13.557 -6.297 1.795 1.00 . B B . 49 LYS C 1 1 2 1487 2 2 28 LYS CA C -13.775 -5.980 0.313 1.00 . B B . 49 LYS CA 1 1 2 1488 2 2 28 LYS CB C -14.681 -7.043 -0.313 1.00 . B B . 49 LYS CB 1 1 2 1489 2 2 28 LYS CD C -16.874 -6.675 -1.454 1.00 . B B . 49 LYS CD 1 1 2 1490 2 2 28 LYS CE C -18.382 -6.555 -1.220 1.00 . B B . 49 LYS CE 1 1 2 1491 2 2 28 LYS CG C -16.145 -6.649 -0.109 1.00 . B B . 49 LYS CG 1 1 2 1492 2 2 28 LYS H H -11.710 -6.488 -0.023 1.00 . B B . 49 LYS H 1 1 2 1493 2 2 28 LYS HA H -14.239 -5.009 0.217 1.00 . B B . 49 LYS HA 1 1 2 1494 2 2 28 LYS HB2 H -14.470 -7.116 -1.370 1.00 . B B . 49 LYS HB2 1 1 2 1495 2 2 28 LYS HB3 H -14.497 -7.996 0.159 1.00 . B B . 49 LYS HB3 1 1 2 1496 2 2 28 LYS HD2 H -16.536 -5.849 -2.063 1.00 . B B . 49 LYS HD2 1 1 2 1497 2 2 28 LYS HD3 H -16.664 -7.606 -1.959 1.00 . B B . 49 LYS HD3 1 1 2 1498 2 2 28 LYS HE2 H -18.737 -7.437 -0.707 1.00 . B B . 49 LYS HE2 1 1 2 1499 2 2 28 LYS HE3 H -18.584 -5.683 -0.617 1.00 . B B . 49 LYS HE3 1 1 2 1500 2 2 28 LYS HG2 H -16.613 -7.346 0.570 1.00 . B B . 49 LYS HG2 1 1 2 1501 2 2 28 LYS HG3 H -16.195 -5.653 0.305 1.00 . B B . 49 LYS HG3 1 1 2 1502 2 2 28 LYS HZ1 H -19.092 -7.348 -3.010 1.00 . B B . 49 LYS HZ1 1 1 2 1503 2 2 28 LYS HZ2 H -18.585 -5.730 -3.121 1.00 . B B . 49 LYS HZ2 1 1 2 1504 2 2 28 LYS HZ3 H -20.060 -6.112 -2.370 1.00 . B B . 49 LYS HZ3 1 1 2 1505 2 2 28 LYS N N -12.460 -5.974 -0.385 1.00 . B B . 49 LYS N 1 1 2 1506 2 2 28 LYS NZ N -19.082 -6.427 -2.529 1.00 . B B . 49 LYS NZ 1 1 2 1507 2 2 28 LYS O O -13.610 -7.442 2.198 1.00 . B B . 49 LYS O 1 1 2 1508 2 2 29 PRO C C -14.384 -5.620 4.754 1.00 . B B . 50 PRO C 1 1 2 1509 2 2 29 PRO CA C -13.069 -5.387 4.005 1.00 . B B . 50 PRO CA 1 1 2 1510 2 2 29 PRO CB C -12.450 -4.040 4.385 1.00 . B B . 50 PRO CB 1 1 2 1511 2 2 29 PRO CD C -13.252 -3.881 2.054 1.00 . B B . 50 PRO CD 1 1 2 1512 2 2 29 PRO CG C -12.882 -3.040 3.288 1.00 . B B . 50 PRO CG 1 1 2 1513 2 2 29 PRO HA H -12.372 -6.179 4.201 1.00 . B B . 50 PRO HA 1 1 2 1514 2 2 29 PRO HB2 H -12.821 -3.722 5.350 1.00 . B B . 50 PRO HB2 1 1 2 1515 2 2 29 PRO HB3 H -11.375 -4.116 4.405 1.00 . B B . 50 PRO HB3 1 1 2 1516 2 2 29 PRO HD2 H -14.213 -3.579 1.666 1.00 . B B . 50 PRO HD2 1 1 2 1517 2 2 29 PRO HD3 H -12.490 -3.797 1.297 1.00 . B B . 50 PRO HD3 1 1 2 1518 2 2 29 PRO HG2 H -13.738 -2.471 3.623 1.00 . B B . 50 PRO HG2 1 1 2 1519 2 2 29 PRO HG3 H -12.065 -2.378 3.047 1.00 . B B . 50 PRO HG3 1 1 2 1520 2 2 29 PRO N N -13.310 -5.265 2.560 1.00 . B B . 50 PRO N 1 1 2 1521 2 2 29 PRO O O -15.457 -5.517 4.194 1.00 . B B . 50 PRO O 1 1 2 1522 2 2 30 THR C C -16.206 -4.840 7.145 1.00 . B B . 51 THR C 1 1 2 1523 2 2 30 THR CA C -15.547 -6.179 6.804 1.00 . B B . 51 THR CA 1 1 2 1524 2 2 30 THR CB C -15.192 -6.918 8.096 1.00 . B B . 51 THR CB 1 1 2 1525 2 2 30 THR CG2 C -15.139 -8.422 7.824 1.00 . B B . 51 THR CG2 1 1 2 1526 2 2 30 THR H H -13.430 -6.016 6.450 1.00 . B B . 51 THR H 1 1 2 1527 2 2 30 THR HA H -16.231 -6.779 6.222 1.00 . B B . 51 THR HA 1 1 2 1528 2 2 30 THR HB H -15.943 -6.718 8.845 1.00 . B B . 51 THR HB 1 1 2 1529 2 2 30 THR HG1 H -14.071 -5.764 9.189 1.00 . B B . 51 THR HG1 1 1 2 1530 2 2 30 THR HG21 H -16.138 -8.831 7.865 1.00 . B B . 51 THR HG21 1 1 2 1531 2 2 30 THR HG22 H -14.523 -8.901 8.571 1.00 . B B . 51 THR HG22 1 1 2 1532 2 2 30 THR HG23 H -14.719 -8.596 6.845 1.00 . B B . 51 THR HG23 1 1 2 1533 2 2 30 THR N N -14.306 -5.936 6.018 1.00 . B B . 51 THR N 1 1 2 1534 2 2 30 THR O O -17.370 -4.676 6.820 1.00 . B B . 51 THR O 1 1 2 1535 2 2 30 THR OXT O -15.535 -4.003 7.726 1.00 . B B . 51 THR OXT 1 1 2 1536 2 2 30 THR OG1 O -13.925 -6.474 8.560 1.00 . B B . 51 THR OG1 1 1 3 1537 1 1 1 GLY C C -6.755 6.533 2.141 1.00 . A A . 1 GLY C 1 1 3 1538 1 1 1 GLY CA C -8.233 6.694 2.024 1.00 . A A . 1 GLY CA 1 1 3 1539 1 1 1 GLY H1 H -8.582 4.712 2.677 1.00 . A A . 1 GLY H1 1 1 3 1540 1 1 1 GLY H2 H -9.543 5.174 1.355 1.00 . A A . 1 GLY H2 1 1 3 1541 1 1 1 GLY H3 H -9.906 5.748 2.912 1.00 . A A . 1 GLY H3 1 1 3 1542 1 1 1 GLY HA2 H -8.040 6.812 1.076 1.00 . A A . 1 GLY HA2 1 1 3 1543 1 1 1 GLY HA3 H -8.768 7.617 2.498 1.00 . A A . 1 GLY HA3 1 1 3 1544 1 1 1 GLY N N -9.139 5.486 2.261 1.00 . A A . 1 GLY N 1 1 3 1545 1 1 1 GLY O O -6.109 7.188 2.934 1.00 . A A . 1 GLY O 1 1 3 1546 1 1 2 ILE C C -4.005 6.335 0.409 1.00 . A A . 2 ILE C 1 1 3 1547 1 1 2 ILE CA C -4.713 5.439 1.428 1.00 . A A . 2 ILE CA 1 1 3 1548 1 1 2 ILE CB C -4.403 3.974 1.119 1.00 . A A . 2 ILE CB 1 1 3 1549 1 1 2 ILE CD1 C -4.932 1.648 1.850 1.00 . A A . 2 ILE CD1 1 1 3 1550 1 1 2 ILE CG1 C -4.845 3.105 2.299 1.00 . A A . 2 ILE CG1 1 1 3 1551 1 1 2 ILE CG2 C -2.898 3.806 0.897 1.00 . A A . 2 ILE CG2 1 1 3 1552 1 1 2 ILE H H -6.728 5.138 0.731 1.00 . A A . 2 ILE H 1 1 3 1553 1 1 2 ILE HA H -4.360 5.674 2.421 1.00 . A A . 2 ILE HA 1 1 3 1554 1 1 2 ILE HB H -4.934 3.674 0.227 1.00 . A A . 2 ILE HB 1 1 3 1555 1 1 2 ILE HD11 H -3.946 1.210 1.858 1.00 . A A . 2 ILE HD11 1 1 3 1556 1 1 2 ILE HD12 H -5.338 1.604 0.851 1.00 . A A . 2 ILE HD12 1 1 3 1557 1 1 2 ILE HD13 H -5.576 1.103 2.525 1.00 . A A . 2 ILE HD13 1 1 3 1558 1 1 2 ILE HG12 H -4.127 3.194 3.101 1.00 . A A . 2 ILE HG12 1 1 3 1559 1 1 2 ILE HG13 H -5.814 3.432 2.644 1.00 . A A . 2 ILE HG13 1 1 3 1560 1 1 2 ILE HG21 H -2.584 4.427 0.072 1.00 . A A . 2 ILE HG21 1 1 3 1561 1 1 2 ILE HG22 H -2.680 2.772 0.673 1.00 . A A . 2 ILE HG22 1 1 3 1562 1 1 2 ILE HG23 H -2.367 4.100 1.791 1.00 . A A . 2 ILE HG23 1 1 3 1563 1 1 2 ILE N N -6.185 5.657 1.360 1.00 . A A . 2 ILE N 1 1 3 1564 1 1 2 ILE O O -2.872 6.730 0.598 1.00 . A A . 2 ILE O 1 1 3 1565 1 1 3 VAL C C -3.695 8.886 -1.082 1.00 . A A . 3 VAL C 1 1 3 1566 1 1 3 VAL CA C -4.013 7.524 -1.697 1.00 . A A . 3 VAL CA 1 1 3 1567 1 1 3 VAL CB C -4.952 7.688 -2.901 1.00 . A A . 3 VAL CB 1 1 3 1568 1 1 3 VAL CG1 C -5.685 6.371 -3.153 1.00 . A A . 3 VAL CG1 1 1 3 1569 1 1 3 VAL CG2 C -5.982 8.791 -2.626 1.00 . A A . 3 VAL CG2 1 1 3 1570 1 1 3 VAL H H -5.572 6.329 -0.811 1.00 . A A . 3 VAL H 1 1 3 1571 1 1 3 VAL HA H -3.096 7.064 -2.020 1.00 . A A . 3 VAL HA 1 1 3 1572 1 1 3 VAL HB H -4.371 7.946 -3.775 1.00 . A A . 3 VAL HB 1 1 3 1573 1 1 3 VAL HG11 H -5.210 5.581 -2.591 1.00 . A A . 3 VAL HG11 1 1 3 1574 1 1 3 VAL HG12 H -5.648 6.135 -4.207 1.00 . A A . 3 VAL HG12 1 1 3 1575 1 1 3 VAL HG13 H -6.715 6.466 -2.841 1.00 . A A . 3 VAL HG13 1 1 3 1576 1 1 3 VAL HG21 H -6.627 8.903 -3.486 1.00 . A A . 3 VAL HG21 1 1 3 1577 1 1 3 VAL HG22 H -5.470 9.723 -2.437 1.00 . A A . 3 VAL HG22 1 1 3 1578 1 1 3 VAL HG23 H -6.575 8.524 -1.764 1.00 . A A . 3 VAL HG23 1 1 3 1579 1 1 3 VAL N N -4.660 6.658 -0.672 1.00 . A A . 3 VAL N 1 1 3 1580 1 1 3 VAL O O -2.681 9.489 -1.362 1.00 . A A . 3 VAL O 1 1 3 1581 1 1 4 GLU C C -3.264 10.545 1.497 1.00 . A A . 4 GLU C 1 1 3 1582 1 1 4 GLU CA C -4.316 10.691 0.395 1.00 . A A . 4 GLU CA 1 1 3 1583 1 1 4 GLU CB C -5.625 11.205 0.999 1.00 . A A . 4 GLU CB 1 1 3 1584 1 1 4 GLU CD C -7.660 12.300 0.043 1.00 . A A . 4 GLU CD 1 1 3 1585 1 1 4 GLU CG C -6.750 11.073 -0.032 1.00 . A A . 4 GLU CG 1 1 3 1586 1 1 4 GLU H H -5.366 8.860 -0.035 1.00 . A A . 4 GLU H 1 1 3 1587 1 1 4 GLU HA H -3.964 11.391 -0.348 1.00 . A A . 4 GLU HA 1 1 3 1588 1 1 4 GLU HB2 H -5.869 10.624 1.877 1.00 . A A . 4 GLU HB2 1 1 3 1589 1 1 4 GLU HB3 H -5.511 12.243 1.274 1.00 . A A . 4 GLU HB3 1 1 3 1590 1 1 4 GLU HG2 H -6.323 11.001 -1.023 1.00 . A A . 4 GLU HG2 1 1 3 1591 1 1 4 GLU HG3 H -7.328 10.185 0.176 1.00 . A A . 4 GLU HG3 1 1 3 1592 1 1 4 GLU N N -4.557 9.369 -0.245 1.00 . A A . 4 GLU N 1 1 3 1593 1 1 4 GLU O O -2.894 11.504 2.145 1.00 . A A . 4 GLU O 1 1 3 1594 1 1 4 GLU OE1 O -7.162 13.395 -0.161 1.00 . A A . 4 GLU OE1 1 1 3 1595 1 1 4 GLU OE2 O -8.838 12.125 0.304 1.00 . A A . 4 GLU OE2 1 1 3 1596 1 1 5 GLN C C -0.375 8.945 2.153 1.00 . A A . 5 GLN C 1 1 3 1597 1 1 5 GLN CA C -1.755 9.155 2.784 1.00 . A A . 5 GLN CA 1 1 3 1598 1 1 5 GLN CB C -2.121 7.927 3.621 1.00 . A A . 5 GLN CB 1 1 3 1599 1 1 5 GLN CD C -0.871 9.029 5.488 1.00 . A A . 5 GLN CD 1 1 3 1600 1 1 5 GLN CG C -2.165 8.310 5.103 1.00 . A A . 5 GLN CG 1 1 3 1601 1 1 5 GLN H H -3.088 8.590 1.187 1.00 . A A . 5 GLN H 1 1 3 1602 1 1 5 GLN HA H -1.729 10.026 3.420 1.00 . A A . 5 GLN HA 1 1 3 1603 1 1 5 GLN HB2 H -3.089 7.559 3.315 1.00 . A A . 5 GLN HB2 1 1 3 1604 1 1 5 GLN HB3 H -1.380 7.156 3.473 1.00 . A A . 5 GLN HB3 1 1 3 1605 1 1 5 GLN HE21 H 0.098 7.350 5.912 1.00 . A A . 5 GLN HE21 1 1 3 1606 1 1 5 GLN HE22 H 0.993 8.776 6.124 1.00 . A A . 5 GLN HE22 1 1 3 1607 1 1 5 GLN HG2 H -3.007 8.963 5.281 1.00 . A A . 5 GLN HG2 1 1 3 1608 1 1 5 GLN HG3 H -2.268 7.418 5.701 1.00 . A A . 5 GLN HG3 1 1 3 1609 1 1 5 GLN N N -2.779 9.353 1.719 1.00 . A A . 5 GLN N 1 1 3 1610 1 1 5 GLN NE2 N 0.159 8.327 5.873 1.00 . A A . 5 GLN NE2 1 1 3 1611 1 1 5 GLN O O 0.613 9.487 2.608 1.00 . A A . 5 GLN O 1 1 3 1612 1 1 5 GLN OE1 O -0.797 10.240 5.440 1.00 . A A . 5 GLN OE1 1 1 3 1613 1 1 6 CYS C C 1.141 8.702 -0.826 1.00 . A A . 6 CYS C 1 1 3 1614 1 1 6 CYS CA C 1.029 7.905 0.474 1.00 . A A . 6 CYS CA 1 1 3 1615 1 1 6 CYS CB C 1.173 6.412 0.177 1.00 . A A . 6 CYS CB 1 1 3 1616 1 1 6 CYS H H -1.099 7.719 0.767 1.00 . A A . 6 CYS H 1 1 3 1617 1 1 6 CYS HA H 1.816 8.211 1.147 1.00 . A A . 6 CYS HA 1 1 3 1618 1 1 6 CYS HB2 H 0.302 6.065 -0.359 1.00 . A A . 6 CYS HB2 1 1 3 1619 1 1 6 CYS HB3 H 2.056 6.247 -0.424 1.00 . A A . 6 CYS HB3 1 1 3 1620 1 1 6 CYS N N -0.294 8.155 1.116 1.00 . A A . 6 CYS N 1 1 3 1621 1 1 6 CYS O O 2.219 9.088 -1.232 1.00 . A A . 6 CYS O 1 1 3 1622 1 1 6 CYS SG S 1.327 5.508 1.737 1.00 . A A . 6 CYS SG 1 1 3 1623 1 1 7 CYS C C 0.494 11.181 -2.436 1.00 . A A . 7 CYS C 1 1 3 1624 1 1 7 CYS CA C 0.114 9.735 -2.750 1.00 . A A . 7 CYS CA 1 1 3 1625 1 1 7 CYS CB C -1.241 9.708 -3.450 1.00 . A A . 7 CYS CB 1 1 3 1626 1 1 7 CYS H H -0.819 8.643 -1.143 1.00 . A A . 7 CYS H 1 1 3 1627 1 1 7 CYS HA H 0.862 9.300 -3.397 1.00 . A A . 7 CYS HA 1 1 3 1628 1 1 7 CYS HB2 H -1.733 8.767 -3.249 1.00 . A A . 7 CYS HB2 1 1 3 1629 1 1 7 CYS HB3 H -1.853 10.518 -3.083 1.00 . A A . 7 CYS HB3 1 1 3 1630 1 1 7 CYS N N 0.045 8.957 -1.483 1.00 . A A . 7 CYS N 1 1 3 1631 1 1 7 CYS O O 0.740 11.974 -3.322 1.00 . A A . 7 CYS O 1 1 3 1632 1 1 7 CYS SG S -0.997 9.894 -5.231 1.00 . A A . 7 CYS SG 1 1 3 1633 1 1 8 THR C C 2.406 12.934 -0.416 1.00 . A A . 8 THR C 1 1 3 1634 1 1 8 THR CA C 0.930 12.921 -0.814 1.00 . A A . 8 THR CA 1 1 3 1635 1 1 8 THR CB C 0.080 13.391 0.368 1.00 . A A . 8 THR CB 1 1 3 1636 1 1 8 THR CG2 C 0.380 12.522 1.589 1.00 . A A . 8 THR CG2 1 1 3 1637 1 1 8 THR H H 0.353 10.876 -0.479 1.00 . A A . 8 THR H 1 1 3 1638 1 1 8 THR HA H 0.774 13.576 -1.659 1.00 . A A . 8 THR HA 1 1 3 1639 1 1 8 THR HB H -0.966 13.306 0.118 1.00 . A A . 8 THR HB 1 1 3 1640 1 1 8 THR HG1 H 1.187 14.755 1.198 1.00 . A A . 8 THR HG1 1 1 3 1641 1 1 8 THR HG21 H -0.490 12.484 2.227 1.00 . A A . 8 THR HG21 1 1 3 1642 1 1 8 THR HG22 H 1.210 12.945 2.135 1.00 . A A . 8 THR HG22 1 1 3 1643 1 1 8 THR HG23 H 0.633 11.522 1.266 1.00 . A A . 8 THR HG23 1 1 3 1644 1 1 8 THR N N 0.552 11.531 -1.181 1.00 . A A . 8 THR N 1 1 3 1645 1 1 8 THR O O 3.109 13.904 -0.615 1.00 . A A . 8 THR O 1 1 3 1646 1 1 8 THR OG1 O 0.392 14.745 0.661 1.00 . A A . 8 THR OG1 1 1 3 1647 1 1 9 SER C C 4.785 10.327 0.391 1.00 . A A . 9 SER C 1 1 3 1648 1 1 9 SER CA C 4.304 11.770 0.553 1.00 . A A . 9 SER CA 1 1 3 1649 1 1 9 SER CB C 4.439 12.190 2.017 1.00 . A A . 9 SER CB 1 1 3 1650 1 1 9 SER H H 2.286 11.081 0.284 1.00 . A A . 9 SER H 1 1 3 1651 1 1 9 SER HA H 4.899 12.423 -0.069 1.00 . A A . 9 SER HA 1 1 3 1652 1 1 9 SER HB2 H 4.090 11.395 2.654 1.00 . A A . 9 SER HB2 1 1 3 1653 1 1 9 SER HB3 H 5.479 12.394 2.237 1.00 . A A . 9 SER HB3 1 1 3 1654 1 1 9 SER HG H 3.891 13.704 3.110 1.00 . A A . 9 SER HG 1 1 3 1655 1 1 9 SER N N 2.876 11.850 0.140 1.00 . A A . 9 SER N 1 1 3 1656 1 1 9 SER O O 3.995 9.417 0.242 1.00 . A A . 9 SER O 1 1 3 1657 1 1 9 SER OG O 3.656 13.354 2.247 1.00 . A A . 9 SER OG 1 1 3 1658 1 1 10 ILE C C 6.467 7.973 1.596 1.00 . A A . 10 ILE C 1 1 3 1659 1 1 10 ILE CA C 6.583 8.714 0.262 1.00 . A A . 10 ILE CA 1 1 3 1660 1 1 10 ILE CB C 8.047 8.751 -0.180 1.00 . A A . 10 ILE CB 1 1 3 1661 1 1 10 ILE CD1 C 7.202 9.875 -2.248 1.00 . A A . 10 ILE CD1 1 1 3 1662 1 1 10 ILE CG1 C 8.261 9.921 -1.145 1.00 . A A . 10 ILE CG1 1 1 3 1663 1 1 10 ILE CG2 C 8.395 7.442 -0.889 1.00 . A A . 10 ILE CG2 1 1 3 1664 1 1 10 ILE H H 6.696 10.850 0.538 1.00 . A A . 10 ILE H 1 1 3 1665 1 1 10 ILE HA H 5.997 8.200 -0.485 1.00 . A A . 10 ILE HA 1 1 3 1666 1 1 10 ILE HB H 8.683 8.872 0.686 1.00 . A A . 10 ILE HB 1 1 3 1667 1 1 10 ILE HD11 H 7.365 10.689 -2.938 1.00 . A A . 10 ILE HD11 1 1 3 1668 1 1 10 ILE HD12 H 6.220 9.965 -1.809 1.00 . A A . 10 ILE HD12 1 1 3 1669 1 1 10 ILE HD13 H 7.274 8.936 -2.778 1.00 . A A . 10 ILE HD13 1 1 3 1670 1 1 10 ILE HG12 H 8.181 10.853 -0.605 1.00 . A A . 10 ILE HG12 1 1 3 1671 1 1 10 ILE HG13 H 9.243 9.845 -1.588 1.00 . A A . 10 ILE HG13 1 1 3 1672 1 1 10 ILE HG21 H 7.491 6.987 -1.268 1.00 . A A . 10 ILE HG21 1 1 3 1673 1 1 10 ILE HG22 H 8.870 6.770 -0.190 1.00 . A A . 10 ILE HG22 1 1 3 1674 1 1 10 ILE HG23 H 9.068 7.645 -1.708 1.00 . A A . 10 ILE HG23 1 1 3 1675 1 1 10 ILE N N 6.070 10.106 0.418 1.00 . A A . 10 ILE N 1 1 3 1676 1 1 10 ILE O O 7.168 8.266 2.544 1.00 . A A . 10 ILE O 1 1 3 1677 1 1 11 CYS C C 6.583 5.282 3.125 1.00 . A A . 11 CYS C 1 1 3 1678 1 1 11 CYS CA C 5.414 6.253 2.947 1.00 . A A . 11 CYS CA 1 1 3 1679 1 1 11 CYS CB C 4.113 5.446 2.895 1.00 . A A . 11 CYS CB 1 1 3 1680 1 1 11 CYS H H 5.027 6.796 0.899 1.00 . A A . 11 CYS H 1 1 3 1681 1 1 11 CYS HA H 5.381 6.938 3.780 1.00 . A A . 11 CYS HA 1 1 3 1682 1 1 11 CYS HB2 H 4.125 4.804 2.028 1.00 . A A . 11 CYS HB2 1 1 3 1683 1 1 11 CYS HB3 H 4.030 4.843 3.787 1.00 . A A . 11 CYS HB3 1 1 3 1684 1 1 11 CYS N N 5.583 7.014 1.676 1.00 . A A . 11 CYS N 1 1 3 1685 1 1 11 CYS O O 7.550 5.310 2.390 1.00 . A A . 11 CYS O 1 1 3 1686 1 1 11 CYS SG S 2.694 6.561 2.791 1.00 . A A . 11 CYS SG 1 1 3 1687 1 1 12 SER C C 6.978 2.017 4.205 1.00 . A A . 12 SER C 1 1 3 1688 1 1 12 SER CA C 7.573 3.421 4.323 1.00 . A A . 12 SER CA 1 1 3 1689 1 1 12 SER CB C 8.155 3.617 5.725 1.00 . A A . 12 SER CB 1 1 3 1690 1 1 12 SER H H 5.691 4.404 4.663 1.00 . A A . 12 SER H 1 1 3 1691 1 1 12 SER HA H 8.349 3.551 3.581 1.00 . A A . 12 SER HA 1 1 3 1692 1 1 12 SER HB2 H 9.021 2.988 5.850 1.00 . A A . 12 SER HB2 1 1 3 1693 1 1 12 SER HB3 H 8.443 4.652 5.852 1.00 . A A . 12 SER HB3 1 1 3 1694 1 1 12 SER HG H 6.324 3.585 6.385 1.00 . A A . 12 SER HG 1 1 3 1695 1 1 12 SER N N 6.488 4.413 4.092 1.00 . A A . 12 SER N 1 1 3 1696 1 1 12 SER O O 5.909 1.748 4.713 1.00 . A A . 12 SER O 1 1 3 1697 1 1 12 SER OG O 7.175 3.262 6.692 1.00 . A A . 12 SER OG 1 1 3 1698 1 1 13 LEU C C 6.521 -0.730 4.712 1.00 . A A . 13 LEU C 1 1 3 1699 1 1 13 LEU CA C 7.101 -0.254 3.379 1.00 . A A . 13 LEU CA 1 1 3 1700 1 1 13 LEU CB C 8.207 -1.208 2.930 1.00 . A A . 13 LEU CB 1 1 3 1701 1 1 13 LEU CD1 C 8.020 -0.736 0.483 1.00 . A A . 13 LEU CD1 1 1 3 1702 1 1 13 LEU CD2 C 8.739 -2.997 1.268 1.00 . A A . 13 LEU CD2 1 1 3 1703 1 1 13 LEU CG C 7.835 -1.799 1.569 1.00 . A A . 13 LEU CG 1 1 3 1704 1 1 13 LEU H H 8.508 1.360 3.119 1.00 . A A . 13 LEU H 1 1 3 1705 1 1 13 LEU HA H 6.317 -0.243 2.636 1.00 . A A . 13 LEU HA 1 1 3 1706 1 1 13 LEU HB2 H 9.139 -0.667 2.849 1.00 . A A . 13 LEU HB2 1 1 3 1707 1 1 13 LEU HB3 H 8.312 -2.004 3.651 1.00 . A A . 13 LEU HB3 1 1 3 1708 1 1 13 LEU HD11 H 7.802 0.239 0.893 1.00 . A A . 13 LEU HD11 1 1 3 1709 1 1 13 LEU HD12 H 7.349 -0.940 -0.338 1.00 . A A . 13 LEU HD12 1 1 3 1710 1 1 13 LEU HD13 H 9.040 -0.757 0.128 1.00 . A A . 13 LEU HD13 1 1 3 1711 1 1 13 LEU HD21 H 9.517 -2.697 0.582 1.00 . A A . 13 LEU HD21 1 1 3 1712 1 1 13 LEU HD22 H 8.153 -3.787 0.824 1.00 . A A . 13 LEU HD22 1 1 3 1713 1 1 13 LEU HD23 H 9.185 -3.351 2.186 1.00 . A A . 13 LEU HD23 1 1 3 1714 1 1 13 LEU HG H 6.801 -2.121 1.586 1.00 . A A . 13 LEU HG 1 1 3 1715 1 1 13 LEU N N 7.650 1.123 3.531 1.00 . A A . 13 LEU N 1 1 3 1716 1 1 13 LEU O O 5.622 -1.546 4.751 1.00 . A A . 13 LEU O 1 1 3 1717 1 1 14 TYR C C 5.004 -0.236 7.213 1.00 . A A . 14 TYR C 1 1 3 1718 1 1 14 TYR CA C 6.476 -0.642 7.128 1.00 . A A . 14 TYR CA 1 1 3 1719 1 1 14 TYR CB C 7.264 0.042 8.249 1.00 . A A . 14 TYR CB 1 1 3 1720 1 1 14 TYR CD1 C 7.812 -2.303 9.178 1.00 . A A . 14 TYR CD1 1 1 3 1721 1 1 14 TYR CD2 C 9.578 -0.627 9.169 1.00 . A A . 14 TYR CD2 1 1 3 1722 1 1 14 TYR CE1 C 8.701 -3.224 9.746 1.00 . A A . 14 TYR CE1 1 1 3 1723 1 1 14 TYR CE2 C 10.453 -1.560 9.738 1.00 . A A . 14 TYR CE2 1 1 3 1724 1 1 14 TYR CG C 8.239 -0.982 8.880 1.00 . A A . 14 TYR CG 1 1 3 1725 1 1 14 TYR CZ C 10.016 -2.853 10.026 1.00 . A A . 14 TYR CZ 1 1 3 1726 1 1 14 TYR H H 7.737 0.442 5.758 1.00 . A A . 14 TYR H 1 1 3 1727 1 1 14 TYR HA H 6.560 -1.714 7.228 1.00 . A A . 14 TYR HA 1 1 3 1728 1 1 14 TYR HB2 H 7.807 0.891 7.831 1.00 . A A . 14 TYR HB2 1 1 3 1729 1 1 14 TYR HB3 H 6.567 0.413 8.996 1.00 . A A . 14 TYR HB3 1 1 3 1730 1 1 14 TYR HD1 H 6.807 -2.620 8.968 1.00 . A A . 14 TYR HD1 1 1 3 1731 1 1 14 TYR HD2 H 9.940 0.355 8.955 1.00 . A A . 14 TYR HD2 1 1 3 1732 1 1 14 TYR HE1 H 8.366 -4.226 9.970 1.00 . A A . 14 TYR HE1 1 1 3 1733 1 1 14 TYR HE2 H 11.473 -1.278 9.954 1.00 . A A . 14 TYR HE2 1 1 3 1734 1 1 14 TYR HH H 11.717 -3.715 10.109 1.00 . A A . 14 TYR HH 1 1 3 1735 1 1 14 TYR N N 7.017 -0.220 5.806 1.00 . A A . 14 TYR N 1 1 3 1736 1 1 14 TYR O O 4.151 -1.030 7.553 1.00 . A A . 14 TYR O 1 1 3 1737 1 1 14 TYR OH O 10.886 -3.766 10.587 1.00 . A A . 14 TYR OH 1 1 3 1738 1 1 15 GLN C C 2.477 0.670 5.897 1.00 . A A . 15 GLN C 1 1 3 1739 1 1 15 GLN CA C 3.278 1.441 6.948 1.00 . A A . 15 GLN CA 1 1 3 1740 1 1 15 GLN CB C 3.201 2.942 6.654 1.00 . A A . 15 GLN CB 1 1 3 1741 1 1 15 GLN CD C 2.191 3.532 8.863 1.00 . A A . 15 GLN CD 1 1 3 1742 1 1 15 GLN CG C 3.402 3.731 7.950 1.00 . A A . 15 GLN CG 1 1 3 1743 1 1 15 GLN H H 5.399 1.617 6.616 1.00 . A A . 15 GLN H 1 1 3 1744 1 1 15 GLN HA H 2.871 1.243 7.929 1.00 . A A . 15 GLN HA 1 1 3 1745 1 1 15 GLN HB2 H 3.972 3.209 5.945 1.00 . A A . 15 GLN HB2 1 1 3 1746 1 1 15 GLN HB3 H 2.233 3.178 6.238 1.00 . A A . 15 GLN HB3 1 1 3 1747 1 1 15 GLN HE21 H 3.163 4.072 10.508 1.00 . A A . 15 GLN HE21 1 1 3 1748 1 1 15 GLN HE22 H 1.536 3.644 10.734 1.00 . A A . 15 GLN HE22 1 1 3 1749 1 1 15 GLN HG2 H 4.293 3.381 8.451 1.00 . A A . 15 GLN HG2 1 1 3 1750 1 1 15 GLN HG3 H 3.507 4.780 7.720 1.00 . A A . 15 GLN HG3 1 1 3 1751 1 1 15 GLN N N 4.697 0.993 6.896 1.00 . A A . 15 GLN N 1 1 3 1752 1 1 15 GLN NE2 N 2.306 3.769 10.141 1.00 . A A . 15 GLN NE2 1 1 3 1753 1 1 15 GLN O O 1.396 0.181 6.159 1.00 . A A . 15 GLN O 1 1 3 1754 1 1 15 GLN OE1 O 1.128 3.158 8.408 1.00 . A A . 15 GLN OE1 1 1 3 1755 1 1 16 LEU C C 1.969 -1.607 4.146 1.00 . A A . 16 LEU C 1 1 3 1756 1 1 16 LEU CA C 2.285 -0.200 3.643 1.00 . A A . 16 LEU CA 1 1 3 1757 1 1 16 LEU CB C 3.165 -0.286 2.393 1.00 . A A . 16 LEU CB 1 1 3 1758 1 1 16 LEU CD1 C 3.529 2.126 1.853 1.00 . A A . 16 LEU CD1 1 1 3 1759 1 1 16 LEU CD2 C 3.221 0.462 0.012 1.00 . A A . 16 LEU CD2 1 1 3 1760 1 1 16 LEU CG C 2.802 0.847 1.434 1.00 . A A . 16 LEU CG 1 1 3 1761 1 1 16 LEU H H 3.882 0.945 4.519 1.00 . A A . 16 LEU H 1 1 3 1762 1 1 16 LEU HA H 1.366 0.309 3.406 1.00 . A A . 16 LEU HA 1 1 3 1763 1 1 16 LEU HB2 H 4.204 -0.199 2.677 1.00 . A A . 16 LEU HB2 1 1 3 1764 1 1 16 LEU HB3 H 3.004 -1.235 1.904 1.00 . A A . 16 LEU HB3 1 1 3 1765 1 1 16 LEU HD11 H 4.468 1.870 2.321 1.00 . A A . 16 LEU HD11 1 1 3 1766 1 1 16 LEU HD12 H 2.916 2.674 2.553 1.00 . A A . 16 LEU HD12 1 1 3 1767 1 1 16 LEU HD13 H 3.715 2.737 0.982 1.00 . A A . 16 LEU HD13 1 1 3 1768 1 1 16 LEU HD21 H 3.002 1.277 -0.662 1.00 . A A . 16 LEU HD21 1 1 3 1769 1 1 16 LEU HD22 H 2.675 -0.417 -0.298 1.00 . A A . 16 LEU HD22 1 1 3 1770 1 1 16 LEU HD23 H 4.280 0.252 -0.008 1.00 . A A . 16 LEU HD23 1 1 3 1771 1 1 16 LEU HG H 1.737 1.013 1.465 1.00 . A A . 16 LEU HG 1 1 3 1772 1 1 16 LEU N N 3.007 0.548 4.709 1.00 . A A . 16 LEU N 1 1 3 1773 1 1 16 LEU O O 0.920 -2.154 3.869 1.00 . A A . 16 LEU O 1 1 3 1774 1 1 17 GLU C C 1.273 -3.546 6.167 1.00 . A A . 17 GLU C 1 1 3 1775 1 1 17 GLU CA C 2.608 -3.550 5.424 1.00 . A A . 17 GLU CA 1 1 3 1776 1 1 17 GLU CB C 3.737 -3.916 6.382 1.00 . A A . 17 GLU CB 1 1 3 1777 1 1 17 GLU CD C 4.796 -5.744 5.053 1.00 . A A . 17 GLU CD 1 1 3 1778 1 1 17 GLU CG C 4.973 -4.318 5.576 1.00 . A A . 17 GLU CG 1 1 3 1779 1 1 17 GLU H H 3.696 -1.736 5.118 1.00 . A A . 17 GLU H 1 1 3 1780 1 1 17 GLU HA H 2.574 -4.260 4.612 1.00 . A A . 17 GLU HA 1 1 3 1781 1 1 17 GLU HB2 H 3.972 -3.065 7.005 1.00 . A A . 17 GLU HB2 1 1 3 1782 1 1 17 GLU HB3 H 3.430 -4.737 6.998 1.00 . A A . 17 GLU HB3 1 1 3 1783 1 1 17 GLU HG2 H 5.095 -3.640 4.743 1.00 . A A . 17 GLU HG2 1 1 3 1784 1 1 17 GLU HG3 H 5.846 -4.274 6.208 1.00 . A A . 17 GLU HG3 1 1 3 1785 1 1 17 GLU N N 2.861 -2.193 4.894 1.00 . A A . 17 GLU N 1 1 3 1786 1 1 17 GLU O O 0.536 -4.511 6.153 1.00 . A A . 17 GLU O 1 1 3 1787 1 1 17 GLU OE1 O 4.138 -5.903 4.037 1.00 . A A . 17 GLU OE1 1 1 3 1788 1 1 17 GLU OE2 O 5.319 -6.652 5.676 1.00 . A A . 17 GLU OE2 1 1 3 1789 1 1 18 ASN C C -1.491 -2.275 6.549 1.00 . A A . 18 ASN C 1 1 3 1790 1 1 18 ASN CA C -0.335 -2.374 7.548 1.00 . A A . 18 ASN CA 1 1 3 1791 1 1 18 ASN CB C -0.331 -1.136 8.446 1.00 . A A . 18 ASN CB 1 1 3 1792 1 1 18 ASN CG C -0.260 -1.569 9.910 1.00 . A A . 18 ASN CG 1 1 3 1793 1 1 18 ASN H H 1.564 -1.687 6.800 1.00 . A A . 18 ASN H 1 1 3 1794 1 1 18 ASN HA H -0.459 -3.259 8.156 1.00 . A A . 18 ASN HA 1 1 3 1795 1 1 18 ASN HB2 H 0.526 -0.522 8.209 1.00 . A A . 18 ASN HB2 1 1 3 1796 1 1 18 ASN HB3 H -1.235 -0.569 8.283 1.00 . A A . 18 ASN HB3 1 1 3 1797 1 1 18 ASN HD21 H -1.596 -3.019 9.691 1.00 . A A . 18 ASN HD21 1 1 3 1798 1 1 18 ASN HD22 H -0.964 -2.848 11.256 1.00 . A A . 18 ASN HD22 1 1 3 1799 1 1 18 ASN N N 0.954 -2.456 6.809 1.00 . A A . 18 ASN N 1 1 3 1800 1 1 18 ASN ND2 N -1.002 -2.561 10.320 1.00 . A A . 18 ASN ND2 1 1 3 1801 1 1 18 ASN O O -2.622 -2.587 6.865 1.00 . A A . 18 ASN O 1 1 3 1802 1 1 18 ASN OD1 O 0.477 -0.999 10.690 1.00 . A A . 18 ASN OD1 1 1 3 1803 1 1 19 TYR C C -2.901 -3.112 4.065 1.00 . A A . 19 TYR C 1 1 3 1804 1 1 19 TYR CA C -2.314 -1.726 4.339 1.00 . A A . 19 TYR CA 1 1 3 1805 1 1 19 TYR CB C -1.765 -1.152 3.030 1.00 . A A . 19 TYR CB 1 1 3 1806 1 1 19 TYR CD1 C -1.122 0.817 4.610 1.00 . A A . 19 TYR CD1 1 1 3 1807 1 1 19 TYR CD2 C -0.525 0.994 2.254 1.00 . A A . 19 TYR CD2 1 1 3 1808 1 1 19 TYR CE1 C -0.542 2.071 4.834 1.00 . A A . 19 TYR CE1 1 1 3 1809 1 1 19 TYR CE2 C 0.048 2.243 2.502 1.00 . A A . 19 TYR CE2 1 1 3 1810 1 1 19 TYR CG C -1.125 0.247 3.301 1.00 . A A . 19 TYR CG 1 1 3 1811 1 1 19 TYR CZ C 0.040 2.780 3.786 1.00 . A A . 19 TYR CZ 1 1 3 1812 1 1 19 TYR H H -0.302 -1.591 5.106 1.00 . A A . 19 TYR H 1 1 3 1813 1 1 19 TYR HA H -3.088 -1.077 4.721 1.00 . A A . 19 TYR HA 1 1 3 1814 1 1 19 TYR HB2 H -1.022 -1.858 2.624 1.00 . A A . 19 TYR HB2 1 1 3 1815 1 1 19 TYR HB3 H -2.594 -1.066 2.315 1.00 . A A . 19 TYR HB3 1 1 3 1816 1 1 19 TYR HD1 H -1.560 0.306 5.445 1.00 . A A . 19 TYR HD1 1 1 3 1817 1 1 19 TYR HD2 H -0.496 0.619 1.264 1.00 . A A . 19 TYR HD2 1 1 3 1818 1 1 19 TYR HE1 H -0.545 2.489 5.827 1.00 . A A . 19 TYR HE1 1 1 3 1819 1 1 19 TYR HE2 H 0.500 2.794 1.690 1.00 . A A . 19 TYR HE2 1 1 3 1820 1 1 19 TYR HH H 0.375 4.283 4.914 1.00 . A A . 19 TYR HH 1 1 3 1821 1 1 19 TYR N N -1.220 -1.842 5.346 1.00 . A A . 19 TYR N 1 1 3 1822 1 1 19 TYR O O -4.062 -3.250 3.733 1.00 . A A . 19 TYR O 1 1 3 1823 1 1 19 TYR OH O 0.606 4.016 4.021 1.00 . A A . 19 TYR OH 1 1 3 1824 1 1 20 CYS C C -3.340 -6.026 5.187 1.00 . A A . 20 CYS C 1 1 3 1825 1 1 20 CYS CA C -2.620 -5.515 3.940 1.00 . A A . 20 CYS CA 1 1 3 1826 1 1 20 CYS CB C -1.450 -6.443 3.603 1.00 . A A . 20 CYS CB 1 1 3 1827 1 1 20 CYS H H -1.176 -4.007 4.464 1.00 . A A . 20 CYS H 1 1 3 1828 1 1 20 CYS HA H -3.311 -5.491 3.111 1.00 . A A . 20 CYS HA 1 1 3 1829 1 1 20 CYS HB2 H -0.742 -6.441 4.418 1.00 . A A . 20 CYS HB2 1 1 3 1830 1 1 20 CYS HB3 H -1.820 -7.446 3.449 1.00 . A A . 20 CYS HB3 1 1 3 1831 1 1 20 CYS N N -2.107 -4.140 4.197 1.00 . A A . 20 CYS N 1 1 3 1832 1 1 20 CYS O O -3.041 -7.085 5.702 1.00 . A A . 20 CYS O 1 1 3 1833 1 1 20 CYS SG S -0.636 -5.862 2.094 1.00 . A A . 20 CYS SG 1 1 3 1834 1 1 21 ASN C C -6.391 -5.008 6.933 1.00 . A A . 21 ASN C 1 1 3 1835 1 1 21 ASN CA C -5.032 -5.710 6.892 1.00 . A A . 21 ASN CA 1 1 3 1836 1 1 21 ASN CB C -4.228 -5.342 8.140 1.00 . A A . 21 ASN CB 1 1 3 1837 1 1 21 ASN CG C -4.368 -6.450 9.186 1.00 . A A . 21 ASN CG 1 1 3 1838 1 1 21 ASN H H -4.507 -4.425 5.244 1.00 . A A . 21 ASN H 1 1 3 1839 1 1 21 ASN HA H -5.181 -6.779 6.861 1.00 . A A . 21 ASN HA 1 1 3 1840 1 1 21 ASN HB2 H -3.187 -5.225 7.875 1.00 . A A . 21 ASN HB2 1 1 3 1841 1 1 21 ASN HB3 H -4.602 -4.415 8.549 1.00 . A A . 21 ASN HB3 1 1 3 1842 1 1 21 ASN HD21 H -3.825 -7.894 7.936 1.00 . A A . 21 ASN HD21 1 1 3 1843 1 1 21 ASN HD22 H -4.195 -8.401 9.513 1.00 . A A . 21 ASN HD22 1 1 3 1844 1 1 21 ASN N N -4.287 -5.276 5.676 1.00 . A A . 21 ASN N 1 1 3 1845 1 1 21 ASN ND2 N -4.108 -7.684 8.850 1.00 . A A . 21 ASN ND2 1 1 3 1846 1 1 21 ASN O O -7.337 -5.618 7.406 1.00 . A A . 21 ASN O 1 1 3 1847 1 1 21 ASN OXT O -6.464 -3.873 6.492 1.00 . A A . 21 ASN OXT 1 1 3 1848 1 1 21 ASN OD1 O -4.718 -6.190 10.320 1.00 . A A . 21 ASN OD1 1 1 3 1849 2 2 1 PHE C C 11.740 1.156 -1.170 1.00 . B B . 22 PHE C 1 1 3 1850 2 2 1 PHE CA C 12.794 0.253 -0.526 1.00 . B B . 22 PHE CA 1 1 3 1851 2 2 1 PHE CB C 13.523 -0.542 -1.612 1.00 . B B . 22 PHE CB 1 1 3 1852 2 2 1 PHE CD1 C 12.231 -2.692 -1.899 1.00 . B B . 22 PHE CD1 1 1 3 1853 2 2 1 PHE CD2 C 11.923 -0.917 -3.526 1.00 . B B . 22 PHE CD2 1 1 3 1854 2 2 1 PHE CE1 C 11.315 -3.491 -2.598 1.00 . B B . 22 PHE CE1 1 1 3 1855 2 2 1 PHE CE2 C 11.008 -1.717 -4.225 1.00 . B B . 22 PHE CE2 1 1 3 1856 2 2 1 PHE CG C 12.535 -1.404 -2.363 1.00 . B B . 22 PHE CG 1 1 3 1857 2 2 1 PHE CZ C 10.704 -3.003 -3.761 1.00 . B B . 22 PHE CZ 1 1 3 1858 2 2 1 PHE H1 H 11.174 -0.913 0.066 1.00 . B B . 22 PHE H1 1 1 3 1859 2 2 1 PHE H2 H 12.065 -0.257 1.355 1.00 . B B . 22 PHE H2 1 1 3 1860 2 2 1 PHE H3 H 12.684 -1.571 0.473 1.00 . B B . 22 PHE H3 1 1 3 1861 2 2 1 PHE HA H 13.505 0.858 0.016 1.00 . B B . 22 PHE HA 1 1 3 1862 2 2 1 PHE HB2 H 13.999 0.142 -2.299 1.00 . B B . 22 PHE HB2 1 1 3 1863 2 2 1 PHE HB3 H 14.272 -1.171 -1.154 1.00 . B B . 22 PHE HB3 1 1 3 1864 2 2 1 PHE HD1 H 12.701 -3.069 -1.003 1.00 . B B . 22 PHE HD1 1 1 3 1865 2 2 1 PHE HD2 H 12.157 0.074 -3.884 1.00 . B B . 22 PHE HD2 1 1 3 1866 2 2 1 PHE HE1 H 11.081 -4.484 -2.241 1.00 . B B . 22 PHE HE1 1 1 3 1867 2 2 1 PHE HE2 H 10.537 -1.341 -5.121 1.00 . B B . 22 PHE HE2 1 1 3 1868 2 2 1 PHE HZ H 9.999 -3.619 -4.299 1.00 . B B . 22 PHE HZ 1 1 3 1869 2 2 1 PHE N N 12.129 -0.693 0.413 1.00 . B B . 22 PHE N 1 1 3 1870 2 2 1 PHE O O 10.812 0.691 -1.801 1.00 . B B . 22 PHE O 1 1 3 1871 2 2 2 VAL C C 11.561 4.632 -2.124 1.00 . B B . 23 VAL C 1 1 3 1872 2 2 2 VAL CA C 10.870 3.371 -1.625 1.00 . B B . 23 VAL CA 1 1 3 1873 2 2 2 VAL CB C 9.819 3.776 -0.592 1.00 . B B . 23 VAL CB 1 1 3 1874 2 2 2 VAL CG1 C 8.589 2.889 -0.742 1.00 . B B . 23 VAL CG1 1 1 3 1875 2 2 2 VAL CG2 C 10.393 3.630 0.815 1.00 . B B . 23 VAL CG2 1 1 3 1876 2 2 2 VAL H H 12.626 2.806 -0.505 1.00 . B B . 23 VAL H 1 1 3 1877 2 2 2 VAL HA H 10.384 2.876 -2.453 1.00 . B B . 23 VAL HA 1 1 3 1878 2 2 2 VAL HB H 9.536 4.806 -0.760 1.00 . B B . 23 VAL HB 1 1 3 1879 2 2 2 VAL HG11 H 7.753 3.349 -0.239 1.00 . B B . 23 VAL HG11 1 1 3 1880 2 2 2 VAL HG12 H 8.788 1.922 -0.304 1.00 . B B . 23 VAL HG12 1 1 3 1881 2 2 2 VAL HG13 H 8.359 2.771 -1.790 1.00 . B B . 23 VAL HG13 1 1 3 1882 2 2 2 VAL HG21 H 9.688 4.019 1.533 1.00 . B B . 23 VAL HG21 1 1 3 1883 2 2 2 VAL HG22 H 11.319 4.182 0.883 1.00 . B B . 23 VAL HG22 1 1 3 1884 2 2 2 VAL HG23 H 10.579 2.586 1.019 1.00 . B B . 23 VAL HG23 1 1 3 1885 2 2 2 VAL N N 11.871 2.447 -1.017 1.00 . B B . 23 VAL N 1 1 3 1886 2 2 2 VAL O O 12.720 4.867 -1.853 1.00 . B B . 23 VAL O 1 1 3 1887 2 2 3 ASN C C 10.421 7.297 -4.410 1.00 . B B . 24 ASN C 1 1 3 1888 2 2 3 ASN CA C 11.390 6.721 -3.375 1.00 . B B . 24 ASN CA 1 1 3 1889 2 2 3 ASN CB C 12.741 6.469 -4.051 1.00 . B B . 24 ASN CB 1 1 3 1890 2 2 3 ASN CG C 12.523 5.678 -5.342 1.00 . B B . 24 ASN CG 1 1 3 1891 2 2 3 ASN H H 9.893 5.216 -3.009 1.00 . B B . 24 ASN H 1 1 3 1892 2 2 3 ASN HA H 11.514 7.426 -2.570 1.00 . B B . 24 ASN HA 1 1 3 1893 2 2 3 ASN HB2 H 13.205 7.415 -4.284 1.00 . B B . 24 ASN HB2 1 1 3 1894 2 2 3 ASN HB3 H 13.383 5.910 -3.394 1.00 . B B . 24 ASN HB3 1 1 3 1895 2 2 3 ASN HD21 H 12.162 7.293 -6.439 1.00 . B B . 24 ASN HD21 1 1 3 1896 2 2 3 ASN HD22 H 12.095 5.818 -7.276 1.00 . B B . 24 ASN HD22 1 1 3 1897 2 2 3 ASN N N 10.831 5.445 -2.837 1.00 . B B . 24 ASN N 1 1 3 1898 2 2 3 ASN ND2 N 12.236 6.316 -6.444 1.00 . B B . 24 ASN ND2 1 1 3 1899 2 2 3 ASN O O 10.338 8.493 -4.602 1.00 . B B . 24 ASN O 1 1 3 1900 2 2 3 ASN OD1 O 12.613 4.466 -5.347 1.00 . B B . 24 ASN OD1 1 1 3 1901 2 2 4 GLN C C 7.400 7.294 -5.461 1.00 . B B . 25 GLN C 1 1 3 1902 2 2 4 GLN CA C 8.734 6.930 -6.117 1.00 . B B . 25 GLN CA 1 1 3 1903 2 2 4 GLN CB C 8.509 5.827 -7.152 1.00 . B B . 25 GLN CB 1 1 3 1904 2 2 4 GLN CD C 10.197 4.536 -8.465 1.00 . B B . 25 GLN CD 1 1 3 1905 2 2 4 GLN CG C 9.583 5.919 -8.238 1.00 . B B . 25 GLN CG 1 1 3 1906 2 2 4 GLN H H 9.789 5.489 -4.908 1.00 . B B . 25 GLN H 1 1 3 1907 2 2 4 GLN HA H 9.141 7.801 -6.607 1.00 . B B . 25 GLN HA 1 1 3 1908 2 2 4 GLN HB2 H 8.566 4.862 -6.668 1.00 . B B . 25 GLN HB2 1 1 3 1909 2 2 4 GLN HB3 H 7.534 5.947 -7.601 1.00 . B B . 25 GLN HB3 1 1 3 1910 2 2 4 GLN HE21 H 8.459 3.586 -8.331 1.00 . B B . 25 GLN HE21 1 1 3 1911 2 2 4 GLN HE22 H 9.808 2.596 -8.616 1.00 . B B . 25 GLN HE22 1 1 3 1912 2 2 4 GLN HG2 H 9.136 6.271 -9.157 1.00 . B B . 25 GLN HG2 1 1 3 1913 2 2 4 GLN HG3 H 10.354 6.606 -7.926 1.00 . B B . 25 GLN HG3 1 1 3 1914 2 2 4 GLN N N 9.696 6.447 -5.081 1.00 . B B . 25 GLN N 1 1 3 1915 2 2 4 GLN NE2 N 9.424 3.485 -8.471 1.00 . B B . 25 GLN NE2 1 1 3 1916 2 2 4 GLN O O 7.281 7.335 -4.253 1.00 . B B . 25 GLN O 1 1 3 1917 2 2 4 GLN OE1 O 11.394 4.411 -8.639 1.00 . B B . 25 GLN OE1 1 1 3 1918 2 2 5 HIS C C 4.029 6.894 -6.120 1.00 . B B . 26 HIS C 1 1 3 1919 2 2 5 HIS CA C 5.070 7.930 -5.678 1.00 . B B . 26 HIS CA 1 1 3 1920 2 2 5 HIS CB C 4.671 9.316 -6.188 1.00 . B B . 26 HIS CB 1 1 3 1921 2 2 5 HIS CD2 C 3.296 11.230 -5.058 1.00 . B B . 26 HIS CD2 1 1 3 1922 2 2 5 HIS CE1 C 3.750 10.732 -2.993 1.00 . B B . 26 HIS CE1 1 1 3 1923 2 2 5 HIS CG C 4.097 10.123 -5.058 1.00 . B B . 26 HIS CG 1 1 3 1924 2 2 5 HIS H H 6.515 7.526 -7.225 1.00 . B B . 26 HIS H 1 1 3 1925 2 2 5 HIS HA H 5.134 7.943 -4.600 1.00 . B B . 26 HIS HA 1 1 3 1926 2 2 5 HIS HB2 H 5.541 9.819 -6.583 1.00 . B B . 26 HIS HB2 1 1 3 1927 2 2 5 HIS HB3 H 3.930 9.212 -6.966 1.00 . B B . 26 HIS HB3 1 1 3 1928 2 2 5 HIS HD2 H 2.903 11.721 -5.936 1.00 . B B . 26 HIS HD2 1 1 3 1929 2 2 5 HIS HE1 H 3.784 10.760 -1.914 1.00 . B B . 26 HIS HE1 1 1 3 1930 2 2 5 HIS HE2 H 2.541 12.378 -3.445 1.00 . B B . 26 HIS HE2 1 1 3 1931 2 2 5 HIS N N 6.395 7.563 -6.253 1.00 . B B . 26 HIS N 1 1 3 1932 2 2 5 HIS ND1 N 4.376 9.815 -3.743 1.00 . B B . 26 HIS ND1 1 1 3 1933 2 2 5 HIS NE2 N 3.076 11.618 -3.754 1.00 . B B . 26 HIS NE2 1 1 3 1934 2 2 5 HIS O O 4.370 5.864 -6.667 1.00 . B B . 26 HIS O 1 1 3 1935 2 2 6 LEU C C 0.347 6.803 -6.393 1.00 . B B . 27 LEU C 1 1 3 1936 2 2 6 LEU CA C 1.734 6.142 -6.307 1.00 . B B . 27 LEU CA 1 1 3 1937 2 2 6 LEU CB C 1.718 4.979 -5.302 1.00 . B B . 27 LEU CB 1 1 3 1938 2 2 6 LEU CD1 C 1.200 6.326 -3.267 1.00 . B B . 27 LEU CD1 1 1 3 1939 2 2 6 LEU CD2 C 2.514 4.211 -3.079 1.00 . B B . 27 LEU CD2 1 1 3 1940 2 2 6 LEU CG C 2.245 5.440 -3.945 1.00 . B B . 27 LEU CG 1 1 3 1941 2 2 6 LEU H H 2.496 7.974 -5.444 1.00 . B B . 27 LEU H 1 1 3 1942 2 2 6 LEU HA H 1.997 5.759 -7.282 1.00 . B B . 27 LEU HA 1 1 3 1943 2 2 6 LEU HB2 H 0.714 4.612 -5.183 1.00 . B B . 27 LEU HB2 1 1 3 1944 2 2 6 LEU HB3 H 2.346 4.183 -5.673 1.00 . B B . 27 LEU HB3 1 1 3 1945 2 2 6 LEU HD11 H 1.624 7.301 -3.075 1.00 . B B . 27 LEU HD11 1 1 3 1946 2 2 6 LEU HD12 H 0.897 5.876 -2.333 1.00 . B B . 27 LEU HD12 1 1 3 1947 2 2 6 LEU HD13 H 0.342 6.428 -3.914 1.00 . B B . 27 LEU HD13 1 1 3 1948 2 2 6 LEU HD21 H 3.579 4.049 -3.007 1.00 . B B . 27 LEU HD21 1 1 3 1949 2 2 6 LEU HD22 H 2.047 3.347 -3.530 1.00 . B B . 27 LEU HD22 1 1 3 1950 2 2 6 LEU HD23 H 2.105 4.369 -2.094 1.00 . B B . 27 LEU HD23 1 1 3 1951 2 2 6 LEU HG H 3.161 5.996 -4.080 1.00 . B B . 27 LEU HG 1 1 3 1952 2 2 6 LEU N N 2.764 7.143 -5.890 1.00 . B B . 27 LEU N 1 1 3 1953 2 2 6 LEU O O 0.247 7.994 -6.537 1.00 . B B . 27 LEU O 1 1 3 1954 2 2 7 CYS C C -2.973 5.452 -7.147 1.00 . B B . 28 CYS C 1 1 3 1955 2 2 7 CYS CA C -2.126 6.502 -6.428 1.00 . B B . 28 CYS CA 1 1 3 1956 2 2 7 CYS CB C -2.262 7.842 -7.177 1.00 . B B . 28 CYS CB 1 1 3 1957 2 2 7 CYS H H -0.559 5.050 -6.239 1.00 . B B . 28 CYS H 1 1 3 1958 2 2 7 CYS HA H -2.512 6.623 -5.424 1.00 . B B . 28 CYS HA 1 1 3 1959 2 2 7 CYS HB2 H -1.338 8.084 -7.671 1.00 . B B . 28 CYS HB2 1 1 3 1960 2 2 7 CYS HB3 H -3.040 7.749 -7.920 1.00 . B B . 28 CYS HB3 1 1 3 1961 2 2 7 CYS N N -0.704 6.010 -6.332 1.00 . B B . 28 CYS N 1 1 3 1962 2 2 7 CYS O O -2.530 4.824 -8.088 1.00 . B B . 28 CYS O 1 1 3 1963 2 2 7 CYS SG S -2.708 9.173 -6.016 1.00 . B B . 28 CYS SG 1 1 3 1964 2 2 8 GLY C C -4.308 3.048 -7.817 1.00 . B B . 29 GLY C 1 1 3 1965 2 2 8 GLY CA C -5.099 4.273 -7.350 1.00 . B B . 29 GLY CA 1 1 3 1966 2 2 8 GLY H H -4.516 5.797 -5.948 1.00 . B B . 29 GLY H 1 1 3 1967 2 2 8 GLY HA2 H -5.851 3.964 -6.638 1.00 . B B . 29 GLY HA2 1 1 3 1968 2 2 8 GLY HA3 H -5.581 4.728 -8.202 1.00 . B B . 29 GLY HA3 1 1 3 1969 2 2 8 GLY N N -4.192 5.269 -6.707 1.00 . B B . 29 GLY N 1 1 3 1970 2 2 8 GLY O O -3.711 2.341 -7.030 1.00 . B B . 29 GLY O 1 1 3 1971 2 2 9 SER C C -2.204 1.493 -8.953 1.00 . B B . 30 SER C 1 1 3 1972 2 2 9 SER CA C -3.570 1.613 -9.632 1.00 . B B . 30 SER CA 1 1 3 1973 2 2 9 SER CB C -3.374 1.781 -11.139 1.00 . B B . 30 SER CB 1 1 3 1974 2 2 9 SER H H -4.804 3.375 -9.709 1.00 . B B . 30 SER H 1 1 3 1975 2 2 9 SER HA H -4.143 0.716 -9.442 1.00 . B B . 30 SER HA 1 1 3 1976 2 2 9 SER HB2 H -3.940 2.629 -11.486 1.00 . B B . 30 SER HB2 1 1 3 1977 2 2 9 SER HB3 H -2.324 1.942 -11.348 1.00 . B B . 30 SER HB3 1 1 3 1978 2 2 9 SER HG H -3.105 -0.018 -11.831 1.00 . B B . 30 SER HG 1 1 3 1979 2 2 9 SER N N -4.309 2.792 -9.096 1.00 . B B . 30 SER N 1 1 3 1980 2 2 9 SER O O -1.921 0.519 -8.286 1.00 . B B . 30 SER O 1 1 3 1981 2 2 9 SER OG O -3.830 0.610 -11.806 1.00 . B B . 30 SER OG 1 1 3 1982 2 2 10 ASP C C -0.153 1.889 -7.051 1.00 . B B . 31 ASP C 1 1 3 1983 2 2 10 ASP CA C -0.001 2.382 -8.489 1.00 . B B . 31 ASP CA 1 1 3 1984 2 2 10 ASP CB C 0.670 3.759 -8.486 1.00 . B B . 31 ASP CB 1 1 3 1985 2 2 10 ASP CG C 0.576 4.390 -9.879 1.00 . B B . 31 ASP CG 1 1 3 1986 2 2 10 ASP H H -1.587 3.242 -9.671 1.00 . B B . 31 ASP H 1 1 3 1987 2 2 10 ASP HA H 0.611 1.686 -9.043 1.00 . B B . 31 ASP HA 1 1 3 1988 2 2 10 ASP HB2 H 0.181 4.396 -7.766 1.00 . B B . 31 ASP HB2 1 1 3 1989 2 2 10 ASP HB3 H 1.710 3.649 -8.215 1.00 . B B . 31 ASP HB3 1 1 3 1990 2 2 10 ASP N N -1.348 2.465 -9.123 1.00 . B B . 31 ASP N 1 1 3 1991 2 2 10 ASP O O 0.708 1.214 -6.524 1.00 . B B . 31 ASP O 1 1 3 1992 2 2 10 ASP OD1 O -0.297 3.997 -10.634 1.00 . B B . 31 ASP OD1 1 1 3 1993 2 2 10 ASP OD2 O 1.383 5.258 -10.166 1.00 . B B . 31 ASP OD2 1 1 3 1994 2 2 11 LEU C C -1.638 0.233 -5.005 1.00 . B B . 32 LEU C 1 1 3 1995 2 2 11 LEU CA C -1.438 1.750 -5.010 1.00 . B B . 32 LEU CA 1 1 3 1996 2 2 11 LEU CB C -2.661 2.434 -4.400 1.00 . B B . 32 LEU CB 1 1 3 1997 2 2 11 LEU CD1 C -1.772 4.669 -3.712 1.00 . B B . 32 LEU CD1 1 1 3 1998 2 2 11 LEU CD2 C -3.390 3.457 -2.239 1.00 . B B . 32 LEU CD2 1 1 3 1999 2 2 11 LEU CG C -2.220 3.293 -3.212 1.00 . B B . 32 LEU CG 1 1 3 2000 2 2 11 LEU H H -1.930 2.757 -6.852 1.00 . B B . 32 LEU H 1 1 3 2001 2 2 11 LEU HA H -0.561 1.995 -4.428 1.00 . B B . 32 LEU HA 1 1 3 2002 2 2 11 LEU HB2 H -3.133 3.060 -5.144 1.00 . B B . 32 LEU HB2 1 1 3 2003 2 2 11 LEU HB3 H -3.360 1.686 -4.060 1.00 . B B . 32 LEU HB3 1 1 3 2004 2 2 11 LEU HD11 H -0.694 4.731 -3.676 1.00 . B B . 32 LEU HD11 1 1 3 2005 2 2 11 LEU HD12 H -2.197 5.437 -3.083 1.00 . B B . 32 LEU HD12 1 1 3 2006 2 2 11 LEU HD13 H -2.106 4.810 -4.730 1.00 . B B . 32 LEU HD13 1 1 3 2007 2 2 11 LEU HD21 H -4.305 3.142 -2.718 1.00 . B B . 32 LEU HD21 1 1 3 2008 2 2 11 LEU HD22 H -3.476 4.494 -1.949 1.00 . B B . 32 LEU HD22 1 1 3 2009 2 2 11 LEU HD23 H -3.216 2.852 -1.362 1.00 . B B . 32 LEU HD23 1 1 3 2010 2 2 11 LEU HG H -1.395 2.812 -2.708 1.00 . B B . 32 LEU HG 1 1 3 2011 2 2 11 LEU N N -1.243 2.214 -6.411 1.00 . B B . 32 LEU N 1 1 3 2012 2 2 11 LEU O O -0.807 -0.505 -4.515 1.00 . B B . 32 LEU O 1 1 3 2013 2 2 12 VAL C C -1.699 -2.385 -6.158 1.00 . B B . 33 VAL C 1 1 3 2014 2 2 12 VAL CA C -2.944 -1.719 -5.578 1.00 . B B . 33 VAL CA 1 1 3 2015 2 2 12 VAL CB C -4.164 -2.056 -6.439 1.00 . B B . 33 VAL CB 1 1 3 2016 2 2 12 VAL CG1 C -5.394 -1.356 -5.870 1.00 . B B . 33 VAL CG1 1 1 3 2017 2 2 12 VAL CG2 C -3.934 -1.585 -7.876 1.00 . B B . 33 VAL CG2 1 1 3 2018 2 2 12 VAL H H -3.383 0.359 -5.954 1.00 . B B . 33 VAL H 1 1 3 2019 2 2 12 VAL HA H -3.104 -2.074 -4.569 1.00 . B B . 33 VAL HA 1 1 3 2020 2 2 12 VAL HB H -4.324 -3.125 -6.431 1.00 . B B . 33 VAL HB 1 1 3 2021 2 2 12 VAL HG11 H -5.393 -0.322 -6.180 1.00 . B B . 33 VAL HG11 1 1 3 2022 2 2 12 VAL HG12 H -5.371 -1.410 -4.792 1.00 . B B . 33 VAL HG12 1 1 3 2023 2 2 12 VAL HG13 H -6.285 -1.842 -6.237 1.00 . B B . 33 VAL HG13 1 1 3 2024 2 2 12 VAL HG21 H -4.580 -0.746 -8.088 1.00 . B B . 33 VAL HG21 1 1 3 2025 2 2 12 VAL HG22 H -4.157 -2.391 -8.559 1.00 . B B . 33 VAL HG22 1 1 3 2026 2 2 12 VAL HG23 H -2.906 -1.287 -7.997 1.00 . B B . 33 VAL HG23 1 1 3 2027 2 2 12 VAL N N -2.724 -0.246 -5.554 1.00 . B B . 33 VAL N 1 1 3 2028 2 2 12 VAL O O -1.369 -3.508 -5.830 1.00 . B B . 33 VAL O 1 1 3 2029 2 2 13 GLU C C 1.339 -2.209 -6.537 1.00 . B B . 34 GLU C 1 1 3 2030 2 2 13 GLU CA C 0.241 -2.264 -7.594 1.00 . B B . 34 GLU CA 1 1 3 2031 2 2 13 GLU CB C 0.650 -1.440 -8.814 1.00 . B B . 34 GLU CB 1 1 3 2032 2 2 13 GLU CD C -1.258 -1.576 -10.419 1.00 . B B . 34 GLU CD 1 1 3 2033 2 2 13 GLU CG C 0.132 -2.120 -10.081 1.00 . B B . 34 GLU CG 1 1 3 2034 2 2 13 GLU H H -1.269 -0.781 -7.246 1.00 . B B . 34 GLU H 1 1 3 2035 2 2 13 GLU HA H 0.065 -3.289 -7.886 1.00 . B B . 34 GLU HA 1 1 3 2036 2 2 13 GLU HB2 H 0.226 -0.449 -8.736 1.00 . B B . 34 GLU HB2 1 1 3 2037 2 2 13 GLU HB3 H 1.724 -1.370 -8.857 1.00 . B B . 34 GLU HB3 1 1 3 2038 2 2 13 GLU HG2 H 0.808 -1.918 -10.900 1.00 . B B . 34 GLU HG2 1 1 3 2039 2 2 13 GLU HG3 H 0.070 -3.185 -9.920 1.00 . B B . 34 GLU HG3 1 1 3 2040 2 2 13 GLU N N -0.994 -1.690 -7.007 1.00 . B B . 34 GLU N 1 1 3 2041 2 2 13 GLU O O 1.883 -3.219 -6.140 1.00 . B B . 34 GLU O 1 1 3 2042 2 2 13 GLU OE1 O -1.336 -0.448 -10.877 1.00 . B B . 34 GLU OE1 1 1 3 2043 2 2 13 GLU OE2 O -2.221 -2.297 -10.213 1.00 . B B . 34 GLU OE2 1 1 3 2044 2 2 14 ALA C C 2.265 -1.784 -3.815 1.00 . B B . 35 ALA C 1 1 3 2045 2 2 14 ALA CA C 2.694 -0.921 -5.002 1.00 . B B . 35 ALA CA 1 1 3 2046 2 2 14 ALA CB C 2.820 0.538 -4.558 1.00 . B B . 35 ALA CB 1 1 3 2047 2 2 14 ALA H H 1.185 -0.232 -6.375 1.00 . B B . 35 ALA H 1 1 3 2048 2 2 14 ALA HA H 3.641 -1.269 -5.388 1.00 . B B . 35 ALA HA 1 1 3 2049 2 2 14 ALA HB1 H 1.895 0.855 -4.098 1.00 . B B . 35 ALA HB1 1 1 3 2050 2 2 14 ALA HB2 H 3.026 1.160 -5.416 1.00 . B B . 35 ALA HB2 1 1 3 2051 2 2 14 ALA HB3 H 3.626 0.630 -3.845 1.00 . B B . 35 ALA HB3 1 1 3 2052 2 2 14 ALA N N 1.651 -1.034 -6.056 1.00 . B B . 35 ALA N 1 1 3 2053 2 2 14 ALA O O 3.030 -2.565 -3.284 1.00 . B B . 35 ALA O 1 1 3 2054 2 2 15 LEU C C 0.706 -3.945 -2.593 1.00 . B B . 36 LEU C 1 1 3 2055 2 2 15 LEU CA C 0.510 -2.465 -2.275 1.00 . B B . 36 LEU CA 1 1 3 2056 2 2 15 LEU CB C -0.991 -2.195 -2.120 1.00 . B B . 36 LEU CB 1 1 3 2057 2 2 15 LEU CD1 C -1.205 -1.268 0.180 1.00 . B B . 36 LEU CD1 1 1 3 2058 2 2 15 LEU CD2 C -0.145 0.117 -1.613 1.00 . B B . 36 LEU CD2 1 1 3 2059 2 2 15 LEU CG C -1.230 -0.922 -1.305 1.00 . B B . 36 LEU CG 1 1 3 2060 2 2 15 LEU H H 0.434 -1.023 -3.869 1.00 . B B . 36 LEU H 1 1 3 2061 2 2 15 LEU HA H 1.027 -2.203 -1.363 1.00 . B B . 36 LEU HA 1 1 3 2062 2 2 15 LEU HB2 H -1.435 -2.080 -3.098 1.00 . B B . 36 LEU HB2 1 1 3 2063 2 2 15 LEU HB3 H -1.451 -3.031 -1.616 1.00 . B B . 36 LEU HB3 1 1 3 2064 2 2 15 LEU HD11 H -1.599 -2.263 0.325 1.00 . B B . 36 LEU HD11 1 1 3 2065 2 2 15 LEU HD12 H -1.812 -0.559 0.722 1.00 . B B . 36 LEU HD12 1 1 3 2066 2 2 15 LEU HD13 H -0.189 -1.226 0.543 1.00 . B B . 36 LEU HD13 1 1 3 2067 2 2 15 LEU HD21 H -0.182 0.376 -2.660 1.00 . B B . 36 LEU HD21 1 1 3 2068 2 2 15 LEU HD22 H 0.824 -0.295 -1.378 1.00 . B B . 36 LEU HD22 1 1 3 2069 2 2 15 LEU HD23 H -0.314 1.002 -1.018 1.00 . B B . 36 LEU HD23 1 1 3 2070 2 2 15 LEU HG H -2.200 -0.516 -1.559 1.00 . B B . 36 LEU HG 1 1 3 2071 2 2 15 LEU N N 1.029 -1.653 -3.411 1.00 . B B . 36 LEU N 1 1 3 2072 2 2 15 LEU O O 0.849 -4.774 -1.717 1.00 . B B . 36 LEU O 1 1 3 2073 2 2 16 TYR C C 2.337 -6.065 -4.295 1.00 . B B . 37 TYR C 1 1 3 2074 2 2 16 TYR CA C 0.853 -5.694 -4.268 1.00 . B B . 37 TYR CA 1 1 3 2075 2 2 16 TYR CB C 0.245 -5.878 -5.662 1.00 . B B . 37 TYR CB 1 1 3 2076 2 2 16 TYR CD1 C -0.604 -8.311 -5.749 1.00 . B B . 37 TYR CD1 1 1 3 2077 2 2 16 TYR CD2 C 1.515 -7.795 -6.830 1.00 . B B . 37 TYR CD2 1 1 3 2078 2 2 16 TYR CE1 C -0.468 -9.649 -6.141 1.00 . B B . 37 TYR CE1 1 1 3 2079 2 2 16 TYR CE2 C 1.636 -9.137 -7.212 1.00 . B B . 37 TYR CE2 1 1 3 2080 2 2 16 TYR CG C 0.388 -7.359 -6.091 1.00 . B B . 37 TYR CG 1 1 3 2081 2 2 16 TYR CZ C 0.648 -10.059 -6.871 1.00 . B B . 37 TYR CZ 1 1 3 2082 2 2 16 TYR H H 0.562 -3.579 -4.529 1.00 . B B . 37 TYR H 1 1 3 2083 2 2 16 TYR HA H 0.337 -6.333 -3.566 1.00 . B B . 37 TYR HA 1 1 3 2084 2 2 16 TYR HB2 H -0.806 -5.582 -5.629 1.00 . B B . 37 TYR HB2 1 1 3 2085 2 2 16 TYR HB3 H 0.762 -5.227 -6.363 1.00 . B B . 37 TYR HB3 1 1 3 2086 2 2 16 TYR HD1 H -1.469 -8.025 -5.184 1.00 . B B . 37 TYR HD1 1 1 3 2087 2 2 16 TYR HD2 H 2.293 -7.111 -7.099 1.00 . B B . 37 TYR HD2 1 1 3 2088 2 2 16 TYR HE1 H -1.231 -10.367 -5.877 1.00 . B B . 37 TYR HE1 1 1 3 2089 2 2 16 TYR HE2 H 2.498 -9.458 -7.778 1.00 . B B . 37 TYR HE2 1 1 3 2090 2 2 16 TYR HH H 0.184 -11.532 -7.993 1.00 . B B . 37 TYR HH 1 1 3 2091 2 2 16 TYR N N 0.691 -4.273 -3.853 1.00 . B B . 37 TYR N 1 1 3 2092 2 2 16 TYR O O 2.694 -7.226 -4.322 1.00 . B B . 37 TYR O 1 1 3 2093 2 2 16 TYR OH O 0.775 -11.379 -7.253 1.00 . B B . 37 TYR OH 1 1 3 2094 2 2 17 LEU C C 5.112 -5.617 -2.833 1.00 . B B . 38 LEU C 1 1 3 2095 2 2 17 LEU CA C 4.666 -5.414 -4.275 1.00 . B B . 38 LEU CA 1 1 3 2096 2 2 17 LEU CB C 5.478 -4.273 -4.899 1.00 . B B . 38 LEU CB 1 1 3 2097 2 2 17 LEU CD1 C 5.419 -2.320 -6.454 1.00 . B B . 38 LEU CD1 1 1 3 2098 2 2 17 LEU CD2 C 4.063 -4.354 -6.953 1.00 . B B . 38 LEU CD2 1 1 3 2099 2 2 17 LEU CG C 4.598 -3.456 -5.840 1.00 . B B . 38 LEU CG 1 1 3 2100 2 2 17 LEU H H 2.906 -4.164 -4.229 1.00 . B B . 38 LEU H 1 1 3 2101 2 2 17 LEU HA H 4.829 -6.321 -4.834 1.00 . B B . 38 LEU HA 1 1 3 2102 2 2 17 LEU HB2 H 5.857 -3.633 -4.115 1.00 . B B . 38 LEU HB2 1 1 3 2103 2 2 17 LEU HB3 H 6.306 -4.687 -5.455 1.00 . B B . 38 LEU HB3 1 1 3 2104 2 2 17 LEU HD11 H 5.535 -1.528 -5.730 1.00 . B B . 38 LEU HD11 1 1 3 2105 2 2 17 LEU HD12 H 4.909 -1.938 -7.326 1.00 . B B . 38 LEU HD12 1 1 3 2106 2 2 17 LEU HD13 H 6.392 -2.692 -6.740 1.00 . B B . 38 LEU HD13 1 1 3 2107 2 2 17 LEU HD21 H 4.858 -4.987 -7.316 1.00 . B B . 38 LEU HD21 1 1 3 2108 2 2 17 LEU HD22 H 3.692 -3.741 -7.761 1.00 . B B . 38 LEU HD22 1 1 3 2109 2 2 17 LEU HD23 H 3.262 -4.966 -6.567 1.00 . B B . 38 LEU HD23 1 1 3 2110 2 2 17 LEU HG H 3.776 -3.044 -5.284 1.00 . B B . 38 LEU HG 1 1 3 2111 2 2 17 LEU N N 3.209 -5.093 -4.270 1.00 . B B . 38 LEU N 1 1 3 2112 2 2 17 LEU O O 5.786 -6.573 -2.504 1.00 . B B . 38 LEU O 1 1 3 2113 2 2 18 VAL C C 4.414 -6.107 0.029 1.00 . B B . 39 VAL C 1 1 3 2114 2 2 18 VAL CA C 5.100 -4.864 -0.537 1.00 . B B . 39 VAL CA 1 1 3 2115 2 2 18 VAL CB C 4.638 -3.618 0.226 1.00 . B B . 39 VAL CB 1 1 3 2116 2 2 18 VAL CG1 C 4.962 -2.370 -0.596 1.00 . B B . 39 VAL CG1 1 1 3 2117 2 2 18 VAL CG2 C 3.127 -3.686 0.461 1.00 . B B . 39 VAL CG2 1 1 3 2118 2 2 18 VAL H H 4.169 -3.971 -2.255 1.00 . B B . 39 VAL H 1 1 3 2119 2 2 18 VAL HA H 6.171 -4.968 -0.453 1.00 . B B . 39 VAL HA 1 1 3 2120 2 2 18 VAL HB H 5.150 -3.567 1.175 1.00 . B B . 39 VAL HB 1 1 3 2121 2 2 18 VAL HG11 H 5.643 -2.630 -1.393 1.00 . B B . 39 VAL HG11 1 1 3 2122 2 2 18 VAL HG12 H 5.419 -1.628 0.042 1.00 . B B . 39 VAL HG12 1 1 3 2123 2 2 18 VAL HG13 H 4.051 -1.971 -1.016 1.00 . B B . 39 VAL HG13 1 1 3 2124 2 2 18 VAL HG21 H 2.683 -2.734 0.214 1.00 . B B . 39 VAL HG21 1 1 3 2125 2 2 18 VAL HG22 H 2.934 -3.916 1.498 1.00 . B B . 39 VAL HG22 1 1 3 2126 2 2 18 VAL HG23 H 2.700 -4.456 -0.164 1.00 . B B . 39 VAL HG23 1 1 3 2127 2 2 18 VAL N N 4.722 -4.726 -1.966 1.00 . B B . 39 VAL N 1 1 3 2128 2 2 18 VAL O O 4.830 -6.666 1.025 1.00 . B B . 39 VAL O 1 1 3 2129 2 2 19 CYS C C 2.650 -8.819 -1.210 1.00 . B B . 40 CYS C 1 1 3 2130 2 2 19 CYS CA C 2.635 -7.745 -0.119 1.00 . B B . 40 CYS CA 1 1 3 2131 2 2 19 CYS CB C 1.187 -7.371 0.208 1.00 . B B . 40 CYS CB 1 1 3 2132 2 2 19 CYS H H 3.045 -6.073 -1.408 1.00 . B B . 40 CYS H 1 1 3 2133 2 2 19 CYS HA H 3.120 -8.122 0.768 1.00 . B B . 40 CYS HA 1 1 3 2134 2 2 19 CYS HB2 H 0.896 -6.511 -0.377 1.00 . B B . 40 CYS HB2 1 1 3 2135 2 2 19 CYS HB3 H 0.538 -8.202 -0.027 1.00 . B B . 40 CYS HB3 1 1 3 2136 2 2 19 CYS N N 3.360 -6.542 -0.606 1.00 . B B . 40 CYS N 1 1 3 2137 2 2 19 CYS O O 1.769 -9.650 -1.287 1.00 . B B . 40 CYS O 1 1 3 2138 2 2 19 CYS SG S 1.045 -6.976 1.969 1.00 . B B . 40 CYS SG 1 1 3 2139 2 2 20 GLY C C 3.357 -11.202 -2.582 1.00 . B B . 41 GLY C 1 1 3 2140 2 2 20 GLY CA C 3.707 -9.824 -3.146 1.00 . B B . 41 GLY CA 1 1 3 2141 2 2 20 GLY H H 4.341 -8.123 -1.984 1.00 . B B . 41 GLY H 1 1 3 2142 2 2 20 GLY HA2 H 3.005 -9.564 -3.925 1.00 . B B . 41 GLY HA2 1 1 3 2143 2 2 20 GLY HA3 H 4.706 -9.850 -3.555 1.00 . B B . 41 GLY HA3 1 1 3 2144 2 2 20 GLY N N 3.641 -8.805 -2.059 1.00 . B B . 41 GLY N 1 1 3 2145 2 2 20 GLY O O 2.880 -12.069 -3.287 1.00 . B B . 41 GLY O 1 1 3 2146 2 2 21 GLU C C 1.848 -12.721 -0.160 1.00 . B B . 42 GLU C 1 1 3 2147 2 2 21 GLU CA C 3.273 -12.737 -0.711 1.00 . B B . 42 GLU CA 1 1 3 2148 2 2 21 GLU CB C 4.254 -13.023 0.425 1.00 . B B . 42 GLU CB 1 1 3 2149 2 2 21 GLU CD C 5.352 -15.009 1.471 1.00 . B B . 42 GLU CD 1 1 3 2150 2 2 21 GLU CG C 4.031 -14.443 0.947 1.00 . B B . 42 GLU CG 1 1 3 2151 2 2 21 GLU H H 3.977 -10.701 -0.763 1.00 . B B . 42 GLU H 1 1 3 2152 2 2 21 GLU HA H 3.359 -13.504 -1.463 1.00 . B B . 42 GLU HA 1 1 3 2153 2 2 21 GLU HB2 H 5.266 -12.926 0.060 1.00 . B B . 42 GLU HB2 1 1 3 2154 2 2 21 GLU HB3 H 4.091 -12.317 1.226 1.00 . B B . 42 GLU HB3 1 1 3 2155 2 2 21 GLU HG2 H 3.304 -14.421 1.747 1.00 . B B . 42 GLU HG2 1 1 3 2156 2 2 21 GLU HG3 H 3.665 -15.067 0.146 1.00 . B B . 42 GLU HG3 1 1 3 2157 2 2 21 GLU N N 3.591 -11.413 -1.316 1.00 . B B . 42 GLU N 1 1 3 2158 2 2 21 GLU O O 1.219 -13.748 -0.002 1.00 . B B . 42 GLU O 1 1 3 2159 2 2 21 GLU OE1 O 6.350 -14.312 1.381 1.00 . B B . 42 GLU OE1 1 1 3 2160 2 2 21 GLU OE2 O 5.345 -16.130 1.953 1.00 . B B . 42 GLU OE2 1 1 3 2161 2 2 22 ARG C C -0.958 -10.835 -0.381 1.00 . B B . 43 ARG C 1 1 3 2162 2 2 22 ARG CA C -0.047 -11.468 0.673 1.00 . B B . 43 ARG CA 1 1 3 2163 2 2 22 ARG CB C -0.043 -10.602 1.934 1.00 . B B . 43 ARG CB 1 1 3 2164 2 2 22 ARG CD C -1.242 -10.259 4.099 1.00 . B B . 43 ARG CD 1 1 3 2165 2 2 22 ARG CG C -1.382 -10.751 2.657 1.00 . B B . 43 ARG CG 1 1 3 2166 2 2 22 ARG CZ C -2.277 -10.928 6.185 1.00 . B B . 43 ARG CZ 1 1 3 2167 2 2 22 ARG H H 1.865 -10.750 -0.006 1.00 . B B . 43 ARG H 1 1 3 2168 2 2 22 ARG HA H -0.407 -12.457 0.915 1.00 . B B . 43 ARG HA 1 1 3 2169 2 2 22 ARG HB2 H 0.758 -10.920 2.586 1.00 . B B . 43 ARG HB2 1 1 3 2170 2 2 22 ARG HB3 H 0.103 -9.567 1.661 1.00 . B B . 43 ARG HB3 1 1 3 2171 2 2 22 ARG HD2 H -0.200 -10.085 4.321 1.00 . B B . 43 ARG HD2 1 1 3 2172 2 2 22 ARG HD3 H -1.794 -9.338 4.219 1.00 . B B . 43 ARG HD3 1 1 3 2173 2 2 22 ARG HE H -1.770 -12.235 4.778 1.00 . B B . 43 ARG HE 1 1 3 2174 2 2 22 ARG HG2 H -2.133 -10.167 2.146 1.00 . B B . 43 ARG HG2 1 1 3 2175 2 2 22 ARG HG3 H -1.675 -11.790 2.661 1.00 . B B . 43 ARG HG3 1 1 3 2176 2 2 22 ARG HH11 H -3.614 -9.666 5.393 1.00 . B B . 43 ARG HH11 1 1 3 2177 2 2 22 ARG HH12 H -3.626 -9.784 7.121 1.00 . B B . 43 ARG HH12 1 1 3 2178 2 2 22 ARG HH21 H -1.055 -12.106 7.247 1.00 . B B . 43 ARG HH21 1 1 3 2179 2 2 22 ARG HH22 H -2.177 -11.164 8.170 1.00 . B B . 43 ARG HH22 1 1 3 2180 2 2 22 ARG N N 1.337 -11.562 0.132 1.00 . B B . 43 ARG N 1 1 3 2181 2 2 22 ARG NE N -1.784 -11.288 5.031 1.00 . B B . 43 ARG NE 1 1 3 2182 2 2 22 ARG NH1 N -3.248 -10.058 6.237 1.00 . B B . 43 ARG NH1 1 1 3 2183 2 2 22 ARG NH2 N -1.799 -11.440 7.286 1.00 . B B . 43 ARG NH2 1 1 3 2184 2 2 22 ARG O O -0.500 -10.169 -1.288 1.00 . B B . 43 ARG O 1 1 3 2185 2 2 23 GLY C C -4.617 -10.786 -0.913 1.00 . B B . 44 GLY C 1 1 3 2186 2 2 23 GLY CA C -3.172 -10.441 -1.276 1.00 . B B . 44 GLY CA 1 1 3 2187 2 2 23 GLY H H -2.595 -11.576 0.464 1.00 . B B . 44 GLY H 1 1 3 2188 2 2 23 GLY HA2 H -3.049 -9.367 -1.287 1.00 . B B . 44 GLY HA2 1 1 3 2189 2 2 23 GLY HA3 H -2.947 -10.838 -2.255 1.00 . B B . 44 GLY HA3 1 1 3 2190 2 2 23 GLY N N -2.243 -11.036 -0.274 1.00 . B B . 44 GLY N 1 1 3 2191 2 2 23 GLY O O -4.910 -11.872 -0.453 1.00 . B B . 44 GLY O 1 1 3 2192 2 2 24 GLY C C -7.409 -9.205 0.326 1.00 . B B . 45 GLY C 1 1 3 2193 2 2 24 GLY CA C -6.951 -10.145 -0.790 1.00 . B B . 45 GLY CA 1 1 3 2194 2 2 24 GLY H H -5.265 -9.002 -1.494 1.00 . B B . 45 GLY H 1 1 3 2195 2 2 24 GLY HA2 H -7.558 -9.984 -1.670 1.00 . B B . 45 GLY HA2 1 1 3 2196 2 2 24 GLY HA3 H -7.055 -11.167 -0.462 1.00 . B B . 45 GLY HA3 1 1 3 2197 2 2 24 GLY N N -5.523 -9.870 -1.119 1.00 . B B . 45 GLY N 1 1 3 2198 2 2 24 GLY O O -8.234 -8.338 0.120 1.00 . B B . 45 GLY O 1 1 3 2199 2 2 25 PHE C C -6.780 -7.072 2.385 1.00 . B B . 46 PHE C 1 1 3 2200 2 2 25 PHE CA C -7.286 -8.487 2.638 1.00 . B B . 46 PHE CA 1 1 3 2201 2 2 25 PHE CB C -6.675 -9.013 3.927 1.00 . B B . 46 PHE CB 1 1 3 2202 2 2 25 PHE CD1 C -9.105 -9.195 4.834 1.00 . B B . 46 PHE CD1 1 1 3 2203 2 2 25 PHE CD2 C -7.356 -8.484 6.376 1.00 . B B . 46 PHE CD2 1 1 3 2204 2 2 25 PHE CE1 C -10.043 -9.086 5.867 1.00 . B B . 46 PHE CE1 1 1 3 2205 2 2 25 PHE CE2 C -8.312 -8.381 7.393 1.00 . B B . 46 PHE CE2 1 1 3 2206 2 2 25 PHE CG C -7.730 -8.896 5.071 1.00 . B B . 46 PHE CG 1 1 3 2207 2 2 25 PHE CZ C -9.649 -8.682 7.140 1.00 . B B . 46 PHE CZ 1 1 3 2208 2 2 25 PHE H H -6.217 -10.077 1.652 1.00 . B B . 46 PHE H 1 1 3 2209 2 2 25 PHE HA H -8.361 -8.479 2.724 1.00 . B B . 46 PHE HA 1 1 3 2210 2 2 25 PHE HB2 H -6.381 -10.054 3.756 1.00 . B B . 46 PHE HB2 1 1 3 2211 2 2 25 PHE HB3 H -5.777 -8.423 4.161 1.00 . B B . 46 PHE HB3 1 1 3 2212 2 2 25 PHE HD1 H -9.449 -9.505 3.867 1.00 . B B . 46 PHE HD1 1 1 3 2213 2 2 25 PHE HD2 H -6.348 -8.239 6.604 1.00 . B B . 46 PHE HD2 1 1 3 2214 2 2 25 PHE HE1 H -11.081 -9.316 5.674 1.00 . B B . 46 PHE HE1 1 1 3 2215 2 2 25 PHE HE2 H -8.011 -8.068 8.382 1.00 . B B . 46 PHE HE2 1 1 3 2216 2 2 25 PHE HZ H -10.379 -8.601 7.931 1.00 . B B . 46 PHE HZ 1 1 3 2217 2 2 25 PHE N N -6.881 -9.371 1.507 1.00 . B B . 46 PHE N 1 1 3 2218 2 2 25 PHE O O -6.008 -6.529 3.150 1.00 . B B . 46 PHE O 1 1 3 2219 2 2 26 TYR C C -7.913 -4.116 1.055 1.00 . B B . 47 TYR C 1 1 3 2220 2 2 26 TYR CA C -6.739 -5.097 0.999 1.00 . B B . 47 TYR CA 1 1 3 2221 2 2 26 TYR CB C -6.125 -5.070 -0.403 1.00 . B B . 47 TYR CB 1 1 3 2222 2 2 26 TYR CD1 C -4.726 -2.897 -0.128 1.00 . B B . 47 TYR CD1 1 1 3 2223 2 2 26 TYR CD2 C -6.544 -2.888 -1.751 1.00 . B B . 47 TYR CD2 1 1 3 2224 2 2 26 TYR CE1 C -4.439 -1.567 -0.461 1.00 . B B . 47 TYR CE1 1 1 3 2225 2 2 26 TYR CE2 C -6.238 -1.558 -2.068 1.00 . B B . 47 TYR CE2 1 1 3 2226 2 2 26 TYR CG C -5.791 -3.591 -0.773 1.00 . B B . 47 TYR CG 1 1 3 2227 2 2 26 TYR CZ C -5.190 -0.902 -1.427 1.00 . B B . 47 TYR CZ 1 1 3 2228 2 2 26 TYR H H -7.817 -6.942 0.713 1.00 . B B . 47 TYR H 1 1 3 2229 2 2 26 TYR HA H -5.995 -4.800 1.719 1.00 . B B . 47 TYR HA 1 1 3 2230 2 2 26 TYR HB2 H -5.219 -5.698 -0.401 1.00 . B B . 47 TYR HB2 1 1 3 2231 2 2 26 TYR HB3 H -6.847 -5.496 -1.114 1.00 . B B . 47 TYR HB3 1 1 3 2232 2 2 26 TYR HD1 H -4.132 -3.370 0.625 1.00 . B B . 47 TYR HD1 1 1 3 2233 2 2 26 TYR HD2 H -7.358 -3.354 -2.259 1.00 . B B . 47 TYR HD2 1 1 3 2234 2 2 26 TYR HE1 H -3.627 -1.055 0.033 1.00 . B B . 47 TYR HE1 1 1 3 2235 2 2 26 TYR HE2 H -6.820 -1.036 -2.813 1.00 . B B . 47 TYR HE2 1 1 3 2236 2 2 26 TYR HH H -4.083 0.647 -1.301 1.00 . B B . 47 TYR HH 1 1 3 2237 2 2 26 TYR N N -7.202 -6.477 1.313 1.00 . B B . 47 TYR N 1 1 3 2238 2 2 26 TYR O O -7.719 -2.921 1.140 1.00 . B B . 47 TYR O 1 1 3 2239 2 2 26 TYR OH O -4.899 0.408 -1.746 1.00 . B B . 47 TYR OH 1 1 3 2240 2 2 27 THR C C -11.629 -4.449 1.125 1.00 . B B . 48 THR C 1 1 3 2241 2 2 27 THR CA C -10.300 -3.673 1.051 1.00 . B B . 48 THR CA 1 1 3 2242 2 2 27 THR CB C -10.296 -2.793 -0.209 1.00 . B B . 48 THR CB 1 1 3 2243 2 2 27 THR CG2 C -11.663 -2.127 -0.387 1.00 . B B . 48 THR CG2 1 1 3 2244 2 2 27 THR H H -9.257 -5.569 0.940 1.00 . B B . 48 THR H 1 1 3 2245 2 2 27 THR HA H -10.214 -3.043 1.921 1.00 . B B . 48 THR HA 1 1 3 2246 2 2 27 THR HB H -10.086 -3.405 -1.073 1.00 . B B . 48 THR HB 1 1 3 2247 2 2 27 THR HG1 H -8.535 -2.066 -0.599 1.00 . B B . 48 THR HG1 1 1 3 2248 2 2 27 THR HG21 H -12.108 -1.955 0.581 1.00 . B B . 48 THR HG21 1 1 3 2249 2 2 27 THR HG22 H -12.304 -2.773 -0.969 1.00 . B B . 48 THR HG22 1 1 3 2250 2 2 27 THR HG23 H -11.539 -1.185 -0.900 1.00 . B B . 48 THR HG23 1 1 3 2251 2 2 27 THR N N -9.125 -4.604 1.006 1.00 . B B . 48 THR N 1 1 3 2252 2 2 27 THR O O -12.650 -3.895 1.481 1.00 . B B . 48 THR O 1 1 3 2253 2 2 27 THR OG1 O -9.299 -1.790 -0.086 1.00 . B B . 48 THR OG1 1 1 3 2254 2 2 28 LYS C C -12.818 -7.553 1.926 1.00 . B B . 49 LYS C 1 1 3 2255 2 2 28 LYS CA C -12.914 -6.484 0.833 1.00 . B B . 49 LYS CA 1 1 3 2256 2 2 28 LYS CB C -13.154 -7.161 -0.519 1.00 . B B . 49 LYS CB 1 1 3 2257 2 2 28 LYS CD C -15.324 -7.262 -1.755 1.00 . B B . 49 LYS CD 1 1 3 2258 2 2 28 LYS CE C -14.657 -7.764 -3.037 1.00 . B B . 49 LYS CE 1 1 3 2259 2 2 28 LYS CG C -14.553 -7.781 -0.541 1.00 . B B . 49 LYS CG 1 1 3 2260 2 2 28 LYS H H -10.821 -6.141 0.489 1.00 . B B . 49 LYS H 1 1 3 2261 2 2 28 LYS HA H -13.735 -5.816 1.053 1.00 . B B . 49 LYS HA 1 1 3 2262 2 2 28 LYS HB2 H -13.073 -6.427 -1.308 1.00 . B B . 49 LYS HB2 1 1 3 2263 2 2 28 LYS HB3 H -12.418 -7.935 -0.669 1.00 . B B . 49 LYS HB3 1 1 3 2264 2 2 28 LYS HD2 H -16.342 -7.620 -1.714 1.00 . B B . 49 LYS HD2 1 1 3 2265 2 2 28 LYS HD3 H -15.321 -6.182 -1.749 1.00 . B B . 49 LYS HD3 1 1 3 2266 2 2 28 LYS HE2 H -13.664 -8.122 -2.809 1.00 . B B . 49 LYS HE2 1 1 3 2267 2 2 28 LYS HE3 H -15.242 -8.568 -3.456 1.00 . B B . 49 LYS HE3 1 1 3 2268 2 2 28 LYS HG2 H -14.469 -8.857 -0.601 1.00 . B B . 49 LYS HG2 1 1 3 2269 2 2 28 LYS HG3 H -15.082 -7.511 0.361 1.00 . B B . 49 LYS HG3 1 1 3 2270 2 2 28 LYS HZ1 H -14.159 -5.811 -3.562 1.00 . B B . 49 LYS HZ1 1 1 3 2271 2 2 28 LYS HZ2 H -15.522 -6.420 -4.372 1.00 . B B . 49 LYS HZ2 1 1 3 2272 2 2 28 LYS HZ3 H -13.966 -6.935 -4.819 1.00 . B B . 49 LYS HZ3 1 1 3 2273 2 2 28 LYS N N -11.640 -5.708 0.783 1.00 . B B . 49 LYS N 1 1 3 2274 2 2 28 LYS NZ N -14.569 -6.648 -4.022 1.00 . B B . 49 LYS NZ 1 1 3 2275 2 2 28 LYS O O -12.469 -8.684 1.655 1.00 . B B . 49 LYS O 1 1 3 2276 2 2 29 PRO C C -14.303 -8.989 4.299 1.00 . B B . 50 PRO C 1 1 3 2277 2 2 29 PRO CA C -13.093 -8.053 4.297 1.00 . B B . 50 PRO CA 1 1 3 2278 2 2 29 PRO CB C -13.139 -7.097 5.489 1.00 . B B . 50 PRO CB 1 1 3 2279 2 2 29 PRO CD C -13.555 -5.779 3.445 1.00 . B B . 50 PRO CD 1 1 3 2280 2 2 29 PRO CG C -13.765 -5.784 4.969 1.00 . B B . 50 PRO CG 1 1 3 2281 2 2 29 PRO HA H -12.176 -8.611 4.310 1.00 . B B . 50 PRO HA 1 1 3 2282 2 2 29 PRO HB2 H -13.749 -7.517 6.276 1.00 . B B . 50 PRO HB2 1 1 3 2283 2 2 29 PRO HB3 H -12.141 -6.905 5.850 1.00 . B B . 50 PRO HB3 1 1 3 2284 2 2 29 PRO HD2 H -14.477 -5.541 2.937 1.00 . B B . 50 PRO HD2 1 1 3 2285 2 2 29 PRO HD3 H -12.778 -5.085 3.176 1.00 . B B . 50 PRO HD3 1 1 3 2286 2 2 29 PRO HG2 H -14.821 -5.759 5.202 1.00 . B B . 50 PRO HG2 1 1 3 2287 2 2 29 PRO HG3 H -13.267 -4.934 5.408 1.00 . B B . 50 PRO HG3 1 1 3 2288 2 2 29 PRO N N -13.132 -7.156 3.133 1.00 . B B . 50 PRO N 1 1 3 2289 2 2 29 PRO O O -15.138 -8.944 3.417 1.00 . B B . 50 PRO O 1 1 3 2290 2 2 30 THR C C -15.722 -11.466 3.987 1.00 . B B . 51 THR C 1 1 3 2291 2 2 30 THR CA C -15.559 -10.777 5.343 1.00 . B B . 51 THR CA 1 1 3 2292 2 2 30 THR CB C -16.831 -9.997 5.677 1.00 . B B . 51 THR CB 1 1 3 2293 2 2 30 THR CG2 C -16.602 -9.155 6.933 1.00 . B B . 51 THR CG2 1 1 3 2294 2 2 30 THR H H -13.720 -9.859 5.986 1.00 . B B . 51 THR H 1 1 3 2295 2 2 30 THR HA H -15.381 -11.520 6.106 1.00 . B B . 51 THR HA 1 1 3 2296 2 2 30 THR HB H -17.642 -10.686 5.853 1.00 . B B . 51 THR HB 1 1 3 2297 2 2 30 THR HG1 H -18.067 -9.327 4.333 1.00 . B B . 51 THR HG1 1 1 3 2298 2 2 30 THR HG21 H -17.363 -9.387 7.665 1.00 . B B . 51 THR HG21 1 1 3 2299 2 2 30 THR HG22 H -16.655 -8.107 6.679 1.00 . B B . 51 THR HG22 1 1 3 2300 2 2 30 THR HG23 H -15.628 -9.378 7.343 1.00 . B B . 51 THR HG23 1 1 3 2301 2 2 30 THR N N -14.404 -9.839 5.284 1.00 . B B . 51 THR N 1 1 3 2302 2 2 30 THR O O -16.523 -10.994 3.197 1.00 . B B . 51 THR O 1 1 3 2303 2 2 30 THR OXT O -15.042 -12.454 3.760 1.00 . B B . 51 THR OXT 1 1 3 2304 2 2 30 THR OG1 O -17.160 -9.145 4.588 1.00 . B B . 51 THR OG1 1 1 4 2305 1 1 1 GLY C C -8.167 4.167 2.587 1.00 . A A . 1 GLY C 1 1 4 2306 1 1 1 GLY CA C -9.574 3.874 2.192 1.00 . A A . 1 GLY CA 1 1 4 2307 1 1 1 GLY H1 H -10.626 2.657 0.817 1.00 . A A . 1 GLY H1 1 1 4 2308 1 1 1 GLY H2 H -9.008 2.931 0.383 1.00 . A A . 1 GLY H2 1 1 4 2309 1 1 1 GLY H3 H -10.162 4.160 0.179 1.00 . A A . 1 GLY H3 1 1 4 2310 1 1 1 GLY HA2 H -9.680 4.842 2.249 1.00 . A A . 1 GLY HA2 1 1 4 2311 1 1 1 GLY HA3 H -10.282 3.293 2.916 1.00 . A A . 1 GLY HA3 1 1 4 2312 1 1 1 GLY N N -9.866 3.365 0.780 1.00 . A A . 1 GLY N 1 1 4 2313 1 1 1 GLY O O -7.905 5.045 3.386 1.00 . A A . 1 GLY O 1 1 4 2314 1 1 2 ILE C C -5.213 4.735 1.447 1.00 . A A . 2 ILE C 1 1 4 2315 1 1 2 ILE CA C -5.800 3.684 2.394 1.00 . A A . 2 ILE CA 1 1 4 2316 1 1 2 ILE CB C -5.025 2.368 2.264 1.00 . A A . 2 ILE CB 1 1 4 2317 1 1 2 ILE CD1 C -4.639 0.138 3.316 1.00 . A A . 2 ILE CD1 1 1 4 2318 1 1 2 ILE CG1 C -5.258 1.521 3.515 1.00 . A A . 2 ILE CG1 1 1 4 2319 1 1 2 ILE CG2 C -3.526 2.646 2.118 1.00 . A A . 2 ILE CG2 1 1 4 2320 1 1 2 ILE H H -7.460 2.741 1.401 1.00 . A A . 2 ILE H 1 1 4 2321 1 1 2 ILE HA H -5.735 4.040 3.411 1.00 . A A . 2 ILE HA 1 1 4 2322 1 1 2 ILE HB H -5.375 1.829 1.395 1.00 . A A . 2 ILE HB 1 1 4 2323 1 1 2 ILE HD11 H -4.354 0.017 2.282 1.00 . A A . 2 ILE HD11 1 1 4 2324 1 1 2 ILE HD12 H -5.360 -0.621 3.582 1.00 . A A . 2 ILE HD12 1 1 4 2325 1 1 2 ILE HD13 H -3.765 0.041 3.944 1.00 . A A . 2 ILE HD13 1 1 4 2326 1 1 2 ILE HG12 H -4.799 2.004 4.366 1.00 . A A . 2 ILE HG12 1 1 4 2327 1 1 2 ILE HG13 H -6.319 1.418 3.687 1.00 . A A . 2 ILE HG13 1 1 4 2328 1 1 2 ILE HG21 H -3.350 3.207 1.212 1.00 . A A . 2 ILE HG21 1 1 4 2329 1 1 2 ILE HG22 H -2.990 1.710 2.072 1.00 . A A . 2 ILE HG22 1 1 4 2330 1 1 2 ILE HG23 H -3.181 3.216 2.968 1.00 . A A . 2 ILE HG23 1 1 4 2331 1 1 2 ILE N N -7.227 3.444 2.043 1.00 . A A . 2 ILE N 1 1 4 2332 1 1 2 ILE O O -4.343 5.500 1.815 1.00 . A A . 2 ILE O 1 1 4 2333 1 1 3 VAL C C -5.093 7.149 -0.063 1.00 . A A . 3 VAL C 1 1 4 2334 1 1 3 VAL CA C -5.145 5.777 -0.735 1.00 . A A . 3 VAL CA 1 1 4 2335 1 1 3 VAL CB C -6.051 5.834 -1.976 1.00 . A A . 3 VAL CB 1 1 4 2336 1 1 3 VAL CG1 C -6.522 4.424 -2.329 1.00 . A A . 3 VAL CG1 1 1 4 2337 1 1 3 VAL CG2 C -7.277 6.711 -1.698 1.00 . A A . 3 VAL CG2 1 1 4 2338 1 1 3 VAL H H -6.380 4.150 -0.044 1.00 . A A . 3 VAL H 1 1 4 2339 1 1 3 VAL HA H -4.152 5.491 -1.029 1.00 . A A . 3 VAL HA 1 1 4 2340 1 1 3 VAL HB H -5.494 6.243 -2.807 1.00 . A A . 3 VAL HB 1 1 4 2341 1 1 3 VAL HG11 H -6.743 4.371 -3.384 1.00 . A A . 3 VAL HG11 1 1 4 2342 1 1 3 VAL HG12 H -7.412 4.191 -1.762 1.00 . A A . 3 VAL HG12 1 1 4 2343 1 1 3 VAL HG13 H -5.746 3.714 -2.086 1.00 . A A . 3 VAL HG13 1 1 4 2344 1 1 3 VAL HG21 H -7.720 6.425 -0.756 1.00 . A A . 3 VAL HG21 1 1 4 2345 1 1 3 VAL HG22 H -8.000 6.579 -2.489 1.00 . A A . 3 VAL HG22 1 1 4 2346 1 1 3 VAL HG23 H -6.976 7.748 -1.656 1.00 . A A . 3 VAL HG23 1 1 4 2347 1 1 3 VAL N N -5.680 4.777 0.232 1.00 . A A . 3 VAL N 1 1 4 2348 1 1 3 VAL O O -4.160 7.909 -0.235 1.00 . A A . 3 VAL O 1 1 4 2349 1 1 4 GLU C C -4.883 8.961 2.254 1.00 . A A . 4 GLU C 1 1 4 2350 1 1 4 GLU CA C -6.135 8.780 1.394 1.00 . A A . 4 GLU CA 1 1 4 2351 1 1 4 GLU CB C -7.377 8.837 2.286 1.00 . A A . 4 GLU CB 1 1 4 2352 1 1 4 GLU CD C -9.868 8.817 2.095 1.00 . A A . 4 GLU CD 1 1 4 2353 1 1 4 GLU CG C -8.568 8.229 1.541 1.00 . A A . 4 GLU CG 1 1 4 2354 1 1 4 GLU H H -6.827 6.826 0.817 1.00 . A A . 4 GLU H 1 1 4 2355 1 1 4 GLU HA H -6.184 9.569 0.661 1.00 . A A . 4 GLU HA 1 1 4 2356 1 1 4 GLU HB2 H -7.196 8.279 3.193 1.00 . A A . 4 GLU HB2 1 1 4 2357 1 1 4 GLU HB3 H -7.597 9.865 2.533 1.00 . A A . 4 GLU HB3 1 1 4 2358 1 1 4 GLU HG2 H -8.488 8.456 0.487 1.00 . A A . 4 GLU HG2 1 1 4 2359 1 1 4 GLU HG3 H -8.572 7.158 1.680 1.00 . A A . 4 GLU HG3 1 1 4 2360 1 1 4 GLU N N -6.094 7.462 0.701 1.00 . A A . 4 GLU N 1 1 4 2361 1 1 4 GLU O O -4.563 10.054 2.675 1.00 . A A . 4 GLU O 1 1 4 2362 1 1 4 GLU OE1 O -10.159 8.573 3.255 1.00 . A A . 4 GLU OE1 1 1 4 2363 1 1 4 GLU OE2 O -10.550 9.503 1.351 1.00 . A A . 4 GLU OE2 1 1 4 2364 1 1 5 GLN C C -1.692 7.910 2.500 1.00 . A A . 5 GLN C 1 1 4 2365 1 1 5 GLN CA C -2.950 8.023 3.369 1.00 . A A . 5 GLN CA 1 1 4 2366 1 1 5 GLN CB C -2.943 6.907 4.415 1.00 . A A . 5 GLN CB 1 1 4 2367 1 1 5 GLN CD C -2.699 6.721 6.897 1.00 . A A . 5 GLN CD 1 1 4 2368 1 1 5 GLN CG C -2.119 7.348 5.627 1.00 . A A . 5 GLN CG 1 1 4 2369 1 1 5 GLN H H -4.451 7.026 2.183 1.00 . A A . 5 GLN H 1 1 4 2370 1 1 5 GLN HA H -2.956 8.980 3.870 1.00 . A A . 5 GLN HA 1 1 4 2371 1 1 5 GLN HB2 H -3.957 6.696 4.724 1.00 . A A . 5 GLN HB2 1 1 4 2372 1 1 5 GLN HB3 H -2.505 6.017 3.988 1.00 . A A . 5 GLN HB3 1 1 4 2373 1 1 5 GLN HE21 H -4.258 7.950 6.962 1.00 . A A . 5 GLN HE21 1 1 4 2374 1 1 5 GLN HE22 H -4.186 6.802 8.211 1.00 . A A . 5 GLN HE22 1 1 4 2375 1 1 5 GLN HG2 H -1.095 7.026 5.502 1.00 . A A . 5 GLN HG2 1 1 4 2376 1 1 5 GLN HG3 H -2.151 8.424 5.712 1.00 . A A . 5 GLN HG3 1 1 4 2377 1 1 5 GLN N N -4.174 7.900 2.526 1.00 . A A . 5 GLN N 1 1 4 2378 1 1 5 GLN NE2 N -3.806 7.198 7.398 1.00 . A A . 5 GLN NE2 1 1 4 2379 1 1 5 GLN O O -0.669 8.491 2.803 1.00 . A A . 5 GLN O 1 1 4 2380 1 1 5 GLN OE1 O -2.139 5.789 7.439 1.00 . A A . 5 GLN OE1 1 1 4 2381 1 1 6 CYS C C -0.692 7.872 -0.694 1.00 . A A . 6 CYS C 1 1 4 2382 1 1 6 CYS CA C -0.544 7.013 0.562 1.00 . A A . 6 CYS CA 1 1 4 2383 1 1 6 CYS CB C -0.381 5.546 0.155 1.00 . A A . 6 CYS CB 1 1 4 2384 1 1 6 CYS H H -2.580 6.692 1.204 1.00 . A A . 6 CYS H 1 1 4 2385 1 1 6 CYS HA H 0.330 7.330 1.107 1.00 . A A . 6 CYS HA 1 1 4 2386 1 1 6 CYS HB2 H -1.356 5.101 0.018 1.00 . A A . 6 CYS HB2 1 1 4 2387 1 1 6 CYS HB3 H 0.173 5.489 -0.769 1.00 . A A . 6 CYS HB3 1 1 4 2388 1 1 6 CYS N N -1.750 7.161 1.431 1.00 . A A . 6 CYS N 1 1 4 2389 1 1 6 CYS O O 0.277 8.360 -1.240 1.00 . A A . 6 CYS O 1 1 4 2390 1 1 6 CYS SG S 0.514 4.654 1.451 1.00 . A A . 6 CYS SG 1 1 4 2391 1 1 7 CYS C C -2.169 10.366 -1.984 1.00 . A A . 7 CYS C 1 1 4 2392 1 1 7 CYS CA C -2.096 8.889 -2.380 1.00 . A A . 7 CYS CA 1 1 4 2393 1 1 7 CYS CB C -3.407 8.482 -3.053 1.00 . A A . 7 CYS CB 1 1 4 2394 1 1 7 CYS H H -2.663 7.659 -0.706 1.00 . A A . 7 CYS H 1 1 4 2395 1 1 7 CYS HA H -1.271 8.736 -3.067 1.00 . A A . 7 CYS HA 1 1 4 2396 1 1 7 CYS HB2 H -4.085 8.096 -2.309 1.00 . A A . 7 CYS HB2 1 1 4 2397 1 1 7 CYS HB3 H -3.846 9.342 -3.531 1.00 . A A . 7 CYS HB3 1 1 4 2398 1 1 7 CYS N N -1.893 8.061 -1.159 1.00 . A A . 7 CYS N 1 1 4 2399 1 1 7 CYS O O -2.085 11.246 -2.816 1.00 . A A . 7 CYS O 1 1 4 2400 1 1 7 CYS SG S -3.087 7.204 -4.288 1.00 . A A . 7 CYS SG 1 1 4 2401 1 1 8 THR C C -1.089 12.445 0.415 1.00 . A A . 8 THR C 1 1 4 2402 1 1 8 THR CA C -2.405 12.064 -0.277 1.00 . A A . 8 THR CA 1 1 4 2403 1 1 8 THR CB C -3.610 12.243 0.675 1.00 . A A . 8 THR CB 1 1 4 2404 1 1 8 THR CG2 C -3.154 12.328 2.138 1.00 . A A . 8 THR CG2 1 1 4 2405 1 1 8 THR H H -2.395 9.921 -0.061 1.00 . A A . 8 THR H 1 1 4 2406 1 1 8 THR HA H -2.542 12.695 -1.144 1.00 . A A . 8 THR HA 1 1 4 2407 1 1 8 THR HB H -4.275 11.399 0.563 1.00 . A A . 8 THR HB 1 1 4 2408 1 1 8 THR HG1 H -3.869 13.840 -0.417 1.00 . A A . 8 THR HG1 1 1 4 2409 1 1 8 THR HG21 H -2.409 13.104 2.237 1.00 . A A . 8 THR HG21 1 1 4 2410 1 1 8 THR HG22 H -2.730 11.382 2.439 1.00 . A A . 8 THR HG22 1 1 4 2411 1 1 8 THR HG23 H -4.001 12.560 2.767 1.00 . A A . 8 THR HG23 1 1 4 2412 1 1 8 THR N N -2.328 10.644 -0.719 1.00 . A A . 8 THR N 1 1 4 2413 1 1 8 THR O O -0.810 13.603 0.650 1.00 . A A . 8 THR O 1 1 4 2414 1 1 8 THR OG1 O -4.310 13.435 0.335 1.00 . A A . 8 THR OG1 1 1 4 2415 1 1 9 SER C C 2.031 10.685 1.038 1.00 . A A . 9 SER C 1 1 4 2416 1 1 9 SER CA C 1.015 11.767 1.413 1.00 . A A . 9 SER CA 1 1 4 2417 1 1 9 SER CB C 0.815 11.780 2.930 1.00 . A A . 9 SER CB 1 1 4 2418 1 1 9 SER H H -0.528 10.545 0.540 1.00 . A A . 9 SER H 1 1 4 2419 1 1 9 SER HA H 1.378 12.731 1.089 1.00 . A A . 9 SER HA 1 1 4 2420 1 1 9 SER HB2 H 0.410 10.835 3.251 1.00 . A A . 9 SER HB2 1 1 4 2421 1 1 9 SER HB3 H 1.768 11.944 3.417 1.00 . A A . 9 SER HB3 1 1 4 2422 1 1 9 SER HG H 0.132 13.594 2.756 1.00 . A A . 9 SER HG 1 1 4 2423 1 1 9 SER N N -0.281 11.472 0.740 1.00 . A A . 9 SER N 1 1 4 2424 1 1 9 SER O O 1.670 9.596 0.640 1.00 . A A . 9 SER O 1 1 4 2425 1 1 9 SER OG O -0.093 12.818 3.275 1.00 . A A . 9 SER OG 1 1 4 2426 1 1 10 ILE C C 4.501 8.973 1.959 1.00 . A A . 10 ILE C 1 1 4 2427 1 1 10 ILE CA C 4.327 9.956 0.800 1.00 . A A . 10 ILE CA 1 1 4 2428 1 1 10 ILE CB C 5.658 10.653 0.518 1.00 . A A . 10 ILE CB 1 1 4 2429 1 1 10 ILE CD1 C 4.834 11.390 -1.720 1.00 . A A . 10 ILE CD1 1 1 4 2430 1 1 10 ILE CG1 C 5.412 11.863 -0.385 1.00 . A A . 10 ILE CG1 1 1 4 2431 1 1 10 ILE CG2 C 6.609 9.679 -0.181 1.00 . A A . 10 ILE CG2 1 1 4 2432 1 1 10 ILE H H 3.572 11.859 1.478 1.00 . A A . 10 ILE H 1 1 4 2433 1 1 10 ILE HA H 4.009 9.417 -0.080 1.00 . A A . 10 ILE HA 1 1 4 2434 1 1 10 ILE HB H 6.098 10.979 1.449 1.00 . A A . 10 ILE HB 1 1 4 2435 1 1 10 ILE HD11 H 4.074 12.083 -2.049 1.00 . A A . 10 ILE HD11 1 1 4 2436 1 1 10 ILE HD12 H 4.400 10.410 -1.597 1.00 . A A . 10 ILE HD12 1 1 4 2437 1 1 10 ILE HD13 H 5.622 11.344 -2.458 1.00 . A A . 10 ILE HD13 1 1 4 2438 1 1 10 ILE HG12 H 4.713 12.533 0.095 1.00 . A A . 10 ILE HG12 1 1 4 2439 1 1 10 ILE HG13 H 6.344 12.379 -0.560 1.00 . A A . 10 ILE HG13 1 1 4 2440 1 1 10 ILE HG21 H 6.685 8.771 0.399 1.00 . A A . 10 ILE HG21 1 1 4 2441 1 1 10 ILE HG22 H 7.586 10.131 -0.271 1.00 . A A . 10 ILE HG22 1 1 4 2442 1 1 10 ILE HG23 H 6.229 9.446 -1.165 1.00 . A A . 10 ILE HG23 1 1 4 2443 1 1 10 ILE N N 3.297 10.974 1.157 1.00 . A A . 10 ILE N 1 1 4 2444 1 1 10 ILE O O 5.208 9.240 2.909 1.00 . A A . 10 ILE O 1 1 4 2445 1 1 11 CYS C C 5.292 6.038 2.786 1.00 . A A . 11 CYS C 1 1 4 2446 1 1 11 CYS CA C 4.002 6.838 2.985 1.00 . A A . 11 CYS CA 1 1 4 2447 1 1 11 CYS CB C 2.797 5.889 2.995 1.00 . A A . 11 CYS CB 1 1 4 2448 1 1 11 CYS H H 3.301 7.641 1.108 1.00 . A A . 11 CYS H 1 1 4 2449 1 1 11 CYS HA H 4.052 7.359 3.930 1.00 . A A . 11 CYS HA 1 1 4 2450 1 1 11 CYS HB2 H 3.026 5.029 3.605 1.00 . A A . 11 CYS HB2 1 1 4 2451 1 1 11 CYS HB3 H 1.942 6.403 3.409 1.00 . A A . 11 CYS HB3 1 1 4 2452 1 1 11 CYS N N 3.864 7.836 1.885 1.00 . A A . 11 CYS N 1 1 4 2453 1 1 11 CYS O O 5.953 6.151 1.773 1.00 . A A . 11 CYS O 1 1 4 2454 1 1 11 CYS SG S 2.410 5.340 1.313 1.00 . A A . 11 CYS SG 1 1 4 2455 1 1 12 SER C C 6.571 2.953 3.472 1.00 . A A . 12 SER C 1 1 4 2456 1 1 12 SER CA C 6.914 4.437 3.618 1.00 . A A . 12 SER CA 1 1 4 2457 1 1 12 SER CB C 7.778 4.636 4.864 1.00 . A A . 12 SER CB 1 1 4 2458 1 1 12 SER H H 5.117 5.164 4.561 1.00 . A A . 12 SER H 1 1 4 2459 1 1 12 SER HA H 7.460 4.767 2.747 1.00 . A A . 12 SER HA 1 1 4 2460 1 1 12 SER HB2 H 8.766 4.246 4.686 1.00 . A A . 12 SER HB2 1 1 4 2461 1 1 12 SER HB3 H 7.846 5.691 5.088 1.00 . A A . 12 SER HB3 1 1 4 2462 1 1 12 SER HG H 6.511 4.506 6.335 1.00 . A A . 12 SER HG 1 1 4 2463 1 1 12 SER N N 5.660 5.236 3.749 1.00 . A A . 12 SER N 1 1 4 2464 1 1 12 SER O O 5.591 2.477 4.009 1.00 . A A . 12 SER O 1 1 4 2465 1 1 12 SER OG O 7.192 3.944 5.959 1.00 . A A . 12 SER OG 1 1 4 2466 1 1 13 LEU C C 6.731 0.160 3.941 1.00 . A A . 13 LEU C 1 1 4 2467 1 1 13 LEU CA C 7.095 0.761 2.584 1.00 . A A . 13 LEU CA 1 1 4 2468 1 1 13 LEU CB C 8.339 0.060 2.035 1.00 . A A . 13 LEU CB 1 1 4 2469 1 1 13 LEU CD1 C 8.304 -1.545 0.123 1.00 . A A . 13 LEU CD1 1 1 4 2470 1 1 13 LEU CD2 C 8.785 -2.364 2.432 1.00 . A A . 13 LEU CD2 1 1 4 2471 1 1 13 LEU CG C 7.977 -1.362 1.605 1.00 . A A . 13 LEU CG 1 1 4 2472 1 1 13 LEU H H 8.164 2.615 2.333 1.00 . A A . 13 LEU H 1 1 4 2473 1 1 13 LEU HA H 6.273 0.630 1.896 1.00 . A A . 13 LEU HA 1 1 4 2474 1 1 13 LEU HB2 H 8.717 0.609 1.185 1.00 . A A . 13 LEU HB2 1 1 4 2475 1 1 13 LEU HB3 H 9.096 0.018 2.803 1.00 . A A . 13 LEU HB3 1 1 4 2476 1 1 13 LEU HD11 H 8.265 -2.595 -0.126 1.00 . A A . 13 LEU HD11 1 1 4 2477 1 1 13 LEU HD12 H 9.294 -1.164 -0.077 1.00 . A A . 13 LEU HD12 1 1 4 2478 1 1 13 LEU HD13 H 7.583 -1.007 -0.474 1.00 . A A . 13 LEU HD13 1 1 4 2479 1 1 13 LEU HD21 H 8.444 -2.343 3.456 1.00 . A A . 13 LEU HD21 1 1 4 2480 1 1 13 LEU HD22 H 9.831 -2.099 2.395 1.00 . A A . 13 LEU HD22 1 1 4 2481 1 1 13 LEU HD23 H 8.650 -3.356 2.027 1.00 . A A . 13 LEU HD23 1 1 4 2482 1 1 13 LEU HG H 6.921 -1.528 1.765 1.00 . A A . 13 LEU HG 1 1 4 2483 1 1 13 LEU N N 7.375 2.215 2.755 1.00 . A A . 13 LEU N 1 1 4 2484 1 1 13 LEU O O 5.987 -0.798 4.028 1.00 . A A . 13 LEU O 1 1 4 2485 1 1 14 TYR C C 5.416 0.244 6.570 1.00 . A A . 14 TYR C 1 1 4 2486 1 1 14 TYR CA C 6.927 0.181 6.354 1.00 . A A . 14 TYR CA 1 1 4 2487 1 1 14 TYR CB C 7.633 1.019 7.424 1.00 . A A . 14 TYR CB 1 1 4 2488 1 1 14 TYR CD1 C 9.695 -0.477 7.029 1.00 . A A . 14 TYR CD1 1 1 4 2489 1 1 14 TYR CD2 C 10.057 1.896 7.438 1.00 . A A . 14 TYR CD2 1 1 4 2490 1 1 14 TYR CE1 C 11.078 -0.658 6.909 1.00 . A A . 14 TYR CE1 1 1 4 2491 1 1 14 TYR CE2 C 11.439 1.697 7.316 1.00 . A A . 14 TYR CE2 1 1 4 2492 1 1 14 TYR CG C 9.161 0.811 7.298 1.00 . A A . 14 TYR CG 1 1 4 2493 1 1 14 TYR CZ C 11.946 0.424 7.052 1.00 . A A . 14 TYR CZ 1 1 4 2494 1 1 14 TYR H H 7.841 1.491 4.909 1.00 . A A . 14 TYR H 1 1 4 2495 1 1 14 TYR HA H 7.259 -0.845 6.422 1.00 . A A . 14 TYR HA 1 1 4 2496 1 1 14 TYR HB2 H 7.368 2.068 7.284 1.00 . A A . 14 TYR HB2 1 1 4 2497 1 1 14 TYR HB3 H 7.286 0.704 8.406 1.00 . A A . 14 TYR HB3 1 1 4 2498 1 1 14 TYR HD1 H 9.050 -1.328 6.911 1.00 . A A . 14 TYR HD1 1 1 4 2499 1 1 14 TYR HD2 H 9.693 2.881 7.635 1.00 . A A . 14 TYR HD2 1 1 4 2500 1 1 14 TYR HE1 H 11.474 -1.641 6.705 1.00 . A A . 14 TYR HE1 1 1 4 2501 1 1 14 TYR HE2 H 12.113 2.533 7.426 1.00 . A A . 14 TYR HE2 1 1 4 2502 1 1 14 TYR HH H 13.749 0.887 7.476 1.00 . A A . 14 TYR HH 1 1 4 2503 1 1 14 TYR N N 7.247 0.718 5.002 1.00 . A A . 14 TYR N 1 1 4 2504 1 1 14 TYR O O 4.783 -0.741 6.894 1.00 . A A . 14 TYR O 1 1 4 2505 1 1 14 TYR OH O 13.308 0.234 6.929 1.00 . A A . 14 TYR OH 1 1 4 2506 1 1 15 GLN C C 2.653 0.600 5.573 1.00 . A A . 15 GLN C 1 1 4 2507 1 1 15 GLN CA C 3.359 1.517 6.571 1.00 . A A . 15 GLN CA 1 1 4 2508 1 1 15 GLN CB C 2.932 2.968 6.335 1.00 . A A . 15 GLN CB 1 1 4 2509 1 1 15 GLN CD C 3.123 3.915 8.639 1.00 . A A . 15 GLN CD 1 1 4 2510 1 1 15 GLN CG C 3.747 3.893 7.242 1.00 . A A . 15 GLN CG 1 1 4 2511 1 1 15 GLN H H 5.358 2.179 6.117 1.00 . A A . 15 GLN H 1 1 4 2512 1 1 15 GLN HA H 3.097 1.221 7.576 1.00 . A A . 15 GLN HA 1 1 4 2513 1 1 15 GLN HB2 H 3.105 3.231 5.301 1.00 . A A . 15 GLN HB2 1 1 4 2514 1 1 15 GLN HB3 H 1.883 3.077 6.564 1.00 . A A . 15 GLN HB3 1 1 4 2515 1 1 15 GLN HE21 H 4.401 2.591 9.385 1.00 . A A . 15 GLN HE21 1 1 4 2516 1 1 15 GLN HE22 H 3.236 3.170 10.476 1.00 . A A . 15 GLN HE22 1 1 4 2517 1 1 15 GLN HG2 H 4.763 3.531 7.305 1.00 . A A . 15 GLN HG2 1 1 4 2518 1 1 15 GLN HG3 H 3.745 4.892 6.833 1.00 . A A . 15 GLN HG3 1 1 4 2519 1 1 15 GLN N N 4.830 1.396 6.385 1.00 . A A . 15 GLN N 1 1 4 2520 1 1 15 GLN NE2 N 3.628 3.163 9.578 1.00 . A A . 15 GLN NE2 1 1 4 2521 1 1 15 GLN O O 1.575 0.101 5.827 1.00 . A A . 15 GLN O 1 1 4 2522 1 1 15 GLN OE1 O 2.167 4.624 8.878 1.00 . A A . 15 GLN OE1 1 1 4 2523 1 1 16 LEU C C 2.689 -1.971 3.958 1.00 . A A . 16 LEU C 1 1 4 2524 1 1 16 LEU CA C 2.628 -0.537 3.438 1.00 . A A . 16 LEU CA 1 1 4 2525 1 1 16 LEU CB C 3.382 -0.436 2.111 1.00 . A A . 16 LEU CB 1 1 4 2526 1 1 16 LEU CD1 C 3.544 2.048 1.905 1.00 . A A . 16 LEU CD1 1 1 4 2527 1 1 16 LEU CD2 C 3.259 0.641 -0.141 1.00 . A A . 16 LEU CD2 1 1 4 2528 1 1 16 LEU CG C 2.889 0.788 1.337 1.00 . A A . 16 LEU CG 1 1 4 2529 1 1 16 LEU H H 4.134 0.765 4.258 1.00 . A A . 16 LEU H 1 1 4 2530 1 1 16 LEU HA H 1.597 -0.249 3.294 1.00 . A A . 16 LEU HA 1 1 4 2531 1 1 16 LEU HB2 H 4.441 -0.338 2.305 1.00 . A A . 16 LEU HB2 1 1 4 2532 1 1 16 LEU HB3 H 3.204 -1.325 1.526 1.00 . A A . 16 LEU HB3 1 1 4 2533 1 1 16 LEU HD11 H 3.030 2.920 1.531 1.00 . A A . 16 LEU HD11 1 1 4 2534 1 1 16 LEU HD12 H 4.580 2.083 1.600 1.00 . A A . 16 LEU HD12 1 1 4 2535 1 1 16 LEU HD13 H 3.486 2.030 2.983 1.00 . A A . 16 LEU HD13 1 1 4 2536 1 1 16 LEU HD21 H 2.456 1.027 -0.752 1.00 . A A . 16 LEU HD21 1 1 4 2537 1 1 16 LEU HD22 H 3.417 -0.402 -0.372 1.00 . A A . 16 LEU HD22 1 1 4 2538 1 1 16 LEU HD23 H 4.163 1.196 -0.344 1.00 . A A . 16 LEU HD23 1 1 4 2539 1 1 16 LEU HG H 1.815 0.866 1.436 1.00 . A A . 16 LEU HG 1 1 4 2540 1 1 16 LEU N N 3.260 0.362 4.442 1.00 . A A . 16 LEU N 1 1 4 2541 1 1 16 LEU O O 1.758 -2.738 3.810 1.00 . A A . 16 LEU O 1 1 4 2542 1 1 17 GLU C C 2.703 -3.963 6.059 1.00 . A A . 17 GLU C 1 1 4 2543 1 1 17 GLU CA C 3.889 -3.712 5.129 1.00 . A A . 17 GLU CA 1 1 4 2544 1 1 17 GLU CB C 5.195 -3.840 5.914 1.00 . A A . 17 GLU CB 1 1 4 2545 1 1 17 GLU CD C 5.805 -5.973 4.756 1.00 . A A . 17 GLU CD 1 1 4 2546 1 1 17 GLU CG C 6.249 -4.539 5.051 1.00 . A A . 17 GLU CG 1 1 4 2547 1 1 17 GLU H H 4.511 -1.702 4.706 1.00 . A A . 17 GLU H 1 1 4 2548 1 1 17 GLU HA H 3.877 -4.428 4.320 1.00 . A A . 17 GLU HA 1 1 4 2549 1 1 17 GLU HB2 H 5.548 -2.856 6.186 1.00 . A A . 17 GLU HB2 1 1 4 2550 1 1 17 GLU HB3 H 5.021 -4.418 6.805 1.00 . A A . 17 GLU HB3 1 1 4 2551 1 1 17 GLU HG2 H 6.368 -4.001 4.122 1.00 . A A . 17 GLU HG2 1 1 4 2552 1 1 17 GLU HG3 H 7.191 -4.558 5.579 1.00 . A A . 17 GLU HG3 1 1 4 2553 1 1 17 GLU N N 3.776 -2.337 4.584 1.00 . A A . 17 GLU N 1 1 4 2554 1 1 17 GLU O O 2.205 -5.066 6.167 1.00 . A A . 17 GLU O 1 1 4 2555 1 1 17 GLU OE1 O 5.890 -6.796 5.653 1.00 . A A . 17 GLU OE1 1 1 4 2556 1 1 17 GLU OE2 O 5.390 -6.225 3.637 1.00 . A A . 17 GLU OE2 1 1 4 2557 1 1 18 ASN C C -0.194 -3.277 6.821 1.00 . A A . 18 ASN C 1 1 4 2558 1 1 18 ASN CA C 1.082 -3.108 7.646 1.00 . A A . 18 ASN CA 1 1 4 2559 1 1 18 ASN CB C 0.949 -1.871 8.538 1.00 . A A . 18 ASN CB 1 1 4 2560 1 1 18 ASN CG C -0.181 -2.086 9.548 1.00 . A A . 18 ASN CG 1 1 4 2561 1 1 18 ASN H H 2.656 -2.055 6.621 1.00 . A A . 18 ASN H 1 1 4 2562 1 1 18 ASN HA H 1.234 -3.983 8.262 1.00 . A A . 18 ASN HA 1 1 4 2563 1 1 18 ASN HB2 H 1.878 -1.705 9.066 1.00 . A A . 18 ASN HB2 1 1 4 2564 1 1 18 ASN HB3 H 0.723 -1.010 7.928 1.00 . A A . 18 ASN HB3 1 1 4 2565 1 1 18 ASN HD21 H 0.380 -3.937 9.998 1.00 . A A . 18 ASN HD21 1 1 4 2566 1 1 18 ASN HD22 H -0.993 -3.374 10.822 1.00 . A A . 18 ASN HD22 1 1 4 2567 1 1 18 ASN N N 2.242 -2.938 6.728 1.00 . A A . 18 ASN N 1 1 4 2568 1 1 18 ASN ND2 N -0.272 -3.227 10.175 1.00 . A A . 18 ASN ND2 1 1 4 2569 1 1 18 ASN O O -1.148 -3.891 7.256 1.00 . A A . 18 ASN O 1 1 4 2570 1 1 18 ASN OD1 O -0.990 -1.206 9.769 1.00 . A A . 18 ASN OD1 1 1 4 2571 1 1 19 TYR C C -1.723 -4.366 4.570 1.00 . A A . 19 TYR C 1 1 4 2572 1 1 19 TYR CA C -1.440 -2.880 4.786 1.00 . A A . 19 TYR CA 1 1 4 2573 1 1 19 TYR CB C -1.218 -2.204 3.430 1.00 . A A . 19 TYR CB 1 1 4 2574 1 1 19 TYR CD1 C -0.938 -0.106 4.953 1.00 . A A . 19 TYR CD1 1 1 4 2575 1 1 19 TYR CD2 C -0.930 0.212 2.538 1.00 . A A . 19 TYR CD2 1 1 4 2576 1 1 19 TYR CE1 C -0.762 1.274 5.121 1.00 . A A . 19 TYR CE1 1 1 4 2577 1 1 19 TYR CE2 C -0.755 1.587 2.729 1.00 . A A . 19 TYR CE2 1 1 4 2578 1 1 19 TYR CG C -1.026 -0.669 3.643 1.00 . A A . 19 TYR CG 1 1 4 2579 1 1 19 TYR CZ C -0.670 2.116 4.014 1.00 . A A . 19 TYR CZ 1 1 4 2580 1 1 19 TYR H H 0.558 -2.250 5.292 1.00 . A A . 19 TYR H 1 1 4 2581 1 1 19 TYR HA H -2.280 -2.421 5.287 1.00 . A A . 19 TYR HA 1 1 4 2582 1 1 19 TYR HB2 H -0.330 -2.654 2.956 1.00 . A A . 19 TYR HB2 1 1 4 2583 1 1 19 TYR HB3 H -2.093 -2.400 2.794 1.00 . A A . 19 TYR HB3 1 1 4 2584 1 1 19 TYR HD1 H -1.006 -0.717 5.831 1.00 . A A . 19 TYR HD1 1 1 4 2585 1 1 19 TYR HD2 H -0.994 -0.155 1.544 1.00 . A A . 19 TYR HD2 1 1 4 2586 1 1 19 TYR HE1 H -0.697 1.688 6.116 1.00 . A A . 19 TYR HE1 1 1 4 2587 1 1 19 TYR HE2 H -0.682 2.242 1.873 1.00 . A A . 19 TYR HE2 1 1 4 2588 1 1 19 TYR HH H -0.068 3.611 5.039 1.00 . A A . 19 TYR HH 1 1 4 2589 1 1 19 TYR N N -0.221 -2.741 5.630 1.00 . A A . 19 TYR N 1 1 4 2590 1 1 19 TYR O O -2.823 -4.759 4.235 1.00 . A A . 19 TYR O 1 1 4 2591 1 1 19 TYR OH O -0.498 3.474 4.191 1.00 . A A . 19 TYR OH 1 1 4 2592 1 1 20 CYS C C -1.619 -7.237 5.814 1.00 . A A . 20 CYS C 1 1 4 2593 1 1 20 CYS CA C -0.932 -6.658 4.576 1.00 . A A . 20 CYS CA 1 1 4 2594 1 1 20 CYS CB C 0.427 -7.333 4.385 1.00 . A A . 20 CYS CB 1 1 4 2595 1 1 20 CYS H H 0.142 -4.852 5.036 1.00 . A A . 20 CYS H 1 1 4 2596 1 1 20 CYS HA H -1.549 -6.832 3.706 1.00 . A A . 20 CYS HA 1 1 4 2597 1 1 20 CYS HB2 H 1.187 -6.759 4.894 1.00 . A A . 20 CYS HB2 1 1 4 2598 1 1 20 CYS HB3 H 0.395 -8.331 4.795 1.00 . A A . 20 CYS HB3 1 1 4 2599 1 1 20 CYS N N -0.734 -5.194 4.764 1.00 . A A . 20 CYS N 1 1 4 2600 1 1 20 CYS O O -1.163 -8.200 6.397 1.00 . A A . 20 CYS O 1 1 4 2601 1 1 20 CYS SG S 0.817 -7.417 2.620 1.00 . A A . 20 CYS SG 1 1 4 2602 1 1 21 ASN C C -4.754 -6.406 7.573 1.00 . A A . 21 ASN C 1 1 4 2603 1 1 21 ASN CA C -3.432 -7.161 7.419 1.00 . A A . 21 ASN CA 1 1 4 2604 1 1 21 ASN CB C -2.571 -6.939 8.665 1.00 . A A . 21 ASN CB 1 1 4 2605 1 1 21 ASN CG C -2.424 -8.259 9.424 1.00 . A A . 21 ASN CG 1 1 4 2606 1 1 21 ASN H H -3.058 -5.877 5.734 1.00 . A A . 21 ASN H 1 1 4 2607 1 1 21 ASN HA H -3.630 -8.216 7.302 1.00 . A A . 21 ASN HA 1 1 4 2608 1 1 21 ASN HB2 H -1.596 -6.581 8.370 1.00 . A A . 21 ASN HB2 1 1 4 2609 1 1 21 ASN HB3 H -3.045 -6.208 9.304 1.00 . A A . 21 ASN HB3 1 1 4 2610 1 1 21 ASN HD21 H -4.343 -8.738 9.245 1.00 . A A . 21 ASN HD21 1 1 4 2611 1 1 21 ASN HD22 H -3.389 -9.864 10.085 1.00 . A A . 21 ASN HD22 1 1 4 2612 1 1 21 ASN N N -2.711 -6.653 6.219 1.00 . A A . 21 ASN N 1 1 4 2613 1 1 21 ASN ND2 N -3.472 -9.017 9.599 1.00 . A A . 21 ASN ND2 1 1 4 2614 1 1 21 ASN O O -5.049 -5.589 6.716 1.00 . A A . 21 ASN O 1 1 4 2615 1 1 21 ASN OXT O -5.447 -6.657 8.544 1.00 . A A . 21 ASN OXT 1 1 4 2616 1 1 21 ASN OD1 O -1.346 -8.603 9.864 1.00 . A A . 21 ASN OD1 1 1 4 2617 2 2 1 PHE C C 11.484 2.543 -1.794 1.00 . B B . 22 PHE C 1 1 4 2618 2 2 1 PHE CA C 12.758 1.803 -2.199 1.00 . B B . 22 PHE CA 1 1 4 2619 2 2 1 PHE CB C 12.429 0.328 -2.472 1.00 . B B . 22 PHE CB 1 1 4 2620 2 2 1 PHE CD1 C 12.034 -0.561 -0.146 1.00 . B B . 22 PHE CD1 1 1 4 2621 2 2 1 PHE CD2 C 14.022 -1.271 -1.344 1.00 . B B . 22 PHE CD2 1 1 4 2622 2 2 1 PHE CE1 C 12.414 -1.348 0.949 1.00 . B B . 22 PHE CE1 1 1 4 2623 2 2 1 PHE CE2 C 14.402 -2.058 -0.249 1.00 . B B . 22 PHE CE2 1 1 4 2624 2 2 1 PHE CG C 12.838 -0.523 -1.292 1.00 . B B . 22 PHE CG 1 1 4 2625 2 2 1 PHE CZ C 13.598 -2.096 0.898 1.00 . B B . 22 PHE CZ 1 1 4 2626 2 2 1 PHE H1 H 14.233 2.843 -1.156 1.00 . B B . 22 PHE H1 1 1 4 2627 2 2 1 PHE H2 H 14.479 1.163 -1.213 1.00 . B B . 22 PHE H2 1 1 4 2628 2 2 1 PHE H3 H 13.294 1.817 -0.185 1.00 . B B . 22 PHE H3 1 1 4 2629 2 2 1 PHE HA H 13.154 2.252 -3.096 1.00 . B B . 22 PHE HA 1 1 4 2630 2 2 1 PHE HB2 H 11.367 0.223 -2.636 1.00 . B B . 22 PHE HB2 1 1 4 2631 2 2 1 PHE HB3 H 12.961 -0.001 -3.352 1.00 . B B . 22 PHE HB3 1 1 4 2632 2 2 1 PHE HD1 H 11.122 0.015 -0.107 1.00 . B B . 22 PHE HD1 1 1 4 2633 2 2 1 PHE HD2 H 14.641 -1.241 -2.229 1.00 . B B . 22 PHE HD2 1 1 4 2634 2 2 1 PHE HE1 H 11.794 -1.377 1.833 1.00 . B B . 22 PHE HE1 1 1 4 2635 2 2 1 PHE HE2 H 15.314 -2.634 -0.289 1.00 . B B . 22 PHE HE2 1 1 4 2636 2 2 1 PHE HZ H 13.891 -2.702 1.743 1.00 . B B . 22 PHE HZ 1 1 4 2637 2 2 1 PHE N N 13.767 1.915 -1.105 1.00 . B B . 22 PHE N 1 1 4 2638 2 2 1 PHE O O 10.474 1.942 -1.484 1.00 . B B . 22 PHE O 1 1 4 2639 2 2 2 VAL C C 10.401 6.034 -2.004 1.00 . B B . 23 VAL C 1 1 4 2640 2 2 2 VAL CA C 10.319 4.626 -1.412 1.00 . B B . 23 VAL CA 1 1 4 2641 2 2 2 VAL CB C 10.219 4.687 0.121 1.00 . B B . 23 VAL CB 1 1 4 2642 2 2 2 VAL CG1 C 10.961 5.912 0.669 1.00 . B B . 23 VAL CG1 1 1 4 2643 2 2 2 VAL CG2 C 8.747 4.754 0.528 1.00 . B B . 23 VAL CG2 1 1 4 2644 2 2 2 VAL H H 12.350 4.310 -2.048 1.00 . B B . 23 VAL H 1 1 4 2645 2 2 2 VAL HA H 9.439 4.139 -1.800 1.00 . B B . 23 VAL HA 1 1 4 2646 2 2 2 VAL HB H 10.660 3.798 0.536 1.00 . B B . 23 VAL HB 1 1 4 2647 2 2 2 VAL HG11 H 11.414 5.663 1.618 1.00 . B B . 23 VAL HG11 1 1 4 2648 2 2 2 VAL HG12 H 10.263 6.724 0.806 1.00 . B B . 23 VAL HG12 1 1 4 2649 2 2 2 VAL HG13 H 11.729 6.210 -0.029 1.00 . B B . 23 VAL HG13 1 1 4 2650 2 2 2 VAL HG21 H 8.630 5.458 1.337 1.00 . B B . 23 VAL HG21 1 1 4 2651 2 2 2 VAL HG22 H 8.418 3.776 0.849 1.00 . B B . 23 VAL HG22 1 1 4 2652 2 2 2 VAL HG23 H 8.156 5.073 -0.318 1.00 . B B . 23 VAL HG23 1 1 4 2653 2 2 2 VAL N N 11.525 3.846 -1.795 1.00 . B B . 23 VAL N 1 1 4 2654 2 2 2 VAL O O 11.103 6.283 -2.963 1.00 . B B . 23 VAL O 1 1 4 2655 2 2 3 ASN C C 8.881 8.403 -3.252 1.00 . B B . 24 ASN C 1 1 4 2656 2 2 3 ASN CA C 9.675 8.347 -1.946 1.00 . B B . 24 ASN CA 1 1 4 2657 2 2 3 ASN CB C 11.113 8.811 -2.202 1.00 . B B . 24 ASN CB 1 1 4 2658 2 2 3 ASN CG C 12.001 8.428 -1.016 1.00 . B B . 24 ASN CG 1 1 4 2659 2 2 3 ASN H H 9.114 6.701 -0.671 1.00 . B B . 24 ASN H 1 1 4 2660 2 2 3 ASN HA H 9.212 8.995 -1.217 1.00 . B B . 24 ASN HA 1 1 4 2661 2 2 3 ASN HB2 H 11.489 8.343 -3.100 1.00 . B B . 24 ASN HB2 1 1 4 2662 2 2 3 ASN HB3 H 11.126 9.884 -2.324 1.00 . B B . 24 ASN HB3 1 1 4 2663 2 2 3 ASN HD21 H 13.302 7.424 -2.131 1.00 . B B . 24 ASN HD21 1 1 4 2664 2 2 3 ASN HD22 H 13.648 7.461 -0.470 1.00 . B B . 24 ASN HD22 1 1 4 2665 2 2 3 ASN N N 9.673 6.945 -1.435 1.00 . B B . 24 ASN N 1 1 4 2666 2 2 3 ASN ND2 N 13.073 7.711 -1.223 1.00 . B B . 24 ASN ND2 1 1 4 2667 2 2 3 ASN O O 9.152 9.205 -4.124 1.00 . B B . 24 ASN O 1 1 4 2668 2 2 3 ASN OD1 O 11.719 8.786 0.110 1.00 . B B . 24 ASN OD1 1 1 4 2669 2 2 4 GLN C C 5.603 7.628 -4.278 1.00 . B B . 25 GLN C 1 1 4 2670 2 2 4 GLN CA C 7.087 7.546 -4.640 1.00 . B B . 25 GLN CA 1 1 4 2671 2 2 4 GLN CB C 7.350 6.251 -5.412 1.00 . B B . 25 GLN CB 1 1 4 2672 2 2 4 GLN CD C 7.810 5.285 -7.672 1.00 . B B . 25 GLN CD 1 1 4 2673 2 2 4 GLN CG C 7.456 6.561 -6.906 1.00 . B B . 25 GLN CG 1 1 4 2674 2 2 4 GLN H H 7.702 6.913 -2.676 1.00 . B B . 25 GLN H 1 1 4 2675 2 2 4 GLN HA H 7.357 8.393 -5.253 1.00 . B B . 25 GLN HA 1 1 4 2676 2 2 4 GLN HB2 H 8.273 5.807 -5.069 1.00 . B B . 25 GLN HB2 1 1 4 2677 2 2 4 GLN HB3 H 6.536 5.561 -5.247 1.00 . B B . 25 GLN HB3 1 1 4 2678 2 2 4 GLN HE21 H 7.017 5.924 -9.376 1.00 . B B . 25 GLN HE21 1 1 4 2679 2 2 4 GLN HE22 H 7.706 4.374 -9.432 1.00 . B B . 25 GLN HE22 1 1 4 2680 2 2 4 GLN HG2 H 6.511 6.944 -7.262 1.00 . B B . 25 GLN HG2 1 1 4 2681 2 2 4 GLN HG3 H 8.227 7.299 -7.065 1.00 . B B . 25 GLN HG3 1 1 4 2682 2 2 4 GLN N N 7.901 7.551 -3.393 1.00 . B B . 25 GLN N 1 1 4 2683 2 2 4 GLN NE2 N 7.483 5.186 -8.931 1.00 . B B . 25 GLN NE2 1 1 4 2684 2 2 4 GLN O O 5.194 7.227 -3.207 1.00 . B B . 25 GLN O 1 1 4 2685 2 2 4 GLN OE1 O 8.389 4.371 -7.120 1.00 . B B . 25 GLN OE1 1 1 4 2686 2 2 5 HIS C C 2.627 7.077 -5.570 1.00 . B B . 26 HIS C 1 1 4 2687 2 2 5 HIS CA C 3.336 8.233 -4.859 1.00 . B B . 26 HIS CA 1 1 4 2688 2 2 5 HIS CB C 2.789 9.567 -5.370 1.00 . B B . 26 HIS CB 1 1 4 2689 2 2 5 HIS CD2 C 0.750 10.925 -4.458 1.00 . B B . 26 HIS CD2 1 1 4 2690 2 2 5 HIS CE1 C 1.178 10.699 -2.339 1.00 . B B . 26 HIS CE1 1 1 4 2691 2 2 5 HIS CG C 1.883 10.170 -4.334 1.00 . B B . 26 HIS CG 1 1 4 2692 2 2 5 HIS H H 5.135 8.454 -6.024 1.00 . B B . 26 HIS H 1 1 4 2693 2 2 5 HIS HA H 3.179 8.157 -3.793 1.00 . B B . 26 HIS HA 1 1 4 2694 2 2 5 HIS HB2 H 3.607 10.241 -5.574 1.00 . B B . 26 HIS HB2 1 1 4 2695 2 2 5 HIS HB3 H 2.224 9.398 -6.275 1.00 . B B . 26 HIS HB3 1 1 4 2696 2 2 5 HIS HD2 H 0.283 11.209 -5.389 1.00 . B B . 26 HIS HD2 1 1 4 2697 2 2 5 HIS HE1 H 1.111 10.781 -1.264 1.00 . B B . 26 HIS HE1 1 1 4 2698 2 2 5 HIS HE2 H -0.485 11.799 -2.974 1.00 . B B . 26 HIS HE2 1 1 4 2699 2 2 5 HIS N N 4.790 8.139 -5.163 1.00 . B B . 26 HIS N 1 1 4 2700 2 2 5 HIS ND1 N 2.143 10.032 -2.986 1.00 . B B . 26 HIS ND1 1 1 4 2701 2 2 5 HIS NE2 N 0.303 11.262 -3.198 1.00 . B B . 26 HIS NE2 1 1 4 2702 2 2 5 HIS O O 3.258 6.259 -6.209 1.00 . B B . 26 HIS O 1 1 4 2703 2 2 6 LEU C C -0.868 6.189 -6.296 1.00 . B B . 27 LEU C 1 1 4 2704 2 2 6 LEU CA C 0.620 5.860 -6.143 1.00 . B B . 27 LEU CA 1 1 4 2705 2 2 6 LEU CB C 0.784 4.569 -5.321 1.00 . B B . 27 LEU CB 1 1 4 2706 2 2 6 LEU CD1 C 0.356 5.903 -3.249 1.00 . B B . 27 LEU CD1 1 1 4 2707 2 2 6 LEU CD2 C 1.313 3.609 -3.092 1.00 . B B . 27 LEU CD2 1 1 4 2708 2 2 6 LEU CG C 1.290 4.892 -3.915 1.00 . B B . 27 LEU CG 1 1 4 2709 2 2 6 LEU H H 0.829 7.646 -4.944 1.00 . B B . 27 LEU H 1 1 4 2710 2 2 6 LEU HA H 1.050 5.711 -7.123 1.00 . B B . 27 LEU HA 1 1 4 2711 2 2 6 LEU HB2 H -0.165 4.065 -5.242 1.00 . B B . 27 LEU HB2 1 1 4 2712 2 2 6 LEU HB3 H 1.493 3.920 -5.812 1.00 . B B . 27 LEU HB3 1 1 4 2713 2 2 6 LEU HD11 H -0.312 5.386 -2.576 1.00 . B B . 27 LEU HD11 1 1 4 2714 2 2 6 LEU HD12 H -0.220 6.414 -4.006 1.00 . B B . 27 LEU HD12 1 1 4 2715 2 2 6 LEU HD13 H 0.941 6.622 -2.694 1.00 . B B . 27 LEU HD13 1 1 4 2716 2 2 6 LEU HD21 H 1.781 2.823 -3.666 1.00 . B B . 27 LEU HD21 1 1 4 2717 2 2 6 LEU HD22 H 0.300 3.322 -2.849 1.00 . B B . 27 LEU HD22 1 1 4 2718 2 2 6 LEU HD23 H 1.869 3.775 -2.183 1.00 . B B . 27 LEU HD23 1 1 4 2719 2 2 6 LEU HG H 2.288 5.303 -3.975 1.00 . B B . 27 LEU HG 1 1 4 2720 2 2 6 LEU N N 1.331 6.986 -5.465 1.00 . B B . 27 LEU N 1 1 4 2721 2 2 6 LEU O O -1.259 7.336 -6.250 1.00 . B B . 27 LEU O 1 1 4 2722 2 2 7 CYS C C -3.683 4.248 -7.555 1.00 . B B . 28 CYS C 1 1 4 2723 2 2 7 CYS CA C -3.157 5.359 -6.648 1.00 . B B . 28 CYS CA 1 1 4 2724 2 2 7 CYS CB C -3.473 6.719 -7.279 1.00 . B B . 28 CYS CB 1 1 4 2725 2 2 7 CYS H H -1.317 4.269 -6.521 1.00 . B B . 28 CYS H 1 1 4 2726 2 2 7 CYS HA H -3.640 5.282 -5.687 1.00 . B B . 28 CYS HA 1 1 4 2727 2 2 7 CYS HB2 H -2.605 7.082 -7.809 1.00 . B B . 28 CYS HB2 1 1 4 2728 2 2 7 CYS HB3 H -4.293 6.607 -7.973 1.00 . B B . 28 CYS HB3 1 1 4 2729 2 2 7 CYS N N -1.683 5.174 -6.483 1.00 . B B . 28 CYS N 1 1 4 2730 2 2 7 CYS O O -2.977 3.743 -8.405 1.00 . B B . 28 CYS O 1 1 4 2731 2 2 7 CYS SG S -3.938 7.908 -5.985 1.00 . B B . 28 CYS SG 1 1 4 2732 2 2 8 GLY C C -4.539 1.570 -8.241 1.00 . B B . 29 GLY C 1 1 4 2733 2 2 8 GLY CA C -5.483 2.773 -8.231 1.00 . B B . 29 GLY CA 1 1 4 2734 2 2 8 GLY H H -5.466 4.272 -6.684 1.00 . B B . 29 GLY H 1 1 4 2735 2 2 8 GLY HA2 H -6.444 2.474 -7.836 1.00 . B B . 29 GLY HA2 1 1 4 2736 2 2 8 GLY HA3 H -5.607 3.136 -9.240 1.00 . B B . 29 GLY HA3 1 1 4 2737 2 2 8 GLY N N -4.915 3.856 -7.379 1.00 . B B . 29 GLY N 1 1 4 2738 2 2 8 GLY O O -4.139 1.070 -7.206 1.00 . B B . 29 GLY O 1 1 4 2739 2 2 9 SER C C -1.955 0.239 -8.771 1.00 . B B . 30 SER C 1 1 4 2740 2 2 9 SER CA C -3.270 -0.076 -9.486 1.00 . B B . 30 SER CA 1 1 4 2741 2 2 9 SER CB C -2.987 -0.401 -10.953 1.00 . B B . 30 SER CB 1 1 4 2742 2 2 9 SER H H -4.520 1.513 -10.225 1.00 . B B . 30 SER H 1 1 4 2743 2 2 9 SER HA H -3.739 -0.928 -9.014 1.00 . B B . 30 SER HA 1 1 4 2744 2 2 9 SER HB2 H -2.048 0.037 -11.246 1.00 . B B . 30 SER HB2 1 1 4 2745 2 2 9 SER HB3 H -2.936 -1.474 -11.079 1.00 . B B . 30 SER HB3 1 1 4 2746 2 2 9 SER HG H -4.839 -0.330 -11.549 1.00 . B B . 30 SER HG 1 1 4 2747 2 2 9 SER N N -4.183 1.097 -9.404 1.00 . B B . 30 SER N 1 1 4 2748 2 2 9 SER O O -1.500 -0.517 -7.936 1.00 . B B . 30 SER O 1 1 4 2749 2 2 9 SER OG O -4.026 0.135 -11.762 1.00 . B B . 30 SER OG 1 1 4 2750 2 2 10 ASP C C -0.169 1.417 -6.924 1.00 . B B . 31 ASP C 1 1 4 2751 2 2 10 ASP CA C -0.052 1.699 -8.421 1.00 . B B . 31 ASP CA 1 1 4 2752 2 2 10 ASP CB C 0.256 3.183 -8.633 1.00 . B B . 31 ASP CB 1 1 4 2753 2 2 10 ASP CG C 0.075 3.542 -10.109 1.00 . B B . 31 ASP CG 1 1 4 2754 2 2 10 ASP H H -1.719 1.944 -9.767 1.00 . B B . 31 ASP H 1 1 4 2755 2 2 10 ASP HA H 0.745 1.102 -8.838 1.00 . B B . 31 ASP HA 1 1 4 2756 2 2 10 ASP HB2 H -0.414 3.778 -8.032 1.00 . B B . 31 ASP HB2 1 1 4 2757 2 2 10 ASP HB3 H 1.276 3.384 -8.337 1.00 . B B . 31 ASP HB3 1 1 4 2758 2 2 10 ASP N N -1.338 1.347 -9.090 1.00 . B B . 31 ASP N 1 1 4 2759 2 2 10 ASP O O 0.732 0.880 -6.312 1.00 . B B . 31 ASP O 1 1 4 2760 2 2 10 ASP OD1 O -1.062 3.702 -10.525 1.00 . B B . 31 ASP OD1 1 1 4 2761 2 2 10 ASP OD2 O 1.074 3.654 -10.799 1.00 . B B . 31 ASP OD2 1 1 4 2762 2 2 11 LEU C C -1.412 0.012 -4.609 1.00 . B B . 32 LEU C 1 1 4 2763 2 2 11 LEU CA C -1.440 1.518 -4.871 1.00 . B B . 32 LEU CA 1 1 4 2764 2 2 11 LEU CB C -2.769 2.101 -4.391 1.00 . B B . 32 LEU CB 1 1 4 2765 2 2 11 LEU CD1 C -2.793 4.385 -3.389 1.00 . B B . 32 LEU CD1 1 1 4 2766 2 2 11 LEU CD2 C -3.486 2.415 -2.019 1.00 . B B . 32 LEU CD2 1 1 4 2767 2 2 11 LEU CG C -2.534 2.905 -3.113 1.00 . B B . 32 LEU CG 1 1 4 2768 2 2 11 LEU H H -1.993 2.202 -6.838 1.00 . B B . 32 LEU H 1 1 4 2769 2 2 11 LEU HA H -0.628 1.987 -4.335 1.00 . B B . 32 LEU HA 1 1 4 2770 2 2 11 LEU HB2 H -3.176 2.748 -5.156 1.00 . B B . 32 LEU HB2 1 1 4 2771 2 2 11 LEU HB3 H -3.464 1.299 -4.189 1.00 . B B . 32 LEU HB3 1 1 4 2772 2 2 11 LEU HD11 H -2.465 4.627 -4.389 1.00 . B B . 32 LEU HD11 1 1 4 2773 2 2 11 LEU HD12 H -2.248 4.987 -2.677 1.00 . B B . 32 LEU HD12 1 1 4 2774 2 2 11 LEU HD13 H -3.850 4.589 -3.297 1.00 . B B . 32 LEU HD13 1 1 4 2775 2 2 11 LEU HD21 H -4.012 3.259 -1.598 1.00 . B B . 32 LEU HD21 1 1 4 2776 2 2 11 LEU HD22 H -2.919 1.920 -1.244 1.00 . B B . 32 LEU HD22 1 1 4 2777 2 2 11 LEU HD23 H -4.197 1.723 -2.445 1.00 . B B . 32 LEU HD23 1 1 4 2778 2 2 11 LEU HG H -1.511 2.773 -2.789 1.00 . B B . 32 LEU HG 1 1 4 2779 2 2 11 LEU N N -1.274 1.772 -6.328 1.00 . B B . 32 LEU N 1 1 4 2780 2 2 11 LEU O O -0.426 -0.522 -4.143 1.00 . B B . 32 LEU O 1 1 4 2781 2 2 12 VAL C C -1.180 -2.748 -5.160 1.00 . B B . 33 VAL C 1 1 4 2782 2 2 12 VAL CA C -2.495 -2.152 -4.666 1.00 . B B . 33 VAL CA 1 1 4 2783 2 2 12 VAL CB C -3.652 -2.793 -5.431 1.00 . B B . 33 VAL CB 1 1 4 2784 2 2 12 VAL CG1 C -4.957 -2.089 -5.069 1.00 . B B . 33 VAL CG1 1 1 4 2785 2 2 12 VAL CG2 C -3.402 -2.661 -6.934 1.00 . B B . 33 VAL CG2 1 1 4 2786 2 2 12 VAL H H -3.268 -0.234 -5.280 1.00 . B B . 33 VAL H 1 1 4 2787 2 2 12 VAL HA H -2.606 -2.348 -3.609 1.00 . B B . 33 VAL HA 1 1 4 2788 2 2 12 VAL HB H -3.722 -3.838 -5.167 1.00 . B B . 33 VAL HB 1 1 4 2789 2 2 12 VAL HG11 H -5.180 -1.342 -5.816 1.00 . B B . 33 VAL HG11 1 1 4 2790 2 2 12 VAL HG12 H -4.854 -1.617 -4.104 1.00 . B B . 33 VAL HG12 1 1 4 2791 2 2 12 VAL HG13 H -5.757 -2.813 -5.034 1.00 . B B . 33 VAL HG13 1 1 4 2792 2 2 12 VAL HG21 H -4.162 -3.204 -7.475 1.00 . B B . 33 VAL HG21 1 1 4 2793 2 2 12 VAL HG22 H -2.430 -3.068 -7.173 1.00 . B B . 33 VAL HG22 1 1 4 2794 2 2 12 VAL HG23 H -3.435 -1.619 -7.215 1.00 . B B . 33 VAL HG23 1 1 4 2795 2 2 12 VAL N N -2.481 -0.680 -4.903 1.00 . B B . 33 VAL N 1 1 4 2796 2 2 12 VAL O O -0.662 -3.693 -4.599 1.00 . B B . 33 VAL O 1 1 4 2797 2 2 13 GLU C C 1.736 -2.541 -5.685 1.00 . B B . 34 GLU C 1 1 4 2798 2 2 13 GLU CA C 0.646 -2.717 -6.740 1.00 . B B . 34 GLU CA 1 1 4 2799 2 2 13 GLU CB C 1.020 -1.935 -7.998 1.00 . B B . 34 GLU CB 1 1 4 2800 2 2 13 GLU CD C 1.530 -3.495 -9.884 1.00 . B B . 34 GLU CD 1 1 4 2801 2 2 13 GLU CG C 0.446 -2.635 -9.231 1.00 . B B . 34 GLU CG 1 1 4 2802 2 2 13 GLU H H -1.065 -1.433 -6.643 1.00 . B B . 34 GLU H 1 1 4 2803 2 2 13 GLU HA H 0.541 -3.764 -6.982 1.00 . B B . 34 GLU HA 1 1 4 2804 2 2 13 GLU HB2 H 0.618 -0.934 -7.931 1.00 . B B . 34 GLU HB2 1 1 4 2805 2 2 13 GLU HB3 H 2.091 -1.885 -8.080 1.00 . B B . 34 GLU HB3 1 1 4 2806 2 2 13 GLU HG2 H -0.384 -3.261 -8.936 1.00 . B B . 34 GLU HG2 1 1 4 2807 2 2 13 GLU HG3 H 0.104 -1.894 -9.938 1.00 . B B . 34 GLU HG3 1 1 4 2808 2 2 13 GLU N N -0.634 -2.195 -6.208 1.00 . B B . 34 GLU N 1 1 4 2809 2 2 13 GLU O O 2.425 -3.475 -5.334 1.00 . B B . 34 GLU O 1 1 4 2810 2 2 13 GLU OE1 O 2.497 -2.928 -10.366 1.00 . B B . 34 GLU OE1 1 1 4 2811 2 2 13 GLU OE2 O 1.374 -4.704 -9.890 1.00 . B B . 34 GLU OE2 1 1 4 2812 2 2 14 ALA C C 2.733 -2.078 -2.970 1.00 . B B . 35 ALA C 1 1 4 2813 2 2 14 ALA CA C 2.947 -1.117 -4.141 1.00 . B B . 35 ALA CA 1 1 4 2814 2 2 14 ALA CB C 2.872 0.327 -3.645 1.00 . B B . 35 ALA CB 1 1 4 2815 2 2 14 ALA H H 1.328 -0.605 -5.469 1.00 . B B . 35 ALA H 1 1 4 2816 2 2 14 ALA HA H 3.918 -1.298 -4.577 1.00 . B B . 35 ALA HA 1 1 4 2817 2 2 14 ALA HB1 H 3.597 0.927 -4.174 1.00 . B B . 35 ALA HB1 1 1 4 2818 2 2 14 ALA HB2 H 3.084 0.356 -2.586 1.00 . B B . 35 ALA HB2 1 1 4 2819 2 2 14 ALA HB3 H 1.882 0.719 -3.825 1.00 . B B . 35 ALA HB3 1 1 4 2820 2 2 14 ALA N N 1.898 -1.348 -5.173 1.00 . B B . 35 ALA N 1 1 4 2821 2 2 14 ALA O O 3.628 -2.798 -2.574 1.00 . B B . 35 ALA O 1 1 4 2822 2 2 15 LEU C C 1.613 -4.456 -1.770 1.00 . B B . 36 LEU C 1 1 4 2823 2 2 15 LEU CA C 1.304 -3.045 -1.286 1.00 . B B . 36 LEU CA 1 1 4 2824 2 2 15 LEU CB C -0.165 -2.964 -0.846 1.00 . B B . 36 LEU CB 1 1 4 2825 2 2 15 LEU CD1 C 0.685 -0.772 0.075 1.00 . B B . 36 LEU CD1 1 1 4 2826 2 2 15 LEU CD2 C -1.097 -0.797 -1.679 1.00 . B B . 36 LEU CD2 1 1 4 2827 2 2 15 LEU CG C -0.540 -1.526 -0.455 1.00 . B B . 36 LEU CG 1 1 4 2828 2 2 15 LEU H H 0.835 -1.531 -2.745 1.00 . B B . 36 LEU H 1 1 4 2829 2 2 15 LEU HA H 1.947 -2.796 -0.458 1.00 . B B . 36 LEU HA 1 1 4 2830 2 2 15 LEU HB2 H -0.798 -3.287 -1.660 1.00 . B B . 36 LEU HB2 1 1 4 2831 2 2 15 LEU HB3 H -0.319 -3.614 0.002 1.00 . B B . 36 LEU HB3 1 1 4 2832 2 2 15 LEU HD11 H 1.063 -1.274 0.953 1.00 . B B . 36 LEU HD11 1 1 4 2833 2 2 15 LEU HD12 H 0.402 0.239 0.331 1.00 . B B . 36 LEU HD12 1 1 4 2834 2 2 15 LEU HD13 H 1.451 -0.749 -0.686 1.00 . B B . 36 LEU HD13 1 1 4 2835 2 2 15 LEU HD21 H -0.353 -0.115 -2.061 1.00 . B B . 36 LEU HD21 1 1 4 2836 2 2 15 LEU HD22 H -1.982 -0.246 -1.397 1.00 . B B . 36 LEU HD22 1 1 4 2837 2 2 15 LEU HD23 H -1.350 -1.518 -2.442 1.00 . B B . 36 LEU HD23 1 1 4 2838 2 2 15 LEU HG H -1.296 -1.556 0.315 1.00 . B B . 36 LEU HG 1 1 4 2839 2 2 15 LEU N N 1.552 -2.109 -2.414 1.00 . B B . 36 LEU N 1 1 4 2840 2 2 15 LEU O O 2.026 -5.319 -1.016 1.00 . B B . 36 LEU O 1 1 4 2841 2 2 16 TYR C C 3.215 -6.230 -3.698 1.00 . B B . 37 TYR C 1 1 4 2842 2 2 16 TYR CA C 1.699 -6.025 -3.611 1.00 . B B . 37 TYR CA 1 1 4 2843 2 2 16 TYR CB C 1.076 -6.116 -5.007 1.00 . B B . 37 TYR CB 1 1 4 2844 2 2 16 TYR CD1 C 0.831 -8.671 -5.193 1.00 . B B . 37 TYR CD1 1 1 4 2845 2 2 16 TYR CD2 C 2.420 -7.559 -6.665 1.00 . B B . 37 TYR CD2 1 1 4 2846 2 2 16 TYR CE1 C 1.177 -9.901 -5.764 1.00 . B B . 37 TYR CE1 1 1 4 2847 2 2 16 TYR CE2 C 2.754 -8.798 -7.226 1.00 . B B . 37 TYR CE2 1 1 4 2848 2 2 16 TYR CG C 1.448 -7.476 -5.638 1.00 . B B . 37 TYR CG 1 1 4 2849 2 2 16 TYR CZ C 2.133 -9.964 -6.777 1.00 . B B . 37 TYR CZ 1 1 4 2850 2 2 16 TYR H H 1.095 -3.964 -3.615 1.00 . B B . 37 TYR H 1 1 4 2851 2 2 16 TYR HA H 1.269 -6.785 -2.975 1.00 . B B . 37 TYR HA 1 1 4 2852 2 2 16 TYR HB2 H -0.008 -6.013 -4.916 1.00 . B B . 37 TYR HB2 1 1 4 2853 2 2 16 TYR HB3 H 1.447 -5.298 -5.618 1.00 . B B . 37 TYR HB3 1 1 4 2854 2 2 16 TYR HD1 H 0.097 -8.653 -4.413 1.00 . B B . 37 TYR HD1 1 1 4 2855 2 2 16 TYR HD2 H 2.916 -6.682 -7.022 1.00 . B B . 37 TYR HD2 1 1 4 2856 2 2 16 TYR HE1 H 0.700 -10.807 -5.418 1.00 . B B . 37 TYR HE1 1 1 4 2857 2 2 16 TYR HE2 H 3.494 -8.852 -8.011 1.00 . B B . 37 TYR HE2 1 1 4 2858 2 2 16 TYR HH H 3.311 -11.455 -6.962 1.00 . B B . 37 TYR HH 1 1 4 2859 2 2 16 TYR N N 1.420 -4.684 -3.037 1.00 . B B . 37 TYR N 1 1 4 2860 2 2 16 TYR O O 3.691 -7.327 -3.914 1.00 . B B . 37 TYR O 1 1 4 2861 2 2 16 TYR OH O 2.468 -11.181 -7.334 1.00 . B B . 37 TYR OH 1 1 4 2862 2 2 17 LEU C C 5.995 -5.476 -2.136 1.00 . B B . 38 LEU C 1 1 4 2863 2 2 17 LEU CA C 5.467 -5.333 -3.562 1.00 . B B . 38 LEU CA 1 1 4 2864 2 2 17 LEU CB C 6.125 -4.111 -4.217 1.00 . B B . 38 LEU CB 1 1 4 2865 2 2 17 LEU CD1 C 5.777 -2.119 -5.674 1.00 . B B . 38 LEU CD1 1 1 4 2866 2 2 17 LEU CD2 C 4.684 -4.285 -6.250 1.00 . B B . 38 LEU CD2 1 1 4 2867 2 2 17 LEU CG C 5.123 -3.378 -5.102 1.00 . B B . 38 LEU CG 1 1 4 2868 2 2 17 LEU H H 3.581 -4.310 -3.321 1.00 . B B . 38 LEU H 1 1 4 2869 2 2 17 LEU HA H 5.714 -6.219 -4.127 1.00 . B B . 38 LEU HA 1 1 4 2870 2 2 17 LEU HB2 H 6.476 -3.439 -3.447 1.00 . B B . 38 LEU HB2 1 1 4 2871 2 2 17 LEU HB3 H 6.962 -4.434 -4.817 1.00 . B B . 38 LEU HB3 1 1 4 2872 2 2 17 LEU HD11 H 5.960 -1.416 -4.875 1.00 . B B . 38 LEU HD11 1 1 4 2873 2 2 17 LEU HD12 H 5.118 -1.672 -6.403 1.00 . B B . 38 LEU HD12 1 1 4 2874 2 2 17 LEU HD13 H 6.712 -2.381 -6.145 1.00 . B B . 38 LEU HD13 1 1 4 2875 2 2 17 LEU HD21 H 4.225 -3.687 -7.024 1.00 . B B . 38 LEU HD21 1 1 4 2876 2 2 17 LEU HD22 H 3.971 -5.007 -5.882 1.00 . B B . 38 LEU HD22 1 1 4 2877 2 2 17 LEU HD23 H 5.544 -4.797 -6.652 1.00 . B B . 38 LEU HD23 1 1 4 2878 2 2 17 LEU HG H 4.269 -3.101 -4.514 1.00 . B B . 38 LEU HG 1 1 4 2879 2 2 17 LEU N N 3.982 -5.183 -3.511 1.00 . B B . 38 LEU N 1 1 4 2880 2 2 17 LEU O O 6.733 -6.390 -1.825 1.00 . B B . 38 LEU O 1 1 4 2881 2 2 18 VAL C C 5.887 -6.106 0.636 1.00 . B B . 39 VAL C 1 1 4 2882 2 2 18 VAL CA C 6.094 -4.673 0.146 1.00 . B B . 39 VAL CA 1 1 4 2883 2 2 18 VAL CB C 5.306 -3.691 1.024 1.00 . B B . 39 VAL CB 1 1 4 2884 2 2 18 VAL CG1 C 5.132 -2.369 0.275 1.00 . B B . 39 VAL CG1 1 1 4 2885 2 2 18 VAL CG2 C 3.925 -4.271 1.352 1.00 . B B . 39 VAL CG2 1 1 4 2886 2 2 18 VAL H H 5.019 -3.854 -1.531 1.00 . B B . 39 VAL H 1 1 4 2887 2 2 18 VAL HA H 7.145 -4.429 0.185 1.00 . B B . 39 VAL HA 1 1 4 2888 2 2 18 VAL HB H 5.851 -3.514 1.940 1.00 . B B . 39 VAL HB 1 1 4 2889 2 2 18 VAL HG11 H 5.233 -1.546 0.968 1.00 . B B . 39 VAL HG11 1 1 4 2890 2 2 18 VAL HG12 H 4.153 -2.339 -0.180 1.00 . B B . 39 VAL HG12 1 1 4 2891 2 2 18 VAL HG13 H 5.888 -2.288 -0.492 1.00 . B B . 39 VAL HG13 1 1 4 2892 2 2 18 VAL HG21 H 4.017 -4.990 2.153 1.00 . B B . 39 VAL HG21 1 1 4 2893 2 2 18 VAL HG22 H 3.520 -4.757 0.477 1.00 . B B . 39 VAL HG22 1 1 4 2894 2 2 18 VAL HG23 H 3.264 -3.474 1.659 1.00 . B B . 39 VAL HG23 1 1 4 2895 2 2 18 VAL N N 5.618 -4.581 -1.261 1.00 . B B . 39 VAL N 1 1 4 2896 2 2 18 VAL O O 6.693 -6.648 1.367 1.00 . B B . 39 VAL O 1 1 4 2897 2 2 19 CYS C C 5.116 -9.083 -0.410 1.00 . B B . 40 CYS C 1 1 4 2898 2 2 19 CYS CA C 4.561 -8.133 0.647 1.00 . B B . 40 CYS CA 1 1 4 2899 2 2 19 CYS CB C 3.058 -8.357 0.810 1.00 . B B . 40 CYS CB 1 1 4 2900 2 2 19 CYS H H 4.187 -6.276 -0.374 1.00 . B B . 40 CYS H 1 1 4 2901 2 2 19 CYS HA H 5.055 -8.319 1.582 1.00 . B B . 40 CYS HA 1 1 4 2902 2 2 19 CYS HB2 H 2.519 -7.585 0.279 1.00 . B B . 40 CYS HB2 1 1 4 2903 2 2 19 CYS HB3 H 2.790 -9.324 0.411 1.00 . B B . 40 CYS HB3 1 1 4 2904 2 2 19 CYS N N 4.816 -6.729 0.224 1.00 . B B . 40 CYS N 1 1 4 2905 2 2 19 CYS O O 5.897 -9.968 -0.122 1.00 . B B . 40 CYS O 1 1 4 2906 2 2 19 CYS SG S 2.637 -8.289 2.568 1.00 . B B . 40 CYS SG 1 1 4 2907 2 2 20 GLY C C 4.482 -11.102 -2.722 1.00 . B B . 41 GLY C 1 1 4 2908 2 2 20 GLY CA C 5.229 -9.768 -2.729 1.00 . B B . 41 GLY CA 1 1 4 2909 2 2 20 GLY H H 4.103 -8.168 -1.832 1.00 . B B . 41 GLY H 1 1 4 2910 2 2 20 GLY HA2 H 5.077 -9.276 -3.679 1.00 . B B . 41 GLY HA2 1 1 4 2911 2 2 20 GLY HA3 H 6.283 -9.951 -2.585 1.00 . B B . 41 GLY HA3 1 1 4 2912 2 2 20 GLY N N 4.725 -8.893 -1.634 1.00 . B B . 41 GLY N 1 1 4 2913 2 2 20 GLY O O 3.988 -11.551 -3.737 1.00 . B B . 41 GLY O 1 1 4 2914 2 2 21 GLU C C 2.472 -12.949 -0.612 1.00 . B B . 42 GLU C 1 1 4 2915 2 2 21 GLU CA C 3.690 -13.053 -1.532 1.00 . B B . 42 GLU CA 1 1 4 2916 2 2 21 GLU CB C 4.641 -14.126 -0.999 1.00 . B B . 42 GLU CB 1 1 4 2917 2 2 21 GLU CD C 5.496 -14.788 1.253 1.00 . B B . 42 GLU CD 1 1 4 2918 2 2 21 GLU CG C 5.322 -13.624 0.275 1.00 . B B . 42 GLU CG 1 1 4 2919 2 2 21 GLU H H 4.809 -11.369 -0.782 1.00 . B B . 42 GLU H 1 1 4 2920 2 2 21 GLU HA H 3.365 -13.326 -2.524 1.00 . B B . 42 GLU HA 1 1 4 2921 2 2 21 GLU HB2 H 4.082 -15.024 -0.779 1.00 . B B . 42 GLU HB2 1 1 4 2922 2 2 21 GLU HB3 H 5.391 -14.342 -1.744 1.00 . B B . 42 GLU HB3 1 1 4 2923 2 2 21 GLU HG2 H 6.290 -13.213 0.027 1.00 . B B . 42 GLU HG2 1 1 4 2924 2 2 21 GLU HG3 H 4.712 -12.860 0.732 1.00 . B B . 42 GLU HG3 1 1 4 2925 2 2 21 GLU N N 4.400 -11.744 -1.590 1.00 . B B . 42 GLU N 1 1 4 2926 2 2 21 GLU O O 1.984 -13.937 -0.101 1.00 . B B . 42 GLU O 1 1 4 2927 2 2 21 GLU OE1 O 5.077 -15.884 0.919 1.00 . B B . 42 GLU OE1 1 1 4 2928 2 2 21 GLU OE2 O 6.045 -14.563 2.319 1.00 . B B . 42 GLU OE2 1 1 4 2929 2 2 22 ARG C C -0.355 -12.483 -0.050 1.00 . B B . 43 ARG C 1 1 4 2930 2 2 22 ARG CA C 0.782 -11.609 0.483 1.00 . B B . 43 ARG CA 1 1 4 2931 2 2 22 ARG CB C 0.336 -10.146 0.492 1.00 . B B . 43 ARG CB 1 1 4 2932 2 2 22 ARG CD C -0.552 -8.327 -0.969 1.00 . B B . 43 ARG CD 1 1 4 2933 2 2 22 ARG CG C 0.245 -9.632 -0.945 1.00 . B B . 43 ARG CG 1 1 4 2934 2 2 22 ARG CZ C -2.359 -8.064 -2.558 1.00 . B B . 43 ARG CZ 1 1 4 2935 2 2 22 ARG H H 2.376 -10.978 -0.823 1.00 . B B . 43 ARG H 1 1 4 2936 2 2 22 ARG HA H 1.035 -11.917 1.487 1.00 . B B . 43 ARG HA 1 1 4 2937 2 2 22 ARG HB2 H -0.633 -10.068 0.965 1.00 . B B . 43 ARG HB2 1 1 4 2938 2 2 22 ARG HB3 H 1.052 -9.553 1.040 1.00 . B B . 43 ARG HB3 1 1 4 2939 2 2 22 ARG HD2 H -0.589 -7.910 0.026 1.00 . B B . 43 ARG HD2 1 1 4 2940 2 2 22 ARG HD3 H -0.072 -7.625 -1.636 1.00 . B B . 43 ARG HD3 1 1 4 2941 2 2 22 ARG HE H -2.530 -9.180 -0.925 1.00 . B B . 43 ARG HE 1 1 4 2942 2 2 22 ARG HG2 H 1.240 -9.455 -1.327 1.00 . B B . 43 ARG HG2 1 1 4 2943 2 2 22 ARG HG3 H -0.252 -10.367 -1.559 1.00 . B B . 43 ARG HG3 1 1 4 2944 2 2 22 ARG HH11 H -2.539 -6.227 -1.783 1.00 . B B . 43 ARG HH11 1 1 4 2945 2 2 22 ARG HH12 H -2.969 -6.381 -3.454 1.00 . B B . 43 ARG HH12 1 1 4 2946 2 2 22 ARG HH21 H -2.274 -9.775 -3.593 1.00 . B B . 43 ARG HH21 1 1 4 2947 2 2 22 ARG HH22 H -2.819 -8.390 -4.479 1.00 . B B . 43 ARG HH22 1 1 4 2948 2 2 22 ARG N N 1.972 -11.764 -0.399 1.00 . B B . 43 ARG N 1 1 4 2949 2 2 22 ARG NE N -1.936 -8.599 -1.446 1.00 . B B . 43 ARG NE 1 1 4 2950 2 2 22 ARG NH1 N -2.644 -6.791 -2.602 1.00 . B B . 43 ARG NH1 1 1 4 2951 2 2 22 ARG NH2 N -2.494 -8.800 -3.626 1.00 . B B . 43 ARG NH2 1 1 4 2952 2 2 22 ARG O O -0.193 -13.207 -1.012 1.00 . B B . 43 ARG O 1 1 4 2953 2 2 23 GLY C C -3.199 -12.657 -1.214 1.00 . B B . 44 GLY C 1 1 4 2954 2 2 23 GLY CA C -2.648 -13.250 0.084 1.00 . B B . 44 GLY CA 1 1 4 2955 2 2 23 GLY H H -1.618 -11.830 1.336 1.00 . B B . 44 GLY H 1 1 4 2956 2 2 23 GLY HA2 H -2.311 -14.260 -0.094 1.00 . B B . 44 GLY HA2 1 1 4 2957 2 2 23 GLY HA3 H -3.427 -13.255 0.831 1.00 . B B . 44 GLY HA3 1 1 4 2958 2 2 23 GLY N N -1.505 -12.422 0.563 1.00 . B B . 44 GLY N 1 1 4 2959 2 2 23 GLY O O -3.052 -11.480 -1.481 1.00 . B B . 44 GLY O 1 1 4 2960 2 2 24 GLY C C -5.708 -12.210 -3.019 1.00 . B B . 45 GLY C 1 1 4 2961 2 2 24 GLY CA C -4.392 -12.936 -3.301 1.00 . B B . 45 GLY CA 1 1 4 2962 2 2 24 GLY H H -3.942 -14.405 -1.790 1.00 . B B . 45 GLY H 1 1 4 2963 2 2 24 GLY HA2 H -3.687 -12.250 -3.748 1.00 . B B . 45 GLY HA2 1 1 4 2964 2 2 24 GLY HA3 H -4.575 -13.757 -3.977 1.00 . B B . 45 GLY HA3 1 1 4 2965 2 2 24 GLY N N -3.832 -13.459 -2.023 1.00 . B B . 45 GLY N 1 1 4 2966 2 2 24 GLY O O -6.738 -12.537 -3.571 1.00 . B B . 45 GLY O 1 1 4 2967 2 2 25 PHE C C -6.601 -9.024 -1.541 1.00 . B B . 46 PHE C 1 1 4 2968 2 2 25 PHE CA C -6.935 -10.487 -1.841 1.00 . B B . 46 PHE CA 1 1 4 2969 2 2 25 PHE CB C -7.604 -11.123 -0.620 1.00 . B B . 46 PHE CB 1 1 4 2970 2 2 25 PHE CD1 C -10.000 -10.235 -1.100 1.00 . B B . 46 PHE CD1 1 1 4 2971 2 2 25 PHE CD2 C -8.915 -9.543 0.970 1.00 . B B . 46 PHE CD2 1 1 4 2972 2 2 25 PHE CE1 C -11.126 -9.480 -0.748 1.00 . B B . 46 PHE CE1 1 1 4 2973 2 2 25 PHE CE2 C -10.051 -8.794 1.301 1.00 . B B . 46 PHE CE2 1 1 4 2974 2 2 25 PHE CG C -8.865 -10.286 -0.240 1.00 . B B . 46 PHE CG 1 1 4 2975 2 2 25 PHE CZ C -11.151 -8.764 0.446 1.00 . B B . 46 PHE CZ 1 1 4 2976 2 2 25 PHE H H -4.841 -10.981 -1.721 1.00 . B B . 46 PHE H 1 1 4 2977 2 2 25 PHE HA H -7.605 -10.536 -2.686 1.00 . B B . 46 PHE HA 1 1 4 2978 2 2 25 PHE HB2 H -7.876 -12.161 -0.873 1.00 . B B . 46 PHE HB2 1 1 4 2979 2 2 25 PHE HB3 H -6.883 -11.140 0.209 1.00 . B B . 46 PHE HB3 1 1 4 2980 2 2 25 PHE HD1 H -10.016 -10.765 -2.029 1.00 . B B . 46 PHE HD1 1 1 4 2981 2 2 25 PHE HD2 H -8.090 -9.534 1.644 1.00 . B B . 46 PHE HD2 1 1 4 2982 2 2 25 PHE HE1 H -11.979 -9.451 -1.409 1.00 . B B . 46 PHE HE1 1 1 4 2983 2 2 25 PHE HE2 H -10.076 -8.237 2.226 1.00 . B B . 46 PHE HE2 1 1 4 2984 2 2 25 PHE HZ H -12.024 -8.185 0.710 1.00 . B B . 46 PHE HZ 1 1 4 2985 2 2 25 PHE N N -5.682 -11.229 -2.159 1.00 . B B . 46 PHE N 1 1 4 2986 2 2 25 PHE O O -5.613 -8.721 -0.901 1.00 . B B . 46 PHE O 1 1 4 2987 2 2 26 TYR C C -8.303 -5.830 -2.285 1.00 . B B . 47 TYR C 1 1 4 2988 2 2 26 TYR CA C -7.144 -6.670 -1.745 1.00 . B B . 47 TYR CA 1 1 4 2989 2 2 26 TYR CB C -5.847 -6.265 -2.450 1.00 . B B . 47 TYR CB 1 1 4 2990 2 2 26 TYR CD1 C -5.832 -3.666 -2.447 1.00 . B B . 47 TYR CD1 1 1 4 2991 2 2 26 TYR CD2 C -4.468 -4.818 -0.787 1.00 . B B . 47 TYR CD2 1 1 4 2992 2 2 26 TYR CE1 C -5.399 -2.437 -1.931 1.00 . B B . 47 TYR CE1 1 1 4 2993 2 2 26 TYR CE2 C -4.051 -3.578 -0.288 1.00 . B B . 47 TYR CE2 1 1 4 2994 2 2 26 TYR CG C -5.372 -4.889 -1.885 1.00 . B B . 47 TYR CG 1 1 4 2995 2 2 26 TYR CZ C -4.512 -2.395 -0.859 1.00 . B B . 47 TYR CZ 1 1 4 2996 2 2 26 TYR H H -8.206 -8.379 -2.516 1.00 . B B . 47 TYR H 1 1 4 2997 2 2 26 TYR HA H -7.043 -6.505 -0.682 1.00 . B B . 47 TYR HA 1 1 4 2998 2 2 26 TYR HB2 H -5.094 -7.051 -2.277 1.00 . B B . 47 TYR HB2 1 1 4 2999 2 2 26 TYR HB3 H -6.041 -6.195 -3.530 1.00 . B B . 47 TYR HB3 1 1 4 3000 2 2 26 TYR HD1 H -6.519 -3.658 -3.265 1.00 . B B . 47 TYR HD1 1 1 4 3001 2 2 26 TYR HD2 H -4.101 -5.703 -0.316 1.00 . B B . 47 TYR HD2 1 1 4 3002 2 2 26 TYR HE1 H -5.758 -1.517 -2.368 1.00 . B B . 47 TYR HE1 1 1 4 3003 2 2 26 TYR HE2 H -3.363 -3.539 0.543 1.00 . B B . 47 TYR HE2 1 1 4 3004 2 2 26 TYR HH H -4.252 -0.511 -1.030 1.00 . B B . 47 TYR HH 1 1 4 3005 2 2 26 TYR N N -7.416 -8.113 -2.001 1.00 . B B . 47 TYR N 1 1 4 3006 2 2 26 TYR O O -8.284 -5.382 -3.415 1.00 . B B . 47 TYR O 1 1 4 3007 2 2 26 TYR OH O -4.092 -1.179 -0.359 1.00 . B B . 47 TYR OH 1 1 4 3008 2 2 27 THR C C -10.512 -3.481 -1.191 1.00 . B B . 48 THR C 1 1 4 3009 2 2 27 THR CA C -10.471 -4.799 -1.959 1.00 . B B . 48 THR CA 1 1 4 3010 2 2 27 THR CB C -11.769 -5.576 -1.719 1.00 . B B . 48 THR CB 1 1 4 3011 2 2 27 THR CG2 C -12.878 -5.010 -2.604 1.00 . B B . 48 THR CG2 1 1 4 3012 2 2 27 THR H H -9.310 -5.981 -0.581 1.00 . B B . 48 THR H 1 1 4 3013 2 2 27 THR HA H -10.363 -4.596 -3.007 1.00 . B B . 48 THR HA 1 1 4 3014 2 2 27 THR HB H -12.057 -5.484 -0.683 1.00 . B B . 48 THR HB 1 1 4 3015 2 2 27 THR HG1 H -12.156 -7.468 -1.486 1.00 . B B . 48 THR HG1 1 1 4 3016 2 2 27 THR HG21 H -12.550 -4.079 -3.042 1.00 . B B . 48 THR HG21 1 1 4 3017 2 2 27 THR HG22 H -13.761 -4.834 -2.007 1.00 . B B . 48 THR HG22 1 1 4 3018 2 2 27 THR HG23 H -13.109 -5.716 -3.388 1.00 . B B . 48 THR HG23 1 1 4 3019 2 2 27 THR N N -9.313 -5.611 -1.489 1.00 . B B . 48 THR N 1 1 4 3020 2 2 27 THR O O -10.597 -2.412 -1.764 1.00 . B B . 48 THR O 1 1 4 3021 2 2 27 THR OG1 O -11.563 -6.947 -2.033 1.00 . B B . 48 THR OG1 1 1 4 3022 2 2 28 LYS C C -10.751 -2.688 2.398 1.00 . B B . 49 LYS C 1 1 4 3023 2 2 28 LYS CA C -10.474 -2.315 0.931 1.00 . B B . 49 LYS CA 1 1 4 3024 2 2 28 LYS CB C -11.554 -1.360 0.380 1.00 . B B . 49 LYS CB 1 1 4 3025 2 2 28 LYS CD C -13.023 0.590 0.940 1.00 . B B . 49 LYS CD 1 1 4 3026 2 2 28 LYS CE C -13.879 1.218 2.041 1.00 . B B . 49 LYS CE 1 1 4 3027 2 2 28 LYS CG C -12.232 -0.586 1.518 1.00 . B B . 49 LYS CG 1 1 4 3028 2 2 28 LYS H H -10.374 -4.429 0.532 1.00 . B B . 49 LYS H 1 1 4 3029 2 2 28 LYS HA H -9.510 -1.830 0.869 1.00 . B B . 49 LYS HA 1 1 4 3030 2 2 28 LYS HB2 H -11.091 -0.657 -0.297 1.00 . B B . 49 LYS HB2 1 1 4 3031 2 2 28 LYS HB3 H -12.296 -1.929 -0.158 1.00 . B B . 49 LYS HB3 1 1 4 3032 2 2 28 LYS HD2 H -12.337 1.327 0.550 1.00 . B B . 49 LYS HD2 1 1 4 3033 2 2 28 LYS HD3 H -13.664 0.237 0.146 1.00 . B B . 49 LYS HD3 1 1 4 3034 2 2 28 LYS HE2 H -14.862 1.439 1.651 1.00 . B B . 49 LYS HE2 1 1 4 3035 2 2 28 LYS HE3 H -13.966 0.528 2.867 1.00 . B B . 49 LYS HE3 1 1 4 3036 2 2 28 LYS HG2 H -12.903 -1.244 2.051 1.00 . B B . 49 LYS HG2 1 1 4 3037 2 2 28 LYS HG3 H -11.480 -0.212 2.197 1.00 . B B . 49 LYS HG3 1 1 4 3038 2 2 28 LYS HZ1 H -13.826 2.912 3.250 1.00 . B B . 49 LYS HZ1 1 1 4 3039 2 2 28 LYS HZ2 H -13.138 3.136 1.713 1.00 . B B . 49 LYS HZ2 1 1 4 3040 2 2 28 LYS HZ3 H -12.298 2.263 2.904 1.00 . B B . 49 LYS HZ3 1 1 4 3041 2 2 28 LYS N N -10.446 -3.554 0.104 1.00 . B B . 49 LYS N 1 1 4 3042 2 2 28 LYS NZ N -13.237 2.478 2.513 1.00 . B B . 49 LYS NZ 1 1 4 3043 2 2 28 LYS O O -9.985 -2.336 3.273 1.00 . B B . 49 LYS O 1 1 4 3044 2 2 29 PRO C C -11.376 -5.006 4.430 1.00 . B B . 50 PRO C 1 1 4 3045 2 2 29 PRO CA C -12.227 -3.820 3.973 1.00 . B B . 50 PRO CA 1 1 4 3046 2 2 29 PRO CB C -13.692 -4.231 3.812 1.00 . B B . 50 PRO CB 1 1 4 3047 2 2 29 PRO CD C -12.764 -3.813 1.561 1.00 . B B . 50 PRO CD 1 1 4 3048 2 2 29 PRO CG C -13.888 -4.549 2.313 1.00 . B B . 50 PRO CG 1 1 4 3049 2 2 29 PRO HA H -12.151 -3.002 4.664 1.00 . B B . 50 PRO HA 1 1 4 3050 2 2 29 PRO HB2 H -13.897 -5.107 4.412 1.00 . B B . 50 PRO HB2 1 1 4 3051 2 2 29 PRO HB3 H -14.340 -3.419 4.100 1.00 . B B . 50 PRO HB3 1 1 4 3052 2 2 29 PRO HD2 H -12.273 -4.479 0.870 1.00 . B B . 50 PRO HD2 1 1 4 3053 2 2 29 PRO HD3 H -13.160 -2.953 1.050 1.00 . B B . 50 PRO HD3 1 1 4 3054 2 2 29 PRO HG2 H -13.812 -5.615 2.148 1.00 . B B . 50 PRO HG2 1 1 4 3055 2 2 29 PRO HG3 H -14.848 -4.188 1.978 1.00 . B B . 50 PRO HG3 1 1 4 3056 2 2 29 PRO N N -11.835 -3.387 2.623 1.00 . B B . 50 PRO N 1 1 4 3057 2 2 29 PRO O O -10.485 -5.449 3.734 1.00 . B B . 50 PRO O 1 1 4 3058 2 2 30 THR C C -11.793 -7.750 6.647 1.00 . B B . 51 THR C 1 1 4 3059 2 2 30 THR CA C -10.849 -6.680 6.096 1.00 . B B . 51 THR CA 1 1 4 3060 2 2 30 THR CB C -9.907 -6.211 7.207 1.00 . B B . 51 THR CB 1 1 4 3061 2 2 30 THR CG2 C -8.611 -7.020 7.154 1.00 . B B . 51 THR CG2 1 1 4 3062 2 2 30 THR H H -12.367 -5.152 6.145 1.00 . B B . 51 THR H 1 1 4 3063 2 2 30 THR HA H -10.270 -7.095 5.285 1.00 . B B . 51 THR HA 1 1 4 3064 2 2 30 THR HB H -10.379 -6.358 8.165 1.00 . B B . 51 THR HB 1 1 4 3065 2 2 30 THR HG1 H -9.621 -4.645 6.087 1.00 . B B . 51 THR HG1 1 1 4 3066 2 2 30 THR HG21 H -8.542 -7.646 8.031 1.00 . B B . 51 THR HG21 1 1 4 3067 2 2 30 THR HG22 H -7.767 -6.346 7.125 1.00 . B B . 51 THR HG22 1 1 4 3068 2 2 30 THR HG23 H -8.609 -7.639 6.269 1.00 . B B . 51 THR HG23 1 1 4 3069 2 2 30 THR N N -11.643 -5.524 5.597 1.00 . B B . 51 THR N 1 1 4 3070 2 2 30 THR O O -12.961 -7.721 6.294 1.00 . B B . 51 THR O 1 1 4 3071 2 2 30 THR OXT O -11.332 -8.582 7.411 1.00 . B B . 51 THR OXT 1 1 4 3072 2 2 30 THR OG1 O -9.615 -4.831 7.029 1.00 . B B . 51 THR OG1 1 1 5 3073 1 1 1 GLY C C -3.365 9.041 5.343 1.00 . A A . 1 GLY C 1 1 5 3074 1 1 1 GLY CA C -4.630 9.726 5.737 1.00 . A A . 1 GLY CA 1 1 5 3075 1 1 1 GLY H1 H -6.245 9.760 7.105 1.00 . A A . 1 GLY H1 1 1 5 3076 1 1 1 GLY H2 H -4.994 8.700 7.552 1.00 . A A . 1 GLY H2 1 1 5 3077 1 1 1 GLY H3 H -6.063 8.275 6.302 1.00 . A A . 1 GLY H3 1 1 5 3078 1 1 1 GLY HA2 H -4.901 9.518 4.824 1.00 . A A . 1 GLY HA2 1 1 5 3079 1 1 1 GLY HA3 H -4.636 10.870 5.966 1.00 . A A . 1 GLY HA3 1 1 5 3080 1 1 1 GLY N N -5.557 9.062 6.756 1.00 . A A . 1 GLY N 1 1 5 3081 1 1 1 GLY O O -2.285 9.580 5.487 1.00 . A A . 1 GLY O 1 1 5 3082 1 1 2 ILE C C -1.695 7.694 3.120 1.00 . A A . 2 ILE C 1 1 5 3083 1 1 2 ILE CA C -2.234 7.104 4.426 1.00 . A A . 2 ILE CA 1 1 5 3084 1 1 2 ILE CB C -2.576 5.629 4.212 1.00 . A A . 2 ILE CB 1 1 5 3085 1 1 2 ILE CD1 C -3.159 3.487 5.356 1.00 . A A . 2 ILE CD1 1 1 5 3086 1 1 2 ILE CG1 C -2.891 4.978 5.561 1.00 . A A . 2 ILE CG1 1 1 5 3087 1 1 2 ILE CG2 C -1.385 4.916 3.567 1.00 . A A . 2 ILE CG2 1 1 5 3088 1 1 2 ILE H H -4.342 7.425 4.731 1.00 . A A . 2 ILE H 1 1 5 3089 1 1 2 ILE HA H -1.484 7.191 5.198 1.00 . A A . 2 ILE HA 1 1 5 3090 1 1 2 ILE HB H -3.436 5.551 3.563 1.00 . A A . 2 ILE HB 1 1 5 3091 1 1 2 ILE HD11 H -3.788 3.351 4.488 1.00 . A A . 2 ILE HD11 1 1 5 3092 1 1 2 ILE HD12 H -3.656 3.088 6.227 1.00 . A A . 2 ILE HD12 1 1 5 3093 1 1 2 ILE HD13 H -2.223 2.970 5.207 1.00 . A A . 2 ILE HD13 1 1 5 3094 1 1 2 ILE HG12 H -2.051 5.106 6.228 1.00 . A A . 2 ILE HG12 1 1 5 3095 1 1 2 ILE HG13 H -3.766 5.443 5.990 1.00 . A A . 2 ILE HG13 1 1 5 3096 1 1 2 ILE HG21 H -0.547 5.594 3.508 1.00 . A A . 2 ILE HG21 1 1 5 3097 1 1 2 ILE HG22 H -1.657 4.592 2.573 1.00 . A A . 2 ILE HG22 1 1 5 3098 1 1 2 ILE HG23 H -1.112 4.057 4.163 1.00 . A A . 2 ILE HG23 1 1 5 3099 1 1 2 ILE N N -3.461 7.842 4.838 1.00 . A A . 2 ILE N 1 1 5 3100 1 1 2 ILE O O -0.519 7.607 2.826 1.00 . A A . 2 ILE O 1 1 5 3101 1 1 3 VAL C C -1.255 10.133 1.315 1.00 . A A . 3 VAL C 1 1 5 3102 1 1 3 VAL CA C -2.091 8.881 1.041 1.00 . A A . 3 VAL CA 1 1 5 3103 1 1 3 VAL CB C -3.317 9.242 0.190 1.00 . A A . 3 VAL CB 1 1 5 3104 1 1 3 VAL CG1 C -4.402 8.186 0.399 1.00 . A A . 3 VAL CG1 1 1 5 3105 1 1 3 VAL CG2 C -3.867 10.612 0.609 1.00 . A A . 3 VAL CG2 1 1 5 3106 1 1 3 VAL H H -3.492 8.345 2.586 1.00 . A A . 3 VAL H 1 1 5 3107 1 1 3 VAL HA H -1.488 8.162 0.514 1.00 . A A . 3 VAL HA 1 1 5 3108 1 1 3 VAL HB H -3.037 9.267 -0.853 1.00 . A A . 3 VAL HB 1 1 5 3109 1 1 3 VAL HG11 H -4.811 7.896 -0.557 1.00 . A A . 3 VAL HG11 1 1 5 3110 1 1 3 VAL HG12 H -5.187 8.595 1.019 1.00 . A A . 3 VAL HG12 1 1 5 3111 1 1 3 VAL HG13 H -3.973 7.323 0.885 1.00 . A A . 3 VAL HG13 1 1 5 3112 1 1 3 VAL HG21 H -3.139 11.377 0.379 1.00 . A A . 3 VAL HG21 1 1 5 3113 1 1 3 VAL HG22 H -4.066 10.612 1.670 1.00 . A A . 3 VAL HG22 1 1 5 3114 1 1 3 VAL HG23 H -4.782 10.814 0.071 1.00 . A A . 3 VAL HG23 1 1 5 3115 1 1 3 VAL N N -2.548 8.290 2.332 1.00 . A A . 3 VAL N 1 1 5 3116 1 1 3 VAL O O -0.361 10.476 0.567 1.00 . A A . 3 VAL O 1 1 5 3117 1 1 4 GLU C C 0.647 11.698 3.078 1.00 . A A . 4 GLU C 1 1 5 3118 1 1 4 GLU CA C -0.796 12.054 2.716 1.00 . A A . 4 GLU CA 1 1 5 3119 1 1 4 GLU CB C -1.467 12.743 3.905 1.00 . A A . 4 GLU CB 1 1 5 3120 1 1 4 GLU CD C -3.611 14.024 3.900 1.00 . A A . 4 GLU CD 1 1 5 3121 1 1 4 GLU CG C -2.987 12.635 3.760 1.00 . A A . 4 GLU CG 1 1 5 3122 1 1 4 GLU H H -2.282 10.517 2.958 1.00 . A A . 4 GLU H 1 1 5 3123 1 1 4 GLU HA H -0.799 12.720 1.866 1.00 . A A . 4 GLU HA 1 1 5 3124 1 1 4 GLU HB2 H -1.157 12.264 4.822 1.00 . A A . 4 GLU HB2 1 1 5 3125 1 1 4 GLU HB3 H -1.183 13.785 3.927 1.00 . A A . 4 GLU HB3 1 1 5 3126 1 1 4 GLU HG2 H -3.227 12.226 2.788 1.00 . A A . 4 GLU HG2 1 1 5 3127 1 1 4 GLU HG3 H -3.378 11.987 4.530 1.00 . A A . 4 GLU HG3 1 1 5 3128 1 1 4 GLU N N -1.552 10.816 2.380 1.00 . A A . 4 GLU N 1 1 5 3129 1 1 4 GLU O O 1.496 12.559 3.200 1.00 . A A . 4 GLU O 1 1 5 3130 1 1 4 GLU OE1 O -3.003 14.863 4.545 1.00 . A A . 4 GLU OE1 1 1 5 3131 1 1 4 GLU OE2 O -4.685 14.227 3.359 1.00 . A A . 4 GLU OE2 1 1 5 3132 1 1 5 GLN C C 3.015 9.417 2.387 1.00 . A A . 5 GLN C 1 1 5 3133 1 1 5 GLN CA C 2.324 10.035 3.607 1.00 . A A . 5 GLN CA 1 1 5 3134 1 1 5 GLN CB C 2.283 9.013 4.746 1.00 . A A . 5 GLN CB 1 1 5 3135 1 1 5 GLN CD C 4.166 9.125 6.384 1.00 . A A . 5 GLN CD 1 1 5 3136 1 1 5 GLN CG C 2.779 9.667 6.038 1.00 . A A . 5 GLN CG 1 1 5 3137 1 1 5 GLN H H 0.236 9.756 3.150 1.00 . A A . 5 GLN H 1 1 5 3138 1 1 5 GLN HA H 2.876 10.906 3.928 1.00 . A A . 5 GLN HA 1 1 5 3139 1 1 5 GLN HB2 H 1.269 8.667 4.883 1.00 . A A . 5 GLN HB2 1 1 5 3140 1 1 5 GLN HB3 H 2.920 8.176 4.502 1.00 . A A . 5 GLN HB3 1 1 5 3141 1 1 5 GLN HE21 H 3.489 7.335 6.907 1.00 . A A . 5 GLN HE21 1 1 5 3142 1 1 5 GLN HE22 H 5.169 7.539 7.033 1.00 . A A . 5 GLN HE22 1 1 5 3143 1 1 5 GLN HG2 H 2.834 10.738 5.902 1.00 . A A . 5 GLN HG2 1 1 5 3144 1 1 5 GLN HG3 H 2.096 9.440 6.843 1.00 . A A . 5 GLN HG3 1 1 5 3145 1 1 5 GLN N N 0.934 10.437 3.252 1.00 . A A . 5 GLN N 1 1 5 3146 1 1 5 GLN NE2 N 4.285 7.898 6.811 1.00 . A A . 5 GLN NE2 1 1 5 3147 1 1 5 GLN O O 4.215 9.523 2.225 1.00 . A A . 5 GLN O 1 1 5 3148 1 1 5 GLN OE1 O 5.152 9.825 6.267 1.00 . A A . 5 GLN OE1 1 1 5 3149 1 1 6 CYS C C 2.594 8.971 -0.923 1.00 . A A . 6 CYS C 1 1 5 3150 1 1 6 CYS CA C 2.905 8.141 0.328 1.00 . A A . 6 CYS CA 1 1 5 3151 1 1 6 CYS CB C 2.362 6.723 0.145 1.00 . A A . 6 CYS CB 1 1 5 3152 1 1 6 CYS H H 1.309 8.685 1.674 1.00 . A A . 6 CYS H 1 1 5 3153 1 1 6 CYS HA H 3.976 8.097 0.468 1.00 . A A . 6 CYS HA 1 1 5 3154 1 1 6 CYS HB2 H 1.283 6.752 0.116 1.00 . A A . 6 CYS HB2 1 1 5 3155 1 1 6 CYS HB3 H 2.737 6.310 -0.780 1.00 . A A . 6 CYS HB3 1 1 5 3156 1 1 6 CYS N N 2.275 8.767 1.528 1.00 . A A . 6 CYS N 1 1 5 3157 1 1 6 CYS O O 3.403 9.073 -1.825 1.00 . A A . 6 CYS O 1 1 5 3158 1 1 6 CYS SG S 2.902 5.690 1.529 1.00 . A A . 6 CYS SG 1 1 5 3159 1 1 7 CYS C C 2.037 11.568 -2.300 1.00 . A A . 7 CYS C 1 1 5 3160 1 1 7 CYS CA C 1.084 10.375 -2.193 1.00 . A A . 7 CYS CA 1 1 5 3161 1 1 7 CYS CB C -0.354 10.872 -2.077 1.00 . A A . 7 CYS CB 1 1 5 3162 1 1 7 CYS H H 0.789 9.467 -0.259 1.00 . A A . 7 CYS H 1 1 5 3163 1 1 7 CYS HA H 1.180 9.762 -3.080 1.00 . A A . 7 CYS HA 1 1 5 3164 1 1 7 CYS HB2 H -0.938 10.154 -1.518 1.00 . A A . 7 CYS HB2 1 1 5 3165 1 1 7 CYS HB3 H -0.369 11.823 -1.567 1.00 . A A . 7 CYS HB3 1 1 5 3166 1 1 7 CYS N N 1.432 9.561 -0.992 1.00 . A A . 7 CYS N 1 1 5 3167 1 1 7 CYS O O 2.082 12.249 -3.305 1.00 . A A . 7 CYS O 1 1 5 3168 1 1 7 CYS SG S -1.062 11.061 -3.730 1.00 . A A . 7 CYS SG 1 1 5 3169 1 1 8 THR C C 5.172 12.369 -1.530 1.00 . A A . 8 THR C 1 1 5 3170 1 1 8 THR CA C 3.773 12.950 -1.333 1.00 . A A . 8 THR CA 1 1 5 3171 1 1 8 THR CB C 3.723 13.738 -0.022 1.00 . A A . 8 THR CB 1 1 5 3172 1 1 8 THR CG2 C 4.304 12.888 1.107 1.00 . A A . 8 THR CG2 1 1 5 3173 1 1 8 THR H H 2.764 11.251 -0.482 1.00 . A A . 8 THR H 1 1 5 3174 1 1 8 THR HA H 3.527 13.599 -2.162 1.00 . A A . 8 THR HA 1 1 5 3175 1 1 8 THR HB H 2.699 13.988 0.210 1.00 . A A . 8 THR HB 1 1 5 3176 1 1 8 THR HG1 H 4.152 15.569 0.473 1.00 . A A . 8 THR HG1 1 1 5 3177 1 1 8 THR HG21 H 5.372 12.793 0.973 1.00 . A A . 8 THR HG21 1 1 5 3178 1 1 8 THR HG22 H 3.850 11.909 1.091 1.00 . A A . 8 THR HG22 1 1 5 3179 1 1 8 THR HG23 H 4.102 13.363 2.056 1.00 . A A . 8 THR HG23 1 1 5 3180 1 1 8 THR N N 2.808 11.818 -1.279 1.00 . A A . 8 THR N 1 1 5 3181 1 1 8 THR O O 5.990 12.903 -2.254 1.00 . A A . 8 THR O 1 1 5 3182 1 1 8 THR OG1 O 4.483 14.931 -0.162 1.00 . A A . 8 THR OG1 1 1 5 3183 1 1 9 SER C C 6.532 9.145 -1.445 1.00 . A A . 9 SER C 1 1 5 3184 1 1 9 SER CA C 6.764 10.603 -1.043 1.00 . A A . 9 SER CA 1 1 5 3185 1 1 9 SER CB C 7.517 10.661 0.287 1.00 . A A . 9 SER CB 1 1 5 3186 1 1 9 SER H H 4.751 10.846 -0.334 1.00 . A A . 9 SER H 1 1 5 3187 1 1 9 SER HA H 7.336 11.104 -1.810 1.00 . A A . 9 SER HA 1 1 5 3188 1 1 9 SER HB2 H 6.836 10.467 1.098 1.00 . A A . 9 SER HB2 1 1 5 3189 1 1 9 SER HB3 H 8.299 9.913 0.290 1.00 . A A . 9 SER HB3 1 1 5 3190 1 1 9 SER HG H 7.451 12.498 0.928 1.00 . A A . 9 SER HG 1 1 5 3191 1 1 9 SER N N 5.437 11.259 -0.898 1.00 . A A . 9 SER N 1 1 5 3192 1 1 9 SER O O 5.548 8.541 -1.069 1.00 . A A . 9 SER O 1 1 5 3193 1 1 9 SER OG O 8.082 11.956 0.449 1.00 . A A . 9 SER OG 1 1 5 3194 1 1 10 ILE C C 7.619 6.229 -1.490 1.00 . A A . 10 ILE C 1 1 5 3195 1 1 10 ILE CA C 7.216 7.161 -2.637 1.00 . A A . 10 ILE CA 1 1 5 3196 1 1 10 ILE CB C 8.069 6.881 -3.884 1.00 . A A . 10 ILE CB 1 1 5 3197 1 1 10 ILE CD1 C 7.811 8.656 -5.625 1.00 . A A . 10 ILE CD1 1 1 5 3198 1 1 10 ILE CG1 C 7.294 7.303 -5.135 1.00 . A A . 10 ILE CG1 1 1 5 3199 1 1 10 ILE CG2 C 8.394 5.388 -3.982 1.00 . A A . 10 ILE CG2 1 1 5 3200 1 1 10 ILE H H 8.202 9.075 -2.517 1.00 . A A . 10 ILE H 1 1 5 3201 1 1 10 ILE HA H 6.173 7.005 -2.873 1.00 . A A . 10 ILE HA 1 1 5 3202 1 1 10 ILE HB H 8.988 7.444 -3.824 1.00 . A A . 10 ILE HB 1 1 5 3203 1 1 10 ILE HD11 H 8.735 8.515 -6.164 1.00 . A A . 10 ILE HD11 1 1 5 3204 1 1 10 ILE HD12 H 7.983 9.304 -4.778 1.00 . A A . 10 ILE HD12 1 1 5 3205 1 1 10 ILE HD13 H 7.078 9.106 -6.279 1.00 . A A . 10 ILE HD13 1 1 5 3206 1 1 10 ILE HG12 H 7.432 6.563 -5.910 1.00 . A A . 10 ILE HG12 1 1 5 3207 1 1 10 ILE HG13 H 6.244 7.385 -4.899 1.00 . A A . 10 ILE HG13 1 1 5 3208 1 1 10 ILE HG21 H 7.605 4.818 -3.515 1.00 . A A . 10 ILE HG21 1 1 5 3209 1 1 10 ILE HG22 H 9.328 5.192 -3.477 1.00 . A A . 10 ILE HG22 1 1 5 3210 1 1 10 ILE HG23 H 8.478 5.106 -5.020 1.00 . A A . 10 ILE HG23 1 1 5 3211 1 1 10 ILE N N 7.416 8.575 -2.213 1.00 . A A . 10 ILE N 1 1 5 3212 1 1 10 ILE O O 8.760 5.829 -1.372 1.00 . A A . 10 ILE O 1 1 5 3213 1 1 11 CYS C C 7.646 3.690 -0.041 1.00 . A A . 11 CYS C 1 1 5 3214 1 1 11 CYS CA C 6.999 4.971 0.490 1.00 . A A . 11 CYS CA 1 1 5 3215 1 1 11 CYS CB C 5.708 4.614 1.230 1.00 . A A . 11 CYS CB 1 1 5 3216 1 1 11 CYS H H 5.770 6.212 -0.768 1.00 . A A . 11 CYS H 1 1 5 3217 1 1 11 CYS HA H 7.679 5.464 1.168 1.00 . A A . 11 CYS HA 1 1 5 3218 1 1 11 CYS HB2 H 5.063 4.048 0.575 1.00 . A A . 11 CYS HB2 1 1 5 3219 1 1 11 CYS HB3 H 5.944 4.023 2.102 1.00 . A A . 11 CYS HB3 1 1 5 3220 1 1 11 CYS N N 6.684 5.878 -0.649 1.00 . A A . 11 CYS N 1 1 5 3221 1 1 11 CYS O O 7.705 3.463 -1.231 1.00 . A A . 11 CYS O 1 1 5 3222 1 1 11 CYS SG S 4.862 6.129 1.742 1.00 . A A . 11 CYS SG 1 1 5 3223 1 1 12 SER C C 7.844 0.406 0.695 1.00 . A A . 12 SER C 1 1 5 3224 1 1 12 SER CA C 8.771 1.583 0.391 1.00 . A A . 12 SER CA 1 1 5 3225 1 1 12 SER CB C 10.091 1.399 1.140 1.00 . A A . 12 SER CB 1 1 5 3226 1 1 12 SER H H 8.065 3.058 1.793 1.00 . A A . 12 SER H 1 1 5 3227 1 1 12 SER HA H 8.964 1.623 -0.671 1.00 . A A . 12 SER HA 1 1 5 3228 1 1 12 SER HB2 H 10.627 0.561 0.728 1.00 . A A . 12 SER HB2 1 1 5 3229 1 1 12 SER HB3 H 10.689 2.293 1.035 1.00 . A A . 12 SER HB3 1 1 5 3230 1 1 12 SER HG H 9.273 1.871 2.840 1.00 . A A . 12 SER HG 1 1 5 3231 1 1 12 SER N N 8.128 2.852 0.837 1.00 . A A . 12 SER N 1 1 5 3232 1 1 12 SER O O 7.012 0.470 1.578 1.00 . A A . 12 SER O 1 1 5 3233 1 1 12 SER OG O 9.821 1.154 2.514 1.00 . A A . 12 SER OG 1 1 5 3234 1 1 13 LEU C C 7.037 -2.115 1.726 1.00 . A A . 13 LEU C 1 1 5 3235 1 1 13 LEU CA C 7.110 -1.852 0.222 1.00 . A A . 13 LEU CA 1 1 5 3236 1 1 13 LEU CB C 7.695 -3.077 -0.485 1.00 . A A . 13 LEU CB 1 1 5 3237 1 1 13 LEU CD1 C 6.167 -3.568 -2.399 1.00 . A A . 13 LEU CD1 1 1 5 3238 1 1 13 LEU CD2 C 7.026 -5.431 -0.974 1.00 . A A . 13 LEU CD2 1 1 5 3239 1 1 13 LEU CG C 6.561 -3.974 -0.977 1.00 . A A . 13 LEU CG 1 1 5 3240 1 1 13 LEU H H 8.661 -0.705 -0.734 1.00 . A A . 13 LEU H 1 1 5 3241 1 1 13 LEU HA H 6.118 -1.654 -0.157 1.00 . A A . 13 LEU HA 1 1 5 3242 1 1 13 LEU HB2 H 8.291 -2.755 -1.327 1.00 . A A . 13 LEU HB2 1 1 5 3243 1 1 13 LEU HB3 H 8.315 -3.629 0.205 1.00 . A A . 13 LEU HB3 1 1 5 3244 1 1 13 LEU HD11 H 7.057 -3.342 -2.968 1.00 . A A . 13 LEU HD11 1 1 5 3245 1 1 13 LEU HD12 H 5.533 -2.694 -2.362 1.00 . A A . 13 LEU HD12 1 1 5 3246 1 1 13 LEU HD13 H 5.634 -4.379 -2.872 1.00 . A A . 13 LEU HD13 1 1 5 3247 1 1 13 LEU HD21 H 7.853 -5.546 -1.659 1.00 . A A . 13 LEU HD21 1 1 5 3248 1 1 13 LEU HD22 H 6.212 -6.070 -1.284 1.00 . A A . 13 LEU HD22 1 1 5 3249 1 1 13 LEU HD23 H 7.341 -5.707 0.021 1.00 . A A . 13 LEU HD23 1 1 5 3250 1 1 13 LEU HG H 5.711 -3.867 -0.321 1.00 . A A . 13 LEU HG 1 1 5 3251 1 1 13 LEU N N 7.982 -0.671 -0.028 1.00 . A A . 13 LEU N 1 1 5 3252 1 1 13 LEU O O 6.075 -2.662 2.226 1.00 . A A . 13 LEU O 1 1 5 3253 1 1 14 TYR C C 6.948 -1.088 4.563 1.00 . A A . 14 TYR C 1 1 5 3254 1 1 14 TYR CA C 8.036 -1.953 3.925 1.00 . A A . 14 TYR CA 1 1 5 3255 1 1 14 TYR CB C 9.399 -1.582 4.516 1.00 . A A . 14 TYR CB 1 1 5 3256 1 1 14 TYR CD1 C 9.619 -3.688 5.988 1.00 . A A . 14 TYR CD1 1 1 5 3257 1 1 14 TYR CD2 C 9.619 -1.514 7.084 1.00 . A A . 14 TYR CD2 1 1 5 3258 1 1 14 TYR CE1 C 9.750 -4.307 7.236 1.00 . A A . 14 TYR CE1 1 1 5 3259 1 1 14 TYR CE2 C 9.751 -2.150 8.325 1.00 . A A . 14 TYR CE2 1 1 5 3260 1 1 14 TYR CG C 9.552 -2.274 5.892 1.00 . A A . 14 TYR CG 1 1 5 3261 1 1 14 TYR CZ C 9.817 -3.542 8.399 1.00 . A A . 14 TYR CZ 1 1 5 3262 1 1 14 TYR H H 8.816 -1.285 2.031 1.00 . A A . 14 TYR H 1 1 5 3263 1 1 14 TYR HA H 7.829 -2.995 4.125 1.00 . A A . 14 TYR HA 1 1 5 3264 1 1 14 TYR HB2 H 10.182 -1.902 3.829 1.00 . A A . 14 TYR HB2 1 1 5 3265 1 1 14 TYR HB3 H 9.456 -0.501 4.626 1.00 . A A . 14 TYR HB3 1 1 5 3266 1 1 14 TYR HD1 H 9.565 -4.302 5.111 1.00 . A A . 14 TYR HD1 1 1 5 3267 1 1 14 TYR HD2 H 9.563 -0.446 7.056 1.00 . A A . 14 TYR HD2 1 1 5 3268 1 1 14 TYR HE1 H 9.800 -5.384 7.298 1.00 . A A . 14 TYR HE1 1 1 5 3269 1 1 14 TYR HE2 H 9.803 -1.560 9.228 1.00 . A A . 14 TYR HE2 1 1 5 3270 1 1 14 TYR HH H 10.785 -3.898 10.006 1.00 . A A . 14 TYR HH 1 1 5 3271 1 1 14 TYR N N 8.049 -1.726 2.454 1.00 . A A . 14 TYR N 1 1 5 3272 1 1 14 TYR O O 6.202 -1.539 5.408 1.00 . A A . 14 TYR O 1 1 5 3273 1 1 14 TYR OH O 9.944 -4.162 9.625 1.00 . A A . 14 TYR OH 1 1 5 3274 1 1 15 GLN C C 4.420 0.523 4.371 1.00 . A A . 15 GLN C 1 1 5 3275 1 1 15 GLN CA C 5.807 1.036 4.761 1.00 . A A . 15 GLN CA 1 1 5 3276 1 1 15 GLN CB C 5.988 2.468 4.247 1.00 . A A . 15 GLN CB 1 1 5 3277 1 1 15 GLN CD C 6.781 4.616 5.255 1.00 . A A . 15 GLN CD 1 1 5 3278 1 1 15 GLN CG C 7.129 3.145 5.011 1.00 . A A . 15 GLN CG 1 1 5 3279 1 1 15 GLN H H 7.462 0.502 3.485 1.00 . A A . 15 GLN H 1 1 5 3280 1 1 15 GLN HA H 5.899 1.026 5.837 1.00 . A A . 15 GLN HA 1 1 5 3281 1 1 15 GLN HB2 H 6.223 2.444 3.194 1.00 . A A . 15 GLN HB2 1 1 5 3282 1 1 15 GLN HB3 H 5.076 3.024 4.401 1.00 . A A . 15 GLN HB3 1 1 5 3283 1 1 15 GLN HE21 H 8.142 4.849 6.683 1.00 . A A . 15 GLN HE21 1 1 5 3284 1 1 15 GLN HE22 H 7.220 6.229 6.325 1.00 . A A . 15 GLN HE22 1 1 5 3285 1 1 15 GLN HG2 H 7.274 2.646 5.958 1.00 . A A . 15 GLN HG2 1 1 5 3286 1 1 15 GLN HG3 H 8.037 3.084 4.430 1.00 . A A . 15 GLN HG3 1 1 5 3287 1 1 15 GLN N N 6.851 0.153 4.168 1.00 . A A . 15 GLN N 1 1 5 3288 1 1 15 GLN NE2 N 7.435 5.287 6.163 1.00 . A A . 15 GLN NE2 1 1 5 3289 1 1 15 GLN O O 3.521 0.467 5.186 1.00 . A A . 15 GLN O 1 1 5 3290 1 1 15 GLN OE1 O 5.905 5.159 4.611 1.00 . A A . 15 GLN OE1 1 1 5 3291 1 1 16 LEU C C 2.568 -1.620 3.524 1.00 . A A . 16 LEU C 1 1 5 3292 1 1 16 LEU CA C 2.897 -0.365 2.720 1.00 . A A . 16 LEU CA 1 1 5 3293 1 1 16 LEU CB C 2.914 -0.696 1.228 1.00 . A A . 16 LEU CB 1 1 5 3294 1 1 16 LEU CD1 C 4.403 1.142 0.432 1.00 . A A . 16 LEU CD1 1 1 5 3295 1 1 16 LEU CD2 C 2.539 0.326 -1.018 1.00 . A A . 16 LEU CD2 1 1 5 3296 1 1 16 LEU CG C 2.972 0.602 0.423 1.00 . A A . 16 LEU CG 1 1 5 3297 1 1 16 LEU H H 4.967 0.191 2.489 1.00 . A A . 16 LEU H 1 1 5 3298 1 1 16 LEU HA H 2.147 0.387 2.918 1.00 . A A . 16 LEU HA 1 1 5 3299 1 1 16 LEU HB2 H 3.781 -1.300 1.002 1.00 . A A . 16 LEU HB2 1 1 5 3300 1 1 16 LEU HB3 H 2.018 -1.239 0.967 1.00 . A A . 16 LEU HB3 1 1 5 3301 1 1 16 LEU HD11 H 4.580 1.710 -0.469 1.00 . A A . 16 LEU HD11 1 1 5 3302 1 1 16 LEU HD12 H 5.098 0.317 0.480 1.00 . A A . 16 LEU HD12 1 1 5 3303 1 1 16 LEU HD13 H 4.541 1.780 1.292 1.00 . A A . 16 LEU HD13 1 1 5 3304 1 1 16 LEU HD21 H 1.825 1.074 -1.328 1.00 . A A . 16 LEU HD21 1 1 5 3305 1 1 16 LEU HD22 H 2.084 -0.652 -1.075 1.00 . A A . 16 LEU HD22 1 1 5 3306 1 1 16 LEU HD23 H 3.402 0.360 -1.666 1.00 . A A . 16 LEU HD23 1 1 5 3307 1 1 16 LEU HG H 2.310 1.331 0.867 1.00 . A A . 16 LEU HG 1 1 5 3308 1 1 16 LEU N N 4.233 0.144 3.137 1.00 . A A . 16 LEU N 1 1 5 3309 1 1 16 LEU O O 1.429 -1.868 3.866 1.00 . A A . 16 LEU O 1 1 5 3310 1 1 17 GLU C C 2.644 -3.203 5.962 1.00 . A A . 17 GLU C 1 1 5 3311 1 1 17 GLU CA C 3.288 -3.626 4.642 1.00 . A A . 17 GLU CA 1 1 5 3312 1 1 17 GLU CB C 4.608 -4.348 4.915 1.00 . A A . 17 GLU CB 1 1 5 3313 1 1 17 GLU CD C 5.848 -6.441 4.342 1.00 . A A . 17 GLU CD 1 1 5 3314 1 1 17 GLU CG C 4.848 -5.402 3.832 1.00 . A A . 17 GLU CG 1 1 5 3315 1 1 17 GLU H H 4.471 -2.190 3.578 1.00 . A A . 17 GLU H 1 1 5 3316 1 1 17 GLU HA H 2.619 -4.278 4.101 1.00 . A A . 17 GLU HA 1 1 5 3317 1 1 17 GLU HB2 H 5.417 -3.632 4.907 1.00 . A A . 17 GLU HB2 1 1 5 3318 1 1 17 GLU HB3 H 4.562 -4.826 5.877 1.00 . A A . 17 GLU HB3 1 1 5 3319 1 1 17 GLU HG2 H 3.914 -5.889 3.591 1.00 . A A . 17 GLU HG2 1 1 5 3320 1 1 17 GLU HG3 H 5.245 -4.926 2.948 1.00 . A A . 17 GLU HG3 1 1 5 3321 1 1 17 GLU N N 3.556 -2.407 3.846 1.00 . A A . 17 GLU N 1 1 5 3322 1 1 17 GLU O O 1.947 -3.965 6.601 1.00 . A A . 17 GLU O 1 1 5 3323 1 1 17 GLU OE1 O 5.827 -6.723 5.529 1.00 . A A . 17 GLU OE1 1 1 5 3324 1 1 17 GLU OE2 O 6.619 -6.937 3.537 1.00 . A A . 17 GLU OE2 1 1 5 3325 1 1 18 ASN C C 0.787 -1.202 7.432 1.00 . A A . 18 ASN C 1 1 5 3326 1 1 18 ASN CA C 2.275 -1.494 7.641 1.00 . A A . 18 ASN CA 1 1 5 3327 1 1 18 ASN CB C 2.985 -0.211 8.078 1.00 . A A . 18 ASN CB 1 1 5 3328 1 1 18 ASN CG C 3.906 -0.509 9.262 1.00 . A A . 18 ASN CG 1 1 5 3329 1 1 18 ASN H H 3.437 -1.384 5.832 1.00 . A A . 18 ASN H 1 1 5 3330 1 1 18 ASN HA H 2.391 -2.248 8.406 1.00 . A A . 18 ASN HA 1 1 5 3331 1 1 18 ASN HB2 H 3.569 0.174 7.255 1.00 . A A . 18 ASN HB2 1 1 5 3332 1 1 18 ASN HB3 H 2.250 0.524 8.371 1.00 . A A . 18 ASN HB3 1 1 5 3333 1 1 18 ASN HD21 H 5.477 -0.911 8.118 1.00 . A A . 18 ASN HD21 1 1 5 3334 1 1 18 ASN HD22 H 5.745 -1.042 9.789 1.00 . A A . 18 ASN HD22 1 1 5 3335 1 1 18 ASN N N 2.872 -1.982 6.368 1.00 . A A . 18 ASN N 1 1 5 3336 1 1 18 ASN ND2 N 5.145 -0.849 9.038 1.00 . A A . 18 ASN ND2 1 1 5 3337 1 1 18 ASN O O 0.010 -1.217 8.366 1.00 . A A . 18 ASN O 1 1 5 3338 1 1 18 ASN OD1 O 3.494 -0.428 10.402 1.00 . A A . 18 ASN OD1 1 1 5 3339 1 1 19 TYR C C -1.860 -1.945 5.972 1.00 . A A . 19 TYR C 1 1 5 3340 1 1 19 TYR CA C -1.064 -0.635 5.981 1.00 . A A . 19 TYR CA 1 1 5 3341 1 1 19 TYR CB C -1.242 0.069 4.630 1.00 . A A . 19 TYR CB 1 1 5 3342 1 1 19 TYR CD1 C 0.600 1.641 5.606 1.00 . A A . 19 TYR CD1 1 1 5 3343 1 1 19 TYR CD2 C 0.028 1.856 3.248 1.00 . A A . 19 TYR CD2 1 1 5 3344 1 1 19 TYR CE1 C 1.545 2.664 5.455 1.00 . A A . 19 TYR CE1 1 1 5 3345 1 1 19 TYR CE2 C 0.977 2.876 3.121 1.00 . A A . 19 TYR CE2 1 1 5 3346 1 1 19 TYR CG C -0.186 1.213 4.492 1.00 . A A . 19 TYR CG 1 1 5 3347 1 1 19 TYR CZ C 1.732 3.278 4.220 1.00 . A A . 19 TYR CZ 1 1 5 3348 1 1 19 TYR H H 1.017 -0.915 5.471 1.00 . A A . 19 TYR H 1 1 5 3349 1 1 19 TYR HA H -1.434 0.004 6.769 1.00 . A A . 19 TYR HA 1 1 5 3350 1 1 19 TYR HB2 H -1.122 -0.680 3.830 1.00 . A A . 19 TYR HB2 1 1 5 3351 1 1 19 TYR HB3 H -2.262 0.475 4.579 1.00 . A A . 19 TYR HB3 1 1 5 3352 1 1 19 TYR HD1 H 0.488 1.197 6.575 1.00 . A A . 19 TYR HD1 1 1 5 3353 1 1 19 TYR HD2 H -0.529 1.577 2.389 1.00 . A A . 19 TYR HD2 1 1 5 3354 1 1 19 TYR HE1 H 2.132 2.977 6.304 1.00 . A A . 19 TYR HE1 1 1 5 3355 1 1 19 TYR HE2 H 1.125 3.354 2.163 1.00 . A A . 19 TYR HE2 1 1 5 3356 1 1 19 TYR HH H 3.176 4.328 4.896 1.00 . A A . 19 TYR HH 1 1 5 3357 1 1 19 TYR N N 0.378 -0.931 6.219 1.00 . A A . 19 TYR N 1 1 5 3358 1 1 19 TYR O O -3.050 -1.955 5.724 1.00 . A A . 19 TYR O 1 1 5 3359 1 1 19 TYR OH O 2.666 4.286 4.084 1.00 . A A . 19 TYR OH 1 1 5 3360 1 1 20 CYS C C -1.763 -5.043 7.590 1.00 . A A . 20 CYS C 1 1 5 3361 1 1 20 CYS CA C -1.937 -4.353 6.235 1.00 . A A . 20 CYS CA 1 1 5 3362 1 1 20 CYS CB C -1.363 -5.245 5.135 1.00 . A A . 20 CYS CB 1 1 5 3363 1 1 20 CYS H H -0.256 -3.023 6.431 1.00 . A A . 20 CYS H 1 1 5 3364 1 1 20 CYS HA H -2.987 -4.183 6.049 1.00 . A A . 20 CYS HA 1 1 5 3365 1 1 20 CYS HB2 H -0.294 -5.101 5.075 1.00 . A A . 20 CYS HB2 1 1 5 3366 1 1 20 CYS HB3 H -1.574 -6.279 5.362 1.00 . A A . 20 CYS HB3 1 1 5 3367 1 1 20 CYS N N -1.215 -3.050 6.236 1.00 . A A . 20 CYS N 1 1 5 3368 1 1 20 CYS O O -1.102 -6.056 7.700 1.00 . A A . 20 CYS O 1 1 5 3369 1 1 20 CYS SG S -2.118 -4.810 3.550 1.00 . A A . 20 CYS SG 1 1 5 3370 1 1 21 ASN C C -2.819 -4.196 11.023 1.00 . A A . 21 ASN C 1 1 5 3371 1 1 21 ASN CA C -2.227 -5.132 9.968 1.00 . A A . 21 ASN CA 1 1 5 3372 1 1 21 ASN CB C -0.749 -5.380 10.279 1.00 . A A . 21 ASN CB 1 1 5 3373 1 1 21 ASN CG C 0.053 -4.111 9.986 1.00 . A A . 21 ASN CG 1 1 5 3374 1 1 21 ASN H H -2.886 -3.689 8.510 1.00 . A A . 21 ASN H 1 1 5 3375 1 1 21 ASN HA H -2.760 -6.071 9.981 1.00 . A A . 21 ASN HA 1 1 5 3376 1 1 21 ASN HB2 H -0.640 -5.642 11.321 1.00 . A A . 21 ASN HB2 1 1 5 3377 1 1 21 ASN HB3 H -0.381 -6.187 9.664 1.00 . A A . 21 ASN HB3 1 1 5 3378 1 1 21 ASN HD21 H 1.810 -4.983 10.294 1.00 . A A . 21 ASN HD21 1 1 5 3379 1 1 21 ASN HD22 H 1.879 -3.341 9.869 1.00 . A A . 21 ASN HD22 1 1 5 3380 1 1 21 ASN N N -2.355 -4.505 8.621 1.00 . A A . 21 ASN N 1 1 5 3381 1 1 21 ASN ND2 N 1.356 -4.148 10.055 1.00 . A A . 21 ASN ND2 1 1 5 3382 1 1 21 ASN O O -2.084 -3.361 11.525 1.00 . A A . 21 ASN O 1 1 5 3383 1 1 21 ASN OXT O -3.997 -4.330 11.312 1.00 . A A . 21 ASN OXT 1 1 5 3384 1 1 21 ASN OD1 O -0.510 -3.077 9.690 1.00 . A A . 21 ASN OD1 1 1 5 3385 2 2 1 PHE C C 7.388 -1.257 -5.519 1.00 . B B . 22 PHE C 1 1 5 3386 2 2 1 PHE CA C 7.460 -2.774 -5.724 1.00 . B B . 22 PHE CA 1 1 5 3387 2 2 1 PHE CB C 8.666 -3.112 -6.607 1.00 . B B . 22 PHE CB 1 1 5 3388 2 2 1 PHE CD1 C 9.877 -3.231 -4.369 1.00 . B B . 22 PHE CD1 1 1 5 3389 2 2 1 PHE CD2 C 11.061 -3.864 -6.393 1.00 . B B . 22 PHE CD2 1 1 5 3390 2 2 1 PHE CE1 C 11.024 -3.510 -3.614 1.00 . B B . 22 PHE CE1 1 1 5 3391 2 2 1 PHE CE2 C 12.206 -4.142 -5.636 1.00 . B B . 22 PHE CE2 1 1 5 3392 2 2 1 PHE CG C 9.893 -3.409 -5.764 1.00 . B B . 22 PHE CG 1 1 5 3393 2 2 1 PHE CZ C 12.187 -3.965 -4.247 1.00 . B B . 22 PHE CZ 1 1 5 3394 2 2 1 PHE H1 H 6.199 -4.274 -6.431 1.00 . B B . 22 PHE H1 1 1 5 3395 2 2 1 PHE H2 H 6.184 -2.856 -7.368 1.00 . B B . 22 PHE H2 1 1 5 3396 2 2 1 PHE H3 H 5.386 -2.896 -5.868 1.00 . B B . 22 PHE H3 1 1 5 3397 2 2 1 PHE HA H 7.552 -3.269 -4.772 1.00 . B B . 22 PHE HA 1 1 5 3398 2 2 1 PHE HB2 H 8.434 -3.978 -7.210 1.00 . B B . 22 PHE HB2 1 1 5 3399 2 2 1 PHE HB3 H 8.876 -2.275 -7.257 1.00 . B B . 22 PHE HB3 1 1 5 3400 2 2 1 PHE HD1 H 8.987 -2.877 -3.875 1.00 . B B . 22 PHE HD1 1 1 5 3401 2 2 1 PHE HD2 H 11.077 -4.001 -7.464 1.00 . B B . 22 PHE HD2 1 1 5 3402 2 2 1 PHE HE1 H 11.012 -3.374 -2.543 1.00 . B B . 22 PHE HE1 1 1 5 3403 2 2 1 PHE HE2 H 13.103 -4.492 -6.124 1.00 . B B . 22 PHE HE2 1 1 5 3404 2 2 1 PHE HZ H 13.071 -4.180 -3.664 1.00 . B B . 22 PHE HZ 1 1 5 3405 2 2 1 PHE N N 6.213 -3.235 -6.398 1.00 . B B . 22 PHE N 1 1 5 3406 2 2 1 PHE O O 6.338 -0.657 -5.639 1.00 . B B . 22 PHE O 1 1 5 3407 2 2 2 VAL C C 8.888 1.511 -6.346 1.00 . B B . 23 VAL C 1 1 5 3408 2 2 2 VAL CA C 8.489 0.844 -5.031 1.00 . B B . 23 VAL CA 1 1 5 3409 2 2 2 VAL CB C 9.470 1.217 -3.903 1.00 . B B . 23 VAL CB 1 1 5 3410 2 2 2 VAL CG1 C 10.889 1.375 -4.444 1.00 . B B . 23 VAL CG1 1 1 5 3411 2 2 2 VAL CG2 C 9.035 2.529 -3.243 1.00 . B B . 23 VAL CG2 1 1 5 3412 2 2 2 VAL H H 9.333 -1.129 -5.145 1.00 . B B . 23 VAL H 1 1 5 3413 2 2 2 VAL HA H 7.498 1.170 -4.763 1.00 . B B . 23 VAL HA 1 1 5 3414 2 2 2 VAL HB H 9.464 0.436 -3.166 1.00 . B B . 23 VAL HB 1 1 5 3415 2 2 2 VAL HG11 H 11.590 0.965 -3.732 1.00 . B B . 23 VAL HG11 1 1 5 3416 2 2 2 VAL HG12 H 11.101 2.422 -4.595 1.00 . B B . 23 VAL HG12 1 1 5 3417 2 2 2 VAL HG13 H 10.977 0.848 -5.381 1.00 . B B . 23 VAL HG13 1 1 5 3418 2 2 2 VAL HG21 H 9.578 3.352 -3.677 1.00 . B B . 23 VAL HG21 1 1 5 3419 2 2 2 VAL HG22 H 9.250 2.484 -2.190 1.00 . B B . 23 VAL HG22 1 1 5 3420 2 2 2 VAL HG23 H 7.976 2.676 -3.391 1.00 . B B . 23 VAL HG23 1 1 5 3421 2 2 2 VAL N N 8.495 -0.631 -5.226 1.00 . B B . 23 VAL N 1 1 5 3422 2 2 2 VAL O O 8.781 0.929 -7.407 1.00 . B B . 23 VAL O 1 1 5 3423 2 2 3 ASN C C 8.468 3.939 -8.232 1.00 . B B . 24 ASN C 1 1 5 3424 2 2 3 ASN CA C 9.728 3.450 -7.518 1.00 . B B . 24 ASN CA 1 1 5 3425 2 2 3 ASN CB C 10.510 2.508 -8.435 1.00 . B B . 24 ASN CB 1 1 5 3426 2 2 3 ASN CG C 11.645 3.279 -9.112 1.00 . B B . 24 ASN CG 1 1 5 3427 2 2 3 ASN H H 9.392 3.165 -5.416 1.00 . B B . 24 ASN H 1 1 5 3428 2 2 3 ASN HA H 10.346 4.296 -7.257 1.00 . B B . 24 ASN HA 1 1 5 3429 2 2 3 ASN HB2 H 10.922 1.698 -7.851 1.00 . B B . 24 ASN HB2 1 1 5 3430 2 2 3 ASN HB3 H 9.849 2.108 -9.190 1.00 . B B . 24 ASN HB3 1 1 5 3431 2 2 3 ASN HD21 H 12.682 1.646 -9.557 1.00 . B B . 24 ASN HD21 1 1 5 3432 2 2 3 ASN HD22 H 13.386 3.109 -10.050 1.00 . B B . 24 ASN HD22 1 1 5 3433 2 2 3 ASN N N 9.330 2.726 -6.280 1.00 . B B . 24 ASN N 1 1 5 3434 2 2 3 ASN ND2 N 12.655 2.624 -9.614 1.00 . B B . 24 ASN ND2 1 1 5 3435 2 2 3 ASN O O 8.427 4.052 -9.440 1.00 . B B . 24 ASN O 1 1 5 3436 2 2 3 ASN OD1 O 11.612 4.492 -9.182 1.00 . B B . 24 ASN OD1 1 1 5 3437 2 2 4 GLN C C 5.388 5.527 -7.077 1.00 . B B . 25 GLN C 1 1 5 3438 2 2 4 GLN CA C 6.173 4.711 -8.107 1.00 . B B . 25 GLN CA 1 1 5 3439 2 2 4 GLN CB C 5.334 3.510 -8.552 1.00 . B B . 25 GLN CB 1 1 5 3440 2 2 4 GLN CD C 5.351 2.634 -10.892 1.00 . B B . 25 GLN CD 1 1 5 3441 2 2 4 GLN CG C 4.823 3.741 -9.976 1.00 . B B . 25 GLN CG 1 1 5 3442 2 2 4 GLN H H 7.495 4.128 -6.513 1.00 . B B . 25 GLN H 1 1 5 3443 2 2 4 GLN HA H 6.402 5.330 -8.961 1.00 . B B . 25 GLN HA 1 1 5 3444 2 2 4 GLN HB2 H 5.942 2.618 -8.528 1.00 . B B . 25 GLN HB2 1 1 5 3445 2 2 4 GLN HB3 H 4.493 3.392 -7.885 1.00 . B B . 25 GLN HB3 1 1 5 3446 2 2 4 GLN HE21 H 3.635 1.634 -10.912 1.00 . B B . 25 GLN HE21 1 1 5 3447 2 2 4 GLN HE22 H 4.889 0.943 -11.824 1.00 . B B . 25 GLN HE22 1 1 5 3448 2 2 4 GLN HG2 H 3.742 3.725 -9.977 1.00 . B B . 25 GLN HG2 1 1 5 3449 2 2 4 GLN HG3 H 5.170 4.698 -10.333 1.00 . B B . 25 GLN HG3 1 1 5 3450 2 2 4 GLN N N 7.437 4.228 -7.486 1.00 . B B . 25 GLN N 1 1 5 3451 2 2 4 GLN NE2 N 4.559 1.656 -11.238 1.00 . B B . 25 GLN NE2 1 1 5 3452 2 2 4 GLN O O 5.636 5.448 -5.890 1.00 . B B . 25 GLN O 1 1 5 3453 2 2 4 GLN OE1 O 6.496 2.660 -11.295 1.00 . B B . 25 GLN OE1 1 1 5 3454 2 2 5 HIS C C 2.222 6.568 -6.528 1.00 . B B . 26 HIS C 1 1 5 3455 2 2 5 HIS CA C 3.648 7.130 -6.560 1.00 . B B . 26 HIS CA 1 1 5 3456 2 2 5 HIS CB C 3.628 8.581 -7.040 1.00 . B B . 26 HIS CB 1 1 5 3457 2 2 5 HIS CD2 C 3.321 10.690 -5.522 1.00 . B B . 26 HIS CD2 1 1 5 3458 2 2 5 HIS CE1 C 4.854 10.202 -4.061 1.00 . B B . 26 HIS CE1 1 1 5 3459 2 2 5 HIS CG C 3.877 9.492 -5.873 1.00 . B B . 26 HIS CG 1 1 5 3460 2 2 5 HIS H H 4.257 6.364 -8.479 1.00 . B B . 26 HIS H 1 1 5 3461 2 2 5 HIS HA H 4.087 7.073 -5.574 1.00 . B B . 26 HIS HA 1 1 5 3462 2 2 5 HIS HB2 H 4.399 8.726 -7.782 1.00 . B B . 26 HIS HB2 1 1 5 3463 2 2 5 HIS HB3 H 2.663 8.806 -7.470 1.00 . B B . 26 HIS HB3 1 1 5 3464 2 2 5 HIS HD2 H 2.531 11.199 -6.056 1.00 . B B . 26 HIS HD2 1 1 5 3465 2 2 5 HIS HE1 H 5.520 10.259 -3.214 1.00 . B B . 26 HIS HE1 1 1 5 3466 2 2 5 HIS HE2 H 3.751 11.972 -3.888 1.00 . B B . 26 HIS HE2 1 1 5 3467 2 2 5 HIS N N 4.443 6.312 -7.519 1.00 . B B . 26 HIS N 1 1 5 3468 2 2 5 HIS ND1 N 4.844 9.194 -4.939 1.00 . B B . 26 HIS ND1 1 1 5 3469 2 2 5 HIS NE2 N 3.938 11.142 -4.374 1.00 . B B . 26 HIS NE2 1 1 5 3470 2 2 5 HIS O O 1.922 5.612 -7.215 1.00 . B B . 26 HIS O 1 1 5 3471 2 2 6 LEU C C -1.076 7.569 -5.178 1.00 . B B . 27 LEU C 1 1 5 3472 2 2 6 LEU CA C -0.054 6.563 -5.726 1.00 . B B . 27 LEU CA 1 1 5 3473 2 2 6 LEU CB C -0.089 5.291 -4.870 1.00 . B B . 27 LEU CB 1 1 5 3474 2 2 6 LEU CD1 C 1.130 6.537 -3.080 1.00 . B B . 27 LEU CD1 1 1 5 3475 2 2 6 LEU CD2 C 0.962 4.046 -2.994 1.00 . B B . 27 LEU CD2 1 1 5 3476 2 2 6 LEU CG C 1.103 5.256 -3.915 1.00 . B B . 27 LEU CG 1 1 5 3477 2 2 6 LEU H H 1.567 7.898 -5.188 1.00 . B B . 27 LEU H 1 1 5 3478 2 2 6 LEU HA H -0.334 6.304 -6.736 1.00 . B B . 27 LEU HA 1 1 5 3479 2 2 6 LEU HB2 H -1.002 5.270 -4.295 1.00 . B B . 27 LEU HB2 1 1 5 3480 2 2 6 LEU HB3 H -0.053 4.425 -5.515 1.00 . B B . 27 LEU HB3 1 1 5 3481 2 2 6 LEU HD11 H 1.246 6.284 -2.037 1.00 . B B . 27 LEU HD11 1 1 5 3482 2 2 6 LEU HD12 H 0.205 7.076 -3.220 1.00 . B B . 27 LEU HD12 1 1 5 3483 2 2 6 LEU HD13 H 1.957 7.154 -3.396 1.00 . B B . 27 LEU HD13 1 1 5 3484 2 2 6 LEU HD21 H 1.856 3.445 -3.049 1.00 . B B . 27 LEU HD21 1 1 5 3485 2 2 6 LEU HD22 H 0.111 3.457 -3.306 1.00 . B B . 27 LEU HD22 1 1 5 3486 2 2 6 LEU HD23 H 0.814 4.382 -1.979 1.00 . B B . 27 LEU HD23 1 1 5 3487 2 2 6 LEU HG H 2.019 5.175 -4.483 1.00 . B B . 27 LEU HG 1 1 5 3488 2 2 6 LEU N N 1.331 7.128 -5.748 1.00 . B B . 27 LEU N 1 1 5 3489 2 2 6 LEU O O -0.806 8.737 -5.035 1.00 . B B . 27 LEU O 1 1 5 3490 2 2 7 CYS C C -4.707 7.249 -4.846 1.00 . B B . 28 CYS C 1 1 5 3491 2 2 7 CYS CA C -3.404 7.898 -4.387 1.00 . B B . 28 CYS CA 1 1 5 3492 2 2 7 CYS CB C -3.362 9.355 -4.872 1.00 . B B . 28 CYS CB 1 1 5 3493 2 2 7 CYS H H -2.413 6.124 -5.060 1.00 . B B . 28 CYS H 1 1 5 3494 2 2 7 CYS HA H -3.372 7.890 -3.304 1.00 . B B . 28 CYS HA 1 1 5 3495 2 2 7 CYS HB2 H -2.617 9.464 -5.644 1.00 . B B . 28 CYS HB2 1 1 5 3496 2 2 7 CYS HB3 H -4.330 9.627 -5.269 1.00 . B B . 28 CYS HB3 1 1 5 3497 2 2 7 CYS N N -2.260 7.078 -4.904 1.00 . B B . 28 CYS N 1 1 5 3498 2 2 7 CYS O O -4.773 6.648 -5.900 1.00 . B B . 28 CYS O 1 1 5 3499 2 2 7 CYS SG S -2.961 10.441 -3.473 1.00 . B B . 28 CYS SG 1 1 5 3500 2 2 8 GLY C C -6.785 5.281 -4.903 1.00 . B B . 29 GLY C 1 1 5 3501 2 2 8 GLY CA C -7.034 6.726 -4.462 1.00 . B B . 29 GLY CA 1 1 5 3502 2 2 8 GLY H H -5.672 7.830 -3.211 1.00 . B B . 29 GLY H 1 1 5 3503 2 2 8 GLY HA2 H -7.713 6.735 -3.621 1.00 . B B . 29 GLY HA2 1 1 5 3504 2 2 8 GLY HA3 H -7.465 7.279 -5.282 1.00 . B B . 29 GLY HA3 1 1 5 3505 2 2 8 GLY N N -5.743 7.351 -4.063 1.00 . B B . 29 GLY N 1 1 5 3506 2 2 8 GLY O O -6.378 4.445 -4.121 1.00 . B B . 29 GLY O 1 1 5 3507 2 2 9 SER C C -5.330 3.222 -6.537 1.00 . B B . 30 SER C 1 1 5 3508 2 2 9 SER CA C -6.813 3.589 -6.637 1.00 . B B . 30 SER CA 1 1 5 3509 2 2 9 SER CB C -7.259 3.484 -8.094 1.00 . B B . 30 SER CB 1 1 5 3510 2 2 9 SER H H -7.359 5.670 -6.763 1.00 . B B . 30 SER H 1 1 5 3511 2 2 9 SER HA H -7.392 2.904 -6.036 1.00 . B B . 30 SER HA 1 1 5 3512 2 2 9 SER HB2 H -6.712 4.194 -8.691 1.00 . B B . 30 SER HB2 1 1 5 3513 2 2 9 SER HB3 H -7.062 2.484 -8.458 1.00 . B B . 30 SER HB3 1 1 5 3514 2 2 9 SER HG H -8.985 3.359 -8.985 1.00 . B B . 30 SER HG 1 1 5 3515 2 2 9 SER N N -7.029 4.981 -6.149 1.00 . B B . 30 SER N 1 1 5 3516 2 2 9 SER O O -4.966 2.256 -5.897 1.00 . B B . 30 SER O 1 1 5 3517 2 2 9 SER OG O -8.649 3.769 -8.184 1.00 . B B . 30 SER OG 1 1 5 3518 2 2 10 ASP C C -2.632 3.298 -5.676 1.00 . B B . 31 ASP C 1 1 5 3519 2 2 10 ASP CA C -3.016 3.655 -7.111 1.00 . B B . 31 ASP CA 1 1 5 3520 2 2 10 ASP CB C -2.192 4.860 -7.569 1.00 . B B . 31 ASP CB 1 1 5 3521 2 2 10 ASP CG C -2.773 5.415 -8.869 1.00 . B B . 31 ASP CG 1 1 5 3522 2 2 10 ASP H H -4.784 4.750 -7.687 1.00 . B B . 31 ASP H 1 1 5 3523 2 2 10 ASP HA H -2.811 2.814 -7.756 1.00 . B B . 31 ASP HA 1 1 5 3524 2 2 10 ASP HB2 H -2.217 5.623 -6.807 1.00 . B B . 31 ASP HB2 1 1 5 3525 2 2 10 ASP HB3 H -1.170 4.553 -7.734 1.00 . B B . 31 ASP HB3 1 1 5 3526 2 2 10 ASP N N -4.472 3.977 -7.170 1.00 . B B . 31 ASP N 1 1 5 3527 2 2 10 ASP O O -1.808 2.436 -5.443 1.00 . B B . 31 ASP O 1 1 5 3528 2 2 10 ASP OD1 O -2.449 4.879 -9.916 1.00 . B B . 31 ASP OD1 1 1 5 3529 2 2 10 ASP OD2 O -3.532 6.368 -8.797 1.00 . B B . 31 ASP OD2 1 1 5 3530 2 2 11 LEU C C -3.380 2.232 -2.959 1.00 . B B . 32 LEU C 1 1 5 3531 2 2 11 LEU CA C -2.880 3.635 -3.297 1.00 . B B . 32 LEU CA 1 1 5 3532 2 2 11 LEU CB C -3.543 4.652 -2.368 1.00 . B B . 32 LEU CB 1 1 5 3533 2 2 11 LEU CD1 C -2.232 6.664 -1.681 1.00 . B B . 32 LEU CD1 1 1 5 3534 2 2 11 LEU CD2 C -3.037 5.048 0.045 1.00 . B B . 32 LEU CD2 1 1 5 3535 2 2 11 LEU CG C -2.505 5.189 -1.382 1.00 . B B . 32 LEU CG 1 1 5 3536 2 2 11 LEU H H -3.886 4.640 -4.915 1.00 . B B . 32 LEU H 1 1 5 3537 2 2 11 LEU HA H -1.808 3.675 -3.168 1.00 . B B . 32 LEU HA 1 1 5 3538 2 2 11 LEU HB2 H -3.942 5.468 -2.953 1.00 . B B . 32 LEU HB2 1 1 5 3539 2 2 11 LEU HB3 H -4.342 4.175 -1.821 1.00 . B B . 32 LEU HB3 1 1 5 3540 2 2 11 LEU HD11 H -1.481 7.038 -1.001 1.00 . B B . 32 LEU HD11 1 1 5 3541 2 2 11 LEU HD12 H -3.143 7.231 -1.559 1.00 . B B . 32 LEU HD12 1 1 5 3542 2 2 11 LEU HD13 H -1.879 6.765 -2.697 1.00 . B B . 32 LEU HD13 1 1 5 3543 2 2 11 LEU HD21 H -4.112 4.943 0.020 1.00 . B B . 32 LEU HD21 1 1 5 3544 2 2 11 LEU HD22 H -2.774 5.926 0.616 1.00 . B B . 32 LEU HD22 1 1 5 3545 2 2 11 LEU HD23 H -2.601 4.175 0.507 1.00 . B B . 32 LEU HD23 1 1 5 3546 2 2 11 LEU HG H -1.588 4.626 -1.483 1.00 . B B . 32 LEU HG 1 1 5 3547 2 2 11 LEU N N -3.221 3.949 -4.711 1.00 . B B . 32 LEU N 1 1 5 3548 2 2 11 LEU O O -2.615 1.290 -2.912 1.00 . B B . 32 LEU O 1 1 5 3549 2 2 12 VAL C C -4.574 -0.285 -3.365 1.00 . B B . 33 VAL C 1 1 5 3550 2 2 12 VAL CA C -5.194 0.730 -2.408 1.00 . B B . 33 VAL CA 1 1 5 3551 2 2 12 VAL CB C -6.718 0.726 -2.564 1.00 . B B . 33 VAL CB 1 1 5 3552 2 2 12 VAL CG1 C -7.303 1.966 -1.887 1.00 . B B . 33 VAL CG1 1 1 5 3553 2 2 12 VAL CG2 C -7.085 0.742 -4.051 1.00 . B B . 33 VAL CG2 1 1 5 3554 2 2 12 VAL H H -5.261 2.851 -2.785 1.00 . B B . 33 VAL H 1 1 5 3555 2 2 12 VAL HA H -4.930 0.473 -1.391 1.00 . B B . 33 VAL HA 1 1 5 3556 2 2 12 VAL HB H -7.125 -0.161 -2.100 1.00 . B B . 33 VAL HB 1 1 5 3557 2 2 12 VAL HG11 H -7.256 2.803 -2.568 1.00 . B B . 33 VAL HG11 1 1 5 3558 2 2 12 VAL HG12 H -6.735 2.193 -0.998 1.00 . B B . 33 VAL HG12 1 1 5 3559 2 2 12 VAL HG13 H -8.333 1.778 -1.619 1.00 . B B . 33 VAL HG13 1 1 5 3560 2 2 12 VAL HG21 H -6.261 1.144 -4.621 1.00 . B B . 33 VAL HG21 1 1 5 3561 2 2 12 VAL HG22 H -7.960 1.357 -4.200 1.00 . B B . 33 VAL HG22 1 1 5 3562 2 2 12 VAL HG23 H -7.293 -0.265 -4.381 1.00 . B B . 33 VAL HG23 1 1 5 3563 2 2 12 VAL N N -4.658 2.081 -2.733 1.00 . B B . 33 VAL N 1 1 5 3564 2 2 12 VAL O O -4.389 -1.439 -3.033 1.00 . B B . 33 VAL O 1 1 5 3565 2 2 13 GLU C C -2.242 -1.193 -4.993 1.00 . B B . 34 GLU C 1 1 5 3566 2 2 13 GLU CA C -3.610 -0.779 -5.525 1.00 . B B . 34 GLU CA 1 1 5 3567 2 2 13 GLU CB C -3.443 -0.063 -6.865 1.00 . B B . 34 GLU CB 1 1 5 3568 2 2 13 GLU CD C -4.280 0.070 -9.215 1.00 . B B . 34 GLU CD 1 1 5 3569 2 2 13 GLU CG C -4.568 -0.477 -7.815 1.00 . B B . 34 GLU CG 1 1 5 3570 2 2 13 GLU H H -4.382 1.084 -4.789 1.00 . B B . 34 GLU H 1 1 5 3571 2 2 13 GLU HA H -4.232 -1.653 -5.651 1.00 . B B . 34 GLU HA 1 1 5 3572 2 2 13 GLU HB2 H -3.479 1.006 -6.708 1.00 . B B . 34 GLU HB2 1 1 5 3573 2 2 13 GLU HB3 H -2.493 -0.330 -7.298 1.00 . B B . 34 GLU HB3 1 1 5 3574 2 2 13 GLU HG2 H -4.629 -1.555 -7.853 1.00 . B B . 34 GLU HG2 1 1 5 3575 2 2 13 GLU HG3 H -5.505 -0.074 -7.460 1.00 . B B . 34 GLU HG3 1 1 5 3576 2 2 13 GLU N N -4.236 0.146 -4.548 1.00 . B B . 34 GLU N 1 1 5 3577 2 2 13 GLU O O -1.952 -2.361 -4.836 1.00 . B B . 34 GLU O 1 1 5 3578 2 2 13 GLU OE1 O -3.118 0.114 -9.584 1.00 . B B . 34 GLU OE1 1 1 5 3579 2 2 13 GLU OE2 O -5.226 0.435 -9.892 1.00 . B B . 34 GLU OE2 1 1 5 3580 2 2 14 ALA C C -0.222 -1.452 -2.926 1.00 . B B . 35 ALA C 1 1 5 3581 2 2 14 ALA CA C -0.054 -0.576 -4.167 1.00 . B B . 35 ALA CA 1 1 5 3582 2 2 14 ALA CB C 0.688 0.709 -3.794 1.00 . B B . 35 ALA CB 1 1 5 3583 2 2 14 ALA H H -1.659 0.699 -4.826 1.00 . B B . 35 ALA H 1 1 5 3584 2 2 14 ALA HA H 0.505 -1.115 -4.919 1.00 . B B . 35 ALA HA 1 1 5 3585 2 2 14 ALA HB1 H 0.415 1.496 -4.481 1.00 . B B . 35 ALA HB1 1 1 5 3586 2 2 14 ALA HB2 H 1.753 0.538 -3.847 1.00 . B B . 35 ALA HB2 1 1 5 3587 2 2 14 ALA HB3 H 0.420 1.000 -2.789 1.00 . B B . 35 ALA HB3 1 1 5 3588 2 2 14 ALA N N -1.400 -0.239 -4.701 1.00 . B B . 35 ALA N 1 1 5 3589 2 2 14 ALA O O 0.310 -2.542 -2.845 1.00 . B B . 35 ALA O 1 1 5 3590 2 2 15 LEU C C -1.792 -3.145 -1.135 1.00 . B B . 36 LEU C 1 1 5 3591 2 2 15 LEU CA C -1.173 -1.807 -0.732 1.00 . B B . 36 LEU CA 1 1 5 3592 2 2 15 LEU CB C -2.118 -1.076 0.231 1.00 . B B . 36 LEU CB 1 1 5 3593 2 2 15 LEU CD1 C -0.049 0.359 0.479 1.00 . B B . 36 LEU CD1 1 1 5 3594 2 2 15 LEU CD2 C -2.165 1.348 -0.404 1.00 . B B . 36 LEU CD2 1 1 5 3595 2 2 15 LEU CG C -1.579 0.326 0.570 1.00 . B B . 36 LEU CG 1 1 5 3596 2 2 15 LEU H H -1.395 -0.113 -2.043 1.00 . B B . 36 LEU H 1 1 5 3597 2 2 15 LEU HA H -0.223 -1.977 -0.246 1.00 . B B . 36 LEU HA 1 1 5 3598 2 2 15 LEU HB2 H -3.091 -0.982 -0.228 1.00 . B B . 36 LEU HB2 1 1 5 3599 2 2 15 LEU HB3 H -2.209 -1.651 1.141 1.00 . B B . 36 LEU HB3 1 1 5 3600 2 2 15 LEU HD11 H 0.368 -0.363 1.165 1.00 . B B . 36 LEU HD11 1 1 5 3601 2 2 15 LEU HD12 H 0.305 1.346 0.735 1.00 . B B . 36 LEU HD12 1 1 5 3602 2 2 15 LEU HD13 H 0.258 0.118 -0.528 1.00 . B B . 36 LEU HD13 1 1 5 3603 2 2 15 LEU HD21 H -1.430 1.588 -1.158 1.00 . B B . 36 LEU HD21 1 1 5 3604 2 2 15 LEU HD22 H -2.435 2.245 0.134 1.00 . B B . 36 LEU HD22 1 1 5 3605 2 2 15 LEU HD23 H -3.043 0.933 -0.877 1.00 . B B . 36 LEU HD23 1 1 5 3606 2 2 15 LEU HG H -1.877 0.584 1.575 1.00 . B B . 36 LEU HG 1 1 5 3607 2 2 15 LEU N N -0.967 -0.990 -1.958 1.00 . B B . 36 LEU N 1 1 5 3608 2 2 15 LEU O O -1.755 -4.110 -0.398 1.00 . B B . 36 LEU O 1 1 5 3609 2 2 16 TYR C C -1.906 -5.341 -3.440 1.00 . B B . 37 TYR C 1 1 5 3610 2 2 16 TYR CA C -2.981 -4.474 -2.782 1.00 . B B . 37 TYR CA 1 1 5 3611 2 2 16 TYR CB C -4.082 -4.152 -3.799 1.00 . B B . 37 TYR CB 1 1 5 3612 2 2 16 TYR CD1 C -4.098 -6.300 -5.232 1.00 . B B . 37 TYR CD1 1 1 5 3613 2 2 16 TYR CD2 C -6.003 -5.873 -3.778 1.00 . B B . 37 TYR CD2 1 1 5 3614 2 2 16 TYR CE1 C -4.704 -7.488 -5.663 1.00 . B B . 37 TYR CE1 1 1 5 3615 2 2 16 TYR CE2 C -6.594 -7.065 -4.218 1.00 . B B . 37 TYR CE2 1 1 5 3616 2 2 16 TYR CG C -4.742 -5.469 -4.280 1.00 . B B . 37 TYR CG 1 1 5 3617 2 2 16 TYR CZ C -5.947 -7.868 -5.159 1.00 . B B . 37 TYR CZ 1 1 5 3618 2 2 16 TYR H H -2.370 -2.412 -2.887 1.00 . B B . 37 TYR H 1 1 5 3619 2 2 16 TYR HA H -3.407 -5.000 -1.941 1.00 . B B . 37 TYR HA 1 1 5 3620 2 2 16 TYR HB2 H -4.818 -3.501 -3.324 1.00 . B B . 37 TYR HB2 1 1 5 3621 2 2 16 TYR HB3 H -3.644 -3.618 -4.639 1.00 . B B . 37 TYR HB3 1 1 5 3622 2 2 16 TYR HD1 H -3.139 -6.037 -5.632 1.00 . B B . 37 TYR HD1 1 1 5 3623 2 2 16 TYR HD2 H -6.518 -5.281 -3.050 1.00 . B B . 37 TYR HD2 1 1 5 3624 2 2 16 TYR HE1 H -4.205 -8.113 -6.389 1.00 . B B . 37 TYR HE1 1 1 5 3625 2 2 16 TYR HE2 H -7.557 -7.362 -3.830 1.00 . B B . 37 TYR HE2 1 1 5 3626 2 2 16 TYR HH H -6.116 -9.770 -5.130 1.00 . B B . 37 TYR HH 1 1 5 3627 2 2 16 TYR N N -2.358 -3.205 -2.311 1.00 . B B . 37 TYR N 1 1 5 3628 2 2 16 TYR O O -2.092 -6.522 -3.658 1.00 . B B . 37 TYR O 1 1 5 3629 2 2 16 TYR OH O -6.538 -9.039 -5.587 1.00 . B B . 37 TYR OH 1 1 5 3630 2 2 17 LEU C C 1.193 -6.160 -3.277 1.00 . B B . 38 LEU C 1 1 5 3631 2 2 17 LEU CA C 0.320 -5.559 -4.378 1.00 . B B . 38 LEU CA 1 1 5 3632 2 2 17 LEU CB C 1.191 -4.663 -5.270 1.00 . B B . 38 LEU CB 1 1 5 3633 2 2 17 LEU CD1 C 1.276 -2.573 -6.633 1.00 . B B . 38 LEU CD1 1 1 5 3634 2 2 17 LEU CD2 C -0.824 -3.914 -6.544 1.00 . B B . 38 LEU CD2 1 1 5 3635 2 2 17 LEU CG C 0.393 -3.451 -5.745 1.00 . B B . 38 LEU CG 1 1 5 3636 2 2 17 LEU H H -0.641 -3.818 -3.547 1.00 . B B . 38 LEU H 1 1 5 3637 2 2 17 LEU HA H -0.109 -6.349 -4.972 1.00 . B B . 38 LEU HA 1 1 5 3638 2 2 17 LEU HB2 H 2.049 -4.327 -4.707 1.00 . B B . 38 LEU HB2 1 1 5 3639 2 2 17 LEU HB3 H 1.524 -5.228 -6.127 1.00 . B B . 38 LEU HB3 1 1 5 3640 2 2 17 LEU HD11 H 1.943 -3.199 -7.207 1.00 . B B . 38 LEU HD11 1 1 5 3641 2 2 17 LEU HD12 H 1.855 -1.902 -6.015 1.00 . B B . 38 LEU HD12 1 1 5 3642 2 2 17 LEU HD13 H 0.655 -1.999 -7.304 1.00 . B B . 38 LEU HD13 1 1 5 3643 2 2 17 LEU HD21 H -1.487 -4.469 -5.898 1.00 . B B . 38 LEU HD21 1 1 5 3644 2 2 17 LEU HD22 H -0.500 -4.544 -7.358 1.00 . B B . 38 LEU HD22 1 1 5 3645 2 2 17 LEU HD23 H -1.343 -3.052 -6.937 1.00 . B B . 38 LEU HD23 1 1 5 3646 2 2 17 LEU HG H 0.069 -2.884 -4.892 1.00 . B B . 38 LEU HG 1 1 5 3647 2 2 17 LEU N N -0.774 -4.765 -3.745 1.00 . B B . 38 LEU N 1 1 5 3648 2 2 17 LEU O O 1.597 -7.304 -3.342 1.00 . B B . 38 LEU O 1 1 5 3649 2 2 18 VAL C C 1.498 -6.840 -0.273 1.00 . B B . 39 VAL C 1 1 5 3650 2 2 18 VAL CA C 2.332 -5.904 -1.153 1.00 . B B . 39 VAL CA 1 1 5 3651 2 2 18 VAL CB C 2.843 -4.719 -0.324 1.00 . B B . 39 VAL CB 1 1 5 3652 2 2 18 VAL CG1 C 3.254 -3.584 -1.265 1.00 . B B . 39 VAL CG1 1 1 5 3653 2 2 18 VAL CG2 C 1.735 -4.217 0.607 1.00 . B B . 39 VAL CG2 1 1 5 3654 2 2 18 VAL H H 1.147 -4.471 -2.236 1.00 . B B . 39 VAL H 1 1 5 3655 2 2 18 VAL HA H 3.171 -6.446 -1.562 1.00 . B B . 39 VAL HA 1 1 5 3656 2 2 18 VAL HB H 3.697 -5.030 0.261 1.00 . B B . 39 VAL HB 1 1 5 3657 2 2 18 VAL HG11 H 4.168 -3.134 -0.912 1.00 . B B . 39 VAL HG11 1 1 5 3658 2 2 18 VAL HG12 H 2.475 -2.838 -1.291 1.00 . B B . 39 VAL HG12 1 1 5 3659 2 2 18 VAL HG13 H 3.408 -3.978 -2.259 1.00 . B B . 39 VAL HG13 1 1 5 3660 2 2 18 VAL HG21 H 0.822 -4.093 0.044 1.00 . B B . 39 VAL HG21 1 1 5 3661 2 2 18 VAL HG22 H 2.025 -3.269 1.035 1.00 . B B . 39 VAL HG22 1 1 5 3662 2 2 18 VAL HG23 H 1.576 -4.936 1.397 1.00 . B B . 39 VAL HG23 1 1 5 3663 2 2 18 VAL N N 1.485 -5.391 -2.265 1.00 . B B . 39 VAL N 1 1 5 3664 2 2 18 VAL O O 2.024 -7.659 0.455 1.00 . B B . 39 VAL O 1 1 5 3665 2 2 19 CYS C C -1.432 -8.573 -0.405 1.00 . B B . 40 CYS C 1 1 5 3666 2 2 19 CYS CA C -0.672 -7.596 0.495 1.00 . B B . 40 CYS CA 1 1 5 3667 2 2 19 CYS CB C -1.672 -6.727 1.258 1.00 . B B . 40 CYS CB 1 1 5 3668 2 2 19 CYS H H -0.202 -6.053 -0.926 1.00 . B B . 40 CYS H 1 1 5 3669 2 2 19 CYS HA H -0.066 -8.150 1.198 1.00 . B B . 40 CYS HA 1 1 5 3670 2 2 19 CYS HB2 H -2.349 -6.259 0.559 1.00 . B B . 40 CYS HB2 1 1 5 3671 2 2 19 CYS HB3 H -2.231 -7.341 1.943 1.00 . B B . 40 CYS HB3 1 1 5 3672 2 2 19 CYS N N 0.200 -6.722 -0.335 1.00 . B B . 40 CYS N 1 1 5 3673 2 2 19 CYS O O -2.287 -9.309 0.045 1.00 . B B . 40 CYS O 1 1 5 3674 2 2 19 CYS SG S -0.782 -5.449 2.178 1.00 . B B . 40 CYS SG 1 1 5 3675 2 2 20 GLY C C -1.315 -10.936 -2.398 1.00 . B B . 41 GLY C 1 1 5 3676 2 2 20 GLY CA C -1.840 -9.514 -2.599 1.00 . B B . 41 GLY CA 1 1 5 3677 2 2 20 GLY H H -0.439 -7.983 -2.021 1.00 . B B . 41 GLY H 1 1 5 3678 2 2 20 GLY HA2 H -2.899 -9.488 -2.391 1.00 . B B . 41 GLY HA2 1 1 5 3679 2 2 20 GLY HA3 H -1.665 -9.210 -3.620 1.00 . B B . 41 GLY HA3 1 1 5 3680 2 2 20 GLY N N -1.130 -8.585 -1.675 1.00 . B B . 41 GLY N 1 1 5 3681 2 2 20 GLY O O -1.890 -11.894 -2.876 1.00 . B B . 41 GLY O 1 1 5 3682 2 2 21 GLU C C -0.399 -13.109 -0.304 1.00 . B B . 42 GLU C 1 1 5 3683 2 2 21 GLU CA C 0.335 -12.440 -1.464 1.00 . B B . 42 GLU CA 1 1 5 3684 2 2 21 GLU CB C 1.823 -12.323 -1.131 1.00 . B B . 42 GLU CB 1 1 5 3685 2 2 21 GLU CD C 3.453 -13.800 -2.314 1.00 . B B . 42 GLU CD 1 1 5 3686 2 2 21 GLU CG C 2.463 -13.712 -1.151 1.00 . B B . 42 GLU CG 1 1 5 3687 2 2 21 GLU H H 0.222 -10.295 -1.318 1.00 . B B . 42 GLU H 1 1 5 3688 2 2 21 GLU HA H 0.213 -13.034 -2.349 1.00 . B B . 42 GLU HA 1 1 5 3689 2 2 21 GLU HB2 H 2.305 -11.694 -1.864 1.00 . B B . 42 GLU HB2 1 1 5 3690 2 2 21 GLU HB3 H 1.941 -11.889 -0.150 1.00 . B B . 42 GLU HB3 1 1 5 3691 2 2 21 GLU HG2 H 2.983 -13.882 -0.219 1.00 . B B . 42 GLU HG2 1 1 5 3692 2 2 21 GLU HG3 H 1.695 -14.461 -1.277 1.00 . B B . 42 GLU HG3 1 1 5 3693 2 2 21 GLU N N -0.227 -11.081 -1.694 1.00 . B B . 42 GLU N 1 1 5 3694 2 2 21 GLU O O -1.176 -14.024 -0.487 1.00 . B B . 42 GLU O 1 1 5 3695 2 2 21 GLU OE1 O 3.396 -12.943 -3.181 1.00 . B B . 42 GLU OE1 1 1 5 3696 2 2 21 GLU OE2 O 4.251 -14.723 -2.318 1.00 . B B . 42 GLU OE2 1 1 5 3697 2 2 22 ARG C C -2.295 -12.821 2.105 1.00 . B B . 43 ARG C 1 1 5 3698 2 2 22 ARG CA C -0.829 -13.257 2.073 1.00 . B B . 43 ARG CA 1 1 5 3699 2 2 22 ARG CB C -0.130 -12.783 3.349 1.00 . B B . 43 ARG CB 1 1 5 3700 2 2 22 ARG CD C 0.155 -10.828 4.880 1.00 . B B . 43 ARG CD 1 1 5 3701 2 2 22 ARG CG C -0.293 -11.268 3.485 1.00 . B B . 43 ARG CG 1 1 5 3702 2 2 22 ARG CZ C 1.997 -9.470 4.089 1.00 . B B . 43 ARG CZ 1 1 5 3703 2 2 22 ARG H H 0.478 -11.920 1.002 1.00 . B B . 43 ARG H 1 1 5 3704 2 2 22 ARG HA H -0.774 -14.334 2.012 1.00 . B B . 43 ARG HA 1 1 5 3705 2 2 22 ARG HB2 H -0.572 -13.273 4.204 1.00 . B B . 43 ARG HB2 1 1 5 3706 2 2 22 ARG HB3 H 0.920 -13.027 3.296 1.00 . B B . 43 ARG HB3 1 1 5 3707 2 2 22 ARG HD2 H -0.428 -9.975 5.193 1.00 . B B . 43 ARG HD2 1 1 5 3708 2 2 22 ARG HD3 H 0.009 -11.640 5.577 1.00 . B B . 43 ARG HD3 1 1 5 3709 2 2 22 ARG HE H 2.246 -10.953 5.386 1.00 . B B . 43 ARG HE 1 1 5 3710 2 2 22 ARG HG2 H 0.311 -10.772 2.739 1.00 . B B . 43 ARG HG2 1 1 5 3711 2 2 22 ARG HG3 H -1.330 -11.003 3.343 1.00 . B B . 43 ARG HG3 1 1 5 3712 2 2 22 ARG HH11 H 1.222 -8.052 5.270 1.00 . B B . 43 ARG HH11 1 1 5 3713 2 2 22 ARG HH12 H 2.037 -7.483 3.851 1.00 . B B . 43 ARG HH12 1 1 5 3714 2 2 22 ARG HH21 H 2.867 -10.657 2.732 1.00 . B B . 43 ARG HH21 1 1 5 3715 2 2 22 ARG HH22 H 2.968 -8.957 2.416 1.00 . B B . 43 ARG HH22 1 1 5 3716 2 2 22 ARG N N -0.154 -12.656 0.888 1.00 . B B . 43 ARG N 1 1 5 3717 2 2 22 ARG NE N 1.598 -10.457 4.844 1.00 . B B . 43 ARG NE 1 1 5 3718 2 2 22 ARG NH1 N 1.731 -8.239 4.430 1.00 . B B . 43 ARG NH1 1 1 5 3719 2 2 22 ARG NH2 N 2.662 -9.714 2.994 1.00 . B B . 43 ARG NH2 1 1 5 3720 2 2 22 ARG O O -2.778 -12.164 1.204 1.00 . B B . 43 ARG O 1 1 5 3721 2 2 23 GLY C C -4.565 -11.501 4.052 1.00 . B B . 44 GLY C 1 1 5 3722 2 2 23 GLY CA C -4.441 -12.785 3.230 1.00 . B B . 44 GLY CA 1 1 5 3723 2 2 23 GLY H H -2.599 -13.709 3.855 1.00 . B B . 44 GLY H 1 1 5 3724 2 2 23 GLY HA2 H -4.833 -12.619 2.236 1.00 . B B . 44 GLY HA2 1 1 5 3725 2 2 23 GLY HA3 H -5.002 -13.572 3.711 1.00 . B B . 44 GLY HA3 1 1 5 3726 2 2 23 GLY N N -3.008 -13.180 3.138 1.00 . B B . 44 GLY N 1 1 5 3727 2 2 23 GLY O O -4.439 -10.408 3.537 1.00 . B B . 44 GLY O 1 1 5 3728 2 2 24 GLY C C -6.324 -9.796 6.002 1.00 . B B . 45 GLY C 1 1 5 3729 2 2 24 GLY CA C -4.936 -10.411 6.186 1.00 . B B . 45 GLY CA 1 1 5 3730 2 2 24 GLY H H -4.902 -12.515 5.726 1.00 . B B . 45 GLY H 1 1 5 3731 2 2 24 GLY HA2 H -4.797 -10.686 7.222 1.00 . B B . 45 GLY HA2 1 1 5 3732 2 2 24 GLY HA3 H -4.186 -9.688 5.902 1.00 . B B . 45 GLY HA3 1 1 5 3733 2 2 24 GLY N N -4.807 -11.624 5.330 1.00 . B B . 45 GLY N 1 1 5 3734 2 2 24 GLY O O -7.331 -10.421 6.268 1.00 . B B . 45 GLY O 1 1 5 3735 2 2 25 PHE C C -7.607 -6.909 4.205 1.00 . B B . 46 PHE C 1 1 5 3736 2 2 25 PHE CA C -7.708 -7.915 5.352 1.00 . B B . 46 PHE CA 1 1 5 3737 2 2 25 PHE CB C -8.111 -7.187 6.636 1.00 . B B . 46 PHE CB 1 1 5 3738 2 2 25 PHE CD1 C -10.391 -8.437 6.509 1.00 . B B . 46 PHE CD1 1 1 5 3739 2 2 25 PHE CD2 C -10.402 -6.096 7.187 1.00 . B B . 46 PHE CD2 1 1 5 3740 2 2 25 PHE CE1 C -11.785 -8.470 6.644 1.00 . B B . 46 PHE CE1 1 1 5 3741 2 2 25 PHE CE2 C -11.796 -6.153 7.316 1.00 . B B . 46 PHE CE2 1 1 5 3742 2 2 25 PHE CG C -9.665 -7.239 6.783 1.00 . B B . 46 PHE CG 1 1 5 3743 2 2 25 PHE CZ C -12.483 -7.334 7.047 1.00 . B B . 46 PHE CZ 1 1 5 3744 2 2 25 PHE H H -5.560 -8.086 5.344 1.00 . B B . 46 PHE H 1 1 5 3745 2 2 25 PHE HA H -8.450 -8.662 5.112 1.00 . B B . 46 PHE HA 1 1 5 3746 2 2 25 PHE HB2 H -7.612 -7.679 7.487 1.00 . B B . 46 PHE HB2 1 1 5 3747 2 2 25 PHE HB3 H -7.760 -6.147 6.576 1.00 . B B . 46 PHE HB3 1 1 5 3748 2 2 25 PHE HD1 H -9.891 -9.330 6.190 1.00 . B B . 46 PHE HD1 1 1 5 3749 2 2 25 PHE HD2 H -9.912 -5.176 7.397 1.00 . B B . 46 PHE HD2 1 1 5 3750 2 2 25 PHE HE1 H -12.322 -9.383 6.436 1.00 . B B . 46 PHE HE1 1 1 5 3751 2 2 25 PHE HE2 H -12.342 -5.274 7.626 1.00 . B B . 46 PHE HE2 1 1 5 3752 2 2 25 PHE HZ H -13.558 -7.369 7.149 1.00 . B B . 46 PHE HZ 1 1 5 3753 2 2 25 PHE N N -6.385 -8.573 5.551 1.00 . B B . 46 PHE N 1 1 5 3754 2 2 25 PHE O O -8.329 -5.933 4.156 1.00 . B B . 46 PHE O 1 1 5 3755 2 2 26 TYR C C -6.275 -6.975 0.859 1.00 . B B . 47 TYR C 1 1 5 3756 2 2 26 TYR CA C -6.565 -6.192 2.140 1.00 . B B . 47 TYR CA 1 1 5 3757 2 2 26 TYR CB C -5.411 -5.232 2.426 1.00 . B B . 47 TYR CB 1 1 5 3758 2 2 26 TYR CD1 C -6.625 -2.965 2.787 1.00 . B B . 47 TYR CD1 1 1 5 3759 2 2 26 TYR CD2 C -5.432 -3.300 0.689 1.00 . B B . 47 TYR CD2 1 1 5 3760 2 2 26 TYR CE1 C -7.001 -1.686 2.357 1.00 . B B . 47 TYR CE1 1 1 5 3761 2 2 26 TYR CE2 C -5.818 -2.017 0.279 1.00 . B B . 47 TYR CE2 1 1 5 3762 2 2 26 TYR CG C -5.827 -3.802 1.959 1.00 . B B . 47 TYR CG 1 1 5 3763 2 2 26 TYR CZ C -6.597 -1.214 1.110 1.00 . B B . 47 TYR CZ 1 1 5 3764 2 2 26 TYR H H -6.140 -7.929 3.339 1.00 . B B . 47 TYR H 1 1 5 3765 2 2 26 TYR HA H -7.477 -5.628 2.020 1.00 . B B . 47 TYR HA 1 1 5 3766 2 2 26 TYR HB2 H -5.200 -5.254 3.507 1.00 . B B . 47 TYR HB2 1 1 5 3767 2 2 26 TYR HB3 H -4.520 -5.577 1.883 1.00 . B B . 47 TYR HB3 1 1 5 3768 2 2 26 TYR HD1 H -6.963 -3.296 3.745 1.00 . B B . 47 TYR HD1 1 1 5 3769 2 2 26 TYR HD2 H -4.841 -3.888 0.023 1.00 . B B . 47 TYR HD2 1 1 5 3770 2 2 26 TYR HE1 H -7.605 -1.061 2.997 1.00 . B B . 47 TYR HE1 1 1 5 3771 2 2 26 TYR HE2 H -5.512 -1.648 -0.689 1.00 . B B . 47 TYR HE2 1 1 5 3772 2 2 26 TYR HH H -7.007 0.615 1.470 1.00 . B B . 47 TYR HH 1 1 5 3773 2 2 26 TYR N N -6.714 -7.137 3.281 1.00 . B B . 47 TYR N 1 1 5 3774 2 2 26 TYR O O -5.746 -6.445 -0.099 1.00 . B B . 47 TYR O 1 1 5 3775 2 2 26 TYR OH O -6.973 0.047 0.696 1.00 . B B . 47 TYR OH 1 1 5 3776 2 2 27 THR C C -7.575 -8.966 -1.320 1.00 . B B . 48 THR C 1 1 5 3777 2 2 27 THR CA C -6.361 -9.049 -0.389 1.00 . B B . 48 THR CA 1 1 5 3778 2 2 27 THR CB C -6.116 -10.506 0.020 1.00 . B B . 48 THR CB 1 1 5 3779 2 2 27 THR CG2 C -6.323 -11.429 -1.183 1.00 . B B . 48 THR CG2 1 1 5 3780 2 2 27 THR H H -7.043 -8.642 1.614 1.00 . B B . 48 THR H 1 1 5 3781 2 2 27 THR HA H -5.490 -8.667 -0.900 1.00 . B B . 48 THR HA 1 1 5 3782 2 2 27 THR HB H -6.806 -10.782 0.802 1.00 . B B . 48 THR HB 1 1 5 3783 2 2 27 THR HG1 H -4.202 -10.699 -0.267 1.00 . B B . 48 THR HG1 1 1 5 3784 2 2 27 THR HG21 H -5.960 -12.417 -0.946 1.00 . B B . 48 THR HG21 1 1 5 3785 2 2 27 THR HG22 H -5.780 -11.039 -2.032 1.00 . B B . 48 THR HG22 1 1 5 3786 2 2 27 THR HG23 H -7.375 -11.478 -1.420 1.00 . B B . 48 THR HG23 1 1 5 3787 2 2 27 THR N N -6.617 -8.233 0.831 1.00 . B B . 48 THR N 1 1 5 3788 2 2 27 THR O O -7.510 -9.334 -2.476 1.00 . B B . 48 THR O 1 1 5 3789 2 2 27 THR OG1 O -4.784 -10.642 0.495 1.00 . B B . 48 THR OG1 1 1 5 3790 2 2 28 LYS C C -10.957 -7.523 -0.971 1.00 . B B . 49 LYS C 1 1 5 3791 2 2 28 LYS CA C -9.893 -8.378 -1.683 1.00 . B B . 49 LYS CA 1 1 5 3792 2 2 28 LYS CB C -10.420 -9.791 -1.995 1.00 . B B . 49 LYS CB 1 1 5 3793 2 2 28 LYS CD C -12.308 -10.757 -3.319 1.00 . B B . 49 LYS CD 1 1 5 3794 2 2 28 LYS CE C -13.312 -11.774 -2.777 1.00 . B B . 49 LYS CE 1 1 5 3795 2 2 28 LYS CG C -11.937 -9.766 -2.214 1.00 . B B . 49 LYS CG 1 1 5 3796 2 2 28 LYS H H -8.708 -8.190 0.106 1.00 . B B . 49 LYS H 1 1 5 3797 2 2 28 LYS HA H -9.621 -7.892 -2.610 1.00 . B B . 49 LYS HA 1 1 5 3798 2 2 28 LYS HB2 H -9.940 -10.155 -2.892 1.00 . B B . 49 LYS HB2 1 1 5 3799 2 2 28 LYS HB3 H -10.183 -10.452 -1.177 1.00 . B B . 49 LYS HB3 1 1 5 3800 2 2 28 LYS HD2 H -12.748 -10.223 -4.149 1.00 . B B . 49 LYS HD2 1 1 5 3801 2 2 28 LYS HD3 H -11.420 -11.273 -3.653 1.00 . B B . 49 LYS HD3 1 1 5 3802 2 2 28 LYS HE2 H -12.788 -12.531 -2.211 1.00 . B B . 49 LYS HE2 1 1 5 3803 2 2 28 LYS HE3 H -14.022 -11.273 -2.136 1.00 . B B . 49 LYS HE3 1 1 5 3804 2 2 28 LYS HG2 H -12.438 -10.043 -1.297 1.00 . B B . 49 LYS HG2 1 1 5 3805 2 2 28 LYS HG3 H -12.242 -8.773 -2.507 1.00 . B B . 49 LYS HG3 1 1 5 3806 2 2 28 LYS HZ1 H -14.711 -13.112 -3.545 1.00 . B B . 49 LYS HZ1 1 1 5 3807 2 2 28 LYS HZ2 H -13.347 -12.890 -4.534 1.00 . B B . 49 LYS HZ2 1 1 5 3808 2 2 28 LYS HZ3 H -14.545 -11.689 -4.452 1.00 . B B . 49 LYS HZ3 1 1 5 3809 2 2 28 LYS N N -8.679 -8.484 -0.826 1.00 . B B . 49 LYS N 1 1 5 3810 2 2 28 LYS NZ N -14.033 -12.415 -3.912 1.00 . B B . 49 LYS NZ 1 1 5 3811 2 2 28 LYS O O -11.324 -6.476 -1.464 1.00 . B B . 49 LYS O 1 1 5 3812 2 2 29 PRO C C -11.803 -6.016 1.613 1.00 . B B . 50 PRO C 1 1 5 3813 2 2 29 PRO CA C -12.426 -7.248 0.953 1.00 . B B . 50 PRO CA 1 1 5 3814 2 2 29 PRO CB C -12.882 -8.263 2.004 1.00 . B B . 50 PRO CB 1 1 5 3815 2 2 29 PRO CD C -10.981 -9.249 0.786 1.00 . B B . 50 PRO CD 1 1 5 3816 2 2 29 PRO CG C -11.741 -9.296 2.123 1.00 . B B . 50 PRO CG 1 1 5 3817 2 2 29 PRO HA H -13.255 -6.970 0.329 1.00 . B B . 50 PRO HA 1 1 5 3818 2 2 29 PRO HB2 H -13.043 -7.768 2.952 1.00 . B B . 50 PRO HB2 1 1 5 3819 2 2 29 PRO HB3 H -13.786 -8.754 1.680 1.00 . B B . 50 PRO HB3 1 1 5 3820 2 2 29 PRO HD2 H -9.916 -9.250 0.957 1.00 . B B . 50 PRO HD2 1 1 5 3821 2 2 29 PRO HD3 H -11.272 -10.079 0.167 1.00 . B B . 50 PRO HD3 1 1 5 3822 2 2 29 PRO HG2 H -11.083 -9.028 2.940 1.00 . B B . 50 PRO HG2 1 1 5 3823 2 2 29 PRO HG3 H -12.146 -10.284 2.279 1.00 . B B . 50 PRO HG3 1 1 5 3824 2 2 29 PRO N N -11.416 -7.980 0.170 1.00 . B B . 50 PRO N 1 1 5 3825 2 2 29 PRO O O -10.606 -5.813 1.565 1.00 . B B . 50 PRO O 1 1 5 3826 2 2 30 THR C C -10.783 -4.317 3.638 1.00 . B B . 51 THR C 1 1 5 3827 2 2 30 THR CA C -12.070 -3.969 2.887 1.00 . B B . 51 THR CA 1 1 5 3828 2 2 30 THR CB C -13.107 -3.428 3.873 1.00 . B B . 51 THR CB 1 1 5 3829 2 2 30 THR CG2 C -14.292 -2.846 3.101 1.00 . B B . 51 THR CG2 1 1 5 3830 2 2 30 THR H H -13.571 -5.375 2.248 1.00 . B B . 51 THR H 1 1 5 3831 2 2 30 THR HA H -11.859 -3.219 2.139 1.00 . B B . 51 THR HA 1 1 5 3832 2 2 30 THR HB H -12.661 -2.654 4.477 1.00 . B B . 51 THR HB 1 1 5 3833 2 2 30 THR HG1 H -12.788 -4.919 5.082 1.00 . B B . 51 THR HG1 1 1 5 3834 2 2 30 THR HG21 H -14.118 -1.797 2.913 1.00 . B B . 51 THR HG21 1 1 5 3835 2 2 30 THR HG22 H -15.194 -2.962 3.685 1.00 . B B . 51 THR HG22 1 1 5 3836 2 2 30 THR HG23 H -14.402 -3.367 2.162 1.00 . B B . 51 THR HG23 1 1 5 3837 2 2 30 THR N N -12.609 -5.191 2.225 1.00 . B B . 51 THR N 1 1 5 3838 2 2 30 THR O O -10.652 -5.456 4.053 1.00 . B B . 51 THR O 1 1 5 3839 2 2 30 THR OXT O -9.949 -3.437 3.783 1.00 . B B . 51 THR OXT 1 1 5 3840 2 2 30 THR OG1 O -13.559 -4.484 4.710 1.00 . B B . 51 THR OG1 1 1 6 3841 1 1 1 GLY C C -4.643 6.880 3.832 1.00 . A A . 1 GLY C 1 1 6 3842 1 1 1 GLY CA C -5.896 7.502 4.346 1.00 . A A . 1 GLY CA 1 1 6 3843 1 1 1 GLY H1 H -7.261 6.711 2.934 1.00 . A A . 1 GLY H1 1 1 6 3844 1 1 1 GLY H2 H -6.951 8.367 2.727 1.00 . A A . 1 GLY H2 1 1 6 3845 1 1 1 GLY H3 H -7.955 7.841 3.992 1.00 . A A . 1 GLY H3 1 1 6 3846 1 1 1 GLY HA2 H -5.367 8.321 4.335 1.00 . A A . 1 GLY HA2 1 1 6 3847 1 1 1 GLY HA3 H -6.297 7.230 5.409 1.00 . A A . 1 GLY HA3 1 1 6 3848 1 1 1 GLY N N -7.113 7.614 3.426 1.00 . A A . 1 GLY N 1 1 6 3849 1 1 1 GLY O O -3.574 7.074 4.376 1.00 . A A . 1 GLY O 1 1 6 3850 1 1 2 ILE C C -3.059 6.220 0.970 1.00 . A A . 2 ILE C 1 1 6 3851 1 1 2 ILE CA C -3.519 5.467 2.222 1.00 . A A . 2 ILE CA 1 1 6 3852 1 1 2 ILE CB C -3.830 4.015 1.869 1.00 . A A . 2 ILE CB 1 1 6 3853 1 1 2 ILE CD1 C -2.922 1.941 0.829 1.00 . A A . 2 ILE CD1 1 1 6 3854 1 1 2 ILE CG1 C -2.599 3.378 1.227 1.00 . A A . 2 ILE CG1 1 1 6 3855 1 1 2 ILE CG2 C -5.004 3.959 0.892 1.00 . A A . 2 ILE CG2 1 1 6 3856 1 1 2 ILE H H -5.609 5.970 2.354 1.00 . A A . 2 ILE H 1 1 6 3857 1 1 2 ILE HA H -2.732 5.489 2.960 1.00 . A A . 2 ILE HA 1 1 6 3858 1 1 2 ILE HB H -4.087 3.474 2.769 1.00 . A A . 2 ILE HB 1 1 6 3859 1 1 2 ILE HD11 H -3.459 1.459 1.632 1.00 . A A . 2 ILE HD11 1 1 6 3860 1 1 2 ILE HD12 H -2.004 1.407 0.637 1.00 . A A . 2 ILE HD12 1 1 6 3861 1 1 2 ILE HD13 H -3.532 1.944 -0.062 1.00 . A A . 2 ILE HD13 1 1 6 3862 1 1 2 ILE HG12 H -2.318 3.942 0.349 1.00 . A A . 2 ILE HG12 1 1 6 3863 1 1 2 ILE HG13 H -1.782 3.379 1.933 1.00 . A A . 2 ILE HG13 1 1 6 3864 1 1 2 ILE HG21 H -4.812 4.621 0.061 1.00 . A A . 2 ILE HG21 1 1 6 3865 1 1 2 ILE HG22 H -5.907 4.266 1.398 1.00 . A A . 2 ILE HG22 1 1 6 3866 1 1 2 ILE HG23 H -5.120 2.949 0.529 1.00 . A A . 2 ILE HG23 1 1 6 3867 1 1 2 ILE N N -4.737 6.117 2.778 1.00 . A A . 2 ILE N 1 1 6 3868 1 1 2 ILE O O -1.960 6.030 0.489 1.00 . A A . 2 ILE O 1 1 6 3869 1 1 3 VAL C C -3.027 9.245 -0.350 1.00 . A A . 3 VAL C 1 1 6 3870 1 1 3 VAL CA C -3.488 7.852 -0.769 1.00 . A A . 3 VAL CA 1 1 6 3871 1 1 3 VAL CB C -4.684 7.994 -1.710 1.00 . A A . 3 VAL CB 1 1 6 3872 1 1 3 VAL CG1 C -5.295 6.623 -1.975 1.00 . A A . 3 VAL CG1 1 1 6 3873 1 1 3 VAL CG2 C -5.733 8.901 -1.064 1.00 . A A . 3 VAL CG2 1 1 6 3874 1 1 3 VAL H H -4.767 7.229 0.849 1.00 . A A . 3 VAL H 1 1 6 3875 1 1 3 VAL HA H -2.687 7.340 -1.274 1.00 . A A . 3 VAL HA 1 1 6 3876 1 1 3 VAL HB H -4.356 8.428 -2.643 1.00 . A A . 3 VAL HB 1 1 6 3877 1 1 3 VAL HG11 H -5.438 6.494 -3.037 1.00 . A A . 3 VAL HG11 1 1 6 3878 1 1 3 VAL HG12 H -6.247 6.552 -1.470 1.00 . A A . 3 VAL HG12 1 1 6 3879 1 1 3 VAL HG13 H -4.632 5.856 -1.604 1.00 . A A . 3 VAL HG13 1 1 6 3880 1 1 3 VAL HG21 H -6.562 9.035 -1.744 1.00 . A A . 3 VAL HG21 1 1 6 3881 1 1 3 VAL HG22 H -5.292 9.861 -0.841 1.00 . A A . 3 VAL HG22 1 1 6 3882 1 1 3 VAL HG23 H -6.087 8.447 -0.151 1.00 . A A . 3 VAL HG23 1 1 6 3883 1 1 3 VAL N N -3.887 7.083 0.444 1.00 . A A . 3 VAL N 1 1 6 3884 1 1 3 VAL O O -2.196 9.859 -0.985 1.00 . A A . 3 VAL O 1 1 6 3885 1 1 4 GLU C C -1.907 11.040 1.999 1.00 . A A . 4 GLU C 1 1 6 3886 1 1 4 GLU CA C -3.191 11.113 1.172 1.00 . A A . 4 GLU CA 1 1 6 3887 1 1 4 GLU CB C -4.322 11.682 2.026 1.00 . A A . 4 GLU CB 1 1 6 3888 1 1 4 GLU CD C -6.793 12.028 2.128 1.00 . A A . 4 GLU CD 1 1 6 3889 1 1 4 GLU CG C -5.666 11.282 1.413 1.00 . A A . 4 GLU CG 1 1 6 3890 1 1 4 GLU H H -4.251 9.240 1.198 1.00 . A A . 4 GLU H 1 1 6 3891 1 1 4 GLU HA H -3.032 11.752 0.316 1.00 . A A . 4 GLU HA 1 1 6 3892 1 1 4 GLU HB2 H -4.249 11.287 3.029 1.00 . A A . 4 GLU HB2 1 1 6 3893 1 1 4 GLU HB3 H -4.247 12.759 2.055 1.00 . A A . 4 GLU HB3 1 1 6 3894 1 1 4 GLU HG2 H -5.673 11.535 0.362 1.00 . A A . 4 GLU HG2 1 1 6 3895 1 1 4 GLU HG3 H -5.813 10.217 1.527 1.00 . A A . 4 GLU HG3 1 1 6 3896 1 1 4 GLU N N -3.575 9.752 0.709 1.00 . A A . 4 GLU N 1 1 6 3897 1 1 4 GLU O O -1.362 12.047 2.407 1.00 . A A . 4 GLU O 1 1 6 3898 1 1 4 GLU OE1 O -7.071 13.152 1.743 1.00 . A A . 4 GLU OE1 1 1 6 3899 1 1 4 GLU OE2 O -7.359 11.463 3.050 1.00 . A A . 4 GLU OE2 1 1 6 3900 1 1 5 GLN C C 1.007 9.367 2.150 1.00 . A A . 5 GLN C 1 1 6 3901 1 1 5 GLN CA C -0.171 9.733 3.060 1.00 . A A . 5 GLN CA 1 1 6 3902 1 1 5 GLN CB C -0.359 8.641 4.117 1.00 . A A . 5 GLN CB 1 1 6 3903 1 1 5 GLN CD C -0.196 9.411 6.490 1.00 . A A . 5 GLN CD 1 1 6 3904 1 1 5 GLN CG C -1.141 9.209 5.304 1.00 . A A . 5 GLN CG 1 1 6 3905 1 1 5 GLN H H -1.871 9.057 1.919 1.00 . A A . 5 GLN H 1 1 6 3906 1 1 5 GLN HA H 0.034 10.672 3.551 1.00 . A A . 5 GLN HA 1 1 6 3907 1 1 5 GLN HB2 H -0.904 7.813 3.687 1.00 . A A . 5 GLN HB2 1 1 6 3908 1 1 5 GLN HB3 H 0.607 8.299 4.456 1.00 . A A . 5 GLN HB3 1 1 6 3909 1 1 5 GLN HE21 H -0.037 7.470 6.877 1.00 . A A . 5 GLN HE21 1 1 6 3910 1 1 5 GLN HE22 H 0.847 8.489 7.907 1.00 . A A . 5 GLN HE22 1 1 6 3911 1 1 5 GLN HG2 H -1.579 10.157 5.026 1.00 . A A . 5 GLN HG2 1 1 6 3912 1 1 5 GLN HG3 H -1.924 8.520 5.583 1.00 . A A . 5 GLN HG3 1 1 6 3913 1 1 5 GLN N N -1.418 9.859 2.254 1.00 . A A . 5 GLN N 1 1 6 3914 1 1 5 GLN NE2 N 0.241 8.371 7.146 1.00 . A A . 5 GLN NE2 1 1 6 3915 1 1 5 GLN O O 2.126 9.783 2.374 1.00 . A A . 5 GLN O 1 1 6 3916 1 1 5 GLN OE1 O 0.150 10.527 6.823 1.00 . A A . 5 GLN OE1 1 1 6 3917 1 1 6 CYS C C 1.791 8.940 -1.105 1.00 . A A . 6 CYS C 1 1 6 3918 1 1 6 CYS CA C 1.887 8.183 0.225 1.00 . A A . 6 CYS CA 1 1 6 3919 1 1 6 CYS CB C 1.801 6.680 -0.037 1.00 . A A . 6 CYS CB 1 1 6 3920 1 1 6 CYS H H -0.136 8.247 0.972 1.00 . A A . 6 CYS H 1 1 6 3921 1 1 6 CYS HA H 2.832 8.406 0.699 1.00 . A A . 6 CYS HA 1 1 6 3922 1 1 6 CYS HB2 H 0.853 6.446 -0.497 1.00 . A A . 6 CYS HB2 1 1 6 3923 1 1 6 CYS HB3 H 2.606 6.380 -0.693 1.00 . A A . 6 CYS HB3 1 1 6 3924 1 1 6 CYS N N 0.771 8.582 1.133 1.00 . A A . 6 CYS N 1 1 6 3925 1 1 6 CYS O O 2.787 9.206 -1.748 1.00 . A A . 6 CYS O 1 1 6 3926 1 1 6 CYS SG S 1.945 5.799 1.536 1.00 . A A . 6 CYS SG 1 1 6 3927 1 1 7 CYS C C 0.964 11.445 -2.669 1.00 . A A . 7 CYS C 1 1 6 3928 1 1 7 CYS CA C 0.456 10.010 -2.821 1.00 . A A . 7 CYS CA 1 1 6 3929 1 1 7 CYS CB C -1.016 10.038 -3.223 1.00 . A A . 7 CYS CB 1 1 6 3930 1 1 7 CYS H H -0.189 9.053 -0.999 1.00 . A A . 7 CYS H 1 1 6 3931 1 1 7 CYS HA H 1.028 9.502 -3.585 1.00 . A A . 7 CYS HA 1 1 6 3932 1 1 7 CYS HB2 H -1.483 9.103 -2.943 1.00 . A A . 7 CYS HB2 1 1 6 3933 1 1 7 CYS HB3 H -1.513 10.851 -2.715 1.00 . A A . 7 CYS HB3 1 1 6 3934 1 1 7 CYS N N 0.604 9.281 -1.527 1.00 . A A . 7 CYS N 1 1 6 3935 1 1 7 CYS O O 1.053 12.186 -3.627 1.00 . A A . 7 CYS O 1 1 6 3936 1 1 7 CYS SG S -1.160 10.265 -5.010 1.00 . A A . 7 CYS SG 1 1 6 3937 1 1 8 THR C C 3.221 13.156 -0.684 1.00 . A A . 8 THR C 1 1 6 3938 1 1 8 THR CA C 1.807 13.231 -1.264 1.00 . A A . 8 THR CA 1 1 6 3939 1 1 8 THR CB C 0.887 14.005 -0.303 1.00 . A A . 8 THR CB 1 1 6 3940 1 1 8 THR CG2 C -0.128 13.057 0.346 1.00 . A A . 8 THR CG2 1 1 6 3941 1 1 8 THR H H 1.216 11.231 -0.713 1.00 . A A . 8 THR H 1 1 6 3942 1 1 8 THR HA H 1.841 13.742 -2.215 1.00 . A A . 8 THR HA 1 1 6 3943 1 1 8 THR HB H 0.356 14.765 -0.854 1.00 . A A . 8 THR HB 1 1 6 3944 1 1 8 THR HG1 H 1.071 14.972 1.375 1.00 . A A . 8 THR HG1 1 1 6 3945 1 1 8 THR HG21 H -0.863 13.633 0.888 1.00 . A A . 8 THR HG21 1 1 6 3946 1 1 8 THR HG22 H 0.383 12.394 1.027 1.00 . A A . 8 THR HG22 1 1 6 3947 1 1 8 THR HG23 H -0.620 12.477 -0.421 1.00 . A A . 8 THR HG23 1 1 6 3948 1 1 8 THR N N 1.298 11.843 -1.473 1.00 . A A . 8 THR N 1 1 6 3949 1 1 8 THR O O 3.954 14.125 -0.670 1.00 . A A . 8 THR O 1 1 6 3950 1 1 8 THR OG1 O 1.669 14.621 0.711 1.00 . A A . 8 THR OG1 1 1 6 3951 1 1 9 SER C C 5.567 10.529 -0.145 1.00 . A A . 9 SER C 1 1 6 3952 1 1 9 SER CA C 4.974 11.846 0.357 1.00 . A A . 9 SER CA 1 1 6 3953 1 1 9 SER CB C 4.891 11.825 1.883 1.00 . A A . 9 SER CB 1 1 6 3954 1 1 9 SER H H 3.005 11.235 -0.242 1.00 . A A . 9 SER H 1 1 6 3955 1 1 9 SER HA H 5.598 12.669 0.038 1.00 . A A . 9 SER HA 1 1 6 3956 1 1 9 SER HB2 H 4.218 11.046 2.198 1.00 . A A . 9 SER HB2 1 1 6 3957 1 1 9 SER HB3 H 5.874 11.636 2.294 1.00 . A A . 9 SER HB3 1 1 6 3958 1 1 9 SER HG H 4.953 13.768 1.962 1.00 . A A . 9 SER HG 1 1 6 3959 1 1 9 SER N N 3.610 12.003 -0.214 1.00 . A A . 9 SER N 1 1 6 3960 1 1 9 SER O O 5.063 9.927 -1.073 1.00 . A A . 9 SER O 1 1 6 3961 1 1 9 SER OG O 4.405 13.079 2.344 1.00 . A A . 9 SER OG 1 1 6 3962 1 1 10 ILE C C 7.250 7.794 1.162 1.00 . A A . 10 ILE C 1 1 6 3963 1 1 10 ILE CA C 7.236 8.792 0.004 1.00 . A A . 10 ILE CA 1 1 6 3964 1 1 10 ILE CB C 8.665 9.049 -0.471 1.00 . A A . 10 ILE CB 1 1 6 3965 1 1 10 ILE CD1 C 7.720 10.468 -2.300 1.00 . A A . 10 ILE CD1 1 1 6 3966 1 1 10 ILE CG1 C 8.737 10.415 -1.158 1.00 . A A . 10 ILE CG1 1 1 6 3967 1 1 10 ILE CG2 C 9.070 7.961 -1.464 1.00 . A A . 10 ILE CG2 1 1 6 3968 1 1 10 ILE H H 7.020 10.567 1.205 1.00 . A A . 10 ILE H 1 1 6 3969 1 1 10 ILE HA H 6.655 8.388 -0.812 1.00 . A A . 10 ILE HA 1 1 6 3970 1 1 10 ILE HB H 9.335 9.032 0.376 1.00 . A A . 10 ILE HB 1 1 6 3971 1 1 10 ILE HD11 H 7.168 9.539 -2.335 1.00 . A A . 10 ILE HD11 1 1 6 3972 1 1 10 ILE HD12 H 8.238 10.614 -3.237 1.00 . A A . 10 ILE HD12 1 1 6 3973 1 1 10 ILE HD13 H 7.036 11.287 -2.136 1.00 . A A . 10 ILE HD13 1 1 6 3974 1 1 10 ILE HG12 H 8.514 11.191 -0.441 1.00 . A A . 10 ILE HG12 1 1 6 3975 1 1 10 ILE HG13 H 9.729 10.566 -1.556 1.00 . A A . 10 ILE HG13 1 1 6 3976 1 1 10 ILE HG21 H 9.413 7.091 -0.925 1.00 . A A . 10 ILE HG21 1 1 6 3977 1 1 10 ILE HG22 H 9.862 8.330 -2.098 1.00 . A A . 10 ILE HG22 1 1 6 3978 1 1 10 ILE HG23 H 8.217 7.694 -2.071 1.00 . A A . 10 ILE HG23 1 1 6 3979 1 1 10 ILE N N 6.626 10.072 0.457 1.00 . A A . 10 ILE N 1 1 6 3980 1 1 10 ILE O O 8.173 7.754 1.950 1.00 . A A . 10 ILE O 1 1 6 3981 1 1 11 CYS C C 7.206 4.882 2.106 1.00 . A A . 11 CYS C 1 1 6 3982 1 1 11 CYS CA C 6.182 5.987 2.372 1.00 . A A . 11 CYS CA 1 1 6 3983 1 1 11 CYS CB C 4.785 5.366 2.440 1.00 . A A . 11 CYS CB 1 1 6 3984 1 1 11 CYS H H 5.498 7.036 0.620 1.00 . A A . 11 CYS H 1 1 6 3985 1 1 11 CYS HA H 6.407 6.472 3.311 1.00 . A A . 11 CYS HA 1 1 6 3986 1 1 11 CYS HB2 H 4.635 4.726 1.583 1.00 . A A . 11 CYS HB2 1 1 6 3987 1 1 11 CYS HB3 H 4.694 4.783 3.343 1.00 . A A . 11 CYS HB3 1 1 6 3988 1 1 11 CYS N N 6.231 6.986 1.268 1.00 . A A . 11 CYS N 1 1 6 3989 1 1 11 CYS O O 7.797 4.810 1.047 1.00 . A A . 11 CYS O 1 1 6 3990 1 1 11 CYS SG S 3.531 6.668 2.436 1.00 . A A . 11 CYS SG 1 1 6 3991 1 1 12 SER C C 7.636 1.572 2.906 1.00 . A A . 12 SER C 1 1 6 3992 1 1 12 SER CA C 8.387 2.904 2.863 1.00 . A A . 12 SER CA 1 1 6 3993 1 1 12 SER CB C 9.428 2.939 3.983 1.00 . A A . 12 SER CB 1 1 6 3994 1 1 12 SER H H 6.918 4.087 3.902 1.00 . A A . 12 SER H 1 1 6 3995 1 1 12 SER HA H 8.877 3.015 1.907 1.00 . A A . 12 SER HA 1 1 6 3996 1 1 12 SER HB2 H 10.294 2.369 3.691 1.00 . A A . 12 SER HB2 1 1 6 3997 1 1 12 SER HB3 H 9.721 3.965 4.169 1.00 . A A . 12 SER HB3 1 1 6 3998 1 1 12 SER HG H 9.430 2.610 5.901 1.00 . A A . 12 SER HG 1 1 6 3999 1 1 12 SER N N 7.412 4.013 3.058 1.00 . A A . 12 SER N 1 1 6 4000 1 1 12 SER O O 6.595 1.463 3.522 1.00 . A A . 12 SER O 1 1 6 4001 1 1 12 SER OG O 8.869 2.371 5.161 1.00 . A A . 12 SER OG 1 1 6 4002 1 1 13 LEU C C 6.987 -1.061 3.703 1.00 . A A . 13 LEU C 1 1 6 4003 1 1 13 LEU CA C 7.446 -0.758 2.277 1.00 . A A . 13 LEU CA 1 1 6 4004 1 1 13 LEU CB C 8.392 -1.860 1.798 1.00 . A A . 13 LEU CB 1 1 6 4005 1 1 13 LEU CD1 C 7.590 -2.445 -0.496 1.00 . A A . 13 LEU CD1 1 1 6 4006 1 1 13 LEU CD2 C 8.275 -4.252 1.087 1.00 . A A . 13 LEU CD2 1 1 6 4007 1 1 13 LEU CG C 7.607 -2.880 0.970 1.00 . A A . 13 LEU CG 1 1 6 4008 1 1 13 LEU H H 8.989 0.661 1.766 1.00 . A A . 13 LEU H 1 1 6 4009 1 1 13 LEU HA H 6.586 -0.714 1.626 1.00 . A A . 13 LEU HA 1 1 6 4010 1 1 13 LEU HB2 H 9.173 -1.425 1.192 1.00 . A A . 13 LEU HB2 1 1 6 4011 1 1 13 LEU HB3 H 8.831 -2.354 2.652 1.00 . A A . 13 LEU HB3 1 1 6 4012 1 1 13 LEU HD11 H 6.941 -1.589 -0.611 1.00 . A A . 13 LEU HD11 1 1 6 4013 1 1 13 LEU HD12 H 7.227 -3.257 -1.109 1.00 . A A . 13 LEU HD12 1 1 6 4014 1 1 13 LEU HD13 H 8.591 -2.182 -0.805 1.00 . A A . 13 LEU HD13 1 1 6 4015 1 1 13 LEU HD21 H 8.107 -4.650 2.076 1.00 . A A . 13 LEU HD21 1 1 6 4016 1 1 13 LEU HD22 H 9.337 -4.151 0.914 1.00 . A A . 13 LEU HD22 1 1 6 4017 1 1 13 LEU HD23 H 7.853 -4.921 0.352 1.00 . A A . 13 LEU HD23 1 1 6 4018 1 1 13 LEU HG H 6.591 -2.939 1.339 1.00 . A A . 13 LEU HG 1 1 6 4019 1 1 13 LEU N N 8.148 0.557 2.260 1.00 . A A . 13 LEU N 1 1 6 4020 1 1 13 LEU O O 5.990 -1.722 3.918 1.00 . A A . 13 LEU O 1 1 6 4021 1 1 14 TYR C C 5.897 -0.237 6.308 1.00 . A A . 14 TYR C 1 1 6 4022 1 1 14 TYR CA C 7.291 -0.823 6.091 1.00 . A A . 14 TYR CA 1 1 6 4023 1 1 14 TYR CB C 8.285 -0.158 7.046 1.00 . A A . 14 TYR CB 1 1 6 4024 1 1 14 TYR CD1 C 8.609 -2.110 8.700 1.00 . A A . 14 TYR CD1 1 1 6 4025 1 1 14 TYR CD2 C 10.509 -1.433 7.338 1.00 . A A . 14 TYR CD2 1 1 6 4026 1 1 14 TYR CE1 C 9.399 -3.102 9.295 1.00 . A A . 14 TYR CE1 1 1 6 4027 1 1 14 TYR CE2 C 11.286 -2.431 7.942 1.00 . A A . 14 TYR CE2 1 1 6 4028 1 1 14 TYR CG C 9.154 -1.254 7.710 1.00 . A A . 14 TYR CG 1 1 6 4029 1 1 14 TYR CZ C 10.733 -3.260 8.917 1.00 . A A . 14 TYR CZ 1 1 6 4030 1 1 14 TYR H H 8.496 -0.033 4.489 1.00 . A A . 14 TYR H 1 1 6 4031 1 1 14 TYR HA H 7.268 -1.887 6.275 1.00 . A A . 14 TYR HA 1 1 6 4032 1 1 14 TYR HB2 H 8.902 0.544 6.482 1.00 . A A . 14 TYR HB2 1 1 6 4033 1 1 14 TYR HB3 H 7.734 0.399 7.800 1.00 . A A . 14 TYR HB3 1 1 6 4034 1 1 14 TYR HD1 H 7.586 -2.014 9.007 1.00 . A A . 14 TYR HD1 1 1 6 4035 1 1 14 TYR HD2 H 10.957 -0.816 6.587 1.00 . A A . 14 TYR HD2 1 1 6 4036 1 1 14 TYR HE1 H 8.974 -3.748 10.047 1.00 . A A . 14 TYR HE1 1 1 6 4037 1 1 14 TYR HE2 H 12.318 -2.557 7.652 1.00 . A A . 14 TYR HE2 1 1 6 4038 1 1 14 TYR HH H 12.417 -3.940 9.509 1.00 . A A . 14 TYR HH 1 1 6 4039 1 1 14 TYR N N 7.700 -0.572 4.682 1.00 . A A . 14 TYR N 1 1 6 4040 1 1 14 TYR O O 5.003 -0.900 6.795 1.00 . A A . 14 TYR O 1 1 6 4041 1 1 14 TYR OH O 11.505 -4.240 9.508 1.00 . A A . 14 TYR OH 1 1 6 4042 1 1 15 GLN C C 3.366 0.897 5.199 1.00 . A A . 15 GLN C 1 1 6 4043 1 1 15 GLN CA C 4.359 1.621 6.105 1.00 . A A . 15 GLN CA 1 1 6 4044 1 1 15 GLN CB C 4.424 3.100 5.716 1.00 . A A . 15 GLN CB 1 1 6 4045 1 1 15 GLN CD C 5.050 4.767 7.470 1.00 . A A . 15 GLN CD 1 1 6 4046 1 1 15 GLN CG C 5.592 3.772 6.442 1.00 . A A . 15 GLN CG 1 1 6 4047 1 1 15 GLN H H 6.432 1.513 5.533 1.00 . A A . 15 GLN H 1 1 6 4048 1 1 15 GLN HA H 4.043 1.527 7.133 1.00 . A A . 15 GLN HA 1 1 6 4049 1 1 15 GLN HB2 H 4.566 3.185 4.648 1.00 . A A . 15 GLN HB2 1 1 6 4050 1 1 15 GLN HB3 H 3.501 3.587 5.995 1.00 . A A . 15 GLN HB3 1 1 6 4051 1 1 15 GLN HE21 H 6.722 4.792 8.540 1.00 . A A . 15 GLN HE21 1 1 6 4052 1 1 15 GLN HE22 H 5.473 5.781 9.123 1.00 . A A . 15 GLN HE22 1 1 6 4053 1 1 15 GLN HG2 H 6.184 3.021 6.944 1.00 . A A . 15 GLN HG2 1 1 6 4054 1 1 15 GLN HG3 H 6.207 4.297 5.726 1.00 . A A . 15 GLN HG3 1 1 6 4055 1 1 15 GLN N N 5.701 0.999 5.935 1.00 . A A . 15 GLN N 1 1 6 4056 1 1 15 GLN NE2 N 5.812 5.145 8.460 1.00 . A A . 15 GLN NE2 1 1 6 4057 1 1 15 GLN O O 2.216 0.708 5.545 1.00 . A A . 15 GLN O 1 1 6 4058 1 1 15 GLN OE1 O 3.921 5.205 7.371 1.00 . A A . 15 GLN OE1 1 1 6 4059 1 1 16 LEU C C 2.503 -1.574 3.760 1.00 . A A . 16 LEU C 1 1 6 4060 1 1 16 LEU CA C 2.891 -0.244 3.121 1.00 . A A . 16 LEU CA 1 1 6 4061 1 1 16 LEU CB C 3.599 -0.500 1.789 1.00 . A A . 16 LEU CB 1 1 6 4062 1 1 16 LEU CD1 C 4.460 1.737 1.087 1.00 . A A . 16 LEU CD1 1 1 6 4063 1 1 16 LEU CD2 C 3.435 0.207 -0.600 1.00 . A A . 16 LEU CD2 1 1 6 4064 1 1 16 LEU CG C 3.374 0.687 0.852 1.00 . A A . 16 LEU CG 1 1 6 4065 1 1 16 LEU H H 4.738 0.635 3.787 1.00 . A A . 16 LEU H 1 1 6 4066 1 1 16 LEU HA H 2.002 0.346 2.956 1.00 . A A . 16 LEU HA 1 1 6 4067 1 1 16 LEU HB2 H 4.658 -0.627 1.963 1.00 . A A . 16 LEU HB2 1 1 6 4068 1 1 16 LEU HB3 H 3.200 -1.394 1.335 1.00 . A A . 16 LEU HB3 1 1 6 4069 1 1 16 LEU HD11 H 5.337 1.263 1.502 1.00 . A A . 16 LEU HD11 1 1 6 4070 1 1 16 LEU HD12 H 4.095 2.485 1.774 1.00 . A A . 16 LEU HD12 1 1 6 4071 1 1 16 LEU HD13 H 4.716 2.206 0.148 1.00 . A A . 16 LEU HD13 1 1 6 4072 1 1 16 LEU HD21 H 4.464 0.036 -0.881 1.00 . A A . 16 LEU HD21 1 1 6 4073 1 1 16 LEU HD22 H 3.006 0.959 -1.245 1.00 . A A . 16 LEU HD22 1 1 6 4074 1 1 16 LEU HD23 H 2.877 -0.712 -0.699 1.00 . A A . 16 LEU HD23 1 1 6 4075 1 1 16 LEU HG H 2.405 1.120 1.049 1.00 . A A . 16 LEU HG 1 1 6 4076 1 1 16 LEU N N 3.805 0.480 4.043 1.00 . A A . 16 LEU N 1 1 6 4077 1 1 16 LEU O O 1.399 -2.053 3.601 1.00 . A A . 16 LEU O 1 1 6 4078 1 1 17 GLU C C 1.883 -3.244 6.081 1.00 . A A . 17 GLU C 1 1 6 4079 1 1 17 GLU CA C 3.079 -3.457 5.156 1.00 . A A . 17 GLU CA 1 1 6 4080 1 1 17 GLU CB C 4.286 -3.922 5.971 1.00 . A A . 17 GLU CB 1 1 6 4081 1 1 17 GLU CD C 5.227 -6.237 6.030 1.00 . A A . 17 GLU CD 1 1 6 4082 1 1 17 GLU CG C 5.064 -4.975 5.180 1.00 . A A . 17 GLU CG 1 1 6 4083 1 1 17 GLU H H 4.282 -1.763 4.622 1.00 . A A . 17 GLU H 1 1 6 4084 1 1 17 GLU HA H 2.835 -4.198 4.409 1.00 . A A . 17 GLU HA 1 1 6 4085 1 1 17 GLU HB2 H 4.927 -3.077 6.177 1.00 . A A . 17 GLU HB2 1 1 6 4086 1 1 17 GLU HB3 H 3.947 -4.349 6.899 1.00 . A A . 17 GLU HB3 1 1 6 4087 1 1 17 GLU HG2 H 4.525 -5.216 4.275 1.00 . A A . 17 GLU HG2 1 1 6 4088 1 1 17 GLU HG3 H 6.038 -4.587 4.926 1.00 . A A . 17 GLU HG3 1 1 6 4089 1 1 17 GLU N N 3.401 -2.169 4.496 1.00 . A A . 17 GLU N 1 1 6 4090 1 1 17 GLU O O 1.141 -4.159 6.378 1.00 . A A . 17 GLU O 1 1 6 4091 1 1 17 GLU OE1 O 4.305 -7.035 6.053 1.00 . A A . 17 GLU OE1 1 1 6 4092 1 1 17 GLU OE2 O 6.273 -6.385 6.641 1.00 . A A . 17 GLU OE2 1 1 6 4093 1 1 18 ASN C C -0.757 -1.735 6.619 1.00 . A A . 18 ASN C 1 1 6 4094 1 1 18 ASN CA C 0.538 -1.755 7.436 1.00 . A A . 18 ASN CA 1 1 6 4095 1 1 18 ASN CB C 0.735 -0.399 8.115 1.00 . A A . 18 ASN CB 1 1 6 4096 1 1 18 ASN CG C 0.274 -0.486 9.572 1.00 . A A . 18 ASN CG 1 1 6 4097 1 1 18 ASN H H 2.298 -1.309 6.279 1.00 . A A . 18 ASN H 1 1 6 4098 1 1 18 ASN HA H 0.475 -2.528 8.188 1.00 . A A . 18 ASN HA 1 1 6 4099 1 1 18 ASN HB2 H 1.781 -0.129 8.083 1.00 . A A . 18 ASN HB2 1 1 6 4100 1 1 18 ASN HB3 H 0.153 0.351 7.600 1.00 . A A . 18 ASN HB3 1 1 6 4101 1 1 18 ASN HD21 H 2.116 -0.411 10.308 1.00 . A A . 18 ASN HD21 1 1 6 4102 1 1 18 ASN HD22 H 0.878 -0.531 11.463 1.00 . A A . 18 ASN HD22 1 1 6 4103 1 1 18 ASN N N 1.688 -2.035 6.534 1.00 . A A . 18 ASN N 1 1 6 4104 1 1 18 ASN ND2 N 1.163 -0.475 10.527 1.00 . A A . 18 ASN ND2 1 1 6 4105 1 1 18 ASN O O -1.800 -2.139 7.092 1.00 . A A . 18 ASN O 1 1 6 4106 1 1 18 ASN OD1 O -0.908 -0.565 9.844 1.00 . A A . 18 ASN OD1 1 1 6 4107 1 1 19 TYR C C -2.489 -2.668 4.442 1.00 . A A . 19 TYR C 1 1 6 4108 1 1 19 TYR CA C -1.952 -1.241 4.575 1.00 . A A . 19 TYR CA 1 1 6 4109 1 1 19 TYR CB C -1.658 -0.677 3.179 1.00 . A A . 19 TYR CB 1 1 6 4110 1 1 19 TYR CD1 C -0.552 1.241 4.557 1.00 . A A . 19 TYR CD1 1 1 6 4111 1 1 19 TYR CD2 C -0.057 1.099 2.176 1.00 . A A . 19 TYR CD2 1 1 6 4112 1 1 19 TYR CE1 C 0.278 2.365 4.648 1.00 . A A . 19 TYR CE1 1 1 6 4113 1 1 19 TYR CE2 C 0.767 2.223 2.291 1.00 . A A . 19 TYR CE2 1 1 6 4114 1 1 19 TYR CG C -0.738 0.579 3.305 1.00 . A A . 19 TYR CG 1 1 6 4115 1 1 19 TYR CZ C 0.934 2.853 3.521 1.00 . A A . 19 TYR CZ 1 1 6 4116 1 1 19 TYR H H 0.142 -0.947 5.021 1.00 . A A . 19 TYR H 1 1 6 4117 1 1 19 TYR HA H -2.691 -0.624 5.065 1.00 . A A . 19 TYR HA 1 1 6 4118 1 1 19 TYR HB2 H -1.175 -1.463 2.578 1.00 . A A . 19 TYR HB2 1 1 6 4119 1 1 19 TYR HB3 H -2.612 -0.411 2.702 1.00 . A A . 19 TYR HB3 1 1 6 4120 1 1 19 TYR HD1 H -1.038 0.896 5.450 1.00 . A A . 19 TYR HD1 1 1 6 4121 1 1 19 TYR HD2 H -0.157 0.644 1.223 1.00 . A A . 19 TYR HD2 1 1 6 4122 1 1 19 TYR HE1 H 0.411 2.856 5.599 1.00 . A A . 19 TYR HE1 1 1 6 4123 1 1 19 TYR HE2 H 1.278 2.604 1.418 1.00 . A A . 19 TYR HE2 1 1 6 4124 1 1 19 TYR HH H 1.782 4.219 4.550 1.00 . A A . 19 TYR HH 1 1 6 4125 1 1 19 TYR N N -0.707 -1.271 5.396 1.00 . A A . 19 TYR N 1 1 6 4126 1 1 19 TYR O O -3.647 -2.883 4.145 1.00 . A A . 19 TYR O 1 1 6 4127 1 1 19 TYR OH O 1.748 3.962 3.625 1.00 . A A . 19 TYR OH 1 1 6 4128 1 1 20 CYS C C -2.615 -5.539 5.910 1.00 . A A . 20 CYS C 1 1 6 4129 1 1 20 CYS CA C -2.105 -5.059 4.550 1.00 . A A . 20 CYS CA 1 1 6 4130 1 1 20 CYS CB C -0.931 -5.935 4.106 1.00 . A A . 20 CYS CB 1 1 6 4131 1 1 20 CYS H H -0.721 -3.447 4.900 1.00 . A A . 20 CYS H 1 1 6 4132 1 1 20 CYS HA H -2.900 -5.126 3.823 1.00 . A A . 20 CYS HA 1 1 6 4133 1 1 20 CYS HB2 H -0.002 -5.458 4.381 1.00 . A A . 20 CYS HB2 1 1 6 4134 1 1 20 CYS HB3 H -0.998 -6.899 4.588 1.00 . A A . 20 CYS HB3 1 1 6 4135 1 1 20 CYS N N -1.651 -3.645 4.661 1.00 . A A . 20 CYS N 1 1 6 4136 1 1 20 CYS O O -2.174 -6.545 6.430 1.00 . A A . 20 CYS O 1 1 6 4137 1 1 20 CYS SG S -0.987 -6.153 2.310 1.00 . A A . 20 CYS SG 1 1 6 4138 1 1 21 ASN C C -5.231 -6.233 7.615 1.00 . A A . 21 ASN C 1 1 6 4139 1 1 21 ASN CA C -4.080 -5.244 7.818 1.00 . A A . 21 ASN CA 1 1 6 4140 1 1 21 ASN CB C -4.591 -4.013 8.570 1.00 . A A . 21 ASN CB 1 1 6 4141 1 1 21 ASN CG C -5.115 -4.434 9.944 1.00 . A A . 21 ASN CG 1 1 6 4142 1 1 21 ASN H H -3.883 -4.019 6.055 1.00 . A A . 21 ASN H 1 1 6 4143 1 1 21 ASN HA H -3.297 -5.717 8.392 1.00 . A A . 21 ASN HA 1 1 6 4144 1 1 21 ASN HB2 H -3.784 -3.305 8.692 1.00 . A A . 21 ASN HB2 1 1 6 4145 1 1 21 ASN HB3 H -5.390 -3.553 8.007 1.00 . A A . 21 ASN HB3 1 1 6 4146 1 1 21 ASN HD21 H -3.942 -3.174 10.934 1.00 . A A . 21 ASN HD21 1 1 6 4147 1 1 21 ASN HD22 H -4.962 -4.127 11.900 1.00 . A A . 21 ASN HD22 1 1 6 4148 1 1 21 ASN N N -3.542 -4.828 6.491 1.00 . A A . 21 ASN N 1 1 6 4149 1 1 21 ASN ND2 N -4.633 -3.864 11.015 1.00 . A A . 21 ASN ND2 1 1 6 4150 1 1 21 ASN O O -5.225 -7.260 8.273 1.00 . A A . 21 ASN O 1 1 6 4151 1 1 21 ASN OXT O -6.097 -5.946 6.805 1.00 . A A . 21 ASN OXT 1 1 6 4152 1 1 21 ASN OD1 O -5.972 -5.289 10.044 1.00 . A A . 21 ASN OD1 1 1 6 4153 2 2 1 PHE C C 8.400 1.732 -1.987 1.00 . B B . 22 PHE C 1 1 6 4154 2 2 1 PHE CA C 8.135 0.255 -2.288 1.00 . B B . 22 PHE CA 1 1 6 4155 2 2 1 PHE CB C 9.090 -0.227 -3.382 1.00 . B B . 22 PHE CB 1 1 6 4156 2 2 1 PHE CD1 C 11.043 -1.254 -2.165 1.00 . B B . 22 PHE CD1 1 1 6 4157 2 2 1 PHE CD2 C 9.377 -2.722 -3.144 1.00 . B B . 22 PHE CD2 1 1 6 4158 2 2 1 PHE CE1 C 11.754 -2.369 -1.702 1.00 . B B . 22 PHE CE1 1 1 6 4159 2 2 1 PHE CE2 C 10.088 -3.837 -2.681 1.00 . B B . 22 PHE CE2 1 1 6 4160 2 2 1 PHE CG C 9.855 -1.430 -2.886 1.00 . B B . 22 PHE CG 1 1 6 4161 2 2 1 PHE CZ C 11.276 -3.661 -1.960 1.00 . B B . 22 PHE CZ 1 1 6 4162 2 2 1 PHE H1 H 6.175 -0.393 -2.013 1.00 . B B . 22 PHE H1 1 1 6 4163 2 2 1 PHE H2 H 6.715 -0.480 -3.621 1.00 . B B . 22 PHE H2 1 1 6 4164 2 2 1 PHE H3 H 6.312 1.022 -2.938 1.00 . B B . 22 PHE H3 1 1 6 4165 2 2 1 PHE HA H 8.290 -0.328 -1.393 1.00 . B B . 22 PHE HA 1 1 6 4166 2 2 1 PHE HB2 H 8.524 -0.498 -4.262 1.00 . B B . 22 PHE HB2 1 1 6 4167 2 2 1 PHE HB3 H 9.784 0.563 -3.629 1.00 . B B . 22 PHE HB3 1 1 6 4168 2 2 1 PHE HD1 H 11.411 -0.258 -1.966 1.00 . B B . 22 PHE HD1 1 1 6 4169 2 2 1 PHE HD2 H 8.461 -2.858 -3.700 1.00 . B B . 22 PHE HD2 1 1 6 4170 2 2 1 PHE HE1 H 12.669 -2.232 -1.146 1.00 . B B . 22 PHE HE1 1 1 6 4171 2 2 1 PHE HE2 H 9.719 -4.833 -2.880 1.00 . B B . 22 PHE HE2 1 1 6 4172 2 2 1 PHE HZ H 11.824 -4.520 -1.602 1.00 . B B . 22 PHE HZ 1 1 6 4173 2 2 1 PHE N N 6.728 0.089 -2.750 1.00 . B B . 22 PHE N 1 1 6 4174 2 2 1 PHE O O 7.615 2.594 -2.326 1.00 . B B . 22 PHE O 1 1 6 4175 2 2 2 VAL C C 10.436 4.125 -2.252 1.00 . B B . 23 VAL C 1 1 6 4176 2 2 2 VAL CA C 9.806 3.455 -1.032 1.00 . B B . 23 VAL CA 1 1 6 4177 2 2 2 VAL CB C 10.761 3.520 0.172 1.00 . B B . 23 VAL CB 1 1 6 4178 2 2 2 VAL CG1 C 12.220 3.381 -0.279 1.00 . B B . 23 VAL CG1 1 1 6 4179 2 2 2 VAL CG2 C 10.574 4.850 0.910 1.00 . B B . 23 VAL CG2 1 1 6 4180 2 2 2 VAL H H 10.122 1.324 -1.084 1.00 . B B . 23 VAL H 1 1 6 4181 2 2 2 VAL HA H 8.889 3.968 -0.784 1.00 . B B . 23 VAL HA 1 1 6 4182 2 2 2 VAL HB H 10.529 2.715 0.840 1.00 . B B . 23 VAL HB 1 1 6 4183 2 2 2 VAL HG11 H 12.490 4.220 -0.901 1.00 . B B . 23 VAL HG11 1 1 6 4184 2 2 2 VAL HG12 H 12.338 2.466 -0.840 1.00 . B B . 23 VAL HG12 1 1 6 4185 2 2 2 VAL HG13 H 12.864 3.356 0.588 1.00 . B B . 23 VAL HG13 1 1 6 4186 2 2 2 VAL HG21 H 9.759 5.399 0.461 1.00 . B B . 23 VAL HG21 1 1 6 4187 2 2 2 VAL HG22 H 11.481 5.431 0.841 1.00 . B B . 23 VAL HG22 1 1 6 4188 2 2 2 VAL HG23 H 10.349 4.657 1.949 1.00 . B B . 23 VAL HG23 1 1 6 4189 2 2 2 VAL N N 9.500 2.032 -1.351 1.00 . B B . 23 VAL N 1 1 6 4190 2 2 2 VAL O O 10.408 3.604 -3.349 1.00 . B B . 23 VAL O 1 1 6 4191 2 2 3 ASN C C 10.687 5.978 -4.402 1.00 . B B . 24 ASN C 1 1 6 4192 2 2 3 ASN CA C 11.634 5.998 -3.201 1.00 . B B . 24 ASN CA 1 1 6 4193 2 2 3 ASN CB C 12.950 5.310 -3.575 1.00 . B B . 24 ASN CB 1 1 6 4194 2 2 3 ASN CG C 13.985 6.369 -3.960 1.00 . B B . 24 ASN CG 1 1 6 4195 2 2 3 ASN H H 11.006 5.669 -1.167 1.00 . B B . 24 ASN H 1 1 6 4196 2 2 3 ASN HA H 11.830 7.020 -2.915 1.00 . B B . 24 ASN HA 1 1 6 4197 2 2 3 ASN HB2 H 13.311 4.741 -2.730 1.00 . B B . 24 ASN HB2 1 1 6 4198 2 2 3 ASN HB3 H 12.786 4.648 -4.412 1.00 . B B . 24 ASN HB3 1 1 6 4199 2 2 3 ASN HD21 H 14.604 5.389 -5.573 1.00 . B B . 24 ASN HD21 1 1 6 4200 2 2 3 ASN HD22 H 15.381 6.869 -5.280 1.00 . B B . 24 ASN HD22 1 1 6 4201 2 2 3 ASN N N 11.000 5.278 -2.062 1.00 . B B . 24 ASN N 1 1 6 4202 2 2 3 ASN ND2 N 14.718 6.194 -5.026 1.00 . B B . 24 ASN ND2 1 1 6 4203 2 2 3 ASN O O 11.106 5.831 -5.533 1.00 . B B . 24 ASN O 1 1 6 4204 2 2 3 ASN OD1 O 14.129 7.367 -3.282 1.00 . B B . 24 ASN OD1 1 1 6 4205 2 2 4 GLN C C 7.137 6.789 -4.873 1.00 . B B . 25 GLN C 1 1 6 4206 2 2 4 GLN CA C 8.441 6.108 -5.297 1.00 . B B . 25 GLN CA 1 1 6 4207 2 2 4 GLN CB C 8.151 4.660 -5.698 1.00 . B B . 25 GLN CB 1 1 6 4208 2 2 4 GLN CD C 9.644 3.352 -7.217 1.00 . B B . 25 GLN CD 1 1 6 4209 2 2 4 GLN CG C 8.570 4.440 -7.153 1.00 . B B . 25 GLN CG 1 1 6 4210 2 2 4 GLN H H 9.092 6.237 -3.247 1.00 . B B . 25 GLN H 1 1 6 4211 2 2 4 GLN HA H 8.864 6.635 -6.139 1.00 . B B . 25 GLN HA 1 1 6 4212 2 2 4 GLN HB2 H 8.707 3.991 -5.057 1.00 . B B . 25 GLN HB2 1 1 6 4213 2 2 4 GLN HB3 H 7.095 4.464 -5.596 1.00 . B B . 25 GLN HB3 1 1 6 4214 2 2 4 GLN HE21 H 8.425 1.914 -6.592 1.00 . B B . 25 GLN HE21 1 1 6 4215 2 2 4 GLN HE22 H 10.017 1.425 -6.920 1.00 . B B . 25 GLN HE22 1 1 6 4216 2 2 4 GLN HG2 H 7.711 4.134 -7.732 1.00 . B B . 25 GLN HG2 1 1 6 4217 2 2 4 GLN HG3 H 8.968 5.359 -7.556 1.00 . B B . 25 GLN HG3 1 1 6 4218 2 2 4 GLN N N 9.411 6.122 -4.166 1.00 . B B . 25 GLN N 1 1 6 4219 2 2 4 GLN NE2 N 9.336 2.128 -6.882 1.00 . B B . 25 GLN NE2 1 1 6 4220 2 2 4 GLN O O 6.919 7.070 -3.710 1.00 . B B . 25 GLN O 1 1 6 4221 2 2 4 GLN OE1 O 10.773 3.617 -7.577 1.00 . B B . 25 GLN OE1 1 1 6 4222 2 2 5 HIS C C 3.844 6.839 -6.031 1.00 . B B . 26 HIS C 1 1 6 4223 2 2 5 HIS CA C 4.972 7.713 -5.472 1.00 . B B . 26 HIS CA 1 1 6 4224 2 2 5 HIS CB C 4.932 9.095 -6.127 1.00 . B B . 26 HIS CB 1 1 6 4225 2 2 5 HIS CD2 C 3.431 11.051 -5.250 1.00 . B B . 26 HIS CD2 1 1 6 4226 2 2 5 HIS CE1 C 4.324 11.225 -3.276 1.00 . B B . 26 HIS CE1 1 1 6 4227 2 2 5 HIS CG C 4.414 10.106 -5.145 1.00 . B B . 26 HIS CG 1 1 6 4228 2 2 5 HIS H H 6.463 6.817 -6.741 1.00 . B B . 26 HIS H 1 1 6 4229 2 2 5 HIS HA H 4.873 7.807 -4.400 1.00 . B B . 26 HIS HA 1 1 6 4230 2 2 5 HIS HB2 H 5.927 9.375 -6.440 1.00 . B B . 26 HIS HB2 1 1 6 4231 2 2 5 HIS HB3 H 4.279 9.065 -6.987 1.00 . B B . 26 HIS HB3 1 1 6 4232 2 2 5 HIS HD2 H 2.806 11.217 -6.115 1.00 . B B . 26 HIS HD2 1 1 6 4233 2 2 5 HIS HE1 H 4.544 11.563 -2.274 1.00 . B B . 26 HIS HE1 1 1 6 4234 2 2 5 HIS HE2 H 2.767 12.498 -3.849 1.00 . B B . 26 HIS HE2 1 1 6 4235 2 2 5 HIS N N 6.266 7.054 -5.811 1.00 . B B . 26 HIS N 1 1 6 4236 2 2 5 HIS ND1 N 4.969 10.226 -3.890 1.00 . B B . 26 HIS ND1 1 1 6 4237 2 2 5 HIS NE2 N 3.374 11.761 -4.069 1.00 . B B . 26 HIS NE2 1 1 6 4238 2 2 5 HIS O O 4.099 5.885 -6.738 1.00 . B B . 26 HIS O 1 1 6 4239 2 2 6 LEU C C 0.152 6.947 -6.225 1.00 . B B . 27 LEU C 1 1 6 4240 2 2 6 LEU CA C 1.520 6.249 -6.272 1.00 . B B . 27 LEU CA 1 1 6 4241 2 2 6 LEU CB C 1.466 4.953 -5.460 1.00 . B B . 27 LEU CB 1 1 6 4242 2 2 6 LEU CD1 C 0.950 6.099 -3.301 1.00 . B B . 27 LEU CD1 1 1 6 4243 2 2 6 LEU CD2 C 2.096 3.882 -3.309 1.00 . B B . 27 LEU CD2 1 1 6 4244 2 2 6 LEU CG C 1.957 5.214 -4.037 1.00 . B B . 27 LEU CG 1 1 6 4245 2 2 6 LEU H H 2.390 7.884 -5.148 1.00 . B B . 27 LEU H 1 1 6 4246 2 2 6 LEU HA H 1.753 6.006 -7.298 1.00 . B B . 27 LEU HA 1 1 6 4247 2 2 6 LEU HB2 H 0.452 4.588 -5.427 1.00 . B B . 27 LEU HB2 1 1 6 4248 2 2 6 LEU HB3 H 2.099 4.212 -5.924 1.00 . B B . 27 LEU HB3 1 1 6 4249 2 2 6 LEU HD11 H 0.129 6.337 -3.961 1.00 . B B . 27 LEU HD11 1 1 6 4250 2 2 6 LEU HD12 H 1.436 7.012 -2.987 1.00 . B B . 27 LEU HD12 1 1 6 4251 2 2 6 LEU HD13 H 0.575 5.575 -2.435 1.00 . B B . 27 LEU HD13 1 1 6 4252 2 2 6 LEU HD21 H 1.431 3.158 -3.757 1.00 . B B . 27 LEU HD21 1 1 6 4253 2 2 6 LEU HD22 H 1.841 4.013 -2.270 1.00 . B B . 27 LEU HD22 1 1 6 4254 2 2 6 LEU HD23 H 3.115 3.534 -3.391 1.00 . B B . 27 LEU HD23 1 1 6 4255 2 2 6 LEU HG H 2.916 5.710 -4.072 1.00 . B B . 27 LEU HG 1 1 6 4256 2 2 6 LEU N N 2.604 7.123 -5.727 1.00 . B B . 27 LEU N 1 1 6 4257 2 2 6 LEU O O 0.060 8.132 -6.025 1.00 . B B . 27 LEU O 1 1 6 4258 2 2 7 CYS C C -3.159 5.823 -7.351 1.00 . B B . 28 CYS C 1 1 6 4259 2 2 7 CYS CA C -2.307 6.694 -6.428 1.00 . B B . 28 CYS CA 1 1 6 4260 2 2 7 CYS CB C -2.406 8.160 -6.883 1.00 . B B . 28 CYS CB 1 1 6 4261 2 2 7 CYS H H -0.754 5.229 -6.591 1.00 . B B . 28 CYS H 1 1 6 4262 2 2 7 CYS HA H -2.700 6.615 -5.423 1.00 . B B . 28 CYS HA 1 1 6 4263 2 2 7 CYS HB2 H -1.468 8.475 -7.311 1.00 . B B . 28 CYS HB2 1 1 6 4264 2 2 7 CYS HB3 H -3.184 8.249 -7.627 1.00 . B B . 28 CYS HB3 1 1 6 4265 2 2 7 CYS N N -0.896 6.181 -6.426 1.00 . B B . 28 CYS N 1 1 6 4266 2 2 7 CYS O O -2.666 5.211 -8.279 1.00 . B B . 28 CYS O 1 1 6 4267 2 2 7 CYS SG S -2.816 9.206 -5.457 1.00 . B B . 28 CYS SG 1 1 6 4268 2 2 8 GLY C C -4.691 3.567 -8.220 1.00 . B B . 29 GLY C 1 1 6 4269 2 2 8 GLY CA C -5.333 4.930 -7.953 1.00 . B B . 29 GLY CA 1 1 6 4270 2 2 8 GLY H H -4.811 6.260 -6.343 1.00 . B B . 29 GLY H 1 1 6 4271 2 2 8 GLY HA2 H -6.279 4.789 -7.449 1.00 . B B . 29 GLY HA2 1 1 6 4272 2 2 8 GLY HA3 H -5.500 5.434 -8.893 1.00 . B B . 29 GLY HA3 1 1 6 4273 2 2 8 GLY N N -4.438 5.759 -7.099 1.00 . B B . 29 GLY N 1 1 6 4274 2 2 8 GLY O O -4.459 2.786 -7.317 1.00 . B B . 29 GLY O 1 1 6 4275 2 2 9 SER C C -2.443 1.810 -9.111 1.00 . B B . 30 SER C 1 1 6 4276 2 2 9 SER CA C -3.801 1.959 -9.803 1.00 . B B . 30 SER CA 1 1 6 4277 2 2 9 SER CB C -3.611 1.876 -11.318 1.00 . B B . 30 SER CB 1 1 6 4278 2 2 9 SER H H -4.619 3.915 -10.171 1.00 . B B . 30 SER H 1 1 6 4279 2 2 9 SER HA H -4.457 1.163 -9.479 1.00 . B B . 30 SER HA 1 1 6 4280 2 2 9 SER HB2 H -3.662 2.865 -11.742 1.00 . B B . 30 SER HB2 1 1 6 4281 2 2 9 SER HB3 H -2.644 1.443 -11.536 1.00 . B B . 30 SER HB3 1 1 6 4282 2 2 9 SER HG H -4.394 0.153 -11.766 1.00 . B B . 30 SER HG 1 1 6 4283 2 2 9 SER N N -4.414 3.273 -9.460 1.00 . B B . 30 SER N 1 1 6 4284 2 2 9 SER O O -2.218 0.873 -8.372 1.00 . B B . 30 SER O 1 1 6 4285 2 2 9 SER OG O -4.642 1.073 -11.878 1.00 . B B . 30 SER OG 1 1 6 4286 2 2 10 ASP C C -0.345 2.199 -7.249 1.00 . B B . 31 ASP C 1 1 6 4287 2 2 10 ASP CA C -0.188 2.612 -8.712 1.00 . B B . 31 ASP CA 1 1 6 4288 2 2 10 ASP CB C 0.530 3.960 -8.785 1.00 . B B . 31 ASP CB 1 1 6 4289 2 2 10 ASP CG C 0.410 4.525 -10.202 1.00 . B B . 31 ASP CG 1 1 6 4290 2 2 10 ASP H H -1.731 3.461 -9.958 1.00 . B B . 31 ASP H 1 1 6 4291 2 2 10 ASP HA H 0.397 1.867 -9.231 1.00 . B B . 31 ASP HA 1 1 6 4292 2 2 10 ASP HB2 H 0.083 4.645 -8.082 1.00 . B B . 31 ASP HB2 1 1 6 4293 2 2 10 ASP HB3 H 1.573 3.826 -8.539 1.00 . B B . 31 ASP HB3 1 1 6 4294 2 2 10 ASP N N -1.533 2.717 -9.352 1.00 . B B . 31 ASP N 1 1 6 4295 2 2 10 ASP O O 0.495 1.518 -6.695 1.00 . B B . 31 ASP O 1 1 6 4296 2 2 10 ASP OD1 O 0.474 3.744 -11.137 1.00 . B B . 31 ASP OD1 1 1 6 4297 2 2 10 ASP OD2 O 0.256 5.729 -10.327 1.00 . B B . 31 ASP OD2 1 1 6 4298 2 2 11 LEU C C -1.911 0.707 -5.131 1.00 . B B . 32 LEU C 1 1 6 4299 2 2 11 LEU CA C -1.614 2.205 -5.197 1.00 . B B . 32 LEU CA 1 1 6 4300 2 2 11 LEU CB C -2.784 2.993 -4.602 1.00 . B B . 32 LEU CB 1 1 6 4301 2 2 11 LEU CD1 C -1.530 4.771 -3.376 1.00 . B B . 32 LEU CD1 1 1 6 4302 2 2 11 LEU CD2 C -3.662 3.880 -2.437 1.00 . B B . 32 LEU CD2 1 1 6 4303 2 2 11 LEU CG C -2.397 3.522 -3.220 1.00 . B B . 32 LEU CG 1 1 6 4304 2 2 11 LEU H H -2.089 3.137 -7.080 1.00 . B B . 32 LEU H 1 1 6 4305 2 2 11 LEU HA H -0.713 2.414 -4.640 1.00 . B B . 32 LEU HA 1 1 6 4306 2 2 11 LEU HB2 H -3.024 3.823 -5.251 1.00 . B B . 32 LEU HB2 1 1 6 4307 2 2 11 LEU HB3 H -3.644 2.347 -4.510 1.00 . B B . 32 LEU HB3 1 1 6 4308 2 2 11 LEU HD11 H -1.242 5.134 -2.401 1.00 . B B . 32 LEU HD11 1 1 6 4309 2 2 11 LEU HD12 H -2.090 5.535 -3.895 1.00 . B B . 32 LEU HD12 1 1 6 4310 2 2 11 LEU HD13 H -0.647 4.525 -3.943 1.00 . B B . 32 LEU HD13 1 1 6 4311 2 2 11 LEU HD21 H -4.236 4.605 -2.995 1.00 . B B . 32 LEU HD21 1 1 6 4312 2 2 11 LEU HD22 H -3.386 4.299 -1.480 1.00 . B B . 32 LEU HD22 1 1 6 4313 2 2 11 LEU HD23 H -4.255 2.992 -2.284 1.00 . B B . 32 LEU HD23 1 1 6 4314 2 2 11 LEU HG H -1.843 2.763 -2.687 1.00 . B B . 32 LEU HG 1 1 6 4315 2 2 11 LEU N N -1.416 2.594 -6.619 1.00 . B B . 32 LEU N 1 1 6 4316 2 2 11 LEU O O -1.109 -0.071 -4.653 1.00 . B B . 32 LEU O 1 1 6 4317 2 2 12 VAL C C -2.205 -1.937 -6.198 1.00 . B B . 33 VAL C 1 1 6 4318 2 2 12 VAL CA C -3.369 -1.164 -5.584 1.00 . B B . 33 VAL CA 1 1 6 4319 2 2 12 VAL CB C -4.635 -1.430 -6.399 1.00 . B B . 33 VAL CB 1 1 6 4320 2 2 12 VAL CG1 C -5.800 -0.649 -5.799 1.00 . B B . 33 VAL CG1 1 1 6 4321 2 2 12 VAL CG2 C -4.415 -0.981 -7.845 1.00 . B B . 33 VAL CG2 1 1 6 4322 2 2 12 VAL H H -3.681 0.927 -6.008 1.00 . B B . 33 VAL H 1 1 6 4323 2 2 12 VAL HA H -3.517 -1.481 -4.560 1.00 . B B . 33 VAL HA 1 1 6 4324 2 2 12 VAL HB H -4.861 -2.487 -6.378 1.00 . B B . 33 VAL HB 1 1 6 4325 2 2 12 VAL HG11 H -5.989 0.228 -6.400 1.00 . B B . 33 VAL HG11 1 1 6 4326 2 2 12 VAL HG12 H -5.551 -0.351 -4.792 1.00 . B B . 33 VAL HG12 1 1 6 4327 2 2 12 VAL HG13 H -6.680 -1.274 -5.785 1.00 . B B . 33 VAL HG13 1 1 6 4328 2 2 12 VAL HG21 H -3.543 -1.473 -8.246 1.00 . B B . 33 VAL HG21 1 1 6 4329 2 2 12 VAL HG22 H -4.269 0.089 -7.871 1.00 . B B . 33 VAL HG22 1 1 6 4330 2 2 12 VAL HG23 H -5.280 -1.240 -8.438 1.00 . B B . 33 VAL HG23 1 1 6 4331 2 2 12 VAL N N -3.048 0.290 -5.617 1.00 . B B . 33 VAL N 1 1 6 4332 2 2 12 VAL O O -1.874 -3.027 -5.775 1.00 . B B . 33 VAL O 1 1 6 4333 2 2 13 GLU C C 0.746 -2.089 -6.856 1.00 . B B . 34 GLU C 1 1 6 4334 2 2 13 GLU CA C -0.429 -2.069 -7.832 1.00 . B B . 34 GLU CA 1 1 6 4335 2 2 13 GLU CB C -0.034 -1.325 -9.108 1.00 . B B . 34 GLU CB 1 1 6 4336 2 2 13 GLU CD C 0.075 -1.560 -11.594 1.00 . B B . 34 GLU CD 1 1 6 4337 2 2 13 GLU CG C -0.615 -2.054 -10.322 1.00 . B B . 34 GLU CG 1 1 6 4338 2 2 13 GLU H H -1.856 -0.494 -7.517 1.00 . B B . 34 GLU H 1 1 6 4339 2 2 13 GLU HA H -0.712 -3.082 -8.076 1.00 . B B . 34 GLU HA 1 1 6 4340 2 2 13 GLU HB2 H -0.424 -0.318 -9.072 1.00 . B B . 34 GLU HB2 1 1 6 4341 2 2 13 GLU HB3 H 1.040 -1.293 -9.189 1.00 . B B . 34 GLU HB3 1 1 6 4342 2 2 13 GLU HG2 H -0.455 -3.117 -10.213 1.00 . B B . 34 GLU HG2 1 1 6 4343 2 2 13 GLU HG3 H -1.674 -1.854 -10.389 1.00 . B B . 34 GLU HG3 1 1 6 4344 2 2 13 GLU N N -1.576 -1.375 -7.193 1.00 . B B . 34 GLU N 1 1 6 4345 2 2 13 GLU O O 1.296 -3.130 -6.557 1.00 . B B . 34 GLU O 1 1 6 4346 2 2 13 GLU OE1 O -0.135 -0.413 -11.952 1.00 . B B . 34 GLU OE1 1 1 6 4347 2 2 13 GLU OE2 O 0.802 -2.339 -12.189 1.00 . B B . 34 GLU OE2 1 1 6 4348 2 2 14 ALA C C 1.848 -1.731 -4.138 1.00 . B B . 35 ALA C 1 1 6 4349 2 2 14 ALA CA C 2.253 -0.923 -5.368 1.00 . B B . 35 ALA CA 1 1 6 4350 2 2 14 ALA CB C 2.547 0.522 -4.958 1.00 . B B . 35 ALA CB 1 1 6 4351 2 2 14 ALA H H 0.661 -0.120 -6.577 1.00 . B B . 35 ALA H 1 1 6 4352 2 2 14 ALA HA H 3.131 -1.361 -5.820 1.00 . B B . 35 ALA HA 1 1 6 4353 2 2 14 ALA HB1 H 2.816 1.096 -5.832 1.00 . B B . 35 ALA HB1 1 1 6 4354 2 2 14 ALA HB2 H 3.364 0.537 -4.252 1.00 . B B . 35 ALA HB2 1 1 6 4355 2 2 14 ALA HB3 H 1.668 0.952 -4.501 1.00 . B B . 35 ALA HB3 1 1 6 4356 2 2 14 ALA N N 1.126 -0.951 -6.338 1.00 . B B . 35 ALA N 1 1 6 4357 2 2 14 ALA O O 2.612 -2.515 -3.610 1.00 . B B . 35 ALA O 1 1 6 4358 2 2 15 LEU C C 0.216 -3.805 -2.823 1.00 . B B . 36 LEU C 1 1 6 4359 2 2 15 LEU CA C 0.153 -2.313 -2.507 1.00 . B B . 36 LEU CA 1 1 6 4360 2 2 15 LEU CB C -1.302 -1.919 -2.226 1.00 . B B . 36 LEU CB 1 1 6 4361 2 2 15 LEU CD1 C -1.199 -1.123 0.130 1.00 . B B . 36 LEU CD1 1 1 6 4362 2 2 15 LEU CD2 C -0.234 0.294 -1.687 1.00 . B B . 36 LEU CD2 1 1 6 4363 2 2 15 LEU CG C -1.358 -0.684 -1.322 1.00 . B B . 36 LEU CG 1 1 6 4364 2 2 15 LEU H H 0.038 -0.925 -4.145 1.00 . B B . 36 LEU H 1 1 6 4365 2 2 15 LEU HA H 0.767 -2.090 -1.649 1.00 . B B . 36 LEU HA 1 1 6 4366 2 2 15 LEU HB2 H -1.801 -1.702 -3.160 1.00 . B B . 36 LEU HB2 1 1 6 4367 2 2 15 LEU HB3 H -1.805 -2.741 -1.737 1.00 . B B . 36 LEU HB3 1 1 6 4368 2 2 15 LEU HD11 H -1.732 -0.439 0.773 1.00 . B B . 36 LEU HD11 1 1 6 4369 2 2 15 LEU HD12 H -0.152 -1.126 0.393 1.00 . B B . 36 LEU HD12 1 1 6 4370 2 2 15 LEU HD13 H -1.604 -2.118 0.249 1.00 . B B . 36 LEU HD13 1 1 6 4371 2 2 15 LEU HD21 H 0.722 -0.190 -1.553 1.00 . B B . 36 LEU HD21 1 1 6 4372 2 2 15 LEU HD22 H -0.290 1.163 -1.047 1.00 . B B . 36 LEU HD22 1 1 6 4373 2 2 15 LEU HD23 H -0.342 0.599 -2.718 1.00 . B B . 36 LEU HD23 1 1 6 4374 2 2 15 LEU HG H -2.315 -0.196 -1.444 1.00 . B B . 36 LEU HG 1 1 6 4375 2 2 15 LEU N N 0.637 -1.554 -3.691 1.00 . B B . 36 LEU N 1 1 6 4376 2 2 15 LEU O O 0.407 -4.638 -1.957 1.00 . B B . 36 LEU O 1 1 6 4377 2 2 16 TYR C C 1.527 -6.064 -4.532 1.00 . B B . 37 TYR C 1 1 6 4378 2 2 16 TYR CA C 0.079 -5.571 -4.476 1.00 . B B . 37 TYR CA 1 1 6 4379 2 2 16 TYR CB C -0.568 -5.718 -5.855 1.00 . B B . 37 TYR CB 1 1 6 4380 2 2 16 TYR CD1 C -0.528 -8.286 -5.601 1.00 . B B . 37 TYR CD1 1 1 6 4381 2 2 16 TYR CD2 C 0.256 -7.325 -7.696 1.00 . B B . 37 TYR CD2 1 1 6 4382 2 2 16 TYR CE1 C -0.255 -9.568 -6.098 1.00 . B B . 37 TYR CE1 1 1 6 4383 2 2 16 TYR CE2 C 0.523 -8.613 -8.177 1.00 . B B . 37 TYR CE2 1 1 6 4384 2 2 16 TYR CG C -0.276 -7.139 -6.399 1.00 . B B . 37 TYR CG 1 1 6 4385 2 2 16 TYR CZ C 0.267 -9.730 -7.381 1.00 . B B . 37 TYR CZ 1 1 6 4386 2 2 16 TYR H H -0.107 -3.444 -4.739 1.00 . B B . 37 TYR H 1 1 6 4387 2 2 16 TYR HA H -0.471 -6.160 -3.758 1.00 . B B . 37 TYR HA 1 1 6 4388 2 2 16 TYR HB2 H -1.642 -5.548 -5.760 1.00 . B B . 37 TYR HB2 1 1 6 4389 2 2 16 TYR HB3 H -0.159 -4.962 -6.522 1.00 . B B . 37 TYR HB3 1 1 6 4390 2 2 16 TYR HD1 H -0.923 -8.192 -4.607 1.00 . B B . 37 TYR HD1 1 1 6 4391 2 2 16 TYR HD2 H 0.464 -6.486 -8.326 1.00 . B B . 37 TYR HD2 1 1 6 4392 2 2 16 TYR HE1 H -0.451 -10.435 -5.484 1.00 . B B . 37 TYR HE1 1 1 6 4393 2 2 16 TYR HE2 H 0.929 -8.743 -9.169 1.00 . B B . 37 TYR HE2 1 1 6 4394 2 2 16 TYR HH H -0.169 -11.579 -7.574 1.00 . B B . 37 TYR HH 1 1 6 4395 2 2 16 TYR N N 0.047 -4.141 -4.069 1.00 . B B . 37 TYR N 1 1 6 4396 2 2 16 TYR O O 1.785 -7.250 -4.581 1.00 . B B . 37 TYR O 1 1 6 4397 2 2 16 TYR OH O 0.535 -10.995 -7.864 1.00 . B B . 37 TYR OH 1 1 6 4398 2 2 17 LEU C C 4.376 -5.837 -3.121 1.00 . B B . 38 LEU C 1 1 6 4399 2 2 17 LEU CA C 3.901 -5.600 -4.551 1.00 . B B . 38 LEU CA 1 1 6 4400 2 2 17 LEU CB C 4.780 -4.524 -5.199 1.00 . B B . 38 LEU CB 1 1 6 4401 2 2 17 LEU CD1 C 4.850 -2.602 -6.787 1.00 . B B . 38 LEU CD1 1 1 6 4402 2 2 17 LEU CD2 C 3.333 -4.528 -7.238 1.00 . B B . 38 LEU CD2 1 1 6 4403 2 2 17 LEU CG C 3.949 -3.658 -6.144 1.00 . B B . 38 LEU CG 1 1 6 4404 2 2 17 LEU H H 2.247 -4.217 -4.460 1.00 . B B . 38 LEU H 1 1 6 4405 2 2 17 LEU HA H 3.981 -6.517 -5.112 1.00 . B B . 38 LEU HA 1 1 6 4406 2 2 17 LEU HB2 H 5.208 -3.901 -4.427 1.00 . B B . 38 LEU HB2 1 1 6 4407 2 2 17 LEU HB3 H 5.574 -4.999 -5.756 1.00 . B B . 38 LEU HB3 1 1 6 4408 2 2 17 LEU HD11 H 5.699 -3.086 -7.248 1.00 . B B . 38 LEU HD11 1 1 6 4409 2 2 17 LEU HD12 H 5.197 -1.915 -6.029 1.00 . B B . 38 LEU HD12 1 1 6 4410 2 2 17 LEU HD13 H 4.293 -2.060 -7.537 1.00 . B B . 38 LEU HD13 1 1 6 4411 2 2 17 LEU HD21 H 2.690 -5.269 -6.788 1.00 . B B . 38 LEU HD21 1 1 6 4412 2 2 17 LEU HD22 H 4.119 -5.019 -7.791 1.00 . B B . 38 LEU HD22 1 1 6 4413 2 2 17 LEU HD23 H 2.754 -3.907 -7.906 1.00 . B B . 38 LEU HD23 1 1 6 4414 2 2 17 LEU HG H 3.168 -3.171 -5.587 1.00 . B B . 38 LEU HG 1 1 6 4415 2 2 17 LEU N N 2.474 -5.167 -4.513 1.00 . B B . 38 LEU N 1 1 6 4416 2 2 17 LEU O O 4.877 -6.892 -2.786 1.00 . B B . 38 LEU O 1 1 6 4417 2 2 18 VAL C C 3.974 -6.284 -0.289 1.00 . B B . 39 VAL C 1 1 6 4418 2 2 18 VAL CA C 4.640 -5.030 -0.859 1.00 . B B . 39 VAL CA 1 1 6 4419 2 2 18 VAL CB C 4.217 -3.796 -0.052 1.00 . B B . 39 VAL CB 1 1 6 4420 2 2 18 VAL CG1 C 4.468 -2.536 -0.882 1.00 . B B . 39 VAL CG1 1 1 6 4421 2 2 18 VAL CG2 C 2.727 -3.882 0.290 1.00 . B B . 39 VAL CG2 1 1 6 4422 2 2 18 VAL H H 3.798 -4.022 -2.562 1.00 . B B . 39 VAL H 1 1 6 4423 2 2 18 VAL HA H 5.714 -5.140 -0.818 1.00 . B B . 39 VAL HA 1 1 6 4424 2 2 18 VAL HB H 4.795 -3.746 0.858 1.00 . B B . 39 VAL HB 1 1 6 4425 2 2 18 VAL HG11 H 4.718 -1.716 -0.225 1.00 . B B . 39 VAL HG11 1 1 6 4426 2 2 18 VAL HG12 H 3.576 -2.290 -1.440 1.00 . B B . 39 VAL HG12 1 1 6 4427 2 2 18 VAL HG13 H 5.284 -2.711 -1.567 1.00 . B B . 39 VAL HG13 1 1 6 4428 2 2 18 VAL HG21 H 2.449 -3.038 0.902 1.00 . B B . 39 VAL HG21 1 1 6 4429 2 2 18 VAL HG22 H 2.534 -4.797 0.830 1.00 . B B . 39 VAL HG22 1 1 6 4430 2 2 18 VAL HG23 H 2.148 -3.872 -0.622 1.00 . B B . 39 VAL HG23 1 1 6 4431 2 2 18 VAL N N 4.212 -4.862 -2.271 1.00 . B B . 39 VAL N 1 1 6 4432 2 2 18 VAL O O 4.483 -6.917 0.615 1.00 . B B . 39 VAL O 1 1 6 4433 2 2 19 CYS C C 1.973 -8.866 -1.452 1.00 . B B . 40 CYS C 1 1 6 4434 2 2 19 CYS CA C 2.128 -7.854 -0.314 1.00 . B B . 40 CYS CA 1 1 6 4435 2 2 19 CYS CB C 0.745 -7.456 0.204 1.00 . B B . 40 CYS CB 1 1 6 4436 2 2 19 CYS H H 2.445 -6.118 -1.545 1.00 . B B . 40 CYS H 1 1 6 4437 2 2 19 CYS HA H 2.698 -8.298 0.489 1.00 . B B . 40 CYS HA 1 1 6 4438 2 2 19 CYS HB2 H 0.280 -6.780 -0.498 1.00 . B B . 40 CYS HB2 1 1 6 4439 2 2 19 CYS HB3 H 0.134 -8.340 0.311 1.00 . B B . 40 CYS HB3 1 1 6 4440 2 2 19 CYS N N 2.835 -6.644 -0.816 1.00 . B B . 40 CYS N 1 1 6 4441 2 2 19 CYS O O 0.985 -9.568 -1.540 1.00 . B B . 40 CYS O 1 1 6 4442 2 2 19 CYS SG S 0.909 -6.637 1.809 1.00 . B B . 40 CYS SG 1 1 6 4443 2 2 20 GLY C C 3.176 -11.328 -2.953 1.00 . B B . 41 GLY C 1 1 6 4444 2 2 20 GLY CA C 2.847 -9.919 -3.454 1.00 . B B . 41 GLY CA 1 1 6 4445 2 2 20 GLY H H 3.730 -8.378 -2.237 1.00 . B B . 41 GLY H 1 1 6 4446 2 2 20 GLY HA2 H 1.844 -9.903 -3.857 1.00 . B B . 41 GLY HA2 1 1 6 4447 2 2 20 GLY HA3 H 3.549 -9.643 -4.225 1.00 . B B . 41 GLY HA3 1 1 6 4448 2 2 20 GLY N N 2.942 -8.951 -2.324 1.00 . B B . 41 GLY N 1 1 6 4449 2 2 20 GLY O O 3.996 -12.023 -3.519 1.00 . B B . 41 GLY O 1 1 6 4450 2 2 21 GLU C C 1.814 -13.434 -0.243 1.00 . B B . 42 GLU C 1 1 6 4451 2 2 21 GLU CA C 2.809 -13.119 -1.361 1.00 . B B . 42 GLU CA 1 1 6 4452 2 2 21 GLU CB C 4.242 -13.184 -0.817 1.00 . B B . 42 GLU CB 1 1 6 4453 2 2 21 GLU CD C 5.776 -12.354 0.974 1.00 . B B . 42 GLU CD 1 1 6 4454 2 2 21 GLU CG C 4.315 -12.475 0.538 1.00 . B B . 42 GLU CG 1 1 6 4455 2 2 21 GLU H H 1.879 -11.179 -1.460 1.00 . B B . 42 GLU H 1 1 6 4456 2 2 21 GLU HA H 2.693 -13.840 -2.151 1.00 . B B . 42 GLU HA 1 1 6 4457 2 2 21 GLU HB2 H 4.534 -14.217 -0.699 1.00 . B B . 42 GLU HB2 1 1 6 4458 2 2 21 GLU HB3 H 4.911 -12.698 -1.511 1.00 . B B . 42 GLU HB3 1 1 6 4459 2 2 21 GLU HG2 H 3.881 -11.490 0.451 1.00 . B B . 42 GLU HG2 1 1 6 4460 2 2 21 GLU HG3 H 3.768 -13.047 1.272 1.00 . B B . 42 GLU HG3 1 1 6 4461 2 2 21 GLU N N 2.538 -11.755 -1.898 1.00 . B B . 42 GLU N 1 1 6 4462 2 2 21 GLU O O 1.387 -14.559 -0.073 1.00 . B B . 42 GLU O 1 1 6 4463 2 2 21 GLU OE1 O 6.641 -12.502 0.127 1.00 . B B . 42 GLU OE1 1 1 6 4464 2 2 21 GLU OE2 O 6.005 -12.117 2.149 1.00 . B B . 42 GLU OE2 1 1 6 4465 2 2 22 ARG C C -0.947 -12.404 1.121 1.00 . B B . 43 ARG C 1 1 6 4466 2 2 22 ARG CA C 0.473 -12.670 1.626 1.00 . B B . 43 ARG CA 1 1 6 4467 2 2 22 ARG CB C 0.791 -11.718 2.781 1.00 . B B . 43 ARG CB 1 1 6 4468 2 2 22 ARG CD C 0.177 -11.425 5.188 1.00 . B B . 43 ARG CD 1 1 6 4469 2 2 22 ARG CG C -0.361 -11.733 3.789 1.00 . B B . 43 ARG CG 1 1 6 4470 2 2 22 ARG CZ C -0.744 -12.703 7.028 1.00 . B B . 43 ARG CZ 1 1 6 4471 2 2 22 ARG H H 1.801 -11.550 0.352 1.00 . B B . 43 ARG H 1 1 6 4472 2 2 22 ARG HA H 0.548 -13.691 1.969 1.00 . B B . 43 ARG HA 1 1 6 4473 2 2 22 ARG HB2 H 1.702 -12.034 3.268 1.00 . B B . 43 ARG HB2 1 1 6 4474 2 2 22 ARG HB3 H 0.917 -10.716 2.398 1.00 . B B . 43 ARG HB3 1 1 6 4475 2 2 22 ARG HD2 H 1.039 -12.046 5.387 1.00 . B B . 43 ARG HD2 1 1 6 4476 2 2 22 ARG HD3 H 0.463 -10.385 5.242 1.00 . B B . 43 ARG HD3 1 1 6 4477 2 2 22 ARG HE H -1.679 -11.138 6.242 1.00 . B B . 43 ARG HE 1 1 6 4478 2 2 22 ARG HG2 H -1.092 -10.988 3.511 1.00 . B B . 43 ARG HG2 1 1 6 4479 2 2 22 ARG HG3 H -0.823 -12.708 3.790 1.00 . B B . 43 ARG HG3 1 1 6 4480 2 2 22 ARG HH11 H -1.442 -14.066 5.739 1.00 . B B . 43 ARG HH11 1 1 6 4481 2 2 22 ARG HH12 H -0.978 -14.674 7.293 1.00 . B B . 43 ARG HH12 1 1 6 4482 2 2 22 ARG HH21 H -0.011 -11.573 8.509 1.00 . B B . 43 ARG HH21 1 1 6 4483 2 2 22 ARG HH22 H -0.168 -13.261 8.863 1.00 . B B . 43 ARG HH22 1 1 6 4484 2 2 22 ARG N N 1.442 -12.444 0.515 1.00 . B B . 43 ARG N 1 1 6 4485 2 2 22 ARG NE N -0.881 -11.704 6.200 1.00 . B B . 43 ARG NE 1 1 6 4486 2 2 22 ARG NH1 N -1.081 -13.908 6.658 1.00 . B B . 43 ARG NH1 1 1 6 4487 2 2 22 ARG NH2 N -0.271 -12.496 8.227 1.00 . B B . 43 ARG NH2 1 1 6 4488 2 2 22 ARG O O -1.155 -11.642 0.197 1.00 . B B . 43 ARG O 1 1 6 4489 2 2 23 GLY C C -3.659 -11.321 1.287 1.00 . B B . 44 GLY C 1 1 6 4490 2 2 23 GLY CA C -3.331 -12.816 1.267 1.00 . B B . 44 GLY CA 1 1 6 4491 2 2 23 GLY H H -1.736 -13.642 2.457 1.00 . B B . 44 GLY H 1 1 6 4492 2 2 23 GLY HA2 H -3.448 -13.198 0.263 1.00 . B B . 44 GLY HA2 1 1 6 4493 2 2 23 GLY HA3 H -4.005 -13.337 1.931 1.00 . B B . 44 GLY HA3 1 1 6 4494 2 2 23 GLY N N -1.926 -13.030 1.716 1.00 . B B . 44 GLY N 1 1 6 4495 2 2 23 GLY O O -3.208 -10.565 0.449 1.00 . B B . 44 GLY O 1 1 6 4496 2 2 24 GLY C C -5.821 -9.115 1.210 1.00 . B B . 45 GLY C 1 1 6 4497 2 2 24 GLY CA C -4.804 -9.443 2.305 1.00 . B B . 45 GLY CA 1 1 6 4498 2 2 24 GLY H H -4.801 -11.514 2.900 1.00 . B B . 45 GLY H 1 1 6 4499 2 2 24 GLY HA2 H -5.232 -9.226 3.274 1.00 . B B . 45 GLY HA2 1 1 6 4500 2 2 24 GLY HA3 H -3.918 -8.843 2.160 1.00 . B B . 45 GLY HA3 1 1 6 4501 2 2 24 GLY N N -4.445 -10.888 2.235 1.00 . B B . 45 GLY N 1 1 6 4502 2 2 24 GLY O O -5.781 -9.665 0.128 1.00 . B B . 45 GLY O 1 1 6 4503 2 2 25 PHE C C -7.819 -6.344 0.301 1.00 . B B . 46 PHE C 1 1 6 4504 2 2 25 PHE CA C -7.754 -7.866 0.454 1.00 . B B . 46 PHE CA 1 1 6 4505 2 2 25 PHE CB C -9.116 -8.399 0.889 1.00 . B B . 46 PHE CB 1 1 6 4506 2 2 25 PHE CD1 C -9.150 -10.619 -0.462 1.00 . B B . 46 PHE CD1 1 1 6 4507 2 2 25 PHE CD2 C -10.732 -8.874 -1.090 1.00 . B B . 46 PHE CD2 1 1 6 4508 2 2 25 PHE CE1 C -9.662 -11.433 -1.481 1.00 . B B . 46 PHE CE1 1 1 6 4509 2 2 25 PHE CE2 C -11.227 -9.706 -2.103 1.00 . B B . 46 PHE CE2 1 1 6 4510 2 2 25 PHE CG C -9.680 -9.315 -0.241 1.00 . B B . 46 PHE CG 1 1 6 4511 2 2 25 PHE CZ C -10.696 -10.979 -2.296 1.00 . B B . 46 PHE CZ 1 1 6 4512 2 2 25 PHE H H -6.753 -7.791 2.361 1.00 . B B . 46 PHE H 1 1 6 4513 2 2 25 PHE HA H -7.483 -8.313 -0.486 1.00 . B B . 46 PHE HA 1 1 6 4514 2 2 25 PHE HB2 H -8.980 -8.959 1.824 1.00 . B B . 46 PHE HB2 1 1 6 4515 2 2 25 PHE HB3 H -9.787 -7.549 1.077 1.00 . B B . 46 PHE HB3 1 1 6 4516 2 2 25 PHE HD1 H -8.352 -11.001 0.139 1.00 . B B . 46 PHE HD1 1 1 6 4517 2 2 25 PHE HD2 H -11.157 -7.903 -0.980 1.00 . B B . 46 PHE HD2 1 1 6 4518 2 2 25 PHE HE1 H -9.251 -12.419 -1.636 1.00 . B B . 46 PHE HE1 1 1 6 4519 2 2 25 PHE HE2 H -12.029 -9.358 -2.738 1.00 . B B . 46 PHE HE2 1 1 6 4520 2 2 25 PHE HZ H -11.085 -11.613 -3.079 1.00 . B B . 46 PHE HZ 1 1 6 4521 2 2 25 PHE N N -6.735 -8.223 1.482 1.00 . B B . 46 PHE N 1 1 6 4522 2 2 25 PHE O O -6.876 -5.640 0.601 1.00 . B B . 46 PHE O 1 1 6 4523 2 2 26 TYR C C -10.514 -3.963 -0.495 1.00 . B B . 47 TYR C 1 1 6 4524 2 2 26 TYR CA C -9.042 -4.351 -0.336 1.00 . B B . 47 TYR CA 1 1 6 4525 2 2 26 TYR CB C -8.267 -3.917 -1.583 1.00 . B B . 47 TYR CB 1 1 6 4526 2 2 26 TYR CD1 C -8.196 -1.656 -0.296 1.00 . B B . 47 TYR CD1 1 1 6 4527 2 2 26 TYR CD2 C -6.668 -1.959 -2.170 1.00 . B B . 47 TYR CD2 1 1 6 4528 2 2 26 TYR CE1 C -7.675 -0.372 -0.095 1.00 . B B . 47 TYR CE1 1 1 6 4529 2 2 26 TYR CE2 C -6.163 -0.672 -1.950 1.00 . B B . 47 TYR CE2 1 1 6 4530 2 2 26 TYR CG C -7.698 -2.483 -1.348 1.00 . B B . 47 TYR CG 1 1 6 4531 2 2 26 TYR CZ C -6.664 0.117 -0.919 1.00 . B B . 47 TYR CZ 1 1 6 4532 2 2 26 TYR H H -9.677 -6.410 -0.404 1.00 . B B . 47 TYR H 1 1 6 4533 2 2 26 TYR HA H -8.632 -3.856 0.532 1.00 . B B . 47 TYR HA 1 1 6 4534 2 2 26 TYR HB2 H -7.458 -4.644 -1.763 1.00 . B B . 47 TYR HB2 1 1 6 4535 2 2 26 TYR HB3 H -8.950 -3.929 -2.444 1.00 . B B . 47 TYR HB3 1 1 6 4536 2 2 26 TYR HD1 H -8.973 -1.997 0.362 1.00 . B B . 47 TYR HD1 1 1 6 4537 2 2 26 TYR HD2 H -6.259 -2.534 -2.965 1.00 . B B . 47 TYR HD2 1 1 6 4538 2 2 26 TYR HE1 H -8.060 0.244 0.705 1.00 . B B . 47 TYR HE1 1 1 6 4539 2 2 26 TYR HE2 H -5.379 -0.288 -2.586 1.00 . B B . 47 TYR HE2 1 1 6 4540 2 2 26 TYR HH H -5.979 1.774 -1.572 1.00 . B B . 47 TYR HH 1 1 6 4541 2 2 26 TYR N N -8.925 -5.828 -0.166 1.00 . B B . 47 TYR N 1 1 6 4542 2 2 26 TYR O O -10.868 -3.171 -1.346 1.00 . B B . 47 TYR O 1 1 6 4543 2 2 26 TYR OH O -6.158 1.384 -0.713 1.00 . B B . 47 TYR OH 1 1 6 4544 2 2 27 THR C C -13.527 -4.547 1.508 1.00 . B B . 48 THR C 1 1 6 4545 2 2 27 THR CA C -12.822 -4.169 0.210 1.00 . B B . 48 THR CA 1 1 6 4546 2 2 27 THR CB C -13.448 -4.943 -0.954 1.00 . B B . 48 THR CB 1 1 6 4547 2 2 27 THR CG2 C -14.095 -3.960 -1.933 1.00 . B B . 48 THR CG2 1 1 6 4548 2 2 27 THR H H -11.072 -5.148 0.999 1.00 . B B . 48 THR H 1 1 6 4549 2 2 27 THR HA H -12.931 -3.115 0.039 1.00 . B B . 48 THR HA 1 1 6 4550 2 2 27 THR HB H -14.203 -5.613 -0.573 1.00 . B B . 48 THR HB 1 1 6 4551 2 2 27 THR HG1 H -12.270 -5.285 -2.470 1.00 . B B . 48 THR HG1 1 1 6 4552 2 2 27 THR HG21 H -13.514 -3.051 -1.969 1.00 . B B . 48 THR HG21 1 1 6 4553 2 2 27 THR HG22 H -15.099 -3.734 -1.605 1.00 . B B . 48 THR HG22 1 1 6 4554 2 2 27 THR HG23 H -14.130 -4.404 -2.918 1.00 . B B . 48 THR HG23 1 1 6 4555 2 2 27 THR N N -11.376 -4.512 0.317 1.00 . B B . 48 THR N 1 1 6 4556 2 2 27 THR O O -13.872 -3.704 2.312 1.00 . B B . 48 THR O 1 1 6 4557 2 2 27 THR OG1 O -12.439 -5.695 -1.618 1.00 . B B . 48 THR OG1 1 1 6 4558 2 2 28 LYS C C -14.374 -7.796 3.026 1.00 . B B . 49 LYS C 1 1 6 4559 2 2 28 LYS CA C -14.423 -6.264 2.954 1.00 . B B . 49 LYS CA 1 1 6 4560 2 2 28 LYS CB C -15.881 -5.801 2.927 1.00 . B B . 49 LYS CB 1 1 6 4561 2 2 28 LYS CD C -17.008 -4.439 4.694 1.00 . B B . 49 LYS CD 1 1 6 4562 2 2 28 LYS CE C -18.162 -4.589 5.685 1.00 . B B . 49 LYS CE 1 1 6 4563 2 2 28 LYS CG C -16.449 -5.820 4.347 1.00 . B B . 49 LYS CG 1 1 6 4564 2 2 28 LYS H H -13.449 -6.460 1.043 1.00 . B B . 49 LYS H 1 1 6 4565 2 2 28 LYS HA H -13.928 -5.839 3.813 1.00 . B B . 49 LYS HA 1 1 6 4566 2 2 28 LYS HB2 H -15.932 -4.796 2.531 1.00 . B B . 49 LYS HB2 1 1 6 4567 2 2 28 LYS HB3 H -16.459 -6.464 2.301 1.00 . B B . 49 LYS HB3 1 1 6 4568 2 2 28 LYS HD2 H -16.227 -3.836 5.136 1.00 . B B . 49 LYS HD2 1 1 6 4569 2 2 28 LYS HD3 H -17.368 -3.960 3.796 1.00 . B B . 49 LYS HD3 1 1 6 4570 2 2 28 LYS HE2 H -18.112 -5.562 6.152 1.00 . B B . 49 LYS HE2 1 1 6 4571 2 2 28 LYS HE3 H -18.089 -3.823 6.442 1.00 . B B . 49 LYS HE3 1 1 6 4572 2 2 28 LYS HG2 H -17.240 -6.554 4.407 1.00 . B B . 49 LYS HG2 1 1 6 4573 2 2 28 LYS HG3 H -15.666 -6.075 5.044 1.00 . B B . 49 LYS HG3 1 1 6 4574 2 2 28 LYS HZ1 H -19.636 -3.448 4.755 1.00 . B B . 49 LYS HZ1 1 1 6 4575 2 2 28 LYS HZ2 H -20.228 -4.825 5.557 1.00 . B B . 49 LYS HZ2 1 1 6 4576 2 2 28 LYS HZ3 H -19.418 -4.986 4.072 1.00 . B B . 49 LYS HZ3 1 1 6 4577 2 2 28 LYS N N -13.740 -5.809 1.711 1.00 . B B . 49 LYS N 1 1 6 4578 2 2 28 LYS NZ N -19.459 -4.452 4.963 1.00 . B B . 49 LYS NZ 1 1 6 4579 2 2 28 LYS O O -15.110 -8.467 2.330 1.00 . B B . 49 LYS O 1 1 6 4580 2 2 29 PRO C C -14.490 -10.335 4.876 1.00 . B B . 50 PRO C 1 1 6 4581 2 2 29 PRO CA C -13.340 -9.756 4.047 1.00 . B B . 50 PRO CA 1 1 6 4582 2 2 29 PRO CB C -12.009 -9.880 4.793 1.00 . B B . 50 PRO CB 1 1 6 4583 2 2 29 PRO CD C -12.618 -7.488 4.713 1.00 . B B . 50 PRO CD 1 1 6 4584 2 2 29 PRO CG C -11.770 -8.517 5.481 1.00 . B B . 50 PRO CG 1 1 6 4585 2 2 29 PRO HA H -13.272 -10.246 3.094 1.00 . B B . 50 PRO HA 1 1 6 4586 2 2 29 PRO HB2 H -12.071 -10.667 5.532 1.00 . B B . 50 PRO HB2 1 1 6 4587 2 2 29 PRO HB3 H -11.210 -10.082 4.098 1.00 . B B . 50 PRO HB3 1 1 6 4588 2 2 29 PRO HD2 H -13.196 -6.888 5.399 1.00 . B B . 50 PRO HD2 1 1 6 4589 2 2 29 PRO HD3 H -11.990 -6.866 4.096 1.00 . B B . 50 PRO HD3 1 1 6 4590 2 2 29 PRO HG2 H -12.085 -8.565 6.515 1.00 . B B . 50 PRO HG2 1 1 6 4591 2 2 29 PRO HG3 H -10.728 -8.248 5.421 1.00 . B B . 50 PRO HG3 1 1 6 4592 2 2 29 PRO N N -13.508 -8.305 3.868 1.00 . B B . 50 PRO N 1 1 6 4593 2 2 29 PRO O O -15.143 -9.635 5.625 1.00 . B B . 50 PRO O 1 1 6 4594 2 2 30 THR C C -17.148 -11.469 5.262 1.00 . B B . 51 THR C 1 1 6 4595 2 2 30 THR CA C -15.850 -12.234 5.521 1.00 . B B . 51 THR CA 1 1 6 4596 2 2 30 THR CB C -15.519 -12.186 7.014 1.00 . B B . 51 THR CB 1 1 6 4597 2 2 30 THR CG2 C -16.683 -12.773 7.814 1.00 . B B . 51 THR CG2 1 1 6 4598 2 2 30 THR H H -14.204 -12.154 4.134 1.00 . B B . 51 THR H 1 1 6 4599 2 2 30 THR HA H -15.970 -13.262 5.212 1.00 . B B . 51 THR HA 1 1 6 4600 2 2 30 THR HB H -15.361 -11.162 7.315 1.00 . B B . 51 THR HB 1 1 6 4601 2 2 30 THR HG1 H -14.425 -13.346 8.126 1.00 . B B . 51 THR HG1 1 1 6 4602 2 2 30 THR HG21 H -16.385 -12.897 8.845 1.00 . B B . 51 THR HG21 1 1 6 4603 2 2 30 THR HG22 H -16.956 -13.732 7.400 1.00 . B B . 51 THR HG22 1 1 6 4604 2 2 30 THR HG23 H -17.529 -12.105 7.762 1.00 . B B . 51 THR HG23 1 1 6 4605 2 2 30 THR N N -14.743 -11.609 4.745 1.00 . B B . 51 THR N 1 1 6 4606 2 2 30 THR O O -17.416 -10.531 5.995 1.00 . B B . 51 THR O 1 1 6 4607 2 2 30 THR OXT O -17.852 -11.833 4.335 1.00 . B B . 51 THR OXT 1 1 6 4608 2 2 30 THR OG1 O -14.341 -12.941 7.260 1.00 . B B . 51 THR OG1 1 1 7 4609 1 1 1 GLY C C -2.264 6.785 7.162 1.00 . A A . 1 GLY C 1 1 7 4610 1 1 1 GLY CA C -3.373 7.116 8.103 1.00 . A A . 1 GLY CA 1 1 7 4611 1 1 1 GLY H1 H -2.115 7.982 9.568 1.00 . A A . 1 GLY H1 1 1 7 4612 1 1 1 GLY H2 H -3.013 6.657 10.137 1.00 . A A . 1 GLY H2 1 1 7 4613 1 1 1 GLY H3 H -3.770 8.158 9.901 1.00 . A A . 1 GLY H3 1 1 7 4614 1 1 1 GLY HA2 H -3.576 6.165 8.032 1.00 . A A . 1 GLY HA2 1 1 7 4615 1 1 1 GLY HA3 H -4.256 7.798 7.759 1.00 . A A . 1 GLY HA3 1 1 7 4616 1 1 1 GLY N N -3.041 7.509 9.542 1.00 . A A . 1 GLY N 1 1 7 4617 1 1 1 GLY O O -1.109 7.044 7.435 1.00 . A A . 1 GLY O 1 1 7 4618 1 1 2 ILE C C -1.498 6.880 3.920 1.00 . A A . 2 ILE C 1 1 7 4619 1 1 2 ILE CA C -1.514 5.854 5.055 1.00 . A A . 2 ILE CA 1 1 7 4620 1 1 2 ILE CB C -1.792 4.468 4.476 1.00 . A A . 2 ILE CB 1 1 7 4621 1 1 2 ILE CD1 C -1.993 2.051 5.075 1.00 . A A . 2 ILE CD1 1 1 7 4622 1 1 2 ILE CG1 C -2.025 3.478 5.620 1.00 . A A . 2 ILE CG1 1 1 7 4623 1 1 2 ILE CG2 C -0.592 4.016 3.641 1.00 . A A . 2 ILE CG2 1 1 7 4624 1 1 2 ILE H H -3.517 6.008 5.832 1.00 . A A . 2 ILE H 1 1 7 4625 1 1 2 ILE HA H -0.555 5.850 5.551 1.00 . A A . 2 ILE HA 1 1 7 4626 1 1 2 ILE HB H -2.671 4.510 3.848 1.00 . A A . 2 ILE HB 1 1 7 4627 1 1 2 ILE HD11 H -1.024 1.615 5.266 1.00 . A A . 2 ILE HD11 1 1 7 4628 1 1 2 ILE HD12 H -2.177 2.068 4.011 1.00 . A A . 2 ILE HD12 1 1 7 4629 1 1 2 ILE HD13 H -2.755 1.462 5.563 1.00 . A A . 2 ILE HD13 1 1 7 4630 1 1 2 ILE HG12 H -1.250 3.599 6.364 1.00 . A A . 2 ILE HG12 1 1 7 4631 1 1 2 ILE HG13 H -2.988 3.668 6.069 1.00 . A A . 2 ILE HG13 1 1 7 4632 1 1 2 ILE HG21 H -0.247 4.840 3.033 1.00 . A A . 2 ILE HG21 1 1 7 4633 1 1 2 ILE HG22 H -0.885 3.196 3.002 1.00 . A A . 2 ILE HG22 1 1 7 4634 1 1 2 ILE HG23 H 0.204 3.695 4.297 1.00 . A A . 2 ILE HG23 1 1 7 4635 1 1 2 ILE N N -2.580 6.208 6.034 1.00 . A A . 2 ILE N 1 1 7 4636 1 1 2 ILE O O -0.456 7.355 3.514 1.00 . A A . 2 ILE O 1 1 7 4637 1 1 3 VAL C C -1.869 9.444 2.659 1.00 . A A . 3 VAL C 1 1 7 4638 1 1 3 VAL CA C -2.691 8.210 2.287 1.00 . A A . 3 VAL CA 1 1 7 4639 1 1 3 VAL CB C -4.144 8.618 2.027 1.00 . A A . 3 VAL CB 1 1 7 4640 1 1 3 VAL CG1 C -5.027 7.369 1.990 1.00 . A A . 3 VAL CG1 1 1 7 4641 1 1 3 VAL CG2 C -4.623 9.547 3.146 1.00 . A A . 3 VAL CG2 1 1 7 4642 1 1 3 VAL H H -3.474 6.824 3.738 1.00 . A A . 3 VAL H 1 1 7 4643 1 1 3 VAL HA H -2.279 7.765 1.399 1.00 . A A . 3 VAL HA 1 1 7 4644 1 1 3 VAL HB H -4.208 9.132 1.078 1.00 . A A . 3 VAL HB 1 1 7 4645 1 1 3 VAL HG11 H -5.597 7.304 2.904 1.00 . A A . 3 VAL HG11 1 1 7 4646 1 1 3 VAL HG12 H -4.405 6.491 1.891 1.00 . A A . 3 VAL HG12 1 1 7 4647 1 1 3 VAL HG13 H -5.702 7.429 1.149 1.00 . A A . 3 VAL HG13 1 1 7 4648 1 1 3 VAL HG21 H -4.217 9.212 4.090 1.00 . A A . 3 VAL HG21 1 1 7 4649 1 1 3 VAL HG22 H -5.702 9.530 3.192 1.00 . A A . 3 VAL HG22 1 1 7 4650 1 1 3 VAL HG23 H -4.287 10.554 2.947 1.00 . A A . 3 VAL HG23 1 1 7 4651 1 1 3 VAL N N -2.644 7.221 3.400 1.00 . A A . 3 VAL N 1 1 7 4652 1 1 3 VAL O O -1.249 10.068 1.823 1.00 . A A . 3 VAL O 1 1 7 4653 1 1 4 GLU C C 0.395 10.654 4.426 1.00 . A A . 4 GLU C 1 1 7 4654 1 1 4 GLU CA C -1.093 10.998 4.343 1.00 . A A . 4 GLU CA 1 1 7 4655 1 1 4 GLU CB C -1.587 11.448 5.720 1.00 . A A . 4 GLU CB 1 1 7 4656 1 1 4 GLU CD C -3.734 12.187 6.767 1.00 . A A . 4 GLU CD 1 1 7 4657 1 1 4 GLU CG C -3.082 11.147 5.853 1.00 . A A . 4 GLU CG 1 1 7 4658 1 1 4 GLU H H -2.376 9.280 4.560 1.00 . A A . 4 GLU H 1 1 7 4659 1 1 4 GLU HA H -1.238 11.796 3.631 1.00 . A A . 4 GLU HA 1 1 7 4660 1 1 4 GLU HB2 H -1.043 10.916 6.488 1.00 . A A . 4 GLU HB2 1 1 7 4661 1 1 4 GLU HB3 H -1.424 12.510 5.832 1.00 . A A . 4 GLU HB3 1 1 7 4662 1 1 4 GLU HG2 H -3.544 11.184 4.876 1.00 . A A . 4 GLU HG2 1 1 7 4663 1 1 4 GLU HG3 H -3.216 10.163 6.277 1.00 . A A . 4 GLU HG3 1 1 7 4664 1 1 4 GLU N N -1.866 9.800 3.908 1.00 . A A . 4 GLU N 1 1 7 4665 1 1 4 GLU O O 1.229 11.512 4.636 1.00 . A A . 4 GLU O 1 1 7 4666 1 1 4 GLU OE1 O -3.169 13.258 6.911 1.00 . A A . 4 GLU OE1 1 1 7 4667 1 1 4 GLU OE2 O -4.789 11.894 7.306 1.00 . A A . 4 GLU OE2 1 1 7 4668 1 1 5 GLN C C 2.715 8.706 2.955 1.00 . A A . 5 GLN C 1 1 7 4669 1 1 5 GLN CA C 2.173 9.015 4.353 1.00 . A A . 5 GLN CA 1 1 7 4670 1 1 5 GLN CB C 2.314 7.776 5.238 1.00 . A A . 5 GLN CB 1 1 7 4671 1 1 5 GLN CD C 4.199 6.710 6.482 1.00 . A A . 5 GLN CD 1 1 7 4672 1 1 5 GLN CG C 3.421 8.009 6.268 1.00 . A A . 5 GLN CG 1 1 7 4673 1 1 5 GLN H H 0.052 8.723 4.109 1.00 . A A . 5 GLN H 1 1 7 4674 1 1 5 GLN HA H 2.740 9.828 4.784 1.00 . A A . 5 GLN HA 1 1 7 4675 1 1 5 GLN HB2 H 1.380 7.588 5.747 1.00 . A A . 5 GLN HB2 1 1 7 4676 1 1 5 GLN HB3 H 2.569 6.924 4.625 1.00 . A A . 5 GLN HB3 1 1 7 4677 1 1 5 GLN HE21 H 4.866 7.237 8.276 1.00 . A A . 5 GLN HE21 1 1 7 4678 1 1 5 GLN HE22 H 5.366 5.707 7.736 1.00 . A A . 5 GLN HE22 1 1 7 4679 1 1 5 GLN HG2 H 4.091 8.776 5.908 1.00 . A A . 5 GLN HG2 1 1 7 4680 1 1 5 GLN HG3 H 2.983 8.322 7.203 1.00 . A A . 5 GLN HG3 1 1 7 4681 1 1 5 GLN N N 0.737 9.405 4.272 1.00 . A A . 5 GLN N 1 1 7 4682 1 1 5 GLN NE2 N 4.866 6.537 7.590 1.00 . A A . 5 GLN NE2 1 1 7 4683 1 1 5 GLN O O 3.832 9.053 2.623 1.00 . A A . 5 GLN O 1 1 7 4684 1 1 5 GLN OE1 O 4.201 5.842 5.631 1.00 . A A . 5 GLN OE1 1 1 7 4685 1 1 6 CYS C C 1.870 8.673 -0.262 1.00 . A A . 6 CYS C 1 1 7 4686 1 1 6 CYS CA C 2.434 7.696 0.772 1.00 . A A . 6 CYS CA 1 1 7 4687 1 1 6 CYS CB C 1.994 6.276 0.422 1.00 . A A . 6 CYS CB 1 1 7 4688 1 1 6 CYS H H 1.052 7.757 2.427 1.00 . A A . 6 CYS H 1 1 7 4689 1 1 6 CYS HA H 3.513 7.747 0.757 1.00 . A A . 6 CYS HA 1 1 7 4690 1 1 6 CYS HB2 H 0.916 6.225 0.417 1.00 . A A . 6 CYS HB2 1 1 7 4691 1 1 6 CYS HB3 H 2.373 6.011 -0.554 1.00 . A A . 6 CYS HB3 1 1 7 4692 1 1 6 CYS N N 1.945 8.041 2.138 1.00 . A A . 6 CYS N 1 1 7 4693 1 1 6 CYS O O 2.525 9.003 -1.230 1.00 . A A . 6 CYS O 1 1 7 4694 1 1 6 CYS SG S 2.648 5.126 1.656 1.00 . A A . 6 CYS SG 1 1 7 4695 1 1 7 CYS C C 0.780 11.442 -0.949 1.00 . A A . 7 CYS C 1 1 7 4696 1 1 7 CYS CA C 0.090 10.084 -1.077 1.00 . A A . 7 CYS CA 1 1 7 4697 1 1 7 CYS CB C -1.404 10.267 -0.830 1.00 . A A . 7 CYS CB 1 1 7 4698 1 1 7 CYS H H 0.139 8.860 0.700 1.00 . A A . 7 CYS H 1 1 7 4699 1 1 7 CYS HA H 0.244 9.690 -2.074 1.00 . A A . 7 CYS HA 1 1 7 4700 1 1 7 CYS HB2 H -1.847 9.319 -0.562 1.00 . A A . 7 CYS HB2 1 1 7 4701 1 1 7 CYS HB3 H -1.551 10.973 -0.028 1.00 . A A . 7 CYS HB3 1 1 7 4702 1 1 7 CYS N N 0.664 9.136 -0.081 1.00 . A A . 7 CYS N 1 1 7 4703 1 1 7 CYS O O 1.069 12.093 -1.929 1.00 . A A . 7 CYS O 1 1 7 4704 1 1 7 CYS SG S -2.182 10.900 -2.336 1.00 . A A . 7 CYS SG 1 1 7 4705 1 1 8 THR C C 3.206 13.041 0.153 1.00 . A A . 8 THR C 1 1 7 4706 1 1 8 THR CA C 1.711 13.197 0.435 1.00 . A A . 8 THR CA 1 1 7 4707 1 1 8 THR CB C 1.510 13.685 1.873 1.00 . A A . 8 THR CB 1 1 7 4708 1 1 8 THR CG2 C 0.022 13.932 2.130 1.00 . A A . 8 THR CG2 1 1 7 4709 1 1 8 THR H H 0.795 11.341 1.034 1.00 . A A . 8 THR H 1 1 7 4710 1 1 8 THR HA H 1.287 13.915 -0.252 1.00 . A A . 8 THR HA 1 1 7 4711 1 1 8 THR HB H 2.053 14.605 2.021 1.00 . A A . 8 THR HB 1 1 7 4712 1 1 8 THR HG1 H 2.019 13.089 3.654 1.00 . A A . 8 THR HG1 1 1 7 4713 1 1 8 THR HG21 H -0.355 14.639 1.406 1.00 . A A . 8 THR HG21 1 1 7 4714 1 1 8 THR HG22 H -0.111 14.331 3.125 1.00 . A A . 8 THR HG22 1 1 7 4715 1 1 8 THR HG23 H -0.518 13.002 2.040 1.00 . A A . 8 THR HG23 1 1 7 4716 1 1 8 THR N N 1.040 11.879 0.253 1.00 . A A . 8 THR N 1 1 7 4717 1 1 8 THR O O 3.859 13.949 -0.322 1.00 . A A . 8 THR O 1 1 7 4718 1 1 8 THR OG1 O 1.991 12.699 2.777 1.00 . A A . 8 THR OG1 1 1 7 4719 1 1 9 SER C C 5.386 10.432 -0.690 1.00 . A A . 9 SER C 1 1 7 4720 1 1 9 SER CA C 5.203 11.666 0.197 1.00 . A A . 9 SER CA 1 1 7 4721 1 1 9 SER CB C 5.915 11.442 1.532 1.00 . A A . 9 SER CB 1 1 7 4722 1 1 9 SER H H 3.204 11.173 0.825 1.00 . A A . 9 SER H 1 1 7 4723 1 1 9 SER HA H 5.624 12.530 -0.296 1.00 . A A . 9 SER HA 1 1 7 4724 1 1 9 SER HB2 H 6.926 11.808 1.471 1.00 . A A . 9 SER HB2 1 1 7 4725 1 1 9 SER HB3 H 5.387 11.974 2.313 1.00 . A A . 9 SER HB3 1 1 7 4726 1 1 9 SER HG H 5.048 9.707 1.697 1.00 . A A . 9 SER HG 1 1 7 4727 1 1 9 SER N N 3.751 11.891 0.444 1.00 . A A . 9 SER N 1 1 7 4728 1 1 9 SER O O 4.543 10.108 -1.502 1.00 . A A . 9 SER O 1 1 7 4729 1 1 9 SER OG O 5.936 10.050 1.822 1.00 . A A . 9 SER OG 1 1 7 4730 1 1 10 ILE C C 7.197 7.388 -0.470 1.00 . A A . 10 ILE C 1 1 7 4731 1 1 10 ILE CA C 6.716 8.527 -1.370 1.00 . A A . 10 ILE CA 1 1 7 4732 1 1 10 ILE CB C 7.779 8.828 -2.428 1.00 . A A . 10 ILE CB 1 1 7 4733 1 1 10 ILE CD1 C 6.280 10.366 -3.707 1.00 . A A . 10 ILE CD1 1 1 7 4734 1 1 10 ILE CG1 C 7.599 10.260 -2.939 1.00 . A A . 10 ILE CG1 1 1 7 4735 1 1 10 ILE CG2 C 7.628 7.854 -3.596 1.00 . A A . 10 ILE CG2 1 1 7 4736 1 1 10 ILE H H 7.148 10.018 0.122 1.00 . A A . 10 ILE H 1 1 7 4737 1 1 10 ILE HA H 5.795 8.238 -1.856 1.00 . A A . 10 ILE HA 1 1 7 4738 1 1 10 ILE HB H 8.761 8.719 -1.992 1.00 . A A . 10 ILE HB 1 1 7 4739 1 1 10 ILE HD11 H 5.607 9.589 -3.376 1.00 . A A . 10 ILE HD11 1 1 7 4740 1 1 10 ILE HD12 H 6.470 10.251 -4.764 1.00 . A A . 10 ILE HD12 1 1 7 4741 1 1 10 ILE HD13 H 5.833 11.331 -3.524 1.00 . A A . 10 ILE HD13 1 1 7 4742 1 1 10 ILE HG12 H 7.585 10.943 -2.101 1.00 . A A . 10 ILE HG12 1 1 7 4743 1 1 10 ILE HG13 H 8.418 10.513 -3.596 1.00 . A A . 10 ILE HG13 1 1 7 4744 1 1 10 ILE HG21 H 8.116 8.261 -4.469 1.00 . A A . 10 ILE HG21 1 1 7 4745 1 1 10 ILE HG22 H 6.579 7.706 -3.807 1.00 . A A . 10 ILE HG22 1 1 7 4746 1 1 10 ILE HG23 H 8.081 6.908 -3.337 1.00 . A A . 10 ILE HG23 1 1 7 4747 1 1 10 ILE N N 6.481 9.740 -0.539 1.00 . A A . 10 ILE N 1 1 7 4748 1 1 10 ILE O O 8.283 7.431 0.074 1.00 . A A . 10 ILE O 1 1 7 4749 1 1 11 CYS C C 7.613 4.222 -0.252 1.00 . A A . 11 CYS C 1 1 7 4750 1 1 11 CYS CA C 6.809 5.233 0.568 1.00 . A A . 11 CYS CA 1 1 7 4751 1 1 11 CYS CB C 5.567 4.550 1.139 1.00 . A A . 11 CYS CB 1 1 7 4752 1 1 11 CYS H H 5.523 6.356 -0.747 1.00 . A A . 11 CYS H 1 1 7 4753 1 1 11 CYS HA H 7.419 5.605 1.378 1.00 . A A . 11 CYS HA 1 1 7 4754 1 1 11 CYS HB2 H 5.005 4.094 0.337 1.00 . A A . 11 CYS HB2 1 1 7 4755 1 1 11 CYS HB3 H 5.867 3.789 1.844 1.00 . A A . 11 CYS HB3 1 1 7 4756 1 1 11 CYS N N 6.396 6.370 -0.303 1.00 . A A . 11 CYS N 1 1 7 4757 1 1 11 CYS O O 7.686 4.306 -1.462 1.00 . A A . 11 CYS O 1 1 7 4758 1 1 11 CYS SG S 4.533 5.775 1.977 1.00 . A A . 11 CYS SG 1 1 7 4759 1 1 12 SER C C 8.213 0.946 -0.431 1.00 . A A . 12 SER C 1 1 7 4760 1 1 12 SER CA C 9.016 2.247 -0.332 1.00 . A A . 12 SER CA 1 1 7 4761 1 1 12 SER CB C 10.321 1.987 0.425 1.00 . A A . 12 SER CB 1 1 7 4762 1 1 12 SER H H 8.142 3.220 1.377 1.00 . A A . 12 SER H 1 1 7 4763 1 1 12 SER HA H 9.241 2.610 -1.325 1.00 . A A . 12 SER HA 1 1 7 4764 1 1 12 SER HB2 H 10.977 1.384 -0.179 1.00 . A A . 12 SER HB2 1 1 7 4765 1 1 12 SER HB3 H 10.803 2.931 0.643 1.00 . A A . 12 SER HB3 1 1 7 4766 1 1 12 SER HG H 9.923 0.367 1.427 1.00 . A A . 12 SER HG 1 1 7 4767 1 1 12 SER N N 8.216 3.267 0.401 1.00 . A A . 12 SER N 1 1 7 4768 1 1 12 SER O O 7.541 0.550 0.500 1.00 . A A . 12 SER O 1 1 7 4769 1 1 12 SER OG O 10.033 1.297 1.635 1.00 . A A . 12 SER OG 1 1 7 4770 1 1 13 LEU C C 7.642 -1.834 -0.440 1.00 . A A . 13 LEU C 1 1 7 4771 1 1 13 LEU CA C 7.507 -0.991 -1.710 1.00 . A A . 13 LEU CA 1 1 7 4772 1 1 13 LEU CB C 8.054 -1.777 -2.904 1.00 . A A . 13 LEU CB 1 1 7 4773 1 1 13 LEU CD1 C 6.816 -2.657 -4.888 1.00 . A A . 13 LEU CD1 1 1 7 4774 1 1 13 LEU CD2 C 7.475 -4.203 -3.039 1.00 . A A . 13 LEU CD2 1 1 7 4775 1 1 13 LEU CG C 7.005 -2.786 -3.375 1.00 . A A . 13 LEU CG 1 1 7 4776 1 1 13 LEU H H 8.817 0.618 -2.295 1.00 . A A . 13 LEU H 1 1 7 4777 1 1 13 LEU HA H 6.465 -0.764 -1.879 1.00 . A A . 13 LEU HA 1 1 7 4778 1 1 13 LEU HB2 H 8.286 -1.093 -3.709 1.00 . A A . 13 LEU HB2 1 1 7 4779 1 1 13 LEU HB3 H 8.950 -2.302 -2.609 1.00 . A A . 13 LEU HB3 1 1 7 4780 1 1 13 LEU HD11 H 6.327 -1.720 -5.111 1.00 . A A . 13 LEU HD11 1 1 7 4781 1 1 13 LEU HD12 H 6.208 -3.475 -5.246 1.00 . A A . 13 LEU HD12 1 1 7 4782 1 1 13 LEU HD13 H 7.780 -2.685 -5.374 1.00 . A A . 13 LEU HD13 1 1 7 4783 1 1 13 LEU HD21 H 6.772 -4.921 -3.437 1.00 . A A . 13 LEU HD21 1 1 7 4784 1 1 13 LEU HD22 H 7.537 -4.317 -1.967 1.00 . A A . 13 LEU HD22 1 1 7 4785 1 1 13 LEU HD23 H 8.448 -4.373 -3.476 1.00 . A A . 13 LEU HD23 1 1 7 4786 1 1 13 LEU HG H 6.066 -2.588 -2.877 1.00 . A A . 13 LEU HG 1 1 7 4787 1 1 13 LEU N N 8.272 0.280 -1.554 1.00 . A A . 13 LEU N 1 1 7 4788 1 1 13 LEU O O 6.746 -2.570 -0.075 1.00 . A A . 13 LEU O 1 1 7 4789 1 1 14 TYR C C 7.895 -2.102 2.518 1.00 . A A . 14 TYR C 1 1 7 4790 1 1 14 TYR CA C 8.936 -2.531 1.483 1.00 . A A . 14 TYR CA 1 1 7 4791 1 1 14 TYR CB C 10.341 -2.294 2.040 1.00 . A A . 14 TYR CB 1 1 7 4792 1 1 14 TYR CD1 C 11.278 -4.088 0.443 1.00 . A A . 14 TYR CD1 1 1 7 4793 1 1 14 TYR CD2 C 12.448 -1.959 0.593 1.00 . A A . 14 TYR CD2 1 1 7 4794 1 1 14 TYR CE1 C 12.219 -4.530 -0.494 1.00 . A A . 14 TYR CE1 1 1 7 4795 1 1 14 TYR CE2 C 13.381 -2.416 -0.347 1.00 . A A . 14 TYR CE2 1 1 7 4796 1 1 14 TYR CG C 11.380 -2.789 1.006 1.00 . A A . 14 TYR CG 1 1 7 4797 1 1 14 TYR CZ C 13.267 -3.698 -0.887 1.00 . A A . 14 TYR CZ 1 1 7 4798 1 1 14 TYR H H 9.462 -1.135 -0.073 1.00 . A A . 14 TYR H 1 1 7 4799 1 1 14 TYR HA H 8.809 -3.580 1.260 1.00 . A A . 14 TYR HA 1 1 7 4800 1 1 14 TYR HB2 H 10.467 -1.230 2.242 1.00 . A A . 14 TYR HB2 1 1 7 4801 1 1 14 TYR HB3 H 10.448 -2.838 2.976 1.00 . A A . 14 TYR HB3 1 1 7 4802 1 1 14 TYR HD1 H 10.479 -4.749 0.723 1.00 . A A . 14 TYR HD1 1 1 7 4803 1 1 14 TYR HD2 H 12.556 -0.971 0.985 1.00 . A A . 14 TYR HD2 1 1 7 4804 1 1 14 TYR HE1 H 12.132 -5.520 -0.916 1.00 . A A . 14 TYR HE1 1 1 7 4805 1 1 14 TYR HE2 H 14.193 -1.775 -0.654 1.00 . A A . 14 TYR HE2 1 1 7 4806 1 1 14 TYR HH H 14.926 -4.529 -1.333 1.00 . A A . 14 TYR HH 1 1 7 4807 1 1 14 TYR N N 8.752 -1.734 0.237 1.00 . A A . 14 TYR N 1 1 7 4808 1 1 14 TYR O O 7.191 -2.918 3.079 1.00 . A A . 14 TYR O 1 1 7 4809 1 1 14 TYR OH O 14.190 -4.142 -1.812 1.00 . A A . 14 TYR OH 1 1 7 4810 1 1 15 GLN C C 5.391 -0.809 3.332 1.00 . A A . 15 GLN C 1 1 7 4811 1 1 15 GLN CA C 6.784 -0.349 3.766 1.00 . A A . 15 GLN CA 1 1 7 4812 1 1 15 GLN CB C 6.821 1.179 3.839 1.00 . A A . 15 GLN CB 1 1 7 4813 1 1 15 GLN CD C 8.523 2.277 5.306 1.00 . A A . 15 GLN CD 1 1 7 4814 1 1 15 GLN CG C 8.274 1.651 3.932 1.00 . A A . 15 GLN CG 1 1 7 4815 1 1 15 GLN H H 8.359 -0.183 2.305 1.00 . A A . 15 GLN H 1 1 7 4816 1 1 15 GLN HA H 7.013 -0.764 4.736 1.00 . A A . 15 GLN HA 1 1 7 4817 1 1 15 GLN HB2 H 6.363 1.592 2.952 1.00 . A A . 15 GLN HB2 1 1 7 4818 1 1 15 GLN HB3 H 6.281 1.511 4.712 1.00 . A A . 15 GLN HB3 1 1 7 4819 1 1 15 GLN HE21 H 7.407 3.878 4.937 1.00 . A A . 15 GLN HE21 1 1 7 4820 1 1 15 GLN HE22 H 8.127 3.834 6.473 1.00 . A A . 15 GLN HE22 1 1 7 4821 1 1 15 GLN HG2 H 8.936 0.807 3.795 1.00 . A A . 15 GLN HG2 1 1 7 4822 1 1 15 GLN HG3 H 8.464 2.386 3.164 1.00 . A A . 15 GLN HG3 1 1 7 4823 1 1 15 GLN N N 7.786 -0.826 2.771 1.00 . A A . 15 GLN N 1 1 7 4824 1 1 15 GLN NE2 N 7.973 3.425 5.596 1.00 . A A . 15 GLN NE2 1 1 7 4825 1 1 15 GLN O O 4.566 -1.178 4.144 1.00 . A A . 15 GLN O 1 1 7 4826 1 1 15 GLN OE1 O 9.223 1.716 6.124 1.00 . A A . 15 GLN OE1 1 1 7 4827 1 1 16 LEU C C 3.625 -2.730 1.876 1.00 . A A . 16 LEU C 1 1 7 4828 1 1 16 LEU CA C 3.793 -1.246 1.564 1.00 . A A . 16 LEU CA 1 1 7 4829 1 1 16 LEU CB C 3.702 -1.031 0.050 1.00 . A A . 16 LEU CB 1 1 7 4830 1 1 16 LEU CD1 C 4.634 1.273 -0.197 1.00 . A A . 16 LEU CD1 1 1 7 4831 1 1 16 LEU CD2 C 2.731 0.534 -1.635 1.00 . A A . 16 LEU CD2 1 1 7 4832 1 1 16 LEU CG C 3.359 0.430 -0.243 1.00 . A A . 16 LEU CG 1 1 7 4833 1 1 16 LEU H H 5.809 -0.505 1.414 1.00 . A A . 16 LEU H 1 1 7 4834 1 1 16 LEU HA H 3.016 -0.685 2.061 1.00 . A A . 16 LEU HA 1 1 7 4835 1 1 16 LEU HB2 H 4.650 -1.276 -0.405 1.00 . A A . 16 LEU HB2 1 1 7 4836 1 1 16 LEU HB3 H 2.931 -1.668 -0.358 1.00 . A A . 16 LEU HB3 1 1 7 4837 1 1 16 LEU HD11 H 4.721 1.744 0.770 1.00 . A A . 16 LEU HD11 1 1 7 4838 1 1 16 LEU HD12 H 4.591 2.031 -0.965 1.00 . A A . 16 LEU HD12 1 1 7 4839 1 1 16 LEU HD13 H 5.491 0.637 -0.367 1.00 . A A . 16 LEU HD13 1 1 7 4840 1 1 16 LEU HD21 H 2.088 -0.317 -1.805 1.00 . A A . 16 LEU HD21 1 1 7 4841 1 1 16 LEU HD22 H 3.512 0.549 -2.381 1.00 . A A . 16 LEU HD22 1 1 7 4842 1 1 16 LEU HD23 H 2.152 1.443 -1.702 1.00 . A A . 16 LEU HD23 1 1 7 4843 1 1 16 LEU HG H 2.660 0.793 0.498 1.00 . A A . 16 LEU HG 1 1 7 4844 1 1 16 LEU N N 5.127 -0.799 2.053 1.00 . A A . 16 LEU N 1 1 7 4845 1 1 16 LEU O O 2.562 -3.180 2.254 1.00 . A A . 16 LEU O 1 1 7 4846 1 1 17 GLU C C 4.138 -5.112 3.483 1.00 . A A . 17 GLU C 1 1 7 4847 1 1 17 GLU CA C 4.573 -4.941 2.028 1.00 . A A . 17 GLU CA 1 1 7 4848 1 1 17 GLU CB C 5.939 -5.588 1.808 1.00 . A A . 17 GLU CB 1 1 7 4849 1 1 17 GLU CD C 6.297 -7.572 0.326 1.00 . A A . 17 GLU CD 1 1 7 4850 1 1 17 GLU CG C 6.046 -6.063 0.357 1.00 . A A . 17 GLU CG 1 1 7 4851 1 1 17 GLU H H 5.522 -3.115 1.432 1.00 . A A . 17 GLU H 1 1 7 4852 1 1 17 GLU HA H 3.844 -5.398 1.375 1.00 . A A . 17 GLU HA 1 1 7 4853 1 1 17 GLU HB2 H 6.716 -4.864 2.009 1.00 . A A . 17 GLU HB2 1 1 7 4854 1 1 17 GLU HB3 H 6.049 -6.426 2.470 1.00 . A A . 17 GLU HB3 1 1 7 4855 1 1 17 GLU HG2 H 5.125 -5.840 -0.162 1.00 . A A . 17 GLU HG2 1 1 7 4856 1 1 17 GLU HG3 H 6.865 -5.554 -0.129 1.00 . A A . 17 GLU HG3 1 1 7 4857 1 1 17 GLU N N 4.670 -3.494 1.730 1.00 . A A . 17 GLU N 1 1 7 4858 1 1 17 GLU O O 3.531 -6.099 3.851 1.00 . A A . 17 GLU O 1 1 7 4859 1 1 17 GLU OE1 O 5.648 -8.276 1.081 1.00 . A A . 17 GLU OE1 1 1 7 4860 1 1 17 GLU OE2 O 7.133 -7.996 -0.455 1.00 . A A . 17 GLU OE2 1 1 7 4861 1 1 18 ASN C C 2.522 -3.982 5.844 1.00 . A A . 18 ASN C 1 1 7 4862 1 1 18 ASN CA C 4.023 -4.243 5.740 1.00 . A A . 18 ASN CA 1 1 7 4863 1 1 18 ASN CB C 4.780 -3.199 6.563 1.00 . A A . 18 ASN CB 1 1 7 4864 1 1 18 ASN CG C 6.191 -3.709 6.858 1.00 . A A . 18 ASN CG 1 1 7 4865 1 1 18 ASN H H 4.913 -3.353 3.992 1.00 . A A . 18 ASN H 1 1 7 4866 1 1 18 ASN HA H 4.246 -5.232 6.114 1.00 . A A . 18 ASN HA 1 1 7 4867 1 1 18 ASN HB2 H 4.839 -2.275 6.007 1.00 . A A . 18 ASN HB2 1 1 7 4868 1 1 18 ASN HB3 H 4.260 -3.028 7.494 1.00 . A A . 18 ASN HB3 1 1 7 4869 1 1 18 ASN HD21 H 6.345 -2.708 8.565 1.00 . A A . 18 ASN HD21 1 1 7 4870 1 1 18 ASN HD22 H 7.700 -3.639 8.146 1.00 . A A . 18 ASN HD22 1 1 7 4871 1 1 18 ASN N N 4.432 -4.147 4.312 1.00 . A A . 18 ASN N 1 1 7 4872 1 1 18 ASN ND2 N 6.796 -3.320 7.947 1.00 . A A . 18 ASN ND2 1 1 7 4873 1 1 18 ASN O O 1.841 -4.537 6.684 1.00 . A A . 18 ASN O 1 1 7 4874 1 1 18 ASN OD1 O 6.748 -4.467 6.091 1.00 . A A . 18 ASN OD1 1 1 7 4875 1 1 19 TYR C C -0.242 -4.155 4.876 1.00 . A A . 19 TYR C 1 1 7 4876 1 1 19 TYR CA C 0.540 -2.849 5.039 1.00 . A A . 19 TYR CA 1 1 7 4877 1 1 19 TYR CB C 0.177 -1.887 3.905 1.00 . A A . 19 TYR CB 1 1 7 4878 1 1 19 TYR CD1 C 1.983 -0.444 5.103 1.00 . A A . 19 TYR CD1 1 1 7 4879 1 1 19 TYR CD2 C 1.123 0.341 2.963 1.00 . A A . 19 TYR CD2 1 1 7 4880 1 1 19 TYR CE1 C 2.817 0.679 5.166 1.00 . A A . 19 TYR CE1 1 1 7 4881 1 1 19 TYR CE2 C 1.965 1.456 3.046 1.00 . A A . 19 TYR CE2 1 1 7 4882 1 1 19 TYR CG C 1.110 -0.637 3.989 1.00 . A A . 19 TYR CG 1 1 7 4883 1 1 19 TYR CZ C 2.808 1.625 4.143 1.00 . A A . 19 TYR CZ 1 1 7 4884 1 1 19 TYR H H 2.565 -2.704 4.319 1.00 . A A . 19 TYR H 1 1 7 4885 1 1 19 TYR HA H 0.293 -2.398 5.989 1.00 . A A . 19 TYR HA 1 1 7 4886 1 1 19 TYR HB2 H 0.301 -2.415 2.945 1.00 . A A . 19 TYR HB2 1 1 7 4887 1 1 19 TYR HB3 H -0.876 -1.594 4.014 1.00 . A A . 19 TYR HB3 1 1 7 4888 1 1 19 TYR HD1 H 2.021 -1.149 5.911 1.00 . A A . 19 TYR HD1 1 1 7 4889 1 1 19 TYR HD2 H 0.498 0.246 2.112 1.00 . A A . 19 TYR HD2 1 1 7 4890 1 1 19 TYR HE1 H 3.472 0.813 6.012 1.00 . A A . 19 TYR HE1 1 1 7 4891 1 1 19 TYR HE2 H 1.961 2.191 2.254 1.00 . A A . 19 TYR HE2 1 1 7 4892 1 1 19 TYR HH H 3.160 3.479 3.848 1.00 . A A . 19 TYR HH 1 1 7 4893 1 1 19 TYR N N 1.998 -3.142 4.992 1.00 . A A . 19 TYR N 1 1 7 4894 1 1 19 TYR O O -1.396 -4.249 5.243 1.00 . A A . 19 TYR O 1 1 7 4895 1 1 19 TYR OH O 3.633 2.729 4.215 1.00 . A A . 19 TYR OH 1 1 7 4896 1 1 20 CYS C C -0.168 -7.315 5.411 1.00 . A A . 20 CYS C 1 1 7 4897 1 1 20 CYS CA C -0.327 -6.465 4.149 1.00 . A A . 20 CYS CA 1 1 7 4898 1 1 20 CYS CB C 0.272 -7.215 2.957 1.00 . A A . 20 CYS CB 1 1 7 4899 1 1 20 CYS H H 1.314 -5.071 4.044 1.00 . A A . 20 CYS H 1 1 7 4900 1 1 20 CYS HA H -1.376 -6.281 3.970 1.00 . A A . 20 CYS HA 1 1 7 4901 1 1 20 CYS HB2 H 1.342 -7.290 3.080 1.00 . A A . 20 CYS HB2 1 1 7 4902 1 1 20 CYS HB3 H -0.155 -8.205 2.904 1.00 . A A . 20 CYS HB3 1 1 7 4903 1 1 20 CYS N N 0.381 -5.166 4.331 1.00 . A A . 20 CYS N 1 1 7 4904 1 1 20 CYS O O 0.210 -8.468 5.351 1.00 . A A . 20 CYS O 1 1 7 4905 1 1 20 CYS SG S -0.098 -6.317 1.429 1.00 . A A . 20 CYS SG 1 1 7 4906 1 1 21 ASN C C -1.692 -7.676 8.482 1.00 . A A . 21 ASN C 1 1 7 4907 1 1 21 ASN CA C -0.320 -7.535 7.818 1.00 . A A . 21 ASN CA 1 1 7 4908 1 1 21 ASN CB C 0.635 -6.809 8.769 1.00 . A A . 21 ASN CB 1 1 7 4909 1 1 21 ASN CG C 0.652 -7.526 10.119 1.00 . A A . 21 ASN CG 1 1 7 4910 1 1 21 ASN H H -0.761 -5.825 6.581 1.00 . A A . 21 ASN H 1 1 7 4911 1 1 21 ASN HA H 0.072 -8.515 7.595 1.00 . A A . 21 ASN HA 1 1 7 4912 1 1 21 ASN HB2 H 1.630 -6.809 8.347 1.00 . A A . 21 ASN HB2 1 1 7 4913 1 1 21 ASN HB3 H 0.303 -5.791 8.908 1.00 . A A . 21 ASN HB3 1 1 7 4914 1 1 21 ASN HD21 H 1.103 -9.292 9.333 1.00 . A A . 21 ASN HD21 1 1 7 4915 1 1 21 ASN HD22 H 0.930 -9.273 11.021 1.00 . A A . 21 ASN HD22 1 1 7 4916 1 1 21 ASN N N -0.455 -6.756 6.555 1.00 . A A . 21 ASN N 1 1 7 4917 1 1 21 ASN ND2 N 0.917 -8.803 10.161 1.00 . A A . 21 ASN ND2 1 1 7 4918 1 1 21 ASN O O -2.475 -8.486 8.013 1.00 . A A . 21 ASN O 1 1 7 4919 1 1 21 ASN OXT O -1.936 -6.973 9.448 1.00 . A A . 21 ASN OXT 1 1 7 4920 1 1 21 ASN OD1 O 0.422 -6.919 11.146 1.00 . A A . 21 ASN OD1 1 1 7 4921 2 2 1 PHE C C 10.042 0.567 -7.501 1.00 . B B . 22 PHE C 1 1 7 4922 2 2 1 PHE CA C 10.989 -0.211 -8.405 1.00 . B B . 22 PHE CA 1 1 7 4923 2 2 1 PHE CB C 11.311 -1.569 -7.774 1.00 . B B . 22 PHE CB 1 1 7 4924 2 2 1 PHE CD1 C 9.873 -2.894 -9.368 1.00 . B B . 22 PHE CD1 1 1 7 4925 2 2 1 PHE CD2 C 9.448 -3.077 -6.986 1.00 . B B . 22 PHE CD2 1 1 7 4926 2 2 1 PHE CE1 C 8.828 -3.792 -9.624 1.00 . B B . 22 PHE CE1 1 1 7 4927 2 2 1 PHE CE2 C 8.402 -3.974 -7.241 1.00 . B B . 22 PHE CE2 1 1 7 4928 2 2 1 PHE CG C 10.183 -2.536 -8.050 1.00 . B B . 22 PHE CG 1 1 7 4929 2 2 1 PHE CZ C 8.092 -4.332 -8.560 1.00 . B B . 22 PHE CZ 1 1 7 4930 2 2 1 PHE H1 H 13.044 -0.093 -8.729 1.00 . B B . 22 PHE H1 1 1 7 4931 2 2 1 PHE H2 H 12.423 1.157 -7.760 1.00 . B B . 22 PHE H2 1 1 7 4932 2 2 1 PHE H3 H 12.159 1.168 -9.438 1.00 . B B . 22 PHE H3 1 1 7 4933 2 2 1 PHE HA H 10.514 -0.356 -9.354 1.00 . B B . 22 PHE HA 1 1 7 4934 2 2 1 PHE HB2 H 12.227 -1.954 -8.197 1.00 . B B . 22 PHE HB2 1 1 7 4935 2 2 1 PHE HB3 H 11.429 -1.452 -6.707 1.00 . B B . 22 PHE HB3 1 1 7 4936 2 2 1 PHE HD1 H 10.441 -2.478 -10.188 1.00 . B B . 22 PHE HD1 1 1 7 4937 2 2 1 PHE HD2 H 9.687 -2.801 -5.969 1.00 . B B . 22 PHE HD2 1 1 7 4938 2 2 1 PHE HE1 H 8.588 -4.067 -10.640 1.00 . B B . 22 PHE HE1 1 1 7 4939 2 2 1 PHE HE2 H 7.835 -4.391 -6.422 1.00 . B B . 22 PHE HE2 1 1 7 4940 2 2 1 PHE HZ H 7.286 -5.023 -8.757 1.00 . B B . 22 PHE HZ 1 1 7 4941 2 2 1 PHE N N 12.249 0.564 -8.597 1.00 . B B . 22 PHE N 1 1 7 4942 2 2 1 PHE O O 9.279 -0.001 -6.745 1.00 . B B . 22 PHE O 1 1 7 4943 2 2 2 VAL C C 9.083 4.097 -7.284 1.00 . B B . 23 VAL C 1 1 7 4944 2 2 2 VAL CA C 9.186 2.677 -6.721 1.00 . B B . 23 VAL CA 1 1 7 4945 2 2 2 VAL CB C 9.746 2.683 -5.296 1.00 . B B . 23 VAL CB 1 1 7 4946 2 2 2 VAL CG1 C 10.777 3.799 -5.139 1.00 . B B . 23 VAL CG1 1 1 7 4947 2 2 2 VAL CG2 C 8.601 2.877 -4.302 1.00 . B B . 23 VAL CG2 1 1 7 4948 2 2 2 VAL H H 10.706 2.302 -8.191 1.00 . B B . 23 VAL H 1 1 7 4949 2 2 2 VAL HA H 8.203 2.239 -6.709 1.00 . B B . 23 VAL HA 1 1 7 4950 2 2 2 VAL HB H 10.223 1.737 -5.104 1.00 . B B . 23 VAL HB 1 1 7 4951 2 2 2 VAL HG11 H 11.617 3.431 -4.570 1.00 . B B . 23 VAL HG11 1 1 7 4952 2 2 2 VAL HG12 H 10.327 4.634 -4.626 1.00 . B B . 23 VAL HG12 1 1 7 4953 2 2 2 VAL HG13 H 11.114 4.112 -6.116 1.00 . B B . 23 VAL HG13 1 1 7 4954 2 2 2 VAL HG21 H 8.391 1.939 -3.810 1.00 . B B . 23 VAL HG21 1 1 7 4955 2 2 2 VAL HG22 H 7.720 3.211 -4.831 1.00 . B B . 23 VAL HG22 1 1 7 4956 2 2 2 VAL HG23 H 8.883 3.615 -3.567 1.00 . B B . 23 VAL HG23 1 1 7 4957 2 2 2 VAL N N 10.084 1.864 -7.574 1.00 . B B . 23 VAL N 1 1 7 4958 2 2 2 VAL O O 9.251 4.325 -8.466 1.00 . B B . 23 VAL O 1 1 7 4959 2 2 3 ASN C C 7.276 6.686 -7.466 1.00 . B B . 24 ASN C 1 1 7 4960 2 2 3 ASN CA C 8.670 6.462 -6.884 1.00 . B B . 24 ASN CA 1 1 7 4961 2 2 3 ASN CB C 9.720 6.781 -7.952 1.00 . B B . 24 ASN CB 1 1 7 4962 2 2 3 ASN CG C 11.035 6.080 -7.609 1.00 . B B . 24 ASN CG 1 1 7 4963 2 2 3 ASN H H 8.666 4.812 -5.499 1.00 . B B . 24 ASN H 1 1 7 4964 2 2 3 ASN HA H 8.812 7.117 -6.036 1.00 . B B . 24 ASN HA 1 1 7 4965 2 2 3 ASN HB2 H 9.369 6.439 -8.914 1.00 . B B . 24 ASN HB2 1 1 7 4966 2 2 3 ASN HB3 H 9.883 7.848 -7.986 1.00 . B B . 24 ASN HB3 1 1 7 4967 2 2 3 ASN HD21 H 11.212 5.239 -9.399 1.00 . B B . 24 ASN HD21 1 1 7 4968 2 2 3 ASN HD22 H 12.461 4.886 -8.304 1.00 . B B . 24 ASN HD22 1 1 7 4969 2 2 3 ASN N N 8.800 5.041 -6.438 1.00 . B B . 24 ASN N 1 1 7 4970 2 2 3 ASN ND2 N 11.618 5.340 -8.512 1.00 . B B . 24 ASN ND2 1 1 7 4971 2 2 3 ASN O O 7.125 7.119 -8.592 1.00 . B B . 24 ASN O 1 1 7 4972 2 2 3 ASN OD1 O 11.537 6.207 -6.510 1.00 . B B . 24 ASN OD1 1 1 7 4973 2 2 4 GLN C C 4.067 7.431 -6.228 1.00 . B B . 25 GLN C 1 1 7 4974 2 2 4 GLN CA C 4.870 6.593 -7.224 1.00 . B B . 25 GLN CA 1 1 7 4975 2 2 4 GLN CB C 4.191 5.234 -7.404 1.00 . B B . 25 GLN CB 1 1 7 4976 2 2 4 GLN CD C 4.923 3.486 -9.033 1.00 . B B . 25 GLN CD 1 1 7 4977 2 2 4 GLN CG C 4.224 4.839 -8.881 1.00 . B B . 25 GLN CG 1 1 7 4978 2 2 4 GLN H H 6.397 6.047 -5.805 1.00 . B B . 25 GLN H 1 1 7 4979 2 2 4 GLN HA H 4.910 7.104 -8.174 1.00 . B B . 25 GLN HA 1 1 7 4980 2 2 4 GLN HB2 H 4.711 4.489 -6.819 1.00 . B B . 25 GLN HB2 1 1 7 4981 2 2 4 GLN HB3 H 3.164 5.299 -7.075 1.00 . B B . 25 GLN HB3 1 1 7 4982 2 2 4 GLN HE21 H 3.511 2.489 -8.056 1.00 . B B . 25 GLN HE21 1 1 7 4983 2 2 4 GLN HE22 H 4.806 1.548 -8.619 1.00 . B B . 25 GLN HE22 1 1 7 4984 2 2 4 GLN HG2 H 3.214 4.767 -9.257 1.00 . B B . 25 GLN HG2 1 1 7 4985 2 2 4 GLN HG3 H 4.765 5.586 -9.441 1.00 . B B . 25 GLN HG3 1 1 7 4986 2 2 4 GLN N N 6.254 6.395 -6.710 1.00 . B B . 25 GLN N 1 1 7 4987 2 2 4 GLN NE2 N 4.367 2.419 -8.528 1.00 . B B . 25 GLN NE2 1 1 7 4988 2 2 4 GLN O O 4.467 7.625 -5.098 1.00 . B B . 25 GLN O 1 1 7 4989 2 2 4 GLN OE1 O 5.984 3.400 -9.617 1.00 . B B . 25 GLN OE1 1 1 7 4990 2 2 5 HIS C C 0.709 8.093 -5.683 1.00 . B B . 26 HIS C 1 1 7 4991 2 2 5 HIS CA C 2.096 8.742 -5.719 1.00 . B B . 26 HIS CA 1 1 7 4992 2 2 5 HIS CB C 1.997 10.165 -6.272 1.00 . B B . 26 HIS CB 1 1 7 4993 2 2 5 HIS CD2 C 1.705 12.399 -4.939 1.00 . B B . 26 HIS CD2 1 1 7 4994 2 2 5 HIS CE1 C 3.170 11.992 -3.386 1.00 . B B . 26 HIS CE1 1 1 7 4995 2 2 5 HIS CG C 2.229 11.156 -5.167 1.00 . B B . 26 HIS CG 1 1 7 4996 2 2 5 HIS H H 2.627 7.750 -7.554 1.00 . B B . 26 HIS H 1 1 7 4997 2 2 5 HIS HA H 2.530 8.752 -4.729 1.00 . B B . 26 HIS HA 1 1 7 4998 2 2 5 HIS HB2 H 2.741 10.304 -7.043 1.00 . B B . 26 HIS HB2 1 1 7 4999 2 2 5 HIS HB3 H 1.013 10.318 -6.689 1.00 . B B . 26 HIS HB3 1 1 7 5000 2 2 5 HIS HD2 H 0.946 12.882 -5.537 1.00 . B B . 26 HIS HD2 1 1 7 5001 2 2 5 HIS HE1 H 3.801 12.099 -2.515 1.00 . B B . 26 HIS HE1 1 1 7 5002 2 2 5 HIS HE2 H 2.133 13.810 -3.415 1.00 . B B . 26 HIS HE2 1 1 7 5003 2 2 5 HIS N N 2.933 7.924 -6.639 1.00 . B B . 26 HIS N 1 1 7 5004 2 2 5 HIS ND1 N 3.153 10.910 -4.174 1.00 . B B . 26 HIS ND1 1 1 7 5005 2 2 5 HIS NE2 N 2.301 12.931 -3.815 1.00 . B B . 26 HIS NE2 1 1 7 5006 2 2 5 HIS O O 0.275 7.524 -6.664 1.00 . B B . 26 HIS O 1 1 7 5007 2 2 6 LEU C C -2.225 7.948 -3.430 1.00 . B B . 27 LEU C 1 1 7 5008 2 2 6 LEU CA C -1.326 7.457 -4.568 1.00 . B B . 27 LEU CA 1 1 7 5009 2 2 6 LEU CB C -1.144 5.943 -4.411 1.00 . B B . 27 LEU CB 1 1 7 5010 2 2 6 LEU CD1 C 0.620 6.411 -2.666 1.00 . B B . 27 LEU CD1 1 1 7 5011 2 2 6 LEU CD2 C 0.314 4.121 -3.562 1.00 . B B . 27 LEU CD2 1 1 7 5012 2 2 6 LEU CG C 0.269 5.601 -3.916 1.00 . B B . 27 LEU CG 1 1 7 5013 2 2 6 LEU H H 0.362 8.569 -3.777 1.00 . B B . 27 LEU H 1 1 7 5014 2 2 6 LEU HA H -1.819 7.648 -5.509 1.00 . B B . 27 LEU HA 1 1 7 5015 2 2 6 LEU HB2 H -1.867 5.573 -3.699 1.00 . B B . 27 LEU HB2 1 1 7 5016 2 2 6 LEU HB3 H -1.311 5.467 -5.365 1.00 . B B . 27 LEU HB3 1 1 7 5017 2 2 6 LEU HD11 H 1.636 6.771 -2.744 1.00 . B B . 27 LEU HD11 1 1 7 5018 2 2 6 LEU HD12 H 0.529 5.782 -1.793 1.00 . B B . 27 LEU HD12 1 1 7 5019 2 2 6 LEU HD13 H -0.050 7.245 -2.575 1.00 . B B . 27 LEU HD13 1 1 7 5020 2 2 6 LEU HD21 H 0.809 3.578 -4.350 1.00 . B B . 27 LEU HD21 1 1 7 5021 2 2 6 LEU HD22 H -0.695 3.753 -3.444 1.00 . B B . 27 LEU HD22 1 1 7 5022 2 2 6 LEU HD23 H 0.855 3.992 -2.636 1.00 . B B . 27 LEU HD23 1 1 7 5023 2 2 6 LEU HG H 0.986 5.808 -4.695 1.00 . B B . 27 LEU HG 1 1 7 5024 2 2 6 LEU N N 0.010 8.130 -4.579 1.00 . B B . 27 LEU N 1 1 7 5025 2 2 6 LEU O O -1.785 8.220 -2.334 1.00 . B B . 27 LEU O 1 1 7 5026 2 2 7 CYS C C -5.670 7.487 -2.636 1.00 . B B . 28 CYS C 1 1 7 5027 2 2 7 CYS CA C -4.470 8.442 -2.641 1.00 . B B . 28 CYS CA 1 1 7 5028 2 2 7 CYS CB C -4.966 9.862 -2.932 1.00 . B B . 28 CYS CB 1 1 7 5029 2 2 7 CYS H H -3.832 7.763 -4.575 1.00 . B B . 28 CYS H 1 1 7 5030 2 2 7 CYS HA H -3.983 8.416 -1.677 1.00 . B B . 28 CYS HA 1 1 7 5031 2 2 7 CYS HB2 H -4.755 10.110 -3.962 1.00 . B B . 28 CYS HB2 1 1 7 5032 2 2 7 CYS HB3 H -6.033 9.909 -2.764 1.00 . B B . 28 CYS HB3 1 1 7 5033 2 2 7 CYS N N -3.503 8.017 -3.689 1.00 . B B . 28 CYS N 1 1 7 5034 2 2 7 CYS O O -5.987 6.868 -3.633 1.00 . B B . 28 CYS O 1 1 7 5035 2 2 7 CYS SG S -4.132 11.048 -1.848 1.00 . B B . 28 CYS SG 1 1 7 5036 2 2 8 GLY C C -7.375 5.235 -2.276 1.00 . B B . 29 GLY C 1 1 7 5037 2 2 8 GLY CA C -7.540 6.493 -1.415 1.00 . B B . 29 GLY CA 1 1 7 5038 2 2 8 GLY H H -6.063 7.908 -0.738 1.00 . B B . 29 GLY H 1 1 7 5039 2 2 8 GLY HA2 H -7.675 6.201 -0.384 1.00 . B B . 29 GLY HA2 1 1 7 5040 2 2 8 GLY HA3 H -8.413 7.035 -1.746 1.00 . B B . 29 GLY HA3 1 1 7 5041 2 2 8 GLY N N -6.342 7.384 -1.518 1.00 . B B . 29 GLY N 1 1 7 5042 2 2 8 GLY O O -6.414 4.502 -2.152 1.00 . B B . 29 GLY O 1 1 7 5043 2 2 9 SER C C -6.838 3.510 -4.483 1.00 . B B . 30 SER C 1 1 7 5044 2 2 9 SER CA C -8.268 3.764 -4.005 1.00 . B B . 30 SER CA 1 1 7 5045 2 2 9 SER CB C -9.172 3.967 -5.221 1.00 . B B . 30 SER CB 1 1 7 5046 2 2 9 SER H H -9.096 5.583 -3.201 1.00 . B B . 30 SER H 1 1 7 5047 2 2 9 SER HA H -8.614 2.908 -3.445 1.00 . B B . 30 SER HA 1 1 7 5048 2 2 9 SER HB2 H -9.665 4.922 -5.151 1.00 . B B . 30 SER HB2 1 1 7 5049 2 2 9 SER HB3 H -8.572 3.940 -6.121 1.00 . B B . 30 SER HB3 1 1 7 5050 2 2 9 SER HG H -9.794 2.206 -5.767 1.00 . B B . 30 SER HG 1 1 7 5051 2 2 9 SER N N -8.327 4.978 -3.136 1.00 . B B . 30 SER N 1 1 7 5052 2 2 9 SER O O -6.246 2.497 -4.169 1.00 . B B . 30 SER O 1 1 7 5053 2 2 9 SER OG O -10.150 2.936 -5.256 1.00 . B B . 30 SER OG 1 1 7 5054 2 2 10 ASP C C -4.028 3.635 -4.642 1.00 . B B . 31 ASP C 1 1 7 5055 2 2 10 ASP CA C -4.898 4.208 -5.760 1.00 . B B . 31 ASP CA 1 1 7 5056 2 2 10 ASP CB C -4.322 5.544 -6.225 1.00 . B B . 31 ASP CB 1 1 7 5057 2 2 10 ASP CG C -5.368 6.288 -7.056 1.00 . B B . 31 ASP CG 1 1 7 5058 2 2 10 ASP H H -6.785 5.216 -5.502 1.00 . B B . 31 ASP H 1 1 7 5059 2 2 10 ASP HA H -4.917 3.517 -6.589 1.00 . B B . 31 ASP HA 1 1 7 5060 2 2 10 ASP HB2 H -4.054 6.136 -5.365 1.00 . B B . 31 ASP HB2 1 1 7 5061 2 2 10 ASP HB3 H -3.445 5.367 -6.829 1.00 . B B . 31 ASP HB3 1 1 7 5062 2 2 10 ASP N N -6.285 4.411 -5.252 1.00 . B B . 31 ASP N 1 1 7 5063 2 2 10 ASP O O -3.121 2.863 -4.882 1.00 . B B . 31 ASP O 1 1 7 5064 2 2 10 ASP OD1 O -6.066 5.636 -7.815 1.00 . B B . 31 ASP OD1 1 1 7 5065 2 2 10 ASP OD2 O -5.456 7.497 -6.917 1.00 . B B . 31 ASP OD2 1 1 7 5066 2 2 11 LEU C C -3.809 1.960 -2.140 1.00 . B B . 32 LEU C 1 1 7 5067 2 2 11 LEU CA C -3.505 3.451 -2.290 1.00 . B B . 32 LEU CA 1 1 7 5068 2 2 11 LEU CB C -3.871 4.181 -0.996 1.00 . B B . 32 LEU CB 1 1 7 5069 2 2 11 LEU CD1 C -2.094 5.885 -0.565 1.00 . B B . 32 LEU CD1 1 1 7 5070 2 2 11 LEU CD2 C -2.898 4.424 1.293 1.00 . B B . 32 LEU CD2 1 1 7 5071 2 2 11 LEU CG C -2.596 4.486 -0.206 1.00 . B B . 32 LEU CG 1 1 7 5072 2 2 11 LEU H H -5.052 4.607 -3.244 1.00 . B B . 32 LEU H 1 1 7 5073 2 2 11 LEU HA H -2.453 3.586 -2.497 1.00 . B B . 32 LEU HA 1 1 7 5074 2 2 11 LEU HB2 H -4.377 5.105 -1.235 1.00 . B B . 32 LEU HB2 1 1 7 5075 2 2 11 LEU HB3 H -4.521 3.558 -0.401 1.00 . B B . 32 LEU HB3 1 1 7 5076 2 2 11 LEU HD11 H -2.935 6.556 -0.662 1.00 . B B . 32 LEU HD11 1 1 7 5077 2 2 11 LEU HD12 H -1.555 5.845 -1.500 1.00 . B B . 32 LEU HD12 1 1 7 5078 2 2 11 LEU HD13 H -1.437 6.242 0.214 1.00 . B B . 32 LEU HD13 1 1 7 5079 2 2 11 LEU HD21 H -2.280 3.667 1.754 1.00 . B B . 32 LEU HD21 1 1 7 5080 2 2 11 LEU HD22 H -3.939 4.178 1.442 1.00 . B B . 32 LEU HD22 1 1 7 5081 2 2 11 LEU HD23 H -2.686 5.383 1.743 1.00 . B B . 32 LEU HD23 1 1 7 5082 2 2 11 LEU HG H -1.838 3.756 -0.453 1.00 . B B . 32 LEU HG 1 1 7 5083 2 2 11 LEU N N -4.308 3.993 -3.419 1.00 . B B . 32 LEU N 1 1 7 5084 2 2 11 LEU O O -2.994 1.118 -2.461 1.00 . B B . 32 LEU O 1 1 7 5085 2 2 12 VAL C C -4.884 -0.585 -2.740 1.00 . B B . 33 VAL C 1 1 7 5086 2 2 12 VAL CA C -5.339 0.188 -1.504 1.00 . B B . 33 VAL CA 1 1 7 5087 2 2 12 VAL CB C -6.855 0.048 -1.351 1.00 . B B . 33 VAL CB 1 1 7 5088 2 2 12 VAL CG1 C -7.298 0.700 -0.043 1.00 . B B . 33 VAL CG1 1 1 7 5089 2 2 12 VAL CG2 C -7.553 0.737 -2.525 1.00 . B B . 33 VAL CG2 1 1 7 5090 2 2 12 VAL H H -5.626 2.322 -1.419 1.00 . B B . 33 VAL H 1 1 7 5091 2 2 12 VAL HA H -4.848 -0.210 -0.628 1.00 . B B . 33 VAL HA 1 1 7 5092 2 2 12 VAL HB H -7.119 -0.999 -1.336 1.00 . B B . 33 VAL HB 1 1 7 5093 2 2 12 VAL HG11 H -6.428 1.019 0.512 1.00 . B B . 33 VAL HG11 1 1 7 5094 2 2 12 VAL HG12 H -7.858 -0.014 0.543 1.00 . B B . 33 VAL HG12 1 1 7 5095 2 2 12 VAL HG13 H -7.920 1.555 -0.261 1.00 . B B . 33 VAL HG13 1 1 7 5096 2 2 12 VAL HG21 H -7.356 1.799 -2.488 1.00 . B B . 33 VAL HG21 1 1 7 5097 2 2 12 VAL HG22 H -8.618 0.566 -2.460 1.00 . B B . 33 VAL HG22 1 1 7 5098 2 2 12 VAL HG23 H -7.180 0.333 -3.455 1.00 . B B . 33 VAL HG23 1 1 7 5099 2 2 12 VAL N N -4.981 1.626 -1.664 1.00 . B B . 33 VAL N 1 1 7 5100 2 2 12 VAL O O -4.397 -1.695 -2.647 1.00 . B B . 33 VAL O 1 1 7 5101 2 2 13 GLU C C -3.084 -0.917 -5.079 1.00 . B B . 34 GLU C 1 1 7 5102 2 2 13 GLU CA C -4.596 -0.699 -5.136 1.00 . B B . 34 GLU CA 1 1 7 5103 2 2 13 GLU CB C -4.944 0.164 -6.349 1.00 . B B . 34 GLU CB 1 1 7 5104 2 2 13 GLU CD C -5.880 -1.016 -8.344 1.00 . B B . 34 GLU CD 1 1 7 5105 2 2 13 GLU CG C -6.223 -0.362 -7.003 1.00 . B B . 34 GLU CG 1 1 7 5106 2 2 13 GLU H H -5.417 0.894 -3.953 1.00 . B B . 34 GLU H 1 1 7 5107 2 2 13 GLU HA H -5.097 -1.653 -5.212 1.00 . B B . 34 GLU HA 1 1 7 5108 2 2 13 GLU HB2 H -5.096 1.185 -6.031 1.00 . B B . 34 GLU HB2 1 1 7 5109 2 2 13 GLU HB3 H -4.136 0.126 -7.061 1.00 . B B . 34 GLU HB3 1 1 7 5110 2 2 13 GLU HG2 H -6.687 -1.091 -6.354 1.00 . B B . 34 GLU HG2 1 1 7 5111 2 2 13 GLU HG3 H -6.905 0.458 -7.170 1.00 . B B . 34 GLU HG3 1 1 7 5112 2 2 13 GLU N N -5.030 -0.004 -3.898 1.00 . B B . 34 GLU N 1 1 7 5113 2 2 13 GLU O O -2.596 -2.009 -5.285 1.00 . B B . 34 GLU O 1 1 7 5114 2 2 13 GLU OE1 O -5.535 -0.291 -9.263 1.00 . B B . 34 GLU OE1 1 1 7 5115 2 2 13 GLU OE2 O -5.969 -2.230 -8.428 1.00 . B B . 34 GLU OE2 1 1 7 5116 2 2 14 ALA C C -0.505 -1.159 -3.756 1.00 . B B . 35 ALA C 1 1 7 5117 2 2 14 ALA CA C -0.860 -0.022 -4.718 1.00 . B B . 35 ALA CA 1 1 7 5118 2 2 14 ALA CB C -0.252 1.287 -4.211 1.00 . B B . 35 ALA CB 1 1 7 5119 2 2 14 ALA H H -2.758 0.989 -4.628 1.00 . B B . 35 ALA H 1 1 7 5120 2 2 14 ALA HA H -0.472 -0.244 -5.702 1.00 . B B . 35 ALA HA 1 1 7 5121 2 2 14 ALA HB1 H -0.792 1.620 -3.337 1.00 . B B . 35 ALA HB1 1 1 7 5122 2 2 14 ALA HB2 H -0.319 2.037 -4.984 1.00 . B B . 35 ALA HB2 1 1 7 5123 2 2 14 ALA HB3 H 0.785 1.127 -3.954 1.00 . B B . 35 ALA HB3 1 1 7 5124 2 2 14 ALA N N -2.341 0.119 -4.794 1.00 . B B . 35 ALA N 1 1 7 5125 2 2 14 ALA O O 0.156 -2.111 -4.122 1.00 . B B . 35 ALA O 1 1 7 5126 2 2 15 LEU C C -1.140 -3.485 -2.133 1.00 . B B . 36 LEU C 1 1 7 5127 2 2 15 LEU CA C -0.631 -2.164 -1.559 1.00 . B B . 36 LEU CA 1 1 7 5128 2 2 15 LEU CB C -1.334 -1.894 -0.220 1.00 . B B . 36 LEU CB 1 1 7 5129 2 2 15 LEU CD1 C 0.342 0.003 -0.218 1.00 . B B . 36 LEU CD1 1 1 7 5130 2 2 15 LEU CD2 C -2.105 0.487 -0.147 1.00 . B B . 36 LEU CD2 1 1 7 5131 2 2 15 LEU CG C -1.014 -0.483 0.305 1.00 . B B . 36 LEU CG 1 1 7 5132 2 2 15 LEU H H -1.479 -0.305 -2.249 1.00 . B B . 36 LEU H 1 1 7 5133 2 2 15 LEU HA H 0.436 -2.219 -1.405 1.00 . B B . 36 LEU HA 1 1 7 5134 2 2 15 LEU HB2 H -2.402 -1.985 -0.356 1.00 . B B . 36 LEU HB2 1 1 7 5135 2 2 15 LEU HB3 H -1.006 -2.624 0.505 1.00 . B B . 36 LEU HB3 1 1 7 5136 2 2 15 LEU HD11 H 0.666 0.856 0.358 1.00 . B B . 36 LEU HD11 1 1 7 5137 2 2 15 LEU HD12 H 0.244 0.286 -1.256 1.00 . B B . 36 LEU HD12 1 1 7 5138 2 2 15 LEU HD13 H 1.068 -0.791 -0.128 1.00 . B B . 36 LEU HD13 1 1 7 5139 2 2 15 LEU HD21 H -2.848 -0.049 -0.718 1.00 . B B . 36 LEU HD21 1 1 7 5140 2 2 15 LEU HD22 H -1.667 1.260 -0.761 1.00 . B B . 36 LEU HD22 1 1 7 5141 2 2 15 LEU HD23 H -2.569 0.935 0.718 1.00 . B B . 36 LEU HD23 1 1 7 5142 2 2 15 LEU HG H -0.990 -0.508 1.384 1.00 . B B . 36 LEU HG 1 1 7 5143 2 2 15 LEU N N -0.943 -1.075 -2.528 1.00 . B B . 36 LEU N 1 1 7 5144 2 2 15 LEU O O -0.682 -4.554 -1.777 1.00 . B B . 36 LEU O 1 1 7 5145 2 2 16 TYR C C -1.742 -5.104 -4.780 1.00 . B B . 37 TYR C 1 1 7 5146 2 2 16 TYR CA C -2.648 -4.647 -3.635 1.00 . B B . 37 TYR CA 1 1 7 5147 2 2 16 TYR CB C -4.054 -4.360 -4.170 1.00 . B B . 37 TYR CB 1 1 7 5148 2 2 16 TYR CD1 C -4.401 -6.874 -4.638 1.00 . B B . 37 TYR CD1 1 1 7 5149 2 2 16 TYR CD2 C -5.004 -5.286 -6.381 1.00 . B B . 37 TYR CD2 1 1 7 5150 2 2 16 TYR CE1 C -4.801 -7.927 -5.471 1.00 . B B . 37 TYR CE1 1 1 7 5151 2 2 16 TYR CE2 C -5.399 -6.350 -7.201 1.00 . B B . 37 TYR CE2 1 1 7 5152 2 2 16 TYR CG C -4.499 -5.530 -5.082 1.00 . B B . 37 TYR CG 1 1 7 5153 2 2 16 TYR CZ C -5.299 -7.665 -6.747 1.00 . B B . 37 TYR CZ 1 1 7 5154 2 2 16 TYR H H -2.434 -2.533 -3.290 1.00 . B B . 37 TYR H 1 1 7 5155 2 2 16 TYR HA H -2.700 -5.424 -2.887 1.00 . B B . 37 TYR HA 1 1 7 5156 2 2 16 TYR HB2 H -4.735 -4.243 -3.326 1.00 . B B . 37 TYR HB2 1 1 7 5157 2 2 16 TYR HB3 H -4.038 -3.428 -4.729 1.00 . B B . 37 TYR HB3 1 1 7 5158 2 2 16 TYR HD1 H -4.017 -7.107 -3.662 1.00 . B B . 37 TYR HD1 1 1 7 5159 2 2 16 TYR HD2 H -5.086 -4.289 -6.756 1.00 . B B . 37 TYR HD2 1 1 7 5160 2 2 16 TYR HE1 H -4.722 -8.946 -5.123 1.00 . B B . 37 TYR HE1 1 1 7 5161 2 2 16 TYR HE2 H -5.786 -6.152 -8.190 1.00 . B B . 37 TYR HE2 1 1 7 5162 2 2 16 TYR HH H -5.436 -8.491 -8.463 1.00 . B B . 37 TYR HH 1 1 7 5163 2 2 16 TYR N N -2.089 -3.410 -3.023 1.00 . B B . 37 TYR N 1 1 7 5164 2 2 16 TYR O O -1.830 -6.224 -5.243 1.00 . B B . 37 TYR O 1 1 7 5165 2 2 16 TYR OH O -5.690 -8.707 -7.562 1.00 . B B . 37 TYR OH 1 1 7 5166 2 2 17 LEU C C 1.266 -5.362 -5.726 1.00 . B B . 38 LEU C 1 1 7 5167 2 2 17 LEU CA C 0.057 -4.653 -6.335 1.00 . B B . 38 LEU CA 1 1 7 5168 2 2 17 LEU CB C 0.534 -3.421 -7.113 1.00 . B B . 38 LEU CB 1 1 7 5169 2 2 17 LEU CD1 C -0.064 -1.124 -7.889 1.00 . B B . 38 LEU CD1 1 1 7 5170 2 2 17 LEU CD2 C -1.848 -2.843 -7.600 1.00 . B B . 38 LEU CD2 1 1 7 5171 2 2 17 LEU CG C -0.522 -2.320 -7.052 1.00 . B B . 38 LEU CG 1 1 7 5172 2 2 17 LEU H H -0.798 -3.359 -4.836 1.00 . B B . 38 LEU H 1 1 7 5173 2 2 17 LEU HA H -0.459 -5.325 -7.004 1.00 . B B . 38 LEU HA 1 1 7 5174 2 2 17 LEU HB2 H 1.456 -3.059 -6.680 1.00 . B B . 38 LEU HB2 1 1 7 5175 2 2 17 LEU HB3 H 0.707 -3.694 -8.144 1.00 . B B . 38 LEU HB3 1 1 7 5176 2 2 17 LEU HD11 H 0.956 -0.876 -7.636 1.00 . B B . 38 LEU HD11 1 1 7 5177 2 2 17 LEU HD12 H -0.702 -0.277 -7.685 1.00 . B B . 38 LEU HD12 1 1 7 5178 2 2 17 LEU HD13 H -0.124 -1.375 -8.938 1.00 . B B . 38 LEU HD13 1 1 7 5179 2 2 17 LEU HD21 H -2.623 -2.114 -7.416 1.00 . B B . 38 LEU HD21 1 1 7 5180 2 2 17 LEU HD22 H -2.100 -3.769 -7.106 1.00 . B B . 38 LEU HD22 1 1 7 5181 2 2 17 LEU HD23 H -1.756 -3.012 -8.661 1.00 . B B . 38 LEU HD23 1 1 7 5182 2 2 17 LEU HG H -0.653 -2.011 -6.032 1.00 . B B . 38 LEU HG 1 1 7 5183 2 2 17 LEU N N -0.862 -4.252 -5.231 1.00 . B B . 38 LEU N 1 1 7 5184 2 2 17 LEU O O 1.696 -6.398 -6.193 1.00 . B B . 38 LEU O 1 1 7 5185 2 2 18 VAL C C 2.554 -6.753 -3.370 1.00 . B B . 39 VAL C 1 1 7 5186 2 2 18 VAL CA C 2.988 -5.438 -4.023 1.00 . B B . 39 VAL CA 1 1 7 5187 2 2 18 VAL CB C 3.543 -4.484 -2.960 1.00 . B B . 39 VAL CB 1 1 7 5188 2 2 18 VAL CG1 C 3.569 -3.063 -3.526 1.00 . B B . 39 VAL CG1 1 1 7 5189 2 2 18 VAL CG2 C 2.650 -4.514 -1.715 1.00 . B B . 39 VAL CG2 1 1 7 5190 2 2 18 VAL H H 1.442 -3.973 -4.320 1.00 . B B . 39 VAL H 1 1 7 5191 2 2 18 VAL HA H 3.749 -5.638 -4.763 1.00 . B B . 39 VAL HA 1 1 7 5192 2 2 18 VAL HB H 4.546 -4.783 -2.695 1.00 . B B . 39 VAL HB 1 1 7 5193 2 2 18 VAL HG11 H 2.563 -2.672 -3.562 1.00 . B B . 39 VAL HG11 1 1 7 5194 2 2 18 VAL HG12 H 3.983 -3.082 -4.524 1.00 . B B . 39 VAL HG12 1 1 7 5195 2 2 18 VAL HG13 H 4.179 -2.434 -2.895 1.00 . B B . 39 VAL HG13 1 1 7 5196 2 2 18 VAL HG21 H 3.174 -5.006 -0.909 1.00 . B B . 39 VAL HG21 1 1 7 5197 2 2 18 VAL HG22 H 1.741 -5.054 -1.936 1.00 . B B . 39 VAL HG22 1 1 7 5198 2 2 18 VAL HG23 H 2.406 -3.503 -1.422 1.00 . B B . 39 VAL HG23 1 1 7 5199 2 2 18 VAL N N 1.812 -4.807 -4.679 1.00 . B B . 39 VAL N 1 1 7 5200 2 2 18 VAL O O 3.357 -7.630 -3.119 1.00 . B B . 39 VAL O 1 1 7 5201 2 2 19 CYS C C -0.110 -8.894 -3.452 1.00 . B B . 40 CYS C 1 1 7 5202 2 2 19 CYS CA C 0.793 -8.149 -2.465 1.00 . B B . 40 CYS CA 1 1 7 5203 2 2 19 CYS CB C -0.002 -7.802 -1.205 1.00 . B B . 40 CYS CB 1 1 7 5204 2 2 19 CYS H H 0.656 -6.175 -3.311 1.00 . B B . 40 CYS H 1 1 7 5205 2 2 19 CYS HA H 1.633 -8.774 -2.201 1.00 . B B . 40 CYS HA 1 1 7 5206 2 2 19 CYS HB2 H -0.744 -7.053 -1.443 1.00 . B B . 40 CYS HB2 1 1 7 5207 2 2 19 CYS HB3 H -0.493 -8.688 -0.833 1.00 . B B . 40 CYS HB3 1 1 7 5208 2 2 19 CYS N N 1.285 -6.894 -3.097 1.00 . B B . 40 CYS N 1 1 7 5209 2 2 19 CYS O O -0.853 -9.781 -3.082 1.00 . B B . 40 CYS O 1 1 7 5210 2 2 19 CYS SG S 1.123 -7.158 0.058 1.00 . B B . 40 CYS SG 1 1 7 5211 2 2 20 GLY C C -0.875 -10.735 -5.479 1.00 . B B . 41 GLY C 1 1 7 5212 2 2 20 GLY CA C -0.906 -9.223 -5.717 1.00 . B B . 41 GLY CA 1 1 7 5213 2 2 20 GLY H H 0.555 -7.820 -4.983 1.00 . B B . 41 GLY H 1 1 7 5214 2 2 20 GLY HA2 H -1.922 -8.865 -5.628 1.00 . B B . 41 GLY HA2 1 1 7 5215 2 2 20 GLY HA3 H -0.534 -9.010 -6.707 1.00 . B B . 41 GLY HA3 1 1 7 5216 2 2 20 GLY N N -0.051 -8.539 -4.706 1.00 . B B . 41 GLY N 1 1 7 5217 2 2 20 GLY O O -1.878 -11.411 -5.593 1.00 . B B . 41 GLY O 1 1 7 5218 2 2 21 GLU C C 1.021 -12.989 -3.550 1.00 . B B . 42 GLU C 1 1 7 5219 2 2 21 GLU CA C 0.360 -12.739 -4.907 1.00 . B B . 42 GLU CA 1 1 7 5220 2 2 21 GLU CB C 1.199 -13.387 -6.011 1.00 . B B . 42 GLU CB 1 1 7 5221 2 2 21 GLU CD C 2.049 -11.650 -7.594 1.00 . B B . 42 GLU CD 1 1 7 5222 2 2 21 GLU CG C 2.382 -12.480 -6.352 1.00 . B B . 42 GLU CG 1 1 7 5223 2 2 21 GLU H H 1.067 -10.710 -5.064 1.00 . B B . 42 GLU H 1 1 7 5224 2 2 21 GLU HA H -0.631 -13.168 -4.910 1.00 . B B . 42 GLU HA 1 1 7 5225 2 2 21 GLU HB2 H 1.565 -14.345 -5.670 1.00 . B B . 42 GLU HB2 1 1 7 5226 2 2 21 GLU HB3 H 0.591 -13.526 -6.891 1.00 . B B . 42 GLU HB3 1 1 7 5227 2 2 21 GLU HG2 H 2.582 -11.820 -5.520 1.00 . B B . 42 GLU HG2 1 1 7 5228 2 2 21 GLU HG3 H 3.254 -13.084 -6.550 1.00 . B B . 42 GLU HG3 1 1 7 5229 2 2 21 GLU N N 0.269 -11.272 -5.151 1.00 . B B . 42 GLU N 1 1 7 5230 2 2 21 GLU O O 1.480 -14.076 -3.262 1.00 . B B . 42 GLU O 1 1 7 5231 2 2 21 GLU OE1 O 1.266 -12.120 -8.403 1.00 . B B . 42 GLU OE1 1 1 7 5232 2 2 21 GLU OE2 O 2.583 -10.559 -7.715 1.00 . B B . 42 GLU OE2 1 1 7 5233 2 2 22 ARG C C 0.788 -11.573 -0.303 1.00 . B B . 43 ARG C 1 1 7 5234 2 2 22 ARG CA C 1.704 -12.163 -1.377 1.00 . B B . 43 ARG CA 1 1 7 5235 2 2 22 ARG CB C 3.052 -11.440 -1.350 1.00 . B B . 43 ARG CB 1 1 7 5236 2 2 22 ARG CD C 4.223 -12.902 0.304 1.00 . B B . 43 ARG CD 1 1 7 5237 2 2 22 ARG CG C 3.643 -11.508 0.060 1.00 . B B . 43 ARG CG 1 1 7 5238 2 2 22 ARG CZ C 5.725 -12.681 2.190 1.00 . B B . 43 ARG CZ 1 1 7 5239 2 2 22 ARG H H 0.697 -11.119 -2.969 1.00 . B B . 43 ARG H 1 1 7 5240 2 2 22 ARG HA H 1.855 -13.215 -1.184 1.00 . B B . 43 ARG HA 1 1 7 5241 2 2 22 ARG HB2 H 3.727 -11.914 -2.047 1.00 . B B . 43 ARG HB2 1 1 7 5242 2 2 22 ARG HB3 H 2.911 -10.407 -1.629 1.00 . B B . 43 ARG HB3 1 1 7 5243 2 2 22 ARG HD2 H 3.584 -13.443 0.984 1.00 . B B . 43 ARG HD2 1 1 7 5244 2 2 22 ARG HD3 H 4.286 -13.435 -0.633 1.00 . B B . 43 ARG HD3 1 1 7 5245 2 2 22 ARG HE H 6.373 -12.764 0.315 1.00 . B B . 43 ARG HE 1 1 7 5246 2 2 22 ARG HG2 H 4.425 -10.768 0.158 1.00 . B B . 43 ARG HG2 1 1 7 5247 2 2 22 ARG HG3 H 2.868 -11.312 0.785 1.00 . B B . 43 ARG HG3 1 1 7 5248 2 2 22 ARG HH11 H 4.829 -10.895 2.311 1.00 . B B . 43 ARG HH11 1 1 7 5249 2 2 22 ARG HH12 H 5.388 -11.556 3.811 1.00 . B B . 43 ARG HH12 1 1 7 5250 2 2 22 ARG HH21 H 6.648 -14.449 2.372 1.00 . B B . 43 ARG HH21 1 1 7 5251 2 2 22 ARG HH22 H 6.416 -13.570 3.846 1.00 . B B . 43 ARG HH22 1 1 7 5252 2 2 22 ARG N N 1.073 -11.988 -2.715 1.00 . B B . 43 ARG N 1 1 7 5253 2 2 22 ARG NE N 5.584 -12.776 0.896 1.00 . B B . 43 ARG NE 1 1 7 5254 2 2 22 ARG NH1 N 5.279 -11.629 2.820 1.00 . B B . 43 ARG NH1 1 1 7 5255 2 2 22 ARG NH2 N 6.308 -13.641 2.854 1.00 . B B . 43 ARG NH2 1 1 7 5256 2 2 22 ARG O O 0.599 -10.376 -0.224 1.00 . B B . 43 ARG O 1 1 7 5257 2 2 23 GLY C C -2.128 -11.874 1.070 1.00 . B B . 44 GLY C 1 1 7 5258 2 2 23 GLY CA C -0.690 -11.896 1.590 1.00 . B B . 44 GLY CA 1 1 7 5259 2 2 23 GLY H H 0.383 -13.368 0.439 1.00 . B B . 44 GLY H 1 1 7 5260 2 2 23 GLY HA2 H -0.627 -12.542 2.454 1.00 . B B . 44 GLY HA2 1 1 7 5261 2 2 23 GLY HA3 H -0.395 -10.895 1.865 1.00 . B B . 44 GLY HA3 1 1 7 5262 2 2 23 GLY N N 0.217 -12.406 0.522 1.00 . B B . 44 GLY N 1 1 7 5263 2 2 23 GLY O O -2.662 -12.881 0.649 1.00 . B B . 44 GLY O 1 1 7 5264 2 2 24 GLY C C -5.116 -10.498 1.787 1.00 . B B . 45 GLY C 1 1 7 5265 2 2 24 GLY CA C -4.165 -10.650 0.600 1.00 . B B . 45 GLY CA 1 1 7 5266 2 2 24 GLY H H -2.315 -9.932 1.438 1.00 . B B . 45 GLY H 1 1 7 5267 2 2 24 GLY HA2 H -4.265 -9.796 -0.055 1.00 . B B . 45 GLY HA2 1 1 7 5268 2 2 24 GLY HA3 H -4.411 -11.551 0.059 1.00 . B B . 45 GLY HA3 1 1 7 5269 2 2 24 GLY N N -2.762 -10.733 1.095 1.00 . B B . 45 GLY N 1 1 7 5270 2 2 24 GLY O O -6.182 -11.080 1.821 1.00 . B B . 45 GLY O 1 1 7 5271 2 2 25 PHE C C -6.205 -8.110 3.924 1.00 . B B . 46 PHE C 1 1 7 5272 2 2 25 PHE CA C -5.620 -9.524 3.947 1.00 . B B . 46 PHE CA 1 1 7 5273 2 2 25 PHE CB C -4.801 -9.712 5.226 1.00 . B B . 46 PHE CB 1 1 7 5274 2 2 25 PHE CD1 C -6.951 -9.957 6.670 1.00 . B B . 46 PHE CD1 1 1 7 5275 2 2 25 PHE CD2 C -5.268 -8.345 7.383 1.00 . B B . 46 PHE CD2 1 1 7 5276 2 2 25 PHE CE1 C -7.739 -9.604 7.773 1.00 . B B . 46 PHE CE1 1 1 7 5277 2 2 25 PHE CE2 C -6.072 -8.010 8.480 1.00 . B B . 46 PHE CE2 1 1 7 5278 2 2 25 PHE CG C -5.688 -9.331 6.452 1.00 . B B . 46 PHE CG 1 1 7 5279 2 2 25 PHE CZ C -7.300 -8.637 8.674 1.00 . B B . 46 PHE CZ 1 1 7 5280 2 2 25 PHE H H -3.876 -9.257 2.713 1.00 . B B . 46 PHE H 1 1 7 5281 2 2 25 PHE HA H -6.422 -10.247 3.922 1.00 . B B . 46 PHE HA 1 1 7 5282 2 2 25 PHE HB2 H -4.473 -10.763 5.280 1.00 . B B . 46 PHE HB2 1 1 7 5283 2 2 25 PHE HB3 H -3.912 -9.068 5.174 1.00 . B B . 46 PHE HB3 1 1 7 5284 2 2 25 PHE HD1 H -7.328 -10.699 5.995 1.00 . B B . 46 PHE HD1 1 1 7 5285 2 2 25 PHE HD2 H -4.338 -7.840 7.265 1.00 . B B . 46 PHE HD2 1 1 7 5286 2 2 25 PHE HE1 H -8.692 -10.087 7.928 1.00 . B B . 46 PHE HE1 1 1 7 5287 2 2 25 PHE HE2 H -5.738 -7.257 9.179 1.00 . B B . 46 PHE HE2 1 1 7 5288 2 2 25 PHE HZ H -7.913 -8.371 9.523 1.00 . B B . 46 PHE HZ 1 1 7 5289 2 2 25 PHE N N -4.739 -9.717 2.762 1.00 . B B . 46 PHE N 1 1 7 5290 2 2 25 PHE O O -6.967 -7.730 4.791 1.00 . B B . 46 PHE O 1 1 7 5291 2 2 26 TYR C C -7.817 -5.958 2.321 1.00 . B B . 47 TYR C 1 1 7 5292 2 2 26 TYR CA C -6.387 -5.937 2.870 1.00 . B B . 47 TYR CA 1 1 7 5293 2 2 26 TYR CB C -5.500 -5.098 1.947 1.00 . B B . 47 TYR CB 1 1 7 5294 2 2 26 TYR CD1 C -6.611 -2.763 2.210 1.00 . B B . 47 TYR CD1 1 1 7 5295 2 2 26 TYR CD2 C -4.403 -3.093 3.186 1.00 . B B . 47 TYR CD2 1 1 7 5296 2 2 26 TYR CE1 C -6.604 -1.441 2.673 1.00 . B B . 47 TYR CE1 1 1 7 5297 2 2 26 TYR CE2 C -4.419 -1.768 3.640 1.00 . B B . 47 TYR CE2 1 1 7 5298 2 2 26 TYR CG C -5.503 -3.622 2.456 1.00 . B B . 47 TYR CG 1 1 7 5299 2 2 26 TYR CZ C -5.513 -0.946 3.383 1.00 . B B . 47 TYR CZ 1 1 7 5300 2 2 26 TYR H H -5.235 -7.649 2.253 1.00 . B B . 47 TYR H 1 1 7 5301 2 2 26 TYR HA H -6.389 -5.502 3.858 1.00 . B B . 47 TYR HA 1 1 7 5302 2 2 26 TYR HB2 H -4.483 -5.523 1.957 1.00 . B B . 47 TYR HB2 1 1 7 5303 2 2 26 TYR HB3 H -5.898 -5.157 0.924 1.00 . B B . 47 TYR HB3 1 1 7 5304 2 2 26 TYR HD1 H -7.471 -3.108 1.676 1.00 . B B . 47 TYR HD1 1 1 7 5305 2 2 26 TYR HD2 H -3.552 -3.696 3.413 1.00 . B B . 47 TYR HD2 1 1 7 5306 2 2 26 TYR HE1 H -7.452 -0.800 2.479 1.00 . B B . 47 TYR HE1 1 1 7 5307 2 2 26 TYR HE2 H -3.575 -1.380 4.191 1.00 . B B . 47 TYR HE2 1 1 7 5308 2 2 26 TYR HH H -4.620 0.588 4.087 1.00 . B B . 47 TYR HH 1 1 7 5309 2 2 26 TYR N N -5.853 -7.326 2.942 1.00 . B B . 47 TYR N 1 1 7 5310 2 2 26 TYR O O -8.149 -5.237 1.401 1.00 . B B . 47 TYR O 1 1 7 5311 2 2 26 TYR OH O -5.517 0.359 3.833 1.00 . B B . 47 TYR OH 1 1 7 5312 2 2 27 THR C C -10.999 -6.302 3.487 1.00 . B B . 48 THR C 1 1 7 5313 2 2 27 THR CA C -10.075 -6.831 2.397 1.00 . B B . 48 THR CA 1 1 7 5314 2 2 27 THR CB C -10.446 -8.279 2.067 1.00 . B B . 48 THR CB 1 1 7 5315 2 2 27 THR CG2 C -11.759 -8.305 1.281 1.00 . B B . 48 THR CG2 1 1 7 5316 2 2 27 THR H H -8.383 -7.342 3.627 1.00 . B B . 48 THR H 1 1 7 5317 2 2 27 THR HA H -10.178 -6.224 1.518 1.00 . B B . 48 THR HA 1 1 7 5318 2 2 27 THR HB H -10.568 -8.838 2.982 1.00 . B B . 48 THR HB 1 1 7 5319 2 2 27 THR HG1 H -9.010 -9.564 1.805 1.00 . B B . 48 THR HG1 1 1 7 5320 2 2 27 THR HG21 H -11.766 -9.158 0.619 1.00 . B B . 48 THR HG21 1 1 7 5321 2 2 27 THR HG22 H -11.849 -7.399 0.701 1.00 . B B . 48 THR HG22 1 1 7 5322 2 2 27 THR HG23 H -12.589 -8.377 1.969 1.00 . B B . 48 THR HG23 1 1 7 5323 2 2 27 THR N N -8.667 -6.773 2.882 1.00 . B B . 48 THR N 1 1 7 5324 2 2 27 THR O O -11.569 -5.235 3.376 1.00 . B B . 48 THR O 1 1 7 5325 2 2 27 THR OG1 O -9.413 -8.864 1.286 1.00 . B B . 48 THR OG1 1 1 7 5326 2 2 28 LYS C C -13.487 -6.632 5.214 1.00 . B B . 49 LYS C 1 1 7 5327 2 2 28 LYS CA C -12.021 -6.590 5.659 1.00 . B B . 49 LYS CA 1 1 7 5328 2 2 28 LYS CB C -11.645 -5.158 6.043 1.00 . B B . 49 LYS CB 1 1 7 5329 2 2 28 LYS CD C -11.175 -3.773 8.066 1.00 . B B . 49 LYS CD 1 1 7 5330 2 2 28 LYS CE C -12.052 -2.799 8.855 1.00 . B B . 49 LYS CE 1 1 7 5331 2 2 28 LYS CG C -12.045 -4.894 7.495 1.00 . B B . 49 LYS CG 1 1 7 5332 2 2 28 LYS H H -10.666 -7.892 4.606 1.00 . B B . 49 LYS H 1 1 7 5333 2 2 28 LYS HA H -11.882 -7.238 6.512 1.00 . B B . 49 LYS HA 1 1 7 5334 2 2 28 LYS HB2 H -10.578 -5.025 5.933 1.00 . B B . 49 LYS HB2 1 1 7 5335 2 2 28 LYS HB3 H -12.163 -4.464 5.397 1.00 . B B . 49 LYS HB3 1 1 7 5336 2 2 28 LYS HD2 H -10.426 -4.196 8.720 1.00 . B B . 49 LYS HD2 1 1 7 5337 2 2 28 LYS HD3 H -10.690 -3.245 7.258 1.00 . B B . 49 LYS HD3 1 1 7 5338 2 2 28 LYS HE2 H -11.546 -1.848 8.944 1.00 . B B . 49 LYS HE2 1 1 7 5339 2 2 28 LYS HE3 H -12.990 -2.661 8.338 1.00 . B B . 49 LYS HE3 1 1 7 5340 2 2 28 LYS HG2 H -13.083 -4.599 7.535 1.00 . B B . 49 LYS HG2 1 1 7 5341 2 2 28 LYS HG3 H -11.901 -5.791 8.078 1.00 . B B . 49 LYS HG3 1 1 7 5342 2 2 28 LYS HZ1 H -13.084 -2.827 10.662 1.00 . B B . 49 LYS HZ1 1 1 7 5343 2 2 28 LYS HZ2 H -11.448 -3.264 10.791 1.00 . B B . 49 LYS HZ2 1 1 7 5344 2 2 28 LYS HZ3 H -12.574 -4.356 10.134 1.00 . B B . 49 LYS HZ3 1 1 7 5345 2 2 28 LYS N N -11.143 -7.041 4.544 1.00 . B B . 49 LYS N 1 1 7 5346 2 2 28 LYS NZ N -12.309 -3.353 10.213 1.00 . B B . 49 LYS NZ 1 1 7 5347 2 2 28 LYS O O -13.971 -5.703 4.597 1.00 . B B . 49 LYS O 1 1 7 5348 2 2 29 PRO C C -16.467 -7.103 6.140 1.00 . B B . 50 PRO C 1 1 7 5349 2 2 29 PRO CA C -15.567 -7.906 5.196 1.00 . B B . 50 PRO CA 1 1 7 5350 2 2 29 PRO CB C -15.783 -9.410 5.385 1.00 . B B . 50 PRO CB 1 1 7 5351 2 2 29 PRO CD C -13.555 -8.833 6.288 1.00 . B B . 50 PRO CD 1 1 7 5352 2 2 29 PRO CG C -14.676 -9.888 6.352 1.00 . B B . 50 PRO CG 1 1 7 5353 2 2 29 PRO HA H -15.744 -7.636 4.173 1.00 . B B . 50 PRO HA 1 1 7 5354 2 2 29 PRO HB2 H -16.760 -9.592 5.815 1.00 . B B . 50 PRO HB2 1 1 7 5355 2 2 29 PRO HB3 H -15.689 -9.921 4.440 1.00 . B B . 50 PRO HB3 1 1 7 5356 2 2 29 PRO HD2 H -13.275 -8.520 7.283 1.00 . B B . 50 PRO HD2 1 1 7 5357 2 2 29 PRO HD3 H -12.703 -9.219 5.754 1.00 . B B . 50 PRO HD3 1 1 7 5358 2 2 29 PRO HG2 H -15.067 -9.958 7.358 1.00 . B B . 50 PRO HG2 1 1 7 5359 2 2 29 PRO HG3 H -14.293 -10.845 6.034 1.00 . B B . 50 PRO HG3 1 1 7 5360 2 2 29 PRO N N -14.152 -7.711 5.543 1.00 . B B . 50 PRO N 1 1 7 5361 2 2 29 PRO O O -16.004 -6.489 7.081 1.00 . B B . 50 PRO O 1 1 7 5362 2 2 30 THR C C -19.423 -7.314 7.695 1.00 . B B . 51 THR C 1 1 7 5363 2 2 30 THR CA C -18.674 -6.341 6.782 1.00 . B B . 51 THR CA 1 1 7 5364 2 2 30 THR CB C -19.680 -5.567 5.926 1.00 . B B . 51 THR CB 1 1 7 5365 2 2 30 THR CG2 C -19.246 -4.105 5.823 1.00 . B B . 51 THR CG2 1 1 7 5366 2 2 30 THR H H -18.103 -7.606 5.133 1.00 . B B . 51 THR H 1 1 7 5367 2 2 30 THR HA H -18.106 -5.648 7.384 1.00 . B B . 51 THR HA 1 1 7 5368 2 2 30 THR HB H -20.656 -5.617 6.385 1.00 . B B . 51 THR HB 1 1 7 5369 2 2 30 THR HG1 H -19.888 -5.432 3.996 1.00 . B B . 51 THR HG1 1 1 7 5370 2 2 30 THR HG21 H -19.489 -3.592 6.742 1.00 . B B . 51 THR HG21 1 1 7 5371 2 2 30 THR HG22 H -19.761 -3.633 5.000 1.00 . B B . 51 THR HG22 1 1 7 5372 2 2 30 THR HG23 H -18.180 -4.056 5.656 1.00 . B B . 51 THR HG23 1 1 7 5373 2 2 30 THR N N -17.749 -7.103 5.897 1.00 . B B . 51 THR N 1 1 7 5374 2 2 30 THR O O -19.415 -8.498 7.399 1.00 . B B . 51 THR O 1 1 7 5375 2 2 30 THR OXT O -19.990 -6.859 8.674 1.00 . B B . 51 THR OXT 1 1 7 5376 2 2 30 THR OG1 O -19.736 -6.140 4.627 1.00 . B B . 51 THR OG1 1 1 8 5377 1 1 1 GLY C C -6.789 7.675 1.052 1.00 . A A . 1 GLY C 1 1 8 5378 1 1 1 GLY CA C -8.197 8.069 0.762 1.00 . A A . 1 GLY CA 1 1 8 5379 1 1 1 GLY H1 H -9.390 6.910 2.071 1.00 . A A . 1 GLY H1 1 1 8 5380 1 1 1 GLY H2 H -9.134 6.182 0.557 1.00 . A A . 1 GLY H2 1 1 8 5381 1 1 1 GLY H3 H -10.227 7.474 0.705 1.00 . A A . 1 GLY H3 1 1 8 5382 1 1 1 GLY HA2 H -7.906 8.017 -0.168 1.00 . A A . 1 GLY HA2 1 1 8 5383 1 1 1 GLY HA3 H -8.587 9.127 1.059 1.00 . A A . 1 GLY HA3 1 1 8 5384 1 1 1 GLY N N -9.327 7.080 1.047 1.00 . A A . 1 GLY N 1 1 8 5385 1 1 1 GLY O O -6.047 8.405 1.679 1.00 . A A . 1 GLY O 1 1 8 5386 1 1 2 ILE C C -4.044 6.706 -0.153 1.00 . A A . 2 ILE C 1 1 8 5387 1 1 2 ILE CA C -4.989 6.067 0.868 1.00 . A A . 2 ILE CA 1 1 8 5388 1 1 2 ILE CB C -4.914 4.550 0.745 1.00 . A A . 2 ILE CB 1 1 8 5389 1 1 2 ILE CD1 C -6.040 2.474 1.543 1.00 . A A . 2 ILE CD1 1 1 8 5390 1 1 2 ILE CG1 C -5.687 3.915 1.902 1.00 . A A . 2 ILE CG1 1 1 8 5391 1 1 2 ILE CG2 C -3.452 4.108 0.800 1.00 . A A . 2 ILE CG2 1 1 8 5392 1 1 2 ILE H H -6.999 5.943 0.106 1.00 . A A . 2 ILE H 1 1 8 5393 1 1 2 ILE HA H -4.697 6.358 1.864 1.00 . A A . 2 ILE HA 1 1 8 5394 1 1 2 ILE HB H -5.349 4.241 -0.195 1.00 . A A . 2 ILE HB 1 1 8 5395 1 1 2 ILE HD11 H -5.811 2.298 0.502 1.00 . A A . 2 ILE HD11 1 1 8 5396 1 1 2 ILE HD12 H -7.094 2.309 1.713 1.00 . A A . 2 ILE HD12 1 1 8 5397 1 1 2 ILE HD13 H -5.465 1.799 2.158 1.00 . A A . 2 ILE HD13 1 1 8 5398 1 1 2 ILE HG12 H -5.075 3.926 2.792 1.00 . A A . 2 ILE HG12 1 1 8 5399 1 1 2 ILE HG13 H -6.594 4.473 2.079 1.00 . A A . 2 ILE HG13 1 1 8 5400 1 1 2 ILE HG21 H -2.898 4.599 0.013 1.00 . A A . 2 ILE HG21 1 1 8 5401 1 1 2 ILE HG22 H -3.392 3.038 0.668 1.00 . A A . 2 ILE HG22 1 1 8 5402 1 1 2 ILE HG23 H -3.031 4.378 1.758 1.00 . A A . 2 ILE HG23 1 1 8 5403 1 1 2 ILE N N -6.384 6.517 0.609 1.00 . A A . 2 ILE N 1 1 8 5404 1 1 2 ILE O O -2.902 6.996 0.141 1.00 . A A . 2 ILE O 1 1 8 5405 1 1 3 VAL C C -3.195 8.925 -1.932 1.00 . A A . 3 VAL C 1 1 8 5406 1 1 3 VAL CA C -3.644 7.541 -2.394 1.00 . A A . 3 VAL CA 1 1 8 5407 1 1 3 VAL CB C -4.433 7.667 -3.701 1.00 . A A . 3 VAL CB 1 1 8 5408 1 1 3 VAL CG1 C -5.205 6.374 -3.950 1.00 . A A . 3 VAL CG1 1 1 8 5409 1 1 3 VAL CG2 C -5.423 8.832 -3.600 1.00 . A A . 3 VAL CG2 1 1 8 5410 1 1 3 VAL H H -5.437 6.680 -1.568 1.00 . A A . 3 VAL H 1 1 8 5411 1 1 3 VAL HA H -2.781 6.919 -2.553 1.00 . A A . 3 VAL HA 1 1 8 5412 1 1 3 VAL HB H -3.748 7.842 -4.519 1.00 . A A . 3 VAL HB 1 1 8 5413 1 1 3 VAL HG11 H -4.889 5.941 -4.887 1.00 . A A . 3 VAL HG11 1 1 8 5414 1 1 3 VAL HG12 H -6.263 6.589 -3.990 1.00 . A A . 3 VAL HG12 1 1 8 5415 1 1 3 VAL HG13 H -5.009 5.679 -3.148 1.00 . A A . 3 VAL HG13 1 1 8 5416 1 1 3 VAL HG21 H -4.880 9.766 -3.588 1.00 . A A . 3 VAL HG21 1 1 8 5417 1 1 3 VAL HG22 H -5.998 8.738 -2.691 1.00 . A A . 3 VAL HG22 1 1 8 5418 1 1 3 VAL HG23 H -6.088 8.814 -4.451 1.00 . A A . 3 VAL HG23 1 1 8 5419 1 1 3 VAL N N -4.513 6.924 -1.352 1.00 . A A . 3 VAL N 1 1 8 5420 1 1 3 VAL O O -2.128 9.395 -2.275 1.00 . A A . 3 VAL O 1 1 8 5421 1 1 4 GLU C C -2.659 10.813 0.495 1.00 . A A . 4 GLU C 1 1 8 5422 1 1 4 GLU CA C -3.646 10.934 -0.667 1.00 . A A . 4 GLU CA 1 1 8 5423 1 1 4 GLU CB C -4.911 11.645 -0.192 1.00 . A A . 4 GLU CB 1 1 8 5424 1 1 4 GLU CD C -6.782 12.650 -1.508 1.00 . A A . 4 GLU CD 1 1 8 5425 1 1 4 GLU CG C -6.054 11.349 -1.167 1.00 . A A . 4 GLU CG 1 1 8 5426 1 1 4 GLU H H -4.860 9.174 -0.900 1.00 . A A . 4 GLU H 1 1 8 5427 1 1 4 GLU HA H -3.193 11.500 -1.467 1.00 . A A . 4 GLU HA 1 1 8 5428 1 1 4 GLU HB2 H -5.175 11.289 0.794 1.00 . A A . 4 GLU HB2 1 1 8 5429 1 1 4 GLU HB3 H -4.736 12.710 -0.157 1.00 . A A . 4 GLU HB3 1 1 8 5430 1 1 4 GLU HG2 H -5.653 10.910 -2.070 1.00 . A A . 4 GLU HG2 1 1 8 5431 1 1 4 GLU HG3 H -6.747 10.659 -0.710 1.00 . A A . 4 GLU HG3 1 1 8 5432 1 1 4 GLU N N -4.007 9.577 -1.158 1.00 . A A . 4 GLU N 1 1 8 5433 1 1 4 GLU O O -2.249 11.796 1.078 1.00 . A A . 4 GLU O 1 1 8 5434 1 1 4 GLU OE1 O -6.236 13.428 -2.274 1.00 . A A . 4 GLU OE1 1 1 8 5435 1 1 4 GLU OE2 O -7.871 12.849 -0.996 1.00 . A A . 4 GLU OE2 1 1 8 5436 1 1 5 GLN C C 0.065 9.086 1.409 1.00 . A A . 5 GLN C 1 1 8 5437 1 1 5 GLN CA C -1.317 9.437 1.961 1.00 . A A . 5 GLN CA 1 1 8 5438 1 1 5 GLN CB C -1.801 8.301 2.863 1.00 . A A . 5 GLN CB 1 1 8 5439 1 1 5 GLN CD C -2.752 9.466 4.856 1.00 . A A . 5 GLN CD 1 1 8 5440 1 1 5 GLN CG C -1.558 8.671 4.327 1.00 . A A . 5 GLN CG 1 1 8 5441 1 1 5 GLN H H -2.617 8.833 0.357 1.00 . A A . 5 GLN H 1 1 8 5442 1 1 5 GLN HA H -1.257 10.351 2.533 1.00 . A A . 5 GLN HA 1 1 8 5443 1 1 5 GLN HB2 H -2.856 8.139 2.702 1.00 . A A . 5 GLN HB2 1 1 8 5444 1 1 5 GLN HB3 H -1.257 7.399 2.627 1.00 . A A . 5 GLN HB3 1 1 8 5445 1 1 5 GLN HE21 H -1.626 10.754 5.861 1.00 . A A . 5 GLN HE21 1 1 8 5446 1 1 5 GLN HE22 H -3.299 11.015 5.971 1.00 . A A . 5 GLN HE22 1 1 8 5447 1 1 5 GLN HG2 H -1.437 7.770 4.912 1.00 . A A . 5 GLN HG2 1 1 8 5448 1 1 5 GLN HG3 H -0.665 9.273 4.403 1.00 . A A . 5 GLN HG3 1 1 8 5449 1 1 5 GLN N N -2.275 9.616 0.837 1.00 . A A . 5 GLN N 1 1 8 5450 1 1 5 GLN NE2 N -2.542 10.497 5.627 1.00 . A A . 5 GLN NE2 1 1 8 5451 1 1 5 GLN O O 1.075 9.553 1.897 1.00 . A A . 5 GLN O 1 1 8 5452 1 1 5 GLN OE1 O -3.888 9.147 4.563 1.00 . A A . 5 GLN OE1 1 1 8 5453 1 1 6 CYS C C 1.675 8.539 -1.512 1.00 . A A . 6 CYS C 1 1 8 5454 1 1 6 CYS CA C 1.442 7.858 -0.160 1.00 . A A . 6 CYS CA 1 1 8 5455 1 1 6 CYS CB C 1.479 6.342 -0.341 1.00 . A A . 6 CYS CB 1 1 8 5456 1 1 6 CYS H H -0.703 7.875 0.035 1.00 . A A . 6 CYS H 1 1 8 5457 1 1 6 CYS HA H 2.222 8.151 0.525 1.00 . A A . 6 CYS HA 1 1 8 5458 1 1 6 CYS HB2 H 0.645 6.030 -0.952 1.00 . A A . 6 CYS HB2 1 1 8 5459 1 1 6 CYS HB3 H 2.404 6.060 -0.821 1.00 . A A . 6 CYS HB3 1 1 8 5460 1 1 6 CYS N N 0.121 8.251 0.406 1.00 . A A . 6 CYS N 1 1 8 5461 1 1 6 CYS O O 2.785 8.911 -1.840 1.00 . A A . 6 CYS O 1 1 8 5462 1 1 6 CYS SG S 1.373 5.546 1.280 1.00 . A A . 6 CYS SG 1 1 8 5463 1 1 7 CYS C C 1.182 10.820 -3.462 1.00 . A A . 7 CYS C 1 1 8 5464 1 1 7 CYS CA C 0.854 9.337 -3.641 1.00 . A A . 7 CYS CA 1 1 8 5465 1 1 7 CYS CB C -0.405 9.199 -4.492 1.00 . A A . 7 CYS CB 1 1 8 5466 1 1 7 CYS H H -0.236 8.378 -2.044 1.00 . A A . 7 CYS H 1 1 8 5467 1 1 7 CYS HA H 1.677 8.851 -4.147 1.00 . A A . 7 CYS HA 1 1 8 5468 1 1 7 CYS HB2 H -0.800 8.198 -4.395 1.00 . A A . 7 CYS HB2 1 1 8 5469 1 1 7 CYS HB3 H -1.144 9.915 -4.166 1.00 . A A . 7 CYS HB3 1 1 8 5470 1 1 7 CYS N N 0.653 8.693 -2.311 1.00 . A A . 7 CYS N 1 1 8 5471 1 1 7 CYS O O 1.656 11.469 -4.371 1.00 . A A . 7 CYS O 1 1 8 5472 1 1 7 CYS SG S 0.028 9.520 -6.218 1.00 . A A . 7 CYS SG 1 1 8 5473 1 1 8 THR C C 2.395 12.875 -1.047 1.00 . A A . 8 THR C 1 1 8 5474 1 1 8 THR CA C 1.261 12.797 -2.068 1.00 . A A . 8 THR CA 1 1 8 5475 1 1 8 THR CB C 0.027 13.524 -1.531 1.00 . A A . 8 THR CB 1 1 8 5476 1 1 8 THR CG2 C -0.233 13.098 -0.087 1.00 . A A . 8 THR CG2 1 1 8 5477 1 1 8 THR H H 0.565 10.817 -1.577 1.00 . A A . 8 THR H 1 1 8 5478 1 1 8 THR HA H 1.578 13.251 -2.996 1.00 . A A . 8 THR HA 1 1 8 5479 1 1 8 THR HB H -0.830 13.275 -2.136 1.00 . A A . 8 THR HB 1 1 8 5480 1 1 8 THR HG1 H -0.533 15.340 -1.945 1.00 . A A . 8 THR HG1 1 1 8 5481 1 1 8 THR HG21 H -1.228 13.400 0.202 1.00 . A A . 8 THR HG21 1 1 8 5482 1 1 8 THR HG22 H 0.490 13.569 0.562 1.00 . A A . 8 THR HG22 1 1 8 5483 1 1 8 THR HG23 H -0.144 12.025 -0.007 1.00 . A A . 8 THR HG23 1 1 8 5484 1 1 8 THR N N 0.944 11.359 -2.300 1.00 . A A . 8 THR N 1 1 8 5485 1 1 8 THR O O 3.184 13.798 -1.036 1.00 . A A . 8 THR O 1 1 8 5486 1 1 8 THR OG1 O 0.252 14.926 -1.578 1.00 . A A . 8 THR OG1 1 1 8 5487 1 1 9 SER C C 4.289 10.516 0.706 1.00 . A A . 9 SER C 1 1 8 5488 1 1 9 SER CA C 3.565 11.858 0.822 1.00 . A A . 9 SER CA 1 1 8 5489 1 1 9 SER CB C 2.958 11.998 2.221 1.00 . A A . 9 SER CB 1 1 8 5490 1 1 9 SER H H 1.838 11.152 -0.245 1.00 . A A . 9 SER H 1 1 8 5491 1 1 9 SER HA H 4.260 12.665 0.642 1.00 . A A . 9 SER HA 1 1 8 5492 1 1 9 SER HB2 H 2.082 11.375 2.299 1.00 . A A . 9 SER HB2 1 1 8 5493 1 1 9 SER HB3 H 3.685 11.688 2.960 1.00 . A A . 9 SER HB3 1 1 8 5494 1 1 9 SER HG H 3.243 13.910 2.012 1.00 . A A . 9 SER HG 1 1 8 5495 1 1 9 SER N N 2.483 11.889 -0.199 1.00 . A A . 9 SER N 1 1 8 5496 1 1 9 SER O O 3.739 9.553 0.212 1.00 . A A . 9 SER O 1 1 8 5497 1 1 9 SER OG O 2.589 13.353 2.440 1.00 . A A . 9 SER OG 1 1 8 5498 1 1 10 ILE C C 5.815 8.217 2.188 1.00 . A A . 10 ILE C 1 1 8 5499 1 1 10 ILE CA C 6.234 9.133 1.037 1.00 . A A . 10 ILE CA 1 1 8 5500 1 1 10 ILE CB C 7.744 9.366 1.087 1.00 . A A . 10 ILE CB 1 1 8 5501 1 1 10 ILE CD1 C 7.576 10.573 -1.096 1.00 . A A . 10 ILE CD1 1 1 8 5502 1 1 10 ILE CG1 C 8.094 10.657 0.342 1.00 . A A . 10 ILE CG1 1 1 8 5503 1 1 10 ILE CG2 C 8.450 8.193 0.411 1.00 . A A . 10 ILE CG2 1 1 8 5504 1 1 10 ILE H H 5.952 11.212 1.542 1.00 . A A . 10 ILE H 1 1 8 5505 1 1 10 ILE HA H 5.978 8.663 0.098 1.00 . A A . 10 ILE HA 1 1 8 5506 1 1 10 ILE HB H 8.066 9.438 2.116 1.00 . A A . 10 ILE HB 1 1 8 5507 1 1 10 ILE HD11 H 8.255 9.978 -1.689 1.00 . A A . 10 ILE HD11 1 1 8 5508 1 1 10 ILE HD12 H 7.509 11.567 -1.513 1.00 . A A . 10 ILE HD12 1 1 8 5509 1 1 10 ILE HD13 H 6.598 10.115 -1.100 1.00 . A A . 10 ILE HD13 1 1 8 5510 1 1 10 ILE HG12 H 7.637 11.498 0.843 1.00 . A A . 10 ILE HG12 1 1 8 5511 1 1 10 ILE HG13 H 9.166 10.785 0.329 1.00 . A A . 10 ILE HG13 1 1 8 5512 1 1 10 ILE HG21 H 9.102 8.565 -0.365 1.00 . A A . 10 ILE HG21 1 1 8 5513 1 1 10 ILE HG22 H 7.712 7.533 -0.024 1.00 . A A . 10 ILE HG22 1 1 8 5514 1 1 10 ILE HG23 H 9.031 7.652 1.142 1.00 . A A . 10 ILE HG23 1 1 8 5515 1 1 10 ILE N N 5.512 10.431 1.146 1.00 . A A . 10 ILE N 1 1 8 5516 1 1 10 ILE O O 5.530 8.666 3.281 1.00 . A A . 10 ILE O 1 1 8 5517 1 1 11 CYS C C 6.445 4.921 3.209 1.00 . A A . 11 CYS C 1 1 8 5518 1 1 11 CYS CA C 5.362 5.985 3.021 1.00 . A A . 11 CYS CA 1 1 8 5519 1 1 11 CYS CB C 4.057 5.290 2.625 1.00 . A A . 11 CYS CB 1 1 8 5520 1 1 11 CYS H H 5.998 6.596 1.057 1.00 . A A . 11 CYS H 1 1 8 5521 1 1 11 CYS HA H 5.218 6.522 3.946 1.00 . A A . 11 CYS HA 1 1 8 5522 1 1 11 CYS HB2 H 4.205 4.747 1.704 1.00 . A A . 11 CYS HB2 1 1 8 5523 1 1 11 CYS HB3 H 3.767 4.600 3.404 1.00 . A A . 11 CYS HB3 1 1 8 5524 1 1 11 CYS N N 5.769 6.934 1.947 1.00 . A A . 11 CYS N 1 1 8 5525 1 1 11 CYS O O 7.533 5.020 2.678 1.00 . A A . 11 CYS O 1 1 8 5526 1 1 11 CYS SG S 2.751 6.518 2.393 1.00 . A A . 11 CYS SG 1 1 8 5527 1 1 12 SER C C 6.398 1.466 4.089 1.00 . A A . 12 SER C 1 1 8 5528 1 1 12 SER CA C 7.127 2.808 4.186 1.00 . A A . 12 SER CA 1 1 8 5529 1 1 12 SER CB C 7.743 2.957 5.577 1.00 . A A . 12 SER CB 1 1 8 5530 1 1 12 SER H H 5.251 3.843 4.367 1.00 . A A . 12 SER H 1 1 8 5531 1 1 12 SER HA H 7.904 2.856 3.436 1.00 . A A . 12 SER HA 1 1 8 5532 1 1 12 SER HB2 H 7.904 1.983 6.008 1.00 . A A . 12 SER HB2 1 1 8 5533 1 1 12 SER HB3 H 8.690 3.473 5.496 1.00 . A A . 12 SER HB3 1 1 8 5534 1 1 12 SER HG H 6.143 3.110 6.673 1.00 . A A . 12 SER HG 1 1 8 5535 1 1 12 SER N N 6.140 3.898 3.958 1.00 . A A . 12 SER N 1 1 8 5536 1 1 12 SER O O 5.263 1.346 4.504 1.00 . A A . 12 SER O 1 1 8 5537 1 1 12 SER OG O 6.856 3.695 6.408 1.00 . A A . 12 SER OG 1 1 8 5538 1 1 13 LEU C C 5.565 -1.159 4.692 1.00 . A A . 13 LEU C 1 1 8 5539 1 1 13 LEU CA C 6.352 -0.862 3.415 1.00 . A A . 13 LEU CA 1 1 8 5540 1 1 13 LEU CB C 7.395 -1.957 3.190 1.00 . A A . 13 LEU CB 1 1 8 5541 1 1 13 LEU CD1 C 7.333 -1.738 0.702 1.00 . A A . 13 LEU CD1 1 1 8 5542 1 1 13 LEU CD2 C 8.002 -3.907 1.750 1.00 . A A . 13 LEU CD2 1 1 8 5543 1 1 13 LEU CG C 7.088 -2.685 1.879 1.00 . A A . 13 LEU CG 1 1 8 5544 1 1 13 LEU H H 7.942 0.580 3.203 1.00 . A A . 13 LEU H 1 1 8 5545 1 1 13 LEU HA H 5.673 -0.838 2.575 1.00 . A A . 13 LEU HA 1 1 8 5546 1 1 13 LEU HB2 H 8.378 -1.513 3.137 1.00 . A A . 13 LEU HB2 1 1 8 5547 1 1 13 LEU HB3 H 7.360 -2.662 4.007 1.00 . A A . 13 LEU HB3 1 1 8 5548 1 1 13 LEU HD11 H 6.397 -1.295 0.396 1.00 . A A . 13 LEU HD11 1 1 8 5549 1 1 13 LEU HD12 H 7.757 -2.291 -0.124 1.00 . A A . 13 LEU HD12 1 1 8 5550 1 1 13 LEU HD13 H 8.018 -0.959 1.003 1.00 . A A . 13 LEU HD13 1 1 8 5551 1 1 13 LEU HD21 H 7.456 -4.797 2.025 1.00 . A A . 13 LEU HD21 1 1 8 5552 1 1 13 LEU HD22 H 8.854 -3.791 2.405 1.00 . A A . 13 LEU HD22 1 1 8 5553 1 1 13 LEU HD23 H 8.344 -3.996 0.729 1.00 . A A . 13 LEU HD23 1 1 8 5554 1 1 13 LEU HG H 6.053 -3.003 1.876 1.00 . A A . 13 LEU HG 1 1 8 5555 1 1 13 LEU N N 7.029 0.462 3.539 1.00 . A A . 13 LEU N 1 1 8 5556 1 1 13 LEU O O 4.516 -1.770 4.655 1.00 . A A . 13 LEU O 1 1 8 5557 1 1 14 TYR C C 3.990 -0.202 7.041 1.00 . A A . 14 TYR C 1 1 8 5558 1 1 14 TYR CA C 5.310 -0.969 7.088 1.00 . A A . 14 TYR CA 1 1 8 5559 1 1 14 TYR CB C 6.135 -0.492 8.285 1.00 . A A . 14 TYR CB 1 1 8 5560 1 1 14 TYR CD1 C 4.994 -1.944 10.087 1.00 . A A . 14 TYR CD1 1 1 8 5561 1 1 14 TYR CD2 C 4.774 0.475 10.248 1.00 . A A . 14 TYR CD2 1 1 8 5562 1 1 14 TYR CE1 C 4.219 -2.083 11.246 1.00 . A A . 14 TYR CE1 1 1 8 5563 1 1 14 TYR CE2 C 4.001 0.318 11.406 1.00 . A A . 14 TYR CE2 1 1 8 5564 1 1 14 TYR CG C 5.286 -0.656 9.569 1.00 . A A . 14 TYR CG 1 1 8 5565 1 1 14 TYR CZ C 3.726 -0.955 11.903 1.00 . A A . 14 TYR CZ 1 1 8 5566 1 1 14 TYR H H 6.892 -0.215 5.833 1.00 . A A . 14 TYR H 1 1 8 5567 1 1 14 TYR HA H 5.110 -2.026 7.184 1.00 . A A . 14 TYR HA 1 1 8 5568 1 1 14 TYR HB2 H 7.049 -1.085 8.343 1.00 . A A . 14 TYR HB2 1 1 8 5569 1 1 14 TYR HB3 H 6.408 0.550 8.138 1.00 . A A . 14 TYR HB3 1 1 8 5570 1 1 14 TYR HD1 H 5.354 -2.828 9.599 1.00 . A A . 14 TYR HD1 1 1 8 5571 1 1 14 TYR HD2 H 4.965 1.463 9.886 1.00 . A A . 14 TYR HD2 1 1 8 5572 1 1 14 TYR HE1 H 4.004 -3.068 11.635 1.00 . A A . 14 TYR HE1 1 1 8 5573 1 1 14 TYR HE2 H 3.615 1.188 11.916 1.00 . A A . 14 TYR HE2 1 1 8 5574 1 1 14 TYR HH H 3.083 -0.315 13.583 1.00 . A A . 14 TYR HH 1 1 8 5575 1 1 14 TYR N N 6.051 -0.718 5.821 1.00 . A A . 14 TYR N 1 1 8 5576 1 1 14 TYR O O 2.934 -0.752 7.279 1.00 . A A . 14 TYR O 1 1 8 5577 1 1 14 TYR OH O 2.963 -1.100 13.044 1.00 . A A . 14 TYR OH 1 1 8 5578 1 1 15 GLN C C 1.881 1.232 5.578 1.00 . A A . 15 GLN C 1 1 8 5579 1 1 15 GLN CA C 2.775 1.849 6.649 1.00 . A A . 15 GLN CA 1 1 8 5580 1 1 15 GLN CB C 3.087 3.301 6.283 1.00 . A A . 15 GLN CB 1 1 8 5581 1 1 15 GLN CD C 2.184 4.811 8.059 1.00 . A A . 15 GLN CD 1 1 8 5582 1 1 15 GLN CG C 3.432 4.085 7.550 1.00 . A A . 15 GLN CG 1 1 8 5583 1 1 15 GLN H H 4.896 1.490 6.526 1.00 . A A . 15 GLN H 1 1 8 5584 1 1 15 GLN HA H 2.268 1.813 7.603 1.00 . A A . 15 GLN HA 1 1 8 5585 1 1 15 GLN HB2 H 3.926 3.329 5.602 1.00 . A A . 15 GLN HB2 1 1 8 5586 1 1 15 GLN HB3 H 2.225 3.747 5.810 1.00 . A A . 15 GLN HB3 1 1 8 5587 1 1 15 GLN HE21 H 1.851 3.513 9.524 1.00 . A A . 15 GLN HE21 1 1 8 5588 1 1 15 GLN HE22 H 0.737 4.789 9.419 1.00 . A A . 15 GLN HE22 1 1 8 5589 1 1 15 GLN HG2 H 3.787 3.404 8.310 1.00 . A A . 15 GLN HG2 1 1 8 5590 1 1 15 GLN HG3 H 4.201 4.809 7.328 1.00 . A A . 15 GLN HG3 1 1 8 5591 1 1 15 GLN N N 4.036 1.063 6.724 1.00 . A A . 15 GLN N 1 1 8 5592 1 1 15 GLN NE2 N 1.537 4.331 9.085 1.00 . A A . 15 GLN NE2 1 1 8 5593 1 1 15 GLN O O 0.676 1.173 5.720 1.00 . A A . 15 GLN O 1 1 8 5594 1 1 15 GLN OE1 O 1.794 5.826 7.517 1.00 . A A . 15 GLN OE1 1 1 8 5595 1 1 16 LEU C C 1.085 -1.189 3.991 1.00 . A A . 16 LEU C 1 1 8 5596 1 1 16 LEU CA C 1.638 0.125 3.448 1.00 . A A . 16 LEU CA 1 1 8 5597 1 1 16 LEU CB C 2.495 -0.140 2.208 1.00 . A A . 16 LEU CB 1 1 8 5598 1 1 16 LEU CD1 C 3.777 1.982 1.909 1.00 . A A . 16 LEU CD1 1 1 8 5599 1 1 16 LEU CD2 C 2.864 0.785 -0.083 1.00 . A A . 16 LEU CD2 1 1 8 5600 1 1 16 LEU CG C 2.612 1.143 1.384 1.00 . A A . 16 LEU CG 1 1 8 5601 1 1 16 LEU H H 3.436 0.799 4.418 1.00 . A A . 16 LEU H 1 1 8 5602 1 1 16 LEU HA H 0.820 0.780 3.194 1.00 . A A . 16 LEU HA 1 1 8 5603 1 1 16 LEU HB2 H 3.480 -0.464 2.513 1.00 . A A . 16 LEU HB2 1 1 8 5604 1 1 16 LEU HB3 H 2.033 -0.907 1.608 1.00 . A A . 16 LEU HB3 1 1 8 5605 1 1 16 LEU HD11 H 3.449 2.556 2.762 1.00 . A A . 16 LEU HD11 1 1 8 5606 1 1 16 LEU HD12 H 4.118 2.652 1.133 1.00 . A A . 16 LEU HD12 1 1 8 5607 1 1 16 LEU HD13 H 4.586 1.330 2.203 1.00 . A A . 16 LEU HD13 1 1 8 5608 1 1 16 LEU HD21 H 2.271 1.427 -0.718 1.00 . A A . 16 LEU HD21 1 1 8 5609 1 1 16 LEU HD22 H 2.587 -0.245 -0.255 1.00 . A A . 16 LEU HD22 1 1 8 5610 1 1 16 LEU HD23 H 3.911 0.919 -0.312 1.00 . A A . 16 LEU HD23 1 1 8 5611 1 1 16 LEU HG H 1.695 1.709 1.467 1.00 . A A . 16 LEU HG 1 1 8 5612 1 1 16 LEU N N 2.462 0.755 4.511 1.00 . A A . 16 LEU N 1 1 8 5613 1 1 16 LEU O O -0.011 -1.599 3.663 1.00 . A A . 16 LEU O 1 1 8 5614 1 1 17 GLU C C 0.011 -2.834 6.125 1.00 . A A . 17 GLU C 1 1 8 5615 1 1 17 GLU CA C 1.344 -3.108 5.432 1.00 . A A . 17 GLU CA 1 1 8 5616 1 1 17 GLU CB C 2.372 -3.599 6.449 1.00 . A A . 17 GLU CB 1 1 8 5617 1 1 17 GLU CD C 4.002 -5.461 6.102 1.00 . A A . 17 GLU CD 1 1 8 5618 1 1 17 GLU CG C 3.653 -4.020 5.725 1.00 . A A . 17 GLU CG 1 1 8 5619 1 1 17 GLU H H 2.699 -1.489 5.110 1.00 . A A . 17 GLU H 1 1 8 5620 1 1 17 GLU HA H 1.211 -3.849 4.657 1.00 . A A . 17 GLU HA 1 1 8 5621 1 1 17 GLU HB2 H 2.597 -2.805 7.145 1.00 . A A . 17 GLU HB2 1 1 8 5622 1 1 17 GLU HB3 H 1.972 -4.438 6.983 1.00 . A A . 17 GLU HB3 1 1 8 5623 1 1 17 GLU HG2 H 3.503 -3.952 4.657 1.00 . A A . 17 GLU HG2 1 1 8 5624 1 1 17 GLU HG3 H 4.463 -3.368 6.018 1.00 . A A . 17 GLU HG3 1 1 8 5625 1 1 17 GLU N N 1.828 -1.842 4.843 1.00 . A A . 17 GLU N 1 1 8 5626 1 1 17 GLU O O -0.840 -3.695 6.229 1.00 . A A . 17 GLU O 1 1 8 5627 1 1 17 GLU OE1 O 3.104 -6.286 6.101 1.00 . A A . 17 GLU OE1 1 1 8 5628 1 1 17 GLU OE2 O 5.161 -5.715 6.386 1.00 . A A . 17 GLU OE2 1 1 8 5629 1 1 18 ASN C C -2.585 -1.239 6.227 1.00 . A A . 18 ASN C 1 1 8 5630 1 1 18 ASN CA C -1.459 -1.276 7.265 1.00 . A A . 18 ASN CA 1 1 8 5631 1 1 18 ASN CB C -1.326 0.100 7.924 1.00 . A A . 18 ASN CB 1 1 8 5632 1 1 18 ASN CG C -2.102 0.117 9.243 1.00 . A A . 18 ASN CG 1 1 8 5633 1 1 18 ASN H H 0.521 -0.945 6.486 1.00 . A A . 18 ASN H 1 1 8 5634 1 1 18 ASN HA H -1.684 -2.017 8.018 1.00 . A A . 18 ASN HA 1 1 8 5635 1 1 18 ASN HB2 H -0.282 0.306 8.117 1.00 . A A . 18 ASN HB2 1 1 8 5636 1 1 18 ASN HB3 H -1.726 0.854 7.264 1.00 . A A . 18 ASN HB3 1 1 8 5637 1 1 18 ASN HD21 H -3.868 0.350 8.366 1.00 . A A . 18 ASN HD21 1 1 8 5638 1 1 18 ASN HD22 H -3.905 0.271 10.061 1.00 . A A . 18 ASN HD22 1 1 8 5639 1 1 18 ASN N N -0.179 -1.626 6.590 1.00 . A A . 18 ASN N 1 1 8 5640 1 1 18 ASN ND2 N -3.399 0.257 9.222 1.00 . A A . 18 ASN ND2 1 1 8 5641 1 1 18 ASN O O -3.724 -1.541 6.524 1.00 . A A . 18 ASN O 1 1 8 5642 1 1 18 ASN OD1 O -1.522 0.004 10.305 1.00 . A A . 18 ASN OD1 1 1 8 5643 1 1 19 TYR C C -3.975 -2.204 3.806 1.00 . A A . 19 TYR C 1 1 8 5644 1 1 19 TYR CA C -3.336 -0.821 3.958 1.00 . A A . 19 TYR CA 1 1 8 5645 1 1 19 TYR CB C -2.717 -0.400 2.621 1.00 . A A . 19 TYR CB 1 1 8 5646 1 1 19 TYR CD1 C -2.691 1.973 3.690 1.00 . A A . 19 TYR CD1 1 1 8 5647 1 1 19 TYR CD2 C -1.026 1.465 1.985 1.00 . A A . 19 TYR CD2 1 1 8 5648 1 1 19 TYR CE1 C -2.152 3.260 3.814 1.00 . A A . 19 TYR CE1 1 1 8 5649 1 1 19 TYR CE2 C -0.505 2.756 2.125 1.00 . A A . 19 TYR CE2 1 1 8 5650 1 1 19 TYR CG C -2.134 1.042 2.763 1.00 . A A . 19 TYR CG 1 1 8 5651 1 1 19 TYR CZ C -1.065 3.650 3.035 1.00 . A A . 19 TYR CZ 1 1 8 5652 1 1 19 TYR H H -1.351 -0.632 4.785 1.00 . A A . 19 TYR H 1 1 8 5653 1 1 19 TYR HA H -4.093 -0.106 4.245 1.00 . A A . 19 TYR HA 1 1 8 5654 1 1 19 TYR HB2 H -1.930 -1.126 2.356 1.00 . A A . 19 TYR HB2 1 1 8 5655 1 1 19 TYR HB3 H -3.497 -0.429 1.847 1.00 . A A . 19 TYR HB3 1 1 8 5656 1 1 19 TYR HD1 H -3.526 1.712 4.311 1.00 . A A . 19 TYR HD1 1 1 8 5657 1 1 19 TYR HD2 H -0.568 0.811 1.286 1.00 . A A . 19 TYR HD2 1 1 8 5658 1 1 19 TYR HE1 H -2.582 3.955 4.517 1.00 . A A . 19 TYR HE1 1 1 8 5659 1 1 19 TYR HE2 H 0.338 3.061 1.522 1.00 . A A . 19 TYR HE2 1 1 8 5660 1 1 19 TYR HH H -1.212 5.547 2.898 1.00 . A A . 19 TYR HH 1 1 8 5661 1 1 19 TYR N N -2.277 -0.873 5.008 1.00 . A A . 19 TYR N 1 1 8 5662 1 1 19 TYR O O -5.026 -2.350 3.214 1.00 . A A . 19 TYR O 1 1 8 5663 1 1 19 TYR OH O -0.540 4.918 3.168 1.00 . A A . 19 TYR OH 1 1 8 5664 1 1 20 CYS C C -4.646 -4.956 5.517 1.00 . A A . 20 CYS C 1 1 8 5665 1 1 20 CYS CA C -3.926 -4.591 4.218 1.00 . A A . 20 CYS CA 1 1 8 5666 1 1 20 CYS CB C -2.805 -5.600 3.964 1.00 . A A . 20 CYS CB 1 1 8 5667 1 1 20 CYS H H -2.504 -3.085 4.808 1.00 . A A . 20 CYS H 1 1 8 5668 1 1 20 CYS HA H -4.627 -4.617 3.398 1.00 . A A . 20 CYS HA 1 1 8 5669 1 1 20 CYS HB2 H -2.112 -5.583 4.791 1.00 . A A . 20 CYS HB2 1 1 8 5670 1 1 20 CYS HB3 H -3.228 -6.589 3.869 1.00 . A A . 20 CYS HB3 1 1 8 5671 1 1 20 CYS N N -3.351 -3.221 4.335 1.00 . A A . 20 CYS N 1 1 8 5672 1 1 20 CYS O O -4.333 -5.941 6.155 1.00 . A A . 20 CYS O 1 1 8 5673 1 1 20 CYS SG S -1.932 -5.170 2.438 1.00 . A A . 20 CYS SG 1 1 8 5674 1 1 21 ASN C C -7.524 -3.513 7.322 1.00 . A A . 21 ASN C 1 1 8 5675 1 1 21 ASN CA C -6.347 -4.478 7.173 1.00 . A A . 21 ASN CA 1 1 8 5676 1 1 21 ASN CB C -5.403 -4.322 8.366 1.00 . A A . 21 ASN CB 1 1 8 5677 1 1 21 ASN CG C -5.776 -5.335 9.450 1.00 . A A . 21 ASN CG 1 1 8 5678 1 1 21 ASN H H -5.847 -3.380 5.387 1.00 . A A . 21 ASN H 1 1 8 5679 1 1 21 ASN HA H -6.715 -5.493 7.135 1.00 . A A . 21 ASN HA 1 1 8 5680 1 1 21 ASN HB2 H -4.386 -4.497 8.044 1.00 . A A . 21 ASN HB2 1 1 8 5681 1 1 21 ASN HB3 H -5.488 -3.323 8.765 1.00 . A A . 21 ASN HB3 1 1 8 5682 1 1 21 ASN HD21 H -7.700 -5.360 8.964 1.00 . A A . 21 ASN HD21 1 1 8 5683 1 1 21 ASN HD22 H -7.266 -6.367 10.260 1.00 . A A . 21 ASN HD22 1 1 8 5684 1 1 21 ASN N N -5.609 -4.171 5.915 1.00 . A A . 21 ASN N 1 1 8 5685 1 1 21 ASN ND2 N -7.017 -5.720 9.567 1.00 . A A . 21 ASN ND2 1 1 8 5686 1 1 21 ASN O O -7.288 -2.374 7.689 1.00 . A A . 21 ASN O 1 1 8 5687 1 1 21 ASN OXT O -8.642 -3.929 7.066 1.00 . A A . 21 ASN OXT 1 1 8 5688 1 1 21 ASN OD1 O -4.928 -5.780 10.198 1.00 . A A . 21 ASN OD1 1 1 8 5689 2 2 1 PHE C C 12.303 0.191 -1.142 1.00 . B B . 22 PHE C 1 1 8 5690 2 2 1 PHE CA C 13.572 -0.584 -1.491 1.00 . B B . 22 PHE CA 1 1 8 5691 2 2 1 PHE CB C 13.200 -1.932 -2.117 1.00 . B B . 22 PHE CB 1 1 8 5692 2 2 1 PHE CD1 C 12.245 -2.769 0.066 1.00 . B B . 22 PHE CD1 1 1 8 5693 2 2 1 PHE CD2 C 13.808 -4.180 -1.141 1.00 . B B . 22 PHE CD2 1 1 8 5694 2 2 1 PHE CE1 C 12.134 -3.746 1.064 1.00 . B B . 22 PHE CE1 1 1 8 5695 2 2 1 PHE CE2 C 13.697 -5.157 -0.143 1.00 . B B . 22 PHE CE2 1 1 8 5696 2 2 1 PHE CG C 13.082 -2.986 -1.037 1.00 . B B . 22 PHE CG 1 1 8 5697 2 2 1 PHE CZ C 12.860 -4.941 0.959 1.00 . B B . 22 PHE CZ 1 1 8 5698 2 2 1 PHE H1 H 13.731 -0.919 0.558 1.00 . B B . 22 PHE H1 1 1 8 5699 2 2 1 PHE H2 H 14.996 0.008 -0.094 1.00 . B B . 22 PHE H2 1 1 8 5700 2 2 1 PHE H3 H 14.942 -1.669 -0.362 1.00 . B B . 22 PHE H3 1 1 8 5701 2 2 1 PHE HA H 14.153 -0.009 -2.193 1.00 . B B . 22 PHE HA 1 1 8 5702 2 2 1 PHE HB2 H 12.257 -1.840 -2.634 1.00 . B B . 22 PHE HB2 1 1 8 5703 2 2 1 PHE HB3 H 13.967 -2.224 -2.819 1.00 . B B . 22 PHE HB3 1 1 8 5704 2 2 1 PHE HD1 H 11.686 -1.850 0.149 1.00 . B B . 22 PHE HD1 1 1 8 5705 2 2 1 PHE HD2 H 14.454 -4.348 -1.991 1.00 . B B . 22 PHE HD2 1 1 8 5706 2 2 1 PHE HE1 H 11.488 -3.579 1.913 1.00 . B B . 22 PHE HE1 1 1 8 5707 2 2 1 PHE HE2 H 14.256 -6.077 -0.223 1.00 . B B . 22 PHE HE2 1 1 8 5708 2 2 1 PHE HZ H 12.774 -5.694 1.728 1.00 . B B . 22 PHE HZ 1 1 8 5709 2 2 1 PHE N N 14.371 -0.808 -0.253 1.00 . B B . 22 PHE N 1 1 8 5710 2 2 1 PHE O O 11.207 -0.328 -1.200 1.00 . B B . 22 PHE O 1 1 8 5711 2 2 2 VAL C C 11.450 3.692 -0.885 1.00 . B B . 23 VAL C 1 1 8 5712 2 2 2 VAL CA C 11.253 2.248 -0.424 1.00 . B B . 23 VAL CA 1 1 8 5713 2 2 2 VAL CB C 11.041 2.191 1.098 1.00 . B B . 23 VAL CB 1 1 8 5714 2 2 2 VAL CG1 C 11.771 3.342 1.803 1.00 . B B . 23 VAL CG1 1 1 8 5715 2 2 2 VAL CG2 C 9.546 2.276 1.398 1.00 . B B . 23 VAL CG2 1 1 8 5716 2 2 2 VAL H H 13.341 1.835 -0.740 1.00 . B B . 23 VAL H 1 1 8 5717 2 2 2 VAL HA H 10.383 1.843 -0.915 1.00 . B B . 23 VAL HA 1 1 8 5718 2 2 2 VAL HB H 11.422 1.256 1.469 1.00 . B B . 23 VAL HB 1 1 8 5719 2 2 2 VAL HG11 H 12.154 2.997 2.752 1.00 . B B . 23 VAL HG11 1 1 8 5720 2 2 2 VAL HG12 H 11.083 4.158 1.968 1.00 . B B . 23 VAL HG12 1 1 8 5721 2 2 2 VAL HG13 H 12.590 3.680 1.185 1.00 . B B . 23 VAL HG13 1 1 8 5722 2 2 2 VAL HG21 H 9.289 1.542 2.147 1.00 . B B . 23 VAL HG21 1 1 8 5723 2 2 2 VAL HG22 H 8.988 2.079 0.494 1.00 . B B . 23 VAL HG22 1 1 8 5724 2 2 2 VAL HG23 H 9.308 3.263 1.763 1.00 . B B . 23 VAL HG23 1 1 8 5725 2 2 2 VAL N N 12.447 1.436 -0.780 1.00 . B B . 23 VAL N 1 1 8 5726 2 2 2 VAL O O 12.247 3.983 -1.755 1.00 . B B . 23 VAL O 1 1 8 5727 2 2 3 ASN C C 10.447 6.202 -2.149 1.00 . B B . 24 ASN C 1 1 8 5728 2 2 3 ASN CA C 10.835 6.025 -0.681 1.00 . B B . 24 ASN CA 1 1 8 5729 2 2 3 ASN CB C 12.273 6.496 -0.474 1.00 . B B . 24 ASN CB 1 1 8 5730 2 2 3 ASN CG C 12.341 8.014 -0.651 1.00 . B B . 24 ASN CG 1 1 8 5731 2 2 3 ASN H H 10.086 4.312 0.394 1.00 . B B . 24 ASN H 1 1 8 5732 2 2 3 ASN HA H 10.173 6.614 -0.063 1.00 . B B . 24 ASN HA 1 1 8 5733 2 2 3 ASN HB2 H 12.597 6.232 0.522 1.00 . B B . 24 ASN HB2 1 1 8 5734 2 2 3 ASN HB3 H 12.915 6.021 -1.201 1.00 . B B . 24 ASN HB3 1 1 8 5735 2 2 3 ASN HD21 H 11.278 8.395 0.983 1.00 . B B . 24 ASN HD21 1 1 8 5736 2 2 3 ASN HD22 H 11.793 9.761 0.117 1.00 . B B . 24 ASN HD22 1 1 8 5737 2 2 3 ASN N N 10.718 4.589 -0.301 1.00 . B B . 24 ASN N 1 1 8 5738 2 2 3 ASN ND2 N 11.756 8.788 0.222 1.00 . B B . 24 ASN ND2 1 1 8 5739 2 2 3 ASN O O 11.269 6.515 -2.988 1.00 . B B . 24 ASN O 1 1 8 5740 2 2 3 ASN OD1 O 12.933 8.501 -1.594 1.00 . B B . 24 ASN OD1 1 1 8 5741 2 2 4 GLN C C 7.384 6.858 -3.888 1.00 . B B . 25 GLN C 1 1 8 5742 2 2 4 GLN CA C 8.749 6.172 -3.872 1.00 . B B . 25 GLN CA 1 1 8 5743 2 2 4 GLN CB C 8.639 4.800 -4.537 1.00 . B B . 25 GLN CB 1 1 8 5744 2 2 4 GLN CD C 9.288 3.490 -6.565 1.00 . B B . 25 GLN CD 1 1 8 5745 2 2 4 GLN CG C 9.578 4.747 -5.744 1.00 . B B . 25 GLN CG 1 1 8 5746 2 2 4 GLN H H 8.554 5.763 -1.769 1.00 . B B . 25 GLN H 1 1 8 5747 2 2 4 GLN HA H 9.463 6.778 -4.411 1.00 . B B . 25 GLN HA 1 1 8 5748 2 2 4 GLN HB2 H 8.918 4.034 -3.827 1.00 . B B . 25 GLN HB2 1 1 8 5749 2 2 4 GLN HB3 H 7.623 4.637 -4.864 1.00 . B B . 25 GLN HB3 1 1 8 5750 2 2 4 GLN HE21 H 8.781 2.401 -4.984 1.00 . B B . 25 GLN HE21 1 1 8 5751 2 2 4 GLN HE22 H 8.703 1.595 -6.476 1.00 . B B . 25 GLN HE22 1 1 8 5752 2 2 4 GLN HG2 H 9.423 5.623 -6.357 1.00 . B B . 25 GLN HG2 1 1 8 5753 2 2 4 GLN HG3 H 10.601 4.722 -5.403 1.00 . B B . 25 GLN HG3 1 1 8 5754 2 2 4 GLN N N 9.199 6.010 -2.463 1.00 . B B . 25 GLN N 1 1 8 5755 2 2 4 GLN NE2 N 8.891 2.405 -5.958 1.00 . B B . 25 GLN NE2 1 1 8 5756 2 2 4 GLN O O 6.780 7.079 -2.857 1.00 . B B . 25 GLN O 1 1 8 5757 2 2 4 GLN OE1 O 9.424 3.495 -7.773 1.00 . B B . 25 GLN OE1 1 1 8 5758 2 2 5 HIS C C 4.654 6.994 -5.975 1.00 . B B . 26 HIS C 1 1 8 5759 2 2 5 HIS CA C 5.564 7.874 -5.109 1.00 . B B . 26 HIS CA 1 1 8 5760 2 2 5 HIS CB C 5.743 9.252 -5.745 1.00 . B B . 26 HIS CB 1 1 8 5761 2 2 5 HIS CD2 C 4.348 11.414 -5.245 1.00 . B B . 26 HIS CD2 1 1 8 5762 2 2 5 HIS CE1 C 4.400 11.269 -3.075 1.00 . B B . 26 HIS CE1 1 1 8 5763 2 2 5 HIS CG C 5.028 10.276 -4.911 1.00 . B B . 26 HIS CG 1 1 8 5764 2 2 5 HIS H H 7.389 7.018 -5.868 1.00 . B B . 26 HIS H 1 1 8 5765 2 2 5 HIS HA H 5.150 7.971 -4.115 1.00 . B B . 26 HIS HA 1 1 8 5766 2 2 5 HIS HB2 H 6.794 9.495 -5.792 1.00 . B B . 26 HIS HB2 1 1 8 5767 2 2 5 HIS HB3 H 5.327 9.245 -6.743 1.00 . B B . 26 HIS HB3 1 1 8 5768 2 2 5 HIS HD2 H 4.152 11.760 -6.250 1.00 . B B . 26 HIS HD2 1 1 8 5769 2 2 5 HIS HE1 H 4.264 11.490 -2.026 1.00 . B B . 26 HIS HE1 1 1 8 5770 2 2 5 HIS HE2 H 3.449 12.885 -4.007 1.00 . B B . 26 HIS HE2 1 1 8 5771 2 2 5 HIS N N 6.890 7.201 -5.045 1.00 . B B . 26 HIS N 1 1 8 5772 2 2 5 HIS ND1 N 5.048 10.195 -3.535 1.00 . B B . 26 HIS ND1 1 1 8 5773 2 2 5 HIS NE2 N 3.951 12.047 -4.083 1.00 . B B . 26 HIS NE2 1 1 8 5774 2 2 5 HIS O O 5.133 6.274 -6.828 1.00 . B B . 26 HIS O 1 1 8 5775 2 2 6 LEU C C 1.028 6.489 -6.587 1.00 . B B . 27 LEU C 1 1 8 5776 2 2 6 LEU CA C 2.511 6.084 -6.589 1.00 . B B . 27 LEU CA 1 1 8 5777 2 2 6 LEU CB C 2.630 4.663 -6.024 1.00 . B B . 27 LEU CB 1 1 8 5778 2 2 6 LEU CD1 C 2.065 3.185 -4.091 1.00 . B B . 27 LEU CD1 1 1 8 5779 2 2 6 LEU CD2 C 2.464 5.607 -3.727 1.00 . B B . 27 LEU CD2 1 1 8 5780 2 2 6 LEU CG C 1.889 4.578 -4.690 1.00 . B B . 27 LEU CG 1 1 8 5781 2 2 6 LEU H H 2.969 7.544 -5.052 1.00 . B B . 27 LEU H 1 1 8 5782 2 2 6 LEU HA H 2.876 6.086 -7.604 1.00 . B B . 27 LEU HA 1 1 8 5783 2 2 6 LEU HB2 H 2.197 3.960 -6.714 1.00 . B B . 27 LEU HB2 1 1 8 5784 2 2 6 LEU HB3 H 3.671 4.423 -5.870 1.00 . B B . 27 LEU HB3 1 1 8 5785 2 2 6 LEU HD11 H 3.020 3.128 -3.590 1.00 . B B . 27 LEU HD11 1 1 8 5786 2 2 6 LEU HD12 H 2.026 2.448 -4.878 1.00 . B B . 27 LEU HD12 1 1 8 5787 2 2 6 LEU HD13 H 1.274 2.996 -3.381 1.00 . B B . 27 LEU HD13 1 1 8 5788 2 2 6 LEU HD21 H 1.944 6.543 -3.855 1.00 . B B . 27 LEU HD21 1 1 8 5789 2 2 6 LEU HD22 H 3.514 5.743 -3.939 1.00 . B B . 27 LEU HD22 1 1 8 5790 2 2 6 LEU HD23 H 2.341 5.258 -2.714 1.00 . B B . 27 LEU HD23 1 1 8 5791 2 2 6 LEU HG H 0.838 4.775 -4.847 1.00 . B B . 27 LEU HG 1 1 8 5792 2 2 6 LEU N N 3.362 6.992 -5.760 1.00 . B B . 27 LEU N 1 1 8 5793 2 2 6 LEU O O 0.467 6.864 -5.577 1.00 . B B . 27 LEU O 1 1 8 5794 2 2 7 CYS C C -1.695 5.587 -8.753 1.00 . B B . 28 CYS C 1 1 8 5795 2 2 7 CYS CA C -1.064 6.658 -7.855 1.00 . B B . 28 CYS CA 1 1 8 5796 2 2 7 CYS CB C -1.276 8.032 -8.494 1.00 . B B . 28 CYS CB 1 1 8 5797 2 2 7 CYS H H 0.877 6.024 -8.507 1.00 . B B . 28 CYS H 1 1 8 5798 2 2 7 CYS HA H -1.527 6.632 -6.879 1.00 . B B . 28 CYS HA 1 1 8 5799 2 2 7 CYS HB2 H -0.371 8.340 -8.994 1.00 . B B . 28 CYS HB2 1 1 8 5800 2 2 7 CYS HB3 H -2.081 7.973 -9.212 1.00 . B B . 28 CYS HB3 1 1 8 5801 2 2 7 CYS N N 0.393 6.357 -7.727 1.00 . B B . 28 CYS N 1 1 8 5802 2 2 7 CYS O O -1.001 4.828 -9.402 1.00 . B B . 28 CYS O 1 1 8 5803 2 2 7 CYS SG S -1.699 9.240 -7.217 1.00 . B B . 28 CYS SG 1 1 8 5804 2 2 8 GLY C C -2.934 3.160 -9.581 1.00 . B B . 29 GLY C 1 1 8 5805 2 2 8 GLY CA C -3.670 4.504 -9.664 1.00 . B B . 29 GLY CA 1 1 8 5806 2 2 8 GLY H H -3.538 6.146 -8.272 1.00 . B B . 29 GLY H 1 1 8 5807 2 2 8 GLY HA2 H -4.691 4.374 -9.333 1.00 . B B . 29 GLY HA2 1 1 8 5808 2 2 8 GLY HA3 H -3.668 4.846 -10.688 1.00 . B B . 29 GLY HA3 1 1 8 5809 2 2 8 GLY N N -2.998 5.522 -8.801 1.00 . B B . 29 GLY N 1 1 8 5810 2 2 8 GLY O O -2.796 2.580 -8.522 1.00 . B B . 29 GLY O 1 1 8 5811 2 2 9 SER C C -0.615 1.351 -9.684 1.00 . B B . 30 SER C 1 1 8 5812 2 2 9 SER CA C -1.760 1.344 -10.701 1.00 . B B . 30 SER CA 1 1 8 5813 2 2 9 SER CB C -1.192 1.080 -12.097 1.00 . B B . 30 SER CB 1 1 8 5814 2 2 9 SER H H -2.609 3.140 -11.539 1.00 . B B . 30 SER H 1 1 8 5815 2 2 9 SER HA H -2.457 0.560 -10.447 1.00 . B B . 30 SER HA 1 1 8 5816 2 2 9 SER HB2 H -0.169 1.416 -12.141 1.00 . B B . 30 SER HB2 1 1 8 5817 2 2 9 SER HB3 H -1.228 0.019 -12.305 1.00 . B B . 30 SER HB3 1 1 8 5818 2 2 9 SER HG H -1.686 1.497 -13.932 1.00 . B B . 30 SER HG 1 1 8 5819 2 2 9 SER N N -2.474 2.657 -10.697 1.00 . B B . 30 SER N 1 1 8 5820 2 2 9 SER O O -0.578 0.541 -8.779 1.00 . B B . 30 SER O 1 1 8 5821 2 2 9 SER OG O -1.959 1.791 -13.060 1.00 . B B . 30 SER OG 1 1 8 5822 2 2 10 ASP C C 0.977 2.049 -7.455 1.00 . B B . 31 ASP C 1 1 8 5823 2 2 10 ASP CA C 1.475 2.299 -8.879 1.00 . B B . 31 ASP CA 1 1 8 5824 2 2 10 ASP CB C 2.143 3.669 -8.958 1.00 . B B . 31 ASP CB 1 1 8 5825 2 2 10 ASP CG C 2.343 4.061 -10.423 1.00 . B B . 31 ASP CG 1 1 8 5826 2 2 10 ASP H H 0.279 2.886 -10.575 1.00 . B B . 31 ASP H 1 1 8 5827 2 2 10 ASP HA H 2.194 1.539 -9.139 1.00 . B B . 31 ASP HA 1 1 8 5828 2 2 10 ASP HB2 H 1.516 4.395 -8.471 1.00 . B B . 31 ASP HB2 1 1 8 5829 2 2 10 ASP HB3 H 3.102 3.634 -8.460 1.00 . B B . 31 ASP HB3 1 1 8 5830 2 2 10 ASP N N 0.326 2.249 -9.832 1.00 . B B . 31 ASP N 1 1 8 5831 2 2 10 ASP O O 1.641 1.414 -6.661 1.00 . B B . 31 ASP O 1 1 8 5832 2 2 10 ASP OD1 O 2.711 3.197 -11.202 1.00 . B B . 31 ASP OD1 1 1 8 5833 2 2 10 ASP OD2 O 2.127 5.219 -10.741 1.00 . B B . 31 ASP OD2 1 1 8 5834 2 2 11 LEU C C -1.023 0.801 -5.599 1.00 . B B . 32 LEU C 1 1 8 5835 2 2 11 LEU CA C -0.725 2.292 -5.758 1.00 . B B . 32 LEU CA 1 1 8 5836 2 2 11 LEU CB C -2.009 3.098 -5.556 1.00 . B B . 32 LEU CB 1 1 8 5837 2 2 11 LEU CD1 C -1.579 5.357 -4.590 1.00 . B B . 32 LEU CD1 1 1 8 5838 2 2 11 LEU CD2 C -3.244 3.837 -3.516 1.00 . B B . 32 LEU CD2 1 1 8 5839 2 2 11 LEU CG C -1.908 3.902 -4.259 1.00 . B B . 32 LEU CG 1 1 8 5840 2 2 11 LEU H H -0.721 3.028 -7.784 1.00 . B B . 32 LEU H 1 1 8 5841 2 2 11 LEU HA H 0.014 2.592 -5.028 1.00 . B B . 32 LEU HA 1 1 8 5842 2 2 11 LEU HB2 H -2.146 3.772 -6.389 1.00 . B B . 32 LEU HB2 1 1 8 5843 2 2 11 LEU HB3 H -2.851 2.425 -5.494 1.00 . B B . 32 LEU HB3 1 1 8 5844 2 2 11 LEU HD11 H -1.003 5.395 -5.501 1.00 . B B . 32 LEU HD11 1 1 8 5845 2 2 11 LEU HD12 H -1.008 5.790 -3.782 1.00 . B B . 32 LEU HD12 1 1 8 5846 2 2 11 LEU HD13 H -2.496 5.913 -4.720 1.00 . B B . 32 LEU HD13 1 1 8 5847 2 2 11 LEU HD21 H -3.322 2.891 -3.000 1.00 . B B . 32 LEU HD21 1 1 8 5848 2 2 11 LEU HD22 H -4.054 3.929 -4.224 1.00 . B B . 32 LEU HD22 1 1 8 5849 2 2 11 LEU HD23 H -3.297 4.643 -2.799 1.00 . B B . 32 LEU HD23 1 1 8 5850 2 2 11 LEU HG H -1.126 3.489 -3.638 1.00 . B B . 32 LEU HG 1 1 8 5851 2 2 11 LEU N N -0.192 2.527 -7.129 1.00 . B B . 32 LEU N 1 1 8 5852 2 2 11 LEU O O -0.308 0.086 -4.925 1.00 . B B . 32 LEU O 1 1 8 5853 2 2 12 VAL C C -1.113 -1.929 -6.392 1.00 . B B . 33 VAL C 1 1 8 5854 2 2 12 VAL CA C -2.384 -1.130 -6.113 1.00 . B B . 33 VAL CA 1 1 8 5855 2 2 12 VAL CB C -3.464 -1.503 -7.132 1.00 . B B . 33 VAL CB 1 1 8 5856 2 2 12 VAL CG1 C -4.663 -0.567 -6.972 1.00 . B B . 33 VAL CG1 1 1 8 5857 2 2 12 VAL CG2 C -2.899 -1.368 -8.548 1.00 . B B . 33 VAL CG2 1 1 8 5858 2 2 12 VAL H H -2.624 0.907 -6.774 1.00 . B B . 33 VAL H 1 1 8 5859 2 2 12 VAL HA H -2.736 -1.346 -5.114 1.00 . B B . 33 VAL HA 1 1 8 5860 2 2 12 VAL HB H -3.779 -2.523 -6.964 1.00 . B B . 33 VAL HB 1 1 8 5861 2 2 12 VAL HG11 H -4.715 -0.221 -5.951 1.00 . B B . 33 VAL HG11 1 1 8 5862 2 2 12 VAL HG12 H -5.570 -1.099 -7.218 1.00 . B B . 33 VAL HG12 1 1 8 5863 2 2 12 VAL HG13 H -4.551 0.279 -7.634 1.00 . B B . 33 VAL HG13 1 1 8 5864 2 2 12 VAL HG21 H -2.036 -2.008 -8.654 1.00 . B B . 33 VAL HG21 1 1 8 5865 2 2 12 VAL HG22 H -2.611 -0.343 -8.725 1.00 . B B . 33 VAL HG22 1 1 8 5866 2 2 12 VAL HG23 H -3.653 -1.659 -9.266 1.00 . B B . 33 VAL HG23 1 1 8 5867 2 2 12 VAL N N -2.064 0.320 -6.225 1.00 . B B . 33 VAL N 1 1 8 5868 2 2 12 VAL O O -0.932 -3.025 -5.899 1.00 . B B . 33 VAL O 1 1 8 5869 2 2 13 GLU C C 1.937 -2.069 -6.243 1.00 . B B . 34 GLU C 1 1 8 5870 2 2 13 GLU CA C 1.044 -2.089 -7.484 1.00 . B B . 34 GLU CA 1 1 8 5871 2 2 13 GLU CB C 1.753 -1.388 -8.645 1.00 . B B . 34 GLU CB 1 1 8 5872 2 2 13 GLU CD C -0.005 -2.396 -10.111 1.00 . B B . 34 GLU CD 1 1 8 5873 2 2 13 GLU CG C 1.496 -2.157 -9.945 1.00 . B B . 34 GLU CG 1 1 8 5874 2 2 13 GLU H H -0.390 -0.490 -7.555 1.00 . B B . 34 GLU H 1 1 8 5875 2 2 13 GLU HA H 0.827 -3.112 -7.756 1.00 . B B . 34 GLU HA 1 1 8 5876 2 2 13 GLU HB2 H 1.373 -0.381 -8.741 1.00 . B B . 34 GLU HB2 1 1 8 5877 2 2 13 GLU HB3 H 2.813 -1.356 -8.451 1.00 . B B . 34 GLU HB3 1 1 8 5878 2 2 13 GLU HG2 H 1.865 -1.581 -10.781 1.00 . B B . 34 GLU HG2 1 1 8 5879 2 2 13 GLU HG3 H 2.008 -3.107 -9.909 1.00 . B B . 34 GLU HG3 1 1 8 5880 2 2 13 GLU N N -0.225 -1.378 -7.176 1.00 . B B . 34 GLU N 1 1 8 5881 2 2 13 GLU O O 2.343 -3.101 -5.744 1.00 . B B . 34 GLU O 1 1 8 5882 2 2 13 GLU OE1 O -0.504 -3.342 -9.524 1.00 . B B . 34 GLU OE1 1 1 8 5883 2 2 13 GLU OE2 O -0.631 -1.629 -10.825 1.00 . B B . 34 GLU OE2 1 1 8 5884 2 2 14 ALA C C 2.367 -1.601 -3.387 1.00 . B B . 35 ALA C 1 1 8 5885 2 2 14 ALA CA C 3.083 -0.844 -4.504 1.00 . B B . 35 ALA CA 1 1 8 5886 2 2 14 ALA CB C 3.284 0.613 -4.087 1.00 . B B . 35 ALA CB 1 1 8 5887 2 2 14 ALA H H 1.887 -0.083 -6.128 1.00 . B B . 35 ALA H 1 1 8 5888 2 2 14 ALA HA H 4.040 -1.303 -4.703 1.00 . B B . 35 ALA HA 1 1 8 5889 2 2 14 ALA HB1 H 2.414 0.953 -3.544 1.00 . B B . 35 ALA HB1 1 1 8 5890 2 2 14 ALA HB2 H 3.422 1.225 -4.966 1.00 . B B . 35 ALA HB2 1 1 8 5891 2 2 14 ALA HB3 H 4.156 0.691 -3.454 1.00 . B B . 35 ALA HB3 1 1 8 5892 2 2 14 ALA N N 2.234 -0.907 -5.725 1.00 . B B . 35 ALA N 1 1 8 5893 2 2 14 ALA O O 2.949 -2.403 -2.686 1.00 . B B . 35 ALA O 1 1 8 5894 2 2 15 LEU C C 0.382 -3.567 -2.463 1.00 . B B . 36 LEU C 1 1 8 5895 2 2 15 LEU CA C 0.308 -2.067 -2.189 1.00 . B B . 36 LEU CA 1 1 8 5896 2 2 15 LEU CB C -1.158 -1.616 -2.270 1.00 . B B . 36 LEU CB 1 1 8 5897 2 2 15 LEU CD1 C -1.890 -0.220 -0.325 1.00 . B B . 36 LEU CD1 1 1 8 5898 2 2 15 LEU CD2 C -0.009 0.592 -1.754 1.00 . B B . 36 LEU CD2 1 1 8 5899 2 2 15 LEU CG C -1.341 -0.176 -1.750 1.00 . B B . 36 LEU CG 1 1 8 5900 2 2 15 LEU H H 0.646 -0.719 -3.830 1.00 . B B . 36 LEU H 1 1 8 5901 2 2 15 LEU HA H 0.711 -1.848 -1.210 1.00 . B B . 36 LEU HA 1 1 8 5902 2 2 15 LEU HB2 H -1.484 -1.664 -3.298 1.00 . B B . 36 LEU HB2 1 1 8 5903 2 2 15 LEU HB3 H -1.764 -2.284 -1.677 1.00 . B B . 36 LEU HB3 1 1 8 5904 2 2 15 LEU HD11 H -2.109 0.784 0.008 1.00 . B B . 36 LEU HD11 1 1 8 5905 2 2 15 LEU HD12 H -1.156 -0.665 0.330 1.00 . B B . 36 LEU HD12 1 1 8 5906 2 2 15 LEU HD13 H -2.794 -0.810 -0.305 1.00 . B B . 36 LEU HD13 1 1 8 5907 2 2 15 LEU HD21 H 0.742 0.016 -1.234 1.00 . B B . 36 LEU HD21 1 1 8 5908 2 2 15 LEU HD22 H -0.140 1.542 -1.257 1.00 . B B . 36 LEU HD22 1 1 8 5909 2 2 15 LEU HD23 H 0.308 0.761 -2.772 1.00 . B B . 36 LEU HD23 1 1 8 5910 2 2 15 LEU HG H -2.052 0.338 -2.384 1.00 . B B . 36 LEU HG 1 1 8 5911 2 2 15 LEU N N 1.093 -1.359 -3.237 1.00 . B B . 36 LEU N 1 1 8 5912 2 2 15 LEU O O 0.267 -4.388 -1.575 1.00 . B B . 36 LEU O 1 1 8 5913 2 2 16 TYR C C 2.043 -5.899 -3.770 1.00 . B B . 37 TYR C 1 1 8 5914 2 2 16 TYR CA C 0.647 -5.358 -4.078 1.00 . B B . 37 TYR CA 1 1 8 5915 2 2 16 TYR CB C 0.366 -5.505 -5.574 1.00 . B B . 37 TYR CB 1 1 8 5916 2 2 16 TYR CD1 C -0.267 -8.003 -5.663 1.00 . B B . 37 TYR CD1 1 1 8 5917 2 2 16 TYR CD2 C 1.812 -7.304 -6.718 1.00 . B B . 37 TYR CD2 1 1 8 5918 2 2 16 TYR CE1 C -0.006 -9.324 -6.045 1.00 . B B . 37 TYR CE1 1 1 8 5919 2 2 16 TYR CE2 C 2.058 -8.630 -7.093 1.00 . B B . 37 TYR CE2 1 1 8 5920 2 2 16 TYR CG C 0.642 -6.967 -5.997 1.00 . B B . 37 TYR CG 1 1 8 5921 2 2 16 TYR CZ C 1.151 -9.636 -6.759 1.00 . B B . 37 TYR CZ 1 1 8 5922 2 2 16 TYR H H 0.655 -3.230 -4.391 1.00 . B B . 37 TYR H 1 1 8 5923 2 2 16 TYR HA H -0.087 -5.917 -3.518 1.00 . B B . 37 TYR HA 1 1 8 5924 2 2 16 TYR HB2 H -0.672 -5.232 -5.767 1.00 . B B . 37 TYR HB2 1 1 8 5925 2 2 16 TYR HB3 H 1.009 -4.823 -6.124 1.00 . B B . 37 TYR HB3 1 1 8 5926 2 2 16 TYR HD1 H -1.162 -7.793 -5.111 1.00 . B B . 37 TYR HD1 1 1 8 5927 2 2 16 TYR HD2 H 2.528 -6.554 -6.981 1.00 . B B . 37 TYR HD2 1 1 8 5928 2 2 16 TYR HE1 H -0.704 -10.106 -5.786 1.00 . B B . 37 TYR HE1 1 1 8 5929 2 2 16 TYR HE2 H 2.953 -8.875 -7.646 1.00 . B B . 37 TYR HE2 1 1 8 5930 2 2 16 TYR HH H 0.622 -11.463 -6.924 1.00 . B B . 37 TYR HH 1 1 8 5931 2 2 16 TYR N N 0.569 -3.920 -3.703 1.00 . B B . 37 TYR N 1 1 8 5932 2 2 16 TYR O O 2.274 -7.092 -3.789 1.00 . B B . 37 TYR O 1 1 8 5933 2 2 16 TYR OH O 1.400 -10.941 -7.132 1.00 . B B . 37 TYR OH 1 1 8 5934 2 2 17 LEU C C 4.460 -5.742 -1.662 1.00 . B B . 38 LEU C 1 1 8 5935 2 2 17 LEU CA C 4.353 -5.516 -3.167 1.00 . B B . 38 LEU CA 1 1 8 5936 2 2 17 LEU CB C 5.397 -4.480 -3.597 1.00 . B B . 38 LEU CB 1 1 8 5937 2 2 17 LEU CD1 C 5.910 -2.614 -5.170 1.00 . B B . 38 LEU CD1 1 1 8 5938 2 2 17 LEU CD2 C 4.485 -4.519 -5.924 1.00 . B B . 38 LEU CD2 1 1 8 5939 2 2 17 LEU CG C 4.849 -3.626 -4.737 1.00 . B B . 38 LEU CG 1 1 8 5940 2 2 17 LEU H H 2.770 -4.080 -3.464 1.00 . B B . 38 LEU H 1 1 8 5941 2 2 17 LEU HA H 4.534 -6.444 -3.685 1.00 . B B . 38 LEU HA 1 1 8 5942 2 2 17 LEU HB2 H 5.638 -3.845 -2.757 1.00 . B B . 38 LEU HB2 1 1 8 5943 2 2 17 LEU HB3 H 6.290 -4.988 -3.930 1.00 . B B . 38 LEU HB3 1 1 8 5944 2 2 17 LEU HD11 H 6.162 -1.977 -4.335 1.00 . B B . 38 LEU HD11 1 1 8 5945 2 2 17 LEU HD12 H 5.524 -2.012 -5.979 1.00 . B B . 38 LEU HD12 1 1 8 5946 2 2 17 LEU HD13 H 6.794 -3.139 -5.502 1.00 . B B . 38 LEU HD13 1 1 8 5947 2 2 17 LEU HD21 H 4.535 -3.941 -6.835 1.00 . B B . 38 LEU HD21 1 1 8 5948 2 2 17 LEU HD22 H 3.483 -4.898 -5.792 1.00 . B B . 38 LEU HD22 1 1 8 5949 2 2 17 LEU HD23 H 5.179 -5.343 -5.981 1.00 . B B . 38 LEU HD23 1 1 8 5950 2 2 17 LEU HG H 3.971 -3.103 -4.399 1.00 . B B . 38 LEU HG 1 1 8 5951 2 2 17 LEU N N 2.977 -5.036 -3.482 1.00 . B B . 38 LEU N 1 1 8 5952 2 2 17 LEU O O 4.915 -6.772 -1.205 1.00 . B B . 38 LEU O 1 1 8 5953 2 2 18 VAL C C 3.217 -6.115 1.008 1.00 . B B . 39 VAL C 1 1 8 5954 2 2 18 VAL CA C 4.095 -4.933 0.590 1.00 . B B . 39 VAL CA 1 1 8 5955 2 2 18 VAL CB C 3.585 -3.646 1.247 1.00 . B B . 39 VAL CB 1 1 8 5956 2 2 18 VAL CG1 C 4.143 -2.436 0.498 1.00 . B B . 39 VAL CG1 1 1 8 5957 2 2 18 VAL CG2 C 2.056 -3.608 1.193 1.00 . B B . 39 VAL CG2 1 1 8 5958 2 2 18 VAL H H 3.664 -3.966 -1.281 1.00 . B B . 39 VAL H 1 1 8 5959 2 2 18 VAL HA H 5.115 -5.115 0.893 1.00 . B B . 39 VAL HA 1 1 8 5960 2 2 18 VAL HB H 3.911 -3.613 2.275 1.00 . B B . 39 VAL HB 1 1 8 5961 2 2 18 VAL HG11 H 4.353 -1.643 1.200 1.00 . B B . 39 VAL HG11 1 1 8 5962 2 2 18 VAL HG12 H 3.416 -2.094 -0.225 1.00 . B B . 39 VAL HG12 1 1 8 5963 2 2 18 VAL HG13 H 5.053 -2.717 -0.012 1.00 . B B . 39 VAL HG13 1 1 8 5964 2 2 18 VAL HG21 H 1.658 -4.487 1.679 1.00 . B B . 39 VAL HG21 1 1 8 5965 2 2 18 VAL HG22 H 1.734 -3.588 0.163 1.00 . B B . 39 VAL HG22 1 1 8 5966 2 2 18 VAL HG23 H 1.700 -2.725 1.700 1.00 . B B . 39 VAL HG23 1 1 8 5967 2 2 18 VAL N N 4.033 -4.784 -0.888 1.00 . B B . 39 VAL N 1 1 8 5968 2 2 18 VAL O O 3.470 -6.774 1.997 1.00 . B B . 39 VAL O 1 1 8 5969 2 2 19 CYS C C 1.282 -8.535 -0.543 1.00 . B B . 40 CYS C 1 1 8 5970 2 2 19 CYS CA C 1.285 -7.519 0.601 1.00 . B B . 40 CYS CA 1 1 8 5971 2 2 19 CYS CB C -0.134 -6.993 0.823 1.00 . B B . 40 CYS CB 1 1 8 5972 2 2 19 CYS H H 2.000 -5.836 -0.536 1.00 . B B . 40 CYS H 1 1 8 5973 2 2 19 CYS HA H 1.637 -7.994 1.503 1.00 . B B . 40 CYS HA 1 1 8 5974 2 2 19 CYS HB2 H -0.349 -6.220 0.099 1.00 . B B . 40 CYS HB2 1 1 8 5975 2 2 19 CYS HB3 H -0.840 -7.801 0.708 1.00 . B B . 40 CYS HB3 1 1 8 5976 2 2 19 CYS N N 2.184 -6.384 0.256 1.00 . B B . 40 CYS N 1 1 8 5977 2 2 19 CYS O O 0.446 -9.415 -0.602 1.00 . B B . 40 CYS O 1 1 8 5978 2 2 19 CYS SG S -0.265 -6.308 2.493 1.00 . B B . 40 CYS SG 1 1 8 5979 2 2 20 GLY C C 2.339 -10.813 -2.049 1.00 . B B . 41 GLY C 1 1 8 5980 2 2 20 GLY CA C 2.261 -9.384 -2.590 1.00 . B B . 41 GLY CA 1 1 8 5981 2 2 20 GLY H H 2.877 -7.706 -1.387 1.00 . B B . 41 GLY H 1 1 8 5982 2 2 20 GLY HA2 H 1.371 -9.274 -3.194 1.00 . B B . 41 GLY HA2 1 1 8 5983 2 2 20 GLY HA3 H 3.133 -9.184 -3.194 1.00 . B B . 41 GLY HA3 1 1 8 5984 2 2 20 GLY N N 2.211 -8.423 -1.453 1.00 . B B . 41 GLY N 1 1 8 5985 2 2 20 GLY O O 1.705 -11.716 -2.558 1.00 . B B . 41 GLY O 1 1 8 5986 2 2 21 GLU C C 2.444 -12.471 0.866 1.00 . B B . 42 GLU C 1 1 8 5987 2 2 21 GLU CA C 3.227 -12.398 -0.446 1.00 . B B . 42 GLU CA 1 1 8 5988 2 2 21 GLU CB C 4.699 -12.717 -0.174 1.00 . B B . 42 GLU CB 1 1 8 5989 2 2 21 GLU CD C 7.036 -12.439 -1.008 1.00 . B B . 42 GLU CD 1 1 8 5990 2 2 21 GLU CG C 5.581 -12.010 -1.205 1.00 . B B . 42 GLU CG 1 1 8 5991 2 2 21 GLU H H 3.615 -10.285 -0.622 1.00 . B B . 42 GLU H 1 1 8 5992 2 2 21 GLU HA H 2.826 -13.115 -1.146 1.00 . B B . 42 GLU HA 1 1 8 5993 2 2 21 GLU HB2 H 4.963 -12.378 0.817 1.00 . B B . 42 GLU HB2 1 1 8 5994 2 2 21 GLU HB3 H 4.855 -13.784 -0.242 1.00 . B B . 42 GLU HB3 1 1 8 5995 2 2 21 GLU HG2 H 5.256 -12.276 -2.201 1.00 . B B . 42 GLU HG2 1 1 8 5996 2 2 21 GLU HG3 H 5.503 -10.941 -1.074 1.00 . B B . 42 GLU HG3 1 1 8 5997 2 2 21 GLU N N 3.111 -11.026 -1.018 1.00 . B B . 42 GLU N 1 1 8 5998 2 2 21 GLU O O 2.225 -13.534 1.411 1.00 . B B . 42 GLU O 1 1 8 5999 2 2 21 GLU OE1 O 7.264 -13.347 -0.225 1.00 . B B . 42 GLU OE1 1 1 8 6000 2 2 21 GLU OE2 O 7.897 -11.853 -1.642 1.00 . B B . 42 GLU OE2 1 1 8 6001 2 2 22 ARG C C -0.225 -11.102 2.372 1.00 . B B . 43 ARG C 1 1 8 6002 2 2 22 ARG CA C 1.257 -11.354 2.659 1.00 . B B . 43 ARG CA 1 1 8 6003 2 2 22 ARG CB C 1.793 -10.252 3.574 1.00 . B B . 43 ARG CB 1 1 8 6004 2 2 22 ARG CD C 2.160 -11.190 5.862 1.00 . B B . 43 ARG CD 1 1 8 6005 2 2 22 ARG CG C 1.192 -10.409 4.972 1.00 . B B . 43 ARG CG 1 1 8 6006 2 2 22 ARG CZ C 1.067 -10.518 7.917 1.00 . B B . 43 ARG CZ 1 1 8 6007 2 2 22 ARG H H 2.210 -10.500 0.926 1.00 . B B . 43 ARG H 1 1 8 6008 2 2 22 ARG HA H 1.372 -12.313 3.143 1.00 . B B . 43 ARG HA 1 1 8 6009 2 2 22 ARG HB2 H 2.869 -10.326 3.634 1.00 . B B . 43 ARG HB2 1 1 8 6010 2 2 22 ARG HB3 H 1.520 -9.287 3.174 1.00 . B B . 43 ARG HB3 1 1 8 6011 2 2 22 ARG HD2 H 1.842 -12.220 5.923 1.00 . B B . 43 ARG HD2 1 1 8 6012 2 2 22 ARG HD3 H 3.154 -11.145 5.440 1.00 . B B . 43 ARG HD3 1 1 8 6013 2 2 22 ARG HE H 3.011 -10.253 7.605 1.00 . B B . 43 ARG HE 1 1 8 6014 2 2 22 ARG HG2 H 1.018 -9.432 5.399 1.00 . B B . 43 ARG HG2 1 1 8 6015 2 2 22 ARG HG3 H 0.257 -10.944 4.904 1.00 . B B . 43 ARG HG3 1 1 8 6016 2 2 22 ARG HH11 H 0.076 -11.816 6.760 1.00 . B B . 43 ARG HH11 1 1 8 6017 2 2 22 ARG HH12 H -0.819 -11.166 8.092 1.00 . B B . 43 ARG HH12 1 1 8 6018 2 2 22 ARG HH21 H 1.797 -9.199 9.235 1.00 . B B . 43 ARG HH21 1 1 8 6019 2 2 22 ARG HH22 H 0.154 -9.683 9.491 1.00 . B B . 43 ARG HH22 1 1 8 6020 2 2 22 ARG N N 2.022 -11.348 1.380 1.00 . B B . 43 ARG N 1 1 8 6021 2 2 22 ARG NE N 2.173 -10.592 7.226 1.00 . B B . 43 ARG NE 1 1 8 6022 2 2 22 ARG NH1 N 0.027 -11.221 7.562 1.00 . B B . 43 ARG NH1 1 1 8 6023 2 2 22 ARG NH2 N 1.001 -9.739 8.963 1.00 . B B . 43 ARG NH2 1 1 8 6024 2 2 22 ARG O O -0.577 -10.268 1.562 1.00 . B B . 43 ARG O 1 1 8 6025 2 2 23 GLY C C -2.844 -11.673 1.297 1.00 . B B . 44 GLY C 1 1 8 6026 2 2 23 GLY CA C -2.553 -11.612 2.798 1.00 . B B . 44 GLY CA 1 1 8 6027 2 2 23 GLY H H -0.792 -12.482 3.683 1.00 . B B . 44 GLY H 1 1 8 6028 2 2 23 GLY HA2 H -3.110 -12.386 3.306 1.00 . B B . 44 GLY HA2 1 1 8 6029 2 2 23 GLY HA3 H -2.847 -10.646 3.180 1.00 . B B . 44 GLY HA3 1 1 8 6030 2 2 23 GLY N N -1.096 -11.815 3.032 1.00 . B B . 44 GLY N 1 1 8 6031 2 2 23 GLY O O -2.236 -12.429 0.566 1.00 . B B . 44 GLY O 1 1 8 6032 2 2 24 GLY C C -5.453 -10.198 -0.830 1.00 . B B . 45 GLY C 1 1 8 6033 2 2 24 GLY CA C -4.105 -10.889 -0.620 1.00 . B B . 45 GLY CA 1 1 8 6034 2 2 24 GLY H H -4.248 -10.278 1.441 1.00 . B B . 45 GLY H 1 1 8 6035 2 2 24 GLY HA2 H -3.337 -10.362 -1.170 1.00 . B B . 45 GLY HA2 1 1 8 6036 2 2 24 GLY HA3 H -4.167 -11.907 -0.970 1.00 . B B . 45 GLY HA3 1 1 8 6037 2 2 24 GLY N N -3.771 -10.880 0.833 1.00 . B B . 45 GLY N 1 1 8 6038 2 2 24 GLY O O -6.192 -9.976 0.107 1.00 . B B . 45 GLY O 1 1 8 6039 2 2 25 PHE C C -7.383 -8.164 -1.226 1.00 . B B . 46 PHE C 1 1 8 6040 2 2 25 PHE CA C -7.079 -9.177 -2.334 1.00 . B B . 46 PHE CA 1 1 8 6041 2 2 25 PHE CB C -8.207 -10.213 -2.413 1.00 . B B . 46 PHE CB 1 1 8 6042 2 2 25 PHE CD1 C -7.008 -12.449 -1.840 1.00 . B B . 46 PHE CD1 1 1 8 6043 2 2 25 PHE CD2 C -8.457 -11.460 -0.148 1.00 . B B . 46 PHE CD2 1 1 8 6044 2 2 25 PHE CE1 C -6.725 -13.504 -0.963 1.00 . B B . 46 PHE CE1 1 1 8 6045 2 2 25 PHE CE2 C -8.161 -12.525 0.711 1.00 . B B . 46 PHE CE2 1 1 8 6046 2 2 25 PHE CG C -7.887 -11.399 -1.449 1.00 . B B . 46 PHE CG 1 1 8 6047 2 2 25 PHE CZ C -7.300 -13.542 0.304 1.00 . B B . 46 PHE CZ 1 1 8 6048 2 2 25 PHE H H -5.160 -10.051 -2.789 1.00 . B B . 46 PHE H 1 1 8 6049 2 2 25 PHE HA H -7.008 -8.657 -3.279 1.00 . B B . 46 PHE HA 1 1 8 6050 2 2 25 PHE HB2 H -9.154 -9.720 -2.138 1.00 . B B . 46 PHE HB2 1 1 8 6051 2 2 25 PHE HB3 H -8.285 -10.567 -3.451 1.00 . B B . 46 PHE HB3 1 1 8 6052 2 2 25 PHE HD1 H -6.539 -12.449 -2.800 1.00 . B B . 46 PHE HD1 1 1 8 6053 2 2 25 PHE HD2 H -9.115 -10.695 0.202 1.00 . B B . 46 PHE HD2 1 1 8 6054 2 2 25 PHE HE1 H -6.059 -14.295 -1.273 1.00 . B B . 46 PHE HE1 1 1 8 6055 2 2 25 PHE HE2 H -8.601 -12.558 1.697 1.00 . B B . 46 PHE HE2 1 1 8 6056 2 2 25 PHE HZ H -7.078 -14.360 0.973 1.00 . B B . 46 PHE HZ 1 1 8 6057 2 2 25 PHE N N -5.777 -9.859 -2.053 1.00 . B B . 46 PHE N 1 1 8 6058 2 2 25 PHE O O -7.942 -8.498 -0.200 1.00 . B B . 46 PHE O 1 1 8 6059 2 2 26 TYR C C -8.751 -5.498 -0.383 1.00 . B B . 47 TYR C 1 1 8 6060 2 2 26 TYR CA C -7.271 -5.894 -0.381 1.00 . B B . 47 TYR CA 1 1 8 6061 2 2 26 TYR CB C -6.409 -4.659 -0.662 1.00 . B B . 47 TYR CB 1 1 8 6062 2 2 26 TYR CD1 C -7.558 -3.647 -2.761 1.00 . B B . 47 TYR CD1 1 1 8 6063 2 2 26 TYR CD2 C -5.401 -4.742 -3.056 1.00 . B B . 47 TYR CD2 1 1 8 6064 2 2 26 TYR CE1 C -7.591 -3.369 -4.133 1.00 . B B . 47 TYR CE1 1 1 8 6065 2 2 26 TYR CE2 C -5.454 -4.451 -4.425 1.00 . B B . 47 TYR CE2 1 1 8 6066 2 2 26 TYR CG C -6.456 -4.342 -2.189 1.00 . B B . 47 TYR CG 1 1 8 6067 2 2 26 TYR CZ C -6.543 -3.767 -4.960 1.00 . B B . 47 TYR CZ 1 1 8 6068 2 2 26 TYR H H -6.562 -6.682 -2.258 1.00 . B B . 47 TYR H 1 1 8 6069 2 2 26 TYR HA H -7.011 -6.295 0.588 1.00 . B B . 47 TYR HA 1 1 8 6070 2 2 26 TYR HB2 H -6.801 -3.817 -0.068 1.00 . B B . 47 TYR HB2 1 1 8 6071 2 2 26 TYR HB3 H -5.379 -4.868 -0.339 1.00 . B B . 47 TYR HB3 1 1 8 6072 2 2 26 TYR HD1 H -8.386 -3.335 -2.161 1.00 . B B . 47 TYR HD1 1 1 8 6073 2 2 26 TYR HD2 H -4.554 -5.274 -2.684 1.00 . B B . 47 TYR HD2 1 1 8 6074 2 2 26 TYR HE1 H -8.433 -2.838 -4.552 1.00 . B B . 47 TYR HE1 1 1 8 6075 2 2 26 TYR HE2 H -4.645 -4.761 -5.071 1.00 . B B . 47 TYR HE2 1 1 8 6076 2 2 26 TYR HH H -7.247 -4.053 -6.711 1.00 . B B . 47 TYR HH 1 1 8 6077 2 2 26 TYR N N -7.013 -6.928 -1.425 1.00 . B B . 47 TYR N 1 1 8 6078 2 2 26 TYR O O -9.168 -4.627 0.354 1.00 . B B . 47 TYR O 1 1 8 6079 2 2 26 TYR OH O -6.586 -3.485 -6.310 1.00 . B B . 47 TYR OH 1 1 8 6080 2 2 27 THR C C -11.589 -5.911 0.166 1.00 . B B . 48 THR C 1 1 8 6081 2 2 27 THR CA C -11.000 -5.784 -1.240 1.00 . B B . 48 THR CA 1 1 8 6082 2 2 27 THR CB C -11.728 -6.740 -2.190 1.00 . B B . 48 THR CB 1 1 8 6083 2 2 27 THR CG2 C -13.239 -6.639 -1.966 1.00 . B B . 48 THR CG2 1 1 8 6084 2 2 27 THR H H -9.198 -6.828 -1.788 1.00 . B B . 48 THR H 1 1 8 6085 2 2 27 THR HA H -11.118 -4.770 -1.587 1.00 . B B . 48 THR HA 1 1 8 6086 2 2 27 THR HB H -11.407 -7.752 -1.998 1.00 . B B . 48 THR HB 1 1 8 6087 2 2 27 THR HG1 H -11.442 -7.195 -4.059 1.00 . B B . 48 THR HG1 1 1 8 6088 2 2 27 THR HG21 H -13.757 -7.051 -2.819 1.00 . B B . 48 THR HG21 1 1 8 6089 2 2 27 THR HG22 H -13.516 -5.602 -1.842 1.00 . B B . 48 THR HG22 1 1 8 6090 2 2 27 THR HG23 H -13.508 -7.192 -1.079 1.00 . B B . 48 THR HG23 1 1 8 6091 2 2 27 THR N N -9.550 -6.128 -1.201 1.00 . B B . 48 THR N 1 1 8 6092 2 2 27 THR O O -12.622 -5.348 0.471 1.00 . B B . 48 THR O 1 1 8 6093 2 2 27 THR OG1 O -11.422 -6.392 -3.533 1.00 . B B . 48 THR OG1 1 1 8 6094 2 2 28 LYS C C -12.880 -7.377 2.365 1.00 . B B . 49 LYS C 1 1 8 6095 2 2 28 LYS CA C -11.456 -6.812 2.409 1.00 . B B . 49 LYS CA 1 1 8 6096 2 2 28 LYS CB C -11.469 -5.453 3.113 1.00 . B B . 49 LYS CB 1 1 8 6097 2 2 28 LYS CD C -11.574 -4.303 5.327 1.00 . B B . 49 LYS CD 1 1 8 6098 2 2 28 LYS CE C -12.970 -4.102 5.923 1.00 . B B . 49 LYS CE 1 1 8 6099 2 2 28 LYS CG C -11.505 -5.662 4.627 1.00 . B B . 49 LYS CG 1 1 8 6100 2 2 28 LYS H H -10.109 -7.088 0.750 1.00 . B B . 49 LYS H 1 1 8 6101 2 2 28 LYS HA H -10.816 -7.491 2.952 1.00 . B B . 49 LYS HA 1 1 8 6102 2 2 28 LYS HB2 H -10.580 -4.901 2.845 1.00 . B B . 49 LYS HB2 1 1 8 6103 2 2 28 LYS HB3 H -12.343 -4.898 2.807 1.00 . B B . 49 LYS HB3 1 1 8 6104 2 2 28 LYS HD2 H -10.837 -4.267 6.116 1.00 . B B . 49 LYS HD2 1 1 8 6105 2 2 28 LYS HD3 H -11.375 -3.519 4.611 1.00 . B B . 49 LYS HD3 1 1 8 6106 2 2 28 LYS HE2 H -13.707 -4.553 5.275 1.00 . B B . 49 LYS HE2 1 1 8 6107 2 2 28 LYS HE3 H -13.015 -4.564 6.898 1.00 . B B . 49 LYS HE3 1 1 8 6108 2 2 28 LYS HG2 H -12.373 -6.249 4.890 1.00 . B B . 49 LYS HG2 1 1 8 6109 2 2 28 LYS HG3 H -10.611 -6.180 4.940 1.00 . B B . 49 LYS HG3 1 1 8 6110 2 2 28 LYS HZ1 H -12.353 -2.129 6.181 1.00 . B B . 49 LYS HZ1 1 1 8 6111 2 2 28 LYS HZ2 H -13.866 -2.478 6.871 1.00 . B B . 49 LYS HZ2 1 1 8 6112 2 2 28 LYS HZ3 H -13.718 -2.302 5.188 1.00 . B B . 49 LYS HZ3 1 1 8 6113 2 2 28 LYS N N -10.939 -6.646 1.021 1.00 . B B . 49 LYS N 1 1 8 6114 2 2 28 LYS NZ N -13.248 -2.643 6.051 1.00 . B B . 49 LYS NZ 1 1 8 6115 2 2 28 LYS O O -13.837 -6.634 2.275 1.00 . B B . 49 LYS O 1 1 8 6116 2 2 29 PRO C C -14.958 -9.287 3.773 1.00 . B B . 50 PRO C 1 1 8 6117 2 2 29 PRO CA C -14.265 -9.385 2.410 1.00 . B B . 50 PRO CA 1 1 8 6118 2 2 29 PRO CB C -13.882 -10.833 2.094 1.00 . B B . 50 PRO CB 1 1 8 6119 2 2 29 PRO CD C -11.805 -9.570 2.543 1.00 . B B . 50 PRO CD 1 1 8 6120 2 2 29 PRO CG C -12.401 -10.989 2.510 1.00 . B B . 50 PRO CG 1 1 8 6121 2 2 29 PRO HA H -14.891 -8.992 1.631 1.00 . B B . 50 PRO HA 1 1 8 6122 2 2 29 PRO HB2 H -14.506 -11.512 2.660 1.00 . B B . 50 PRO HB2 1 1 8 6123 2 2 29 PRO HB3 H -13.986 -11.024 1.037 1.00 . B B . 50 PRO HB3 1 1 8 6124 2 2 29 PRO HD2 H -11.285 -9.400 3.474 1.00 . B B . 50 PRO HD2 1 1 8 6125 2 2 29 PRO HD3 H -11.147 -9.418 1.704 1.00 . B B . 50 PRO HD3 1 1 8 6126 2 2 29 PRO HG2 H -12.338 -11.445 3.490 1.00 . B B . 50 PRO HG2 1 1 8 6127 2 2 29 PRO HG3 H -11.874 -11.589 1.786 1.00 . B B . 50 PRO HG3 1 1 8 6128 2 2 29 PRO N N -12.975 -8.681 2.435 1.00 . B B . 50 PRO N 1 1 8 6129 2 2 29 PRO O O -14.330 -9.047 4.784 1.00 . B B . 50 PRO O 1 1 8 6130 2 2 30 THR C C -16.469 -10.473 6.049 1.00 . B B . 51 THR C 1 1 8 6131 2 2 30 THR CA C -16.982 -9.387 5.100 1.00 . B B . 51 THR CA 1 1 8 6132 2 2 30 THR CB C -18.479 -9.590 4.854 1.00 . B B . 51 THR CB 1 1 8 6133 2 2 30 THR CG2 C -19.238 -9.452 6.174 1.00 . B B . 51 THR CG2 1 1 8 6134 2 2 30 THR H H -16.738 -9.662 2.978 1.00 . B B . 51 THR H 1 1 8 6135 2 2 30 THR HA H -16.819 -8.416 5.543 1.00 . B B . 51 THR HA 1 1 8 6136 2 2 30 THR HB H -18.647 -10.576 4.449 1.00 . B B . 51 THR HB 1 1 8 6137 2 2 30 THR HG1 H -19.097 -9.053 3.090 1.00 . B B . 51 THR HG1 1 1 8 6138 2 2 30 THR HG21 H -18.736 -8.732 6.804 1.00 . B B . 51 THR HG21 1 1 8 6139 2 2 30 THR HG22 H -19.266 -10.409 6.674 1.00 . B B . 51 THR HG22 1 1 8 6140 2 2 30 THR HG23 H -20.246 -9.119 5.978 1.00 . B B . 51 THR HG23 1 1 8 6141 2 2 30 THR N N -16.250 -9.470 3.805 1.00 . B B . 51 THR N 1 1 8 6142 2 2 30 THR O O -16.316 -10.180 7.223 1.00 . B B . 51 THR O 1 1 8 6143 2 2 30 THR OXT O -16.241 -11.578 5.585 1.00 . B B . 51 THR OXT 1 1 8 6144 2 2 30 THR OG1 O -18.943 -8.615 3.931 1.00 . B B . 51 THR OG1 1 1 9 6145 1 1 1 GLY C C -5.901 7.761 4.393 1.00 . A A . 1 GLY C 1 1 9 6146 1 1 1 GLY CA C -7.334 8.111 4.605 1.00 . A A . 1 GLY CA 1 1 9 6147 1 1 1 GLY H1 H -8.320 9.878 5.223 1.00 . A A . 1 GLY H1 1 1 9 6148 1 1 1 GLY H2 H -6.835 9.617 6.004 1.00 . A A . 1 GLY H2 1 1 9 6149 1 1 1 GLY H3 H -8.199 8.704 6.442 1.00 . A A . 1 GLY H3 1 1 9 6150 1 1 1 GLY HA2 H -7.392 7.209 4.970 1.00 . A A . 1 GLY HA2 1 1 9 6151 1 1 1 GLY HA3 H -8.043 8.279 3.692 1.00 . A A . 1 GLY HA3 1 1 9 6152 1 1 1 GLY N N -7.702 9.162 5.652 1.00 . A A . 1 GLY N 1 1 9 6153 1 1 1 GLY O O -5.011 8.466 4.823 1.00 . A A . 1 GLY O 1 1 9 6154 1 1 2 ILE C C -3.670 7.067 2.303 1.00 . A A . 2 ILE C 1 1 9 6155 1 1 2 ILE CA C -4.227 6.268 3.482 1.00 . A A . 2 ILE CA 1 1 9 6156 1 1 2 ILE CB C -4.171 4.775 3.157 1.00 . A A . 2 ILE CB 1 1 9 6157 1 1 2 ILE CD1 C -4.147 2.491 4.171 1.00 . A A . 2 ILE CD1 1 1 9 6158 1 1 2 ILE CG1 C -4.473 3.966 4.419 1.00 . A A . 2 ILE CG1 1 1 9 6159 1 1 2 ILE CG2 C -2.776 4.415 2.644 1.00 . A A . 2 ILE CG2 1 1 9 6160 1 1 2 ILE H H -6.373 6.115 3.388 1.00 . A A . 2 ILE H 1 1 9 6161 1 1 2 ILE HA H -3.637 6.467 4.364 1.00 . A A . 2 ILE HA 1 1 9 6162 1 1 2 ILE HB H -4.903 4.545 2.396 1.00 . A A . 2 ILE HB 1 1 9 6163 1 1 2 ILE HD11 H -4.371 2.240 3.144 1.00 . A A . 2 ILE HD11 1 1 9 6164 1 1 2 ILE HD12 H -4.739 1.874 4.830 1.00 . A A . 2 ILE HD12 1 1 9 6165 1 1 2 ILE HD13 H -3.098 2.318 4.362 1.00 . A A . 2 ILE HD13 1 1 9 6166 1 1 2 ILE HG12 H -3.871 4.337 5.236 1.00 . A A . 2 ILE HG12 1 1 9 6167 1 1 2 ILE HG13 H -5.519 4.064 4.668 1.00 . A A . 2 ILE HG13 1 1 9 6168 1 1 2 ILE HG21 H -2.501 5.090 1.848 1.00 . A A . 2 ILE HG21 1 1 9 6169 1 1 2 ILE HG22 H -2.780 3.401 2.272 1.00 . A A . 2 ILE HG22 1 1 9 6170 1 1 2 ILE HG23 H -2.064 4.501 3.451 1.00 . A A . 2 ILE HG23 1 1 9 6171 1 1 2 ILE N N -5.640 6.670 3.728 1.00 . A A . 2 ILE N 1 1 9 6172 1 1 2 ILE O O -2.475 7.235 2.162 1.00 . A A . 2 ILE O 1 1 9 6173 1 1 3 VAL C C -3.299 9.581 0.757 1.00 . A A . 3 VAL C 1 1 9 6174 1 1 3 VAL CA C -4.055 8.342 0.276 1.00 . A A . 3 VAL CA 1 1 9 6175 1 1 3 VAL CB C -5.259 8.771 -0.569 1.00 . A A . 3 VAL CB 1 1 9 6176 1 1 3 VAL CG1 C -6.212 7.587 -0.737 1.00 . A A . 3 VAL CG1 1 1 9 6177 1 1 3 VAL CG2 C -5.996 9.918 0.130 1.00 . A A . 3 VAL CG2 1 1 9 6178 1 1 3 VAL H H -5.487 7.406 1.585 1.00 . A A . 3 VAL H 1 1 9 6179 1 1 3 VAL HA H -3.397 7.732 -0.318 1.00 . A A . 3 VAL HA 1 1 9 6180 1 1 3 VAL HB H -4.918 9.098 -1.540 1.00 . A A . 3 VAL HB 1 1 9 6181 1 1 3 VAL HG11 H -6.971 7.623 0.031 1.00 . A A . 3 VAL HG11 1 1 9 6182 1 1 3 VAL HG12 H -5.658 6.663 -0.653 1.00 . A A . 3 VAL HG12 1 1 9 6183 1 1 3 VAL HG13 H -6.681 7.638 -1.709 1.00 . A A . 3 VAL HG13 1 1 9 6184 1 1 3 VAL HG21 H -6.955 10.071 -0.344 1.00 . A A . 3 VAL HG21 1 1 9 6185 1 1 3 VAL HG22 H -5.410 10.822 0.054 1.00 . A A . 3 VAL HG22 1 1 9 6186 1 1 3 VAL HG23 H -6.144 9.671 1.171 1.00 . A A . 3 VAL HG23 1 1 9 6187 1 1 3 VAL N N -4.529 7.557 1.452 1.00 . A A . 3 VAL N 1 1 9 6188 1 1 3 VAL O O -2.429 10.094 0.082 1.00 . A A . 3 VAL O 1 1 9 6189 1 1 4 GLU C C -1.631 10.855 3.127 1.00 . A A . 4 GLU C 1 1 9 6190 1 1 4 GLU CA C -2.942 11.271 2.453 1.00 . A A . 4 GLU CA 1 1 9 6191 1 1 4 GLU CB C -3.846 11.959 3.481 1.00 . A A . 4 GLU CB 1 1 9 6192 1 1 4 GLU CD C -6.198 12.672 3.944 1.00 . A A . 4 GLU CD 1 1 9 6193 1 1 4 GLU CG C -5.315 11.751 3.099 1.00 . A A . 4 GLU CG 1 1 9 6194 1 1 4 GLU H H -4.336 9.630 2.439 1.00 . A A . 4 GLU H 1 1 9 6195 1 1 4 GLU HA H -2.731 11.954 1.643 1.00 . A A . 4 GLU HA 1 1 9 6196 1 1 4 GLU HB2 H -3.666 11.536 4.458 1.00 . A A . 4 GLU HB2 1 1 9 6197 1 1 4 GLU HB3 H -3.629 13.017 3.500 1.00 . A A . 4 GLU HB3 1 1 9 6198 1 1 4 GLU HG2 H -5.451 11.981 2.052 1.00 . A A . 4 GLU HG2 1 1 9 6199 1 1 4 GLU HG3 H -5.593 10.723 3.281 1.00 . A A . 4 GLU HG3 1 1 9 6200 1 1 4 GLU N N -3.630 10.063 1.918 1.00 . A A . 4 GLU N 1 1 9 6201 1 1 4 GLU O O -0.944 11.664 3.719 1.00 . A A . 4 GLU O 1 1 9 6202 1 1 4 GLU OE1 O -5.796 13.801 4.169 1.00 . A A . 4 GLU OE1 1 1 9 6203 1 1 4 GLU OE2 O -7.260 12.232 4.351 1.00 . A A . 4 GLU OE2 1 1 9 6204 1 1 5 GLN C C 1.057 8.873 2.644 1.00 . A A . 5 GLN C 1 1 9 6205 1 1 5 GLN CA C -0.021 9.138 3.699 1.00 . A A . 5 GLN CA 1 1 9 6206 1 1 5 GLN CB C -0.291 7.849 4.477 1.00 . A A . 5 GLN CB 1 1 9 6207 1 1 5 GLN CD C 0.394 7.741 6.876 1.00 . A A . 5 GLN CD 1 1 9 6208 1 1 5 GLN CG C 0.872 7.577 5.433 1.00 . A A . 5 GLN CG 1 1 9 6209 1 1 5 GLN H H -1.851 8.959 2.576 1.00 . A A . 5 GLN H 1 1 9 6210 1 1 5 GLN HA H 0.328 9.899 4.382 1.00 . A A . 5 GLN HA 1 1 9 6211 1 1 5 GLN HB2 H -1.206 7.954 5.042 1.00 . A A . 5 GLN HB2 1 1 9 6212 1 1 5 GLN HB3 H -0.386 7.025 3.786 1.00 . A A . 5 GLN HB3 1 1 9 6213 1 1 5 GLN HE21 H -0.605 9.415 6.502 1.00 . A A . 5 GLN HE21 1 1 9 6214 1 1 5 GLN HE22 H -0.667 8.877 8.111 1.00 . A A . 5 GLN HE22 1 1 9 6215 1 1 5 GLN HG2 H 1.234 6.570 5.284 1.00 . A A . 5 GLN HG2 1 1 9 6216 1 1 5 GLN HG3 H 1.670 8.278 5.238 1.00 . A A . 5 GLN HG3 1 1 9 6217 1 1 5 GLN N N -1.282 9.599 3.051 1.00 . A A . 5 GLN N 1 1 9 6218 1 1 5 GLN NE2 N -0.355 8.762 7.189 1.00 . A A . 5 GLN NE2 1 1 9 6219 1 1 5 GLN O O 2.182 9.314 2.772 1.00 . A A . 5 GLN O 1 1 9 6220 1 1 5 GLN OE1 O 0.706 6.932 7.728 1.00 . A A . 5 GLN OE1 1 1 9 6221 1 1 6 CYS C C 1.520 8.655 -0.689 1.00 . A A . 6 CYS C 1 1 9 6222 1 1 6 CYS CA C 1.763 7.828 0.576 1.00 . A A . 6 CYS CA 1 1 9 6223 1 1 6 CYS CB C 1.698 6.340 0.235 1.00 . A A . 6 CYS CB 1 1 9 6224 1 1 6 CYS H H -0.169 7.772 1.533 1.00 . A A . 6 CYS H 1 1 9 6225 1 1 6 CYS HA H 2.743 8.058 0.967 1.00 . A A . 6 CYS HA 1 1 9 6226 1 1 6 CYS HB2 H 0.736 6.111 -0.200 1.00 . A A . 6 CYS HB2 1 1 9 6227 1 1 6 CYS HB3 H 2.479 6.097 -0.471 1.00 . A A . 6 CYS HB3 1 1 9 6228 1 1 6 CYS N N 0.737 8.136 1.614 1.00 . A A . 6 CYS N 1 1 9 6229 1 1 6 CYS O O 2.449 9.044 -1.367 1.00 . A A . 6 CYS O 1 1 9 6230 1 1 6 CYS SG S 1.927 5.371 1.746 1.00 . A A . 6 CYS SG 1 1 9 6231 1 1 7 CYS C C 0.658 11.114 -2.111 1.00 . A A . 7 CYS C 1 1 9 6232 1 1 7 CYS CA C 0.025 9.727 -2.255 1.00 . A A . 7 CYS CA 1 1 9 6233 1 1 7 CYS CB C -1.479 9.876 -2.466 1.00 . A A . 7 CYS CB 1 1 9 6234 1 1 7 CYS H H -0.454 8.606 -0.473 1.00 . A A . 7 CYS H 1 1 9 6235 1 1 7 CYS HA H 0.460 9.220 -3.110 1.00 . A A . 7 CYS HA 1 1 9 6236 1 1 7 CYS HB2 H -1.980 8.971 -2.155 1.00 . A A . 7 CYS HB2 1 1 9 6237 1 1 7 CYS HB3 H -1.845 10.709 -1.884 1.00 . A A . 7 CYS HB3 1 1 9 6238 1 1 7 CYS N N 0.290 8.927 -1.024 1.00 . A A . 7 CYS N 1 1 9 6239 1 1 7 CYS O O 0.763 11.857 -3.066 1.00 . A A . 7 CYS O 1 1 9 6240 1 1 7 CYS SG S -1.806 10.176 -4.221 1.00 . A A . 7 CYS SG 1 1 9 6241 1 1 8 THR C C 3.238 12.619 -0.742 1.00 . A A . 8 THR C 1 1 9 6242 1 1 8 THR CA C 1.720 12.802 -0.737 1.00 . A A . 8 THR CA 1 1 9 6243 1 1 8 THR CB C 1.276 13.397 0.602 1.00 . A A . 8 THR CB 1 1 9 6244 1 1 8 THR CG2 C 1.568 12.400 1.724 1.00 . A A . 8 THR CG2 1 1 9 6245 1 1 8 THR H H 0.993 10.857 -0.170 1.00 . A A . 8 THR H 1 1 9 6246 1 1 8 THR HA H 1.432 13.462 -1.542 1.00 . A A . 8 THR HA 1 1 9 6247 1 1 8 THR HB H 0.218 13.600 0.572 1.00 . A A . 8 THR HB 1 1 9 6248 1 1 8 THR HG1 H 1.780 15.216 0.129 1.00 . A A . 8 THR HG1 1 1 9 6249 1 1 8 THR HG21 H 2.581 12.039 1.630 1.00 . A A . 8 THR HG21 1 1 9 6250 1 1 8 THR HG22 H 0.881 11.569 1.654 1.00 . A A . 8 THR HG22 1 1 9 6251 1 1 8 THR HG23 H 1.446 12.888 2.680 1.00 . A A . 8 THR HG23 1 1 9 6252 1 1 8 THR N N 1.084 11.469 -0.929 1.00 . A A . 8 THR N 1 1 9 6253 1 1 8 THR O O 3.980 13.469 -1.192 1.00 . A A . 8 THR O 1 1 9 6254 1 1 8 THR OG1 O 1.986 14.604 0.841 1.00 . A A . 8 THR OG1 1 1 9 6255 1 1 9 SER C C 5.434 9.958 -1.038 1.00 . A A . 9 SER C 1 1 9 6256 1 1 9 SER CA C 5.162 11.230 -0.234 1.00 . A A . 9 SER CA 1 1 9 6257 1 1 9 SER CB C 5.626 11.031 1.210 1.00 . A A . 9 SER CB 1 1 9 6258 1 1 9 SER H H 3.075 10.828 0.094 1.00 . A A . 9 SER H 1 1 9 6259 1 1 9 SER HA H 5.692 12.061 -0.676 1.00 . A A . 9 SER HA 1 1 9 6260 1 1 9 SER HB2 H 5.149 11.756 1.847 1.00 . A A . 9 SER HB2 1 1 9 6261 1 1 9 SER HB3 H 5.358 10.035 1.538 1.00 . A A . 9 SER HB3 1 1 9 6262 1 1 9 SER HG H 7.357 10.711 2.040 1.00 . A A . 9 SER HG 1 1 9 6263 1 1 9 SER N N 3.699 11.500 -0.253 1.00 . A A . 9 SER N 1 1 9 6264 1 1 9 SER O O 4.651 9.571 -1.881 1.00 . A A . 9 SER O 1 1 9 6265 1 1 9 SER OG O 7.036 11.203 1.280 1.00 . A A . 9 SER OG 1 1 9 6266 1 1 10 ILE C C 6.679 6.838 -0.618 1.00 . A A . 10 ILE C 1 1 9 6267 1 1 10 ILE CA C 6.815 8.049 -1.547 1.00 . A A . 10 ILE CA 1 1 9 6268 1 1 10 ILE CB C 8.229 8.111 -2.120 1.00 . A A . 10 ILE CB 1 1 9 6269 1 1 10 ILE CD1 C 7.379 9.673 -3.879 1.00 . A A . 10 ILE CD1 1 1 9 6270 1 1 10 ILE CG1 C 8.443 9.468 -2.797 1.00 . A A . 10 ILE CG1 1 1 9 6271 1 1 10 ILE CG2 C 8.400 6.999 -3.152 1.00 . A A . 10 ILE CG2 1 1 9 6272 1 1 10 ILE H H 7.150 9.612 -0.101 1.00 . A A . 10 ILE H 1 1 9 6273 1 1 10 ILE HA H 6.106 7.955 -2.357 1.00 . A A . 10 ILE HA 1 1 9 6274 1 1 10 ILE HB H 8.950 7.982 -1.325 1.00 . A A . 10 ILE HB 1 1 9 6275 1 1 10 ILE HD11 H 7.412 10.694 -4.229 1.00 . A A . 10 ILE HD11 1 1 9 6276 1 1 10 ILE HD12 H 6.402 9.466 -3.467 1.00 . A A . 10 ILE HD12 1 1 9 6277 1 1 10 ILE HD13 H 7.570 9.003 -4.705 1.00 . A A . 10 ILE HD13 1 1 9 6278 1 1 10 ILE HG12 H 8.366 10.254 -2.060 1.00 . A A . 10 ILE HG12 1 1 9 6279 1 1 10 ILE HG13 H 9.423 9.494 -3.250 1.00 . A A . 10 ILE HG13 1 1 9 6280 1 1 10 ILE HG21 H 7.462 6.475 -3.273 1.00 . A A . 10 ILE HG21 1 1 9 6281 1 1 10 ILE HG22 H 9.158 6.308 -2.816 1.00 . A A . 10 ILE HG22 1 1 9 6282 1 1 10 ILE HG23 H 8.696 7.428 -4.098 1.00 . A A . 10 ILE HG23 1 1 9 6283 1 1 10 ILE N N 6.526 9.295 -0.787 1.00 . A A . 10 ILE N 1 1 9 6284 1 1 10 ILE O O 6.775 5.703 -1.041 1.00 . A A . 10 ILE O 1 1 9 6285 1 1 11 CYS C C 7.381 4.896 1.374 1.00 . A A . 11 CYS C 1 1 9 6286 1 1 11 CYS CA C 6.284 5.938 1.601 1.00 . A A . 11 CYS CA 1 1 9 6287 1 1 11 CYS CB C 4.922 5.276 1.380 1.00 . A A . 11 CYS CB 1 1 9 6288 1 1 11 CYS H H 6.360 7.993 0.965 1.00 . A A . 11 CYS H 1 1 9 6289 1 1 11 CYS HA H 6.343 6.308 2.613 1.00 . A A . 11 CYS HA 1 1 9 6290 1 1 11 CYS HB2 H 4.616 5.417 0.355 1.00 . A A . 11 CYS HB2 1 1 9 6291 1 1 11 CYS HB3 H 5.001 4.219 1.589 1.00 . A A . 11 CYS HB3 1 1 9 6292 1 1 11 CYS N N 6.443 7.071 0.645 1.00 . A A . 11 CYS N 1 1 9 6293 1 1 11 CYS O O 8.327 5.115 0.642 1.00 . A A . 11 CYS O 1 1 9 6294 1 1 11 CYS SG S 3.694 6.017 2.483 1.00 . A A . 11 CYS SG 1 1 9 6295 1 1 12 SER C C 7.567 1.327 2.013 1.00 . A A . 12 SER C 1 1 9 6296 1 1 12 SER CA C 8.260 2.680 1.835 1.00 . A A . 12 SER CA 1 1 9 6297 1 1 12 SER CB C 9.351 2.839 2.894 1.00 . A A . 12 SER CB 1 1 9 6298 1 1 12 SER H H 6.471 3.611 2.577 1.00 . A A . 12 SER H 1 1 9 6299 1 1 12 SER HA H 8.697 2.738 0.848 1.00 . A A . 12 SER HA 1 1 9 6300 1 1 12 SER HB2 H 10.228 2.292 2.594 1.00 . A A . 12 SER HB2 1 1 9 6301 1 1 12 SER HB3 H 9.601 3.887 2.998 1.00 . A A . 12 SER HB3 1 1 9 6302 1 1 12 SER HG H 9.629 1.934 4.595 1.00 . A A . 12 SER HG 1 1 9 6303 1 1 12 SER N N 7.247 3.759 1.998 1.00 . A A . 12 SER N 1 1 9 6304 1 1 12 SER O O 6.596 1.209 2.734 1.00 . A A . 12 SER O 1 1 9 6305 1 1 12 SER OG O 8.882 2.326 4.134 1.00 . A A . 12 SER OG 1 1 9 6306 1 1 13 LEU C C 7.166 -1.338 2.977 1.00 . A A . 13 LEU C 1 1 9 6307 1 1 13 LEU CA C 7.403 -1.030 1.497 1.00 . A A . 13 LEU CA 1 1 9 6308 1 1 13 LEU CB C 8.307 -2.104 0.888 1.00 . A A . 13 LEU CB 1 1 9 6309 1 1 13 LEU CD1 C 7.554 -2.716 -1.416 1.00 . A A . 13 LEU CD1 1 1 9 6310 1 1 13 LEU CD2 C 7.977 -4.503 0.278 1.00 . A A . 13 LEU CD2 1 1 9 6311 1 1 13 LEU CG C 7.459 -3.079 0.068 1.00 . A A . 13 LEU CG 1 1 9 6312 1 1 13 LEU H H 8.830 0.418 0.779 1.00 . A A . 13 LEU H 1 1 9 6313 1 1 13 LEU HA H 6.456 -1.022 0.979 1.00 . A A . 13 LEU HA 1 1 9 6314 1 1 13 LEU HB2 H 9.040 -1.636 0.247 1.00 . A A . 13 LEU HB2 1 1 9 6315 1 1 13 LEU HB3 H 8.810 -2.643 1.677 1.00 . A A . 13 LEU HB3 1 1 9 6316 1 1 13 LEU HD11 H 7.309 -1.672 -1.548 1.00 . A A . 13 LEU HD11 1 1 9 6317 1 1 13 LEU HD12 H 6.862 -3.322 -1.980 1.00 . A A . 13 LEU HD12 1 1 9 6318 1 1 13 LEU HD13 H 8.560 -2.897 -1.767 1.00 . A A . 13 LEU HD13 1 1 9 6319 1 1 13 LEU HD21 H 7.152 -5.152 0.531 1.00 . A A . 13 LEU HD21 1 1 9 6320 1 1 13 LEU HD22 H 8.700 -4.508 1.080 1.00 . A A . 13 LEU HD22 1 1 9 6321 1 1 13 LEU HD23 H 8.444 -4.853 -0.630 1.00 . A A . 13 LEU HD23 1 1 9 6322 1 1 13 LEU HG H 6.427 -3.017 0.388 1.00 . A A . 13 LEU HG 1 1 9 6323 1 1 13 LEU N N 8.049 0.306 1.361 1.00 . A A . 13 LEU N 1 1 9 6324 1 1 13 LEU O O 6.284 -2.097 3.327 1.00 . A A . 13 LEU O 1 1 9 6325 1 1 14 TYR C C 6.349 -0.551 5.714 1.00 . A A . 14 TYR C 1 1 9 6326 1 1 14 TYR CA C 7.744 -1.018 5.303 1.00 . A A . 14 TYR CA 1 1 9 6327 1 1 14 TYR CB C 8.793 -0.254 6.114 1.00 . A A . 14 TYR CB 1 1 9 6328 1 1 14 TYR CD1 C 8.455 -1.934 8.041 1.00 . A A . 14 TYR CD1 1 1 9 6329 1 1 14 TYR CD2 C 8.563 0.437 8.588 1.00 . A A . 14 TYR CD2 1 1 9 6330 1 1 14 TYR CE1 C 8.279 -2.230 9.399 1.00 . A A . 14 TYR CE1 1 1 9 6331 1 1 14 TYR CE2 C 8.385 0.123 9.942 1.00 . A A . 14 TYR CE2 1 1 9 6332 1 1 14 TYR CG C 8.603 -0.588 7.613 1.00 . A A . 14 TYR CG 1 1 9 6333 1 1 14 TYR CZ C 8.245 -1.206 10.345 1.00 . A A . 14 TYR CZ 1 1 9 6334 1 1 14 TYR H H 8.644 -0.142 3.552 1.00 . A A . 14 TYR H 1 1 9 6335 1 1 14 TYR HA H 7.840 -2.077 5.493 1.00 . A A . 14 TYR HA 1 1 9 6336 1 1 14 TYR HB2 H 9.787 -0.545 5.771 1.00 . A A . 14 TYR HB2 1 1 9 6337 1 1 14 TYR HB3 H 8.667 0.812 5.944 1.00 . A A . 14 TYR HB3 1 1 9 6338 1 1 14 TYR HD1 H 8.473 -2.742 7.335 1.00 . A A . 14 TYR HD1 1 1 9 6339 1 1 14 TYR HD2 H 8.662 1.462 8.305 1.00 . A A . 14 TYR HD2 1 1 9 6340 1 1 14 TYR HE1 H 8.167 -3.257 9.715 1.00 . A A . 14 TYR HE1 1 1 9 6341 1 1 14 TYR HE2 H 8.358 0.912 10.677 1.00 . A A . 14 TYR HE2 1 1 9 6342 1 1 14 TYR HH H 7.487 -2.266 11.739 1.00 . A A . 14 TYR HH 1 1 9 6343 1 1 14 TYR N N 7.940 -0.754 3.850 1.00 . A A . 14 TYR N 1 1 9 6344 1 1 14 TYR O O 5.566 -1.303 6.259 1.00 . A A . 14 TYR O 1 1 9 6345 1 1 14 TYR OH O 8.070 -1.506 11.680 1.00 . A A . 14 TYR OH 1 1 9 6346 1 1 15 GLN C C 3.617 0.440 5.050 1.00 . A A . 15 GLN C 1 1 9 6347 1 1 15 GLN CA C 4.686 1.202 5.831 1.00 . A A . 15 GLN CA 1 1 9 6348 1 1 15 GLN CB C 4.597 2.696 5.507 1.00 . A A . 15 GLN CB 1 1 9 6349 1 1 15 GLN CD C 5.494 4.171 7.314 1.00 . A A . 15 GLN CD 1 1 9 6350 1 1 15 GLN CG C 5.844 3.409 6.034 1.00 . A A . 15 GLN CG 1 1 9 6351 1 1 15 GLN H H 6.677 1.278 5.012 1.00 . A A . 15 GLN H 1 1 9 6352 1 1 15 GLN HA H 4.528 1.052 6.888 1.00 . A A . 15 GLN HA 1 1 9 6353 1 1 15 GLN HB2 H 4.530 2.830 4.437 1.00 . A A . 15 GLN HB2 1 1 9 6354 1 1 15 GLN HB3 H 3.720 3.115 5.978 1.00 . A A . 15 GLN HB3 1 1 9 6355 1 1 15 GLN HE21 H 4.423 2.683 8.077 1.00 . A A . 15 GLN HE21 1 1 9 6356 1 1 15 GLN HE22 H 4.522 4.076 9.043 1.00 . A A . 15 GLN HE22 1 1 9 6357 1 1 15 GLN HG2 H 6.612 2.680 6.247 1.00 . A A . 15 GLN HG2 1 1 9 6358 1 1 15 GLN HG3 H 6.203 4.104 5.291 1.00 . A A . 15 GLN HG3 1 1 9 6359 1 1 15 GLN N N 6.031 0.688 5.455 1.00 . A A . 15 GLN N 1 1 9 6360 1 1 15 GLN NE2 N 4.751 3.596 8.220 1.00 . A A . 15 GLN NE2 1 1 9 6361 1 1 15 GLN O O 2.635 -0.009 5.607 1.00 . A A . 15 GLN O 1 1 9 6362 1 1 15 GLN OE1 O 5.901 5.302 7.492 1.00 . A A . 15 GLN OE1 1 1 9 6363 1 1 16 LEU C C 2.699 -1.893 3.507 1.00 . A A . 16 LEU C 1 1 9 6364 1 1 16 LEU CA C 2.786 -0.468 2.974 1.00 . A A . 16 LEU CA 1 1 9 6365 1 1 16 LEU CB C 3.195 -0.489 1.500 1.00 . A A . 16 LEU CB 1 1 9 6366 1 1 16 LEU CD1 C 3.783 1.932 1.304 1.00 . A A . 16 LEU CD1 1 1 9 6367 1 1 16 LEU CD2 C 2.880 0.700 -0.672 1.00 . A A . 16 LEU CD2 1 1 9 6368 1 1 16 LEU CG C 2.812 0.841 0.849 1.00 . A A . 16 LEU CG 1 1 9 6369 1 1 16 LEU H H 4.600 0.638 3.332 1.00 . A A . 16 LEU H 1 1 9 6370 1 1 16 LEU HA H 1.823 0.010 3.078 1.00 . A A . 16 LEU HA 1 1 9 6371 1 1 16 LEU HB2 H 4.263 -0.635 1.424 1.00 . A A . 16 LEU HB2 1 1 9 6372 1 1 16 LEU HB3 H 2.683 -1.294 0.996 1.00 . A A . 16 LEU HB3 1 1 9 6373 1 1 16 LEU HD11 H 3.706 2.059 2.375 1.00 . A A . 16 LEU HD11 1 1 9 6374 1 1 16 LEU HD12 H 3.535 2.861 0.813 1.00 . A A . 16 LEU HD12 1 1 9 6375 1 1 16 LEU HD13 H 4.793 1.647 1.047 1.00 . A A . 16 LEU HD13 1 1 9 6376 1 1 16 LEU HD21 H 3.230 -0.289 -0.927 1.00 . A A . 16 LEU HD21 1 1 9 6377 1 1 16 LEU HD22 H 3.561 1.437 -1.072 1.00 . A A . 16 LEU HD22 1 1 9 6378 1 1 16 LEU HD23 H 1.896 0.853 -1.092 1.00 . A A . 16 LEU HD23 1 1 9 6379 1 1 16 LEU HG H 1.808 1.109 1.144 1.00 . A A . 16 LEU HG 1 1 9 6380 1 1 16 LEU N N 3.798 0.278 3.768 1.00 . A A . 16 LEU N 1 1 9 6381 1 1 16 LEU O O 1.639 -2.484 3.558 1.00 . A A . 16 LEU O 1 1 9 6382 1 1 17 GLU C C 2.781 -3.845 5.639 1.00 . A A . 17 GLU C 1 1 9 6383 1 1 17 GLU CA C 3.771 -3.821 4.478 1.00 . A A . 17 GLU CA 1 1 9 6384 1 1 17 GLU CB C 5.164 -4.199 4.979 1.00 . A A . 17 GLU CB 1 1 9 6385 1 1 17 GLU CD C 7.195 -5.569 4.507 1.00 . A A . 17 GLU CD 1 1 9 6386 1 1 17 GLU CG C 5.861 -5.079 3.942 1.00 . A A . 17 GLU CG 1 1 9 6387 1 1 17 GLU H H 4.648 -1.951 3.897 1.00 . A A . 17 GLU H 1 1 9 6388 1 1 17 GLU HA H 3.455 -4.515 3.713 1.00 . A A . 17 GLU HA 1 1 9 6389 1 1 17 GLU HB2 H 5.744 -3.301 5.138 1.00 . A A . 17 GLU HB2 1 1 9 6390 1 1 17 GLU HB3 H 5.078 -4.738 5.907 1.00 . A A . 17 GLU HB3 1 1 9 6391 1 1 17 GLU HG2 H 5.233 -5.927 3.710 1.00 . A A . 17 GLU HG2 1 1 9 6392 1 1 17 GLU HG3 H 6.041 -4.507 3.045 1.00 . A A . 17 GLU HG3 1 1 9 6393 1 1 17 GLU N N 3.803 -2.446 3.927 1.00 . A A . 17 GLU N 1 1 9 6394 1 1 17 GLU O O 2.240 -4.875 5.992 1.00 . A A . 17 GLU O 1 1 9 6395 1 1 17 GLU OE1 O 7.179 -6.526 5.264 1.00 . A A . 17 GLU OE1 1 1 9 6396 1 1 17 GLU OE2 O 8.210 -4.978 4.176 1.00 . A A . 17 GLU OE2 1 1 9 6397 1 1 18 ASN C C 0.148 -2.757 6.822 1.00 . A A . 18 ASN C 1 1 9 6398 1 1 18 ASN CA C 1.575 -2.647 7.362 1.00 . A A . 18 ASN CA 1 1 9 6399 1 1 18 ASN CB C 1.742 -1.317 8.102 1.00 . A A . 18 ASN CB 1 1 9 6400 1 1 18 ASN CG C 0.812 -1.287 9.317 1.00 . A A . 18 ASN CG 1 1 9 6401 1 1 18 ASN H H 2.981 -1.887 5.923 1.00 . A A . 18 ASN H 1 1 9 6402 1 1 18 ASN HA H 1.768 -3.464 8.041 1.00 . A A . 18 ASN HA 1 1 9 6403 1 1 18 ASN HB2 H 2.766 -1.214 8.430 1.00 . A A . 18 ASN HB2 1 1 9 6404 1 1 18 ASN HB3 H 1.492 -0.502 7.440 1.00 . A A . 18 ASN HB3 1 1 9 6405 1 1 18 ASN HD21 H 2.238 -1.802 10.598 1.00 . A A . 18 ASN HD21 1 1 9 6406 1 1 18 ASN HD22 H 0.704 -1.556 11.281 1.00 . A A . 18 ASN HD22 1 1 9 6407 1 1 18 ASN N N 2.535 -2.706 6.229 1.00 . A A . 18 ASN N 1 1 9 6408 1 1 18 ASN ND2 N 1.292 -1.572 10.496 1.00 . A A . 18 ASN ND2 1 1 9 6409 1 1 18 ASN O O -0.754 -3.177 7.519 1.00 . A A . 18 ASN O 1 1 9 6410 1 1 18 ASN OD1 O -0.362 -0.999 9.192 1.00 . A A . 18 ASN OD1 1 1 9 6411 1 1 19 TYR C C -1.782 -3.943 4.738 1.00 . A A . 19 TYR C 1 1 9 6412 1 1 19 TYR CA C -1.456 -2.475 5.035 1.00 . A A . 19 TYR CA 1 1 9 6413 1 1 19 TYR CB C -1.576 -1.670 3.734 1.00 . A A . 19 TYR CB 1 1 9 6414 1 1 19 TYR CD1 C -0.591 0.262 5.210 1.00 . A A . 19 TYR CD1 1 1 9 6415 1 1 19 TYR CD2 C -1.154 0.741 2.889 1.00 . A A . 19 TYR CD2 1 1 9 6416 1 1 19 TYR CE1 C -0.165 1.587 5.363 1.00 . A A . 19 TYR CE1 1 1 9 6417 1 1 19 TYR CE2 C -0.721 2.057 3.065 1.00 . A A . 19 TYR CE2 1 1 9 6418 1 1 19 TYR CG C -1.102 -0.193 3.954 1.00 . A A . 19 TYR CG 1 1 9 6419 1 1 19 TYR CZ C -0.228 2.479 4.295 1.00 . A A . 19 TYR CZ 1 1 9 6420 1 1 19 TYR H H 0.660 -2.040 5.031 1.00 . A A . 19 TYR H 1 1 9 6421 1 1 19 TYR HA H -2.158 -2.092 5.761 1.00 . A A . 19 TYR HA 1 1 9 6422 1 1 19 TYR HB2 H -0.967 -2.166 2.963 1.00 . A A . 19 TYR HB2 1 1 9 6423 1 1 19 TYR HB3 H -2.626 -1.691 3.411 1.00 . A A . 19 TYR HB3 1 1 9 6424 1 1 19 TYR HD1 H -0.531 -0.385 6.062 1.00 . A A . 19 TYR HD1 1 1 9 6425 1 1 19 TYR HD2 H -1.529 0.461 1.940 1.00 . A A . 19 TYR HD2 1 1 9 6426 1 1 19 TYR HE1 H 0.219 1.917 6.314 1.00 . A A . 19 TYR HE1 1 1 9 6427 1 1 19 TYR HE2 H -0.769 2.750 2.237 1.00 . A A . 19 TYR HE2 1 1 9 6428 1 1 19 TYR HH H -0.394 4.211 5.078 1.00 . A A . 19 TYR HH 1 1 9 6429 1 1 19 TYR N N -0.074 -2.382 5.587 1.00 . A A . 19 TYR N 1 1 9 6430 1 1 19 TYR O O -2.882 -4.275 4.343 1.00 . A A . 19 TYR O 1 1 9 6431 1 1 19 TYR OH O 0.198 3.781 4.457 1.00 . A A . 19 TYR OH 1 1 9 6432 1 1 20 CYS C C -1.880 -6.868 5.819 1.00 . A A . 20 CYS C 1 1 9 6433 1 1 20 CYS CA C -1.093 -6.269 4.653 1.00 . A A . 20 CYS CA 1 1 9 6434 1 1 20 CYS CB C 0.238 -7.013 4.509 1.00 . A A . 20 CYS CB 1 1 9 6435 1 1 20 CYS H H 0.044 -4.540 5.244 1.00 . A A . 20 CYS H 1 1 9 6436 1 1 20 CYS HA H -1.664 -6.369 3.742 1.00 . A A . 20 CYS HA 1 1 9 6437 1 1 20 CYS HB2 H 0.773 -6.976 5.446 1.00 . A A . 20 CYS HB2 1 1 9 6438 1 1 20 CYS HB3 H 0.047 -8.043 4.245 1.00 . A A . 20 CYS HB3 1 1 9 6439 1 1 20 CYS N N -0.835 -4.825 4.925 1.00 . A A . 20 CYS N 1 1 9 6440 1 1 20 CYS O O -1.505 -7.878 6.382 1.00 . A A . 20 CYS O 1 1 9 6441 1 1 20 CYS SG S 1.239 -6.236 3.215 1.00 . A A . 20 CYS SG 1 1 9 6442 1 1 21 ASN C C -5.206 -7.054 6.843 1.00 . A A . 21 ASN C 1 1 9 6443 1 1 21 ASN CA C -3.778 -6.779 7.319 1.00 . A A . 21 ASN CA 1 1 9 6444 1 1 21 ASN CB C -3.808 -5.744 8.446 1.00 . A A . 21 ASN CB 1 1 9 6445 1 1 21 ASN CG C -4.252 -6.415 9.746 1.00 . A A . 21 ASN CG 1 1 9 6446 1 1 21 ASN H H -3.250 -5.438 5.721 1.00 . A A . 21 ASN H 1 1 9 6447 1 1 21 ASN HA H -3.337 -7.695 7.683 1.00 . A A . 21 ASN HA 1 1 9 6448 1 1 21 ASN HB2 H -2.820 -5.325 8.575 1.00 . A A . 21 ASN HB2 1 1 9 6449 1 1 21 ASN HB3 H -4.503 -4.958 8.193 1.00 . A A . 21 ASN HB3 1 1 9 6450 1 1 21 ASN HD21 H -6.187 -6.185 9.371 1.00 . A A . 21 ASN HD21 1 1 9 6451 1 1 21 ASN HD22 H -5.820 -6.956 10.837 1.00 . A A . 21 ASN HD22 1 1 9 6452 1 1 21 ASN N N -2.967 -6.251 6.187 1.00 . A A . 21 ASN N 1 1 9 6453 1 1 21 ASN ND2 N -5.525 -6.528 10.006 1.00 . A A . 21 ASN ND2 1 1 9 6454 1 1 21 ASN O O -5.557 -6.574 5.777 1.00 . A A . 21 ASN O 1 1 9 6455 1 1 21 ASN OXT O -5.924 -7.739 7.553 1.00 . A A . 21 ASN OXT 1 1 9 6456 1 1 21 ASN OD1 O -3.431 -6.841 10.534 1.00 . A A . 21 ASN OD1 1 1 9 6457 2 2 1 PHE C C 11.907 -0.808 -4.344 1.00 . B B . 22 PHE C 1 1 9 6458 2 2 1 PHE CA C 13.159 -1.614 -4.651 1.00 . B B . 22 PHE CA 1 1 9 6459 2 2 1 PHE CB C 13.129 -2.923 -3.863 1.00 . B B . 22 PHE CB 1 1 9 6460 2 2 1 PHE CD1 C 13.786 -1.875 -1.666 1.00 . B B . 22 PHE CD1 1 1 9 6461 2 2 1 PHE CD2 C 11.691 -3.092 -1.797 1.00 . B B . 22 PHE CD2 1 1 9 6462 2 2 1 PHE CE1 C 13.539 -1.594 -0.316 1.00 . B B . 22 PHE CE1 1 1 9 6463 2 2 1 PHE CE2 C 11.444 -2.812 -0.447 1.00 . B B . 22 PHE CE2 1 1 9 6464 2 2 1 PHE CG C 12.862 -2.624 -2.407 1.00 . B B . 22 PHE CG 1 1 9 6465 2 2 1 PHE CZ C 12.368 -2.062 0.294 1.00 . B B . 22 PHE CZ 1 1 9 6466 2 2 1 PHE H1 H 14.693 -0.274 -5.085 1.00 . B B . 22 PHE H1 1 1 9 6467 2 2 1 PHE H2 H 15.120 -1.473 -3.960 1.00 . B B . 22 PHE H2 1 1 9 6468 2 2 1 PHE H3 H 14.125 -0.178 -3.490 1.00 . B B . 22 PHE H3 1 1 9 6469 2 2 1 PHE HA H 13.189 -1.824 -5.703 1.00 . B B . 22 PHE HA 1 1 9 6470 2 2 1 PHE HB2 H 12.347 -3.558 -4.250 1.00 . B B . 22 PHE HB2 1 1 9 6471 2 2 1 PHE HB3 H 14.082 -3.422 -3.959 1.00 . B B . 22 PHE HB3 1 1 9 6472 2 2 1 PHE HD1 H 14.689 -1.514 -2.136 1.00 . B B . 22 PHE HD1 1 1 9 6473 2 2 1 PHE HD2 H 10.978 -3.670 -2.368 1.00 . B B . 22 PHE HD2 1 1 9 6474 2 2 1 PHE HE1 H 14.252 -1.016 0.255 1.00 . B B . 22 PHE HE1 1 1 9 6475 2 2 1 PHE HE2 H 10.540 -3.172 0.023 1.00 . B B . 22 PHE HE2 1 1 9 6476 2 2 1 PHE HZ H 12.178 -1.846 1.335 1.00 . B B . 22 PHE HZ 1 1 9 6477 2 2 1 PHE N N 14.365 -0.825 -4.267 1.00 . B B . 22 PHE N 1 1 9 6478 2 2 1 PHE O O 10.909 -1.331 -3.892 1.00 . B B . 22 PHE O 1 1 9 6479 2 2 2 VAL C C 10.899 2.626 -5.094 1.00 . B B . 23 VAL C 1 1 9 6480 2 2 2 VAL CA C 10.776 1.319 -4.310 1.00 . B B . 23 VAL CA 1 1 9 6481 2 2 2 VAL CB C 10.705 1.576 -2.800 1.00 . B B . 23 VAL CB 1 1 9 6482 2 2 2 VAL CG1 C 11.561 2.784 -2.420 1.00 . B B . 23 VAL CG1 1 1 9 6483 2 2 2 VAL CG2 C 9.251 1.814 -2.394 1.00 . B B . 23 VAL CG2 1 1 9 6484 2 2 2 VAL H H 12.774 0.861 -4.950 1.00 . B B . 23 VAL H 1 1 9 6485 2 2 2 VAL HA H 9.880 0.812 -4.624 1.00 . B B . 23 VAL HA 1 1 9 6486 2 2 2 VAL HB H 11.077 0.708 -2.281 1.00 . B B . 23 VAL HB 1 1 9 6487 2 2 2 VAL HG11 H 12.093 2.572 -1.504 1.00 . B B . 23 VAL HG11 1 1 9 6488 2 2 2 VAL HG12 H 10.927 3.645 -2.279 1.00 . B B . 23 VAL HG12 1 1 9 6489 2 2 2 VAL HG13 H 12.271 2.983 -3.210 1.00 . B B . 23 VAL HG13 1 1 9 6490 2 2 2 VAL HG21 H 8.605 1.589 -3.231 1.00 . B B . 23 VAL HG21 1 1 9 6491 2 2 2 VAL HG22 H 9.122 2.845 -2.106 1.00 . B B . 23 VAL HG22 1 1 9 6492 2 2 2 VAL HG23 H 9.001 1.171 -1.564 1.00 . B B . 23 VAL HG23 1 1 9 6493 2 2 2 VAL N N 11.956 0.465 -4.587 1.00 . B B . 23 VAL N 1 1 9 6494 2 2 2 VAL O O 11.529 2.681 -6.130 1.00 . B B . 23 VAL O 1 1 9 6495 2 2 3 ASN C C 9.196 5.076 -6.312 1.00 . B B . 24 ASN C 1 1 9 6496 2 2 3 ASN CA C 10.331 4.990 -5.290 1.00 . B B . 24 ASN CA 1 1 9 6497 2 2 3 ASN CB C 11.672 5.180 -6.003 1.00 . B B . 24 ASN CB 1 1 9 6498 2 2 3 ASN CG C 11.880 6.665 -6.307 1.00 . B B . 24 ASN CG 1 1 9 6499 2 2 3 ASN H H 9.782 3.562 -3.772 1.00 . B B . 24 ASN H 1 1 9 6500 2 2 3 ASN HA H 10.205 5.772 -4.555 1.00 . B B . 24 ASN HA 1 1 9 6501 2 2 3 ASN HB2 H 12.470 4.825 -5.368 1.00 . B B . 24 ASN HB2 1 1 9 6502 2 2 3 ASN HB3 H 11.669 4.623 -6.927 1.00 . B B . 24 ASN HB3 1 1 9 6503 2 2 3 ASN HD21 H 13.840 6.602 -5.992 1.00 . B B . 24 ASN HD21 1 1 9 6504 2 2 3 ASN HD22 H 13.224 8.122 -6.430 1.00 . B B . 24 ASN HD22 1 1 9 6505 2 2 3 ASN N N 10.286 3.662 -4.602 1.00 . B B . 24 ASN N 1 1 9 6506 2 2 3 ASN ND2 N 13.081 7.172 -6.237 1.00 . B B . 24 ASN ND2 1 1 9 6507 2 2 3 ASN O O 9.409 4.997 -7.505 1.00 . B B . 24 ASN O 1 1 9 6508 2 2 3 ASN OD1 O 10.940 7.372 -6.611 1.00 . B B . 24 ASN OD1 1 1 9 6509 2 2 4 GLN C C 5.685 6.059 -6.052 1.00 . B B . 25 GLN C 1 1 9 6510 2 2 4 GLN CA C 6.830 5.345 -6.774 1.00 . B B . 25 GLN CA 1 1 9 6511 2 2 4 GLN CB C 6.382 3.942 -7.190 1.00 . B B . 25 GLN CB 1 1 9 6512 2 2 4 GLN CD C 6.639 2.205 -8.971 1.00 . B B . 25 GLN CD 1 1 9 6513 2 2 4 GLN CG C 6.749 3.700 -8.657 1.00 . B B . 25 GLN CG 1 1 9 6514 2 2 4 GLN H H 7.852 5.309 -4.879 1.00 . B B . 25 GLN H 1 1 9 6515 2 2 4 GLN HA H 7.115 5.910 -7.649 1.00 . B B . 25 GLN HA 1 1 9 6516 2 2 4 GLN HB2 H 6.876 3.209 -6.568 1.00 . B B . 25 GLN HB2 1 1 9 6517 2 2 4 GLN HB3 H 5.313 3.856 -7.069 1.00 . B B . 25 GLN HB3 1 1 9 6518 2 2 4 GLN HE21 H 5.018 2.411 -10.103 1.00 . B B . 25 GLN HE21 1 1 9 6519 2 2 4 GLN HE22 H 5.594 0.822 -9.942 1.00 . B B . 25 GLN HE22 1 1 9 6520 2 2 4 GLN HG2 H 6.075 4.254 -9.293 1.00 . B B . 25 GLN HG2 1 1 9 6521 2 2 4 GLN HG3 H 7.763 4.028 -8.834 1.00 . B B . 25 GLN HG3 1 1 9 6522 2 2 4 GLN N N 7.992 5.244 -5.846 1.00 . B B . 25 GLN N 1 1 9 6523 2 2 4 GLN NE2 N 5.669 1.778 -9.735 1.00 . B B . 25 GLN NE2 1 1 9 6524 2 2 4 GLN O O 5.602 6.043 -4.840 1.00 . B B . 25 GLN O 1 1 9 6525 2 2 4 GLN OE1 O 7.443 1.417 -8.516 1.00 . B B . 25 GLN OE1 1 1 9 6526 2 2 5 HIS C C 2.410 6.579 -6.301 1.00 . B B . 26 HIS C 1 1 9 6527 2 2 5 HIS CA C 3.681 7.407 -6.105 1.00 . B B . 26 HIS CA 1 1 9 6528 2 2 5 HIS CB C 3.504 8.781 -6.747 1.00 . B B . 26 HIS CB 1 1 9 6529 2 2 5 HIS CD2 C 2.412 10.768 -5.446 1.00 . B B . 26 HIS CD2 1 1 9 6530 2 2 5 HIS CE1 C 3.937 10.967 -3.912 1.00 . B B . 26 HIS CE1 1 1 9 6531 2 2 5 HIS CG C 3.365 9.818 -5.672 1.00 . B B . 26 HIS CG 1 1 9 6532 2 2 5 HIS H H 4.883 6.706 -7.753 1.00 . B B . 26 HIS H 1 1 9 6533 2 2 5 HIS HA H 3.891 7.516 -5.051 1.00 . B B . 26 HIS HA 1 1 9 6534 2 2 5 HIS HB2 H 4.359 9.009 -7.365 1.00 . B B . 26 HIS HB2 1 1 9 6535 2 2 5 HIS HB3 H 2.609 8.779 -7.353 1.00 . B B . 26 HIS HB3 1 1 9 6536 2 2 5 HIS HD2 H 1.525 10.921 -6.039 1.00 . B B . 26 HIS HD2 1 1 9 6537 2 2 5 HIS HE1 H 4.491 11.316 -3.052 1.00 . B B . 26 HIS HE1 1 1 9 6538 2 2 5 HIS HE2 H 2.281 12.246 -3.931 1.00 . B B . 26 HIS HE2 1 1 9 6539 2 2 5 HIS N N 4.804 6.694 -6.777 1.00 . B B . 26 HIS N 1 1 9 6540 2 2 5 HIS ND1 N 4.325 9.953 -4.692 1.00 . B B . 26 HIS ND1 1 1 9 6541 2 2 5 HIS NE2 N 2.771 11.499 -4.333 1.00 . B B . 26 HIS NE2 1 1 9 6542 2 2 5 HIS O O 2.424 5.583 -6.996 1.00 . B B . 26 HIS O 1 1 9 6543 2 2 6 LEU C C -1.190 6.982 -5.711 1.00 . B B . 27 LEU C 1 1 9 6544 2 2 6 LEU CA C 0.074 6.135 -5.892 1.00 . B B . 27 LEU CA 1 1 9 6545 2 2 6 LEU CB C 0.034 4.975 -4.887 1.00 . B B . 27 LEU CB 1 1 9 6546 2 2 6 LEU CD1 C 1.601 6.010 -3.236 1.00 . B B . 27 LEU CD1 1 1 9 6547 2 2 6 LEU CD2 C 1.348 3.532 -3.351 1.00 . B B . 27 LEU CD2 1 1 9 6548 2 2 6 LEU CG C 1.376 4.820 -4.170 1.00 . B B . 27 LEU CG 1 1 9 6549 2 2 6 LEU H H 1.298 7.755 -5.138 1.00 . B B . 27 LEU H 1 1 9 6550 2 2 6 LEU HA H 0.078 5.727 -6.892 1.00 . B B . 27 LEU HA 1 1 9 6551 2 2 6 LEU HB2 H -0.738 5.165 -4.157 1.00 . B B . 27 LEU HB2 1 1 9 6552 2 2 6 LEU HB3 H -0.193 4.060 -5.414 1.00 . B B . 27 LEU HB3 1 1 9 6553 2 2 6 LEU HD11 H 1.773 5.652 -2.232 1.00 . B B . 27 LEU HD11 1 1 9 6554 2 2 6 LEU HD12 H 0.728 6.647 -3.247 1.00 . B B . 27 LEU HD12 1 1 9 6555 2 2 6 LEU HD13 H 2.460 6.572 -3.570 1.00 . B B . 27 LEU HD13 1 1 9 6556 2 2 6 LEU HD21 H 2.077 2.840 -3.745 1.00 . B B . 27 LEU HD21 1 1 9 6557 2 2 6 LEU HD22 H 0.363 3.093 -3.410 1.00 . B B . 27 LEU HD22 1 1 9 6558 2 2 6 LEU HD23 H 1.582 3.756 -2.322 1.00 . B B . 27 LEU HD23 1 1 9 6559 2 2 6 LEU HG H 2.173 4.770 -4.895 1.00 . B B . 27 LEU HG 1 1 9 6560 2 2 6 LEU N N 1.310 6.955 -5.703 1.00 . B B . 27 LEU N 1 1 9 6561 2 2 6 LEU O O -1.168 8.178 -5.866 1.00 . B B . 27 LEU O 1 1 9 6562 2 2 7 CYS C C -4.694 6.058 -5.820 1.00 . B B . 28 CYS C 1 1 9 6563 2 2 7 CYS CA C -3.629 6.955 -5.186 1.00 . B B . 28 CYS CA 1 1 9 6564 2 2 7 CYS CB C -3.743 8.367 -5.789 1.00 . B B . 28 CYS CB 1 1 9 6565 2 2 7 CYS H H -2.216 5.345 -5.293 1.00 . B B . 28 CYS H 1 1 9 6566 2 2 7 CYS HA H -3.820 7.011 -4.123 1.00 . B B . 28 CYS HA 1 1 9 6567 2 2 7 CYS HB2 H -2.933 8.550 -6.471 1.00 . B B . 28 CYS HB2 1 1 9 6568 2 2 7 CYS HB3 H -4.677 8.445 -6.327 1.00 . B B . 28 CYS HB3 1 1 9 6569 2 2 7 CYS N N -2.281 6.317 -5.393 1.00 . B B . 28 CYS N 1 1 9 6570 2 2 7 CYS O O -4.461 5.413 -6.824 1.00 . B B . 28 CYS O 1 1 9 6571 2 2 7 CYS SG S -3.725 9.603 -4.455 1.00 . B B . 28 CYS SG 1 1 9 6572 2 2 8 GLY C C -6.401 3.754 -6.100 1.00 . B B . 29 GLY C 1 1 9 6573 2 2 8 GLY CA C -6.945 5.153 -5.799 1.00 . B B . 29 GLY CA 1 1 9 6574 2 2 8 GLY H H -6.023 6.534 -4.427 1.00 . B B . 29 GLY H 1 1 9 6575 2 2 8 GLY HA2 H -7.751 5.080 -5.082 1.00 . B B . 29 GLY HA2 1 1 9 6576 2 2 8 GLY HA3 H -7.315 5.595 -6.711 1.00 . B B . 29 GLY HA3 1 1 9 6577 2 2 8 GLY N N -5.860 6.008 -5.237 1.00 . B B . 29 GLY N 1 1 9 6578 2 2 8 GLY O O -5.759 3.132 -5.275 1.00 . B B . 29 GLY O 1 1 9 6579 2 2 9 SER C C -4.648 1.826 -7.446 1.00 . B B . 30 SER C 1 1 9 6580 2 2 9 SER CA C -6.166 1.891 -7.634 1.00 . B B . 30 SER CA 1 1 9 6581 2 2 9 SER CB C -6.515 1.587 -9.091 1.00 . B B . 30 SER CB 1 1 9 6582 2 2 9 SER H H -7.184 3.767 -7.926 1.00 . B B . 30 SER H 1 1 9 6583 2 2 9 SER HA H -6.637 1.161 -6.993 1.00 . B B . 30 SER HA 1 1 9 6584 2 2 9 SER HB2 H -6.357 2.466 -9.694 1.00 . B B . 30 SER HB2 1 1 9 6585 2 2 9 SER HB3 H -5.882 0.787 -9.452 1.00 . B B . 30 SER HB3 1 1 9 6586 2 2 9 SER HG H -8.093 1.057 -10.101 1.00 . B B . 30 SER HG 1 1 9 6587 2 2 9 SER N N -6.659 3.251 -7.277 1.00 . B B . 30 SER N 1 1 9 6588 2 2 9 SER O O -4.115 0.834 -6.991 1.00 . B B . 30 SER O 1 1 9 6589 2 2 9 SER OG O -7.882 1.202 -9.175 1.00 . B B . 30 SER OG 1 1 9 6590 2 2 10 ASP C C -2.131 2.441 -6.188 1.00 . B B . 31 ASP C 1 1 9 6591 2 2 10 ASP CA C -2.463 2.850 -7.622 1.00 . B B . 31 ASP CA 1 1 9 6592 2 2 10 ASP CB C -1.886 4.240 -7.902 1.00 . B B . 31 ASP CB 1 1 9 6593 2 2 10 ASP CG C -2.556 4.835 -9.142 1.00 . B B . 31 ASP CG 1 1 9 6594 2 2 10 ASP H H -4.387 3.666 -8.156 1.00 . B B . 31 ASP H 1 1 9 6595 2 2 10 ASP HA H -2.034 2.136 -8.308 1.00 . B B . 31 ASP HA 1 1 9 6596 2 2 10 ASP HB2 H -2.065 4.880 -7.053 1.00 . B B . 31 ASP HB2 1 1 9 6597 2 2 10 ASP HB3 H -0.822 4.160 -8.071 1.00 . B B . 31 ASP HB3 1 1 9 6598 2 2 10 ASP N N -3.944 2.872 -7.790 1.00 . B B . 31 ASP N 1 1 9 6599 2 2 10 ASP O O -1.209 1.688 -5.943 1.00 . B B . 31 ASP O 1 1 9 6600 2 2 10 ASP OD1 O -2.610 4.149 -10.149 1.00 . B B . 31 ASP OD1 1 1 9 6601 2 2 10 ASP OD2 O -3.006 5.967 -9.063 1.00 . B B . 31 ASP OD2 1 1 9 6602 2 2 11 LEU C C -2.911 1.074 -3.625 1.00 . B B . 32 LEU C 1 1 9 6603 2 2 11 LEU CA C -2.608 2.560 -3.819 1.00 . B B . 32 LEU CA 1 1 9 6604 2 2 11 LEU CB C -3.495 3.395 -2.891 1.00 . B B . 32 LEU CB 1 1 9 6605 2 2 11 LEU CD1 C -2.486 5.599 -2.284 1.00 . B B . 32 LEU CD1 1 1 9 6606 2 2 11 LEU CD2 C -3.277 4.051 -0.490 1.00 . B B . 32 LEU CD2 1 1 9 6607 2 2 11 LEU CG C -2.623 4.131 -1.872 1.00 . B B . 32 LEU CG 1 1 9 6608 2 2 11 LEU H H -3.621 3.531 -5.454 1.00 . B B . 32 LEU H 1 1 9 6609 2 2 11 LEU HA H -1.568 2.745 -3.592 1.00 . B B . 32 LEU HA 1 1 9 6610 2 2 11 LEU HB2 H -4.051 4.114 -3.476 1.00 . B B . 32 LEU HB2 1 1 9 6611 2 2 11 LEU HB3 H -4.183 2.746 -2.370 1.00 . B B . 32 LEU HB3 1 1 9 6612 2 2 11 LEU HD11 H -1.477 5.934 -2.093 1.00 . B B . 32 LEU HD11 1 1 9 6613 2 2 11 LEU HD12 H -3.180 6.200 -1.714 1.00 . B B . 32 LEU HD12 1 1 9 6614 2 2 11 LEU HD13 H -2.706 5.698 -3.336 1.00 . B B . 32 LEU HD13 1 1 9 6615 2 2 11 LEU HD21 H -2.520 3.858 0.256 1.00 . B B . 32 LEU HD21 1 1 9 6616 2 2 11 LEU HD22 H -4.003 3.251 -0.481 1.00 . B B . 32 LEU HD22 1 1 9 6617 2 2 11 LEU HD23 H -3.769 4.987 -0.269 1.00 . B B . 32 LEU HD23 1 1 9 6618 2 2 11 LEU HG H -1.645 3.673 -1.838 1.00 . B B . 32 LEU HG 1 1 9 6619 2 2 11 LEU N N -2.879 2.928 -5.236 1.00 . B B . 32 LEU N 1 1 9 6620 2 2 11 LEU O O -2.015 0.265 -3.490 1.00 . B B . 32 LEU O 1 1 9 6621 2 2 12 VAL C C -3.581 -1.583 -4.291 1.00 . B B . 33 VAL C 1 1 9 6622 2 2 12 VAL CA C -4.521 -0.729 -3.444 1.00 . B B . 33 VAL CA 1 1 9 6623 2 2 12 VAL CB C -5.962 -0.962 -3.900 1.00 . B B . 33 VAL CB 1 1 9 6624 2 2 12 VAL CG1 C -6.915 -0.184 -2.994 1.00 . B B . 33 VAL CG1 1 1 9 6625 2 2 12 VAL CG2 C -6.124 -0.480 -5.344 1.00 . B B . 33 VAL CG2 1 1 9 6626 2 2 12 VAL H H -4.872 1.377 -3.737 1.00 . B B . 33 VAL H 1 1 9 6627 2 2 12 VAL HA H -4.422 -1.003 -2.404 1.00 . B B . 33 VAL HA 1 1 9 6628 2 2 12 VAL HB H -6.190 -2.017 -3.842 1.00 . B B . 33 VAL HB 1 1 9 6629 2 2 12 VAL HG11 H -7.935 -0.411 -3.265 1.00 . B B . 33 VAL HG11 1 1 9 6630 2 2 12 VAL HG12 H -6.739 0.875 -3.111 1.00 . B B . 33 VAL HG12 1 1 9 6631 2 2 12 VAL HG13 H -6.745 -0.467 -1.965 1.00 . B B . 33 VAL HG13 1 1 9 6632 2 2 12 VAL HG21 H -5.553 0.426 -5.487 1.00 . B B . 33 VAL HG21 1 1 9 6633 2 2 12 VAL HG22 H -7.167 -0.284 -5.542 1.00 . B B . 33 VAL HG22 1 1 9 6634 2 2 12 VAL HG23 H -5.766 -1.241 -6.021 1.00 . B B . 33 VAL HG23 1 1 9 6635 2 2 12 VAL N N -4.166 0.709 -3.620 1.00 . B B . 33 VAL N 1 1 9 6636 2 2 12 VAL O O -3.126 -2.629 -3.875 1.00 . B B . 33 VAL O 1 1 9 6637 2 2 13 GLU C C -1.065 -2.183 -5.586 1.00 . B B . 34 GLU C 1 1 9 6638 2 2 13 GLU CA C -2.365 -1.921 -6.343 1.00 . B B . 34 GLU CA 1 1 9 6639 2 2 13 GLU CB C -2.078 -1.128 -7.620 1.00 . B B . 34 GLU CB 1 1 9 6640 2 2 13 GLU CD C -2.134 -1.884 -10.005 1.00 . B B . 34 GLU CD 1 1 9 6641 2 2 13 GLU CG C -2.975 -1.637 -8.751 1.00 . B B . 34 GLU CG 1 1 9 6642 2 2 13 GLU H H -3.648 -0.292 -5.797 1.00 . B B . 34 GLU H 1 1 9 6643 2 2 13 GLU HA H -2.826 -2.864 -6.595 1.00 . B B . 34 GLU HA 1 1 9 6644 2 2 13 GLU HB2 H -2.278 -0.080 -7.445 1.00 . B B . 34 GLU HB2 1 1 9 6645 2 2 13 GLU HB3 H -1.046 -1.254 -7.896 1.00 . B B . 34 GLU HB3 1 1 9 6646 2 2 13 GLU HG2 H -3.448 -2.559 -8.446 1.00 . B B . 34 GLU HG2 1 1 9 6647 2 2 13 GLU HG3 H -3.733 -0.899 -8.969 1.00 . B B . 34 GLU HG3 1 1 9 6648 2 2 13 GLU N N -3.279 -1.140 -5.478 1.00 . B B . 34 GLU N 1 1 9 6649 2 2 13 GLU O O -0.621 -3.307 -5.473 1.00 . B B . 34 GLU O 1 1 9 6650 2 2 13 GLU OE1 O -0.985 -2.267 -9.859 1.00 . B B . 34 GLU OE1 1 1 9 6651 2 2 13 GLU OE2 O -2.654 -1.686 -11.091 1.00 . B B . 34 GLU OE2 1 1 9 6652 2 2 14 ALA C C 0.536 -2.337 -3.136 1.00 . B B . 35 ALA C 1 1 9 6653 2 2 14 ALA CA C 0.811 -1.377 -4.296 1.00 . B B . 35 ALA CA 1 1 9 6654 2 2 14 ALA CB C 1.323 -0.039 -3.755 1.00 . B B . 35 ALA CB 1 1 9 6655 2 2 14 ALA H H -0.829 -0.257 -5.137 1.00 . B B . 35 ALA H 1 1 9 6656 2 2 14 ALA HA H 1.550 -1.813 -4.956 1.00 . B B . 35 ALA HA 1 1 9 6657 2 2 14 ALA HB1 H 1.853 -0.203 -2.829 1.00 . B B . 35 ALA HB1 1 1 9 6658 2 2 14 ALA HB2 H 0.487 0.622 -3.578 1.00 . B B . 35 ALA HB2 1 1 9 6659 2 2 14 ALA HB3 H 1.990 0.410 -4.477 1.00 . B B . 35 ALA HB3 1 1 9 6660 2 2 14 ALA N N -0.454 -1.161 -5.051 1.00 . B B . 35 ALA N 1 1 9 6661 2 2 14 ALA O O 1.180 -3.357 -2.994 1.00 . B B . 35 ALA O 1 1 9 6662 2 2 15 LEU C C -1.007 -4.335 -1.720 1.00 . B B . 36 LEU C 1 1 9 6663 2 2 15 LEU CA C -0.746 -2.932 -1.175 1.00 . B B . 36 LEU CA 1 1 9 6664 2 2 15 LEU CB C -2.000 -2.425 -0.454 1.00 . B B . 36 LEU CB 1 1 9 6665 2 2 15 LEU CD1 C -0.284 -0.814 0.466 1.00 . B B . 36 LEU CD1 1 1 9 6666 2 2 15 LEU CD2 C -2.190 0.029 -0.919 1.00 . B B . 36 LEU CD2 1 1 9 6667 2 2 15 LEU CG C -1.765 -1.016 0.115 1.00 . B B . 36 LEU CG 1 1 9 6668 2 2 15 LEU H H -0.942 -1.205 -2.444 1.00 . B B . 36 LEU H 1 1 9 6669 2 2 15 LEU HA H 0.085 -2.953 -0.483 1.00 . B B . 36 LEU HA 1 1 9 6670 2 2 15 LEU HB2 H -2.823 -2.394 -1.152 1.00 . B B . 36 LEU HB2 1 1 9 6671 2 2 15 LEU HB3 H -2.243 -3.098 0.355 1.00 . B B . 36 LEU HB3 1 1 9 6672 2 2 15 LEU HD11 H -0.123 0.208 0.771 1.00 . B B . 36 LEU HD11 1 1 9 6673 2 2 15 LEU HD12 H 0.323 -1.029 -0.400 1.00 . B B . 36 LEU HD12 1 1 9 6674 2 2 15 LEU HD13 H -0.013 -1.478 1.272 1.00 . B B . 36 LEU HD13 1 1 9 6675 2 2 15 LEU HD21 H -1.312 0.468 -1.370 1.00 . B B . 36 LEU HD21 1 1 9 6676 2 2 15 LEU HD22 H -2.771 0.800 -0.435 1.00 . B B . 36 LEU HD22 1 1 9 6677 2 2 15 LEU HD23 H -2.788 -0.445 -1.683 1.00 . B B . 36 LEU HD23 1 1 9 6678 2 2 15 LEU HG H -2.359 -0.896 1.006 1.00 . B B . 36 LEU HG 1 1 9 6679 2 2 15 LEU N N -0.426 -2.026 -2.311 1.00 . B B . 36 LEU N 1 1 9 6680 2 2 15 LEU O O -0.933 -5.316 -1.007 1.00 . B B . 36 LEU O 1 1 9 6681 2 2 16 TYR C C -0.261 -6.399 -4.032 1.00 . B B . 37 TYR C 1 1 9 6682 2 2 16 TYR CA C -1.581 -5.769 -3.587 1.00 . B B . 37 TYR CA 1 1 9 6683 2 2 16 TYR CB C -2.497 -5.601 -4.800 1.00 . B B . 37 TYR CB 1 1 9 6684 2 2 16 TYR CD1 C -3.081 -8.111 -4.877 1.00 . B B . 37 TYR CD1 1 1 9 6685 2 2 16 TYR CD2 C -2.208 -7.070 -6.897 1.00 . B B . 37 TYR CD2 1 1 9 6686 2 2 16 TYR CE1 C -3.167 -9.333 -5.554 1.00 . B B . 37 TYR CE1 1 1 9 6687 2 2 16 TYR CE2 C -2.300 -8.301 -7.560 1.00 . B B . 37 TYR CE2 1 1 9 6688 2 2 16 TYR CG C -2.599 -6.954 -5.542 1.00 . B B . 37 TYR CG 1 1 9 6689 2 2 16 TYR CZ C -2.779 -9.427 -6.891 1.00 . B B . 37 TYR CZ 1 1 9 6690 2 2 16 TYR H H -1.367 -3.629 -3.540 1.00 . B B . 37 TYR H 1 1 9 6691 2 2 16 TYR HA H -2.060 -6.406 -2.857 1.00 . B B . 37 TYR HA 1 1 9 6692 2 2 16 TYR HB2 H -3.477 -5.267 -4.457 1.00 . B B . 37 TYR HB2 1 1 9 6693 2 2 16 TYR HB3 H -2.082 -4.838 -5.455 1.00 . B B . 37 TYR HB3 1 1 9 6694 2 2 16 TYR HD1 H -3.382 -8.069 -3.848 1.00 . B B . 37 TYR HD1 1 1 9 6695 2 2 16 TYR HD2 H -1.831 -6.225 -7.432 1.00 . B B . 37 TYR HD2 1 1 9 6696 2 2 16 TYR HE1 H -3.534 -10.208 -5.038 1.00 . B B . 37 TYR HE1 1 1 9 6697 2 2 16 TYR HE2 H -2.001 -8.377 -8.594 1.00 . B B . 37 TYR HE2 1 1 9 6698 2 2 16 TYR HH H -3.617 -11.115 -7.193 1.00 . B B . 37 TYR HH 1 1 9 6699 2 2 16 TYR N N -1.313 -4.435 -2.985 1.00 . B B . 37 TYR N 1 1 9 6700 2 2 16 TYR O O -0.201 -7.563 -4.374 1.00 . B B . 37 TYR O 1 1 9 6701 2 2 16 TYR OH O -2.867 -10.636 -7.551 1.00 . B B . 37 TYR OH 1 1 9 6702 2 2 17 LEU C C 2.918 -6.577 -3.201 1.00 . B B . 38 LEU C 1 1 9 6703 2 2 17 LEU CA C 2.116 -6.200 -4.447 1.00 . B B . 38 LEU CA 1 1 9 6704 2 2 17 LEU CB C 2.911 -5.170 -5.262 1.00 . B B . 38 LEU CB 1 1 9 6705 2 2 17 LEU CD1 C 2.795 -3.047 -6.572 1.00 . B B . 38 LEU CD1 1 1 9 6706 2 2 17 LEU CD2 C 0.997 -4.757 -6.811 1.00 . B B . 38 LEU CD2 1 1 9 6707 2 2 17 LEU CG C 1.975 -4.107 -5.836 1.00 . B B . 38 LEU CG 1 1 9 6708 2 2 17 LEU H H 0.730 -4.705 -3.743 1.00 . B B . 38 LEU H 1 1 9 6709 2 2 17 LEU HA H 1.951 -7.080 -5.046 1.00 . B B . 38 LEU HA 1 1 9 6710 2 2 17 LEU HB2 H 3.640 -4.695 -4.623 1.00 . B B . 38 LEU HB2 1 1 9 6711 2 2 17 LEU HB3 H 3.419 -5.670 -6.072 1.00 . B B . 38 LEU HB3 1 1 9 6712 2 2 17 LEU HD11 H 3.094 -3.429 -7.536 1.00 . B B . 38 LEU HD11 1 1 9 6713 2 2 17 LEU HD12 H 3.673 -2.804 -5.992 1.00 . B B . 38 LEU HD12 1 1 9 6714 2 2 17 LEU HD13 H 2.195 -2.158 -6.706 1.00 . B B . 38 LEU HD13 1 1 9 6715 2 2 17 LEU HD21 H 0.380 -5.464 -6.280 1.00 . B B . 38 LEU HD21 1 1 9 6716 2 2 17 LEU HD22 H 1.547 -5.265 -7.588 1.00 . B B . 38 LEU HD22 1 1 9 6717 2 2 17 LEU HD23 H 0.373 -3.993 -7.251 1.00 . B B . 38 LEU HD23 1 1 9 6718 2 2 17 LEU HG H 1.427 -3.645 -5.035 1.00 . B B . 38 LEU HG 1 1 9 6719 2 2 17 LEU N N 0.800 -5.639 -4.027 1.00 . B B . 38 LEU N 1 1 9 6720 2 2 17 LEU O O 3.576 -7.597 -3.157 1.00 . B B . 38 LEU O 1 1 9 6721 2 2 18 VAL C C 2.855 -7.098 -0.120 1.00 . B B . 39 VAL C 1 1 9 6722 2 2 18 VAL CA C 3.623 -6.058 -0.943 1.00 . B B . 39 VAL CA 1 1 9 6723 2 2 18 VAL CB C 3.801 -4.766 -0.137 1.00 . B B . 39 VAL CB 1 1 9 6724 2 2 18 VAL CG1 C 4.143 -3.621 -1.091 1.00 . B B . 39 VAL CG1 1 1 9 6725 2 2 18 VAL CG2 C 2.506 -4.429 0.603 1.00 . B B . 39 VAL CG2 1 1 9 6726 2 2 18 VAL H H 2.330 -4.940 -2.248 1.00 . B B . 39 VAL H 1 1 9 6727 2 2 18 VAL HA H 4.594 -6.455 -1.202 1.00 . B B . 39 VAL HA 1 1 9 6728 2 2 18 VAL HB H 4.603 -4.893 0.575 1.00 . B B . 39 VAL HB 1 1 9 6729 2 2 18 VAL HG11 H 4.859 -2.963 -0.622 1.00 . B B . 39 VAL HG11 1 1 9 6730 2 2 18 VAL HG12 H 3.245 -3.068 -1.324 1.00 . B B . 39 VAL HG12 1 1 9 6731 2 2 18 VAL HG13 H 4.564 -4.024 -2.000 1.00 . B B . 39 VAL HG13 1 1 9 6732 2 2 18 VAL HG21 H 2.610 -4.683 1.648 1.00 . B B . 39 VAL HG21 1 1 9 6733 2 2 18 VAL HG22 H 1.691 -4.991 0.175 1.00 . B B . 39 VAL HG22 1 1 9 6734 2 2 18 VAL HG23 H 2.304 -3.372 0.508 1.00 . B B . 39 VAL HG23 1 1 9 6735 2 2 18 VAL N N 2.867 -5.757 -2.189 1.00 . B B . 39 VAL N 1 1 9 6736 2 2 18 VAL O O 3.430 -7.855 0.636 1.00 . B B . 39 VAL O 1 1 9 6737 2 2 19 CYS C C 0.336 -9.281 -0.428 1.00 . B B . 40 CYS C 1 1 9 6738 2 2 19 CYS CA C 0.753 -8.135 0.500 1.00 . B B . 40 CYS CA 1 1 9 6739 2 2 19 CYS CB C -0.502 -7.455 1.053 1.00 . B B . 40 CYS CB 1 1 9 6740 2 2 19 CYS H H 1.113 -6.527 -0.884 1.00 . B B . 40 CYS H 1 1 9 6741 2 2 19 CYS HA H 1.342 -8.526 1.316 1.00 . B B . 40 CYS HA 1 1 9 6742 2 2 19 CYS HB2 H -1.221 -7.330 0.257 1.00 . B B . 40 CYS HB2 1 1 9 6743 2 2 19 CYS HB3 H -0.929 -8.070 1.828 1.00 . B B . 40 CYS HB3 1 1 9 6744 2 2 19 CYS N N 1.558 -7.143 -0.267 1.00 . B B . 40 CYS N 1 1 9 6745 2 2 19 CYS O O -0.322 -10.216 -0.016 1.00 . B B . 40 CYS O 1 1 9 6746 2 2 19 CYS SG S -0.076 -5.834 1.735 1.00 . B B . 40 CYS SG 1 1 9 6747 2 2 20 GLY C C 1.163 -11.547 -2.371 1.00 . B B . 41 GLY C 1 1 9 6748 2 2 20 GLY CA C 0.322 -10.295 -2.632 1.00 . B B . 41 GLY CA 1 1 9 6749 2 2 20 GLY H H 1.231 -8.449 -1.995 1.00 . B B . 41 GLY H 1 1 9 6750 2 2 20 GLY HA2 H -0.725 -10.531 -2.503 1.00 . B B . 41 GLY HA2 1 1 9 6751 2 2 20 GLY HA3 H 0.492 -9.959 -3.643 1.00 . B B . 41 GLY HA3 1 1 9 6752 2 2 20 GLY N N 0.706 -9.213 -1.680 1.00 . B B . 41 GLY N 1 1 9 6753 2 2 20 GLY O O 0.688 -12.659 -2.494 1.00 . B B . 41 GLY O 1 1 9 6754 2 2 21 GLU C C 3.250 -12.903 -0.266 1.00 . B B . 42 GLU C 1 1 9 6755 2 2 21 GLU CA C 3.273 -12.567 -1.758 1.00 . B B . 42 GLU CA 1 1 9 6756 2 2 21 GLU CB C 4.710 -12.255 -2.188 1.00 . B B . 42 GLU CB 1 1 9 6757 2 2 21 GLU CD C 6.139 -10.220 -1.916 1.00 . B B . 42 GLU CD 1 1 9 6758 2 2 21 GLU CG C 5.357 -11.306 -1.175 1.00 . B B . 42 GLU CG 1 1 9 6759 2 2 21 GLU H H 2.775 -10.476 -1.928 1.00 . B B . 42 GLU H 1 1 9 6760 2 2 21 GLU HA H 2.904 -13.410 -2.322 1.00 . B B . 42 GLU HA 1 1 9 6761 2 2 21 GLU HB2 H 5.277 -13.173 -2.236 1.00 . B B . 42 GLU HB2 1 1 9 6762 2 2 21 GLU HB3 H 4.700 -11.786 -3.161 1.00 . B B . 42 GLU HB3 1 1 9 6763 2 2 21 GLU HG2 H 4.588 -10.849 -0.569 1.00 . B B . 42 GLU HG2 1 1 9 6764 2 2 21 GLU HG3 H 6.030 -11.863 -0.541 1.00 . B B . 42 GLU HG3 1 1 9 6765 2 2 21 GLU N N 2.408 -11.380 -2.018 1.00 . B B . 42 GLU N 1 1 9 6766 2 2 21 GLU O O 3.658 -13.970 0.148 1.00 . B B . 42 GLU O 1 1 9 6767 2 2 21 GLU OE1 O 7.016 -10.571 -2.687 1.00 . B B . 42 GLU OE1 1 1 9 6768 2 2 21 GLU OE2 O 5.848 -9.055 -1.698 1.00 . B B . 42 GLU OE2 1 1 9 6769 2 2 22 ARG C C 1.303 -12.081 2.515 1.00 . B B . 43 ARG C 1 1 9 6770 2 2 22 ARG CA C 2.738 -12.254 2.010 1.00 . B B . 43 ARG CA 1 1 9 6771 2 2 22 ARG CB C 3.668 -11.259 2.718 1.00 . B B . 43 ARG CB 1 1 9 6772 2 2 22 ARG CD C 4.125 -10.030 4.842 1.00 . B B . 43 ARG CD 1 1 9 6773 2 2 22 ARG CG C 3.291 -11.137 4.198 1.00 . B B . 43 ARG CG 1 1 9 6774 2 2 22 ARG CZ C 5.386 -9.821 6.898 1.00 . B B . 43 ARG CZ 1 1 9 6775 2 2 22 ARG H H 2.464 -11.140 0.188 1.00 . B B . 43 ARG H 1 1 9 6776 2 2 22 ARG HA H 3.071 -13.262 2.209 1.00 . B B . 43 ARG HA 1 1 9 6777 2 2 22 ARG HB2 H 4.687 -11.605 2.636 1.00 . B B . 43 ARG HB2 1 1 9 6778 2 2 22 ARG HB3 H 3.580 -10.291 2.247 1.00 . B B . 43 ARG HB3 1 1 9 6779 2 2 22 ARG HD2 H 5.066 -9.940 4.320 1.00 . B B . 43 ARG HD2 1 1 9 6780 2 2 22 ARG HD3 H 3.588 -9.095 4.780 1.00 . B B . 43 ARG HD3 1 1 9 6781 2 2 22 ARG HE H 3.790 -10.990 6.742 1.00 . B B . 43 ARG HE 1 1 9 6782 2 2 22 ARG HG2 H 2.241 -10.894 4.285 1.00 . B B . 43 ARG HG2 1 1 9 6783 2 2 22 ARG HG3 H 3.487 -12.072 4.699 1.00 . B B . 43 ARG HG3 1 1 9 6784 2 2 22 ARG HH11 H 4.482 -8.050 7.134 1.00 . B B . 43 ARG HH11 1 1 9 6785 2 2 22 ARG HH12 H 6.084 -8.166 7.784 1.00 . B B . 43 ARG HH12 1 1 9 6786 2 2 22 ARG HH21 H 6.525 -11.466 6.806 1.00 . B B . 43 ARG HH21 1 1 9 6787 2 2 22 ARG HH22 H 7.242 -10.102 7.596 1.00 . B B . 43 ARG HH22 1 1 9 6788 2 2 22 ARG N N 2.782 -11.996 0.544 1.00 . B B . 43 ARG N 1 1 9 6789 2 2 22 ARG NE N 4.379 -10.364 6.272 1.00 . B B . 43 ARG NE 1 1 9 6790 2 2 22 ARG NH1 N 5.312 -8.583 7.304 1.00 . B B . 43 ARG NH1 1 1 9 6791 2 2 22 ARG NH2 N 6.469 -10.517 7.117 1.00 . B B . 43 ARG NH2 1 1 9 6792 2 2 22 ARG O O 0.475 -11.472 1.868 1.00 . B B . 43 ARG O 1 1 9 6793 2 2 23 GLY C C -0.802 -11.006 4.135 1.00 . B B . 44 GLY C 1 1 9 6794 2 2 23 GLY CA C -0.370 -12.469 4.222 1.00 . B B . 44 GLY CA 1 1 9 6795 2 2 23 GLY H H 1.692 -13.091 4.181 1.00 . B B . 44 GLY H 1 1 9 6796 2 2 23 GLY HA2 H -1.050 -13.083 3.648 1.00 . B B . 44 GLY HA2 1 1 9 6797 2 2 23 GLY HA3 H -0.381 -12.785 5.254 1.00 . B B . 44 GLY HA3 1 1 9 6798 2 2 23 GLY N N 1.007 -12.608 3.672 1.00 . B B . 44 GLY N 1 1 9 6799 2 2 23 GLY O O 0.006 -10.123 3.929 1.00 . B B . 44 GLY O 1 1 9 6800 2 2 24 GLY C C -3.496 -9.185 3.017 1.00 . B B . 45 GLY C 1 1 9 6801 2 2 24 GLY CA C -2.547 -9.331 4.207 1.00 . B B . 45 GLY CA 1 1 9 6802 2 2 24 GLY H H -2.706 -11.466 4.449 1.00 . B B . 45 GLY H 1 1 9 6803 2 2 24 GLY HA2 H -3.067 -9.075 5.120 1.00 . B B . 45 GLY HA2 1 1 9 6804 2 2 24 GLY HA3 H -1.705 -8.671 4.073 1.00 . B B . 45 GLY HA3 1 1 9 6805 2 2 24 GLY N N -2.069 -10.740 4.286 1.00 . B B . 45 GLY N 1 1 9 6806 2 2 24 GLY O O -4.163 -8.181 2.862 1.00 . B B . 45 GLY O 1 1 9 6807 2 2 25 PHE C C -5.816 -9.525 1.437 1.00 . B B . 46 PHE C 1 1 9 6808 2 2 25 PHE CA C -4.472 -10.109 1.000 1.00 . B B . 46 PHE CA 1 1 9 6809 2 2 25 PHE CB C -4.684 -11.519 0.441 1.00 . B B . 46 PHE CB 1 1 9 6810 2 2 25 PHE CD1 C -5.639 -10.197 -1.587 1.00 . B B . 46 PHE CD1 1 1 9 6811 2 2 25 PHE CD2 C -6.193 -12.562 -1.396 1.00 . B B . 46 PHE CD2 1 1 9 6812 2 2 25 PHE CE1 C -6.393 -10.128 -2.764 1.00 . B B . 46 PHE CE1 1 1 9 6813 2 2 25 PHE CE2 C -6.943 -12.470 -2.575 1.00 . B B . 46 PHE CE2 1 1 9 6814 2 2 25 PHE CG C -5.522 -11.427 -0.873 1.00 . B B . 46 PHE CG 1 1 9 6815 2 2 25 PHE CZ C -7.041 -11.259 -3.256 1.00 . B B . 46 PHE CZ 1 1 9 6816 2 2 25 PHE H H -3.019 -10.983 2.324 1.00 . B B . 46 PHE H 1 1 9 6817 2 2 25 PHE HA H -4.032 -9.480 0.241 1.00 . B B . 46 PHE HA 1 1 9 6818 2 2 25 PHE HB2 H -3.697 -11.972 0.253 1.00 . B B . 46 PHE HB2 1 1 9 6819 2 2 25 PHE HB3 H -5.210 -12.120 1.196 1.00 . B B . 46 PHE HB3 1 1 9 6820 2 2 25 PHE HD1 H -5.158 -9.303 -1.240 1.00 . B B . 46 PHE HD1 1 1 9 6821 2 2 25 PHE HD2 H -6.143 -13.502 -0.901 1.00 . B B . 46 PHE HD2 1 1 9 6822 2 2 25 PHE HE1 H -6.473 -9.192 -3.295 1.00 . B B . 46 PHE HE1 1 1 9 6823 2 2 25 PHE HE2 H -7.447 -13.344 -2.960 1.00 . B B . 46 PHE HE2 1 1 9 6824 2 2 25 PHE HZ H -7.621 -11.197 -4.165 1.00 . B B . 46 PHE HZ 1 1 9 6825 2 2 25 PHE N N -3.564 -10.182 2.177 1.00 . B B . 46 PHE N 1 1 9 6826 2 2 25 PHE O O -6.455 -10.027 2.340 1.00 . B B . 46 PHE O 1 1 9 6827 2 2 26 TYR C C -8.456 -7.867 -0.052 1.00 . B B . 47 TYR C 1 1 9 6828 2 2 26 TYR CA C -7.552 -7.872 1.183 1.00 . B B . 47 TYR CA 1 1 9 6829 2 2 26 TYR CB C -7.325 -6.442 1.710 1.00 . B B . 47 TYR CB 1 1 9 6830 2 2 26 TYR CD1 C -5.278 -5.832 0.207 1.00 . B B . 47 TYR CD1 1 1 9 6831 2 2 26 TYR CD2 C -7.306 -4.500 -0.021 1.00 . B B . 47 TYR CD2 1 1 9 6832 2 2 26 TYR CE1 C -4.668 -5.045 -0.778 1.00 . B B . 47 TYR CE1 1 1 9 6833 2 2 26 TYR CE2 C -6.676 -3.729 -1.003 1.00 . B B . 47 TYR CE2 1 1 9 6834 2 2 26 TYR CG C -6.622 -5.574 0.612 1.00 . B B . 47 TYR CG 1 1 9 6835 2 2 26 TYR CZ C -5.364 -3.999 -1.378 1.00 . B B . 47 TYR CZ 1 1 9 6836 2 2 26 TYR H H -5.737 -8.083 0.075 1.00 . B B . 47 TYR H 1 1 9 6837 2 2 26 TYR HA H -8.010 -8.470 1.957 1.00 . B B . 47 TYR HA 1 1 9 6838 2 2 26 TYR HB2 H -8.302 -6.014 1.986 1.00 . B B . 47 TYR HB2 1 1 9 6839 2 2 26 TYR HB3 H -6.702 -6.499 2.614 1.00 . B B . 47 TYR HB3 1 1 9 6840 2 2 26 TYR HD1 H -4.711 -6.630 0.639 1.00 . B B . 47 TYR HD1 1 1 9 6841 2 2 26 TYR HD2 H -8.314 -4.267 0.234 1.00 . B B . 47 TYR HD2 1 1 9 6842 2 2 26 TYR HE1 H -3.651 -5.252 -1.075 1.00 . B B . 47 TYR HE1 1 1 9 6843 2 2 26 TYR HE2 H -7.211 -2.916 -1.471 1.00 . B B . 47 TYR HE2 1 1 9 6844 2 2 26 TYR HH H -4.268 -3.819 -2.928 1.00 . B B . 47 TYR HH 1 1 9 6845 2 2 26 TYR N N -6.255 -8.473 0.804 1.00 . B B . 47 TYR N 1 1 9 6846 2 2 26 TYR O O -8.542 -8.849 -0.758 1.00 . B B . 47 TYR O 1 1 9 6847 2 2 26 TYR OH O -4.754 -3.231 -2.346 1.00 . B B . 47 TYR OH 1 1 9 6848 2 2 27 THR C C -10.973 -5.534 -1.346 1.00 . B B . 48 THR C 1 1 9 6849 2 2 27 THR CA C -10.017 -6.715 -1.513 1.00 . B B . 48 THR CA 1 1 9 6850 2 2 27 THR CB C -10.809 -8.033 -1.646 1.00 . B B . 48 THR CB 1 1 9 6851 2 2 27 THR CG2 C -12.170 -7.784 -2.308 1.00 . B B . 48 THR CG2 1 1 9 6852 2 2 27 THR H H -9.028 -6.006 0.260 1.00 . B B . 48 THR H 1 1 9 6853 2 2 27 THR HA H -9.423 -6.563 -2.394 1.00 . B B . 48 THR HA 1 1 9 6854 2 2 27 THR HB H -10.963 -8.458 -0.666 1.00 . B B . 48 THR HB 1 1 9 6855 2 2 27 THR HG1 H -9.908 -8.530 -3.296 1.00 . B B . 48 THR HG1 1 1 9 6856 2 2 27 THR HG21 H -12.732 -7.072 -1.721 1.00 . B B . 48 THR HG21 1 1 9 6857 2 2 27 THR HG22 H -12.717 -8.713 -2.368 1.00 . B B . 48 THR HG22 1 1 9 6858 2 2 27 THR HG23 H -12.020 -7.390 -3.303 1.00 . B B . 48 THR HG23 1 1 9 6859 2 2 27 THR N N -9.120 -6.782 -0.320 1.00 . B B . 48 THR N 1 1 9 6860 2 2 27 THR O O -11.090 -4.684 -2.206 1.00 . B B . 48 THR O 1 1 9 6861 2 2 27 THR OG1 O -10.071 -8.945 -2.446 1.00 . B B . 48 THR OG1 1 1 9 6862 2 2 28 LYS C C -13.171 -4.470 1.421 1.00 . B B . 49 LYS C 1 1 9 6863 2 2 28 LYS CA C -12.613 -4.368 -0.004 1.00 . B B . 49 LYS CA 1 1 9 6864 2 2 28 LYS CB C -13.766 -4.467 -1.005 1.00 . B B . 49 LYS CB 1 1 9 6865 2 2 28 LYS CD C -15.069 -2.954 -2.508 1.00 . B B . 49 LYS CD 1 1 9 6866 2 2 28 LYS CE C -16.008 -4.126 -2.794 1.00 . B B . 49 LYS CE 1 1 9 6867 2 2 28 LYS CG C -14.467 -3.111 -1.110 1.00 . B B . 49 LYS CG 1 1 9 6868 2 2 28 LYS H H -11.540 -6.185 0.428 1.00 . B B . 49 LYS H 1 1 9 6869 2 2 28 LYS HA H -12.106 -3.426 -0.136 1.00 . B B . 49 LYS HA 1 1 9 6870 2 2 28 LYS HB2 H -13.379 -4.749 -1.973 1.00 . B B . 49 LYS HB2 1 1 9 6871 2 2 28 LYS HB3 H -14.473 -5.211 -0.668 1.00 . B B . 49 LYS HB3 1 1 9 6872 2 2 28 LYS HD2 H -15.621 -2.027 -2.560 1.00 . B B . 49 LYS HD2 1 1 9 6873 2 2 28 LYS HD3 H -14.277 -2.944 -3.241 1.00 . B B . 49 LYS HD3 1 1 9 6874 2 2 28 LYS HE2 H -16.037 -4.314 -3.857 1.00 . B B . 49 LYS HE2 1 1 9 6875 2 2 28 LYS HE3 H -15.651 -5.008 -2.283 1.00 . B B . 49 LYS HE3 1 1 9 6876 2 2 28 LYS HG2 H -15.254 -3.054 -0.371 1.00 . B B . 49 LYS HG2 1 1 9 6877 2 2 28 LYS HG3 H -13.751 -2.322 -0.937 1.00 . B B . 49 LYS HG3 1 1 9 6878 2 2 28 LYS HZ1 H -17.957 -3.466 -3.108 1.00 . B B . 49 LYS HZ1 1 1 9 6879 2 2 28 LYS HZ2 H -17.319 -3.043 -1.592 1.00 . B B . 49 LYS HZ2 1 1 9 6880 2 2 28 LYS HZ3 H -17.815 -4.640 -1.892 1.00 . B B . 49 LYS HZ3 1 1 9 6881 2 2 28 LYS N N -11.656 -5.484 -0.243 1.00 . B B . 49 LYS N 1 1 9 6882 2 2 28 LYS NZ N -17.378 -3.794 -2.310 1.00 . B B . 49 LYS NZ 1 1 9 6883 2 2 28 LYS O O -13.941 -5.363 1.715 1.00 . B B . 49 LYS O 1 1 9 6884 2 2 29 PRO C C -14.651 -2.977 3.753 1.00 . B B . 50 PRO C 1 1 9 6885 2 2 29 PRO CA C -13.222 -3.520 3.665 1.00 . B B . 50 PRO CA 1 1 9 6886 2 2 29 PRO CB C -12.231 -2.573 4.345 1.00 . B B . 50 PRO CB 1 1 9 6887 2 2 29 PRO CD C -11.836 -2.469 1.910 1.00 . B B . 50 PRO CD 1 1 9 6888 2 2 29 PRO CG C -11.633 -1.694 3.224 1.00 . B B . 50 PRO CG 1 1 9 6889 2 2 29 PRO HA H -13.155 -4.498 4.103 1.00 . B B . 50 PRO HA 1 1 9 6890 2 2 29 PRO HB2 H -12.746 -1.958 5.071 1.00 . B B . 50 PRO HB2 1 1 9 6891 2 2 29 PRO HB3 H -11.445 -3.136 4.824 1.00 . B B . 50 PRO HB3 1 1 9 6892 2 2 29 PRO HD2 H -12.269 -1.829 1.157 1.00 . B B . 50 PRO HD2 1 1 9 6893 2 2 29 PRO HD3 H -10.902 -2.885 1.567 1.00 . B B . 50 PRO HD3 1 1 9 6894 2 2 29 PRO HG2 H -12.152 -0.745 3.182 1.00 . B B . 50 PRO HG2 1 1 9 6895 2 2 29 PRO HG3 H -10.580 -1.536 3.396 1.00 . B B . 50 PRO HG3 1 1 9 6896 2 2 29 PRO N N -12.770 -3.553 2.266 1.00 . B B . 50 PRO N 1 1 9 6897 2 2 29 PRO O O -15.271 -2.671 2.753 1.00 . B B . 50 PRO O 1 1 9 6898 2 2 30 THR C C -16.554 -1.107 6.006 1.00 . B B . 51 THR C 1 1 9 6899 2 2 30 THR CA C -16.565 -2.330 5.087 1.00 . B B . 51 THR CA 1 1 9 6900 2 2 30 THR CB C -17.459 -3.414 5.693 1.00 . B B . 51 THR CB 1 1 9 6901 2 2 30 THR CG2 C -17.374 -4.682 4.841 1.00 . B B . 51 THR CG2 1 1 9 6902 2 2 30 THR H H -14.663 -3.107 5.734 1.00 . B B . 51 THR H 1 1 9 6903 2 2 30 THR HA H -16.948 -2.048 4.118 1.00 . B B . 51 THR HA 1 1 9 6904 2 2 30 THR HB H -18.481 -3.068 5.714 1.00 . B B . 51 THR HB 1 1 9 6905 2 2 30 THR HG1 H -17.497 -3.116 7.614 1.00 . B B . 51 THR HG1 1 1 9 6906 2 2 30 THR HG21 H -16.339 -4.963 4.717 1.00 . B B . 51 THR HG21 1 1 9 6907 2 2 30 THR HG22 H -17.816 -4.496 3.873 1.00 . B B . 51 THR HG22 1 1 9 6908 2 2 30 THR HG23 H -17.908 -5.482 5.332 1.00 . B B . 51 THR HG23 1 1 9 6909 2 2 30 THR N N -15.178 -2.854 4.940 1.00 . B B . 51 THR N 1 1 9 6910 2 2 30 THR O O -15.483 -0.742 6.461 1.00 . B B . 51 THR O 1 1 9 6911 2 2 30 THR OXT O -17.618 -0.557 6.240 1.00 . B B . 51 THR OXT 1 1 9 6912 2 2 30 THR OG1 O -17.025 -3.699 7.015 1.00 . B B . 51 THR OG1 1 1 10 6913 1 1 1 GLY C C -6.747 8.358 2.054 1.00 . A A . 1 GLY C 1 1 10 6914 1 1 1 GLY CA C -8.145 8.681 1.648 1.00 . A A . 1 GLY CA 1 1 10 6915 1 1 1 GLY H1 H -9.722 9.844 2.450 1.00 . A A . 1 GLY H1 1 1 10 6916 1 1 1 GLY H2 H -8.812 10.653 1.265 1.00 . A A . 1 GLY H2 1 1 10 6917 1 1 1 GLY H3 H -8.177 10.440 2.826 1.00 . A A . 1 GLY H3 1 1 10 6918 1 1 1 GLY HA2 H -8.378 7.964 2.266 1.00 . A A . 1 GLY HA2 1 1 10 6919 1 1 1 GLY HA3 H -8.506 8.479 0.557 1.00 . A A . 1 GLY HA3 1 1 10 6920 1 1 1 GLY N N -8.763 10.011 2.082 1.00 . A A . 1 GLY N 1 1 10 6921 1 1 1 GLY O O -6.127 9.082 2.809 1.00 . A A . 1 GLY O 1 1 10 6922 1 1 2 ILE C C -3.892 7.193 0.754 1.00 . A A . 2 ILE C 1 1 10 6923 1 1 2 ILE CA C -4.817 6.896 1.937 1.00 . A A . 2 ILE CA 1 1 10 6924 1 1 2 ILE CB C -4.758 5.397 2.322 1.00 . A A . 2 ILE CB 1 1 10 6925 1 1 2 ILE CD1 C -2.799 4.209 1.314 1.00 . A A . 2 ILE CD1 1 1 10 6926 1 1 2 ILE CG1 C -4.287 4.522 1.149 1.00 . A A . 2 ILE CG1 1 1 10 6927 1 1 2 ILE CG2 C -6.146 4.925 2.737 1.00 . A A . 2 ILE CG2 1 1 10 6928 1 1 2 ILE H H -6.730 6.701 0.960 1.00 . A A . 2 ILE H 1 1 10 6929 1 1 2 ILE HA H -4.506 7.491 2.783 1.00 . A A . 2 ILE HA 1 1 10 6930 1 1 2 ILE HB H -4.080 5.274 3.155 1.00 . A A . 2 ILE HB 1 1 10 6931 1 1 2 ILE HD11 H -2.591 3.229 0.909 1.00 . A A . 2 ILE HD11 1 1 10 6932 1 1 2 ILE HD12 H -2.542 4.227 2.363 1.00 . A A . 2 ILE HD12 1 1 10 6933 1 1 2 ILE HD13 H -2.215 4.948 0.787 1.00 . A A . 2 ILE HD13 1 1 10 6934 1 1 2 ILE HG12 H -4.848 3.598 1.146 1.00 . A A . 2 ILE HG12 1 1 10 6935 1 1 2 ILE HG13 H -4.446 5.040 0.216 1.00 . A A . 2 ILE HG13 1 1 10 6936 1 1 2 ILE HG21 H -6.634 5.703 3.302 1.00 . A A . 2 ILE HG21 1 1 10 6937 1 1 2 ILE HG22 H -6.057 4.037 3.343 1.00 . A A . 2 ILE HG22 1 1 10 6938 1 1 2 ILE HG23 H -6.725 4.703 1.853 1.00 . A A . 2 ILE HG23 1 1 10 6939 1 1 2 ILE N N -6.213 7.271 1.568 1.00 . A A . 2 ILE N 1 1 10 6940 1 1 2 ILE O O -2.684 7.123 0.864 1.00 . A A . 2 ILE O 1 1 10 6941 1 1 3 VAL C C -2.995 9.186 -1.452 1.00 . A A . 3 VAL C 1 1 10 6942 1 1 3 VAL CA C -3.608 7.790 -1.568 1.00 . A A . 3 VAL CA 1 1 10 6943 1 1 3 VAL CB C -4.468 7.728 -2.834 1.00 . A A . 3 VAL CB 1 1 10 6944 1 1 3 VAL CG1 C -5.378 6.510 -2.766 1.00 . A A . 3 VAL CG1 1 1 10 6945 1 1 3 VAL CG2 C -5.332 8.991 -2.939 1.00 . A A . 3 VAL CG2 1 1 10 6946 1 1 3 VAL H H -5.429 7.549 -0.453 1.00 . A A . 3 VAL H 1 1 10 6947 1 1 3 VAL HA H -2.832 7.049 -1.621 1.00 . A A . 3 VAL HA 1 1 10 6948 1 1 3 VAL HB H -3.828 7.653 -3.702 1.00 . A A . 3 VAL HB 1 1 10 6949 1 1 3 VAL HG11 H -6.405 6.835 -2.691 1.00 . A A . 3 VAL HG11 1 1 10 6950 1 1 3 VAL HG12 H -5.121 5.922 -1.899 1.00 . A A . 3 VAL HG12 1 1 10 6951 1 1 3 VAL HG13 H -5.251 5.916 -3.658 1.00 . A A . 3 VAL HG13 1 1 10 6952 1 1 3 VAL HG21 H -5.776 9.204 -1.978 1.00 . A A . 3 VAL HG21 1 1 10 6953 1 1 3 VAL HG22 H -6.112 8.833 -3.668 1.00 . A A . 3 VAL HG22 1 1 10 6954 1 1 3 VAL HG23 H -4.717 9.825 -3.245 1.00 . A A . 3 VAL HG23 1 1 10 6955 1 1 3 VAL N N -4.453 7.509 -0.380 1.00 . A A . 3 VAL N 1 1 10 6956 1 1 3 VAL O O -1.888 9.437 -1.886 1.00 . A A . 3 VAL O 1 1 10 6957 1 1 4 GLU C C -1.975 11.544 0.106 1.00 . A A . 4 GLU C 1 1 10 6958 1 1 4 GLU CA C -3.237 11.497 -0.759 1.00 . A A . 4 GLU CA 1 1 10 6959 1 1 4 GLU CB C -4.331 12.353 -0.116 1.00 . A A . 4 GLU CB 1 1 10 6960 1 1 4 GLU CD C -6.647 13.114 -0.687 1.00 . A A . 4 GLU CD 1 1 10 6961 1 1 4 GLU CG C -5.700 11.913 -0.645 1.00 . A A . 4 GLU CG 1 1 10 6962 1 1 4 GLU H H -4.624 9.861 -0.573 1.00 . A A . 4 GLU H 1 1 10 6963 1 1 4 GLU HA H -3.011 11.888 -1.739 1.00 . A A . 4 GLU HA 1 1 10 6964 1 1 4 GLU HB2 H -4.300 12.229 0.957 1.00 . A A . 4 GLU HB2 1 1 10 6965 1 1 4 GLU HB3 H -4.168 13.391 -0.364 1.00 . A A . 4 GLU HB3 1 1 10 6966 1 1 4 GLU HG2 H -5.586 11.507 -1.641 1.00 . A A . 4 GLU HG2 1 1 10 6967 1 1 4 GLU HG3 H -6.110 11.155 0.005 1.00 . A A . 4 GLU HG3 1 1 10 6968 1 1 4 GLU N N -3.731 10.097 -0.892 1.00 . A A . 4 GLU N 1 1 10 6969 1 1 4 GLU O O -1.309 12.557 0.182 1.00 . A A . 4 GLU O 1 1 10 6970 1 1 4 GLU OE1 O -6.156 14.229 -0.749 1.00 . A A . 4 GLU OE1 1 1 10 6971 1 1 4 GLU OE2 O -7.848 12.898 -0.657 1.00 . A A . 4 GLU OE2 1 1 10 6972 1 1 5 GLN C C 0.712 9.705 0.942 1.00 . A A . 5 GLN C 1 1 10 6973 1 1 5 GLN CA C -0.417 10.486 1.620 1.00 . A A . 5 GLN CA 1 1 10 6974 1 1 5 GLN CB C -0.735 9.854 2.975 1.00 . A A . 5 GLN CB 1 1 10 6975 1 1 5 GLN CD C 0.969 11.415 3.930 1.00 . A A . 5 GLN CD 1 1 10 6976 1 1 5 GLN CG C -0.451 10.866 4.086 1.00 . A A . 5 GLN CG 1 1 10 6977 1 1 5 GLN H H -2.185 9.659 0.699 1.00 . A A . 5 GLN H 1 1 10 6978 1 1 5 GLN HA H -0.102 11.508 1.770 1.00 . A A . 5 GLN HA 1 1 10 6979 1 1 5 GLN HB2 H -1.777 9.570 3.003 1.00 . A A . 5 GLN HB2 1 1 10 6980 1 1 5 GLN HB3 H -0.119 8.980 3.121 1.00 . A A . 5 GLN HB3 1 1 10 6981 1 1 5 GLN HE21 H 1.773 10.099 5.180 1.00 . A A . 5 GLN HE21 1 1 10 6982 1 1 5 GLN HE22 H 2.860 11.208 4.496 1.00 . A A . 5 GLN HE22 1 1 10 6983 1 1 5 GLN HG2 H -1.160 11.679 4.021 1.00 . A A . 5 GLN HG2 1 1 10 6984 1 1 5 GLN HG3 H -0.545 10.383 5.047 1.00 . A A . 5 GLN HG3 1 1 10 6985 1 1 5 GLN N N -1.638 10.470 0.764 1.00 . A A . 5 GLN N 1 1 10 6986 1 1 5 GLN NE2 N 1.948 10.861 4.590 1.00 . A A . 5 GLN NE2 1 1 10 6987 1 1 5 GLN O O 1.872 10.043 1.067 1.00 . A A . 5 GLN O 1 1 10 6988 1 1 5 GLN OE1 O 1.190 12.360 3.198 1.00 . A A . 5 GLN OE1 1 1 10 6989 1 1 6 CYS C C 1.551 8.279 -1.913 1.00 . A A . 6 CYS C 1 1 10 6990 1 1 6 CYS CA C 1.450 7.865 -0.445 1.00 . A A . 6 CYS CA 1 1 10 6991 1 1 6 CYS CB C 1.105 6.378 -0.355 1.00 . A A . 6 CYS CB 1 1 10 6992 1 1 6 CYS H H -0.554 8.400 0.141 1.00 . A A . 6 CYS H 1 1 10 6993 1 1 6 CYS HA H 2.396 8.043 0.043 1.00 . A A . 6 CYS HA 1 1 10 6994 1 1 6 CYS HB2 H 0.153 6.199 -0.834 1.00 . A A . 6 CYS HB2 1 1 10 6995 1 1 6 CYS HB3 H 1.871 5.800 -0.849 1.00 . A A . 6 CYS HB3 1 1 10 6996 1 1 6 CYS N N 0.387 8.662 0.229 1.00 . A A . 6 CYS N 1 1 10 6997 1 1 6 CYS O O 2.538 8.025 -2.575 1.00 . A A . 6 CYS O 1 1 10 6998 1 1 6 CYS SG S 1.007 5.891 1.385 1.00 . A A . 6 CYS SG 1 1 10 6999 1 1 7 CYS C C 1.257 10.706 -3.955 1.00 . A A . 7 CYS C 1 1 10 7000 1 1 7 CYS CA C 0.572 9.347 -3.853 1.00 . A A . 7 CYS CA 1 1 10 7001 1 1 7 CYS CB C -0.853 9.452 -4.384 1.00 . A A . 7 CYS CB 1 1 10 7002 1 1 7 CYS H H -0.249 9.111 -1.877 1.00 . A A . 7 CYS H 1 1 10 7003 1 1 7 CYS HA H 1.125 8.622 -4.439 1.00 . A A . 7 CYS HA 1 1 10 7004 1 1 7 CYS HB2 H -1.412 8.574 -4.089 1.00 . A A . 7 CYS HB2 1 1 10 7005 1 1 7 CYS HB3 H -1.327 10.332 -3.976 1.00 . A A . 7 CYS HB3 1 1 10 7006 1 1 7 CYS N N 0.537 8.916 -2.428 1.00 . A A . 7 CYS N 1 1 10 7007 1 1 7 CYS O O 1.962 10.985 -4.903 1.00 . A A . 7 CYS O 1 1 10 7008 1 1 7 CYS SG S -0.816 9.567 -6.186 1.00 . A A . 7 CYS SG 1 1 10 7009 1 1 8 THR C C 3.093 12.739 -2.339 1.00 . A A . 8 THR C 1 1 10 7010 1 1 8 THR CA C 1.735 12.880 -3.020 1.00 . A A . 8 THR CA 1 1 10 7011 1 1 8 THR CB C 0.879 13.911 -2.277 1.00 . A A . 8 THR CB 1 1 10 7012 1 1 8 THR CG2 C 1.005 13.700 -0.767 1.00 . A A . 8 THR CG2 1 1 10 7013 1 1 8 THR H H 0.507 11.305 -2.218 1.00 . A A . 8 THR H 1 1 10 7014 1 1 8 THR HA H 1.873 13.188 -4.047 1.00 . A A . 8 THR HA 1 1 10 7015 1 1 8 THR HB H -0.154 13.795 -2.567 1.00 . A A . 8 THR HB 1 1 10 7016 1 1 8 THR HG1 H 2.026 15.457 -2.008 1.00 . A A . 8 THR HG1 1 1 10 7017 1 1 8 THR HG21 H 1.154 12.650 -0.561 1.00 . A A . 8 THR HG21 1 1 10 7018 1 1 8 THR HG22 H 0.104 14.039 -0.279 1.00 . A A . 8 THR HG22 1 1 10 7019 1 1 8 THR HG23 H 1.849 14.263 -0.394 1.00 . A A . 8 THR HG23 1 1 10 7020 1 1 8 THR N N 1.070 11.551 -2.981 1.00 . A A . 8 THR N 1 1 10 7021 1 1 8 THR O O 4.049 13.411 -2.669 1.00 . A A . 8 THR O 1 1 10 7022 1 1 8 THR OG1 O 1.321 15.218 -2.614 1.00 . A A . 8 THR OG1 1 1 10 7023 1 1 9 SER C C 4.757 10.115 -0.706 1.00 . A A . 9 SER C 1 1 10 7024 1 1 9 SER CA C 4.452 11.610 -0.679 1.00 . A A . 9 SER CA 1 1 10 7025 1 1 9 SER CB C 4.322 12.074 0.771 1.00 . A A . 9 SER CB 1 1 10 7026 1 1 9 SER H H 2.384 11.310 -1.164 1.00 . A A . 9 SER H 1 1 10 7027 1 1 9 SER HA H 5.249 12.153 -1.166 1.00 . A A . 9 SER HA 1 1 10 7028 1 1 9 SER HB2 H 3.736 11.361 1.327 1.00 . A A . 9 SER HB2 1 1 10 7029 1 1 9 SER HB3 H 5.306 12.151 1.213 1.00 . A A . 9 SER HB3 1 1 10 7030 1 1 9 SER HG H 4.259 13.961 1.242 1.00 . A A . 9 SER HG 1 1 10 7031 1 1 9 SER N N 3.173 11.844 -1.395 1.00 . A A . 9 SER N 1 1 10 7032 1 1 9 SER O O 3.905 9.305 -1.011 1.00 . A A . 9 SER O 1 1 10 7033 1 1 9 SER OG O 3.674 13.339 0.803 1.00 . A A . 9 SER OG 1 1 10 7034 1 1 10 ILE C C 6.135 7.725 1.006 1.00 . A A . 10 ILE C 1 1 10 7035 1 1 10 ILE CA C 6.310 8.297 -0.407 1.00 . A A . 10 ILE CA 1 1 10 7036 1 1 10 ILE CB C 7.760 8.139 -0.899 1.00 . A A . 10 ILE CB 1 1 10 7037 1 1 10 ILE CD1 C 8.177 9.198 -3.129 1.00 . A A . 10 ILE CD1 1 1 10 7038 1 1 10 ILE CG1 C 7.749 7.916 -2.414 1.00 . A A . 10 ILE CG1 1 1 10 7039 1 1 10 ILE CG2 C 8.436 6.940 -0.230 1.00 . A A . 10 ILE CG2 1 1 10 7040 1 1 10 ILE H H 6.636 10.408 -0.151 1.00 . A A . 10 ILE H 1 1 10 7041 1 1 10 ILE HA H 5.645 7.779 -1.083 1.00 . A A . 10 ILE HA 1 1 10 7042 1 1 10 ILE HB H 8.315 9.037 -0.673 1.00 . A A . 10 ILE HB 1 1 10 7043 1 1 10 ILE HD11 H 9.149 9.504 -2.769 1.00 . A A . 10 ILE HD11 1 1 10 7044 1 1 10 ILE HD12 H 7.458 9.977 -2.930 1.00 . A A . 10 ILE HD12 1 1 10 7045 1 1 10 ILE HD13 H 8.227 9.016 -4.193 1.00 . A A . 10 ILE HD13 1 1 10 7046 1 1 10 ILE HG12 H 8.431 7.117 -2.664 1.00 . A A . 10 ILE HG12 1 1 10 7047 1 1 10 ILE HG13 H 6.751 7.649 -2.728 1.00 . A A . 10 ILE HG13 1 1 10 7048 1 1 10 ILE HG21 H 8.336 7.021 0.842 1.00 . A A . 10 ILE HG21 1 1 10 7049 1 1 10 ILE HG22 H 9.482 6.927 -0.494 1.00 . A A . 10 ILE HG22 1 1 10 7050 1 1 10 ILE HG23 H 7.965 6.030 -0.569 1.00 . A A . 10 ILE HG23 1 1 10 7051 1 1 10 ILE N N 5.961 9.741 -0.394 1.00 . A A . 10 ILE N 1 1 10 7052 1 1 10 ILE O O 6.652 8.252 1.971 1.00 . A A . 10 ILE O 1 1 10 7053 1 1 11 CYS C C 6.185 4.894 2.678 1.00 . A A . 11 CYS C 1 1 10 7054 1 1 11 CYS CA C 5.191 6.040 2.470 1.00 . A A . 11 CYS CA 1 1 10 7055 1 1 11 CYS CB C 3.765 5.492 2.558 1.00 . A A . 11 CYS CB 1 1 10 7056 1 1 11 CYS H H 4.997 6.244 0.336 1.00 . A A . 11 CYS H 1 1 10 7057 1 1 11 CYS HA H 5.337 6.789 3.234 1.00 . A A . 11 CYS HA 1 1 10 7058 1 1 11 CYS HB2 H 3.633 4.715 1.820 1.00 . A A . 11 CYS HB2 1 1 10 7059 1 1 11 CYS HB3 H 3.598 5.083 3.544 1.00 . A A . 11 CYS HB3 1 1 10 7060 1 1 11 CYS N N 5.405 6.650 1.128 1.00 . A A . 11 CYS N 1 1 10 7061 1 1 11 CYS O O 6.934 4.539 1.790 1.00 . A A . 11 CYS O 1 1 10 7062 1 1 11 CYS SG S 2.579 6.823 2.248 1.00 . A A . 11 CYS SG 1 1 10 7063 1 1 12 SER C C 6.349 1.873 4.152 1.00 . A A . 12 SER C 1 1 10 7064 1 1 12 SER CA C 7.132 3.188 4.118 1.00 . A A . 12 SER CA 1 1 10 7065 1 1 12 SER CB C 7.812 3.414 5.468 1.00 . A A . 12 SER CB 1 1 10 7066 1 1 12 SER H H 5.578 4.615 4.546 1.00 . A A . 12 SER H 1 1 10 7067 1 1 12 SER HA H 7.880 3.145 3.339 1.00 . A A . 12 SER HA 1 1 10 7068 1 1 12 SER HB2 H 8.690 2.794 5.540 1.00 . A A . 12 SER HB2 1 1 10 7069 1 1 12 SER HB3 H 8.101 4.453 5.553 1.00 . A A . 12 SER HB3 1 1 10 7070 1 1 12 SER HG H 7.080 3.654 7.254 1.00 . A A . 12 SER HG 1 1 10 7071 1 1 12 SER N N 6.193 4.313 3.846 1.00 . A A . 12 SER N 1 1 10 7072 1 1 12 SER O O 5.199 1.835 4.541 1.00 . A A . 12 SER O 1 1 10 7073 1 1 12 SER OG O 6.909 3.072 6.510 1.00 . A A . 12 SER OG 1 1 10 7074 1 1 13 LEU C C 5.460 -0.669 5.059 1.00 . A A . 13 LEU C 1 1 10 7075 1 1 13 LEU CA C 6.245 -0.516 3.755 1.00 . A A . 13 LEU CA 1 1 10 7076 1 1 13 LEU CB C 7.263 -1.651 3.642 1.00 . A A . 13 LEU CB 1 1 10 7077 1 1 13 LEU CD1 C 7.447 -2.493 1.297 1.00 . A A . 13 LEU CD1 1 1 10 7078 1 1 13 LEU CD2 C 7.074 -4.094 3.178 1.00 . A A . 13 LEU CD2 1 1 10 7079 1 1 13 LEU CG C 6.755 -2.695 2.647 1.00 . A A . 13 LEU CG 1 1 10 7080 1 1 13 LEU H H 7.887 0.843 3.434 1.00 . A A . 13 LEU H 1 1 10 7081 1 1 13 LEU HA H 5.564 -0.560 2.917 1.00 . A A . 13 LEU HA 1 1 10 7082 1 1 13 LEU HB2 H 8.207 -1.254 3.299 1.00 . A A . 13 LEU HB2 1 1 10 7083 1 1 13 LEU HB3 H 7.395 -2.112 4.610 1.00 . A A . 13 LEU HB3 1 1 10 7084 1 1 13 LEU HD11 H 6.747 -2.692 0.499 1.00 . A A . 13 LEU HD11 1 1 10 7085 1 1 13 LEU HD12 H 8.284 -3.171 1.218 1.00 . A A . 13 LEU HD12 1 1 10 7086 1 1 13 LEU HD13 H 7.800 -1.476 1.221 1.00 . A A . 13 LEU HD13 1 1 10 7087 1 1 13 LEU HD21 H 6.417 -4.324 4.004 1.00 . A A . 13 LEU HD21 1 1 10 7088 1 1 13 LEU HD22 H 8.100 -4.125 3.516 1.00 . A A . 13 LEU HD22 1 1 10 7089 1 1 13 LEU HD23 H 6.932 -4.820 2.391 1.00 . A A . 13 LEU HD23 1 1 10 7090 1 1 13 LEU HG H 5.685 -2.589 2.525 1.00 . A A . 13 LEU HG 1 1 10 7091 1 1 13 LEU N N 6.960 0.793 3.746 1.00 . A A . 13 LEU N 1 1 10 7092 1 1 13 LEU O O 4.430 -1.312 5.103 1.00 . A A . 13 LEU O 1 1 10 7093 1 1 14 TYR C C 3.832 0.436 7.289 1.00 . A A . 14 TYR C 1 1 10 7094 1 1 14 TYR CA C 5.216 -0.197 7.421 1.00 . A A . 14 TYR CA 1 1 10 7095 1 1 14 TYR CB C 6.008 0.529 8.510 1.00 . A A . 14 TYR CB 1 1 10 7096 1 1 14 TYR CD1 C 7.566 -1.514 8.734 1.00 . A A . 14 TYR CD1 1 1 10 7097 1 1 14 TYR CD2 C 8.577 0.696 8.593 1.00 . A A . 14 TYR CD2 1 1 10 7098 1 1 14 TYR CE1 C 8.842 -2.083 8.826 1.00 . A A . 14 TYR CE1 1 1 10 7099 1 1 14 TYR CE2 C 9.847 0.110 8.685 1.00 . A A . 14 TYR CE2 1 1 10 7100 1 1 14 TYR CG C 7.413 -0.108 8.618 1.00 . A A . 14 TYR CG 1 1 10 7101 1 1 14 TYR CZ C 9.978 -1.274 8.802 1.00 . A A . 14 TYR CZ 1 1 10 7102 1 1 14 TYR H H 6.770 0.430 6.068 1.00 . A A . 14 TYR H 1 1 10 7103 1 1 14 TYR HA H 5.112 -1.239 7.686 1.00 . A A . 14 TYR HA 1 1 10 7104 1 1 14 TYR HB2 H 6.077 1.586 8.251 1.00 . A A . 14 TYR HB2 1 1 10 7105 1 1 14 TYR HB3 H 5.476 0.440 9.455 1.00 . A A . 14 TYR HB3 1 1 10 7106 1 1 14 TYR HD1 H 6.710 -2.162 8.751 1.00 . A A . 14 TYR HD1 1 1 10 7107 1 1 14 TYR HD2 H 8.506 1.757 8.499 1.00 . A A . 14 TYR HD2 1 1 10 7108 1 1 14 TYR HE1 H 8.947 -3.154 8.913 1.00 . A A . 14 TYR HE1 1 1 10 7109 1 1 14 TYR HE2 H 10.728 0.733 8.667 1.00 . A A . 14 TYR HE2 1 1 10 7110 1 1 14 TYR HH H 11.504 -2.110 8.014 1.00 . A A . 14 TYR HH 1 1 10 7111 1 1 14 TYR N N 5.937 -0.083 6.123 1.00 . A A . 14 TYR N 1 1 10 7112 1 1 14 TYR O O 2.824 -0.199 7.531 1.00 . A A . 14 TYR O 1 1 10 7113 1 1 14 TYR OH O 11.232 -1.843 8.895 1.00 . A A . 14 TYR OH 1 1 10 7114 1 1 15 GLN C C 1.598 1.557 5.760 1.00 . A A . 15 GLN C 1 1 10 7115 1 1 15 GLN CA C 2.445 2.345 6.759 1.00 . A A . 15 GLN CA 1 1 10 7116 1 1 15 GLN CB C 2.633 3.779 6.257 1.00 . A A . 15 GLN CB 1 1 10 7117 1 1 15 GLN CD C 3.948 5.204 7.840 1.00 . A A . 15 GLN CD 1 1 10 7118 1 1 15 GLN CG C 2.543 4.751 7.437 1.00 . A A . 15 GLN CG 1 1 10 7119 1 1 15 GLN H H 4.593 2.178 6.713 1.00 . A A . 15 GLN H 1 1 10 7120 1 1 15 GLN HA H 1.944 2.358 7.716 1.00 . A A . 15 GLN HA 1 1 10 7121 1 1 15 GLN HB2 H 3.600 3.872 5.785 1.00 . A A . 15 GLN HB2 1 1 10 7122 1 1 15 GLN HB3 H 1.859 4.013 5.542 1.00 . A A . 15 GLN HB3 1 1 10 7123 1 1 15 GLN HE21 H 3.294 6.508 9.188 1.00 . A A . 15 GLN HE21 1 1 10 7124 1 1 15 GLN HE22 H 4.981 6.415 9.028 1.00 . A A . 15 GLN HE22 1 1 10 7125 1 1 15 GLN HG2 H 1.956 5.611 7.150 1.00 . A A . 15 GLN HG2 1 1 10 7126 1 1 15 GLN HG3 H 2.072 4.258 8.274 1.00 . A A . 15 GLN HG3 1 1 10 7127 1 1 15 GLN N N 3.770 1.682 6.905 1.00 . A A . 15 GLN N 1 1 10 7128 1 1 15 GLN NE2 N 4.085 6.118 8.762 1.00 . A A . 15 GLN NE2 1 1 10 7129 1 1 15 GLN O O 0.406 1.396 5.936 1.00 . A A . 15 GLN O 1 1 10 7130 1 1 15 GLN OE1 O 4.931 4.722 7.313 1.00 . A A . 15 GLN OE1 1 1 10 7131 1 1 16 LEU C C 0.946 -1.021 4.378 1.00 . A A . 16 LEU C 1 1 10 7132 1 1 16 LEU CA C 1.420 0.271 3.723 1.00 . A A . 16 LEU CA 1 1 10 7133 1 1 16 LEU CB C 2.297 -0.059 2.514 1.00 . A A . 16 LEU CB 1 1 10 7134 1 1 16 LEU CD1 C 3.572 2.079 2.303 1.00 . A A . 16 LEU CD1 1 1 10 7135 1 1 16 LEU CD2 C 2.928 0.802 0.255 1.00 . A A . 16 LEU CD2 1 1 10 7136 1 1 16 LEU CG C 2.493 1.200 1.668 1.00 . A A . 16 LEU CG 1 1 10 7137 1 1 16 LEU H H 3.165 1.187 4.593 1.00 . A A . 16 LEU H 1 1 10 7138 1 1 16 LEU HA H 0.562 0.844 3.405 1.00 . A A . 16 LEU HA 1 1 10 7139 1 1 16 LEU HB2 H 3.257 -0.420 2.853 1.00 . A A . 16 LEU HB2 1 1 10 7140 1 1 16 LEU HB3 H 1.817 -0.820 1.917 1.00 . A A . 16 LEU HB3 1 1 10 7141 1 1 16 LEU HD11 H 3.184 2.534 3.202 1.00 . A A . 16 LEU HD11 1 1 10 7142 1 1 16 LEU HD12 H 3.865 2.850 1.606 1.00 . A A . 16 LEU HD12 1 1 10 7143 1 1 16 LEU HD13 H 4.431 1.472 2.549 1.00 . A A . 16 LEU HD13 1 1 10 7144 1 1 16 LEU HD21 H 4.005 0.833 0.188 1.00 . A A . 16 LEU HD21 1 1 10 7145 1 1 16 LEU HD22 H 2.502 1.491 -0.459 1.00 . A A . 16 LEU HD22 1 1 10 7146 1 1 16 LEU HD23 H 2.583 -0.199 0.039 1.00 . A A . 16 LEU HD23 1 1 10 7147 1 1 16 LEU HG H 1.565 1.748 1.620 1.00 . A A . 16 LEU HG 1 1 10 7148 1 1 16 LEU N N 2.201 1.055 4.717 1.00 . A A . 16 LEU N 1 1 10 7149 1 1 16 LEU O O -0.172 -1.456 4.182 1.00 . A A . 16 LEU O 1 1 10 7150 1 1 17 GLU C C 0.095 -2.595 6.650 1.00 . A A . 17 GLU C 1 1 10 7151 1 1 17 GLU CA C 1.362 -2.883 5.848 1.00 . A A . 17 GLU CA 1 1 10 7152 1 1 17 GLU CB C 2.483 -3.352 6.776 1.00 . A A . 17 GLU CB 1 1 10 7153 1 1 17 GLU CD C 2.908 -5.813 6.686 1.00 . A A . 17 GLU CD 1 1 10 7154 1 1 17 GLU CG C 3.281 -4.458 6.083 1.00 . A A . 17 GLU CG 1 1 10 7155 1 1 17 GLU H H 2.672 -1.264 5.331 1.00 . A A . 17 GLU H 1 1 10 7156 1 1 17 GLU HA H 1.158 -3.646 5.109 1.00 . A A . 17 GLU HA 1 1 10 7157 1 1 17 GLU HB2 H 3.136 -2.521 6.999 1.00 . A A . 17 GLU HB2 1 1 10 7158 1 1 17 GLU HB3 H 2.059 -3.732 7.690 1.00 . A A . 17 GLU HB3 1 1 10 7159 1 1 17 GLU HG2 H 3.051 -4.457 5.027 1.00 . A A . 17 GLU HG2 1 1 10 7160 1 1 17 GLU HG3 H 4.338 -4.282 6.221 1.00 . A A . 17 GLU HG3 1 1 10 7161 1 1 17 GLU N N 1.779 -1.633 5.171 1.00 . A A . 17 GLU N 1 1 10 7162 1 1 17 GLU O O -0.712 -3.469 6.898 1.00 . A A . 17 GLU O 1 1 10 7163 1 1 17 GLU OE1 O 3.373 -6.103 7.775 1.00 . A A . 17 GLU OE1 1 1 10 7164 1 1 17 GLU OE2 O 2.163 -6.538 6.047 1.00 . A A . 17 GLU OE2 1 1 10 7165 1 1 18 ASN C C -2.526 -1.056 6.886 1.00 . A A . 18 ASN C 1 1 10 7166 1 1 18 ASN CA C -1.312 -1.003 7.816 1.00 . A A . 18 ASN CA 1 1 10 7167 1 1 18 ASN CB C -1.159 0.411 8.382 1.00 . A A . 18 ASN CB 1 1 10 7168 1 1 18 ASN CG C -2.137 0.605 9.544 1.00 . A A . 18 ASN CG 1 1 10 7169 1 1 18 ASN H H 0.569 -0.671 6.822 1.00 . A A . 18 ASN H 1 1 10 7170 1 1 18 ASN HA H -1.447 -1.704 8.625 1.00 . A A . 18 ASN HA 1 1 10 7171 1 1 18 ASN HB2 H -0.147 0.549 8.735 1.00 . A A . 18 ASN HB2 1 1 10 7172 1 1 18 ASN HB3 H -1.373 1.134 7.610 1.00 . A A . 18 ASN HB3 1 1 10 7173 1 1 18 ASN HD21 H -3.510 1.504 8.425 1.00 . A A . 18 ASN HD21 1 1 10 7174 1 1 18 ASN HD22 H -3.916 1.320 10.063 1.00 . A A . 18 ASN HD22 1 1 10 7175 1 1 18 ASN N N -0.091 -1.363 7.044 1.00 . A A . 18 ASN N 1 1 10 7176 1 1 18 ASN ND2 N -3.283 1.192 9.326 1.00 . A A . 18 ASN ND2 1 1 10 7177 1 1 18 ASN O O -3.621 -1.382 7.297 1.00 . A A . 18 ASN O 1 1 10 7178 1 1 18 ASN OD1 O -1.856 0.219 10.661 1.00 . A A . 18 ASN OD1 1 1 10 7179 1 1 19 TYR C C -3.907 -2.244 4.465 1.00 . A A . 19 TYR C 1 1 10 7180 1 1 19 TYR CA C -3.483 -0.788 4.675 1.00 . A A . 19 TYR CA 1 1 10 7181 1 1 19 TYR CB C -3.055 -0.207 3.326 1.00 . A A . 19 TYR CB 1 1 10 7182 1 1 19 TYR CD1 C -2.268 1.787 4.806 1.00 . A A . 19 TYR CD1 1 1 10 7183 1 1 19 TYR CD2 C -1.442 1.652 2.518 1.00 . A A . 19 TYR CD2 1 1 10 7184 1 1 19 TYR CE1 C -1.527 2.961 4.989 1.00 . A A . 19 TYR CE1 1 1 10 7185 1 1 19 TYR CE2 C -0.711 2.826 2.723 1.00 . A A . 19 TYR CE2 1 1 10 7186 1 1 19 TYR CG C -2.240 1.104 3.553 1.00 . A A . 19 TYR CG 1 1 10 7187 1 1 19 TYR CZ C -0.753 3.478 3.953 1.00 . A A . 19 TYR CZ 1 1 10 7188 1 1 19 TYR H H -1.444 -0.488 5.312 1.00 . A A . 19 TYR H 1 1 10 7189 1 1 19 TYR HA H -4.311 -0.218 5.069 1.00 . A A . 19 TYR HA 1 1 10 7190 1 1 19 TYR HB2 H -2.449 -0.964 2.807 1.00 . A A . 19 TYR HB2 1 1 10 7191 1 1 19 TYR HB3 H -3.955 -0.007 2.727 1.00 . A A . 19 TYR HB3 1 1 10 7192 1 1 19 TYR HD1 H -2.849 1.419 5.631 1.00 . A A . 19 TYR HD1 1 1 10 7193 1 1 19 TYR HD2 H -1.384 1.182 1.568 1.00 . A A . 19 TYR HD2 1 1 10 7194 1 1 19 TYR HE1 H -1.557 3.468 5.941 1.00 . A A . 19 TYR HE1 1 1 10 7195 1 1 19 TYR HE2 H -0.109 3.229 1.921 1.00 . A A . 19 TYR HE2 1 1 10 7196 1 1 19 TYR HH H -0.357 5.295 3.528 1.00 . A A . 19 TYR HH 1 1 10 7197 1 1 19 TYR N N -2.339 -0.745 5.629 1.00 . A A . 19 TYR N 1 1 10 7198 1 1 19 TYR O O -5.062 -2.540 4.232 1.00 . A A . 19 TYR O 1 1 10 7199 1 1 19 TYR OH O -0.029 4.637 4.144 1.00 . A A . 19 TYR OH 1 1 10 7200 1 1 20 CYS C C -4.308 -5.040 5.384 1.00 . A A . 20 CYS C 1 1 10 7201 1 1 20 CYS CA C -3.305 -4.589 4.338 1.00 . A A . 20 CYS CA 1 1 10 7202 1 1 20 CYS CB C -2.020 -5.422 4.426 1.00 . A A . 20 CYS CB 1 1 10 7203 1 1 20 CYS H H -2.049 -2.892 4.727 1.00 . A A . 20 CYS H 1 1 10 7204 1 1 20 CYS HA H -3.735 -4.730 3.388 1.00 . A A . 20 CYS HA 1 1 10 7205 1 1 20 CYS HB2 H -1.315 -4.930 5.080 1.00 . A A . 20 CYS HB2 1 1 10 7206 1 1 20 CYS HB3 H -2.252 -6.401 4.819 1.00 . A A . 20 CYS HB3 1 1 10 7207 1 1 20 CYS N N -2.973 -3.154 4.540 1.00 . A A . 20 CYS N 1 1 10 7208 1 1 20 CYS O O -5.499 -4.829 5.267 1.00 . A A . 20 CYS O 1 1 10 7209 1 1 20 CYS SG S -1.291 -5.600 2.778 1.00 . A A . 20 CYS SG 1 1 10 7210 1 1 21 ASN C C -3.867 -6.698 8.624 1.00 . A A . 21 ASN C 1 1 10 7211 1 1 21 ASN CA C -4.719 -6.163 7.473 1.00 . A A . 21 ASN CA 1 1 10 7212 1 1 21 ASN CB C -5.600 -7.287 6.922 1.00 . A A . 21 ASN CB 1 1 10 7213 1 1 21 ASN CG C -6.568 -7.759 8.008 1.00 . A A . 21 ASN CG 1 1 10 7214 1 1 21 ASN H H -2.875 -5.809 6.429 1.00 . A A . 21 ASN H 1 1 10 7215 1 1 21 ASN HA H -5.343 -5.356 7.829 1.00 . A A . 21 ASN HA 1 1 10 7216 1 1 21 ASN HB2 H -6.160 -6.922 6.073 1.00 . A A . 21 ASN HB2 1 1 10 7217 1 1 21 ASN HB3 H -4.977 -8.114 6.614 1.00 . A A . 21 ASN HB3 1 1 10 7218 1 1 21 ASN HD21 H -7.685 -6.118 7.926 1.00 . A A . 21 ASN HD21 1 1 10 7219 1 1 21 ASN HD22 H -8.188 -7.284 9.052 1.00 . A A . 21 ASN HD22 1 1 10 7220 1 1 21 ASN N N -3.828 -5.664 6.391 1.00 . A A . 21 ASN N 1 1 10 7221 1 1 21 ASN ND2 N -7.563 -6.990 8.358 1.00 . A A . 21 ASN ND2 1 1 10 7222 1 1 21 ASN O O -3.189 -7.692 8.420 1.00 . A A . 21 ASN O 1 1 10 7223 1 1 21 ASN OXT O -3.904 -6.105 9.688 1.00 . A A . 21 ASN OXT 1 1 10 7224 1 1 21 ASN OD1 O -6.418 -8.839 8.544 1.00 . A A . 21 ASN OD1 1 1 10 7225 2 2 1 PHE C C 11.846 -1.156 -0.069 1.00 . B B . 22 PHE C 1 1 10 7226 2 2 1 PHE CA C 12.983 -2.144 -0.346 1.00 . B B . 22 PHE CA 1 1 10 7227 2 2 1 PHE CB C 12.415 -3.535 -0.675 1.00 . B B . 22 PHE CB 1 1 10 7228 2 2 1 PHE CD1 C 10.963 -2.745 -2.585 1.00 . B B . 22 PHE CD1 1 1 10 7229 2 2 1 PHE CD2 C 9.924 -3.934 -0.742 1.00 . B B . 22 PHE CD2 1 1 10 7230 2 2 1 PHE CE1 C 9.713 -2.615 -3.206 1.00 . B B . 22 PHE CE1 1 1 10 7231 2 2 1 PHE CE2 C 8.675 -3.803 -1.361 1.00 . B B . 22 PHE CE2 1 1 10 7232 2 2 1 PHE CG C 11.068 -3.406 -1.353 1.00 . B B . 22 PHE CG 1 1 10 7233 2 2 1 PHE CZ C 8.569 -3.144 -2.594 1.00 . B B . 22 PHE CZ 1 1 10 7234 2 2 1 PHE H1 H 14.840 -2.414 0.556 1.00 . B B . 22 PHE H1 1 1 10 7235 2 2 1 PHE H2 H 13.535 -3.016 1.463 1.00 . B B . 22 PHE H2 1 1 10 7236 2 2 1 PHE H3 H 13.819 -1.343 1.385 1.00 . B B . 22 PHE H3 1 1 10 7237 2 2 1 PHE HA H 13.565 -1.789 -1.184 1.00 . B B . 22 PHE HA 1 1 10 7238 2 2 1 PHE HB2 H 13.097 -4.052 -1.332 1.00 . B B . 22 PHE HB2 1 1 10 7239 2 2 1 PHE HB3 H 12.303 -4.099 0.238 1.00 . B B . 22 PHE HB3 1 1 10 7240 2 2 1 PHE HD1 H 11.846 -2.337 -3.055 1.00 . B B . 22 PHE HD1 1 1 10 7241 2 2 1 PHE HD2 H 10.006 -4.443 0.207 1.00 . B B . 22 PHE HD2 1 1 10 7242 2 2 1 PHE HE1 H 9.632 -2.107 -4.155 1.00 . B B . 22 PHE HE1 1 1 10 7243 2 2 1 PHE HE2 H 7.793 -4.211 -0.890 1.00 . B B . 22 PHE HE2 1 1 10 7244 2 2 1 PHE HZ H 7.606 -3.042 -3.071 1.00 . B B . 22 PHE HZ 1 1 10 7245 2 2 1 PHE N N 13.861 -2.237 0.855 1.00 . B B . 22 PHE N 1 1 10 7246 2 2 1 PHE O O 10.802 -1.518 0.436 1.00 . B B . 22 PHE O 1 1 10 7247 2 2 2 VAL C C 11.253 2.304 -1.087 1.00 . B B . 23 VAL C 1 1 10 7248 2 2 2 VAL CA C 10.977 1.100 -0.190 1.00 . B B . 23 VAL CA 1 1 10 7249 2 2 2 VAL CB C 10.949 1.507 1.298 1.00 . B B . 23 VAL CB 1 1 10 7250 2 2 2 VAL CG1 C 11.754 2.789 1.546 1.00 . B B . 23 VAL CG1 1 1 10 7251 2 2 2 VAL CG2 C 9.497 1.722 1.738 1.00 . B B . 23 VAL CG2 1 1 10 7252 2 2 2 VAL H H 12.888 0.345 -0.827 1.00 . B B . 23 VAL H 1 1 10 7253 2 2 2 VAL HA H 10.020 0.680 -0.459 1.00 . B B . 23 VAL HA 1 1 10 7254 2 2 2 VAL HB H 11.376 0.714 1.882 1.00 . B B . 23 VAL HB 1 1 10 7255 2 2 2 VAL HG11 H 11.091 3.641 1.516 1.00 . B B . 23 VAL HG11 1 1 10 7256 2 2 2 VAL HG12 H 12.511 2.893 0.784 1.00 . B B . 23 VAL HG12 1 1 10 7257 2 2 2 VAL HG13 H 12.225 2.734 2.516 1.00 . B B . 23 VAL HG13 1 1 10 7258 2 2 2 VAL HG21 H 8.889 0.903 1.386 1.00 . B B . 23 VAL HG21 1 1 10 7259 2 2 2 VAL HG22 H 9.127 2.648 1.327 1.00 . B B . 23 VAL HG22 1 1 10 7260 2 2 2 VAL HG23 H 9.452 1.765 2.816 1.00 . B B . 23 VAL HG23 1 1 10 7261 2 2 2 VAL N N 12.041 0.083 -0.411 1.00 . B B . 23 VAL N 1 1 10 7262 2 2 2 VAL O O 12.008 2.228 -2.035 1.00 . B B . 23 VAL O 1 1 10 7263 2 2 3 ASN C C 10.160 4.474 -2.963 1.00 . B B . 24 ASN C 1 1 10 7264 2 2 3 ASN CA C 10.880 4.626 -1.618 1.00 . B B . 24 ASN CA 1 1 10 7265 2 2 3 ASN CB C 12.382 4.793 -1.858 1.00 . B B . 24 ASN CB 1 1 10 7266 2 2 3 ASN CG C 12.783 6.246 -1.601 1.00 . B B . 24 ASN CG 1 1 10 7267 2 2 3 ASN H H 10.054 3.438 -0.015 1.00 . B B . 24 ASN H 1 1 10 7268 2 2 3 ASN HA H 10.500 5.493 -1.100 1.00 . B B . 24 ASN HA 1 1 10 7269 2 2 3 ASN HB2 H 12.927 4.145 -1.186 1.00 . B B . 24 ASN HB2 1 1 10 7270 2 2 3 ASN HB3 H 12.615 4.532 -2.879 1.00 . B B . 24 ASN HB3 1 1 10 7271 2 2 3 ASN HD21 H 13.602 5.851 0.164 1.00 . B B . 24 ASN HD21 1 1 10 7272 2 2 3 ASN HD22 H 13.658 7.479 -0.315 1.00 . B B . 24 ASN HD22 1 1 10 7273 2 2 3 ASN N N 10.651 3.409 -0.789 1.00 . B B . 24 ASN N 1 1 10 7274 2 2 3 ASN ND2 N 13.399 6.551 -0.492 1.00 . B B . 24 ASN ND2 1 1 10 7275 2 2 3 ASN O O 10.783 4.342 -3.998 1.00 . B B . 24 ASN O 1 1 10 7276 2 2 3 ASN OD1 O 12.534 7.112 -2.416 1.00 . B B . 24 ASN OD1 1 1 10 7277 2 2 4 GLN C C 6.872 5.271 -4.205 1.00 . B B . 25 GLN C 1 1 10 7278 2 2 4 GLN CA C 8.093 4.348 -4.230 1.00 . B B . 25 GLN CA 1 1 10 7279 2 2 4 GLN CB C 7.623 2.901 -4.379 1.00 . B B . 25 GLN CB 1 1 10 7280 2 2 4 GLN CD C 9.243 2.054 -6.081 1.00 . B B . 25 GLN CD 1 1 10 7281 2 2 4 GLN CG C 7.788 2.454 -5.833 1.00 . B B . 25 GLN CG 1 1 10 7282 2 2 4 GLN H H 8.372 4.600 -2.108 1.00 . B B . 25 GLN H 1 1 10 7283 2 2 4 GLN HA H 8.729 4.611 -5.063 1.00 . B B . 25 GLN HA 1 1 10 7284 2 2 4 GLN HB2 H 8.213 2.264 -3.736 1.00 . B B . 25 GLN HB2 1 1 10 7285 2 2 4 GLN HB3 H 6.583 2.832 -4.100 1.00 . B B . 25 GLN HB3 1 1 10 7286 2 2 4 GLN HE21 H 9.059 2.056 -8.058 1.00 . B B . 25 GLN HE21 1 1 10 7287 2 2 4 GLN HE22 H 10.601 1.653 -7.473 1.00 . B B . 25 GLN HE22 1 1 10 7288 2 2 4 GLN HG2 H 7.142 1.609 -6.025 1.00 . B B . 25 GLN HG2 1 1 10 7289 2 2 4 GLN HG3 H 7.523 3.268 -6.492 1.00 . B B . 25 GLN HG3 1 1 10 7290 2 2 4 GLN N N 8.854 4.493 -2.954 1.00 . B B . 25 GLN N 1 1 10 7291 2 2 4 GLN NE2 N 9.670 1.909 -7.305 1.00 . B B . 25 GLN NE2 1 1 10 7292 2 2 4 GLN O O 6.387 5.640 -3.155 1.00 . B B . 25 GLN O 1 1 10 7293 2 2 4 GLN OE1 O 10.001 1.870 -5.149 1.00 . B B . 25 GLN OE1 1 1 10 7294 2 2 5 HIS C C 4.027 5.738 -6.004 1.00 . B B . 26 HIS C 1 1 10 7295 2 2 5 HIS CA C 5.176 6.541 -5.377 1.00 . B B . 26 HIS CA 1 1 10 7296 2 2 5 HIS CB C 5.497 7.765 -6.236 1.00 . B B . 26 HIS CB 1 1 10 7297 2 2 5 HIS CD2 C 4.389 10.111 -5.894 1.00 . B B . 26 HIS CD2 1 1 10 7298 2 2 5 HIS CE1 C 5.051 10.428 -3.845 1.00 . B B . 26 HIS CE1 1 1 10 7299 2 2 5 HIS CG C 5.096 9.011 -5.501 1.00 . B B . 26 HIS CG 1 1 10 7300 2 2 5 HIS H H 6.769 5.334 -6.188 1.00 . B B . 26 HIS H 1 1 10 7301 2 2 5 HIS HA H 4.916 6.844 -4.373 1.00 . B B . 26 HIS HA 1 1 10 7302 2 2 5 HIS HB2 H 6.555 7.793 -6.448 1.00 . B B . 26 HIS HB2 1 1 10 7303 2 2 5 HIS HB3 H 4.944 7.705 -7.161 1.00 . B B . 26 HIS HB3 1 1 10 7304 2 2 5 HIS HD2 H 3.928 10.251 -6.860 1.00 . B B . 26 HIS HD2 1 1 10 7305 2 2 5 HIS HE1 H 5.220 10.875 -2.875 1.00 . B B . 26 HIS HE1 1 1 10 7306 2 2 5 HIS HE2 H 3.932 11.895 -4.837 1.00 . B B . 26 HIS HE2 1 1 10 7307 2 2 5 HIS N N 6.367 5.644 -5.350 1.00 . B B . 26 HIS N 1 1 10 7308 2 2 5 HIS ND1 N 5.506 9.223 -4.202 1.00 . B B . 26 HIS ND1 1 1 10 7309 2 2 5 HIS NE2 N 4.360 11.013 -4.847 1.00 . B B . 26 HIS NE2 1 1 10 7310 2 2 5 HIS O O 4.262 4.704 -6.598 1.00 . B B . 26 HIS O 1 1 10 7311 2 2 6 LEU C C 0.390 6.082 -6.673 1.00 . B B . 27 LEU C 1 1 10 7312 2 2 6 LEU CA C 1.712 5.312 -6.477 1.00 . B B . 27 LEU CA 1 1 10 7313 2 2 6 LEU CB C 1.502 4.092 -5.576 1.00 . B B . 27 LEU CB 1 1 10 7314 2 2 6 LEU CD1 C 0.867 3.423 -3.260 1.00 . B B . 27 LEU CD1 1 1 10 7315 2 2 6 LEU CD2 C 0.951 5.836 -3.844 1.00 . B B . 27 LEU CD2 1 1 10 7316 2 2 6 LEU CG C 0.619 4.440 -4.376 1.00 . B B . 27 LEU CG 1 1 10 7317 2 2 6 LEU H H 2.579 6.972 -5.381 1.00 . B B . 27 LEU H 1 1 10 7318 2 2 6 LEU HA H 2.048 4.966 -7.441 1.00 . B B . 27 LEU HA 1 1 10 7319 2 2 6 LEU HB2 H 1.035 3.307 -6.145 1.00 . B B . 27 LEU HB2 1 1 10 7320 2 2 6 LEU HB3 H 2.461 3.747 -5.219 1.00 . B B . 27 LEU HB3 1 1 10 7321 2 2 6 LEU HD11 H 1.416 3.898 -2.459 1.00 . B B . 27 LEU HD11 1 1 10 7322 2 2 6 LEU HD12 H 1.441 2.595 -3.648 1.00 . B B . 27 LEU HD12 1 1 10 7323 2 2 6 LEU HD13 H -0.076 3.063 -2.883 1.00 . B B . 27 LEU HD13 1 1 10 7324 2 2 6 LEU HD21 H 2.018 5.988 -3.873 1.00 . B B . 27 LEU HD21 1 1 10 7325 2 2 6 LEU HD22 H 0.606 5.917 -2.826 1.00 . B B . 27 LEU HD22 1 1 10 7326 2 2 6 LEU HD23 H 0.462 6.582 -4.448 1.00 . B B . 27 LEU HD23 1 1 10 7327 2 2 6 LEU HG H -0.415 4.401 -4.678 1.00 . B B . 27 LEU HG 1 1 10 7328 2 2 6 LEU N N 2.790 6.152 -5.875 1.00 . B B . 27 LEU N 1 1 10 7329 2 2 6 LEU O O 0.378 7.281 -6.795 1.00 . B B . 27 LEU O 1 1 10 7330 2 2 7 CYS C C -2.988 4.923 -7.661 1.00 . B B . 28 CYS C 1 1 10 7331 2 2 7 CYS CA C -2.088 5.939 -6.949 1.00 . B B . 28 CYS CA 1 1 10 7332 2 2 7 CYS CB C -2.066 7.235 -7.776 1.00 . B B . 28 CYS CB 1 1 10 7333 2 2 7 CYS H H -0.626 4.383 -6.644 1.00 . B B . 28 CYS H 1 1 10 7334 2 2 7 CYS HA H -2.521 6.155 -5.983 1.00 . B B . 28 CYS HA 1 1 10 7335 2 2 7 CYS HB2 H -1.082 7.391 -8.186 1.00 . B B . 28 CYS HB2 1 1 10 7336 2 2 7 CYS HB3 H -2.776 7.151 -8.585 1.00 . B B . 28 CYS HB3 1 1 10 7337 2 2 7 CYS N N -0.709 5.355 -6.730 1.00 . B B . 28 CYS N 1 1 10 7338 2 2 7 CYS O O -2.568 4.216 -8.554 1.00 . B B . 28 CYS O 1 1 10 7339 2 2 7 CYS SG S -2.522 8.641 -6.720 1.00 . B B . 28 CYS SG 1 1 10 7340 2 2 8 GLY C C -4.461 2.544 -8.094 1.00 . B B . 29 GLY C 1 1 10 7341 2 2 8 GLY CA C -5.165 3.889 -7.926 1.00 . B B . 29 GLY CA 1 1 10 7342 2 2 8 GLY H H -4.556 5.434 -6.554 1.00 . B B . 29 GLY H 1 1 10 7343 2 2 8 GLY HA2 H -6.044 3.765 -7.311 1.00 . B B . 29 GLY HA2 1 1 10 7344 2 2 8 GLY HA3 H -5.452 4.266 -8.897 1.00 . B B . 29 GLY HA3 1 1 10 7345 2 2 8 GLY N N -4.234 4.852 -7.273 1.00 . B B . 29 GLY N 1 1 10 7346 2 2 8 GLY O O -3.898 2.009 -7.161 1.00 . B B . 29 GLY O 1 1 10 7347 2 2 9 SER C C -2.408 0.751 -8.859 1.00 . B B . 30 SER C 1 1 10 7348 2 2 9 SER CA C -3.801 0.688 -9.484 1.00 . B B . 30 SER CA 1 1 10 7349 2 2 9 SER CB C -3.679 0.403 -10.981 1.00 . B B . 30 SER CB 1 1 10 7350 2 2 9 SER H H -4.934 2.439 -10.022 1.00 . B B . 30 SER H 1 1 10 7351 2 2 9 SER HA H -4.374 -0.098 -9.009 1.00 . B B . 30 SER HA 1 1 10 7352 2 2 9 SER HB2 H -4.109 1.216 -11.542 1.00 . B B . 30 SER HB2 1 1 10 7353 2 2 9 SER HB3 H -2.634 0.301 -11.243 1.00 . B B . 30 SER HB3 1 1 10 7354 2 2 9 SER HG H -3.810 -1.537 -11.051 1.00 . B B . 30 SER HG 1 1 10 7355 2 2 9 SER N N -4.480 1.994 -9.275 1.00 . B B . 30 SER N 1 1 10 7356 2 2 9 SER O O -1.947 -0.194 -8.251 1.00 . B B . 30 SER O 1 1 10 7357 2 2 9 SER OG O -4.375 -0.797 -11.288 1.00 . B B . 30 SER OG 1 1 10 7358 2 2 10 ASP C C -0.494 1.756 -6.883 1.00 . B B . 31 ASP C 1 1 10 7359 2 2 10 ASP CA C -0.380 1.979 -8.389 1.00 . B B . 31 ASP CA 1 1 10 7360 2 2 10 ASP CB C 0.213 3.360 -8.676 1.00 . B B . 31 ASP CB 1 1 10 7361 2 2 10 ASP CG C 0.646 3.434 -10.142 1.00 . B B . 31 ASP CG 1 1 10 7362 2 2 10 ASP H H -2.125 2.622 -9.478 1.00 . B B . 31 ASP H 1 1 10 7363 2 2 10 ASP HA H 0.264 1.222 -8.806 1.00 . B B . 31 ASP HA 1 1 10 7364 2 2 10 ASP HB2 H -0.523 4.119 -8.482 1.00 . B B . 31 ASP HB2 1 1 10 7365 2 2 10 ASP HB3 H 1.072 3.519 -8.043 1.00 . B B . 31 ASP HB3 1 1 10 7366 2 2 10 ASP N N -1.735 1.865 -8.992 1.00 . B B . 31 ASP N 1 1 10 7367 2 2 10 ASP O O 0.416 1.258 -6.253 1.00 . B B . 31 ASP O 1 1 10 7368 2 2 10 ASP OD1 O 0.944 2.393 -10.704 1.00 . B B . 31 ASP OD1 1 1 10 7369 2 2 10 ASP OD2 O 0.674 4.530 -10.676 1.00 . B B . 31 ASP OD2 1 1 10 7370 2 2 11 LEU C C -1.842 0.369 -4.601 1.00 . B B . 32 LEU C 1 1 10 7371 2 2 11 LEU CA C -1.771 1.875 -4.837 1.00 . B B . 32 LEU CA 1 1 10 7372 2 2 11 LEU CB C -3.050 2.552 -4.324 1.00 . B B . 32 LEU CB 1 1 10 7373 2 2 11 LEU CD1 C -2.400 4.869 -3.635 1.00 . B B . 32 LEU CD1 1 1 10 7374 2 2 11 LEU CD2 C -3.896 3.524 -2.173 1.00 . B B . 32 LEU CD2 1 1 10 7375 2 2 11 LEU CG C -2.709 3.459 -3.134 1.00 . B B . 32 LEU CG 1 1 10 7376 2 2 11 LEU H H -2.345 2.488 -6.822 1.00 . B B . 32 LEU H 1 1 10 7377 2 2 11 LEU HA H -0.911 2.274 -4.320 1.00 . B B . 32 LEU HA 1 1 10 7378 2 2 11 LEU HB2 H -3.486 3.144 -5.115 1.00 . B B . 32 LEU HB2 1 1 10 7379 2 2 11 LEU HB3 H -3.754 1.798 -4.008 1.00 . B B . 32 LEU HB3 1 1 10 7380 2 2 11 LEU HD11 H -3.223 5.526 -3.394 1.00 . B B . 32 LEU HD11 1 1 10 7381 2 2 11 LEU HD12 H -2.257 4.847 -4.704 1.00 . B B . 32 LEU HD12 1 1 10 7382 2 2 11 LEU HD13 H -1.499 5.230 -3.160 1.00 . B B . 32 LEU HD13 1 1 10 7383 2 2 11 LEU HD21 H -3.936 4.505 -1.721 1.00 . B B . 32 LEU HD21 1 1 10 7384 2 2 11 LEU HD22 H -3.776 2.779 -1.401 1.00 . B B . 32 LEU HD22 1 1 10 7385 2 2 11 LEU HD23 H -4.811 3.340 -2.715 1.00 . B B . 32 LEU HD23 1 1 10 7386 2 2 11 LEU HG H -1.850 3.062 -2.616 1.00 . B B . 32 LEU HG 1 1 10 7387 2 2 11 LEU N N -1.613 2.101 -6.299 1.00 . B B . 32 LEU N 1 1 10 7388 2 2 11 LEU O O -1.036 -0.191 -3.884 1.00 . B B . 32 LEU O 1 1 10 7389 2 2 12 VAL C C -1.496 -2.363 -5.407 1.00 . B B . 33 VAL C 1 1 10 7390 2 2 12 VAL CA C -2.847 -1.778 -5.029 1.00 . B B . 33 VAL CA 1 1 10 7391 2 2 12 VAL CB C -3.922 -2.399 -5.922 1.00 . B B . 33 VAL CB 1 1 10 7392 2 2 12 VAL CG1 C -5.298 -2.103 -5.343 1.00 . B B . 33 VAL CG1 1 1 10 7393 2 2 12 VAL CG2 C -3.825 -1.825 -7.337 1.00 . B B . 33 VAL CG2 1 1 10 7394 2 2 12 VAL H H -3.409 0.152 -5.810 1.00 . B B . 33 VAL H 1 1 10 7395 2 2 12 VAL HA H -3.061 -2.001 -3.993 1.00 . B B . 33 VAL HA 1 1 10 7396 2 2 12 VAL HB H -3.775 -3.468 -5.959 1.00 . B B . 33 VAL HB 1 1 10 7397 2 2 12 VAL HG11 H -6.055 -2.384 -6.059 1.00 . B B . 33 VAL HG11 1 1 10 7398 2 2 12 VAL HG12 H -5.377 -1.049 -5.127 1.00 . B B . 33 VAL HG12 1 1 10 7399 2 2 12 VAL HG13 H -5.432 -2.671 -4.435 1.00 . B B . 33 VAL HG13 1 1 10 7400 2 2 12 VAL HG21 H -2.847 -2.035 -7.744 1.00 . B B . 33 VAL HG21 1 1 10 7401 2 2 12 VAL HG22 H -3.982 -0.759 -7.305 1.00 . B B . 33 VAL HG22 1 1 10 7402 2 2 12 VAL HG23 H -4.579 -2.282 -7.961 1.00 . B B . 33 VAL HG23 1 1 10 7403 2 2 12 VAL N N -2.777 -0.305 -5.217 1.00 . B B . 33 VAL N 1 1 10 7404 2 2 12 VAL O O -1.029 -3.304 -4.810 1.00 . B B . 33 VAL O 1 1 10 7405 2 2 13 GLU C C 1.412 -2.220 -5.595 1.00 . B B . 34 GLU C 1 1 10 7406 2 2 13 GLU CA C 0.471 -2.323 -6.793 1.00 . B B . 34 GLU CA 1 1 10 7407 2 2 13 GLU CB C 1.014 -1.496 -7.958 1.00 . B B . 34 GLU CB 1 1 10 7408 2 2 13 GLU CD C 2.128 -2.599 -9.908 1.00 . B B . 34 GLU CD 1 1 10 7409 2 2 13 GLU CG C 0.782 -2.248 -9.272 1.00 . B B . 34 GLU CG 1 1 10 7410 2 2 13 GLU H H -1.243 -1.035 -6.861 1.00 . B B . 34 GLU H 1 1 10 7411 2 2 13 GLU HA H 0.378 -3.357 -7.090 1.00 . B B . 34 GLU HA 1 1 10 7412 2 2 13 GLU HB2 H 0.503 -0.545 -7.992 1.00 . B B . 34 GLU HB2 1 1 10 7413 2 2 13 GLU HB3 H 2.070 -1.331 -7.820 1.00 . B B . 34 GLU HB3 1 1 10 7414 2 2 13 GLU HG2 H 0.228 -3.155 -9.073 1.00 . B B . 34 GLU HG2 1 1 10 7415 2 2 13 GLU HG3 H 0.218 -1.624 -9.949 1.00 . B B . 34 GLU HG3 1 1 10 7416 2 2 13 GLU N N -0.856 -1.802 -6.392 1.00 . B B . 34 GLU N 1 1 10 7417 2 2 13 GLU O O 1.927 -3.210 -5.118 1.00 . B B . 34 GLU O 1 1 10 7418 2 2 13 GLU OE1 O 2.889 -3.317 -9.280 1.00 . B B . 34 GLU OE1 1 1 10 7419 2 2 13 GLU OE2 O 2.375 -2.148 -11.015 1.00 . B B . 34 GLU OE2 1 1 10 7420 2 2 14 ALA C C 1.911 -1.695 -2.750 1.00 . B B . 35 ALA C 1 1 10 7421 2 2 14 ALA CA C 2.520 -0.897 -3.904 1.00 . B B . 35 ALA CA 1 1 10 7422 2 2 14 ALA CB C 2.641 0.577 -3.510 1.00 . B B . 35 ALA CB 1 1 10 7423 2 2 14 ALA H H 1.186 -0.243 -5.468 1.00 . B B . 35 ALA H 1 1 10 7424 2 2 14 ALA HA H 3.497 -1.291 -4.145 1.00 . B B . 35 ALA HA 1 1 10 7425 2 2 14 ALA HB1 H 2.645 1.188 -4.401 1.00 . B B . 35 ALA HB1 1 1 10 7426 2 2 14 ALA HB2 H 3.561 0.729 -2.966 1.00 . B B . 35 ALA HB2 1 1 10 7427 2 2 14 ALA HB3 H 1.804 0.855 -2.887 1.00 . B B . 35 ALA HB3 1 1 10 7428 2 2 14 ALA N N 1.626 -1.034 -5.086 1.00 . B B . 35 ALA N 1 1 10 7429 2 2 14 ALA O O 2.579 -2.466 -2.090 1.00 . B B . 35 ALA O 1 1 10 7430 2 2 15 LEU C C 0.144 -3.786 -1.707 1.00 . B B . 36 LEU C 1 1 10 7431 2 2 15 LEU CA C -0.047 -2.293 -1.440 1.00 . B B . 36 LEU CA 1 1 10 7432 2 2 15 LEU CB C -1.551 -1.975 -1.471 1.00 . B B . 36 LEU CB 1 1 10 7433 2 2 15 LEU CD1 C -2.326 -0.668 0.515 1.00 . B B . 36 LEU CD1 1 1 10 7434 2 2 15 LEU CD2 C -0.603 0.330 -0.988 1.00 . B B . 36 LEU CD2 1 1 10 7435 2 2 15 LEU CG C -1.849 -0.564 -0.931 1.00 . B B . 36 LEU CG 1 1 10 7436 2 2 15 LEU H H 0.117 -0.918 -3.087 1.00 . B B . 36 LEU H 1 1 10 7437 2 2 15 LEU HA H 0.368 -2.029 -0.481 1.00 . B B . 36 LEU HA 1 1 10 7438 2 2 15 LEU HB2 H -1.903 -2.041 -2.490 1.00 . B B . 36 LEU HB2 1 1 10 7439 2 2 15 LEU HB3 H -2.077 -2.702 -0.869 1.00 . B B . 36 LEU HB3 1 1 10 7440 2 2 15 LEU HD11 H -1.473 -0.651 1.178 1.00 . B B . 36 LEU HD11 1 1 10 7441 2 2 15 LEU HD12 H -2.868 -1.593 0.649 1.00 . B B . 36 LEU HD12 1 1 10 7442 2 2 15 LEU HD13 H -2.974 0.166 0.742 1.00 . B B . 36 LEU HD13 1 1 10 7443 2 2 15 LEU HD21 H 0.225 -0.173 -0.509 1.00 . B B . 36 LEU HD21 1 1 10 7444 2 2 15 LEU HD22 H -0.803 1.259 -0.474 1.00 . B B . 36 LEU HD22 1 1 10 7445 2 2 15 LEU HD23 H -0.354 0.535 -2.018 1.00 . B B . 36 LEU HD23 1 1 10 7446 2 2 15 LEU HG H -2.635 -0.120 -1.527 1.00 . B B . 36 LEU HG 1 1 10 7447 2 2 15 LEU N N 0.634 -1.531 -2.525 1.00 . B B . 36 LEU N 1 1 10 7448 2 2 15 LEU O O 0.250 -4.595 -0.805 1.00 . B B . 36 LEU O 1 1 10 7449 2 2 16 TYR C C 1.780 -6.016 -3.058 1.00 . B B . 37 TYR C 1 1 10 7450 2 2 16 TYR CA C 0.346 -5.564 -3.354 1.00 . B B . 37 TYR CA 1 1 10 7451 2 2 16 TYR CB C 0.077 -5.689 -4.857 1.00 . B B . 37 TYR CB 1 1 10 7452 2 2 16 TYR CD1 C -2.394 -5.395 -4.145 1.00 . B B . 37 TYR CD1 1 1 10 7453 2 2 16 TYR CD2 C -1.918 -6.270 -6.366 1.00 . B B . 37 TYR CD2 1 1 10 7454 2 2 16 TYR CE1 C -3.767 -5.479 -4.418 1.00 . B B . 37 TYR CE1 1 1 10 7455 2 2 16 TYR CE2 C -3.292 -6.351 -6.621 1.00 . B B . 37 TYR CE2 1 1 10 7456 2 2 16 TYR CG C -1.445 -5.792 -5.125 1.00 . B B . 37 TYR CG 1 1 10 7457 2 2 16 TYR CZ C -4.212 -5.956 -5.653 1.00 . B B . 37 TYR CZ 1 1 10 7458 2 2 16 TYR H H 0.085 -3.454 -3.651 1.00 . B B . 37 TYR H 1 1 10 7459 2 2 16 TYR HA H -0.352 -6.180 -2.808 1.00 . B B . 37 TYR HA 1 1 10 7460 2 2 16 TYR HB2 H 0.489 -4.813 -5.356 1.00 . B B . 37 TYR HB2 1 1 10 7461 2 2 16 TYR HB3 H 0.585 -6.569 -5.234 1.00 . B B . 37 TYR HB3 1 1 10 7462 2 2 16 TYR HD1 H -2.081 -5.028 -3.184 1.00 . B B . 37 TYR HD1 1 1 10 7463 2 2 16 TYR HD2 H -1.235 -6.582 -7.123 1.00 . B B . 37 TYR HD2 1 1 10 7464 2 2 16 TYR HE1 H -4.484 -5.175 -3.669 1.00 . B B . 37 TYR HE1 1 1 10 7465 2 2 16 TYR HE2 H -3.640 -6.718 -7.575 1.00 . B B . 37 TYR HE2 1 1 10 7466 2 2 16 TYR HH H -5.681 -6.568 -6.708 1.00 . B B . 37 TYR HH 1 1 10 7467 2 2 16 TYR N N 0.178 -4.140 -2.958 1.00 . B B . 37 TYR N 1 1 10 7468 2 2 16 TYR O O 2.052 -7.193 -2.919 1.00 . B B . 37 TYR O 1 1 10 7469 2 2 16 TYR OH O -5.564 -6.034 -5.918 1.00 . B B . 37 TYR OH 1 1 10 7470 2 2 17 LEU C C 4.261 -5.724 -1.170 1.00 . B B . 38 LEU C 1 1 10 7471 2 2 17 LEU CA C 4.111 -5.489 -2.670 1.00 . B B . 38 LEU CA 1 1 10 7472 2 2 17 LEU CB C 5.088 -4.384 -3.101 1.00 . B B . 38 LEU CB 1 1 10 7473 2 2 17 LEU CD1 C 5.494 -2.502 -4.692 1.00 . B B . 38 LEU CD1 1 1 10 7474 2 2 17 LEU CD2 C 4.138 -4.469 -5.410 1.00 . B B . 38 LEU CD2 1 1 10 7475 2 2 17 LEU CG C 4.485 -3.558 -4.233 1.00 . B B . 38 LEU CG 1 1 10 7476 2 2 17 LEU H H 2.462 -4.153 -3.069 1.00 . B B . 38 LEU H 1 1 10 7477 2 2 17 LEU HA H 4.342 -6.398 -3.202 1.00 . B B . 38 LEU HA 1 1 10 7478 2 2 17 LEU HB2 H 5.293 -3.740 -2.259 1.00 . B B . 38 LEU HB2 1 1 10 7479 2 2 17 LEU HB3 H 6.011 -4.834 -3.440 1.00 . B B . 38 LEU HB3 1 1 10 7480 2 2 17 LEU HD11 H 5.314 -2.260 -5.729 1.00 . B B . 38 LEU HD11 1 1 10 7481 2 2 17 LEU HD12 H 6.496 -2.889 -4.582 1.00 . B B . 38 LEU HD12 1 1 10 7482 2 2 17 LEU HD13 H 5.383 -1.612 -4.090 1.00 . B B . 38 LEU HD13 1 1 10 7483 2 2 17 LEU HD21 H 3.631 -3.894 -6.170 1.00 . B B . 38 LEU HD21 1 1 10 7484 2 2 17 LEU HD22 H 3.493 -5.265 -5.070 1.00 . B B . 38 LEU HD22 1 1 10 7485 2 2 17 LEU HD23 H 5.045 -4.888 -5.819 1.00 . B B . 38 LEU HD23 1 1 10 7486 2 2 17 LEU HG H 3.596 -3.071 -3.880 1.00 . B B . 38 LEU HG 1 1 10 7487 2 2 17 LEU N N 2.700 -5.095 -2.959 1.00 . B B . 38 LEU N 1 1 10 7488 2 2 17 LEU O O 4.635 -6.791 -0.727 1.00 . B B . 38 LEU O 1 1 10 7489 2 2 18 VAL C C 3.423 -6.183 1.528 1.00 . B B . 39 VAL C 1 1 10 7490 2 2 18 VAL CA C 4.085 -4.873 1.091 1.00 . B B . 39 VAL CA 1 1 10 7491 2 2 18 VAL CB C 3.400 -3.684 1.774 1.00 . B B . 39 VAL CB 1 1 10 7492 2 2 18 VAL CG1 C 3.754 -2.398 1.025 1.00 . B B . 39 VAL CG1 1 1 10 7493 2 2 18 VAL CG2 C 1.882 -3.876 1.751 1.00 . B B . 39 VAL CG2 1 1 10 7494 2 2 18 VAL H H 3.664 -3.879 -0.770 1.00 . B B . 39 VAL H 1 1 10 7495 2 2 18 VAL HA H 5.129 -4.892 1.366 1.00 . B B . 39 VAL HA 1 1 10 7496 2 2 18 VAL HB H 3.742 -3.610 2.797 1.00 . B B . 39 VAL HB 1 1 10 7497 2 2 18 VAL HG11 H 4.127 -1.665 1.724 1.00 . B B . 39 VAL HG11 1 1 10 7498 2 2 18 VAL HG12 H 2.872 -2.012 0.535 1.00 . B B . 39 VAL HG12 1 1 10 7499 2 2 18 VAL HG13 H 4.513 -2.609 0.285 1.00 . B B . 39 VAL HG13 1 1 10 7500 2 2 18 VAL HG21 H 1.623 -4.768 2.303 1.00 . B B . 39 VAL HG21 1 1 10 7501 2 2 18 VAL HG22 H 1.547 -3.975 0.729 1.00 . B B . 39 VAL HG22 1 1 10 7502 2 2 18 VAL HG23 H 1.405 -3.021 2.205 1.00 . B B . 39 VAL HG23 1 1 10 7503 2 2 18 VAL N N 3.966 -4.727 -0.385 1.00 . B B . 39 VAL N 1 1 10 7504 2 2 18 VAL O O 3.853 -6.822 2.469 1.00 . B B . 39 VAL O 1 1 10 7505 2 2 19 CYS C C 2.161 -8.992 0.305 1.00 . B B . 40 CYS C 1 1 10 7506 2 2 19 CYS CA C 1.709 -7.865 1.235 1.00 . B B . 40 CYS CA 1 1 10 7507 2 2 19 CYS CB C 0.191 -7.694 1.146 1.00 . B B . 40 CYS CB 1 1 10 7508 2 2 19 CYS H H 2.053 -6.068 0.093 1.00 . B B . 40 CYS H 1 1 10 7509 2 2 19 CYS HA H 1.979 -8.115 2.246 1.00 . B B . 40 CYS HA 1 1 10 7510 2 2 19 CYS HB2 H -0.041 -6.834 0.534 1.00 . B B . 40 CYS HB2 1 1 10 7511 2 2 19 CYS HB3 H -0.248 -8.578 0.708 1.00 . B B . 40 CYS HB3 1 1 10 7512 2 2 19 CYS N N 2.384 -6.593 0.852 1.00 . B B . 40 CYS N 1 1 10 7513 2 2 19 CYS O O 2.172 -10.149 0.677 1.00 . B B . 40 CYS O 1 1 10 7514 2 2 19 CYS SG S -0.478 -7.449 2.811 1.00 . B B . 40 CYS SG 1 1 10 7515 2 2 20 GLY C C 2.107 -10.943 -1.756 1.00 . B B . 41 GLY C 1 1 10 7516 2 2 20 GLY CA C 3.003 -9.706 -1.855 1.00 . B B . 41 GLY CA 1 1 10 7517 2 2 20 GLY H H 2.529 -7.720 -1.164 1.00 . B B . 41 GLY H 1 1 10 7518 2 2 20 GLY HA2 H 2.962 -9.311 -2.860 1.00 . B B . 41 GLY HA2 1 1 10 7519 2 2 20 GLY HA3 H 4.019 -9.984 -1.619 1.00 . B B . 41 GLY HA3 1 1 10 7520 2 2 20 GLY N N 2.541 -8.661 -0.895 1.00 . B B . 41 GLY N 1 1 10 7521 2 2 20 GLY O O 2.545 -12.004 -1.360 1.00 . B B . 41 GLY O 1 1 10 7522 2 2 21 GLU C C 0.191 -12.799 -0.801 1.00 . B B . 42 GLU C 1 1 10 7523 2 2 21 GLU CA C -0.074 -11.979 -2.063 1.00 . B B . 42 GLU CA 1 1 10 7524 2 2 21 GLU CB C 0.131 -12.866 -3.291 1.00 . B B . 42 GLU CB 1 1 10 7525 2 2 21 GLU CD C 1.802 -14.129 -4.648 1.00 . B B . 42 GLU CD 1 1 10 7526 2 2 21 GLU CG C 1.619 -13.176 -3.466 1.00 . B B . 42 GLU CG 1 1 10 7527 2 2 21 GLU H H 0.533 -9.947 -2.446 1.00 . B B . 42 GLU H 1 1 10 7528 2 2 21 GLU HA H -1.092 -11.620 -2.048 1.00 . B B . 42 GLU HA 1 1 10 7529 2 2 21 GLU HB2 H -0.414 -13.789 -3.159 1.00 . B B . 42 GLU HB2 1 1 10 7530 2 2 21 GLU HB3 H -0.234 -12.354 -4.168 1.00 . B B . 42 GLU HB3 1 1 10 7531 2 2 21 GLU HG2 H 2.158 -12.260 -3.658 1.00 . B B . 42 GLU HG2 1 1 10 7532 2 2 21 GLU HG3 H 1.999 -13.641 -2.569 1.00 . B B . 42 GLU HG3 1 1 10 7533 2 2 21 GLU N N 0.859 -10.814 -2.124 1.00 . B B . 42 GLU N 1 1 10 7534 2 2 21 GLU O O -0.014 -13.996 -0.772 1.00 . B B . 42 GLU O 1 1 10 7535 2 2 21 GLU OE1 O 1.291 -15.233 -4.578 1.00 . B B . 42 GLU OE1 1 1 10 7536 2 2 21 GLU OE2 O 2.450 -13.735 -5.604 1.00 . B B . 42 GLU OE2 1 1 10 7537 2 2 22 ARG C C -0.337 -12.918 2.369 1.00 . B B . 43 ARG C 1 1 10 7538 2 2 22 ARG CA C 0.919 -12.914 1.499 1.00 . B B . 43 ARG CA 1 1 10 7539 2 2 22 ARG CB C 2.064 -12.238 2.254 1.00 . B B . 43 ARG CB 1 1 10 7540 2 2 22 ARG CD C 2.592 -12.146 4.690 1.00 . B B . 43 ARG CD 1 1 10 7541 2 2 22 ARG CG C 2.420 -13.071 3.485 1.00 . B B . 43 ARG CG 1 1 10 7542 2 2 22 ARG CZ C 4.033 -11.999 6.626 1.00 . B B . 43 ARG CZ 1 1 10 7543 2 2 22 ARG H H 0.803 -11.201 0.198 1.00 . B B . 43 ARG H 1 1 10 7544 2 2 22 ARG HA H 1.197 -13.930 1.261 1.00 . B B . 43 ARG HA 1 1 10 7545 2 2 22 ARG HB2 H 2.926 -12.159 1.608 1.00 . B B . 43 ARG HB2 1 1 10 7546 2 2 22 ARG HB3 H 1.756 -11.252 2.567 1.00 . B B . 43 ARG HB3 1 1 10 7547 2 2 22 ARG HD2 H 2.815 -11.146 4.347 1.00 . B B . 43 ARG HD2 1 1 10 7548 2 2 22 ARG HD3 H 1.680 -12.135 5.267 1.00 . B B . 43 ARG HD3 1 1 10 7549 2 2 22 ARG HE H 4.205 -13.446 5.278 1.00 . B B . 43 ARG HE 1 1 10 7550 2 2 22 ARG HG2 H 1.627 -13.777 3.682 1.00 . B B . 43 ARG HG2 1 1 10 7551 2 2 22 ARG HG3 H 3.342 -13.603 3.307 1.00 . B B . 43 ARG HG3 1 1 10 7552 2 2 22 ARG HH11 H 2.148 -11.869 7.290 1.00 . B B . 43 ARG HH11 1 1 10 7553 2 2 22 ARG HH12 H 3.352 -11.155 8.309 1.00 . B B . 43 ARG HH12 1 1 10 7554 2 2 22 ARG HH21 H 5.990 -11.972 6.214 1.00 . B B . 43 ARG HH21 1 1 10 7555 2 2 22 ARG HH22 H 5.527 -11.213 7.700 1.00 . B B . 43 ARG HH22 1 1 10 7556 2 2 22 ARG N N 0.644 -12.167 0.242 1.00 . B B . 43 ARG N 1 1 10 7557 2 2 22 ARG NE N 3.711 -12.641 5.538 1.00 . B B . 43 ARG NE 1 1 10 7558 2 2 22 ARG NH1 N 3.105 -11.647 7.474 1.00 . B B . 43 ARG NH1 1 1 10 7559 2 2 22 ARG NH2 N 5.280 -11.705 6.865 1.00 . B B . 43 ARG NH2 1 1 10 7560 2 2 22 ARG O O -1.001 -11.912 2.522 1.00 . B B . 43 ARG O 1 1 10 7561 2 2 23 GLY C C -3.066 -13.472 3.050 1.00 . B B . 44 GLY C 1 1 10 7562 2 2 23 GLY CA C -1.890 -14.105 3.797 1.00 . B B . 44 GLY CA 1 1 10 7563 2 2 23 GLY H H -0.126 -14.844 2.805 1.00 . B B . 44 GLY H 1 1 10 7564 2 2 23 GLY HA2 H -2.117 -15.136 4.026 1.00 . B B . 44 GLY HA2 1 1 10 7565 2 2 23 GLY HA3 H -1.715 -13.561 4.712 1.00 . B B . 44 GLY HA3 1 1 10 7566 2 2 23 GLY N N -0.673 -14.042 2.940 1.00 . B B . 44 GLY N 1 1 10 7567 2 2 23 GLY O O -3.576 -12.440 3.438 1.00 . B B . 44 GLY O 1 1 10 7568 2 2 24 GLY C C -4.148 -12.283 0.423 1.00 . B B . 45 GLY C 1 1 10 7569 2 2 24 GLY CA C -4.637 -13.501 1.210 1.00 . B B . 45 GLY CA 1 1 10 7570 2 2 24 GLY H H -3.072 -14.908 1.678 1.00 . B B . 45 GLY H 1 1 10 7571 2 2 24 GLY HA2 H -5.022 -14.244 0.524 1.00 . B B . 45 GLY HA2 1 1 10 7572 2 2 24 GLY HA3 H -5.417 -13.198 1.891 1.00 . B B . 45 GLY HA3 1 1 10 7573 2 2 24 GLY N N -3.498 -14.078 1.979 1.00 . B B . 45 GLY N 1 1 10 7574 2 2 24 GLY O O -3.007 -11.879 0.535 1.00 . B B . 45 GLY O 1 1 10 7575 2 2 25 PHE C C -4.593 -9.253 -0.289 1.00 . B B . 46 PHE C 1 1 10 7576 2 2 25 PHE CA C -4.572 -10.510 -1.171 1.00 . B B . 46 PHE CA 1 1 10 7577 2 2 25 PHE CB C -5.510 -10.346 -2.359 1.00 . B B . 46 PHE CB 1 1 10 7578 2 2 25 PHE CD1 C -4.009 -12.146 -3.483 1.00 . B B . 46 PHE CD1 1 1 10 7579 2 2 25 PHE CD2 C -5.046 -10.465 -4.910 1.00 . B B . 46 PHE CD2 1 1 10 7580 2 2 25 PHE CE1 C -3.415 -12.721 -4.613 1.00 . B B . 46 PHE CE1 1 1 10 7581 2 2 25 PHE CE2 C -4.442 -11.057 -6.026 1.00 . B B . 46 PHE CE2 1 1 10 7582 2 2 25 PHE CG C -4.845 -10.997 -3.611 1.00 . B B . 46 PHE CG 1 1 10 7583 2 2 25 PHE CZ C -3.631 -12.180 -5.877 1.00 . B B . 46 PHE CZ 1 1 10 7584 2 2 25 PHE H H -5.912 -12.035 -0.458 1.00 . B B . 46 PHE H 1 1 10 7585 2 2 25 PHE HA H -3.579 -10.673 -1.536 1.00 . B B . 46 PHE HA 1 1 10 7586 2 2 25 PHE HB2 H -6.455 -10.837 -2.112 1.00 . B B . 46 PHE HB2 1 1 10 7587 2 2 25 PHE HB3 H -5.694 -9.280 -2.528 1.00 . B B . 46 PHE HB3 1 1 10 7588 2 2 25 PHE HD1 H -3.813 -12.590 -2.526 1.00 . B B . 46 PHE HD1 1 1 10 7589 2 2 25 PHE HD2 H -5.655 -9.607 -5.061 1.00 . B B . 46 PHE HD2 1 1 10 7590 2 2 25 PHE HE1 H -2.785 -13.591 -4.502 1.00 . B B . 46 PHE HE1 1 1 10 7591 2 2 25 PHE HE2 H -4.603 -10.639 -7.008 1.00 . B B . 46 PHE HE2 1 1 10 7592 2 2 25 PHE HZ H -3.171 -12.631 -6.743 1.00 . B B . 46 PHE HZ 1 1 10 7593 2 2 25 PHE N N -4.997 -11.695 -0.377 1.00 . B B . 46 PHE N 1 1 10 7594 2 2 25 PHE O O -3.685 -9.021 0.484 1.00 . B B . 46 PHE O 1 1 10 7595 2 2 26 TYR C C -6.720 -7.408 1.553 1.00 . B B . 47 TYR C 1 1 10 7596 2 2 26 TYR CA C -5.669 -7.214 0.457 1.00 . B B . 47 TYR CA 1 1 10 7597 2 2 26 TYR CB C -6.009 -5.986 -0.409 1.00 . B B . 47 TYR CB 1 1 10 7598 2 2 26 TYR CD1 C -5.931 -6.970 -2.813 1.00 . B B . 47 TYR CD1 1 1 10 7599 2 2 26 TYR CD2 C -8.112 -6.375 -1.902 1.00 . B B . 47 TYR CD2 1 1 10 7600 2 2 26 TYR CE1 C -6.554 -7.391 -3.994 1.00 . B B . 47 TYR CE1 1 1 10 7601 2 2 26 TYR CE2 C -8.712 -6.803 -3.094 1.00 . B B . 47 TYR CE2 1 1 10 7602 2 2 26 TYR CG C -6.700 -6.449 -1.735 1.00 . B B . 47 TYR CG 1 1 10 7603 2 2 26 TYR CZ C -7.936 -7.306 -4.135 1.00 . B B . 47 TYR CZ 1 1 10 7604 2 2 26 TYR H H -6.345 -8.637 -1.005 1.00 . B B . 47 TYR H 1 1 10 7605 2 2 26 TYR HA H -4.708 -7.062 0.921 1.00 . B B . 47 TYR HA 1 1 10 7606 2 2 26 TYR HB2 H -6.663 -5.317 0.171 1.00 . B B . 47 TYR HB2 1 1 10 7607 2 2 26 TYR HB3 H -5.076 -5.452 -0.630 1.00 . B B . 47 TYR HB3 1 1 10 7608 2 2 26 TYR HD1 H -4.867 -7.059 -2.744 1.00 . B B . 47 TYR HD1 1 1 10 7609 2 2 26 TYR HD2 H -8.741 -6.000 -1.128 1.00 . B B . 47 TYR HD2 1 1 10 7610 2 2 26 TYR HE1 H -5.956 -7.780 -4.804 1.00 . B B . 47 TYR HE1 1 1 10 7611 2 2 26 TYR HE2 H -9.785 -6.741 -3.207 1.00 . B B . 47 TYR HE2 1 1 10 7612 2 2 26 TYR HH H -7.961 -7.492 -6.035 1.00 . B B . 47 TYR HH 1 1 10 7613 2 2 26 TYR N N -5.615 -8.441 -0.387 1.00 . B B . 47 TYR N 1 1 10 7614 2 2 26 TYR O O -6.465 -8.044 2.556 1.00 . B B . 47 TYR O 1 1 10 7615 2 2 26 TYR OH O -8.538 -7.725 -5.304 1.00 . B B . 47 TYR OH 1 1 10 7616 2 2 27 THR C C -10.242 -6.364 1.910 1.00 . B B . 48 THR C 1 1 10 7617 2 2 27 THR CA C -8.964 -7.041 2.400 1.00 . B B . 48 THR CA 1 1 10 7618 2 2 27 THR CB C -8.513 -6.399 3.721 1.00 . B B . 48 THR CB 1 1 10 7619 2 2 27 THR CG2 C -9.725 -6.148 4.623 1.00 . B B . 48 THR CG2 1 1 10 7620 2 2 27 THR H H -8.085 -6.381 0.552 1.00 . B B . 48 THR H 1 1 10 7621 2 2 27 THR HA H -9.154 -8.087 2.555 1.00 . B B . 48 THR HA 1 1 10 7622 2 2 27 THR HB H -8.023 -5.460 3.516 1.00 . B B . 48 THR HB 1 1 10 7623 2 2 27 THR HG1 H -8.116 -8.002 4.748 1.00 . B B . 48 THR HG1 1 1 10 7624 2 2 27 THR HG21 H -10.398 -6.991 4.564 1.00 . B B . 48 THR HG21 1 1 10 7625 2 2 27 THR HG22 H -10.237 -5.255 4.298 1.00 . B B . 48 THR HG22 1 1 10 7626 2 2 27 THR HG23 H -9.394 -6.023 5.644 1.00 . B B . 48 THR HG23 1 1 10 7627 2 2 27 THR N N -7.898 -6.879 1.369 1.00 . B B . 48 THR N 1 1 10 7628 2 2 27 THR O O -11.310 -6.943 1.918 1.00 . B B . 48 THR O 1 1 10 7629 2 2 27 THR OG1 O -7.610 -7.269 4.389 1.00 . B B . 48 THR OG1 1 1 10 7630 2 2 28 LYS C C -12.438 -4.484 2.063 1.00 . B B . 49 LYS C 1 1 10 7631 2 2 28 LYS CA C -11.338 -4.411 0.999 1.00 . B B . 49 LYS CA 1 1 10 7632 2 2 28 LYS CB C -11.834 -5.054 -0.297 1.00 . B B . 49 LYS CB 1 1 10 7633 2 2 28 LYS CD C -11.954 -3.895 -2.510 1.00 . B B . 49 LYS CD 1 1 10 7634 2 2 28 LYS CE C -12.557 -4.949 -3.442 1.00 . B B . 49 LYS CE 1 1 10 7635 2 2 28 LYS CG C -12.593 -4.014 -1.124 1.00 . B B . 49 LYS CG 1 1 10 7636 2 2 28 LYS H H -9.262 -4.703 1.495 1.00 . B B . 49 LYS H 1 1 10 7637 2 2 28 LYS HA H -11.082 -3.377 0.814 1.00 . B B . 49 LYS HA 1 1 10 7638 2 2 28 LYS HB2 H -10.989 -5.419 -0.863 1.00 . B B . 49 LYS HB2 1 1 10 7639 2 2 28 LYS HB3 H -12.492 -5.875 -0.062 1.00 . B B . 49 LYS HB3 1 1 10 7640 2 2 28 LYS HD2 H -12.142 -2.909 -2.910 1.00 . B B . 49 LYS HD2 1 1 10 7641 2 2 28 LYS HD3 H -10.889 -4.055 -2.431 1.00 . B B . 49 LYS HD3 1 1 10 7642 2 2 28 LYS HE2 H -11.844 -5.195 -4.215 1.00 . B B . 49 LYS HE2 1 1 10 7643 2 2 28 LYS HE3 H -12.794 -5.838 -2.876 1.00 . B B . 49 LYS HE3 1 1 10 7644 2 2 28 LYS HG2 H -13.624 -4.319 -1.225 1.00 . B B . 49 LYS HG2 1 1 10 7645 2 2 28 LYS HG3 H -12.548 -3.057 -0.626 1.00 . B B . 49 LYS HG3 1 1 10 7646 2 2 28 LYS HZ1 H -13.859 -3.387 -3.887 1.00 . B B . 49 LYS HZ1 1 1 10 7647 2 2 28 LYS HZ2 H -14.629 -4.883 -3.652 1.00 . B B . 49 LYS HZ2 1 1 10 7648 2 2 28 LYS HZ3 H -13.776 -4.580 -5.090 1.00 . B B . 49 LYS HZ3 1 1 10 7649 2 2 28 LYS N N -10.135 -5.141 1.487 1.00 . B B . 49 LYS N 1 1 10 7650 2 2 28 LYS NZ N -13.799 -4.409 -4.065 1.00 . B B . 49 LYS NZ 1 1 10 7651 2 2 28 LYS O O -13.367 -5.257 1.940 1.00 . B B . 49 LYS O 1 1 10 7652 2 2 29 PRO C C -14.507 -2.848 3.800 1.00 . B B . 50 PRO C 1 1 10 7653 2 2 29 PRO CA C -13.249 -3.624 4.200 1.00 . B B . 50 PRO CA 1 1 10 7654 2 2 29 PRO CB C -12.482 -2.884 5.298 1.00 . B B . 50 PRO CB 1 1 10 7655 2 2 29 PRO CD C -11.158 -2.746 3.217 1.00 . B B . 50 PRO CD 1 1 10 7656 2 2 29 PRO CG C -11.377 -2.073 4.584 1.00 . B B . 50 PRO CG 1 1 10 7657 2 2 29 PRO HA H -13.496 -4.614 4.530 1.00 . B B . 50 PRO HA 1 1 10 7658 2 2 29 PRO HB2 H -13.148 -2.220 5.832 1.00 . B B . 50 PRO HB2 1 1 10 7659 2 2 29 PRO HB3 H -12.033 -3.590 5.979 1.00 . B B . 50 PRO HB3 1 1 10 7660 2 2 29 PRO HD2 H -11.178 -2.011 2.427 1.00 . B B . 50 PRO HD2 1 1 10 7661 2 2 29 PRO HD3 H -10.229 -3.292 3.208 1.00 . B B . 50 PRO HD3 1 1 10 7662 2 2 29 PRO HG2 H -11.700 -1.049 4.451 1.00 . B B . 50 PRO HG2 1 1 10 7663 2 2 29 PRO HG3 H -10.464 -2.104 5.157 1.00 . B B . 50 PRO HG3 1 1 10 7664 2 2 29 PRO N N -12.292 -3.678 3.084 1.00 . B B . 50 PRO N 1 1 10 7665 2 2 29 PRO O O -14.646 -2.405 2.677 1.00 . B B . 50 PRO O 1 1 10 7666 2 2 30 THR C C -16.717 -0.644 5.223 1.00 . B B . 51 THR C 1 1 10 7667 2 2 30 THR CA C -16.669 -1.927 4.392 1.00 . B B . 51 THR CA 1 1 10 7668 2 2 30 THR CB C -17.887 -2.794 4.721 1.00 . B B . 51 THR CB 1 1 10 7669 2 2 30 THR CG2 C -18.247 -3.653 3.508 1.00 . B B . 51 THR CG2 1 1 10 7670 2 2 30 THR H H -15.289 -3.039 5.615 1.00 . B B . 51 THR H 1 1 10 7671 2 2 30 THR HA H -16.677 -1.676 3.342 1.00 . B B . 51 THR HA 1 1 10 7672 2 2 30 THR HB H -18.724 -2.160 4.968 1.00 . B B . 51 THR HB 1 1 10 7673 2 2 30 THR HG1 H -17.586 -3.092 6.620 1.00 . B B . 51 THR HG1 1 1 10 7674 2 2 30 THR HG21 H -19.315 -3.814 3.485 1.00 . B B . 51 THR HG21 1 1 10 7675 2 2 30 THR HG22 H -17.741 -4.605 3.578 1.00 . B B . 51 THR HG22 1 1 10 7676 2 2 30 THR HG23 H -17.940 -3.148 2.604 1.00 . B B . 51 THR HG23 1 1 10 7677 2 2 30 THR N N -15.423 -2.677 4.714 1.00 . B B . 51 THR N 1 1 10 7678 2 2 30 THR O O -15.685 -0.007 5.354 1.00 . B B . 51 THR O 1 1 10 7679 2 2 30 THR OXT O -17.785 -0.322 5.718 1.00 . B B . 51 THR OXT 1 1 10 7680 2 2 30 THR OG1 O -17.583 -3.633 5.826 1.00 . B B . 51 THR OG1 1 1 11 7681 1 1 1 GLY C C -8.470 5.200 -0.303 1.00 . A A . 1 GLY C 1 1 11 7682 1 1 1 GLY CA C -9.781 5.165 -1.012 1.00 . A A . 1 GLY CA 1 1 11 7683 1 1 1 GLY H1 H -11.496 3.953 -1.276 1.00 . A A . 1 GLY H1 1 1 11 7684 1 1 1 GLY H2 H -10.212 3.158 -0.498 1.00 . A A . 1 GLY H2 1 1 11 7685 1 1 1 GLY H3 H -10.151 3.435 -2.173 1.00 . A A . 1 GLY H3 1 1 11 7686 1 1 1 GLY HA2 H -9.250 5.440 -1.783 1.00 . A A . 1 GLY HA2 1 1 11 7687 1 1 1 GLY HA3 H -10.620 5.930 -0.742 1.00 . A A . 1 GLY HA3 1 1 11 7688 1 1 1 GLY N N -10.465 3.821 -1.259 1.00 . A A . 1 GLY N 1 1 11 7689 1 1 1 GLY O O -8.243 6.022 0.562 1.00 . A A . 1 GLY O 1 1 11 7690 1 1 2 ILE C C -5.280 5.209 -0.736 1.00 . A A . 2 ILE C 1 1 11 7691 1 1 2 ILE CA C -6.245 4.294 0.021 1.00 . A A . 2 ILE CA 1 1 11 7692 1 1 2 ILE CB C -5.694 2.867 0.017 1.00 . A A . 2 ILE CB 1 1 11 7693 1 1 2 ILE CD1 C -5.855 0.621 1.096 1.00 . A A . 2 ILE CD1 1 1 11 7694 1 1 2 ILE CG1 C -6.517 1.994 0.968 1.00 . A A . 2 ILE CG1 1 1 11 7695 1 1 2 ILE CG2 C -4.235 2.881 0.477 1.00 . A A . 2 ILE CG2 1 1 11 7696 1 1 2 ILE H H -7.781 3.660 -1.349 1.00 . A A . 2 ILE H 1 1 11 7697 1 1 2 ILE HA H -6.347 4.640 1.039 1.00 . A A . 2 ILE HA 1 1 11 7698 1 1 2 ILE HB H -5.751 2.464 -0.984 1.00 . A A . 2 ILE HB 1 1 11 7699 1 1 2 ILE HD11 H -5.637 0.421 2.135 1.00 . A A . 2 ILE HD11 1 1 11 7700 1 1 2 ILE HD12 H -4.937 0.609 0.527 1.00 . A A . 2 ILE HD12 1 1 11 7701 1 1 2 ILE HD13 H -6.524 -0.138 0.716 1.00 . A A . 2 ILE HD13 1 1 11 7702 1 1 2 ILE HG12 H -6.564 2.465 1.939 1.00 . A A . 2 ILE HG12 1 1 11 7703 1 1 2 ILE HG13 H -7.516 1.876 0.575 1.00 . A A . 2 ILE HG13 1 1 11 7704 1 1 2 ILE HG21 H -3.979 3.869 0.830 1.00 . A A . 2 ILE HG21 1 1 11 7705 1 1 2 ILE HG22 H -3.595 2.617 -0.352 1.00 . A A . 2 ILE HG22 1 1 11 7706 1 1 2 ILE HG23 H -4.103 2.168 1.276 1.00 . A A . 2 ILE HG23 1 1 11 7707 1 1 2 ILE N N -7.576 4.313 -0.648 1.00 . A A . 2 ILE N 1 1 11 7708 1 1 2 ILE O O -4.325 5.715 -0.181 1.00 . A A . 2 ILE O 1 1 11 7709 1 1 3 VAL C C -4.528 7.677 -2.149 1.00 . A A . 3 VAL C 1 1 11 7710 1 1 3 VAL CA C -4.609 6.294 -2.797 1.00 . A A . 3 VAL CA 1 1 11 7711 1 1 3 VAL CB C -5.143 6.422 -4.228 1.00 . A A . 3 VAL CB 1 1 11 7712 1 1 3 VAL CG1 C -5.620 5.055 -4.717 1.00 . A A . 3 VAL CG1 1 1 11 7713 1 1 3 VAL CG2 C -6.318 7.405 -4.263 1.00 . A A . 3 VAL CG2 1 1 11 7714 1 1 3 VAL H H -6.290 4.997 -2.433 1.00 . A A . 3 VAL H 1 1 11 7715 1 1 3 VAL HA H -3.626 5.857 -2.819 1.00 . A A . 3 VAL HA 1 1 11 7716 1 1 3 VAL HB H -4.354 6.779 -4.875 1.00 . A A . 3 VAL HB 1 1 11 7717 1 1 3 VAL HG11 H -6.603 4.854 -4.318 1.00 . A A . 3 VAL HG11 1 1 11 7718 1 1 3 VAL HG12 H -4.933 4.292 -4.383 1.00 . A A . 3 VAL HG12 1 1 11 7719 1 1 3 VAL HG13 H -5.663 5.054 -5.796 1.00 . A A . 3 VAL HG13 1 1 11 7720 1 1 3 VAL HG21 H -5.943 8.413 -4.358 1.00 . A A . 3 VAL HG21 1 1 11 7721 1 1 3 VAL HG22 H -6.889 7.318 -3.350 1.00 . A A . 3 VAL HG22 1 1 11 7722 1 1 3 VAL HG23 H -6.952 7.176 -5.107 1.00 . A A . 3 VAL HG23 1 1 11 7723 1 1 3 VAL N N -5.517 5.419 -2.003 1.00 . A A . 3 VAL N 1 1 11 7724 1 1 3 VAL O O -3.525 8.357 -2.233 1.00 . A A . 3 VAL O 1 1 11 7725 1 1 4 GLU C C -4.806 9.358 0.466 1.00 . A A . 4 GLU C 1 1 11 7726 1 1 4 GLU CA C -5.573 9.432 -0.854 1.00 . A A . 4 GLU CA 1 1 11 7727 1 1 4 GLU CB C -7.014 9.867 -0.586 1.00 . A A . 4 GLU CB 1 1 11 7728 1 1 4 GLU CD C -8.848 10.505 -2.158 1.00 . A A . 4 GLU CD 1 1 11 7729 1 1 4 GLU CG C -7.909 9.378 -1.726 1.00 . A A . 4 GLU CG 1 1 11 7730 1 1 4 GLU H H -6.372 7.524 -1.457 1.00 . A A . 4 GLU H 1 1 11 7731 1 1 4 GLU HA H -5.098 10.149 -1.507 1.00 . A A . 4 GLU HA 1 1 11 7732 1 1 4 GLU HB2 H -7.352 9.441 0.348 1.00 . A A . 4 GLU HB2 1 1 11 7733 1 1 4 GLU HB3 H -7.062 10.943 -0.530 1.00 . A A . 4 GLU HB3 1 1 11 7734 1 1 4 GLU HG2 H -7.293 9.080 -2.563 1.00 . A A . 4 GLU HG2 1 1 11 7735 1 1 4 GLU HG3 H -8.492 8.534 -1.391 1.00 . A A . 4 GLU HG3 1 1 11 7736 1 1 4 GLU N N -5.578 8.093 -1.508 1.00 . A A . 4 GLU N 1 1 11 7737 1 1 4 GLU O O -4.699 10.329 1.187 1.00 . A A . 4 GLU O 1 1 11 7738 1 1 4 GLU OE1 O -8.478 11.655 -1.989 1.00 . A A . 4 GLU OE1 1 1 11 7739 1 1 4 GLU OE2 O -9.921 10.199 -2.651 1.00 . A A . 4 GLU OE2 1 1 11 7740 1 1 5 GLN C C -2.014 8.024 1.760 1.00 . A A . 5 GLN C 1 1 11 7741 1 1 5 GLN CA C -3.511 8.083 2.062 1.00 . A A . 5 GLN CA 1 1 11 7742 1 1 5 GLN CB C -3.936 6.802 2.781 1.00 . A A . 5 GLN CB 1 1 11 7743 1 1 5 GLN CD C -4.235 7.077 5.246 1.00 . A A . 5 GLN CD 1 1 11 7744 1 1 5 GLN CG C -3.238 6.727 4.140 1.00 . A A . 5 GLN CG 1 1 11 7745 1 1 5 GLN H H -4.367 7.441 0.195 1.00 . A A . 5 GLN H 1 1 11 7746 1 1 5 GLN HA H -3.717 8.935 2.693 1.00 . A A . 5 GLN HA 1 1 11 7747 1 1 5 GLN HB2 H -5.007 6.809 2.925 1.00 . A A . 5 GLN HB2 1 1 11 7748 1 1 5 GLN HB3 H -3.657 5.945 2.187 1.00 . A A . 5 GLN HB3 1 1 11 7749 1 1 5 GLN HE21 H -3.705 8.989 5.313 1.00 . A A . 5 GLN HE21 1 1 11 7750 1 1 5 GLN HE22 H -4.932 8.538 6.396 1.00 . A A . 5 GLN HE22 1 1 11 7751 1 1 5 GLN HG2 H -2.863 5.726 4.296 1.00 . A A . 5 GLN HG2 1 1 11 7752 1 1 5 GLN HG3 H -2.417 7.428 4.163 1.00 . A A . 5 GLN HG3 1 1 11 7753 1 1 5 GLN N N -4.271 8.213 0.789 1.00 . A A . 5 GLN N 1 1 11 7754 1 1 5 GLN NE2 N -4.295 8.303 5.688 1.00 . A A . 5 GLN NE2 1 1 11 7755 1 1 5 GLN O O -1.211 8.636 2.436 1.00 . A A . 5 GLN O 1 1 11 7756 1 1 5 GLN OE1 O -4.967 6.226 5.712 1.00 . A A . 5 GLN OE1 1 1 11 7757 1 1 6 CYS C C 0.127 8.005 -0.834 1.00 . A A . 6 CYS C 1 1 11 7758 1 1 6 CYS CA C -0.179 7.189 0.423 1.00 . A A . 6 CYS CA 1 1 11 7759 1 1 6 CYS CB C 0.198 5.722 0.213 1.00 . A A . 6 CYS CB 1 1 11 7760 1 1 6 CYS H H -2.288 6.795 0.223 1.00 . A A . 6 CYS H 1 1 11 7761 1 1 6 CYS HA H 0.394 7.588 1.240 1.00 . A A . 6 CYS HA 1 1 11 7762 1 1 6 CYS HB2 H -0.454 5.285 -0.529 1.00 . A A . 6 CYS HB2 1 1 11 7763 1 1 6 CYS HB3 H 1.222 5.657 -0.124 1.00 . A A . 6 CYS HB3 1 1 11 7764 1 1 6 CYS N N -1.627 7.286 0.755 1.00 . A A . 6 CYS N 1 1 11 7765 1 1 6 CYS O O 1.136 8.676 -0.913 1.00 . A A . 6 CYS O 1 1 11 7766 1 1 6 CYS SG S 0.018 4.829 1.780 1.00 . A A . 6 CYS SG 1 1 11 7767 1 1 7 CYS C C -0.326 10.242 -2.630 1.00 . A A . 7 CYS C 1 1 11 7768 1 1 7 CYS CA C -0.463 8.777 -3.039 1.00 . A A . 7 CYS CA 1 1 11 7769 1 1 7 CYS CB C -1.618 8.626 -4.025 1.00 . A A . 7 CYS CB 1 1 11 7770 1 1 7 CYS H H -1.550 7.440 -1.740 1.00 . A A . 7 CYS H 1 1 11 7771 1 1 7 CYS HA H 0.459 8.443 -3.501 1.00 . A A . 7 CYS HA 1 1 11 7772 1 1 7 CYS HB2 H -2.051 7.641 -3.926 1.00 . A A . 7 CYS HB2 1 1 11 7773 1 1 7 CYS HB3 H -2.369 9.373 -3.817 1.00 . A A . 7 CYS HB3 1 1 11 7774 1 1 7 CYS N N -0.731 7.974 -1.814 1.00 . A A . 7 CYS N 1 1 11 7775 1 1 7 CYS O O 0.658 10.883 -2.917 1.00 . A A . 7 CYS O 1 1 11 7776 1 1 7 CYS SG S -0.999 8.848 -5.710 1.00 . A A . 7 CYS SG 1 1 11 7777 1 1 8 THR C C -0.022 12.314 -0.532 1.00 . A A . 8 THR C 1 1 11 7778 1 1 8 THR CA C -1.196 12.194 -1.502 1.00 . A A . 8 THR CA 1 1 11 7779 1 1 8 THR CB C -2.489 12.611 -0.799 1.00 . A A . 8 THR CB 1 1 11 7780 1 1 8 THR CG2 C -3.615 12.729 -1.827 1.00 . A A . 8 THR CG2 1 1 11 7781 1 1 8 THR H H -2.083 10.240 -1.702 1.00 . A A . 8 THR H 1 1 11 7782 1 1 8 THR HA H -1.025 12.829 -2.360 1.00 . A A . 8 THR HA 1 1 11 7783 1 1 8 THR HB H -2.345 13.566 -0.317 1.00 . A A . 8 THR HB 1 1 11 7784 1 1 8 THR HG1 H -3.349 12.068 0.857 1.00 . A A . 8 THR HG1 1 1 11 7785 1 1 8 THR HG21 H -4.050 13.716 -1.771 1.00 . A A . 8 THR HG21 1 1 11 7786 1 1 8 THR HG22 H -4.372 11.988 -1.617 1.00 . A A . 8 THR HG22 1 1 11 7787 1 1 8 THR HG23 H -3.216 12.567 -2.817 1.00 . A A . 8 THR HG23 1 1 11 7788 1 1 8 THR N N -1.298 10.775 -1.942 1.00 . A A . 8 THR N 1 1 11 7789 1 1 8 THR O O 0.998 12.897 -0.840 1.00 . A A . 8 THR O 1 1 11 7790 1 1 8 THR OG1 O -2.832 11.635 0.174 1.00 . A A . 8 THR OG1 1 1 11 7791 1 1 9 SER C C 1.782 10.513 1.483 1.00 . A A . 9 SER C 1 1 11 7792 1 1 9 SER CA C 0.961 11.796 1.621 1.00 . A A . 9 SER CA 1 1 11 7793 1 1 9 SER CB C 0.391 11.893 3.036 1.00 . A A . 9 SER CB 1 1 11 7794 1 1 9 SER H H -0.978 11.264 0.854 1.00 . A A . 9 SER H 1 1 11 7795 1 1 9 SER HA H 1.588 12.653 1.418 1.00 . A A . 9 SER HA 1 1 11 7796 1 1 9 SER HB2 H -0.528 11.334 3.094 1.00 . A A . 9 SER HB2 1 1 11 7797 1 1 9 SER HB3 H 1.104 11.484 3.739 1.00 . A A . 9 SER HB3 1 1 11 7798 1 1 9 SER HG H -0.539 13.282 4.032 1.00 . A A . 9 SER HG 1 1 11 7799 1 1 9 SER N N -0.152 11.744 0.634 1.00 . A A . 9 SER N 1 1 11 7800 1 1 9 SER O O 1.242 9.451 1.270 1.00 . A A . 9 SER O 1 1 11 7801 1 1 9 SER OG O 0.131 13.256 3.344 1.00 . A A . 9 SER OG 1 1 11 7802 1 1 10 ILE C C 3.883 8.553 2.736 1.00 . A A . 10 ILE C 1 1 11 7803 1 1 10 ILE CA C 3.908 9.365 1.434 1.00 . A A . 10 ILE CA 1 1 11 7804 1 1 10 ILE CB C 5.351 9.763 1.105 1.00 . A A . 10 ILE CB 1 1 11 7805 1 1 10 ILE CD1 C 5.907 10.532 -1.265 1.00 . A A . 10 ILE CD1 1 1 11 7806 1 1 10 ILE CG1 C 5.341 10.944 0.102 1.00 . A A . 10 ILE CG1 1 1 11 7807 1 1 10 ILE CG2 C 6.093 8.549 0.530 1.00 . A A . 10 ILE CG2 1 1 11 7808 1 1 10 ILE H H 3.505 11.462 1.745 1.00 . A A . 10 ILE H 1 1 11 7809 1 1 10 ILE HA H 3.511 8.763 0.630 1.00 . A A . 10 ILE HA 1 1 11 7810 1 1 10 ILE HB H 5.843 10.074 2.016 1.00 . A A . 10 ILE HB 1 1 11 7811 1 1 10 ILE HD11 H 6.981 10.448 -1.199 1.00 . A A . 10 ILE HD11 1 1 11 7812 1 1 10 ILE HD12 H 5.649 11.279 -2.001 1.00 . A A . 10 ILE HD12 1 1 11 7813 1 1 10 ILE HD13 H 5.488 9.580 -1.556 1.00 . A A . 10 ILE HD13 1 1 11 7814 1 1 10 ILE HG12 H 4.328 11.290 -0.032 1.00 . A A . 10 ILE HG12 1 1 11 7815 1 1 10 ILE HG13 H 5.938 11.751 0.502 1.00 . A A . 10 ILE HG13 1 1 11 7816 1 1 10 ILE HG21 H 7.069 8.855 0.183 1.00 . A A . 10 ILE HG21 1 1 11 7817 1 1 10 ILE HG22 H 5.529 8.141 -0.296 1.00 . A A . 10 ILE HG22 1 1 11 7818 1 1 10 ILE HG23 H 6.202 7.797 1.297 1.00 . A A . 10 ILE HG23 1 1 11 7819 1 1 10 ILE N N 3.077 10.595 1.585 1.00 . A A . 10 ILE N 1 1 11 7820 1 1 10 ILE O O 4.390 8.980 3.754 1.00 . A A . 10 ILE O 1 1 11 7821 1 1 11 CYS C C 4.601 5.865 4.161 1.00 . A A . 11 CYS C 1 1 11 7822 1 1 11 CYS CA C 3.248 6.540 3.943 1.00 . A A . 11 CYS CA 1 1 11 7823 1 1 11 CYS CB C 2.190 5.441 3.792 1.00 . A A . 11 CYS CB 1 1 11 7824 1 1 11 CYS H H 2.899 7.052 1.877 1.00 . A A . 11 CYS H 1 1 11 7825 1 1 11 CYS HA H 3.009 7.157 4.796 1.00 . A A . 11 CYS HA 1 1 11 7826 1 1 11 CYS HB2 H 2.541 4.702 3.088 1.00 . A A . 11 CYS HB2 1 1 11 7827 1 1 11 CYS HB3 H 2.025 4.970 4.750 1.00 . A A . 11 CYS HB3 1 1 11 7828 1 1 11 CYS N N 3.300 7.380 2.709 1.00 . A A . 11 CYS N 1 1 11 7829 1 1 11 CYS O O 5.580 6.181 3.516 1.00 . A A . 11 CYS O 1 1 11 7830 1 1 11 CYS SG S 0.635 6.140 3.193 1.00 . A A . 11 CYS SG 1 1 11 7831 1 1 12 SER C C 5.663 2.694 5.082 1.00 . A A . 12 SER C 1 1 11 7832 1 1 12 SER CA C 5.914 4.184 5.319 1.00 . A A . 12 SER CA 1 1 11 7833 1 1 12 SER CB C 6.351 4.412 6.767 1.00 . A A . 12 SER CB 1 1 11 7834 1 1 12 SER H H 3.834 4.676 5.547 1.00 . A A . 12 SER H 1 1 11 7835 1 1 12 SER HA H 6.684 4.534 4.646 1.00 . A A . 12 SER HA 1 1 11 7836 1 1 12 SER HB2 H 7.419 4.296 6.847 1.00 . A A . 12 SER HB2 1 1 11 7837 1 1 12 SER HB3 H 6.076 5.414 7.070 1.00 . A A . 12 SER HB3 1 1 11 7838 1 1 12 SER HG H 5.368 3.922 8.373 1.00 . A A . 12 SER HG 1 1 11 7839 1 1 12 SER N N 4.646 4.917 5.055 1.00 . A A . 12 SER N 1 1 11 7840 1 1 12 SER O O 4.605 2.183 5.393 1.00 . A A . 12 SER O 1 1 11 7841 1 1 12 SER OG O 5.713 3.458 7.606 1.00 . A A . 12 SER OG 1 1 11 7842 1 1 13 LEU C C 5.728 -0.110 5.471 1.00 . A A . 13 LEU C 1 1 11 7843 1 1 13 LEU CA C 6.402 0.539 4.261 1.00 . A A . 13 LEU CA 1 1 11 7844 1 1 13 LEU CB C 7.744 -0.145 3.994 1.00 . A A . 13 LEU CB 1 1 11 7845 1 1 13 LEU CD1 C 8.059 0.102 1.527 1.00 . A A . 13 LEU CD1 1 1 11 7846 1 1 13 LEU CD2 C 8.664 -2.044 2.654 1.00 . A A . 13 LEU CD2 1 1 11 7847 1 1 13 LEU CG C 7.682 -0.870 2.648 1.00 . A A . 13 LEU CG 1 1 11 7848 1 1 13 LEU H H 7.457 2.421 4.269 1.00 . A A . 13 LEU H 1 1 11 7849 1 1 13 LEU HA H 5.765 0.424 3.396 1.00 . A A . 13 LEU HA 1 1 11 7850 1 1 13 LEU HB2 H 8.529 0.598 3.971 1.00 . A A . 13 LEU HB2 1 1 11 7851 1 1 13 LEU HB3 H 7.947 -0.860 4.777 1.00 . A A . 13 LEU HB3 1 1 11 7852 1 1 13 LEU HD11 H 8.726 0.857 1.915 1.00 . A A . 13 LEU HD11 1 1 11 7853 1 1 13 LEU HD12 H 7.166 0.573 1.144 1.00 . A A . 13 LEU HD12 1 1 11 7854 1 1 13 LEU HD13 H 8.551 -0.438 0.731 1.00 . A A . 13 LEU HD13 1 1 11 7855 1 1 13 LEU HD21 H 8.298 -2.815 3.316 1.00 . A A . 13 LEU HD21 1 1 11 7856 1 1 13 LEU HD22 H 9.630 -1.703 2.996 1.00 . A A . 13 LEU HD22 1 1 11 7857 1 1 13 LEU HD23 H 8.756 -2.441 1.654 1.00 . A A . 13 LEU HD23 1 1 11 7858 1 1 13 LEU HG H 6.677 -1.239 2.482 1.00 . A A . 13 LEU HG 1 1 11 7859 1 1 13 LEU N N 6.613 1.992 4.524 1.00 . A A . 13 LEU N 1 1 11 7860 1 1 13 LEU O O 5.021 -1.090 5.346 1.00 . A A . 13 LEU O 1 1 11 7861 1 1 14 TYR C C 3.766 -0.058 7.691 1.00 . A A . 14 TYR C 1 1 11 7862 1 1 14 TYR CA C 5.283 -0.151 7.847 1.00 . A A . 14 TYR CA 1 1 11 7863 1 1 14 TYR CB C 5.715 0.626 9.093 1.00 . A A . 14 TYR CB 1 1 11 7864 1 1 14 TYR CD1 C 5.467 -1.245 10.850 1.00 . A A . 14 TYR CD1 1 1 11 7865 1 1 14 TYR CD2 C 3.950 0.655 10.972 1.00 . A A . 14 TYR CD2 1 1 11 7866 1 1 14 TYR CE1 C 4.839 -1.807 11.969 1.00 . A A . 14 TYR CE1 1 1 11 7867 1 1 14 TYR CE2 C 3.333 0.079 12.091 1.00 . A A . 14 TYR CE2 1 1 11 7868 1 1 14 TYR CG C 5.031 0.002 10.334 1.00 . A A . 14 TYR CG 1 1 11 7869 1 1 14 TYR CZ C 3.778 -1.146 12.587 1.00 . A A . 14 TYR CZ 1 1 11 7870 1 1 14 TYR H H 6.494 1.230 6.721 1.00 . A A . 14 TYR H 1 1 11 7871 1 1 14 TYR HA H 5.574 -1.187 7.946 1.00 . A A . 14 TYR HA 1 1 11 7872 1 1 14 TYR HB2 H 6.801 0.579 9.181 1.00 . A A . 14 TYR HB2 1 1 11 7873 1 1 14 TYR HB3 H 5.422 1.667 8.982 1.00 . A A . 14 TYR HB3 1 1 11 7874 1 1 14 TYR HD1 H 6.275 -1.778 10.391 1.00 . A A . 14 TYR HD1 1 1 11 7875 1 1 14 TYR HD2 H 3.586 1.594 10.609 1.00 . A A . 14 TYR HD2 1 1 11 7876 1 1 14 TYR HE1 H 5.180 -2.756 12.356 1.00 . A A . 14 TYR HE1 1 1 11 7877 1 1 14 TYR HE2 H 2.509 0.586 12.570 1.00 . A A . 14 TYR HE2 1 1 11 7878 1 1 14 TYR HH H 2.396 -1.175 13.904 1.00 . A A . 14 TYR HH 1 1 11 7879 1 1 14 TYR N N 5.928 0.434 6.640 1.00 . A A . 14 TYR N 1 1 11 7880 1 1 14 TYR O O 3.070 -1.053 7.671 1.00 . A A . 14 TYR O 1 1 11 7881 1 1 14 TYR OH O 3.165 -1.707 13.690 1.00 . A A . 14 TYR OH 1 1 11 7882 1 1 15 GLN C C 1.318 0.472 6.206 1.00 . A A . 15 GLN C 1 1 11 7883 1 1 15 GLN CA C 1.778 1.294 7.409 1.00 . A A . 15 GLN CA 1 1 11 7884 1 1 15 GLN CB C 1.445 2.770 7.182 1.00 . A A . 15 GLN CB 1 1 11 7885 1 1 15 GLN CD C 1.451 4.961 8.384 1.00 . A A . 15 GLN CD 1 1 11 7886 1 1 15 GLN CG C 2.175 3.624 8.221 1.00 . A A . 15 GLN CG 1 1 11 7887 1 1 15 GLN H H 3.829 1.924 7.586 1.00 . A A . 15 GLN H 1 1 11 7888 1 1 15 GLN HA H 1.276 0.944 8.299 1.00 . A A . 15 GLN HA 1 1 11 7889 1 1 15 GLN HB2 H 1.760 3.061 6.190 1.00 . A A . 15 GLN HB2 1 1 11 7890 1 1 15 GLN HB3 H 0.381 2.919 7.281 1.00 . A A . 15 GLN HB3 1 1 11 7891 1 1 15 GLN HE21 H 2.941 6.018 7.610 1.00 . A A . 15 GLN HE21 1 1 11 7892 1 1 15 GLN HE22 H 1.590 6.921 8.100 1.00 . A A . 15 GLN HE22 1 1 11 7893 1 1 15 GLN HG2 H 2.191 3.103 9.168 1.00 . A A . 15 GLN HG2 1 1 11 7894 1 1 15 GLN HG3 H 3.188 3.803 7.891 1.00 . A A . 15 GLN HG3 1 1 11 7895 1 1 15 GLN N N 3.248 1.135 7.572 1.00 . A A . 15 GLN N 1 1 11 7896 1 1 15 GLN NE2 N 2.043 6.058 7.999 1.00 . A A . 15 GLN NE2 1 1 11 7897 1 1 15 GLN O O 0.299 -0.188 6.246 1.00 . A A . 15 GLN O 1 1 11 7898 1 1 15 GLN OE1 O 0.337 5.007 8.867 1.00 . A A . 15 GLN OE1 1 1 11 7899 1 1 16 LEU C C 1.513 -1.758 4.348 1.00 . A A . 16 LEU C 1 1 11 7900 1 1 16 LEU CA C 1.670 -0.296 3.940 1.00 . A A . 16 LEU CA 1 1 11 7901 1 1 16 LEU CB C 2.751 -0.180 2.862 1.00 . A A . 16 LEU CB 1 1 11 7902 1 1 16 LEU CD1 C 2.976 2.259 2.375 1.00 . A A . 16 LEU CD1 1 1 11 7903 1 1 16 LEU CD2 C 2.948 0.607 0.500 1.00 . A A . 16 LEU CD2 1 1 11 7904 1 1 16 LEU CG C 2.383 0.937 1.884 1.00 . A A . 16 LEU CG 1 1 11 7905 1 1 16 LEU H H 2.890 1.028 5.124 1.00 . A A . 16 LEU H 1 1 11 7906 1 1 16 LEU HA H 0.731 0.073 3.556 1.00 . A A . 16 LEU HA 1 1 11 7907 1 1 16 LEU HB2 H 3.699 0.046 3.328 1.00 . A A . 16 LEU HB2 1 1 11 7908 1 1 16 LEU HB3 H 2.826 -1.113 2.326 1.00 . A A . 16 LEU HB3 1 1 11 7909 1 1 16 LEU HD11 H 2.926 2.297 3.453 1.00 . A A . 16 LEU HD11 1 1 11 7910 1 1 16 LEU HD12 H 2.416 3.082 1.958 1.00 . A A . 16 LEU HD12 1 1 11 7911 1 1 16 LEU HD13 H 4.007 2.329 2.061 1.00 . A A . 16 LEU HD13 1 1 11 7912 1 1 16 LEU HD21 H 2.308 1.031 -0.261 1.00 . A A . 16 LEU HD21 1 1 11 7913 1 1 16 LEU HD22 H 2.993 -0.465 0.376 1.00 . A A . 16 LEU HD22 1 1 11 7914 1 1 16 LEU HD23 H 3.941 1.022 0.407 1.00 . A A . 16 LEU HD23 1 1 11 7915 1 1 16 LEU HG H 1.308 1.024 1.825 1.00 . A A . 16 LEU HG 1 1 11 7916 1 1 16 LEU N N 2.066 0.496 5.137 1.00 . A A . 16 LEU N 1 1 11 7917 1 1 16 LEU O O 0.542 -2.406 4.012 1.00 . A A . 16 LEU O 1 1 11 7918 1 1 17 GLU C C 0.963 -3.888 6.157 1.00 . A A . 17 GLU C 1 1 11 7919 1 1 17 GLU CA C 2.342 -3.689 5.532 1.00 . A A . 17 GLU CA 1 1 11 7920 1 1 17 GLU CB C 3.430 -3.975 6.568 1.00 . A A . 17 GLU CB 1 1 11 7921 1 1 17 GLU CD C 5.914 -4.233 6.508 1.00 . A A . 17 GLU CD 1 1 11 7922 1 1 17 GLU CG C 4.594 -4.709 5.900 1.00 . A A . 17 GLU CG 1 1 11 7923 1 1 17 GLU H H 3.221 -1.739 5.364 1.00 . A A . 17 GLU H 1 1 11 7924 1 1 17 GLU HA H 2.460 -4.349 4.685 1.00 . A A . 17 GLU HA 1 1 11 7925 1 1 17 GLU HB2 H 3.783 -3.042 6.983 1.00 . A A . 17 GLU HB2 1 1 11 7926 1 1 17 GLU HB3 H 3.024 -4.586 7.354 1.00 . A A . 17 GLU HB3 1 1 11 7927 1 1 17 GLU HG2 H 4.486 -5.772 6.057 1.00 . A A . 17 GLU HG2 1 1 11 7928 1 1 17 GLU HG3 H 4.591 -4.498 4.841 1.00 . A A . 17 GLU HG3 1 1 11 7929 1 1 17 GLU N N 2.452 -2.279 5.089 1.00 . A A . 17 GLU N 1 1 11 7930 1 1 17 GLU O O 0.439 -4.983 6.205 1.00 . A A . 17 GLU O 1 1 11 7931 1 1 17 GLU OE1 O 6.278 -4.742 7.556 1.00 . A A . 17 GLU OE1 1 1 11 7932 1 1 17 GLU OE2 O 6.539 -3.368 5.917 1.00 . A A . 17 GLU OE2 1 1 11 7933 1 1 18 ASN C C -2.012 -3.205 6.150 1.00 . A A . 18 ASN C 1 1 11 7934 1 1 18 ASN CA C -0.982 -2.932 7.245 1.00 . A A . 18 ASN CA 1 1 11 7935 1 1 18 ASN CB C -1.328 -1.620 7.955 1.00 . A A . 18 ASN CB 1 1 11 7936 1 1 18 ASN CG C -2.458 -1.863 8.957 1.00 . A A . 18 ASN CG 1 1 11 7937 1 1 18 ASN H H 0.812 -1.952 6.572 1.00 . A A . 18 ASN H 1 1 11 7938 1 1 18 ASN HA H -0.990 -3.742 7.959 1.00 . A A . 18 ASN HA 1 1 11 7939 1 1 18 ASN HB2 H -0.456 -1.253 8.477 1.00 . A A . 18 ASN HB2 1 1 11 7940 1 1 18 ASN HB3 H -1.646 -0.890 7.226 1.00 . A A . 18 ASN HB3 1 1 11 7941 1 1 18 ASN HD21 H -3.661 -0.509 8.143 1.00 . A A . 18 ASN HD21 1 1 11 7942 1 1 18 ASN HD22 H -4.292 -1.322 9.492 1.00 . A A . 18 ASN HD22 1 1 11 7943 1 1 18 ASN N N 0.369 -2.824 6.629 1.00 . A A . 18 ASN N 1 1 11 7944 1 1 18 ASN ND2 N -3.562 -1.174 8.855 1.00 . A A . 18 ASN ND2 1 1 11 7945 1 1 18 ASN O O -2.936 -3.973 6.333 1.00 . A A . 18 ASN O 1 1 11 7946 1 1 18 ASN OD1 O -2.337 -2.688 9.840 1.00 . A A . 18 ASN OD1 1 1 11 7947 1 1 19 TYR C C -2.994 -4.329 3.693 1.00 . A A . 19 TYR C 1 1 11 7948 1 1 19 TYR CA C -2.834 -2.823 3.906 1.00 . A A . 19 TYR CA 1 1 11 7949 1 1 19 TYR CB C -2.314 -2.187 2.616 1.00 . A A . 19 TYR CB 1 1 11 7950 1 1 19 TYR CD1 C -3.131 0.071 3.623 1.00 . A A . 19 TYR CD1 1 1 11 7951 1 1 19 TYR CD2 C -1.162 0.097 2.189 1.00 . A A . 19 TYR CD2 1 1 11 7952 1 1 19 TYR CE1 C -3.015 1.458 3.784 1.00 . A A . 19 TYR CE1 1 1 11 7953 1 1 19 TYR CE2 C -1.064 1.481 2.365 1.00 . A A . 19 TYR CE2 1 1 11 7954 1 1 19 TYR CG C -2.199 -0.642 2.812 1.00 . A A . 19 TYR CG 1 1 11 7955 1 1 19 TYR CZ C -1.987 2.159 3.158 1.00 . A A . 19 TYR CZ 1 1 11 7956 1 1 19 TYR H H -1.105 -1.974 4.876 1.00 . A A . 19 TYR H 1 1 11 7957 1 1 19 TYR HA H -3.788 -2.390 4.166 1.00 . A A . 19 TYR HA 1 1 11 7958 1 1 19 TYR HB2 H -1.334 -2.631 2.377 1.00 . A A . 19 TYR HB2 1 1 11 7959 1 1 19 TYR HB3 H -3.014 -2.422 1.802 1.00 . A A . 19 TYR HB3 1 1 11 7960 1 1 19 TYR HD1 H -3.934 -0.432 4.125 1.00 . A A . 19 TYR HD1 1 1 11 7961 1 1 19 TYR HD2 H -0.435 -0.387 1.583 1.00 . A A . 19 TYR HD2 1 1 11 7962 1 1 19 TYR HE1 H -3.725 1.986 4.399 1.00 . A A . 19 TYR HE1 1 1 11 7963 1 1 19 TYR HE2 H -0.268 2.028 1.879 1.00 . A A . 19 TYR HE2 1 1 11 7964 1 1 19 TYR HH H -2.308 3.758 4.152 1.00 . A A . 19 TYR HH 1 1 11 7965 1 1 19 TYR N N -1.860 -2.588 5.008 1.00 . A A . 19 TYR N 1 1 11 7966 1 1 19 TYR O O -4.051 -4.808 3.335 1.00 . A A . 19 TYR O 1 1 11 7967 1 1 19 TYR OH O -1.881 3.526 3.323 1.00 . A A . 19 TYR OH 1 1 11 7968 1 1 20 CYS C C -2.555 -7.199 5.002 1.00 . A A . 20 CYS C 1 1 11 7969 1 1 20 CYS CA C -2.031 -6.552 3.720 1.00 . A A . 20 CYS CA 1 1 11 7970 1 1 20 CYS CB C -0.642 -7.100 3.401 1.00 . A A . 20 CYS CB 1 1 11 7971 1 1 20 CYS H H -1.104 -4.668 4.196 1.00 . A A . 20 CYS H 1 1 11 7972 1 1 20 CYS HA H -2.699 -6.773 2.900 1.00 . A A . 20 CYS HA 1 1 11 7973 1 1 20 CYS HB2 H 0.108 -6.474 3.862 1.00 . A A . 20 CYS HB2 1 1 11 7974 1 1 20 CYS HB3 H -0.555 -8.108 3.780 1.00 . A A . 20 CYS HB3 1 1 11 7975 1 1 20 CYS N N -1.947 -5.077 3.909 1.00 . A A . 20 CYS N 1 1 11 7976 1 1 20 CYS O O -1.960 -8.114 5.536 1.00 . A A . 20 CYS O 1 1 11 7977 1 1 20 CYS SG S -0.408 -7.107 1.608 1.00 . A A . 20 CYS SG 1 1 11 7978 1 1 21 ASN C C -5.482 -8.116 6.428 1.00 . A A . 21 ASN C 1 1 11 7979 1 1 21 ASN CA C -4.221 -7.314 6.754 1.00 . A A . 21 ASN CA 1 1 11 7980 1 1 21 ASN CB C -4.569 -6.189 7.730 1.00 . A A . 21 ASN CB 1 1 11 7981 1 1 21 ASN CG C -5.092 -6.790 9.034 1.00 . A A . 21 ASN CG 1 1 11 7982 1 1 21 ASN H H -4.125 -5.988 5.060 1.00 . A A . 21 ASN H 1 1 11 7983 1 1 21 ASN HA H -3.486 -7.965 7.205 1.00 . A A . 21 ASN HA 1 1 11 7984 1 1 21 ASN HB2 H -3.685 -5.601 7.931 1.00 . A A . 21 ASN HB2 1 1 11 7985 1 1 21 ASN HB3 H -5.330 -5.558 7.295 1.00 . A A . 21 ASN HB3 1 1 11 7986 1 1 21 ASN HD21 H -6.963 -6.209 8.718 1.00 . A A . 21 ASN HD21 1 1 11 7987 1 1 21 ASN HD22 H -6.702 -7.058 10.164 1.00 . A A . 21 ASN HD22 1 1 11 7988 1 1 21 ASN N N -3.663 -6.728 5.504 1.00 . A A . 21 ASN N 1 1 11 7989 1 1 21 ASN ND2 N -6.357 -6.676 9.330 1.00 . A A . 21 ASN ND2 1 1 11 7990 1 1 21 ASN O O -6.347 -7.578 5.757 1.00 . A A . 21 ASN O 1 1 11 7991 1 1 21 ASN OXT O -5.563 -9.256 6.858 1.00 . A A . 21 ASN OXT 1 1 11 7992 1 1 21 ASN OD1 O -4.341 -7.370 9.793 1.00 . A A . 21 ASN OD1 1 1 11 7993 2 2 1 PHE C C 10.275 2.504 -0.333 1.00 . B B . 22 PHE C 1 1 11 7994 2 2 1 PHE CA C 11.143 1.251 -0.181 1.00 . B B . 22 PHE CA 1 1 11 7995 2 2 1 PHE CB C 12.530 1.643 0.334 1.00 . B B . 22 PHE CB 1 1 11 7996 2 2 1 PHE CD1 C 12.134 0.454 2.523 1.00 . B B . 22 PHE CD1 1 1 11 7997 2 2 1 PHE CD2 C 14.174 -0.016 1.293 1.00 . B B . 22 PHE CD2 1 1 11 7998 2 2 1 PHE CE1 C 12.527 -0.449 3.520 1.00 . B B . 22 PHE CE1 1 1 11 7999 2 2 1 PHE CE2 C 14.566 -0.920 2.291 1.00 . B B . 22 PHE CE2 1 1 11 8000 2 2 1 PHE CG C 12.958 0.672 1.409 1.00 . B B . 22 PHE CG 1 1 11 8001 2 2 1 PHE CZ C 13.742 -1.136 3.404 1.00 . B B . 22 PHE CZ 1 1 11 8002 2 2 1 PHE H1 H 11.802 -0.312 -1.387 1.00 . B B . 22 PHE H1 1 1 11 8003 2 2 1 PHE H2 H 11.798 1.203 -2.155 1.00 . B B . 22 PHE H2 1 1 11 8004 2 2 1 PHE H3 H 10.337 0.377 -1.890 1.00 . B B . 22 PHE H3 1 1 11 8005 2 2 1 PHE HA H 10.677 0.573 0.521 1.00 . B B . 22 PHE HA 1 1 11 8006 2 2 1 PHE HB2 H 13.237 1.612 -0.483 1.00 . B B . 22 PHE HB2 1 1 11 8007 2 2 1 PHE HB3 H 12.496 2.641 0.742 1.00 . B B . 22 PHE HB3 1 1 11 8008 2 2 1 PHE HD1 H 11.198 0.984 2.613 1.00 . B B . 22 PHE HD1 1 1 11 8009 2 2 1 PHE HD2 H 14.810 0.150 0.435 1.00 . B B . 22 PHE HD2 1 1 11 8010 2 2 1 PHE HE1 H 11.892 -0.615 4.377 1.00 . B B . 22 PHE HE1 1 1 11 8011 2 2 1 PHE HE2 H 15.502 -1.451 2.202 1.00 . B B . 22 PHE HE2 1 1 11 8012 2 2 1 PHE HZ H 14.043 -1.833 4.173 1.00 . B B . 22 PHE HZ 1 1 11 8013 2 2 1 PHE N N 11.280 0.578 -1.503 1.00 . B B . 22 PHE N 1 1 11 8014 2 2 1 PHE O O 9.581 2.672 -1.315 1.00 . B B . 22 PHE O 1 1 11 8015 2 2 2 VAL C C 10.180 5.642 -0.366 1.00 . B B . 23 VAL C 1 1 11 8016 2 2 2 VAL CA C 9.481 4.626 0.537 1.00 . B B . 23 VAL CA 1 1 11 8017 2 2 2 VAL CB C 9.276 5.250 1.928 1.00 . B B . 23 VAL CB 1 1 11 8018 2 2 2 VAL CG1 C 8.008 4.681 2.559 1.00 . B B . 23 VAL CG1 1 1 11 8019 2 2 2 VAL CG2 C 10.474 4.945 2.830 1.00 . B B . 23 VAL CG2 1 1 11 8020 2 2 2 VAL H H 10.874 3.225 1.413 1.00 . B B . 23 VAL H 1 1 11 8021 2 2 2 VAL HA H 8.518 4.381 0.112 1.00 . B B . 23 VAL HA 1 1 11 8022 2 2 2 VAL HB H 9.169 6.319 1.827 1.00 . B B . 23 VAL HB 1 1 11 8023 2 2 2 VAL HG11 H 8.267 3.869 3.220 1.00 . B B . 23 VAL HG11 1 1 11 8024 2 2 2 VAL HG12 H 7.351 4.320 1.781 1.00 . B B . 23 VAL HG12 1 1 11 8025 2 2 2 VAL HG13 H 7.509 5.456 3.120 1.00 . B B . 23 VAL HG13 1 1 11 8026 2 2 2 VAL HG21 H 10.458 5.607 3.684 1.00 . B B . 23 VAL HG21 1 1 11 8027 2 2 2 VAL HG22 H 11.388 5.095 2.275 1.00 . B B . 23 VAL HG22 1 1 11 8028 2 2 2 VAL HG23 H 10.420 3.921 3.167 1.00 . B B . 23 VAL HG23 1 1 11 8029 2 2 2 VAL N N 10.308 3.384 0.632 1.00 . B B . 23 VAL N 1 1 11 8030 2 2 2 VAL O O 11.128 5.323 -1.055 1.00 . B B . 23 VAL O 1 1 11 8031 2 2 3 ASN C C 9.661 7.915 -2.598 1.00 . B B . 24 ASN C 1 1 11 8032 2 2 3 ASN CA C 10.309 7.932 -1.214 1.00 . B B . 24 ASN CA 1 1 11 8033 2 2 3 ASN CB C 11.819 7.715 -1.348 1.00 . B B . 24 ASN CB 1 1 11 8034 2 2 3 ASN CG C 12.505 9.057 -1.608 1.00 . B B . 24 ASN CG 1 1 11 8035 2 2 3 ASN H H 8.928 7.073 0.200 1.00 . B B . 24 ASN H 1 1 11 8036 2 2 3 ASN HA H 10.128 8.892 -0.752 1.00 . B B . 24 ASN HA 1 1 11 8037 2 2 3 ASN HB2 H 12.203 7.285 -0.434 1.00 . B B . 24 ASN HB2 1 1 11 8038 2 2 3 ASN HB3 H 12.016 7.046 -2.172 1.00 . B B . 24 ASN HB3 1 1 11 8039 2 2 3 ASN HD21 H 12.923 8.639 -3.504 1.00 . B B . 24 ASN HD21 1 1 11 8040 2 2 3 ASN HD22 H 13.436 10.166 -2.967 1.00 . B B . 24 ASN HD22 1 1 11 8041 2 2 3 ASN N N 9.702 6.861 -0.364 1.00 . B B . 24 ASN N 1 1 11 8042 2 2 3 ASN ND2 N 12.995 9.308 -2.791 1.00 . B B . 24 ASN ND2 1 1 11 8043 2 2 3 ASN O O 9.842 8.819 -3.389 1.00 . B B . 24 ASN O 1 1 11 8044 2 2 3 ASN OD1 O 12.593 9.888 -0.726 1.00 . B B . 24 ASN OD1 1 1 11 8045 2 2 4 GLN C C 6.752 7.171 -4.068 1.00 . B B . 25 GLN C 1 1 11 8046 2 2 4 GLN CA C 8.236 6.833 -4.227 1.00 . B B . 25 GLN CA 1 1 11 8047 2 2 4 GLN CB C 8.387 5.425 -4.806 1.00 . B B . 25 GLN CB 1 1 11 8048 2 2 4 GLN CD C 9.826 4.024 -6.301 1.00 . B B . 25 GLN CD 1 1 11 8049 2 2 4 GLN CG C 9.416 5.453 -5.939 1.00 . B B . 25 GLN CG 1 1 11 8050 2 2 4 GLN H H 8.761 6.183 -2.242 1.00 . B B . 25 GLN H 1 1 11 8051 2 2 4 GLN HA H 8.696 7.548 -4.893 1.00 . B B . 25 GLN HA 1 1 11 8052 2 2 4 GLN HB2 H 8.719 4.750 -4.031 1.00 . B B . 25 GLN HB2 1 1 11 8053 2 2 4 GLN HB3 H 7.436 5.090 -5.193 1.00 . B B . 25 GLN HB3 1 1 11 8054 2 2 4 GLN HE21 H 11.600 4.152 -5.415 1.00 . B B . 25 GLN HE21 1 1 11 8055 2 2 4 GLN HE22 H 11.266 2.663 -6.158 1.00 . B B . 25 GLN HE22 1 1 11 8056 2 2 4 GLN HG2 H 8.984 5.934 -6.805 1.00 . B B . 25 GLN HG2 1 1 11 8057 2 2 4 GLN HG3 H 10.287 6.004 -5.618 1.00 . B B . 25 GLN HG3 1 1 11 8058 2 2 4 GLN N N 8.900 6.899 -2.896 1.00 . B B . 25 GLN N 1 1 11 8059 2 2 4 GLN NE2 N 10.994 3.575 -5.926 1.00 . B B . 25 GLN NE2 1 1 11 8060 2 2 4 GLN O O 6.133 6.840 -3.076 1.00 . B B . 25 GLN O 1 1 11 8061 2 2 4 GLN OE1 O 9.077 3.308 -6.935 1.00 . B B . 25 GLN OE1 1 1 11 8062 2 2 5 HIS C C 3.932 7.065 -5.585 1.00 . B B . 26 HIS C 1 1 11 8063 2 2 5 HIS CA C 4.737 8.200 -4.938 1.00 . B B . 26 HIS CA 1 1 11 8064 2 2 5 HIS CB C 4.514 9.501 -5.711 1.00 . B B . 26 HIS CB 1 1 11 8065 2 2 5 HIS CD2 C 2.736 11.357 -5.235 1.00 . B B . 26 HIS CD2 1 1 11 8066 2 2 5 HIS CE1 C 3.109 11.567 -3.105 1.00 . B B . 26 HIS CE1 1 1 11 8067 2 2 5 HIS CG C 3.705 10.460 -4.885 1.00 . B B . 26 HIS CG 1 1 11 8068 2 2 5 HIS H H 6.697 8.095 -5.825 1.00 . B B . 26 HIS H 1 1 11 8069 2 2 5 HIS HA H 4.450 8.323 -3.904 1.00 . B B . 26 HIS HA 1 1 11 8070 2 2 5 HIS HB2 H 5.467 9.947 -5.951 1.00 . B B . 26 HIS HB2 1 1 11 8071 2 2 5 HIS HB3 H 3.978 9.281 -6.622 1.00 . B B . 26 HIS HB3 1 1 11 8072 2 2 5 HIS HD2 H 2.334 11.492 -6.226 1.00 . B B . 26 HIS HD2 1 1 11 8073 2 2 5 HIS HE1 H 3.055 11.910 -2.082 1.00 . B B . 26 HIS HE1 1 1 11 8074 2 2 5 HIS HE2 H 1.685 12.771 -4.056 1.00 . B B . 26 HIS HE2 1 1 11 8075 2 2 5 HIS N N 6.178 7.834 -5.035 1.00 . B B . 26 HIS N 1 1 11 8076 2 2 5 HIS ND1 N 3.930 10.600 -3.532 1.00 . B B . 26 HIS ND1 1 1 11 8077 2 2 5 HIS NE2 N 2.359 12.061 -4.112 1.00 . B B . 26 HIS NE2 1 1 11 8078 2 2 5 HIS O O 4.471 6.297 -6.357 1.00 . B B . 26 HIS O 1 1 11 8079 2 2 6 LEU C C 0.392 6.018 -5.887 1.00 . B B . 27 LEU C 1 1 11 8080 2 2 6 LEU CA C 1.910 5.799 -5.930 1.00 . B B . 27 LEU CA 1 1 11 8081 2 2 6 LEU CB C 2.241 4.491 -5.207 1.00 . B B . 27 LEU CB 1 1 11 8082 2 2 6 LEU CD1 C 1.366 5.478 -3.074 1.00 . B B . 27 LEU CD1 1 1 11 8083 2 2 6 LEU CD2 C 2.786 3.437 -3.015 1.00 . B B . 27 LEU CD2 1 1 11 8084 2 2 6 LEU CG C 2.548 4.764 -3.731 1.00 . B B . 27 LEU CG 1 1 11 8085 2 2 6 LEU H H 2.223 7.533 -4.663 1.00 . B B . 27 LEU H 1 1 11 8086 2 2 6 LEU HA H 2.221 5.713 -6.960 1.00 . B B . 27 LEU HA 1 1 11 8087 2 2 6 LEU HB2 H 1.398 3.819 -5.279 1.00 . B B . 27 LEU HB2 1 1 11 8088 2 2 6 LEU HB3 H 3.103 4.036 -5.671 1.00 . B B . 27 LEU HB3 1 1 11 8089 2 2 6 LEU HD11 H 0.443 5.036 -3.417 1.00 . B B . 27 LEU HD11 1 1 11 8090 2 2 6 LEU HD12 H 1.384 6.525 -3.337 1.00 . B B . 27 LEU HD12 1 1 11 8091 2 2 6 LEU HD13 H 1.436 5.375 -2.001 1.00 . B B . 27 LEU HD13 1 1 11 8092 2 2 6 LEU HD21 H 2.250 2.652 -3.528 1.00 . B B . 27 LEU HD21 1 1 11 8093 2 2 6 LEU HD22 H 2.432 3.510 -1.998 1.00 . B B . 27 LEU HD22 1 1 11 8094 2 2 6 LEU HD23 H 3.842 3.213 -3.015 1.00 . B B . 27 LEU HD23 1 1 11 8095 2 2 6 LEU HG H 3.431 5.382 -3.654 1.00 . B B . 27 LEU HG 1 1 11 8096 2 2 6 LEU N N 2.664 6.924 -5.291 1.00 . B B . 27 LEU N 1 1 11 8097 2 2 6 LEU O O -0.173 6.395 -4.881 1.00 . B B . 27 LEU O 1 1 11 8098 2 2 7 CYS C C -2.358 4.611 -7.647 1.00 . B B . 28 CYS C 1 1 11 8099 2 2 7 CYS CA C -1.756 5.883 -7.033 1.00 . B B . 28 CYS CA 1 1 11 8100 2 2 7 CYS CB C -2.142 7.084 -7.905 1.00 . B B . 28 CYS CB 1 1 11 8101 2 2 7 CYS H H 0.208 5.417 -7.770 1.00 . B B . 28 CYS H 1 1 11 8102 2 2 7 CYS HA H -2.138 6.018 -6.031 1.00 . B B . 28 CYS HA 1 1 11 8103 2 2 7 CYS HB2 H -1.302 7.363 -8.523 1.00 . B B . 28 CYS HB2 1 1 11 8104 2 2 7 CYS HB3 H -2.976 6.812 -8.537 1.00 . B B . 28 CYS HB3 1 1 11 8105 2 2 7 CYS N N -0.272 5.742 -6.981 1.00 . B B . 28 CYS N 1 1 11 8106 2 2 7 CYS O O -1.774 4.007 -8.524 1.00 . B B . 28 CYS O 1 1 11 8107 2 2 7 CYS SG S -2.612 8.491 -6.866 1.00 . B B . 28 CYS SG 1 1 11 8108 2 2 8 GLY C C -3.192 1.976 -8.258 1.00 . B B . 29 GLY C 1 1 11 8109 2 2 8 GLY CA C -4.207 2.998 -7.737 1.00 . B B . 29 GLY CA 1 1 11 8110 2 2 8 GLY H H -3.965 4.741 -6.491 1.00 . B B . 29 GLY H 1 1 11 8111 2 2 8 GLY HA2 H -4.796 2.544 -6.954 1.00 . B B . 29 GLY HA2 1 1 11 8112 2 2 8 GLY HA3 H -4.860 3.289 -8.547 1.00 . B B . 29 GLY HA3 1 1 11 8113 2 2 8 GLY N N -3.525 4.220 -7.194 1.00 . B B . 29 GLY N 1 1 11 8114 2 2 8 GLY O O -2.563 1.266 -7.499 1.00 . B B . 29 GLY O 1 1 11 8115 2 2 9 SER C C -0.794 0.888 -9.311 1.00 . B B . 30 SER C 1 1 11 8116 2 2 9 SER CA C -2.078 0.913 -10.139 1.00 . B B . 30 SER CA 1 1 11 8117 2 2 9 SER CB C -1.748 1.321 -11.575 1.00 . B B . 30 SER CB 1 1 11 8118 2 2 9 SER H H -3.566 2.470 -10.144 1.00 . B B . 30 SER H 1 1 11 8119 2 2 9 SER HA H -2.524 -0.071 -10.139 1.00 . B B . 30 SER HA 1 1 11 8120 2 2 9 SER HB2 H -2.599 1.139 -12.209 1.00 . B B . 30 SER HB2 1 1 11 8121 2 2 9 SER HB3 H -1.502 2.375 -11.601 1.00 . B B . 30 SER HB3 1 1 11 8122 2 2 9 SER HG H 0.157 0.945 -11.689 1.00 . B B . 30 SER HG 1 1 11 8123 2 2 9 SER N N -3.040 1.892 -9.554 1.00 . B B . 30 SER N 1 1 11 8124 2 2 9 SER O O -0.452 -0.114 -8.715 1.00 . B B . 30 SER O 1 1 11 8125 2 2 9 SER OG O -0.646 0.552 -12.038 1.00 . B B . 30 SER OG 1 1 11 8126 2 2 10 ASP C C 0.878 1.448 -7.072 1.00 . B B . 31 ASP C 1 1 11 8127 2 2 10 ASP CA C 1.178 1.995 -8.464 1.00 . B B . 31 ASP CA 1 1 11 8128 2 2 10 ASP CB C 1.714 3.423 -8.340 1.00 . B B . 31 ASP CB 1 1 11 8129 2 2 10 ASP CG C 1.455 4.191 -9.638 1.00 . B B . 31 ASP CG 1 1 11 8130 2 2 10 ASP H H -0.371 2.778 -9.747 1.00 . B B . 31 ASP H 1 1 11 8131 2 2 10 ASP HA H 1.918 1.371 -8.945 1.00 . B B . 31 ASP HA 1 1 11 8132 2 2 10 ASP HB2 H 1.219 3.920 -7.519 1.00 . B B . 31 ASP HB2 1 1 11 8133 2 2 10 ASP HB3 H 2.776 3.391 -8.150 1.00 . B B . 31 ASP HB3 1 1 11 8134 2 2 10 ASP N N -0.080 1.978 -9.264 1.00 . B B . 31 ASP N 1 1 11 8135 2 2 10 ASP O O 1.700 0.797 -6.458 1.00 . B B . 31 ASP O 1 1 11 8136 2 2 10 ASP OD1 O 2.263 4.073 -10.544 1.00 . B B . 31 ASP OD1 1 1 11 8137 2 2 10 ASP OD2 O 0.452 4.883 -9.704 1.00 . B B . 31 ASP OD2 1 1 11 8138 2 2 11 LEU C C -0.564 -0.343 -5.230 1.00 . B B . 32 LEU C 1 1 11 8139 2 2 11 LEU CA C -0.651 1.184 -5.219 1.00 . B B . 32 LEU CA 1 1 11 8140 2 2 11 LEU CB C -2.071 1.617 -4.851 1.00 . B B . 32 LEU CB 1 1 11 8141 2 2 11 LEU CD1 C -1.626 3.869 -3.861 1.00 . B B . 32 LEU CD1 1 1 11 8142 2 2 11 LEU CD2 C -3.429 2.421 -2.919 1.00 . B B . 32 LEU CD2 1 1 11 8143 2 2 11 LEU CG C -2.038 2.428 -3.555 1.00 . B B . 32 LEU CG 1 1 11 8144 2 2 11 LEU H H -0.954 2.222 -7.082 1.00 . B B . 32 LEU H 1 1 11 8145 2 2 11 LEU HA H 0.047 1.577 -4.494 1.00 . B B . 32 LEU HA 1 1 11 8146 2 2 11 LEU HB2 H -2.480 2.224 -5.645 1.00 . B B . 32 LEU HB2 1 1 11 8147 2 2 11 LEU HB3 H -2.688 0.742 -4.710 1.00 . B B . 32 LEU HB3 1 1 11 8148 2 2 11 LEU HD11 H -1.320 4.357 -2.948 1.00 . B B . 32 LEU HD11 1 1 11 8149 2 2 11 LEU HD12 H -2.464 4.400 -4.289 1.00 . B B . 32 LEU HD12 1 1 11 8150 2 2 11 LEU HD13 H -0.805 3.868 -4.562 1.00 . B B . 32 LEU HD13 1 1 11 8151 2 2 11 LEU HD21 H -3.416 1.804 -2.033 1.00 . B B . 32 LEU HD21 1 1 11 8152 2 2 11 LEU HD22 H -4.144 2.024 -3.624 1.00 . B B . 32 LEU HD22 1 1 11 8153 2 2 11 LEU HD23 H -3.708 3.430 -2.652 1.00 . B B . 32 LEU HD23 1 1 11 8154 2 2 11 LEU HG H -1.326 1.988 -2.872 1.00 . B B . 32 LEU HG 1 1 11 8155 2 2 11 LEU N N -0.301 1.700 -6.570 1.00 . B B . 32 LEU N 1 1 11 8156 2 2 11 LEU O O 0.280 -0.927 -4.581 1.00 . B B . 32 LEU O 1 1 11 8157 2 2 12 VAL C C 0.087 -2.901 -6.292 1.00 . B B . 33 VAL C 1 1 11 8158 2 2 12 VAL CA C -1.358 -2.485 -6.021 1.00 . B B . 33 VAL CA 1 1 11 8159 2 2 12 VAL CB C -2.260 -3.007 -7.144 1.00 . B B . 33 VAL CB 1 1 11 8160 2 2 12 VAL CG1 C -3.712 -2.614 -6.864 1.00 . B B . 33 VAL CG1 1 1 11 8161 2 2 12 VAL CG2 C -1.818 -2.401 -8.477 1.00 . B B . 33 VAL CG2 1 1 11 8162 2 2 12 VAL H H -2.087 -0.512 -6.499 1.00 . B B . 33 VAL H 1 1 11 8163 2 2 12 VAL HA H -1.682 -2.892 -5.073 1.00 . B B . 33 VAL HA 1 1 11 8164 2 2 12 VAL HB H -2.184 -4.084 -7.193 1.00 . B B . 33 VAL HB 1 1 11 8165 2 2 12 VAL HG11 H -3.869 -1.587 -7.157 1.00 . B B . 33 VAL HG11 1 1 11 8166 2 2 12 VAL HG12 H -3.919 -2.726 -5.811 1.00 . B B . 33 VAL HG12 1 1 11 8167 2 2 12 VAL HG13 H -4.372 -3.254 -7.431 1.00 . B B . 33 VAL HG13 1 1 11 8168 2 2 12 VAL HG21 H -2.233 -2.979 -9.290 1.00 . B B . 33 VAL HG21 1 1 11 8169 2 2 12 VAL HG22 H -0.740 -2.415 -8.538 1.00 . B B . 33 VAL HG22 1 1 11 8170 2 2 12 VAL HG23 H -2.170 -1.382 -8.543 1.00 . B B . 33 VAL HG23 1 1 11 8171 2 2 12 VAL N N -1.418 -0.997 -5.972 1.00 . B B . 33 VAL N 1 1 11 8172 2 2 12 VAL O O 0.542 -3.936 -5.848 1.00 . B B . 33 VAL O 1 1 11 8173 2 2 13 GLU C C 3.055 -2.230 -6.036 1.00 . B B . 34 GLU C 1 1 11 8174 2 2 13 GLU CA C 2.232 -2.420 -7.307 1.00 . B B . 34 GLU CA 1 1 11 8175 2 2 13 GLU CB C 2.753 -1.487 -8.402 1.00 . B B . 34 GLU CB 1 1 11 8176 2 2 13 GLU CD C 3.263 -1.281 -10.839 1.00 . B B . 34 GLU CD 1 1 11 8177 2 2 13 GLU CG C 2.733 -2.213 -9.749 1.00 . B B . 34 GLU CG 1 1 11 8178 2 2 13 GLU H H 0.428 -1.257 -7.352 1.00 . B B . 34 GLU H 1 1 11 8179 2 2 13 GLU HA H 2.305 -3.446 -7.635 1.00 . B B . 34 GLU HA 1 1 11 8180 2 2 13 GLU HB2 H 2.124 -0.610 -8.456 1.00 . B B . 34 GLU HB2 1 1 11 8181 2 2 13 GLU HB3 H 3.764 -1.190 -8.170 1.00 . B B . 34 GLU HB3 1 1 11 8182 2 2 13 GLU HG2 H 3.356 -3.094 -9.692 1.00 . B B . 34 GLU HG2 1 1 11 8183 2 2 13 GLU HG3 H 1.720 -2.502 -9.986 1.00 . B B . 34 GLU HG3 1 1 11 8184 2 2 13 GLU N N 0.814 -2.090 -7.012 1.00 . B B . 34 GLU N 1 1 11 8185 2 2 13 GLU O O 3.673 -3.152 -5.542 1.00 . B B . 34 GLU O 1 1 11 8186 2 2 13 GLU OE1 O 4.290 -0.661 -10.615 1.00 . B B . 34 GLU OE1 1 1 11 8187 2 2 13 GLU OE2 O 2.633 -1.201 -11.881 1.00 . B B . 34 GLU OE2 1 1 11 8188 2 2 14 ALA C C 3.268 -1.726 -3.153 1.00 . B B . 35 ALA C 1 1 11 8189 2 2 14 ALA CA C 3.827 -0.808 -4.240 1.00 . B B . 35 ALA CA 1 1 11 8190 2 2 14 ALA CB C 3.677 0.653 -3.810 1.00 . B B . 35 ALA CB 1 1 11 8191 2 2 14 ALA H H 2.540 -0.314 -5.894 1.00 . B B . 35 ALA H 1 1 11 8192 2 2 14 ALA HA H 4.869 -1.035 -4.410 1.00 . B B . 35 ALA HA 1 1 11 8193 2 2 14 ALA HB1 H 2.682 0.814 -3.421 1.00 . B B . 35 ALA HB1 1 1 11 8194 2 2 14 ALA HB2 H 3.839 1.297 -4.662 1.00 . B B . 35 ALA HB2 1 1 11 8195 2 2 14 ALA HB3 H 4.403 0.879 -3.044 1.00 . B B . 35 ALA HB3 1 1 11 8196 2 2 14 ALA N N 3.056 -1.043 -5.490 1.00 . B B . 35 ALA N 1 1 11 8197 2 2 14 ALA O O 3.998 -2.333 -2.394 1.00 . B B . 35 ALA O 1 1 11 8198 2 2 15 LEU C C 1.839 -4.156 -2.290 1.00 . B B . 36 LEU C 1 1 11 8199 2 2 15 LEU CA C 1.338 -2.729 -2.077 1.00 . B B . 36 LEU CA 1 1 11 8200 2 2 15 LEU CB C -0.183 -2.701 -2.271 1.00 . B B . 36 LEU CB 1 1 11 8201 2 2 15 LEU CD1 C -0.942 -2.034 0.012 1.00 . B B . 36 LEU CD1 1 1 11 8202 2 2 15 LEU CD2 C 0.074 -0.325 -1.501 1.00 . B B . 36 LEU CD2 1 1 11 8203 2 2 15 LEU CG C -0.807 -1.577 -1.439 1.00 . B B . 36 LEU CG 1 1 11 8204 2 2 15 LEU H H 1.406 -1.351 -3.725 1.00 . B B . 36 LEU H 1 1 11 8205 2 2 15 LEU HA H 1.588 -2.392 -1.084 1.00 . B B . 36 LEU HA 1 1 11 8206 2 2 15 LEU HB2 H -0.405 -2.537 -3.315 1.00 . B B . 36 LEU HB2 1 1 11 8207 2 2 15 LEU HB3 H -0.600 -3.647 -1.961 1.00 . B B . 36 LEU HB3 1 1 11 8208 2 2 15 LEU HD11 H -1.689 -1.433 0.506 1.00 . B B . 36 LEU HD11 1 1 11 8209 2 2 15 LEU HD12 H 0.006 -1.918 0.516 1.00 . B B . 36 LEU HD12 1 1 11 8210 2 2 15 LEU HD13 H -1.239 -3.072 0.036 1.00 . B B . 36 LEU HD13 1 1 11 8211 2 2 15 LEU HD21 H 0.503 -0.237 -2.488 1.00 . B B . 36 LEU HD21 1 1 11 8212 2 2 15 LEU HD22 H 0.864 -0.404 -0.770 1.00 . B B . 36 LEU HD22 1 1 11 8213 2 2 15 LEU HD23 H -0.527 0.548 -1.290 1.00 . B B . 36 LEU HD23 1 1 11 8214 2 2 15 LEU HG H -1.787 -1.347 -1.831 1.00 . B B . 36 LEU HG 1 1 11 8215 2 2 15 LEU N N 1.969 -1.842 -3.091 1.00 . B B . 36 LEU N 1 1 11 8216 2 2 15 LEU O O 1.939 -4.944 -1.368 1.00 . B B . 36 LEU O 1 1 11 8217 2 2 16 TYR C C 4.113 -5.987 -3.479 1.00 . B B . 37 TYR C 1 1 11 8218 2 2 16 TYR CA C 2.628 -5.862 -3.825 1.00 . B B . 37 TYR CA 1 1 11 8219 2 2 16 TYR CB C 2.424 -6.136 -5.316 1.00 . B B . 37 TYR CB 1 1 11 8220 2 2 16 TYR CD1 C 2.544 -8.706 -5.494 1.00 . B B . 37 TYR CD1 1 1 11 8221 2 2 16 TYR CD2 C 4.460 -7.410 -6.253 1.00 . B B . 37 TYR CD2 1 1 11 8222 2 2 16 TYR CE1 C 3.215 -9.884 -5.843 1.00 . B B . 37 TYR CE1 1 1 11 8223 2 2 16 TYR CE2 C 5.117 -8.598 -6.595 1.00 . B B . 37 TYR CE2 1 1 11 8224 2 2 16 TYR CG C 3.158 -7.444 -5.698 1.00 . B B . 37 TYR CG 1 1 11 8225 2 2 16 TYR CZ C 4.496 -9.830 -6.391 1.00 . B B . 37 TYR CZ 1 1 11 8226 2 2 16 TYR H H 2.046 -3.830 -4.229 1.00 . B B . 37 TYR H 1 1 11 8227 2 2 16 TYR HA H 2.065 -6.581 -3.249 1.00 . B B . 37 TYR HA 1 1 11 8228 2 2 16 TYR HB2 H 1.355 -6.215 -5.516 1.00 . B B . 37 TYR HB2 1 1 11 8229 2 2 16 TYR HB3 H 2.819 -5.298 -5.886 1.00 . B B . 37 TYR HB3 1 1 11 8230 2 2 16 TYR HD1 H 1.563 -8.777 -5.069 1.00 . B B . 37 TYR HD1 1 1 11 8231 2 2 16 TYR HD2 H 4.964 -6.479 -6.412 1.00 . B B . 37 TYR HD2 1 1 11 8232 2 2 16 TYR HE1 H 2.739 -10.840 -5.683 1.00 . B B . 37 TYR HE1 1 1 11 8233 2 2 16 TYR HE2 H 6.109 -8.561 -7.020 1.00 . B B . 37 TYR HE2 1 1 11 8234 2 2 16 TYR HH H 4.676 -11.730 -6.332 1.00 . B B . 37 TYR HH 1 1 11 8235 2 2 16 TYR N N 2.144 -4.489 -3.511 1.00 . B B . 37 TYR N 1 1 11 8236 2 2 16 TYR O O 4.653 -7.073 -3.412 1.00 . B B . 37 TYR O 1 1 11 8237 2 2 16 TYR OH O 5.150 -10.997 -6.732 1.00 . B B . 37 TYR OH 1 1 11 8238 2 2 17 LEU C C 6.351 -5.048 -1.376 1.00 . B B . 38 LEU C 1 1 11 8239 2 2 17 LEU CA C 6.225 -4.964 -2.893 1.00 . B B . 38 LEU CA 1 1 11 8240 2 2 17 LEU CB C 6.979 -3.724 -3.392 1.00 . B B . 38 LEU CB 1 1 11 8241 2 2 17 LEU CD1 C 6.971 -1.829 -5.015 1.00 . B B . 38 LEU CD1 1 1 11 8242 2 2 17 LEU CD2 C 6.076 -4.053 -5.697 1.00 . B B . 38 LEU CD2 1 1 11 8243 2 2 17 LEU CG C 6.213 -3.068 -4.538 1.00 . B B . 38 LEU CG 1 1 11 8244 2 2 17 LEU H H 4.324 -4.023 -3.293 1.00 . B B . 38 LEU H 1 1 11 8245 2 2 17 LEU HA H 6.654 -5.847 -3.340 1.00 . B B . 38 LEU HA 1 1 11 8246 2 2 17 LEU HB2 H 7.083 -3.019 -2.580 1.00 . B B . 38 LEU HB2 1 1 11 8247 2 2 17 LEU HB3 H 7.958 -4.018 -3.739 1.00 . B B . 38 LEU HB3 1 1 11 8248 2 2 17 LEU HD11 H 6.480 -1.421 -5.886 1.00 . B B . 38 LEU HD11 1 1 11 8249 2 2 17 LEU HD12 H 7.985 -2.102 -5.269 1.00 . B B . 38 LEU HD12 1 1 11 8250 2 2 17 LEU HD13 H 6.983 -1.088 -4.229 1.00 . B B . 38 LEU HD13 1 1 11 8251 2 2 17 LEU HD21 H 5.204 -4.670 -5.541 1.00 . B B . 38 LEU HD21 1 1 11 8252 2 2 17 LEU HD22 H 6.956 -4.675 -5.747 1.00 . B B . 38 LEU HD22 1 1 11 8253 2 2 17 LEU HD23 H 5.968 -3.504 -6.621 1.00 . B B . 38 LEU HD23 1 1 11 8254 2 2 17 LEU HG H 5.237 -2.782 -4.192 1.00 . B B . 38 LEU HG 1 1 11 8255 2 2 17 LEU N N 4.778 -4.889 -3.247 1.00 . B B . 38 LEU N 1 1 11 8256 2 2 17 LEU O O 7.070 -5.870 -0.844 1.00 . B B . 38 LEU O 1 1 11 8257 2 2 18 VAL C C 5.173 -5.576 1.311 1.00 . B B . 39 VAL C 1 1 11 8258 2 2 18 VAL CA C 5.712 -4.234 0.811 1.00 . B B . 39 VAL CA 1 1 11 8259 2 2 18 VAL CB C 4.876 -3.082 1.379 1.00 . B B . 39 VAL CB 1 1 11 8260 2 2 18 VAL CG1 C 5.130 -1.820 0.554 1.00 . B B . 39 VAL CG1 1 1 11 8261 2 2 18 VAL CG2 C 3.388 -3.435 1.311 1.00 . B B . 39 VAL CG2 1 1 11 8262 2 2 18 VAL H H 5.068 -3.554 -1.126 1.00 . B B . 39 VAL H 1 1 11 8263 2 2 18 VAL HA H 6.739 -4.121 1.126 1.00 . B B . 39 VAL HA 1 1 11 8264 2 2 18 VAL HB H 5.159 -2.904 2.405 1.00 . B B . 39 VAL HB 1 1 11 8265 2 2 18 VAL HG11 H 5.081 -0.954 1.197 1.00 . B B . 39 VAL HG11 1 1 11 8266 2 2 18 VAL HG12 H 4.381 -1.738 -0.219 1.00 . B B . 39 VAL HG12 1 1 11 8267 2 2 18 VAL HG13 H 6.109 -1.878 0.101 1.00 . B B . 39 VAL HG13 1 1 11 8268 2 2 18 VAL HG21 H 3.071 -3.840 2.260 1.00 . B B . 39 VAL HG21 1 1 11 8269 2 2 18 VAL HG22 H 3.228 -4.168 0.534 1.00 . B B . 39 VAL HG22 1 1 11 8270 2 2 18 VAL HG23 H 2.818 -2.545 1.090 1.00 . B B . 39 VAL HG23 1 1 11 8271 2 2 18 VAL N N 5.646 -4.205 -0.674 1.00 . B B . 39 VAL N 1 1 11 8272 2 2 18 VAL O O 5.477 -6.012 2.403 1.00 . B B . 39 VAL O 1 1 11 8273 2 2 19 CYS C C 4.617 -8.674 0.259 1.00 . B B . 40 CYS C 1 1 11 8274 2 2 19 CYS CA C 3.830 -7.557 0.940 1.00 . B B . 40 CYS CA 1 1 11 8275 2 2 19 CYS CB C 2.355 -7.651 0.546 1.00 . B B . 40 CYS CB 1 1 11 8276 2 2 19 CYS H H 4.149 -5.875 -0.367 1.00 . B B . 40 CYS H 1 1 11 8277 2 2 19 CYS HA H 3.923 -7.655 2.006 1.00 . B B . 40 CYS HA 1 1 11 8278 2 2 19 CYS HB2 H 2.258 -7.557 -0.523 1.00 . B B . 40 CYS HB2 1 1 11 8279 2 2 19 CYS HB3 H 1.960 -8.604 0.861 1.00 . B B . 40 CYS HB3 1 1 11 8280 2 2 19 CYS N N 4.378 -6.240 0.514 1.00 . B B . 40 CYS N 1 1 11 8281 2 2 19 CYS O O 4.947 -9.676 0.861 1.00 . B B . 40 CYS O 1 1 11 8282 2 2 19 CYS SG S 1.432 -6.322 1.351 1.00 . B B . 40 CYS SG 1 1 11 8283 2 2 20 GLY C C 4.762 -10.680 -2.149 1.00 . B B . 41 GLY C 1 1 11 8284 2 2 20 GLY CA C 5.695 -9.543 -1.728 1.00 . B B . 41 GLY CA 1 1 11 8285 2 2 20 GLY H H 4.645 -7.683 -1.447 1.00 . B B . 41 GLY H 1 1 11 8286 2 2 20 GLY HA2 H 6.144 -9.101 -2.606 1.00 . B B . 41 GLY HA2 1 1 11 8287 2 2 20 GLY HA3 H 6.469 -9.937 -1.087 1.00 . B B . 41 GLY HA3 1 1 11 8288 2 2 20 GLY N N 4.922 -8.502 -0.992 1.00 . B B . 41 GLY N 1 1 11 8289 2 2 20 GLY O O 4.744 -11.088 -3.293 1.00 . B B . 41 GLY O 1 1 11 8290 2 2 21 GLU C C 2.178 -12.654 -0.393 1.00 . B B . 42 GLU C 1 1 11 8291 2 2 21 GLU CA C 3.062 -12.310 -1.593 1.00 . B B . 42 GLU CA 1 1 11 8292 2 2 21 GLU CB C 3.878 -13.539 -1.993 1.00 . B B . 42 GLU CB 1 1 11 8293 2 2 21 GLU CD C 5.747 -15.051 -1.314 1.00 . B B . 42 GLU CD 1 1 11 8294 2 2 21 GLU CG C 5.048 -13.722 -1.023 1.00 . B B . 42 GLU CG 1 1 11 8295 2 2 21 GLU H H 4.016 -10.857 -0.317 1.00 . B B . 42 GLU H 1 1 11 8296 2 2 21 GLU HA H 2.440 -12.007 -2.423 1.00 . B B . 42 GLU HA 1 1 11 8297 2 2 21 GLU HB2 H 3.246 -14.414 -1.962 1.00 . B B . 42 GLU HB2 1 1 11 8298 2 2 21 GLU HB3 H 4.261 -13.405 -2.993 1.00 . B B . 42 GLU HB3 1 1 11 8299 2 2 21 GLU HG2 H 5.751 -12.909 -1.148 1.00 . B B . 42 GLU HG2 1 1 11 8300 2 2 21 GLU HG3 H 4.679 -13.726 -0.009 1.00 . B B . 42 GLU HG3 1 1 11 8301 2 2 21 GLU N N 3.987 -11.198 -1.236 1.00 . B B . 42 GLU N 1 1 11 8302 2 2 21 GLU O O 1.823 -13.797 -0.179 1.00 . B B . 42 GLU O 1 1 11 8303 2 2 21 GLU OE1 O 6.167 -15.243 -2.443 1.00 . B B . 42 GLU OE1 1 1 11 8304 2 2 21 GLU OE2 O 5.850 -15.856 -0.402 1.00 . B B . 42 GLU OE2 1 1 11 8305 2 2 22 ARG C C -0.161 -12.915 1.188 1.00 . B B . 43 ARG C 1 1 11 8306 2 2 22 ARG CA C 0.958 -11.942 1.575 1.00 . B B . 43 ARG CA 1 1 11 8307 2 2 22 ARG CB C 0.361 -10.618 2.087 1.00 . B B . 43 ARG CB 1 1 11 8308 2 2 22 ARG CD C -0.571 -9.905 -0.135 1.00 . B B . 43 ARG CD 1 1 11 8309 2 2 22 ARG CG C -0.917 -10.258 1.314 1.00 . B B . 43 ARG CG 1 1 11 8310 2 2 22 ARG CZ C -0.933 -11.052 -2.240 1.00 . B B . 43 ARG CZ 1 1 11 8311 2 2 22 ARG H H 2.120 -10.763 0.195 1.00 . B B . 43 ARG H 1 1 11 8312 2 2 22 ARG HA H 1.559 -12.386 2.355 1.00 . B B . 43 ARG HA 1 1 11 8313 2 2 22 ARG HB2 H 0.125 -10.718 3.136 1.00 . B B . 43 ARG HB2 1 1 11 8314 2 2 22 ARG HB3 H 1.087 -9.829 1.960 1.00 . B B . 43 ARG HB3 1 1 11 8315 2 2 22 ARG HD2 H -0.781 -8.860 -0.310 1.00 . B B . 43 ARG HD2 1 1 11 8316 2 2 22 ARG HD3 H 0.475 -10.094 -0.313 1.00 . B B . 43 ARG HD3 1 1 11 8317 2 2 22 ARG HE H -2.278 -11.051 -0.780 1.00 . B B . 43 ARG HE 1 1 11 8318 2 2 22 ARG HG2 H -1.595 -11.098 1.327 1.00 . B B . 43 ARG HG2 1 1 11 8319 2 2 22 ARG HG3 H -1.390 -9.410 1.784 1.00 . B B . 43 ARG HG3 1 1 11 8320 2 2 22 ARG HH11 H -1.440 -9.303 -3.073 1.00 . B B . 43 ARG HH11 1 1 11 8321 2 2 22 ARG HH12 H -0.668 -10.439 -4.128 1.00 . B B . 43 ARG HH12 1 1 11 8322 2 2 22 ARG HH21 H -0.316 -12.874 -1.686 1.00 . B B . 43 ARG HH21 1 1 11 8323 2 2 22 ARG HH22 H -0.035 -12.459 -3.344 1.00 . B B . 43 ARG HH22 1 1 11 8324 2 2 22 ARG N N 1.820 -11.675 0.388 1.00 . B B . 43 ARG N 1 1 11 8325 2 2 22 ARG NE N -1.392 -10.738 -1.059 1.00 . B B . 43 ARG NE 1 1 11 8326 2 2 22 ARG NH1 N -1.020 -10.198 -3.223 1.00 . B B . 43 ARG NH1 1 1 11 8327 2 2 22 ARG NH2 N -0.385 -12.219 -2.439 1.00 . B B . 43 ARG NH2 1 1 11 8328 2 2 22 ARG O O -0.608 -12.945 0.059 1.00 . B B . 43 ARG O 1 1 11 8329 2 2 23 GLY C C -3.025 -13.911 1.643 1.00 . B B . 44 GLY C 1 1 11 8330 2 2 23 GLY CA C -1.708 -14.673 1.803 1.00 . B B . 44 GLY CA 1 1 11 8331 2 2 23 GLY H H -0.245 -13.666 3.024 1.00 . B B . 44 GLY H 1 1 11 8332 2 2 23 GLY HA2 H -1.475 -15.192 0.884 1.00 . B B . 44 GLY HA2 1 1 11 8333 2 2 23 GLY HA3 H -1.804 -15.386 2.607 1.00 . B B . 44 GLY HA3 1 1 11 8334 2 2 23 GLY N N -0.618 -13.708 2.118 1.00 . B B . 44 GLY N 1 1 11 8335 2 2 23 GLY O O -3.923 -14.340 0.946 1.00 . B B . 44 GLY O 1 1 11 8336 2 2 24 GLY C C -4.077 -10.616 1.565 1.00 . B B . 45 GLY C 1 1 11 8337 2 2 24 GLY CA C -4.399 -11.984 2.169 1.00 . B B . 45 GLY CA 1 1 11 8338 2 2 24 GLY H H -2.406 -12.451 2.837 1.00 . B B . 45 GLY H 1 1 11 8339 2 2 24 GLY HA2 H -5.100 -12.505 1.532 1.00 . B B . 45 GLY HA2 1 1 11 8340 2 2 24 GLY HA3 H -4.831 -11.848 3.148 1.00 . B B . 45 GLY HA3 1 1 11 8341 2 2 24 GLY N N -3.144 -12.779 2.283 1.00 . B B . 45 GLY N 1 1 11 8342 2 2 24 GLY O O -3.556 -9.741 2.229 1.00 . B B . 45 GLY O 1 1 11 8343 2 2 25 PHE C C -5.048 -8.052 0.189 1.00 . B B . 46 PHE C 1 1 11 8344 2 2 25 PHE CA C -4.083 -9.117 -0.337 1.00 . B B . 46 PHE CA 1 1 11 8345 2 2 25 PHE CB C -4.238 -9.253 -1.857 1.00 . B B . 46 PHE CB 1 1 11 8346 2 2 25 PHE CD1 C -6.725 -9.828 -1.327 1.00 . B B . 46 PHE CD1 1 1 11 8347 2 2 25 PHE CD2 C -6.224 -8.741 -3.450 1.00 . B B . 46 PHE CD2 1 1 11 8348 2 2 25 PHE CE1 C -8.083 -9.839 -1.667 1.00 . B B . 46 PHE CE1 1 1 11 8349 2 2 25 PHE CE2 C -7.588 -8.761 -3.768 1.00 . B B . 46 PHE CE2 1 1 11 8350 2 2 25 PHE CG C -5.758 -9.274 -2.221 1.00 . B B . 46 PHE CG 1 1 11 8351 2 2 25 PHE CZ C -8.512 -9.310 -2.882 1.00 . B B . 46 PHE CZ 1 1 11 8352 2 2 25 PHE H H -4.793 -11.146 -0.208 1.00 . B B . 46 PHE H 1 1 11 8353 2 2 25 PHE HA H -3.069 -8.824 -0.106 1.00 . B B . 46 PHE HA 1 1 11 8354 2 2 25 PHE HB2 H -3.726 -8.403 -2.337 1.00 . B B . 46 PHE HB2 1 1 11 8355 2 2 25 PHE HB3 H -3.749 -10.183 -2.178 1.00 . B B . 46 PHE HB3 1 1 11 8356 2 2 25 PHE HD1 H -6.438 -10.242 -0.381 1.00 . B B . 46 PHE HD1 1 1 11 8357 2 2 25 PHE HD2 H -5.549 -8.309 -4.149 1.00 . B B . 46 PHE HD2 1 1 11 8358 2 2 25 PHE HE1 H -8.803 -10.260 -0.982 1.00 . B B . 46 PHE HE1 1 1 11 8359 2 2 25 PHE HE2 H -7.926 -8.352 -4.709 1.00 . B B . 46 PHE HE2 1 1 11 8360 2 2 25 PHE HZ H -9.562 -9.322 -3.135 1.00 . B B . 46 PHE HZ 1 1 11 8361 2 2 25 PHE N N -4.377 -10.426 0.310 1.00 . B B . 46 PHE N 1 1 11 8362 2 2 25 PHE O O -5.591 -8.170 1.269 1.00 . B B . 46 PHE O 1 1 11 8363 2 2 26 TYR C C -7.432 -6.555 0.506 1.00 . B B . 47 TYR C 1 1 11 8364 2 2 26 TYR CA C -6.187 -5.933 -0.120 1.00 . B B . 47 TYR CA 1 1 11 8365 2 2 26 TYR CB C -6.603 -5.057 -1.301 1.00 . B B . 47 TYR CB 1 1 11 8366 2 2 26 TYR CD1 C -4.176 -4.633 -2.135 1.00 . B B . 47 TYR CD1 1 1 11 8367 2 2 26 TYR CD2 C -5.779 -5.569 -3.714 1.00 . B B . 47 TYR CD2 1 1 11 8368 2 2 26 TYR CE1 C -3.193 -4.668 -3.132 1.00 . B B . 47 TYR CE1 1 1 11 8369 2 2 26 TYR CE2 C -4.780 -5.596 -4.694 1.00 . B B . 47 TYR CE2 1 1 11 8370 2 2 26 TYR CG C -5.500 -5.085 -2.408 1.00 . B B . 47 TYR CG 1 1 11 8371 2 2 26 TYR CZ C -3.495 -5.144 -4.405 1.00 . B B . 47 TYR CZ 1 1 11 8372 2 2 26 TYR H H -4.809 -6.941 -1.431 1.00 . B B . 47 TYR H 1 1 11 8373 2 2 26 TYR HA H -5.700 -5.324 0.606 1.00 . B B . 47 TYR HA 1 1 11 8374 2 2 26 TYR HB2 H -7.556 -5.433 -1.678 1.00 . B B . 47 TYR HB2 1 1 11 8375 2 2 26 TYR HB3 H -6.752 -4.037 -0.935 1.00 . B B . 47 TYR HB3 1 1 11 8376 2 2 26 TYR HD1 H -3.903 -4.267 -1.167 1.00 . B B . 47 TYR HD1 1 1 11 8377 2 2 26 TYR HD2 H -6.748 -5.931 -3.970 1.00 . B B . 47 TYR HD2 1 1 11 8378 2 2 26 TYR HE1 H -2.193 -4.323 -2.911 1.00 . B B . 47 TYR HE1 1 1 11 8379 2 2 26 TYR HE2 H -5.009 -5.964 -5.683 1.00 . B B . 47 TYR HE2 1 1 11 8380 2 2 26 TYR HH H -2.606 -6.000 -5.862 1.00 . B B . 47 TYR HH 1 1 11 8381 2 2 26 TYR N N -5.261 -7.011 -0.570 1.00 . B B . 47 TYR N 1 1 11 8382 2 2 26 TYR O O -7.664 -6.438 1.692 1.00 . B B . 47 TYR O 1 1 11 8383 2 2 26 TYR OH O -2.518 -5.174 -5.380 1.00 . B B . 47 TYR OH 1 1 11 8384 2 2 27 THR C C -10.563 -6.791 0.491 1.00 . B B . 48 THR C 1 1 11 8385 2 2 27 THR CA C -9.494 -7.850 0.190 1.00 . B B . 48 THR CA 1 1 11 8386 2 2 27 THR CB C -9.209 -8.678 1.452 1.00 . B B . 48 THR CB 1 1 11 8387 2 2 27 THR CG2 C -10.515 -8.943 2.201 1.00 . B B . 48 THR CG2 1 1 11 8388 2 2 27 THR H H -8.007 -7.248 -1.247 1.00 . B B . 48 THR H 1 1 11 8389 2 2 27 THR HA H -9.865 -8.508 -0.582 1.00 . B B . 48 THR HA 1 1 11 8390 2 2 27 THR HB H -8.537 -8.144 2.098 1.00 . B B . 48 THR HB 1 1 11 8391 2 2 27 THR HG1 H -7.668 -9.798 1.060 1.00 . B B . 48 THR HG1 1 1 11 8392 2 2 27 THR HG21 H -11.299 -9.155 1.489 1.00 . B B . 48 THR HG21 1 1 11 8393 2 2 27 THR HG22 H -10.781 -8.068 2.777 1.00 . B B . 48 THR HG22 1 1 11 8394 2 2 27 THR HG23 H -10.388 -9.785 2.862 1.00 . B B . 48 THR HG23 1 1 11 8395 2 2 27 THR N N -8.234 -7.199 -0.300 1.00 . B B . 48 THR N 1 1 11 8396 2 2 27 THR O O -11.708 -7.110 0.741 1.00 . B B . 48 THR O 1 1 11 8397 2 2 27 THR OG1 O -8.620 -9.916 1.080 1.00 . B B . 48 THR OG1 1 1 11 8398 2 2 28 LYS C C -11.927 -4.791 2.070 1.00 . B B . 49 LYS C 1 1 11 8399 2 2 28 LYS CA C -11.204 -4.475 0.757 1.00 . B B . 49 LYS CA 1 1 11 8400 2 2 28 LYS CB C -12.225 -4.412 -0.382 1.00 . B B . 49 LYS CB 1 1 11 8401 2 2 28 LYS CD C -13.666 -2.872 -1.726 1.00 . B B . 49 LYS CD 1 1 11 8402 2 2 28 LYS CE C -14.939 -3.709 -1.581 1.00 . B B . 49 LYS CE 1 1 11 8403 2 2 28 LYS CG C -12.820 -3.005 -0.457 1.00 . B B . 49 LYS CG 1 1 11 8404 2 2 28 LYS H H -9.284 -5.309 0.270 1.00 . B B . 49 LYS H 1 1 11 8405 2 2 28 LYS HA H -10.701 -3.524 0.842 1.00 . B B . 49 LYS HA 1 1 11 8406 2 2 28 LYS HB2 H -11.737 -4.648 -1.317 1.00 . B B . 49 LYS HB2 1 1 11 8407 2 2 28 LYS HB3 H -13.015 -5.125 -0.198 1.00 . B B . 49 LYS HB3 1 1 11 8408 2 2 28 LYS HD2 H -13.930 -1.835 -1.874 1.00 . B B . 49 LYS HD2 1 1 11 8409 2 2 28 LYS HD3 H -13.099 -3.225 -2.575 1.00 . B B . 49 LYS HD3 1 1 11 8410 2 2 28 LYS HE2 H -15.302 -3.985 -2.560 1.00 . B B . 49 LYS HE2 1 1 11 8411 2 2 28 LYS HE3 H -14.720 -4.602 -1.013 1.00 . B B . 49 LYS HE3 1 1 11 8412 2 2 28 LYS HG2 H -13.440 -2.830 0.410 1.00 . B B . 49 LYS HG2 1 1 11 8413 2 2 28 LYS HG3 H -12.022 -2.278 -0.481 1.00 . B B . 49 LYS HG3 1 1 11 8414 2 2 28 LYS HZ1 H -16.657 -3.555 -0.413 1.00 . B B . 49 LYS HZ1 1 1 11 8415 2 2 28 LYS HZ2 H -16.484 -2.313 -1.559 1.00 . B B . 49 LYS HZ2 1 1 11 8416 2 2 28 LYS HZ3 H -15.530 -2.314 -0.153 1.00 . B B . 49 LYS HZ3 1 1 11 8417 2 2 28 LYS N N -10.205 -5.544 0.471 1.00 . B B . 49 LYS N 1 1 11 8418 2 2 28 LYS NZ N -15.981 -2.913 -0.873 1.00 . B B . 49 LYS NZ 1 1 11 8419 2 2 28 LYS O O -12.936 -5.468 2.073 1.00 . B B . 49 LYS O 1 1 11 8420 2 2 29 PRO C C -13.166 -3.600 4.713 1.00 . B B . 50 PRO C 1 1 11 8421 2 2 29 PRO CA C -11.946 -4.498 4.493 1.00 . B B . 50 PRO CA 1 1 11 8422 2 2 29 PRO CB C -10.800 -4.107 5.430 1.00 . B B . 50 PRO CB 1 1 11 8423 2 2 29 PRO CD C -10.158 -3.470 3.131 1.00 . B B . 50 PRO CD 1 1 11 8424 2 2 29 PRO CG C -9.871 -3.180 4.615 1.00 . B B . 50 PRO CG 1 1 11 8425 2 2 29 PRO HA H -12.199 -5.531 4.636 1.00 . B B . 50 PRO HA 1 1 11 8426 2 2 29 PRO HB2 H -11.190 -3.584 6.292 1.00 . B B . 50 PRO HB2 1 1 11 8427 2 2 29 PRO HB3 H -10.257 -4.986 5.740 1.00 . B B . 50 PRO HB3 1 1 11 8428 2 2 29 PRO HD2 H -10.327 -2.550 2.592 1.00 . B B . 50 PRO HD2 1 1 11 8429 2 2 29 PRO HD3 H -9.347 -4.029 2.690 1.00 . B B . 50 PRO HD3 1 1 11 8430 2 2 29 PRO HG2 H -10.088 -2.146 4.843 1.00 . B B . 50 PRO HG2 1 1 11 8431 2 2 29 PRO HG3 H -8.839 -3.402 4.836 1.00 . B B . 50 PRO HG3 1 1 11 8432 2 2 29 PRO N N -11.383 -4.290 3.150 1.00 . B B . 50 PRO N 1 1 11 8433 2 2 29 PRO O O -13.265 -2.523 4.159 1.00 . B B . 50 PRO O 1 1 11 8434 2 2 30 THR C C -16.023 -2.933 4.447 1.00 . B B . 51 THR C 1 1 11 8435 2 2 30 THR CA C -15.308 -3.208 5.772 1.00 . B B . 51 THR CA 1 1 11 8436 2 2 30 THR CB C -14.896 -1.882 6.416 1.00 . B B . 51 THR CB 1 1 11 8437 2 2 30 THR CG2 C -15.931 -1.480 7.467 1.00 . B B . 51 THR CG2 1 1 11 8438 2 2 30 THR H H -13.998 -4.907 5.953 1.00 . B B . 51 THR H 1 1 11 8439 2 2 30 THR HA H -15.973 -3.740 6.436 1.00 . B B . 51 THR HA 1 1 11 8440 2 2 30 THR HB H -14.840 -1.116 5.659 1.00 . B B . 51 THR HB 1 1 11 8441 2 2 30 THR HG1 H -13.559 -1.385 7.739 1.00 . B B . 51 THR HG1 1 1 11 8442 2 2 30 THR HG21 H -15.454 -0.887 8.234 1.00 . B B . 51 THR HG21 1 1 11 8443 2 2 30 THR HG22 H -16.357 -2.367 7.911 1.00 . B B . 51 THR HG22 1 1 11 8444 2 2 30 THR HG23 H -16.713 -0.900 6.999 1.00 . B B . 51 THR HG23 1 1 11 8445 2 2 30 THR N N -14.096 -4.036 5.517 1.00 . B B . 51 THR N 1 1 11 8446 2 2 30 THR O O -16.911 -2.097 4.438 1.00 . B B . 51 THR O 1 1 11 8447 2 2 30 THR OXT O -15.670 -3.564 3.465 1.00 . B B . 51 THR OXT 1 1 11 8448 2 2 30 THR OG1 O -13.625 -2.033 7.034 1.00 . B B . 51 THR OG1 1 1 12 8449 1 1 1 GLY C C -8.630 6.957 -0.852 1.00 . A A . 1 GLY C 1 1 12 8450 1 1 1 GLY CA C -9.845 7.151 -1.692 1.00 . A A . 1 GLY CA 1 1 12 8451 1 1 1 GLY H1 H -10.050 5.244 -2.586 1.00 . A A . 1 GLY H1 1 1 12 8452 1 1 1 GLY H2 H -11.419 6.234 -2.769 1.00 . A A . 1 GLY H2 1 1 12 8453 1 1 1 GLY H3 H -11.097 5.497 -1.272 1.00 . A A . 1 GLY H3 1 1 12 8454 1 1 1 GLY HA2 H -9.200 7.400 -2.380 1.00 . A A . 1 GLY HA2 1 1 12 8455 1 1 1 GLY HA3 H -10.603 8.005 -1.446 1.00 . A A . 1 GLY HA3 1 1 12 8456 1 1 1 GLY N N -10.669 5.934 -2.114 1.00 . A A . 1 GLY N 1 1 12 8457 1 1 1 GLY O O -8.495 7.544 0.203 1.00 . A A . 1 GLY O 1 1 12 8458 1 1 2 ILE C C -5.336 6.742 -1.072 1.00 . A A . 2 ILE C 1 1 12 8459 1 1 2 ILE CA C -6.480 5.899 -0.488 1.00 . A A . 2 ILE CA 1 1 12 8460 1 1 2 ILE CB C -6.144 4.393 -0.514 1.00 . A A . 2 ILE CB 1 1 12 8461 1 1 2 ILE CD1 C -6.479 2.262 0.747 1.00 . A A . 2 ILE CD1 1 1 12 8462 1 1 2 ILE CG1 C -6.485 3.787 0.849 1.00 . A A . 2 ILE CG1 1 1 12 8463 1 1 2 ILE CG2 C -4.655 4.155 -0.807 1.00 . A A . 2 ILE CG2 1 1 12 8464 1 1 2 ILE H H -7.844 5.666 -2.141 1.00 . A A . 2 ILE H 1 1 12 8465 1 1 2 ILE HA H -6.658 6.205 0.533 1.00 . A A . 2 ILE HA 1 1 12 8466 1 1 2 ILE HB H -6.737 3.909 -1.276 1.00 . A A . 2 ILE HB 1 1 12 8467 1 1 2 ILE HD11 H -6.965 1.960 -0.169 1.00 . A A . 2 ILE HD11 1 1 12 8468 1 1 2 ILE HD12 H -7.007 1.843 1.590 1.00 . A A . 2 ILE HD12 1 1 12 8469 1 1 2 ILE HD13 H -5.460 1.905 0.747 1.00 . A A . 2 ILE HD13 1 1 12 8470 1 1 2 ILE HG12 H -5.751 4.103 1.576 1.00 . A A . 2 ILE HG12 1 1 12 8471 1 1 2 ILE HG13 H -7.464 4.121 1.155 1.00 . A A . 2 ILE HG13 1 1 12 8472 1 1 2 ILE HG21 H -4.430 4.486 -1.810 1.00 . A A . 2 ILE HG21 1 1 12 8473 1 1 2 ILE HG22 H -4.434 3.102 -0.718 1.00 . A A . 2 ILE HG22 1 1 12 8474 1 1 2 ILE HG23 H -4.056 4.710 -0.101 1.00 . A A . 2 ILE HG23 1 1 12 8475 1 1 2 ILE N N -7.717 6.132 -1.288 1.00 . A A . 2 ILE N 1 1 12 8476 1 1 2 ILE O O -4.421 7.131 -0.375 1.00 . A A . 2 ILE O 1 1 12 8477 1 1 3 VAL C C -4.031 9.061 -2.071 1.00 . A A . 3 VAL C 1 1 12 8478 1 1 3 VAL CA C -4.304 7.851 -2.965 1.00 . A A . 3 VAL CA 1 1 12 8479 1 1 3 VAL CB C -4.746 8.321 -4.363 1.00 . A A . 3 VAL CB 1 1 12 8480 1 1 3 VAL CG1 C -5.551 7.215 -5.042 1.00 . A A . 3 VAL CG1 1 1 12 8481 1 1 3 VAL CG2 C -5.623 9.573 -4.248 1.00 . A A . 3 VAL CG2 1 1 12 8482 1 1 3 VAL H H -6.136 6.708 -2.885 1.00 . A A . 3 VAL H 1 1 12 8483 1 1 3 VAL HA H -3.407 7.259 -3.050 1.00 . A A . 3 VAL HA 1 1 12 8484 1 1 3 VAL HB H -3.873 8.545 -4.958 1.00 . A A . 3 VAL HB 1 1 12 8485 1 1 3 VAL HG11 H -6.600 7.351 -4.823 1.00 . A A . 3 VAL HG11 1 1 12 8486 1 1 3 VAL HG12 H -5.228 6.255 -4.670 1.00 . A A . 3 VAL HG12 1 1 12 8487 1 1 3 VAL HG13 H -5.396 7.261 -6.109 1.00 . A A . 3 VAL HG13 1 1 12 8488 1 1 3 VAL HG21 H -5.017 10.408 -3.931 1.00 . A A . 3 VAL HG21 1 1 12 8489 1 1 3 VAL HG22 H -6.406 9.400 -3.524 1.00 . A A . 3 VAL HG22 1 1 12 8490 1 1 3 VAL HG23 H -6.064 9.793 -5.210 1.00 . A A . 3 VAL HG23 1 1 12 8491 1 1 3 VAL N N -5.386 7.029 -2.344 1.00 . A A . 3 VAL N 1 1 12 8492 1 1 3 VAL O O -2.937 9.586 -2.017 1.00 . A A . 3 VAL O 1 1 12 8493 1 1 4 GLU C C -3.730 10.421 0.503 1.00 . A A . 4 GLU C 1 1 12 8494 1 1 4 GLU CA C -4.877 10.680 -0.475 1.00 . A A . 4 GLU CA 1 1 12 8495 1 1 4 GLU CB C -6.168 10.937 0.327 1.00 . A A . 4 GLU CB 1 1 12 8496 1 1 4 GLU CD C -8.655 10.646 0.387 1.00 . A A . 4 GLU CD 1 1 12 8497 1 1 4 GLU CG C -7.364 10.230 -0.322 1.00 . A A . 4 GLU CG 1 1 12 8498 1 1 4 GLU H H -5.894 9.046 -1.456 1.00 . A A . 4 GLU H 1 1 12 8499 1 1 4 GLU HA H -4.646 11.551 -1.068 1.00 . A A . 4 GLU HA 1 1 12 8500 1 1 4 GLU HB2 H -6.040 10.567 1.334 1.00 . A A . 4 GLU HB2 1 1 12 8501 1 1 4 GLU HB3 H -6.360 12.000 0.361 1.00 . A A . 4 GLU HB3 1 1 12 8502 1 1 4 GLU HG2 H -7.420 10.500 -1.367 1.00 . A A . 4 GLU HG2 1 1 12 8503 1 1 4 GLU HG3 H -7.240 9.160 -0.234 1.00 . A A . 4 GLU HG3 1 1 12 8504 1 1 4 GLU N N -5.035 9.499 -1.377 1.00 . A A . 4 GLU N 1 1 12 8505 1 1 4 GLU O O -3.184 11.334 1.090 1.00 . A A . 4 GLU O 1 1 12 8506 1 1 4 GLU OE1 O -8.702 10.540 1.601 1.00 . A A . 4 GLU OE1 1 1 12 8507 1 1 4 GLU OE2 O -9.576 11.060 -0.298 1.00 . A A . 4 GLU OE2 1 1 12 8508 1 1 5 GLN C C -0.963 8.635 0.851 1.00 . A A . 5 GLN C 1 1 12 8509 1 1 5 GLN CA C -2.260 8.860 1.630 1.00 . A A . 5 GLN CA 1 1 12 8510 1 1 5 GLN CB C -2.613 7.589 2.406 1.00 . A A . 5 GLN CB 1 1 12 8511 1 1 5 GLN CD C -3.678 7.723 4.666 1.00 . A A . 5 GLN CD 1 1 12 8512 1 1 5 GLN CG C -2.357 7.814 3.898 1.00 . A A . 5 GLN CG 1 1 12 8513 1 1 5 GLN H H -3.826 8.465 0.204 1.00 . A A . 5 GLN H 1 1 12 8514 1 1 5 GLN HA H -2.127 9.678 2.322 1.00 . A A . 5 GLN HA 1 1 12 8515 1 1 5 GLN HB2 H -3.656 7.351 2.250 1.00 . A A . 5 GLN HB2 1 1 12 8516 1 1 5 GLN HB3 H -2.001 6.772 2.057 1.00 . A A . 5 GLN HB3 1 1 12 8517 1 1 5 GLN HE21 H -4.263 6.061 3.751 1.00 . A A . 5 GLN HE21 1 1 12 8518 1 1 5 GLN HE22 H -5.345 6.672 4.908 1.00 . A A . 5 GLN HE22 1 1 12 8519 1 1 5 GLN HG2 H -1.676 7.059 4.263 1.00 . A A . 5 GLN HG2 1 1 12 8520 1 1 5 GLN HG3 H -1.924 8.791 4.046 1.00 . A A . 5 GLN HG3 1 1 12 8521 1 1 5 GLN N N -3.367 9.183 0.685 1.00 . A A . 5 GLN N 1 1 12 8522 1 1 5 GLN NE2 N -4.496 6.737 4.421 1.00 . A A . 5 GLN NE2 1 1 12 8523 1 1 5 GLN O O -0.083 9.474 0.836 1.00 . A A . 5 GLN O 1 1 12 8524 1 1 5 GLN OE1 O -3.968 8.560 5.497 1.00 . A A . 5 GLN OE1 1 1 12 8525 1 1 6 CYS C C 0.168 7.545 -2.042 1.00 . A A . 6 CYS C 1 1 12 8526 1 1 6 CYS CA C 0.405 7.224 -0.568 1.00 . A A . 6 CYS CA 1 1 12 8527 1 1 6 CYS CB C 0.768 5.748 -0.416 1.00 . A A . 6 CYS CB 1 1 12 8528 1 1 6 CYS H H -1.556 6.844 0.236 1.00 . A A . 6 CYS H 1 1 12 8529 1 1 6 CYS HA H 1.212 7.834 -0.191 1.00 . A A . 6 CYS HA 1 1 12 8530 1 1 6 CYS HB2 H 0.104 5.148 -1.023 1.00 . A A . 6 CYS HB2 1 1 12 8531 1 1 6 CYS HB3 H 1.788 5.592 -0.737 1.00 . A A . 6 CYS HB3 1 1 12 8532 1 1 6 CYS N N -0.836 7.507 0.207 1.00 . A A . 6 CYS N 1 1 12 8533 1 1 6 CYS O O -0.360 6.746 -2.780 1.00 . A A . 6 CYS O 1 1 12 8534 1 1 6 CYS SG S 0.601 5.271 1.320 1.00 . A A . 6 CYS SG 1 1 12 8535 1 1 7 CYS C C 0.471 10.653 -3.935 1.00 . A A . 7 CYS C 1 1 12 8536 1 1 7 CYS CA C 0.360 9.129 -3.886 1.00 . A A . 7 CYS CA 1 1 12 8537 1 1 7 CYS CB C -1.028 8.683 -4.369 1.00 . A A . 7 CYS CB 1 1 12 8538 1 1 7 CYS H H 0.975 9.341 -1.836 1.00 . A A . 7 CYS H 1 1 12 8539 1 1 7 CYS HA H 1.130 8.682 -4.502 1.00 . A A . 7 CYS HA 1 1 12 8540 1 1 7 CYS HB2 H -1.031 7.615 -4.512 1.00 . A A . 7 CYS HB2 1 1 12 8541 1 1 7 CYS HB3 H -1.762 8.943 -3.622 1.00 . A A . 7 CYS HB3 1 1 12 8542 1 1 7 CYS N N 0.555 8.717 -2.464 1.00 . A A . 7 CYS N 1 1 12 8543 1 1 7 CYS O O 0.975 11.231 -4.877 1.00 . A A . 7 CYS O 1 1 12 8544 1 1 7 CYS SG S -1.456 9.493 -5.938 1.00 . A A . 7 CYS SG 1 1 12 8545 1 1 8 THR C C 1.228 13.157 -1.836 1.00 . A A . 8 THR C 1 1 12 8546 1 1 8 THR CA C 0.114 12.782 -2.822 1.00 . A A . 8 THR CA 1 1 12 8547 1 1 8 THR CB C -1.222 13.351 -2.337 1.00 . A A . 8 THR CB 1 1 12 8548 1 1 8 THR CG2 C -1.990 13.929 -3.525 1.00 . A A . 8 THR CG2 1 1 12 8549 1 1 8 THR H H -0.355 10.801 -2.139 1.00 . A A . 8 THR H 1 1 12 8550 1 1 8 THR HA H 0.346 13.180 -3.799 1.00 . A A . 8 THR HA 1 1 12 8551 1 1 8 THR HB H -1.043 14.131 -1.614 1.00 . A A . 8 THR HB 1 1 12 8552 1 1 8 THR HG1 H -2.445 11.842 -2.436 1.00 . A A . 8 THR HG1 1 1 12 8553 1 1 8 THR HG21 H -2.830 13.290 -3.757 1.00 . A A . 8 THR HG21 1 1 12 8554 1 1 8 THR HG22 H -1.336 13.989 -4.382 1.00 . A A . 8 THR HG22 1 1 12 8555 1 1 8 THR HG23 H -2.349 14.917 -3.275 1.00 . A A . 8 THR HG23 1 1 12 8556 1 1 8 THR N N 0.024 11.300 -2.893 1.00 . A A . 8 THR N 1 1 12 8557 1 1 8 THR O O 1.550 14.314 -1.651 1.00 . A A . 8 THR O 1 1 12 8558 1 1 8 THR OG1 O -1.985 12.313 -1.737 1.00 . A A . 8 THR OG1 1 1 12 8559 1 1 9 SER C C 3.795 11.181 -0.141 1.00 . A A . 9 SER C 1 1 12 8560 1 1 9 SER CA C 2.926 12.438 -0.243 1.00 . A A . 9 SER CA 1 1 12 8561 1 1 9 SER CB C 2.337 12.765 1.130 1.00 . A A . 9 SER CB 1 1 12 8562 1 1 9 SER H H 1.551 11.250 -1.383 1.00 . A A . 9 SER H 1 1 12 8563 1 1 9 SER HA H 3.524 13.268 -0.591 1.00 . A A . 9 SER HA 1 1 12 8564 1 1 9 SER HB2 H 1.351 12.342 1.211 1.00 . A A . 9 SER HB2 1 1 12 8565 1 1 9 SER HB3 H 2.971 12.346 1.900 1.00 . A A . 9 SER HB3 1 1 12 8566 1 1 9 SER HG H 1.696 14.359 2.046 1.00 . A A . 9 SER HG 1 1 12 8567 1 1 9 SER N N 1.824 12.173 -1.210 1.00 . A A . 9 SER N 1 1 12 8568 1 1 9 SER O O 3.602 10.229 -0.870 1.00 . A A . 9 SER O 1 1 12 8569 1 1 9 SER OG O 2.252 14.176 1.284 1.00 . A A . 9 SER OG 1 1 12 8570 1 1 10 ILE C C 5.016 9.014 1.930 1.00 . A A . 10 ILE C 1 1 12 8571 1 1 10 ILE CA C 5.613 9.955 0.882 1.00 . A A . 10 ILE CA 1 1 12 8572 1 1 10 ILE CB C 7.018 10.373 1.310 1.00 . A A . 10 ILE CB 1 1 12 8573 1 1 10 ILE CD1 C 7.754 10.881 -1.022 1.00 . A A . 10 ILE CD1 1 1 12 8574 1 1 10 ILE CG1 C 7.529 11.469 0.372 1.00 . A A . 10 ILE CG1 1 1 12 8575 1 1 10 ILE CG2 C 7.953 9.164 1.237 1.00 . A A . 10 ILE CG2 1 1 12 8576 1 1 10 ILE H H 4.892 11.937 1.333 1.00 . A A . 10 ILE H 1 1 12 8577 1 1 10 ILE HA H 5.665 9.445 -0.070 1.00 . A A . 10 ILE HA 1 1 12 8578 1 1 10 ILE HB H 6.990 10.747 2.324 1.00 . A A . 10 ILE HB 1 1 12 8579 1 1 10 ILE HD11 H 6.998 10.136 -1.225 1.00 . A A . 10 ILE HD11 1 1 12 8580 1 1 10 ILE HD12 H 8.731 10.423 -1.067 1.00 . A A . 10 ILE HD12 1 1 12 8581 1 1 10 ILE HD13 H 7.690 11.668 -1.759 1.00 . A A . 10 ILE HD13 1 1 12 8582 1 1 10 ILE HG12 H 6.797 12.262 0.315 1.00 . A A . 10 ILE HG12 1 1 12 8583 1 1 10 ILE HG13 H 8.461 11.863 0.750 1.00 . A A . 10 ILE HG13 1 1 12 8584 1 1 10 ILE HG21 H 8.365 8.968 2.216 1.00 . A A . 10 ILE HG21 1 1 12 8585 1 1 10 ILE HG22 H 8.754 9.371 0.543 1.00 . A A . 10 ILE HG22 1 1 12 8586 1 1 10 ILE HG23 H 7.398 8.301 0.900 1.00 . A A . 10 ILE HG23 1 1 12 8587 1 1 10 ILE N N 4.747 11.163 0.750 1.00 . A A . 10 ILE N 1 1 12 8588 1 1 10 ILE O O 4.488 9.445 2.935 1.00 . A A . 10 ILE O 1 1 12 8589 1 1 11 CYS C C 5.629 5.865 3.229 1.00 . A A . 11 CYS C 1 1 12 8590 1 1 11 CYS CA C 4.521 6.765 2.682 1.00 . A A . 11 CYS CA 1 1 12 8591 1 1 11 CYS CB C 3.475 5.895 1.984 1.00 . A A . 11 CYS CB 1 1 12 8592 1 1 11 CYS H H 5.519 7.404 0.883 1.00 . A A . 11 CYS H 1 1 12 8593 1 1 11 CYS HA H 4.058 7.303 3.496 1.00 . A A . 11 CYS HA 1 1 12 8594 1 1 11 CYS HB2 H 3.661 5.894 0.921 1.00 . A A . 11 CYS HB2 1 1 12 8595 1 1 11 CYS HB3 H 3.540 4.885 2.361 1.00 . A A . 11 CYS HB3 1 1 12 8596 1 1 11 CYS N N 5.091 7.732 1.701 1.00 . A A . 11 CYS N 1 1 12 8597 1 1 11 CYS O O 6.802 6.102 3.019 1.00 . A A . 11 CYS O 1 1 12 8598 1 1 11 CYS SG S 1.819 6.549 2.302 1.00 . A A . 11 CYS SG 1 1 12 8599 1 1 12 SER C C 5.701 2.474 4.468 1.00 . A A . 12 SER C 1 1 12 8600 1 1 12 SER CA C 6.270 3.894 4.487 1.00 . A A . 12 SER CA 1 1 12 8601 1 1 12 SER CB C 6.597 4.300 5.925 1.00 . A A . 12 SER CB 1 1 12 8602 1 1 12 SER H H 4.302 4.659 4.074 1.00 . A A . 12 SER H 1 1 12 8603 1 1 12 SER HA H 7.167 3.933 3.887 1.00 . A A . 12 SER HA 1 1 12 8604 1 1 12 SER HB2 H 7.539 3.868 6.218 1.00 . A A . 12 SER HB2 1 1 12 8605 1 1 12 SER HB3 H 6.664 5.378 5.987 1.00 . A A . 12 SER HB3 1 1 12 8606 1 1 12 SER HG H 5.164 4.584 7.209 1.00 . A A . 12 SER HG 1 1 12 8607 1 1 12 SER N N 5.256 4.827 3.925 1.00 . A A . 12 SER N 1 1 12 8608 1 1 12 SER O O 4.519 2.267 4.660 1.00 . A A . 12 SER O 1 1 12 8609 1 1 12 SER OG O 5.576 3.825 6.791 1.00 . A A . 12 SER OG 1 1 12 8610 1 1 13 LEU C C 5.064 -0.144 5.361 1.00 . A A . 13 LEU C 1 1 12 8611 1 1 13 LEU CA C 6.028 0.089 4.196 1.00 . A A . 13 LEU CA 1 1 12 8612 1 1 13 LEU CB C 7.212 -0.871 4.315 1.00 . A A . 13 LEU CB 1 1 12 8613 1 1 13 LEU CD1 C 7.410 -2.991 3.007 1.00 . A A . 13 LEU CD1 1 1 12 8614 1 1 13 LEU CD2 C 7.051 -3.073 5.477 1.00 . A A . 13 LEU CD2 1 1 12 8615 1 1 13 LEU CG C 6.718 -2.313 4.192 1.00 . A A . 13 LEU CG 1 1 12 8616 1 1 13 LEU H H 7.477 1.679 4.075 1.00 . A A . 13 LEU H 1 1 12 8617 1 1 13 LEU HA H 5.514 -0.087 3.263 1.00 . A A . 13 LEU HA 1 1 12 8618 1 1 13 LEU HB2 H 7.922 -0.664 3.527 1.00 . A A . 13 LEU HB2 1 1 12 8619 1 1 13 LEU HB3 H 7.690 -0.737 5.274 1.00 . A A . 13 LEU HB3 1 1 12 8620 1 1 13 LEU HD11 H 8.365 -2.519 2.831 1.00 . A A . 13 LEU HD11 1 1 12 8621 1 1 13 LEU HD12 H 6.792 -2.893 2.126 1.00 . A A . 13 LEU HD12 1 1 12 8622 1 1 13 LEU HD13 H 7.560 -4.037 3.228 1.00 . A A . 13 LEU HD13 1 1 12 8623 1 1 13 LEU HD21 H 7.930 -3.680 5.319 1.00 . A A . 13 LEU HD21 1 1 12 8624 1 1 13 LEU HD22 H 6.220 -3.706 5.747 1.00 . A A . 13 LEU HD22 1 1 12 8625 1 1 13 LEU HD23 H 7.241 -2.368 6.273 1.00 . A A . 13 LEU HD23 1 1 12 8626 1 1 13 LEU HG H 5.647 -2.317 4.033 1.00 . A A . 13 LEU HG 1 1 12 8627 1 1 13 LEU N N 6.528 1.493 4.232 1.00 . A A . 13 LEU N 1 1 12 8628 1 1 13 LEU O O 4.180 -0.975 5.289 1.00 . A A . 13 LEU O 1 1 12 8629 1 1 14 TYR C C 2.885 0.762 7.203 1.00 . A A . 14 TYR C 1 1 12 8630 1 1 14 TYR CA C 4.317 0.395 7.601 1.00 . A A . 14 TYR CA 1 1 12 8631 1 1 14 TYR CB C 4.772 1.294 8.753 1.00 . A A . 14 TYR CB 1 1 12 8632 1 1 14 TYR CD1 C 4.737 -0.227 10.837 1.00 . A A . 14 TYR CD1 1 1 12 8633 1 1 14 TYR CD2 C 6.889 0.277 9.817 1.00 . A A . 14 TYR CD2 1 1 12 8634 1 1 14 TYR CE1 C 5.388 -1.005 11.804 1.00 . A A . 14 TYR CE1 1 1 12 8635 1 1 14 TYR CE2 C 7.524 -0.505 10.790 1.00 . A A . 14 TYR CE2 1 1 12 8636 1 1 14 TYR CG C 5.481 0.431 9.825 1.00 . A A . 14 TYR CG 1 1 12 8637 1 1 14 TYR CZ C 6.776 -1.142 11.780 1.00 . A A . 14 TYR CZ 1 1 12 8638 1 1 14 TYR H H 5.944 1.246 6.474 1.00 . A A . 14 TYR H 1 1 12 8639 1 1 14 TYR HA H 4.346 -0.637 7.918 1.00 . A A . 14 TYR HA 1 1 12 8640 1 1 14 TYR HB2 H 5.447 2.056 8.360 1.00 . A A . 14 TYR HB2 1 1 12 8641 1 1 14 TYR HB3 H 3.903 1.791 9.180 1.00 . A A . 14 TYR HB3 1 1 12 8642 1 1 14 TYR HD1 H 3.670 -0.144 10.876 1.00 . A A . 14 TYR HD1 1 1 12 8643 1 1 14 TYR HD2 H 7.487 0.748 9.064 1.00 . A A . 14 TYR HD2 1 1 12 8644 1 1 14 TYR HE1 H 4.812 -1.501 12.571 1.00 . A A . 14 TYR HE1 1 1 12 8645 1 1 14 TYR HE2 H 8.598 -0.614 10.775 1.00 . A A . 14 TYR HE2 1 1 12 8646 1 1 14 TYR HH H 7.996 -1.337 13.236 1.00 . A A . 14 TYR HH 1 1 12 8647 1 1 14 TYR N N 5.225 0.581 6.434 1.00 . A A . 14 TYR N 1 1 12 8648 1 1 14 TYR O O 1.964 -0.009 7.386 1.00 . A A . 14 TYR O 1 1 12 8649 1 1 14 TYR OH O 7.409 -1.910 12.737 1.00 . A A . 14 TYR OH 1 1 12 8650 1 1 15 GLN C C 0.751 1.346 5.247 1.00 . A A . 15 GLN C 1 1 12 8651 1 1 15 GLN CA C 1.314 2.346 6.259 1.00 . A A . 15 GLN CA 1 1 12 8652 1 1 15 GLN CB C 1.360 3.737 5.622 1.00 . A A . 15 GLN CB 1 1 12 8653 1 1 15 GLN CD C 1.605 6.112 6.355 1.00 . A A . 15 GLN CD 1 1 12 8654 1 1 15 GLN CG C 2.152 4.691 6.517 1.00 . A A . 15 GLN CG 1 1 12 8655 1 1 15 GLN H H 3.444 2.543 6.526 1.00 . A A . 15 GLN H 1 1 12 8656 1 1 15 GLN HA H 0.675 2.369 7.130 1.00 . A A . 15 GLN HA 1 1 12 8657 1 1 15 GLN HB2 H 1.837 3.672 4.655 1.00 . A A . 15 GLN HB2 1 1 12 8658 1 1 15 GLN HB3 H 0.354 4.110 5.502 1.00 . A A . 15 GLN HB3 1 1 12 8659 1 1 15 GLN HE21 H -0.227 5.630 6.951 1.00 . A A . 15 GLN HE21 1 1 12 8660 1 1 15 GLN HE22 H -0.005 7.260 6.537 1.00 . A A . 15 GLN HE22 1 1 12 8661 1 1 15 GLN HG2 H 2.055 4.382 7.548 1.00 . A A . 15 GLN HG2 1 1 12 8662 1 1 15 GLN HG3 H 3.192 4.673 6.231 1.00 . A A . 15 GLN HG3 1 1 12 8663 1 1 15 GLN N N 2.689 1.934 6.663 1.00 . A A . 15 GLN N 1 1 12 8664 1 1 15 GLN NE2 N 0.354 6.354 6.638 1.00 . A A . 15 GLN NE2 1 1 12 8665 1 1 15 GLN O O -0.436 1.091 5.211 1.00 . A A . 15 GLN O 1 1 12 8666 1 1 15 GLN OE1 O 2.324 7.011 5.965 1.00 . A A . 15 GLN OE1 1 1 12 8667 1 1 16 LEU C C 0.591 -1.454 4.150 1.00 . A A . 16 LEU C 1 1 12 8668 1 1 16 LEU CA C 1.080 -0.204 3.422 1.00 . A A . 16 LEU CA 1 1 12 8669 1 1 16 LEU CB C 2.195 -0.573 2.442 1.00 . A A . 16 LEU CB 1 1 12 8670 1 1 16 LEU CD1 C 3.303 1.628 2.037 1.00 . A A . 16 LEU CD1 1 1 12 8671 1 1 16 LEU CD2 C 3.004 0.016 0.154 1.00 . A A . 16 LEU CD2 1 1 12 8672 1 1 16 LEU CG C 2.382 0.566 1.438 1.00 . A A . 16 LEU CG 1 1 12 8673 1 1 16 LEU H H 2.543 0.990 4.463 1.00 . A A . 16 LEU H 1 1 12 8674 1 1 16 LEU HA H 0.255 0.233 2.883 1.00 . A A . 16 LEU HA 1 1 12 8675 1 1 16 LEU HB2 H 3.116 -0.731 2.986 1.00 . A A . 16 LEU HB2 1 1 12 8676 1 1 16 LEU HB3 H 1.928 -1.475 1.914 1.00 . A A . 16 LEU HB3 1 1 12 8677 1 1 16 LEU HD11 H 3.792 1.228 2.913 1.00 . A A . 16 LEU HD11 1 1 12 8678 1 1 16 LEU HD12 H 2.720 2.494 2.316 1.00 . A A . 16 LEU HD12 1 1 12 8679 1 1 16 LEU HD13 H 4.046 1.914 1.308 1.00 . A A . 16 LEU HD13 1 1 12 8680 1 1 16 LEU HD21 H 4.076 0.142 0.190 1.00 . A A . 16 LEU HD21 1 1 12 8681 1 1 16 LEU HD22 H 2.607 0.552 -0.696 1.00 . A A . 16 LEU HD22 1 1 12 8682 1 1 16 LEU HD23 H 2.767 -1.033 0.060 1.00 . A A . 16 LEU HD23 1 1 12 8683 1 1 16 LEU HG H 1.422 1.009 1.214 1.00 . A A . 16 LEU HG 1 1 12 8684 1 1 16 LEU N N 1.588 0.776 4.423 1.00 . A A . 16 LEU N 1 1 12 8685 1 1 16 LEU O O -0.384 -2.067 3.764 1.00 . A A . 16 LEU O 1 1 12 8686 1 1 17 GLU C C -0.627 -2.767 6.464 1.00 . A A . 17 GLU C 1 1 12 8687 1 1 17 GLU CA C 0.798 -3.018 5.973 1.00 . A A . 17 GLU CA 1 1 12 8688 1 1 17 GLU CB C 1.729 -3.240 7.168 1.00 . A A . 17 GLU CB 1 1 12 8689 1 1 17 GLU CD C 2.815 -5.323 8.022 1.00 . A A . 17 GLU CD 1 1 12 8690 1 1 17 GLU CG C 2.729 -4.352 6.842 1.00 . A A . 17 GLU CG 1 1 12 8691 1 1 17 GLU H H 2.019 -1.310 5.524 1.00 . A A . 17 GLU H 1 1 12 8692 1 1 17 GLU HA H 0.814 -3.886 5.331 1.00 . A A . 17 GLU HA 1 1 12 8693 1 1 17 GLU HB2 H 2.265 -2.326 7.379 1.00 . A A . 17 GLU HB2 1 1 12 8694 1 1 17 GLU HB3 H 1.147 -3.522 8.029 1.00 . A A . 17 GLU HB3 1 1 12 8695 1 1 17 GLU HG2 H 2.402 -4.884 5.960 1.00 . A A . 17 GLU HG2 1 1 12 8696 1 1 17 GLU HG3 H 3.702 -3.921 6.662 1.00 . A A . 17 GLU HG3 1 1 12 8697 1 1 17 GLU N N 1.246 -1.825 5.215 1.00 . A A . 17 GLU N 1 1 12 8698 1 1 17 GLU O O -1.372 -3.685 6.748 1.00 . A A . 17 GLU O 1 1 12 8699 1 1 17 GLU OE1 O 1.986 -6.215 8.092 1.00 . A A . 17 GLU OE1 1 1 12 8700 1 1 17 GLU OE2 O 3.710 -5.158 8.835 1.00 . A A . 17 GLU OE2 1 1 12 8701 1 1 18 ASN C C -3.392 -1.505 5.909 1.00 . A A . 18 ASN C 1 1 12 8702 1 1 18 ASN CA C -2.389 -1.197 7.023 1.00 . A A . 18 ASN CA 1 1 12 8703 1 1 18 ASN CB C -2.473 0.289 7.386 1.00 . A A . 18 ASN CB 1 1 12 8704 1 1 18 ASN CG C -1.831 0.520 8.756 1.00 . A A . 18 ASN CG 1 1 12 8705 1 1 18 ASN H H -0.394 -0.798 6.318 1.00 . A A . 18 ASN H 1 1 12 8706 1 1 18 ASN HA H -2.623 -1.793 7.891 1.00 . A A . 18 ASN HA 1 1 12 8707 1 1 18 ASN HB2 H -1.954 0.873 6.641 1.00 . A A . 18 ASN HB2 1 1 12 8708 1 1 18 ASN HB3 H -3.509 0.591 7.422 1.00 . A A . 18 ASN HB3 1 1 12 8709 1 1 18 ASN HD21 H 0.004 0.726 8.024 1.00 . A A . 18 ASN HD21 1 1 12 8710 1 1 18 ASN HD22 H -0.125 0.876 9.709 1.00 . A A . 18 ASN HD22 1 1 12 8711 1 1 18 ASN N N -1.012 -1.521 6.558 1.00 . A A . 18 ASN N 1 1 12 8712 1 1 18 ASN ND2 N -0.544 0.723 8.836 1.00 . A A . 18 ASN ND2 1 1 12 8713 1 1 18 ASN O O -4.485 -1.971 6.162 1.00 . A A . 18 ASN O 1 1 12 8714 1 1 18 ASN OD1 O -2.508 0.516 9.765 1.00 . A A . 18 ASN OD1 1 1 12 8715 1 1 19 TYR C C -4.174 -3.048 3.432 1.00 . A A . 19 TYR C 1 1 12 8716 1 1 19 TYR CA C -3.985 -1.536 3.563 1.00 . A A . 19 TYR CA 1 1 12 8717 1 1 19 TYR CB C -3.428 -0.982 2.250 1.00 . A A . 19 TYR CB 1 1 12 8718 1 1 19 TYR CD1 C -3.125 1.200 3.632 1.00 . A A . 19 TYR CD1 1 1 12 8719 1 1 19 TYR CD2 C -1.658 0.840 1.722 1.00 . A A . 19 TYR CD2 1 1 12 8720 1 1 19 TYR CE1 C -2.482 2.418 3.880 1.00 . A A . 19 TYR CE1 1 1 12 8721 1 1 19 TYR CE2 C -1.028 2.061 1.988 1.00 . A A . 19 TYR CE2 1 1 12 8722 1 1 19 TYR CG C -2.722 0.380 2.537 1.00 . A A . 19 TYR CG 1 1 12 8723 1 1 19 TYR CZ C -1.440 2.847 3.062 1.00 . A A . 19 TYR CZ 1 1 12 8724 1 1 19 TYR H H -2.148 -0.872 4.484 1.00 . A A . 19 TYR H 1 1 12 8725 1 1 19 TYR HA H -4.937 -1.072 3.774 1.00 . A A . 19 TYR HA 1 1 12 8726 1 1 19 TYR HB2 H -2.722 -1.718 1.832 1.00 . A A . 19 TYR HB2 1 1 12 8727 1 1 19 TYR HB3 H -4.259 -0.849 1.543 1.00 . A A . 19 TYR HB3 1 1 12 8728 1 1 19 TYR HD1 H -3.920 0.904 4.287 1.00 . A A . 19 TYR HD1 1 1 12 8729 1 1 19 TYR HD2 H -1.314 0.265 0.902 1.00 . A A . 19 TYR HD2 1 1 12 8730 1 1 19 TYR HE1 H -2.795 3.028 4.711 1.00 . A A . 19 TYR HE1 1 1 12 8731 1 1 19 TYR HE2 H -0.219 2.395 1.355 1.00 . A A . 19 TYR HE2 1 1 12 8732 1 1 19 TYR HH H -1.288 4.484 4.032 1.00 . A A . 19 TYR HH 1 1 12 8733 1 1 19 TYR N N -3.036 -1.250 4.676 1.00 . A A . 19 TYR N 1 1 12 8734 1 1 19 TYR O O -5.095 -3.516 2.793 1.00 . A A . 19 TYR O 1 1 12 8735 1 1 19 TYR OH O -0.814 4.049 3.319 1.00 . A A . 19 TYR OH 1 1 12 8736 1 1 20 CYS C C -3.978 -5.845 5.256 1.00 . A A . 20 CYS C 1 1 12 8737 1 1 20 CYS CA C -3.435 -5.297 3.937 1.00 . A A . 20 CYS CA 1 1 12 8738 1 1 20 CYS CB C -2.063 -5.909 3.654 1.00 . A A . 20 CYS CB 1 1 12 8739 1 1 20 CYS H H -2.568 -3.420 4.540 1.00 . A A . 20 CYS H 1 1 12 8740 1 1 20 CYS HA H -4.114 -5.548 3.136 1.00 . A A . 20 CYS HA 1 1 12 8741 1 1 20 CYS HB2 H -1.296 -5.294 4.102 1.00 . A A . 20 CYS HB2 1 1 12 8742 1 1 20 CYS HB3 H -2.017 -6.904 4.072 1.00 . A A . 20 CYS HB3 1 1 12 8743 1 1 20 CYS N N -3.305 -3.816 4.031 1.00 . A A . 20 CYS N 1 1 12 8744 1 1 20 CYS O O -3.430 -6.761 5.835 1.00 . A A . 20 CYS O 1 1 12 8745 1 1 20 CYS SG S -1.804 -5.993 1.866 1.00 . A A . 20 CYS SG 1 1 12 8746 1 1 21 ASN C C -5.853 -7.288 6.936 1.00 . A A . 21 ASN C 1 1 12 8747 1 1 21 ASN CA C -5.637 -5.776 7.016 1.00 . A A . 21 ASN CA 1 1 12 8748 1 1 21 ASN CB C -6.976 -5.080 7.259 1.00 . A A . 21 ASN CB 1 1 12 8749 1 1 21 ASN CG C -7.283 -5.070 8.757 1.00 . A A . 21 ASN CG 1 1 12 8750 1 1 21 ASN H H -5.483 -4.552 5.252 1.00 . A A . 21 ASN H 1 1 12 8751 1 1 21 ASN HA H -4.961 -5.550 7.827 1.00 . A A . 21 ASN HA 1 1 12 8752 1 1 21 ASN HB2 H -6.923 -4.063 6.894 1.00 . A A . 21 ASN HB2 1 1 12 8753 1 1 21 ASN HB3 H -7.758 -5.610 6.736 1.00 . A A . 21 ASN HB3 1 1 12 8754 1 1 21 ASN HD21 H -9.234 -4.809 8.500 1.00 . A A . 21 ASN HD21 1 1 12 8755 1 1 21 ASN HD22 H -8.721 -4.910 10.115 1.00 . A A . 21 ASN HD22 1 1 12 8756 1 1 21 ASN N N -5.056 -5.290 5.736 1.00 . A A . 21 ASN N 1 1 12 8757 1 1 21 ASN ND2 N -8.515 -4.917 9.157 1.00 . A A . 21 ASN ND2 1 1 12 8758 1 1 21 ASN O O -6.891 -7.693 6.439 1.00 . A A . 21 ASN O 1 1 12 8759 1 1 21 ASN OXT O -4.976 -8.016 7.371 1.00 . A A . 21 ASN OXT 1 1 12 8760 1 1 21 ASN OD1 O -6.391 -5.201 9.572 1.00 . A A . 21 ASN OD1 1 1 12 8761 2 2 1 PHE C C 12.620 0.309 1.780 1.00 . B B . 22 PHE C 1 1 12 8762 2 2 1 PHE CA C 13.617 -0.456 2.643 1.00 . B B . 22 PHE CA 1 1 12 8763 2 2 1 PHE CB C 13.189 -0.369 4.109 1.00 . B B . 22 PHE CB 1 1 12 8764 2 2 1 PHE CD1 C 14.100 -2.628 4.737 1.00 . B B . 22 PHE CD1 1 1 12 8765 2 2 1 PHE CD2 C 11.740 -2.182 5.088 1.00 . B B . 22 PHE CD2 1 1 12 8766 2 2 1 PHE CE1 C 13.930 -3.923 5.243 1.00 . B B . 22 PHE CE1 1 1 12 8767 2 2 1 PHE CE2 C 11.570 -3.477 5.595 1.00 . B B . 22 PHE CE2 1 1 12 8768 2 2 1 PHE CG C 13.005 -1.760 4.659 1.00 . B B . 22 PHE CG 1 1 12 8769 2 2 1 PHE CZ C 12.666 -4.348 5.673 1.00 . B B . 22 PHE CZ 1 1 12 8770 2 2 1 PHE H1 H 15.641 -0.333 3.120 1.00 . B B . 22 PHE H1 1 1 12 8771 2 2 1 PHE H2 H 14.935 1.156 2.710 1.00 . B B . 22 PHE H2 1 1 12 8772 2 2 1 PHE H3 H 15.291 0.020 1.499 1.00 . B B . 22 PHE H3 1 1 12 8773 2 2 1 PHE HA H 13.639 -1.483 2.334 1.00 . B B . 22 PHE HA 1 1 12 8774 2 2 1 PHE HB2 H 13.950 0.146 4.677 1.00 . B B . 22 PHE HB2 1 1 12 8775 2 2 1 PHE HB3 H 12.257 0.172 4.181 1.00 . B B . 22 PHE HB3 1 1 12 8776 2 2 1 PHE HD1 H 15.074 -2.301 4.407 1.00 . B B . 22 PHE HD1 1 1 12 8777 2 2 1 PHE HD2 H 10.897 -1.510 5.028 1.00 . B B . 22 PHE HD2 1 1 12 8778 2 2 1 PHE HE1 H 14.774 -4.593 5.303 1.00 . B B . 22 PHE HE1 1 1 12 8779 2 2 1 PHE HE2 H 10.595 -3.803 5.926 1.00 . B B . 22 PHE HE2 1 1 12 8780 2 2 1 PHE HZ H 12.535 -5.346 6.062 1.00 . B B . 22 PHE HZ 1 1 12 8781 2 2 1 PHE N N 14.973 0.142 2.481 1.00 . B B . 22 PHE N 1 1 12 8782 2 2 1 PHE O O 11.827 -0.266 1.062 1.00 . B B . 22 PHE O 1 1 12 8783 2 2 2 VAL C C 12.331 3.799 0.793 1.00 . B B . 23 VAL C 1 1 12 8784 2 2 2 VAL CA C 11.724 2.426 1.035 1.00 . B B . 23 VAL CA 1 1 12 8785 2 2 2 VAL CB C 10.391 2.601 1.764 1.00 . B B . 23 VAL CB 1 1 12 8786 2 2 2 VAL CG1 C 9.375 1.615 1.198 1.00 . B B . 23 VAL CG1 1 1 12 8787 2 2 2 VAL CG2 C 10.577 2.347 3.260 1.00 . B B . 23 VAL CG2 1 1 12 8788 2 2 2 VAL H H 13.312 2.034 2.436 1.00 . B B . 23 VAL H 1 1 12 8789 2 2 2 VAL HA H 11.551 1.940 0.087 1.00 . B B . 23 VAL HA 1 1 12 8790 2 2 2 VAL HB H 10.031 3.608 1.612 1.00 . B B . 23 VAL HB 1 1 12 8791 2 2 2 VAL HG11 H 9.777 1.162 0.304 1.00 . B B . 23 VAL HG11 1 1 12 8792 2 2 2 VAL HG12 H 8.462 2.139 0.959 1.00 . B B . 23 VAL HG12 1 1 12 8793 2 2 2 VAL HG13 H 9.172 0.849 1.930 1.00 . B B . 23 VAL HG13 1 1 12 8794 2 2 2 VAL HG21 H 9.830 2.899 3.813 1.00 . B B . 23 VAL HG21 1 1 12 8795 2 2 2 VAL HG22 H 11.562 2.676 3.558 1.00 . B B . 23 VAL HG22 1 1 12 8796 2 2 2 VAL HG23 H 10.471 1.292 3.462 1.00 . B B . 23 VAL HG23 1 1 12 8797 2 2 2 VAL N N 12.661 1.603 1.849 1.00 . B B . 23 VAL N 1 1 12 8798 2 2 2 VAL O O 13.360 4.138 1.340 1.00 . B B . 23 VAL O 1 1 12 8799 2 2 3 ASN C C 11.658 6.369 -1.707 1.00 . B B . 24 ASN C 1 1 12 8800 2 2 3 ASN CA C 12.170 5.959 -0.328 1.00 . B B . 24 ASN CA 1 1 12 8801 2 2 3 ASN CB C 13.697 5.993 -0.338 1.00 . B B . 24 ASN CB 1 1 12 8802 2 2 3 ASN CG C 14.239 4.813 -1.145 1.00 . B B . 24 ASN CG 1 1 12 8803 2 2 3 ASN H H 10.847 4.267 -0.423 1.00 . B B . 24 ASN H 1 1 12 8804 2 2 3 ASN HA H 11.798 6.649 0.414 1.00 . B B . 24 ASN HA 1 1 12 8805 2 2 3 ASN HB2 H 14.026 6.915 -0.787 1.00 . B B . 24 ASN HB2 1 1 12 8806 2 2 3 ASN HB3 H 14.063 5.935 0.674 1.00 . B B . 24 ASN HB3 1 1 12 8807 2 2 3 ASN HD21 H 16.100 5.507 -1.169 1.00 . B B . 24 ASN HD21 1 1 12 8808 2 2 3 ASN HD22 H 15.866 4.030 -1.974 1.00 . B B . 24 ASN HD22 1 1 12 8809 2 2 3 ASN N N 11.679 4.585 -0.018 1.00 . B B . 24 ASN N 1 1 12 8810 2 2 3 ASN ND2 N 15.507 4.780 -1.455 1.00 . B B . 24 ASN ND2 1 1 12 8811 2 2 3 ASN O O 12.408 6.819 -2.550 1.00 . B B . 24 ASN O 1 1 12 8812 2 2 3 ASN OD1 O 13.503 3.913 -1.497 1.00 . B B . 24 ASN OD1 1 1 12 8813 2 2 4 GLN C C 8.353 6.957 -3.116 1.00 . B B . 25 GLN C 1 1 12 8814 2 2 4 GLN CA C 9.830 6.593 -3.271 1.00 . B B . 25 GLN CA 1 1 12 8815 2 2 4 GLN CB C 9.969 5.417 -4.240 1.00 . B B . 25 GLN CB 1 1 12 8816 2 2 4 GLN CD C 12.070 4.482 -5.227 1.00 . B B . 25 GLN CD 1 1 12 8817 2 2 4 GLN CG C 11.126 5.687 -5.206 1.00 . B B . 25 GLN CG 1 1 12 8818 2 2 4 GLN H H 9.802 5.847 -1.251 1.00 . B B . 25 GLN H 1 1 12 8819 2 2 4 GLN HA H 10.371 7.444 -3.657 1.00 . B B . 25 GLN HA 1 1 12 8820 2 2 4 GLN HB2 H 10.165 4.512 -3.683 1.00 . B B . 25 GLN HB2 1 1 12 8821 2 2 4 GLN HB3 H 9.054 5.304 -4.802 1.00 . B B . 25 GLN HB3 1 1 12 8822 2 2 4 GLN HE21 H 13.168 5.133 -3.705 1.00 . B B . 25 GLN HE21 1 1 12 8823 2 2 4 GLN HE22 H 13.653 3.646 -4.366 1.00 . B B . 25 GLN HE22 1 1 12 8824 2 2 4 GLN HG2 H 10.734 5.854 -6.198 1.00 . B B . 25 GLN HG2 1 1 12 8825 2 2 4 GLN HG3 H 11.669 6.562 -4.881 1.00 . B B . 25 GLN HG3 1 1 12 8826 2 2 4 GLN N N 10.388 6.214 -1.944 1.00 . B B . 25 GLN N 1 1 12 8827 2 2 4 GLN NE2 N 13.045 4.415 -4.361 1.00 . B B . 25 GLN NE2 1 1 12 8828 2 2 4 GLN O O 7.670 6.471 -2.236 1.00 . B B . 25 GLN O 1 1 12 8829 2 2 4 GLN OE1 O 11.921 3.594 -6.042 1.00 . B B . 25 GLN OE1 1 1 12 8830 2 2 5 HIS C C 5.537 7.069 -4.330 1.00 . B B . 26 HIS C 1 1 12 8831 2 2 5 HIS CA C 6.431 8.220 -3.869 1.00 . B B . 26 HIS CA 1 1 12 8832 2 2 5 HIS CB C 6.188 9.430 -4.772 1.00 . B B . 26 HIS CB 1 1 12 8833 2 2 5 HIS CD2 C 3.965 10.697 -4.245 1.00 . B B . 26 HIS CD2 1 1 12 8834 2 2 5 HIS CE1 C 4.727 11.977 -2.665 1.00 . B B . 26 HIS CE1 1 1 12 8835 2 2 5 HIS CG C 5.290 10.410 -4.072 1.00 . B B . 26 HIS CG 1 1 12 8836 2 2 5 HIS H H 8.430 8.195 -4.662 1.00 . B B . 26 HIS H 1 1 12 8837 2 2 5 HIS HA H 6.193 8.478 -2.848 1.00 . B B . 26 HIS HA 1 1 12 8838 2 2 5 HIS HB2 H 7.131 9.903 -5.002 1.00 . B B . 26 HIS HB2 1 1 12 8839 2 2 5 HIS HB3 H 5.715 9.103 -5.687 1.00 . B B . 26 HIS HB3 1 1 12 8840 2 2 5 HIS HD2 H 3.307 10.225 -4.960 1.00 . B B . 26 HIS HD2 1 1 12 8841 2 2 5 HIS HE1 H 4.783 12.722 -1.884 1.00 . B B . 26 HIS HE1 1 1 12 8842 2 2 5 HIS HE2 H 2.724 12.097 -3.254 1.00 . B B . 26 HIS HE2 1 1 12 8843 2 2 5 HIS N N 7.859 7.814 -3.964 1.00 . B B . 26 HIS N 1 1 12 8844 2 2 5 HIS ND1 N 5.762 11.227 -3.067 1.00 . B B . 26 HIS ND1 1 1 12 8845 2 2 5 HIS NE2 N 3.607 11.688 -3.358 1.00 . B B . 26 HIS NE2 1 1 12 8846 2 2 5 HIS O O 5.964 5.936 -4.438 1.00 . B B . 26 HIS O 1 1 12 8847 2 2 6 LEU C C 2.238 6.992 -5.855 1.00 . B B . 27 LEU C 1 1 12 8848 2 2 6 LEU CA C 3.351 6.312 -5.065 1.00 . B B . 27 LEU CA 1 1 12 8849 2 2 6 LEU CB C 2.750 5.606 -3.850 1.00 . B B . 27 LEU CB 1 1 12 8850 2 2 6 LEU CD1 C 3.704 4.230 -2.000 1.00 . B B . 27 LEU CD1 1 1 12 8851 2 2 6 LEU CD2 C 2.865 3.132 -4.076 1.00 . B B . 27 LEU CD2 1 1 12 8852 2 2 6 LEU CG C 3.572 4.364 -3.517 1.00 . B B . 27 LEU CG 1 1 12 8853 2 2 6 LEU H H 3.988 8.287 -4.509 1.00 . B B . 27 LEU H 1 1 12 8854 2 2 6 LEU HA H 3.865 5.598 -5.691 1.00 . B B . 27 LEU HA 1 1 12 8855 2 2 6 LEU HB2 H 2.755 6.278 -3.004 1.00 . B B . 27 LEU HB2 1 1 12 8856 2 2 6 LEU HB3 H 1.734 5.314 -4.070 1.00 . B B . 27 LEU HB3 1 1 12 8857 2 2 6 LEU HD11 H 4.621 3.713 -1.762 1.00 . B B . 27 LEU HD11 1 1 12 8858 2 2 6 LEU HD12 H 2.864 3.671 -1.614 1.00 . B B . 27 LEU HD12 1 1 12 8859 2 2 6 LEU HD13 H 3.718 5.213 -1.552 1.00 . B B . 27 LEU HD13 1 1 12 8860 2 2 6 LEU HD21 H 2.231 3.426 -4.900 1.00 . B B . 27 LEU HD21 1 1 12 8861 2 2 6 LEU HD22 H 2.264 2.681 -3.301 1.00 . B B . 27 LEU HD22 1 1 12 8862 2 2 6 LEU HD23 H 3.600 2.421 -4.423 1.00 . B B . 27 LEU HD23 1 1 12 8863 2 2 6 LEU HG H 4.553 4.453 -3.959 1.00 . B B . 27 LEU HG 1 1 12 8864 2 2 6 LEU N N 4.299 7.362 -4.604 1.00 . B B . 27 LEU N 1 1 12 8865 2 2 6 LEU O O 2.320 8.167 -6.123 1.00 . B B . 27 LEU O 1 1 12 8866 2 2 7 CYS C C -0.579 5.791 -7.872 1.00 . B B . 28 CYS C 1 1 12 8867 2 2 7 CYS CA C 0.048 6.856 -6.964 1.00 . B B . 28 CYS CA 1 1 12 8868 2 2 7 CYS CB C 0.497 8.040 -7.837 1.00 . B B . 28 CYS CB 1 1 12 8869 2 2 7 CYS H H 1.175 5.316 -5.955 1.00 . B B . 28 CYS H 1 1 12 8870 2 2 7 CYS HA H -0.695 7.190 -6.263 1.00 . B B . 28 CYS HA 1 1 12 8871 2 2 7 CYS HB2 H 1.538 7.915 -8.093 1.00 . B B . 28 CYS HB2 1 1 12 8872 2 2 7 CYS HB3 H -0.091 8.054 -8.744 1.00 . B B . 28 CYS HB3 1 1 12 8873 2 2 7 CYS N N 1.202 6.263 -6.206 1.00 . B B . 28 CYS N 1 1 12 8874 2 2 7 CYS O O 0.107 5.009 -8.500 1.00 . B B . 28 CYS O 1 1 12 8875 2 2 7 CYS SG S 0.284 9.624 -6.961 1.00 . B B . 28 CYS SG 1 1 12 8876 2 2 8 GLY C C -1.873 3.446 -8.859 1.00 . B B . 29 GLY C 1 1 12 8877 2 2 8 GLY CA C -2.605 4.793 -8.815 1.00 . B B . 29 GLY CA 1 1 12 8878 2 2 8 GLY H H -2.402 6.431 -7.432 1.00 . B B . 29 GLY H 1 1 12 8879 2 2 8 GLY HA2 H -3.600 4.641 -8.424 1.00 . B B . 29 GLY HA2 1 1 12 8880 2 2 8 GLY HA3 H -2.675 5.190 -9.817 1.00 . B B . 29 GLY HA3 1 1 12 8881 2 2 8 GLY N N -1.885 5.776 -7.947 1.00 . B B . 29 GLY N 1 1 12 8882 2 2 8 GLY O O -1.587 2.844 -7.842 1.00 . B B . 29 GLY O 1 1 12 8883 2 2 9 SER C C 0.218 1.556 -9.115 1.00 . B B . 30 SER C 1 1 12 8884 2 2 9 SER CA C -0.886 1.654 -10.166 1.00 . B B . 30 SER CA 1 1 12 8885 2 2 9 SER CB C -0.271 1.536 -11.561 1.00 . B B . 30 SER CB 1 1 12 8886 2 2 9 SER H H -1.837 3.463 -10.845 1.00 . B B . 30 SER H 1 1 12 8887 2 2 9 SER HA H -1.595 0.853 -10.018 1.00 . B B . 30 SER HA 1 1 12 8888 2 2 9 SER HB2 H -0.016 2.516 -11.928 1.00 . B B . 30 SER HB2 1 1 12 8889 2 2 9 SER HB3 H 0.624 0.929 -11.508 1.00 . B B . 30 SER HB3 1 1 12 8890 2 2 9 SER HG H -1.325 1.518 -13.196 1.00 . B B . 30 SER HG 1 1 12 8891 2 2 9 SER N N -1.585 2.964 -10.040 1.00 . B B . 30 SER N 1 1 12 8892 2 2 9 SER O O 0.278 0.612 -8.352 1.00 . B B . 30 SER O 1 1 12 8893 2 2 9 SER OG O -1.213 0.936 -12.440 1.00 . B B . 30 SER OG 1 1 12 8894 2 2 10 ASP C C 1.612 2.062 -6.707 1.00 . B B . 31 ASP C 1 1 12 8895 2 2 10 ASP CA C 2.188 2.481 -8.059 1.00 . B B . 31 ASP CA 1 1 12 8896 2 2 10 ASP CB C 2.828 3.865 -7.937 1.00 . B B . 31 ASP CB 1 1 12 8897 2 2 10 ASP CG C 3.505 4.234 -9.259 1.00 . B B . 31 ASP CG 1 1 12 8898 2 2 10 ASP H H 1.027 3.278 -9.688 1.00 . B B . 31 ASP H 1 1 12 8899 2 2 10 ASP HA H 2.935 1.765 -8.371 1.00 . B B . 31 ASP HA 1 1 12 8900 2 2 10 ASP HB2 H 2.065 4.595 -7.707 1.00 . B B . 31 ASP HB2 1 1 12 8901 2 2 10 ASP HB3 H 3.565 3.854 -7.149 1.00 . B B . 31 ASP HB3 1 1 12 8902 2 2 10 ASP N N 1.092 2.524 -9.065 1.00 . B B . 31 ASP N 1 1 12 8903 2 2 10 ASP O O 2.274 1.425 -5.910 1.00 . B B . 31 ASP O 1 1 12 8904 2 2 10 ASP OD1 O 4.627 3.802 -9.468 1.00 . B B . 31 ASP OD1 1 1 12 8905 2 2 10 ASP OD2 O 2.892 4.944 -10.039 1.00 . B B . 31 ASP OD2 1 1 12 8906 2 2 11 LEU C C -0.561 0.527 -5.169 1.00 . B B . 32 LEU C 1 1 12 8907 2 2 11 LEU CA C -0.230 2.016 -5.141 1.00 . B B . 32 LEU CA 1 1 12 8908 2 2 11 LEU CB C -1.516 2.811 -4.900 1.00 . B B . 32 LEU CB 1 1 12 8909 2 2 11 LEU CD1 C -1.139 5.257 -4.687 1.00 . B B . 32 LEU CD1 1 1 12 8910 2 2 11 LEU CD2 C -2.379 4.028 -2.901 1.00 . B B . 32 LEU CD2 1 1 12 8911 2 2 11 LEU CG C -1.237 3.942 -3.917 1.00 . B B . 32 LEU CG 1 1 12 8912 2 2 11 LEU H H -0.141 2.914 -7.098 1.00 . B B . 32 LEU H 1 1 12 8913 2 2 11 LEU HA H 0.469 2.215 -4.343 1.00 . B B . 32 LEU HA 1 1 12 8914 2 2 11 LEU HB2 H -1.866 3.224 -5.833 1.00 . B B . 32 LEU HB2 1 1 12 8915 2 2 11 LEU HB3 H -2.272 2.158 -4.489 1.00 . B B . 32 LEU HB3 1 1 12 8916 2 2 11 LEU HD11 H -1.340 5.077 -5.732 1.00 . B B . 32 LEU HD11 1 1 12 8917 2 2 11 LEU HD12 H -0.146 5.665 -4.575 1.00 . B B . 32 LEU HD12 1 1 12 8918 2 2 11 LEU HD13 H -1.862 5.957 -4.296 1.00 . B B . 32 LEU HD13 1 1 12 8919 2 2 11 LEU HD21 H -2.446 3.097 -2.356 1.00 . B B . 32 LEU HD21 1 1 12 8920 2 2 11 LEU HD22 H -3.308 4.209 -3.420 1.00 . B B . 32 LEU HD22 1 1 12 8921 2 2 11 LEU HD23 H -2.188 4.837 -2.211 1.00 . B B . 32 LEU HD23 1 1 12 8922 2 2 11 LEU HG H -0.304 3.754 -3.403 1.00 . B B . 32 LEU HG 1 1 12 8923 2 2 11 LEU N N 0.380 2.407 -6.442 1.00 . B B . 32 LEU N 1 1 12 8924 2 2 11 LEU O O 0.142 -0.283 -4.599 1.00 . B B . 32 LEU O 1 1 12 8925 2 2 12 VAL C C -0.766 -2.124 -6.101 1.00 . B B . 33 VAL C 1 1 12 8926 2 2 12 VAL CA C -2.014 -1.277 -5.892 1.00 . B B . 33 VAL CA 1 1 12 8927 2 2 12 VAL CB C -2.984 -1.505 -7.053 1.00 . B B . 33 VAL CB 1 1 12 8928 2 2 12 VAL CG1 C -4.130 -0.503 -6.957 1.00 . B B . 33 VAL CG1 1 1 12 8929 2 2 12 VAL CG2 C -2.246 -1.311 -8.380 1.00 . B B . 33 VAL CG2 1 1 12 8930 2 2 12 VAL H H -2.177 0.838 -6.284 1.00 . B B . 33 VAL H 1 1 12 8931 2 2 12 VAL HA H -2.487 -1.561 -4.963 1.00 . B B . 33 VAL HA 1 1 12 8932 2 2 12 VAL HB H -3.379 -2.509 -7.001 1.00 . B B . 33 VAL HB 1 1 12 8933 2 2 12 VAL HG11 H -5.072 -1.025 -7.041 1.00 . B B . 33 VAL HG11 1 1 12 8934 2 2 12 VAL HG12 H -4.045 0.219 -7.755 1.00 . B B . 33 VAL HG12 1 1 12 8935 2 2 12 VAL HG13 H -4.083 0.005 -6.005 1.00 . B B . 33 VAL HG13 1 1 12 8936 2 2 12 VAL HG21 H -1.896 -0.292 -8.453 1.00 . B B . 33 VAL HG21 1 1 12 8937 2 2 12 VAL HG22 H -2.918 -1.520 -9.199 1.00 . B B . 33 VAL HG22 1 1 12 8938 2 2 12 VAL HG23 H -1.404 -1.986 -8.425 1.00 . B B . 33 VAL HG23 1 1 12 8939 2 2 12 VAL N N -1.629 0.163 -5.830 1.00 . B B . 33 VAL N 1 1 12 8940 2 2 12 VAL O O -0.645 -3.212 -5.574 1.00 . B B . 33 VAL O 1 1 12 8941 2 2 13 GLU C C 2.220 -2.424 -5.787 1.00 . B B . 34 GLU C 1 1 12 8942 2 2 13 GLU CA C 1.414 -2.399 -7.084 1.00 . B B . 34 GLU CA 1 1 12 8943 2 2 13 GLU CB C 2.231 -1.728 -8.189 1.00 . B B . 34 GLU CB 1 1 12 8944 2 2 13 GLU CD C 0.599 -2.158 -10.033 1.00 . B B . 34 GLU CD 1 1 12 8945 2 2 13 GLU CG C 2.004 -2.466 -9.510 1.00 . B B . 34 GLU CG 1 1 12 8946 2 2 13 GLU H H 0.058 -0.745 -7.263 1.00 . B B . 34 GLU H 1 1 12 8947 2 2 13 GLU HA H 1.167 -3.408 -7.376 1.00 . B B . 34 GLU HA 1 1 12 8948 2 2 13 GLU HB2 H 1.919 -0.699 -8.292 1.00 . B B . 34 GLU HB2 1 1 12 8949 2 2 13 GLU HB3 H 3.277 -1.763 -7.934 1.00 . B B . 34 GLU HB3 1 1 12 8950 2 2 13 GLU HG2 H 2.738 -2.142 -10.234 1.00 . B B . 34 GLU HG2 1 1 12 8951 2 2 13 GLU HG3 H 2.101 -3.530 -9.349 1.00 . B B . 34 GLU HG3 1 1 12 8952 2 2 13 GLU N N 0.170 -1.628 -6.855 1.00 . B B . 34 GLU N 1 1 12 8953 2 2 13 GLU O O 2.579 -3.470 -5.292 1.00 . B B . 34 GLU O 1 1 12 8954 2 2 13 GLU OE1 O 0.323 -0.996 -10.283 1.00 . B B . 34 GLU OE1 1 1 12 8955 2 2 13 GLU OE2 O -0.176 -3.089 -10.173 1.00 . B B . 34 GLU OE2 1 1 12 8956 2 2 14 ALA C C 2.600 -2.152 -2.919 1.00 . B B . 35 ALA C 1 1 12 8957 2 2 14 ALA CA C 3.277 -1.250 -3.954 1.00 . B B . 35 ALA CA 1 1 12 8958 2 2 14 ALA CB C 3.338 0.183 -3.421 1.00 . B B . 35 ALA CB 1 1 12 8959 2 2 14 ALA H H 2.191 -0.443 -5.632 1.00 . B B . 35 ALA H 1 1 12 8960 2 2 14 ALA HA H 4.280 -1.609 -4.142 1.00 . B B . 35 ALA HA 1 1 12 8961 2 2 14 ALA HB1 H 3.437 0.162 -2.346 1.00 . B B . 35 ALA HB1 1 1 12 8962 2 2 14 ALA HB2 H 2.433 0.706 -3.690 1.00 . B B . 35 ALA HB2 1 1 12 8963 2 2 14 ALA HB3 H 4.189 0.691 -3.850 1.00 . B B . 35 ALA HB3 1 1 12 8964 2 2 14 ALA N N 2.498 -1.280 -5.224 1.00 . B B . 35 ALA N 1 1 12 8965 2 2 14 ALA O O 3.205 -3.064 -2.391 1.00 . B B . 35 ALA O 1 1 12 8966 2 2 15 LEU C C 0.748 -4.228 -2.116 1.00 . B B . 36 LEU C 1 1 12 8967 2 2 15 LEU CA C 0.660 -2.783 -1.629 1.00 . B B . 36 LEU CA 1 1 12 8968 2 2 15 LEU CB C -0.819 -2.383 -1.503 1.00 . B B . 36 LEU CB 1 1 12 8969 2 2 15 LEU CD1 C 0.318 -0.252 -0.721 1.00 . B B . 36 LEU CD1 1 1 12 8970 2 2 15 LEU CD2 C -1.367 -0.182 -2.561 1.00 . B B . 36 LEU CD2 1 1 12 8971 2 2 15 LEU CG C -0.981 -0.871 -1.255 1.00 . B B . 36 LEU CG 1 1 12 8972 2 2 15 LEU H H 0.867 -1.181 -3.059 1.00 . B B . 36 LEU H 1 1 12 8973 2 2 15 LEU HA H 1.145 -2.690 -0.668 1.00 . B B . 36 LEU HA 1 1 12 8974 2 2 15 LEU HB2 H -1.334 -2.646 -2.415 1.00 . B B . 36 LEU HB2 1 1 12 8975 2 2 15 LEU HB3 H -1.261 -2.925 -0.680 1.00 . B B . 36 LEU HB3 1 1 12 8976 2 2 15 LEU HD11 H 0.096 0.675 -0.215 1.00 . B B . 36 LEU HD11 1 1 12 8977 2 2 15 LEU HD12 H 0.988 -0.056 -1.546 1.00 . B B . 36 LEU HD12 1 1 12 8978 2 2 15 LEU HD13 H 0.786 -0.937 -0.031 1.00 . B B . 36 LEU HD13 1 1 12 8979 2 2 15 LEU HD21 H -0.619 0.554 -2.813 1.00 . B B . 36 LEU HD21 1 1 12 8980 2 2 15 LEU HD22 H -2.325 0.302 -2.442 1.00 . B B . 36 LEU HD22 1 1 12 8981 2 2 15 LEU HD23 H -1.429 -0.917 -3.349 1.00 . B B . 36 LEU HD23 1 1 12 8982 2 2 15 LEU HG H -1.768 -0.720 -0.533 1.00 . B B . 36 LEU HG 1 1 12 8983 2 2 15 LEU N N 1.349 -1.915 -2.624 1.00 . B B . 36 LEU N 1 1 12 8984 2 2 15 LEU O O 0.610 -5.168 -1.357 1.00 . B B . 36 LEU O 1 1 12 8985 2 2 16 TYR C C 2.499 -6.303 -3.792 1.00 . B B . 37 TYR C 1 1 12 8986 2 2 16 TYR CA C 1.072 -5.772 -3.961 1.00 . B B . 37 TYR CA 1 1 12 8987 2 2 16 TYR CB C 0.715 -5.720 -5.451 1.00 . B B . 37 TYR CB 1 1 12 8988 2 2 16 TYR CD1 C -0.253 -8.082 -5.800 1.00 . B B . 37 TYR CD1 1 1 12 8989 2 2 16 TYR CD2 C 1.895 -7.558 -6.819 1.00 . B B . 37 TYR CD2 1 1 12 8990 2 2 16 TYR CE1 C -0.180 -9.374 -6.332 1.00 . B B . 37 TYR CE1 1 1 12 8991 2 2 16 TYR CE2 C 1.953 -8.855 -7.343 1.00 . B B . 37 TYR CE2 1 1 12 8992 2 2 16 TYR CG C 0.787 -7.149 -6.038 1.00 . B B . 37 TYR CG 1 1 12 8993 2 2 16 TYR CZ C 0.918 -9.759 -7.102 1.00 . B B . 37 TYR CZ 1 1 12 8994 2 2 16 TYR H H 1.079 -3.624 -3.973 1.00 . B B . 37 TYR H 1 1 12 8995 2 2 16 TYR HA H 0.382 -6.425 -3.449 1.00 . B B . 37 TYR HA 1 1 12 8996 2 2 16 TYR HB2 H -0.289 -5.304 -5.559 1.00 . B B . 37 TYR HB2 1 1 12 8997 2 2 16 TYR HB3 H 1.415 -5.064 -5.963 1.00 . B B . 37 TYR HB3 1 1 12 8998 2 2 16 TYR HD1 H -1.105 -7.817 -5.209 1.00 . B B . 37 TYR HD1 1 1 12 8999 2 2 16 TYR HD2 H 2.706 -6.887 -7.013 1.00 . B B . 37 TYR HD2 1 1 12 9000 2 2 16 TYR HE1 H -0.977 -10.077 -6.145 1.00 . B B . 37 TYR HE1 1 1 12 9001 2 2 16 TYR HE2 H 2.801 -9.156 -7.940 1.00 . B B . 37 TYR HE2 1 1 12 9002 2 2 16 TYR HH H 0.775 -10.985 -8.557 1.00 . B B . 37 TYR HH 1 1 12 9003 2 2 16 TYR N N 0.975 -4.402 -3.389 1.00 . B B . 37 TYR N 1 1 12 9004 2 2 16 TYR O O 2.766 -7.467 -4.013 1.00 . B B . 37 TYR O 1 1 12 9005 2 2 16 TYR OH O 0.982 -11.036 -7.622 1.00 . B B . 37 TYR OH 1 1 12 9006 2 2 17 LEU C C 5.041 -6.254 -1.724 1.00 . B B . 38 LEU C 1 1 12 9007 2 2 17 LEU CA C 4.821 -5.938 -3.201 1.00 . B B . 38 LEU CA 1 1 12 9008 2 2 17 LEU CB C 5.828 -4.861 -3.628 1.00 . B B . 38 LEU CB 1 1 12 9009 2 2 17 LEU CD1 C 6.167 -2.754 -4.920 1.00 . B B . 38 LEU CD1 1 1 12 9010 2 2 17 LEU CD2 C 4.779 -4.593 -5.876 1.00 . B B . 38 LEU CD2 1 1 12 9011 2 2 17 LEU CG C 5.176 -3.872 -4.590 1.00 . B B . 38 LEU CG 1 1 12 9012 2 2 17 LEU H H 3.183 -4.532 -3.209 1.00 . B B . 38 LEU H 1 1 12 9013 2 2 17 LEU HA H 4.979 -6.829 -3.787 1.00 . B B . 38 LEU HA 1 1 12 9014 2 2 17 LEU HB2 H 6.175 -4.332 -2.752 1.00 . B B . 38 LEU HB2 1 1 12 9015 2 2 17 LEU HB3 H 6.668 -5.331 -4.116 1.00 . B B . 38 LEU HB3 1 1 12 9016 2 2 17 LEU HD11 H 7.130 -3.184 -5.153 1.00 . B B . 38 LEU HD11 1 1 12 9017 2 2 17 LEU HD12 H 6.263 -2.095 -4.069 1.00 . B B . 38 LEU HD12 1 1 12 9018 2 2 17 LEU HD13 H 5.808 -2.193 -5.770 1.00 . B B . 38 LEU HD13 1 1 12 9019 2 2 17 LEU HD21 H 4.378 -3.877 -6.579 1.00 . B B . 38 LEU HD21 1 1 12 9020 2 2 17 LEU HD22 H 4.029 -5.337 -5.653 1.00 . B B . 38 LEU HD22 1 1 12 9021 2 2 17 LEU HD23 H 5.646 -5.071 -6.303 1.00 . B B . 38 LEU HD23 1 1 12 9022 2 2 17 LEU HG H 4.302 -3.450 -4.127 1.00 . B B . 38 LEU HG 1 1 12 9023 2 2 17 LEU N N 3.418 -5.464 -3.392 1.00 . B B . 38 LEU N 1 1 12 9024 2 2 17 LEU O O 5.648 -7.245 -1.371 1.00 . B B . 38 LEU O 1 1 12 9025 2 2 18 VAL C C 3.834 -6.804 1.047 1.00 . B B . 39 VAL C 1 1 12 9026 2 2 18 VAL CA C 4.732 -5.646 0.598 1.00 . B B . 39 VAL CA 1 1 12 9027 2 2 18 VAL CB C 4.370 -4.366 1.363 1.00 . B B . 39 VAL CB 1 1 12 9028 2 2 18 VAL CG1 C 4.879 -3.150 0.585 1.00 . B B . 39 VAL CG1 1 1 12 9029 2 2 18 VAL CG2 C 2.851 -4.258 1.527 1.00 . B B . 39 VAL CG2 1 1 12 9030 2 2 18 VAL H H 4.070 -4.616 -1.169 1.00 . B B . 39 VAL H 1 1 12 9031 2 2 18 VAL HA H 5.763 -5.899 0.794 1.00 . B B . 39 VAL HA 1 1 12 9032 2 2 18 VAL HB H 4.837 -4.386 2.336 1.00 . B B . 39 VAL HB 1 1 12 9033 2 2 18 VAL HG11 H 5.010 -2.319 1.262 1.00 . B B . 39 VAL HG11 1 1 12 9034 2 2 18 VAL HG12 H 4.162 -2.883 -0.177 1.00 . B B . 39 VAL HG12 1 1 12 9035 2 2 18 VAL HG13 H 5.825 -3.389 0.122 1.00 . B B . 39 VAL HG13 1 1 12 9036 2 2 18 VAL HG21 H 2.481 -5.136 2.035 1.00 . B B . 39 VAL HG21 1 1 12 9037 2 2 18 VAL HG22 H 2.388 -4.181 0.555 1.00 . B B . 39 VAL HG22 1 1 12 9038 2 2 18 VAL HG23 H 2.615 -3.379 2.109 1.00 . B B . 39 VAL HG23 1 1 12 9039 2 2 18 VAL N N 4.553 -5.410 -0.859 1.00 . B B . 39 VAL N 1 1 12 9040 2 2 18 VAL O O 4.117 -7.480 2.017 1.00 . B B . 39 VAL O 1 1 12 9041 2 2 19 CYS C C 2.050 -9.343 -0.194 1.00 . B B . 40 CYS C 1 1 12 9042 2 2 19 CYS CA C 1.846 -8.151 0.744 1.00 . B B . 40 CYS CA 1 1 12 9043 2 2 19 CYS CB C 0.396 -7.675 0.657 1.00 . B B . 40 CYS CB 1 1 12 9044 2 2 19 CYS H H 2.542 -6.483 -0.427 1.00 . B B . 40 CYS H 1 1 12 9045 2 2 19 CYS HA H 2.064 -8.452 1.758 1.00 . B B . 40 CYS HA 1 1 12 9046 2 2 19 CYS HB2 H 0.151 -7.450 -0.370 1.00 . B B . 40 CYS HB2 1 1 12 9047 2 2 19 CYS HB3 H -0.260 -8.450 1.023 1.00 . B B . 40 CYS HB3 1 1 12 9048 2 2 19 CYS N N 2.755 -7.039 0.351 1.00 . B B . 40 CYS N 1 1 12 9049 2 2 19 CYS O O 1.576 -10.432 0.059 1.00 . B B . 40 CYS O 1 1 12 9050 2 2 19 CYS SG S 0.195 -6.187 1.666 1.00 . B B . 40 CYS SG 1 1 12 9051 2 2 20 GLY C C 1.647 -10.953 -2.542 1.00 . B B . 41 GLY C 1 1 12 9052 2 2 20 GLY CA C 2.981 -10.275 -2.224 1.00 . B B . 41 GLY CA 1 1 12 9053 2 2 20 GLY H H 3.128 -8.263 -1.466 1.00 . B B . 41 GLY H 1 1 12 9054 2 2 20 GLY HA2 H 3.421 -9.895 -3.136 1.00 . B B . 41 GLY HA2 1 1 12 9055 2 2 20 GLY HA3 H 3.648 -10.995 -1.774 1.00 . B B . 41 GLY HA3 1 1 12 9056 2 2 20 GLY N N 2.752 -9.148 -1.277 1.00 . B B . 41 GLY N 1 1 12 9057 2 2 20 GLY O O 1.598 -12.115 -2.893 1.00 . B B . 41 GLY O 1 1 12 9058 2 2 21 GLU C C -1.188 -11.732 -1.547 1.00 . B B . 42 GLU C 1 1 12 9059 2 2 21 GLU CA C -0.765 -10.837 -2.719 1.00 . B B . 42 GLU CA 1 1 12 9060 2 2 21 GLU CB C -0.679 -11.637 -4.039 1.00 . B B . 42 GLU CB 1 1 12 9061 2 2 21 GLU CD C -0.261 -13.906 -5.014 1.00 . B B . 42 GLU CD 1 1 12 9062 2 2 21 GLU CG C -0.767 -13.149 -3.785 1.00 . B B . 42 GLU CG 1 1 12 9063 2 2 21 GLU H H 0.626 -9.300 -2.139 1.00 . B B . 42 GLU H 1 1 12 9064 2 2 21 GLU HA H -1.491 -10.045 -2.834 1.00 . B B . 42 GLU HA 1 1 12 9065 2 2 21 GLU HB2 H -1.490 -11.340 -4.686 1.00 . B B . 42 GLU HB2 1 1 12 9066 2 2 21 GLU HB3 H 0.260 -11.415 -4.525 1.00 . B B . 42 GLU HB3 1 1 12 9067 2 2 21 GLU HG2 H -0.162 -13.407 -2.927 1.00 . B B . 42 GLU HG2 1 1 12 9068 2 2 21 GLU HG3 H -1.794 -13.422 -3.595 1.00 . B B . 42 GLU HG3 1 1 12 9069 2 2 21 GLU N N 0.565 -10.236 -2.423 1.00 . B B . 42 GLU N 1 1 12 9070 2 2 21 GLU O O -2.142 -12.479 -1.636 1.00 . B B . 42 GLU O 1 1 12 9071 2 2 21 GLU OE1 O -0.559 -13.474 -6.115 1.00 . B B . 42 GLU OE1 1 1 12 9072 2 2 21 GLU OE2 O 0.415 -14.905 -4.833 1.00 . B B . 42 GLU OE2 1 1 12 9073 2 2 22 ARG C C -2.314 -12.255 1.094 1.00 . B B . 43 ARG C 1 1 12 9074 2 2 22 ARG CA C -0.851 -12.506 0.723 1.00 . B B . 43 ARG CA 1 1 12 9075 2 2 22 ARG CB C 0.047 -12.151 1.911 1.00 . B B . 43 ARG CB 1 1 12 9076 2 2 22 ARG CD C -1.237 -10.978 3.708 1.00 . B B . 43 ARG CD 1 1 12 9077 2 2 22 ARG CG C -0.358 -10.785 2.471 1.00 . B B . 43 ARG CG 1 1 12 9078 2 2 22 ARG CZ C -0.709 -10.425 6.006 1.00 . B B . 43 ARG CZ 1 1 12 9079 2 2 22 ARG H H 0.281 -11.052 -0.395 1.00 . B B . 43 ARG H 1 1 12 9080 2 2 22 ARG HA H -0.718 -13.548 0.470 1.00 . B B . 43 ARG HA 1 1 12 9081 2 2 22 ARG HB2 H -0.060 -12.903 2.680 1.00 . B B . 43 ARG HB2 1 1 12 9082 2 2 22 ARG HB3 H 1.076 -12.114 1.586 1.00 . B B . 43 ARG HB3 1 1 12 9083 2 2 22 ARG HD2 H -1.910 -10.140 3.805 1.00 . B B . 43 ARG HD2 1 1 12 9084 2 2 22 ARG HD3 H -1.808 -11.889 3.606 1.00 . B B . 43 ARG HD3 1 1 12 9085 2 2 22 ARG HE H 0.444 -11.603 4.901 1.00 . B B . 43 ARG HE 1 1 12 9086 2 2 22 ARG HG2 H 0.528 -10.229 2.741 1.00 . B B . 43 ARG HG2 1 1 12 9087 2 2 22 ARG HG3 H -0.911 -10.239 1.721 1.00 . B B . 43 ARG HG3 1 1 12 9088 2 2 22 ARG HH11 H -2.664 -10.397 5.571 1.00 . B B . 43 ARG HH11 1 1 12 9089 2 2 22 ARG HH12 H -2.218 -9.643 7.065 1.00 . B B . 43 ARG HH12 1 1 12 9090 2 2 22 ARG HH21 H 1.167 -10.297 6.691 1.00 . B B . 43 ARG HH21 1 1 12 9091 2 2 22 ARG HH22 H -0.048 -9.586 7.699 1.00 . B B . 43 ARG HH22 1 1 12 9092 2 2 22 ARG N N -0.485 -11.661 -0.449 1.00 . B B . 43 ARG N 1 1 12 9093 2 2 22 ARG NE N -0.375 -11.065 4.920 1.00 . B B . 43 ARG NE 1 1 12 9094 2 2 22 ARG NH1 N -1.961 -10.132 6.232 1.00 . B B . 43 ARG NH1 1 1 12 9095 2 2 22 ARG NH2 N 0.208 -10.075 6.866 1.00 . B B . 43 ARG NH2 1 1 12 9096 2 2 22 ARG O O -2.865 -11.209 0.812 1.00 . B B . 43 ARG O 1 1 12 9097 2 2 23 GLY C C -5.275 -13.310 0.907 1.00 . B B . 44 GLY C 1 1 12 9098 2 2 23 GLY CA C -4.376 -13.023 2.111 1.00 . B B . 44 GLY CA 1 1 12 9099 2 2 23 GLY H H -2.485 -14.043 1.939 1.00 . B B . 44 GLY H 1 1 12 9100 2 2 23 GLY HA2 H -4.620 -13.703 2.914 1.00 . B B . 44 GLY HA2 1 1 12 9101 2 2 23 GLY HA3 H -4.532 -12.006 2.438 1.00 . B B . 44 GLY HA3 1 1 12 9102 2 2 23 GLY N N -2.948 -13.207 1.722 1.00 . B B . 44 GLY N 1 1 12 9103 2 2 23 GLY O O -5.181 -14.349 0.283 1.00 . B B . 44 GLY O 1 1 12 9104 2 2 24 GLY C C -6.579 -11.779 -1.775 1.00 . B B . 45 GLY C 1 1 12 9105 2 2 24 GLY CA C -7.052 -12.622 -0.590 1.00 . B B . 45 GLY CA 1 1 12 9106 2 2 24 GLY H H -6.208 -11.567 1.088 1.00 . B B . 45 GLY H 1 1 12 9107 2 2 24 GLY HA2 H -7.037 -13.668 -0.861 1.00 . B B . 45 GLY HA2 1 1 12 9108 2 2 24 GLY HA3 H -8.058 -12.332 -0.326 1.00 . B B . 45 GLY HA3 1 1 12 9109 2 2 24 GLY N N -6.148 -12.399 0.574 1.00 . B B . 45 GLY N 1 1 12 9110 2 2 24 GLY O O -5.768 -12.208 -2.570 1.00 . B B . 45 GLY O 1 1 12 9111 2 2 25 PHE C C -6.065 -8.406 -2.475 1.00 . B B . 46 PHE C 1 1 12 9112 2 2 25 PHE CA C -6.658 -9.709 -3.033 1.00 . B B . 46 PHE CA 1 1 12 9113 2 2 25 PHE CB C -7.874 -9.406 -3.916 1.00 . B B . 46 PHE CB 1 1 12 9114 2 2 25 PHE CD1 C -5.986 -8.707 -5.569 1.00 . B B . 46 PHE CD1 1 1 12 9115 2 2 25 PHE CD2 C -8.300 -8.431 -6.285 1.00 . B B . 46 PHE CD2 1 1 12 9116 2 2 25 PHE CE1 C -5.557 -8.194 -6.799 1.00 . B B . 46 PHE CE1 1 1 12 9117 2 2 25 PHE CE2 C -7.847 -7.920 -7.508 1.00 . B B . 46 PHE CE2 1 1 12 9118 2 2 25 PHE CG C -7.380 -8.837 -5.285 1.00 . B B . 46 PHE CG 1 1 12 9119 2 2 25 PHE CZ C -6.483 -7.803 -7.764 1.00 . B B . 46 PHE CZ 1 1 12 9120 2 2 25 PHE H H -7.732 -10.252 -1.247 1.00 . B B . 46 PHE H 1 1 12 9121 2 2 25 PHE HA H -5.908 -10.221 -3.617 1.00 . B B . 46 PHE HA 1 1 12 9122 2 2 25 PHE HB2 H -8.447 -10.338 -4.053 1.00 . B B . 46 PHE HB2 1 1 12 9123 2 2 25 PHE HB3 H -8.511 -8.675 -3.398 1.00 . B B . 46 PHE HB3 1 1 12 9124 2 2 25 PHE HD1 H -5.241 -8.997 -4.854 1.00 . B B . 46 PHE HD1 1 1 12 9125 2 2 25 PHE HD2 H -9.347 -8.506 -6.125 1.00 . B B . 46 PHE HD2 1 1 12 9126 2 2 25 PHE HE1 H -4.500 -8.101 -7.002 1.00 . B B . 46 PHE HE1 1 1 12 9127 2 2 25 PHE HE2 H -8.561 -7.615 -8.259 1.00 . B B . 46 PHE HE2 1 1 12 9128 2 2 25 PHE HZ H -6.143 -7.409 -8.710 1.00 . B B . 46 PHE HZ 1 1 12 9129 2 2 25 PHE N N -7.079 -10.580 -1.900 1.00 . B B . 46 PHE N 1 1 12 9130 2 2 25 PHE O O -5.179 -8.433 -1.644 1.00 . B B . 46 PHE O 1 1 12 9131 2 2 26 TYR C C -6.168 -5.939 -0.873 1.00 . B B . 47 TYR C 1 1 12 9132 2 2 26 TYR CA C -5.983 -5.988 -2.390 1.00 . B B . 47 TYR CA 1 1 12 9133 2 2 26 TYR CB C -6.711 -4.812 -3.052 1.00 . B B . 47 TYR CB 1 1 12 9134 2 2 26 TYR CD1 C -4.754 -3.370 -2.128 1.00 . B B . 47 TYR CD1 1 1 12 9135 2 2 26 TYR CD2 C -6.948 -2.329 -2.328 1.00 . B B . 47 TYR CD2 1 1 12 9136 2 2 26 TYR CE1 C -4.242 -2.166 -1.627 1.00 . B B . 47 TYR CE1 1 1 12 9137 2 2 26 TYR CE2 C -6.415 -1.135 -1.827 1.00 . B B . 47 TYR CE2 1 1 12 9138 2 2 26 TYR CG C -6.130 -3.476 -2.492 1.00 . B B . 47 TYR CG 1 1 12 9139 2 2 26 TYR CZ C -5.068 -1.054 -1.479 1.00 . B B . 47 TYR CZ 1 1 12 9140 2 2 26 TYR H H -7.250 -7.249 -3.581 1.00 . B B . 47 TYR H 1 1 12 9141 2 2 26 TYR HA H -4.934 -5.931 -2.620 1.00 . B B . 47 TYR HA 1 1 12 9142 2 2 26 TYR HB2 H -6.565 -4.882 -4.142 1.00 . B B . 47 TYR HB2 1 1 12 9143 2 2 26 TYR HB3 H -7.785 -4.890 -2.837 1.00 . B B . 47 TYR HB3 1 1 12 9144 2 2 26 TYR HD1 H -4.087 -4.204 -2.221 1.00 . B B . 47 TYR HD1 1 1 12 9145 2 2 26 TYR HD2 H -7.982 -2.355 -2.579 1.00 . B B . 47 TYR HD2 1 1 12 9146 2 2 26 TYR HE1 H -3.199 -2.099 -1.356 1.00 . B B . 47 TYR HE1 1 1 12 9147 2 2 26 TYR HE2 H -7.052 -0.271 -1.708 1.00 . B B . 47 TYR HE2 1 1 12 9148 2 2 26 TYR HH H -5.280 0.745 -0.876 1.00 . B B . 47 TYR HH 1 1 12 9149 2 2 26 TYR N N -6.536 -7.267 -2.914 1.00 . B B . 47 TYR N 1 1 12 9150 2 2 26 TYR O O -5.310 -6.356 -0.121 1.00 . B B . 47 TYR O 1 1 12 9151 2 2 26 TYR OH O -4.553 0.128 -0.986 1.00 . B B . 47 TYR OH 1 1 12 9152 2 2 27 THR C C -8.642 -6.342 1.426 1.00 . B B . 48 THR C 1 1 12 9153 2 2 27 THR CA C -7.523 -5.373 1.052 1.00 . B B . 48 THR CA 1 1 12 9154 2 2 27 THR CB C -7.929 -3.948 1.441 1.00 . B B . 48 THR CB 1 1 12 9155 2 2 27 THR CG2 C -8.178 -3.882 2.948 1.00 . B B . 48 THR CG2 1 1 12 9156 2 2 27 THR H H -7.959 -5.116 -1.039 1.00 . B B . 48 THR H 1 1 12 9157 2 2 27 THR HA H -6.627 -5.646 1.578 1.00 . B B . 48 THR HA 1 1 12 9158 2 2 27 THR HB H -8.831 -3.674 0.918 1.00 . B B . 48 THR HB 1 1 12 9159 2 2 27 THR HG1 H -6.796 -3.057 0.134 1.00 . B B . 48 THR HG1 1 1 12 9160 2 2 27 THR HG21 H -7.670 -4.702 3.433 1.00 . B B . 48 THR HG21 1 1 12 9161 2 2 27 THR HG22 H -9.239 -3.951 3.140 1.00 . B B . 48 THR HG22 1 1 12 9162 2 2 27 THR HG23 H -7.802 -2.946 3.334 1.00 . B B . 48 THR HG23 1 1 12 9163 2 2 27 THR N N -7.281 -5.441 -0.416 1.00 . B B . 48 THR N 1 1 12 9164 2 2 27 THR O O -8.406 -7.413 1.949 1.00 . B B . 48 THR O 1 1 12 9165 2 2 27 THR OG1 O -6.886 -3.049 1.090 1.00 . B B . 48 THR OG1 1 1 12 9166 2 2 28 LYS C C -11.023 -7.139 2.997 1.00 . B B . 49 LYS C 1 1 12 9167 2 2 28 LYS CA C -11.005 -6.862 1.490 1.00 . B B . 49 LYS CA 1 1 12 9168 2 2 28 LYS CB C -10.859 -8.184 0.732 1.00 . B B . 49 LYS CB 1 1 12 9169 2 2 28 LYS CD C -12.700 -8.668 -0.885 1.00 . B B . 49 LYS CD 1 1 12 9170 2 2 28 LYS CE C -13.503 -9.901 -1.305 1.00 . B B . 49 LYS CE 1 1 12 9171 2 2 28 LYS CG C -12.234 -8.832 0.563 1.00 . B B . 49 LYS CG 1 1 12 9172 2 2 28 LYS H H -10.014 -5.104 0.736 1.00 . B B . 49 LYS H 1 1 12 9173 2 2 28 LYS HA H -11.928 -6.383 1.200 1.00 . B B . 49 LYS HA 1 1 12 9174 2 2 28 LYS HB2 H -10.427 -7.995 -0.241 1.00 . B B . 49 LYS HB2 1 1 12 9175 2 2 28 LYS HB3 H -10.216 -8.849 1.288 1.00 . B B . 49 LYS HB3 1 1 12 9176 2 2 28 LYS HD2 H -13.322 -7.788 -0.965 1.00 . B B . 49 LYS HD2 1 1 12 9177 2 2 28 LYS HD3 H -11.842 -8.564 -1.530 1.00 . B B . 49 LYS HD3 1 1 12 9178 2 2 28 LYS HE2 H -12.892 -10.530 -1.936 1.00 . B B . 49 LYS HE2 1 1 12 9179 2 2 28 LYS HE3 H -13.800 -10.454 -0.426 1.00 . B B . 49 LYS HE3 1 1 12 9180 2 2 28 LYS HG2 H -12.168 -9.883 0.805 1.00 . B B . 49 LYS HG2 1 1 12 9181 2 2 28 LYS HG3 H -12.941 -8.353 1.223 1.00 . B B . 49 LYS HG3 1 1 12 9182 2 2 28 LYS HZ1 H -14.546 -8.541 -2.486 1.00 . B B . 49 LYS HZ1 1 1 12 9183 2 2 28 LYS HZ2 H -15.524 -9.412 -1.402 1.00 . B B . 49 LYS HZ2 1 1 12 9184 2 2 28 LYS HZ3 H -14.925 -10.163 -2.802 1.00 . B B . 49 LYS HZ3 1 1 12 9185 2 2 28 LYS N N -9.858 -5.971 1.159 1.00 . B B . 49 LYS N 1 1 12 9186 2 2 28 LYS NZ N -14.716 -9.472 -2.056 1.00 . B B . 49 LYS NZ 1 1 12 9187 2 2 28 LYS O O -10.367 -8.048 3.465 1.00 . B B . 49 LYS O 1 1 12 9188 2 2 29 PRO C C -12.840 -7.633 5.528 1.00 . B B . 50 PRO C 1 1 12 9189 2 2 29 PRO CA C -11.906 -6.472 5.172 1.00 . B B . 50 PRO CA 1 1 12 9190 2 2 29 PRO CB C -12.509 -5.133 5.603 1.00 . B B . 50 PRO CB 1 1 12 9191 2 2 29 PRO CD C -12.567 -5.241 3.134 1.00 . B B . 50 PRO CD 1 1 12 9192 2 2 29 PRO CG C -13.206 -4.550 4.353 1.00 . B B . 50 PRO CG 1 1 12 9193 2 2 29 PRO HA H -10.941 -6.603 5.623 1.00 . B B . 50 PRO HA 1 1 12 9194 2 2 29 PRO HB2 H -13.228 -5.290 6.397 1.00 . B B . 50 PRO HB2 1 1 12 9195 2 2 29 PRO HB3 H -11.731 -4.462 5.932 1.00 . B B . 50 PRO HB3 1 1 12 9196 2 2 29 PRO HD2 H -13.330 -5.628 2.476 1.00 . B B . 50 PRO HD2 1 1 12 9197 2 2 29 PRO HD3 H -11.918 -4.557 2.609 1.00 . B B . 50 PRO HD3 1 1 12 9198 2 2 29 PRO HG2 H -14.266 -4.763 4.390 1.00 . B B . 50 PRO HG2 1 1 12 9199 2 2 29 PRO HG3 H -13.042 -3.486 4.298 1.00 . B B . 50 PRO HG3 1 1 12 9200 2 2 29 PRO N N -11.777 -6.342 3.713 1.00 . B B . 50 PRO N 1 1 12 9201 2 2 29 PRO O O -13.794 -7.911 4.828 1.00 . B B . 50 PRO O 1 1 12 9202 2 2 30 THR C C -14.107 -9.137 8.355 1.00 . B B . 51 THR C 1 1 12 9203 2 2 30 THR CA C -13.448 -9.450 7.011 1.00 . B B . 51 THR CA 1 1 12 9204 2 2 30 THR CB C -12.605 -10.721 7.139 1.00 . B B . 51 THR CB 1 1 12 9205 2 2 30 THR CG2 C -12.997 -11.708 6.038 1.00 . B B . 51 THR CG2 1 1 12 9206 2 2 30 THR H H -11.800 -8.069 7.162 1.00 . B B . 51 THR H 1 1 12 9207 2 2 30 THR HA H -14.212 -9.598 6.262 1.00 . B B . 51 THR HA 1 1 12 9208 2 2 30 THR HB H -12.782 -11.175 8.102 1.00 . B B . 51 THR HB 1 1 12 9209 2 2 30 THR HG1 H -10.819 -10.495 7.877 1.00 . B B . 51 THR HG1 1 1 12 9210 2 2 30 THR HG21 H -12.117 -12.233 5.696 1.00 . B B . 51 THR HG21 1 1 12 9211 2 2 30 THR HG22 H -13.438 -11.169 5.212 1.00 . B B . 51 THR HG22 1 1 12 9212 2 2 30 THR HG23 H -13.711 -12.418 6.427 1.00 . B B . 51 THR HG23 1 1 12 9213 2 2 30 THR N N -12.574 -8.311 6.611 1.00 . B B . 51 THR N 1 1 12 9214 2 2 30 THR O O -15.127 -8.468 8.352 1.00 . B B . 51 THR O 1 1 12 9215 2 2 30 THR OXT O -13.580 -9.573 9.366 1.00 . B B . 51 THR OXT 1 1 12 9216 2 2 30 THR OG1 O -11.229 -10.390 7.015 1.00 . B B . 51 THR OG1 1 1 13 9217 1 1 1 GLY C C -6.344 8.346 0.915 1.00 . A A . 1 GLY C 1 1 13 9218 1 1 1 GLY CA C -7.784 8.616 0.640 1.00 . A A . 1 GLY CA 1 1 13 9219 1 1 1 GLY H1 H -8.588 6.851 -0.209 1.00 . A A . 1 GLY H1 1 1 13 9220 1 1 1 GLY H2 H -9.747 7.825 0.564 1.00 . A A . 1 GLY H2 1 1 13 9221 1 1 1 GLY H3 H -8.671 6.889 1.486 1.00 . A A . 1 GLY H3 1 1 13 9222 1 1 1 GLY HA2 H -7.464 8.826 -0.256 1.00 . A A . 1 GLY HA2 1 1 13 9223 1 1 1 GLY HA3 H -8.325 9.515 1.154 1.00 . A A . 1 GLY HA3 1 1 13 9224 1 1 1 GLY N N -8.777 7.453 0.618 1.00 . A A . 1 GLY N 1 1 13 9225 1 1 1 GLY O O -5.636 9.180 1.442 1.00 . A A . 1 GLY O 1 1 13 9226 1 1 2 ILE C C -3.580 7.442 -0.302 1.00 . A A . 2 ILE C 1 1 13 9227 1 1 2 ILE CA C -4.443 6.849 0.812 1.00 . A A . 2 ILE CA 1 1 13 9228 1 1 2 ILE CB C -4.273 5.331 0.829 1.00 . A A . 2 ILE CB 1 1 13 9229 1 1 2 ILE CD1 C -4.810 3.237 2.078 1.00 . A A . 2 ILE CD1 1 1 13 9230 1 1 2 ILE CG1 C -5.013 4.751 2.035 1.00 . A A . 2 ILE CG1 1 1 13 9231 1 1 2 ILE CG2 C -2.786 4.984 0.926 1.00 . A A . 2 ILE CG2 1 1 13 9232 1 1 2 ILE H H -6.464 6.523 0.141 1.00 . A A . 2 ILE H 1 1 13 9233 1 1 2 ILE HA H -4.136 7.254 1.765 1.00 . A A . 2 ILE HA 1 1 13 9234 1 1 2 ILE HB H -4.680 4.914 -0.081 1.00 . A A . 2 ILE HB 1 1 13 9235 1 1 2 ILE HD11 H -4.324 2.966 3.003 1.00 . A A . 2 ILE HD11 1 1 13 9236 1 1 2 ILE HD12 H -4.195 2.933 1.245 1.00 . A A . 2 ILE HD12 1 1 13 9237 1 1 2 ILE HD13 H -5.769 2.744 2.017 1.00 . A A . 2 ILE HD13 1 1 13 9238 1 1 2 ILE HG12 H -4.626 5.193 2.942 1.00 . A A . 2 ILE HG12 1 1 13 9239 1 1 2 ILE HG13 H -6.067 4.968 1.950 1.00 . A A . 2 ILE HG13 1 1 13 9240 1 1 2 ILE HG21 H -2.197 5.876 0.771 1.00 . A A . 2 ILE HG21 1 1 13 9241 1 1 2 ILE HG22 H -2.538 4.253 0.172 1.00 . A A . 2 ILE HG22 1 1 13 9242 1 1 2 ILE HG23 H -2.575 4.579 1.904 1.00 . A A . 2 ILE HG23 1 1 13 9243 1 1 2 ILE N N -5.874 7.181 0.566 1.00 . A A . 2 ILE N 1 1 13 9244 1 1 2 ILE O O -2.554 8.044 -0.053 1.00 . A A . 2 ILE O 1 1 13 9245 1 1 3 VAL C C -2.956 9.319 -2.452 1.00 . A A . 3 VAL C 1 1 13 9246 1 1 3 VAL CA C -3.192 7.824 -2.663 1.00 . A A . 3 VAL CA 1 1 13 9247 1 1 3 VAL CB C -3.959 7.614 -3.969 1.00 . A A . 3 VAL CB 1 1 13 9248 1 1 3 VAL CG1 C -4.450 6.170 -4.045 1.00 . A A . 3 VAL CG1 1 1 13 9249 1 1 3 VAL CG2 C -5.162 8.559 -4.008 1.00 . A A . 3 VAL CG2 1 1 13 9250 1 1 3 VAL H H -4.816 6.783 -1.707 1.00 . A A . 3 VAL H 1 1 13 9251 1 1 3 VAL HA H -2.243 7.314 -2.718 1.00 . A A . 3 VAL HA 1 1 13 9252 1 1 3 VAL HB H -3.308 7.820 -4.806 1.00 . A A . 3 VAL HB 1 1 13 9253 1 1 3 VAL HG11 H -3.946 5.661 -4.853 1.00 . A A . 3 VAL HG11 1 1 13 9254 1 1 3 VAL HG12 H -5.515 6.161 -4.223 1.00 . A A . 3 VAL HG12 1 1 13 9255 1 1 3 VAL HG13 H -4.237 5.667 -3.113 1.00 . A A . 3 VAL HG13 1 1 13 9256 1 1 3 VAL HG21 H -4.838 9.543 -4.314 1.00 . A A . 3 VAL HG21 1 1 13 9257 1 1 3 VAL HG22 H -5.607 8.616 -3.026 1.00 . A A . 3 VAL HG22 1 1 13 9258 1 1 3 VAL HG23 H -5.891 8.185 -4.712 1.00 . A A . 3 VAL HG23 1 1 13 9259 1 1 3 VAL N N -3.987 7.274 -1.529 1.00 . A A . 3 VAL N 1 1 13 9260 1 1 3 VAL O O -2.080 9.911 -3.048 1.00 . A A . 3 VAL O 1 1 13 9261 1 1 4 GLU C C -2.631 11.614 -0.182 1.00 . A A . 4 GLU C 1 1 13 9262 1 1 4 GLU CA C -3.568 11.396 -1.372 1.00 . A A . 4 GLU CA 1 1 13 9263 1 1 4 GLU CB C -4.934 12.021 -1.071 1.00 . A A . 4 GLU CB 1 1 13 9264 1 1 4 GLU CD C -7.281 12.119 -1.930 1.00 . A A . 4 GLU CD 1 1 13 9265 1 1 4 GLU CG C -6.026 11.252 -1.821 1.00 . A A . 4 GLU CG 1 1 13 9266 1 1 4 GLU H H -4.444 9.440 -1.150 1.00 . A A . 4 GLU H 1 1 13 9267 1 1 4 GLU HA H -3.146 11.860 -2.251 1.00 . A A . 4 GLU HA 1 1 13 9268 1 1 4 GLU HB2 H -5.125 11.975 -0.009 1.00 . A A . 4 GLU HB2 1 1 13 9269 1 1 4 GLU HB3 H -4.937 13.052 -1.393 1.00 . A A . 4 GLU HB3 1 1 13 9270 1 1 4 GLU HG2 H -5.674 11.000 -2.811 1.00 . A A . 4 GLU HG2 1 1 13 9271 1 1 4 GLU HG3 H -6.263 10.346 -1.283 1.00 . A A . 4 GLU HG3 1 1 13 9272 1 1 4 GLU N N -3.738 9.935 -1.615 1.00 . A A . 4 GLU N 1 1 13 9273 1 1 4 GLU O O -2.240 12.725 0.116 1.00 . A A . 4 GLU O 1 1 13 9274 1 1 4 GLU OE1 O -7.337 13.134 -1.255 1.00 . A A . 4 GLU OE1 1 1 13 9275 1 1 4 GLU OE2 O -8.166 11.754 -2.687 1.00 . A A . 4 GLU OE2 1 1 13 9276 1 1 5 GLN C C 0.045 10.230 1.321 1.00 . A A . 5 GLN C 1 1 13 9277 1 1 5 GLN CA C -1.362 10.719 1.677 1.00 . A A . 5 GLN CA 1 1 13 9278 1 1 5 GLN CB C -1.902 9.898 2.848 1.00 . A A . 5 GLN CB 1 1 13 9279 1 1 5 GLN CD C -1.397 10.448 5.234 1.00 . A A . 5 GLN CD 1 1 13 9280 1 1 5 GLN CG C -2.239 10.830 4.015 1.00 . A A . 5 GLN CG 1 1 13 9281 1 1 5 GLN H H -2.598 9.676 0.252 1.00 . A A . 5 GLN H 1 1 13 9282 1 1 5 GLN HA H -1.318 11.760 1.961 1.00 . A A . 5 GLN HA 1 1 13 9283 1 1 5 GLN HB2 H -2.793 9.371 2.538 1.00 . A A . 5 GLN HB2 1 1 13 9284 1 1 5 GLN HB3 H -1.155 9.186 3.164 1.00 . A A . 5 GLN HB3 1 1 13 9285 1 1 5 GLN HE21 H 0.029 11.773 4.842 1.00 . A A . 5 GLN HE21 1 1 13 9286 1 1 5 GLN HE22 H 0.276 10.831 6.232 1.00 . A A . 5 GLN HE22 1 1 13 9287 1 1 5 GLN HG2 H -2.024 11.850 3.732 1.00 . A A . 5 GLN HG2 1 1 13 9288 1 1 5 GLN HG3 H -3.287 10.738 4.260 1.00 . A A . 5 GLN HG3 1 1 13 9289 1 1 5 GLN N N -2.270 10.565 0.505 1.00 . A A . 5 GLN N 1 1 13 9290 1 1 5 GLN NE2 N -0.271 11.069 5.454 1.00 . A A . 5 GLN NE2 1 1 13 9291 1 1 5 GLN O O 1.029 10.719 1.839 1.00 . A A . 5 GLN O 1 1 13 9292 1 1 5 GLN OE1 O -1.768 9.575 5.993 1.00 . A A . 5 GLN OE1 1 1 13 9293 1 1 6 CYS C C 1.902 9.225 -1.306 1.00 . A A . 6 CYS C 1 1 13 9294 1 1 6 CYS CA C 1.500 8.735 0.088 1.00 . A A . 6 CYS CA 1 1 13 9295 1 1 6 CYS CB C 1.470 7.208 0.111 1.00 . A A . 6 CYS CB 1 1 13 9296 1 1 6 CYS H H -0.652 8.867 0.053 1.00 . A A . 6 CYS H 1 1 13 9297 1 1 6 CYS HA H 2.224 9.086 0.809 1.00 . A A . 6 CYS HA 1 1 13 9298 1 1 6 CYS HB2 H 0.618 6.855 -0.451 1.00 . A A . 6 CYS HB2 1 1 13 9299 1 1 6 CYS HB3 H 2.378 6.821 -0.329 1.00 . A A . 6 CYS HB3 1 1 13 9300 1 1 6 CYS N N 0.152 9.259 0.454 1.00 . A A . 6 CYS N 1 1 13 9301 1 1 6 CYS O O 2.879 9.926 -1.465 1.00 . A A . 6 CYS O 1 1 13 9302 1 1 6 CYS SG S 1.342 6.645 1.826 1.00 . A A . 6 CYS SG 1 1 13 9303 1 1 7 CYS C C 1.816 10.817 -3.675 1.00 . A A . 7 CYS C 1 1 13 9304 1 1 7 CYS CA C 1.524 9.314 -3.695 1.00 . A A . 7 CYS CA 1 1 13 9305 1 1 7 CYS CB C 0.360 9.037 -4.645 1.00 . A A . 7 CYS CB 1 1 13 9306 1 1 7 CYS H H 0.381 8.291 -2.178 1.00 . A A . 7 CYS H 1 1 13 9307 1 1 7 CYS HA H 2.406 8.780 -4.041 1.00 . A A . 7 CYS HA 1 1 13 9308 1 1 7 CYS HB2 H 0.085 7.994 -4.586 1.00 . A A . 7 CYS HB2 1 1 13 9309 1 1 7 CYS HB3 H -0.484 9.649 -4.369 1.00 . A A . 7 CYS HB3 1 1 13 9310 1 1 7 CYS N N 1.165 8.861 -2.320 1.00 . A A . 7 CYS N 1 1 13 9311 1 1 7 CYS O O 2.589 11.316 -4.466 1.00 . A A . 7 CYS O 1 1 13 9312 1 1 7 CYS SG S 0.864 9.435 -6.334 1.00 . A A . 7 CYS SG 1 1 13 9313 1 1 8 THR C C 2.899 13.243 -2.217 1.00 . A A . 8 THR C 1 1 13 9314 1 1 8 THR CA C 1.472 13.013 -2.719 1.00 . A A . 8 THR CA 1 1 13 9315 1 1 8 THR CB C 0.480 13.683 -1.765 1.00 . A A . 8 THR CB 1 1 13 9316 1 1 8 THR CG2 C 0.498 12.970 -0.413 1.00 . A A . 8 THR CG2 1 1 13 9317 1 1 8 THR H H 0.590 11.130 -2.141 1.00 . A A . 8 THR H 1 1 13 9318 1 1 8 THR HA H 1.366 13.436 -3.707 1.00 . A A . 8 THR HA 1 1 13 9319 1 1 8 THR HB H -0.514 13.630 -2.182 1.00 . A A . 8 THR HB 1 1 13 9320 1 1 8 THR HG1 H 0.087 15.511 -1.234 1.00 . A A . 8 THR HG1 1 1 13 9321 1 1 8 THR HG21 H -0.173 12.125 -0.442 1.00 . A A . 8 THR HG21 1 1 13 9322 1 1 8 THR HG22 H 0.179 13.656 0.359 1.00 . A A . 8 THR HG22 1 1 13 9323 1 1 8 THR HG23 H 1.499 12.628 -0.198 1.00 . A A . 8 THR HG23 1 1 13 9324 1 1 8 THR N N 1.210 11.546 -2.776 1.00 . A A . 8 THR N 1 1 13 9325 1 1 8 THR O O 3.482 14.290 -2.420 1.00 . A A . 8 THR O 1 1 13 9326 1 1 8 THR OG1 O 0.846 15.044 -1.587 1.00 . A A . 8 THR OG1 1 1 13 9327 1 1 9 SER C C 5.506 11.016 -1.017 1.00 . A A . 9 SER C 1 1 13 9328 1 1 9 SER CA C 4.852 12.400 -1.048 1.00 . A A . 9 SER CA 1 1 13 9329 1 1 9 SER CB C 4.812 12.983 0.366 1.00 . A A . 9 SER CB 1 1 13 9330 1 1 9 SER H H 2.970 11.430 -1.421 1.00 . A A . 9 SER H 1 1 13 9331 1 1 9 SER HA H 5.418 13.054 -1.695 1.00 . A A . 9 SER HA 1 1 13 9332 1 1 9 SER HB2 H 4.059 13.751 0.420 1.00 . A A . 9 SER HB2 1 1 13 9333 1 1 9 SER HB3 H 4.574 12.198 1.073 1.00 . A A . 9 SER HB3 1 1 13 9334 1 1 9 SER HG H 6.061 13.830 1.596 1.00 . A A . 9 SER HG 1 1 13 9335 1 1 9 SER N N 3.463 12.264 -1.567 1.00 . A A . 9 SER N 1 1 13 9336 1 1 9 SER O O 5.174 10.146 -1.797 1.00 . A A . 9 SER O 1 1 13 9337 1 1 9 SER OG O 6.078 13.550 0.677 1.00 . A A . 9 SER OG 1 1 13 9338 1 1 10 ILE C C 6.635 8.735 1.210 1.00 . A A . 10 ILE C 1 1 13 9339 1 1 10 ILE CA C 7.088 9.464 -0.055 1.00 . A A . 10 ILE CA 1 1 13 9340 1 1 10 ILE CB C 8.605 9.642 -0.033 1.00 . A A . 10 ILE CB 1 1 13 9341 1 1 10 ILE CD1 C 8.466 10.363 -2.420 1.00 . A A . 10 ILE CD1 1 1 13 9342 1 1 10 ILE CG1 C 9.001 10.729 -1.034 1.00 . A A . 10 ILE CG1 1 1 13 9343 1 1 10 ILE CG2 C 9.275 8.325 -0.423 1.00 . A A . 10 ILE CG2 1 1 13 9344 1 1 10 ILE H H 6.686 11.507 0.503 1.00 . A A . 10 ILE H 1 1 13 9345 1 1 10 ILE HA H 6.808 8.882 -0.922 1.00 . A A . 10 ILE HA 1 1 13 9346 1 1 10 ILE HB H 8.921 9.929 0.960 1.00 . A A . 10 ILE HB 1 1 13 9347 1 1 10 ILE HD11 H 7.852 11.169 -2.794 1.00 . A A . 10 ILE HD11 1 1 13 9348 1 1 10 ILE HD12 H 7.874 9.462 -2.351 1.00 . A A . 10 ILE HD12 1 1 13 9349 1 1 10 ILE HD13 H 9.294 10.199 -3.093 1.00 . A A . 10 ILE HD13 1 1 13 9350 1 1 10 ILE HG12 H 8.583 11.675 -0.722 1.00 . A A . 10 ILE HG12 1 1 13 9351 1 1 10 ILE HG13 H 10.077 10.806 -1.075 1.00 . A A . 10 ILE HG13 1 1 13 9352 1 1 10 ILE HG21 H 10.123 8.528 -1.060 1.00 . A A . 10 ILE HG21 1 1 13 9353 1 1 10 ILE HG22 H 8.567 7.704 -0.953 1.00 . A A . 10 ILE HG22 1 1 13 9354 1 1 10 ILE HG23 H 9.608 7.813 0.467 1.00 . A A . 10 ILE HG23 1 1 13 9355 1 1 10 ILE N N 6.429 10.798 -0.123 1.00 . A A . 10 ILE N 1 1 13 9356 1 1 10 ILE O O 6.694 9.268 2.301 1.00 . A A . 10 ILE O 1 1 13 9357 1 1 11 CYS C C 6.667 5.592 2.535 1.00 . A A . 11 CYS C 1 1 13 9358 1 1 11 CYS CA C 5.711 6.754 2.260 1.00 . A A . 11 CYS CA 1 1 13 9359 1 1 11 CYS CB C 4.317 6.189 1.983 1.00 . A A . 11 CYS CB 1 1 13 9360 1 1 11 CYS H H 6.134 7.114 0.179 1.00 . A A . 11 CYS H 1 1 13 9361 1 1 11 CYS HA H 5.673 7.406 3.120 1.00 . A A . 11 CYS HA 1 1 13 9362 1 1 11 CYS HB2 H 4.169 6.106 0.917 1.00 . A A . 11 CYS HB2 1 1 13 9363 1 1 11 CYS HB3 H 4.230 5.212 2.435 1.00 . A A . 11 CYS HB3 1 1 13 9364 1 1 11 CYS N N 6.176 7.521 1.070 1.00 . A A . 11 CYS N 1 1 13 9365 1 1 11 CYS O O 7.461 5.213 1.696 1.00 . A A . 11 CYS O 1 1 13 9366 1 1 11 CYS SG S 3.058 7.286 2.678 1.00 . A A . 11 CYS SG 1 1 13 9367 1 1 12 SER C C 6.616 2.590 4.046 1.00 . A A . 12 SER C 1 1 13 9368 1 1 12 SER CA C 7.466 3.862 4.032 1.00 . A A . 12 SER CA 1 1 13 9369 1 1 12 SER CB C 8.093 4.078 5.410 1.00 . A A . 12 SER CB 1 1 13 9370 1 1 12 SER H H 5.922 5.327 4.355 1.00 . A A . 12 SER H 1 1 13 9371 1 1 12 SER HA H 8.242 3.773 3.286 1.00 . A A . 12 SER HA 1 1 13 9372 1 1 12 SER HB2 H 8.988 3.485 5.499 1.00 . A A . 12 SER HB2 1 1 13 9373 1 1 12 SER HB3 H 8.344 5.124 5.530 1.00 . A A . 12 SER HB3 1 1 13 9374 1 1 12 SER HG H 6.689 4.461 6.702 1.00 . A A . 12 SER HG 1 1 13 9375 1 1 12 SER N N 6.581 5.013 3.700 1.00 . A A . 12 SER N 1 1 13 9376 1 1 12 SER O O 5.481 2.604 4.476 1.00 . A A . 12 SER O 1 1 13 9377 1 1 12 SER OG O 7.170 3.681 6.415 1.00 . A A . 12 SER OG 1 1 13 9378 1 1 13 LEU C C 5.645 0.083 4.921 1.00 . A A . 13 LEU C 1 1 13 9379 1 1 13 LEU CA C 6.325 0.246 3.564 1.00 . A A . 13 LEU CA 1 1 13 9380 1 1 13 LEU CB C 7.210 -0.972 3.282 1.00 . A A . 13 LEU CB 1 1 13 9381 1 1 13 LEU CD1 C 5.156 -1.870 2.172 1.00 . A A . 13 LEU CD1 1 1 13 9382 1 1 13 LEU CD2 C 7.007 -0.899 0.795 1.00 . A A . 13 LEU CD2 1 1 13 9383 1 1 13 LEU CG C 6.674 -1.710 2.051 1.00 . A A . 13 LEU CG 1 1 13 9384 1 1 13 LEU H H 8.049 1.489 3.217 1.00 . A A . 13 LEU H 1 1 13 9385 1 1 13 LEU HA H 5.569 0.325 2.797 1.00 . A A . 13 LEU HA 1 1 13 9386 1 1 13 LEU HB2 H 8.223 -0.646 3.096 1.00 . A A . 13 LEU HB2 1 1 13 9387 1 1 13 LEU HB3 H 7.193 -1.636 4.133 1.00 . A A . 13 LEU HB3 1 1 13 9388 1 1 13 LEU HD11 H 4.669 -1.281 1.409 1.00 . A A . 13 LEU HD11 1 1 13 9389 1 1 13 LEU HD12 H 4.838 -1.530 3.147 1.00 . A A . 13 LEU HD12 1 1 13 9390 1 1 13 LEU HD13 H 4.890 -2.907 2.052 1.00 . A A . 13 LEU HD13 1 1 13 9391 1 1 13 LEU HD21 H 7.521 -1.529 0.084 1.00 . A A . 13 LEU HD21 1 1 13 9392 1 1 13 LEU HD22 H 7.641 -0.067 1.062 1.00 . A A . 13 LEU HD22 1 1 13 9393 1 1 13 LEU HD23 H 6.094 -0.529 0.353 1.00 . A A . 13 LEU HD23 1 1 13 9394 1 1 13 LEU HG H 7.129 -2.687 1.985 1.00 . A A . 13 LEU HG 1 1 13 9395 1 1 13 LEU N N 7.138 1.492 3.572 1.00 . A A . 13 LEU N 1 1 13 9396 1 1 13 LEU O O 4.582 -0.496 5.026 1.00 . A A . 13 LEU O 1 1 13 9397 1 1 14 TYR C C 4.178 1.017 7.206 1.00 . A A . 14 TYR C 1 1 13 9398 1 1 14 TYR CA C 5.605 0.482 7.300 1.00 . A A . 14 TYR CA 1 1 13 9399 1 1 14 TYR CB C 6.395 1.299 8.326 1.00 . A A . 14 TYR CB 1 1 13 9400 1 1 14 TYR CD1 C 5.206 0.103 10.277 1.00 . A A . 14 TYR CD1 1 1 13 9401 1 1 14 TYR CD2 C 7.638 0.210 10.305 1.00 . A A . 14 TYR CD2 1 1 13 9402 1 1 14 TYR CE1 C 5.232 -0.606 11.485 1.00 . A A . 14 TYR CE1 1 1 13 9403 1 1 14 TYR CE2 C 7.646 -0.498 11.513 1.00 . A A . 14 TYR CE2 1 1 13 9404 1 1 14 TYR CG C 6.416 0.525 9.666 1.00 . A A . 14 TYR CG 1 1 13 9405 1 1 14 TYR CZ C 6.447 -0.904 12.102 1.00 . A A . 14 TYR CZ 1 1 13 9406 1 1 14 TYR H H 7.091 1.074 5.856 1.00 . A A . 14 TYR H 1 1 13 9407 1 1 14 TYR HA H 5.584 -0.555 7.600 1.00 . A A . 14 TYR HA 1 1 13 9408 1 1 14 TYR HB2 H 7.406 1.457 7.949 1.00 . A A . 14 TYR HB2 1 1 13 9409 1 1 14 TYR HB3 H 5.918 2.268 8.453 1.00 . A A . 14 TYR HB3 1 1 13 9410 1 1 14 TYR HD1 H 4.256 0.314 9.824 1.00 . A A . 14 TYR HD1 1 1 13 9411 1 1 14 TYR HD2 H 8.570 0.503 9.873 1.00 . A A . 14 TYR HD2 1 1 13 9412 1 1 14 TYR HE1 H 4.306 -0.923 11.942 1.00 . A A . 14 TYR HE1 1 1 13 9413 1 1 14 TYR HE2 H 8.585 -0.731 11.993 1.00 . A A . 14 TYR HE2 1 1 13 9414 1 1 14 TYR HH H 5.901 -1.141 13.917 1.00 . A A . 14 TYR HH 1 1 13 9415 1 1 14 TYR N N 6.239 0.600 5.960 1.00 . A A . 14 TYR N 1 1 13 9416 1 1 14 TYR O O 3.238 0.392 7.653 1.00 . A A . 14 TYR O 1 1 13 9417 1 1 14 TYR OH O 6.464 -1.603 13.292 1.00 . A A . 14 TYR OH 1 1 13 9418 1 1 15 GLN C C 1.838 1.822 5.540 1.00 . A A . 15 GLN C 1 1 13 9419 1 1 15 GLN CA C 2.644 2.735 6.461 1.00 . A A . 15 GLN CA 1 1 13 9420 1 1 15 GLN CB C 2.737 4.138 5.854 1.00 . A A . 15 GLN CB 1 1 13 9421 1 1 15 GLN CD C 2.241 5.629 7.798 1.00 . A A . 15 GLN CD 1 1 13 9422 1 1 15 GLN CG C 3.343 5.100 6.878 1.00 . A A . 15 GLN CG 1 1 13 9423 1 1 15 GLN H H 4.782 2.644 6.241 1.00 . A A . 15 GLN H 1 1 13 9424 1 1 15 GLN HA H 2.166 2.785 7.428 1.00 . A A . 15 GLN HA 1 1 13 9425 1 1 15 GLN HB2 H 3.362 4.108 4.974 1.00 . A A . 15 GLN HB2 1 1 13 9426 1 1 15 GLN HB3 H 1.751 4.480 5.583 1.00 . A A . 15 GLN HB3 1 1 13 9427 1 1 15 GLN HE21 H 3.355 5.506 9.436 1.00 . A A . 15 GLN HE21 1 1 13 9428 1 1 15 GLN HE22 H 1.779 6.091 9.673 1.00 . A A . 15 GLN HE22 1 1 13 9429 1 1 15 GLN HG2 H 4.084 4.578 7.468 1.00 . A A . 15 GLN HG2 1 1 13 9430 1 1 15 GLN HG3 H 3.809 5.926 6.364 1.00 . A A . 15 GLN HG3 1 1 13 9431 1 1 15 GLN N N 4.010 2.165 6.608 1.00 . A A . 15 GLN N 1 1 13 9432 1 1 15 GLN NE2 N 2.478 5.752 9.075 1.00 . A A . 15 GLN NE2 1 1 13 9433 1 1 15 GLN O O 0.679 1.543 5.780 1.00 . A A . 15 GLN O 1 1 13 9434 1 1 15 GLN OE1 O 1.155 5.937 7.349 1.00 . A A . 15 GLN OE1 1 1 13 9435 1 1 16 LEU C C 1.357 -0.842 4.336 1.00 . A A . 16 LEU C 1 1 13 9436 1 1 16 LEU CA C 1.729 0.423 3.569 1.00 . A A . 16 LEU CA 1 1 13 9437 1 1 16 LEU CB C 2.632 0.064 2.384 1.00 . A A . 16 LEU CB 1 1 13 9438 1 1 16 LEU CD1 C 3.596 2.350 2.095 1.00 . A A . 16 LEU CD1 1 1 13 9439 1 1 16 LEU CD2 C 3.409 0.817 0.130 1.00 . A A . 16 LEU CD2 1 1 13 9440 1 1 16 LEU CG C 2.747 1.261 1.438 1.00 . A A . 16 LEU CG 1 1 13 9441 1 1 16 LEU H H 3.389 1.563 4.326 1.00 . A A . 16 LEU H 1 1 13 9442 1 1 16 LEU HA H 0.831 0.903 3.213 1.00 . A A . 16 LEU HA 1 1 13 9443 1 1 16 LEU HB2 H 3.613 -0.200 2.749 1.00 . A A . 16 LEU HB2 1 1 13 9444 1 1 16 LEU HB3 H 2.209 -0.775 1.851 1.00 . A A . 16 LEU HB3 1 1 13 9445 1 1 16 LEU HD11 H 3.943 3.041 1.341 1.00 . A A . 16 LEU HD11 1 1 13 9446 1 1 16 LEU HD12 H 4.445 1.897 2.586 1.00 . A A . 16 LEU HD12 1 1 13 9447 1 1 16 LEU HD13 H 3.000 2.881 2.823 1.00 . A A . 16 LEU HD13 1 1 13 9448 1 1 16 LEU HD21 H 3.396 -0.261 0.068 1.00 . A A . 16 LEU HD21 1 1 13 9449 1 1 16 LEU HD22 H 4.431 1.167 0.107 1.00 . A A . 16 LEU HD22 1 1 13 9450 1 1 16 LEU HD23 H 2.868 1.233 -0.707 1.00 . A A . 16 LEU HD23 1 1 13 9451 1 1 16 LEU HG H 1.763 1.651 1.229 1.00 . A A . 16 LEU HG 1 1 13 9452 1 1 16 LEU N N 2.451 1.337 4.493 1.00 . A A . 16 LEU N 1 1 13 9453 1 1 16 LEU O O 0.314 -1.428 4.122 1.00 . A A . 16 LEU O 1 1 13 9454 1 1 17 GLU C C 0.517 -2.271 6.694 1.00 . A A . 17 GLU C 1 1 13 9455 1 1 17 GLU CA C 1.881 -2.470 6.040 1.00 . A A . 17 GLU CA 1 1 13 9456 1 1 17 GLU CB C 2.949 -2.661 7.117 1.00 . A A . 17 GLU CB 1 1 13 9457 1 1 17 GLU CD C 4.603 -4.366 7.891 1.00 . A A . 17 GLU CD 1 1 13 9458 1 1 17 GLU CG C 3.953 -3.722 6.664 1.00 . A A . 17 GLU CG 1 1 13 9459 1 1 17 GLU H H 3.023 -0.765 5.417 1.00 . A A . 17 GLU H 1 1 13 9460 1 1 17 GLU HA H 1.854 -3.334 5.394 1.00 . A A . 17 GLU HA 1 1 13 9461 1 1 17 GLU HB2 H 3.464 -1.724 7.281 1.00 . A A . 17 GLU HB2 1 1 13 9462 1 1 17 GLU HB3 H 2.482 -2.977 8.034 1.00 . A A . 17 GLU HB3 1 1 13 9463 1 1 17 GLU HG2 H 3.441 -4.479 6.087 1.00 . A A . 17 GLU HG2 1 1 13 9464 1 1 17 GLU HG3 H 4.716 -3.260 6.056 1.00 . A A . 17 GLU HG3 1 1 13 9465 1 1 17 GLU N N 2.196 -1.259 5.246 1.00 . A A . 17 GLU N 1 1 13 9466 1 1 17 GLU O O -0.241 -3.202 6.881 1.00 . A A . 17 GLU O 1 1 13 9467 1 1 17 GLU OE1 O 4.427 -3.836 8.976 1.00 . A A . 17 GLU OE1 1 1 13 9468 1 1 17 GLU OE2 O 5.267 -5.376 7.725 1.00 . A A . 17 GLU OE2 1 1 13 9469 1 1 18 ASN C C -2.225 -1.054 6.637 1.00 . A A . 18 ASN C 1 1 13 9470 1 1 18 ASN CA C -1.124 -0.775 7.659 1.00 . A A . 18 ASN CA 1 1 13 9471 1 1 18 ASN CB C -1.189 0.692 8.092 1.00 . A A . 18 ASN CB 1 1 13 9472 1 1 18 ASN CG C -2.435 0.918 8.949 1.00 . A A . 18 ASN CG 1 1 13 9473 1 1 18 ASN H H 0.820 -0.313 6.862 1.00 . A A . 18 ASN H 1 1 13 9474 1 1 18 ASN HA H -1.258 -1.414 8.520 1.00 . A A . 18 ASN HA 1 1 13 9475 1 1 18 ASN HB2 H -0.306 0.937 8.665 1.00 . A A . 18 ASN HB2 1 1 13 9476 1 1 18 ASN HB3 H -1.237 1.323 7.217 1.00 . A A . 18 ASN HB3 1 1 13 9477 1 1 18 ASN HD21 H -3.693 0.711 7.427 1.00 . A A . 18 ASN HD21 1 1 13 9478 1 1 18 ASN HD22 H -4.418 1.026 8.929 1.00 . A A . 18 ASN HD22 1 1 13 9479 1 1 18 ASN N N 0.195 -1.051 7.032 1.00 . A A . 18 ASN N 1 1 13 9480 1 1 18 ASN ND2 N -3.613 0.882 8.389 1.00 . A A . 18 ASN ND2 1 1 13 9481 1 1 18 ASN O O -3.325 -1.434 6.984 1.00 . A A . 18 ASN O 1 1 13 9482 1 1 18 ASN OD1 O -2.336 1.131 10.141 1.00 . A A . 18 ASN OD1 1 1 13 9483 1 1 19 TYR C C -3.342 -2.613 4.372 1.00 . A A . 19 TYR C 1 1 13 9484 1 1 19 TYR CA C -2.979 -1.127 4.342 1.00 . A A . 19 TYR CA 1 1 13 9485 1 1 19 TYR CB C -2.445 -0.779 2.947 1.00 . A A . 19 TYR CB 1 1 13 9486 1 1 19 TYR CD1 C -1.752 1.467 4.108 1.00 . A A . 19 TYR CD1 1 1 13 9487 1 1 19 TYR CD2 C -1.031 1.073 1.815 1.00 . A A . 19 TYR CD2 1 1 13 9488 1 1 19 TYR CE1 C -1.089 2.700 4.085 1.00 . A A . 19 TYR CE1 1 1 13 9489 1 1 19 TYR CE2 C -0.382 2.308 1.814 1.00 . A A . 19 TYR CE2 1 1 13 9490 1 1 19 TYR CG C -1.735 0.617 2.959 1.00 . A A . 19 TYR CG 1 1 13 9491 1 1 19 TYR CZ C -0.407 3.118 2.944 1.00 . A A . 19 TYR CZ 1 1 13 9492 1 1 19 TYR H H -1.046 -0.560 5.110 1.00 . A A . 19 TYR H 1 1 13 9493 1 1 19 TYR HA H -3.857 -0.534 4.553 1.00 . A A . 19 TYR HA 1 1 13 9494 1 1 19 TYR HB2 H -1.742 -1.571 2.644 1.00 . A A . 19 TYR HB2 1 1 13 9495 1 1 19 TYR HB3 H -3.288 -0.777 2.242 1.00 . A A . 19 TYR HB3 1 1 13 9496 1 1 19 TYR HD1 H -2.267 1.189 5.007 1.00 . A A . 19 TYR HD1 1 1 13 9497 1 1 19 TYR HD2 H -0.991 0.491 0.934 1.00 . A A . 19 TYR HD2 1 1 13 9498 1 1 19 TYR HE1 H -1.106 3.330 4.956 1.00 . A A . 19 TYR HE1 1 1 13 9499 1 1 19 TYR HE2 H 0.149 2.631 0.930 1.00 . A A . 19 TYR HE2 1 1 13 9500 1 1 19 TYR HH H -0.362 4.998 3.268 1.00 . A A . 19 TYR HH 1 1 13 9501 1 1 19 TYR N N -1.940 -0.869 5.375 1.00 . A A . 19 TYR N 1 1 13 9502 1 1 19 TYR O O -4.494 -2.986 4.275 1.00 . A A . 19 TYR O 1 1 13 9503 1 1 19 TYR OH O 0.244 4.334 2.934 1.00 . A A . 19 TYR OH 1 1 13 9504 1 1 20 CYS C C -2.835 -5.382 5.980 1.00 . A A . 20 CYS C 1 1 13 9505 1 1 20 CYS CA C -2.630 -4.928 4.533 1.00 . A A . 20 CYS CA 1 1 13 9506 1 1 20 CYS CB C -1.437 -5.674 3.935 1.00 . A A . 20 CYS CB 1 1 13 9507 1 1 20 CYS H H -1.439 -3.135 4.574 1.00 . A A . 20 CYS H 1 1 13 9508 1 1 20 CYS HA H -3.516 -5.145 3.955 1.00 . A A . 20 CYS HA 1 1 13 9509 1 1 20 CYS HB2 H -0.520 -5.245 4.311 1.00 . A A . 20 CYS HB2 1 1 13 9510 1 1 20 CYS HB3 H -1.487 -6.716 4.215 1.00 . A A . 20 CYS HB3 1 1 13 9511 1 1 20 CYS N N -2.359 -3.463 4.501 1.00 . A A . 20 CYS N 1 1 13 9512 1 1 20 CYS O O -2.188 -6.297 6.449 1.00 . A A . 20 CYS O 1 1 13 9513 1 1 20 CYS SG S -1.473 -5.531 2.131 1.00 . A A . 20 CYS SG 1 1 13 9514 1 1 21 ASN C C -4.982 -6.303 8.146 1.00 . A A . 21 ASN C 1 1 13 9515 1 1 21 ASN CA C -3.968 -5.158 8.107 1.00 . A A . 21 ASN CA 1 1 13 9516 1 1 21 ASN CB C -4.514 -3.967 8.895 1.00 . A A . 21 ASN CB 1 1 13 9517 1 1 21 ASN CG C -4.943 -4.434 10.288 1.00 . A A . 21 ASN CG 1 1 13 9518 1 1 21 ASN H H -4.242 -4.018 6.299 1.00 . A A . 21 ASN H 1 1 13 9519 1 1 21 ASN HA H -3.039 -5.486 8.549 1.00 . A A . 21 ASN HA 1 1 13 9520 1 1 21 ASN HB2 H -3.745 -3.214 8.987 1.00 . A A . 21 ASN HB2 1 1 13 9521 1 1 21 ASN HB3 H -5.366 -3.553 8.378 1.00 . A A . 21 ASN HB3 1 1 13 9522 1 1 21 ASN HD21 H -6.008 -2.801 10.664 1.00 . A A . 21 ASN HD21 1 1 13 9523 1 1 21 ASN HD22 H -5.990 -3.958 11.906 1.00 . A A . 21 ASN HD22 1 1 13 9524 1 1 21 ASN N N -3.729 -4.754 6.692 1.00 . A A . 21 ASN N 1 1 13 9525 1 1 21 ASN ND2 N -5.710 -3.667 11.013 1.00 . A A . 21 ASN ND2 1 1 13 9526 1 1 21 ASN O O -5.914 -6.269 7.359 1.00 . A A . 21 ASN O 1 1 13 9527 1 1 21 ASN OXT O -4.809 -7.193 8.962 1.00 . A A . 21 ASN OXT 1 1 13 9528 1 1 21 ASN OD1 O -4.575 -5.508 10.721 1.00 . A A . 21 ASN OD1 1 1 13 9529 2 2 1 PHE C C 11.349 0.115 0.309 1.00 . B B . 22 PHE C 1 1 13 9530 2 2 1 PHE CA C 12.235 -1.131 0.376 1.00 . B B . 22 PHE CA 1 1 13 9531 2 2 1 PHE CB C 11.387 -2.384 0.111 1.00 . B B . 22 PHE CB 1 1 13 9532 2 2 1 PHE CD1 C 9.958 -2.446 2.191 1.00 . B B . 22 PHE CD1 1 1 13 9533 2 2 1 PHE CD2 C 11.618 -4.186 1.863 1.00 . B B . 22 PHE CD2 1 1 13 9534 2 2 1 PHE CE1 C 9.580 -3.037 3.405 1.00 . B B . 22 PHE CE1 1 1 13 9535 2 2 1 PHE CE2 C 11.240 -4.776 3.076 1.00 . B B . 22 PHE CE2 1 1 13 9536 2 2 1 PHE CG C 10.977 -3.021 1.420 1.00 . B B . 22 PHE CG 1 1 13 9537 2 2 1 PHE CZ C 10.220 -4.202 3.847 1.00 . B B . 22 PHE CZ 1 1 13 9538 2 2 1 PHE H1 H 13.644 -0.533 1.788 1.00 . B B . 22 PHE H1 1 1 13 9539 2 2 1 PHE H2 H 13.228 -2.178 1.878 1.00 . B B . 22 PHE H2 1 1 13 9540 2 2 1 PHE H3 H 12.153 -0.994 2.453 1.00 . B B . 22 PHE H3 1 1 13 9541 2 2 1 PHE HA H 13.009 -1.058 -0.374 1.00 . B B . 22 PHE HA 1 1 13 9542 2 2 1 PHE HB2 H 10.502 -2.107 -0.445 1.00 . B B . 22 PHE HB2 1 1 13 9543 2 2 1 PHE HB3 H 11.964 -3.091 -0.465 1.00 . B B . 22 PHE HB3 1 1 13 9544 2 2 1 PHE HD1 H 9.464 -1.548 1.851 1.00 . B B . 22 PHE HD1 1 1 13 9545 2 2 1 PHE HD2 H 12.404 -4.630 1.269 1.00 . B B . 22 PHE HD2 1 1 13 9546 2 2 1 PHE HE1 H 8.794 -2.594 3.998 1.00 . B B . 22 PHE HE1 1 1 13 9547 2 2 1 PHE HE2 H 11.734 -5.674 3.417 1.00 . B B . 22 PHE HE2 1 1 13 9548 2 2 1 PHE HZ H 9.929 -4.657 4.782 1.00 . B B . 22 PHE HZ 1 1 13 9549 2 2 1 PHE N N 12.863 -1.216 1.726 1.00 . B B . 22 PHE N 1 1 13 9550 2 2 1 PHE O O 10.424 0.192 -0.476 1.00 . B B . 22 PHE O 1 1 13 9551 2 2 2 VAL C C 11.373 3.310 0.089 1.00 . B B . 23 VAL C 1 1 13 9552 2 2 2 VAL CA C 10.812 2.338 1.110 1.00 . B B . 23 VAL CA 1 1 13 9553 2 2 2 VAL CB C 10.847 3.007 2.486 1.00 . B B . 23 VAL CB 1 1 13 9554 2 2 2 VAL CG1 C 10.278 2.058 3.516 1.00 . B B . 23 VAL CG1 1 1 13 9555 2 2 2 VAL CG2 C 12.289 3.362 2.855 1.00 . B B . 23 VAL CG2 1 1 13 9556 2 2 2 VAL H H 12.383 1.008 1.747 1.00 . B B . 23 VAL H 1 1 13 9557 2 2 2 VAL HA H 9.791 2.101 0.855 1.00 . B B . 23 VAL HA 1 1 13 9558 2 2 2 VAL HB H 10.247 3.903 2.470 1.00 . B B . 23 VAL HB 1 1 13 9559 2 2 2 VAL HG11 H 11.028 1.845 4.257 1.00 . B B . 23 VAL HG11 1 1 13 9560 2 2 2 VAL HG12 H 9.974 1.147 3.026 1.00 . B B . 23 VAL HG12 1 1 13 9561 2 2 2 VAL HG13 H 9.424 2.519 3.985 1.00 . B B . 23 VAL HG13 1 1 13 9562 2 2 2 VAL HG21 H 12.532 4.338 2.460 1.00 . B B . 23 VAL HG21 1 1 13 9563 2 2 2 VAL HG22 H 12.959 2.627 2.437 1.00 . B B . 23 VAL HG22 1 1 13 9564 2 2 2 VAL HG23 H 12.392 3.373 3.930 1.00 . B B . 23 VAL HG23 1 1 13 9565 2 2 2 VAL N N 11.631 1.093 1.125 1.00 . B B . 23 VAL N 1 1 13 9566 2 2 2 VAL O O 12.085 2.945 -0.826 1.00 . B B . 23 VAL O 1 1 13 9567 2 2 3 ASN C C 11.026 5.316 -2.089 1.00 . B B . 24 ASN C 1 1 13 9568 2 2 3 ASN CA C 11.546 5.598 -0.679 1.00 . B B . 24 ASN CA 1 1 13 9569 2 2 3 ASN CB C 13.074 5.590 -0.689 1.00 . B B . 24 ASN CB 1 1 13 9570 2 2 3 ASN CG C 13.585 6.870 -1.352 1.00 . B B . 24 ASN CG 1 1 13 9571 2 2 3 ASN H H 10.475 4.794 1.016 1.00 . B B . 24 ASN H 1 1 13 9572 2 2 3 ASN HA H 11.195 6.566 -0.355 1.00 . B B . 24 ASN HA 1 1 13 9573 2 2 3 ASN HB2 H 13.438 5.539 0.327 1.00 . B B . 24 ASN HB2 1 1 13 9574 2 2 3 ASN HB3 H 13.426 4.734 -1.243 1.00 . B B . 24 ASN HB3 1 1 13 9575 2 2 3 ASN HD21 H 15.329 6.075 -1.869 1.00 . B B . 24 ASN HD21 1 1 13 9576 2 2 3 ASN HD22 H 15.109 7.696 -2.319 1.00 . B B . 24 ASN HD22 1 1 13 9577 2 2 3 ASN N N 11.050 4.551 0.258 1.00 . B B . 24 ASN N 1 1 13 9578 2 2 3 ASN ND2 N 14.773 6.881 -1.892 1.00 . B B . 24 ASN ND2 1 1 13 9579 2 2 3 ASN O O 11.783 5.040 -2.999 1.00 . B B . 24 ASN O 1 1 13 9580 2 2 3 ASN OD1 O 12.896 7.871 -1.381 1.00 . B B . 24 ASN OD1 1 1 13 9581 2 2 4 GLN C C 7.921 5.997 -3.818 1.00 . B B . 25 GLN C 1 1 13 9582 2 2 4 GLN CA C 9.167 5.130 -3.626 1.00 . B B . 25 GLN CA 1 1 13 9583 2 2 4 GLN CB C 8.788 3.651 -3.746 1.00 . B B . 25 GLN CB 1 1 13 9584 2 2 4 GLN CD C 9.028 3.487 -6.228 1.00 . B B . 25 GLN CD 1 1 13 9585 2 2 4 GLN CG C 9.583 3.010 -4.886 1.00 . B B . 25 GLN CG 1 1 13 9586 2 2 4 GLN H H 9.151 5.615 -1.529 1.00 . B B . 25 GLN H 1 1 13 9587 2 2 4 GLN HA H 9.898 5.378 -4.381 1.00 . B B . 25 GLN HA 1 1 13 9588 2 2 4 GLN HB2 H 9.014 3.145 -2.819 1.00 . B B . 25 GLN HB2 1 1 13 9589 2 2 4 GLN HB3 H 7.732 3.566 -3.955 1.00 . B B . 25 GLN HB3 1 1 13 9590 2 2 4 GLN HE21 H 10.377 4.928 -6.431 1.00 . B B . 25 GLN HE21 1 1 13 9591 2 2 4 GLN HE22 H 9.253 4.804 -7.697 1.00 . B B . 25 GLN HE22 1 1 13 9592 2 2 4 GLN HG2 H 10.622 3.296 -4.803 1.00 . B B . 25 GLN HG2 1 1 13 9593 2 2 4 GLN HG3 H 9.498 1.935 -4.825 1.00 . B B . 25 GLN HG3 1 1 13 9594 2 2 4 GLN N N 9.741 5.388 -2.276 1.00 . B B . 25 GLN N 1 1 13 9595 2 2 4 GLN NE2 N 9.600 4.489 -6.836 1.00 . B B . 25 GLN NE2 1 1 13 9596 2 2 4 GLN O O 7.566 6.786 -2.966 1.00 . B B . 25 GLN O 1 1 13 9597 2 2 4 GLN OE1 O 8.063 2.944 -6.727 1.00 . B B . 25 GLN OE1 1 1 13 9598 2 2 5 HIS C C 4.972 5.761 -5.805 1.00 . B B . 26 HIS C 1 1 13 9599 2 2 5 HIS CA C 6.031 6.673 -5.177 1.00 . B B . 26 HIS CA 1 1 13 9600 2 2 5 HIS CB C 6.366 7.795 -6.159 1.00 . B B . 26 HIS CB 1 1 13 9601 2 2 5 HIS CD2 C 5.002 10.015 -6.348 1.00 . B B . 26 HIS CD2 1 1 13 9602 2 2 5 HIS CE1 C 5.374 10.754 -4.339 1.00 . B B . 26 HIS CE1 1 1 13 9603 2 2 5 HIS CG C 5.769 9.092 -5.693 1.00 . B B . 26 HIS CG 1 1 13 9604 2 2 5 HIS H H 7.558 5.215 -5.606 1.00 . B B . 26 HIS H 1 1 13 9605 2 2 5 HIS HA H 5.666 7.088 -4.248 1.00 . B B . 26 HIS HA 1 1 13 9606 2 2 5 HIS HB2 H 7.437 7.898 -6.241 1.00 . B B . 26 HIS HB2 1 1 13 9607 2 2 5 HIS HB3 H 5.951 7.547 -7.123 1.00 . B B . 26 HIS HB3 1 1 13 9608 2 2 5 HIS HD2 H 4.652 9.934 -7.367 1.00 . B B . 26 HIS HD2 1 1 13 9609 2 2 5 HIS HE1 H 5.378 11.382 -3.460 1.00 . B B . 26 HIS HE1 1 1 13 9610 2 2 5 HIS HE2 H 4.231 11.876 -5.687 1.00 . B B . 26 HIS HE2 1 1 13 9611 2 2 5 HIS N N 7.254 5.857 -4.931 1.00 . B B . 26 HIS N 1 1 13 9612 2 2 5 HIS ND1 N 5.996 9.570 -4.421 1.00 . B B . 26 HIS ND1 1 1 13 9613 2 2 5 HIS NE2 N 4.751 11.068 -5.495 1.00 . B B . 26 HIS NE2 1 1 13 9614 2 2 5 HIS O O 5.266 4.653 -6.205 1.00 . B B . 26 HIS O 1 1 13 9615 2 2 6 LEU C C 1.505 6.190 -6.969 1.00 . B B . 27 LEU C 1 1 13 9616 2 2 6 LEU CA C 2.707 5.330 -6.525 1.00 . B B . 27 LEU CA 1 1 13 9617 2 2 6 LEU CB C 2.304 4.238 -5.517 1.00 . B B . 27 LEU CB 1 1 13 9618 2 2 6 LEU CD1 C 1.509 5.831 -3.761 1.00 . B B . 27 LEU CD1 1 1 13 9619 2 2 6 LEU CD2 C 2.341 3.565 -3.120 1.00 . B B . 27 LEU CD2 1 1 13 9620 2 2 6 LEU CG C 2.522 4.735 -4.088 1.00 . B B . 27 LEU CG 1 1 13 9621 2 2 6 LEU H H 3.518 7.101 -5.588 1.00 . B B . 27 LEU H 1 1 13 9622 2 2 6 LEU HA H 3.130 4.858 -7.400 1.00 . B B . 27 LEU HA 1 1 13 9623 2 2 6 LEU HB2 H 1.275 3.965 -5.650 1.00 . B B . 27 LEU HB2 1 1 13 9624 2 2 6 LEU HB3 H 2.921 3.368 -5.680 1.00 . B B . 27 LEU HB3 1 1 13 9625 2 2 6 LEU HD11 H 1.102 5.661 -2.774 1.00 . B B . 27 LEU HD11 1 1 13 9626 2 2 6 LEU HD12 H 0.710 5.810 -4.487 1.00 . B B . 27 LEU HD12 1 1 13 9627 2 2 6 LEU HD13 H 1.996 6.793 -3.789 1.00 . B B . 27 LEU HD13 1 1 13 9628 2 2 6 LEU HD21 H 3.242 2.970 -3.103 1.00 . B B . 27 LEU HD21 1 1 13 9629 2 2 6 LEU HD22 H 1.513 2.954 -3.446 1.00 . B B . 27 LEU HD22 1 1 13 9630 2 2 6 LEU HD23 H 2.141 3.945 -2.129 1.00 . B B . 27 LEU HD23 1 1 13 9631 2 2 6 LEU HG H 3.522 5.131 -3.993 1.00 . B B . 27 LEU HG 1 1 13 9632 2 2 6 LEU N N 3.749 6.204 -5.908 1.00 . B B . 27 LEU N 1 1 13 9633 2 2 6 LEU O O 1.700 7.240 -7.529 1.00 . B B . 27 LEU O 1 1 13 9634 2 2 7 CYS C C -1.960 5.462 -7.735 1.00 . B B . 28 CYS C 1 1 13 9635 2 2 7 CYS CA C -0.971 6.466 -7.143 1.00 . B B . 28 CYS CA 1 1 13 9636 2 2 7 CYS CB C -0.734 7.569 -8.193 1.00 . B B . 28 CYS CB 1 1 13 9637 2 2 7 CYS H H 0.183 4.871 -6.302 1.00 . B B . 28 CYS H 1 1 13 9638 2 2 7 CYS HA H -1.414 6.906 -6.259 1.00 . B B . 28 CYS HA 1 1 13 9639 2 2 7 CYS HB2 H 0.221 7.437 -8.663 1.00 . B B . 28 CYS HB2 1 1 13 9640 2 2 7 CYS HB3 H -1.504 7.497 -8.949 1.00 . B B . 28 CYS HB3 1 1 13 9641 2 2 7 CYS N N 0.285 5.732 -6.739 1.00 . B B . 28 CYS N 1 1 13 9642 2 2 7 CYS O O -1.600 4.635 -8.550 1.00 . B B . 28 CYS O 1 1 13 9643 2 2 7 CYS SG S -0.823 9.213 -7.418 1.00 . B B . 28 CYS SG 1 1 13 9644 2 2 8 GLY C C -3.649 3.235 -8.156 1.00 . B B . 29 GLY C 1 1 13 9645 2 2 8 GLY CA C -4.246 4.613 -7.864 1.00 . B B . 29 GLY CA 1 1 13 9646 2 2 8 GLY H H -3.455 6.229 -6.681 1.00 . B B . 29 GLY H 1 1 13 9647 2 2 8 GLY HA2 H -5.037 4.512 -7.134 1.00 . B B . 29 GLY HA2 1 1 13 9648 2 2 8 GLY HA3 H -4.655 5.022 -8.776 1.00 . B B . 29 GLY HA3 1 1 13 9649 2 2 8 GLY N N -3.202 5.542 -7.333 1.00 . B B . 29 GLY N 1 1 13 9650 2 2 8 GLY O O -3.240 2.519 -7.263 1.00 . B B . 29 GLY O 1 1 13 9651 2 2 9 SER C C -1.698 1.320 -9.076 1.00 . B B . 30 SER C 1 1 13 9652 2 2 9 SER CA C -3.041 1.529 -9.774 1.00 . B B . 30 SER CA 1 1 13 9653 2 2 9 SER CB C -2.842 1.464 -11.289 1.00 . B B . 30 SER CB 1 1 13 9654 2 2 9 SER H H -3.943 3.455 -10.106 1.00 . B B . 30 SER H 1 1 13 9655 2 2 9 SER HA H -3.728 0.753 -9.470 1.00 . B B . 30 SER HA 1 1 13 9656 2 2 9 SER HB2 H -3.251 2.349 -11.745 1.00 . B B . 30 SER HB2 1 1 13 9657 2 2 9 SER HB3 H -1.784 1.405 -11.509 1.00 . B B . 30 SER HB3 1 1 13 9658 2 2 9 SER HG H -3.147 -0.456 -11.372 1.00 . B B . 30 SER HG 1 1 13 9659 2 2 9 SER N N -3.603 2.859 -9.406 1.00 . B B . 30 SER N 1 1 13 9660 2 2 9 SER O O -1.505 0.353 -8.365 1.00 . B B . 30 SER O 1 1 13 9661 2 2 9 SER OG O -3.511 0.320 -11.803 1.00 . B B . 30 SER OG 1 1 13 9662 2 2 10 ASP C C 0.350 1.640 -7.158 1.00 . B B . 31 ASP C 1 1 13 9663 2 2 10 ASP CA C 0.561 2.050 -8.615 1.00 . B B . 31 ASP CA 1 1 13 9664 2 2 10 ASP CB C 1.333 3.369 -8.667 1.00 . B B . 31 ASP CB 1 1 13 9665 2 2 10 ASP CG C 1.392 3.875 -10.109 1.00 . B B . 31 ASP CG 1 1 13 9666 2 2 10 ASP H H -0.936 2.985 -9.850 1.00 . B B . 31 ASP H 1 1 13 9667 2 2 10 ASP HA H 1.123 1.282 -9.126 1.00 . B B . 31 ASP HA 1 1 13 9668 2 2 10 ASP HB2 H 0.836 4.099 -8.049 1.00 . B B . 31 ASP HB2 1 1 13 9669 2 2 10 ASP HB3 H 2.337 3.213 -8.302 1.00 . B B . 31 ASP HB3 1 1 13 9670 2 2 10 ASP N N -0.765 2.213 -9.272 1.00 . B B . 31 ASP N 1 1 13 9671 2 2 10 ASP O O 1.121 0.889 -6.595 1.00 . B B . 31 ASP O 1 1 13 9672 2 2 10 ASP OD1 O 0.394 4.402 -10.572 1.00 . B B . 31 ASP OD1 1 1 13 9673 2 2 10 ASP OD2 O 2.434 3.727 -10.726 1.00 . B B . 31 ASP OD2 1 1 13 9674 2 2 11 LEU C C -1.265 0.249 -5.060 1.00 . B B . 32 LEU C 1 1 13 9675 2 2 11 LEU CA C -0.956 1.741 -5.126 1.00 . B B . 32 LEU CA 1 1 13 9676 2 2 11 LEU CB C -2.149 2.531 -4.586 1.00 . B B . 32 LEU CB 1 1 13 9677 2 2 11 LEU CD1 C -0.882 4.409 -3.554 1.00 . B B . 32 LEU CD1 1 1 13 9678 2 2 11 LEU CD2 C -3.032 3.668 -2.546 1.00 . B B . 32 LEU CD2 1 1 13 9679 2 2 11 LEU CG C -1.766 3.202 -3.266 1.00 . B B . 32 LEU CG 1 1 13 9680 2 2 11 LEU H H -1.315 2.718 -7.014 1.00 . B B . 32 LEU H 1 1 13 9681 2 2 11 LEU HA H -0.079 1.951 -4.532 1.00 . B B . 32 LEU HA 1 1 13 9682 2 2 11 LEU HB2 H -2.435 3.287 -5.305 1.00 . B B . 32 LEU HB2 1 1 13 9683 2 2 11 LEU HB3 H -2.979 1.861 -4.420 1.00 . B B . 32 LEU HB3 1 1 13 9684 2 2 11 LEU HD11 H -0.004 4.089 -4.094 1.00 . B B . 32 LEU HD11 1 1 13 9685 2 2 11 LEU HD12 H -0.586 4.869 -2.624 1.00 . B B . 32 LEU HD12 1 1 13 9686 2 2 11 LEU HD13 H -1.431 5.123 -4.151 1.00 . B B . 32 LEU HD13 1 1 13 9687 2 2 11 LEU HD21 H -2.833 4.599 -2.035 1.00 . B B . 32 LEU HD21 1 1 13 9688 2 2 11 LEU HD22 H -3.335 2.920 -1.829 1.00 . B B . 32 LEU HD22 1 1 13 9689 2 2 11 LEU HD23 H -3.822 3.816 -3.268 1.00 . B B . 32 LEU HD23 1 1 13 9690 2 2 11 LEU HG H -1.226 2.499 -2.641 1.00 . B B . 32 LEU HG 1 1 13 9691 2 2 11 LEU N N -0.698 2.119 -6.543 1.00 . B B . 32 LEU N 1 1 13 9692 2 2 11 LEU O O -0.463 -0.539 -4.600 1.00 . B B . 32 LEU O 1 1 13 9693 2 2 12 VAL C C -1.559 -2.378 -6.069 1.00 . B B . 33 VAL C 1 1 13 9694 2 2 12 VAL CA C -2.745 -1.605 -5.495 1.00 . B B . 33 VAL CA 1 1 13 9695 2 2 12 VAL CB C -3.997 -1.880 -6.332 1.00 . B B . 33 VAL CB 1 1 13 9696 2 2 12 VAL CG1 C -5.134 -0.969 -5.866 1.00 . B B . 33 VAL CG1 1 1 13 9697 2 2 12 VAL CG2 C -3.701 -1.610 -7.810 1.00 . B B . 33 VAL CG2 1 1 13 9698 2 2 12 VAL H H -3.051 0.488 -5.906 1.00 . B B . 33 VAL H 1 1 13 9699 2 2 12 VAL HA H -2.915 -1.913 -4.472 1.00 . B B . 33 VAL HA 1 1 13 9700 2 2 12 VAL HB H -4.292 -2.912 -6.206 1.00 . B B . 33 VAL HB 1 1 13 9701 2 2 12 VAL HG11 H -5.623 -0.535 -6.726 1.00 . B B . 33 VAL HG11 1 1 13 9702 2 2 12 VAL HG12 H -4.734 -0.184 -5.243 1.00 . B B . 33 VAL HG12 1 1 13 9703 2 2 12 VAL HG13 H -5.850 -1.548 -5.300 1.00 . B B . 33 VAL HG13 1 1 13 9704 2 2 12 VAL HG21 H -4.314 -0.791 -8.157 1.00 . B B . 33 VAL HG21 1 1 13 9705 2 2 12 VAL HG22 H -3.923 -2.494 -8.388 1.00 . B B . 33 VAL HG22 1 1 13 9706 2 2 12 VAL HG23 H -2.660 -1.354 -7.929 1.00 . B B . 33 VAL HG23 1 1 13 9707 2 2 12 VAL N N -2.415 -0.156 -5.528 1.00 . B B . 33 VAL N 1 1 13 9708 2 2 12 VAL O O -1.350 -3.536 -5.766 1.00 . B B . 33 VAL O 1 1 13 9709 2 2 13 GLU C C 1.501 -2.526 -6.412 1.00 . B B . 34 GLU C 1 1 13 9710 2 2 13 GLU CA C 0.410 -2.414 -7.477 1.00 . B B . 34 GLU CA 1 1 13 9711 2 2 13 GLU CB C 0.931 -1.595 -8.658 1.00 . B B . 34 GLU CB 1 1 13 9712 2 2 13 GLU CD C 1.260 -1.693 -11.133 1.00 . B B . 34 GLU CD 1 1 13 9713 2 2 13 GLU CG C 0.413 -2.199 -9.964 1.00 . B B . 34 GLU CG 1 1 13 9714 2 2 13 GLU H H -0.955 -0.800 -7.113 1.00 . B B . 34 GLU H 1 1 13 9715 2 2 13 GLU HA H 0.131 -3.401 -7.815 1.00 . B B . 34 GLU HA 1 1 13 9716 2 2 13 GLU HB2 H 0.586 -0.576 -8.569 1.00 . B B . 34 GLU HB2 1 1 13 9717 2 2 13 GLU HB3 H 2.009 -1.611 -8.659 1.00 . B B . 34 GLU HB3 1 1 13 9718 2 2 13 GLU HG2 H 0.477 -3.277 -9.912 1.00 . B B . 34 GLU HG2 1 1 13 9719 2 2 13 GLU HG3 H -0.615 -1.906 -10.114 1.00 . B B . 34 GLU HG3 1 1 13 9720 2 2 13 GLU N N -0.771 -1.735 -6.889 1.00 . B B . 34 GLU N 1 1 13 9721 2 2 13 GLU O O 1.894 -3.609 -6.030 1.00 . B B . 34 GLU O 1 1 13 9722 2 2 13 GLU OE1 O 0.961 -0.623 -11.636 1.00 . B B . 34 GLU OE1 1 1 13 9723 2 2 13 GLU OE2 O 2.193 -2.386 -11.506 1.00 . B B . 34 GLU OE2 1 1 13 9724 2 2 14 ALA C C 2.501 -2.294 -3.693 1.00 . B B . 35 ALA C 1 1 13 9725 2 2 14 ALA CA C 3.042 -1.482 -4.867 1.00 . B B . 35 ALA CA 1 1 13 9726 2 2 14 ALA CB C 3.394 -0.068 -4.398 1.00 . B B . 35 ALA CB 1 1 13 9727 2 2 14 ALA H H 1.650 -0.546 -6.223 1.00 . B B . 35 ALA H 1 1 13 9728 2 2 14 ALA HA H 3.922 -1.963 -5.271 1.00 . B B . 35 ALA HA 1 1 13 9729 2 2 14 ALA HB1 H 2.509 0.412 -4.007 1.00 . B B . 35 ALA HB1 1 1 13 9730 2 2 14 ALA HB2 H 3.776 0.504 -5.230 1.00 . B B . 35 ALA HB2 1 1 13 9731 2 2 14 ALA HB3 H 4.146 -0.122 -3.623 1.00 . B B . 35 ALA HB3 1 1 13 9732 2 2 14 ALA N N 1.987 -1.416 -5.916 1.00 . B B . 35 ALA N 1 1 13 9733 2 2 14 ALA O O 3.167 -3.152 -3.149 1.00 . B B . 35 ALA O 1 1 13 9734 2 2 15 LEU C C 0.690 -4.284 -2.536 1.00 . B B . 36 LEU C 1 1 13 9735 2 2 15 LEU CA C 0.657 -2.793 -2.199 1.00 . B B . 36 LEU CA 1 1 13 9736 2 2 15 LEU CB C -0.804 -2.356 -2.071 1.00 . B B . 36 LEU CB 1 1 13 9737 2 2 15 LEU CD1 C -0.855 -1.672 0.314 1.00 . B B . 36 LEU CD1 1 1 13 9738 2 2 15 LEU CD2 C 0.229 -0.180 -1.369 1.00 . B B . 36 LEU CD2 1 1 13 9739 2 2 15 LEU CG C -0.918 -1.166 -1.121 1.00 . B B . 36 LEU CG 1 1 13 9740 2 2 15 LEU H H 0.763 -1.350 -3.787 1.00 . B B . 36 LEU H 1 1 13 9741 2 2 15 LEU HA H 1.185 -2.599 -1.273 1.00 . B B . 36 LEU HA 1 1 13 9742 2 2 15 LEU HB2 H -1.178 -2.075 -3.044 1.00 . B B . 36 LEU HB2 1 1 13 9743 2 2 15 LEU HB3 H -1.390 -3.177 -1.686 1.00 . B B . 36 LEU HB3 1 1 13 9744 2 2 15 LEU HD11 H -1.797 -1.474 0.802 1.00 . B B . 36 LEU HD11 1 1 13 9745 2 2 15 LEU HD12 H -0.061 -1.161 0.839 1.00 . B B . 36 LEU HD12 1 1 13 9746 2 2 15 LEU HD13 H -0.665 -2.734 0.313 1.00 . B B . 36 LEU HD13 1 1 13 9747 2 2 15 LEU HD21 H 1.172 -0.673 -1.191 1.00 . B B . 36 LEU HD21 1 1 13 9748 2 2 15 LEU HD22 H 0.131 0.662 -0.699 1.00 . B B . 36 LEU HD22 1 1 13 9749 2 2 15 LEU HD23 H 0.191 0.168 -2.391 1.00 . B B . 36 LEU HD23 1 1 13 9750 2 2 15 LEU HG H -1.864 -0.669 -1.283 1.00 . B B . 36 LEU HG 1 1 13 9751 2 2 15 LEU N N 1.281 -2.037 -3.317 1.00 . B B . 36 LEU N 1 1 13 9752 2 2 15 LEU O O 0.804 -5.136 -1.676 1.00 . B B . 36 LEU O 1 1 13 9753 2 2 16 TYR C C 1.989 -6.570 -4.258 1.00 . B B . 37 TYR C 1 1 13 9754 2 2 16 TYR CA C 0.563 -6.009 -4.252 1.00 . B B . 37 TYR CA 1 1 13 9755 2 2 16 TYR CB C -0.030 -6.062 -5.668 1.00 . B B . 37 TYR CB 1 1 13 9756 2 2 16 TYR CD1 C -0.081 -8.614 -6.054 1.00 . B B . 37 TYR CD1 1 1 13 9757 2 2 16 TYR CD2 C 1.421 -7.271 -7.419 1.00 . B B . 37 TYR CD2 1 1 13 9758 2 2 16 TYR CE1 C 0.358 -9.766 -6.721 1.00 . B B . 37 TYR CE1 1 1 13 9759 2 2 16 TYR CE2 C 1.850 -8.431 -8.075 1.00 . B B . 37 TYR CE2 1 1 13 9760 2 2 16 TYR CG C 0.445 -7.343 -6.397 1.00 . B B . 37 TYR CG 1 1 13 9761 2 2 16 TYR CZ C 1.320 -9.673 -7.728 1.00 . B B . 37 TYR CZ 1 1 13 9762 2 2 16 TYR H H 0.466 -3.870 -4.453 1.00 . B B . 37 TYR H 1 1 13 9763 2 2 16 TYR HA H -0.052 -6.597 -3.586 1.00 . B B . 37 TYR HA 1 1 13 9764 2 2 16 TYR HB2 H -1.116 -6.040 -5.594 1.00 . B B . 37 TYR HB2 1 1 13 9765 2 2 16 TYR HB3 H 0.292 -5.177 -6.214 1.00 . B B . 37 TYR HB3 1 1 13 9766 2 2 16 TYR HD1 H -0.816 -8.715 -5.281 1.00 . B B . 37 TYR HD1 1 1 13 9767 2 2 16 TYR HD2 H 1.851 -6.332 -7.700 1.00 . B B . 37 TYR HD2 1 1 13 9768 2 2 16 TYR HE1 H -0.048 -10.730 -6.452 1.00 . B B . 37 TYR HE1 1 1 13 9769 2 2 16 TYR HE2 H 2.594 -8.363 -8.855 1.00 . B B . 37 TYR HE2 1 1 13 9770 2 2 16 TYR HH H 2.489 -10.572 -8.942 1.00 . B B . 37 TYR HH 1 1 13 9771 2 2 16 TYR N N 0.569 -4.589 -3.797 1.00 . B B . 37 TYR N 1 1 13 9772 2 2 16 TYR O O 2.192 -7.768 -4.298 1.00 . B B . 37 TYR O 1 1 13 9773 2 2 16 TYR OH O 1.747 -10.812 -8.381 1.00 . B B . 37 TYR OH 1 1 13 9774 2 2 17 LEU C C 4.837 -6.425 -2.785 1.00 . B B . 38 LEU C 1 1 13 9775 2 2 17 LEU CA C 4.378 -6.229 -4.224 1.00 . B B . 38 LEU CA 1 1 13 9776 2 2 17 LEU CB C 5.322 -5.234 -4.914 1.00 . B B . 38 LEU CB 1 1 13 9777 2 2 17 LEU CD1 C 5.484 -3.257 -6.431 1.00 . B B . 38 LEU CD1 1 1 13 9778 2 2 17 LEU CD2 C 3.824 -5.058 -6.907 1.00 . B B . 38 LEU CD2 1 1 13 9779 2 2 17 LEU CG C 4.532 -4.276 -5.802 1.00 . B B . 38 LEU CG 1 1 13 9780 2 2 17 LEU H H 2.793 -4.763 -4.183 1.00 . B B . 38 LEU H 1 1 13 9781 2 2 17 LEU HA H 4.411 -7.172 -4.742 1.00 . B B . 38 LEU HA 1 1 13 9782 2 2 17 LEU HB2 H 5.852 -4.667 -4.163 1.00 . B B . 38 LEU HB2 1 1 13 9783 2 2 17 LEU HB3 H 6.032 -5.777 -5.519 1.00 . B B . 38 LEU HB3 1 1 13 9784 2 2 17 LEU HD11 H 5.758 -2.517 -5.693 1.00 . B B . 38 LEU HD11 1 1 13 9785 2 2 17 LEU HD12 H 4.995 -2.772 -7.262 1.00 . B B . 38 LEU HD12 1 1 13 9786 2 2 17 LEU HD13 H 6.372 -3.762 -6.781 1.00 . B B . 38 LEU HD13 1 1 13 9787 2 2 17 LEU HD21 H 3.204 -4.385 -7.481 1.00 . B B . 38 LEU HD21 1 1 13 9788 2 2 17 LEU HD22 H 3.208 -5.826 -6.465 1.00 . B B . 38 LEU HD22 1 1 13 9789 2 2 17 LEU HD23 H 4.559 -5.512 -7.553 1.00 . B B . 38 LEU HD23 1 1 13 9790 2 2 17 LEU HG H 3.804 -3.761 -5.203 1.00 . B B . 38 LEU HG 1 1 13 9791 2 2 17 LEU N N 2.975 -5.722 -4.219 1.00 . B B . 38 LEU N 1 1 13 9792 2 2 17 LEU O O 5.607 -7.314 -2.480 1.00 . B B . 38 LEU O 1 1 13 9793 2 2 18 VAL C C 3.818 -6.666 0.247 1.00 . B B . 39 VAL C 1 1 13 9794 2 2 18 VAL CA C 4.779 -5.719 -0.477 1.00 . B B . 39 VAL CA 1 1 13 9795 2 2 18 VAL CB C 4.758 -4.329 0.170 1.00 . B B . 39 VAL CB 1 1 13 9796 2 2 18 VAL CG1 C 5.255 -3.295 -0.842 1.00 . B B . 39 VAL CG1 1 1 13 9797 2 2 18 VAL CG2 C 3.337 -3.963 0.600 1.00 . B B . 39 VAL CG2 1 1 13 9798 2 2 18 VAL H H 3.755 -4.883 -2.170 1.00 . B B . 39 VAL H 1 1 13 9799 2 2 18 VAL HA H 5.780 -6.121 -0.427 1.00 . B B . 39 VAL HA 1 1 13 9800 2 2 18 VAL HB H 5.406 -4.327 1.028 1.00 . B B . 39 VAL HB 1 1 13 9801 2 2 18 VAL HG11 H 5.935 -2.613 -0.355 1.00 . B B . 39 VAL HG11 1 1 13 9802 2 2 18 VAL HG12 H 4.413 -2.744 -1.236 1.00 . B B . 39 VAL HG12 1 1 13 9803 2 2 18 VAL HG13 H 5.766 -3.797 -1.649 1.00 . B B . 39 VAL HG13 1 1 13 9804 2 2 18 VAL HG21 H 3.204 -2.894 0.524 1.00 . B B . 39 VAL HG21 1 1 13 9805 2 2 18 VAL HG22 H 3.180 -4.274 1.622 1.00 . B B . 39 VAL HG22 1 1 13 9806 2 2 18 VAL HG23 H 2.628 -4.461 -0.043 1.00 . B B . 39 VAL HG23 1 1 13 9807 2 2 18 VAL N N 4.372 -5.594 -1.898 1.00 . B B . 39 VAL N 1 1 13 9808 2 2 18 VAL O O 4.091 -7.133 1.336 1.00 . B B . 39 VAL O 1 1 13 9809 2 2 19 CYS C C 1.597 -9.152 -0.547 1.00 . B B . 40 CYS C 1 1 13 9810 2 2 19 CYS CA C 1.721 -7.877 0.290 1.00 . B B . 40 CYS CA 1 1 13 9811 2 2 19 CYS CB C 0.356 -7.190 0.384 1.00 . B B . 40 CYS CB 1 1 13 9812 2 2 19 CYS H H 2.498 -6.572 -1.233 1.00 . B B . 40 CYS H 1 1 13 9813 2 2 19 CYS HA H 2.065 -8.130 1.282 1.00 . B B . 40 CYS HA 1 1 13 9814 2 2 19 CYS HB2 H 0.080 -6.802 -0.585 1.00 . B B . 40 CYS HB2 1 1 13 9815 2 2 19 CYS HB3 H -0.383 -7.905 0.709 1.00 . B B . 40 CYS HB3 1 1 13 9816 2 2 19 CYS N N 2.697 -6.956 -0.355 1.00 . B B . 40 CYS N 1 1 13 9817 2 2 19 CYS O O 1.008 -10.127 -0.125 1.00 . B B . 40 CYS O 1 1 13 9818 2 2 19 CYS SG S 0.445 -5.830 1.573 1.00 . B B . 40 CYS SG 1 1 13 9819 2 2 20 GLY C C 0.629 -10.899 -2.594 1.00 . B B . 41 GLY C 1 1 13 9820 2 2 20 GLY CA C 2.064 -10.368 -2.592 1.00 . B B . 41 GLY CA 1 1 13 9821 2 2 20 GLY H H 2.622 -8.356 -2.054 1.00 . B B . 41 GLY H 1 1 13 9822 2 2 20 GLY HA2 H 2.356 -10.113 -3.601 1.00 . B B . 41 GLY HA2 1 1 13 9823 2 2 20 GLY HA3 H 2.725 -11.130 -2.207 1.00 . B B . 41 GLY HA3 1 1 13 9824 2 2 20 GLY N N 2.149 -9.154 -1.731 1.00 . B B . 41 GLY N 1 1 13 9825 2 2 20 GLY O O 0.353 -11.963 -2.078 1.00 . B B . 41 GLY O 1 1 13 9826 2 2 21 GLU C C -2.100 -11.301 -1.926 1.00 . B B . 42 GLU C 1 1 13 9827 2 2 21 GLU CA C -1.707 -10.601 -3.228 1.00 . B B . 42 GLU CA 1 1 13 9828 2 2 21 GLU CB C -1.912 -11.554 -4.409 1.00 . B B . 42 GLU CB 1 1 13 9829 2 2 21 GLU CD C -2.115 -14.030 -4.687 1.00 . B B . 42 GLU CD 1 1 13 9830 2 2 21 GLU CG C -1.240 -12.904 -4.133 1.00 . B B . 42 GLU CG 1 1 13 9831 2 2 21 GLU H H -0.022 -9.308 -3.583 1.00 . B B . 42 GLU H 1 1 13 9832 2 2 21 GLU HA H -2.337 -9.734 -3.363 1.00 . B B . 42 GLU HA 1 1 13 9833 2 2 21 GLU HB2 H -2.970 -11.707 -4.561 1.00 . B B . 42 GLU HB2 1 1 13 9834 2 2 21 GLU HB3 H -1.482 -11.117 -5.296 1.00 . B B . 42 GLU HB3 1 1 13 9835 2 2 21 GLU HG2 H -0.273 -12.929 -4.613 1.00 . B B . 42 GLU HG2 1 1 13 9836 2 2 21 GLU HG3 H -1.117 -13.041 -3.071 1.00 . B B . 42 GLU HG3 1 1 13 9837 2 2 21 GLU N N -0.280 -10.161 -3.175 1.00 . B B . 42 GLU N 1 1 13 9838 2 2 21 GLU O O -2.826 -12.276 -1.929 1.00 . B B . 42 GLU O 1 1 13 9839 2 2 21 GLU OE1 O -3.059 -13.725 -5.399 1.00 . B B . 42 GLU OE1 1 1 13 9840 2 2 21 GLU OE2 O -1.829 -15.178 -4.389 1.00 . B B . 42 GLU OE2 1 1 13 9841 2 2 22 ARG C C -3.497 -11.301 0.712 1.00 . B B . 43 ARG C 1 1 13 9842 2 2 22 ARG CA C -1.992 -11.451 0.482 1.00 . B B . 43 ARG CA 1 1 13 9843 2 2 22 ARG CB C -1.231 -10.772 1.623 1.00 . B B . 43 ARG CB 1 1 13 9844 2 2 22 ARG CD C -0.338 -11.695 3.770 1.00 . B B . 43 ARG CD 1 1 13 9845 2 2 22 ARG CG C -1.604 -11.436 2.950 1.00 . B B . 43 ARG CG 1 1 13 9846 2 2 22 ARG CZ C -0.963 -13.191 5.572 1.00 . B B . 43 ARG CZ 1 1 13 9847 2 2 22 ARG H H -1.055 -10.024 -0.833 1.00 . B B . 43 ARG H 1 1 13 9848 2 2 22 ARG HA H -1.736 -12.500 0.450 1.00 . B B . 43 ARG HA 1 1 13 9849 2 2 22 ARG HB2 H -0.168 -10.872 1.455 1.00 . B B . 43 ARG HB2 1 1 13 9850 2 2 22 ARG HB3 H -1.494 -9.726 1.659 1.00 . B B . 43 ARG HB3 1 1 13 9851 2 2 22 ARG HD2 H 0.186 -12.547 3.364 1.00 . B B . 43 ARG HD2 1 1 13 9852 2 2 22 ARG HD3 H 0.302 -10.825 3.728 1.00 . B B . 43 ARG HD3 1 1 13 9853 2 2 22 ARG HE H -0.767 -11.232 5.830 1.00 . B B . 43 ARG HE 1 1 13 9854 2 2 22 ARG HG2 H -2.266 -10.786 3.503 1.00 . B B . 43 ARG HG2 1 1 13 9855 2 2 22 ARG HG3 H -2.101 -12.374 2.756 1.00 . B B . 43 ARG HG3 1 1 13 9856 2 2 22 ARG HH11 H -1.220 -13.887 3.712 1.00 . B B . 43 ARG HH11 1 1 13 9857 2 2 22 ARG HH12 H -1.411 -15.051 4.981 1.00 . B B . 43 ARG HH12 1 1 13 9858 2 2 22 ARG HH21 H -0.769 -12.781 7.522 1.00 . B B . 43 ARG HH21 1 1 13 9859 2 2 22 ARG HH22 H -1.156 -14.424 7.137 1.00 . B B . 43 ARG HH22 1 1 13 9860 2 2 22 ARG N N -1.634 -10.812 -0.815 1.00 . B B . 43 ARG N 1 1 13 9861 2 2 22 ARG NE N -0.711 -11.969 5.187 1.00 . B B . 43 ARG NE 1 1 13 9862 2 2 22 ARG NH1 N -1.219 -14.115 4.686 1.00 . B B . 43 ARG NH1 1 1 13 9863 2 2 22 ARG NH2 N -0.963 -13.488 6.843 1.00 . B B . 43 ARG NH2 1 1 13 9864 2 2 22 ARG O O -4.102 -10.331 0.301 1.00 . B B . 43 ARG O 1 1 13 9865 2 2 23 GLY C C -6.323 -12.544 0.323 1.00 . B B . 44 GLY C 1 1 13 9866 2 2 23 GLY CA C -5.576 -12.160 1.601 1.00 . B B . 44 GLY CA 1 1 13 9867 2 2 23 GLY H H -3.606 -13.032 1.679 1.00 . B B . 44 GLY H 1 1 13 9868 2 2 23 GLY HA2 H -5.852 -12.833 2.401 1.00 . B B . 44 GLY HA2 1 1 13 9869 2 2 23 GLY HA3 H -5.832 -11.148 1.874 1.00 . B B . 44 GLY HA3 1 1 13 9870 2 2 23 GLY N N -4.109 -12.254 1.358 1.00 . B B . 44 GLY N 1 1 13 9871 2 2 23 GLY O O -5.779 -12.495 -0.762 1.00 . B B . 44 GLY O 1 1 13 9872 2 2 24 GLY C C -8.957 -12.074 -1.415 1.00 . B B . 45 GLY C 1 1 13 9873 2 2 24 GLY CA C -8.337 -13.318 -0.775 1.00 . B B . 45 GLY CA 1 1 13 9874 2 2 24 GLY H H -7.986 -12.965 1.322 1.00 . B B . 45 GLY H 1 1 13 9875 2 2 24 GLY HA2 H -7.676 -13.796 -1.484 1.00 . B B . 45 GLY HA2 1 1 13 9876 2 2 24 GLY HA3 H -9.123 -14.004 -0.497 1.00 . B B . 45 GLY HA3 1 1 13 9877 2 2 24 GLY N N -7.564 -12.929 0.438 1.00 . B B . 45 GLY N 1 1 13 9878 2 2 24 GLY O O -9.610 -12.152 -2.437 1.00 . B B . 45 GLY O 1 1 13 9879 2 2 25 PHE C C -8.241 -8.630 -1.558 1.00 . B B . 46 PHE C 1 1 13 9880 2 2 25 PHE CA C -9.343 -9.684 -1.404 1.00 . B B . 46 PHE CA 1 1 13 9881 2 2 25 PHE CB C -10.445 -9.161 -0.476 1.00 . B B . 46 PHE CB 1 1 13 9882 2 2 25 PHE CD1 C -11.818 -8.689 -2.646 1.00 . B B . 46 PHE CD1 1 1 13 9883 2 2 25 PHE CD2 C -12.079 -7.165 -0.761 1.00 . B B . 46 PHE CD2 1 1 13 9884 2 2 25 PHE CE1 C -12.737 -7.923 -3.376 1.00 . B B . 46 PHE CE1 1 1 13 9885 2 2 25 PHE CE2 C -12.994 -6.415 -1.511 1.00 . B B . 46 PHE CE2 1 1 13 9886 2 2 25 PHE CG C -11.469 -8.323 -1.309 1.00 . B B . 46 PHE CG 1 1 13 9887 2 2 25 PHE CZ C -13.322 -6.793 -2.811 1.00 . B B . 46 PHE CZ 1 1 13 9888 2 2 25 PHE H H -8.232 -10.883 -0.001 1.00 . B B . 46 PHE H 1 1 13 9889 2 2 25 PHE HA H -9.763 -9.906 -2.373 1.00 . B B . 46 PHE HA 1 1 13 9890 2 2 25 PHE HB2 H -10.934 -10.025 0.004 1.00 . B B . 46 PHE HB2 1 1 13 9891 2 2 25 PHE HB3 H -9.981 -8.543 0.305 1.00 . B B . 46 PHE HB3 1 1 13 9892 2 2 25 PHE HD1 H -11.390 -9.550 -3.120 1.00 . B B . 46 PHE HD1 1 1 13 9893 2 2 25 PHE HD2 H -11.850 -6.843 0.226 1.00 . B B . 46 PHE HD2 1 1 13 9894 2 2 25 PHE HE1 H -12.992 -8.210 -4.386 1.00 . B B . 46 PHE HE1 1 1 13 9895 2 2 25 PHE HE2 H -13.451 -5.538 -1.077 1.00 . B B . 46 PHE HE2 1 1 13 9896 2 2 25 PHE HZ H -14.028 -6.208 -3.381 1.00 . B B . 46 PHE HZ 1 1 13 9897 2 2 25 PHE N N -8.761 -10.927 -0.825 1.00 . B B . 46 PHE N 1 1 13 9898 2 2 25 PHE O O -7.111 -8.946 -1.869 1.00 . B B . 46 PHE O 1 1 13 9899 2 2 26 TYR C C -7.293 -5.653 -0.124 1.00 . B B . 47 TYR C 1 1 13 9900 2 2 26 TYR CA C -7.526 -6.314 -1.487 1.00 . B B . 47 TYR CA 1 1 13 9901 2 2 26 TYR CB C -8.014 -5.274 -2.508 1.00 . B B . 47 TYR CB 1 1 13 9902 2 2 26 TYR CD1 C -5.902 -3.755 -2.384 1.00 . B B . 47 TYR CD1 1 1 13 9903 2 2 26 TYR CD2 C -8.059 -2.765 -1.831 1.00 . B B . 47 TYR CD2 1 1 13 9904 2 2 26 TYR CE1 C -5.286 -2.522 -2.132 1.00 . B B . 47 TYR CE1 1 1 13 9905 2 2 26 TYR CE2 C -7.423 -1.543 -1.585 1.00 . B B . 47 TYR CE2 1 1 13 9906 2 2 26 TYR CG C -7.312 -3.902 -2.240 1.00 . B B . 47 TYR CG 1 1 13 9907 2 2 26 TYR CZ C -6.044 -1.421 -1.736 1.00 . B B . 47 TYR CZ 1 1 13 9908 2 2 26 TYR H H -9.475 -7.141 -1.099 1.00 . B B . 47 TYR H 1 1 13 9909 2 2 26 TYR HA H -6.603 -6.754 -1.834 1.00 . B B . 47 TYR HA 1 1 13 9910 2 2 26 TYR HB2 H -7.783 -5.646 -3.520 1.00 . B B . 47 TYR HB2 1 1 13 9911 2 2 26 TYR HB3 H -9.105 -5.176 -2.413 1.00 . B B . 47 TYR HB3 1 1 13 9912 2 2 26 TYR HD1 H -5.284 -4.579 -2.676 1.00 . B B . 47 TYR HD1 1 1 13 9913 2 2 26 TYR HD2 H -9.115 -2.822 -1.698 1.00 . B B . 47 TYR HD2 1 1 13 9914 2 2 26 TYR HE1 H -4.217 -2.423 -2.248 1.00 . B B . 47 TYR HE1 1 1 13 9915 2 2 26 TYR HE2 H -8.005 -0.688 -1.275 1.00 . B B . 47 TYR HE2 1 1 13 9916 2 2 26 TYR HH H -6.047 0.487 -1.715 1.00 . B B . 47 TYR HH 1 1 13 9917 2 2 26 TYR N N -8.558 -7.380 -1.347 1.00 . B B . 47 TYR N 1 1 13 9918 2 2 26 TYR O O -6.309 -4.971 0.086 1.00 . B B . 47 TYR O 1 1 13 9919 2 2 26 TYR OH O -5.428 -0.211 -1.491 1.00 . B B . 47 TYR OH 1 1 13 9920 2 2 27 THR C C -8.869 -5.987 3.162 1.00 . B B . 48 THR C 1 1 13 9921 2 2 27 THR CA C -8.019 -5.231 2.145 1.00 . B B . 48 THR CA 1 1 13 9922 2 2 27 THR CB C -8.460 -3.766 2.095 1.00 . B B . 48 THR CB 1 1 13 9923 2 2 27 THR CG2 C -8.237 -3.118 3.461 1.00 . B B . 48 THR CG2 1 1 13 9924 2 2 27 THR H H -8.975 -6.402 0.610 1.00 . B B . 48 THR H 1 1 13 9925 2 2 27 THR HA H -6.986 -5.286 2.434 1.00 . B B . 48 THR HA 1 1 13 9926 2 2 27 THR HB H -9.508 -3.714 1.843 1.00 . B B . 48 THR HB 1 1 13 9927 2 2 27 THR HG1 H -6.849 -3.515 1.032 1.00 . B B . 48 THR HG1 1 1 13 9928 2 2 27 THR HG21 H -8.195 -2.045 3.349 1.00 . B B . 48 THR HG21 1 1 13 9929 2 2 27 THR HG22 H -7.307 -3.473 3.880 1.00 . B B . 48 THR HG22 1 1 13 9930 2 2 27 THR HG23 H -9.051 -3.380 4.121 1.00 . B B . 48 THR HG23 1 1 13 9931 2 2 27 THR N N -8.190 -5.849 0.800 1.00 . B B . 48 THR N 1 1 13 9932 2 2 27 THR O O -8.462 -6.219 4.283 1.00 . B B . 48 THR O 1 1 13 9933 2 2 27 THR OG1 O -7.700 -3.077 1.111 1.00 . B B . 48 THR OG1 1 1 13 9934 2 2 28 LYS C C -11.223 -8.507 3.124 1.00 . B B . 49 LYS C 1 1 13 9935 2 2 28 LYS CA C -10.935 -7.120 3.706 1.00 . B B . 49 LYS CA 1 1 13 9936 2 2 28 LYS CB C -12.249 -6.355 3.880 1.00 . B B . 49 LYS CB 1 1 13 9937 2 2 28 LYS CD C -13.046 -4.344 5.133 1.00 . B B . 49 LYS CD 1 1 13 9938 2 2 28 LYS CE C -14.477 -4.581 5.616 1.00 . B B . 49 LYS CE 1 1 13 9939 2 2 28 LYS CG C -12.250 -5.646 5.236 1.00 . B B . 49 LYS CG 1 1 13 9940 2 2 28 LYS H H -10.344 -6.175 1.864 1.00 . B B . 49 LYS H 1 1 13 9941 2 2 28 LYS HA H -10.448 -7.224 4.664 1.00 . B B . 49 LYS HA 1 1 13 9942 2 2 28 LYS HB2 H -12.347 -5.624 3.090 1.00 . B B . 49 LYS HB2 1 1 13 9943 2 2 28 LYS HB3 H -13.077 -7.047 3.837 1.00 . B B . 49 LYS HB3 1 1 13 9944 2 2 28 LYS HD2 H -12.579 -3.587 5.746 1.00 . B B . 49 LYS HD2 1 1 13 9945 2 2 28 LYS HD3 H -13.066 -4.014 4.105 1.00 . B B . 49 LYS HD3 1 1 13 9946 2 2 28 LYS HE2 H -14.964 -5.294 4.966 1.00 . B B . 49 LYS HE2 1 1 13 9947 2 2 28 LYS HE3 H -14.457 -4.969 6.624 1.00 . B B . 49 LYS HE3 1 1 13 9948 2 2 28 LYS HG2 H -12.703 -6.288 5.977 1.00 . B B . 49 LYS HG2 1 1 13 9949 2 2 28 LYS HG3 H -11.234 -5.422 5.526 1.00 . B B . 49 LYS HG3 1 1 13 9950 2 2 28 LYS HZ1 H -16.244 -3.488 5.484 1.00 . B B . 49 LYS HZ1 1 1 13 9951 2 2 28 LYS HZ2 H -14.896 -2.713 4.798 1.00 . B B . 49 LYS HZ2 1 1 13 9952 2 2 28 LYS HZ3 H -15.070 -2.785 6.486 1.00 . B B . 49 LYS HZ3 1 1 13 9953 2 2 28 LYS N N -10.046 -6.374 2.774 1.00 . B B . 49 LYS N 1 1 13 9954 2 2 28 LYS NZ N -15.229 -3.295 5.594 1.00 . B B . 49 LYS NZ 1 1 13 9955 2 2 28 LYS O O -12.212 -8.700 2.445 1.00 . B B . 49 LYS O 1 1 13 9956 2 2 29 PRO C C -11.503 -11.584 3.738 1.00 . B B . 50 PRO C 1 1 13 9957 2 2 29 PRO CA C -10.458 -10.814 2.925 1.00 . B B . 50 PRO CA 1 1 13 9958 2 2 29 PRO CB C -9.058 -11.394 3.142 1.00 . B B . 50 PRO CB 1 1 13 9959 2 2 29 PRO CD C -9.146 -9.179 4.235 1.00 . B B . 50 PRO CD 1 1 13 9960 2 2 29 PRO CG C -8.392 -10.521 4.229 1.00 . B B . 50 PRO CG 1 1 13 9961 2 2 29 PRO HA H -10.702 -10.826 1.880 1.00 . B B . 50 PRO HA 1 1 13 9962 2 2 29 PRO HB2 H -9.131 -12.420 3.475 1.00 . B B . 50 PRO HB2 1 1 13 9963 2 2 29 PRO HB3 H -8.487 -11.337 2.229 1.00 . B B . 50 PRO HB3 1 1 13 9964 2 2 29 PRO HD2 H -9.432 -8.912 5.241 1.00 . B B . 50 PRO HD2 1 1 13 9965 2 2 29 PRO HD3 H -8.544 -8.405 3.788 1.00 . B B . 50 PRO HD3 1 1 13 9966 2 2 29 PRO HG2 H -8.478 -11.002 5.194 1.00 . B B . 50 PRO HG2 1 1 13 9967 2 2 29 PRO HG3 H -7.353 -10.354 3.988 1.00 . B B . 50 PRO HG3 1 1 13 9968 2 2 29 PRO N N -10.341 -9.431 3.407 1.00 . B B . 50 PRO N 1 1 13 9969 2 2 29 PRO O O -12.051 -11.081 4.699 1.00 . B B . 50 PRO O 1 1 13 9970 2 2 30 THR C C -12.216 -14.990 4.406 1.00 . B B . 51 THR C 1 1 13 9971 2 2 30 THR CA C -12.789 -13.603 4.108 1.00 . B B . 51 THR CA 1 1 13 9972 2 2 30 THR CB C -14.057 -13.745 3.264 1.00 . B B . 51 THR CB 1 1 13 9973 2 2 30 THR CG2 C -15.237 -13.114 4.005 1.00 . B B . 51 THR CG2 1 1 13 9974 2 2 30 THR H H -11.328 -13.188 2.581 1.00 . B B . 51 THR H 1 1 13 9975 2 2 30 THR HA H -13.027 -13.106 5.036 1.00 . B B . 51 THR HA 1 1 13 9976 2 2 30 THR HB H -14.263 -14.791 3.095 1.00 . B B . 51 THR HB 1 1 13 9977 2 2 30 THR HG1 H -13.918 -13.752 1.325 1.00 . B B . 51 THR HG1 1 1 13 9978 2 2 30 THR HG21 H -16.148 -13.626 3.733 1.00 . B B . 51 THR HG21 1 1 13 9979 2 2 30 THR HG22 H -15.315 -12.072 3.735 1.00 . B B . 51 THR HG22 1 1 13 9980 2 2 30 THR HG23 H -15.079 -13.200 5.070 1.00 . B B . 51 THR HG23 1 1 13 9981 2 2 30 THR N N -11.782 -12.801 3.359 1.00 . B B . 51 THR N 1 1 13 9982 2 2 30 THR O O -11.722 -15.182 5.505 1.00 . B B . 51 THR O 1 1 13 9983 2 2 30 THR OXT O -12.282 -15.837 3.530 1.00 . B B . 51 THR OXT 1 1 13 9984 2 2 30 THR OG1 O -13.872 -13.090 2.018 1.00 . B B . 51 THR OG1 1 1 14 9985 1 1 1 GLY C C -6.617 7.425 3.486 1.00 . A A . 1 GLY C 1 1 14 9986 1 1 1 GLY CA C -8.073 7.364 3.173 1.00 . A A . 1 GLY CA 1 1 14 9987 1 1 1 GLY H1 H -9.346 7.700 4.829 1.00 . A A . 1 GLY H1 1 1 14 9988 1 1 1 GLY H2 H -9.885 8.433 3.395 1.00 . A A . 1 GLY H2 1 1 14 9989 1 1 1 GLY H3 H -8.586 9.106 4.258 1.00 . A A . 1 GLY H3 1 1 14 9990 1 1 1 GLY HA2 H -8.005 6.463 3.538 1.00 . A A . 1 GLY HA2 1 1 14 9991 1 1 1 GLY HA3 H -8.440 7.381 2.065 1.00 . A A . 1 GLY HA3 1 1 14 9992 1 1 1 GLY N N -9.051 8.219 3.978 1.00 . A A . 1 GLY N 1 1 14 9993 1 1 1 GLY O O -6.155 8.318 4.169 1.00 . A A . 1 GLY O 1 1 14 9994 1 1 2 ILE C C -3.671 7.293 2.186 1.00 . A A . 2 ILE C 1 1 14 9995 1 1 2 ILE CA C -4.392 6.494 3.273 1.00 . A A . 2 ILE CA 1 1 14 9996 1 1 2 ILE CB C -3.859 5.065 3.266 1.00 . A A . 2 ILE CB 1 1 14 9997 1 1 2 ILE CD1 C -4.091 2.798 4.278 1.00 . A A . 2 ILE CD1 1 1 14 9998 1 1 2 ILE CG1 C -4.739 4.178 4.146 1.00 . A A . 2 ILE CG1 1 1 14 9999 1 1 2 ILE CG2 C -2.436 5.069 3.812 1.00 . A A . 2 ILE CG2 1 1 14 10000 1 1 2 ILE H H -6.246 5.775 2.447 1.00 . A A . 2 ILE H 1 1 14 10001 1 1 2 ILE HA H -4.207 6.940 4.238 1.00 . A A . 2 ILE HA 1 1 14 10002 1 1 2 ILE HB H -3.856 4.687 2.254 1.00 . A A . 2 ILE HB 1 1 14 10003 1 1 2 ILE HD11 H -3.490 2.598 3.403 1.00 . A A . 2 ILE HD11 1 1 14 10004 1 1 2 ILE HD12 H -4.859 2.045 4.366 1.00 . A A . 2 ILE HD12 1 1 14 10005 1 1 2 ILE HD13 H -3.464 2.777 5.158 1.00 . A A . 2 ILE HD13 1 1 14 10006 1 1 2 ILE HG12 H -4.840 4.626 5.123 1.00 . A A . 2 ILE HG12 1 1 14 10007 1 1 2 ILE HG13 H -5.714 4.074 3.693 1.00 . A A . 2 ILE HG13 1 1 14 10008 1 1 2 ILE HG21 H -2.391 5.703 4.685 1.00 . A A . 2 ILE HG21 1 1 14 10009 1 1 2 ILE HG22 H -1.763 5.448 3.057 1.00 . A A . 2 ILE HG22 1 1 14 10010 1 1 2 ILE HG23 H -2.149 4.065 4.080 1.00 . A A . 2 ILE HG23 1 1 14 10011 1 1 2 ILE N N -5.856 6.485 2.997 1.00 . A A . 2 ILE N 1 1 14 10012 1 1 2 ILE O O -2.700 7.973 2.439 1.00 . A A . 2 ILE O 1 1 14 10013 1 1 3 VAL C C -3.051 9.320 0.285 1.00 . A A . 3 VAL C 1 1 14 10014 1 1 3 VAL CA C -3.492 7.924 -0.159 1.00 . A A . 3 VAL CA 1 1 14 10015 1 1 3 VAL CB C -4.490 8.054 -1.318 1.00 . A A . 3 VAL CB 1 1 14 10016 1 1 3 VAL CG1 C -5.249 6.739 -1.488 1.00 . A A . 3 VAL CG1 1 1 14 10017 1 1 3 VAL CG2 C -5.493 9.174 -1.019 1.00 . A A . 3 VAL CG2 1 1 14 10018 1 1 3 VAL H H -4.914 6.621 0.806 1.00 . A A . 3 VAL H 1 1 14 10019 1 1 3 VAL HA H -2.632 7.371 -0.491 1.00 . A A . 3 VAL HA 1 1 14 10020 1 1 3 VAL HB H -3.955 8.281 -2.229 1.00 . A A . 3 VAL HB 1 1 14 10021 1 1 3 VAL HG11 H -5.498 6.600 -2.530 1.00 . A A . 3 VAL HG11 1 1 14 10022 1 1 3 VAL HG12 H -6.157 6.770 -0.903 1.00 . A A . 3 VAL HG12 1 1 14 10023 1 1 3 VAL HG13 H -4.631 5.920 -1.152 1.00 . A A . 3 VAL HG13 1 1 14 10024 1 1 3 VAL HG21 H -6.431 8.957 -1.507 1.00 . A A . 3 VAL HG21 1 1 14 10025 1 1 3 VAL HG22 H -5.104 10.112 -1.386 1.00 . A A . 3 VAL HG22 1 1 14 10026 1 1 3 VAL HG23 H -5.649 9.242 0.048 1.00 . A A . 3 VAL HG23 1 1 14 10027 1 1 3 VAL N N -4.138 7.193 0.974 1.00 . A A . 3 VAL N 1 1 14 10028 1 1 3 VAL O O -2.088 9.868 -0.213 1.00 . A A . 3 VAL O 1 1 14 10029 1 1 4 GLU C C -2.090 11.239 2.454 1.00 . A A . 4 GLU C 1 1 14 10030 1 1 4 GLU CA C -3.405 11.272 1.670 1.00 . A A . 4 GLU CA 1 1 14 10031 1 1 4 GLU CB C -4.523 11.796 2.570 1.00 . A A . 4 GLU CB 1 1 14 10032 1 1 4 GLU CD C -6.951 12.355 2.384 1.00 . A A . 4 GLU CD 1 1 14 10033 1 1 4 GLU CG C -5.875 11.329 2.024 1.00 . A A . 4 GLU CG 1 1 14 10034 1 1 4 GLU H H -4.539 9.443 1.576 1.00 . A A . 4 GLU H 1 1 14 10035 1 1 4 GLU HA H -3.297 11.925 0.818 1.00 . A A . 4 GLU HA 1 1 14 10036 1 1 4 GLU HB2 H -4.386 11.416 3.572 1.00 . A A . 4 GLU HB2 1 1 14 10037 1 1 4 GLU HB3 H -4.497 12.874 2.586 1.00 . A A . 4 GLU HB3 1 1 14 10038 1 1 4 GLU HG2 H -5.814 11.230 0.948 1.00 . A A . 4 GLU HG2 1 1 14 10039 1 1 4 GLU HG3 H -6.129 10.374 2.459 1.00 . A A . 4 GLU HG3 1 1 14 10040 1 1 4 GLU N N -3.761 9.903 1.203 1.00 . A A . 4 GLU N 1 1 14 10041 1 1 4 GLU O O -1.547 12.266 2.813 1.00 . A A . 4 GLU O 1 1 14 10042 1 1 4 GLU OE1 O -6.619 13.322 3.051 1.00 . A A . 4 GLU OE1 1 1 14 10043 1 1 4 GLU OE2 O -8.087 12.158 1.988 1.00 . A A . 4 GLU OE2 1 1 14 10044 1 1 5 GLN C C 0.854 9.605 2.566 1.00 . A A . 5 GLN C 1 1 14 10045 1 1 5 GLN CA C -0.301 9.989 3.497 1.00 . A A . 5 GLN CA 1 1 14 10046 1 1 5 GLN CB C -0.435 8.934 4.597 1.00 . A A . 5 GLN CB 1 1 14 10047 1 1 5 GLN CD C 0.682 9.332 6.798 1.00 . A A . 5 GLN CD 1 1 14 10048 1 1 5 GLN CG C -0.561 9.626 5.956 1.00 . A A . 5 GLN CG 1 1 14 10049 1 1 5 GLN H H -2.028 9.255 2.439 1.00 . A A . 5 GLN H 1 1 14 10050 1 1 5 GLN HA H -0.092 10.948 3.948 1.00 . A A . 5 GLN HA 1 1 14 10051 1 1 5 GLN HB2 H -1.314 8.334 4.413 1.00 . A A . 5 GLN HB2 1 1 14 10052 1 1 5 GLN HB3 H 0.440 8.302 4.597 1.00 . A A . 5 GLN HB3 1 1 14 10053 1 1 5 GLN HE21 H 1.772 10.753 5.941 1.00 . A A . 5 GLN HE21 1 1 14 10054 1 1 5 GLN HE22 H 2.564 9.861 7.149 1.00 . A A . 5 GLN HE22 1 1 14 10055 1 1 5 GLN HG2 H -0.653 10.692 5.809 1.00 . A A . 5 GLN HG2 1 1 14 10056 1 1 5 GLN HG3 H -1.436 9.256 6.469 1.00 . A A . 5 GLN HG3 1 1 14 10057 1 1 5 GLN N N -1.575 10.074 2.730 1.00 . A A . 5 GLN N 1 1 14 10058 1 1 5 GLN NE2 N 1.762 10.041 6.614 1.00 . A A . 5 GLN NE2 1 1 14 10059 1 1 5 GLN O O 1.972 10.045 2.745 1.00 . A A . 5 GLN O 1 1 14 10060 1 1 5 GLN OE1 O 0.670 8.450 7.633 1.00 . A A . 5 GLN OE1 1 1 14 10061 1 1 6 CYS C C 1.592 9.059 -0.681 1.00 . A A . 6 CYS C 1 1 14 10062 1 1 6 CYS CA C 1.714 8.364 0.678 1.00 . A A . 6 CYS CA 1 1 14 10063 1 1 6 CYS CB C 1.686 6.847 0.490 1.00 . A A . 6 CYS CB 1 1 14 10064 1 1 6 CYS H H -0.296 8.415 1.461 1.00 . A A . 6 CYS H 1 1 14 10065 1 1 6 CYS HA H 2.657 8.641 1.127 1.00 . A A . 6 CYS HA 1 1 14 10066 1 1 6 CYS HB2 H 0.689 6.532 0.220 1.00 . A A . 6 CYS HB2 1 1 14 10067 1 1 6 CYS HB3 H 2.377 6.570 -0.292 1.00 . A A . 6 CYS HB3 1 1 14 10068 1 1 6 CYS N N 0.607 8.775 1.588 1.00 . A A . 6 CYS N 1 1 14 10069 1 1 6 CYS O O 2.479 9.779 -1.083 1.00 . A A . 6 CYS O 1 1 14 10070 1 1 6 CYS SG S 2.178 6.049 2.038 1.00 . A A . 6 CYS SG 1 1 14 10071 1 1 7 CYS C C 0.897 10.933 -2.682 1.00 . A A . 7 CYS C 1 1 14 10072 1 1 7 CYS CA C 0.377 9.496 -2.742 1.00 . A A . 7 CYS CA 1 1 14 10073 1 1 7 CYS CB C -1.093 9.515 -3.169 1.00 . A A . 7 CYS CB 1 1 14 10074 1 1 7 CYS H H -0.186 8.250 -1.066 1.00 . A A . 7 CYS H 1 1 14 10075 1 1 7 CYS HA H 0.954 8.938 -3.471 1.00 . A A . 7 CYS HA 1 1 14 10076 1 1 7 CYS HB2 H -1.593 8.640 -2.783 1.00 . A A . 7 CYS HB2 1 1 14 10077 1 1 7 CYS HB3 H -1.570 10.404 -2.783 1.00 . A A . 7 CYS HB3 1 1 14 10078 1 1 7 CYS N N 0.518 8.845 -1.400 1.00 . A A . 7 CYS N 1 1 14 10079 1 1 7 CYS O O 1.820 11.291 -3.383 1.00 . A A . 7 CYS O 1 1 14 10080 1 1 7 CYS SG S -1.183 9.517 -4.980 1.00 . A A . 7 CYS SG 1 1 14 10081 1 1 8 THR C C 2.320 13.193 -1.765 1.00 . A A . 8 THR C 1 1 14 10082 1 1 8 THR CA C 0.790 13.172 -1.758 1.00 . A A . 8 THR CA 1 1 14 10083 1 1 8 THR CB C 0.279 13.798 -0.459 1.00 . A A . 8 THR CB 1 1 14 10084 1 1 8 THR CG2 C 0.582 12.864 0.713 1.00 . A A . 8 THR CG2 1 1 14 10085 1 1 8 THR H H -0.427 11.453 -1.294 1.00 . A A . 8 THR H 1 1 14 10086 1 1 8 THR HA H 0.418 13.735 -2.601 1.00 . A A . 8 THR HA 1 1 14 10087 1 1 8 THR HB H -0.787 13.950 -0.527 1.00 . A A . 8 THR HB 1 1 14 10088 1 1 8 THR HG1 H 0.380 15.568 0.343 1.00 . A A . 8 THR HG1 1 1 14 10089 1 1 8 THR HG21 H 1.214 12.057 0.375 1.00 . A A . 8 THR HG21 1 1 14 10090 1 1 8 THR HG22 H -0.342 12.461 1.099 1.00 . A A . 8 THR HG22 1 1 14 10091 1 1 8 THR HG23 H 1.087 13.416 1.492 1.00 . A A . 8 THR HG23 1 1 14 10092 1 1 8 THR N N 0.317 11.760 -1.853 1.00 . A A . 8 THR N 1 1 14 10093 1 1 8 THR O O 2.940 14.135 -2.218 1.00 . A A . 8 THR O 1 1 14 10094 1 1 8 THR OG1 O 0.924 15.047 -0.252 1.00 . A A . 8 THR OG1 1 1 14 10095 1 1 9 SER C C 4.862 10.650 -1.542 1.00 . A A . 9 SER C 1 1 14 10096 1 1 9 SER CA C 4.418 12.089 -1.248 1.00 . A A . 9 SER CA 1 1 14 10097 1 1 9 SER CB C 4.924 12.523 0.128 1.00 . A A . 9 SER CB 1 1 14 10098 1 1 9 SER H H 2.406 11.403 -0.916 1.00 . A A . 9 SER H 1 1 14 10099 1 1 9 SER HA H 4.815 12.750 -2.005 1.00 . A A . 9 SER HA 1 1 14 10100 1 1 9 SER HB2 H 4.622 11.803 0.868 1.00 . A A . 9 SER HB2 1 1 14 10101 1 1 9 SER HB3 H 6.004 12.586 0.109 1.00 . A A . 9 SER HB3 1 1 14 10102 1 1 9 SER HG H 4.670 14.028 1.333 1.00 . A A . 9 SER HG 1 1 14 10103 1 1 9 SER N N 2.930 12.151 -1.270 1.00 . A A . 9 SER N 1 1 14 10104 1 1 9 SER O O 4.327 9.996 -2.413 1.00 . A A . 9 SER O 1 1 14 10105 1 1 9 SER OG O 4.368 13.790 0.454 1.00 . A A . 9 SER OG 1 1 14 10106 1 1 10 ILE C C 6.732 8.101 0.217 1.00 . A A . 10 ILE C 1 1 14 10107 1 1 10 ILE CA C 6.278 8.749 -1.099 1.00 . A A . 10 ILE CA 1 1 14 10108 1 1 10 ILE CB C 7.421 8.783 -2.128 1.00 . A A . 10 ILE CB 1 1 14 10109 1 1 10 ILE CD1 C 7.533 9.713 -4.450 1.00 . A A . 10 ILE CD1 1 1 14 10110 1 1 10 ILE CG1 C 6.827 8.708 -3.538 1.00 . A A . 10 ILE CG1 1 1 14 10111 1 1 10 ILE CG2 C 8.365 7.600 -1.924 1.00 . A A . 10 ILE CG2 1 1 14 10112 1 1 10 ILE H H 6.261 10.671 -0.129 1.00 . A A . 10 ILE H 1 1 14 10113 1 1 10 ILE HA H 5.451 8.183 -1.504 1.00 . A A . 10 ILE HA 1 1 14 10114 1 1 10 ILE HB H 7.973 9.705 -2.020 1.00 . A A . 10 ILE HB 1 1 14 10115 1 1 10 ILE HD11 H 7.058 10.679 -4.356 1.00 . A A . 10 ILE HD11 1 1 14 10116 1 1 10 ILE HD12 H 7.465 9.377 -5.474 1.00 . A A . 10 ILE HD12 1 1 14 10117 1 1 10 ILE HD13 H 8.570 9.792 -4.164 1.00 . A A . 10 ILE HD13 1 1 14 10118 1 1 10 ILE HG12 H 6.961 7.710 -3.930 1.00 . A A . 10 ILE HG12 1 1 14 10119 1 1 10 ILE HG13 H 5.775 8.939 -3.498 1.00 . A A . 10 ILE HG13 1 1 14 10120 1 1 10 ILE HG21 H 8.786 7.309 -2.874 1.00 . A A . 10 ILE HG21 1 1 14 10121 1 1 10 ILE HG22 H 7.815 6.772 -1.503 1.00 . A A . 10 ILE HG22 1 1 14 10122 1 1 10 ILE HG23 H 9.157 7.887 -1.250 1.00 . A A . 10 ILE HG23 1 1 14 10123 1 1 10 ILE N N 5.830 10.143 -0.832 1.00 . A A . 10 ILE N 1 1 14 10124 1 1 10 ILE O O 7.709 8.502 0.815 1.00 . A A . 10 ILE O 1 1 14 10125 1 1 11 CYS C C 7.380 5.297 1.675 1.00 . A A . 11 CYS C 1 1 14 10126 1 1 11 CYS CA C 6.390 6.430 1.948 1.00 . A A . 11 CYS CA 1 1 14 10127 1 1 11 CYS CB C 5.137 5.840 2.600 1.00 . A A . 11 CYS CB 1 1 14 10128 1 1 11 CYS H H 5.230 6.802 0.171 1.00 . A A . 11 CYS H 1 1 14 10129 1 1 11 CYS HA H 6.839 7.145 2.619 1.00 . A A . 11 CYS HA 1 1 14 10130 1 1 11 CYS HB2 H 4.808 4.983 2.032 1.00 . A A . 11 CYS HB2 1 1 14 10131 1 1 11 CYS HB3 H 5.368 5.536 3.609 1.00 . A A . 11 CYS HB3 1 1 14 10132 1 1 11 CYS N N 6.017 7.104 0.670 1.00 . A A . 11 CYS N 1 1 14 10133 1 1 11 CYS O O 7.932 5.179 0.600 1.00 . A A . 11 CYS O 1 1 14 10134 1 1 11 CYS SG S 3.818 7.072 2.633 1.00 . A A . 11 CYS SG 1 1 14 10135 1 1 12 SER C C 7.765 2.005 2.559 1.00 . A A . 12 SER C 1 1 14 10136 1 1 12 SER CA C 8.543 3.320 2.470 1.00 . A A . 12 SER CA 1 1 14 10137 1 1 12 SER CB C 9.603 3.358 3.571 1.00 . A A . 12 SER CB 1 1 14 10138 1 1 12 SER H H 7.135 4.577 3.506 1.00 . A A . 12 SER H 1 1 14 10139 1 1 12 SER HA H 9.020 3.394 1.504 1.00 . A A . 12 SER HA 1 1 14 10140 1 1 12 SER HB2 H 10.435 2.733 3.294 1.00 . A A . 12 SER HB2 1 1 14 10141 1 1 12 SER HB3 H 9.948 4.375 3.702 1.00 . A A . 12 SER HB3 1 1 14 10142 1 1 12 SER HG H 8.387 3.516 5.081 1.00 . A A . 12 SER HG 1 1 14 10143 1 1 12 SER N N 7.599 4.458 2.651 1.00 . A A . 12 SER N 1 1 14 10144 1 1 12 SER O O 6.681 1.952 3.105 1.00 . A A . 12 SER O 1 1 14 10145 1 1 12 SER OG O 9.038 2.877 4.782 1.00 . A A . 12 SER OG 1 1 14 10146 1 1 13 LEU C C 7.151 -0.629 3.537 1.00 . A A . 13 LEU C 1 1 14 10147 1 1 13 LEU CA C 7.581 -0.361 2.094 1.00 . A A . 13 LEU CA 1 1 14 10148 1 1 13 LEU CB C 8.498 -1.487 1.614 1.00 . A A . 13 LEU CB 1 1 14 10149 1 1 13 LEU CD1 C 7.751 -1.944 -0.727 1.00 . A A . 13 LEU CD1 1 1 14 10150 1 1 13 LEU CD2 C 8.317 -3.842 0.791 1.00 . A A . 13 LEU CD2 1 1 14 10151 1 1 13 LEU CG C 7.703 -2.442 0.718 1.00 . A A . 13 LEU CG 1 1 14 10152 1 1 13 LEU H H 9.180 0.996 1.596 1.00 . A A . 13 LEU H 1 1 14 10153 1 1 13 LEU HA H 6.706 -0.315 1.462 1.00 . A A . 13 LEU HA 1 1 14 10154 1 1 13 LEU HB2 H 9.321 -1.067 1.054 1.00 . A A . 13 LEU HB2 1 1 14 10155 1 1 13 LEU HB3 H 8.880 -2.029 2.466 1.00 . A A . 13 LEU HB3 1 1 14 10156 1 1 13 LEU HD11 H 8.626 -2.345 -1.217 1.00 . A A . 13 LEU HD11 1 1 14 10157 1 1 13 LEU HD12 H 7.796 -0.865 -0.734 1.00 . A A . 13 LEU HD12 1 1 14 10158 1 1 13 LEU HD13 H 6.864 -2.271 -1.249 1.00 . A A . 13 LEU HD13 1 1 14 10159 1 1 13 LEU HD21 H 9.048 -3.956 0.004 1.00 . A A . 13 LEU HD21 1 1 14 10160 1 1 13 LEU HD22 H 7.540 -4.582 0.671 1.00 . A A . 13 LEU HD22 1 1 14 10161 1 1 13 LEU HD23 H 8.798 -3.976 1.749 1.00 . A A . 13 LEU HD23 1 1 14 10162 1 1 13 LEU HG H 6.674 -2.479 1.052 1.00 . A A . 13 LEU HG 1 1 14 10163 1 1 13 LEU N N 8.304 0.940 2.031 1.00 . A A . 13 LEU N 1 1 14 10164 1 1 13 LEU O O 6.213 -1.358 3.789 1.00 . A A . 13 LEU O 1 1 14 10165 1 1 14 TYR C C 6.049 0.338 6.140 1.00 . A A . 14 TYR C 1 1 14 10166 1 1 14 TYR CA C 7.439 -0.254 5.909 1.00 . A A . 14 TYR CA 1 1 14 10167 1 1 14 TYR CB C 8.449 0.433 6.831 1.00 . A A . 14 TYR CB 1 1 14 10168 1 1 14 TYR CD1 C 7.080 0.946 8.955 1.00 . A A . 14 TYR CD1 1 1 14 10169 1 1 14 TYR CD2 C 8.657 -0.907 9.023 1.00 . A A . 14 TYR CD2 1 1 14 10170 1 1 14 TYR CE1 C 6.726 0.681 10.285 1.00 . A A . 14 TYR CE1 1 1 14 10171 1 1 14 TYR CE2 C 8.292 -1.158 10.352 1.00 . A A . 14 TYR CE2 1 1 14 10172 1 1 14 TYR CG C 8.057 0.153 8.302 1.00 . A A . 14 TYR CG 1 1 14 10173 1 1 14 TYR CZ C 7.331 -0.366 10.980 1.00 . A A . 14 TYR CZ 1 1 14 10174 1 1 14 TYR H H 8.572 0.555 4.264 1.00 . A A . 14 TYR H 1 1 14 10175 1 1 14 TYR HA H 7.420 -1.314 6.119 1.00 . A A . 14 TYR HA 1 1 14 10176 1 1 14 TYR HB2 H 9.446 0.047 6.613 1.00 . A A . 14 TYR HB2 1 1 14 10177 1 1 14 TYR HB3 H 8.442 1.502 6.632 1.00 . A A . 14 TYR HB3 1 1 14 10178 1 1 14 TYR HD1 H 6.595 1.753 8.444 1.00 . A A . 14 TYR HD1 1 1 14 10179 1 1 14 TYR HD2 H 9.392 -1.536 8.564 1.00 . A A . 14 TYR HD2 1 1 14 10180 1 1 14 TYR HE1 H 5.980 1.291 10.774 1.00 . A A . 14 TYR HE1 1 1 14 10181 1 1 14 TYR HE2 H 8.758 -1.968 10.893 1.00 . A A . 14 TYR HE2 1 1 14 10182 1 1 14 TYR HH H 6.130 -0.202 12.456 1.00 . A A . 14 TYR HH 1 1 14 10183 1 1 14 TYR N N 7.823 -0.037 4.487 1.00 . A A . 14 TYR N 1 1 14 10184 1 1 14 TYR O O 5.177 -0.300 6.693 1.00 . A A . 14 TYR O 1 1 14 10185 1 1 14 TYR OH O 6.978 -0.620 12.290 1.00 . A A . 14 TYR OH 1 1 14 10186 1 1 15 GLN C C 3.446 1.272 5.221 1.00 . A A . 15 GLN C 1 1 14 10187 1 1 15 GLN CA C 4.487 2.164 5.893 1.00 . A A . 15 GLN CA 1 1 14 10188 1 1 15 GLN CB C 4.463 3.557 5.257 1.00 . A A . 15 GLN CB 1 1 14 10189 1 1 15 GLN CD C 5.818 5.537 5.954 1.00 . A A . 15 GLN CD 1 1 14 10190 1 1 15 GLN CG C 4.657 4.620 6.342 1.00 . A A . 15 GLN CG 1 1 14 10191 1 1 15 GLN H H 6.542 2.047 5.253 1.00 . A A . 15 GLN H 1 1 14 10192 1 1 15 GLN HA H 4.266 2.240 6.948 1.00 . A A . 15 GLN HA 1 1 14 10193 1 1 15 GLN HB2 H 5.258 3.634 4.531 1.00 . A A . 15 GLN HB2 1 1 14 10194 1 1 15 GLN HB3 H 3.512 3.714 4.769 1.00 . A A . 15 GLN HB3 1 1 14 10195 1 1 15 GLN HE21 H 5.155 7.068 7.030 1.00 . A A . 15 GLN HE21 1 1 14 10196 1 1 15 GLN HE22 H 6.602 7.346 6.188 1.00 . A A . 15 GLN HE22 1 1 14 10197 1 1 15 GLN HG2 H 3.753 5.203 6.441 1.00 . A A . 15 GLN HG2 1 1 14 10198 1 1 15 GLN HG3 H 4.880 4.138 7.282 1.00 . A A . 15 GLN HG3 1 1 14 10199 1 1 15 GLN N N 5.830 1.549 5.707 1.00 . A A . 15 GLN N 1 1 14 10200 1 1 15 GLN NE2 N 5.862 6.751 6.430 1.00 . A A . 15 GLN NE2 1 1 14 10201 1 1 15 GLN O O 2.365 1.068 5.734 1.00 . A A . 15 GLN O 1 1 14 10202 1 1 15 GLN OE1 O 6.695 5.144 5.210 1.00 . A A . 15 GLN OE1 1 1 14 10203 1 1 16 LEU C C 2.584 -1.411 4.240 1.00 . A A . 16 LEU C 1 1 14 10204 1 1 16 LEU CA C 2.806 -0.168 3.386 1.00 . A A . 16 LEU CA 1 1 14 10205 1 1 16 LEU CB C 3.371 -0.573 2.023 1.00 . A A . 16 LEU CB 1 1 14 10206 1 1 16 LEU CD1 C 4.306 1.588 1.178 1.00 . A A . 16 LEU CD1 1 1 14 10207 1 1 16 LEU CD2 C 3.185 0.007 -0.398 1.00 . A A . 16 LEU CD2 1 1 14 10208 1 1 16 LEU CG C 3.173 0.570 1.025 1.00 . A A . 16 LEU CG 1 1 14 10209 1 1 16 LEU H H 4.654 0.894 3.691 1.00 . A A . 16 LEU H 1 1 14 10210 1 1 16 LEU HA H 1.866 0.346 3.253 1.00 . A A . 16 LEU HA 1 1 14 10211 1 1 16 LEU HB2 H 4.425 -0.789 2.121 1.00 . A A . 16 LEU HB2 1 1 14 10212 1 1 16 LEU HB3 H 2.854 -1.452 1.667 1.00 . A A . 16 LEU HB3 1 1 14 10213 1 1 16 LEU HD11 H 4.302 1.982 2.184 1.00 . A A . 16 LEU HD11 1 1 14 10214 1 1 16 LEU HD12 H 4.163 2.395 0.475 1.00 . A A . 16 LEU HD12 1 1 14 10215 1 1 16 LEU HD13 H 5.252 1.106 0.984 1.00 . A A . 16 LEU HD13 1 1 14 10216 1 1 16 LEU HD21 H 3.513 -1.022 -0.375 1.00 . A A . 16 LEU HD21 1 1 14 10217 1 1 16 LEU HD22 H 3.860 0.587 -1.009 1.00 . A A . 16 LEU HD22 1 1 14 10218 1 1 16 LEU HD23 H 2.189 0.058 -0.813 1.00 . A A . 16 LEU HD23 1 1 14 10219 1 1 16 LEU HG H 2.226 1.054 1.215 1.00 . A A . 16 LEU HG 1 1 14 10220 1 1 16 LEU N N 3.771 0.726 4.082 1.00 . A A . 16 LEU N 1 1 14 10221 1 1 16 LEU O O 1.493 -1.940 4.313 1.00 . A A . 16 LEU O 1 1 14 10222 1 1 17 GLU C C 2.319 -2.776 6.765 1.00 . A A . 17 GLU C 1 1 14 10223 1 1 17 GLU CA C 3.439 -3.064 5.768 1.00 . A A . 17 GLU CA 1 1 14 10224 1 1 17 GLU CB C 4.747 -3.326 6.514 1.00 . A A . 17 GLU CB 1 1 14 10225 1 1 17 GLU CD C 5.657 -5.643 6.293 1.00 . A A . 17 GLU CD 1 1 14 10226 1 1 17 GLU CG C 5.639 -4.243 5.676 1.00 . A A . 17 GLU CG 1 1 14 10227 1 1 17 GLU H H 4.475 -1.430 4.852 1.00 . A A . 17 GLU H 1 1 14 10228 1 1 17 GLU HA H 3.182 -3.923 5.165 1.00 . A A . 17 GLU HA 1 1 14 10229 1 1 17 GLU HB2 H 5.255 -2.389 6.686 1.00 . A A . 17 GLU HB2 1 1 14 10230 1 1 17 GLU HB3 H 4.534 -3.795 7.455 1.00 . A A . 17 GLU HB3 1 1 14 10231 1 1 17 GLU HG2 H 5.253 -4.298 4.669 1.00 . A A . 17 GLU HG2 1 1 14 10232 1 1 17 GLU HG3 H 6.644 -3.848 5.656 1.00 . A A . 17 GLU HG3 1 1 14 10233 1 1 17 GLU N N 3.605 -1.874 4.906 1.00 . A A . 17 GLU N 1 1 14 10234 1 1 17 GLU O O 1.637 -3.667 7.231 1.00 . A A . 17 GLU O 1 1 14 10235 1 1 17 GLU OE1 O 4.652 -6.028 6.866 1.00 . A A . 17 GLU OE1 1 1 14 10236 1 1 17 GLU OE2 O 6.676 -6.305 6.182 1.00 . A A . 17 GLU OE2 1 1 14 10237 1 1 18 ASN C C -0.316 -1.271 7.338 1.00 . A A . 18 ASN C 1 1 14 10238 1 1 18 ASN CA C 1.038 -1.163 8.041 1.00 . A A . 18 ASN CA 1 1 14 10239 1 1 18 ASN CB C 1.247 0.272 8.533 1.00 . A A . 18 ASN CB 1 1 14 10240 1 1 18 ASN CG C 0.397 0.510 9.782 1.00 . A A . 18 ASN CG 1 1 14 10241 1 1 18 ASN H H 2.678 -0.820 6.689 1.00 . A A . 18 ASN H 1 1 14 10242 1 1 18 ASN HA H 1.062 -1.839 8.882 1.00 . A A . 18 ASN HA 1 1 14 10243 1 1 18 ASN HB2 H 2.290 0.421 8.772 1.00 . A A . 18 ASN HB2 1 1 14 10244 1 1 18 ASN HB3 H 0.951 0.966 7.760 1.00 . A A . 18 ASN HB3 1 1 14 10245 1 1 18 ASN HD21 H 1.636 -0.472 10.983 1.00 . A A . 18 ASN HD21 1 1 14 10246 1 1 18 ASN HD22 H 0.260 0.177 11.735 1.00 . A A . 18 ASN HD22 1 1 14 10247 1 1 18 ASN N N 2.119 -1.524 7.085 1.00 . A A . 18 ASN N 1 1 14 10248 1 1 18 ASN ND2 N 0.798 0.033 10.929 1.00 . A A . 18 ASN ND2 1 1 14 10249 1 1 18 ASN O O -1.349 -1.336 7.974 1.00 . A A . 18 ASN O 1 1 14 10250 1 1 18 ASN OD1 O -0.642 1.137 9.715 1.00 . A A . 18 ASN OD1 1 1 14 10251 1 1 19 TYR C C -2.145 -2.842 5.474 1.00 . A A . 19 TYR C 1 1 14 10252 1 1 19 TYR CA C -1.621 -1.414 5.306 1.00 . A A . 19 TYR CA 1 1 14 10253 1 1 19 TYR CB C -1.423 -1.138 3.809 1.00 . A A . 19 TYR CB 1 1 14 10254 1 1 19 TYR CD1 C -0.062 1.025 4.372 1.00 . A A . 19 TYR CD1 1 1 14 10255 1 1 19 TYR CD2 C -1.624 1.090 2.504 1.00 . A A . 19 TYR CD2 1 1 14 10256 1 1 19 TYR CE1 C 0.286 2.355 4.109 1.00 . A A . 19 TYR CE1 1 1 14 10257 1 1 19 TYR CE2 C -1.264 2.419 2.263 1.00 . A A . 19 TYR CE2 1 1 14 10258 1 1 19 TYR CG C -1.033 0.357 3.564 1.00 . A A . 19 TYR CG 1 1 14 10259 1 1 19 TYR CZ C -0.312 3.048 3.060 1.00 . A A . 19 TYR CZ 1 1 14 10260 1 1 19 TYR H H 0.519 -1.253 5.527 1.00 . A A . 19 TYR H 1 1 14 10261 1 1 19 TYR HA H -2.332 -0.713 5.717 1.00 . A A . 19 TYR HA 1 1 14 10262 1 1 19 TYR HB2 H -0.637 -1.807 3.438 1.00 . A A . 19 TYR HB2 1 1 14 10263 1 1 19 TYR HB3 H -2.359 -1.381 3.288 1.00 . A A . 19 TYR HB3 1 1 14 10264 1 1 19 TYR HD1 H 0.416 0.535 5.192 1.00 . A A . 19 TYR HD1 1 1 14 10265 1 1 19 TYR HD2 H -2.362 0.646 1.879 1.00 . A A . 19 TYR HD2 1 1 14 10266 1 1 19 TYR HE1 H 1.024 2.844 4.725 1.00 . A A . 19 TYR HE1 1 1 14 10267 1 1 19 TYR HE2 H -1.722 2.957 1.448 1.00 . A A . 19 TYR HE2 1 1 14 10268 1 1 19 TYR HH H -0.321 4.605 1.955 1.00 . A A . 19 TYR HH 1 1 14 10269 1 1 19 TYR N N -0.325 -1.299 6.030 1.00 . A A . 19 TYR N 1 1 14 10270 1 1 19 TYR O O -3.335 -3.086 5.469 1.00 . A A . 19 TYR O 1 1 14 10271 1 1 19 TYR OH O 0.040 4.359 2.810 1.00 . A A . 19 TYR OH 1 1 14 10272 1 1 20 CYS C C -1.973 -5.492 7.253 1.00 . A A . 20 CYS C 1 1 14 10273 1 1 20 CYS CA C -1.685 -5.208 5.778 1.00 . A A . 20 CYS CA 1 1 14 10274 1 1 20 CYS CB C -0.568 -6.136 5.289 1.00 . A A . 20 CYS CB 1 1 14 10275 1 1 20 CYS H H -0.302 -3.566 5.612 1.00 . A A . 20 CYS H 1 1 14 10276 1 1 20 CYS HA H -2.578 -5.383 5.196 1.00 . A A . 20 CYS HA 1 1 14 10277 1 1 20 CYS HB2 H 0.281 -6.056 5.952 1.00 . A A . 20 CYS HB2 1 1 14 10278 1 1 20 CYS HB3 H -0.924 -7.155 5.281 1.00 . A A . 20 CYS HB3 1 1 14 10279 1 1 20 CYS N N -1.255 -3.789 5.616 1.00 . A A . 20 CYS N 1 1 14 10280 1 1 20 CYS O O -1.464 -6.437 7.824 1.00 . A A . 20 CYS O 1 1 14 10281 1 1 20 CYS SG S -0.071 -5.658 3.613 1.00 . A A . 20 CYS SG 1 1 14 10282 1 1 21 ASN C C -3.791 -6.269 9.477 1.00 . A A . 21 ASN C 1 1 14 10283 1 1 21 ASN CA C -3.110 -4.908 9.313 1.00 . A A . 21 ASN CA 1 1 14 10284 1 1 21 ASN CB C -4.050 -3.807 9.807 1.00 . A A . 21 ASN CB 1 1 14 10285 1 1 21 ASN CG C -3.313 -2.919 10.811 1.00 . A A . 21 ASN CG 1 1 14 10286 1 1 21 ASN H H -3.187 -3.928 7.395 1.00 . A A . 21 ASN H 1 1 14 10287 1 1 21 ASN HA H -2.199 -4.890 9.893 1.00 . A A . 21 ASN HA 1 1 14 10288 1 1 21 ASN HB2 H -4.377 -3.209 8.968 1.00 . A A . 21 ASN HB2 1 1 14 10289 1 1 21 ASN HB3 H -4.908 -4.254 10.287 1.00 . A A . 21 ASN HB3 1 1 14 10290 1 1 21 ASN HD21 H -4.966 -2.394 11.778 1.00 . A A . 21 ASN HD21 1 1 14 10291 1 1 21 ASN HD22 H -3.528 -1.723 12.381 1.00 . A A . 21 ASN HD22 1 1 14 10292 1 1 21 ASN N N -2.787 -4.683 7.875 1.00 . A A . 21 ASN N 1 1 14 10293 1 1 21 ASN ND2 N -3.992 -2.294 11.733 1.00 . A A . 21 ASN ND2 1 1 14 10294 1 1 21 ASN O O -4.651 -6.579 8.670 1.00 . A A . 21 ASN O 1 1 14 10295 1 1 21 ASN OXT O -3.441 -6.976 10.408 1.00 . A A . 21 ASN OXT 1 1 14 10296 1 1 21 ASN OD1 O -2.105 -2.796 10.758 1.00 . A A . 21 ASN OD1 1 1 14 10297 2 2 1 PHE C C 11.372 -0.821 -3.340 1.00 . B B . 22 PHE C 1 1 14 10298 2 2 1 PHE CA C 12.427 -1.841 -3.774 1.00 . B B . 22 PHE CA 1 1 14 10299 2 2 1 PHE CB C 11.752 -2.958 -4.575 1.00 . B B . 22 PHE CB 1 1 14 10300 2 2 1 PHE CD1 C 11.496 -4.752 -2.820 1.00 . B B . 22 PHE CD1 1 1 14 10301 2 2 1 PHE CD2 C 9.508 -3.621 -3.632 1.00 . B B . 22 PHE CD2 1 1 14 10302 2 2 1 PHE CE1 C 10.704 -5.530 -1.965 1.00 . B B . 22 PHE CE1 1 1 14 10303 2 2 1 PHE CE2 C 8.716 -4.399 -2.778 1.00 . B B . 22 PHE CE2 1 1 14 10304 2 2 1 PHE CG C 10.899 -3.797 -3.654 1.00 . B B . 22 PHE CG 1 1 14 10305 2 2 1 PHE CZ C 9.314 -5.354 -1.944 1.00 . B B . 22 PHE CZ 1 1 14 10306 2 2 1 PHE H1 H 13.734 -1.716 -2.158 1.00 . B B . 22 PHE H1 1 1 14 10307 2 2 1 PHE H2 H 13.626 -3.267 -2.844 1.00 . B B . 22 PHE H2 1 1 14 10308 2 2 1 PHE H3 H 12.367 -2.677 -1.868 1.00 . B B . 22 PHE H3 1 1 14 10309 2 2 1 PHE HA H 13.166 -1.353 -4.391 1.00 . B B . 22 PHE HA 1 1 14 10310 2 2 1 PHE HB2 H 11.132 -2.524 -5.345 1.00 . B B . 22 PHE HB2 1 1 14 10311 2 2 1 PHE HB3 H 12.508 -3.581 -5.031 1.00 . B B . 22 PHE HB3 1 1 14 10312 2 2 1 PHE HD1 H 12.567 -4.888 -2.836 1.00 . B B . 22 PHE HD1 1 1 14 10313 2 2 1 PHE HD2 H 9.047 -2.885 -4.275 1.00 . B B . 22 PHE HD2 1 1 14 10314 2 2 1 PHE HE1 H 11.164 -6.266 -1.323 1.00 . B B . 22 PHE HE1 1 1 14 10315 2 2 1 PHE HE2 H 7.645 -4.262 -2.761 1.00 . B B . 22 PHE HE2 1 1 14 10316 2 2 1 PHE HZ H 8.703 -5.954 -1.285 1.00 . B B . 22 PHE HZ 1 1 14 10317 2 2 1 PHE N N 13.089 -2.419 -2.570 1.00 . B B . 22 PHE N 1 1 14 10318 2 2 1 PHE O O 10.294 -1.174 -2.905 1.00 . B B . 22 PHE O 1 1 14 10319 2 2 2 VAL C C 10.872 2.726 -3.921 1.00 . B B . 23 VAL C 1 1 14 10320 2 2 2 VAL CA C 10.689 1.485 -3.048 1.00 . B B . 23 VAL CA 1 1 14 10321 2 2 2 VAL CB C 10.896 1.835 -1.564 1.00 . B B . 23 VAL CB 1 1 14 10322 2 2 2 VAL CG1 C 11.920 2.966 -1.411 1.00 . B B . 23 VAL CG1 1 1 14 10323 2 2 2 VAL CG2 C 9.559 2.265 -0.952 1.00 . B B . 23 VAL CG2 1 1 14 10324 2 2 2 VAL H H 12.549 0.709 -3.807 1.00 . B B . 23 VAL H 1 1 14 10325 2 2 2 VAL HA H 9.689 1.108 -3.185 1.00 . B B . 23 VAL HA 1 1 14 10326 2 2 2 VAL HB H 11.257 0.965 -1.047 1.00 . B B . 23 VAL HB 1 1 14 10327 2 2 2 VAL HG11 H 12.438 2.857 -0.470 1.00 . B B . 23 VAL HG11 1 1 14 10328 2 2 2 VAL HG12 H 11.413 3.918 -1.434 1.00 . B B . 23 VAL HG12 1 1 14 10329 2 2 2 VAL HG13 H 12.632 2.917 -2.222 1.00 . B B . 23 VAL HG13 1 1 14 10330 2 2 2 VAL HG21 H 8.798 2.271 -1.717 1.00 . B B . 23 VAL HG21 1 1 14 10331 2 2 2 VAL HG22 H 9.656 3.256 -0.532 1.00 . B B . 23 VAL HG22 1 1 14 10332 2 2 2 VAL HG23 H 9.281 1.571 -0.173 1.00 . B B . 23 VAL HG23 1 1 14 10333 2 2 2 VAL N N 11.674 0.444 -3.454 1.00 . B B . 23 VAL N 1 1 14 10334 2 2 2 VAL O O 11.432 2.669 -4.997 1.00 . B B . 23 VAL O 1 1 14 10335 2 2 3 ASN C C 9.485 5.114 -5.358 1.00 . B B . 24 ASN C 1 1 14 10336 2 2 3 ASN CA C 10.527 5.102 -4.240 1.00 . B B . 24 ASN CA 1 1 14 10337 2 2 3 ASN CB C 11.930 5.188 -4.846 1.00 . B B . 24 ASN CB 1 1 14 10338 2 2 3 ASN CG C 12.221 6.633 -5.259 1.00 . B B . 24 ASN CG 1 1 14 10339 2 2 3 ASN H H 9.949 3.845 -2.587 1.00 . B B . 24 ASN H 1 1 14 10340 2 2 3 ASN HA H 10.364 5.948 -3.588 1.00 . B B . 24 ASN HA 1 1 14 10341 2 2 3 ASN HB2 H 12.658 4.868 -4.115 1.00 . B B . 24 ASN HB2 1 1 14 10342 2 2 3 ASN HB3 H 11.987 4.551 -5.715 1.00 . B B . 24 ASN HB3 1 1 14 10343 2 2 3 ASN HD21 H 13.452 6.969 -3.737 1.00 . B B . 24 ASN HD21 1 1 14 10344 2 2 3 ASN HD22 H 13.229 8.279 -4.793 1.00 . B B . 24 ASN HD22 1 1 14 10345 2 2 3 ASN N N 10.396 3.840 -3.456 1.00 . B B . 24 ASN N 1 1 14 10346 2 2 3 ASN ND2 N 13.035 7.353 -4.536 1.00 . B B . 24 ASN ND2 1 1 14 10347 2 2 3 ASN O O 9.808 5.217 -6.524 1.00 . B B . 24 ASN O 1 1 14 10348 2 2 3 ASN OD1 O 11.705 7.110 -6.249 1.00 . B B . 24 ASN OD1 1 1 14 10349 2 2 4 GLN C C 5.994 5.863 -5.558 1.00 . B B . 25 GLN C 1 1 14 10350 2 2 4 GLN CA C 7.166 5.015 -6.045 1.00 . B B . 25 GLN CA 1 1 14 10351 2 2 4 GLN CB C 6.681 3.586 -6.295 1.00 . B B . 25 GLN CB 1 1 14 10352 2 2 4 GLN CD C 6.888 1.635 -7.843 1.00 . B B . 25 GLN CD 1 1 14 10353 2 2 4 GLN CG C 7.085 3.146 -7.704 1.00 . B B . 25 GLN CG 1 1 14 10354 2 2 4 GLN H H 7.996 4.927 -4.061 1.00 . B B . 25 GLN H 1 1 14 10355 2 2 4 GLN HA H 7.556 5.430 -6.963 1.00 . B B . 25 GLN HA 1 1 14 10356 2 2 4 GLN HB2 H 7.126 2.923 -5.568 1.00 . B B . 25 GLN HB2 1 1 14 10357 2 2 4 GLN HB3 H 5.606 3.551 -6.204 1.00 . B B . 25 GLN HB3 1 1 14 10358 2 2 4 GLN HE21 H 5.533 1.534 -6.394 1.00 . B B . 25 GLN HE21 1 1 14 10359 2 2 4 GLN HE22 H 5.905 0.057 -7.143 1.00 . B B . 25 GLN HE22 1 1 14 10360 2 2 4 GLN HG2 H 6.470 3.658 -8.430 1.00 . B B . 25 GLN HG2 1 1 14 10361 2 2 4 GLN HG3 H 8.122 3.389 -7.874 1.00 . B B . 25 GLN HG3 1 1 14 10362 2 2 4 GLN N N 8.233 5.009 -5.008 1.00 . B B . 25 GLN N 1 1 14 10363 2 2 4 GLN NE2 N 6.038 1.025 -7.062 1.00 . B B . 25 GLN NE2 1 1 14 10364 2 2 4 GLN O O 5.657 5.862 -4.391 1.00 . B B . 25 GLN O 1 1 14 10365 2 2 4 GLN OE1 O 7.514 1.002 -8.670 1.00 . B B . 25 GLN OE1 1 1 14 10366 2 2 5 HIS C C 2.952 6.577 -6.182 1.00 . B B . 26 HIS C 1 1 14 10367 2 2 5 HIS CA C 4.215 7.428 -6.023 1.00 . B B . 26 HIS CA 1 1 14 10368 2 2 5 HIS CB C 4.136 8.651 -6.937 1.00 . B B . 26 HIS CB 1 1 14 10369 2 2 5 HIS CD2 C 3.023 10.898 -6.184 1.00 . B B . 26 HIS CD2 1 1 14 10370 2 2 5 HIS CE1 C 4.389 11.339 -4.551 1.00 . B B . 26 HIS CE1 1 1 14 10371 2 2 5 HIS CG C 3.937 9.884 -6.107 1.00 . B B . 26 HIS CG 1 1 14 10372 2 2 5 HIS H H 5.651 6.572 -7.379 1.00 . B B . 26 HIS H 1 1 14 10373 2 2 5 HIS HA H 4.332 7.735 -4.994 1.00 . B B . 26 HIS HA 1 1 14 10374 2 2 5 HIS HB2 H 5.050 8.740 -7.504 1.00 . B B . 26 HIS HB2 1 1 14 10375 2 2 5 HIS HB3 H 3.301 8.539 -7.612 1.00 . B B . 26 HIS HB3 1 1 14 10376 2 2 5 HIS HD2 H 2.214 10.962 -6.895 1.00 . B B . 26 HIS HD2 1 1 14 10377 2 2 5 HIS HE1 H 4.866 11.823 -3.710 1.00 . B B . 26 HIS HE1 1 1 14 10378 2 2 5 HIS HE2 H 2.826 12.656 -5.013 1.00 . B B . 26 HIS HE2 1 1 14 10379 2 2 5 HIS N N 5.366 6.586 -6.442 1.00 . B B . 26 HIS N 1 1 14 10380 2 2 5 HIS ND1 N 4.793 10.176 -5.069 1.00 . B B . 26 HIS ND1 1 1 14 10381 2 2 5 HIS NE2 N 3.308 11.823 -5.201 1.00 . B B . 26 HIS NE2 1 1 14 10382 2 2 5 HIS O O 2.867 5.770 -7.087 1.00 . B B . 26 HIS O 1 1 14 10383 2 2 6 LEU C C -0.481 6.478 -4.877 1.00 . B B . 27 LEU C 1 1 14 10384 2 2 6 LEU CA C 0.774 5.841 -5.483 1.00 . B B . 27 LEU CA 1 1 14 10385 2 2 6 LEU CB C 1.033 4.498 -4.792 1.00 . B B . 27 LEU CB 1 1 14 10386 2 2 6 LEU CD1 C 1.199 5.692 -2.597 1.00 . B B . 27 LEU CD1 1 1 14 10387 2 2 6 LEU CD2 C 2.077 3.380 -2.823 1.00 . B B . 27 LEU CD2 1 1 14 10388 2 2 6 LEU CG C 1.893 4.712 -3.543 1.00 . B B . 27 LEU CG 1 1 14 10389 2 2 6 LEU H H 2.046 7.340 -4.576 1.00 . B B . 27 LEU H 1 1 14 10390 2 2 6 LEU HA H 0.607 5.664 -6.535 1.00 . B B . 27 LEU HA 1 1 14 10391 2 2 6 LEU HB2 H 0.091 4.052 -4.509 1.00 . B B . 27 LEU HB2 1 1 14 10392 2 2 6 LEU HB3 H 1.552 3.839 -5.473 1.00 . B B . 27 LEU HB3 1 1 14 10393 2 2 6 LEU HD11 H 1.546 5.524 -1.588 1.00 . B B . 27 LEU HD11 1 1 14 10394 2 2 6 LEU HD12 H 0.131 5.538 -2.640 1.00 . B B . 27 LEU HD12 1 1 14 10395 2 2 6 LEU HD13 H 1.430 6.704 -2.893 1.00 . B B . 27 LEU HD13 1 1 14 10396 2 2 6 LEU HD21 H 1.387 2.655 -3.228 1.00 . B B . 27 LEU HD21 1 1 14 10397 2 2 6 LEU HD22 H 1.883 3.513 -1.769 1.00 . B B . 27 LEU HD22 1 1 14 10398 2 2 6 LEU HD23 H 3.089 3.033 -2.963 1.00 . B B . 27 LEU HD23 1 1 14 10399 2 2 6 LEU HG H 2.857 5.106 -3.829 1.00 . B B . 27 LEU HG 1 1 14 10400 2 2 6 LEU N N 1.979 6.707 -5.320 1.00 . B B . 27 LEU N 1 1 14 10401 2 2 6 LEU O O -0.438 7.144 -3.865 1.00 . B B . 27 LEU O 1 1 14 10402 2 2 7 CYS C C -3.875 5.617 -4.783 1.00 . B B . 28 CYS C 1 1 14 10403 2 2 7 CYS CA C -2.894 6.782 -4.975 1.00 . B B . 28 CYS CA 1 1 14 10404 2 2 7 CYS CB C -3.473 7.793 -5.971 1.00 . B B . 28 CYS CB 1 1 14 10405 2 2 7 CYS H H -1.616 5.687 -6.297 1.00 . B B . 28 CYS H 1 1 14 10406 2 2 7 CYS HA H -2.721 7.265 -4.024 1.00 . B B . 28 CYS HA 1 1 14 10407 2 2 7 CYS HB2 H -3.004 7.655 -6.933 1.00 . B B . 28 CYS HB2 1 1 14 10408 2 2 7 CYS HB3 H -4.537 7.638 -6.068 1.00 . B B . 28 CYS HB3 1 1 14 10409 2 2 7 CYS N N -1.611 6.242 -5.494 1.00 . B B . 28 CYS N 1 1 14 10410 2 2 7 CYS O O -3.482 4.470 -4.732 1.00 . B B . 28 CYS O 1 1 14 10411 2 2 7 CYS SG S -3.159 9.478 -5.386 1.00 . B B . 28 CYS SG 1 1 14 10412 2 2 8 GLY C C -5.808 3.559 -5.270 1.00 . B B . 29 GLY C 1 1 14 10413 2 2 8 GLY CA C -6.154 4.821 -4.462 1.00 . B B . 29 GLY CA 1 1 14 10414 2 2 8 GLY H H -5.435 6.837 -4.700 1.00 . B B . 29 GLY H 1 1 14 10415 2 2 8 GLY HA2 H -6.193 4.568 -3.413 1.00 . B B . 29 GLY HA2 1 1 14 10416 2 2 8 GLY HA3 H -7.124 5.182 -4.774 1.00 . B B . 29 GLY HA3 1 1 14 10417 2 2 8 GLY N N -5.142 5.903 -4.667 1.00 . B B . 29 GLY N 1 1 14 10418 2 2 8 GLY O O -5.595 2.500 -4.713 1.00 . B B . 29 GLY O 1 1 14 10419 2 2 9 SER C C -4.035 2.000 -7.258 1.00 . B B . 30 SER C 1 1 14 10420 2 2 9 SER CA C -5.496 2.435 -7.403 1.00 . B B . 30 SER CA 1 1 14 10421 2 2 9 SER CB C -5.788 2.739 -8.870 1.00 . B B . 30 SER CB 1 1 14 10422 2 2 9 SER H H -5.987 4.502 -7.010 1.00 . B B . 30 SER H 1 1 14 10423 2 2 9 SER HA H -6.134 1.624 -7.076 1.00 . B B . 30 SER HA 1 1 14 10424 2 2 9 SER HB2 H -6.169 1.854 -9.352 1.00 . B B . 30 SER HB2 1 1 14 10425 2 2 9 SER HB3 H -6.527 3.526 -8.932 1.00 . B B . 30 SER HB3 1 1 14 10426 2 2 9 SER HG H -4.302 3.971 -9.121 1.00 . B B . 30 SER HG 1 1 14 10427 2 2 9 SER N N -5.786 3.648 -6.574 1.00 . B B . 30 SER N 1 1 14 10428 2 2 9 SER O O -3.741 0.825 -7.186 1.00 . B B . 30 SER O 1 1 14 10429 2 2 9 SER OG O -4.587 3.144 -9.516 1.00 . B B . 30 SER OG 1 1 14 10430 2 2 10 ASP C C -1.491 1.965 -5.657 1.00 . B B . 31 ASP C 1 1 14 10431 2 2 10 ASP CA C -1.692 2.497 -7.074 1.00 . B B . 31 ASP CA 1 1 14 10432 2 2 10 ASP CB C -0.766 3.685 -7.324 1.00 . B B . 31 ASP CB 1 1 14 10433 2 2 10 ASP CG C -1.401 4.624 -8.352 1.00 . B B . 31 ASP CG 1 1 14 10434 2 2 10 ASP H H -3.346 3.863 -7.278 1.00 . B B . 31 ASP H 1 1 14 10435 2 2 10 ASP HA H -1.476 1.713 -7.786 1.00 . B B . 31 ASP HA 1 1 14 10436 2 2 10 ASP HB2 H -0.608 4.212 -6.400 1.00 . B B . 31 ASP HB2 1 1 14 10437 2 2 10 ASP HB3 H 0.181 3.330 -7.701 1.00 . B B . 31 ASP HB3 1 1 14 10438 2 2 10 ASP N N -3.111 2.915 -7.218 1.00 . B B . 31 ASP N 1 1 14 10439 2 2 10 ASP O O -0.578 1.210 -5.386 1.00 . B B . 31 ASP O 1 1 14 10440 2 2 10 ASP OD1 O -2.362 5.289 -8.003 1.00 . B B . 31 ASP OD1 1 1 14 10441 2 2 10 ASP OD2 O -0.918 4.660 -9.472 1.00 . B B . 31 ASP OD2 1 1 14 10442 2 2 11 LEU C C -2.573 0.351 -3.363 1.00 . B B . 32 LEU C 1 1 14 10443 2 2 11 LEU CA C -2.247 1.841 -3.359 1.00 . B B . 32 LEU CA 1 1 14 10444 2 2 11 LEU CB C -3.246 2.581 -2.465 1.00 . B B . 32 LEU CB 1 1 14 10445 2 2 11 LEU CD1 C -2.354 4.914 -2.344 1.00 . B B . 32 LEU CD1 1 1 14 10446 2 2 11 LEU CD2 C -3.303 3.831 -0.305 1.00 . B B . 32 LEU CD2 1 1 14 10447 2 2 11 LEU CG C -2.505 3.592 -1.588 1.00 . B B . 32 LEU CG 1 1 14 10448 2 2 11 LEU H H -3.097 2.933 -5.003 1.00 . B B . 32 LEU H 1 1 14 10449 2 2 11 LEU HA H -1.241 1.994 -2.994 1.00 . B B . 32 LEU HA 1 1 14 10450 2 2 11 LEU HB2 H -3.965 3.098 -3.083 1.00 . B B . 32 LEU HB2 1 1 14 10451 2 2 11 LEU HB3 H -3.758 1.870 -1.834 1.00 . B B . 32 LEU HB3 1 1 14 10452 2 2 11 LEU HD11 H -3.331 5.344 -2.514 1.00 . B B . 32 LEU HD11 1 1 14 10453 2 2 11 LEU HD12 H -1.871 4.734 -3.292 1.00 . B B . 32 LEU HD12 1 1 14 10454 2 2 11 LEU HD13 H -1.757 5.597 -1.758 1.00 . B B . 32 LEU HD13 1 1 14 10455 2 2 11 LEU HD21 H -4.302 4.154 -0.557 1.00 . B B . 32 LEU HD21 1 1 14 10456 2 2 11 LEU HD22 H -2.816 4.594 0.285 1.00 . B B . 32 LEU HD22 1 1 14 10457 2 2 11 LEU HD23 H -3.353 2.914 0.264 1.00 . B B . 32 LEU HD23 1 1 14 10458 2 2 11 LEU HG H -1.526 3.205 -1.340 1.00 . B B . 32 LEU HG 1 1 14 10459 2 2 11 LEU N N -2.359 2.338 -4.755 1.00 . B B . 32 LEU N 1 1 14 10460 2 2 11 LEU O O -1.706 -0.482 -3.190 1.00 . B B . 32 LEU O 1 1 14 10461 2 2 12 VAL C C -3.139 -2.177 -4.434 1.00 . B B . 33 VAL C 1 1 14 10462 2 2 12 VAL CA C -4.196 -1.431 -3.628 1.00 . B B . 33 VAL CA 1 1 14 10463 2 2 12 VAL CB C -5.560 -1.582 -4.305 1.00 . B B . 33 VAL CB 1 1 14 10464 2 2 12 VAL CG1 C -6.611 -0.807 -3.516 1.00 . B B . 33 VAL CG1 1 1 14 10465 2 2 12 VAL CG2 C -5.484 -1.021 -5.722 1.00 . B B . 33 VAL CG2 1 1 14 10466 2 2 12 VAL H H -4.497 0.701 -3.744 1.00 . B B . 33 VAL H 1 1 14 10467 2 2 12 VAL HA H -4.237 -1.826 -2.623 1.00 . B B . 33 VAL HA 1 1 14 10468 2 2 12 VAL HB H -5.833 -2.625 -4.343 1.00 . B B . 33 VAL HB 1 1 14 10469 2 2 12 VAL HG11 H -7.082 -1.465 -2.800 1.00 . B B . 33 VAL HG11 1 1 14 10470 2 2 12 VAL HG12 H -7.356 -0.421 -4.195 1.00 . B B . 33 VAL HG12 1 1 14 10471 2 2 12 VAL HG13 H -6.137 0.012 -2.996 1.00 . B B . 33 VAL HG13 1 1 14 10472 2 2 12 VAL HG21 H -4.742 -0.242 -5.755 1.00 . B B . 33 VAL HG21 1 1 14 10473 2 2 12 VAL HG22 H -6.446 -0.615 -6.001 1.00 . B B . 33 VAL HG22 1 1 14 10474 2 2 12 VAL HG23 H -5.212 -1.809 -6.409 1.00 . B B . 33 VAL HG23 1 1 14 10475 2 2 12 VAL N N -3.818 0.010 -3.587 1.00 . B B . 33 VAL N 1 1 14 10476 2 2 12 VAL O O -2.836 -3.326 -4.181 1.00 . B B . 33 VAL O 1 1 14 10477 2 2 13 GLU C C -0.269 -2.358 -5.336 1.00 . B B . 34 GLU C 1 1 14 10478 2 2 13 GLU CA C -1.500 -2.150 -6.213 1.00 . B B . 34 GLU CA 1 1 14 10479 2 2 13 GLU CB C -1.154 -1.238 -7.392 1.00 . B B . 34 GLU CB 1 1 14 10480 2 2 13 GLU CD C -2.042 -0.594 -9.635 1.00 . B B . 34 GLU CD 1 1 14 10481 2 2 13 GLU CG C -1.843 -1.752 -8.657 1.00 . B B . 34 GLU CG 1 1 14 10482 2 2 13 GLU H H -2.811 -0.580 -5.566 1.00 . B B . 34 GLU H 1 1 14 10483 2 2 13 GLU HA H -1.849 -3.103 -6.579 1.00 . B B . 34 GLU HA 1 1 14 10484 2 2 13 GLU HB2 H -1.496 -0.234 -7.181 1.00 . B B . 34 GLU HB2 1 1 14 10485 2 2 13 GLU HB3 H -0.087 -1.227 -7.542 1.00 . B B . 34 GLU HB3 1 1 14 10486 2 2 13 GLU HG2 H -1.229 -2.513 -9.117 1.00 . B B . 34 GLU HG2 1 1 14 10487 2 2 13 GLU HG3 H -2.803 -2.171 -8.398 1.00 . B B . 34 GLU HG3 1 1 14 10488 2 2 13 GLU N N -2.559 -1.511 -5.395 1.00 . B B . 34 GLU N 1 1 14 10489 2 2 13 GLU O O 0.230 -3.456 -5.204 1.00 . B B . 34 GLU O 1 1 14 10490 2 2 13 GLU OE1 O -2.822 0.291 -9.323 1.00 . B B . 34 GLU OE1 1 1 14 10491 2 2 13 GLU OE2 O -1.410 -0.610 -10.678 1.00 . B B . 34 GLU OE2 1 1 14 10492 2 2 14 ALA C C 1.087 -2.504 -2.759 1.00 . B B . 35 ALA C 1 1 14 10493 2 2 14 ALA CA C 1.405 -1.470 -3.838 1.00 . B B . 35 ALA CA 1 1 14 10494 2 2 14 ALA CB C 1.741 -0.129 -3.182 1.00 . B B . 35 ALA CB 1 1 14 10495 2 2 14 ALA H H -0.207 -0.439 -4.826 1.00 . B B . 35 ALA H 1 1 14 10496 2 2 14 ALA HA H 2.245 -1.809 -4.427 1.00 . B B . 35 ALA HA 1 1 14 10497 2 2 14 ALA HB1 H 2.700 -0.199 -2.690 1.00 . B B . 35 ALA HB1 1 1 14 10498 2 2 14 ALA HB2 H 0.981 0.118 -2.456 1.00 . B B . 35 ALA HB2 1 1 14 10499 2 2 14 ALA HB3 H 1.781 0.642 -3.937 1.00 . B B . 35 ALA HB3 1 1 14 10500 2 2 14 ALA N N 0.216 -1.316 -4.719 1.00 . B B . 35 ALA N 1 1 14 10501 2 2 14 ALA O O 1.788 -3.483 -2.599 1.00 . B B . 35 ALA O 1 1 14 10502 2 2 15 LEU C C -0.417 -4.673 -1.630 1.00 . B B . 36 LEU C 1 1 14 10503 2 2 15 LEU CA C -0.327 -3.299 -0.975 1.00 . B B . 36 LEU CA 1 1 14 10504 2 2 15 LEU CB C -1.687 -2.944 -0.363 1.00 . B B . 36 LEU CB 1 1 14 10505 2 2 15 LEU CD1 C -0.229 -1.139 0.639 1.00 . B B . 36 LEU CD1 1 1 14 10506 2 2 15 LEU CD2 C -2.247 -0.526 -0.700 1.00 . B B . 36 LEU CD2 1 1 14 10507 2 2 15 LEU CG C -1.661 -1.545 0.278 1.00 . B B . 36 LEU CG 1 1 14 10508 2 2 15 LEU H H -0.537 -1.518 -2.164 1.00 . B B . 36 LEU H 1 1 14 10509 2 2 15 LEU HA H 0.433 -3.304 -0.206 1.00 . B B . 36 LEU HA 1 1 14 10510 2 2 15 LEU HB2 H -2.436 -2.962 -1.140 1.00 . B B . 36 LEU HB2 1 1 14 10511 2 2 15 LEU HB3 H -1.939 -3.675 0.391 1.00 . B B . 36 LEU HB3 1 1 14 10512 2 2 15 LEU HD11 H -0.243 -0.200 1.166 1.00 . B B . 36 LEU HD11 1 1 14 10513 2 2 15 LEU HD12 H 0.353 -1.037 -0.264 1.00 . B B . 36 LEU HD12 1 1 14 10514 2 2 15 LEU HD13 H 0.210 -1.900 1.266 1.00 . B B . 36 LEU HD13 1 1 14 10515 2 2 15 LEU HD21 H -1.448 0.049 -1.143 1.00 . B B . 36 LEU HD21 1 1 14 10516 2 2 15 LEU HD22 H -2.918 0.136 -0.173 1.00 . B B . 36 LEU HD22 1 1 14 10517 2 2 15 LEU HD23 H -2.790 -1.044 -1.477 1.00 . B B . 36 LEU HD23 1 1 14 10518 2 2 15 LEU HG H -2.259 -1.560 1.175 1.00 . B B . 36 LEU HG 1 1 14 10519 2 2 15 LEU N N 0.027 -2.307 -2.022 1.00 . B B . 36 LEU N 1 1 14 10520 2 2 15 LEU O O -0.302 -5.695 -0.984 1.00 . B B . 36 LEU O 1 1 14 10521 2 2 16 TYR C C 0.679 -6.483 -3.990 1.00 . B B . 37 TYR C 1 1 14 10522 2 2 16 TYR CA C -0.725 -5.992 -3.636 1.00 . B B . 37 TYR CA 1 1 14 10523 2 2 16 TYR CB C -1.546 -5.804 -4.912 1.00 . B B . 37 TYR CB 1 1 14 10524 2 2 16 TYR CD1 C -1.805 -8.369 -4.961 1.00 . B B . 37 TYR CD1 1 1 14 10525 2 2 16 TYR CD2 C -1.481 -7.204 -7.074 1.00 . B B . 37 TYR CD2 1 1 14 10526 2 2 16 TYR CE1 C -1.861 -9.586 -5.651 1.00 . B B . 37 TYR CE1 1 1 14 10527 2 2 16 TYR CE2 C -1.540 -8.430 -7.748 1.00 . B B . 37 TYR CE2 1 1 14 10528 2 2 16 TYR CG C -1.615 -7.152 -5.667 1.00 . B B . 37 TYR CG 1 1 14 10529 2 2 16 TYR CZ C -1.730 -9.616 -7.039 1.00 . B B . 37 TYR CZ 1 1 14 10530 2 2 16 TYR H H -0.712 -3.853 -3.412 1.00 . B B . 37 TYR H 1 1 14 10531 2 2 16 TYR HA H -1.211 -6.718 -3.000 1.00 . B B . 37 TYR HA 1 1 14 10532 2 2 16 TYR HB2 H -2.544 -5.455 -4.639 1.00 . B B . 37 TYR HB2 1 1 14 10533 2 2 16 TYR HB3 H -1.074 -5.044 -5.529 1.00 . B B . 37 TYR HB3 1 1 14 10534 2 2 16 TYR HD1 H -1.903 -8.377 -3.892 1.00 . B B . 37 TYR HD1 1 1 14 10535 2 2 16 TYR HD2 H -1.331 -6.311 -7.641 1.00 . B B . 37 TYR HD2 1 1 14 10536 2 2 16 TYR HE1 H -2.007 -10.506 -5.105 1.00 . B B . 37 TYR HE1 1 1 14 10537 2 2 16 TYR HE2 H -1.437 -8.458 -8.823 1.00 . B B . 37 TYR HE2 1 1 14 10538 2 2 16 TYR HH H -1.287 -11.466 -7.201 1.00 . B B . 37 TYR HH 1 1 14 10539 2 2 16 TYR N N -0.624 -4.695 -2.917 1.00 . B B . 37 TYR N 1 1 14 10540 2 2 16 TYR O O 0.861 -7.582 -4.472 1.00 . B B . 37 TYR O 1 1 14 10541 2 2 16 TYR OH O -1.785 -10.821 -7.709 1.00 . B B . 37 TYR OH 1 1 14 10542 2 2 17 LEU C C 3.789 -6.457 -2.753 1.00 . B B . 38 LEU C 1 1 14 10543 2 2 17 LEU CA C 3.070 -6.120 -4.059 1.00 . B B . 38 LEU CA 1 1 14 10544 2 2 17 LEU CB C 3.848 -5.010 -4.779 1.00 . B B . 38 LEU CB 1 1 14 10545 2 2 17 LEU CD1 C 3.684 -2.812 -5.949 1.00 . B B . 38 LEU CD1 1 1 14 10546 2 2 17 LEU CD2 C 2.087 -4.641 -6.515 1.00 . B B . 38 LEU CD2 1 1 14 10547 2 2 17 LEU CG C 2.887 -3.991 -5.388 1.00 . B B . 38 LEU CG 1 1 14 10548 2 2 17 LEU H H 1.514 -4.799 -3.355 1.00 . B B . 38 LEU H 1 1 14 10549 2 2 17 LEU HA H 3.032 -6.998 -4.682 1.00 . B B . 38 LEU HA 1 1 14 10550 2 2 17 LEU HB2 H 4.494 -4.511 -4.072 1.00 . B B . 38 LEU HB2 1 1 14 10551 2 2 17 LEU HB3 H 4.449 -5.446 -5.564 1.00 . B B . 38 LEU HB3 1 1 14 10552 2 2 17 LEU HD11 H 4.396 -2.475 -5.210 1.00 . B B . 38 LEU HD11 1 1 14 10553 2 2 17 LEU HD12 H 3.009 -2.005 -6.193 1.00 . B B . 38 LEU HD12 1 1 14 10554 2 2 17 LEU HD13 H 4.210 -3.124 -6.839 1.00 . B B . 38 LEU HD13 1 1 14 10555 2 2 17 LEU HD21 H 1.430 -5.390 -6.101 1.00 . B B . 38 LEU HD21 1 1 14 10556 2 2 17 LEU HD22 H 2.764 -5.101 -7.218 1.00 . B B . 38 LEU HD22 1 1 14 10557 2 2 17 LEU HD23 H 1.501 -3.886 -7.018 1.00 . B B . 38 LEU HD23 1 1 14 10558 2 2 17 LEU HG H 2.215 -3.641 -4.625 1.00 . B B . 38 LEU HG 1 1 14 10559 2 2 17 LEU N N 1.678 -5.681 -3.747 1.00 . B B . 38 LEU N 1 1 14 10560 2 2 17 LEU O O 4.387 -7.506 -2.611 1.00 . B B . 38 LEU O 1 1 14 10561 2 2 18 VAL C C 3.732 -6.972 0.232 1.00 . B B . 39 VAL C 1 1 14 10562 2 2 18 VAL CA C 4.423 -5.819 -0.502 1.00 . B B . 39 VAL CA 1 1 14 10563 2 2 18 VAL CB C 4.365 -4.546 0.352 1.00 . B B . 39 VAL CB 1 1 14 10564 2 2 18 VAL CG1 C 4.587 -3.328 -0.545 1.00 . B B . 39 VAL CG1 1 1 14 10565 2 2 18 VAL CG2 C 2.996 -4.430 1.027 1.00 . B B . 39 VAL CG2 1 1 14 10566 2 2 18 VAL H H 3.255 -4.727 -1.942 1.00 . B B . 39 VAL H 1 1 14 10567 2 2 18 VAL HA H 5.455 -6.080 -0.685 1.00 . B B . 39 VAL HA 1 1 14 10568 2 2 18 VAL HB H 5.137 -4.582 1.105 1.00 . B B . 39 VAL HB 1 1 14 10569 2 2 18 VAL HG11 H 5.013 -2.525 0.038 1.00 . B B . 39 VAL HG11 1 1 14 10570 2 2 18 VAL HG12 H 3.641 -3.009 -0.959 1.00 . B B . 39 VAL HG12 1 1 14 10571 2 2 18 VAL HG13 H 5.262 -3.589 -1.346 1.00 . B B . 39 VAL HG13 1 1 14 10572 2 2 18 VAL HG21 H 3.051 -4.842 2.024 1.00 . B B . 39 VAL HG21 1 1 14 10573 2 2 18 VAL HG22 H 2.264 -4.975 0.451 1.00 . B B . 39 VAL HG22 1 1 14 10574 2 2 18 VAL HG23 H 2.710 -3.390 1.083 1.00 . B B . 39 VAL HG23 1 1 14 10575 2 2 18 VAL N N 3.740 -5.567 -1.800 1.00 . B B . 39 VAL N 1 1 14 10576 2 2 18 VAL O O 4.329 -7.650 1.044 1.00 . B B . 39 VAL O 1 1 14 10577 2 2 19 CYS C C 1.172 -9.262 -0.381 1.00 . B B . 40 CYS C 1 1 14 10578 2 2 19 CYS CA C 1.751 -8.294 0.650 1.00 . B B . 40 CYS CA 1 1 14 10579 2 2 19 CYS CB C 0.609 -7.708 1.488 1.00 . B B . 40 CYS CB 1 1 14 10580 2 2 19 CYS H H 2.009 -6.630 -0.694 1.00 . B B . 40 CYS H 1 1 14 10581 2 2 19 CYS HA H 2.432 -8.825 1.295 1.00 . B B . 40 CYS HA 1 1 14 10582 2 2 19 CYS HB2 H 0.140 -6.902 0.943 1.00 . B B . 40 CYS HB2 1 1 14 10583 2 2 19 CYS HB3 H -0.121 -8.479 1.686 1.00 . B B . 40 CYS HB3 1 1 14 10584 2 2 19 CYS N N 2.476 -7.192 -0.040 1.00 . B B . 40 CYS N 1 1 14 10585 2 2 19 CYS O O 0.879 -10.399 -0.067 1.00 . B B . 40 CYS O 1 1 14 10586 2 2 19 CYS SG S 1.260 -7.076 3.057 1.00 . B B . 40 CYS SG 1 1 14 10587 2 2 20 GLY C C -0.705 -10.550 -2.019 1.00 . B B . 41 GLY C 1 1 14 10588 2 2 20 GLY CA C 0.423 -9.734 -2.644 1.00 . B B . 41 GLY CA 1 1 14 10589 2 2 20 GLY H H 1.241 -7.904 -1.836 1.00 . B B . 41 GLY H 1 1 14 10590 2 2 20 GLY HA2 H 0.033 -9.149 -3.461 1.00 . B B . 41 GLY HA2 1 1 14 10591 2 2 20 GLY HA3 H 1.188 -10.401 -3.007 1.00 . B B . 41 GLY HA3 1 1 14 10592 2 2 20 GLY N N 0.998 -8.826 -1.604 1.00 . B B . 41 GLY N 1 1 14 10593 2 2 20 GLY O O -0.959 -11.677 -2.395 1.00 . B B . 41 GLY O 1 1 14 10594 2 2 21 GLU C C -1.934 -12.111 0.018 1.00 . B B . 42 GLU C 1 1 14 10595 2 2 21 GLU CA C -2.454 -10.732 -0.358 1.00 . B B . 42 GLU CA 1 1 14 10596 2 2 21 GLU CB C -3.670 -10.876 -1.265 1.00 . B B . 42 GLU CB 1 1 14 10597 2 2 21 GLU CD C -5.210 -10.440 0.653 1.00 . B B . 42 GLU CD 1 1 14 10598 2 2 21 GLU CG C -4.824 -11.440 -0.439 1.00 . B B . 42 GLU CG 1 1 14 10599 2 2 21 GLU H H -1.126 -9.094 -0.739 1.00 . B B . 42 GLU H 1 1 14 10600 2 2 21 GLU HA H -2.736 -10.201 0.539 1.00 . B B . 42 GLU HA 1 1 14 10601 2 2 21 GLU HB2 H -3.943 -9.909 -1.664 1.00 . B B . 42 GLU HB2 1 1 14 10602 2 2 21 GLU HB3 H -3.443 -11.553 -2.074 1.00 . B B . 42 GLU HB3 1 1 14 10603 2 2 21 GLU HG2 H -5.669 -11.619 -1.077 1.00 . B B . 42 GLU HG2 1 1 14 10604 2 2 21 GLU HG3 H -4.518 -12.367 0.020 1.00 . B B . 42 GLU HG3 1 1 14 10605 2 2 21 GLU N N -1.365 -9.993 -1.041 1.00 . B B . 42 GLU N 1 1 14 10606 2 2 21 GLU O O -1.999 -13.048 -0.752 1.00 . B B . 42 GLU O 1 1 14 10607 2 2 21 GLU OE1 O -5.590 -9.333 0.309 1.00 . B B . 42 GLU OE1 1 1 14 10608 2 2 21 GLU OE2 O -5.121 -10.800 1.816 1.00 . B B . 42 GLU OE2 1 1 14 10609 2 2 22 ARG C C -2.009 -14.460 2.052 1.00 . B B . 43 ARG C 1 1 14 10610 2 2 22 ARG CA C -0.862 -13.531 1.646 1.00 . B B . 43 ARG CA 1 1 14 10611 2 2 22 ARG CB C 0.037 -13.251 2.837 1.00 . B B . 43 ARG CB 1 1 14 10612 2 2 22 ARG CD C 1.980 -13.935 1.424 1.00 . B B . 43 ARG CD 1 1 14 10613 2 2 22 ARG CG C 1.287 -14.128 2.774 1.00 . B B . 43 ARG CG 1 1 14 10614 2 2 22 ARG CZ C 2.943 -15.548 -0.107 1.00 . B B . 43 ARG CZ 1 1 14 10615 2 2 22 ARG H H -1.360 -11.461 1.794 1.00 . B B . 43 ARG H 1 1 14 10616 2 2 22 ARG HA H -0.287 -13.983 0.853 1.00 . B B . 43 ARG HA 1 1 14 10617 2 2 22 ARG HB2 H 0.324 -12.213 2.812 1.00 . B B . 43 ARG HB2 1 1 14 10618 2 2 22 ARG HB3 H -0.505 -13.446 3.743 1.00 . B B . 43 ARG HB3 1 1 14 10619 2 2 22 ARG HD2 H 1.469 -13.165 0.865 1.00 . B B . 43 ARG HD2 1 1 14 10620 2 2 22 ARG HD3 H 3.007 -13.642 1.584 1.00 . B B . 43 ARG HD3 1 1 14 10621 2 2 22 ARG HE H 1.161 -15.802 0.730 1.00 . B B . 43 ARG HE 1 1 14 10622 2 2 22 ARG HG2 H 1.964 -13.844 3.568 1.00 . B B . 43 ARG HG2 1 1 14 10623 2 2 22 ARG HG3 H 1.009 -15.163 2.889 1.00 . B B . 43 ARG HG3 1 1 14 10624 2 2 22 ARG HH11 H 3.417 -13.659 -0.573 1.00 . B B . 43 ARG HH11 1 1 14 10625 2 2 22 ARG HH12 H 4.415 -14.881 -1.288 1.00 . B B . 43 ARG HH12 1 1 14 10626 2 2 22 ARG HH21 H 2.698 -17.514 0.176 1.00 . B B . 43 ARG HH21 1 1 14 10627 2 2 22 ARG HH22 H 4.008 -17.064 -0.864 1.00 . B B . 43 ARG HH22 1 1 14 10628 2 2 22 ARG N N -1.407 -12.234 1.196 1.00 . B B . 43 ARG N 1 1 14 10629 2 2 22 ARG NE N 1.940 -15.213 0.659 1.00 . B B . 43 ARG NE 1 1 14 10630 2 2 22 ARG NH1 N 3.646 -14.624 -0.702 1.00 . B B . 43 ARG NH1 1 1 14 10631 2 2 22 ARG NH2 N 3.239 -16.807 -0.278 1.00 . B B . 43 ARG NH2 1 1 14 10632 2 2 22 ARG O O -2.019 -15.021 3.130 1.00 . B B . 43 ARG O 1 1 14 10633 2 2 23 GLY C C -5.357 -15.108 0.694 1.00 . B B . 44 GLY C 1 1 14 10634 2 2 23 GLY CA C -4.128 -15.516 1.516 1.00 . B B . 44 GLY CA 1 1 14 10635 2 2 23 GLY H H -2.941 -14.160 0.333 1.00 . B B . 44 GLY H 1 1 14 10636 2 2 23 GLY HA2 H -3.864 -16.538 1.287 1.00 . B B . 44 GLY HA2 1 1 14 10637 2 2 23 GLY HA3 H -4.360 -15.433 2.567 1.00 . B B . 44 GLY HA3 1 1 14 10638 2 2 23 GLY N N -2.975 -14.624 1.192 1.00 . B B . 44 GLY N 1 1 14 10639 2 2 23 GLY O O -6.367 -14.701 1.234 1.00 . B B . 44 GLY O 1 1 14 10640 2 2 24 GLY C C -6.148 -13.551 -2.219 1.00 . B B . 45 GLY C 1 1 14 10641 2 2 24 GLY CA C -6.457 -14.842 -1.456 1.00 . B B . 45 GLY CA 1 1 14 10642 2 2 24 GLY H H -4.465 -15.554 -1.027 1.00 . B B . 45 GLY H 1 1 14 10643 2 2 24 GLY HA2 H -6.663 -15.637 -2.159 1.00 . B B . 45 GLY HA2 1 1 14 10644 2 2 24 GLY HA3 H -7.321 -14.686 -0.827 1.00 . B B . 45 GLY HA3 1 1 14 10645 2 2 24 GLY N N -5.286 -15.219 -0.608 1.00 . B B . 45 GLY N 1 1 14 10646 2 2 24 GLY O O -5.043 -13.341 -2.678 1.00 . B B . 45 GLY O 1 1 14 10647 2 2 25 PHE C C -7.138 -10.222 -2.125 1.00 . B B . 46 PHE C 1 1 14 10648 2 2 25 PHE CA C -6.872 -11.394 -3.077 1.00 . B B . 46 PHE CA 1 1 14 10649 2 2 25 PHE CB C -7.807 -11.302 -4.285 1.00 . B B . 46 PHE CB 1 1 14 10650 2 2 25 PHE CD1 C -9.979 -11.470 -2.868 1.00 . B B . 46 PHE CD1 1 1 14 10651 2 2 25 PHE CD2 C -9.628 -13.122 -4.624 1.00 . B B . 46 PHE CD2 1 1 14 10652 2 2 25 PHE CE1 C -11.195 -12.085 -2.548 1.00 . B B . 46 PHE CE1 1 1 14 10653 2 2 25 PHE CE2 C -10.847 -13.723 -4.286 1.00 . B B . 46 PHE CE2 1 1 14 10654 2 2 25 PHE CG C -9.166 -11.977 -3.922 1.00 . B B . 46 PHE CG 1 1 14 10655 2 2 25 PHE CZ C -11.627 -13.205 -3.254 1.00 . B B . 46 PHE CZ 1 1 14 10656 2 2 25 PHE H H -7.997 -12.864 -1.968 1.00 . B B . 46 PHE H 1 1 14 10657 2 2 25 PHE HA H -5.846 -11.359 -3.411 1.00 . B B . 46 PHE HA 1 1 14 10658 2 2 25 PHE HB2 H -7.945 -10.238 -4.542 1.00 . B B . 46 PHE HB2 1 1 14 10659 2 2 25 PHE HB3 H -7.334 -11.812 -5.136 1.00 . B B . 46 PHE HB3 1 1 14 10660 2 2 25 PHE HD1 H -9.678 -10.614 -2.298 1.00 . B B . 46 PHE HD1 1 1 14 10661 2 2 25 PHE HD2 H -9.054 -13.552 -5.412 1.00 . B B . 46 PHE HD2 1 1 14 10662 2 2 25 PHE HE1 H -11.800 -11.689 -1.746 1.00 . B B . 46 PHE HE1 1 1 14 10663 2 2 25 PHE HE2 H -11.187 -14.592 -4.831 1.00 . B B . 46 PHE HE2 1 1 14 10664 2 2 25 PHE HZ H -12.566 -13.673 -3.000 1.00 . B B . 46 PHE HZ 1 1 14 10665 2 2 25 PHE N N -7.114 -12.678 -2.352 1.00 . B B . 46 PHE N 1 1 14 10666 2 2 25 PHE O O -7.510 -10.421 -0.985 1.00 . B B . 46 PHE O 1 1 14 10667 2 2 26 TYR C C -8.429 -8.063 -0.841 1.00 . B B . 47 TYR C 1 1 14 10668 2 2 26 TYR CA C -7.168 -7.833 -1.678 1.00 . B B . 47 TYR CA 1 1 14 10669 2 2 26 TYR CB C -7.320 -6.564 -2.521 1.00 . B B . 47 TYR CB 1 1 14 10670 2 2 26 TYR CD1 C -5.133 -5.671 -1.410 1.00 . B B . 47 TYR CD1 1 1 14 10671 2 2 26 TYR CD2 C -6.975 -4.109 -1.743 1.00 . B B . 47 TYR CD2 1 1 14 10672 2 2 26 TYR CE1 C -4.380 -4.638 -0.835 1.00 . B B . 47 TYR CE1 1 1 14 10673 2 2 26 TYR CE2 C -6.203 -3.095 -1.166 1.00 . B B . 47 TYR CE2 1 1 14 10674 2 2 26 TYR CG C -6.460 -5.424 -1.882 1.00 . B B . 47 TYR CG 1 1 14 10675 2 2 26 TYR CZ C -4.914 -3.357 -0.716 1.00 . B B . 47 TYR CZ 1 1 14 10676 2 2 26 TYR H H -6.626 -8.870 -3.491 1.00 . B B . 47 TYR H 1 1 14 10677 2 2 26 TYR HA H -6.328 -7.719 -1.021 1.00 . B B . 47 TYR HA 1 1 14 10678 2 2 26 TYR HB2 H -6.986 -6.787 -3.545 1.00 . B B . 47 TYR HB2 1 1 14 10679 2 2 26 TYR HB3 H -8.381 -6.279 -2.550 1.00 . B B . 47 TYR HB3 1 1 14 10680 2 2 26 TYR HD1 H -4.687 -6.643 -1.479 1.00 . B B . 47 TYR HD1 1 1 14 10681 2 2 26 TYR HD2 H -7.958 -3.869 -2.069 1.00 . B B . 47 TYR HD2 1 1 14 10682 2 2 26 TYR HE1 H -3.378 -4.836 -0.483 1.00 . B B . 47 TYR HE1 1 1 14 10683 2 2 26 TYR HE2 H -6.611 -2.099 -1.071 1.00 . B B . 47 TYR HE2 1 1 14 10684 2 2 26 TYR HH H -4.682 -1.538 -0.190 1.00 . B B . 47 TYR HH 1 1 14 10685 2 2 26 TYR N N -6.937 -9.008 -2.572 1.00 . B B . 47 TYR N 1 1 14 10686 2 2 26 TYR O O -8.350 -8.366 0.329 1.00 . B B . 47 TYR O 1 1 14 10687 2 2 26 TYR OH O -4.167 -2.347 -0.146 1.00 . B B . 47 TYR OH 1 1 14 10688 2 2 27 THR C C -11.301 -6.839 -0.017 1.00 . B B . 48 THR C 1 1 14 10689 2 2 27 THR CA C -10.882 -8.122 -0.728 1.00 . B B . 48 THR CA 1 1 14 10690 2 2 27 THR CB C -10.770 -9.240 0.309 1.00 . B B . 48 THR CB 1 1 14 10691 2 2 27 THR CG2 C -12.126 -9.418 0.978 1.00 . B B . 48 THR CG2 1 1 14 10692 2 2 27 THR H H -9.584 -7.667 -2.384 1.00 . B B . 48 THR H 1 1 14 10693 2 2 27 THR HA H -11.640 -8.385 -1.450 1.00 . B B . 48 THR HA 1 1 14 10694 2 2 27 THR HB H -10.048 -8.975 1.060 1.00 . B B . 48 THR HB 1 1 14 10695 2 2 27 THR HG1 H -9.516 -10.693 0.006 1.00 . B B . 48 THR HG1 1 1 14 10696 2 2 27 THR HG21 H -12.393 -8.504 1.490 1.00 . B B . 48 THR HG21 1 1 14 10697 2 2 27 THR HG22 H -12.072 -10.227 1.689 1.00 . B B . 48 THR HG22 1 1 14 10698 2 2 27 THR HG23 H -12.868 -9.641 0.228 1.00 . B B . 48 THR HG23 1 1 14 10699 2 2 27 THR N N -9.578 -7.916 -1.444 1.00 . B B . 48 THR N 1 1 14 10700 2 2 27 THR O O -12.461 -6.628 0.278 1.00 . B B . 48 THR O 1 1 14 10701 2 2 27 THR OG1 O -10.383 -10.449 -0.326 1.00 . B B . 48 THR OG1 1 1 14 10702 2 2 28 LYS C C -9.401 -3.947 1.228 1.00 . B B . 49 LYS C 1 1 14 10703 2 2 28 LYS CA C -10.696 -4.720 0.963 1.00 . B B . 49 LYS CA 1 1 14 10704 2 2 28 LYS CB C -11.381 -5.035 2.294 1.00 . B B . 49 LYS CB 1 1 14 10705 2 2 28 LYS CD C -12.638 -3.944 4.158 1.00 . B B . 49 LYS CD 1 1 14 10706 2 2 28 LYS CE C -14.068 -3.455 4.400 1.00 . B B . 49 LYS CE 1 1 14 10707 2 2 28 LYS CG C -12.330 -3.894 2.661 1.00 . B B . 49 LYS CG 1 1 14 10708 2 2 28 LYS H H -9.447 -6.189 0.017 1.00 . B B . 49 LYS H 1 1 14 10709 2 2 28 LYS HA H -11.359 -4.134 0.347 1.00 . B B . 49 LYS HA 1 1 14 10710 2 2 28 LYS HB2 H -11.940 -5.956 2.203 1.00 . B B . 49 LYS HB2 1 1 14 10711 2 2 28 LYS HB3 H -10.634 -5.143 3.067 1.00 . B B . 49 LYS HB3 1 1 14 10712 2 2 28 LYS HD2 H -12.539 -4.959 4.513 1.00 . B B . 49 LYS HD2 1 1 14 10713 2 2 28 LYS HD3 H -11.948 -3.307 4.690 1.00 . B B . 49 LYS HD3 1 1 14 10714 2 2 28 LYS HE2 H -14.470 -3.052 3.482 1.00 . B B . 49 LYS HE2 1 1 14 10715 2 2 28 LYS HE3 H -14.680 -4.282 4.728 1.00 . B B . 49 LYS HE3 1 1 14 10716 2 2 28 LYS HG2 H -11.866 -2.948 2.419 1.00 . B B . 49 LYS HG2 1 1 14 10717 2 2 28 LYS HG3 H -13.249 -3.997 2.103 1.00 . B B . 49 LYS HG3 1 1 14 10718 2 2 28 LYS HZ1 H -14.993 -2.354 5.906 1.00 . B B . 49 LYS HZ1 1 1 14 10719 2 2 28 LYS HZ2 H -13.850 -1.476 5.008 1.00 . B B . 49 LYS HZ2 1 1 14 10720 2 2 28 LYS HZ3 H -13.337 -2.615 6.160 1.00 . B B . 49 LYS HZ3 1 1 14 10721 2 2 28 LYS N N -10.368 -5.990 0.264 1.00 . B B . 49 LYS N 1 1 14 10722 2 2 28 LYS NZ N -14.062 -2.395 5.448 1.00 . B B . 49 LYS NZ 1 1 14 10723 2 2 28 LYS O O -8.455 -4.498 1.754 1.00 . B B . 49 LYS O 1 1 14 10724 2 2 29 PRO C C -8.109 -1.381 2.495 1.00 . B B . 50 PRO C 1 1 14 10725 2 2 29 PRO CA C -8.218 -1.832 1.038 1.00 . B B . 50 PRO CA 1 1 14 10726 2 2 29 PRO CB C -8.491 -0.649 0.110 1.00 . B B . 50 PRO CB 1 1 14 10727 2 2 29 PRO CD C -10.538 -2.024 0.216 1.00 . B B . 50 PRO CD 1 1 14 10728 2 2 29 PRO CG C -10.020 -0.613 -0.108 1.00 . B B . 50 PRO CG 1 1 14 10729 2 2 29 PRO HA H -7.327 -2.342 0.729 1.00 . B B . 50 PRO HA 1 1 14 10730 2 2 29 PRO HB2 H -8.155 0.268 0.571 1.00 . B B . 50 PRO HB2 1 1 14 10731 2 2 29 PRO HB3 H -7.994 -0.798 -0.836 1.00 . B B . 50 PRO HB3 1 1 14 10732 2 2 29 PRO HD2 H -11.372 -1.971 0.898 1.00 . B B . 50 PRO HD2 1 1 14 10733 2 2 29 PRO HD3 H -10.813 -2.542 -0.689 1.00 . B B . 50 PRO HD3 1 1 14 10734 2 2 29 PRO HG2 H -10.471 0.113 0.556 1.00 . B B . 50 PRO HG2 1 1 14 10735 2 2 29 PRO HG3 H -10.244 -0.368 -1.134 1.00 . B B . 50 PRO HG3 1 1 14 10736 2 2 29 PRO N N -9.390 -2.695 0.853 1.00 . B B . 50 PRO N 1 1 14 10737 2 2 29 PRO O O -9.100 -1.133 3.155 1.00 . B B . 50 PRO O 1 1 14 10738 2 2 30 THR C C -5.275 -0.498 4.677 1.00 . B B . 51 THR C 1 1 14 10739 2 2 30 THR CA C -6.742 -0.849 4.421 1.00 . B B . 51 THR CA 1 1 14 10740 2 2 30 THR CB C -7.162 -1.989 5.353 1.00 . B B . 51 THR CB 1 1 14 10741 2 2 30 THR CG2 C -8.419 -1.583 6.122 1.00 . B B . 51 THR CG2 1 1 14 10742 2 2 30 THR H H -6.128 -1.488 2.457 1.00 . B B . 51 THR H 1 1 14 10743 2 2 30 THR HA H -7.359 0.017 4.612 1.00 . B B . 51 THR HA 1 1 14 10744 2 2 30 THR HB H -6.368 -2.195 6.053 1.00 . B B . 51 THR HB 1 1 14 10745 2 2 30 THR HG1 H -8.020 -3.715 5.094 1.00 . B B . 51 THR HG1 1 1 14 10746 2 2 30 THR HG21 H -8.370 -1.979 7.126 1.00 . B B . 51 THR HG21 1 1 14 10747 2 2 30 THR HG22 H -9.291 -1.978 5.622 1.00 . B B . 51 THR HG22 1 1 14 10748 2 2 30 THR HG23 H -8.484 -0.507 6.162 1.00 . B B . 51 THR HG23 1 1 14 10749 2 2 30 THR N N -6.913 -1.279 3.005 1.00 . B B . 51 THR N 1 1 14 10750 2 2 30 THR O O -4.988 0.016 5.745 1.00 . B B . 51 THR O 1 1 14 10751 2 2 30 THR OXT O -4.465 -0.749 3.800 1.00 . B B . 51 THR OXT 1 1 14 10752 2 2 30 THR OG1 O -7.432 -3.153 4.584 1.00 . B B . 51 THR OG1 1 1 15 10753 1 1 1 GLY C C 0.011 8.826 5.599 1.00 . A A . 1 GLY C 1 1 15 10754 1 1 1 GLY CA C -0.475 9.947 6.453 1.00 . A A . 1 GLY CA 1 1 15 10755 1 1 1 GLY H1 H -2.439 9.221 6.770 1.00 . A A . 1 GLY H1 1 1 15 10756 1 1 1 GLY H2 H -2.377 10.622 5.810 1.00 . A A . 1 GLY H2 1 1 15 10757 1 1 1 GLY H3 H -2.146 10.731 7.489 1.00 . A A . 1 GLY H3 1 1 15 10758 1 1 1 GLY HA2 H -0.133 10.505 5.730 1.00 . A A . 1 GLY HA2 1 1 15 10759 1 1 1 GLY HA3 H 0.032 10.169 7.481 1.00 . A A . 1 GLY HA3 1 1 15 10760 1 1 1 GLY N N -1.980 10.146 6.646 1.00 . A A . 1 GLY N 1 1 15 10761 1 1 1 GLY O O 1.157 8.430 5.672 1.00 . A A . 1 GLY O 1 1 15 10762 1 1 2 ILE C C -0.218 7.666 2.462 1.00 . A A . 2 ILE C 1 1 15 10763 1 1 2 ILE CA C -0.407 7.159 3.894 1.00 . A A . 2 ILE CA 1 1 15 10764 1 1 2 ILE CB C -1.472 6.060 3.910 1.00 . A A . 2 ILE CB 1 1 15 10765 1 1 2 ILE CD1 C -0.336 4.529 5.538 1.00 . A A . 2 ILE CD1 1 1 15 10766 1 1 2 ILE CG1 C -1.544 5.443 5.312 1.00 . A A . 2 ILE CG1 1 1 15 10767 1 1 2 ILE CG2 C -1.108 4.979 2.887 1.00 . A A . 2 ILE CG2 1 1 15 10768 1 1 2 ILE H H -1.760 8.615 4.725 1.00 . A A . 2 ILE H 1 1 15 10769 1 1 2 ILE HA H 0.528 6.758 4.259 1.00 . A A . 2 ILE HA 1 1 15 10770 1 1 2 ILE HB H -2.432 6.488 3.655 1.00 . A A . 2 ILE HB 1 1 15 10771 1 1 2 ILE HD11 H -0.648 3.497 5.464 1.00 . A A . 2 ILE HD11 1 1 15 10772 1 1 2 ILE HD12 H 0.076 4.711 6.519 1.00 . A A . 2 ILE HD12 1 1 15 10773 1 1 2 ILE HD13 H 0.414 4.733 4.788 1.00 . A A . 2 ILE HD13 1 1 15 10774 1 1 2 ILE HG12 H -1.541 6.231 6.051 1.00 . A A . 2 ILE HG12 1 1 15 10775 1 1 2 ILE HG13 H -2.452 4.866 5.406 1.00 . A A . 2 ILE HG13 1 1 15 10776 1 1 2 ILE HG21 H -1.350 5.328 1.895 1.00 . A A . 2 ILE HG21 1 1 15 10777 1 1 2 ILE HG22 H -1.668 4.080 3.099 1.00 . A A . 2 ILE HG22 1 1 15 10778 1 1 2 ILE HG23 H -0.051 4.768 2.947 1.00 . A A . 2 ILE HG23 1 1 15 10779 1 1 2 ILE N N -0.839 8.284 4.770 1.00 . A A . 2 ILE N 1 1 15 10780 1 1 2 ILE O O 0.619 7.179 1.728 1.00 . A A . 2 ILE O 1 1 15 10781 1 1 3 VAL C C 0.242 10.237 0.635 1.00 . A A . 3 VAL C 1 1 15 10782 1 1 3 VAL CA C -0.855 9.169 0.671 1.00 . A A . 3 VAL CA 1 1 15 10783 1 1 3 VAL CB C -2.196 9.777 0.215 1.00 . A A . 3 VAL CB 1 1 15 10784 1 1 3 VAL CG1 C -3.356 9.019 0.863 1.00 . A A . 3 VAL CG1 1 1 15 10785 1 1 3 VAL CG2 C -2.281 11.254 0.625 1.00 . A A . 3 VAL CG2 1 1 15 10786 1 1 3 VAL H H -1.662 9.014 2.663 1.00 . A A . 3 VAL H 1 1 15 10787 1 1 3 VAL HA H -0.584 8.365 0.010 1.00 . A A . 3 VAL HA 1 1 15 10788 1 1 3 VAL HB H -2.275 9.697 -0.860 1.00 . A A . 3 VAL HB 1 1 15 10789 1 1 3 VAL HG11 H -2.982 8.145 1.371 1.00 . A A . 3 VAL HG11 1 1 15 10790 1 1 3 VAL HG12 H -4.059 8.718 0.100 1.00 . A A . 3 VAL HG12 1 1 15 10791 1 1 3 VAL HG13 H -3.852 9.664 1.573 1.00 . A A . 3 VAL HG13 1 1 15 10792 1 1 3 VAL HG21 H -3.224 11.666 0.296 1.00 . A A . 3 VAL HG21 1 1 15 10793 1 1 3 VAL HG22 H -1.469 11.802 0.169 1.00 . A A . 3 VAL HG22 1 1 15 10794 1 1 3 VAL HG23 H -2.208 11.332 1.700 1.00 . A A . 3 VAL HG23 1 1 15 10795 1 1 3 VAL N N -0.991 8.638 2.057 1.00 . A A . 3 VAL N 1 1 15 10796 1 1 3 VAL O O 1.029 10.310 -0.287 1.00 . A A . 3 VAL O 1 1 15 10797 1 1 4 GLU C C 2.687 11.570 1.919 1.00 . A A . 4 GLU C 1 1 15 10798 1 1 4 GLU CA C 1.300 12.158 1.667 1.00 . A A . 4 GLU CA 1 1 15 10799 1 1 4 GLU CB C 0.953 13.140 2.787 1.00 . A A . 4 GLU CB 1 1 15 10800 1 1 4 GLU CD C -0.829 14.778 3.400 1.00 . A A . 4 GLU CD 1 1 15 10801 1 1 4 GLU CG C -0.553 13.407 2.782 1.00 . A A . 4 GLU CG 1 1 15 10802 1 1 4 GLU H H -0.379 10.992 2.349 1.00 . A A . 4 GLU H 1 1 15 10803 1 1 4 GLU HA H 1.300 12.678 0.723 1.00 . A A . 4 GLU HA 1 1 15 10804 1 1 4 GLU HB2 H 1.241 12.716 3.739 1.00 . A A . 4 GLU HB2 1 1 15 10805 1 1 4 GLU HB3 H 1.482 14.067 2.630 1.00 . A A . 4 GLU HB3 1 1 15 10806 1 1 4 GLU HG2 H -0.918 13.388 1.765 1.00 . A A . 4 GLU HG2 1 1 15 10807 1 1 4 GLU HG3 H -1.056 12.646 3.360 1.00 . A A . 4 GLU HG3 1 1 15 10808 1 1 4 GLU N N 0.279 11.072 1.629 1.00 . A A . 4 GLU N 1 1 15 10809 1 1 4 GLU O O 3.694 12.192 1.644 1.00 . A A . 4 GLU O 1 1 15 10810 1 1 4 GLU OE1 O -0.861 14.862 4.616 1.00 . A A . 4 GLU OE1 1 1 15 10811 1 1 4 GLU OE2 O -1.004 15.721 2.646 1.00 . A A . 4 GLU OE2 1 1 15 10812 1 1 5 GLN C C 4.542 8.988 1.470 1.00 . A A . 5 GLN C 1 1 15 10813 1 1 5 GLN CA C 4.082 9.765 2.707 1.00 . A A . 5 GLN CA 1 1 15 10814 1 1 5 GLN CB C 3.981 8.813 3.902 1.00 . A A . 5 GLN CB 1 1 15 10815 1 1 5 GLN CD C 4.882 10.354 5.657 1.00 . A A . 5 GLN CD 1 1 15 10816 1 1 5 GLN CG C 3.641 9.605 5.168 1.00 . A A . 5 GLN CG 1 1 15 10817 1 1 5 GLN H H 1.931 9.893 2.656 1.00 . A A . 5 GLN H 1 1 15 10818 1 1 5 GLN HA H 4.798 10.543 2.927 1.00 . A A . 5 GLN HA 1 1 15 10819 1 1 5 GLN HB2 H 3.208 8.082 3.715 1.00 . A A . 5 GLN HB2 1 1 15 10820 1 1 5 GLN HB3 H 4.926 8.309 4.040 1.00 . A A . 5 GLN HB3 1 1 15 10821 1 1 5 GLN HE21 H 6.075 8.775 5.502 1.00 . A A . 5 GLN HE21 1 1 15 10822 1 1 5 GLN HE22 H 6.820 10.194 6.059 1.00 . A A . 5 GLN HE22 1 1 15 10823 1 1 5 GLN HG2 H 2.855 10.314 4.948 1.00 . A A . 5 GLN HG2 1 1 15 10824 1 1 5 GLN HG3 H 3.308 8.926 5.938 1.00 . A A . 5 GLN HG3 1 1 15 10825 1 1 5 GLN N N 2.753 10.380 2.441 1.00 . A A . 5 GLN N 1 1 15 10826 1 1 5 GLN NE2 N 6.020 9.722 5.747 1.00 . A A . 5 GLN NE2 1 1 15 10827 1 1 5 GLN O O 5.717 8.933 1.167 1.00 . A A . 5 GLN O 1 1 15 10828 1 1 5 GLN OE1 O 4.815 11.528 5.965 1.00 . A A . 5 GLN OE1 1 1 15 10829 1 1 6 CYS C C 3.662 8.370 -1.727 1.00 . A A . 6 CYS C 1 1 15 10830 1 1 6 CYS CA C 4.037 7.608 -0.452 1.00 . A A . 6 CYS CA 1 1 15 10831 1 1 6 CYS CB C 3.342 6.244 -0.446 1.00 . A A . 6 CYS CB 1 1 15 10832 1 1 6 CYS H H 2.687 8.431 1.015 1.00 . A A . 6 CYS H 1 1 15 10833 1 1 6 CYS HA H 5.106 7.458 -0.433 1.00 . A A . 6 CYS HA 1 1 15 10834 1 1 6 CYS HB2 H 2.280 6.374 -0.596 1.00 . A A . 6 CYS HB2 1 1 15 10835 1 1 6 CYS HB3 H 3.745 5.632 -1.240 1.00 . A A . 6 CYS HB3 1 1 15 10836 1 1 6 CYS N N 3.631 8.382 0.756 1.00 . A A . 6 CYS N 1 1 15 10837 1 1 6 CYS O O 4.425 8.420 -2.671 1.00 . A A . 6 CYS O 1 1 15 10838 1 1 6 CYS SG S 3.638 5.437 1.145 1.00 . A A . 6 CYS SG 1 1 15 10839 1 1 7 CYS C C 3.044 10.866 -3.246 1.00 . A A . 7 CYS C 1 1 15 10840 1 1 7 CYS CA C 2.099 9.688 -3.012 1.00 . A A . 7 CYS CA 1 1 15 10841 1 1 7 CYS CB C 0.673 10.221 -2.891 1.00 . A A . 7 CYS CB 1 1 15 10842 1 1 7 CYS H H 1.880 8.900 -1.014 1.00 . A A . 7 CYS H 1 1 15 10843 1 1 7 CYS HA H 2.154 9.011 -3.854 1.00 . A A . 7 CYS HA 1 1 15 10844 1 1 7 CYS HB2 H 0.036 9.462 -2.461 1.00 . A A . 7 CYS HB2 1 1 15 10845 1 1 7 CYS HB3 H 0.666 11.099 -2.264 1.00 . A A . 7 CYS HB3 1 1 15 10846 1 1 7 CYS N N 2.494 8.953 -1.776 1.00 . A A . 7 CYS N 1 1 15 10847 1 1 7 CYS O O 3.121 11.398 -4.334 1.00 . A A . 7 CYS O 1 1 15 10848 1 1 7 CYS SG S 0.080 10.653 -4.548 1.00 . A A . 7 CYS SG 1 1 15 10849 1 1 8 THR C C 6.125 11.878 -2.494 1.00 . A A . 8 THR C 1 1 15 10850 1 1 8 THR CA C 4.701 12.425 -2.429 1.00 . A A . 8 THR CA 1 1 15 10851 1 1 8 THR CB C 4.576 13.404 -1.258 1.00 . A A . 8 THR CB 1 1 15 10852 1 1 8 THR CG2 C 3.098 13.648 -0.950 1.00 . A A . 8 THR CG2 1 1 15 10853 1 1 8 THR H H 3.689 10.844 -1.367 1.00 . A A . 8 THR H 1 1 15 10854 1 1 8 THR HA H 4.469 12.934 -3.353 1.00 . A A . 8 THR HA 1 1 15 10855 1 1 8 THR HB H 5.043 14.341 -1.521 1.00 . A A . 8 THR HB 1 1 15 10856 1 1 8 THR HG1 H 5.899 13.478 0.167 1.00 . A A . 8 THR HG1 1 1 15 10857 1 1 8 THR HG21 H 2.902 13.417 0.087 1.00 . A A . 8 THR HG21 1 1 15 10858 1 1 8 THR HG22 H 2.490 13.016 -1.581 1.00 . A A . 8 THR HG22 1 1 15 10859 1 1 8 THR HG23 H 2.857 14.684 -1.140 1.00 . A A . 8 THR HG23 1 1 15 10860 1 1 8 THR N N 3.763 11.282 -2.241 1.00 . A A . 8 THR N 1 1 15 10861 1 1 8 THR O O 6.946 12.332 -3.267 1.00 . A A . 8 THR O 1 1 15 10862 1 1 8 THR OG1 O 5.220 12.859 -0.114 1.00 . A A . 8 THR OG1 1 1 15 10863 1 1 9 SER C C 7.692 8.902 -2.335 1.00 . A A . 9 SER C 1 1 15 10864 1 1 9 SER CA C 7.774 10.293 -1.706 1.00 . A A . 9 SER CA 1 1 15 10865 1 1 9 SER CB C 8.294 10.189 -0.272 1.00 . A A . 9 SER CB 1 1 15 10866 1 1 9 SER H H 5.731 10.538 -1.088 1.00 . A A . 9 SER H 1 1 15 10867 1 1 9 SER HA H 8.438 10.915 -2.288 1.00 . A A . 9 SER HA 1 1 15 10868 1 1 9 SER HB2 H 7.563 10.597 0.407 1.00 . A A . 9 SER HB2 1 1 15 10869 1 1 9 SER HB3 H 8.469 9.151 -0.025 1.00 . A A . 9 SER HB3 1 1 15 10870 1 1 9 SER HG H 10.232 10.307 -0.168 1.00 . A A . 9 SER HG 1 1 15 10871 1 1 9 SER N N 6.415 10.892 -1.694 1.00 . A A . 9 SER N 1 1 15 10872 1 1 9 SER O O 6.795 8.613 -3.102 1.00 . A A . 9 SER O 1 1 15 10873 1 1 9 SER OG O 9.502 10.929 -0.157 1.00 . A A . 9 SER OG 1 1 15 10874 1 1 10 ILE C C 8.706 5.627 -1.510 1.00 . A A . 10 ILE C 1 1 15 10875 1 1 10 ILE CA C 8.571 6.671 -2.618 1.00 . A A . 10 ILE CA 1 1 15 10876 1 1 10 ILE CB C 9.718 6.516 -3.614 1.00 . A A . 10 ILE CB 1 1 15 10877 1 1 10 ILE CD1 C 8.599 8.025 -5.265 1.00 . A A . 10 ILE CD1 1 1 15 10878 1 1 10 ILE CG1 C 9.861 7.805 -4.427 1.00 . A A . 10 ILE CG1 1 1 15 10879 1 1 10 ILE CG2 C 9.420 5.351 -4.556 1.00 . A A . 10 ILE CG2 1 1 15 10880 1 1 10 ILE H H 9.334 8.281 -1.408 1.00 . A A . 10 ILE H 1 1 15 10881 1 1 10 ILE HA H 7.630 6.532 -3.130 1.00 . A A . 10 ILE HA 1 1 15 10882 1 1 10 ILE HB H 10.636 6.321 -3.078 1.00 . A A . 10 ILE HB 1 1 15 10883 1 1 10 ILE HD11 H 7.935 7.182 -5.145 1.00 . A A . 10 ILE HD11 1 1 15 10884 1 1 10 ILE HD12 H 8.870 8.125 -6.306 1.00 . A A . 10 ILE HD12 1 1 15 10885 1 1 10 ILE HD13 H 8.100 8.925 -4.935 1.00 . A A . 10 ILE HD13 1 1 15 10886 1 1 10 ILE HG12 H 9.998 8.640 -3.755 1.00 . A A . 10 ILE HG12 1 1 15 10887 1 1 10 ILE HG13 H 10.716 7.724 -5.081 1.00 . A A . 10 ILE HG13 1 1 15 10888 1 1 10 ILE HG21 H 9.813 5.573 -5.537 1.00 . A A . 10 ILE HG21 1 1 15 10889 1 1 10 ILE HG22 H 8.352 5.205 -4.620 1.00 . A A . 10 ILE HG22 1 1 15 10890 1 1 10 ILE HG23 H 9.885 4.453 -4.176 1.00 . A A . 10 ILE HG23 1 1 15 10891 1 1 10 ILE N N 8.614 8.036 -2.025 1.00 . A A . 10 ILE N 1 1 15 10892 1 1 10 ILE O O 9.780 5.125 -1.246 1.00 . A A . 10 ILE O 1 1 15 10893 1 1 11 CYS C C 8.215 2.963 -0.329 1.00 . A A . 11 CYS C 1 1 15 10894 1 1 11 CYS CA C 7.696 4.286 0.231 1.00 . A A . 11 CYS CA 1 1 15 10895 1 1 11 CYS CB C 6.303 4.060 0.822 1.00 . A A . 11 CYS CB 1 1 15 10896 1 1 11 CYS H H 6.767 5.713 -1.087 1.00 . A A . 11 CYS H 1 1 15 10897 1 1 11 CYS HA H 8.362 4.637 1.004 1.00 . A A . 11 CYS HA 1 1 15 10898 1 1 11 CYS HB2 H 5.651 3.659 0.061 1.00 . A A . 11 CYS HB2 1 1 15 10899 1 1 11 CYS HB3 H 6.372 3.361 1.643 1.00 . A A . 11 CYS HB3 1 1 15 10900 1 1 11 CYS N N 7.625 5.296 -0.859 1.00 . A A . 11 CYS N 1 1 15 10901 1 1 11 CYS O O 8.341 2.786 -1.524 1.00 . A A . 11 CYS O 1 1 15 10902 1 1 11 CYS SG S 5.630 5.627 1.423 1.00 . A A . 11 CYS SG 1 1 15 10903 1 1 12 SER C C 7.955 -0.354 0.371 1.00 . A A . 12 SER C 1 1 15 10904 1 1 12 SER CA C 9.006 0.711 0.058 1.00 . A A . 12 SER CA 1 1 15 10905 1 1 12 SER CB C 10.311 0.374 0.780 1.00 . A A . 12 SER CB 1 1 15 10906 1 1 12 SER H H 8.388 2.193 1.489 1.00 . A A . 12 SER H 1 1 15 10907 1 1 12 SER HA H 9.178 0.749 -1.007 1.00 . A A . 12 SER HA 1 1 15 10908 1 1 12 SER HB2 H 10.736 -0.522 0.360 1.00 . A A . 12 SER HB2 1 1 15 10909 1 1 12 SER HB3 H 11.009 1.192 0.659 1.00 . A A . 12 SER HB3 1 1 15 10910 1 1 12 SER HG H 10.862 0.287 2.644 1.00 . A A . 12 SER HG 1 1 15 10911 1 1 12 SER N N 8.506 2.029 0.530 1.00 . A A . 12 SER N 1 1 15 10912 1 1 12 SER O O 7.273 -0.283 1.374 1.00 . A A . 12 SER O 1 1 15 10913 1 1 12 SER OG O 10.042 0.164 2.160 1.00 . A A . 12 SER OG 1 1 15 10914 1 1 13 LEU C C 6.867 -2.801 1.257 1.00 . A A . 13 LEU C 1 1 15 10915 1 1 13 LEU CA C 6.801 -2.400 -0.218 1.00 . A A . 13 LEU CA 1 1 15 10916 1 1 13 LEU CB C 7.095 -3.619 -1.096 1.00 . A A . 13 LEU CB 1 1 15 10917 1 1 13 LEU CD1 C 5.703 -3.107 -3.107 1.00 . A A . 13 LEU CD1 1 1 15 10918 1 1 13 LEU CD2 C 5.951 -5.465 -2.328 1.00 . A A . 13 LEU CD2 1 1 15 10919 1 1 13 LEU CG C 5.836 -4.007 -1.877 1.00 . A A . 13 LEU CG 1 1 15 10920 1 1 13 LEU H H 8.372 -1.375 -1.281 1.00 . A A . 13 LEU H 1 1 15 10921 1 1 13 LEU HA H 5.815 -2.020 -0.444 1.00 . A A . 13 LEU HA 1 1 15 10922 1 1 13 LEU HB2 H 7.889 -3.380 -1.789 1.00 . A A . 13 LEU HB2 1 1 15 10923 1 1 13 LEU HB3 H 7.398 -4.447 -0.473 1.00 . A A . 13 LEU HB3 1 1 15 10924 1 1 13 LEU HD11 H 6.568 -2.465 -3.177 1.00 . A A . 13 LEU HD11 1 1 15 10925 1 1 13 LEU HD12 H 4.813 -2.503 -3.017 1.00 . A A . 13 LEU HD12 1 1 15 10926 1 1 13 LEU HD13 H 5.635 -3.718 -3.995 1.00 . A A . 13 LEU HD13 1 1 15 10927 1 1 13 LEU HD21 H 6.160 -5.498 -3.388 1.00 . A A . 13 LEU HD21 1 1 15 10928 1 1 13 LEU HD22 H 5.023 -5.978 -2.129 1.00 . A A . 13 LEU HD22 1 1 15 10929 1 1 13 LEU HD23 H 6.753 -5.946 -1.789 1.00 . A A . 13 LEU HD23 1 1 15 10930 1 1 13 LEU HG H 4.964 -3.888 -1.245 1.00 . A A . 13 LEU HG 1 1 15 10931 1 1 13 LEU N N 7.814 -1.337 -0.477 1.00 . A A . 13 LEU N 1 1 15 10932 1 1 13 LEU O O 5.890 -3.231 1.838 1.00 . A A . 13 LEU O 1 1 15 10933 1 1 14 TYR C C 7.204 -2.113 4.128 1.00 . A A . 14 TYR C 1 1 15 10934 1 1 14 TYR CA C 8.138 -3.009 3.309 1.00 . A A . 14 TYR CA 1 1 15 10935 1 1 14 TYR CB C 9.588 -2.800 3.763 1.00 . A A . 14 TYR CB 1 1 15 10936 1 1 14 TYR CD1 C 9.338 -3.946 6.062 1.00 . A A . 14 TYR CD1 1 1 15 10937 1 1 14 TYR CD2 C 9.967 -1.595 6.008 1.00 . A A . 14 TYR CD2 1 1 15 10938 1 1 14 TYR CE1 C 9.377 -3.915 7.461 1.00 . A A . 14 TYR CE1 1 1 15 10939 1 1 14 TYR CE2 C 10.002 -1.581 7.406 1.00 . A A . 14 TYR CE2 1 1 15 10940 1 1 14 TYR CG C 9.636 -2.781 5.310 1.00 . A A . 14 TYR CG 1 1 15 10941 1 1 14 TYR CZ C 9.709 -2.736 8.130 1.00 . A A . 14 TYR CZ 1 1 15 10942 1 1 14 TYR H H 8.784 -2.293 1.384 1.00 . A A . 14 TYR H 1 1 15 10943 1 1 14 TYR HA H 7.861 -4.044 3.449 1.00 . A A . 14 TYR HA 1 1 15 10944 1 1 14 TYR HB2 H 10.203 -3.609 3.365 1.00 . A A . 14 TYR HB2 1 1 15 10945 1 1 14 TYR HB3 H 9.955 -1.859 3.360 1.00 . A A . 14 TYR HB3 1 1 15 10946 1 1 14 TYR HD1 H 9.071 -4.864 5.573 1.00 . A A . 14 TYR HD1 1 1 15 10947 1 1 14 TYR HD2 H 10.190 -0.694 5.478 1.00 . A A . 14 TYR HD2 1 1 15 10948 1 1 14 TYR HE1 H 9.151 -4.807 8.026 1.00 . A A . 14 TYR HE1 1 1 15 10949 1 1 14 TYR HE2 H 10.255 -0.669 7.928 1.00 . A A . 14 TYR HE2 1 1 15 10950 1 1 14 TYR HH H 9.713 -1.795 9.790 1.00 . A A . 14 TYR HH 1 1 15 10951 1 1 14 TYR N N 8.011 -2.650 1.869 1.00 . A A . 14 TYR N 1 1 15 10952 1 1 14 TYR O O 6.480 -2.575 4.987 1.00 . A A . 14 TYR O 1 1 15 10953 1 1 14 TYR OH O 9.747 -2.712 9.509 1.00 . A A . 14 TYR OH 1 1 15 10954 1 1 15 GLN C C 4.862 -0.239 4.274 1.00 . A A . 15 GLN C 1 1 15 10955 1 1 15 GLN CA C 6.315 0.086 4.618 1.00 . A A . 15 GLN CA 1 1 15 10956 1 1 15 GLN CB C 6.616 1.533 4.226 1.00 . A A . 15 GLN CB 1 1 15 10957 1 1 15 GLN CD C 8.463 3.197 3.982 1.00 . A A . 15 GLN CD 1 1 15 10958 1 1 15 GLN CG C 8.040 1.888 4.652 1.00 . A A . 15 GLN CG 1 1 15 10959 1 1 15 GLN H H 7.797 -0.481 3.161 1.00 . A A . 15 GLN H 1 1 15 10960 1 1 15 GLN HA H 6.474 -0.043 5.678 1.00 . A A . 15 GLN HA 1 1 15 10961 1 1 15 GLN HB2 H 6.520 1.643 3.155 1.00 . A A . 15 GLN HB2 1 1 15 10962 1 1 15 GLN HB3 H 5.919 2.193 4.720 1.00 . A A . 15 GLN HB3 1 1 15 10963 1 1 15 GLN HE21 H 7.353 4.328 5.176 1.00 . A A . 15 GLN HE21 1 1 15 10964 1 1 15 GLN HE22 H 8.244 5.170 4.002 1.00 . A A . 15 GLN HE22 1 1 15 10965 1 1 15 GLN HG2 H 8.074 2.005 5.726 1.00 . A A . 15 GLN HG2 1 1 15 10966 1 1 15 GLN HG3 H 8.713 1.099 4.353 1.00 . A A . 15 GLN HG3 1 1 15 10967 1 1 15 GLN N N 7.210 -0.834 3.862 1.00 . A A . 15 GLN N 1 1 15 10968 1 1 15 GLN NE2 N 7.980 4.326 4.423 1.00 . A A . 15 GLN NE2 1 1 15 10969 1 1 15 GLN O O 4.028 -0.400 5.143 1.00 . A A . 15 GLN O 1 1 15 10970 1 1 15 GLN OE1 O 9.241 3.192 3.049 1.00 . A A . 15 GLN OE1 1 1 15 10971 1 1 16 LEU C C 2.732 -1.963 3.280 1.00 . A A . 16 LEU C 1 1 15 10972 1 1 16 LEU CA C 3.156 -0.660 2.612 1.00 . A A . 16 LEU CA 1 1 15 10973 1 1 16 LEU CB C 3.080 -0.811 1.094 1.00 . A A . 16 LEU CB 1 1 15 10974 1 1 16 LEU CD1 C 4.378 1.252 0.568 1.00 . A A . 16 LEU CD1 1 1 15 10975 1 1 16 LEU CD2 C 2.636 0.432 -1.022 1.00 . A A . 16 LEU CD2 1 1 15 10976 1 1 16 LEU CG C 3.014 0.572 0.453 1.00 . A A . 16 LEU CG 1 1 15 10977 1 1 16 LEU H H 5.241 -0.210 2.325 1.00 . A A . 16 LEU H 1 1 15 10978 1 1 16 LEU HA H 2.501 0.136 2.929 1.00 . A A . 16 LEU HA 1 1 15 10979 1 1 16 LEU HB2 H 3.956 -1.334 0.739 1.00 . A A . 16 LEU HB2 1 1 15 10980 1 1 16 LEU HB3 H 2.196 -1.369 0.831 1.00 . A A . 16 LEU HB3 1 1 15 10981 1 1 16 LEU HD11 H 5.153 0.556 0.281 1.00 . A A . 16 LEU HD11 1 1 15 10982 1 1 16 LEU HD12 H 4.537 1.568 1.588 1.00 . A A . 16 LEU HD12 1 1 15 10983 1 1 16 LEU HD13 H 4.407 2.113 -0.083 1.00 . A A . 16 LEU HD13 1 1 15 10984 1 1 16 LEU HD21 H 3.466 0.743 -1.637 1.00 . A A . 16 LEU HD21 1 1 15 10985 1 1 16 LEU HD22 H 1.778 1.053 -1.234 1.00 . A A . 16 LEU HD22 1 1 15 10986 1 1 16 LEU HD23 H 2.395 -0.599 -1.236 1.00 . A A . 16 LEU HD23 1 1 15 10987 1 1 16 LEU HG H 2.271 1.167 0.964 1.00 . A A . 16 LEU HG 1 1 15 10988 1 1 16 LEU N N 4.553 -0.340 3.011 1.00 . A A . 16 LEU N 1 1 15 10989 1 1 16 LEU O O 1.580 -2.157 3.612 1.00 . A A . 16 LEU O 1 1 15 10990 1 1 17 GLU C C 2.714 -3.842 5.518 1.00 . A A . 17 GLU C 1 1 15 10991 1 1 17 GLU CA C 3.311 -4.138 4.142 1.00 . A A . 17 GLU CA 1 1 15 10992 1 1 17 GLU CB C 4.581 -4.972 4.296 1.00 . A A . 17 GLU CB 1 1 15 10993 1 1 17 GLU CD C 4.814 -7.172 3.134 1.00 . A A . 17 GLU CD 1 1 15 10994 1 1 17 GLU CG C 4.909 -5.655 2.967 1.00 . A A . 17 GLU CG 1 1 15 10995 1 1 17 GLU H H 4.580 -2.682 3.222 1.00 . A A . 17 GLU H 1 1 15 10996 1 1 17 GLU HA H 2.594 -4.674 3.539 1.00 . A A . 17 GLU HA 1 1 15 10997 1 1 17 GLU HB2 H 5.401 -4.330 4.585 1.00 . A A . 17 GLU HB2 1 1 15 10998 1 1 17 GLU HB3 H 4.427 -5.717 5.052 1.00 . A A . 17 GLU HB3 1 1 15 10999 1 1 17 GLU HG2 H 4.207 -5.330 2.213 1.00 . A A . 17 GLU HG2 1 1 15 11000 1 1 17 GLU HG3 H 5.911 -5.391 2.664 1.00 . A A . 17 GLU HG3 1 1 15 11001 1 1 17 GLU N N 3.656 -2.857 3.488 1.00 . A A . 17 GLU N 1 1 15 11002 1 1 17 GLU O O 1.818 -4.521 5.978 1.00 . A A . 17 GLU O 1 1 15 11003 1 1 17 GLU OE1 O 3.732 -7.648 3.433 1.00 . A A . 17 GLU OE1 1 1 15 11004 1 1 17 GLU OE2 O 5.825 -7.833 2.958 1.00 . A A . 17 GLU OE2 1 1 15 11005 1 1 18 ASN C C 1.296 -1.800 7.352 1.00 . A A . 18 ASN C 1 1 15 11006 1 1 18 ASN CA C 2.661 -2.470 7.516 1.00 . A A . 18 ASN CA 1 1 15 11007 1 1 18 ASN CB C 3.622 -1.507 8.218 1.00 . A A . 18 ASN CB 1 1 15 11008 1 1 18 ASN CG C 3.223 -1.367 9.687 1.00 . A A . 18 ASN CG 1 1 15 11009 1 1 18 ASN H H 3.919 -2.285 5.778 1.00 . A A . 18 ASN H 1 1 15 11010 1 1 18 ASN HA H 2.553 -3.368 8.108 1.00 . A A . 18 ASN HA 1 1 15 11011 1 1 18 ASN HB2 H 4.630 -1.892 8.152 1.00 . A A . 18 ASN HB2 1 1 15 11012 1 1 18 ASN HB3 H 3.574 -0.540 7.740 1.00 . A A . 18 ASN HB3 1 1 15 11013 1 1 18 ASN HD21 H 2.710 0.543 9.514 1.00 . A A . 18 ASN HD21 1 1 15 11014 1 1 18 ASN HD22 H 2.526 -0.119 11.066 1.00 . A A . 18 ASN HD22 1 1 15 11015 1 1 18 ASN N N 3.201 -2.822 6.173 1.00 . A A . 18 ASN N 1 1 15 11016 1 1 18 ASN ND2 N 2.783 -0.219 10.125 1.00 . A A . 18 ASN ND2 1 1 15 11017 1 1 18 ASN O O 0.484 -1.793 8.255 1.00 . A A . 18 ASN O 1 1 15 11018 1 1 18 ASN OD1 O 3.312 -2.313 10.445 1.00 . A A . 18 ASN OD1 1 1 15 11019 1 1 19 TYR C C -1.398 -1.610 6.156 1.00 . A A . 19 TYR C 1 1 15 11020 1 1 19 TYR CA C -0.282 -0.577 5.983 1.00 . A A . 19 TYR CA 1 1 15 11021 1 1 19 TYR CB C -0.337 0.007 4.567 1.00 . A A . 19 TYR CB 1 1 15 11022 1 1 19 TYR CD1 C 1.660 1.392 5.504 1.00 . A A . 19 TYR CD1 1 1 15 11023 1 1 19 TYR CD2 C 0.942 1.824 3.216 1.00 . A A . 19 TYR CD2 1 1 15 11024 1 1 19 TYR CE1 C 2.653 2.368 5.361 1.00 . A A . 19 TYR CE1 1 1 15 11025 1 1 19 TYR CE2 C 1.940 2.794 3.096 1.00 . A A . 19 TYR CE2 1 1 15 11026 1 1 19 TYR CG C 0.775 1.097 4.423 1.00 . A A . 19 TYR CG 1 1 15 11027 1 1 19 TYR CZ C 2.793 3.066 4.163 1.00 . A A . 19 TYR CZ 1 1 15 11028 1 1 19 TYR H H 1.700 -1.257 5.482 1.00 . A A . 19 TYR H 1 1 15 11029 1 1 19 TYR HA H -0.410 0.216 6.706 1.00 . A A . 19 TYR HA 1 1 15 11030 1 1 19 TYR HB2 H -0.188 -0.812 3.845 1.00 . A A . 19 TYR HB2 1 1 15 11031 1 1 19 TYR HB3 H -1.332 0.444 4.404 1.00 . A A . 19 TYR HB3 1 1 15 11032 1 1 19 TYR HD1 H 1.586 0.878 6.443 1.00 . A A . 19 TYR HD1 1 1 15 11033 1 1 19 TYR HD2 H 0.315 1.647 2.381 1.00 . A A . 19 TYR HD2 1 1 15 11034 1 1 19 TYR HE1 H 3.316 2.580 6.184 1.00 . A A . 19 TYR HE1 1 1 15 11035 1 1 19 TYR HE2 H 2.050 3.335 2.167 1.00 . A A . 19 TYR HE2 1 1 15 11036 1 1 19 TYR HH H 3.488 4.810 4.511 1.00 . A A . 19 TYR HH 1 1 15 11037 1 1 19 TYR N N 1.034 -1.239 6.202 1.00 . A A . 19 TYR N 1 1 15 11038 1 1 19 TYR O O -2.557 -1.270 6.289 1.00 . A A . 19 TYR O 1 1 15 11039 1 1 19 TYR OH O 3.775 4.026 4.035 1.00 . A A . 19 TYR OH 1 1 15 11040 1 1 20 CYS C C -2.248 -4.259 7.812 1.00 . A A . 20 CYS C 1 1 15 11041 1 1 20 CYS CA C -2.101 -3.922 6.326 1.00 . A A . 20 CYS CA 1 1 15 11042 1 1 20 CYS CB C -1.690 -5.179 5.553 1.00 . A A . 20 CYS CB 1 1 15 11043 1 1 20 CYS H H -0.118 -3.126 6.050 1.00 . A A . 20 CYS H 1 1 15 11044 1 1 20 CYS HA H -3.043 -3.557 5.945 1.00 . A A . 20 CYS HA 1 1 15 11045 1 1 20 CYS HB2 H -0.844 -5.640 6.041 1.00 . A A . 20 CYS HB2 1 1 15 11046 1 1 20 CYS HB3 H -2.517 -5.875 5.532 1.00 . A A . 20 CYS HB3 1 1 15 11047 1 1 20 CYS N N -1.058 -2.871 6.158 1.00 . A A . 20 CYS N 1 1 15 11048 1 1 20 CYS O O -2.161 -5.403 8.210 1.00 . A A . 20 CYS O 1 1 15 11049 1 1 20 CYS SG S -1.240 -4.729 3.858 1.00 . A A . 20 CYS SG 1 1 15 11050 1 1 21 ASN C C -4.108 -3.707 10.428 1.00 . A A . 21 ASN C 1 1 15 11051 1 1 21 ASN CA C -2.624 -3.534 10.094 1.00 . A A . 21 ASN CA 1 1 15 11052 1 1 21 ASN CB C -2.058 -2.356 10.890 1.00 . A A . 21 ASN CB 1 1 15 11053 1 1 21 ASN CG C -2.492 -1.042 10.239 1.00 . A A . 21 ASN CG 1 1 15 11054 1 1 21 ASN H H -2.539 -2.354 8.294 1.00 . A A . 21 ASN H 1 1 15 11055 1 1 21 ASN HA H -2.089 -4.435 10.355 1.00 . A A . 21 ASN HA 1 1 15 11056 1 1 21 ASN HB2 H -2.430 -2.396 11.904 1.00 . A A . 21 ASN HB2 1 1 15 11057 1 1 21 ASN HB3 H -0.980 -2.412 10.899 1.00 . A A . 21 ASN HB3 1 1 15 11058 1 1 21 ASN HD21 H -0.640 -0.500 9.772 1.00 . A A . 21 ASN HD21 1 1 15 11059 1 1 21 ASN HD22 H -1.854 0.596 9.316 1.00 . A A . 21 ASN HD22 1 1 15 11060 1 1 21 ASN N N -2.472 -3.270 8.635 1.00 . A A . 21 ASN N 1 1 15 11061 1 1 21 ASN ND2 N -1.587 -0.250 9.733 1.00 . A A . 21 ASN ND2 1 1 15 11062 1 1 21 ASN O O -4.889 -3.854 9.503 1.00 . A A . 21 ASN O 1 1 15 11063 1 1 21 ASN OXT O -4.437 -3.688 11.603 1.00 . A A . 21 ASN OXT 1 1 15 11064 1 1 21 ASN OD1 O -3.666 -0.732 10.190 1.00 . A A . 21 ASN OD1 1 1 15 11065 2 2 1 PHE C C 9.998 -3.268 -5.440 1.00 . B B . 22 PHE C 1 1 15 11066 2 2 1 PHE CA C 10.761 -4.530 -5.862 1.00 . B B . 22 PHE CA 1 1 15 11067 2 2 1 PHE CB C 10.324 -4.994 -7.263 1.00 . B B . 22 PHE CB 1 1 15 11068 2 2 1 PHE CD1 C 7.861 -4.956 -6.690 1.00 . B B . 22 PHE CD1 1 1 15 11069 2 2 1 PHE CD2 C 8.612 -3.820 -8.699 1.00 . B B . 22 PHE CD2 1 1 15 11070 2 2 1 PHE CE1 C 6.541 -4.574 -6.967 1.00 . B B . 22 PHE CE1 1 1 15 11071 2 2 1 PHE CE2 C 7.293 -3.437 -8.976 1.00 . B B . 22 PHE CE2 1 1 15 11072 2 2 1 PHE CG C 8.897 -4.580 -7.556 1.00 . B B . 22 PHE CG 1 1 15 11073 2 2 1 PHE CZ C 6.258 -3.815 -8.111 1.00 . B B . 22 PHE CZ 1 1 15 11074 2 2 1 PHE H1 H 9.735 -5.328 -4.237 1.00 . B B . 22 PHE H1 1 1 15 11075 2 2 1 PHE H2 H 11.362 -5.809 -4.334 1.00 . B B . 22 PHE H2 1 1 15 11076 2 2 1 PHE H3 H 10.210 -6.480 -5.387 1.00 . B B . 22 PHE H3 1 1 15 11077 2 2 1 PHE HA H 11.820 -4.315 -5.874 1.00 . B B . 22 PHE HA 1 1 15 11078 2 2 1 PHE HB2 H 10.978 -4.558 -8.001 1.00 . B B . 22 PHE HB2 1 1 15 11079 2 2 1 PHE HB3 H 10.398 -6.071 -7.316 1.00 . B B . 22 PHE HB3 1 1 15 11080 2 2 1 PHE HD1 H 8.081 -5.541 -5.808 1.00 . B B . 22 PHE HD1 1 1 15 11081 2 2 1 PHE HD2 H 9.409 -3.528 -9.366 1.00 . B B . 22 PHE HD2 1 1 15 11082 2 2 1 PHE HE1 H 5.743 -4.864 -6.301 1.00 . B B . 22 PHE HE1 1 1 15 11083 2 2 1 PHE HE2 H 7.074 -2.852 -9.857 1.00 . B B . 22 PHE HE2 1 1 15 11084 2 2 1 PHE HZ H 5.241 -3.521 -8.325 1.00 . B B . 22 PHE HZ 1 1 15 11085 2 2 1 PHE N N 10.497 -5.619 -4.881 1.00 . B B . 22 PHE N 1 1 15 11086 2 2 1 PHE O O 9.093 -3.321 -4.631 1.00 . B B . 22 PHE O 1 1 15 11087 2 2 2 VAL C C 9.890 0.187 -6.680 1.00 . B B . 23 VAL C 1 1 15 11088 2 2 2 VAL CA C 9.652 -0.877 -5.606 1.00 . B B . 23 VAL CA 1 1 15 11089 2 2 2 VAL CB C 10.169 -0.397 -4.238 1.00 . B B . 23 VAL CB 1 1 15 11090 2 2 2 VAL CG1 C 11.398 0.506 -4.405 1.00 . B B . 23 VAL CG1 1 1 15 11091 2 2 2 VAL CG2 C 9.060 0.372 -3.514 1.00 . B B . 23 VAL CG2 1 1 15 11092 2 2 2 VAL H H 11.090 -2.113 -6.631 1.00 . B B . 23 VAL H 1 1 15 11093 2 2 2 VAL HA H 8.594 -1.065 -5.535 1.00 . B B . 23 VAL HA 1 1 15 11094 2 2 2 VAL HB H 10.445 -1.255 -3.649 1.00 . B B . 23 VAL HB 1 1 15 11095 2 2 2 VAL HG11 H 11.913 0.247 -5.319 1.00 . B B . 23 VAL HG11 1 1 15 11096 2 2 2 VAL HG12 H 12.062 0.367 -3.566 1.00 . B B . 23 VAL HG12 1 1 15 11097 2 2 2 VAL HG13 H 11.085 1.538 -4.448 1.00 . B B . 23 VAL HG13 1 1 15 11098 2 2 2 VAL HG21 H 9.470 1.267 -3.071 1.00 . B B . 23 VAL HG21 1 1 15 11099 2 2 2 VAL HG22 H 8.636 -0.251 -2.741 1.00 . B B . 23 VAL HG22 1 1 15 11100 2 2 2 VAL HG23 H 8.288 0.642 -4.221 1.00 . B B . 23 VAL HG23 1 1 15 11101 2 2 2 VAL N N 10.357 -2.136 -5.981 1.00 . B B . 23 VAL N 1 1 15 11102 2 2 2 VAL O O 10.192 -0.121 -7.816 1.00 . B B . 23 VAL O 1 1 15 11103 2 2 3 ASN C C 8.635 2.891 -7.970 1.00 . B B . 24 ASN C 1 1 15 11104 2 2 3 ASN CA C 9.952 2.563 -7.263 1.00 . B B . 24 ASN CA 1 1 15 11105 2 2 3 ASN CB C 11.015 2.196 -8.301 1.00 . B B . 24 ASN CB 1 1 15 11106 2 2 3 ASN CG C 11.519 3.465 -8.993 1.00 . B B . 24 ASN CG 1 1 15 11107 2 2 3 ASN H H 9.496 1.618 -5.383 1.00 . B B . 24 ASN H 1 1 15 11108 2 2 3 ASN HA H 10.280 3.432 -6.711 1.00 . B B . 24 ASN HA 1 1 15 11109 2 2 3 ASN HB2 H 11.839 1.702 -7.808 1.00 . B B . 24 ASN HB2 1 1 15 11110 2 2 3 ASN HB3 H 10.584 1.536 -9.037 1.00 . B B . 24 ASN HB3 1 1 15 11111 2 2 3 ASN HD21 H 13.302 2.697 -9.413 1.00 . B B . 24 ASN HD21 1 1 15 11112 2 2 3 ASN HD22 H 13.060 4.294 -9.933 1.00 . B B . 24 ASN HD22 1 1 15 11113 2 2 3 ASN N N 9.747 1.429 -6.308 1.00 . B B . 24 ASN N 1 1 15 11114 2 2 3 ASN ND2 N 12.728 3.487 -9.487 1.00 . B B . 24 ASN ND2 1 1 15 11115 2 2 3 ASN O O 8.407 2.499 -9.098 1.00 . B B . 24 ASN O 1 1 15 11116 2 2 3 ASN OD1 O 10.807 4.445 -9.085 1.00 . B B . 24 ASN OD1 1 1 15 11117 2 2 4 GLN C C 5.851 5.173 -7.207 1.00 . B B . 25 GLN C 1 1 15 11118 2 2 4 GLN CA C 6.467 3.976 -7.943 1.00 . B B . 25 GLN CA 1 1 15 11119 2 2 4 GLN CB C 5.515 2.781 -7.870 1.00 . B B . 25 GLN CB 1 1 15 11120 2 2 4 GLN CD C 4.095 1.252 -9.243 1.00 . B B . 25 GLN CD 1 1 15 11121 2 2 4 GLN CG C 4.835 2.590 -9.227 1.00 . B B . 25 GLN CG 1 1 15 11122 2 2 4 GLN H H 7.977 3.918 -6.407 1.00 . B B . 25 GLN H 1 1 15 11123 2 2 4 GLN HA H 6.633 4.239 -8.977 1.00 . B B . 25 GLN HA 1 1 15 11124 2 2 4 GLN HB2 H 6.072 1.891 -7.617 1.00 . B B . 25 GLN HB2 1 1 15 11125 2 2 4 GLN HB3 H 4.764 2.964 -7.116 1.00 . B B . 25 GLN HB3 1 1 15 11126 2 2 4 GLN HE21 H 2.400 2.021 -8.553 1.00 . B B . 25 GLN HE21 1 1 15 11127 2 2 4 GLN HE22 H 2.368 0.352 -8.859 1.00 . B B . 25 GLN HE22 1 1 15 11128 2 2 4 GLN HG2 H 4.133 3.394 -9.394 1.00 . B B . 25 GLN HG2 1 1 15 11129 2 2 4 GLN HG3 H 5.581 2.595 -10.008 1.00 . B B . 25 GLN HG3 1 1 15 11130 2 2 4 GLN N N 7.769 3.612 -7.313 1.00 . B B . 25 GLN N 1 1 15 11131 2 2 4 GLN NE2 N 2.851 1.204 -8.852 1.00 . B B . 25 GLN NE2 1 1 15 11132 2 2 4 GLN O O 6.442 5.729 -6.303 1.00 . B B . 25 GLN O 1 1 15 11133 2 2 4 GLN OE1 O 4.655 0.240 -9.614 1.00 . B B . 25 GLN OE1 1 1 15 11134 2 2 5 HIS C C 2.497 6.432 -6.874 1.00 . B B . 26 HIS C 1 1 15 11135 2 2 5 HIS CA C 4.003 6.727 -6.919 1.00 . B B . 26 HIS CA 1 1 15 11136 2 2 5 HIS CB C 4.270 7.992 -7.739 1.00 . B B . 26 HIS CB 1 1 15 11137 2 2 5 HIS CD2 C 4.311 10.448 -6.837 1.00 . B B . 26 HIS CD2 1 1 15 11138 2 2 5 HIS CE1 C 5.700 10.123 -5.197 1.00 . B B . 26 HIS CE1 1 1 15 11139 2 2 5 HIS CG C 4.649 9.123 -6.825 1.00 . B B . 26 HIS CG 1 1 15 11140 2 2 5 HIS H H 4.210 5.105 -8.322 1.00 . B B . 26 HIS H 1 1 15 11141 2 2 5 HIS HA H 4.388 6.844 -5.916 1.00 . B B . 26 HIS HA 1 1 15 11142 2 2 5 HIS HB2 H 5.077 7.805 -8.431 1.00 . B B . 26 HIS HB2 1 1 15 11143 2 2 5 HIS HB3 H 3.380 8.258 -8.288 1.00 . B B . 26 HIS HB3 1 1 15 11144 2 2 5 HIS HD2 H 3.634 10.918 -7.534 1.00 . B B . 26 HIS HD2 1 1 15 11145 2 2 5 HIS HE1 H 6.344 10.294 -4.346 1.00 . B B . 26 HIS HE1 1 1 15 11146 2 2 5 HIS HE2 H 4.935 12.034 -5.575 1.00 . B B . 26 HIS HE2 1 1 15 11147 2 2 5 HIS N N 4.666 5.570 -7.590 1.00 . B B . 26 HIS N 1 1 15 11148 2 2 5 HIS ND1 N 5.526 8.929 -5.779 1.00 . B B . 26 HIS ND1 1 1 15 11149 2 2 5 HIS NE2 N 4.978 11.084 -5.810 1.00 . B B . 26 HIS NE2 1 1 15 11150 2 2 5 HIS O O 1.985 5.736 -7.729 1.00 . B B . 26 HIS O 1 1 15 11151 2 2 6 LEU C C -0.483 7.519 -4.940 1.00 . B B . 27 LEU C 1 1 15 11152 2 2 6 LEU CA C 0.315 6.574 -5.851 1.00 . B B . 27 LEU CA 1 1 15 11153 2 2 6 LEU CB C 0.145 5.140 -5.334 1.00 . B B . 27 LEU CB 1 1 15 11154 2 2 6 LEU CD1 C 1.677 5.725 -3.419 1.00 . B B . 27 LEU CD1 1 1 15 11155 2 2 6 LEU CD2 C 1.103 3.354 -3.883 1.00 . B B . 27 LEU CD2 1 1 15 11156 2 2 6 LEU CG C 1.378 4.708 -4.524 1.00 . B B . 27 LEU CG 1 1 15 11157 2 2 6 LEU H H 2.185 7.454 -5.186 1.00 . B B . 27 LEU H 1 1 15 11158 2 2 6 LEU HA H -0.085 6.632 -6.851 1.00 . B B . 27 LEU HA 1 1 15 11159 2 2 6 LEU HB2 H -0.731 5.090 -4.704 1.00 . B B . 27 LEU HB2 1 1 15 11160 2 2 6 LEU HB3 H 0.019 4.472 -6.173 1.00 . B B . 27 LEU HB3 1 1 15 11161 2 2 6 LEU HD11 H 2.465 6.386 -3.741 1.00 . B B . 27 LEU HD11 1 1 15 11162 2 2 6 LEU HD12 H 1.991 5.203 -2.527 1.00 . B B . 27 LEU HD12 1 1 15 11163 2 2 6 LEU HD13 H 0.792 6.296 -3.204 1.00 . B B . 27 LEU HD13 1 1 15 11164 2 2 6 LEU HD21 H 1.356 3.398 -2.834 1.00 . B B . 27 LEU HD21 1 1 15 11165 2 2 6 LEU HD22 H 1.701 2.600 -4.368 1.00 . B B . 27 LEU HD22 1 1 15 11166 2 2 6 LEU HD23 H 0.057 3.114 -3.990 1.00 . B B . 27 LEU HD23 1 1 15 11167 2 2 6 LEU HG H 2.232 4.629 -5.181 1.00 . B B . 27 LEU HG 1 1 15 11168 2 2 6 LEU N N 1.776 6.909 -5.889 1.00 . B B . 27 LEU N 1 1 15 11169 2 2 6 LEU O O 0.002 8.003 -3.944 1.00 . B B . 27 LEU O 1 1 15 11170 2 2 7 CYS C C -3.979 7.917 -4.257 1.00 . B B . 28 CYS C 1 1 15 11171 2 2 7 CYS CA C -2.616 8.600 -4.426 1.00 . B B . 28 CYS CA 1 1 15 11172 2 2 7 CYS CB C -2.831 9.967 -5.087 1.00 . B B . 28 CYS CB 1 1 15 11173 2 2 7 CYS H H -2.103 7.306 -6.065 1.00 . B B . 28 CYS H 1 1 15 11174 2 2 7 CYS HA H -2.159 8.735 -3.456 1.00 . B B . 28 CYS HA 1 1 15 11175 2 2 7 CYS HB2 H -2.549 9.911 -6.127 1.00 . B B . 28 CYS HB2 1 1 15 11176 2 2 7 CYS HB3 H -3.874 10.237 -5.015 1.00 . B B . 28 CYS HB3 1 1 15 11177 2 2 7 CYS N N -1.733 7.737 -5.269 1.00 . B B . 28 CYS N 1 1 15 11178 2 2 7 CYS O O -4.362 7.079 -5.049 1.00 . B B . 28 CYS O 1 1 15 11179 2 2 7 CYS SG S -1.828 11.230 -4.259 1.00 . B B . 28 CYS SG 1 1 15 11180 2 2 8 GLY C C -6.220 6.308 -3.569 1.00 . B B . 29 GLY C 1 1 15 11181 2 2 8 GLY CA C -6.064 7.714 -2.971 1.00 . B B . 29 GLY CA 1 1 15 11182 2 2 8 GLY H H -4.357 8.981 -2.629 1.00 . B B . 29 GLY H 1 1 15 11183 2 2 8 GLY HA2 H -6.220 7.659 -1.904 1.00 . B B . 29 GLY HA2 1 1 15 11184 2 2 8 GLY HA3 H -6.812 8.363 -3.402 1.00 . B B . 29 GLY HA3 1 1 15 11185 2 2 8 GLY N N -4.705 8.293 -3.234 1.00 . B B . 29 GLY N 1 1 15 11186 2 2 8 GLY O O -5.519 5.384 -3.213 1.00 . B B . 29 GLY O 1 1 15 11187 2 2 9 SER C C -6.099 4.050 -5.293 1.00 . B B . 30 SER C 1 1 15 11188 2 2 9 SER CA C -7.412 4.814 -5.090 1.00 . B B . 30 SER CA 1 1 15 11189 2 2 9 SER CB C -8.099 5.020 -6.441 1.00 . B B . 30 SER CB 1 1 15 11190 2 2 9 SER H H -7.722 6.912 -4.714 1.00 . B B . 30 SER H 1 1 15 11191 2 2 9 SER HA H -8.061 4.237 -4.445 1.00 . B B . 30 SER HA 1 1 15 11192 2 2 9 SER HB2 H -7.470 5.617 -7.080 1.00 . B B . 30 SER HB2 1 1 15 11193 2 2 9 SER HB3 H -8.272 4.059 -6.908 1.00 . B B . 30 SER HB3 1 1 15 11194 2 2 9 SER HG H -9.967 5.352 -6.878 1.00 . B B . 30 SER HG 1 1 15 11195 2 2 9 SER N N -7.161 6.148 -4.463 1.00 . B B . 30 SER N 1 1 15 11196 2 2 9 SER O O -5.936 2.950 -4.805 1.00 . B B . 30 SER O 1 1 15 11197 2 2 9 SER OG O -9.335 5.694 -6.241 1.00 . B B . 30 SER OG 1 1 15 11198 2 2 10 ASP C C -3.397 3.309 -4.903 1.00 . B B . 31 ASP C 1 1 15 11199 2 2 10 ASP CA C -3.874 3.893 -6.229 1.00 . B B . 31 ASP CA 1 1 15 11200 2 2 10 ASP CB C -2.818 4.860 -6.762 1.00 . B B . 31 ASP CB 1 1 15 11201 2 2 10 ASP CG C -3.399 5.660 -7.928 1.00 . B B . 31 ASP CG 1 1 15 11202 2 2 10 ASP H H -5.306 5.498 -6.402 1.00 . B B . 31 ASP H 1 1 15 11203 2 2 10 ASP HA H -4.023 3.094 -6.942 1.00 . B B . 31 ASP HA 1 1 15 11204 2 2 10 ASP HB2 H -2.519 5.533 -5.972 1.00 . B B . 31 ASP HB2 1 1 15 11205 2 2 10 ASP HB3 H -1.959 4.302 -7.103 1.00 . B B . 31 ASP HB3 1 1 15 11206 2 2 10 ASP N N -5.162 4.612 -6.010 1.00 . B B . 31 ASP N 1 1 15 11207 2 2 10 ASP O O -2.967 2.175 -4.833 1.00 . B B . 31 ASP O 1 1 15 11208 2 2 10 ASP OD1 O -4.443 6.263 -7.744 1.00 . B B . 31 ASP OD1 1 1 15 11209 2 2 10 ASP OD2 O -2.791 5.654 -8.986 1.00 . B B . 31 ASP OD2 1 1 15 11210 2 2 11 LEU C C -3.756 2.229 -2.245 1.00 . B B . 32 LEU C 1 1 15 11211 2 2 11 LEU CA C -3.026 3.540 -2.527 1.00 . B B . 32 LEU CA 1 1 15 11212 2 2 11 LEU CB C -3.339 4.553 -1.421 1.00 . B B . 32 LEU CB 1 1 15 11213 2 2 11 LEU CD1 C -1.379 5.779 -2.366 1.00 . B B . 32 LEU CD1 1 1 15 11214 2 2 11 LEU CD2 C -2.461 6.580 -0.261 1.00 . B B . 32 LEU CD2 1 1 15 11215 2 2 11 LEU CG C -2.077 5.344 -1.076 1.00 . B B . 32 LEU CG 1 1 15 11216 2 2 11 LEU H H -3.826 4.981 -3.916 1.00 . B B . 32 LEU H 1 1 15 11217 2 2 11 LEU HA H -1.962 3.357 -2.558 1.00 . B B . 32 LEU HA 1 1 15 11218 2 2 11 LEU HB2 H -4.105 5.233 -1.757 1.00 . B B . 32 LEU HB2 1 1 15 11219 2 2 11 LEU HB3 H -3.684 4.030 -0.542 1.00 . B B . 32 LEU HB3 1 1 15 11220 2 2 11 LEU HD11 H -0.478 5.200 -2.496 1.00 . B B . 32 LEU HD11 1 1 15 11221 2 2 11 LEU HD12 H -1.130 6.828 -2.307 1.00 . B B . 32 LEU HD12 1 1 15 11222 2 2 11 LEU HD13 H -2.038 5.612 -3.206 1.00 . B B . 32 LEU HD13 1 1 15 11223 2 2 11 LEU HD21 H -1.695 6.782 0.473 1.00 . B B . 32 LEU HD21 1 1 15 11224 2 2 11 LEU HD22 H -3.402 6.403 0.240 1.00 . B B . 32 LEU HD22 1 1 15 11225 2 2 11 LEU HD23 H -2.561 7.430 -0.920 1.00 . B B . 32 LEU HD23 1 1 15 11226 2 2 11 LEU HG H -1.409 4.721 -0.499 1.00 . B B . 32 LEU HG 1 1 15 11227 2 2 11 LEU N N -3.474 4.070 -3.844 1.00 . B B . 32 LEU N 1 1 15 11228 2 2 11 LEU O O -3.152 1.176 -2.185 1.00 . B B . 32 LEU O 1 1 15 11229 2 2 12 VAL C C -5.424 -0.016 -2.873 1.00 . B B . 33 VAL C 1 1 15 11230 2 2 12 VAL CA C -5.801 1.015 -1.811 1.00 . B B . 33 VAL CA 1 1 15 11231 2 2 12 VAL CB C -7.307 1.279 -1.860 1.00 . B B . 33 VAL CB 1 1 15 11232 2 2 12 VAL CG1 C -7.710 2.156 -0.678 1.00 . B B . 33 VAL CG1 1 1 15 11233 2 2 12 VAL CG2 C -7.663 1.996 -3.163 1.00 . B B . 33 VAL CG2 1 1 15 11234 2 2 12 VAL H H -5.526 3.131 -2.135 1.00 . B B . 33 VAL H 1 1 15 11235 2 2 12 VAL HA H -5.531 0.639 -0.834 1.00 . B B . 33 VAL HA 1 1 15 11236 2 2 12 VAL HB H -7.838 0.338 -1.808 1.00 . B B . 33 VAL HB 1 1 15 11237 2 2 12 VAL HG11 H -7.584 3.195 -0.944 1.00 . B B . 33 VAL HG11 1 1 15 11238 2 2 12 VAL HG12 H -7.086 1.922 0.172 1.00 . B B . 33 VAL HG12 1 1 15 11239 2 2 12 VAL HG13 H -8.744 1.971 -0.429 1.00 . B B . 33 VAL HG13 1 1 15 11240 2 2 12 VAL HG21 H -8.737 2.064 -3.253 1.00 . B B . 33 VAL HG21 1 1 15 11241 2 2 12 VAL HG22 H -7.266 1.441 -4.000 1.00 . B B . 33 VAL HG22 1 1 15 11242 2 2 12 VAL HG23 H -7.239 2.989 -3.154 1.00 . B B . 33 VAL HG23 1 1 15 11243 2 2 12 VAL N N -5.051 2.275 -2.079 1.00 . B B . 33 VAL N 1 1 15 11244 2 2 12 VAL O O -5.498 -1.208 -2.653 1.00 . B B . 33 VAL O 1 1 15 11245 2 2 13 GLU C C -3.197 -1.022 -4.795 1.00 . B B . 34 GLU C 1 1 15 11246 2 2 13 GLU CA C -4.605 -0.511 -5.096 1.00 . B B . 34 GLU CA 1 1 15 11247 2 2 13 GLU CB C -4.623 0.210 -6.447 1.00 . B B . 34 GLU CB 1 1 15 11248 2 2 13 GLU CD C -5.595 -0.319 -8.688 1.00 . B B . 34 GLU CD 1 1 15 11249 2 2 13 GLU CG C -5.908 -0.142 -7.200 1.00 . B B . 34 GLU CG 1 1 15 11250 2 2 13 GLU H H -4.941 1.403 -4.177 1.00 . B B . 34 GLU H 1 1 15 11251 2 2 13 GLU HA H -5.294 -1.344 -5.118 1.00 . B B . 34 GLU HA 1 1 15 11252 2 2 13 GLU HB2 H -4.584 1.278 -6.284 1.00 . B B . 34 GLU HB2 1 1 15 11253 2 2 13 GLU HB3 H -3.770 -0.096 -7.030 1.00 . B B . 34 GLU HB3 1 1 15 11254 2 2 13 GLU HG2 H -6.317 -1.062 -6.806 1.00 . B B . 34 GLU HG2 1 1 15 11255 2 2 13 GLU HG3 H -6.628 0.654 -7.079 1.00 . B B . 34 GLU HG3 1 1 15 11256 2 2 13 GLU N N -5.004 0.437 -4.024 1.00 . B B . 34 GLU N 1 1 15 11257 2 2 13 GLU O O -2.978 -2.207 -4.634 1.00 . B B . 34 GLU O 1 1 15 11258 2 2 13 GLU OE1 O -4.661 0.310 -9.156 1.00 . B B . 34 GLU OE1 1 1 15 11259 2 2 13 GLU OE2 O -6.296 -1.081 -9.334 1.00 . B B . 34 GLU OE2 1 1 15 11260 2 2 14 ALA C C -0.884 -1.277 -3.012 1.00 . B B . 35 ALA C 1 1 15 11261 2 2 14 ALA CA C -0.857 -0.581 -4.373 1.00 . B B . 35 ALA CA 1 1 15 11262 2 2 14 ALA CB C 0.074 0.630 -4.312 1.00 . B B . 35 ALA CB 1 1 15 11263 2 2 14 ALA H H -2.437 0.817 -4.806 1.00 . B B . 35 ALA H 1 1 15 11264 2 2 14 ALA HA H -0.513 -1.269 -5.132 1.00 . B B . 35 ALA HA 1 1 15 11265 2 2 14 ALA HB1 H 0.231 0.912 -3.282 1.00 . B B . 35 ALA HB1 1 1 15 11266 2 2 14 ALA HB2 H -0.373 1.455 -4.847 1.00 . B B . 35 ALA HB2 1 1 15 11267 2 2 14 ALA HB3 H 1.022 0.379 -4.765 1.00 . B B . 35 ALA HB3 1 1 15 11268 2 2 14 ALA N N -2.240 -0.137 -4.692 1.00 . B B . 35 ALA N 1 1 15 11269 2 2 14 ALA O O -0.229 -2.275 -2.794 1.00 . B B . 35 ALA O 1 1 15 11270 2 2 15 LEU C C -2.317 -2.790 -0.898 1.00 . B B . 36 LEU C 1 1 15 11271 2 2 15 LEU CA C -1.769 -1.371 -0.748 1.00 . B B . 36 LEU CA 1 1 15 11272 2 2 15 LEU CB C -2.756 -0.548 0.093 1.00 . B B . 36 LEU CB 1 1 15 11273 2 2 15 LEU CD1 C -1.640 0.521 2.054 1.00 . B B . 36 LEU CD1 1 1 15 11274 2 2 15 LEU CD2 C -0.909 1.151 -0.252 1.00 . B B . 36 LEU CD2 1 1 15 11275 2 2 15 LEU CG C -2.108 0.744 0.618 1.00 . B B . 36 LEU CG 1 1 15 11276 2 2 15 LEU H H -2.187 0.044 -2.311 1.00 . B B . 36 LEU H 1 1 15 11277 2 2 15 LEU HA H -0.802 -1.389 -0.268 1.00 . B B . 36 LEU HA 1 1 15 11278 2 2 15 LEU HB2 H -3.612 -0.293 -0.515 1.00 . B B . 36 LEU HB2 1 1 15 11279 2 2 15 LEU HB3 H -3.086 -1.144 0.932 1.00 . B B . 36 LEU HB3 1 1 15 11280 2 2 15 LEU HD11 H -0.667 0.052 2.046 1.00 . B B . 36 LEU HD11 1 1 15 11281 2 2 15 LEU HD12 H -2.344 -0.117 2.567 1.00 . B B . 36 LEU HD12 1 1 15 11282 2 2 15 LEU HD13 H -1.577 1.472 2.562 1.00 . B B . 36 LEU HD13 1 1 15 11283 2 2 15 LEU HD21 H -0.160 0.374 -0.217 1.00 . B B . 36 LEU HD21 1 1 15 11284 2 2 15 LEU HD22 H -0.489 2.073 0.122 1.00 . B B . 36 LEU HD22 1 1 15 11285 2 2 15 LEU HD23 H -1.235 1.291 -1.272 1.00 . B B . 36 LEU HD23 1 1 15 11286 2 2 15 LEU HG H -2.844 1.537 0.607 1.00 . B B . 36 LEU HG 1 1 15 11287 2 2 15 LEU N N -1.661 -0.754 -2.100 1.00 . B B . 36 LEU N 1 1 15 11288 2 2 15 LEU O O -1.981 -3.692 -0.153 1.00 . B B . 36 LEU O 1 1 15 11289 2 2 16 TYR C C -2.761 -5.251 -2.738 1.00 . B B . 37 TYR C 1 1 15 11290 2 2 16 TYR CA C -3.783 -4.319 -2.084 1.00 . B B . 37 TYR CA 1 1 15 11291 2 2 16 TYR CB C -5.004 -4.172 -2.998 1.00 . B B . 37 TYR CB 1 1 15 11292 2 2 16 TYR CD1 C -5.732 -6.586 -2.471 1.00 . B B . 37 TYR CD1 1 1 15 11293 2 2 16 TYR CD2 C -5.654 -5.893 -4.803 1.00 . B B . 37 TYR CD2 1 1 15 11294 2 2 16 TYR CE1 C -6.154 -7.860 -2.872 1.00 . B B . 37 TYR CE1 1 1 15 11295 2 2 16 TYR CE2 C -6.076 -7.172 -5.188 1.00 . B B . 37 TYR CE2 1 1 15 11296 2 2 16 TYR CG C -5.476 -5.578 -3.435 1.00 . B B . 37 TYR CG 1 1 15 11297 2 2 16 TYR CZ C -6.326 -8.151 -4.225 1.00 . B B . 37 TYR CZ 1 1 15 11298 2 2 16 TYR H H -3.425 -2.227 -2.431 1.00 . B B . 37 TYR H 1 1 15 11299 2 2 16 TYR HA H -4.094 -4.734 -1.137 1.00 . B B . 37 TYR HA 1 1 15 11300 2 2 16 TYR HB2 H -5.791 -3.646 -2.454 1.00 . B B . 37 TYR HB2 1 1 15 11301 2 2 16 TYR HB3 H -4.729 -3.575 -3.864 1.00 . B B . 37 TYR HB3 1 1 15 11302 2 2 16 TYR HD1 H -5.604 -6.391 -1.423 1.00 . B B . 37 TYR HD1 1 1 15 11303 2 2 16 TYR HD2 H -5.464 -5.163 -5.561 1.00 . B B . 37 TYR HD2 1 1 15 11304 2 2 16 TYR HE1 H -6.346 -8.621 -2.130 1.00 . B B . 37 TYR HE1 1 1 15 11305 2 2 16 TYR HE2 H -6.211 -7.400 -6.234 1.00 . B B . 37 TYR HE2 1 1 15 11306 2 2 16 TYR HH H -6.293 -9.631 -5.431 1.00 . B B . 37 TYR HH 1 1 15 11307 2 2 16 TYR N N -3.175 -2.978 -1.859 1.00 . B B . 37 TYR N 1 1 15 11308 2 2 16 TYR O O -2.763 -6.444 -2.511 1.00 . B B . 37 TYR O 1 1 15 11309 2 2 16 TYR OH O -6.743 -9.409 -4.612 1.00 . B B . 37 TYR OH 1 1 15 11310 2 2 17 LEU C C 0.132 -6.057 -3.134 1.00 . B B . 38 LEU C 1 1 15 11311 2 2 17 LEU CA C -0.857 -5.585 -4.196 1.00 . B B . 38 LEU CA 1 1 15 11312 2 2 17 LEU CB C -0.088 -4.825 -5.287 1.00 . B B . 38 LEU CB 1 1 15 11313 2 2 17 LEU CD1 C -0.120 -2.895 -6.869 1.00 . B B . 38 LEU CD1 1 1 15 11314 2 2 17 LEU CD2 C -2.248 -4.062 -6.287 1.00 . B B . 38 LEU CD2 1 1 15 11315 2 2 17 LEU CG C -0.886 -3.613 -5.758 1.00 . B B . 38 LEU CG 1 1 15 11316 2 2 17 LEU H H -1.895 -3.755 -3.699 1.00 . B B . 38 LEU H 1 1 15 11317 2 2 17 LEU HA H -1.346 -6.438 -4.634 1.00 . B B . 38 LEU HA 1 1 15 11318 2 2 17 LEU HB2 H 0.861 -4.493 -4.890 1.00 . B B . 38 LEU HB2 1 1 15 11319 2 2 17 LEU HB3 H 0.087 -5.484 -6.124 1.00 . B B . 38 LEU HB3 1 1 15 11320 2 2 17 LEU HD11 H 0.823 -2.537 -6.482 1.00 . B B . 38 LEU HD11 1 1 15 11321 2 2 17 LEU HD12 H -0.703 -2.059 -7.226 1.00 . B B . 38 LEU HD12 1 1 15 11322 2 2 17 LEU HD13 H 0.062 -3.581 -7.683 1.00 . B B . 38 LEU HD13 1 1 15 11323 2 2 17 LEU HD21 H -2.617 -3.330 -6.991 1.00 . B B . 38 LEU HD21 1 1 15 11324 2 2 17 LEU HD22 H -2.941 -4.150 -5.464 1.00 . B B . 38 LEU HD22 1 1 15 11325 2 2 17 LEU HD23 H -2.146 -5.017 -6.779 1.00 . B B . 38 LEU HD23 1 1 15 11326 2 2 17 LEU HG H -1.026 -2.945 -4.932 1.00 . B B . 38 LEU HG 1 1 15 11327 2 2 17 LEU N N -1.882 -4.717 -3.540 1.00 . B B . 38 LEU N 1 1 15 11328 2 2 17 LEU O O 0.247 -7.233 -2.852 1.00 . B B . 38 LEU O 1 1 15 11329 2 2 18 VAL C C 1.149 -6.535 -0.542 1.00 . B B . 39 VAL C 1 1 15 11330 2 2 18 VAL CA C 1.817 -5.530 -1.484 1.00 . B B . 39 VAL CA 1 1 15 11331 2 2 18 VAL CB C 2.244 -4.283 -0.701 1.00 . B B . 39 VAL CB 1 1 15 11332 2 2 18 VAL CG1 C 2.485 -3.128 -1.675 1.00 . B B . 39 VAL CG1 1 1 15 11333 2 2 18 VAL CG2 C 1.142 -3.888 0.287 1.00 . B B . 39 VAL CG2 1 1 15 11334 2 2 18 VAL H H 0.727 -4.198 -2.775 1.00 . B B . 39 VAL H 1 1 15 11335 2 2 18 VAL HA H 2.683 -5.985 -1.943 1.00 . B B . 39 VAL HA 1 1 15 11336 2 2 18 VAL HB H 3.156 -4.491 -0.161 1.00 . B B . 39 VAL HB 1 1 15 11337 2 2 18 VAL HG11 H 3.278 -2.499 -1.300 1.00 . B B . 39 VAL HG11 1 1 15 11338 2 2 18 VAL HG12 H 1.581 -2.548 -1.775 1.00 . B B . 39 VAL HG12 1 1 15 11339 2 2 18 VAL HG13 H 2.766 -3.525 -2.640 1.00 . B B . 39 VAL HG13 1 1 15 11340 2 2 18 VAL HG21 H 0.900 -4.733 0.913 1.00 . B B . 39 VAL HG21 1 1 15 11341 2 2 18 VAL HG22 H 0.263 -3.581 -0.259 1.00 . B B . 39 VAL HG22 1 1 15 11342 2 2 18 VAL HG23 H 1.487 -3.072 0.902 1.00 . B B . 39 VAL HG23 1 1 15 11343 2 2 18 VAL N N 0.842 -5.142 -2.536 1.00 . B B . 39 VAL N 1 1 15 11344 2 2 18 VAL O O 1.799 -7.356 0.072 1.00 . B B . 39 VAL O 1 1 15 11345 2 2 19 CYS C C -1.850 -8.255 -0.351 1.00 . B B . 40 CYS C 1 1 15 11346 2 2 19 CYS CA C -0.871 -7.414 0.470 1.00 . B B . 40 CYS CA 1 1 15 11347 2 2 19 CYS CB C -1.643 -6.624 1.529 1.00 . B B . 40 CYS CB 1 1 15 11348 2 2 19 CYS H H -0.654 -5.797 -0.934 1.00 . B B . 40 CYS H 1 1 15 11349 2 2 19 CYS HA H -0.157 -8.063 0.955 1.00 . B B . 40 CYS HA 1 1 15 11350 2 2 19 CYS HB2 H -1.874 -5.641 1.147 1.00 . B B . 40 CYS HB2 1 1 15 11351 2 2 19 CYS HB3 H -2.561 -7.142 1.767 1.00 . B B . 40 CYS HB3 1 1 15 11352 2 2 19 CYS N N -0.151 -6.469 -0.428 1.00 . B B . 40 CYS N 1 1 15 11353 2 2 19 CYS O O -2.933 -8.573 0.099 1.00 . B B . 40 CYS O 1 1 15 11354 2 2 19 CYS SG S -0.633 -6.467 3.024 1.00 . B B . 40 CYS SG 1 1 15 11355 2 2 20 GLY C C -3.063 -10.516 -1.551 1.00 . B B . 41 GLY C 1 1 15 11356 2 2 20 GLY CA C -2.391 -9.436 -2.402 1.00 . B B . 41 GLY CA 1 1 15 11357 2 2 20 GLY H H -0.603 -8.345 -1.896 1.00 . B B . 41 GLY H 1 1 15 11358 2 2 20 GLY HA2 H -3.147 -8.797 -2.836 1.00 . B B . 41 GLY HA2 1 1 15 11359 2 2 20 GLY HA3 H -1.823 -9.907 -3.190 1.00 . B B . 41 GLY HA3 1 1 15 11360 2 2 20 GLY N N -1.480 -8.616 -1.552 1.00 . B B . 41 GLY N 1 1 15 11361 2 2 20 GLY O O -4.267 -10.524 -1.383 1.00 . B B . 41 GLY O 1 1 15 11362 2 2 21 GLU C C -2.291 -12.495 1.221 1.00 . B B . 42 GLU C 1 1 15 11363 2 2 21 GLU CA C -2.912 -12.504 -0.177 1.00 . B B . 42 GLU CA 1 1 15 11364 2 2 21 GLU CB C -2.672 -13.865 -0.833 1.00 . B B . 42 GLU CB 1 1 15 11365 2 2 21 GLU CD C -0.915 -14.735 -2.380 1.00 . B B . 42 GLU CD 1 1 15 11366 2 2 21 GLU CG C -1.170 -14.092 -1.015 1.00 . B B . 42 GLU CG 1 1 15 11367 2 2 21 GLU H H -1.332 -11.411 -1.158 1.00 . B B . 42 GLU H 1 1 15 11368 2 2 21 GLU HA H -3.971 -12.328 -0.096 1.00 . B B . 42 GLU HA 1 1 15 11369 2 2 21 GLU HB2 H -3.080 -14.643 -0.204 1.00 . B B . 42 GLU HB2 1 1 15 11370 2 2 21 GLU HB3 H -3.157 -13.891 -1.798 1.00 . B B . 42 GLU HB3 1 1 15 11371 2 2 21 GLU HG2 H -0.653 -13.145 -0.960 1.00 . B B . 42 GLU HG2 1 1 15 11372 2 2 21 GLU HG3 H -0.808 -14.747 -0.237 1.00 . B B . 42 GLU HG3 1 1 15 11373 2 2 21 GLU N N -2.301 -11.430 -1.012 1.00 . B B . 42 GLU N 1 1 15 11374 2 2 21 GLU O O -2.879 -12.968 2.173 1.00 . B B . 42 GLU O 1 1 15 11375 2 2 21 GLU OE1 O -1.872 -14.916 -3.115 1.00 . B B . 42 GLU OE1 1 1 15 11376 2 2 21 GLU OE2 O 0.231 -15.038 -2.666 1.00 . B B . 42 GLU OE2 1 1 15 11377 2 2 22 ARG C C -1.004 -10.745 3.494 1.00 . B B . 43 ARG C 1 1 15 11378 2 2 22 ARG CA C -0.458 -11.928 2.693 1.00 . B B . 43 ARG CA 1 1 15 11379 2 2 22 ARG CB C 1.056 -11.785 2.522 1.00 . B B . 43 ARG CB 1 1 15 11380 2 2 22 ARG CD C 2.333 -9.635 2.502 1.00 . B B . 43 ARG CD 1 1 15 11381 2 2 22 ARG CG C 1.374 -10.527 1.711 1.00 . B B . 43 ARG CG 1 1 15 11382 2 2 22 ARG CZ C 4.586 -10.258 1.858 1.00 . B B . 43 ARG CZ 1 1 15 11383 2 2 22 ARG H H -0.651 -11.587 0.576 1.00 . B B . 43 ARG H 1 1 15 11384 2 2 22 ARG HA H -0.674 -12.846 3.219 1.00 . B B . 43 ARG HA 1 1 15 11385 2 2 22 ARG HB2 H 1.524 -11.716 3.494 1.00 . B B . 43 ARG HB2 1 1 15 11386 2 2 22 ARG HB3 H 1.437 -12.649 2.002 1.00 . B B . 43 ARG HB3 1 1 15 11387 2 2 22 ARG HD2 H 2.524 -8.729 1.945 1.00 . B B . 43 ARG HD2 1 1 15 11388 2 2 22 ARG HD3 H 1.888 -9.385 3.454 1.00 . B B . 43 ARG HD3 1 1 15 11389 2 2 22 ARG HE H 3.737 -10.904 3.533 1.00 . B B . 43 ARG HE 1 1 15 11390 2 2 22 ARG HG2 H 1.835 -10.811 0.776 1.00 . B B . 43 ARG HG2 1 1 15 11391 2 2 22 ARG HG3 H 0.461 -9.986 1.513 1.00 . B B . 43 ARG HG3 1 1 15 11392 2 2 22 ARG HH11 H 3.436 -9.430 0.444 1.00 . B B . 43 ARG HH11 1 1 15 11393 2 2 22 ARG HH12 H 5.096 -9.671 0.013 1.00 . B B . 43 ARG HH12 1 1 15 11394 2 2 22 ARG HH21 H 5.964 -11.059 3.069 1.00 . B B . 43 ARG HH21 1 1 15 11395 2 2 22 ARG HH22 H 6.527 -10.593 1.499 1.00 . B B . 43 ARG HH22 1 1 15 11396 2 2 22 ARG N N -1.109 -11.963 1.354 1.00 . B B . 43 ARG N 1 1 15 11397 2 2 22 ARG NE N 3.618 -10.357 2.729 1.00 . B B . 43 ARG NE 1 1 15 11398 2 2 22 ARG NH1 N 4.354 -9.746 0.680 1.00 . B B . 43 ARG NH1 1 1 15 11399 2 2 22 ARG NH2 N 5.786 -10.668 2.166 1.00 . B B . 43 ARG NH2 1 1 15 11400 2 2 22 ARG O O -0.756 -9.599 3.178 1.00 . B B . 43 ARG O 1 1 15 11401 2 2 23 GLY C C -3.268 -9.071 4.499 1.00 . B B . 44 GLY C 1 1 15 11402 2 2 23 GLY CA C -2.314 -9.909 5.353 1.00 . B B . 44 GLY CA 1 1 15 11403 2 2 23 GLY H H -1.937 -11.948 4.767 1.00 . B B . 44 GLY H 1 1 15 11404 2 2 23 GLY HA2 H -2.851 -10.324 6.194 1.00 . B B . 44 GLY HA2 1 1 15 11405 2 2 23 GLY HA3 H -1.513 -9.281 5.711 1.00 . B B . 44 GLY HA3 1 1 15 11406 2 2 23 GLY N N -1.749 -11.016 4.530 1.00 . B B . 44 GLY N 1 1 15 11407 2 2 23 GLY O O -2.866 -8.129 3.846 1.00 . B B . 44 GLY O 1 1 15 11408 2 2 24 GLY C C -6.791 -8.415 4.493 1.00 . B B . 45 GLY C 1 1 15 11409 2 2 24 GLY CA C -5.509 -8.627 3.685 1.00 . B B . 45 GLY CA 1 1 15 11410 2 2 24 GLY H H -4.835 -10.170 5.032 1.00 . B B . 45 GLY H 1 1 15 11411 2 2 24 GLY HA2 H -5.080 -7.669 3.428 1.00 . B B . 45 GLY HA2 1 1 15 11412 2 2 24 GLY HA3 H -5.742 -9.172 2.783 1.00 . B B . 45 GLY HA3 1 1 15 11413 2 2 24 GLY N N -4.530 -9.406 4.498 1.00 . B B . 45 GLY N 1 1 15 11414 2 2 24 GLY O O -7.541 -9.338 4.739 1.00 . B B . 45 GLY O 1 1 15 11415 2 2 25 PHE C C -8.600 -5.437 5.641 1.00 . B B . 46 PHE C 1 1 15 11416 2 2 25 PHE CA C -8.280 -6.931 5.698 1.00 . B B . 46 PHE CA 1 1 15 11417 2 2 25 PHE CB C -8.053 -7.348 7.152 1.00 . B B . 46 PHE CB 1 1 15 11418 2 2 25 PHE CD1 C -10.653 -7.473 7.113 1.00 . B B . 46 PHE CD1 1 1 15 11419 2 2 25 PHE CD2 C -9.482 -8.474 9.002 1.00 . B B . 46 PHE CD2 1 1 15 11420 2 2 25 PHE CE1 C -11.873 -7.860 7.681 1.00 . B B . 46 PHE CE1 1 1 15 11421 2 2 25 PHE CE2 C -10.714 -8.852 9.550 1.00 . B B . 46 PHE CE2 1 1 15 11422 2 2 25 PHE CG C -9.421 -7.775 7.771 1.00 . B B . 46 PHE CG 1 1 15 11423 2 2 25 PHE CZ C -11.903 -8.545 8.893 1.00 . B B . 46 PHE CZ 1 1 15 11424 2 2 25 PHE H H -6.429 -6.474 4.696 1.00 . B B . 46 PHE H 1 1 15 11425 2 2 25 PHE HA H -9.105 -7.493 5.286 1.00 . B B . 46 PHE HA 1 1 15 11426 2 2 25 PHE HB2 H -7.329 -8.180 7.169 1.00 . B B . 46 PHE HB2 1 1 15 11427 2 2 25 PHE HB3 H -7.626 -6.497 7.701 1.00 . B B . 46 PHE HB3 1 1 15 11428 2 2 25 PHE HD1 H -10.672 -6.948 6.177 1.00 . B B . 46 PHE HD1 1 1 15 11429 2 2 25 PHE HD2 H -8.595 -8.727 9.529 1.00 . B B . 46 PHE HD2 1 1 15 11430 2 2 25 PHE HE1 H -12.798 -7.626 7.174 1.00 . B B . 46 PHE HE1 1 1 15 11431 2 2 25 PHE HE2 H -10.742 -9.384 10.489 1.00 . B B . 46 PHE HE2 1 1 15 11432 2 2 25 PHE HZ H -12.849 -8.840 9.323 1.00 . B B . 46 PHE HZ 1 1 15 11433 2 2 25 PHE N N -7.047 -7.204 4.906 1.00 . B B . 46 PHE N 1 1 15 11434 2 2 25 PHE O O -9.268 -4.902 6.503 1.00 . B B . 46 PHE O 1 1 15 11435 2 2 26 TYR C C -9.843 -3.094 4.037 1.00 . B B . 47 TYR C 1 1 15 11436 2 2 26 TYR CA C -8.407 -3.300 4.518 1.00 . B B . 47 TYR CA 1 1 15 11437 2 2 26 TYR CB C -7.440 -2.672 3.513 1.00 . B B . 47 TYR CB 1 1 15 11438 2 2 26 TYR CD1 C -8.343 -0.237 3.378 1.00 . B B . 47 TYR CD1 1 1 15 11439 2 2 26 TYR CD2 C -6.220 -0.608 4.516 1.00 . B B . 47 TYR CD2 1 1 15 11440 2 2 26 TYR CE1 C -8.235 1.133 3.649 1.00 . B B . 47 TYR CE1 1 1 15 11441 2 2 26 TYR CE2 C -6.132 0.766 4.774 1.00 . B B . 47 TYR CE2 1 1 15 11442 2 2 26 TYR CG C -7.330 -1.142 3.806 1.00 . B B . 47 TYR CG 1 1 15 11443 2 2 26 TYR CZ C -7.135 1.631 4.341 1.00 . B B . 47 TYR CZ 1 1 15 11444 2 2 26 TYR H H -7.592 -5.209 3.946 1.00 . B B . 47 TYR H 1 1 15 11445 2 2 26 TYR HA H -8.280 -2.832 5.483 1.00 . B B . 47 TYR HA 1 1 15 11446 2 2 26 TYR HB2 H -6.461 -3.169 3.611 1.00 . B B . 47 TYR HB2 1 1 15 11447 2 2 26 TYR HB3 H -7.824 -2.847 2.498 1.00 . B B . 47 TYR HB3 1 1 15 11448 2 2 26 TYR HD1 H -9.208 -0.583 2.854 1.00 . B B . 47 TYR HD1 1 1 15 11449 2 2 26 TYR HD2 H -5.436 -1.241 4.869 1.00 . B B . 47 TYR HD2 1 1 15 11450 2 2 26 TYR HE1 H -9.010 1.809 3.317 1.00 . B B . 47 TYR HE1 1 1 15 11451 2 2 26 TYR HE2 H -5.283 1.157 5.314 1.00 . B B . 47 TYR HE2 1 1 15 11452 2 2 26 TYR HH H -6.514 3.382 3.900 1.00 . B B . 47 TYR HH 1 1 15 11453 2 2 26 TYR N N -8.129 -4.759 4.631 1.00 . B B . 47 TYR N 1 1 15 11454 2 2 26 TYR O O -10.399 -2.020 4.152 1.00 . B B . 47 TYR O 1 1 15 11455 2 2 26 TYR OH O -7.037 2.983 4.599 1.00 . B B . 47 TYR OH 1 1 15 11456 2 2 27 THR C C -12.472 -5.363 2.844 1.00 . B B . 48 THR C 1 1 15 11457 2 2 27 THR CA C -11.848 -3.980 3.009 1.00 . B B . 48 THR CA 1 1 15 11458 2 2 27 THR CB C -11.847 -3.254 1.661 1.00 . B B . 48 THR CB 1 1 15 11459 2 2 27 THR CG2 C -13.287 -2.988 1.221 1.00 . B B . 48 THR CG2 1 1 15 11460 2 2 27 THR H H -9.981 -4.973 3.415 1.00 . B B . 48 THR H 1 1 15 11461 2 2 27 THR HA H -12.422 -3.415 3.718 1.00 . B B . 48 THR HA 1 1 15 11462 2 2 27 THR HB H -11.357 -3.867 0.921 1.00 . B B . 48 THR HB 1 1 15 11463 2 2 27 THR HG1 H -11.698 -1.428 2.314 1.00 . B B . 48 THR HG1 1 1 15 11464 2 2 27 THR HG21 H -13.954 -3.151 2.055 1.00 . B B . 48 THR HG21 1 1 15 11465 2 2 27 THR HG22 H -13.547 -3.659 0.416 1.00 . B B . 48 THR HG22 1 1 15 11466 2 2 27 THR HG23 H -13.378 -1.966 0.882 1.00 . B B . 48 THR HG23 1 1 15 11467 2 2 27 THR N N -10.448 -4.116 3.499 1.00 . B B . 48 THR N 1 1 15 11468 2 2 27 THR O O -13.305 -5.779 3.624 1.00 . B B . 48 THR O 1 1 15 11469 2 2 27 THR OG1 O -11.153 -2.021 1.791 1.00 . B B . 48 THR OG1 1 1 15 11470 2 2 28 LYS C C -12.043 -8.027 0.323 1.00 . B B . 49 LYS C 1 1 15 11471 2 2 28 LYS CA C -12.645 -7.430 1.601 1.00 . B B . 49 LYS CA 1 1 15 11472 2 2 28 LYS CB C -14.164 -7.321 1.446 1.00 . B B . 49 LYS CB 1 1 15 11473 2 2 28 LYS CD C -15.596 -9.083 2.490 1.00 . B B . 49 LYS CD 1 1 15 11474 2 2 28 LYS CE C -15.666 -10.606 2.627 1.00 . B B . 49 LYS CE 1 1 15 11475 2 2 28 LYS CG C -14.763 -8.717 1.260 1.00 . B B . 49 LYS CG 1 1 15 11476 2 2 28 LYS H H -11.407 -5.708 1.219 1.00 . B B . 49 LYS H 1 1 15 11477 2 2 28 LYS HA H -12.415 -8.065 2.443 1.00 . B B . 49 LYS HA 1 1 15 11478 2 2 28 LYS HB2 H -14.584 -6.864 2.331 1.00 . B B . 49 LYS HB2 1 1 15 11479 2 2 28 LYS HB3 H -14.395 -6.714 0.584 1.00 . B B . 49 LYS HB3 1 1 15 11480 2 2 28 LYS HD2 H -15.139 -8.661 3.374 1.00 . B B . 49 LYS HD2 1 1 15 11481 2 2 28 LYS HD3 H -16.595 -8.688 2.377 1.00 . B B . 49 LYS HD3 1 1 15 11482 2 2 28 LYS HE2 H -15.737 -11.053 1.646 1.00 . B B . 49 LYS HE2 1 1 15 11483 2 2 28 LYS HE3 H -14.776 -10.964 3.124 1.00 . B B . 49 LYS HE3 1 1 15 11484 2 2 28 LYS HG2 H -15.394 -8.723 0.382 1.00 . B B . 49 LYS HG2 1 1 15 11485 2 2 28 LYS HG3 H -13.968 -9.438 1.138 1.00 . B B . 49 LYS HG3 1 1 15 11486 2 2 28 LYS HZ1 H -16.720 -10.701 4.421 1.00 . B B . 49 LYS HZ1 1 1 15 11487 2 2 28 LYS HZ2 H -17.017 -12.004 3.373 1.00 . B B . 49 LYS HZ2 1 1 15 11488 2 2 28 LYS HZ3 H -17.701 -10.483 3.054 1.00 . B B . 49 LYS HZ3 1 1 15 11489 2 2 28 LYS N N -12.077 -6.072 1.831 1.00 . B B . 49 LYS N 1 1 15 11490 2 2 28 LYS NZ N -16.867 -10.976 3.430 1.00 . B B . 49 LYS NZ 1 1 15 11491 2 2 28 LYS O O -12.493 -7.730 -0.765 1.00 . B B . 49 LYS O 1 1 15 11492 2 2 29 PRO C C -11.201 -10.662 -1.175 1.00 . B B . 50 PRO C 1 1 15 11493 2 2 29 PRO CA C -10.354 -9.508 -0.628 1.00 . B B . 50 PRO CA 1 1 15 11494 2 2 29 PRO CB C -9.054 -10.026 -0.007 1.00 . B B . 50 PRO CB 1 1 15 11495 2 2 29 PRO CD C -10.499 -9.206 1.820 1.00 . B B . 50 PRO CD 1 1 15 11496 2 2 29 PRO CG C -9.315 -10.140 1.512 1.00 . B B . 50 PRO CG 1 1 15 11497 2 2 29 PRO HA H -10.134 -8.795 -1.399 1.00 . B B . 50 PRO HA 1 1 15 11498 2 2 29 PRO HB2 H -8.808 -10.996 -0.419 1.00 . B B . 50 PRO HB2 1 1 15 11499 2 2 29 PRO HB3 H -8.252 -9.329 -0.188 1.00 . B B . 50 PRO HB3 1 1 15 11500 2 2 29 PRO HD2 H -11.244 -9.722 2.407 1.00 . B B . 50 PRO HD2 1 1 15 11501 2 2 29 PRO HD3 H -10.158 -8.318 2.329 1.00 . B B . 50 PRO HD3 1 1 15 11502 2 2 29 PRO HG2 H -9.567 -11.160 1.768 1.00 . B B . 50 PRO HG2 1 1 15 11503 2 2 29 PRO HG3 H -8.445 -9.821 2.064 1.00 . B B . 50 PRO HG3 1 1 15 11504 2 2 29 PRO N N -11.040 -8.852 0.495 1.00 . B B . 50 PRO N 1 1 15 11505 2 2 29 PRO O O -11.957 -11.285 -0.456 1.00 . B B . 50 PRO O 1 1 15 11506 2 2 30 THR C C -13.365 -11.707 -2.992 1.00 . B B . 51 THR C 1 1 15 11507 2 2 30 THR CA C -11.877 -12.063 -3.036 1.00 . B B . 51 THR CA 1 1 15 11508 2 2 30 THR CB C -11.636 -13.348 -2.238 1.00 . B B . 51 THR CB 1 1 15 11509 2 2 30 THR CG2 C -11.995 -14.560 -3.100 1.00 . B B . 51 THR CG2 1 1 15 11510 2 2 30 THR H H -10.464 -10.437 -3.005 1.00 . B B . 51 THR H 1 1 15 11511 2 2 30 THR HA H -11.574 -12.216 -4.061 1.00 . B B . 51 THR HA 1 1 15 11512 2 2 30 THR HB H -12.253 -13.345 -1.353 1.00 . B B . 51 THR HB 1 1 15 11513 2 2 30 THR HG1 H -10.163 -14.161 -1.263 1.00 . B B . 51 THR HG1 1 1 15 11514 2 2 30 THR HG21 H -11.383 -14.562 -3.990 1.00 . B B . 51 THR HG21 1 1 15 11515 2 2 30 THR HG22 H -13.037 -14.508 -3.380 1.00 . B B . 51 THR HG22 1 1 15 11516 2 2 30 THR HG23 H -11.818 -15.466 -2.539 1.00 . B B . 51 THR HG23 1 1 15 11517 2 2 30 THR N N -11.080 -10.951 -2.443 1.00 . B B . 51 THR N 1 1 15 11518 2 2 30 THR O O -14.163 -12.536 -3.399 1.00 . B B . 51 THR O 1 1 15 11519 2 2 30 THR OXT O -13.680 -10.613 -2.556 1.00 . B B . 51 THR OXT 1 1 15 11520 2 2 30 THR OG1 O -10.268 -13.419 -1.863 1.00 . B B . 51 THR OG1 1 1 16 11521 1 1 1 GLY C C -3.999 9.584 2.994 1.00 . A A . 1 GLY C 1 1 16 11522 1 1 1 GLY CA C -5.237 10.379 3.246 1.00 . A A . 1 GLY CA 1 1 16 11523 1 1 1 GLY H1 H -6.785 10.460 4.686 1.00 . A A . 1 GLY H1 1 1 16 11524 1 1 1 GLY H2 H -6.026 8.944 4.587 1.00 . A A . 1 GLY H2 1 1 16 11525 1 1 1 GLY H3 H -7.122 9.426 3.382 1.00 . A A . 1 GLY H3 1 1 16 11526 1 1 1 GLY HA2 H -5.372 10.279 2.285 1.00 . A A . 1 GLY HA2 1 1 16 11527 1 1 1 GLY HA3 H -5.163 11.494 3.583 1.00 . A A . 1 GLY HA3 1 1 16 11528 1 1 1 GLY N N -6.384 9.752 4.038 1.00 . A A . 1 GLY N 1 1 16 11529 1 1 1 GLY O O -2.926 9.936 3.441 1.00 . A A . 1 GLY O 1 1 16 11530 1 1 2 ILE C C -2.275 8.124 0.672 1.00 . A A . 2 ILE C 1 1 16 11531 1 1 2 ILE CA C -2.906 7.665 1.993 1.00 . A A . 2 ILE CA 1 1 16 11532 1 1 2 ILE CB C -3.292 6.165 1.962 1.00 . A A . 2 ILE CB 1 1 16 11533 1 1 2 ILE CD1 C -2.966 4.054 0.720 1.00 . A A . 2 ILE CD1 1 1 16 11534 1 1 2 ILE CG1 C -3.133 5.557 0.565 1.00 . A A . 2 ILE CG1 1 1 16 11535 1 1 2 ILE CG2 C -4.743 5.975 2.414 1.00 . A A . 2 ILE CG2 1 1 16 11536 1 1 2 ILE H H -4.985 8.234 1.924 1.00 . A A . 2 ILE H 1 1 16 11537 1 1 2 ILE HA H -2.188 7.810 2.781 1.00 . A A . 2 ILE HA 1 1 16 11538 1 1 2 ILE HB H -2.648 5.634 2.650 1.00 . A A . 2 ILE HB 1 1 16 11539 1 1 2 ILE HD11 H -3.328 3.559 -0.165 1.00 . A A . 2 ILE HD11 1 1 16 11540 1 1 2 ILE HD12 H -3.529 3.722 1.580 1.00 . A A . 2 ILE HD12 1 1 16 11541 1 1 2 ILE HD13 H -1.921 3.825 0.865 1.00 . A A . 2 ILE HD13 1 1 16 11542 1 1 2 ILE HG12 H -4.011 5.769 -0.028 1.00 . A A . 2 ILE HG12 1 1 16 11543 1 1 2 ILE HG13 H -2.259 5.960 0.080 1.00 . A A . 2 ILE HG13 1 1 16 11544 1 1 2 ILE HG21 H -4.881 4.961 2.760 1.00 . A A . 2 ILE HG21 1 1 16 11545 1 1 2 ILE HG22 H -5.407 6.166 1.584 1.00 . A A . 2 ILE HG22 1 1 16 11546 1 1 2 ILE HG23 H -4.964 6.663 3.218 1.00 . A A . 2 ILE HG23 1 1 16 11547 1 1 2 ILE N N -4.110 8.499 2.277 1.00 . A A . 2 ILE N 1 1 16 11548 1 1 2 ILE O O -1.092 7.960 0.449 1.00 . A A . 2 ILE O 1 1 16 11549 1 1 3 VAL C C -1.703 10.448 -1.293 1.00 . A A . 3 VAL C 1 1 16 11550 1 1 3 VAL CA C -2.496 9.161 -1.505 1.00 . A A . 3 VAL CA 1 1 16 11551 1 1 3 VAL CB C -3.639 9.434 -2.480 1.00 . A A . 3 VAL CB 1 1 16 11552 1 1 3 VAL CG1 C -4.594 8.246 -2.480 1.00 . A A . 3 VAL CG1 1 1 16 11553 1 1 3 VAL CG2 C -4.396 10.691 -2.044 1.00 . A A . 3 VAL CG2 1 1 16 11554 1 1 3 VAL H H -4.006 8.820 -0.006 1.00 . A A . 3 VAL H 1 1 16 11555 1 1 3 VAL HA H -1.849 8.399 -1.912 1.00 . A A . 3 VAL HA 1 1 16 11556 1 1 3 VAL HB H -3.239 9.576 -3.474 1.00 . A A . 3 VAL HB 1 1 16 11557 1 1 3 VAL HG11 H -5.538 8.546 -2.050 1.00 . A A . 3 VAL HG11 1 1 16 11558 1 1 3 VAL HG12 H -4.168 7.446 -1.894 1.00 . A A . 3 VAL HG12 1 1 16 11559 1 1 3 VAL HG13 H -4.749 7.910 -3.493 1.00 . A A . 3 VAL HG13 1 1 16 11560 1 1 3 VAL HG21 H -3.713 11.526 -2.001 1.00 . A A . 3 VAL HG21 1 1 16 11561 1 1 3 VAL HG22 H -4.830 10.529 -1.068 1.00 . A A . 3 VAL HG22 1 1 16 11562 1 1 3 VAL HG23 H -5.180 10.903 -2.756 1.00 . A A . 3 VAL HG23 1 1 16 11563 1 1 3 VAL N N -3.054 8.696 -0.203 1.00 . A A . 3 VAL N 1 1 16 11564 1 1 3 VAL O O -1.026 10.925 -2.180 1.00 . A A . 3 VAL O 1 1 16 11565 1 1 4 GLU C C 0.256 11.961 0.869 1.00 . A A . 4 GLU C 1 1 16 11566 1 1 4 GLU CA C -1.046 12.281 0.134 1.00 . A A . 4 GLU CA 1 1 16 11567 1 1 4 GLU CB C -1.916 13.205 0.989 1.00 . A A . 4 GLU CB 1 1 16 11568 1 1 4 GLU CD C -4.144 14.325 0.781 1.00 . A A . 4 GLU CD 1 1 16 11569 1 1 4 GLU CG C -3.387 13.005 0.612 1.00 . A A . 4 GLU CG 1 1 16 11570 1 1 4 GLU H H -2.346 10.624 0.574 1.00 . A A . 4 GLU H 1 1 16 11571 1 1 4 GLU HA H -0.820 12.767 -0.804 1.00 . A A . 4 GLU HA 1 1 16 11572 1 1 4 GLU HB2 H -1.774 12.968 2.034 1.00 . A A . 4 GLU HB2 1 1 16 11573 1 1 4 GLU HB3 H -1.636 14.232 0.810 1.00 . A A . 4 GLU HB3 1 1 16 11574 1 1 4 GLU HG2 H -3.453 12.679 -0.418 1.00 . A A . 4 GLU HG2 1 1 16 11575 1 1 4 GLU HG3 H -3.826 12.255 1.253 1.00 . A A . 4 GLU HG3 1 1 16 11576 1 1 4 GLU N N -1.788 11.020 -0.128 1.00 . A A . 4 GLU N 1 1 16 11577 1 1 4 GLU O O 1.122 12.800 1.014 1.00 . A A . 4 GLU O 1 1 16 11578 1 1 4 GLU OE1 O -4.120 15.120 -0.144 1.00 . A A . 4 GLU OE1 1 1 16 11579 1 1 4 GLU OE2 O -4.735 14.516 1.831 1.00 . A A . 4 GLU OE2 1 1 16 11580 1 1 5 GLN C C 2.522 9.497 1.143 1.00 . A A . 5 GLN C 1 1 16 11581 1 1 5 GLN CA C 1.649 10.369 2.051 1.00 . A A . 5 GLN CA 1 1 16 11582 1 1 5 GLN CB C 1.284 9.586 3.315 1.00 . A A . 5 GLN CB 1 1 16 11583 1 1 5 GLN CD C 2.132 8.764 5.518 1.00 . A A . 5 GLN CD 1 1 16 11584 1 1 5 GLN CG C 2.458 9.624 4.295 1.00 . A A . 5 GLN CG 1 1 16 11585 1 1 5 GLN H H -0.308 10.086 1.198 1.00 . A A . 5 GLN H 1 1 16 11586 1 1 5 GLN HA H 2.192 11.261 2.325 1.00 . A A . 5 GLN HA 1 1 16 11587 1 1 5 GLN HB2 H 0.415 10.033 3.776 1.00 . A A . 5 GLN HB2 1 1 16 11588 1 1 5 GLN HB3 H 1.068 8.561 3.054 1.00 . A A . 5 GLN HB3 1 1 16 11589 1 1 5 GLN HE21 H 3.514 9.615 6.662 1.00 . A A . 5 GLN HE21 1 1 16 11590 1 1 5 GLN HE22 H 2.604 8.393 7.410 1.00 . A A . 5 GLN HE22 1 1 16 11591 1 1 5 GLN HG2 H 3.344 9.240 3.809 1.00 . A A . 5 GLN HG2 1 1 16 11592 1 1 5 GLN HG3 H 2.632 10.641 4.610 1.00 . A A . 5 GLN HG3 1 1 16 11593 1 1 5 GLN N N 0.402 10.749 1.329 1.00 . A A . 5 GLN N 1 1 16 11594 1 1 5 GLN NE2 N 2.806 8.938 6.621 1.00 . A A . 5 GLN NE2 1 1 16 11595 1 1 5 GLN O O 3.734 9.556 1.190 1.00 . A A . 5 GLN O 1 1 16 11596 1 1 5 GLN OE1 O 1.254 7.925 5.468 1.00 . A A . 5 GLN OE1 1 1 16 11597 1 1 6 CYS C C 2.884 8.492 -1.947 1.00 . A A . 6 CYS C 1 1 16 11598 1 1 6 CYS CA C 2.705 7.805 -0.590 1.00 . A A . 6 CYS CA 1 1 16 11599 1 1 6 CYS CB C 1.968 6.478 -0.772 1.00 . A A . 6 CYS CB 1 1 16 11600 1 1 6 CYS H H 0.934 8.651 0.300 1.00 . A A . 6 CYS H 1 1 16 11601 1 1 6 CYS HA H 3.675 7.620 -0.154 1.00 . A A . 6 CYS HA 1 1 16 11602 1 1 6 CYS HB2 H 1.013 6.656 -1.245 1.00 . A A . 6 CYS HB2 1 1 16 11603 1 1 6 CYS HB3 H 2.559 5.816 -1.387 1.00 . A A . 6 CYS HB3 1 1 16 11604 1 1 6 CYS N N 1.913 8.685 0.319 1.00 . A A . 6 CYS N 1 1 16 11605 1 1 6 CYS O O 3.982 8.849 -2.325 1.00 . A A . 6 CYS O 1 1 16 11606 1 1 6 CYS SG S 1.709 5.721 0.852 1.00 . A A . 6 CYS SG 1 1 16 11607 1 1 7 CYS C C 2.894 10.531 -3.888 1.00 . A A . 7 CYS C 1 1 16 11608 1 1 7 CYS CA C 1.921 9.356 -4.008 1.00 . A A . 7 CYS CA 1 1 16 11609 1 1 7 CYS CB C 0.534 9.857 -4.424 1.00 . A A . 7 CYS CB 1 1 16 11610 1 1 7 CYS H H 0.940 8.390 -2.349 1.00 . A A . 7 CYS H 1 1 16 11611 1 1 7 CYS HA H 2.295 8.653 -4.746 1.00 . A A . 7 CYS HA 1 1 16 11612 1 1 7 CYS HB2 H -0.187 9.064 -4.288 1.00 . A A . 7 CYS HB2 1 1 16 11613 1 1 7 CYS HB3 H 0.255 10.699 -3.812 1.00 . A A . 7 CYS HB3 1 1 16 11614 1 1 7 CYS N N 1.815 8.683 -2.678 1.00 . A A . 7 CYS N 1 1 16 11615 1 1 7 CYS O O 4.039 10.432 -4.271 1.00 . A A . 7 CYS O 1 1 16 11616 1 1 7 CYS SG S 0.548 10.357 -6.164 1.00 . A A . 7 CYS SG 1 1 16 11617 1 1 8 THR C C 4.483 12.370 -2.176 1.00 . A A . 8 THR C 1 1 16 11618 1 1 8 THR CA C 3.399 12.781 -3.171 1.00 . A A . 8 THR CA 1 1 16 11619 1 1 8 THR CB C 2.636 13.996 -2.638 1.00 . A A . 8 THR CB 1 1 16 11620 1 1 8 THR CG2 C 1.813 13.588 -1.416 1.00 . A A . 8 THR CG2 1 1 16 11621 1 1 8 THR H H 1.547 11.694 -3.001 1.00 . A A . 8 THR H 1 1 16 11622 1 1 8 THR HA H 3.850 13.020 -4.124 1.00 . A A . 8 THR HA 1 1 16 11623 1 1 8 THR HB H 1.974 14.370 -3.404 1.00 . A A . 8 THR HB 1 1 16 11624 1 1 8 THR HG1 H 3.086 15.843 -2.230 1.00 . A A . 8 THR HG1 1 1 16 11625 1 1 8 THR HG21 H 2.233 14.044 -0.531 1.00 . A A . 8 THR HG21 1 1 16 11626 1 1 8 THR HG22 H 1.833 12.514 -1.311 1.00 . A A . 8 THR HG22 1 1 16 11627 1 1 8 THR HG23 H 0.794 13.920 -1.542 1.00 . A A . 8 THR HG23 1 1 16 11628 1 1 8 THR N N 2.466 11.631 -3.332 1.00 . A A . 8 THR N 1 1 16 11629 1 1 8 THR O O 4.198 11.774 -1.156 1.00 . A A . 8 THR O 1 1 16 11630 1 1 8 THR OG1 O 3.561 15.010 -2.273 1.00 . A A . 8 THR OG1 1 1 16 11631 1 1 9 SER C C 7.027 10.735 -1.697 1.00 . A A . 9 SER C 1 1 16 11632 1 1 9 SER CA C 6.807 12.241 -1.532 1.00 . A A . 9 SER CA 1 1 16 11633 1 1 9 SER CB C 6.392 12.553 -0.093 1.00 . A A . 9 SER CB 1 1 16 11634 1 1 9 SER H H 5.941 13.117 -3.302 1.00 . A A . 9 SER H 1 1 16 11635 1 1 9 SER HA H 7.717 12.771 -1.774 1.00 . A A . 9 SER HA 1 1 16 11636 1 1 9 SER HB2 H 5.744 11.775 0.274 1.00 . A A . 9 SER HB2 1 1 16 11637 1 1 9 SER HB3 H 7.274 12.610 0.532 1.00 . A A . 9 SER HB3 1 1 16 11638 1 1 9 SER HG H 5.285 13.886 0.796 1.00 . A A . 9 SER HG 1 1 16 11639 1 1 9 SER N N 5.723 12.653 -2.466 1.00 . A A . 9 SER N 1 1 16 11640 1 1 9 SER O O 6.637 10.154 -2.689 1.00 . A A . 9 SER O 1 1 16 11641 1 1 9 SER OG O 5.696 13.794 -0.067 1.00 . A A . 9 SER OG 1 1 16 11642 1 1 10 ILE C C 7.365 7.881 0.346 1.00 . A A . 10 ILE C 1 1 16 11643 1 1 10 ILE CA C 7.863 8.622 -0.898 1.00 . A A . 10 ILE CA 1 1 16 11644 1 1 10 ILE CB C 9.351 8.347 -1.105 1.00 . A A . 10 ILE CB 1 1 16 11645 1 1 10 ILE CD1 C 9.075 8.969 -3.510 1.00 . A A . 10 ILE CD1 1 1 16 11646 1 1 10 ILE CG1 C 9.881 9.233 -2.236 1.00 . A A . 10 ILE CG1 1 1 16 11647 1 1 10 ILE CG2 C 9.540 6.880 -1.484 1.00 . A A . 10 ILE CG2 1 1 16 11648 1 1 10 ILE H H 7.955 10.559 0.052 1.00 . A A . 10 ILE H 1 1 16 11649 1 1 10 ILE HA H 7.316 8.269 -1.760 1.00 . A A . 10 ILE HA 1 1 16 11650 1 1 10 ILE HB H 9.890 8.559 -0.192 1.00 . A A . 10 ILE HB 1 1 16 11651 1 1 10 ILE HD11 H 8.426 8.120 -3.356 1.00 . A A . 10 ILE HD11 1 1 16 11652 1 1 10 ILE HD12 H 9.750 8.763 -4.328 1.00 . A A . 10 ILE HD12 1 1 16 11653 1 1 10 ILE HD13 H 8.479 9.839 -3.745 1.00 . A A . 10 ILE HD13 1 1 16 11654 1 1 10 ILE HG12 H 9.784 10.272 -1.955 1.00 . A A . 10 ILE HG12 1 1 16 11655 1 1 10 ILE HG13 H 10.919 9.003 -2.417 1.00 . A A . 10 ILE HG13 1 1 16 11656 1 1 10 ILE HG21 H 8.625 6.500 -1.914 1.00 . A A . 10 ILE HG21 1 1 16 11657 1 1 10 ILE HG22 H 9.787 6.310 -0.601 1.00 . A A . 10 ILE HG22 1 1 16 11658 1 1 10 ILE HG23 H 10.339 6.795 -2.205 1.00 . A A . 10 ILE HG23 1 1 16 11659 1 1 10 ILE N N 7.642 10.088 -0.748 1.00 . A A . 10 ILE N 1 1 16 11660 1 1 10 ILE O O 7.684 8.233 1.465 1.00 . A A . 10 ILE O 1 1 16 11661 1 1 11 CYS C C 7.038 4.952 1.663 1.00 . A A . 11 CYS C 1 1 16 11662 1 1 11 CYS CA C 6.056 6.070 1.307 1.00 . A A . 11 CYS CA 1 1 16 11663 1 1 11 CYS CB C 4.713 5.443 0.923 1.00 . A A . 11 CYS CB 1 1 16 11664 1 1 11 CYS H H 6.345 6.588 -0.762 1.00 . A A . 11 CYS H 1 1 16 11665 1 1 11 CYS HA H 5.922 6.719 2.158 1.00 . A A . 11 CYS HA 1 1 16 11666 1 1 11 CYS HB2 H 4.530 5.601 -0.129 1.00 . A A . 11 CYS HB2 1 1 16 11667 1 1 11 CYS HB3 H 4.743 4.382 1.125 1.00 . A A . 11 CYS HB3 1 1 16 11668 1 1 11 CYS N N 6.584 6.850 0.151 1.00 . A A . 11 CYS N 1 1 16 11669 1 1 11 CYS O O 8.164 4.926 1.210 1.00 . A A . 11 CYS O 1 1 16 11670 1 1 11 CYS SG S 3.379 6.199 1.885 1.00 . A A . 11 CYS SG 1 1 16 11671 1 1 12 SER C C 6.646 1.605 2.880 1.00 . A A . 12 SER C 1 1 16 11672 1 1 12 SER CA C 7.485 2.886 2.858 1.00 . A A . 12 SER CA 1 1 16 11673 1 1 12 SER CB C 8.062 3.142 4.251 1.00 . A A . 12 SER CB 1 1 16 11674 1 1 12 SER H H 5.687 4.068 2.808 1.00 . A A . 12 SER H 1 1 16 11675 1 1 12 SER HA H 8.293 2.783 2.142 1.00 . A A . 12 SER HA 1 1 16 11676 1 1 12 SER HB2 H 8.722 2.336 4.524 1.00 . A A . 12 SER HB2 1 1 16 11677 1 1 12 SER HB3 H 8.617 4.072 4.244 1.00 . A A . 12 SER HB3 1 1 16 11678 1 1 12 SER HG H 6.703 4.128 5.233 1.00 . A A . 12 SER HG 1 1 16 11679 1 1 12 SER N N 6.604 4.022 2.466 1.00 . A A . 12 SER N 1 1 16 11680 1 1 12 SER O O 5.590 1.561 3.479 1.00 . A A . 12 SER O 1 1 16 11681 1 1 12 SER OG O 7.000 3.216 5.192 1.00 . A A . 12 SER OG 1 1 16 11682 1 1 13 LEU C C 5.711 -0.966 3.571 1.00 . A A . 13 LEU C 1 1 16 11683 1 1 13 LEU CA C 6.329 -0.706 2.197 1.00 . A A . 13 LEU CA 1 1 16 11684 1 1 13 LEU CB C 7.267 -1.859 1.833 1.00 . A A . 13 LEU CB 1 1 16 11685 1 1 13 LEU CD1 C 6.803 -3.317 -0.143 1.00 . A A . 13 LEU CD1 1 1 16 11686 1 1 13 LEU CD2 C 6.757 -4.280 2.161 1.00 . A A . 13 LEU CD2 1 1 16 11687 1 1 13 LEU CG C 6.445 -3.041 1.318 1.00 . A A . 13 LEU CG 1 1 16 11688 1 1 13 LEU H H 7.947 0.634 1.741 1.00 . A A . 13 LEU H 1 1 16 11689 1 1 13 LEU HA H 5.545 -0.635 1.459 1.00 . A A . 13 LEU HA 1 1 16 11690 1 1 13 LEU HB2 H 7.954 -1.534 1.065 1.00 . A A . 13 LEU HB2 1 1 16 11691 1 1 13 LEU HB3 H 7.821 -2.162 2.708 1.00 . A A . 13 LEU HB3 1 1 16 11692 1 1 13 LEU HD11 H 6.943 -4.378 -0.285 1.00 . A A . 13 LEU HD11 1 1 16 11693 1 1 13 LEU HD12 H 7.716 -2.797 -0.394 1.00 . A A . 13 LEU HD12 1 1 16 11694 1 1 13 LEU HD13 H 6.004 -2.970 -0.780 1.00 . A A . 13 LEU HD13 1 1 16 11695 1 1 13 LEU HD21 H 7.629 -4.777 1.761 1.00 . A A . 13 LEU HD21 1 1 16 11696 1 1 13 LEU HD22 H 5.914 -4.954 2.135 1.00 . A A . 13 LEU HD22 1 1 16 11697 1 1 13 LEU HD23 H 6.948 -3.982 3.181 1.00 . A A . 13 LEU HD23 1 1 16 11698 1 1 13 LEU HG H 5.393 -2.808 1.393 1.00 . A A . 13 LEU HG 1 1 16 11699 1 1 13 LEU N N 7.101 0.570 2.224 1.00 . A A . 13 LEU N 1 1 16 11700 1 1 13 LEU O O 4.632 -1.512 3.682 1.00 . A A . 13 LEU O 1 1 16 11701 1 1 14 TYR C C 4.448 -0.115 6.066 1.00 . A A . 14 TYR C 1 1 16 11702 1 1 14 TYR CA C 5.815 -0.793 5.980 1.00 . A A . 14 TYR CA 1 1 16 11703 1 1 14 TYR CB C 6.749 -0.191 7.032 1.00 . A A . 14 TYR CB 1 1 16 11704 1 1 14 TYR CD1 C 5.783 -1.777 8.824 1.00 . A A . 14 TYR CD1 1 1 16 11705 1 1 14 TYR CD2 C 6.001 0.585 9.372 1.00 . A A . 14 TYR CD2 1 1 16 11706 1 1 14 TYR CE1 C 5.257 -2.015 10.100 1.00 . A A . 14 TYR CE1 1 1 16 11707 1 1 14 TYR CE2 C 5.473 0.330 10.643 1.00 . A A . 14 TYR CE2 1 1 16 11708 1 1 14 TYR CG C 6.167 -0.465 8.439 1.00 . A A . 14 TYR CG 1 1 16 11709 1 1 14 TYR CZ C 5.103 -0.966 11.006 1.00 . A A . 14 TYR CZ 1 1 16 11710 1 1 14 TYR H H 7.246 -0.126 4.514 1.00 . A A . 14 TYR H 1 1 16 11711 1 1 14 TYR HA H 5.705 -1.852 6.157 1.00 . A A . 14 TYR HA 1 1 16 11712 1 1 14 TYR HB2 H 7.737 -0.640 6.924 1.00 . A A . 14 TYR HB2 1 1 16 11713 1 1 14 TYR HB3 H 6.836 0.879 6.859 1.00 . A A . 14 TYR HB3 1 1 16 11714 1 1 14 TYR HD1 H 5.885 -2.603 8.146 1.00 . A A . 14 TYR HD1 1 1 16 11715 1 1 14 TYR HD2 H 6.269 1.587 9.118 1.00 . A A . 14 TYR HD2 1 1 16 11716 1 1 14 TYR HE1 H 4.967 -3.017 10.384 1.00 . A A . 14 TYR HE1 1 1 16 11717 1 1 14 TYR HE2 H 5.352 1.140 11.347 1.00 . A A . 14 TYR HE2 1 1 16 11718 1 1 14 TYR HH H 5.216 -0.886 12.911 1.00 . A A . 14 TYR HH 1 1 16 11719 1 1 14 TYR N N 6.380 -0.571 4.621 1.00 . A A . 14 TYR N 1 1 16 11720 1 1 14 TYR O O 3.465 -0.721 6.446 1.00 . A A . 14 TYR O 1 1 16 11721 1 1 14 TYR OH O 4.585 -1.208 12.263 1.00 . A A . 14 TYR OH 1 1 16 11722 1 1 15 GLN C C 2.040 1.087 4.938 1.00 . A A . 15 GLN C 1 1 16 11723 1 1 15 GLN CA C 3.072 1.856 5.763 1.00 . A A . 15 GLN CA 1 1 16 11724 1 1 15 GLN CB C 3.239 3.265 5.189 1.00 . A A . 15 GLN CB 1 1 16 11725 1 1 15 GLN CD C 3.630 4.405 7.378 1.00 . A A . 15 GLN CD 1 1 16 11726 1 1 15 GLN CG C 4.253 4.044 6.028 1.00 . A A . 15 GLN CG 1 1 16 11727 1 1 15 GLN H H 5.180 1.607 5.400 1.00 . A A . 15 GLN H 1 1 16 11728 1 1 15 GLN HA H 2.737 1.920 6.787 1.00 . A A . 15 GLN HA 1 1 16 11729 1 1 15 GLN HB2 H 3.590 3.198 4.169 1.00 . A A . 15 GLN HB2 1 1 16 11730 1 1 15 GLN HB3 H 2.288 3.777 5.209 1.00 . A A . 15 GLN HB3 1 1 16 11731 1 1 15 GLN HE21 H 3.419 6.326 6.925 1.00 . A A . 15 GLN HE21 1 1 16 11732 1 1 15 GLN HE22 H 2.882 5.883 8.473 1.00 . A A . 15 GLN HE22 1 1 16 11733 1 1 15 GLN HG2 H 5.131 3.435 6.187 1.00 . A A . 15 GLN HG2 1 1 16 11734 1 1 15 GLN HG3 H 4.531 4.949 5.509 1.00 . A A . 15 GLN HG3 1 1 16 11735 1 1 15 GLN N N 4.376 1.139 5.709 1.00 . A A . 15 GLN N 1 1 16 11736 1 1 15 GLN NE2 N 3.281 5.640 7.611 1.00 . A A . 15 GLN NE2 1 1 16 11737 1 1 15 GLN O O 0.919 0.885 5.360 1.00 . A A . 15 GLN O 1 1 16 11738 1 1 15 GLN OE1 O 3.461 3.555 8.230 1.00 . A A . 15 GLN OE1 1 1 16 11739 1 1 16 LEU C C 0.951 -1.326 3.694 1.00 . A A . 16 LEU C 1 1 16 11740 1 1 16 LEU CA C 1.446 -0.106 2.920 1.00 . A A . 16 LEU CA 1 1 16 11741 1 1 16 LEU CB C 2.135 -0.557 1.632 1.00 . A A . 16 LEU CB 1 1 16 11742 1 1 16 LEU CD1 C 3.497 1.446 1.028 1.00 . A A . 16 LEU CD1 1 1 16 11743 1 1 16 LEU CD2 C 2.362 0.122 -0.760 1.00 . A A . 16 LEU CD2 1 1 16 11744 1 1 16 LEU CG C 2.251 0.632 0.678 1.00 . A A . 16 LEU CG 1 1 16 11745 1 1 16 LEU H H 3.318 0.823 3.440 1.00 . A A . 16 LEU H 1 1 16 11746 1 1 16 LEU HA H 0.605 0.528 2.677 1.00 . A A . 16 LEU HA 1 1 16 11747 1 1 16 LEU HB2 H 3.121 -0.933 1.864 1.00 . A A . 16 LEU HB2 1 1 16 11748 1 1 16 LEU HB3 H 1.552 -1.336 1.165 1.00 . A A . 16 LEU HB3 1 1 16 11749 1 1 16 LEU HD11 H 4.288 0.778 1.337 1.00 . A A . 16 LEU HD11 1 1 16 11750 1 1 16 LEU HD12 H 3.267 2.128 1.834 1.00 . A A . 16 LEU HD12 1 1 16 11751 1 1 16 LEU HD13 H 3.816 2.006 0.162 1.00 . A A . 16 LEU HD13 1 1 16 11752 1 1 16 LEU HD21 H 3.399 -0.069 -0.995 1.00 . A A . 16 LEU HD21 1 1 16 11753 1 1 16 LEU HD22 H 1.970 0.867 -1.438 1.00 . A A . 16 LEU HD22 1 1 16 11754 1 1 16 LEU HD23 H 1.795 -0.791 -0.863 1.00 . A A . 16 LEU HD23 1 1 16 11755 1 1 16 LEU HG H 1.374 1.257 0.774 1.00 . A A . 16 LEU HG 1 1 16 11756 1 1 16 LEU N N 2.409 0.653 3.764 1.00 . A A . 16 LEU N 1 1 16 11757 1 1 16 LEU O O -0.235 -1.575 3.783 1.00 . A A . 16 LEU O 1 1 16 11758 1 1 17 GLU C C 0.365 -2.823 6.066 1.00 . A A . 17 GLU C 1 1 16 11759 1 1 17 GLU CA C 1.408 -3.271 5.044 1.00 . A A . 17 GLU CA 1 1 16 11760 1 1 17 GLU CB C 2.611 -3.882 5.762 1.00 . A A . 17 GLU CB 1 1 16 11761 1 1 17 GLU CD C 3.294 -4.724 3.511 1.00 . A A . 17 GLU CD 1 1 16 11762 1 1 17 GLU CG C 3.105 -5.101 4.982 1.00 . A A . 17 GLU CG 1 1 16 11763 1 1 17 GLU H H 2.796 -1.867 4.201 1.00 . A A . 17 GLU H 1 1 16 11764 1 1 17 GLU HA H 0.972 -4.000 4.377 1.00 . A A . 17 GLU HA 1 1 16 11765 1 1 17 GLU HB2 H 3.402 -3.149 5.824 1.00 . A A . 17 GLU HB2 1 1 16 11766 1 1 17 GLU HB3 H 2.322 -4.183 6.753 1.00 . A A . 17 GLU HB3 1 1 16 11767 1 1 17 GLU HG2 H 4.047 -5.434 5.393 1.00 . A A . 17 GLU HG2 1 1 16 11768 1 1 17 GLU HG3 H 2.378 -5.896 5.057 1.00 . A A . 17 GLU HG3 1 1 16 11769 1 1 17 GLU N N 1.844 -2.084 4.269 1.00 . A A . 17 GLU N 1 1 16 11770 1 1 17 GLU O O -0.452 -3.599 6.520 1.00 . A A . 17 GLU O 1 1 16 11771 1 1 17 GLU OE1 O 3.893 -3.692 3.256 1.00 . A A . 17 GLU OE1 1 1 16 11772 1 1 17 GLU OE2 O 2.836 -5.474 2.665 1.00 . A A . 17 GLU OE2 1 1 16 11773 1 1 18 ASN C C -1.967 -0.906 6.704 1.00 . A A . 18 ASN C 1 1 16 11774 1 1 18 ASN CA C -0.613 -1.054 7.400 1.00 . A A . 18 ASN CA 1 1 16 11775 1 1 18 ASN CB C -0.157 0.308 7.929 1.00 . A A . 18 ASN CB 1 1 16 11776 1 1 18 ASN CG C -0.738 0.535 9.326 1.00 . A A . 18 ASN CG 1 1 16 11777 1 1 18 ASN H H 1.045 -0.956 6.032 1.00 . A A . 18 ASN H 1 1 16 11778 1 1 18 ASN HA H -0.702 -1.750 8.222 1.00 . A A . 18 ASN HA 1 1 16 11779 1 1 18 ASN HB2 H 0.922 0.332 7.979 1.00 . A A . 18 ASN HB2 1 1 16 11780 1 1 18 ASN HB3 H -0.505 1.086 7.267 1.00 . A A . 18 ASN HB3 1 1 16 11781 1 1 18 ASN HD21 H -2.285 1.591 8.666 1.00 . A A . 18 ASN HD21 1 1 16 11782 1 1 18 ASN HD22 H -2.219 1.376 10.349 1.00 . A A . 18 ASN HD22 1 1 16 11783 1 1 18 ASN N N 0.382 -1.566 6.420 1.00 . A A . 18 ASN N 1 1 16 11784 1 1 18 ASN ND2 N -1.839 1.225 9.458 1.00 . A A . 18 ASN ND2 1 1 16 11785 1 1 18 ASN O O -3.007 -1.035 7.317 1.00 . A A . 18 ASN O 1 1 16 11786 1 1 18 ASN OD1 O -0.184 0.083 10.309 1.00 . A A . 18 ASN OD1 1 1 16 11787 1 1 19 TYR C C -3.903 -1.864 4.531 1.00 . A A . 19 TYR C 1 1 16 11788 1 1 19 TYR CA C -3.253 -0.488 4.693 1.00 . A A . 19 TYR CA 1 1 16 11789 1 1 19 TYR CB C -3.003 0.125 3.309 1.00 . A A . 19 TYR CB 1 1 16 11790 1 1 19 TYR CD1 C -1.735 1.911 4.715 1.00 . A A . 19 TYR CD1 1 1 16 11791 1 1 19 TYR CD2 C -1.309 1.826 2.318 1.00 . A A . 19 TYR CD2 1 1 16 11792 1 1 19 TYR CE1 C -0.829 2.973 4.826 1.00 . A A . 19 TYR CE1 1 1 16 11793 1 1 19 TYR CE2 C -0.407 2.889 2.452 1.00 . A A . 19 TYR CE2 1 1 16 11794 1 1 19 TYR CG C -1.997 1.312 3.447 1.00 . A A . 19 TYR CG 1 1 16 11795 1 1 19 TYR CZ C -0.169 3.459 3.700 1.00 . A A . 19 TYR CZ 1 1 16 11796 1 1 19 TYR H H -1.111 -0.541 4.943 1.00 . A A . 19 TYR H 1 1 16 11797 1 1 19 TYR HA H -3.911 0.155 5.257 1.00 . A A . 19 TYR HA 1 1 16 11798 1 1 19 TYR HB2 H -2.606 -0.658 2.644 1.00 . A A . 19 TYR HB2 1 1 16 11799 1 1 19 TYR HB3 H -3.962 0.476 2.902 1.00 . A A . 19 TYR HB3 1 1 16 11800 1 1 19 TYR HD1 H -2.220 1.564 5.606 1.00 . A A . 19 TYR HD1 1 1 16 11801 1 1 19 TYR HD2 H -1.464 1.416 1.351 1.00 . A A . 19 TYR HD2 1 1 16 11802 1 1 19 TYR HE1 H -0.641 3.418 5.791 1.00 . A A . 19 TYR HE1 1 1 16 11803 1 1 19 TYR HE2 H 0.108 3.268 1.581 1.00 . A A . 19 TYR HE2 1 1 16 11804 1 1 19 TYR HH H 1.381 4.417 3.131 1.00 . A A . 19 TYR HH 1 1 16 11805 1 1 19 TYR N N -1.962 -0.639 5.423 1.00 . A A . 19 TYR N 1 1 16 11806 1 1 19 TYR O O -5.054 -1.978 4.162 1.00 . A A . 19 TYR O 1 1 16 11807 1 1 19 TYR OH O 0.722 4.507 3.822 1.00 . A A . 19 TYR OH 1 1 16 11808 1 1 20 CYS C C -4.387 -4.694 5.998 1.00 . A A . 20 CYS C 1 1 16 11809 1 1 20 CYS CA C -3.744 -4.279 4.673 1.00 . A A . 20 CYS CA 1 1 16 11810 1 1 20 CYS CB C -2.628 -5.264 4.317 1.00 . A A . 20 CYS CB 1 1 16 11811 1 1 20 CYS H H -2.245 -2.795 5.104 1.00 . A A . 20 CYS H 1 1 16 11812 1 1 20 CYS HA H -4.492 -4.283 3.893 1.00 . A A . 20 CYS HA 1 1 16 11813 1 1 20 CYS HB2 H -1.740 -5.020 4.881 1.00 . A A . 20 CYS HB2 1 1 16 11814 1 1 20 CYS HB3 H -2.943 -6.268 4.558 1.00 . A A . 20 CYS HB3 1 1 16 11815 1 1 20 CYS N N -3.172 -2.910 4.807 1.00 . A A . 20 CYS N 1 1 16 11816 1 1 20 CYS O O -4.113 -5.753 6.527 1.00 . A A . 20 CYS O 1 1 16 11817 1 1 20 CYS SG S -2.267 -5.153 2.546 1.00 . A A . 20 CYS SG 1 1 16 11818 1 1 21 ASN C C -7.366 -3.777 7.785 1.00 . A A . 21 ASN C 1 1 16 11819 1 1 21 ASN CA C -5.899 -4.211 7.830 1.00 . A A . 21 ASN CA 1 1 16 11820 1 1 21 ASN CB C -5.185 -3.486 8.975 1.00 . A A . 21 ASN CB 1 1 16 11821 1 1 21 ASN CG C -5.915 -3.764 10.291 1.00 . A A . 21 ASN CG 1 1 16 11822 1 1 21 ASN H H -5.445 -3.018 6.095 1.00 . A A . 21 ASN H 1 1 16 11823 1 1 21 ASN HA H -5.844 -5.277 7.990 1.00 . A A . 21 ASN HA 1 1 16 11824 1 1 21 ASN HB2 H -4.167 -3.841 9.046 1.00 . A A . 21 ASN HB2 1 1 16 11825 1 1 21 ASN HB3 H -5.184 -2.424 8.784 1.00 . A A . 21 ASN HB3 1 1 16 11826 1 1 21 ASN HD21 H -4.908 -5.434 10.664 1.00 . A A . 21 ASN HD21 1 1 16 11827 1 1 21 ASN HD22 H -6.066 -5.010 11.830 1.00 . A A . 21 ASN HD22 1 1 16 11828 1 1 21 ASN N N -5.239 -3.867 6.539 1.00 . A A . 21 ASN N 1 1 16 11829 1 1 21 ASN ND2 N -5.604 -4.824 10.986 1.00 . A A . 21 ASN ND2 1 1 16 11830 1 1 21 ASN O O -8.087 -4.099 8.715 1.00 . A A . 21 ASN O 1 1 16 11831 1 1 21 ASN OXT O -7.742 -3.131 6.821 1.00 . A A . 21 ASN OXT 1 1 16 11832 1 1 21 ASN OD1 O -6.776 -3.006 10.692 1.00 . A A . 21 ASN OD1 1 1 16 11833 2 2 1 PHE C C 12.346 -1.949 -0.349 1.00 . B B . 22 PHE C 1 1 16 11834 2 2 1 PHE CA C 13.485 -2.923 -0.659 1.00 . B B . 22 PHE CA 1 1 16 11835 2 2 1 PHE CB C 12.948 -4.356 -0.638 1.00 . B B . 22 PHE CB 1 1 16 11836 2 2 1 PHE CD1 C 13.435 -4.899 1.778 1.00 . B B . 22 PHE CD1 1 1 16 11837 2 2 1 PHE CD2 C 11.125 -4.834 1.037 1.00 . B B . 22 PHE CD2 1 1 16 11838 2 2 1 PHE CE1 C 13.011 -5.222 3.074 1.00 . B B . 22 PHE CE1 1 1 16 11839 2 2 1 PHE CE2 C 10.701 -5.157 2.333 1.00 . B B . 22 PHE CE2 1 1 16 11840 2 2 1 PHE CG C 12.492 -4.704 0.759 1.00 . B B . 22 PHE CG 1 1 16 11841 2 2 1 PHE CZ C 11.643 -5.351 3.351 1.00 . B B . 22 PHE CZ 1 1 16 11842 2 2 1 PHE H1 H 14.133 -2.713 1.309 1.00 . B B . 22 PHE H1 1 1 16 11843 2 2 1 PHE H2 H 15.111 -1.918 0.169 1.00 . B B . 22 PHE H2 1 1 16 11844 2 2 1 PHE H3 H 15.187 -3.607 0.326 1.00 . B B . 22 PHE H3 1 1 16 11845 2 2 1 PHE HA H 13.887 -2.703 -1.636 1.00 . B B . 22 PHE HA 1 1 16 11846 2 2 1 PHE HB2 H 12.114 -4.438 -1.319 1.00 . B B . 22 PHE HB2 1 1 16 11847 2 2 1 PHE HB3 H 13.728 -5.038 -0.941 1.00 . B B . 22 PHE HB3 1 1 16 11848 2 2 1 PHE HD1 H 14.489 -4.801 1.564 1.00 . B B . 22 PHE HD1 1 1 16 11849 2 2 1 PHE HD2 H 10.398 -4.684 0.252 1.00 . B B . 22 PHE HD2 1 1 16 11850 2 2 1 PHE HE1 H 13.737 -5.371 3.858 1.00 . B B . 22 PHE HE1 1 1 16 11851 2 2 1 PHE HE2 H 9.647 -5.256 2.547 1.00 . B B . 22 PHE HE2 1 1 16 11852 2 2 1 PHE HZ H 11.316 -5.600 4.349 1.00 . B B . 22 PHE HZ 1 1 16 11853 2 2 1 PHE N N 14.560 -2.779 0.364 1.00 . B B . 22 PHE N 1 1 16 11854 2 2 1 PHE O O 11.341 -2.319 0.224 1.00 . B B . 22 PHE O 1 1 16 11855 2 2 2 VAL C C 11.485 1.430 -1.459 1.00 . B B . 23 VAL C 1 1 16 11856 2 2 2 VAL CA C 11.411 0.283 -0.451 1.00 . B B . 23 VAL CA 1 1 16 11857 2 2 2 VAL CB C 11.552 0.816 0.986 1.00 . B B . 23 VAL CB 1 1 16 11858 2 2 2 VAL CG1 C 12.424 2.074 1.027 1.00 . B B . 23 VAL CG1 1 1 16 11859 2 2 2 VAL CG2 C 10.167 1.152 1.533 1.00 . B B . 23 VAL CG2 1 1 16 11860 2 2 2 VAL H H 13.308 -0.426 -1.189 1.00 . B B . 23 VAL H 1 1 16 11861 2 2 2 VAL HA H 10.452 -0.201 -0.551 1.00 . B B . 23 VAL HA 1 1 16 11862 2 2 2 VAL HB H 11.999 0.056 1.602 1.00 . B B . 23 VAL HB 1 1 16 11863 2 2 2 VAL HG11 H 13.038 2.057 1.915 1.00 . B B . 23 VAL HG11 1 1 16 11864 2 2 2 VAL HG12 H 11.790 2.949 1.046 1.00 . B B . 23 VAL HG12 1 1 16 11865 2 2 2 VAL HG13 H 13.054 2.104 0.151 1.00 . B B . 23 VAL HG13 1 1 16 11866 2 2 2 VAL HG21 H 9.481 1.293 0.710 1.00 . B B . 23 VAL HG21 1 1 16 11867 2 2 2 VAL HG22 H 10.221 2.058 2.116 1.00 . B B . 23 VAL HG22 1 1 16 11868 2 2 2 VAL HG23 H 9.819 0.341 2.156 1.00 . B B . 23 VAL HG23 1 1 16 11869 2 2 2 VAL N N 12.492 -0.707 -0.725 1.00 . B B . 23 VAL N 1 1 16 11870 2 2 2 VAL O O 12.039 1.300 -2.532 1.00 . B B . 23 VAL O 1 1 16 11871 2 2 3 ASN C C 10.027 3.444 -3.229 1.00 . B B . 24 ASN C 1 1 16 11872 2 2 3 ASN CA C 10.928 3.725 -2.026 1.00 . B B . 24 ASN CA 1 1 16 11873 2 2 3 ASN CB C 12.356 3.996 -2.511 1.00 . B B . 24 ASN CB 1 1 16 11874 2 2 3 ASN CG C 13.295 4.113 -1.309 1.00 . B B . 24 ASN CG 1 1 16 11875 2 2 3 ASN H H 10.476 2.606 -0.240 1.00 . B B . 24 ASN H 1 1 16 11876 2 2 3 ASN HA H 10.559 4.591 -1.495 1.00 . B B . 24 ASN HA 1 1 16 11877 2 2 3 ASN HB2 H 12.681 3.186 -3.147 1.00 . B B . 24 ASN HB2 1 1 16 11878 2 2 3 ASN HB3 H 12.375 4.920 -3.070 1.00 . B B . 24 ASN HB3 1 1 16 11879 2 2 3 ASN HD21 H 14.941 3.857 -2.391 1.00 . B B . 24 ASN HD21 1 1 16 11880 2 2 3 ASN HD22 H 15.193 4.085 -0.728 1.00 . B B . 24 ASN HD22 1 1 16 11881 2 2 3 ASN N N 10.918 2.546 -1.111 1.00 . B B . 24 ASN N 1 1 16 11882 2 2 3 ASN ND2 N 14.583 4.009 -1.491 1.00 . B B . 24 ASN ND2 1 1 16 11883 2 2 3 ASN O O 10.396 2.729 -4.139 1.00 . B B . 24 ASN O 1 1 16 11884 2 2 3 ASN OD1 O 12.852 4.302 -0.193 1.00 . B B . 24 ASN OD1 1 1 16 11885 2 2 4 GLN C C 6.961 4.941 -4.531 1.00 . B B . 25 GLN C 1 1 16 11886 2 2 4 GLN CA C 7.923 3.760 -4.388 1.00 . B B . 25 GLN CA 1 1 16 11887 2 2 4 GLN CB C 7.122 2.480 -4.138 1.00 . B B . 25 GLN CB 1 1 16 11888 2 2 4 GLN CD C 7.044 0.020 -4.559 1.00 . B B . 25 GLN CD 1 1 16 11889 2 2 4 GLN CG C 7.719 1.334 -4.957 1.00 . B B . 25 GLN CG 1 1 16 11890 2 2 4 GLN H H 8.564 4.572 -2.498 1.00 . B B . 25 GLN H 1 1 16 11891 2 2 4 GLN HA H 8.498 3.652 -5.296 1.00 . B B . 25 GLN HA 1 1 16 11892 2 2 4 GLN HB2 H 7.161 2.231 -3.088 1.00 . B B . 25 GLN HB2 1 1 16 11893 2 2 4 GLN HB3 H 6.096 2.634 -4.435 1.00 . B B . 25 GLN HB3 1 1 16 11894 2 2 4 GLN HE21 H 5.759 0.056 -6.072 1.00 . B B . 25 GLN HE21 1 1 16 11895 2 2 4 GLN HE22 H 5.619 -1.279 -5.035 1.00 . B B . 25 GLN HE22 1 1 16 11896 2 2 4 GLN HG2 H 7.557 1.519 -6.009 1.00 . B B . 25 GLN HG2 1 1 16 11897 2 2 4 GLN HG3 H 8.779 1.265 -4.762 1.00 . B B . 25 GLN HG3 1 1 16 11898 2 2 4 GLN N N 8.845 3.999 -3.242 1.00 . B B . 25 GLN N 1 1 16 11899 2 2 4 GLN NE2 N 6.059 -0.439 -5.282 1.00 . B B . 25 GLN NE2 1 1 16 11900 2 2 4 GLN O O 6.645 5.618 -3.573 1.00 . B B . 25 GLN O 1 1 16 11901 2 2 4 GLN OE1 O 7.415 -0.595 -3.579 1.00 . B B . 25 GLN OE1 1 1 16 11902 2 2 5 HIS C C 4.263 5.740 -6.526 1.00 . B B . 26 HIS C 1 1 16 11903 2 2 5 HIS CA C 5.547 6.321 -5.935 1.00 . B B . 26 HIS CA 1 1 16 11904 2 2 5 HIS CB C 6.159 7.298 -6.937 1.00 . B B . 26 HIS CB 1 1 16 11905 2 2 5 HIS CD2 C 5.217 9.738 -6.885 1.00 . B B . 26 HIS CD2 1 1 16 11906 2 2 5 HIS CE1 C 6.443 10.473 -5.248 1.00 . B B . 26 HIS CE1 1 1 16 11907 2 2 5 HIS CG C 6.004 8.709 -6.450 1.00 . B B . 26 HIS CG 1 1 16 11908 2 2 5 HIS H H 6.759 4.628 -6.479 1.00 . B B . 26 HIS H 1 1 16 11909 2 2 5 HIS HA H 5.340 6.820 -5.000 1.00 . B B . 26 HIS HA 1 1 16 11910 2 2 5 HIS HB2 H 7.205 7.073 -7.067 1.00 . B B . 26 HIS HB2 1 1 16 11911 2 2 5 HIS HB3 H 5.648 7.194 -7.881 1.00 . B B . 26 HIS HB3 1 1 16 11912 2 2 5 HIS HD2 H 4.494 9.683 -7.686 1.00 . B B . 26 HIS HD2 1 1 16 11913 2 2 5 HIS HE1 H 6.886 11.121 -4.507 1.00 . B B . 26 HIS HE1 1 1 16 11914 2 2 5 HIS HE2 H 5.090 11.746 -6.213 1.00 . B B . 26 HIS HE2 1 1 16 11915 2 2 5 HIS N N 6.491 5.189 -5.722 1.00 . B B . 26 HIS N 1 1 16 11916 2 2 5 HIS ND1 N 6.773 9.187 -5.412 1.00 . B B . 26 HIS ND1 1 1 16 11917 2 2 5 HIS NE2 N 5.495 10.858 -6.128 1.00 . B B . 26 HIS NE2 1 1 16 11918 2 2 5 HIS O O 4.301 4.748 -7.227 1.00 . B B . 26 HIS O 1 1 16 11919 2 2 6 LEU C C 0.792 6.801 -6.985 1.00 . B B . 27 LEU C 1 1 16 11920 2 2 6 LEU CA C 1.877 5.732 -6.832 1.00 . B B . 27 LEU CA 1 1 16 11921 2 2 6 LEU CB C 1.355 4.607 -5.924 1.00 . B B . 27 LEU CB 1 1 16 11922 2 2 6 LEU CD1 C 2.161 5.669 -3.810 1.00 . B B . 27 LEU CD1 1 1 16 11923 2 2 6 LEU CD2 C 1.781 3.208 -3.915 1.00 . B B . 27 LEU CD2 1 1 16 11924 2 2 6 LEU CG C 2.253 4.429 -4.699 1.00 . B B . 27 LEU CG 1 1 16 11925 2 2 6 LEU H H 3.090 7.113 -5.687 1.00 . B B . 27 LEU H 1 1 16 11926 2 2 6 LEU HA H 2.100 5.320 -7.805 1.00 . B B . 27 LEU HA 1 1 16 11927 2 2 6 LEU HB2 H 0.358 4.849 -5.593 1.00 . B B . 27 LEU HB2 1 1 16 11928 2 2 6 LEU HB3 H 1.331 3.683 -6.483 1.00 . B B . 27 LEU HB3 1 1 16 11929 2 2 6 LEU HD11 H 1.831 6.512 -4.400 1.00 . B B . 27 LEU HD11 1 1 16 11930 2 2 6 LEU HD12 H 3.131 5.883 -3.387 1.00 . B B . 27 LEU HD12 1 1 16 11931 2 2 6 LEU HD13 H 1.453 5.488 -3.015 1.00 . B B . 27 LEU HD13 1 1 16 11932 2 2 6 LEU HD21 H 2.523 2.427 -3.985 1.00 . B B . 27 LEU HD21 1 1 16 11933 2 2 6 LEU HD22 H 0.848 2.856 -4.331 1.00 . B B . 27 LEU HD22 1 1 16 11934 2 2 6 LEU HD23 H 1.636 3.478 -2.881 1.00 . B B . 27 LEU HD23 1 1 16 11935 2 2 6 LEU HG H 3.275 4.284 -5.015 1.00 . B B . 27 LEU HG 1 1 16 11936 2 2 6 LEU N N 3.126 6.317 -6.259 1.00 . B B . 27 LEU N 1 1 16 11937 2 2 6 LEU O O 1.076 7.967 -7.056 1.00 . B B . 27 LEU O 1 1 16 11938 2 2 7 CYS C C -2.708 6.531 -8.012 1.00 . B B . 28 CYS C 1 1 16 11939 2 2 7 CYS CA C -1.632 7.277 -7.224 1.00 . B B . 28 CYS CA 1 1 16 11940 2 2 7 CYS CB C -1.286 8.596 -7.946 1.00 . B B . 28 CYS CB 1 1 16 11941 2 2 7 CYS H H -0.605 5.405 -7.009 1.00 . B B . 28 CYS H 1 1 16 11942 2 2 7 CYS HA H -2.027 7.510 -6.243 1.00 . B B . 28 CYS HA 1 1 16 11943 2 2 7 CYS HB2 H -0.304 8.531 -8.384 1.00 . B B . 28 CYS HB2 1 1 16 11944 2 2 7 CYS HB3 H -2.010 8.770 -8.729 1.00 . B B . 28 CYS HB3 1 1 16 11945 2 2 7 CYS N N -0.445 6.370 -7.055 1.00 . B B . 28 CYS N 1 1 16 11946 2 2 7 CYS O O -2.414 5.722 -8.869 1.00 . B B . 28 CYS O 1 1 16 11947 2 2 7 CYS SG S -1.344 9.981 -6.762 1.00 . B B . 28 CYS SG 1 1 16 11948 2 2 8 GLY C C -4.822 4.569 -8.385 1.00 . B B . 29 GLY C 1 1 16 11949 2 2 8 GLY CA C -5.049 6.082 -8.449 1.00 . B B . 29 GLY CA 1 1 16 11950 2 2 8 GLY H H -4.172 7.434 -7.019 1.00 . B B . 29 GLY H 1 1 16 11951 2 2 8 GLY HA2 H -5.997 6.324 -7.991 1.00 . B B . 29 GLY HA2 1 1 16 11952 2 2 8 GLY HA3 H -5.056 6.397 -9.481 1.00 . B B . 29 GLY HA3 1 1 16 11953 2 2 8 GLY N N -3.955 6.785 -7.721 1.00 . B B . 29 GLY N 1 1 16 11954 2 2 8 GLY O O -4.528 4.016 -7.342 1.00 . B B . 29 GLY O 1 1 16 11955 2 2 9 SER C C -3.366 2.089 -8.955 1.00 . B B . 30 SER C 1 1 16 11956 2 2 9 SER CA C -4.756 2.420 -9.501 1.00 . B B . 30 SER CA 1 1 16 11957 2 2 9 SER CB C -4.880 1.895 -10.932 1.00 . B B . 30 SER CB 1 1 16 11958 2 2 9 SER H H -5.198 4.360 -10.323 1.00 . B B . 30 SER H 1 1 16 11959 2 2 9 SER HA H -5.507 1.951 -8.879 1.00 . B B . 30 SER HA 1 1 16 11960 2 2 9 SER HB2 H -4.287 1.002 -11.042 1.00 . B B . 30 SER HB2 1 1 16 11961 2 2 9 SER HB3 H -5.916 1.665 -11.142 1.00 . B B . 30 SER HB3 1 1 16 11962 2 2 9 SER HG H -5.156 3.203 -12.346 1.00 . B B . 30 SER HG 1 1 16 11963 2 2 9 SER N N -4.959 3.895 -9.494 1.00 . B B . 30 SER N 1 1 16 11964 2 2 9 SER O O -3.211 1.212 -8.131 1.00 . B B . 30 SER O 1 1 16 11965 2 2 9 SER OG O -4.407 2.885 -11.836 1.00 . B B . 30 SER OG 1 1 16 11966 2 2 10 ASP C C -1.053 2.353 -7.375 1.00 . B B . 31 ASP C 1 1 16 11967 2 2 10 ASP CA C -0.983 2.495 -8.890 1.00 . B B . 31 ASP CA 1 1 16 11968 2 2 10 ASP CB C -0.039 3.643 -9.245 1.00 . B B . 31 ASP CB 1 1 16 11969 2 2 10 ASP CG C -0.265 4.059 -10.700 1.00 . B B . 31 ASP CG 1 1 16 11970 2 2 10 ASP H H -2.492 3.491 -10.067 1.00 . B B . 31 ASP H 1 1 16 11971 2 2 10 ASP HA H -0.619 1.575 -9.325 1.00 . B B . 31 ASP HA 1 1 16 11972 2 2 10 ASP HB2 H -0.234 4.482 -8.592 1.00 . B B . 31 ASP HB2 1 1 16 11973 2 2 10 ASP HB3 H 0.983 3.319 -9.118 1.00 . B B . 31 ASP HB3 1 1 16 11974 2 2 10 ASP N N -2.352 2.783 -9.403 1.00 . B B . 31 ASP N 1 1 16 11975 2 2 10 ASP O O -0.469 1.459 -6.793 1.00 . B B . 31 ASP O 1 1 16 11976 2 2 10 ASP OD1 O 0.045 3.269 -11.577 1.00 . B B . 31 ASP OD1 1 1 16 11977 2 2 10 ASP OD2 O -0.746 5.160 -10.913 1.00 . B B . 31 ASP OD2 1 1 16 11978 2 2 11 LEU C C -2.522 1.787 -4.892 1.00 . B B . 32 LEU C 1 1 16 11979 2 2 11 LEU CA C -1.904 3.136 -5.255 1.00 . B B . 32 LEU CA 1 1 16 11980 2 2 11 LEU CB C -2.799 4.272 -4.752 1.00 . B B . 32 LEU CB 1 1 16 11981 2 2 11 LEU CD1 C -1.326 6.093 -3.875 1.00 . B B . 32 LEU CD1 1 1 16 11982 2 2 11 LEU CD2 C -3.306 5.344 -2.551 1.00 . B B . 32 LEU CD2 1 1 16 11983 2 2 11 LEU CG C -2.188 4.887 -3.491 1.00 . B B . 32 LEU CG 1 1 16 11984 2 2 11 LEU H H -2.248 3.930 -7.223 1.00 . B B . 32 LEU H 1 1 16 11985 2 2 11 LEU HA H -0.927 3.214 -4.803 1.00 . B B . 32 LEU HA 1 1 16 11986 2 2 11 LEU HB2 H -2.880 5.029 -5.518 1.00 . B B . 32 LEU HB2 1 1 16 11987 2 2 11 LEU HB3 H -3.780 3.884 -4.522 1.00 . B B . 32 LEU HB3 1 1 16 11988 2 2 11 LEU HD11 H -1.915 6.994 -3.795 1.00 . B B . 32 LEU HD11 1 1 16 11989 2 2 11 LEU HD12 H -0.978 5.979 -4.891 1.00 . B B . 32 LEU HD12 1 1 16 11990 2 2 11 LEU HD13 H -0.479 6.157 -3.208 1.00 . B B . 32 LEU HD13 1 1 16 11991 2 2 11 LEU HD21 H -4.011 5.951 -3.099 1.00 . B B . 32 LEU HD21 1 1 16 11992 2 2 11 LEU HD22 H -2.883 5.924 -1.744 1.00 . B B . 32 LEU HD22 1 1 16 11993 2 2 11 LEU HD23 H -3.813 4.480 -2.146 1.00 . B B . 32 LEU HD23 1 1 16 11994 2 2 11 LEU HG H -1.574 4.150 -2.993 1.00 . B B . 32 LEU HG 1 1 16 11995 2 2 11 LEU N N -1.778 3.224 -6.732 1.00 . B B . 32 LEU N 1 1 16 11996 2 2 11 LEU O O -1.851 0.904 -4.398 1.00 . B B . 32 LEU O 1 1 16 11997 2 2 12 VAL C C -3.528 -0.827 -5.282 1.00 . B B . 33 VAL C 1 1 16 11998 2 2 12 VAL CA C -4.434 0.310 -4.812 1.00 . B B . 33 VAL CA 1 1 16 11999 2 2 12 VAL CB C -5.787 0.203 -5.519 1.00 . B B . 33 VAL CB 1 1 16 12000 2 2 12 VAL CG1 C -6.776 1.167 -4.873 1.00 . B B . 33 VAL CG1 1 1 16 12001 2 2 12 VAL CG2 C -5.624 0.564 -6.996 1.00 . B B . 33 VAL CG2 1 1 16 12002 2 2 12 VAL H H -4.318 2.332 -5.548 1.00 . B B . 33 VAL H 1 1 16 12003 2 2 12 VAL HA H -4.575 0.239 -3.743 1.00 . B B . 33 VAL HA 1 1 16 12004 2 2 12 VAL HB H -6.160 -0.807 -5.432 1.00 . B B . 33 VAL HB 1 1 16 12005 2 2 12 VAL HG11 H -7.348 0.644 -4.122 1.00 . B B . 33 VAL HG11 1 1 16 12006 2 2 12 VAL HG12 H -7.442 1.557 -5.628 1.00 . B B . 33 VAL HG12 1 1 16 12007 2 2 12 VAL HG13 H -6.235 1.980 -4.414 1.00 . B B . 33 VAL HG13 1 1 16 12008 2 2 12 VAL HG21 H -6.594 0.756 -7.428 1.00 . B B . 33 VAL HG21 1 1 16 12009 2 2 12 VAL HG22 H -5.154 -0.256 -7.518 1.00 . B B . 33 VAL HG22 1 1 16 12010 2 2 12 VAL HG23 H -5.009 1.448 -7.084 1.00 . B B . 33 VAL HG23 1 1 16 12011 2 2 12 VAL N N -3.792 1.613 -5.142 1.00 . B B . 33 VAL N 1 1 16 12012 2 2 12 VAL O O -3.213 -1.732 -4.535 1.00 . B B . 33 VAL O 1 1 16 12013 2 2 13 GLU C C -0.981 -1.958 -6.124 1.00 . B B . 34 GLU C 1 1 16 12014 2 2 13 GLU CA C -2.210 -1.856 -7.025 1.00 . B B . 34 GLU CA 1 1 16 12015 2 2 13 GLU CB C -1.771 -1.515 -8.448 1.00 . B B . 34 GLU CB 1 1 16 12016 2 2 13 GLU CD C -4.071 -1.862 -9.362 1.00 . B B . 34 GLU CD 1 1 16 12017 2 2 13 GLU CG C -2.611 -2.311 -9.447 1.00 . B B . 34 GLU CG 1 1 16 12018 2 2 13 GLU H H -3.356 -0.044 -7.099 1.00 . B B . 34 GLU H 1 1 16 12019 2 2 13 GLU HA H -2.738 -2.798 -7.025 1.00 . B B . 34 GLU HA 1 1 16 12020 2 2 13 GLU HB2 H -1.908 -0.458 -8.622 1.00 . B B . 34 GLU HB2 1 1 16 12021 2 2 13 GLU HB3 H -0.731 -1.767 -8.572 1.00 . B B . 34 GLU HB3 1 1 16 12022 2 2 13 GLU HG2 H -2.238 -2.140 -10.447 1.00 . B B . 34 GLU HG2 1 1 16 12023 2 2 13 GLU HG3 H -2.546 -3.364 -9.214 1.00 . B B . 34 GLU HG3 1 1 16 12024 2 2 13 GLU N N -3.099 -0.784 -6.513 1.00 . B B . 34 GLU N 1 1 16 12025 2 2 13 GLU O O -0.559 -3.035 -5.758 1.00 . B B . 34 GLU O 1 1 16 12026 2 2 13 GLU OE1 O -4.340 -0.723 -9.705 1.00 . B B . 34 GLU OE1 1 1 16 12027 2 2 13 GLU OE2 O -4.894 -2.665 -8.953 1.00 . B B . 34 GLU OE2 1 1 16 12028 2 2 14 ALA C C 0.465 -1.671 -3.613 1.00 . B B . 35 ALA C 1 1 16 12029 2 2 14 ALA CA C 0.795 -0.883 -4.883 1.00 . B B . 35 ALA CA 1 1 16 12030 2 2 14 ALA CB C 1.204 0.541 -4.511 1.00 . B B . 35 ALA CB 1 1 16 12031 2 2 14 ALA H H -0.763 0.018 -6.065 1.00 . B B . 35 ALA H 1 1 16 12032 2 2 14 ALA HA H 1.607 -1.366 -5.409 1.00 . B B . 35 ALA HA 1 1 16 12033 2 2 14 ALA HB1 H 1.375 1.115 -5.411 1.00 . B B . 35 ALA HB1 1 1 16 12034 2 2 14 ALA HB2 H 2.111 0.513 -3.925 1.00 . B B . 35 ALA HB2 1 1 16 12035 2 2 14 ALA HB3 H 0.416 1.002 -3.934 1.00 . B B . 35 ALA HB3 1 1 16 12036 2 2 14 ALA N N -0.405 -0.844 -5.762 1.00 . B B . 35 ALA N 1 1 16 12037 2 2 14 ALA O O 1.088 -2.669 -3.312 1.00 . B B . 35 ALA O 1 1 16 12038 2 2 15 LEU C C -1.185 -3.428 -2.010 1.00 . B B . 36 LEU C 1 1 16 12039 2 2 15 LEU CA C -0.882 -1.983 -1.629 1.00 . B B . 36 LEU CA 1 1 16 12040 2 2 15 LEU CB C -2.132 -1.359 -0.991 1.00 . B B . 36 LEU CB 1 1 16 12041 2 2 15 LEU CD1 C -0.448 0.466 -0.526 1.00 . B B . 36 LEU CD1 1 1 16 12042 2 2 15 LEU CD2 C -2.465 0.944 -1.916 1.00 . B B . 36 LEU CD2 1 1 16 12043 2 2 15 LEU CG C -1.931 0.143 -0.729 1.00 . B B . 36 LEU CG 1 1 16 12044 2 2 15 LEU H H -1.015 -0.436 -3.126 1.00 . B B . 36 LEU H 1 1 16 12045 2 2 15 LEU HA H -0.061 -1.955 -0.929 1.00 . B B . 36 LEU HA 1 1 16 12046 2 2 15 LEU HB2 H -2.973 -1.493 -1.656 1.00 . B B . 36 LEU HB2 1 1 16 12047 2 2 15 LEU HB3 H -2.337 -1.858 -0.055 1.00 . B B . 36 LEU HB3 1 1 16 12048 2 2 15 LEU HD11 H 0.077 0.347 -1.463 1.00 . B B . 36 LEU HD11 1 1 16 12049 2 2 15 LEU HD12 H -0.032 -0.207 0.208 1.00 . B B . 36 LEU HD12 1 1 16 12050 2 2 15 LEU HD13 H -0.346 1.484 -0.182 1.00 . B B . 36 LEU HD13 1 1 16 12051 2 2 15 LEU HD21 H -3.211 1.644 -1.570 1.00 . B B . 36 LEU HD21 1 1 16 12052 2 2 15 LEU HD22 H -2.908 0.271 -2.635 1.00 . B B . 36 LEU HD22 1 1 16 12053 2 2 15 LEU HD23 H -1.653 1.484 -2.379 1.00 . B B . 36 LEU HD23 1 1 16 12054 2 2 15 LEU HG H -2.478 0.420 0.160 1.00 . B B . 36 LEU HG 1 1 16 12055 2 2 15 LEU N N -0.517 -1.239 -2.867 1.00 . B B . 36 LEU N 1 1 16 12056 2 2 15 LEU O O -1.087 -4.337 -1.208 1.00 . B B . 36 LEU O 1 1 16 12057 2 2 16 TYR C C -0.565 -5.759 -4.008 1.00 . B B . 37 TYR C 1 1 16 12058 2 2 16 TYR CA C -1.868 -5.013 -3.707 1.00 . B B . 37 TYR CA 1 1 16 12059 2 2 16 TYR CB C -2.729 -4.937 -4.972 1.00 . B B . 37 TYR CB 1 1 16 12060 2 2 16 TYR CD1 C -3.722 -7.316 -4.972 1.00 . B B . 37 TYR CD1 1 1 16 12061 2 2 16 TYR CD2 C -2.134 -6.732 -6.723 1.00 . B B . 37 TYR CD2 1 1 16 12062 2 2 16 TYR CE1 C -3.835 -8.602 -5.516 1.00 . B B . 37 TYR CE1 1 1 16 12063 2 2 16 TYR CE2 C -2.259 -8.022 -7.254 1.00 . B B . 37 TYR CE2 1 1 16 12064 2 2 16 TYR CG C -2.867 -6.357 -5.571 1.00 . B B . 37 TYR CG 1 1 16 12065 2 2 16 TYR CZ C -3.108 -8.952 -6.653 1.00 . B B . 37 TYR CZ 1 1 16 12066 2 2 16 TYR H H -1.616 -2.884 -3.862 1.00 . B B . 37 TYR H 1 1 16 12067 2 2 16 TYR HA H -2.411 -5.537 -2.934 1.00 . B B . 37 TYR HA 1 1 16 12068 2 2 16 TYR HB2 H -3.706 -4.526 -4.709 1.00 . B B . 37 TYR HB2 1 1 16 12069 2 2 16 TYR HB3 H -2.256 -4.266 -5.686 1.00 . B B . 37 TYR HB3 1 1 16 12070 2 2 16 TYR HD1 H -4.290 -7.076 -4.095 1.00 . B B . 37 TYR HD1 1 1 16 12071 2 2 16 TYR HD2 H -1.471 -6.041 -7.199 1.00 . B B . 37 TYR HD2 1 1 16 12072 2 2 16 TYR HE1 H -4.489 -9.325 -5.052 1.00 . B B . 37 TYR HE1 1 1 16 12073 2 2 16 TYR HE2 H -1.698 -8.298 -8.134 1.00 . B B . 37 TYR HE2 1 1 16 12074 2 2 16 TYR HH H -3.047 -10.852 -6.478 1.00 . B B . 37 TYR HH 1 1 16 12075 2 2 16 TYR N N -1.551 -3.638 -3.241 1.00 . B B . 37 TYR N 1 1 16 12076 2 2 16 TYR O O -0.545 -6.968 -4.112 1.00 . B B . 37 TYR O 1 1 16 12077 2 2 16 TYR OH O -3.224 -10.222 -7.181 1.00 . B B . 37 TYR OH 1 1 16 12078 2 2 17 LEU C C 2.412 -6.220 -3.081 1.00 . B B . 38 LEU C 1 1 16 12079 2 2 17 LEU CA C 1.825 -5.738 -4.406 1.00 . B B . 38 LEU CA 1 1 16 12080 2 2 17 LEU CB C 2.819 -4.776 -5.065 1.00 . B B . 38 LEU CB 1 1 16 12081 2 2 17 LEU CD1 C 3.083 -2.897 -6.685 1.00 . B B . 38 LEU CD1 1 1 16 12082 2 2 17 LEU CD2 C 1.187 -4.501 -6.932 1.00 . B B . 38 LEU CD2 1 1 16 12083 2 2 17 LEU CG C 2.073 -3.764 -5.930 1.00 . B B . 38 LEU CG 1 1 16 12084 2 2 17 LEU H H 0.499 -4.078 -4.031 1.00 . B B . 38 LEU H 1 1 16 12085 2 2 17 LEU HA H 1.654 -6.582 -5.055 1.00 . B B . 38 LEU HA 1 1 16 12086 2 2 17 LEU HB2 H 3.372 -4.252 -4.299 1.00 . B B . 38 LEU HB2 1 1 16 12087 2 2 17 LEU HB3 H 3.504 -5.336 -5.682 1.00 . B B . 38 LEU HB3 1 1 16 12088 2 2 17 LEU HD11 H 3.299 -3.347 -7.643 1.00 . B B . 38 LEU HD11 1 1 16 12089 2 2 17 LEU HD12 H 3.994 -2.822 -6.110 1.00 . B B . 38 LEU HD12 1 1 16 12090 2 2 17 LEU HD13 H 2.671 -1.910 -6.836 1.00 . B B . 38 LEU HD13 1 1 16 12091 2 2 17 LEU HD21 H 0.340 -4.926 -6.415 1.00 . B B . 38 LEU HD21 1 1 16 12092 2 2 17 LEU HD22 H 1.755 -5.287 -7.404 1.00 . B B . 38 LEU HD22 1 1 16 12093 2 2 17 LEU HD23 H 0.840 -3.806 -7.682 1.00 . B B . 38 LEU HD23 1 1 16 12094 2 2 17 LEU HG H 1.464 -3.144 -5.300 1.00 . B B . 38 LEU HG 1 1 16 12095 2 2 17 LEU N N 0.529 -5.052 -4.132 1.00 . B B . 38 LEU N 1 1 16 12096 2 2 17 LEU O O 2.715 -7.383 -2.905 1.00 . B B . 38 LEU O 1 1 16 12097 2 2 18 VAL C C 2.307 -6.867 -0.249 1.00 . B B . 39 VAL C 1 1 16 12098 2 2 18 VAL CA C 3.131 -5.714 -0.823 1.00 . B B . 39 VAL CA 1 1 16 12099 2 2 18 VAL CB C 3.073 -4.507 0.120 1.00 . B B . 39 VAL CB 1 1 16 12100 2 2 18 VAL CG1 C 3.498 -3.250 -0.641 1.00 . B B . 39 VAL CG1 1 1 16 12101 2 2 18 VAL CG2 C 1.644 -4.322 0.640 1.00 . B B . 39 VAL CG2 1 1 16 12102 2 2 18 VAL H H 2.314 -4.393 -2.311 1.00 . B B . 39 VAL H 1 1 16 12103 2 2 18 VAL HA H 4.157 -6.029 -0.945 1.00 . B B . 39 VAL HA 1 1 16 12104 2 2 18 VAL HB H 3.744 -4.666 0.950 1.00 . B B . 39 VAL HB 1 1 16 12105 2 2 18 VAL HG11 H 4.011 -2.579 0.031 1.00 . B B . 39 VAL HG11 1 1 16 12106 2 2 18 VAL HG12 H 2.623 -2.759 -1.042 1.00 . B B . 39 VAL HG12 1 1 16 12107 2 2 18 VAL HG13 H 4.159 -3.525 -1.450 1.00 . B B . 39 VAL HG13 1 1 16 12108 2 2 18 VAL HG21 H 0.981 -4.122 -0.189 1.00 . B B . 39 VAL HG21 1 1 16 12109 2 2 18 VAL HG22 H 1.616 -3.493 1.331 1.00 . B B . 39 VAL HG22 1 1 16 12110 2 2 18 VAL HG23 H 1.326 -5.222 1.146 1.00 . B B . 39 VAL HG23 1 1 16 12111 2 2 18 VAL N N 2.570 -5.325 -2.144 1.00 . B B . 39 VAL N 1 1 16 12112 2 2 18 VAL O O 2.837 -7.802 0.317 1.00 . B B . 39 VAL O 1 1 16 12113 2 2 19 CYS C C -0.232 -8.843 -0.999 1.00 . B B . 40 CYS C 1 1 16 12114 2 2 19 CYS CA C 0.147 -7.894 0.140 1.00 . B B . 40 CYS CA 1 1 16 12115 2 2 19 CYS CB C -1.124 -7.289 0.739 1.00 . B B . 40 CYS CB 1 1 16 12116 2 2 19 CYS H H 0.607 -6.040 -0.855 1.00 . B B . 40 CYS H 1 1 16 12117 2 2 19 CYS HA H 0.683 -8.440 0.903 1.00 . B B . 40 CYS HA 1 1 16 12118 2 2 19 CYS HB2 H -1.556 -6.593 0.035 1.00 . B B . 40 CYS HB2 1 1 16 12119 2 2 19 CYS HB3 H -1.833 -8.076 0.948 1.00 . B B . 40 CYS HB3 1 1 16 12120 2 2 19 CYS N N 1.011 -6.804 -0.393 1.00 . B B . 40 CYS N 1 1 16 12121 2 2 19 CYS O O -1.167 -9.611 -0.893 1.00 . B B . 40 CYS O 1 1 16 12122 2 2 19 CYS SG S -0.717 -6.420 2.274 1.00 . B B . 40 CYS SG 1 1 16 12123 2 2 20 GLY C C 0.909 -11.013 -3.092 1.00 . B B . 41 GLY C 1 1 16 12124 2 2 20 GLY CA C 0.157 -9.688 -3.236 1.00 . B B . 41 GLY CA 1 1 16 12125 2 2 20 GLY H H 1.231 -8.162 -2.158 1.00 . B B . 41 GLY H 1 1 16 12126 2 2 20 GLY HA2 H -0.907 -9.876 -3.250 1.00 . B B . 41 GLY HA2 1 1 16 12127 2 2 20 GLY HA3 H 0.450 -9.212 -4.160 1.00 . B B . 41 GLY HA3 1 1 16 12128 2 2 20 GLY N N 0.483 -8.792 -2.090 1.00 . B B . 41 GLY N 1 1 16 12129 2 2 20 GLY O O 0.658 -11.958 -3.812 1.00 . B B . 41 GLY O 1 1 16 12130 2 2 21 GLU C C 1.705 -13.387 -1.284 1.00 . B B . 42 GLU C 1 1 16 12131 2 2 21 GLU CA C 2.589 -12.362 -1.992 1.00 . B B . 42 GLU CA 1 1 16 12132 2 2 21 GLU CB C 3.838 -12.098 -1.151 1.00 . B B . 42 GLU CB 1 1 16 12133 2 2 21 GLU CD C 4.608 -11.065 0.989 1.00 . B B . 42 GLU CD 1 1 16 12134 2 2 21 GLU CG C 3.425 -11.717 0.272 1.00 . B B . 42 GLU CG 1 1 16 12135 2 2 21 GLU H H 2.019 -10.321 -1.598 1.00 . B B . 42 GLU H 1 1 16 12136 2 2 21 GLU HA H 2.877 -12.745 -2.955 1.00 . B B . 42 GLU HA 1 1 16 12137 2 2 21 GLU HB2 H 4.448 -12.989 -1.123 1.00 . B B . 42 GLU HB2 1 1 16 12138 2 2 21 GLU HB3 H 4.402 -11.288 -1.588 1.00 . B B . 42 GLU HB3 1 1 16 12139 2 2 21 GLU HG2 H 2.599 -11.021 0.233 1.00 . B B . 42 GLU HG2 1 1 16 12140 2 2 21 GLU HG3 H 3.124 -12.603 0.810 1.00 . B B . 42 GLU HG3 1 1 16 12141 2 2 21 GLU N N 1.828 -11.093 -2.171 1.00 . B B . 42 GLU N 1 1 16 12142 2 2 21 GLU O O 1.880 -14.581 -1.426 1.00 . B B . 42 GLU O 1 1 16 12143 2 2 21 GLU OE1 O 5.694 -11.616 0.918 1.00 . B B . 42 GLU OE1 1 1 16 12144 2 2 21 GLU OE2 O 4.408 -10.027 1.597 1.00 . B B . 42 GLU OE2 1 1 16 12145 2 2 22 ARG C C -1.459 -14.003 -0.571 1.00 . B B . 43 ARG C 1 1 16 12146 2 2 22 ARG CA C -0.145 -13.864 0.200 1.00 . B B . 43 ARG CA 1 1 16 12147 2 2 22 ARG CB C -0.432 -13.311 1.596 1.00 . B B . 43 ARG CB 1 1 16 12148 2 2 22 ARG CD C -1.384 -11.354 2.824 1.00 . B B . 43 ARG CD 1 1 16 12149 2 2 22 ARG CG C -1.323 -12.074 1.476 1.00 . B B . 43 ARG CG 1 1 16 12150 2 2 22 ARG CZ C -3.148 -10.399 4.181 1.00 . B B . 43 ARG CZ 1 1 16 12151 2 2 22 ARG H H 0.638 -11.960 -0.425 1.00 . B B . 43 ARG H 1 1 16 12152 2 2 22 ARG HA H 0.329 -14.830 0.285 1.00 . B B . 43 ARG HA 1 1 16 12153 2 2 22 ARG HB2 H -0.934 -14.064 2.187 1.00 . B B . 43 ARG HB2 1 1 16 12154 2 2 22 ARG HB3 H 0.497 -13.037 2.072 1.00 . B B . 43 ARG HB3 1 1 16 12155 2 2 22 ARG HD2 H -0.802 -11.900 3.551 1.00 . B B . 43 ARG HD2 1 1 16 12156 2 2 22 ARG HD3 H -0.982 -10.357 2.717 1.00 . B B . 43 ARG HD3 1 1 16 12157 2 2 22 ARG HE H -3.471 -11.878 2.898 1.00 . B B . 43 ARG HE 1 1 16 12158 2 2 22 ARG HG2 H -0.916 -11.408 0.729 1.00 . B B . 43 ARG HG2 1 1 16 12159 2 2 22 ARG HG3 H -2.319 -12.374 1.187 1.00 . B B . 43 ARG HG3 1 1 16 12160 2 2 22 ARG HH11 H -3.512 -8.946 2.854 1.00 . B B . 43 ARG HH11 1 1 16 12161 2 2 22 ARG HH12 H -3.773 -8.526 4.514 1.00 . B B . 43 ARG HH12 1 1 16 12162 2 2 22 ARG HH21 H -2.866 -11.649 5.719 1.00 . B B . 43 ARG HH21 1 1 16 12163 2 2 22 ARG HH22 H -3.405 -10.057 6.137 1.00 . B B . 43 ARG HH22 1 1 16 12164 2 2 22 ARG N N 0.757 -12.926 -0.522 1.00 . B B . 43 ARG N 1 1 16 12165 2 2 22 ARG NE N -2.800 -11.274 3.278 1.00 . B B . 43 ARG NE 1 1 16 12166 2 2 22 ARG NH1 N -3.505 -9.197 3.822 1.00 . B B . 43 ARG NH1 1 1 16 12167 2 2 22 ARG NH2 N -3.139 -10.727 5.444 1.00 . B B . 43 ARG NH2 1 1 16 12168 2 2 22 ARG O O -1.600 -13.507 -1.671 1.00 . B B . 43 ARG O 1 1 16 12169 2 2 23 GLY C C -4.228 -13.485 -1.192 1.00 . B B . 44 GLY C 1 1 16 12170 2 2 23 GLY CA C -3.726 -14.845 -0.703 1.00 . B B . 44 GLY CA 1 1 16 12171 2 2 23 GLY H H -2.288 -15.066 0.886 1.00 . B B . 44 GLY H 1 1 16 12172 2 2 23 GLY HA2 H -3.596 -15.507 -1.547 1.00 . B B . 44 GLY HA2 1 1 16 12173 2 2 23 GLY HA3 H -4.448 -15.267 -0.021 1.00 . B B . 44 GLY HA3 1 1 16 12174 2 2 23 GLY N N -2.422 -14.675 -0.002 1.00 . B B . 44 GLY N 1 1 16 12175 2 2 23 GLY O O -4.272 -12.524 -0.449 1.00 . B B . 44 GLY O 1 1 16 12176 2 2 24 GLY C C -6.358 -11.672 -2.214 1.00 . B B . 45 GLY C 1 1 16 12177 2 2 24 GLY CA C -5.105 -12.100 -2.978 1.00 . B B . 45 GLY CA 1 1 16 12178 2 2 24 GLY H H -4.562 -14.185 -3.020 1.00 . B B . 45 GLY H 1 1 16 12179 2 2 24 GLY HA2 H -4.339 -11.346 -2.868 1.00 . B B . 45 GLY HA2 1 1 16 12180 2 2 24 GLY HA3 H -5.348 -12.216 -4.023 1.00 . B B . 45 GLY HA3 1 1 16 12181 2 2 24 GLY N N -4.606 -13.397 -2.438 1.00 . B B . 45 GLY N 1 1 16 12182 2 2 24 GLY O O -7.276 -12.444 -2.022 1.00 . B B . 45 GLY O 1 1 16 12183 2 2 25 PHE C C -7.617 -8.428 -1.040 1.00 . B B . 46 PHE C 1 1 16 12184 2 2 25 PHE CA C -7.597 -9.960 -1.029 1.00 . B B . 46 PHE CA 1 1 16 12185 2 2 25 PHE CB C -7.538 -10.473 0.414 1.00 . B B . 46 PHE CB 1 1 16 12186 2 2 25 PHE CD1 C -10.014 -9.671 0.410 1.00 . B B . 46 PHE CD1 1 1 16 12187 2 2 25 PHE CD2 C -9.294 -11.167 2.194 1.00 . B B . 46 PHE CD2 1 1 16 12188 2 2 25 PHE CE1 C -11.300 -9.648 0.965 1.00 . B B . 46 PHE CE1 1 1 16 12189 2 2 25 PHE CE2 C -10.587 -11.129 2.731 1.00 . B B . 46 PHE CE2 1 1 16 12190 2 2 25 PHE CG C -8.976 -10.437 1.021 1.00 . B B . 46 PHE CG 1 1 16 12191 2 2 25 PHE CZ C -11.584 -10.373 2.120 1.00 . B B . 46 PHE CZ 1 1 16 12192 2 2 25 PHE H H -5.653 -9.836 -1.946 1.00 . B B . 46 PHE H 1 1 16 12193 2 2 25 PHE HA H -8.492 -10.332 -1.505 1.00 . B B . 46 PHE HA 1 1 16 12194 2 2 25 PHE HB2 H -7.135 -11.500 0.403 1.00 . B B . 46 PHE HB2 1 1 16 12195 2 2 25 PHE HB3 H -6.856 -9.836 0.993 1.00 . B B . 46 PHE HB3 1 1 16 12196 2 2 25 PHE HD1 H -9.837 -9.100 -0.481 1.00 . B B . 46 PHE HD1 1 1 16 12197 2 2 25 PHE HD2 H -8.559 -11.757 2.685 1.00 . B B . 46 PHE HD2 1 1 16 12198 2 2 25 PHE HE1 H -12.077 -9.065 0.494 1.00 . B B . 46 PHE HE1 1 1 16 12199 2 2 25 PHE HE2 H -10.812 -11.690 3.626 1.00 . B B . 46 PHE HE2 1 1 16 12200 2 2 25 PHE HZ H -12.579 -10.350 2.541 1.00 . B B . 46 PHE HZ 1 1 16 12201 2 2 25 PHE N N -6.403 -10.443 -1.778 1.00 . B B . 46 PHE N 1 1 16 12202 2 2 25 PHE O O -8.393 -7.820 -1.750 1.00 . B B . 46 PHE O 1 1 16 12203 2 2 26 TYR C C -8.129 -5.735 -0.348 1.00 . B B . 47 TYR C 1 1 16 12204 2 2 26 TYR CA C -6.716 -6.312 -0.231 1.00 . B B . 47 TYR CA 1 1 16 12205 2 2 26 TYR CB C -5.863 -5.803 -1.393 1.00 . B B . 47 TYR CB 1 1 16 12206 2 2 26 TYR CD1 C -5.215 -3.595 -0.187 1.00 . B B . 47 TYR CD1 1 1 16 12207 2 2 26 TYR CD2 C -6.313 -3.432 -2.356 1.00 . B B . 47 TYR CD2 1 1 16 12208 2 2 26 TYR CE1 C -5.163 -2.197 -0.121 1.00 . B B . 47 TYR CE1 1 1 16 12209 2 2 26 TYR CE2 C -6.251 -2.035 -2.268 1.00 . B B . 47 TYR CE2 1 1 16 12210 2 2 26 TYR CG C -5.793 -4.246 -1.315 1.00 . B B . 47 TYR CG 1 1 16 12211 2 2 26 TYR CZ C -5.677 -1.422 -1.157 1.00 . B B . 47 TYR CZ 1 1 16 12212 2 2 26 TYR H H -6.142 -8.320 0.285 1.00 . B B . 47 TYR H 1 1 16 12213 2 2 26 TYR HA H -6.275 -5.992 0.702 1.00 . B B . 47 TYR HA 1 1 16 12214 2 2 26 TYR HB2 H -4.859 -6.254 -1.316 1.00 . B B . 47 TYR HB2 1 1 16 12215 2 2 26 TYR HB3 H -6.324 -6.126 -2.337 1.00 . B B . 47 TYR HB3 1 1 16 12216 2 2 26 TYR HD1 H -4.815 -4.155 0.633 1.00 . B B . 47 TYR HD1 1 1 16 12217 2 2 26 TYR HD2 H -6.767 -3.865 -3.217 1.00 . B B . 47 TYR HD2 1 1 16 12218 2 2 26 TYR HE1 H -4.722 -1.717 0.740 1.00 . B B . 47 TYR HE1 1 1 16 12219 2 2 26 TYR HE2 H -6.648 -1.429 -3.069 1.00 . B B . 47 TYR HE2 1 1 16 12220 2 2 26 TYR HH H -6.520 0.291 -1.121 1.00 . B B . 47 TYR HH 1 1 16 12221 2 2 26 TYR N N -6.762 -7.805 -0.267 1.00 . B B . 47 TYR N 1 1 16 12222 2 2 26 TYR O O -8.442 -5.026 -1.284 1.00 . B B . 47 TYR O 1 1 16 12223 2 2 26 TYR OH O -5.621 -0.045 -1.081 1.00 . B B . 47 TYR OH 1 1 16 12224 2 2 27 THR C C -11.018 -5.567 1.904 1.00 . B B . 48 THR C 1 1 16 12225 2 2 27 THR CA C -10.374 -5.496 0.523 1.00 . B B . 48 THR CA 1 1 16 12226 2 2 27 THR CB C -11.193 -6.328 -0.466 1.00 . B B . 48 THR CB 1 1 16 12227 2 2 27 THR CG2 C -12.428 -5.538 -0.900 1.00 . B B . 48 THR CG2 1 1 16 12228 2 2 27 THR H H -8.715 -6.605 1.337 1.00 . B B . 48 THR H 1 1 16 12229 2 2 27 THR HA H -10.347 -4.475 0.197 1.00 . B B . 48 THR HA 1 1 16 12230 2 2 27 THR HB H -11.507 -7.245 0.007 1.00 . B B . 48 THR HB 1 1 16 12231 2 2 27 THR HG1 H -10.968 -7.009 -2.273 1.00 . B B . 48 THR HG1 1 1 16 12232 2 2 27 THR HG21 H -12.141 -4.524 -1.139 1.00 . B B . 48 THR HG21 1 1 16 12233 2 2 27 THR HG22 H -13.150 -5.529 -0.097 1.00 . B B . 48 THR HG22 1 1 16 12234 2 2 27 THR HG23 H -12.864 -6.003 -1.772 1.00 . B B . 48 THR HG23 1 1 16 12235 2 2 27 THR N N -8.985 -6.031 0.590 1.00 . B B . 48 THR N 1 1 16 12236 2 2 27 THR O O -11.500 -4.585 2.432 1.00 . B B . 48 THR O 1 1 16 12237 2 2 27 THR OG1 O -10.396 -6.627 -1.603 1.00 . B B . 48 THR OG1 1 1 16 12238 2 2 28 LYS C C -10.858 -7.930 4.634 1.00 . B B . 49 LYS C 1 1 16 12239 2 2 28 LYS CA C -11.639 -6.880 3.837 1.00 . B B . 49 LYS CA 1 1 16 12240 2 2 28 LYS CB C -13.093 -7.329 3.687 1.00 . B B . 49 LYS CB 1 1 16 12241 2 2 28 LYS CD C -15.423 -6.469 3.416 1.00 . B B . 49 LYS CD 1 1 16 12242 2 2 28 LYS CE C -16.049 -5.204 2.827 1.00 . B B . 49 LYS CE 1 1 16 12243 2 2 28 LYS CG C -14.026 -6.146 3.952 1.00 . B B . 49 LYS CG 1 1 16 12244 2 2 28 LYS H H -10.632 -7.496 2.035 1.00 . B B . 49 LYS H 1 1 16 12245 2 2 28 LYS HA H -11.606 -5.934 4.358 1.00 . B B . 49 LYS HA 1 1 16 12246 2 2 28 LYS HB2 H -13.254 -7.696 2.683 1.00 . B B . 49 LYS HB2 1 1 16 12247 2 2 28 LYS HB3 H -13.302 -8.115 4.396 1.00 . B B . 49 LYS HB3 1 1 16 12248 2 2 28 LYS HD2 H -15.347 -7.226 2.649 1.00 . B B . 49 LYS HD2 1 1 16 12249 2 2 28 LYS HD3 H -16.041 -6.832 4.222 1.00 . B B . 49 LYS HD3 1 1 16 12250 2 2 28 LYS HE2 H -15.295 -4.437 2.736 1.00 . B B . 49 LYS HE2 1 1 16 12251 2 2 28 LYS HE3 H -16.457 -5.426 1.852 1.00 . B B . 49 LYS HE3 1 1 16 12252 2 2 28 LYS HG2 H -14.080 -5.961 5.015 1.00 . B B . 49 LYS HG2 1 1 16 12253 2 2 28 LYS HG3 H -13.646 -5.268 3.452 1.00 . B B . 49 LYS HG3 1 1 16 12254 2 2 28 LYS HZ1 H -16.942 -5.022 4.700 1.00 . B B . 49 LYS HZ1 1 1 16 12255 2 2 28 LYS HZ2 H -18.046 -5.131 3.413 1.00 . B B . 49 LYS HZ2 1 1 16 12256 2 2 28 LYS HZ3 H -17.192 -3.688 3.683 1.00 . B B . 49 LYS HZ3 1 1 16 12257 2 2 28 LYS N N -11.027 -6.725 2.488 1.00 . B B . 49 LYS N 1 1 16 12258 2 2 28 LYS NZ N -17.140 -4.725 3.724 1.00 . B B . 49 LYS NZ 1 1 16 12259 2 2 28 LYS O O -11.389 -8.968 4.974 1.00 . B B . 49 LYS O 1 1 16 12260 2 2 29 PRO C C -9.041 -8.463 7.157 1.00 . B B . 50 PRO C 1 1 16 12261 2 2 29 PRO CA C -8.722 -8.517 5.660 1.00 . B B . 50 PRO CA 1 1 16 12262 2 2 29 PRO CB C -7.326 -7.957 5.376 1.00 . B B . 50 PRO CB 1 1 16 12263 2 2 29 PRO CD C -8.986 -6.358 4.485 1.00 . B B . 50 PRO CD 1 1 16 12264 2 2 29 PRO CG C -7.526 -6.483 4.955 1.00 . B B . 50 PRO CG 1 1 16 12265 2 2 29 PRO HA H -8.797 -9.520 5.288 1.00 . B B . 50 PRO HA 1 1 16 12266 2 2 29 PRO HB2 H -6.716 -8.013 6.268 1.00 . B B . 50 PRO HB2 1 1 16 12267 2 2 29 PRO HB3 H -6.861 -8.505 4.571 1.00 . B B . 50 PRO HB3 1 1 16 12268 2 2 29 PRO HD2 H -9.467 -5.519 4.964 1.00 . B B . 50 PRO HD2 1 1 16 12269 2 2 29 PRO HD3 H -9.030 -6.263 3.412 1.00 . B B . 50 PRO HD3 1 1 16 12270 2 2 29 PRO HG2 H -7.347 -5.830 5.799 1.00 . B B . 50 PRO HG2 1 1 16 12271 2 2 29 PRO HG3 H -6.860 -6.234 4.144 1.00 . B B . 50 PRO HG3 1 1 16 12272 2 2 29 PRO N N -9.615 -7.624 4.906 1.00 . B B . 50 PRO N 1 1 16 12273 2 2 29 PRO O O -10.020 -7.876 7.574 1.00 . B B . 50 PRO O 1 1 16 12274 2 2 30 THR C C -7.141 -9.182 10.182 1.00 . B B . 51 THR C 1 1 16 12275 2 2 30 THR CA C -8.471 -9.061 9.437 1.00 . B B . 51 THR CA 1 1 16 12276 2 2 30 THR CB C -9.374 -10.239 9.811 1.00 . B B . 51 THR CB 1 1 16 12277 2 2 30 THR CG2 C -10.755 -10.046 9.183 1.00 . B B . 51 THR CG2 1 1 16 12278 2 2 30 THR H H -7.436 -9.541 7.610 1.00 . B B . 51 THR H 1 1 16 12279 2 2 30 THR HA H -8.954 -8.135 9.712 1.00 . B B . 51 THR HA 1 1 16 12280 2 2 30 THR HB H -9.475 -10.290 10.884 1.00 . B B . 51 THR HB 1 1 16 12281 2 2 30 THR HG1 H -9.015 -12.145 9.949 1.00 . B B . 51 THR HG1 1 1 16 12282 2 2 30 THR HG21 H -11.442 -10.771 9.594 1.00 . B B . 51 THR HG21 1 1 16 12283 2 2 30 THR HG22 H -10.687 -10.181 8.114 1.00 . B B . 51 THR HG22 1 1 16 12284 2 2 30 THR HG23 H -11.113 -9.050 9.397 1.00 . B B . 51 THR HG23 1 1 16 12285 2 2 30 THR N N -8.220 -9.073 7.968 1.00 . B B . 51 THR N 1 1 16 12286 2 2 30 THR O O -7.071 -8.721 11.309 1.00 . B B . 51 THR O 1 1 16 12287 2 2 30 THR OXT O -6.214 -9.737 9.613 1.00 . B B . 51 THR OXT 1 1 16 12288 2 2 30 THR OG1 O -8.797 -11.445 9.330 1.00 . B B . 51 THR OG1 1 1 17 12289 1 1 1 GLY C C -5.720 6.983 6.293 1.00 . A A . 1 GLY C 1 1 17 12290 1 1 1 GLY CA C -7.180 7.120 6.569 1.00 . A A . 1 GLY CA 1 1 17 12291 1 1 1 GLY H1 H -8.265 7.978 8.169 1.00 . A A . 1 GLY H1 1 1 17 12292 1 1 1 GLY H2 H -8.257 8.931 6.762 1.00 . A A . 1 GLY H2 1 1 17 12293 1 1 1 GLY H3 H -6.873 8.852 7.745 1.00 . A A . 1 GLY H3 1 1 17 12294 1 1 1 GLY HA2 H -7.037 6.344 7.140 1.00 . A A . 1 GLY HA2 1 1 17 12295 1 1 1 GLY HA3 H -7.961 6.928 5.722 1.00 . A A . 1 GLY HA3 1 1 17 12296 1 1 1 GLY N N -7.684 8.316 7.375 1.00 . A A . 1 GLY N 1 1 17 12297 1 1 1 GLY O O -4.889 7.454 7.044 1.00 . A A . 1 GLY O 1 1 17 12298 1 1 2 ILE C C -3.553 7.182 3.784 1.00 . A A . 2 ILE C 1 1 17 12299 1 1 2 ILE CA C -3.930 6.171 4.870 1.00 . A A . 2 ILE CA 1 1 17 12300 1 1 2 ILE CB C -3.696 4.753 4.344 1.00 . A A . 2 ILE CB 1 1 17 12301 1 1 2 ILE CD1 C -3.740 2.335 4.958 1.00 . A A . 2 ILE CD1 1 1 17 12302 1 1 2 ILE CG1 C -3.729 3.761 5.509 1.00 . A A . 2 ILE CG1 1 1 17 12303 1 1 2 ILE CG2 C -2.332 4.682 3.658 1.00 . A A . 2 ILE CG2 1 1 17 12304 1 1 2 ILE H H -6.060 5.973 4.619 1.00 . A A . 2 ILE H 1 1 17 12305 1 1 2 ILE HA H -3.325 6.334 5.748 1.00 . A A . 2 ILE HA 1 1 17 12306 1 1 2 ILE HB H -4.470 4.501 3.632 1.00 . A A . 2 ILE HB 1 1 17 12307 1 1 2 ILE HD11 H -4.236 1.682 5.661 1.00 . A A . 2 ILE HD11 1 1 17 12308 1 1 2 ILE HD12 H -2.725 1.999 4.808 1.00 . A A . 2 ILE HD12 1 1 17 12309 1 1 2 ILE HD13 H -4.268 2.318 4.016 1.00 . A A . 2 ILE HD13 1 1 17 12310 1 1 2 ILE HG12 H -2.854 3.903 6.126 1.00 . A A . 2 ILE HG12 1 1 17 12311 1 1 2 ILE HG13 H -4.618 3.926 6.099 1.00 . A A . 2 ILE HG13 1 1 17 12312 1 1 2 ILE HG21 H -2.137 3.667 3.348 1.00 . A A . 2 ILE HG21 1 1 17 12313 1 1 2 ILE HG22 H -1.567 5.003 4.349 1.00 . A A . 2 ILE HG22 1 1 17 12314 1 1 2 ILE HG23 H -2.331 5.330 2.793 1.00 . A A . 2 ILE HG23 1 1 17 12315 1 1 2 ILE N N -5.371 6.340 5.211 1.00 . A A . 2 ILE N 1 1 17 12316 1 1 2 ILE O O -2.393 7.453 3.544 1.00 . A A . 2 ILE O 1 1 17 12317 1 1 3 VAL C C -3.541 9.946 2.593 1.00 . A A . 3 VAL C 1 1 17 12318 1 1 3 VAL CA C -4.253 8.708 2.030 1.00 . A A . 3 VAL CA 1 1 17 12319 1 1 3 VAL CB C -5.577 9.141 1.393 1.00 . A A . 3 VAL CB 1 1 17 12320 1 1 3 VAL CG1 C -6.442 7.910 1.119 1.00 . A A . 3 VAL CG1 1 1 17 12321 1 1 3 VAL CG2 C -6.322 10.080 2.347 1.00 . A A . 3 VAL CG2 1 1 17 12322 1 1 3 VAL H H -5.455 7.478 3.324 1.00 . A A . 3 VAL H 1 1 17 12323 1 1 3 VAL HA H -3.632 8.242 1.280 1.00 . A A . 3 VAL HA 1 1 17 12324 1 1 3 VAL HB H -5.378 9.654 0.463 1.00 . A A . 3 VAL HB 1 1 17 12325 1 1 3 VAL HG11 H -6.713 7.885 0.074 1.00 . A A . 3 VAL HG11 1 1 17 12326 1 1 3 VAL HG12 H -7.338 7.959 1.721 1.00 . A A . 3 VAL HG12 1 1 17 12327 1 1 3 VAL HG13 H -5.889 7.017 1.369 1.00 . A A . 3 VAL HG13 1 1 17 12328 1 1 3 VAL HG21 H -5.928 11.081 2.249 1.00 . A A . 3 VAL HG21 1 1 17 12329 1 1 3 VAL HG22 H -6.190 9.740 3.364 1.00 . A A . 3 VAL HG22 1 1 17 12330 1 1 3 VAL HG23 H -7.374 10.083 2.103 1.00 . A A . 3 VAL HG23 1 1 17 12331 1 1 3 VAL N N -4.531 7.726 3.117 1.00 . A A . 3 VAL N 1 1 17 12332 1 1 3 VAL O O -3.060 10.781 1.852 1.00 . A A . 3 VAL O 1 1 17 12333 1 1 4 GLU C C -1.428 10.934 4.989 1.00 . A A . 4 GLU C 1 1 17 12334 1 1 4 GLU CA C -2.828 11.288 4.482 1.00 . A A . 4 GLU CA 1 1 17 12335 1 1 4 GLU CB C -3.673 11.800 5.652 1.00 . A A . 4 GLU CB 1 1 17 12336 1 1 4 GLU CD C -6.011 12.164 6.468 1.00 . A A . 4 GLU CD 1 1 17 12337 1 1 4 GLU CG C -5.154 11.549 5.359 1.00 . A A . 4 GLU CG 1 1 17 12338 1 1 4 GLU H H -3.894 9.412 4.472 1.00 . A A . 4 GLU H 1 1 17 12339 1 1 4 GLU HA H -2.753 12.060 3.732 1.00 . A A . 4 GLU HA 1 1 17 12340 1 1 4 GLU HB2 H -3.390 11.279 6.556 1.00 . A A . 4 GLU HB2 1 1 17 12341 1 1 4 GLU HB3 H -3.508 12.859 5.780 1.00 . A A . 4 GLU HB3 1 1 17 12342 1 1 4 GLU HG2 H -5.413 11.999 4.412 1.00 . A A . 4 GLU HG2 1 1 17 12343 1 1 4 GLU HG3 H -5.337 10.486 5.314 1.00 . A A . 4 GLU HG3 1 1 17 12344 1 1 4 GLU N N -3.487 10.086 3.889 1.00 . A A . 4 GLU N 1 1 17 12345 1 1 4 GLU O O -0.690 11.790 5.437 1.00 . A A . 4 GLU O 1 1 17 12346 1 1 4 GLU OE1 O -5.826 11.786 7.613 1.00 . A A . 4 GLU OE1 1 1 17 12347 1 1 4 GLU OE2 O -6.839 13.003 6.152 1.00 . A A . 4 GLU OE2 1 1 17 12348 1 1 5 GLN C C 1.229 9.009 4.257 1.00 . A A . 5 GLN C 1 1 17 12349 1 1 5 GLN CA C 0.294 9.298 5.433 1.00 . A A . 5 GLN CA 1 1 17 12350 1 1 5 GLN CB C 0.169 8.043 6.297 1.00 . A A . 5 GLN CB 1 1 17 12351 1 1 5 GLN CD C 1.232 9.323 8.164 1.00 . A A . 5 GLN CD 1 1 17 12352 1 1 5 GLN CG C 0.046 8.442 7.769 1.00 . A A . 5 GLN CG 1 1 17 12353 1 1 5 GLN H H -1.664 9.007 4.580 1.00 . A A . 5 GLN H 1 1 17 12354 1 1 5 GLN HA H 0.704 10.102 6.026 1.00 . A A . 5 GLN HA 1 1 17 12355 1 1 5 GLN HB2 H -0.711 7.489 5.999 1.00 . A A . 5 GLN HB2 1 1 17 12356 1 1 5 GLN HB3 H 1.044 7.425 6.165 1.00 . A A . 5 GLN HB3 1 1 17 12357 1 1 5 GLN HE21 H 2.350 7.794 8.756 1.00 . A A . 5 GLN HE21 1 1 17 12358 1 1 5 GLN HE22 H 3.074 9.323 8.904 1.00 . A A . 5 GLN HE22 1 1 17 12359 1 1 5 GLN HG2 H -0.874 8.989 7.917 1.00 . A A . 5 GLN HG2 1 1 17 12360 1 1 5 GLN HG3 H 0.040 7.555 8.383 1.00 . A A . 5 GLN HG3 1 1 17 12361 1 1 5 GLN N N -1.055 9.687 4.936 1.00 . A A . 5 GLN N 1 1 17 12362 1 1 5 GLN NE2 N 2.308 8.767 8.648 1.00 . A A . 5 GLN NE2 1 1 17 12363 1 1 5 GLN O O 2.386 9.384 4.266 1.00 . A A . 5 GLN O 1 1 17 12364 1 1 5 GLN OE1 O 1.179 10.530 8.031 1.00 . A A . 5 GLN OE1 1 1 17 12365 1 1 6 CYS C C 1.274 8.865 0.882 1.00 . A A . 6 CYS C 1 1 17 12366 1 1 6 CYS CA C 1.622 7.996 2.096 1.00 . A A . 6 CYS CA 1 1 17 12367 1 1 6 CYS CB C 1.432 6.523 1.736 1.00 . A A . 6 CYS CB 1 1 17 12368 1 1 6 CYS H H -0.182 8.020 3.273 1.00 . A A . 6 CYS H 1 1 17 12369 1 1 6 CYS HA H 2.656 8.159 2.368 1.00 . A A . 6 CYS HA 1 1 17 12370 1 1 6 CYS HB2 H 0.385 6.268 1.803 1.00 . A A . 6 CYS HB2 1 1 17 12371 1 1 6 CYS HB3 H 1.783 6.348 0.730 1.00 . A A . 6 CYS HB3 1 1 17 12372 1 1 6 CYS N N 0.748 8.328 3.255 1.00 . A A . 6 CYS N 1 1 17 12373 1 1 6 CYS O O 2.119 9.541 0.342 1.00 . A A . 6 CYS O 1 1 17 12374 1 1 6 CYS SG S 2.378 5.504 2.893 1.00 . A A . 6 CYS SG 1 1 17 12375 1 1 7 CYS C C 0.351 10.982 -0.815 1.00 . A A . 7 CYS C 1 1 17 12376 1 1 7 CYS CA C -0.351 9.614 -0.785 1.00 . A A . 7 CYS CA 1 1 17 12377 1 1 7 CYS CB C -1.868 9.812 -0.787 1.00 . A A . 7 CYS CB 1 1 17 12378 1 1 7 CYS H H -0.612 8.241 0.862 1.00 . A A . 7 CYS H 1 1 17 12379 1 1 7 CYS HA H -0.074 9.065 -1.674 1.00 . A A . 7 CYS HA 1 1 17 12380 1 1 7 CYS HB2 H -2.253 9.628 0.204 1.00 . A A . 7 CYS HB2 1 1 17 12381 1 1 7 CYS HB3 H -2.101 10.820 -1.086 1.00 . A A . 7 CYS HB3 1 1 17 12382 1 1 7 CYS N N 0.047 8.820 0.426 1.00 . A A . 7 CYS N 1 1 17 12383 1 1 7 CYS O O 0.560 11.548 -1.870 1.00 . A A . 7 CYS O 1 1 17 12384 1 1 7 CYS SG S -2.636 8.652 -1.942 1.00 . A A . 7 CYS SG 1 1 17 12385 1 1 8 THR C C 2.804 12.697 -0.309 1.00 . A A . 8 THR C 1 1 17 12386 1 1 8 THR CA C 1.410 12.852 0.309 1.00 . A A . 8 THR CA 1 1 17 12387 1 1 8 THR CB C 1.543 13.376 1.741 1.00 . A A . 8 THR CB 1 1 17 12388 1 1 8 THR CG2 C 2.206 12.314 2.618 1.00 . A A . 8 THR CG2 1 1 17 12389 1 1 8 THR H H 0.552 11.062 1.164 1.00 . A A . 8 THR H 1 1 17 12390 1 1 8 THR HA H 0.834 13.551 -0.279 1.00 . A A . 8 THR HA 1 1 17 12391 1 1 8 THR HB H 0.564 13.602 2.134 1.00 . A A . 8 THR HB 1 1 17 12392 1 1 8 THR HG1 H 2.001 15.142 2.417 1.00 . A A . 8 THR HG1 1 1 17 12393 1 1 8 THR HG21 H 2.154 11.355 2.125 1.00 . A A . 8 THR HG21 1 1 17 12394 1 1 8 THR HG22 H 1.693 12.260 3.567 1.00 . A A . 8 THR HG22 1 1 17 12395 1 1 8 THR HG23 H 3.241 12.578 2.782 1.00 . A A . 8 THR HG23 1 1 17 12396 1 1 8 THR N N 0.721 11.523 0.317 1.00 . A A . 8 THR N 1 1 17 12397 1 1 8 THR O O 3.408 13.649 -0.762 1.00 . A A . 8 THR O 1 1 17 12398 1 1 8 THR OG1 O 2.338 14.554 1.738 1.00 . A A . 8 THR OG1 1 1 17 12399 1 1 9 SER C C 4.730 9.762 -1.301 1.00 . A A . 9 SER C 1 1 17 12400 1 1 9 SER CA C 4.652 11.241 -0.922 1.00 . A A . 9 SER CA 1 1 17 12401 1 1 9 SER CB C 5.736 11.568 0.105 1.00 . A A . 9 SER CB 1 1 17 12402 1 1 9 SER H H 2.792 10.750 0.035 1.00 . A A . 9 SER H 1 1 17 12403 1 1 9 SER HA H 4.786 11.853 -1.803 1.00 . A A . 9 SER HA 1 1 17 12404 1 1 9 SER HB2 H 5.550 12.540 0.531 1.00 . A A . 9 SER HB2 1 1 17 12405 1 1 9 SER HB3 H 5.722 10.825 0.891 1.00 . A A . 9 SER HB3 1 1 17 12406 1 1 9 SER HG H 6.878 11.895 -1.435 1.00 . A A . 9 SER HG 1 1 17 12407 1 1 9 SER N N 3.308 11.497 -0.333 1.00 . A A . 9 SER N 1 1 17 12408 1 1 9 SER O O 3.741 9.062 -1.262 1.00 . A A . 9 SER O 1 1 17 12409 1 1 9 SER OG O 7.002 11.574 -0.538 1.00 . A A . 9 SER OG 1 1 17 12410 1 1 10 ILE C C 6.592 7.017 -0.910 1.00 . A A . 10 ILE C 1 1 17 12411 1 1 10 ILE CA C 5.963 7.825 -2.038 1.00 . A A . 10 ILE CA 1 1 17 12412 1 1 10 ILE CB C 6.773 7.641 -3.325 1.00 . A A . 10 ILE CB 1 1 17 12413 1 1 10 ILE CD1 C 5.694 5.378 -3.349 1.00 . A A . 10 ILE CD1 1 1 17 12414 1 1 10 ILE CG1 C 6.984 6.151 -3.609 1.00 . A A . 10 ILE CG1 1 1 17 12415 1 1 10 ILE CG2 C 8.134 8.291 -3.164 1.00 . A A . 10 ILE CG2 1 1 17 12416 1 1 10 ILE H H 6.679 9.837 -1.697 1.00 . A A . 10 ILE H 1 1 17 12417 1 1 10 ILE HA H 4.973 7.461 -2.196 1.00 . A A . 10 ILE HA 1 1 17 12418 1 1 10 ILE HB H 6.248 8.098 -4.151 1.00 . A A . 10 ILE HB 1 1 17 12419 1 1 10 ILE HD11 H 5.869 4.325 -3.515 1.00 . A A . 10 ILE HD11 1 1 17 12420 1 1 10 ILE HD12 H 4.926 5.725 -4.020 1.00 . A A . 10 ILE HD12 1 1 17 12421 1 1 10 ILE HD13 H 5.383 5.536 -2.329 1.00 . A A . 10 ILE HD13 1 1 17 12422 1 1 10 ILE HG12 H 7.277 6.022 -4.641 1.00 . A A . 10 ILE HG12 1 1 17 12423 1 1 10 ILE HG13 H 7.763 5.773 -2.965 1.00 . A A . 10 ILE HG13 1 1 17 12424 1 1 10 ILE HG21 H 8.891 7.522 -3.128 1.00 . A A . 10 ILE HG21 1 1 17 12425 1 1 10 ILE HG22 H 8.151 8.858 -2.249 1.00 . A A . 10 ILE HG22 1 1 17 12426 1 1 10 ILE HG23 H 8.319 8.942 -4.002 1.00 . A A . 10 ILE HG23 1 1 17 12427 1 1 10 ILE N N 5.883 9.268 -1.667 1.00 . A A . 10 ILE N 1 1 17 12428 1 1 10 ILE O O 7.796 6.889 -0.812 1.00 . A A . 10 ILE O 1 1 17 12429 1 1 11 CYS C C 7.194 4.534 0.440 1.00 . A A . 11 CYS C 1 1 17 12430 1 1 11 CYS CA C 6.304 5.621 1.042 1.00 . A A . 11 CYS CA 1 1 17 12431 1 1 11 CYS CB C 5.137 4.974 1.793 1.00 . A A . 11 CYS CB 1 1 17 12432 1 1 11 CYS H H 4.805 6.555 -0.182 1.00 . A A . 11 CYS H 1 1 17 12433 1 1 11 CYS HA H 6.879 6.237 1.718 1.00 . A A . 11 CYS HA 1 1 17 12434 1 1 11 CYS HB2 H 4.454 4.532 1.082 1.00 . A A . 11 CYS HB2 1 1 17 12435 1 1 11 CYS HB3 H 5.512 4.209 2.455 1.00 . A A . 11 CYS HB3 1 1 17 12436 1 1 11 CYS N N 5.773 6.449 -0.069 1.00 . A A . 11 CYS N 1 1 17 12437 1 1 11 CYS O O 7.207 4.331 -0.757 1.00 . A A . 11 CYS O 1 1 17 12438 1 1 11 CYS SG S 4.260 6.227 2.758 1.00 . A A . 11 CYS SG 1 1 17 12439 1 1 12 SER C C 8.037 1.452 0.604 1.00 . A A . 12 SER C 1 1 17 12440 1 1 12 SER CA C 8.819 2.768 0.686 1.00 . A A . 12 SER CA 1 1 17 12441 1 1 12 SER CB C 10.034 2.580 1.594 1.00 . A A . 12 SER CB 1 1 17 12442 1 1 12 SER H H 7.923 4.004 2.210 1.00 . A A . 12 SER H 1 1 17 12443 1 1 12 SER HA H 9.147 3.061 -0.304 1.00 . A A . 12 SER HA 1 1 17 12444 1 1 12 SER HB2 H 10.847 2.158 1.028 1.00 . A A . 12 SER HB2 1 1 17 12445 1 1 12 SER HB3 H 10.336 3.540 1.992 1.00 . A A . 12 SER HB3 1 1 17 12446 1 1 12 SER HG H 10.350 1.801 3.349 1.00 . A A . 12 SER HG 1 1 17 12447 1 1 12 SER N N 7.939 3.833 1.245 1.00 . A A . 12 SER N 1 1 17 12448 1 1 12 SER O O 7.228 1.148 1.457 1.00 . A A . 12 SER O 1 1 17 12449 1 1 12 SER OG O 9.695 1.697 2.656 1.00 . A A . 12 SER OG 1 1 17 12450 1 1 13 LEU C C 7.619 -1.397 0.776 1.00 . A A . 13 LEU C 1 1 17 12451 1 1 13 LEU CA C 7.538 -0.624 -0.543 1.00 . A A . 13 LEU CA 1 1 17 12452 1 1 13 LEU CB C 8.165 -1.459 -1.664 1.00 . A A . 13 LEU CB 1 1 17 12453 1 1 13 LEU CD1 C 7.524 -3.471 -3.002 1.00 . A A . 13 LEU CD1 1 1 17 12454 1 1 13 LEU CD2 C 8.646 -3.752 -0.789 1.00 . A A . 13 LEU CD2 1 1 17 12455 1 1 13 LEU CG C 7.655 -2.901 -1.588 1.00 . A A . 13 LEU CG 1 1 17 12456 1 1 13 LEU H H 8.928 0.929 -1.093 1.00 . A A . 13 LEU H 1 1 17 12457 1 1 13 LEU HA H 6.501 -0.426 -0.776 1.00 . A A . 13 LEU HA 1 1 17 12458 1 1 13 LEU HB2 H 7.899 -1.033 -2.620 1.00 . A A . 13 LEU HB2 1 1 17 12459 1 1 13 LEU HB3 H 9.239 -1.455 -1.556 1.00 . A A . 13 LEU HB3 1 1 17 12460 1 1 13 LEU HD11 H 8.495 -3.789 -3.352 1.00 . A A . 13 LEU HD11 1 1 17 12461 1 1 13 LEU HD12 H 7.136 -2.710 -3.663 1.00 . A A . 13 LEU HD12 1 1 17 12462 1 1 13 LEU HD13 H 6.851 -4.315 -2.990 1.00 . A A . 13 LEU HD13 1 1 17 12463 1 1 13 LEU HD21 H 8.873 -4.651 -1.342 1.00 . A A . 13 LEU HD21 1 1 17 12464 1 1 13 LEU HD22 H 8.211 -4.015 0.164 1.00 . A A . 13 LEU HD22 1 1 17 12465 1 1 13 LEU HD23 H 9.554 -3.190 -0.627 1.00 . A A . 13 LEU HD23 1 1 17 12466 1 1 13 LEU HG H 6.689 -2.917 -1.102 1.00 . A A . 13 LEU HG 1 1 17 12467 1 1 13 LEU N N 8.272 0.668 -0.414 1.00 . A A . 13 LEU N 1 1 17 12468 1 1 13 LEU O O 6.779 -2.225 1.070 1.00 . A A . 13 LEU O 1 1 17 12469 1 1 14 TYR C C 7.636 -1.374 3.815 1.00 . A A . 14 TYR C 1 1 17 12470 1 1 14 TYR CA C 8.736 -1.858 2.869 1.00 . A A . 14 TYR CA 1 1 17 12471 1 1 14 TYR CB C 10.110 -1.582 3.488 1.00 . A A . 14 TYR CB 1 1 17 12472 1 1 14 TYR CD1 C 11.489 -2.822 1.694 1.00 . A A . 14 TYR CD1 1 1 17 12473 1 1 14 TYR CD2 C 11.626 -3.606 3.994 1.00 . A A . 14 TYR CD2 1 1 17 12474 1 1 14 TYR CE1 C 12.381 -3.830 1.307 1.00 . A A . 14 TYR CE1 1 1 17 12475 1 1 14 TYR CE2 C 12.518 -4.608 3.590 1.00 . A A . 14 TYR CE2 1 1 17 12476 1 1 14 TYR CG C 11.097 -2.693 3.051 1.00 . A A . 14 TYR CG 1 1 17 12477 1 1 14 TYR CZ C 12.895 -4.719 2.252 1.00 . A A . 14 TYR CZ 1 1 17 12478 1 1 14 TYR H H 9.283 -0.462 1.321 1.00 . A A . 14 TYR H 1 1 17 12479 1 1 14 TYR HA H 8.623 -2.919 2.702 1.00 . A A . 14 TYR HA 1 1 17 12480 1 1 14 TYR HB2 H 10.455 -0.602 3.156 1.00 . A A . 14 TYR HB2 1 1 17 12481 1 1 14 TYR HB3 H 10.014 -1.564 4.571 1.00 . A A . 14 TYR HB3 1 1 17 12482 1 1 14 TYR HD1 H 11.105 -2.158 0.943 1.00 . A A . 14 TYR HD1 1 1 17 12483 1 1 14 TYR HD2 H 11.351 -3.548 5.025 1.00 . A A . 14 TYR HD2 1 1 17 12484 1 1 14 TYR HE1 H 12.675 -3.919 0.271 1.00 . A A . 14 TYR HE1 1 1 17 12485 1 1 14 TYR HE2 H 12.916 -5.300 4.319 1.00 . A A . 14 TYR HE2 1 1 17 12486 1 1 14 TYR HH H 14.547 -5.284 1.479 1.00 . A A . 14 TYR HH 1 1 17 12487 1 1 14 TYR N N 8.616 -1.135 1.573 1.00 . A A . 14 TYR N 1 1 17 12488 1 1 14 TYR O O 7.053 -2.145 4.552 1.00 . A A . 14 TYR O 1 1 17 12489 1 1 14 TYR OH O 13.776 -5.708 1.861 1.00 . A A . 14 TYR OH 1 1 17 12490 1 1 15 GLN C C 4.920 -0.135 4.272 1.00 . A A . 15 GLN C 1 1 17 12491 1 1 15 GLN CA C 6.278 0.429 4.696 1.00 . A A . 15 GLN CA 1 1 17 12492 1 1 15 GLN CB C 6.249 1.955 4.612 1.00 . A A . 15 GLN CB 1 1 17 12493 1 1 15 GLN CD C 7.142 3.497 6.361 1.00 . A A . 15 GLN CD 1 1 17 12494 1 1 15 GLN CG C 7.521 2.522 5.245 1.00 . A A . 15 GLN CG 1 1 17 12495 1 1 15 GLN H H 7.822 0.503 3.194 1.00 . A A . 15 GLN H 1 1 17 12496 1 1 15 GLN HA H 6.488 0.131 5.713 1.00 . A A . 15 GLN HA 1 1 17 12497 1 1 15 GLN HB2 H 6.193 2.259 3.577 1.00 . A A . 15 GLN HB2 1 1 17 12498 1 1 15 GLN HB3 H 5.388 2.328 5.145 1.00 . A A . 15 GLN HB3 1 1 17 12499 1 1 15 GLN HE21 H 8.774 4.606 6.136 1.00 . A A . 15 GLN HE21 1 1 17 12500 1 1 15 GLN HE22 H 7.706 5.123 7.351 1.00 . A A . 15 GLN HE22 1 1 17 12501 1 1 15 GLN HG2 H 8.109 1.713 5.656 1.00 . A A . 15 GLN HG2 1 1 17 12502 1 1 15 GLN HG3 H 8.097 3.042 4.495 1.00 . A A . 15 GLN HG3 1 1 17 12503 1 1 15 GLN N N 7.343 -0.102 3.798 1.00 . A A . 15 GLN N 1 1 17 12504 1 1 15 GLN NE2 N 7.940 4.491 6.640 1.00 . A A . 15 GLN NE2 1 1 17 12505 1 1 15 GLN O O 4.165 -0.627 5.087 1.00 . A A . 15 GLN O 1 1 17 12506 1 1 15 GLN OE1 O 6.109 3.353 6.985 1.00 . A A . 15 GLN OE1 1 1 17 12507 1 1 16 LEU C C 3.190 -2.081 3.001 1.00 . A A . 16 LEU C 1 1 17 12508 1 1 16 LEU CA C 3.288 -0.627 2.555 1.00 . A A . 16 LEU CA 1 1 17 12509 1 1 16 LEU CB C 3.190 -0.546 1.030 1.00 . A A . 16 LEU CB 1 1 17 12510 1 1 16 LEU CD1 C 4.025 1.775 0.617 1.00 . A A . 16 LEU CD1 1 1 17 12511 1 1 16 LEU CD2 C 2.193 0.837 -0.796 1.00 . A A . 16 LEU CD2 1 1 17 12512 1 1 16 LEU CG C 2.791 0.871 0.613 1.00 . A A . 16 LEU CG 1 1 17 12513 1 1 16 LEU H H 5.221 0.312 2.354 1.00 . A A . 16 LEU H 1 1 17 12514 1 1 16 LEU HA H 2.482 -0.064 3.006 1.00 . A A . 16 LEU HA 1 1 17 12515 1 1 16 LEU HB2 H 4.148 -0.794 0.596 1.00 . A A . 16 LEU HB2 1 1 17 12516 1 1 16 LEU HB3 H 2.445 -1.245 0.681 1.00 . A A . 16 LEU HB3 1 1 17 12517 1 1 16 LEU HD11 H 3.780 2.722 0.157 1.00 . A A . 16 LEU HD11 1 1 17 12518 1 1 16 LEU HD12 H 4.820 1.301 0.062 1.00 . A A . 16 LEU HD12 1 1 17 12519 1 1 16 LEU HD13 H 4.346 1.943 1.634 1.00 . A A . 16 LEU HD13 1 1 17 12520 1 1 16 LEU HD21 H 2.871 1.317 -1.486 1.00 . A A . 16 LEU HD21 1 1 17 12521 1 1 16 LEU HD22 H 1.247 1.359 -0.799 1.00 . A A . 16 LEU HD22 1 1 17 12522 1 1 16 LEU HD23 H 2.039 -0.189 -1.097 1.00 . A A . 16 LEU HD23 1 1 17 12523 1 1 16 LEU HG H 2.060 1.258 1.308 1.00 . A A . 16 LEU HG 1 1 17 12524 1 1 16 LEU N N 4.599 -0.080 3.005 1.00 . A A . 16 LEU N 1 1 17 12525 1 1 16 LEU O O 2.131 -2.565 3.349 1.00 . A A . 16 LEU O 1 1 17 12526 1 1 17 GLU C C 3.828 -4.209 4.931 1.00 . A A . 17 GLU C 1 1 17 12527 1 1 17 GLU CA C 4.260 -4.189 3.466 1.00 . A A . 17 GLU CA 1 1 17 12528 1 1 17 GLU CB C 5.655 -4.797 3.321 1.00 . A A . 17 GLU CB 1 1 17 12529 1 1 17 GLU CD C 6.775 -6.728 2.199 1.00 . A A . 17 GLU CD 1 1 17 12530 1 1 17 GLU CG C 5.717 -5.635 2.042 1.00 . A A . 17 GLU CG 1 1 17 12531 1 1 17 GLU H H 5.141 -2.367 2.752 1.00 . A A . 17 GLU H 1 1 17 12532 1 1 17 GLU HA H 3.553 -4.747 2.869 1.00 . A A . 17 GLU HA 1 1 17 12533 1 1 17 GLU HB2 H 6.388 -4.004 3.267 1.00 . A A . 17 GLU HB2 1 1 17 12534 1 1 17 GLU HB3 H 5.866 -5.424 4.172 1.00 . A A . 17 GLU HB3 1 1 17 12535 1 1 17 GLU HG2 H 4.752 -6.087 1.862 1.00 . A A . 17 GLU HG2 1 1 17 12536 1 1 17 GLU HG3 H 5.978 -5.000 1.208 1.00 . A A . 17 GLU HG3 1 1 17 12537 1 1 17 GLU N N 4.291 -2.778 3.017 1.00 . A A . 17 GLU N 1 1 17 12538 1 1 17 GLU O O 3.385 -5.214 5.451 1.00 . A A . 17 GLU O 1 1 17 12539 1 1 17 GLU OE1 O 7.885 -6.400 2.583 1.00 . A A . 17 GLU OE1 1 1 17 12540 1 1 17 GLU OE2 O 6.457 -7.875 1.931 1.00 . A A . 17 GLU OE2 1 1 17 12541 1 1 18 ASN C C 2.003 -2.965 7.100 1.00 . A A . 18 ASN C 1 1 17 12542 1 1 18 ASN CA C 3.530 -3.022 7.024 1.00 . A A . 18 ASN CA 1 1 17 12543 1 1 18 ASN CB C 4.122 -1.767 7.673 1.00 . A A . 18 ASN CB 1 1 17 12544 1 1 18 ASN CG C 3.880 -1.810 9.185 1.00 . A A . 18 ASN CG 1 1 17 12545 1 1 18 ASN H H 4.295 -2.290 5.152 1.00 . A A . 18 ASN H 1 1 17 12546 1 1 18 ASN HA H 3.884 -3.899 7.544 1.00 . A A . 18 ASN HA 1 1 17 12547 1 1 18 ASN HB2 H 5.183 -1.729 7.478 1.00 . A A . 18 ASN HB2 1 1 17 12548 1 1 18 ASN HB3 H 3.648 -0.890 7.259 1.00 . A A . 18 ASN HB3 1 1 17 12549 1 1 18 ASN HD21 H 5.682 -1.109 9.639 1.00 . A A . 18 ASN HD21 1 1 17 12550 1 1 18 ASN HD22 H 4.680 -1.448 10.967 1.00 . A A . 18 ASN HD22 1 1 17 12551 1 1 18 ASN N N 3.943 -3.089 5.597 1.00 . A A . 18 ASN N 1 1 17 12552 1 1 18 ASN ND2 N 4.826 -1.423 9.998 1.00 . A A . 18 ASN ND2 1 1 17 12553 1 1 18 ASN O O 1.405 -3.413 8.059 1.00 . A A . 18 ASN O 1 1 17 12554 1 1 18 ASN OD1 O 2.819 -2.197 9.631 1.00 . A A . 18 ASN OD1 1 1 17 12555 1 1 19 TYR C C -0.712 -3.749 5.967 1.00 . A A . 19 TYR C 1 1 17 12556 1 1 19 TYR CA C -0.125 -2.343 6.124 1.00 . A A . 19 TYR CA 1 1 17 12557 1 1 19 TYR CB C -0.623 -1.458 4.977 1.00 . A A . 19 TYR CB 1 1 17 12558 1 1 19 TYR CD1 C 1.067 0.218 6.024 1.00 . A A . 19 TYR CD1 1 1 17 12559 1 1 19 TYR CD2 C 0.242 0.674 3.778 1.00 . A A . 19 TYR CD2 1 1 17 12560 1 1 19 TYR CE1 C 1.843 1.381 5.963 1.00 . A A . 19 TYR CE1 1 1 17 12561 1 1 19 TYR CE2 C 1.026 1.833 3.738 1.00 . A A . 19 TYR CE2 1 1 17 12562 1 1 19 TYR CG C 0.243 -0.162 4.923 1.00 . A A . 19 TYR CG 1 1 17 12563 1 1 19 TYR CZ C 1.822 2.185 4.825 1.00 . A A . 19 TYR CZ 1 1 17 12564 1 1 19 TYR H H 1.862 -2.059 5.326 1.00 . A A . 19 TYR H 1 1 17 12565 1 1 19 TYR HA H -0.446 -1.924 7.066 1.00 . A A . 19 TYR HA 1 1 17 12566 1 1 19 TYR HB2 H -0.548 -2.029 4.036 1.00 . A A . 19 TYR HB2 1 1 17 12567 1 1 19 TYR HB3 H -1.680 -1.213 5.156 1.00 . A A . 19 TYR HB3 1 1 17 12568 1 1 19 TYR HD1 H 1.112 -0.375 6.916 1.00 . A A . 19 TYR HD1 1 1 17 12569 1 1 19 TYR HD2 H -0.353 0.436 2.930 1.00 . A A . 19 TYR HD2 1 1 17 12570 1 1 19 TYR HE1 H 2.462 1.657 6.803 1.00 . A A . 19 TYR HE1 1 1 17 12571 1 1 19 TYR HE2 H 1.015 2.458 2.857 1.00 . A A . 19 TYR HE2 1 1 17 12572 1 1 19 TYR HH H 3.447 3.095 4.406 1.00 . A A . 19 TYR HH 1 1 17 12573 1 1 19 TYR N N 1.364 -2.419 6.097 1.00 . A A . 19 TYR N 1 1 17 12574 1 1 19 TYR O O -1.908 -3.945 6.056 1.00 . A A . 19 TYR O 1 1 17 12575 1 1 19 TYR OH O 2.592 3.329 4.774 1.00 . A A . 19 TYR OH 1 1 17 12576 1 1 20 CYS C C -0.581 -6.764 6.940 1.00 . A A . 20 CYS C 1 1 17 12577 1 1 20 CYS CA C -0.400 -6.117 5.566 1.00 . A A . 20 CYS CA 1 1 17 12578 1 1 20 CYS CB C 0.592 -6.939 4.744 1.00 . A A . 20 CYS CB 1 1 17 12579 1 1 20 CYS H H 1.079 -4.554 5.661 1.00 . A A . 20 CYS H 1 1 17 12580 1 1 20 CYS HA H -1.351 -6.086 5.056 1.00 . A A . 20 CYS HA 1 1 17 12581 1 1 20 CYS HB2 H 1.437 -7.207 5.362 1.00 . A A . 20 CYS HB2 1 1 17 12582 1 1 20 CYS HB3 H 0.108 -7.837 4.389 1.00 . A A . 20 CYS HB3 1 1 17 12583 1 1 20 CYS N N 0.118 -4.730 5.731 1.00 . A A . 20 CYS N 1 1 17 12584 1 1 20 CYS O O -0.108 -7.854 7.190 1.00 . A A . 20 CYS O 1 1 17 12585 1 1 20 CYS SG S 1.163 -5.962 3.333 1.00 . A A . 20 CYS SG 1 1 17 12586 1 1 21 ASN C C -2.971 -6.683 9.512 1.00 . A A . 21 ASN C 1 1 17 12587 1 1 21 ASN CA C -1.476 -6.679 9.188 1.00 . A A . 21 ASN CA 1 1 17 12588 1 1 21 ASN CB C -0.733 -5.838 10.227 1.00 . A A . 21 ASN CB 1 1 17 12589 1 1 21 ASN CG C -0.496 -6.678 11.483 1.00 . A A . 21 ASN CG 1 1 17 12590 1 1 21 ASN H H -1.636 -5.222 7.609 1.00 . A A . 21 ASN H 1 1 17 12591 1 1 21 ASN HA H -1.101 -7.691 9.210 1.00 . A A . 21 ASN HA 1 1 17 12592 1 1 21 ASN HB2 H 0.216 -5.520 9.820 1.00 . A A . 21 ASN HB2 1 1 17 12593 1 1 21 ASN HB3 H -1.325 -4.972 10.481 1.00 . A A . 21 ASN HB3 1 1 17 12594 1 1 21 ASN HD21 H 0.763 -7.926 10.587 1.00 . A A . 21 ASN HD21 1 1 17 12595 1 1 21 ASN HD22 H 0.470 -8.245 12.228 1.00 . A A . 21 ASN HD22 1 1 17 12596 1 1 21 ASN N N -1.263 -6.100 7.832 1.00 . A A . 21 ASN N 1 1 17 12597 1 1 21 ASN ND2 N 0.312 -7.701 11.428 1.00 . A A . 21 ASN ND2 1 1 17 12598 1 1 21 ASN O O -3.757 -6.748 8.581 1.00 . A A . 21 ASN O 1 1 17 12599 1 1 21 ASN OXT O -3.303 -6.621 10.684 1.00 . A A . 21 ASN OXT 1 1 17 12600 1 1 21 ASN OD1 O -1.056 -6.402 12.526 1.00 . A A . 21 ASN OD1 1 1 17 12601 2 2 1 PHE C C 10.641 0.189 -5.867 1.00 . B B . 22 PHE C 1 1 17 12602 2 2 1 PHE CA C 11.735 -0.852 -6.032 1.00 . B B . 22 PHE CA 1 1 17 12603 2 2 1 PHE CB C 12.763 -0.698 -4.910 1.00 . B B . 22 PHE CB 1 1 17 12604 2 2 1 PHE CD1 C 13.878 -2.955 -5.022 1.00 . B B . 22 PHE CD1 1 1 17 12605 2 2 1 PHE CD2 C 12.528 -2.414 -3.079 1.00 . B B . 22 PHE CD2 1 1 17 12606 2 2 1 PHE CE1 C 14.154 -4.216 -4.479 1.00 . B B . 22 PHE CE1 1 1 17 12607 2 2 1 PHE CE2 C 12.804 -3.674 -2.536 1.00 . B B . 22 PHE CE2 1 1 17 12608 2 2 1 PHE CG C 13.065 -2.054 -4.322 1.00 . B B . 22 PHE CG 1 1 17 12609 2 2 1 PHE CZ C 13.618 -4.576 -3.236 1.00 . B B . 22 PHE CZ 1 1 17 12610 2 2 1 PHE H1 H 11.700 -0.397 -8.063 1.00 . B B . 22 PHE H1 1 1 17 12611 2 2 1 PHE H2 H 12.854 -1.567 -7.635 1.00 . B B . 22 PHE H2 1 1 17 12612 2 2 1 PHE H3 H 13.127 0.071 -7.275 1.00 . B B . 22 PHE H3 1 1 17 12613 2 2 1 PHE HA H 11.296 -1.823 -5.980 1.00 . B B . 22 PHE HA 1 1 17 12614 2 2 1 PHE HB2 H 13.670 -0.267 -5.308 1.00 . B B . 22 PHE HB2 1 1 17 12615 2 2 1 PHE HB3 H 12.364 -0.053 -4.142 1.00 . B B . 22 PHE HB3 1 1 17 12616 2 2 1 PHE HD1 H 14.291 -2.677 -5.981 1.00 . B B . 22 PHE HD1 1 1 17 12617 2 2 1 PHE HD2 H 11.901 -1.719 -2.540 1.00 . B B . 22 PHE HD2 1 1 17 12618 2 2 1 PHE HE1 H 14.781 -4.909 -5.020 1.00 . B B . 22 PHE HE1 1 1 17 12619 2 2 1 PHE HE2 H 12.390 -3.950 -1.578 1.00 . B B . 22 PHE HE2 1 1 17 12620 2 2 1 PHE HZ H 13.831 -5.549 -2.817 1.00 . B B . 22 PHE HZ 1 1 17 12621 2 2 1 PHE N N 12.404 -0.673 -7.351 1.00 . B B . 22 PHE N 1 1 17 12622 2 2 1 PHE O O 9.536 -0.109 -5.458 1.00 . B B . 22 PHE O 1 1 17 12623 2 2 2 VAL C C 10.334 3.694 -6.859 1.00 . B B . 23 VAL C 1 1 17 12624 2 2 2 VAL CA C 9.929 2.478 -6.017 1.00 . B B . 23 VAL CA 1 1 17 12625 2 2 2 VAL CB C 9.838 2.834 -4.530 1.00 . B B . 23 VAL CB 1 1 17 12626 2 2 2 VAL CG1 C 10.955 3.807 -4.158 1.00 . B B . 23 VAL CG1 1 1 17 12627 2 2 2 VAL CG2 C 8.472 3.450 -4.222 1.00 . B B . 23 VAL CG2 1 1 17 12628 2 2 2 VAL H H 11.845 1.618 -6.484 1.00 . B B . 23 VAL H 1 1 17 12629 2 2 2 VAL HA H 8.971 2.120 -6.354 1.00 . B B . 23 VAL HA 1 1 17 12630 2 2 2 VAL HB H 9.956 1.935 -3.951 1.00 . B B . 23 VAL HB 1 1 17 12631 2 2 2 VAL HG11 H 11.211 3.676 -3.117 1.00 . B B . 23 VAL HG11 1 1 17 12632 2 2 2 VAL HG12 H 10.623 4.820 -4.326 1.00 . B B . 23 VAL HG12 1 1 17 12633 2 2 2 VAL HG13 H 11.823 3.605 -4.769 1.00 . B B . 23 VAL HG13 1 1 17 12634 2 2 2 VAL HG21 H 7.828 3.345 -5.082 1.00 . B B . 23 VAL HG21 1 1 17 12635 2 2 2 VAL HG22 H 8.595 4.496 -3.992 1.00 . B B . 23 VAL HG22 1 1 17 12636 2 2 2 VAL HG23 H 8.030 2.944 -3.377 1.00 . B B . 23 VAL HG23 1 1 17 12637 2 2 2 VAL N N 10.944 1.407 -6.168 1.00 . B B . 23 VAL N 1 1 17 12638 2 2 2 VAL O O 11.092 3.571 -7.796 1.00 . B B . 23 VAL O 1 1 17 12639 2 2 3 ASN C C 8.829 6.544 -8.009 1.00 . B B . 24 ASN C 1 1 17 12640 2 2 3 ASN CA C 10.087 6.131 -7.244 1.00 . B B . 24 ASN CA 1 1 17 12641 2 2 3 ASN CB C 11.265 6.003 -8.220 1.00 . B B . 24 ASN CB 1 1 17 12642 2 2 3 ASN CG C 12.542 5.655 -7.447 1.00 . B B . 24 ASN CG 1 1 17 12643 2 2 3 ASN H H 9.197 4.862 -5.758 1.00 . B B . 24 ASN H 1 1 17 12644 2 2 3 ASN HA H 10.308 6.895 -6.512 1.00 . B B . 24 ASN HA 1 1 17 12645 2 2 3 ASN HB2 H 11.055 5.232 -8.944 1.00 . B B . 24 ASN HB2 1 1 17 12646 2 2 3 ASN HB3 H 11.407 6.943 -8.732 1.00 . B B . 24 ASN HB3 1 1 17 12647 2 2 3 ASN HD21 H 12.464 7.279 -6.307 1.00 . B B . 24 ASN HD21 1 1 17 12648 2 2 3 ASN HD22 H 13.780 6.248 -6.012 1.00 . B B . 24 ASN HD22 1 1 17 12649 2 2 3 ASN N N 9.806 4.844 -6.516 1.00 . B B . 24 ASN N 1 1 17 12650 2 2 3 ASN ND2 N 12.964 6.461 -6.510 1.00 . B B . 24 ASN ND2 1 1 17 12651 2 2 3 ASN O O 8.885 7.159 -9.055 1.00 . B B . 24 ASN O 1 1 17 12652 2 2 3 ASN OD1 O 13.162 4.640 -7.699 1.00 . B B . 24 ASN OD1 1 1 17 12653 2 2 4 GLN C C 5.353 6.485 -6.985 1.00 . B B . 25 GLN C 1 1 17 12654 2 2 4 GLN CA C 6.394 6.574 -8.088 1.00 . B B . 25 GLN CA 1 1 17 12655 2 2 4 GLN CB C 6.056 5.584 -9.202 1.00 . B B . 25 GLN CB 1 1 17 12656 2 2 4 GLN CD C 4.650 7.403 -10.178 1.00 . B B . 25 GLN CD 1 1 17 12657 2 2 4 GLN CG C 4.686 5.924 -9.792 1.00 . B B . 25 GLN CG 1 1 17 12658 2 2 4 GLN H H 7.701 5.737 -6.605 1.00 . B B . 25 GLN H 1 1 17 12659 2 2 4 GLN HA H 6.434 7.581 -8.479 1.00 . B B . 25 GLN HA 1 1 17 12660 2 2 4 GLN HB2 H 6.806 5.645 -9.976 1.00 . B B . 25 GLN HB2 1 1 17 12661 2 2 4 GLN HB3 H 6.034 4.583 -8.800 1.00 . B B . 25 GLN HB3 1 1 17 12662 2 2 4 GLN HE21 H 5.339 7.088 -12.014 1.00 . B B . 25 GLN HE21 1 1 17 12663 2 2 4 GLN HE22 H 5.014 8.710 -11.630 1.00 . B B . 25 GLN HE22 1 1 17 12664 2 2 4 GLN HG2 H 4.512 5.317 -10.670 1.00 . B B . 25 GLN HG2 1 1 17 12665 2 2 4 GLN HG3 H 3.919 5.725 -9.058 1.00 . B B . 25 GLN HG3 1 1 17 12666 2 2 4 GLN N N 7.697 6.218 -7.461 1.00 . B B . 25 GLN N 1 1 17 12667 2 2 4 GLN NE2 N 5.032 7.764 -11.373 1.00 . B B . 25 GLN NE2 1 1 17 12668 2 2 4 GLN O O 5.602 5.874 -5.967 1.00 . B B . 25 GLN O 1 1 17 12669 2 2 4 GLN OE1 O 4.270 8.241 -9.384 1.00 . B B . 25 GLN OE1 1 1 17 12670 2 2 5 HIS C C 1.869 6.469 -6.383 1.00 . B B . 26 HIS C 1 1 17 12671 2 2 5 HIS CA C 3.251 6.980 -5.996 1.00 . B B . 26 HIS CA 1 1 17 12672 2 2 5 HIS CB C 3.082 8.315 -5.293 1.00 . B B . 26 HIS CB 1 1 17 12673 2 2 5 HIS CD2 C 1.738 8.485 -3.062 1.00 . B B . 26 HIS CD2 1 1 17 12674 2 2 5 HIS CE1 C 2.735 6.846 -2.044 1.00 . B B . 26 HIS CE1 1 1 17 12675 2 2 5 HIS CG C 2.698 7.987 -3.891 1.00 . B B . 26 HIS CG 1 1 17 12676 2 2 5 HIS H H 4.000 7.600 -7.929 1.00 . B B . 26 HIS H 1 1 17 12677 2 2 5 HIS HA H 3.667 6.287 -5.282 1.00 . B B . 26 HIS HA 1 1 17 12678 2 2 5 HIS HB2 H 4.012 8.867 -5.310 1.00 . B B . 26 HIS HB2 1 1 17 12679 2 2 5 HIS HB3 H 2.298 8.887 -5.762 1.00 . B B . 26 HIS HB3 1 1 17 12680 2 2 5 HIS HD2 H 1.077 9.309 -3.285 1.00 . B B . 26 HIS HD2 1 1 17 12681 2 2 5 HIS HE1 H 3.043 6.145 -1.285 1.00 . B B . 26 HIS HE1 1 1 17 12682 2 2 5 HIS HE2 H 1.157 7.846 -1.132 1.00 . B B . 26 HIS HE2 1 1 17 12683 2 2 5 HIS N N 4.207 7.085 -7.126 1.00 . B B . 26 HIS N 1 1 17 12684 2 2 5 HIS ND1 N 3.317 6.954 -3.235 1.00 . B B . 26 HIS ND1 1 1 17 12685 2 2 5 HIS NE2 N 1.756 7.756 -1.891 1.00 . B B . 26 HIS NE2 1 1 17 12686 2 2 5 HIS O O 1.457 6.467 -7.526 1.00 . B B . 26 HIS O 1 1 17 12687 2 2 6 LEU C C -1.256 6.555 -5.184 1.00 . B B . 27 LEU C 1 1 17 12688 2 2 6 LEU CA C -0.204 5.480 -5.508 1.00 . B B . 27 LEU CA 1 1 17 12689 2 2 6 LEU CB C -0.325 4.308 -4.513 1.00 . B B . 27 LEU CB 1 1 17 12690 2 2 6 LEU CD1 C -0.372 3.743 -2.062 1.00 . B B . 27 LEU CD1 1 1 17 12691 2 2 6 LEU CD2 C -0.244 6.121 -2.687 1.00 . B B . 27 LEU CD2 1 1 17 12692 2 2 6 LEU CG C -0.816 4.761 -3.108 1.00 . B B . 27 LEU CG 1 1 17 12693 2 2 6 LEU H H 1.579 6.054 -4.481 1.00 . B B . 27 LEU H 1 1 17 12694 2 2 6 LEU HA H -0.351 5.117 -6.510 1.00 . B B . 27 LEU HA 1 1 17 12695 2 2 6 LEU HB2 H -1.021 3.586 -4.908 1.00 . B B . 27 LEU HB2 1 1 17 12696 2 2 6 LEU HB3 H 0.643 3.839 -4.409 1.00 . B B . 27 LEU HB3 1 1 17 12697 2 2 6 LEU HD11 H 0.485 4.128 -1.529 1.00 . B B . 27 LEU HD11 1 1 17 12698 2 2 6 LEU HD12 H -0.109 2.820 -2.547 1.00 . B B . 27 LEU HD12 1 1 17 12699 2 2 6 LEU HD13 H -1.178 3.569 -1.364 1.00 . B B . 27 LEU HD13 1 1 17 12700 2 2 6 LEU HD21 H -1.052 6.758 -2.363 1.00 . B B . 27 LEU HD21 1 1 17 12701 2 2 6 LEU HD22 H 0.264 6.583 -3.507 1.00 . B B . 27 LEU HD22 1 1 17 12702 2 2 6 LEU HD23 H 0.446 5.979 -1.871 1.00 . B B . 27 LEU HD23 1 1 17 12703 2 2 6 LEU HG H -1.891 4.812 -3.112 1.00 . B B . 27 LEU HG 1 1 17 12704 2 2 6 LEU N N 1.171 6.030 -5.369 1.00 . B B . 27 LEU N 1 1 17 12705 2 2 6 LEU O O -0.987 7.735 -5.260 1.00 . B B . 27 LEU O 1 1 17 12706 2 2 7 CYS C C -4.867 6.444 -4.918 1.00 . B B . 28 CYS C 1 1 17 12707 2 2 7 CYS CA C -3.556 7.032 -4.394 1.00 . B B . 28 CYS CA 1 1 17 12708 2 2 7 CYS CB C -3.367 8.455 -4.942 1.00 . B B . 28 CYS CB 1 1 17 12709 2 2 7 CYS H H -2.574 5.149 -4.731 1.00 . B B . 28 CYS H 1 1 17 12710 2 2 7 CYS HA H -3.615 7.062 -3.322 1.00 . B B . 28 CYS HA 1 1 17 12711 2 2 7 CYS HB2 H -2.849 8.407 -5.887 1.00 . B B . 28 CYS HB2 1 1 17 12712 2 2 7 CYS HB3 H -4.338 8.905 -5.095 1.00 . B B . 28 CYS HB3 1 1 17 12713 2 2 7 CYS N N -2.431 6.116 -4.789 1.00 . B B . 28 CYS N 1 1 17 12714 2 2 7 CYS O O -4.913 5.841 -5.972 1.00 . B B . 28 CYS O 1 1 17 12715 2 2 7 CYS SG S -2.406 9.485 -3.776 1.00 . B B . 28 CYS SG 1 1 17 12716 2 2 8 GLY C C -7.027 4.521 -4.872 1.00 . B B . 29 GLY C 1 1 17 12717 2 2 8 GLY CA C -7.229 6.012 -4.616 1.00 . B B . 29 GLY CA 1 1 17 12718 2 2 8 GLY H H -5.870 7.060 -3.316 1.00 . B B . 29 GLY H 1 1 17 12719 2 2 8 GLY HA2 H -7.971 6.153 -3.843 1.00 . B B . 29 GLY HA2 1 1 17 12720 2 2 8 GLY HA3 H -7.554 6.493 -5.526 1.00 . B B . 29 GLY HA3 1 1 17 12721 2 2 8 GLY N N -5.931 6.590 -4.173 1.00 . B B . 29 GLY N 1 1 17 12722 2 2 8 GLY O O -6.430 3.821 -4.074 1.00 . B B . 29 GLY O 1 1 17 12723 2 2 9 SER C C -5.806 2.271 -6.121 1.00 . B B . 30 SER C 1 1 17 12724 2 2 9 SER CA C -7.295 2.579 -6.266 1.00 . B B . 30 SER CA 1 1 17 12725 2 2 9 SER CB C -7.752 2.265 -7.691 1.00 . B B . 30 SER CB 1 1 17 12726 2 2 9 SER H H -7.963 4.595 -6.624 1.00 . B B . 30 SER H 1 1 17 12727 2 2 9 SER HA H -7.858 1.985 -5.558 1.00 . B B . 30 SER HA 1 1 17 12728 2 2 9 SER HB2 H -7.571 3.115 -8.326 1.00 . B B . 30 SER HB2 1 1 17 12729 2 2 9 SER HB3 H -7.198 1.414 -8.067 1.00 . B B . 30 SER HB3 1 1 17 12730 2 2 9 SER HG H -9.383 1.649 -8.556 1.00 . B B . 30 SER HG 1 1 17 12731 2 2 9 SER N N -7.496 4.022 -5.980 1.00 . B B . 30 SER N 1 1 17 12732 2 2 9 SER O O -5.418 1.309 -5.490 1.00 . B B . 30 SER O 1 1 17 12733 2 2 9 SER OG O -9.143 1.975 -7.685 1.00 . B B . 30 SER OG 1 1 17 12734 2 2 10 ASP C C -3.143 2.620 -5.111 1.00 . B B . 31 ASP C 1 1 17 12735 2 2 10 ASP CA C -3.501 2.862 -6.577 1.00 . B B . 31 ASP CA 1 1 17 12736 2 2 10 ASP CB C -2.743 4.084 -7.100 1.00 . B B . 31 ASP CB 1 1 17 12737 2 2 10 ASP CG C -3.009 4.247 -8.599 1.00 . B B . 31 ASP CG 1 1 17 12738 2 2 10 ASP H H -5.302 3.873 -7.185 1.00 . B B . 31 ASP H 1 1 17 12739 2 2 10 ASP HA H -3.227 1.998 -7.156 1.00 . B B . 31 ASP HA 1 1 17 12740 2 2 10 ASP HB2 H -3.074 4.968 -6.575 1.00 . B B . 31 ASP HB2 1 1 17 12741 2 2 10 ASP HB3 H -1.686 3.943 -6.938 1.00 . B B . 31 ASP HB3 1 1 17 12742 2 2 10 ASP N N -4.967 3.095 -6.691 1.00 . B B . 31 ASP N 1 1 17 12743 2 2 10 ASP O O -2.226 1.886 -4.801 1.00 . B B . 31 ASP O 1 1 17 12744 2 2 10 ASP OD1 O -2.412 3.514 -9.370 1.00 . B B . 31 ASP OD1 1 1 17 12745 2 2 10 ASP OD2 O -3.804 5.103 -8.951 1.00 . B B . 31 ASP OD2 1 1 17 12746 2 2 11 LEU C C -3.889 1.564 -2.400 1.00 . B B . 32 LEU C 1 1 17 12747 2 2 11 LEU CA C -3.563 3.006 -2.763 1.00 . B B . 32 LEU CA 1 1 17 12748 2 2 11 LEU CB C -4.392 3.968 -1.902 1.00 . B B . 32 LEU CB 1 1 17 12749 2 2 11 LEU CD1 C -2.869 5.739 -0.993 1.00 . B B . 32 LEU CD1 1 1 17 12750 2 2 11 LEU CD2 C -4.506 4.620 0.511 1.00 . B B . 32 LEU CD2 1 1 17 12751 2 2 11 LEU CG C -3.574 4.417 -0.685 1.00 . B B . 32 LEU CG 1 1 17 12752 2 2 11 LEU H H -4.609 3.802 -4.471 1.00 . B B . 32 LEU H 1 1 17 12753 2 2 11 LEU HA H -2.518 3.173 -2.593 1.00 . B B . 32 LEU HA 1 1 17 12754 2 2 11 LEU HB2 H -4.664 4.833 -2.491 1.00 . B B . 32 LEU HB2 1 1 17 12755 2 2 11 LEU HB3 H -5.288 3.468 -1.565 1.00 . B B . 32 LEU HB3 1 1 17 12756 2 2 11 LEU HD11 H -3.373 6.543 -0.479 1.00 . B B . 32 LEU HD11 1 1 17 12757 2 2 11 LEU HD12 H -2.892 5.921 -2.054 1.00 . B B . 32 LEU HD12 1 1 17 12758 2 2 11 LEU HD13 H -1.843 5.686 -0.658 1.00 . B B . 32 LEU HD13 1 1 17 12759 2 2 11 LEU HD21 H -3.947 5.032 1.339 1.00 . B B . 32 LEU HD21 1 1 17 12760 2 2 11 LEU HD22 H -4.932 3.672 0.802 1.00 . B B . 32 LEU HD22 1 1 17 12761 2 2 11 LEU HD23 H -5.298 5.302 0.238 1.00 . B B . 32 LEU HD23 1 1 17 12762 2 2 11 LEU HG H -2.836 3.664 -0.447 1.00 . B B . 32 LEU HG 1 1 17 12763 2 2 11 LEU N N -3.866 3.220 -4.205 1.00 . B B . 32 LEU N 1 1 17 12764 2 2 11 LEU O O -3.008 0.774 -2.127 1.00 . B B . 32 LEU O 1 1 17 12765 2 2 12 VAL C C -4.679 -1.128 -2.993 1.00 . B B . 33 VAL C 1 1 17 12766 2 2 12 VAL CA C -5.476 -0.210 -2.072 1.00 . B B . 33 VAL CA 1 1 17 12767 2 2 12 VAL CB C -6.969 -0.452 -2.291 1.00 . B B . 33 VAL CB 1 1 17 12768 2 2 12 VAL CG1 C -7.773 0.553 -1.475 1.00 . B B . 33 VAL CG1 1 1 17 12769 2 2 12 VAL CG2 C -7.299 -0.281 -3.775 1.00 . B B . 33 VAL CG2 1 1 17 12770 2 2 12 VAL H H -5.841 1.839 -2.640 1.00 . B B . 33 VAL H 1 1 17 12771 2 2 12 VAL HA H -5.212 -0.411 -1.042 1.00 . B B . 33 VAL HA 1 1 17 12772 2 2 12 VAL HB H -7.220 -1.455 -1.978 1.00 . B B . 33 VAL HB 1 1 17 12773 2 2 12 VAL HG11 H -7.927 0.165 -0.480 1.00 . B B . 33 VAL HG11 1 1 17 12774 2 2 12 VAL HG12 H -8.728 0.719 -1.951 1.00 . B B . 33 VAL HG12 1 1 17 12775 2 2 12 VAL HG13 H -7.231 1.484 -1.419 1.00 . B B . 33 VAL HG13 1 1 17 12776 2 2 12 VAL HG21 H -7.082 0.734 -4.077 1.00 . B B . 33 VAL HG21 1 1 17 12777 2 2 12 VAL HG22 H -8.346 -0.489 -3.938 1.00 . B B . 33 VAL HG22 1 1 17 12778 2 2 12 VAL HG23 H -6.700 -0.965 -4.359 1.00 . B B . 33 VAL HG23 1 1 17 12779 2 2 12 VAL N N -5.137 1.199 -2.407 1.00 . B B . 33 VAL N 1 1 17 12780 2 2 12 VAL O O -4.227 -2.184 -2.599 1.00 . B B . 33 VAL O 1 1 17 12781 2 2 13 GLU C C -2.287 -1.680 -4.693 1.00 . B B . 34 GLU C 1 1 17 12782 2 2 13 GLU CA C -3.732 -1.566 -5.171 1.00 . B B . 34 GLU CA 1 1 17 12783 2 2 13 GLU CB C -3.763 -0.923 -6.559 1.00 . B B . 34 GLU CB 1 1 17 12784 2 2 13 GLU CD C -5.888 -0.624 -7.839 1.00 . B B . 34 GLU CD 1 1 17 12785 2 2 13 GLU CG C -4.810 -1.626 -7.425 1.00 . B B . 34 GLU CG 1 1 17 12786 2 2 13 GLU H H -4.871 0.130 -4.515 1.00 . B B . 34 GLU H 1 1 17 12787 2 2 13 GLU HA H -4.174 -2.549 -5.221 1.00 . B B . 34 GLU HA 1 1 17 12788 2 2 13 GLU HB2 H -4.016 0.123 -6.466 1.00 . B B . 34 GLU HB2 1 1 17 12789 2 2 13 GLU HB3 H -2.795 -1.017 -7.019 1.00 . B B . 34 GLU HB3 1 1 17 12790 2 2 13 GLU HG2 H -4.334 -2.029 -8.306 1.00 . B B . 34 GLU HG2 1 1 17 12791 2 2 13 GLU HG3 H -5.263 -2.428 -6.862 1.00 . B B . 34 GLU HG3 1 1 17 12792 2 2 13 GLU N N -4.501 -0.726 -4.220 1.00 . B B . 34 GLU N 1 1 17 12793 2 2 13 GLU O O -1.755 -2.762 -4.564 1.00 . B B . 34 GLU O 1 1 17 12794 2 2 13 GLU OE1 O -6.791 -0.396 -7.051 1.00 . B B . 34 GLU OE1 1 1 17 12795 2 2 13 GLU OE2 O -5.791 -0.100 -8.937 1.00 . B B . 34 GLU OE2 1 1 17 12796 2 2 14 ALA C C -0.117 -1.693 -2.847 1.00 . B B . 35 ALA C 1 1 17 12797 2 2 14 ALA CA C -0.229 -0.648 -3.957 1.00 . B B . 35 ALA CA 1 1 17 12798 2 2 14 ALA CB C 0.210 0.714 -3.422 1.00 . B B . 35 ALA CB 1 1 17 12799 2 2 14 ALA H H -2.084 0.296 -4.525 1.00 . B B . 35 ALA H 1 1 17 12800 2 2 14 ALA HA H 0.405 -0.933 -4.784 1.00 . B B . 35 ALA HA 1 1 17 12801 2 2 14 ALA HB1 H -0.039 0.786 -2.374 1.00 . B B . 35 ALA HB1 1 1 17 12802 2 2 14 ALA HB2 H -0.297 1.496 -3.968 1.00 . B B . 35 ALA HB2 1 1 17 12803 2 2 14 ALA HB3 H 1.278 0.822 -3.546 1.00 . B B . 35 ALA HB3 1 1 17 12804 2 2 14 ALA N N -1.642 -0.576 -4.423 1.00 . B B . 35 ALA N 1 1 17 12805 2 2 14 ALA O O 0.584 -2.677 -2.976 1.00 . B B . 35 ALA O 1 1 17 12806 2 2 15 LEU C C -1.102 -3.869 -1.232 1.00 . B B . 36 LEU C 1 1 17 12807 2 2 15 LEU CA C -0.730 -2.504 -0.660 1.00 . B B . 36 LEU CA 1 1 17 12808 2 2 15 LEU CB C -1.711 -2.136 0.466 1.00 . B B . 36 LEU CB 1 1 17 12809 2 2 15 LEU CD1 C -0.140 -0.149 0.522 1.00 . B B . 36 LEU CD1 1 1 17 12810 2 2 15 LEU CD2 C -2.598 0.202 0.339 1.00 . B B . 36 LEU CD2 1 1 17 12811 2 2 15 LEU CG C -1.510 -0.683 0.940 1.00 . B B . 36 LEU CG 1 1 17 12812 2 2 15 LEU H H -1.375 -0.707 -1.664 1.00 . B B . 36 LEU H 1 1 17 12813 2 2 15 LEU HA H 0.276 -2.537 -0.271 1.00 . B B . 36 LEU HA 1 1 17 12814 2 2 15 LEU HB2 H -2.722 -2.245 0.101 1.00 . B B . 36 LEU HB2 1 1 17 12815 2 2 15 LEU HB3 H -1.561 -2.805 1.300 1.00 . B B . 36 LEU HB3 1 1 17 12816 2 2 15 LEU HD11 H 0.595 -0.933 0.613 1.00 . B B . 36 LEU HD11 1 1 17 12817 2 2 15 LEU HD12 H 0.132 0.679 1.158 1.00 . B B . 36 LEU HD12 1 1 17 12818 2 2 15 LEU HD13 H -0.185 0.186 -0.505 1.00 . B B . 36 LEU HD13 1 1 17 12819 2 2 15 LEU HD21 H -2.139 1.014 -0.205 1.00 . B B . 36 LEU HD21 1 1 17 12820 2 2 15 LEU HD22 H -3.212 0.602 1.132 1.00 . B B . 36 LEU HD22 1 1 17 12821 2 2 15 LEU HD23 H -3.207 -0.384 -0.331 1.00 . B B . 36 LEU HD23 1 1 17 12822 2 2 15 LEU HG H -1.586 -0.652 2.017 1.00 . B B . 36 LEU HG 1 1 17 12823 2 2 15 LEU N N -0.807 -1.500 -1.756 1.00 . B B . 36 LEU N 1 1 17 12824 2 2 15 LEU O O -0.757 -4.903 -0.692 1.00 . B B . 36 LEU O 1 1 17 12825 2 2 16 TYR C C -1.083 -5.674 -3.853 1.00 . B B . 37 TYR C 1 1 17 12826 2 2 16 TYR CA C -2.212 -5.158 -2.954 1.00 . B B . 37 TYR CA 1 1 17 12827 2 2 16 TYR CB C -3.480 -4.944 -3.786 1.00 . B B . 37 TYR CB 1 1 17 12828 2 2 16 TYR CD1 C -4.440 -7.333 -3.892 1.00 . B B . 37 TYR CD1 1 1 17 12829 2 2 16 TYR CD2 C -3.450 -6.403 -5.913 1.00 . B B . 37 TYR CD2 1 1 17 12830 2 2 16 TYR CE1 C -4.721 -8.517 -4.585 1.00 . B B . 37 TYR CE1 1 1 17 12831 2 2 16 TYR CE2 C -3.738 -7.596 -6.591 1.00 . B B . 37 TYR CE2 1 1 17 12832 2 2 16 TYR CG C -3.800 -6.252 -4.548 1.00 . B B . 37 TYR CG 1 1 17 12833 2 2 16 TYR CZ C -4.372 -8.647 -5.929 1.00 . B B . 37 TYR CZ 1 1 17 12834 2 2 16 TYR H H -2.061 -3.023 -2.743 1.00 . B B . 37 TYR H 1 1 17 12835 2 2 16 TYR HA H -2.412 -5.884 -2.180 1.00 . B B . 37 TYR HA 1 1 17 12836 2 2 16 TYR HB2 H -4.298 -4.668 -3.117 1.00 . B B . 37 TYR HB2 1 1 17 12837 2 2 16 TYR HB3 H -3.318 -4.126 -4.483 1.00 . B B . 37 TYR HB3 1 1 17 12838 2 2 16 TYR HD1 H -4.715 -7.263 -2.859 1.00 . B B . 37 TYR HD1 1 1 17 12839 2 2 16 TYR HD2 H -2.956 -5.615 -6.443 1.00 . B B . 37 TYR HD2 1 1 17 12840 2 2 16 TYR HE1 H -5.208 -9.335 -4.076 1.00 . B B . 37 TYR HE1 1 1 17 12841 2 2 16 TYR HE2 H -3.469 -7.702 -7.632 1.00 . B B . 37 TYR HE2 1 1 17 12842 2 2 16 TYR HH H -3.822 -10.185 -6.915 1.00 . B B . 37 TYR HH 1 1 17 12843 2 2 16 TYR N N -1.804 -3.872 -2.329 1.00 . B B . 37 TYR N 1 1 17 12844 2 2 16 TYR O O -1.097 -6.808 -4.292 1.00 . B B . 37 TYR O 1 1 17 12845 2 2 16 TYR OH O -4.652 -9.817 -6.603 1.00 . B B . 37 TYR OH 1 1 17 12846 2 2 17 LEU C C 2.164 -5.814 -4.058 1.00 . B B . 38 LEU C 1 1 17 12847 2 2 17 LEU CA C 1.041 -5.323 -4.968 1.00 . B B . 38 LEU CA 1 1 17 12848 2 2 17 LEU CB C 1.581 -4.184 -5.845 1.00 . B B . 38 LEU CB 1 1 17 12849 2 2 17 LEU CD1 C 1.139 -1.918 -6.784 1.00 . B B . 38 LEU CD1 1 1 17 12850 2 2 17 LEU CD2 C -0.688 -3.616 -6.725 1.00 . B B . 38 LEU CD2 1 1 17 12851 2 2 17 LEU CG C 0.539 -3.078 -5.990 1.00 . B B . 38 LEU CG 1 1 17 12852 2 2 17 LEU H H -0.094 -3.957 -3.738 1.00 . B B . 38 LEU H 1 1 17 12853 2 2 17 LEU HA H 0.709 -6.133 -5.595 1.00 . B B . 38 LEU HA 1 1 17 12854 2 2 17 LEU HB2 H 2.471 -3.776 -5.389 1.00 . B B . 38 LEU HB2 1 1 17 12855 2 2 17 LEU HB3 H 1.826 -4.572 -6.822 1.00 . B B . 38 LEU HB3 1 1 17 12856 2 2 17 LEU HD11 H 1.710 -1.285 -6.121 1.00 . B B . 38 LEU HD11 1 1 17 12857 2 2 17 LEU HD12 H 0.346 -1.342 -7.238 1.00 . B B . 38 LEU HD12 1 1 17 12858 2 2 17 LEU HD13 H 1.787 -2.307 -7.556 1.00 . B B . 38 LEU HD13 1 1 17 12859 2 2 17 LEU HD21 H -1.253 -4.254 -6.062 1.00 . B B . 38 LEU HD21 1 1 17 12860 2 2 17 LEU HD22 H -0.371 -4.180 -7.588 1.00 . B B . 38 LEU HD22 1 1 17 12861 2 2 17 LEU HD23 H -1.307 -2.789 -7.041 1.00 . B B . 38 LEU HD23 1 1 17 12862 2 2 17 LEU HG H 0.254 -2.733 -5.016 1.00 . B B . 38 LEU HG 1 1 17 12863 2 2 17 LEU N N -0.095 -4.860 -4.115 1.00 . B B . 38 LEU N 1 1 17 12864 2 2 17 LEU O O 2.634 -6.929 -4.175 1.00 . B B . 38 LEU O 1 1 17 12865 2 2 18 VAL C C 3.221 -6.632 -1.436 1.00 . B B . 39 VAL C 1 1 17 12866 2 2 18 VAL CA C 3.676 -5.397 -2.215 1.00 . B B . 39 VAL CA 1 1 17 12867 2 2 18 VAL CB C 3.971 -4.246 -1.245 1.00 . B B . 39 VAL CB 1 1 17 12868 2 2 18 VAL CG1 C 3.948 -2.922 -2.009 1.00 . B B . 39 VAL CG1 1 1 17 12869 2 2 18 VAL CG2 C 2.910 -4.211 -0.139 1.00 . B B . 39 VAL CG2 1 1 17 12870 2 2 18 VAL H H 2.192 -4.096 -3.068 1.00 . B B . 39 VAL H 1 1 17 12871 2 2 18 VAL HA H 4.566 -5.633 -2.779 1.00 . B B . 39 VAL HA 1 1 17 12872 2 2 18 VAL HB H 4.945 -4.388 -0.805 1.00 . B B . 39 VAL HB 1 1 17 12873 2 2 18 VAL HG11 H 4.570 -2.201 -1.499 1.00 . B B . 39 VAL HG11 1 1 17 12874 2 2 18 VAL HG12 H 2.934 -2.551 -2.059 1.00 . B B . 39 VAL HG12 1 1 17 12875 2 2 18 VAL HG13 H 4.324 -3.077 -3.010 1.00 . B B . 39 VAL HG13 1 1 17 12876 2 2 18 VAL HG21 H 2.009 -4.694 -0.488 1.00 . B B . 39 VAL HG21 1 1 17 12877 2 2 18 VAL HG22 H 2.693 -3.186 0.121 1.00 . B B . 39 VAL HG22 1 1 17 12878 2 2 18 VAL HG23 H 3.282 -4.732 0.732 1.00 . B B . 39 VAL HG23 1 1 17 12879 2 2 18 VAL N N 2.590 -4.987 -3.144 1.00 . B B . 39 VAL N 1 1 17 12880 2 2 18 VAL O O 4.020 -7.433 -0.992 1.00 . B B . 39 VAL O 1 1 17 12881 2 2 19 CYS C C 0.418 -8.721 -1.395 1.00 . B B . 40 CYS C 1 1 17 12882 2 2 19 CYS CA C 1.420 -7.963 -0.520 1.00 . B B . 40 CYS CA 1 1 17 12883 2 2 19 CYS CB C 0.728 -7.485 0.757 1.00 . B B . 40 CYS CB 1 1 17 12884 2 2 19 CYS H H 1.312 -6.127 -1.635 1.00 . B B . 40 CYS H 1 1 17 12885 2 2 19 CYS HA H 2.242 -8.613 -0.263 1.00 . B B . 40 CYS HA 1 1 17 12886 2 2 19 CYS HB2 H 0.269 -6.524 0.579 1.00 . B B . 40 CYS HB2 1 1 17 12887 2 2 19 CYS HB3 H -0.029 -8.197 1.047 1.00 . B B . 40 CYS HB3 1 1 17 12888 2 2 19 CYS N N 1.936 -6.787 -1.268 1.00 . B B . 40 CYS N 1 1 17 12889 2 2 19 CYS O O -0.555 -9.265 -0.912 1.00 . B B . 40 CYS O 1 1 17 12890 2 2 19 CYS SG S 1.954 -7.332 2.079 1.00 . B B . 40 CYS SG 1 1 17 12891 2 2 20 GLY C C -0.243 -10.979 -3.300 1.00 . B B . 41 GLY C 1 1 17 12892 2 2 20 GLY CA C -0.291 -9.476 -3.587 1.00 . B B . 41 GLY CA 1 1 17 12893 2 2 20 GLY H H 1.438 -8.308 -3.050 1.00 . B B . 41 GLY H 1 1 17 12894 2 2 20 GLY HA2 H -1.296 -9.108 -3.427 1.00 . B B . 41 GLY HA2 1 1 17 12895 2 2 20 GLY HA3 H -0.004 -9.302 -4.614 1.00 . B B . 41 GLY HA3 1 1 17 12896 2 2 20 GLY N N 0.648 -8.757 -2.680 1.00 . B B . 41 GLY N 1 1 17 12897 2 2 20 GLY O O -1.181 -11.701 -3.572 1.00 . B B . 41 GLY O 1 1 17 12898 2 2 21 GLU C C 0.599 -13.160 -0.984 1.00 . B B . 42 GLU C 1 1 17 12899 2 2 21 GLU CA C 0.941 -12.915 -2.454 1.00 . B B . 42 GLU CA 1 1 17 12900 2 2 21 GLU CB C 2.366 -13.397 -2.736 1.00 . B B . 42 GLU CB 1 1 17 12901 2 2 21 GLU CD C 3.782 -15.444 -2.956 1.00 . B B . 42 GLU CD 1 1 17 12902 2 2 21 GLU CG C 2.489 -14.877 -2.367 1.00 . B B . 42 GLU CG 1 1 17 12903 2 2 21 GLU H H 1.590 -10.861 -2.541 1.00 . B B . 42 GLU H 1 1 17 12904 2 2 21 GLU HA H 0.248 -13.458 -3.077 1.00 . B B . 42 GLU HA 1 1 17 12905 2 2 21 GLU HB2 H 2.587 -13.268 -3.786 1.00 . B B . 42 GLU HB2 1 1 17 12906 2 2 21 GLU HB3 H 3.064 -12.822 -2.147 1.00 . B B . 42 GLU HB3 1 1 17 12907 2 2 21 GLU HG2 H 2.507 -14.979 -1.291 1.00 . B B . 42 GLU HG2 1 1 17 12908 2 2 21 GLU HG3 H 1.646 -15.420 -2.766 1.00 . B B . 42 GLU HG3 1 1 17 12909 2 2 21 GLU N N 0.841 -11.458 -2.754 1.00 . B B . 42 GLU N 1 1 17 12910 2 2 21 GLU O O 0.253 -14.257 -0.589 1.00 . B B . 42 GLU O 1 1 17 12911 2 2 21 GLU OE1 O 4.417 -14.741 -3.725 1.00 . B B . 42 GLU OE1 1 1 17 12912 2 2 21 GLU OE2 O 4.116 -16.570 -2.627 1.00 . B B . 42 GLU OE2 1 1 17 12913 2 2 22 ARG C C -0.743 -11.346 1.665 1.00 . B B . 43 ARG C 1 1 17 12914 2 2 22 ARG CA C 0.374 -12.314 1.273 1.00 . B B . 43 ARG CA 1 1 17 12915 2 2 22 ARG CB C 1.621 -12.017 2.109 1.00 . B B . 43 ARG CB 1 1 17 12916 2 2 22 ARG CD C 1.990 -10.976 4.349 1.00 . B B . 43 ARG CD 1 1 17 12917 2 2 22 ARG CG C 1.269 -12.095 3.596 1.00 . B B . 43 ARG CG 1 1 17 12918 2 2 22 ARG CZ C 4.036 -11.559 5.508 1.00 . B B . 43 ARG CZ 1 1 17 12919 2 2 22 ARG H H 0.973 -11.272 -0.515 1.00 . B B . 43 ARG H 1 1 17 12920 2 2 22 ARG HA H 0.051 -13.328 1.455 1.00 . B B . 43 ARG HA 1 1 17 12921 2 2 22 ARG HB2 H 2.388 -12.743 1.881 1.00 . B B . 43 ARG HB2 1 1 17 12922 2 2 22 ARG HB3 H 1.981 -11.026 1.878 1.00 . B B . 43 ARG HB3 1 1 17 12923 2 2 22 ARG HD2 H 2.686 -10.485 3.684 1.00 . B B . 43 ARG HD2 1 1 17 12924 2 2 22 ARG HD3 H 1.267 -10.257 4.706 1.00 . B B . 43 ARG HD3 1 1 17 12925 2 2 22 ARG HE H 2.238 -11.928 6.265 1.00 . B B . 43 ARG HE 1 1 17 12926 2 2 22 ARG HG2 H 0.201 -11.984 3.719 1.00 . B B . 43 ARG HG2 1 1 17 12927 2 2 22 ARG HG3 H 1.580 -13.050 3.990 1.00 . B B . 43 ARG HG3 1 1 17 12928 2 2 22 ARG HH11 H 4.201 -9.631 4.994 1.00 . B B . 43 ARG HH11 1 1 17 12929 2 2 22 ARG HH12 H 5.696 -10.476 5.224 1.00 . B B . 43 ARG HH12 1 1 17 12930 2 2 22 ARG HH21 H 4.177 -13.490 6.016 1.00 . B B . 43 ARG HH21 1 1 17 12931 2 2 22 ARG HH22 H 5.682 -12.661 5.799 1.00 . B B . 43 ARG HH22 1 1 17 12932 2 2 22 ARG N N 0.693 -12.146 -0.173 1.00 . B B . 43 ARG N 1 1 17 12933 2 2 22 ARG NE N 2.731 -11.552 5.506 1.00 . B B . 43 ARG NE 1 1 17 12934 2 2 22 ARG NH1 N 4.696 -10.471 5.219 1.00 . B B . 43 ARG NH1 1 1 17 12935 2 2 22 ARG NH2 N 4.682 -12.655 5.797 1.00 . B B . 43 ARG NH2 1 1 17 12936 2 2 22 ARG O O -0.593 -10.144 1.583 1.00 . B B . 43 ARG O 1 1 17 12937 2 2 23 GLY C C -2.584 -10.155 3.720 1.00 . B B . 44 GLY C 1 1 17 12938 2 2 23 GLY CA C -2.989 -10.968 2.488 1.00 . B B . 44 GLY CA 1 1 17 12939 2 2 23 GLY H H -1.965 -12.833 2.150 1.00 . B B . 44 GLY H 1 1 17 12940 2 2 23 GLY HA2 H -3.222 -10.297 1.673 1.00 . B B . 44 GLY HA2 1 1 17 12941 2 2 23 GLY HA3 H -3.857 -11.565 2.724 1.00 . B B . 44 GLY HA3 1 1 17 12942 2 2 23 GLY N N -1.864 -11.861 2.091 1.00 . B B . 44 GLY N 1 1 17 12943 2 2 23 GLY O O -1.537 -10.366 4.298 1.00 . B B . 44 GLY O 1 1 17 12944 2 2 24 GLY C C -4.307 -7.660 5.806 1.00 . B B . 45 GLY C 1 1 17 12945 2 2 24 GLY CA C -3.063 -8.405 5.322 1.00 . B B . 45 GLY CA 1 1 17 12946 2 2 24 GLY H H -4.246 -9.072 3.649 1.00 . B B . 45 GLY H 1 1 17 12947 2 2 24 GLY HA2 H -2.698 -9.050 6.109 1.00 . B B . 45 GLY HA2 1 1 17 12948 2 2 24 GLY HA3 H -2.298 -7.691 5.059 1.00 . B B . 45 GLY HA3 1 1 17 12949 2 2 24 GLY N N -3.405 -9.228 4.127 1.00 . B B . 45 GLY N 1 1 17 12950 2 2 24 GLY O O -5.330 -8.253 6.081 1.00 . B B . 45 GLY O 1 1 17 12951 2 2 25 PHE C C -6.351 -5.328 5.202 1.00 . B B . 46 PHE C 1 1 17 12952 2 2 25 PHE CA C -5.406 -5.578 6.380 1.00 . B B . 46 PHE CA 1 1 17 12953 2 2 25 PHE CB C -4.934 -4.238 6.954 1.00 . B B . 46 PHE CB 1 1 17 12954 2 2 25 PHE CD1 C -6.920 -2.615 6.521 1.00 . B B . 46 PHE CD1 1 1 17 12955 2 2 25 PHE CD2 C -6.622 -3.483 8.780 1.00 . B B . 46 PHE CD2 1 1 17 12956 2 2 25 PHE CE1 C -8.040 -1.897 6.958 1.00 . B B . 46 PHE CE1 1 1 17 12957 2 2 25 PHE CE2 C -7.745 -2.755 9.194 1.00 . B B . 46 PHE CE2 1 1 17 12958 2 2 25 PHE CG C -6.181 -3.426 7.429 1.00 . B B . 46 PHE CG 1 1 17 12959 2 2 25 PHE CZ C -8.449 -1.965 8.287 1.00 . B B . 46 PHE CZ 1 1 17 12960 2 2 25 PHE H H -3.392 -5.901 5.687 1.00 . B B . 46 PHE H 1 1 17 12961 2 2 25 PHE HA H -5.926 -6.134 7.147 1.00 . B B . 46 PHE HA 1 1 17 12962 2 2 25 PHE HB2 H -4.245 -4.439 7.790 1.00 . B B . 46 PHE HB2 1 1 17 12963 2 2 25 PHE HB3 H -4.388 -3.693 6.171 1.00 . B B . 46 PHE HB3 1 1 17 12964 2 2 25 PHE HD1 H -6.643 -2.546 5.492 1.00 . B B . 46 PHE HD1 1 1 17 12965 2 2 25 PHE HD2 H -6.112 -4.082 9.502 1.00 . B B . 46 PHE HD2 1 1 17 12966 2 2 25 PHE HE1 H -8.589 -1.284 6.259 1.00 . B B . 46 PHE HE1 1 1 17 12967 2 2 25 PHE HE2 H -8.068 -2.808 10.222 1.00 . B B . 46 PHE HE2 1 1 17 12968 2 2 25 PHE HZ H -9.313 -1.407 8.616 1.00 . B B . 46 PHE HZ 1 1 17 12969 2 2 25 PHE N N -4.227 -6.361 5.913 1.00 . B B . 46 PHE N 1 1 17 12970 2 2 25 PHE O O -7.507 -5.702 5.231 1.00 . B B . 46 PHE O 1 1 17 12971 2 2 26 TYR C C -7.557 -5.682 2.657 1.00 . B B . 47 TYR C 1 1 17 12972 2 2 26 TYR CA C -6.738 -4.430 2.984 1.00 . B B . 47 TYR CA 1 1 17 12973 2 2 26 TYR CB C -5.864 -4.047 1.785 1.00 . B B . 47 TYR CB 1 1 17 12974 2 2 26 TYR CD1 C -8.063 -3.212 0.677 1.00 . B B . 47 TYR CD1 1 1 17 12975 2 2 26 TYR CD2 C -6.376 -4.233 -0.755 1.00 . B B . 47 TYR CD2 1 1 17 12976 2 2 26 TYR CE1 C -8.882 -3.022 -0.443 1.00 . B B . 47 TYR CE1 1 1 17 12977 2 2 26 TYR CE2 C -7.212 -4.033 -1.861 1.00 . B B . 47 TYR CE2 1 1 17 12978 2 2 26 TYR CG C -6.782 -3.826 0.542 1.00 . B B . 47 TYR CG 1 1 17 12979 2 2 26 TYR CZ C -8.458 -3.429 -1.706 1.00 . B B . 47 TYR CZ 1 1 17 12980 2 2 26 TYR H H -4.932 -4.409 4.160 1.00 . B B . 47 TYR H 1 1 17 12981 2 2 26 TYR HA H -7.407 -3.619 3.211 1.00 . B B . 47 TYR HA 1 1 17 12982 2 2 26 TYR HB2 H -5.306 -3.129 2.038 1.00 . B B . 47 TYR HB2 1 1 17 12983 2 2 26 TYR HB3 H -5.142 -4.855 1.599 1.00 . B B . 47 TYR HB3 1 1 17 12984 2 2 26 TYR HD1 H -8.427 -2.887 1.633 1.00 . B B . 47 TYR HD1 1 1 17 12985 2 2 26 TYR HD2 H -5.433 -4.702 -0.911 1.00 . B B . 47 TYR HD2 1 1 17 12986 2 2 26 TYR HE1 H -9.849 -2.556 -0.328 1.00 . B B . 47 TYR HE1 1 1 17 12987 2 2 26 TYR HE2 H -6.887 -4.348 -2.842 1.00 . B B . 47 TYR HE2 1 1 17 12988 2 2 26 TYR HH H -10.170 -3.105 -2.486 1.00 . B B . 47 TYR HH 1 1 17 12989 2 2 26 TYR N N -5.868 -4.701 4.164 1.00 . B B . 47 TYR N 1 1 17 12990 2 2 26 TYR O O -8.695 -5.802 3.054 1.00 . B B . 47 TYR O 1 1 17 12991 2 2 26 TYR OH O -9.273 -3.235 -2.802 1.00 . B B . 47 TYR OH 1 1 17 12992 2 2 27 THR C C -8.637 -7.625 0.378 1.00 . B B . 48 THR C 1 1 17 12993 2 2 27 THR CA C -7.668 -7.872 1.539 1.00 . B B . 48 THR CA 1 1 17 12994 2 2 27 THR CB C -8.433 -8.468 2.731 1.00 . B B . 48 THR CB 1 1 17 12995 2 2 27 THR CG2 C -9.372 -9.563 2.227 1.00 . B B . 48 THR CG2 1 1 17 12996 2 2 27 THR H H -6.061 -6.444 1.625 1.00 . B B . 48 THR H 1 1 17 12997 2 2 27 THR HA H -6.921 -8.584 1.216 1.00 . B B . 48 THR HA 1 1 17 12998 2 2 27 THR HB H -9.013 -7.709 3.219 1.00 . B B . 48 THR HB 1 1 17 12999 2 2 27 THR HG1 H -6.795 -8.393 3.777 1.00 . B B . 48 THR HG1 1 1 17 13000 2 2 27 THR HG21 H -8.884 -10.120 1.441 1.00 . B B . 48 THR HG21 1 1 17 13001 2 2 27 THR HG22 H -10.274 -9.111 1.841 1.00 . B B . 48 THR HG22 1 1 17 13002 2 2 27 THR HG23 H -9.620 -10.227 3.040 1.00 . B B . 48 THR HG23 1 1 17 13003 2 2 27 THR N N -6.973 -6.598 1.928 1.00 . B B . 48 THR N 1 1 17 13004 2 2 27 THR O O -9.099 -8.549 -0.262 1.00 . B B . 48 THR O 1 1 17 13005 2 2 27 THR OG1 O -7.508 -9.025 3.654 1.00 . B B . 48 THR OG1 1 1 17 13006 2 2 28 LYS C C -11.210 -6.827 -0.778 1.00 . B B . 49 LYS C 1 1 17 13007 2 2 28 LYS CA C -9.884 -6.102 -1.023 1.00 . B B . 49 LYS CA 1 1 17 13008 2 2 28 LYS CB C -9.271 -6.594 -2.336 1.00 . B B . 49 LYS CB 1 1 17 13009 2 2 28 LYS CD C -9.729 -6.870 -4.778 1.00 . B B . 49 LYS CD 1 1 17 13010 2 2 28 LYS CE C -10.968 -7.114 -5.643 1.00 . B B . 49 LYS CE 1 1 17 13011 2 2 28 LYS CG C -10.130 -6.117 -3.509 1.00 . B B . 49 LYS CG 1 1 17 13012 2 2 28 LYS H H -8.568 -5.669 0.624 1.00 . B B . 49 LYS H 1 1 17 13013 2 2 28 LYS HA H -10.055 -5.039 -1.083 1.00 . B B . 49 LYS HA 1 1 17 13014 2 2 28 LYS HB2 H -8.271 -6.198 -2.437 1.00 . B B . 49 LYS HB2 1 1 17 13015 2 2 28 LYS HB3 H -9.234 -7.672 -2.336 1.00 . B B . 49 LYS HB3 1 1 17 13016 2 2 28 LYS HD2 H -9.011 -6.282 -5.332 1.00 . B B . 49 LYS HD2 1 1 17 13017 2 2 28 LYS HD3 H -9.288 -7.818 -4.509 1.00 . B B . 49 LYS HD3 1 1 17 13018 2 2 28 LYS HE2 H -10.804 -7.975 -6.273 1.00 . B B . 49 LYS HE2 1 1 17 13019 2 2 28 LYS HE3 H -11.822 -7.291 -5.006 1.00 . B B . 49 LYS HE3 1 1 17 13020 2 2 28 LYS HG2 H -11.171 -6.304 -3.292 1.00 . B B . 49 LYS HG2 1 1 17 13021 2 2 28 LYS HG3 H -9.978 -5.059 -3.659 1.00 . B B . 49 LYS HG3 1 1 17 13022 2 2 28 LYS HZ1 H -10.654 -5.980 -7.362 1.00 . B B . 49 LYS HZ1 1 1 17 13023 2 2 28 LYS HZ2 H -10.968 -5.057 -5.971 1.00 . B B . 49 LYS HZ2 1 1 17 13024 2 2 28 LYS HZ3 H -12.232 -5.884 -6.749 1.00 . B B . 49 LYS HZ3 1 1 17 13025 2 2 28 LYS N N -8.948 -6.395 0.099 1.00 . B B . 49 LYS N 1 1 17 13026 2 2 28 LYS NZ N -11.225 -5.918 -6.495 1.00 . B B . 49 LYS NZ 1 1 17 13027 2 2 28 LYS O O -11.342 -7.993 -1.092 1.00 . B B . 49 LYS O 1 1 17 13028 2 2 29 PRO C C -14.314 -6.791 -1.199 1.00 . B B . 50 PRO C 1 1 17 13029 2 2 29 PRO CA C -13.484 -6.664 0.082 1.00 . B B . 50 PRO CA 1 1 17 13030 2 2 29 PRO CB C -14.095 -5.636 1.037 1.00 . B B . 50 PRO CB 1 1 17 13031 2 2 29 PRO CD C -11.989 -4.698 0.157 1.00 . B B . 50 PRO CD 1 1 17 13032 2 2 29 PRO CG C -13.339 -4.312 0.788 1.00 . B B . 50 PRO CG 1 1 17 13033 2 2 29 PRO HA H -13.393 -7.614 0.575 1.00 . B B . 50 PRO HA 1 1 17 13034 2 2 29 PRO HB2 H -15.148 -5.514 0.825 1.00 . B B . 50 PRO HB2 1 1 17 13035 2 2 29 PRO HB3 H -13.953 -5.949 2.059 1.00 . B B . 50 PRO HB3 1 1 17 13036 2 2 29 PRO HD2 H -11.793 -4.094 -0.716 1.00 . B B . 50 PRO HD2 1 1 17 13037 2 2 29 PRO HD3 H -11.193 -4.599 0.878 1.00 . B B . 50 PRO HD3 1 1 17 13038 2 2 29 PRO HG2 H -13.905 -3.686 0.110 1.00 . B B . 50 PRO HG2 1 1 17 13039 2 2 29 PRO HG3 H -13.173 -3.797 1.720 1.00 . B B . 50 PRO HG3 1 1 17 13040 2 2 29 PRO N N -12.156 -6.114 -0.220 1.00 . B B . 50 PRO N 1 1 17 13041 2 2 29 PRO O O -13.914 -6.343 -2.254 1.00 . B B . 50 PRO O 1 1 17 13042 2 2 30 THR C C -17.294 -6.386 -2.422 1.00 . B B . 51 THR C 1 1 17 13043 2 2 30 THR CA C -16.314 -7.557 -2.330 1.00 . B B . 51 THR CA 1 1 17 13044 2 2 30 THR CB C -17.094 -8.872 -2.242 1.00 . B B . 51 THR CB 1 1 17 13045 2 2 30 THR CG2 C -16.272 -9.998 -2.870 1.00 . B B . 51 THR CG2 1 1 17 13046 2 2 30 THR H H -15.769 -7.758 -0.255 1.00 . B B . 51 THR H 1 1 17 13047 2 2 30 THR HA H -15.687 -7.571 -3.208 1.00 . B B . 51 THR HA 1 1 17 13048 2 2 30 THR HB H -18.027 -8.774 -2.777 1.00 . B B . 51 THR HB 1 1 17 13049 2 2 30 THR HG1 H -17.534 -10.118 -0.815 1.00 . B B . 51 THR HG1 1 1 17 13050 2 2 30 THR HG21 H -16.152 -9.810 -3.926 1.00 . B B . 51 THR HG21 1 1 17 13051 2 2 30 THR HG22 H -16.781 -10.939 -2.726 1.00 . B B . 51 THR HG22 1 1 17 13052 2 2 30 THR HG23 H -15.300 -10.039 -2.399 1.00 . B B . 51 THR HG23 1 1 17 13053 2 2 30 THR N N -15.465 -7.402 -1.115 1.00 . B B . 51 THR N 1 1 17 13054 2 2 30 THR O O -18.270 -6.511 -3.142 1.00 . B B . 51 THR O 1 1 17 13055 2 2 30 THR OXT O -17.050 -5.384 -1.771 1.00 . B B . 51 THR OXT 1 1 17 13056 2 2 30 THR OG1 O -17.357 -9.177 -0.880 1.00 . B B . 51 THR OG1 1 1 18 13057 1 1 1 GLY C C -6.652 8.253 1.769 1.00 . A A . 1 GLY C 1 1 18 13058 1 1 1 GLY CA C -8.012 8.837 1.606 1.00 . A A . 1 GLY CA 1 1 18 13059 1 1 1 GLY H1 H -9.076 10.199 2.828 1.00 . A A . 1 GLY H1 1 1 18 13060 1 1 1 GLY H2 H -8.547 10.869 1.359 1.00 . A A . 1 GLY H2 1 1 18 13061 1 1 1 GLY H3 H -7.441 10.603 2.620 1.00 . A A . 1 GLY H3 1 1 18 13062 1 1 1 GLY HA2 H -8.271 8.148 2.247 1.00 . A A . 1 GLY HA2 1 1 18 13063 1 1 1 GLY HA3 H -8.575 8.748 0.587 1.00 . A A . 1 GLY HA3 1 1 18 13064 1 1 1 GLY N N -8.292 10.239 2.146 1.00 . A A . 1 GLY N 1 1 18 13065 1 1 1 GLY O O -5.744 8.899 2.253 1.00 . A A . 1 GLY O 1 1 18 13066 1 1 2 ILE C C -4.203 6.931 0.416 1.00 . A A . 2 ILE C 1 1 18 13067 1 1 2 ILE CA C -5.132 6.389 1.511 1.00 . A A . 2 ILE CA 1 1 18 13068 1 1 2 ILE CB C -5.283 4.859 1.390 1.00 . A A . 2 ILE CB 1 1 18 13069 1 1 2 ILE CD1 C -5.003 2.800 2.827 1.00 . A A . 2 ILE CD1 1 1 18 13070 1 1 2 ILE CG1 C -5.459 4.266 2.799 1.00 . A A . 2 ILE CG1 1 1 18 13071 1 1 2 ILE CG2 C -4.045 4.248 0.716 1.00 . A A . 2 ILE CG2 1 1 18 13072 1 1 2 ILE H H -7.217 6.520 0.984 1.00 . A A . 2 ILE H 1 1 18 13073 1 1 2 ILE HA H -4.720 6.633 2.479 1.00 . A A . 2 ILE HA 1 1 18 13074 1 1 2 ILE HB H -6.157 4.635 0.797 1.00 . A A . 2 ILE HB 1 1 18 13075 1 1 2 ILE HD11 H -5.400 2.282 1.967 1.00 . A A . 2 ILE HD11 1 1 18 13076 1 1 2 ILE HD12 H -5.361 2.328 3.729 1.00 . A A . 2 ILE HD12 1 1 18 13077 1 1 2 ILE HD13 H -3.923 2.759 2.805 1.00 . A A . 2 ILE HD13 1 1 18 13078 1 1 2 ILE HG12 H -4.870 4.837 3.502 1.00 . A A . 2 ILE HG12 1 1 18 13079 1 1 2 ILE HG13 H -6.500 4.319 3.080 1.00 . A A . 2 ILE HG13 1 1 18 13080 1 1 2 ILE HG21 H -3.951 4.640 -0.285 1.00 . A A . 2 ILE HG21 1 1 18 13081 1 1 2 ILE HG22 H -4.153 3.174 0.674 1.00 . A A . 2 ILE HG22 1 1 18 13082 1 1 2 ILE HG23 H -3.164 4.500 1.287 1.00 . A A . 2 ILE HG23 1 1 18 13083 1 1 2 ILE N N -6.472 7.024 1.373 1.00 . A A . 2 ILE N 1 1 18 13084 1 1 2 ILE O O -3.008 7.044 0.604 1.00 . A A . 2 ILE O 1 1 18 13085 1 1 3 VAL C C -3.314 9.145 -1.416 1.00 . A A . 3 VAL C 1 1 18 13086 1 1 3 VAL CA C -3.884 7.791 -1.823 1.00 . A A . 3 VAL CA 1 1 18 13087 1 1 3 VAL CB C -4.713 7.958 -3.100 1.00 . A A . 3 VAL CB 1 1 18 13088 1 1 3 VAL CG1 C -5.522 6.689 -3.363 1.00 . A A . 3 VAL CG1 1 1 18 13089 1 1 3 VAL CG2 C -5.667 9.144 -2.941 1.00 . A A . 3 VAL CG2 1 1 18 13090 1 1 3 VAL H H -5.707 7.162 -0.855 1.00 . A A . 3 VAL H 1 1 18 13091 1 1 3 VAL HA H -3.075 7.105 -2.005 1.00 . A A . 3 VAL HA 1 1 18 13092 1 1 3 VAL HB H -4.050 8.138 -3.934 1.00 . A A . 3 VAL HB 1 1 18 13093 1 1 3 VAL HG11 H -5.807 6.240 -2.425 1.00 . A A . 3 VAL HG11 1 1 18 13094 1 1 3 VAL HG12 H -4.922 5.993 -3.928 1.00 . A A . 3 VAL HG12 1 1 18 13095 1 1 3 VAL HG13 H -6.408 6.942 -3.925 1.00 . A A . 3 VAL HG13 1 1 18 13096 1 1 3 VAL HG21 H -5.151 10.058 -3.196 1.00 . A A . 3 VAL HG21 1 1 18 13097 1 1 3 VAL HG22 H -6.010 9.198 -1.919 1.00 . A A . 3 VAL HG22 1 1 18 13098 1 1 3 VAL HG23 H -6.514 9.015 -3.599 1.00 . A A . 3 VAL HG23 1 1 18 13099 1 1 3 VAL N N -4.742 7.262 -0.723 1.00 . A A . 3 VAL N 1 1 18 13100 1 1 3 VAL O O -2.216 9.508 -1.781 1.00 . A A . 3 VAL O 1 1 18 13101 1 1 4 GLU C C -2.593 11.084 0.930 1.00 . A A . 4 GLU C 1 1 18 13102 1 1 4 GLU CA C -3.581 11.234 -0.229 1.00 . A A . 4 GLU CA 1 1 18 13103 1 1 4 GLU CB C -4.783 12.067 0.214 1.00 . A A . 4 GLU CB 1 1 18 13104 1 1 4 GLU CD C -6.543 13.075 -1.245 1.00 . A A . 4 GLU CD 1 1 18 13105 1 1 4 GLU CG C -5.967 11.764 -0.708 1.00 . A A . 4 GLU CG 1 1 18 13106 1 1 4 GLU H H -4.942 9.573 -0.388 1.00 . A A . 4 GLU H 1 1 18 13107 1 1 4 GLU HA H -3.091 11.725 -1.057 1.00 . A A . 4 GLU HA 1 1 18 13108 1 1 4 GLU HB2 H -5.041 11.815 1.233 1.00 . A A . 4 GLU HB2 1 1 18 13109 1 1 4 GLU HB3 H -4.539 13.116 0.152 1.00 . A A . 4 GLU HB3 1 1 18 13110 1 1 4 GLU HG2 H -5.632 11.151 -1.535 1.00 . A A . 4 GLU HG2 1 1 18 13111 1 1 4 GLU HG3 H -6.729 11.235 -0.156 1.00 . A A . 4 GLU HG3 1 1 18 13112 1 1 4 GLU N N -4.059 9.893 -0.664 1.00 . A A . 4 GLU N 1 1 18 13113 1 1 4 GLU O O -2.144 12.056 1.505 1.00 . A A . 4 GLU O 1 1 18 13114 1 1 4 GLU OE1 O -5.775 13.866 -1.768 1.00 . A A . 4 GLU OE1 1 1 18 13115 1 1 4 GLU OE2 O -7.743 13.265 -1.127 1.00 . A A . 4 GLU OE2 1 1 18 13116 1 1 5 GLN C C 0.084 9.285 1.812 1.00 . A A . 5 GLN C 1 1 18 13117 1 1 5 GLN CA C -1.278 9.670 2.390 1.00 . A A . 5 GLN CA 1 1 18 13118 1 1 5 GLN CB C -1.778 8.549 3.304 1.00 . A A . 5 GLN CB 1 1 18 13119 1 1 5 GLN CD C -1.206 9.281 5.625 1.00 . A A . 5 GLN CD 1 1 18 13120 1 1 5 GLN CG C -0.801 8.365 4.468 1.00 . A A . 5 GLN CG 1 1 18 13121 1 1 5 GLN H H -2.610 9.103 0.798 1.00 . A A . 5 GLN H 1 1 18 13122 1 1 5 GLN HA H -1.183 10.584 2.957 1.00 . A A . 5 GLN HA 1 1 18 13123 1 1 5 GLN HB2 H -2.753 8.808 3.689 1.00 . A A . 5 GLN HB2 1 1 18 13124 1 1 5 GLN HB3 H -1.844 7.629 2.744 1.00 . A A . 5 GLN HB3 1 1 18 13125 1 1 5 GLN HE21 H -3.115 8.740 5.569 1.00 . A A . 5 GLN HE21 1 1 18 13126 1 1 5 GLN HE22 H -2.721 9.887 6.756 1.00 . A A . 5 GLN HE22 1 1 18 13127 1 1 5 GLN HG2 H -0.823 7.336 4.798 1.00 . A A . 5 GLN HG2 1 1 18 13128 1 1 5 GLN HG3 H 0.198 8.618 4.145 1.00 . A A . 5 GLN HG3 1 1 18 13129 1 1 5 GLN N N -2.243 9.875 1.275 1.00 . A A . 5 GLN N 1 1 18 13130 1 1 5 GLN NE2 N -2.451 9.305 6.016 1.00 . A A . 5 GLN NE2 1 1 18 13131 1 1 5 GLN O O 1.113 9.768 2.242 1.00 . A A . 5 GLN O 1 1 18 13132 1 1 5 GLN OE1 O -0.382 9.982 6.179 1.00 . A A . 5 GLN OE1 1 1 18 13133 1 1 6 CYS C C 1.566 8.639 -1.142 1.00 . A A . 6 CYS C 1 1 18 13134 1 1 6 CYS CA C 1.396 7.993 0.238 1.00 . A A . 6 CYS CA 1 1 18 13135 1 1 6 CYS CB C 1.421 6.470 0.108 1.00 . A A . 6 CYS CB 1 1 18 13136 1 1 6 CYS H H -0.740 8.033 0.509 1.00 . A A . 6 CYS H 1 1 18 13137 1 1 6 CYS HA H 2.205 8.307 0.881 1.00 . A A . 6 CYS HA 1 1 18 13138 1 1 6 CYS HB2 H 0.541 6.137 -0.422 1.00 . A A . 6 CYS HB2 1 1 18 13139 1 1 6 CYS HB3 H 2.305 6.167 -0.433 1.00 . A A . 6 CYS HB3 1 1 18 13140 1 1 6 CYS N N 0.100 8.413 0.840 1.00 . A A . 6 CYS N 1 1 18 13141 1 1 6 CYS O O 2.669 8.801 -1.626 1.00 . A A . 6 CYS O 1 1 18 13142 1 1 6 CYS SG S 1.445 5.735 1.762 1.00 . A A . 6 CYS SG 1 1 18 13143 1 1 7 CYS C C 1.080 11.098 -2.953 1.00 . A A . 7 CYS C 1 1 18 13144 1 1 7 CYS CA C 0.620 9.651 -3.124 1.00 . A A . 7 CYS CA 1 1 18 13145 1 1 7 CYS CB C -0.721 9.622 -3.855 1.00 . A A . 7 CYS CB 1 1 18 13146 1 1 7 CYS H H -0.394 8.882 -1.382 1.00 . A A . 7 CYS H 1 1 18 13147 1 1 7 CYS HA H 1.358 9.112 -3.707 1.00 . A A . 7 CYS HA 1 1 18 13148 1 1 7 CYS HB2 H -1.191 8.659 -3.713 1.00 . A A . 7 CYS HB2 1 1 18 13149 1 1 7 CYS HB3 H -1.363 10.398 -3.467 1.00 . A A . 7 CYS HB3 1 1 18 13150 1 1 7 CYS N N 0.491 9.014 -1.782 1.00 . A A . 7 CYS N 1 1 18 13151 1 1 7 CYS O O 1.740 11.652 -3.806 1.00 . A A . 7 CYS O 1 1 18 13152 1 1 7 CYS SG S -0.430 9.903 -5.617 1.00 . A A . 7 CYS SG 1 1 18 13153 1 1 8 THR C C 2.587 13.067 -0.986 1.00 . A A . 8 THR C 1 1 18 13154 1 1 8 THR CA C 1.198 13.114 -1.621 1.00 . A A . 8 THR CA 1 1 18 13155 1 1 8 THR CB C 0.225 13.823 -0.678 1.00 . A A . 8 THR CB 1 1 18 13156 1 1 8 THR CG2 C 0.148 13.060 0.645 1.00 . A A . 8 THR CG2 1 1 18 13157 1 1 8 THR H H 0.229 11.245 -1.163 1.00 . A A . 8 THR H 1 1 18 13158 1 1 8 THR HA H 1.246 13.639 -2.563 1.00 . A A . 8 THR HA 1 1 18 13159 1 1 8 THR HB H -0.755 13.857 -1.128 1.00 . A A . 8 THR HB 1 1 18 13160 1 1 8 THR HG1 H 0.685 15.616 -1.275 1.00 . A A . 8 THR HG1 1 1 18 13161 1 1 8 THR HG21 H -0.454 13.618 1.347 1.00 . A A . 8 THR HG21 1 1 18 13162 1 1 8 THR HG22 H 1.143 12.932 1.044 1.00 . A A . 8 THR HG22 1 1 18 13163 1 1 8 THR HG23 H -0.300 12.092 0.476 1.00 . A A . 8 THR HG23 1 1 18 13164 1 1 8 THR N N 0.752 11.711 -1.848 1.00 . A A . 8 THR N 1 1 18 13165 1 1 8 THR O O 3.424 13.918 -1.216 1.00 . A A . 8 THR O 1 1 18 13166 1 1 8 THR OG1 O 0.683 15.147 -0.438 1.00 . A A . 8 THR OG1 1 1 18 13167 1 1 9 SER C C 4.603 10.446 0.302 1.00 . A A . 9 SER C 1 1 18 13168 1 1 9 SER CA C 4.163 11.904 0.452 1.00 . A A . 9 SER CA 1 1 18 13169 1 1 9 SER CB C 4.053 12.261 1.936 1.00 . A A . 9 SER CB 1 1 18 13170 1 1 9 SER H H 2.140 11.381 -0.048 1.00 . A A . 9 SER H 1 1 18 13171 1 1 9 SER HA H 4.880 12.553 -0.029 1.00 . A A . 9 SER HA 1 1 18 13172 1 1 9 SER HB2 H 4.285 13.304 2.075 1.00 . A A . 9 SER HB2 1 1 18 13173 1 1 9 SER HB3 H 3.044 12.071 2.278 1.00 . A A . 9 SER HB3 1 1 18 13174 1 1 9 SER HG H 5.860 11.783 2.473 1.00 . A A . 9 SER HG 1 1 18 13175 1 1 9 SER N N 2.834 12.056 -0.200 1.00 . A A . 9 SER N 1 1 18 13176 1 1 9 SER O O 3.786 9.548 0.277 1.00 . A A . 9 SER O 1 1 18 13177 1 1 9 SER OG O 4.975 11.474 2.678 1.00 . A A . 9 SER OG 1 1 18 13178 1 1 10 ILE C C 6.342 8.091 1.392 1.00 . A A . 10 ILE C 1 1 18 13179 1 1 10 ILE CA C 6.337 8.787 0.026 1.00 . A A . 10 ILE CA 1 1 18 13180 1 1 10 ILE CB C 7.745 8.779 -0.590 1.00 . A A . 10 ILE CB 1 1 18 13181 1 1 10 ILE CD1 C 7.853 10.362 -2.528 1.00 . A A . 10 ILE CD1 1 1 18 13182 1 1 10 ILE CG1 C 7.627 8.908 -2.111 1.00 . A A . 10 ILE CG1 1 1 18 13183 1 1 10 ILE CG2 C 8.461 7.467 -0.257 1.00 . A A . 10 ILE CG2 1 1 18 13184 1 1 10 ILE H H 6.527 10.929 0.199 1.00 . A A . 10 ILE H 1 1 18 13185 1 1 10 ILE HA H 5.657 8.267 -0.634 1.00 . A A . 10 ILE HA 1 1 18 13186 1 1 10 ILE HB H 8.314 9.610 -0.200 1.00 . A A . 10 ILE HB 1 1 18 13187 1 1 10 ILE HD11 H 7.126 10.995 -2.040 1.00 . A A . 10 ILE HD11 1 1 18 13188 1 1 10 ILE HD12 H 7.745 10.449 -3.599 1.00 . A A . 10 ILE HD12 1 1 18 13189 1 1 10 ILE HD13 H 8.848 10.669 -2.240 1.00 . A A . 10 ILE HD13 1 1 18 13190 1 1 10 ILE HG12 H 8.369 8.280 -2.583 1.00 . A A . 10 ILE HG12 1 1 18 13191 1 1 10 ILE HG13 H 6.642 8.596 -2.423 1.00 . A A . 10 ILE HG13 1 1 18 13192 1 1 10 ILE HG21 H 7.900 6.639 -0.665 1.00 . A A . 10 ILE HG21 1 1 18 13193 1 1 10 ILE HG22 H 8.534 7.359 0.815 1.00 . A A . 10 ILE HG22 1 1 18 13194 1 1 10 ILE HG23 H 9.451 7.479 -0.687 1.00 . A A . 10 ILE HG23 1 1 18 13195 1 1 10 ILE N N 5.877 10.196 0.187 1.00 . A A . 10 ILE N 1 1 18 13196 1 1 10 ILE O O 6.977 8.533 2.328 1.00 . A A . 10 ILE O 1 1 18 13197 1 1 11 CYS C C 6.687 5.213 2.841 1.00 . A A . 11 CYS C 1 1 18 13198 1 1 11 CYS CA C 5.577 6.264 2.801 1.00 . A A . 11 CYS CA 1 1 18 13199 1 1 11 CYS CB C 4.224 5.562 2.930 1.00 . A A . 11 CYS CB 1 1 18 13200 1 1 11 CYS H H 5.124 6.667 0.735 1.00 . A A . 11 CYS H 1 1 18 13201 1 1 11 CYS HA H 5.703 6.955 3.619 1.00 . A A . 11 CYS HA 1 1 18 13202 1 1 11 CYS HB2 H 4.139 4.805 2.165 1.00 . A A . 11 CYS HB2 1 1 18 13203 1 1 11 CYS HB3 H 4.151 5.099 3.903 1.00 . A A . 11 CYS HB3 1 1 18 13204 1 1 11 CYS N N 5.629 7.001 1.506 1.00 . A A . 11 CYS N 1 1 18 13205 1 1 11 CYS O O 7.581 5.203 2.018 1.00 . A A . 11 CYS O 1 1 18 13206 1 1 11 CYS SG S 2.887 6.764 2.735 1.00 . A A . 11 CYS SG 1 1 18 13207 1 1 12 SER C C 6.994 1.891 3.844 1.00 . A A . 12 SER C 1 1 18 13208 1 1 12 SER CA C 7.670 3.263 3.895 1.00 . A A . 12 SER CA 1 1 18 13209 1 1 12 SER CB C 8.423 3.409 5.217 1.00 . A A . 12 SER CB 1 1 18 13210 1 1 12 SER H H 5.894 4.353 4.442 1.00 . A A . 12 SER H 1 1 18 13211 1 1 12 SER HA H 8.362 3.356 3.071 1.00 . A A . 12 SER HA 1 1 18 13212 1 1 12 SER HB2 H 9.326 2.822 5.186 1.00 . A A . 12 SER HB2 1 1 18 13213 1 1 12 SER HB3 H 8.678 4.449 5.372 1.00 . A A . 12 SER HB3 1 1 18 13214 1 1 12 SER HG H 7.759 3.504 7.043 1.00 . A A . 12 SER HG 1 1 18 13215 1 1 12 SER N N 6.629 4.325 3.794 1.00 . A A . 12 SER N 1 1 18 13216 1 1 12 SER O O 5.865 1.733 4.263 1.00 . A A . 12 SER O 1 1 18 13217 1 1 12 SER OG O 7.600 2.946 6.279 1.00 . A A . 12 SER OG 1 1 18 13218 1 1 13 LEU C C 6.357 -0.765 4.585 1.00 . A A . 13 LEU C 1 1 18 13219 1 1 13 LEU CA C 7.062 -0.458 3.263 1.00 . A A . 13 LEU CA 1 1 18 13220 1 1 13 LEU CB C 8.155 -1.499 3.009 1.00 . A A . 13 LEU CB 1 1 18 13221 1 1 13 LEU CD1 C 8.608 -3.373 1.421 1.00 . A A . 13 LEU CD1 1 1 18 13222 1 1 13 LEU CD2 C 7.084 -3.728 3.362 1.00 . A A . 13 LEU CD2 1 1 18 13223 1 1 13 LEU CG C 7.551 -2.720 2.312 1.00 . A A . 13 LEU CG 1 1 18 13224 1 1 13 LEU H H 8.583 1.046 3.003 1.00 . A A . 13 LEU H 1 1 18 13225 1 1 13 LEU HA H 6.342 -0.486 2.458 1.00 . A A . 13 LEU HA 1 1 18 13226 1 1 13 LEU HB2 H 8.922 -1.069 2.382 1.00 . A A . 13 LEU HB2 1 1 18 13227 1 1 13 LEU HB3 H 8.588 -1.803 3.950 1.00 . A A . 13 LEU HB3 1 1 18 13228 1 1 13 LEU HD11 H 8.227 -3.459 0.414 1.00 . A A . 13 LEU HD11 1 1 18 13229 1 1 13 LEU HD12 H 8.844 -4.355 1.803 1.00 . A A . 13 LEU HD12 1 1 18 13230 1 1 13 LEU HD13 H 9.501 -2.765 1.417 1.00 . A A . 13 LEU HD13 1 1 18 13231 1 1 13 LEU HD21 H 7.310 -4.729 3.025 1.00 . A A . 13 LEU HD21 1 1 18 13232 1 1 13 LEU HD22 H 6.019 -3.630 3.508 1.00 . A A . 13 LEU HD22 1 1 18 13233 1 1 13 LEU HD23 H 7.594 -3.539 4.295 1.00 . A A . 13 LEU HD23 1 1 18 13234 1 1 13 LEU HG H 6.710 -2.411 1.707 1.00 . A A . 13 LEU HG 1 1 18 13235 1 1 13 LEU N N 7.673 0.899 3.336 1.00 . A A . 13 LEU N 1 1 18 13236 1 1 13 LEU O O 5.394 -1.505 4.630 1.00 . A A . 13 LEU O 1 1 18 13237 1 1 14 TYR C C 4.754 0.099 6.950 1.00 . A A . 14 TYR C 1 1 18 13238 1 1 14 TYR CA C 6.179 -0.453 6.978 1.00 . A A . 14 TYR CA 1 1 18 13239 1 1 14 TYR CB C 6.975 0.239 8.087 1.00 . A A . 14 TYR CB 1 1 18 13240 1 1 14 TYR CD1 C 7.686 -1.863 9.398 1.00 . A A . 14 TYR CD1 1 1 18 13241 1 1 14 TYR CD2 C 9.421 -0.536 8.323 1.00 . A A . 14 TYR CD2 1 1 18 13242 1 1 14 TYR CE1 C 8.666 -2.747 9.868 1.00 . A A . 14 TYR CE1 1 1 18 13243 1 1 14 TYR CE2 C 10.388 -1.429 8.800 1.00 . A A . 14 TYR CE2 1 1 18 13244 1 1 14 TYR CG C 8.051 -0.738 8.616 1.00 . A A . 14 TYR CG 1 1 18 13245 1 1 14 TYR CZ C 10.011 -2.529 9.571 1.00 . A A . 14 TYR CZ 1 1 18 13246 1 1 14 TYR H H 7.602 0.399 5.603 1.00 . A A . 14 TYR H 1 1 18 13247 1 1 14 TYR HA H 6.149 -1.516 7.164 1.00 . A A . 14 TYR HA 1 1 18 13248 1 1 14 TYR HB2 H 7.433 1.142 7.682 1.00 . A A . 14 TYR HB2 1 1 18 13249 1 1 14 TYR HB3 H 6.295 0.525 8.886 1.00 . A A . 14 TYR HB3 1 1 18 13250 1 1 14 TYR HD1 H 6.659 -2.057 9.637 1.00 . A A . 14 TYR HD1 1 1 18 13251 1 1 14 TYR HD2 H 9.736 0.295 7.728 1.00 . A A . 14 TYR HD2 1 1 18 13252 1 1 14 TYR HE1 H 8.378 -3.601 10.463 1.00 . A A . 14 TYR HE1 1 1 18 13253 1 1 14 TYR HE2 H 11.431 -1.265 8.573 1.00 . A A . 14 TYR HE2 1 1 18 13254 1 1 14 TYR HH H 10.920 -4.208 9.509 1.00 . A A . 14 TYR HH 1 1 18 13255 1 1 14 TYR N N 6.827 -0.198 5.661 1.00 . A A . 14 TYR N 1 1 18 13256 1 1 14 TYR O O 3.799 -0.608 7.204 1.00 . A A . 14 TYR O 1 1 18 13257 1 1 14 TYR OH O 10.969 -3.406 10.036 1.00 . A A . 14 TYR OH 1 1 18 13258 1 1 15 GLN C C 2.376 1.134 5.611 1.00 . A A . 15 GLN C 1 1 18 13259 1 1 15 GLN CA C 3.232 1.944 6.584 1.00 . A A . 15 GLN CA 1 1 18 13260 1 1 15 GLN CB C 3.314 3.397 6.110 1.00 . A A . 15 GLN CB 1 1 18 13261 1 1 15 GLN CD C 4.681 5.289 6.999 1.00 . A A . 15 GLN CD 1 1 18 13262 1 1 15 GLN CG C 3.546 4.313 7.312 1.00 . A A . 15 GLN CG 1 1 18 13263 1 1 15 GLN H H 5.381 1.911 6.427 1.00 . A A . 15 GLN H 1 1 18 13264 1 1 15 GLN HA H 2.789 1.909 7.568 1.00 . A A . 15 GLN HA 1 1 18 13265 1 1 15 GLN HB2 H 4.132 3.503 5.411 1.00 . A A . 15 GLN HB2 1 1 18 13266 1 1 15 GLN HB3 H 2.389 3.669 5.625 1.00 . A A . 15 GLN HB3 1 1 18 13267 1 1 15 GLN HE21 H 3.482 6.637 6.171 1.00 . A A . 15 GLN HE21 1 1 18 13268 1 1 15 GLN HE22 H 5.127 7.053 6.203 1.00 . A A . 15 GLN HE22 1 1 18 13269 1 1 15 GLN HG2 H 2.641 4.866 7.522 1.00 . A A . 15 GLN HG2 1 1 18 13270 1 1 15 GLN HG3 H 3.811 3.718 8.172 1.00 . A A . 15 GLN HG3 1 1 18 13271 1 1 15 GLN N N 4.599 1.356 6.635 1.00 . A A . 15 GLN N 1 1 18 13272 1 1 15 GLN NE2 N 4.407 6.420 6.409 1.00 . A A . 15 GLN NE2 1 1 18 13273 1 1 15 GLN O O 1.225 0.845 5.874 1.00 . A A . 15 GLN O 1 1 18 13274 1 1 15 GLN OE1 O 5.829 5.021 7.296 1.00 . A A . 15 GLN OE1 1 1 18 13275 1 1 16 LEU C C 1.737 -1.363 4.157 1.00 . A A . 16 LEU C 1 1 18 13276 1 1 16 LEU CA C 2.142 -0.042 3.510 1.00 . A A . 16 LEU CA 1 1 18 13277 1 1 16 LEU CB C 2.995 -0.316 2.268 1.00 . A A . 16 LEU CB 1 1 18 13278 1 1 16 LEU CD1 C 4.219 1.858 2.108 1.00 . A A . 16 LEU CD1 1 1 18 13279 1 1 16 LEU CD2 C 3.580 0.630 0.031 1.00 . A A . 16 LEU CD2 1 1 18 13280 1 1 16 LEU CG C 3.153 0.973 1.459 1.00 . A A . 16 LEU CG 1 1 18 13281 1 1 16 LEU H H 3.860 0.992 4.297 1.00 . A A . 16 LEU H 1 1 18 13282 1 1 16 LEU HA H 1.254 0.505 3.228 1.00 . A A . 16 LEU HA 1 1 18 13283 1 1 16 LEU HB2 H 3.968 -0.673 2.572 1.00 . A A . 16 LEU HB2 1 1 18 13284 1 1 16 LEU HB3 H 2.511 -1.064 1.658 1.00 . A A . 16 LEU HB3 1 1 18 13285 1 1 16 LEU HD11 H 5.071 1.253 2.381 1.00 . A A . 16 LEU HD11 1 1 18 13286 1 1 16 LEU HD12 H 3.811 2.325 2.992 1.00 . A A . 16 LEU HD12 1 1 18 13287 1 1 16 LEU HD13 H 4.529 2.621 1.409 1.00 . A A . 16 LEU HD13 1 1 18 13288 1 1 16 LEU HD21 H 2.875 1.057 -0.668 1.00 . A A . 16 LEU HD21 1 1 18 13289 1 1 16 LEU HD22 H 3.602 -0.443 -0.089 1.00 . A A . 16 LEU HD22 1 1 18 13290 1 1 16 LEU HD23 H 4.563 1.034 -0.157 1.00 . A A . 16 LEU HD23 1 1 18 13291 1 1 16 LEU HG H 2.211 1.502 1.438 1.00 . A A . 16 LEU HG 1 1 18 13292 1 1 16 LEU N N 2.928 0.756 4.490 1.00 . A A . 16 LEU N 1 1 18 13293 1 1 16 LEU O O 0.653 -1.865 3.939 1.00 . A A . 16 LEU O 1 1 18 13294 1 1 17 GLU C C 0.946 -3.002 6.419 1.00 . A A . 17 GLU C 1 1 18 13295 1 1 17 GLU CA C 2.243 -3.200 5.637 1.00 . A A . 17 GLU CA 1 1 18 13296 1 1 17 GLU CB C 3.368 -3.596 6.590 1.00 . A A . 17 GLU CB 1 1 18 13297 1 1 17 GLU CD C 5.311 -5.131 6.919 1.00 . A A . 17 GLU CD 1 1 18 13298 1 1 17 GLU CG C 4.238 -4.669 5.933 1.00 . A A . 17 GLU CG 1 1 18 13299 1 1 17 GLU H H 3.457 -1.500 5.142 1.00 . A A . 17 GLU H 1 1 18 13300 1 1 17 GLU HA H 2.105 -3.973 4.895 1.00 . A A . 17 GLU HA 1 1 18 13301 1 1 17 GLU HB2 H 3.972 -2.729 6.814 1.00 . A A . 17 GLU HB2 1 1 18 13302 1 1 17 GLU HB3 H 2.945 -3.985 7.502 1.00 . A A . 17 GLU HB3 1 1 18 13303 1 1 17 GLU HG2 H 3.620 -5.509 5.651 1.00 . A A . 17 GLU HG2 1 1 18 13304 1 1 17 GLU HG3 H 4.712 -4.259 5.054 1.00 . A A . 17 GLU HG3 1 1 18 13305 1 1 17 GLU N N 2.592 -1.924 4.967 1.00 . A A . 17 GLU N 1 1 18 13306 1 1 17 GLU O O 0.161 -3.915 6.584 1.00 . A A . 17 GLU O 1 1 18 13307 1 1 17 GLU OE1 O 5.383 -4.561 7.996 1.00 . A A . 17 GLU OE1 1 1 18 13308 1 1 17 GLU OE2 O 6.042 -6.047 6.582 1.00 . A A . 17 GLU OE2 1 1 18 13309 1 1 18 ASN C C -1.724 -1.606 6.687 1.00 . A A . 18 ASN C 1 1 18 13310 1 1 18 ASN CA C -0.541 -1.544 7.653 1.00 . A A . 18 ASN CA 1 1 18 13311 1 1 18 ASN CB C -0.473 -0.157 8.296 1.00 . A A . 18 ASN CB 1 1 18 13312 1 1 18 ASN CG C -0.906 -0.251 9.762 1.00 . A A . 18 ASN CG 1 1 18 13313 1 1 18 ASN H H 1.354 -1.083 6.741 1.00 . A A . 18 ASN H 1 1 18 13314 1 1 18 ASN HA H -0.662 -2.295 8.420 1.00 . A A . 18 ASN HA 1 1 18 13315 1 1 18 ASN HB2 H 0.539 0.216 8.242 1.00 . A A . 18 ASN HB2 1 1 18 13316 1 1 18 ASN HB3 H -1.134 0.517 7.771 1.00 . A A . 18 ASN HB3 1 1 18 13317 1 1 18 ASN HD21 H 0.948 -0.447 10.446 1.00 . A A . 18 ASN HD21 1 1 18 13318 1 1 18 ASN HD22 H -0.268 -0.462 11.630 1.00 . A A . 18 ASN HD22 1 1 18 13319 1 1 18 ASN N N 0.711 -1.808 6.893 1.00 . A A . 18 ASN N 1 1 18 13320 1 1 18 ASN ND2 N 0.000 -0.398 10.690 1.00 . A A . 18 ASN ND2 1 1 18 13321 1 1 18 ASN O O -2.818 -1.988 7.053 1.00 . A A . 18 ASN O 1 1 18 13322 1 1 18 ASN OD1 O -2.081 -0.189 10.065 1.00 . A A . 18 ASN OD1 1 1 18 13323 1 1 19 TYR C C -3.208 -2.708 4.452 1.00 . A A . 19 TYR C 1 1 18 13324 1 1 19 TYR CA C -2.621 -1.294 4.458 1.00 . A A . 19 TYR CA 1 1 18 13325 1 1 19 TYR CB C -2.078 -0.972 3.063 1.00 . A A . 19 TYR CB 1 1 18 13326 1 1 19 TYR CD1 C -1.274 1.307 4.040 1.00 . A A . 19 TYR CD1 1 1 18 13327 1 1 19 TYR CD2 C -2.064 1.255 1.736 1.00 . A A . 19 TYR CD2 1 1 18 13328 1 1 19 TYR CE1 C -1.027 2.679 3.911 1.00 . A A . 19 TYR CE1 1 1 18 13329 1 1 19 TYR CE2 C -1.807 2.627 1.629 1.00 . A A . 19 TYR CE2 1 1 18 13330 1 1 19 TYR CG C -1.803 0.561 2.945 1.00 . A A . 19 TYR CG 1 1 18 13331 1 1 19 TYR CZ C -1.290 3.335 2.711 1.00 . A A . 19 TYR CZ 1 1 18 13332 1 1 19 TYR H H -0.617 -0.946 5.170 1.00 . A A . 19 TYR H 1 1 18 13333 1 1 19 TYR HA H -3.387 -0.581 4.727 1.00 . A A . 19 TYR HA 1 1 18 13334 1 1 19 TYR HB2 H -1.155 -1.549 2.914 1.00 . A A . 19 TYR HB2 1 1 18 13335 1 1 19 TYR HB3 H -2.816 -1.292 2.314 1.00 . A A . 19 TYR HB3 1 1 18 13336 1 1 19 TYR HD1 H -1.065 0.844 4.983 1.00 . A A . 19 TYR HD1 1 1 18 13337 1 1 19 TYR HD2 H -2.465 0.749 0.891 1.00 . A A . 19 TYR HD2 1 1 18 13338 1 1 19 TYR HE1 H -0.626 3.232 4.747 1.00 . A A . 19 TYR HE1 1 1 18 13339 1 1 19 TYR HE2 H -2.007 3.137 0.700 1.00 . A A . 19 TYR HE2 1 1 18 13340 1 1 19 TYR HH H -1.817 5.159 2.910 1.00 . A A . 19 TYR HH 1 1 18 13341 1 1 19 TYR N N -1.511 -1.243 5.449 1.00 . A A . 19 TYR N 1 1 18 13342 1 1 19 TYR O O -4.407 -2.897 4.402 1.00 . A A . 19 TYR O 1 1 18 13343 1 1 19 TYR OH O -1.042 4.688 2.595 1.00 . A A . 19 TYR OH 1 1 18 13344 1 1 20 CYS C C -3.313 -5.485 5.916 1.00 . A A . 20 CYS C 1 1 18 13345 1 1 20 CYS CA C -2.853 -5.109 4.507 1.00 . A A . 20 CYS CA 1 1 18 13346 1 1 20 CYS CB C -1.723 -6.042 4.078 1.00 . A A . 20 CYS CB 1 1 18 13347 1 1 20 CYS H H -1.400 -3.522 4.549 1.00 . A A . 20 CYS H 1 1 18 13348 1 1 20 CYS HA H -3.676 -5.206 3.816 1.00 . A A . 20 CYS HA 1 1 18 13349 1 1 20 CYS HB2 H -0.773 -5.547 4.216 1.00 . A A . 20 CYS HB2 1 1 18 13350 1 1 20 CYS HB3 H -1.750 -6.942 4.675 1.00 . A A . 20 CYS HB3 1 1 18 13351 1 1 20 CYS N N -2.362 -3.703 4.506 1.00 . A A . 20 CYS N 1 1 18 13352 1 1 20 CYS O O -2.914 -6.494 6.463 1.00 . A A . 20 CYS O 1 1 18 13353 1 1 20 CYS SG S -1.938 -6.466 2.335 1.00 . A A . 20 CYS SG 1 1 18 13354 1 1 21 ASN C C -5.317 -6.346 7.899 1.00 . A A . 21 ASN C 1 1 18 13355 1 1 21 ASN CA C -4.626 -4.982 7.888 1.00 . A A . 21 ASN CA 1 1 18 13356 1 1 21 ASN CB C -5.617 -3.907 8.336 1.00 . A A . 21 ASN CB 1 1 18 13357 1 1 21 ASN CG C -5.409 -3.611 9.822 1.00 . A A . 21 ASN CG 1 1 18 13358 1 1 21 ASN H H -4.450 -3.866 6.054 1.00 . A A . 21 ASN H 1 1 18 13359 1 1 21 ASN HA H -3.785 -5.001 8.566 1.00 . A A . 21 ASN HA 1 1 18 13360 1 1 21 ASN HB2 H -5.456 -3.006 7.762 1.00 . A A . 21 ASN HB2 1 1 18 13361 1 1 21 ASN HB3 H -6.626 -4.259 8.180 1.00 . A A . 21 ASN HB3 1 1 18 13362 1 1 21 ASN HD21 H -6.088 -5.380 10.413 1.00 . A A . 21 ASN HD21 1 1 18 13363 1 1 21 ASN HD22 H -5.594 -4.339 11.660 1.00 . A A . 21 ASN HD22 1 1 18 13364 1 1 21 ASN N N -4.144 -4.676 6.511 1.00 . A A . 21 ASN N 1 1 18 13365 1 1 21 ASN ND2 N -5.723 -4.519 10.705 1.00 . A A . 21 ASN ND2 1 1 18 13366 1 1 21 ASN O O -5.282 -7.015 6.880 1.00 . A A . 21 ASN O 1 1 18 13367 1 1 21 ASN OXT O -5.871 -6.698 8.928 1.00 . A A . 21 ASN OXT 1 1 18 13368 1 1 21 ASN OD1 O -4.954 -2.544 10.184 1.00 . A A . 21 ASN OD1 1 1 18 13369 2 2 1 PHE C C 9.124 1.372 0.059 1.00 . B B . 22 PHE C 1 1 18 13370 2 2 1 PHE CA C 8.809 -0.077 -0.338 1.00 . B B . 22 PHE CA 1 1 18 13371 2 2 1 PHE CB C 9.974 -0.678 -1.132 1.00 . B B . 22 PHE CB 1 1 18 13372 2 2 1 PHE CD1 C 8.747 -2.327 -2.594 1.00 . B B . 22 PHE CD1 1 1 18 13373 2 2 1 PHE CD2 C 10.220 -3.176 -0.862 1.00 . B B . 22 PHE CD2 1 1 18 13374 2 2 1 PHE CE1 C 8.437 -3.639 -2.975 1.00 . B B . 22 PHE CE1 1 1 18 13375 2 2 1 PHE CE2 C 9.909 -4.489 -1.243 1.00 . B B . 22 PHE CE2 1 1 18 13376 2 2 1 PHE CG C 9.638 -2.094 -1.537 1.00 . B B . 22 PHE CG 1 1 18 13377 2 2 1 PHE CZ C 9.018 -4.720 -2.300 1.00 . B B . 22 PHE CZ 1 1 18 13378 2 2 1 PHE H1 H 7.819 0.134 -2.158 1.00 . B B . 22 PHE H1 1 1 18 13379 2 2 1 PHE H2 H 6.894 0.593 -0.808 1.00 . B B . 22 PHE H2 1 1 18 13380 2 2 1 PHE H3 H 7.155 -1.052 -1.144 1.00 . B B . 22 PHE H3 1 1 18 13381 2 2 1 PHE HA H 8.647 -0.660 0.553 1.00 . B B . 22 PHE HA 1 1 18 13382 2 2 1 PHE HB2 H 10.148 -0.087 -2.018 1.00 . B B . 22 PHE HB2 1 1 18 13383 2 2 1 PHE HB3 H 10.864 -0.681 -0.520 1.00 . B B . 22 PHE HB3 1 1 18 13384 2 2 1 PHE HD1 H 8.298 -1.493 -3.115 1.00 . B B . 22 PHE HD1 1 1 18 13385 2 2 1 PHE HD2 H 10.906 -2.999 -0.047 1.00 . B B . 22 PHE HD2 1 1 18 13386 2 2 1 PHE HE1 H 7.750 -3.818 -3.789 1.00 . B B . 22 PHE HE1 1 1 18 13387 2 2 1 PHE HE2 H 10.358 -5.323 -0.723 1.00 . B B . 22 PHE HE2 1 1 18 13388 2 2 1 PHE HZ H 8.779 -5.732 -2.593 1.00 . B B . 22 PHE HZ 1 1 18 13389 2 2 1 PHE N N 7.576 -0.103 -1.175 1.00 . B B . 22 PHE N 1 1 18 13390 2 2 1 PHE O O 8.516 1.919 0.958 1.00 . B B . 22 PHE O 1 1 18 13391 2 2 2 VAL C C 10.917 4.136 -1.493 1.00 . B B . 23 VAL C 1 1 18 13392 2 2 2 VAL CA C 10.394 3.415 -0.249 1.00 . B B . 23 VAL CA 1 1 18 13393 2 2 2 VAL CB C 11.474 3.467 0.844 1.00 . B B . 23 VAL CB 1 1 18 13394 2 2 2 VAL CG1 C 10.915 4.183 2.074 1.00 . B B . 23 VAL CG1 1 1 18 13395 2 2 2 VAL CG2 C 11.912 2.053 1.239 1.00 . B B . 23 VAL CG2 1 1 18 13396 2 2 2 VAL H H 10.539 1.553 -1.321 1.00 . B B . 23 VAL H 1 1 18 13397 2 2 2 VAL HA H 9.504 3.915 0.104 1.00 . B B . 23 VAL HA 1 1 18 13398 2 2 2 VAL HB H 12.327 4.018 0.473 1.00 . B B . 23 VAL HB 1 1 18 13399 2 2 2 VAL HG11 H 10.167 4.898 1.765 1.00 . B B . 23 VAL HG11 1 1 18 13400 2 2 2 VAL HG12 H 11.715 4.697 2.585 1.00 . B B . 23 VAL HG12 1 1 18 13401 2 2 2 VAL HG13 H 10.468 3.459 2.740 1.00 . B B . 23 VAL HG13 1 1 18 13402 2 2 2 VAL HG21 H 12.333 1.555 0.379 1.00 . B B . 23 VAL HG21 1 1 18 13403 2 2 2 VAL HG22 H 11.057 1.498 1.595 1.00 . B B . 23 VAL HG22 1 1 18 13404 2 2 2 VAL HG23 H 12.655 2.113 2.020 1.00 . B B . 23 VAL HG23 1 1 18 13405 2 2 2 VAL N N 10.060 2.002 -0.599 1.00 . B B . 23 VAL N 1 1 18 13406 2 2 2 VAL O O 10.900 3.604 -2.585 1.00 . B B . 23 VAL O 1 1 18 13407 2 2 3 ASN C C 11.044 5.887 -3.720 1.00 . B B . 24 ASN C 1 1 18 13408 2 2 3 ASN CA C 11.926 6.112 -2.489 1.00 . B B . 24 ASN CA 1 1 18 13409 2 2 3 ASN CB C 13.351 5.642 -2.792 1.00 . B B . 24 ASN CB 1 1 18 13410 2 2 3 ASN CG C 14.352 6.700 -2.322 1.00 . B B . 24 ASN CG 1 1 18 13411 2 2 3 ASN H H 11.396 5.742 -0.433 1.00 . B B . 24 ASN H 1 1 18 13412 2 2 3 ASN HA H 11.940 7.164 -2.245 1.00 . B B . 24 ASN HA 1 1 18 13413 2 2 3 ASN HB2 H 13.540 4.712 -2.275 1.00 . B B . 24 ASN HB2 1 1 18 13414 2 2 3 ASN HB3 H 13.463 5.493 -3.855 1.00 . B B . 24 ASN HB3 1 1 18 13415 2 2 3 ASN HD21 H 13.615 6.784 -0.481 1.00 . B B . 24 ASN HD21 1 1 18 13416 2 2 3 ASN HD22 H 14.931 7.813 -0.783 1.00 . B B . 24 ASN HD22 1 1 18 13417 2 2 3 ASN N N 11.389 5.343 -1.327 1.00 . B B . 24 ASN N 1 1 18 13418 2 2 3 ASN ND2 N 14.294 7.135 -1.093 1.00 . B B . 24 ASN ND2 1 1 18 13419 2 2 3 ASN O O 11.527 5.585 -4.793 1.00 . B B . 24 ASN O 1 1 18 13420 2 2 3 ASN OD1 O 15.196 7.134 -3.081 1.00 . B B . 24 ASN OD1 1 1 18 13421 2 2 4 GLN C C 7.507 6.510 -4.487 1.00 . B B . 25 GLN C 1 1 18 13422 2 2 4 GLN CA C 8.849 5.826 -4.745 1.00 . B B . 25 GLN CA 1 1 18 13423 2 2 4 GLN CB C 8.615 4.330 -4.951 1.00 . B B . 25 GLN CB 1 1 18 13424 2 2 4 GLN CD C 9.869 2.463 -6.037 1.00 . B B . 25 GLN CD 1 1 18 13425 2 2 4 GLN CG C 9.320 3.876 -6.230 1.00 . B B . 25 GLN CG 1 1 18 13426 2 2 4 GLN H H 9.381 6.277 -2.705 1.00 . B B . 25 GLN H 1 1 18 13427 2 2 4 GLN HA H 9.303 6.244 -5.631 1.00 . B B . 25 GLN HA 1 1 18 13428 2 2 4 GLN HB2 H 9.009 3.785 -4.106 1.00 . B B . 25 GLN HB2 1 1 18 13429 2 2 4 GLN HB3 H 7.556 4.142 -5.040 1.00 . B B . 25 GLN HB3 1 1 18 13430 2 2 4 GLN HE21 H 11.269 2.671 -7.428 1.00 . B B . 25 GLN HE21 1 1 18 13431 2 2 4 GLN HE22 H 11.236 1.162 -6.651 1.00 . B B . 25 GLN HE22 1 1 18 13432 2 2 4 GLN HG2 H 8.616 3.881 -7.049 1.00 . B B . 25 GLN HG2 1 1 18 13433 2 2 4 GLN HG3 H 10.134 4.549 -6.450 1.00 . B B . 25 GLN HG3 1 1 18 13434 2 2 4 GLN N N 9.754 6.032 -3.577 1.00 . B B . 25 GLN N 1 1 18 13435 2 2 4 GLN NE2 N 10.874 2.066 -6.766 1.00 . B B . 25 GLN NE2 1 1 18 13436 2 2 4 GLN O O 7.113 6.719 -3.357 1.00 . B B . 25 GLN O 1 1 18 13437 2 2 4 GLN OE1 O 9.378 1.713 -5.216 1.00 . B B . 25 GLN OE1 1 1 18 13438 2 2 5 HIS C C 4.420 6.641 -6.012 1.00 . B B . 26 HIS C 1 1 18 13439 2 2 5 HIS CA C 5.478 7.517 -5.331 1.00 . B B . 26 HIS CA 1 1 18 13440 2 2 5 HIS CB C 5.510 8.901 -5.979 1.00 . B B . 26 HIS CB 1 1 18 13441 2 2 5 HIS CD2 C 4.470 11.181 -5.230 1.00 . B B . 26 HIS CD2 1 1 18 13442 2 2 5 HIS CE1 C 4.405 10.775 -3.096 1.00 . B B . 26 HIS CE1 1 1 18 13443 2 2 5 HIS CG C 4.942 9.915 -5.026 1.00 . B B . 26 HIS CG 1 1 18 13444 2 2 5 HIS H H 7.127 6.673 -6.431 1.00 . B B . 26 HIS H 1 1 18 13445 2 2 5 HIS HA H 5.262 7.603 -4.276 1.00 . B B . 26 HIS HA 1 1 18 13446 2 2 5 HIS HB2 H 6.528 9.165 -6.224 1.00 . B B . 26 HIS HB2 1 1 18 13447 2 2 5 HIS HB3 H 4.913 8.887 -6.879 1.00 . B B . 26 HIS HB3 1 1 18 13448 2 2 5 HIS HD2 H 4.377 11.672 -6.188 1.00 . B B . 26 HIS HD2 1 1 18 13449 2 2 5 HIS HE1 H 4.257 10.890 -2.032 1.00 . B B . 26 HIS HE1 1 1 18 13450 2 2 5 HIS HE2 H 3.775 12.625 -3.842 1.00 . B B . 26 HIS HE2 1 1 18 13451 2 2 5 HIS N N 6.796 6.854 -5.527 1.00 . B B . 26 HIS N 1 1 18 13452 2 2 5 HIS ND1 N 4.891 9.668 -3.671 1.00 . B B . 26 HIS ND1 1 1 18 13453 2 2 5 HIS NE2 N 4.132 11.729 -4.010 1.00 . B B . 26 HIS NE2 1 1 18 13454 2 2 5 HIS O O 4.754 5.684 -6.683 1.00 . B B . 26 HIS O 1 1 18 13455 2 2 6 LEU C C 0.774 6.769 -6.607 1.00 . B B . 27 LEU C 1 1 18 13456 2 2 6 LEU CA C 2.135 6.046 -6.502 1.00 . B B . 27 LEU CA 1 1 18 13457 2 2 6 LEU CB C 2.020 4.732 -5.698 1.00 . B B . 27 LEU CB 1 1 18 13458 2 2 6 LEU CD1 C 1.875 6.033 -3.569 1.00 . B B . 27 LEU CD1 1 1 18 13459 2 2 6 LEU CD2 C 2.454 3.603 -3.515 1.00 . B B . 27 LEU CD2 1 1 18 13460 2 2 6 LEU CG C 2.612 4.908 -4.297 1.00 . B B . 27 LEU CG 1 1 18 13461 2 2 6 LEU H H 2.881 7.685 -5.296 1.00 . B B . 27 LEU H 1 1 18 13462 2 2 6 LEU HA H 2.476 5.811 -7.500 1.00 . B B . 27 LEU HA 1 1 18 13463 2 2 6 LEU HB2 H 0.993 4.440 -5.609 1.00 . B B . 27 LEU HB2 1 1 18 13464 2 2 6 LEU HB3 H 2.565 3.954 -6.214 1.00 . B B . 27 LEU HB3 1 1 18 13465 2 2 6 LEU HD11 H 2.544 6.868 -3.424 1.00 . B B . 27 LEU HD11 1 1 18 13466 2 2 6 LEU HD12 H 1.532 5.676 -2.609 1.00 . B B . 27 LEU HD12 1 1 18 13467 2 2 6 LEU HD13 H 1.028 6.349 -4.159 1.00 . B B . 27 LEU HD13 1 1 18 13468 2 2 6 LEU HD21 H 2.076 3.819 -2.527 1.00 . B B . 27 LEU HD21 1 1 18 13469 2 2 6 LEU HD22 H 3.412 3.113 -3.435 1.00 . B B . 27 LEU HD22 1 1 18 13470 2 2 6 LEU HD23 H 1.761 2.956 -4.033 1.00 . B B . 27 LEU HD23 1 1 18 13471 2 2 6 LEU HG H 3.660 5.157 -4.377 1.00 . B B . 27 LEU HG 1 1 18 13472 2 2 6 LEU N N 3.155 6.923 -5.848 1.00 . B B . 27 LEU N 1 1 18 13473 2 2 6 LEU O O 0.729 7.941 -6.884 1.00 . B B . 27 LEU O 1 1 18 13474 2 2 7 CYS C C -2.650 5.515 -7.032 1.00 . B B . 28 CYS C 1 1 18 13475 2 2 7 CYS CA C -1.713 6.609 -6.522 1.00 . B B . 28 CYS CA 1 1 18 13476 2 2 7 CYS CB C -1.824 7.830 -7.456 1.00 . B B . 28 CYS CB 1 1 18 13477 2 2 7 CYS H H -0.225 5.102 -6.236 1.00 . B B . 28 CYS H 1 1 18 13478 2 2 7 CYS HA H -2.034 6.898 -5.531 1.00 . B B . 28 CYS HA 1 1 18 13479 2 2 7 CYS HB2 H -0.912 7.949 -8.014 1.00 . B B . 28 CYS HB2 1 1 18 13480 2 2 7 CYS HB3 H -2.638 7.667 -8.148 1.00 . B B . 28 CYS HB3 1 1 18 13481 2 2 7 CYS N N -0.317 6.052 -6.423 1.00 . B B . 28 CYS N 1 1 18 13482 2 2 7 CYS O O -2.366 4.844 -8.004 1.00 . B B . 28 CYS O 1 1 18 13483 2 2 7 CYS SG S -2.157 9.343 -6.494 1.00 . B B . 28 CYS SG 1 1 18 13484 2 2 8 GLY C C -4.020 3.050 -7.310 1.00 . B B . 29 GLY C 1 1 18 13485 2 2 8 GLY CA C -4.751 4.296 -6.805 1.00 . B B . 29 GLY CA 1 1 18 13486 2 2 8 GLY H H -3.967 5.899 -5.598 1.00 . B B . 29 GLY H 1 1 18 13487 2 2 8 GLY HA2 H -5.375 4.028 -5.964 1.00 . B B . 29 GLY HA2 1 1 18 13488 2 2 8 GLY HA3 H -5.368 4.691 -7.597 1.00 . B B . 29 GLY HA3 1 1 18 13489 2 2 8 GLY N N -3.769 5.338 -6.377 1.00 . B B . 29 GLY N 1 1 18 13490 2 2 8 GLY O O -3.312 2.391 -6.575 1.00 . B B . 29 GLY O 1 1 18 13491 2 2 9 SER C C -2.069 1.478 -8.626 1.00 . B B . 30 SER C 1 1 18 13492 2 2 9 SER CA C -3.514 1.520 -9.120 1.00 . B B . 30 SER CA 1 1 18 13493 2 2 9 SER CB C -3.529 1.589 -10.647 1.00 . B B . 30 SER CB 1 1 18 13494 2 2 9 SER H H -4.771 3.269 -9.134 1.00 . B B . 30 SER H 1 1 18 13495 2 2 9 SER HA H -4.032 0.631 -8.794 1.00 . B B . 30 SER HA 1 1 18 13496 2 2 9 SER HB2 H -4.333 2.228 -10.972 1.00 . B B . 30 SER HB2 1 1 18 13497 2 2 9 SER HB3 H -2.588 1.991 -10.997 1.00 . B B . 30 SER HB3 1 1 18 13498 2 2 9 SER HG H -4.300 -0.196 -10.570 1.00 . B B . 30 SER HG 1 1 18 13499 2 2 9 SER N N -4.193 2.723 -8.562 1.00 . B B . 30 SER N 1 1 18 13500 2 2 9 SER O O -1.661 0.557 -7.948 1.00 . B B . 30 SER O 1 1 18 13501 2 2 9 SER OG O -3.727 0.283 -11.173 1.00 . B B . 30 SER OG 1 1 18 13502 2 2 10 ASP C C 0.169 2.101 -7.016 1.00 . B B . 31 ASP C 1 1 18 13503 2 2 10 ASP CA C 0.125 2.479 -8.497 1.00 . B B . 31 ASP CA 1 1 18 13504 2 2 10 ASP CB C 0.720 3.876 -8.687 1.00 . B B . 31 ASP CB 1 1 18 13505 2 2 10 ASP CG C 0.380 4.391 -10.087 1.00 . B B . 31 ASP CG 1 1 18 13506 2 2 10 ASP H H -1.636 3.208 -9.502 1.00 . B B . 31 ASP H 1 1 18 13507 2 2 10 ASP HA H 0.694 1.762 -9.070 1.00 . B B . 31 ASP HA 1 1 18 13508 2 2 10 ASP HB2 H 0.309 4.547 -7.947 1.00 . B B . 31 ASP HB2 1 1 18 13509 2 2 10 ASP HB3 H 1.793 3.828 -8.574 1.00 . B B . 31 ASP HB3 1 1 18 13510 2 2 10 ASP N N -1.290 2.470 -8.957 1.00 . B B . 31 ASP N 1 1 18 13511 2 2 10 ASP O O 1.144 1.562 -6.532 1.00 . B B . 31 ASP O 1 1 18 13512 2 2 10 ASP OD1 O 1.065 4.007 -11.021 1.00 . B B . 31 ASP OD1 1 1 18 13513 2 2 10 ASP OD2 O -0.558 5.163 -10.201 1.00 . B B . 31 ASP OD2 1 1 18 13514 2 2 11 LEU C C -1.232 0.535 -4.689 1.00 . B B . 32 LEU C 1 1 18 13515 2 2 11 LEU CA C -0.904 2.021 -4.845 1.00 . B B . 32 LEU CA 1 1 18 13516 2 2 11 LEU CB C -1.966 2.856 -4.126 1.00 . B B . 32 LEU CB 1 1 18 13517 2 2 11 LEU CD1 C -0.857 4.861 -3.128 1.00 . B B . 32 LEU CD1 1 1 18 13518 2 2 11 LEU CD2 C -2.453 3.508 -1.763 1.00 . B B . 32 LEU CD2 1 1 18 13519 2 2 11 LEU CG C -1.372 3.448 -2.845 1.00 . B B . 32 LEU CG 1 1 18 13520 2 2 11 LEU H H -1.665 2.803 -6.704 1.00 . B B . 32 LEU H 1 1 18 13521 2 2 11 LEU HA H 0.067 2.219 -4.416 1.00 . B B . 32 LEU HA 1 1 18 13522 2 2 11 LEU HB2 H -2.294 3.656 -4.774 1.00 . B B . 32 LEU HB2 1 1 18 13523 2 2 11 LEU HB3 H -2.807 2.229 -3.873 1.00 . B B . 32 LEU HB3 1 1 18 13524 2 2 11 LEU HD11 H -0.119 4.824 -3.915 1.00 . B B . 32 LEU HD11 1 1 18 13525 2 2 11 LEU HD12 H -0.411 5.268 -2.233 1.00 . B B . 32 LEU HD12 1 1 18 13526 2 2 11 LEU HD13 H -1.681 5.488 -3.436 1.00 . B B . 32 LEU HD13 1 1 18 13527 2 2 11 LEU HD21 H -2.437 2.595 -1.187 1.00 . B B . 32 LEU HD21 1 1 18 13528 2 2 11 LEU HD22 H -3.422 3.625 -2.226 1.00 . B B . 32 LEU HD22 1 1 18 13529 2 2 11 LEU HD23 H -2.263 4.348 -1.111 1.00 . B B . 32 LEU HD23 1 1 18 13530 2 2 11 LEU HG H -0.554 2.827 -2.506 1.00 . B B . 32 LEU HG 1 1 18 13531 2 2 11 LEU N N -0.886 2.373 -6.294 1.00 . B B . 32 LEU N 1 1 18 13532 2 2 11 LEU O O -0.379 -0.263 -4.353 1.00 . B B . 32 LEU O 1 1 18 13533 2 2 12 VAL C C -1.738 -2.134 -5.456 1.00 . B B . 33 VAL C 1 1 18 13534 2 2 12 VAL CA C -2.824 -1.284 -4.798 1.00 . B B . 33 VAL CA 1 1 18 13535 2 2 12 VAL CB C -4.165 -1.542 -5.487 1.00 . B B . 33 VAL CB 1 1 18 13536 2 2 12 VAL CG1 C -5.218 -0.589 -4.923 1.00 . B B . 33 VAL CG1 1 1 18 13537 2 2 12 VAL CG2 C -4.019 -1.308 -6.992 1.00 . B B . 33 VAL CG2 1 1 18 13538 2 2 12 VAL H H -3.133 0.809 -5.203 1.00 . B B . 33 VAL H 1 1 18 13539 2 2 12 VAL HA H -2.897 -1.541 -3.751 1.00 . B B . 33 VAL HA 1 1 18 13540 2 2 12 VAL HB H -4.471 -2.563 -5.307 1.00 . B B . 33 VAL HB 1 1 18 13541 2 2 12 VAL HG11 H -5.188 -0.617 -3.845 1.00 . B B . 33 VAL HG11 1 1 18 13542 2 2 12 VAL HG12 H -6.197 -0.892 -5.265 1.00 . B B . 33 VAL HG12 1 1 18 13543 2 2 12 VAL HG13 H -5.013 0.415 -5.264 1.00 . B B . 33 VAL HG13 1 1 18 13544 2 2 12 VAL HG21 H -4.866 -0.742 -7.352 1.00 . B B . 33 VAL HG21 1 1 18 13545 2 2 12 VAL HG22 H -3.977 -2.259 -7.503 1.00 . B B . 33 VAL HG22 1 1 18 13546 2 2 12 VAL HG23 H -3.111 -0.756 -7.184 1.00 . B B . 33 VAL HG23 1 1 18 13547 2 2 12 VAL N N -2.458 0.153 -4.932 1.00 . B B . 33 VAL N 1 1 18 13548 2 2 12 VAL O O -1.483 -3.253 -5.058 1.00 . B B . 33 VAL O 1 1 18 13549 2 2 13 GLU C C 1.175 -2.487 -6.161 1.00 . B B . 34 GLU C 1 1 18 13550 2 2 13 GLU CA C -0.004 -2.370 -7.123 1.00 . B B . 34 GLU CA 1 1 18 13551 2 2 13 GLU CB C 0.434 -1.634 -8.389 1.00 . B B . 34 GLU CB 1 1 18 13552 2 2 13 GLU CD C 0.764 -3.241 -10.277 1.00 . B B . 34 GLU CD 1 1 18 13553 2 2 13 GLU CG C -0.222 -2.280 -9.611 1.00 . B B . 34 GLU CG 1 1 18 13554 2 2 13 GLU H H -1.294 -0.694 -6.752 1.00 . B B . 34 GLU H 1 1 18 13555 2 2 13 GLU HA H -0.363 -3.357 -7.378 1.00 . B B . 34 GLU HA 1 1 18 13556 2 2 13 GLU HB2 H 0.132 -0.598 -8.324 1.00 . B B . 34 GLU HB2 1 1 18 13557 2 2 13 GLU HB3 H 1.506 -1.691 -8.485 1.00 . B B . 34 GLU HB3 1 1 18 13558 2 2 13 GLU HG2 H -1.102 -2.824 -9.300 1.00 . B B . 34 GLU HG2 1 1 18 13559 2 2 13 GLU HG3 H -0.504 -1.512 -10.315 1.00 . B B . 34 GLU HG3 1 1 18 13560 2 2 13 GLU N N -1.084 -1.603 -6.453 1.00 . B B . 34 GLU N 1 1 18 13561 2 2 13 GLU O O 1.567 -3.569 -5.771 1.00 . B B . 34 GLU O 1 1 18 13562 2 2 13 GLU OE1 O 1.623 -2.769 -11.003 1.00 . B B . 34 GLU OE1 1 1 18 13563 2 2 13 GLU OE2 O 0.643 -4.434 -10.050 1.00 . B B . 34 GLU OE2 1 1 18 13564 2 2 14 ALA C C 2.375 -2.122 -3.520 1.00 . B B . 35 ALA C 1 1 18 13565 2 2 14 ALA CA C 2.866 -1.441 -4.796 1.00 . B B . 35 ALA CA 1 1 18 13566 2 2 14 ALA CB C 3.357 -0.027 -4.479 1.00 . B B . 35 ALA CB 1 1 18 13567 2 2 14 ALA H H 1.392 -0.512 -6.060 1.00 . B B . 35 ALA H 1 1 18 13568 2 2 14 ALA HA H 3.669 -2.018 -5.230 1.00 . B B . 35 ALA HA 1 1 18 13569 2 2 14 ALA HB1 H 4.431 0.014 -4.588 1.00 . B B . 35 ALA HB1 1 1 18 13570 2 2 14 ALA HB2 H 3.088 0.230 -3.464 1.00 . B B . 35 ALA HB2 1 1 18 13571 2 2 14 ALA HB3 H 2.900 0.675 -5.161 1.00 . B B . 35 ALA HB3 1 1 18 13572 2 2 14 ALA N N 1.731 -1.378 -5.752 1.00 . B B . 35 ALA N 1 1 18 13573 2 2 14 ALA O O 3.035 -2.974 -2.960 1.00 . B B . 35 ALA O 1 1 18 13574 2 2 15 LEU C C 0.522 -3.898 -2.068 1.00 . B B . 36 LEU C 1 1 18 13575 2 2 15 LEU CA C 0.642 -2.391 -1.846 1.00 . B B . 36 LEU CA 1 1 18 13576 2 2 15 LEU CB C -0.748 -1.812 -1.588 1.00 . B B . 36 LEU CB 1 1 18 13577 2 2 15 LEU CD1 C -0.293 -1.008 0.720 1.00 . B B . 36 LEU CD1 1 1 18 13578 2 2 15 LEU CD2 C 0.474 0.339 -1.233 1.00 . B B . 36 LEU CD2 1 1 18 13579 2 2 15 LEU CG C -0.631 -0.575 -0.703 1.00 . B B . 36 LEU CG 1 1 18 13580 2 2 15 LEU H H 0.685 -1.080 -3.545 1.00 . B B . 36 LEU H 1 1 18 13581 2 2 15 LEU HA H 1.282 -2.193 -1.004 1.00 . B B . 36 LEU HA 1 1 18 13582 2 2 15 LEU HB2 H -1.204 -1.541 -2.529 1.00 . B B . 36 LEU HB2 1 1 18 13583 2 2 15 LEU HB3 H -1.359 -2.551 -1.092 1.00 . B B . 36 LEU HB3 1 1 18 13584 2 2 15 LEU HD11 H -1.061 -1.673 1.081 1.00 . B B . 36 LEU HD11 1 1 18 13585 2 2 15 LEU HD12 H -0.236 -0.138 1.356 1.00 . B B . 36 LEU HD12 1 1 18 13586 2 2 15 LEU HD13 H 0.658 -1.520 0.723 1.00 . B B . 36 LEU HD13 1 1 18 13587 2 2 15 LEU HD21 H 1.428 -0.155 -1.133 1.00 . B B . 36 LEU HD21 1 1 18 13588 2 2 15 LEU HD22 H 0.483 1.258 -0.666 1.00 . B B . 36 LEU HD22 1 1 18 13589 2 2 15 LEU HD23 H 0.290 0.559 -2.274 1.00 . B B . 36 LEU HD23 1 1 18 13590 2 2 15 LEU HG H -1.570 -0.045 -0.707 1.00 . B B . 36 LEU HG 1 1 18 13591 2 2 15 LEU N N 1.204 -1.761 -3.069 1.00 . B B . 36 LEU N 1 1 18 13592 2 2 15 LEU O O 0.596 -4.688 -1.146 1.00 . B B . 36 LEU O 1 1 18 13593 2 2 16 TYR C C 1.570 -6.398 -3.628 1.00 . B B . 37 TYR C 1 1 18 13594 2 2 16 TYR CA C 0.190 -5.745 -3.603 1.00 . B B . 37 TYR CA 1 1 18 13595 2 2 16 TYR CB C -0.474 -5.905 -4.970 1.00 . B B . 37 TYR CB 1 1 18 13596 2 2 16 TYR CD1 C -0.782 -8.429 -4.509 1.00 . B B . 37 TYR CD1 1 1 18 13597 2 2 16 TYR CD2 C 0.043 -7.746 -6.695 1.00 . B B . 37 TYR CD2 1 1 18 13598 2 2 16 TYR CE1 C -0.713 -9.769 -4.911 1.00 . B B . 37 TYR CE1 1 1 18 13599 2 2 16 TYR CE2 C 0.107 -9.091 -7.081 1.00 . B B . 37 TYR CE2 1 1 18 13600 2 2 16 TYR CG C -0.404 -7.390 -5.402 1.00 . B B . 37 TYR CG 1 1 18 13601 2 2 16 TYR CZ C -0.270 -10.098 -6.193 1.00 . B B . 37 TYR CZ 1 1 18 13602 2 2 16 TYR H H 0.271 -3.633 -4.012 1.00 . B B . 37 TYR H 1 1 18 13603 2 2 16 TYR HA H -0.420 -6.218 -2.848 1.00 . B B . 37 TYR HA 1 1 18 13604 2 2 16 TYR HB2 H -1.508 -5.567 -4.899 1.00 . B B . 37 TYR HB2 1 1 18 13605 2 2 16 TYR HB3 H 0.045 -5.275 -5.690 1.00 . B B . 37 TYR HB3 1 1 18 13606 2 2 16 TYR HD1 H -1.123 -8.206 -3.515 1.00 . B B . 37 TYR HD1 1 1 18 13607 2 2 16 TYR HD2 H 0.344 -6.996 -7.393 1.00 . B B . 37 TYR HD2 1 1 18 13608 2 2 16 TYR HE1 H -1.002 -10.552 -4.226 1.00 . B B . 37 TYR HE1 1 1 18 13609 2 2 16 TYR HE2 H 0.450 -9.349 -8.072 1.00 . B B . 37 TYR HE2 1 1 18 13610 2 2 16 TYR HH H -0.466 -11.964 -5.834 1.00 . B B . 37 TYR HH 1 1 18 13611 2 2 16 TYR N N 0.329 -4.295 -3.292 1.00 . B B . 37 TYR N 1 1 18 13612 2 2 16 TYR O O 1.694 -7.607 -3.669 1.00 . B B . 37 TYR O 1 1 18 13613 2 2 16 TYR OH O -0.205 -11.421 -6.582 1.00 . B B . 37 TYR OH 1 1 18 13614 2 2 17 LEU C C 4.494 -6.322 -2.188 1.00 . B B . 38 LEU C 1 1 18 13615 2 2 17 LEU CA C 3.979 -6.196 -3.621 1.00 . B B . 38 LEU CA 1 1 18 13616 2 2 17 LEU CB C 4.937 -5.306 -4.423 1.00 . B B . 38 LEU CB 1 1 18 13617 2 2 17 LEU CD1 C 5.130 -3.534 -6.168 1.00 . B B . 38 LEU CD1 1 1 18 13618 2 2 17 LEU CD2 C 3.372 -5.290 -6.371 1.00 . B B . 38 LEU CD2 1 1 18 13619 2 2 17 LEU CG C 4.156 -4.419 -5.390 1.00 . B B . 38 LEU CG 1 1 18 13620 2 2 17 LEU H H 2.485 -4.641 -3.565 1.00 . B B . 38 LEU H 1 1 18 13621 2 2 17 LEU HA H 3.938 -7.173 -4.072 1.00 . B B . 38 LEU HA 1 1 18 13622 2 2 17 LEU HB2 H 5.500 -4.683 -3.743 1.00 . B B . 38 LEU HB2 1 1 18 13623 2 2 17 LEU HB3 H 5.618 -5.930 -4.982 1.00 . B B . 38 LEU HB3 1 1 18 13624 2 2 17 LEU HD11 H 4.652 -3.176 -7.067 1.00 . B B . 38 LEU HD11 1 1 18 13625 2 2 17 LEU HD12 H 6.008 -4.106 -6.429 1.00 . B B . 38 LEU HD12 1 1 18 13626 2 2 17 LEU HD13 H 5.419 -2.693 -5.555 1.00 . B B . 38 LEU HD13 1 1 18 13627 2 2 17 LEU HD21 H 2.431 -5.576 -5.925 1.00 . B B . 38 LEU HD21 1 1 18 13628 2 2 17 LEU HD22 H 3.946 -6.173 -6.604 1.00 . B B . 38 LEU HD22 1 1 18 13629 2 2 17 LEU HD23 H 3.186 -4.730 -7.276 1.00 . B B . 38 LEU HD23 1 1 18 13630 2 2 17 LEU HG H 3.473 -3.801 -4.833 1.00 . B B . 38 LEU HG 1 1 18 13631 2 2 17 LEU N N 2.609 -5.611 -3.601 1.00 . B B . 38 LEU N 1 1 18 13632 2 2 17 LEU O O 5.173 -7.268 -1.842 1.00 . B B . 38 LEU O 1 1 18 13633 2 2 18 VAL C C 3.872 -6.530 0.804 1.00 . B B . 39 VAL C 1 1 18 13634 2 2 18 VAL CA C 4.646 -5.441 0.059 1.00 . B B . 39 VAL CA 1 1 18 13635 2 2 18 VAL CB C 4.420 -4.087 0.733 1.00 . B B . 39 VAL CB 1 1 18 13636 2 2 18 VAL CG1 C 4.896 -2.972 -0.199 1.00 . B B . 39 VAL CG1 1 1 18 13637 2 2 18 VAL CG2 C 2.929 -3.899 1.027 1.00 . B B . 39 VAL CG2 1 1 18 13638 2 2 18 VAL H H 3.626 -4.620 -1.648 1.00 . B B . 39 VAL H 1 1 18 13639 2 2 18 VAL HA H 5.700 -5.677 0.073 1.00 . B B . 39 VAL HA 1 1 18 13640 2 2 18 VAL HB H 4.979 -4.048 1.656 1.00 . B B . 39 VAL HB 1 1 18 13641 2 2 18 VAL HG11 H 4.113 -2.732 -0.903 1.00 . B B . 39 VAL HG11 1 1 18 13642 2 2 18 VAL HG12 H 5.774 -3.302 -0.736 1.00 . B B . 39 VAL HG12 1 1 18 13643 2 2 18 VAL HG13 H 5.138 -2.096 0.383 1.00 . B B . 39 VAL HG13 1 1 18 13644 2 2 18 VAL HG21 H 2.680 -4.390 1.956 1.00 . B B . 39 VAL HG21 1 1 18 13645 2 2 18 VAL HG22 H 2.347 -4.330 0.225 1.00 . B B . 39 VAL HG22 1 1 18 13646 2 2 18 VAL HG23 H 2.708 -2.845 1.105 1.00 . B B . 39 VAL HG23 1 1 18 13647 2 2 18 VAL N N 4.175 -5.375 -1.350 1.00 . B B . 39 VAL N 1 1 18 13648 2 2 18 VAL O O 4.369 -7.129 1.738 1.00 . B B . 39 VAL O 1 1 18 13649 2 2 19 CYS C C 2.314 -9.229 0.584 1.00 . B B . 40 CYS C 1 1 18 13650 2 2 19 CYS CA C 1.870 -7.855 1.089 1.00 . B B . 40 CYS CA 1 1 18 13651 2 2 19 CYS CB C 0.378 -7.648 0.817 1.00 . B B . 40 CYS CB 1 1 18 13652 2 2 19 CYS H H 2.274 -6.311 -0.359 1.00 . B B . 40 CYS H 1 1 18 13653 2 2 19 CYS HA H 2.052 -7.796 2.147 1.00 . B B . 40 CYS HA 1 1 18 13654 2 2 19 CYS HB2 H 0.195 -7.649 -0.244 1.00 . B B . 40 CYS HB2 1 1 18 13655 2 2 19 CYS HB3 H -0.185 -8.441 1.281 1.00 . B B . 40 CYS HB3 1 1 18 13656 2 2 19 CYS N N 2.660 -6.799 0.398 1.00 . B B . 40 CYS N 1 1 18 13657 2 2 19 CYS O O 2.400 -10.181 1.333 1.00 . B B . 40 CYS O 1 1 18 13658 2 2 19 CYS SG S -0.142 -6.062 1.509 1.00 . B B . 40 CYS SG 1 1 18 13659 2 2 20 GLY C C 1.895 -11.580 -1.448 1.00 . B B . 41 GLY C 1 1 18 13660 2 2 20 GLY CA C 3.079 -10.633 -1.238 1.00 . B B . 41 GLY CA 1 1 18 13661 2 2 20 GLY H H 2.552 -8.542 -1.255 1.00 . B B . 41 GLY H 1 1 18 13662 2 2 20 GLY HA2 H 3.570 -10.459 -2.185 1.00 . B B . 41 GLY HA2 1 1 18 13663 2 2 20 GLY HA3 H 3.778 -11.087 -0.551 1.00 . B B . 41 GLY HA3 1 1 18 13664 2 2 20 GLY N N 2.615 -9.330 -0.678 1.00 . B B . 41 GLY N 1 1 18 13665 2 2 20 GLY O O 1.450 -12.245 -0.534 1.00 . B B . 41 GLY O 1 1 18 13666 2 2 21 GLU C C -0.738 -12.584 -1.791 1.00 . B B . 42 GLU C 1 1 18 13667 2 2 21 GLU CA C 0.254 -12.571 -2.956 1.00 . B B . 42 GLU CA 1 1 18 13668 2 2 21 GLU CB C 0.776 -13.991 -3.194 1.00 . B B . 42 GLU CB 1 1 18 13669 2 2 21 GLU CD C 2.706 -15.540 -2.833 1.00 . B B . 42 GLU CD 1 1 18 13670 2 2 21 GLU CG C 2.078 -14.208 -2.418 1.00 . B B . 42 GLU CG 1 1 18 13671 2 2 21 GLU H H 1.790 -11.116 -3.374 1.00 . B B . 42 GLU H 1 1 18 13672 2 2 21 GLU HA H -0.251 -12.226 -3.846 1.00 . B B . 42 GLU HA 1 1 18 13673 2 2 21 GLU HB2 H 0.036 -14.704 -2.859 1.00 . B B . 42 GLU HB2 1 1 18 13674 2 2 21 GLU HB3 H 0.960 -14.133 -4.248 1.00 . B B . 42 GLU HB3 1 1 18 13675 2 2 21 GLU HG2 H 2.765 -13.403 -2.635 1.00 . B B . 42 GLU HG2 1 1 18 13676 2 2 21 GLU HG3 H 1.868 -14.227 -1.359 1.00 . B B . 42 GLU HG3 1 1 18 13677 2 2 21 GLU N N 1.399 -11.656 -2.656 1.00 . B B . 42 GLU N 1 1 18 13678 2 2 21 GLU O O -1.304 -13.607 -1.459 1.00 . B B . 42 GLU O 1 1 18 13679 2 2 21 GLU OE1 O 1.982 -16.520 -2.894 1.00 . B B . 42 GLU OE1 1 1 18 13680 2 2 21 GLU OE2 O 3.899 -15.557 -3.084 1.00 . B B . 42 GLU OE2 1 1 18 13681 2 2 22 ARG C C -3.291 -10.999 -0.564 1.00 . B B . 43 ARG C 1 1 18 13682 2 2 22 ARG CA C -1.914 -11.409 -0.038 1.00 . B B . 43 ARG CA 1 1 18 13683 2 2 22 ARG CB C -1.421 -10.380 0.977 1.00 . B B . 43 ARG CB 1 1 18 13684 2 2 22 ARG CD C -0.800 -11.099 3.287 1.00 . B B . 43 ARG CD 1 1 18 13685 2 2 22 ARG CG C -1.963 -10.718 2.368 1.00 . B B . 43 ARG CG 1 1 18 13686 2 2 22 ARG CZ C -2.139 -11.049 5.307 1.00 . B B . 43 ARG CZ 1 1 18 13687 2 2 22 ARG H H -0.494 -10.646 -1.456 1.00 . B B . 43 ARG H 1 1 18 13688 2 2 22 ARG HA H -1.978 -12.379 0.431 1.00 . B B . 43 ARG HA 1 1 18 13689 2 2 22 ARG HB2 H -0.340 -10.391 1.001 1.00 . B B . 43 ARG HB2 1 1 18 13690 2 2 22 ARG HB3 H -1.762 -9.400 0.685 1.00 . B B . 43 ARG HB3 1 1 18 13691 2 2 22 ARG HD2 H -0.682 -12.173 3.291 1.00 . B B . 43 ARG HD2 1 1 18 13692 2 2 22 ARG HD3 H 0.108 -10.639 2.926 1.00 . B B . 43 ARG HD3 1 1 18 13693 2 2 22 ARG HE H -0.470 -9.993 5.105 1.00 . B B . 43 ARG HE 1 1 18 13694 2 2 22 ARG HG2 H -2.477 -9.859 2.773 1.00 . B B . 43 ARG HG2 1 1 18 13695 2 2 22 ARG HG3 H -2.648 -11.549 2.296 1.00 . B B . 43 ARG HG3 1 1 18 13696 2 2 22 ARG HH11 H -1.974 -12.930 4.644 1.00 . B B . 43 ARG HH11 1 1 18 13697 2 2 22 ARG HH12 H -3.316 -12.621 5.695 1.00 . B B . 43 ARG HH12 1 1 18 13698 2 2 22 ARG HH21 H -2.549 -9.268 6.123 1.00 . B B . 43 ARG HH21 1 1 18 13699 2 2 22 ARG HH22 H -3.640 -10.548 6.533 1.00 . B B . 43 ARG HH22 1 1 18 13700 2 2 22 ARG N N -0.956 -11.461 -1.173 1.00 . B B . 43 ARG N 1 1 18 13701 2 2 22 ARG NE N -1.081 -10.624 4.671 1.00 . B B . 43 ARG NE 1 1 18 13702 2 2 22 ARG NH1 N -2.505 -12.297 5.208 1.00 . B B . 43 ARG NH1 1 1 18 13703 2 2 22 ARG NH2 N -2.830 -10.224 6.045 1.00 . B B . 43 ARG NH2 1 1 18 13704 2 2 22 ARG O O -3.514 -10.932 -1.757 1.00 . B B . 43 ARG O 1 1 18 13705 2 2 23 GLY C C -5.459 -9.319 -1.293 1.00 . B B . 44 GLY C 1 1 18 13706 2 2 23 GLY CA C -5.578 -10.322 -0.143 1.00 . B B . 44 GLY CA 1 1 18 13707 2 2 23 GLY H H -4.019 -10.787 1.269 1.00 . B B . 44 GLY H 1 1 18 13708 2 2 23 GLY HA2 H -6.119 -11.196 -0.479 1.00 . B B . 44 GLY HA2 1 1 18 13709 2 2 23 GLY HA3 H -6.110 -9.863 0.677 1.00 . B B . 44 GLY HA3 1 1 18 13710 2 2 23 GLY N N -4.217 -10.726 0.312 1.00 . B B . 44 GLY N 1 1 18 13711 2 2 23 GLY O O -5.012 -8.204 -1.112 1.00 . B B . 44 GLY O 1 1 18 13712 2 2 24 GLY C C -6.927 -7.781 -3.592 1.00 . B B . 45 GLY C 1 1 18 13713 2 2 24 GLY CA C -5.761 -8.770 -3.633 1.00 . B B . 45 GLY CA 1 1 18 13714 2 2 24 GLY H H -6.212 -10.609 -2.602 1.00 . B B . 45 GLY H 1 1 18 13715 2 2 24 GLY HA2 H -4.826 -8.229 -3.583 1.00 . B B . 45 GLY HA2 1 1 18 13716 2 2 24 GLY HA3 H -5.803 -9.332 -4.554 1.00 . B B . 45 GLY HA3 1 1 18 13717 2 2 24 GLY N N -5.855 -9.705 -2.475 1.00 . B B . 45 GLY N 1 1 18 13718 2 2 24 GLY O O -6.994 -6.854 -4.375 1.00 . B B . 45 GLY O 1 1 18 13719 2 2 25 PHE C C -8.575 -5.742 -1.914 1.00 . B B . 46 PHE C 1 1 18 13720 2 2 25 PHE CA C -9.007 -7.040 -2.601 1.00 . B B . 46 PHE CA 1 1 18 13721 2 2 25 PHE CB C -10.128 -7.700 -1.799 1.00 . B B . 46 PHE CB 1 1 18 13722 2 2 25 PHE CD1 C -11.760 -8.095 -3.784 1.00 . B B . 46 PHE CD1 1 1 18 13723 2 2 25 PHE CD2 C -12.469 -6.593 -2.001 1.00 . B B . 46 PHE CD2 1 1 18 13724 2 2 25 PHE CE1 C -12.975 -7.868 -4.443 1.00 . B B . 46 PHE CE1 1 1 18 13725 2 2 25 PHE CE2 C -13.677 -6.380 -2.678 1.00 . B B . 46 PHE CE2 1 1 18 13726 2 2 25 PHE CG C -11.481 -7.459 -2.539 1.00 . B B . 46 PHE CG 1 1 18 13727 2 2 25 PHE CZ C -13.929 -7.016 -3.892 1.00 . B B . 46 PHE CZ 1 1 18 13728 2 2 25 PHE H H -7.777 -8.723 -2.066 1.00 . B B . 46 PHE H 1 1 18 13729 2 2 25 PHE HA H -9.364 -6.820 -3.595 1.00 . B B . 46 PHE HA 1 1 18 13730 2 2 25 PHE HB2 H -9.905 -8.775 -1.716 1.00 . B B . 46 PHE HB2 1 1 18 13731 2 2 25 PHE HB3 H -10.150 -7.263 -0.791 1.00 . B B . 46 PHE HB3 1 1 18 13732 2 2 25 PHE HD1 H -11.050 -8.751 -4.243 1.00 . B B . 46 PHE HD1 1 1 18 13733 2 2 25 PHE HD2 H -12.309 -6.081 -1.080 1.00 . B B . 46 PHE HD2 1 1 18 13734 2 2 25 PHE HE1 H -13.173 -8.355 -5.386 1.00 . B B . 46 PHE HE1 1 1 18 13735 2 2 25 PHE HE2 H -14.420 -5.720 -2.255 1.00 . B B . 46 PHE HE2 1 1 18 13736 2 2 25 PHE HZ H -14.863 -6.846 -4.407 1.00 . B B . 46 PHE HZ 1 1 18 13737 2 2 25 PHE N N -7.847 -7.970 -2.687 1.00 . B B . 46 PHE N 1 1 18 13738 2 2 25 PHE O O -7.402 -5.499 -1.709 1.00 . B B . 46 PHE O 1 1 18 13739 2 2 26 TYR C C -10.216 -3.279 0.158 1.00 . B B . 47 TYR C 1 1 18 13740 2 2 26 TYR CA C -9.149 -3.626 -0.882 1.00 . B B . 47 TYR CA 1 1 18 13741 2 2 26 TYR CB C -9.065 -2.505 -1.921 1.00 . B B . 47 TYR CB 1 1 18 13742 2 2 26 TYR CD1 C -7.652 -1.355 -0.061 1.00 . B B . 47 TYR CD1 1 1 18 13743 2 2 26 TYR CD2 C -7.406 -0.552 -2.349 1.00 . B B . 47 TYR CD2 1 1 18 13744 2 2 26 TYR CE1 C -6.713 -0.404 0.361 1.00 . B B . 47 TYR CE1 1 1 18 13745 2 2 26 TYR CE2 C -6.469 0.390 -1.905 1.00 . B B . 47 TYR CE2 1 1 18 13746 2 2 26 TYR CG C -8.021 -1.448 -1.438 1.00 . B B . 47 TYR CG 1 1 18 13747 2 2 26 TYR CZ C -6.126 0.464 -0.557 1.00 . B B . 47 TYR CZ 1 1 18 13748 2 2 26 TYR H H -10.452 -5.119 -1.729 1.00 . B B . 47 TYR H 1 1 18 13749 2 2 26 TYR HA H -8.193 -3.735 -0.393 1.00 . B B . 47 TYR HA 1 1 18 13750 2 2 26 TYR HB2 H -8.772 -2.945 -2.888 1.00 . B B . 47 TYR HB2 1 1 18 13751 2 2 26 TYR HB3 H -10.059 -2.048 -2.028 1.00 . B B . 47 TYR HB3 1 1 18 13752 2 2 26 TYR HD1 H -8.079 -2.007 0.676 1.00 . B B . 47 TYR HD1 1 1 18 13753 2 2 26 TYR HD2 H -7.639 -0.582 -3.385 1.00 . B B . 47 TYR HD2 1 1 18 13754 2 2 26 TYR HE1 H -6.443 -0.345 1.404 1.00 . B B . 47 TYR HE1 1 1 18 13755 2 2 26 TYR HE2 H -6.011 1.065 -2.612 1.00 . B B . 47 TYR HE2 1 1 18 13756 2 2 26 TYR HH H -4.325 1.055 -0.317 1.00 . B B . 47 TYR HH 1 1 18 13757 2 2 26 TYR N N -9.511 -4.906 -1.555 1.00 . B B . 47 TYR N 1 1 18 13758 2 2 26 TYR O O -10.638 -2.146 0.275 1.00 . B B . 47 TYR O 1 1 18 13759 2 2 26 TYR OH O -5.203 1.397 -0.130 1.00 . B B . 47 TYR OH 1 1 18 13760 2 2 27 THR C C -11.504 -4.915 3.134 1.00 . B B . 48 THR C 1 1 18 13761 2 2 27 THR CA C -11.698 -3.976 1.945 1.00 . B B . 48 THR CA 1 1 18 13762 2 2 27 THR CB C -13.086 -4.198 1.341 1.00 . B B . 48 THR CB 1 1 18 13763 2 2 27 THR CG2 C -14.154 -3.949 2.406 1.00 . B B . 48 THR CG2 1 1 18 13764 2 2 27 THR H H -10.303 -5.153 0.800 1.00 . B B . 48 THR H 1 1 18 13765 2 2 27 THR HA H -11.611 -2.959 2.279 1.00 . B B . 48 THR HA 1 1 18 13766 2 2 27 THR HB H -13.167 -5.213 0.986 1.00 . B B . 48 THR HB 1 1 18 13767 2 2 27 THR HG1 H -13.637 -2.481 0.611 1.00 . B B . 48 THR HG1 1 1 18 13768 2 2 27 THR HG21 H -15.046 -3.559 1.938 1.00 . B B . 48 THR HG21 1 1 18 13769 2 2 27 THR HG22 H -13.785 -3.235 3.127 1.00 . B B . 48 THR HG22 1 1 18 13770 2 2 27 THR HG23 H -14.387 -4.878 2.907 1.00 . B B . 48 THR HG23 1 1 18 13771 2 2 27 THR N N -10.657 -4.248 0.912 1.00 . B B . 48 THR N 1 1 18 13772 2 2 27 THR O O -11.688 -4.539 4.275 1.00 . B B . 48 THR O 1 1 18 13773 2 2 27 THR OG1 O -13.279 -3.299 0.258 1.00 . B B . 48 THR OG1 1 1 18 13774 2 2 28 LYS C C -10.184 -8.343 3.457 1.00 . B B . 49 LYS C 1 1 18 13775 2 2 28 LYS CA C -10.918 -7.100 3.988 1.00 . B B . 49 LYS CA 1 1 18 13776 2 2 28 LYS CB C -12.278 -7.500 4.583 1.00 . B B . 49 LYS CB 1 1 18 13777 2 2 28 LYS CD C -13.127 -7.914 2.257 1.00 . B B . 49 LYS CD 1 1 18 13778 2 2 28 LYS CE C -13.987 -8.845 1.399 1.00 . B B . 49 LYS CE 1 1 18 13779 2 2 28 LYS CG C -12.997 -8.497 3.667 1.00 . B B . 49 LYS CG 1 1 18 13780 2 2 28 LYS H H -10.985 -6.408 1.950 1.00 . B B . 49 LYS H 1 1 18 13781 2 2 28 LYS HA H -10.325 -6.628 4.754 1.00 . B B . 49 LYS HA 1 1 18 13782 2 2 28 LYS HB2 H -12.123 -7.954 5.551 1.00 . B B . 49 LYS HB2 1 1 18 13783 2 2 28 LYS HB3 H -12.890 -6.617 4.698 1.00 . B B . 49 LYS HB3 1 1 18 13784 2 2 28 LYS HD2 H -13.593 -6.941 2.311 1.00 . B B . 49 LYS HD2 1 1 18 13785 2 2 28 LYS HD3 H -12.151 -7.821 1.811 1.00 . B B . 49 LYS HD3 1 1 18 13786 2 2 28 LYS HE2 H -13.522 -8.975 0.433 1.00 . B B . 49 LYS HE2 1 1 18 13787 2 2 28 LYS HE3 H -14.078 -9.804 1.887 1.00 . B B . 49 LYS HE3 1 1 18 13788 2 2 28 LYS HG2 H -12.440 -9.420 3.629 1.00 . B B . 49 LYS HG2 1 1 18 13789 2 2 28 LYS HG3 H -13.983 -8.694 4.061 1.00 . B B . 49 LYS HG3 1 1 18 13790 2 2 28 LYS HZ1 H -15.878 -8.336 2.107 1.00 . B B . 49 LYS HZ1 1 1 18 13791 2 2 28 LYS HZ2 H -15.842 -8.748 0.458 1.00 . B B . 49 LYS HZ2 1 1 18 13792 2 2 28 LYS HZ3 H -15.247 -7.243 0.975 1.00 . B B . 49 LYS HZ3 1 1 18 13793 2 2 28 LYS N N -11.130 -6.133 2.876 1.00 . B B . 49 LYS N 1 1 18 13794 2 2 28 LYS NZ N -15.341 -8.248 1.221 1.00 . B B . 49 LYS NZ 1 1 18 13795 2 2 28 LYS O O -10.699 -9.054 2.618 1.00 . B B . 49 LYS O 1 1 18 13796 2 2 29 PRO C C -8.684 -10.999 4.217 1.00 . B B . 50 PRO C 1 1 18 13797 2 2 29 PRO CA C -8.178 -9.720 3.544 1.00 . B B . 50 PRO CA 1 1 18 13798 2 2 29 PRO CB C -6.771 -9.359 4.025 1.00 . B B . 50 PRO CB 1 1 18 13799 2 2 29 PRO CD C -8.354 -7.711 4.970 1.00 . B B . 50 PRO CD 1 1 18 13800 2 2 29 PRO CG C -6.952 -8.321 5.155 1.00 . B B . 50 PRO CG 1 1 18 13801 2 2 29 PRO HA H -8.185 -9.821 2.476 1.00 . B B . 50 PRO HA 1 1 18 13802 2 2 29 PRO HB2 H -6.271 -10.241 4.402 1.00 . B B . 50 PRO HB2 1 1 18 13803 2 2 29 PRO HB3 H -6.202 -8.924 3.218 1.00 . B B . 50 PRO HB3 1 1 18 13804 2 2 29 PRO HD2 H -8.906 -7.745 5.897 1.00 . B B . 50 PRO HD2 1 1 18 13805 2 2 29 PRO HD3 H -8.282 -6.700 4.603 1.00 . B B . 50 PRO HD3 1 1 18 13806 2 2 29 PRO HG2 H -6.878 -8.806 6.119 1.00 . B B . 50 PRO HG2 1 1 18 13807 2 2 29 PRO HG3 H -6.206 -7.547 5.070 1.00 . B B . 50 PRO HG3 1 1 18 13808 2 2 29 PRO N N -8.994 -8.571 3.957 1.00 . B B . 50 PRO N 1 1 18 13809 2 2 29 PRO O O -9.735 -11.015 4.826 1.00 . B B . 50 PRO O 1 1 18 13810 2 2 30 THR C C -7.819 -13.437 6.158 1.00 . B B . 51 THR C 1 1 18 13811 2 2 30 THR CA C -8.392 -13.344 4.743 1.00 . B B . 51 THR CA 1 1 18 13812 2 2 30 THR CB C -7.895 -14.529 3.911 1.00 . B B . 51 THR CB 1 1 18 13813 2 2 30 THR CG2 C -8.639 -14.566 2.576 1.00 . B B . 51 THR CG2 1 1 18 13814 2 2 30 THR H H -7.104 -12.037 3.612 1.00 . B B . 51 THR H 1 1 18 13815 2 2 30 THR HA H -9.471 -13.364 4.790 1.00 . B B . 51 THR HA 1 1 18 13816 2 2 30 THR HB H -8.078 -15.447 4.446 1.00 . B B . 51 THR HB 1 1 18 13817 2 2 30 THR HG1 H -6.036 -14.936 4.311 1.00 . B B . 51 THR HG1 1 1 18 13818 2 2 30 THR HG21 H -8.032 -15.074 1.840 1.00 . B B . 51 THR HG21 1 1 18 13819 2 2 30 THR HG22 H -8.835 -13.557 2.245 1.00 . B B . 51 THR HG22 1 1 18 13820 2 2 30 THR HG23 H -9.573 -15.093 2.698 1.00 . B B . 51 THR HG23 1 1 18 13821 2 2 30 THR N N -7.948 -12.070 4.110 1.00 . B B . 51 THR N 1 1 18 13822 2 2 30 THR O O -8.127 -12.569 6.959 1.00 . B B . 51 THR O 1 1 18 13823 2 2 30 THR OXT O -7.083 -14.374 6.417 1.00 . B B . 51 THR OXT 1 1 18 13824 2 2 30 THR OG1 O -6.501 -14.387 3.676 1.00 . B B . 51 THR OG1 1 1 stop_ save_
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