NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
577444 | 2mkx | 19799 | cing | 4-filtered-FRED | STAR | entry | full | 549 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2mkx # This FRED archive file contains, for PDB entry <2mkx>: # # - 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_2mkx _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 2mkx _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 5420.14 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 $Autolysin A . 1 1 stop_ save_ save_Autolysin _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name Autolysin _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code MGTNTYYTVKSGDTLNKIAAQYGVSVANLRSWNGISGDLIFVGQKLIVKKGSHHHHHH _Entity.Number_of_monomers 58 loop_ _Entity_comp_index.ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 MET . 1 1 2 GLY . 1 1 3 THR . 1 1 4 ASN . 1 1 5 THR . 1 1 6 TYR . 1 1 7 TYR . 1 1 8 THR . 1 1 9 VAL . 1 1 10 LYS . 1 1 11 SER . 1 1 12 GLY . 1 1 13 ASP . 1 1 14 THR . 1 1 15 LEU . 1 1 16 ASN . 1 1 17 LYS . 1 1 18 ILE . 1 1 19 ALA . 1 1 20 ALA . 1 1 21 GLN . 1 1 22 TYR . 1 1 23 GLY . 1 1 24 VAL . 1 1 25 SER . 1 1 26 VAL . 1 1 27 ALA . 1 1 28 ASN . 1 1 29 LEU . 1 1 30 ARG . 1 1 31 SER . 1 1 32 TRP . 1 1 33 ASN . 1 1 34 GLY . 1 1 35 ILE . 1 1 36 SER . 1 1 37 GLY . 1 1 38 ASP . 1 1 39 LEU . 1 1 40 ILE . 1 1 41 PHE . 1 1 42 VAL . 1 1 43 GLY . 1 1 44 GLN . 1 1 45 LYS . 1 1 46 LEU . 1 1 47 ILE . 1 1 48 VAL . 1 1 49 LYS . 1 1 50 LYS . 1 1 51 GLY . 1 1 52 SER . 1 1 53 HIS . 1 1 54 HIS . 1 1 55 HIS . 1 1 56 HIS . 1 1 57 HIS . 1 1 58 HIS . 1 1 stop_ loop_ _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID MET 1 1 1 1 GLY 2 2 1 1 THR 3 3 1 1 ASN 4 4 1 1 THR 5 5 1 1 TYR 6 6 1 1 TYR 7 7 1 1 THR 8 8 1 1 VAL 9 9 1 1 LYS 10 10 1 1 SER 11 11 1 1 GLY 12 12 1 1 ASP 13 13 1 1 THR 14 14 1 1 LEU 15 15 1 1 ASN 16 16 1 1 LYS 17 17 1 1 ILE 18 18 1 1 ALA 19 19 1 1 ALA 20 20 1 1 GLN 21 21 1 1 TYR 22 22 1 1 GLY 23 23 1 1 VAL 24 24 1 1 SER 25 25 1 1 VAL 26 26 1 1 ALA 27 27 1 1 ASN 28 28 1 1 LEU 29 29 1 1 ARG 30 30 1 1 SER 31 31 1 1 TRP 32 32 1 1 ASN 33 33 1 1 GLY 34 34 1 1 ILE 35 35 1 1 SER 36 36 1 1 GLY 37 37 1 1 ASP 38 38 1 1 LEU 39 39 1 1 ILE 40 40 1 1 PHE 41 41 1 1 VAL 42 42 1 1 GLY 43 43 1 1 GLN 44 44 1 1 LYS 45 45 1 1 LEU 46 46 1 1 ILE 47 47 1 1 VAL 48 48 1 1 LYS 49 49 1 1 LYS 50 50 1 1 GLY 51 51 1 1 SER 52 52 1 1 HIS 53 53 1 1 HIS 54 54 1 1 HIS 55 55 1 1 HIS 56 56 1 1 HIS 57 57 1 1 HIS 58 58 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 121 1 . . . 1 1 122 1 . . . 1 1 123 1 . . . 1 1 124 1 . . . 1 1 125 1 . . . 1 1 126 1 . . . 1 1 127 1 . . . 1 1 128 1 . . . 1 1 129 1 . . . 1 1 130 1 . . . 1 1 131 1 . . . 1 1 132 1 . . . 1 1 133 1 . . . 1 1 134 1 . . . 1 1 135 1 . . . 1 1 136 1 . . . 1 1 137 1 . . . 1 1 138 1 . . . 1 1 139 1 . . . 1 1 140 1 . . . 1 1 141 1 . . . 1 1 142 1 . . . 1 1 143 1 . . . 1 1 144 1 . . . 1 1 145 1 . . . 1 1 146 1 . . . 1 1 147 1 . . . 1 1 148 1 . . . 1 1 149 1 . . . 1 1 150 1 . . . 1 1 151 1 . . . 1 1 152 1 . . . 1 1 153 1 . . . 1 1 154 1 . . . 1 1 155 1 . . . 1 1 156 1 . . . 1 1 157 1 . . . 1 1 158 1 . . . 1 1 159 1 . . . 1 1 160 1 . . . 1 1 161 1 . . . 1 1 162 1 . . . 1 1 163 1 . . . 1 1 164 1 . . . 1 1 165 1 . . . 1 1 166 1 . . . 1 1 167 1 . . . 1 1 168 1 . . . 1 1 169 1 . . . 1 1 170 1 . . . 1 1 171 1 . . . 1 1 172 1 . . . 1 1 173 1 . . . 1 1 174 1 . . . 1 1 175 1 . . . 1 1 176 1 . . . 1 1 177 1 . . . 1 1 178 1 . . . 1 1 179 1 . . . 1 1 180 1 . . . 1 1 181 1 . . . 1 1 182 1 . . . 1 1 183 1 . . . 1 1 184 1 . . . 1 1 185 1 . . . 1 1 186 1 . . . 1 1 187 1 . . . 1 1 188 1 . . . 1 1 189 1 . . . 1 1 190 1 . . . 1 1 191 1 . . . 1 1 192 1 . . . 1 1 193 1 . . . 1 1 194 1 . . . 1 1 195 1 . . . 1 1 196 1 . . . 1 1 197 1 . . . 1 1 198 1 . . . 1 1 199 1 . . . 1 1 200 1 . . . 1 1 201 1 . . . 1 1 202 1 . . . 1 1 203 1 . . . 1 1 204 1 . . . 1 1 205 1 . . . 1 1 206 1 . . . 1 1 207 1 . . . 1 1 208 1 . . . 1 1 209 1 . . . 1 1 210 1 . . . 1 1 211 1 . . . 1 1 212 1 . . . 1 1 213 1 . . . 1 1 214 1 . . . 1 1 215 1 . . . 1 1 216 1 . . . 1 1 217 1 . . . 1 1 218 1 . . . 1 1 219 1 . . . 1 1 220 1 . . . 1 1 221 1 . . . 1 1 222 1 . . . 1 1 223 1 . . . 1 1 224 1 . . . 1 1 225 1 . . . 1 1 226 1 . . . 1 1 227 1 . . . 1 1 228 1 . . . 1 1 229 1 . . . 1 1 230 1 . . . 1 1 231 1 . . . 1 1 232 1 . . . 1 1 233 1 . . . 1 1 234 1 . . . 1 1 235 1 . . . 1 1 236 1 . . . 1 1 237 1 . . . 1 1 238 1 . . . 1 1 239 1 . . . 1 1 240 1 . . . 1 1 241 1 . . . 1 1 242 1 . . . 1 1 243 1 . . . 1 1 244 1 . . . 1 1 245 1 . . . 1 1 246 1 . . . 1 1 247 1 . . . 1 1 248 1 . . . 1 1 249 1 . . . 1 1 250 1 . . . 1 1 251 1 . . . 1 1 252 1 . . . 1 1 253 1 . . . 1 1 254 1 . . . 1 1 255 1 . . . 1 1 256 1 . . . 1 1 257 1 . . . 1 1 258 1 . . . 1 1 259 1 . . . 1 1 260 1 . . . 1 1 261 1 . . . 1 1 262 1 . . . 1 1 263 1 . . . 1 1 264 1 . . . 1 1 265 1 . . . 1 1 266 1 . . . 1 1 267 1 . . . 1 1 268 1 . . . 1 1 269 1 . . . 1 1 270 1 . . . 1 1 271 1 . . . 1 1 272 1 . . . 1 1 273 1 . . . 1 1 274 1 . . . 1 1 275 1 . . . 1 1 276 1 . . . 1 1 277 1 . . . 1 1 278 1 . . . 1 1 279 1 . . . 1 1 280 1 . . . 1 1 281 1 . . . 1 1 282 1 . . . 1 1 283 1 . . . 1 1 284 1 . . . 1 1 285 1 . . . 1 1 286 1 . . . 1 1 287 1 . . . 1 1 288 1 . . . 1 1 289 1 . . . 1 1 290 1 . . . 1 1 291 1 . . . 1 1 292 1 . . . 1 1 293 1 . . . 1 1 294 1 . . . 1 1 295 1 . . . 1 1 296 1 . . . 1 1 297 1 . . . 1 1 298 1 . . . 1 1 299 1 . . . 1 1 300 1 . . . 1 1 301 1 . . . 1 1 302 1 . . . 1 1 303 1 . . . 1 1 304 1 . . . 1 1 305 1 . . . 1 1 306 1 . . . 1 1 307 1 . . . 1 1 308 1 . . . 1 1 309 1 . . . 1 1 310 1 . . . 1 1 311 1 . . . 1 1 312 1 . . . 1 1 313 1 . . . 1 1 314 1 . . . 1 1 315 1 . . . 1 1 316 1 . . . 1 1 317 1 . . . 1 1 318 1 . . . 1 1 319 1 . . . 1 1 320 1 . . . 1 1 321 1 . . . 1 1 322 1 . . . 1 1 323 1 . . . 1 1 324 1 . . . 1 1 325 1 . . . 1 1 326 1 . . . 1 1 327 1 . . . 1 1 328 1 . . . 1 1 329 1 . . . 1 1 330 1 . . . 1 1 331 1 . . . 1 1 332 1 . . . 1 1 333 1 . . . 1 1 334 1 . . . 1 1 335 1 . . . 1 1 336 1 . . . 1 1 337 1 . . . 1 1 338 1 . . . 1 1 339 1 . . . 1 1 340 1 . . . 1 1 341 1 . . . 1 1 342 1 . . . 1 1 343 1 . . . 1 1 344 1 . . . 1 1 345 1 . . . 1 1 346 1 . . . 1 1 347 1 . . . 1 1 348 1 . . . 1 1 349 1 . . . 1 1 350 1 . . . 1 1 351 1 . . . 1 1 352 1 . . . 1 1 353 1 . . . 1 1 354 1 . . . 1 1 355 1 . . . 1 1 356 1 . . . 1 1 357 1 . . . 1 1 358 1 . . . 1 1 359 1 . . . 1 1 360 1 . . . 1 1 361 1 . . . 1 1 362 1 . . . 1 1 363 1 . . . 1 1 364 1 . . . 1 1 365 1 . . . 1 1 366 1 . . . 1 1 367 1 . . . 1 1 368 1 . . . 1 1 369 1 . . . 1 1 370 1 . . . 1 1 371 1 . . . 1 1 372 1 . . . 1 1 373 1 . . . 1 1 374 1 . . . 1 1 375 1 . . . 1 1 376 1 . . . 1 1 377 1 . . . 1 1 378 1 . . . 1 1 379 1 . . . 1 1 380 1 . . . 1 1 381 1 . . . 1 1 382 1 . . . 1 1 383 1 . . . 1 1 384 1 . . . 1 1 385 1 . . . 1 1 386 1 . . . 1 1 387 1 . . . 1 1 388 1 . . . 1 1 389 1 . . . 1 1 390 1 . . . 1 1 391 1 . . . 1 1 392 1 . . . 1 1 393 1 . . . 1 1 394 1 . . . 1 1 395 1 . . . 1 1 396 1 . . . 1 1 397 1 . . . 1 1 398 1 . . . 1 1 399 1 . . . 1 1 400 1 . . . 1 1 401 1 . . . 1 1 402 1 . . . 1 1 403 1 . . . 1 1 404 1 . . . 1 1 405 1 . . . 1 1 406 1 . . . 1 1 407 1 . . . 1 1 408 1 . . . 1 1 409 1 . . . 1 1 410 1 . . . 1 1 411 1 . . . 1 1 412 1 . . . 1 1 413 1 . . . 1 1 414 1 . . . 1 1 415 1 . . . 1 1 416 1 . . . 1 1 417 1 . . . 1 1 418 1 . . . 1 1 419 1 . . . 1 1 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 3 THR HA . 2 . HA 1 1 1 1 2 1 1 4 ASN H . 3 . HN 1 1 2 1 1 1 1 3 THR MG . 2 . HG2+ 1 1 2 1 2 1 1 4 ASN H . 3 . HN 1 1 3 1 1 1 1 4 ASN HA . 3 . HA 1 1 3 1 2 1 1 5 THR H . 4 . HN 1 1 4 1 1 1 1 4 ASN QB . 3 . HB+ 1 1 4 1 2 1 1 5 THR H . 4 . HN 1 1 5 1 1 1 1 4 ASN QB . 3 . HB+ 1 1 5 1 2 1 1 6 TYR QE . 5 . HE+ 1 1 6 1 1 1 1 4 ASN QB . 3 . HB+ 1 1 6 1 2 1 1 47 ILE MG . 46 . HG2+ 1 1 7 1 1 1 1 4 ASN QD . 3 . HD2+ 1 1 7 1 2 1 1 47 ILE MD . 46 . HD1+ 1 1 8 1 1 1 1 5 THR HA . 4 . HA 1 1 8 1 2 1 1 6 TYR H . 5 . HN 1 1 9 1 1 1 1 5 THR HB . 4 . HB 1 1 9 1 2 1 1 6 TYR H . 5 . HN 1 1 10 1 1 1 1 5 THR MG . 4 . HG2+ 1 1 10 1 2 1 1 6 TYR H . 5 . HN 1 1 11 1 1 1 1 5 THR MG . 4 . HG2+ 1 1 11 1 2 1 1 22 TYR QD . 21 . HD+ 1 1 12 1 1 1 1 5 THR MG . 4 . HG2+ 1 1 12 1 2 1 1 22 TYR QE . 21 . HE+ 1 1 13 1 1 1 1 5 THR HB . 4 . HB 1 1 13 1 2 1 1 48 VAL QG . 47 . HG++ 1 1 14 1 1 1 1 5 THR MG . 4 . HG2+ 1 1 14 1 2 1 1 48 VAL QG . 47 . HG++ 1 1 15 1 1 1 1 5 THR HB . 4 . HB 1 1 15 1 2 1 1 49 LYS QB . 48 . HB+ 1 1 16 1 1 1 1 5 THR HB . 4 . HB 1 1 16 1 2 1 1 49 LYS QG . 48 . HG+ 1 1 17 1 1 1 1 5 THR HB . 4 . HB 1 1 17 1 2 1 1 49 LYS H . 48 . HN 1 1 18 1 1 1 1 5 THR H . 4 . HN 1 1 18 1 2 1 1 49 LYS QB . 48 . HB+ 1 1 19 1 1 1 1 6 TYR HA . 5 . HA 1 1 19 1 2 1 1 6 TYR QD . 5 . HD+ 1 1 20 1 1 1 1 6 TYR QB . 5 . HB+ 1 1 20 1 2 1 1 6 TYR QD . 5 . HD+ 1 1 21 1 1 1 1 6 TYR HA . 5 . HA 1 1 21 1 2 1 1 7 TYR H . 6 . HN 1 1 22 1 1 1 1 6 TYR QB . 5 . HB+ 1 1 22 1 2 1 1 7 TYR H . 6 . HN 1 1 23 1 1 1 1 6 TYR QD . 5 . HD+ 1 1 23 1 2 1 1 7 TYR H . 6 . HN 1 1 24 1 1 1 1 6 TYR QB . 5 . HB+ 1 1 24 1 2 1 1 45 LYS QD . 44 . HD+ 1 1 25 1 1 1 1 6 TYR QB . 5 . HB+ 1 1 25 1 2 1 1 45 LYS QG . 44 . HG+ 1 1 26 1 1 1 1 6 TYR QD . 5 . HD+ 1 1 26 1 2 1 1 45 LYS QB . 44 . HB+ 1 1 27 1 1 1 1 6 TYR QD . 5 . HD+ 1 1 27 1 2 1 1 45 LYS QD . 44 . HD+ 1 1 28 1 1 1 1 6 TYR QD . 5 . HD+ 1 1 28 1 2 1 1 45 LYS QG . 44 . HG+ 1 1 29 1 1 1 1 6 TYR QE . 5 . HE+ 1 1 29 1 2 1 1 45 LYS QG . 44 . HG+ 1 1 30 1 1 1 1 6 TYR HA . 5 . HA 1 1 30 1 2 1 1 46 LEU H . 45 . HN 1 1 31 1 1 1 1 6 TYR QD . 5 . HD+ 1 1 31 1 2 1 1 46 LEU H . 45 . HN 1 1 32 1 1 1 1 6 TYR HA . 5 . HA 1 1 32 1 2 1 1 47 ILE HA . 46 . HA 1 1 33 1 1 1 1 6 TYR QD . 5 . HD+ 1 1 33 1 2 1 1 47 ILE QG . 46 . HG1+ 1 1 34 1 1 1 1 6 TYR QD . 5 . HD+ 1 1 34 1 2 1 1 47 ILE H . 46 . HN 1 1 35 1 1 1 1 6 TYR QE . 5 . HE+ 1 1 35 1 2 1 1 47 ILE QG . 46 . HG1+ 1 1 36 1 1 1 1 6 TYR QE . 5 . HE+ 1 1 36 1 2 1 1 47 ILE MD . 46 . HD1+ 1 1 37 1 1 1 1 6 TYR HA . 5 . HA 1 1 37 1 2 1 1 48 VAL H . 47 . HN 1 1 38 1 1 1 1 6 TYR QB . 5 . HB+ 1 1 38 1 2 1 1 48 VAL H . 47 . HN 1 1 39 1 1 1 1 6 TYR H . 5 . HN 1 1 39 1 2 1 1 48 VAL QG . 47 . HG++ 1 1 40 1 1 1 1 6 TYR HA . 5 . HA 1 1 40 1 2 1 1 49 LYS H . 48 . HN 1 1 41 1 1 1 1 7 TYR HA . 6 . HA 1 1 41 1 2 1 1 8 THR H . 7 . HN 1 1 42 1 1 1 1 7 TYR QB . 6 . HB+ 1 1 42 1 2 1 1 8 THR H . 7 . HN 1 1 43 1 1 1 1 7 TYR QD . 6 . HD+ 1 1 43 1 2 1 1 8 THR H . 7 . HN 1 1 44 1 1 1 1 7 TYR H . 6 . HN 1 1 44 1 2 1 1 8 THR H . 7 . HN 1 1 45 1 1 1 1 7 TYR QD . 6 . HD+ 1 1 45 1 2 1 1 9 VAL QG . 8 . HG++ 1 1 46 1 1 1 1 7 TYR QE . 6 . HE+ 1 1 46 1 2 1 1 9 VAL HA . 8 . HA 1 1 47 1 1 1 1 7 TYR QE . 6 . HE+ 1 1 47 1 2 1 1 9 VAL QG . 8 . HG++ 1 1 48 1 1 1 1 7 TYR QE . 6 . HE+ 1 1 48 1 2 1 1 9 VAL H . 8 . HN 1 1 49 1 1 1 1 7 TYR QE . 6 . HE+ 1 1 49 1 2 1 1 10 LYS H . 9 . HN 1 1 50 1 1 1 1 7 TYR QD . 6 . HD+ 1 1 50 1 2 1 1 18 ILE MD . 17 . HD1+ 1 1 51 1 1 1 1 7 TYR QD . 6 . HD+ 1 1 51 1 2 1 1 18 ILE QG . 17 . HG1+ 1 1 52 1 1 1 1 7 TYR QD . 6 . HD+ 1 1 52 1 2 1 1 18 ILE MG . 17 . HG2+ 1 1 53 1 1 1 1 7 TYR QE . 6 . HE+ 1 1 53 1 2 1 1 18 ILE MD . 17 . HD1+ 1 1 54 1 1 1 1 7 TYR QE . 6 . HE+ 1 1 54 1 2 1 1 18 ILE MG . 17 . HG2+ 1 1 55 1 1 1 1 7 TYR QE . 6 . HE+ 1 1 55 1 2 1 1 18 ILE QG . 17 . HG1+ 1 1 56 1 1 1 1 7 TYR QB . 6 . HB+ 1 1 56 1 2 1 1 22 TYR QE . 21 . HE+ 1 1 57 1 1 1 1 7 TYR QD . 6 . HD+ 1 1 57 1 2 1 1 22 TYR QE . 21 . HE+ 1 1 58 1 1 1 1 7 TYR QE . 6 . HE+ 1 1 58 1 2 1 1 22 TYR QE . 21 . HE+ 1 1 59 1 1 1 1 7 TYR QB . 6 . HB+ 1 1 59 1 2 1 1 46 LEU H . 45 . HN 1 1 60 1 1 1 1 7 TYR QD . 6 . HD+ 1 1 60 1 2 1 1 46 LEU QD . 45 . HD++ 1 1 61 1 1 1 1 7 TYR QD . 6 . HD+ 1 1 61 1 2 1 1 46 LEU H . 45 . HN 1 1 62 1 1 1 1 7 TYR QE . 6 . HE+ 1 1 62 1 2 1 1 46 LEU QD . 45 . HD++ 1 1 63 1 1 1 1 7 TYR H . 6 . HN 1 1 63 1 2 1 1 46 LEU QB . 45 . HB+ 1 1 64 1 1 1 1 7 TYR H . 6 . HN 1 1 64 1 2 1 1 46 LEU QD . 45 . HD++ 1 1 65 1 1 1 1 7 TYR H . 6 . HN 1 1 65 1 2 1 1 47 ILE HA . 46 . HA 1 1 66 1 1 1 1 7 TYR QB . 6 . HB+ 1 1 66 1 2 1 1 48 VAL QG . 47 . HG++ 1 1 67 1 1 1 1 7 TYR H . 6 . HN 1 1 67 1 2 1 1 48 VAL QG . 47 . HG++ 1 1 68 1 1 1 1 8 THR HA . 7 . HA 1 1 68 1 2 1 1 9 VAL H . 8 . HN 1 1 69 1 1 1 1 8 THR HB . 7 . HB 1 1 69 1 2 1 1 9 VAL H . 8 . HN 1 1 70 1 1 1 1 8 THR MG . 7 . HG2+ 1 1 70 1 2 1 1 9 VAL H . 8 . HN 1 1 71 1 1 1 1 8 THR H . 7 . HN 1 1 71 1 2 1 1 9 VAL H . 8 . HN 1 1 72 1 1 1 1 8 THR MG . 7 . HG2+ 1 1 72 1 2 1 1 43 GLY H . 42 . HN 1 1 73 1 1 1 1 8 THR MG . 7 . HG2+ 1 1 73 1 2 1 1 43 GLY QA . 42 . HA+ 1 1 74 1 1 1 1 9 VAL HA . 8 . HA 1 1 74 1 2 1 1 10 LYS H . 9 . HN 1 1 75 1 1 1 1 9 VAL HB . 8 . HB 1 1 75 1 2 1 1 10 LYS H . 9 . HN 1 1 76 1 1 1 1 9 VAL QG . 8 . HG++ 1 1 76 1 2 1 1 10 LYS H . 9 . HN 1 1 77 1 1 1 1 9 VAL H . 8 . HN 1 1 77 1 2 1 1 10 LYS H . 9 . HN 1 1 78 1 1 1 1 9 VAL QG . 8 . HG++ 1 1 78 1 2 1 1 13 ASP QB . 12 . HB+ 1 1 79 1 1 1 1 9 VAL HA . 8 . HA 1 1 79 1 2 1 1 18 ILE MD . 17 . HD1+ 1 1 80 1 1 1 1 9 VAL H . 8 . HN 1 1 80 1 2 1 1 40 ILE MD . 39 . HD1+ 1 1 81 1 1 1 1 9 VAL QG . 8 . HG++ 1 1 81 1 2 1 1 41 PHE QB . 40 . HB+ 1 1 82 1 1 1 1 9 VAL HB . 8 . HB 1 1 82 1 2 1 1 42 VAL HA . 41 . HA 1 1 83 1 1 1 1 9 VAL QG . 8 . HG++ 1 1 83 1 2 1 1 42 VAL HA . 41 . HA 1 1 84 1 1 1 1 9 VAL QG . 8 . HG++ 1 1 84 1 2 1 1 42 VAL H . 41 . HN 1 1 85 1 1 1 1 9 VAL HB . 8 . HB 1 1 85 1 2 1 1 43 GLY H . 42 . HN 1 1 86 1 1 1 1 9 VAL QG . 8 . HG++ 1 1 86 1 2 1 1 43 GLY H . 42 . HN 1 1 87 1 1 1 1 9 VAL HB . 8 . HB 1 1 87 1 2 1 1 44 GLN QB . 43 . HB+ 1 1 88 1 1 1 1 9 VAL HB . 8 . HB 1 1 88 1 2 1 1 44 GLN H . 43 . HN 1 1 89 1 1 1 1 9 VAL QG . 8 . HG++ 1 1 89 1 2 1 1 44 GLN QB . 43 . HB+ 1 1 90 1 1 1 1 9 VAL QG . 8 . HG++ 1 1 90 1 2 1 1 44 GLN H . 43 . HN 1 1 91 1 1 1 1 9 VAL QG . 8 . HG++ 1 1 91 1 2 1 1 46 LEU QB . 45 . HB+ 1 1 92 1 1 1 1 9 VAL QG . 8 . HG++ 1 1 92 1 2 1 1 46 LEU HG . 45 . HG 1 1 93 1 1 1 1 9 VAL QG . 8 . HG++ 1 1 93 1 2 1 1 46 LEU H . 45 . HN 1 1 94 1 1 1 1 10 LYS HA . 9 . HA 1 1 94 1 2 1 1 11 SER H . 10 . HN 1 1 95 1 1 1 1 10 LYS QB . 9 . HB+ 1 1 95 1 2 1 1 11 SER QB . 10 . HB+ 1 1 96 1 1 1 1 10 LYS QB . 9 . HB+ 1 1 96 1 2 1 1 11 SER H . 10 . HN 1 1 97 1 1 1 1 10 LYS QD . 9 . HD+ 1 1 97 1 2 1 1 11 SER QB . 10 . HB+ 1 1 98 1 1 1 1 10 LYS QG . 9 . HG+ 1 1 98 1 2 1 1 11 SER H . 10 . HN 1 1 99 1 1 1 1 10 LYS H . 9 . HN 1 1 99 1 2 1 1 13 ASP QB . 12 . HB+ 1 1 100 1 1 1 1 10 LYS H . 9 . HN 1 1 100 1 2 1 1 13 ASP H . 12 . HN 1 1 101 1 1 1 1 10 LYS HA . 9 . HA 1 1 101 1 2 1 1 42 VAL QG . 41 . HG++ 1 1 102 1 1 1 1 10 LYS QB . 9 . HB+ 1 1 102 1 2 1 1 43 GLY H . 42 . HN 1 1 103 1 1 1 1 10 LYS QE . 9 . HE+ 1 1 103 1 2 1 1 43 GLY H . 42 . HN 1 1 104 1 1 1 1 11 SER HA . 10 . HA 1 1 104 1 2 1 1 12 GLY H . 11 . HN 1 1 105 1 1 1 1 11 SER QB . 10 . HB+ 1 1 105 1 2 1 1 12 GLY H . 11 . HN 1 1 106 1 1 1 1 11 SER HA . 10 . HA 1 1 106 1 2 1 1 13 ASP H . 12 . HN 1 1 107 1 1 1 1 11 SER QB . 10 . HB+ 1 1 107 1 2 1 1 13 ASP H . 12 . HN 1 1 108 1 1 1 1 11 SER HA . 10 . HA 1 1 108 1 2 1 1 42 VAL QG . 41 . HG++ 1 1 109 1 1 1 1 11 SER H . 10 . HN 1 1 109 1 2 1 1 42 VAL QG . 41 . HG++ 1 1 110 1 1 1 1 12 GLY QA . 11 . HA+ 1 1 110 1 2 1 1 13 ASP H . 12 . HN 1 1 111 1 1 1 1 12 GLY H . 11 . HN 1 1 111 1 2 1 1 42 VAL QG . 41 . HG++ 1 1 112 1 1 1 1 13 ASP QB . 12 . HB+ 1 1 112 1 2 1 1 14 THR H . 13 . HN 1 1 113 1 1 1 1 13 ASP H . 12 . HN 1 1 113 1 2 1 1 14 THR H . 13 . HN 1 1 114 1 1 1 1 13 ASP QB . 12 . HB+ 1 1 114 1 2 1 1 18 ILE MD . 17 . HD1+ 1 1 115 1 1 1 1 13 ASP H . 12 . HN 1 1 115 1 2 1 1 18 ILE MD . 17 . HD1+ 1 1 116 1 1 1 1 13 ASP H . 12 . HN 1 1 116 1 2 1 1 18 ILE QG . 17 . HG1+ 1 1 117 1 1 1 1 13 ASP H . 12 . HN 1 1 117 1 2 1 1 18 ILE MG . 17 . HG2+ 1 1 118 1 1 1 1 13 ASP QB . 12 . HB+ 1 1 118 1 2 1 1 40 ILE MD . 39 . HD1+ 1 1 119 1 1 1 1 13 ASP QB . 12 . HB+ 1 1 119 1 2 1 1 40 ILE MG . 39 . HG2+ 1 1 120 1 1 1 1 13 ASP H . 12 . HN 1 1 120 1 2 1 1 42 VAL QG . 41 . HG++ 1 1 121 1 1 1 1 14 THR HA . 13 . HA 1 1 121 1 2 1 1 15 LEU H . 14 . HN 1 1 122 1 1 1 1 14 THR HB . 13 . HB 1 1 122 1 2 1 1 15 LEU H . 14 . HN 1 1 123 1 1 1 1 14 THR MG . 13 . HG2+ 1 1 123 1 2 1 1 15 LEU H . 14 . HN 1 1 124 1 1 1 1 14 THR HB . 13 . HB 1 1 124 1 2 1 1 16 ASN H . 15 . HN 1 1 125 1 1 1 1 14 THR MG . 13 . HG2+ 1 1 125 1 2 1 1 16 ASN H . 15 . HN 1 1 126 1 1 1 1 14 THR HB . 13 . HB 1 1 126 1 2 1 1 17 LYS H . 16 . HN 1 1 127 1 1 1 1 14 THR MG . 13 . HG2+ 1 1 127 1 2 1 1 17 LYS H . 16 . HN 1 1 128 1 1 1 1 14 THR H . 13 . HN 1 1 128 1 2 1 1 17 LYS QB . 16 . HB+ 1 1 129 1 1 1 1 14 THR H . 13 . HN 1 1 129 1 2 1 1 17 LYS H . 16 . HN 1 1 130 1 1 1 1 14 THR H . 13 . HN 1 1 130 1 2 1 1 18 ILE HB . 17 . HB 1 1 131 1 1 1 1 14 THR H . 13 . HN 1 1 131 1 2 1 1 18 ILE MD . 17 . HD1+ 1 1 132 1 1 1 1 14 THR H . 13 . HN 1 1 132 1 2 1 1 18 ILE QG . 17 . HG1+ 1 1 133 1 1 1 1 14 THR H . 13 . HN 1 1 133 1 2 1 1 18 ILE MG . 17 . HG2+ 1 1 134 1 1 1 1 14 THR H . 13 . HN 1 1 134 1 2 1 1 18 ILE H . 17 . HN 1 1 135 1 1 1 1 14 THR HA . 13 . HA 1 1 135 1 2 1 1 40 ILE MD . 39 . HD1+ 1 1 136 1 1 1 1 14 THR H . 13 . HN 1 1 136 1 2 1 1 40 ILE MD . 39 . HD1+ 1 1 137 1 1 1 1 15 LEU HA . 14 . HA 1 1 137 1 2 1 1 16 ASN H . 15 . HN 1 1 138 1 1 1 1 15 LEU QB . 14 . HB+ 1 1 138 1 2 1 1 16 ASN H . 15 . HN 1 1 139 1 1 1 1 15 LEU QD . 14 . HD++ 1 1 139 1 2 1 1 16 ASN H . 15 . HN 1 1 140 1 1 1 1 15 LEU HG . 14 . HG 1 1 140 1 2 1 1 16 ASN H . 15 . HN 1 1 141 1 1 1 1 15 LEU H . 14 . HN 1 1 141 1 2 1 1 16 ASN H . 15 . HN 1 1 142 1 1 1 1 15 LEU HA . 14 . HA 1 1 142 1 2 1 1 18 ILE MG . 17 . HG2+ 1 1 143 1 1 1 1 15 LEU HA . 14 . HA 1 1 143 1 2 1 1 18 ILE MD . 17 . HD1+ 1 1 144 1 1 1 1 15 LEU HA . 14 . HA 1 1 144 1 2 1 1 18 ILE H . 17 . HN 1 1 145 1 1 1 1 15 LEU QB . 14 . HB+ 1 1 145 1 2 1 1 18 ILE MG . 17 . HG2+ 1 1 146 1 1 1 1 15 LEU QD . 14 . HD++ 1 1 146 1 2 1 1 18 ILE MD . 17 . HD1+ 1 1 147 1 1 1 1 15 LEU HA . 14 . HA 1 1 147 1 2 1 1 40 ILE MD . 39 . HD1+ 1 1 148 1 1 1 1 15 LEU QB . 14 . HB+ 1 1 148 1 2 1 1 40 ILE MD . 39 . HD1+ 1 1 149 1 1 1 1 15 LEU H . 14 . HN 1 1 149 1 2 1 1 40 ILE MD . 39 . HD1+ 1 1 150 1 1 1 1 15 LEU H . 14 . HN 1 1 150 1 2 1 1 40 ILE MG . 39 . HG2+ 1 1 151 1 1 1 1 16 ASN HA . 15 . HA 1 1 151 1 2 1 1 17 LYS H . 16 . HN 1 1 152 1 1 1 1 16 ASN QB . 15 . HB+ 1 1 152 1 2 1 1 17 LYS H . 16 . HN 1 1 153 1 1 1 1 16 ASN H . 15 . HN 1 1 153 1 2 1 1 17 LYS H . 16 . HN 1 1 154 1 1 1 1 16 ASN HA . 15 . HA 1 1 154 1 2 1 1 19 ALA MB . 18 . HB+ 1 1 155 1 1 1 1 16 ASN HA . 15 . HA 1 1 155 1 2 1 1 19 ALA H . 18 . HN 1 1 156 1 1 1 1 16 ASN HA . 15 . HA 1 1 156 1 2 1 1 26 VAL QG . 25 . HG++ 1 1 157 1 1 1 1 16 ASN QB . 15 . HB+ 1 1 157 1 2 1 1 26 VAL QG . 25 . HG++ 1 1 158 1 1 1 1 16 ASN QD . 15 . HD2+ 1 1 158 1 2 1 1 26 VAL QG . 25 . HG++ 1 1 159 1 1 1 1 16 ASN H . 15 . HN 1 1 159 1 2 1 1 26 VAL QG . 25 . HG++ 1 1 160 1 1 1 1 17 LYS HA . 16 . HA 1 1 160 1 2 1 1 18 ILE H . 17 . HN 1 1 161 1 1 1 1 17 LYS QB . 16 . HB+ 1 1 161 1 2 1 1 18 ILE H . 17 . HN 1 1 162 1 1 1 1 17 LYS H . 16 . HN 1 1 162 1 2 1 1 18 ILE H . 17 . HN 1 1 163 1 1 1 1 17 LYS HA . 16 . HA 1 1 163 1 2 1 1 20 ALA H . 19 . HN 1 1 164 1 1 1 1 17 LYS H . 16 . HN 1 1 164 1 2 1 1 40 ILE MD . 39 . HD1+ 1 1 165 1 1 1 1 17 LYS H . 16 . HN 1 1 165 1 2 1 1 40 ILE MG . 39 . HG2+ 1 1 166 1 1 1 1 18 ILE HA . 17 . HA 1 1 166 1 2 1 1 19 ALA H . 18 . HN 1 1 167 1 1 1 1 18 ILE HB . 17 . HB 1 1 167 1 2 1 1 19 ALA H . 18 . HN 1 1 168 1 1 1 1 18 ILE MD . 17 . HD1+ 1 1 168 1 2 1 1 19 ALA H . 18 . HN 1 1 169 1 1 1 1 18 ILE MG . 17 . HG2+ 1 1 169 1 2 1 1 19 ALA H . 18 . HN 1 1 170 1 1 1 1 18 ILE H . 17 . HN 1 1 170 1 2 1 1 19 ALA H . 18 . HN 1 1 171 1 1 1 1 18 ILE HA . 17 . HA 1 1 171 1 2 1 1 21 GLN QB . 20 . HB+ 1 1 172 1 1 1 1 18 ILE HA . 17 . HA 1 1 172 1 2 1 1 21 GLN H . 20 . HN 1 1 173 1 1 1 1 18 ILE HA . 17 . HA 1 1 173 1 2 1 1 22 TYR H . 21 . HN 1 1 174 1 1 1 1 18 ILE MG . 17 . HG2+ 1 1 174 1 2 1 1 22 TYR QD . 21 . HD+ 1 1 175 1 1 1 1 18 ILE MG . 17 . HG2+ 1 1 175 1 2 1 1 22 TYR QE . 21 . HE+ 1 1 176 1 1 1 1 18 ILE MG . 17 . HG2+ 1 1 176 1 2 1 1 22 TYR H . 21 . HN 1 1 177 1 1 1 1 18 ILE QG . 17 . HG1+ 1 1 177 1 2 1 1 40 ILE MG . 39 . HG2+ 1 1 178 1 1 1 1 18 ILE H . 17 . HN 1 1 178 1 2 1 1 40 ILE MD . 39 . HD1+ 1 1 179 1 1 1 1 19 ALA HA . 18 . HA 1 1 179 1 2 1 1 20 ALA H . 19 . HN 1 1 180 1 1 1 1 19 ALA MB . 18 . HB+ 1 1 180 1 2 1 1 20 ALA H . 19 . HN 1 1 181 1 1 1 1 19 ALA H . 18 . HN 1 1 181 1 2 1 1 20 ALA H . 19 . HN 1 1 182 1 1 1 1 19 ALA MB . 18 . HB+ 1 1 182 1 2 1 1 21 GLN H . 20 . HN 1 1 183 1 1 1 1 19 ALA HA . 18 . HA 1 1 183 1 2 1 1 22 TYR H . 21 . HN 1 1 184 1 1 1 1 19 ALA HA . 18 . HA 1 1 184 1 2 1 1 24 VAL H . 23 . HN 1 1 185 1 1 1 1 19 ALA HA . 18 . HA 1 1 185 1 2 1 1 24 VAL QG . 23 . HG++ 1 1 186 1 1 1 1 19 ALA MB . 18 . HB+ 1 1 186 1 2 1 1 24 VAL QG . 23 . HG++ 1 1 187 1 1 1 1 19 ALA MB . 18 . HB+ 1 1 187 1 2 1 1 24 VAL H . 23 . HN 1 1 188 1 1 1 1 19 ALA H . 18 . HN 1 1 188 1 2 1 1 24 VAL QG . 23 . HG++ 1 1 189 1 1 1 1 19 ALA MB . 18 . HB+ 1 1 189 1 2 1 1 26 VAL QG . 25 . HG++ 1 1 190 1 1 1 1 19 ALA MB . 18 . HB+ 1 1 190 1 2 1 1 26 VAL H . 25 . HN 1 1 191 1 1 1 1 19 ALA MB . 18 . HB+ 1 1 191 1 2 1 1 26 VAL HA . 25 . HA 1 1 192 1 1 1 1 19 ALA HA . 18 . HA 1 1 192 1 2 1 1 29 LEU QD . 28 . HD++ 1 1 193 1 1 1 1 19 ALA MB . 18 . HB+ 1 1 193 1 2 1 1 29 LEU QD . 28 . HD++ 1 1 194 1 1 1 1 19 ALA H . 18 . HN 1 1 194 1 2 1 1 29 LEU QD . 28 . HD++ 1 1 195 1 1 1 1 20 ALA HA . 19 . HA 1 1 195 1 2 1 1 21 GLN H . 20 . HN 1 1 196 1 1 1 1 20 ALA MB . 19 . HB+ 1 1 196 1 2 1 1 21 GLN HA . 20 . HA 1 1 197 1 1 1 1 20 ALA MB . 19 . HB+ 1 1 197 1 2 1 1 21 GLN H . 20 . HN 1 1 198 1 1 1 1 20 ALA H . 19 . HN 1 1 198 1 2 1 1 21 GLN H . 20 . HN 1 1 199 1 1 1 1 20 ALA HA . 19 . HA 1 1 199 1 2 1 1 22 TYR H . 21 . HN 1 1 200 1 1 1 1 20 ALA MB . 19 . HB+ 1 1 200 1 2 1 1 22 TYR H . 21 . HN 1 1 201 1 1 1 1 20 ALA HA . 19 . HA 1 1 201 1 2 1 1 23 GLY H . 22 . HN 1 1 202 1 1 1 1 20 ALA MB . 19 . HB+ 1 1 202 1 2 1 1 23 GLY H . 22 . HN 1 1 203 1 1 1 1 20 ALA HA . 19 . HA 1 1 203 1 2 1 1 24 VAL H . 23 . HN 1 1 204 1 1 1 1 20 ALA MB . 19 . HB+ 1 1 204 1 2 1 1 26 VAL H . 25 . HN 1 1 205 1 1 1 1 21 GLN HA . 20 . HA 1 1 205 1 2 1 1 22 TYR H . 21 . HN 1 1 206 1 1 1 1 21 GLN QB . 20 . HB+ 1 1 206 1 2 1 1 22 TYR H . 21 . HN 1 1 207 1 1 1 1 21 GLN QG . 20 . HG+ 1 1 207 1 2 1 1 22 TYR H . 21 . HN 1 1 208 1 1 1 1 21 GLN H . 20 . HN 1 1 208 1 2 1 1 22 TYR H . 21 . HN 1 1 209 1 1 1 1 21 GLN HA . 20 . HA 1 1 209 1 2 1 1 23 GLY H . 22 . HN 1 1 210 1 1 1 1 22 TYR HA . 21 . HA 1 1 210 1 2 1 1 23 GLY H . 22 . HN 1 1 211 1 1 1 1 22 TYR QB . 21 . HB+ 1 1 211 1 2 1 1 23 GLY H . 22 . HN 1 1 212 1 1 1 1 22 TYR QD . 21 . HD+ 1 1 212 1 2 1 1 23 GLY H . 22 . HN 1 1 213 1 1 1 1 22 TYR H . 21 . HN 1 1 213 1 2 1 1 23 GLY H . 22 . HN 1 1 214 1 1 1 1 22 TYR QB . 21 . HB+ 1 1 214 1 2 1 1 24 VAL QG . 23 . HG++ 1 1 215 1 1 1 1 22 TYR QB . 21 . HB+ 1 1 215 1 2 1 1 24 VAL H . 23 . HN 1 1 216 1 1 1 1 22 TYR QD . 21 . HD+ 1 1 216 1 2 1 1 24 VAL H . 23 . HN 1 1 217 1 1 1 1 22 TYR H . 21 . HN 1 1 217 1 2 1 1 24 VAL QG . 23 . HG++ 1 1 218 1 1 1 1 22 TYR QB . 21 . HB+ 1 1 218 1 2 1 1 48 VAL HB . 47 . HB 1 1 219 1 1 1 1 22 TYR QB . 21 . HB+ 1 1 219 1 2 1 1 48 VAL QG . 47 . HG++ 1 1 220 1 1 1 1 22 TYR QD . 21 . HD+ 1 1 220 1 2 1 1 48 VAL HB . 47 . HB 1 1 221 1 1 1 1 22 TYR QD . 21 . HD+ 1 1 221 1 2 1 1 48 VAL QG . 47 . HG++ 1 1 222 1 1 1 1 22 TYR QE . 21 . HE+ 1 1 222 1 2 1 1 48 VAL HA . 47 . HA 1 1 223 1 1 1 1 22 TYR QE . 21 . HE+ 1 1 223 1 2 1 1 48 VAL HB . 47 . HB 1 1 224 1 1 1 1 22 TYR QE . 21 . HE+ 1 1 224 1 2 1 1 48 VAL QG . 47 . HG++ 1 1 225 1 1 1 1 23 GLY QA . 22 . HA+ 1 1 225 1 2 1 1 24 VAL H . 23 . HN 1 1 226 1 1 1 1 23 GLY H . 22 . HN 1 1 226 1 2 1 1 24 VAL QG . 23 . HG++ 1 1 227 1 1 1 1 24 VAL HA . 23 . HA 1 1 227 1 2 1 1 25 SER H . 24 . HN 1 1 228 1 1 1 1 24 VAL HB . 23 . HB 1 1 228 1 2 1 1 25 SER H . 24 . HN 1 1 229 1 1 1 1 24 VAL QG . 23 . HG++ 1 1 229 1 2 1 1 25 SER H . 24 . HN 1 1 230 1 1 1 1 24 VAL QG . 23 . HG++ 1 1 230 1 2 1 1 26 VAL HA . 25 . HA 1 1 231 1 1 1 1 24 VAL HB . 23 . HB 1 1 231 1 2 1 1 28 ASN QB . 27 . HB+ 1 1 232 1 1 1 1 24 VAL QG . 23 . HG++ 1 1 232 1 2 1 1 28 ASN QB . 27 . HB+ 1 1 233 1 1 1 1 24 VAL QG . 23 . HG++ 1 1 233 1 2 1 1 28 ASN QD . 27 . HD2+ 1 1 234 1 1 1 1 24 VAL QG . 23 . HG++ 1 1 234 1 2 1 1 29 LEU H . 28 . HN 1 1 235 1 1 1 1 24 VAL HB . 23 . HB 1 1 235 1 2 1 1 32 TRP HH2 . 31 . HH2 1 1 236 1 1 1 1 24 VAL QG . 23 . HG++ 1 1 236 1 2 1 1 32 TRP HE3 . 31 . HE3 1 1 237 1 1 1 1 24 VAL QG . 23 . HG++ 1 1 237 1 2 1 1 32 TRP HH2 . 31 . HH2 1 1 238 1 1 1 1 24 VAL QG . 23 . HG++ 1 1 238 1 2 1 1 32 TRP HZ3 . 31 . HZ3 1 1 239 1 1 1 1 24 VAL QG . 23 . HG++ 1 1 239 1 2 1 1 48 VAL QG . 47 . HG++ 1 1 240 1 1 1 1 25 SER HA . 24 . HA 1 1 240 1 2 1 1 26 VAL H . 25 . HN 1 1 241 1 1 1 1 25 SER QB . 24 . HB+ 1 1 241 1 2 1 1 26 VAL H . 25 . HN 1 1 242 1 1 1 1 25 SER HA . 24 . HA 1 1 242 1 2 1 1 27 ALA H . 26 . HN 1 1 243 1 1 1 1 25 SER QB . 24 . HB+ 1 1 243 1 2 1 1 27 ALA MB . 26 . HB+ 1 1 244 1 1 1 1 25 SER QB . 24 . HB+ 1 1 244 1 2 1 1 27 ALA H . 26 . HN 1 1 245 1 1 1 1 25 SER QB . 24 . HB+ 1 1 245 1 2 1 1 28 ASN H . 27 . HN 1 1 246 1 1 1 1 25 SER H . 24 . HN 1 1 246 1 2 1 1 28 ASN QB . 27 . HB+ 1 1 247 1 1 1 1 25 SER H . 24 . HN 1 1 247 1 2 1 1 28 ASN QD . 27 . HD2+ 1 1 248 1 1 1 1 25 SER H . 24 . HN 1 1 248 1 2 1 1 28 ASN H . 27 . HN 1 1 249 1 1 1 1 26 VAL HA . 25 . HA 1 1 249 1 2 1 1 27 ALA H . 26 . HN 1 1 250 1 1 1 1 26 VAL HB . 25 . HB 1 1 250 1 2 1 1 27 ALA H . 26 . HN 1 1 251 1 1 1 1 26 VAL QG . 25 . HG++ 1 1 251 1 2 1 1 27 ALA H . 26 . HN 1 1 252 1 1 1 1 26 VAL H . 25 . HN 1 1 252 1 2 1 1 27 ALA MB . 26 . HB+ 1 1 253 1 1 1 1 26 VAL H . 25 . HN 1 1 253 1 2 1 1 27 ALA H . 26 . HN 1 1 254 1 1 1 1 26 VAL HA . 25 . HA 1 1 254 1 2 1 1 28 ASN H . 27 . HN 1 1 255 1 1 1 1 26 VAL QG . 25 . HG++ 1 1 255 1 2 1 1 28 ASN H . 27 . HN 1 1 256 1 1 1 1 26 VAL HA . 25 . HA 1 1 256 1 2 1 1 29 LEU HG . 28 . HG 1 1 257 1 1 1 1 26 VAL HA . 25 . HA 1 1 257 1 2 1 1 29 LEU H . 28 . HN 1 1 258 1 1 1 1 26 VAL HA . 25 . HA 1 1 258 1 2 1 1 29 LEU QB . 28 . HB+ 1 1 259 1 1 1 1 26 VAL HA . 25 . HA 1 1 259 1 2 1 1 29 LEU QD . 28 . HD++ 1 1 260 1 1 1 1 26 VAL HA . 25 . HA 1 1 260 1 2 1 1 30 ARG QD . 29 . HD+ 1 1 261 1 1 1 1 26 VAL HA . 25 . HA 1 1 261 1 2 1 1 30 ARG H . 29 . HN 1 1 262 1 1 1 1 26 VAL QG . 25 . HG++ 1 1 262 1 2 1 1 30 ARG QG . 29 . HG+ 1 1 263 1 1 1 1 26 VAL QG . 25 . HG++ 1 1 263 1 2 1 1 30 ARG QD . 29 . HD+ 1 1 264 1 1 1 1 26 VAL QG . 25 . HG++ 1 1 264 1 2 1 1 30 ARG HE . 29 . HE 1 1 265 1 1 1 1 27 ALA HA . 26 . HA 1 1 265 1 2 1 1 28 ASN H . 27 . HN 1 1 266 1 1 1 1 27 ALA MB . 26 . HB+ 1 1 266 1 2 1 1 28 ASN H . 27 . HN 1 1 267 1 1 1 1 27 ALA H . 26 . HN 1 1 267 1 2 1 1 28 ASN QB . 27 . HB+ 1 1 268 1 1 1 1 27 ALA H . 26 . HN 1 1 268 1 2 1 1 28 ASN H . 27 . HN 1 1 269 1 1 1 1 27 ALA HA . 26 . HA 1 1 269 1 2 1 1 29 LEU H . 28 . HN 1 1 270 1 1 1 1 27 ALA HA . 26 . HA 1 1 270 1 2 1 1 30 ARG QD . 29 . HD+ 1 1 271 1 1 1 1 27 ALA HA . 26 . HA 1 1 271 1 2 1 1 30 ARG H . 29 . HN 1 1 272 1 1 1 1 28 ASN HA . 27 . HA 1 1 272 1 2 1 1 29 LEU H . 28 . HN 1 1 273 1 1 1 1 28 ASN QB . 27 . HB+ 1 1 273 1 2 1 1 29 LEU H . 28 . HN 1 1 274 1 1 1 1 28 ASN H . 27 . HN 1 1 274 1 2 1 1 29 LEU H . 28 . HN 1 1 275 1 1 1 1 28 ASN HA . 27 . HA 1 1 275 1 2 1 1 31 SER H . 30 . HN 1 1 276 1 1 1 1 28 ASN HA . 27 . HA 1 1 276 1 2 1 1 32 TRP HE1 . 31 . HE1 1 1 277 1 1 1 1 28 ASN QB . 27 . HB+ 1 1 277 1 2 1 1 32 TRP HZ2 . 31 . HZ2 1 1 278 1 1 1 1 28 ASN QB . 27 . HB+ 1 1 278 1 2 1 1 32 TRP HE1 . 31 . HE1 1 1 279 1 1 1 1 29 LEU HA . 28 . HA 1 1 279 1 2 1 1 30 ARG H . 29 . HN 1 1 280 1 1 1 1 29 LEU QB . 28 . HB+ 1 1 280 1 2 1 1 30 ARG H . 29 . HN 1 1 281 1 1 1 1 29 LEU QD . 28 . HD++ 1 1 281 1 2 1 1 30 ARG H . 29 . HN 1 1 282 1 1 1 1 29 LEU H . 28 . HN 1 1 282 1 2 1 1 30 ARG H . 29 . HN 1 1 283 1 1 1 1 29 LEU HA . 28 . HA 1 1 283 1 2 1 1 32 TRP HE3 . 31 . HE3 1 1 284 1 1 1 1 29 LEU HA . 28 . HA 1 1 284 1 2 1 1 32 TRP H . 31 . HN 1 1 285 1 1 1 1 29 LEU QD . 28 . HD++ 1 1 285 1 2 1 1 32 TRP H . 31 . HN 1 1 286 1 1 1 1 29 LEU HA . 28 . HA 1 1 286 1 2 1 1 33 ASN QD . 32 . HD2+ 1 1 287 1 1 1 1 29 LEU QB . 28 . HB+ 1 1 287 1 2 1 1 33 ASN QD . 32 . HD2+ 1 1 288 1 1 1 1 29 LEU QD . 28 . HD++ 1 1 288 1 2 1 1 33 ASN QD . 32 . HD2+ 1 1 289 1 1 1 1 29 LEU QD . 28 . HD++ 1 1 289 1 2 1 1 40 ILE MD . 39 . HD1+ 1 1 290 1 1 1 1 29 LEU QD . 28 . HD++ 1 1 290 1 2 1 1 48 VAL HA . 47 . HA 1 1 291 1 1 1 1 29 LEU QD . 28 . HD++ 1 1 291 1 2 1 1 48 VAL QG . 47 . HG++ 1 1 292 1 1 1 1 29 LEU QD . 28 . HD++ 1 1 292 1 2 1 1 48 VAL HB . 47 . HB 1 1 293 1 1 1 1 30 ARG HA . 29 . HA 1 1 293 1 2 1 1 31 SER H . 30 . HN 1 1 294 1 1 1 1 30 ARG QB . 29 . HB+ 1 1 294 1 2 1 1 31 SER H . 30 . HN 1 1 295 1 1 1 1 30 ARG QG . 29 . HG+ 1 1 295 1 2 1 1 31 SER H . 30 . HN 1 1 296 1 1 1 1 30 ARG H . 29 . HN 1 1 296 1 2 1 1 31 SER H . 30 . HN 1 1 297 1 1 1 1 30 ARG HA . 29 . HA 1 1 297 1 2 1 1 33 ASN H . 32 . HN 1 1 298 1 1 1 1 30 ARG HA . 29 . HA 1 1 298 1 2 1 1 35 ILE MD . 34 . HD1+ 1 1 299 1 1 1 1 30 ARG QD . 29 . HD+ 1 1 299 1 2 1 1 37 GLY H . 36 . HN 1 1 300 1 1 1 1 30 ARG HE . 29 . HE 1 1 300 1 2 1 1 37 GLY QA . 36 . HA+ 1 1 301 1 1 1 1 30 ARG HE . 29 . HE 1 1 301 1 2 1 1 37 GLY H . 36 . HN 1 1 302 1 1 1 1 31 SER HA . 30 . HA 1 1 302 1 2 1 1 32 TRP H . 31 . HN 1 1 303 1 1 1 1 31 SER QB . 30 . HB+ 1 1 303 1 2 1 1 32 TRP H . 31 . HN 1 1 304 1 1 1 1 31 SER H . 30 . HN 1 1 304 1 2 1 1 32 TRP H . 31 . HN 1 1 305 1 1 1 1 31 SER HA . 30 . HA 1 1 305 1 2 1 1 34 GLY H . 33 . HN 1 1 306 1 1 1 1 32 TRP H . 31 . HN 1 1 306 1 2 1 1 32 TRP HE3 . 31 . HE3 1 1 307 1 1 1 1 32 TRP HA . 31 . HA 1 1 307 1 2 1 1 33 ASN H . 32 . HN 1 1 308 1 1 1 1 32 TRP QB . 31 . HB+ 1 1 308 1 2 1 1 33 ASN QD . 32 . HD2+ 1 1 309 1 1 1 1 32 TRP QB . 31 . HB+ 1 1 309 1 2 1 1 33 ASN H . 32 . HN 1 1 310 1 1 1 1 32 TRP H . 31 . HN 1 1 310 1 2 1 1 33 ASN H . 32 . HN 1 1 311 1 1 1 1 32 TRP QB . 31 . HB+ 1 1 311 1 2 1 1 47 ILE MD . 46 . HD1+ 1 1 312 1 1 1 1 32 TRP QB . 31 . HB+ 1 1 312 1 2 1 1 47 ILE QG . 46 . HG1+ 1 1 313 1 1 1 1 32 TRP QB . 31 . HB+ 1 1 313 1 2 1 1 47 ILE MG . 46 . HG2+ 1 1 314 1 1 1 1 32 TRP QB . 31 . HB+ 1 1 314 1 2 1 1 47 ILE HB . 46 . HB 1 1 315 1 1 1 1 32 TRP HE1 . 31 . HE1 1 1 315 1 2 1 1 47 ILE MG . 46 . HG2+ 1 1 316 1 1 1 1 32 TRP HE3 . 31 . HE3 1 1 316 1 2 1 1 47 ILE MG . 46 . HG2+ 1 1 317 1 1 1 1 32 TRP HZ3 . 31 . HZ3 1 1 317 1 2 1 1 49 LYS HA . 48 . HA 1 1 318 1 1 1 1 33 ASN HA . 32 . HA 1 1 318 1 2 1 1 34 GLY H . 33 . HN 1 1 319 1 1 1 1 33 ASN QB . 32 . HB+ 1 1 319 1 2 1 1 34 GLY H . 33 . HN 1 1 320 1 1 1 1 33 ASN H . 32 . HN 1 1 320 1 2 1 1 34 GLY H . 33 . HN 1 1 321 1 1 1 1 33 ASN QB . 32 . HB+ 1 1 321 1 2 1 1 35 ILE MD . 34 . HD1+ 1 1 322 1 1 1 1 33 ASN QB . 32 . HB+ 1 1 322 1 2 1 1 35 ILE H . 34 . HN 1 1 323 1 1 1 1 33 ASN QB . 32 . HB+ 1 1 323 1 2 1 1 35 ILE QG . 34 . HG1+ 1 1 324 1 1 1 1 33 ASN H . 32 . HN 1 1 324 1 2 1 1 35 ILE MD . 34 . HD1+ 1 1 325 1 1 1 1 33 ASN QB . 32 . HB+ 1 1 325 1 2 1 1 46 LEU QD . 45 . HD++ 1 1 326 1 1 1 1 33 ASN QD . 32 . HD2+ 1 1 326 1 2 1 1 46 LEU QB . 45 . HB+ 1 1 327 1 1 1 1 33 ASN QD . 32 . HD2+ 1 1 327 1 2 1 1 46 LEU QD . 45 . HD++ 1 1 328 1 1 1 1 33 ASN QD . 32 . HD2+ 1 1 328 1 2 1 1 46 LEU HG . 45 . HG 1 1 329 1 1 1 1 33 ASN QD . 32 . HD2+ 1 1 329 1 2 1 1 47 ILE HB . 46 . HB 1 1 330 1 1 1 1 33 ASN QD . 32 . HD2+ 1 1 330 1 2 1 1 47 ILE MG . 46 . HG2+ 1 1 331 1 1 1 1 33 ASN QD . 32 . HD2+ 1 1 331 1 2 1 1 47 ILE H . 46 . HN 1 1 332 1 1 1 1 33 ASN QD . 32 . HD2+ 1 1 332 1 2 1 1 47 ILE MD . 46 . HD1+ 1 1 333 1 1 1 1 33 ASN QD . 32 . HD2+ 1 1 333 1 2 1 1 47 ILE HA . 46 . HA 1 1 334 1 1 1 1 34 GLY QA . 33 . HA+ 1 1 334 1 2 1 1 35 ILE H . 34 . HN 1 1 335 1 1 1 1 34 GLY H . 33 . HN 1 1 335 1 2 1 1 35 ILE HB . 34 . HB 1 1 336 1 1 1 1 34 GLY H . 33 . HN 1 1 336 1 2 1 1 35 ILE MD . 34 . HD1+ 1 1 337 1 1 1 1 34 GLY H . 33 . HN 1 1 337 1 2 1 1 35 ILE QG . 34 . HG1+ 1 1 338 1 1 1 1 34 GLY H . 33 . HN 1 1 338 1 2 1 1 35 ILE MG . 34 . HG2+ 1 1 339 1 1 1 1 35 ILE HA . 34 . HA 1 1 339 1 2 1 1 36 SER H . 35 . HN 1 1 340 1 1 1 1 35 ILE HB . 34 . HB 1 1 340 1 2 1 1 36 SER H . 35 . HN 1 1 341 1 1 1 1 35 ILE QG . 34 . HG1+ 1 1 341 1 2 1 1 36 SER H . 35 . HN 1 1 342 1 1 1 1 35 ILE MG . 34 . HG2+ 1 1 342 1 2 1 1 36 SER QB . 35 . HB+ 1 1 343 1 1 1 1 35 ILE MG . 34 . HG2+ 1 1 343 1 2 1 1 36 SER H . 35 . HN 1 1 344 1 1 1 1 35 ILE H . 34 . HN 1 1 344 1 2 1 1 36 SER H . 35 . HN 1 1 345 1 1 1 1 35 ILE MD . 34 . HD1+ 1 1 345 1 2 1 1 37 GLY H . 36 . HN 1 1 346 1 1 1 1 35 ILE MG . 34 . HG2+ 1 1 346 1 2 1 1 37 GLY H . 36 . HN 1 1 347 1 1 1 1 35 ILE MG . 34 . HG2+ 1 1 347 1 2 1 1 38 ASP H . 37 . HN 1 1 348 1 1 1 1 35 ILE MG . 34 . HG2+ 1 1 348 1 2 1 1 39 LEU H . 38 . HN 1 1 349 1 1 1 1 35 ILE MD . 34 . HD1+ 1 1 349 1 2 1 1 44 GLN QE . 43 . HE2+ 1 1 350 1 1 1 1 35 ILE QG . 34 . HG1+ 1 1 350 1 2 1 1 44 GLN QE . 43 . HE2+ 1 1 351 1 1 1 1 35 ILE MG . 34 . HG2+ 1 1 351 1 2 1 1 44 GLN QE . 43 . HE2+ 1 1 352 1 1 1 1 36 SER HA . 35 . HA 1 1 352 1 2 1 1 37 GLY H . 36 . HN 1 1 353 1 1 1 1 36 SER QB . 35 . HB+ 1 1 353 1 2 1 1 37 GLY H . 36 . HN 1 1 354 1 1 1 1 37 GLY QA . 36 . HA+ 1 1 354 1 2 1 1 38 ASP H . 37 . HN 1 1 355 1 1 1 1 37 GLY QA . 36 . HA+ 1 1 355 1 2 1 1 39 LEU H . 38 . HN 1 1 356 1 1 1 1 38 ASP QB . 37 . HB+ 1 1 356 1 2 1 1 39 LEU H . 38 . HN 1 1 357 1 1 1 1 38 ASP H . 37 . HN 1 1 357 1 2 1 1 39 LEU HA . 38 . HA 1 1 358 1 1 1 1 38 ASP H . 37 . HN 1 1 358 1 2 1 1 39 LEU QB . 38 . HB+ 1 1 359 1 1 1 1 38 ASP H . 37 . HN 1 1 359 1 2 1 1 39 LEU H . 38 . HN 1 1 360 1 1 1 1 39 LEU HA . 38 . HA 1 1 360 1 2 1 1 40 ILE H . 39 . HN 1 1 361 1 1 1 1 39 LEU QB . 38 . HB+ 1 1 361 1 2 1 1 40 ILE H . 39 . HN 1 1 362 1 1 1 1 39 LEU QD . 38 . HD++ 1 1 362 1 2 1 1 40 ILE H . 39 . HN 1 1 363 1 1 1 1 39 LEU HG . 38 . HG 1 1 363 1 2 1 1 40 ILE H . 39 . HN 1 1 364 1 1 1 1 40 ILE HA . 39 . HA 1 1 364 1 2 1 1 41 PHE H . 40 . HN 1 1 365 1 1 1 1 40 ILE HB . 39 . HB 1 1 365 1 2 1 1 41 PHE H . 40 . HN 1 1 366 1 1 1 1 40 ILE MD . 39 . HD1+ 1 1 366 1 2 1 1 41 PHE H . 40 . HN 1 1 367 1 1 1 1 40 ILE QG . 39 . HG1+ 1 1 367 1 2 1 1 41 PHE H . 40 . HN 1 1 368 1 1 1 1 40 ILE MG . 39 . HG2+ 1 1 368 1 2 1 1 41 PHE H . 40 . HN 1 1 369 1 1 1 1 40 ILE MG . 39 . HG2+ 1 1 369 1 2 1 1 44 GLN QE . 43 . HE2+ 1 1 370 1 1 1 1 40 ILE MD . 39 . HD1+ 1 1 370 1 2 1 1 46 LEU QB . 45 . HB+ 1 1 371 1 1 1 1 41 PHE HA . 40 . HA 1 1 371 1 2 1 1 42 VAL H . 41 . HN 1 1 372 1 1 1 1 41 PHE QB . 40 . HB+ 1 1 372 1 2 1 1 42 VAL H . 41 . HN 1 1 373 1 1 1 1 41 PHE QD . 40 . HD+ 1 1 373 1 2 1 1 42 VAL H . 41 . HN 1 1 374 1 1 1 1 41 PHE QE . 40 . HE+ 1 1 374 1 2 1 1 42 VAL H . 41 . HN 1 1 375 1 1 1 1 41 PHE QB . 40 . HB+ 1 1 375 1 2 1 1 44 GLN H . 43 . HN 1 1 376 1 1 1 1 41 PHE QE . 40 . HE+ 1 1 376 1 2 1 1 44 GLN H . 43 . HN 1 1 377 1 1 1 1 41 PHE H . 40 . HN 1 1 377 1 2 1 1 44 GLN QB . 43 . HB+ 1 1 378 1 1 1 1 42 VAL HA . 41 . HA 1 1 378 1 2 1 1 43 GLY H . 42 . HN 1 1 379 1 1 1 1 42 VAL HB . 41 . HB 1 1 379 1 2 1 1 43 GLY H . 42 . HN 1 1 380 1 1 1 1 42 VAL QG . 41 . HG++ 1 1 380 1 2 1 1 43 GLY QA . 42 . HA+ 1 1 381 1 1 1 1 42 VAL QG . 41 . HG++ 1 1 381 1 2 1 1 43 GLY H . 42 . HN 1 1 382 1 1 1 1 42 VAL HA . 41 . HA 1 1 382 1 2 1 1 44 GLN H . 43 . HN 1 1 383 1 1 1 1 42 VAL QG . 41 . HG++ 1 1 383 1 2 1 1 44 GLN H . 43 . HN 1 1 384 1 1 1 1 43 GLY QA . 42 . HA+ 1 1 384 1 2 1 1 44 GLN H . 43 . HN 1 1 385 1 1 1 1 43 GLY H . 42 . HN 1 1 385 1 2 1 1 44 GLN H . 43 . HN 1 1 386 1 1 1 1 44 GLN HA . 43 . HA 1 1 386 1 2 1 1 45 LYS H . 44 . HN 1 1 387 1 1 1 1 44 GLN QB . 43 . HB+ 1 1 387 1 2 1 1 45 LYS H . 44 . HN 1 1 388 1 1 1 1 44 GLN QG . 43 . HG+ 1 1 388 1 2 1 1 45 LYS H . 44 . HN 1 1 389 1 1 1 1 44 GLN H . 43 . HN 1 1 389 1 2 1 1 45 LYS H . 44 . HN 1 1 390 1 1 1 1 44 GLN QE . 43 . HE2+ 1 1 390 1 2 1 1 46 LEU QD . 45 . HD++ 1 1 391 1 1 1 1 44 GLN QE . 43 . HE2+ 1 1 391 1 2 1 1 46 LEU QB . 45 . HB+ 1 1 392 1 1 1 1 44 GLN QG . 43 . HG+ 1 1 392 1 2 1 1 46 LEU QD . 45 . HD++ 1 1 393 1 1 1 1 45 LYS HA . 44 . HA 1 1 393 1 2 1 1 46 LEU H . 45 . HN 1 1 394 1 1 1 1 45 LYS QB . 44 . HB+ 1 1 394 1 2 1 1 46 LEU H . 45 . HN 1 1 395 1 1 1 1 45 LYS H . 44 . HN 1 1 395 1 2 1 1 46 LEU QD . 45 . HD++ 1 1 396 1 1 1 1 45 LYS H . 44 . HN 1 1 396 1 2 1 1 46 LEU H . 45 . HN 1 1 397 1 1 1 1 46 LEU HA . 45 . HA 1 1 397 1 2 1 1 47 ILE H . 46 . HN 1 1 398 1 1 1 1 46 LEU QB . 45 . HB+ 1 1 398 1 2 1 1 47 ILE H . 46 . HN 1 1 399 1 1 1 1 47 ILE HA . 46 . HA 1 1 399 1 2 1 1 48 VAL H . 47 . HN 1 1 400 1 1 1 1 47 ILE QG . 46 . HG1+ 1 1 400 1 2 1 1 48 VAL H . 47 . HN 1 1 401 1 1 1 1 47 ILE MG . 46 . HG2+ 1 1 401 1 2 1 1 48 VAL H . 47 . HN 1 1 402 1 1 1 1 47 ILE H . 46 . HN 1 1 402 1 2 1 1 48 VAL H . 47 . HN 1 1 403 1 1 1 1 47 ILE HA . 46 . HA 1 1 403 1 2 1 1 49 LYS H . 48 . HN 1 1 404 1 1 1 1 47 ILE HB . 46 . HB 1 1 404 1 2 1 1 49 LYS H . 48 . HN 1 1 405 1 1 1 1 47 ILE MG . 46 . HG2+ 1 1 405 1 2 1 1 49 LYS H . 48 . HN 1 1 406 1 1 1 1 48 VAL HA . 47 . HA 1 1 406 1 2 1 1 49 LYS H . 48 . HN 1 1 407 1 1 1 1 48 VAL HB . 47 . HB 1 1 407 1 2 1 1 49 LYS H . 48 . HN 1 1 408 1 1 1 1 48 VAL QG . 47 . HG++ 1 1 408 1 2 1 1 49 LYS H . 48 . HN 1 1 409 1 1 1 1 48 VAL QG . 47 . HG++ 1 1 409 1 2 1 1 49 LYS QB . 48 . HB+ 1 1 410 1 1 1 1 48 VAL H . 47 . HN 1 1 410 1 2 1 1 49 LYS H . 48 . HN 1 1 411 1 1 1 1 49 LYS HA . 48 . HA 1 1 411 1 2 1 1 50 LYS H . 49 . HN 1 1 412 1 1 1 1 49 LYS QB . 48 . HB+ 1 1 412 1 2 1 1 50 LYS H . 49 . HN 1 1 413 1 1 1 1 49 LYS QG . 48 . HG+ 1 1 413 1 2 1 1 50 LYS H . 49 . HN 1 1 414 1 1 1 1 49 LYS H . 48 . HN 1 1 414 1 2 1 1 50 LYS H . 49 . HN 1 1 415 1 1 1 1 50 LYS HA . 49 . HA 1 1 415 1 2 1 1 51 GLY H . 50 . HN 1 1 416 1 1 1 1 50 LYS QB . 49 . HB+ 1 1 416 1 2 1 1 51 GLY H . 50 . HN 1 1 417 1 1 1 1 50 LYS QG . 49 . HG+ 1 1 417 1 2 1 1 51 GLY H . 50 . HN 1 1 418 1 1 1 1 50 LYS H . 49 . HN 1 1 418 1 2 1 1 51 GLY H . 50 . HN 1 1 419 1 1 1 1 51 GLY QA . 50 . HA+ 1 1 419 1 2 1 1 52 SER H . 51 . HN 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 6.0 1.8 6.0 1 1 2 1 . . . . . 6.0 1.8 6.0 1 1 3 1 . . . . . 6.0 1.8 6.0 1 1 4 1 . . . . . 6.0 1.8 6.0 1 1 5 1 . . . . . 6.0 1.8 6.0 1 1 6 1 . . . . . 3.4 1.8 3.4 1 1 7 1 . . . . . 6.0 1.8 6.0 1 1 8 1 . . . . . 3.4 1.8 3.4 1 1 9 1 . . . . . 6.0 1.8 6.0 1 1 10 1 . . . . . 6.0 1.8 6.0 1 1 11 1 . . . . . 6.0 1.8 6.0 1 1 12 1 . . . . . 6.0 1.8 6.0 1 1 13 1 . . . . . 3.4 1.8 3.4 1 1 14 1 . . . . . 2.8 1.8 2.8 1 1 15 1 . . . . . 3.4 1.8 3.4 1 1 16 1 . . . . . 6.0 1.8 6.0 1 1 17 1 . . . . . 6.0 1.8 6.0 1 1 18 1 . . . . . 6.0 1.8 6.0 1 1 19 1 . . . . . 4.0 1.8 4.0 1 1 20 1 . . . . . 2.8 1.8 2.8 1 1 21 1 . . . . . 3.4 1.8 3.4 1 1 22 1 . . . . . 3.4 1.8 3.4 1 1 23 1 . . . . . 6.0 1.8 6.0 1 1 24 1 . . . . . 3.4 1.8 3.4 1 1 25 1 . . . . . 3.4 1.8 3.4 1 1 26 1 . . . . . 6.0 1.8 6.0 1 1 27 1 . . . . . 6.0 1.8 6.0 1 1 28 1 . . . . . 6.0 1.8 6.0 1 1 29 1 . . . . . 6.0 1.8 6.0 1 1 30 1 . . . . . 6.0 1.8 6.0 1 1 31 1 . . . . . 6.0 1.8 6.0 1 1 32 1 . . . . . 3.4 1.8 3.4 1 1 33 1 . . . . . 6.0 1.8 6.0 1 1 34 1 . . . . . 6.0 1.8 6.0 1 1 35 1 . . . . . 6.0 1.8 6.0 1 1 36 1 . . . . . 6.0 1.8 6.0 1 1 37 1 . . . . . 6.0 1.8 6.0 1 1 38 1 . . . . . 6.0 1.8 6.0 1 1 39 1 . . . . . 6.0 1.8 6.0 1 1 40 1 . . . . . 6.0 1.8 6.0 1 1 41 1 . . . . . 2.8 1.8 2.8 1 1 42 1 . . . . . 6.0 1.8 6.0 1 1 43 1 . . . . . 6.0 1.8 6.0 1 1 44 1 . . . . . 6.0 1.8 6.0 1 1 45 1 . . . . . 3.4 1.8 3.4 1 1 46 1 . . . . . 3.4 1.8 3.4 1 1 47 1 . . . . . 6.0 1.8 6.0 1 1 48 1 . . . . . 6.0 1.8 6.0 1 1 49 1 . . . . . 6.0 1.8 6.0 1 1 50 1 . . . . . 6.0 1.8 6.0 1 1 51 1 . . . . . 6.0 1.8 6.0 1 1 52 1 . . . . . 6.0 1.8 6.0 1 1 53 1 . . . . . 2.8 1.8 2.8 1 1 54 1 . . . . . 6.0 1.8 6.0 1 1 55 1 . . . . . 6.0 1.8 6.0 1 1 56 1 . . . . . 6.0 1.8 6.0 1 1 57 1 . . . . . 6.0 1.8 6.0 1 1 58 1 . . . . . 6.0 1.8 6.0 1 1 59 1 . . . . . 6.0 1.8 6.0 1 1 60 1 . . . . . 6.0 1.8 6.0 1 1 61 1 . . . . . 6.0 1.8 6.0 1 1 62 1 . . . . . 6.0 1.8 6.0 1 1 63 1 . . . . . 6.0 1.8 6.0 1 1 64 1 . . . . . 6.0 1.8 6.0 1 1 65 1 . . . . . 6.0 1.8 6.0 1 1 66 1 . . . . . 3.4 1.8 3.4 1 1 67 1 . . . . . 6.0 1.8 6.0 1 1 68 1 . . . . . 6.0 1.8 6.0 1 1 69 1 . . . . . 6.0 1.8 6.0 1 1 70 1 . . . . . 3.4 1.8 3.4 1 1 71 1 . . . . . 6.0 1.8 6.0 1 1 72 1 . . . . . 4.0 1.8 4.0 1 1 73 1 . . . . . 3.4 1.8 3.4 1 1 74 1 . . . . . 3.4 1.8 3.4 1 1 75 1 . . . . . 6.0 1.8 6.0 1 1 76 1 . . . . . 6.0 1.8 6.0 1 1 77 1 . . . . . 6.0 1.8 6.0 1 1 78 1 . . . . . 3.4 1.8 3.4 1 1 79 1 . . . . . 3.4 1.8 3.4 1 1 80 1 . . . . . 6.0 1.8 6.0 1 1 81 1 . . . . . 6.0 1.8 6.0 1 1 82 1 . . . . . 3.4 1.8 3.4 1 1 83 1 . . . . . 2.8 1.8 2.8 1 1 84 1 . . . . . 6.0 1.8 6.0 1 1 85 1 . . . . . 6.0 1.8 6.0 1 1 86 1 . . . . . 6.0 1.8 6.0 1 1 87 1 . . . . . 3.4 1.8 3.4 1 1 88 1 . . . . . 3.4 1.8 3.4 1 1 89 1 . . . . . 3.4 1.8 3.4 1 1 90 1 . . . . . 6.0 1.8 6.0 1 1 91 1 . . . . . 2.8 1.8 2.8 1 1 92 1 . . . . . 2.8 1.8 2.8 1 1 93 1 . . . . . 6.0 1.8 6.0 1 1 94 1 . . . . . 3.4 1.8 3.4 1 1 95 1 . . . . . 6.0 1.8 6.0 1 1 96 1 . . . . . 3.4 1.8 3.4 1 1 97 1 . . . . . 6.0 1.8 6.0 1 1 98 1 . . . . . 6.0 1.8 6.0 1 1 99 1 . . . . . 6.0 1.8 6.0 1 1 100 1 . . . . . 6.0 1.8 6.0 1 1 101 1 . . . . . 3.4 1.8 3.4 1 1 102 1 . . . . . 6.0 1.8 6.0 1 1 103 1 . . . . . 3.4 1.8 3.4 1 1 104 1 . . . . . 3.4 1.8 3.4 1 1 105 1 . . . . . 6.0 1.8 6.0 1 1 106 1 . . . . . 6.0 1.8 6.0 1 1 107 1 . . . . . 6.0 1.8 6.0 1 1 108 1 . . . . . 3.4 1.8 3.4 1 1 109 1 . . . . . 6.0 1.8 6.0 1 1 110 1 . . . . . 6.0 1.8 6.0 1 1 111 1 . . . . . 6.0 1.8 6.0 1 1 112 1 . . . . . 6.0 1.8 6.0 1 1 113 1 . . . . . 6.0 1.8 6.0 1 1 114 1 . . . . . 6.0 1.8 6.0 1 1 115 1 . . . . . 6.0 1.8 6.0 1 1 116 1 . . . . . 6.0 1.8 6.0 1 1 117 1 . . . . . 6.0 1.8 6.0 1 1 118 1 . . . . . 6.0 1.8 6.0 1 1 119 1 . . . . . 3.0 1.8 3.0 1 1 120 1 . . . . . 6.0 1.8 6.0 1 1 121 1 . . . . . 6.0 1.8 6.0 1 1 122 1 . . . . . 6.0 1.8 6.0 1 1 123 1 . . . . . 6.0 1.8 6.0 1 1 124 1 . . . . . 6.0 1.8 6.0 1 1 125 1 . . . . . 6.0 1.8 6.0 1 1 126 1 . . . . . 6.0 1.8 6.0 1 1 127 1 . . . . . 6.0 1.8 6.0 1 1 128 1 . . . . . 3.4 1.8 3.4 1 1 129 1 . . . . . 6.0 1.8 6.0 1 1 130 1 . . . . . 6.0 1.8 6.0 1 1 131 1 . . . . . 6.0 1.8 6.0 1 1 132 1 . . . . . 6.0 1.8 6.0 1 1 133 1 . . . . . 6.0 1.8 6.0 1 1 134 1 . . . . . 6.0 1.8 6.0 1 1 135 1 . . . . . 4.0 1.8 4.0 1 1 136 1 . . . . . 6.0 1.8 6.0 1 1 137 1 . . . . . 6.0 1.8 6.0 1 1 138 1 . . . . . 6.0 1.8 6.0 1 1 139 1 . . . . . 6.0 1.8 6.0 1 1 140 1 . . . . . 6.0 1.8 6.0 1 1 141 1 . . . . . 6.0 1.8 6.0 1 1 142 1 . . . . . 6.0 1.8 6.0 1 1 143 1 . . . . . 6.0 1.8 6.0 1 1 144 1 . . . . . 6.0 1.8 6.0 1 1 145 1 . . . . . 6.0 1.8 6.0 1 1 146 1 . . . . . 2.8 1.8 2.8 1 1 147 1 . . . . . 3.4 1.8 3.4 1 1 148 1 . . . . . 6.0 1.8 6.0 1 1 149 1 . . . . . 6.0 1.8 6.0 1 1 150 1 . . . . . 6.0 1.8 6.0 1 1 151 1 . . . . . 6.0 1.8 6.0 1 1 152 1 . . . . . 6.0 1.8 6.0 1 1 153 1 . . . . . 6.0 1.8 6.0 1 1 154 1 . . . . . 3.4 1.8 3.4 1 1 155 1 . . . . . 6.0 1.8 6.0 1 1 156 1 . . . . . 2.8 1.8 2.8 1 1 157 1 . . . . . 6.0 1.8 6.0 1 1 158 1 . . . . . 6.0 1.8 6.0 1 1 159 1 . . . . . 6.0 1.8 6.0 1 1 160 1 . . . . . 6.0 1.8 6.0 1 1 161 1 . . . . . 3.4 1.8 3.4 1 1 162 1 . . . . . 6.0 1.8 6.0 1 1 163 1 . . . . . 6.0 1.8 6.0 1 1 164 1 . . . . . 6.0 1.8 6.0 1 1 165 1 . . . . . 6.0 1.8 6.0 1 1 166 1 . . . . . 6.0 1.8 6.0 1 1 167 1 . . . . . 3.4 1.8 3.4 1 1 168 1 . . . . . 6.0 1.8 6.0 1 1 169 1 . . . . . 6.0 1.8 6.0 1 1 170 1 . . . . . 3.4 1.8 3.4 1 1 171 1 . . . . . 6.0 1.8 6.0 1 1 172 1 . . . . . 6.0 1.8 6.0 1 1 173 1 . . . . . 6.0 1.8 6.0 1 1 174 1 . . . . . 6.0 1.8 6.0 1 1 175 1 . . . . . 6.0 1.8 6.0 1 1 176 1 . . . . . 6.0 1.8 6.0 1 1 177 1 . . . . . 3.4 1.8 3.4 1 1 178 1 . . . . . 6.0 1.8 6.0 1 1 179 1 . . . . . 6.0 1.8 6.0 1 1 180 1 . . . . . 3.4 1.8 3.4 1 1 181 1 . . . . . 3.4 1.8 3.4 1 1 182 1 . . . . . 4.0 1.8 4.0 1 1 183 1 . . . . . 6.0 1.8 6.0 1 1 184 1 . . . . . 6.0 1.8 6.0 1 1 185 1 . . . . . 3.4 1.8 3.4 1 1 186 1 . . . . . 2.8 1.8 2.8 1 1 187 1 . . . . . 6.0 1.8 6.0 1 1 188 1 . . . . . 6.0 1.8 6.0 1 1 189 1 . . . . . 2.8 1.8 2.8 1 1 190 1 . . . . . 6.0 1.8 6.0 1 1 191 1 . . . . . 3.4 1.8 3.4 1 1 192 1 . . . . . 3.4 1.8 3.4 1 1 193 1 . . . . . 2.8 1.8 2.8 1 1 194 1 . . . . . 6.0 1.8 6.0 1 1 195 1 . . . . . 6.0 1.8 6.0 1 1 196 1 . . . . . 6.0 1.8 6.0 1 1 197 1 . . . . . 6.0 1.8 6.0 1 1 198 1 . . . . . 6.0 1.8 6.0 1 1 199 1 . . . . . 6.0 1.8 6.0 1 1 200 1 . . . . . 6.0 1.8 6.0 1 1 201 1 . . . . . 6.0 1.8 6.0 1 1 202 1 . . . . . 6.0 1.8 6.0 1 1 203 1 . . . . . 6.0 1.8 6.0 1 1 204 1 . . . . . 6.0 1.8 6.0 1 1 205 1 . . . . . 6.0 1.8 6.0 1 1 206 1 . . . . . 6.0 1.8 6.0 1 1 207 1 . . . . . 6.0 1.8 6.0 1 1 208 1 . . . . . 3.4 1.8 3.4 1 1 209 1 . . . . . 6.0 1.8 6.0 1 1 210 1 . . . . . 6.0 1.8 6.0 1 1 211 1 . . . . . 6.0 1.8 6.0 1 1 212 1 . . . . . 6.0 1.8 6.0 1 1 213 1 . . . . . 3.4 1.8 3.4 1 1 214 1 . . . . . 6.0 1.8 6.0 1 1 215 1 . . . . . 6.0 1.8 6.0 1 1 216 1 . . . . . 6.0 1.8 6.0 1 1 217 1 . . . . . 6.0 1.8 6.0 1 1 218 1 . . . . . 6.0 1.8 6.0 1 1 219 1 . . . . . 6.0 1.8 6.0 1 1 220 1 . . . . . 6.0 1.8 6.0 1 1 221 1 . . . . . 6.0 1.8 6.0 1 1 222 1 . . . . . 6.0 1.8 6.0 1 1 223 1 . . . . . 6.0 1.8 6.0 1 1 224 1 . . . . . 6.0 1.8 6.0 1 1 225 1 . . . . . 6.0 1.8 6.0 1 1 226 1 . . . . . 6.0 1.8 6.0 1 1 227 1 . . . . . 6.0 1.8 6.0 1 1 228 1 . . . . . 4.0 1.8 4.0 1 1 229 1 . . . . . 6.0 1.8 6.0 1 1 230 1 . . . . . 4.0 1.8 4.0 1 1 231 1 . . . . . 6.0 1.8 6.0 1 1 232 1 . . . . . 6.0 1.8 6.0 1 1 233 1 . . . . . 6.0 1.8 6.0 1 1 234 1 . . . . . 3.4 1.8 3.4 1 1 235 1 . . . . . 6.0 1.8 6.0 1 1 236 1 . . . . . 6.0 1.8 6.0 1 1 237 1 . . . . . 6.0 1.8 6.0 1 1 238 1 . . . . . 6.0 1.8 6.0 1 1 239 1 . . . . . 3.4 1.8 3.4 1 1 240 1 . . . . . 6.0 1.8 6.0 1 1 241 1 . . . . . 6.0 1.8 6.0 1 1 242 1 . . . . . 6.0 1.8 6.0 1 1 243 1 . . . . . 6.0 1.8 6.0 1 1 244 1 . . . . . 6.0 1.8 6.0 1 1 245 1 . . . . . 6.0 1.8 6.0 1 1 246 1 . . . . . 6.0 1.8 6.0 1 1 247 1 . . . . . 6.0 1.8 6.0 1 1 248 1 . . . . . 6.0 1.8 6.0 1 1 249 1 . . . . . 6.0 1.8 6.0 1 1 250 1 . . . . . 3.4 1.8 3.4 1 1 251 1 . . . . . 6.0 1.8 6.0 1 1 252 1 . . . . . 6.0 1.8 6.0 1 1 253 1 . . . . . 3.4 1.8 3.4 1 1 254 1 . . . . . 6.0 1.8 6.0 1 1 255 1 . . . . . 6.0 1.8 6.0 1 1 256 1 . . . . . 3.4 1.8 3.4 1 1 257 1 . . . . . 6.0 1.8 6.0 1 1 258 1 . . . . . 6.0 1.8 6.0 1 1 259 1 . . . . . 3.4 1.8 3.4 1 1 260 1 . . . . . 4.0 1.8 4.0 1 1 261 1 . . . . . 6.0 1.8 6.0 1 1 262 1 . . . . . 3.4 1.8 3.4 1 1 263 1 . . . . . 3.4 1.8 3.4 1 1 264 1 . . . . . 6.0 1.8 6.0 1 1 265 1 . . . . . 6.0 1.8 6.0 1 1 266 1 . . . . . 6.0 1.8 6.0 1 1 267 1 . . . . . 6.0 1.8 6.0 1 1 268 1 . . . . . 6.0 1.8 6.0 1 1 269 1 . . . . . 6.0 1.8 6.0 1 1 270 1 . . . . . 3.4 1.8 3.4 1 1 271 1 . . . . . 6.0 1.8 6.0 1 1 272 1 . . . . . 6.0 1.8 6.0 1 1 273 1 . . . . . 6.0 1.8 6.0 1 1 274 1 . . . . . 6.0 1.8 6.0 1 1 275 1 . . . . . 6.0 1.8 6.0 1 1 276 1 . . . . . 6.0 1.8 6.0 1 1 277 1 . . . . . 6.0 1.8 6.0 1 1 278 1 . . . . . 6.0 1.8 6.0 1 1 279 1 . . . . . 6.0 1.8 6.0 1 1 280 1 . . . . . 6.0 1.8 6.0 1 1 281 1 . . . . . 6.0 1.8 6.0 1 1 282 1 . . . . . 3.4 1.8 3.4 1 1 283 1 . . . . . 6.0 1.8 6.0 1 1 284 1 . . . . . 6.0 1.8 6.0 1 1 285 1 . . . . . 6.0 1.8 6.0 1 1 286 1 . . . . . 6.0 1.8 6.0 1 1 287 1 . . . . . 6.0 1.8 6.0 1 1 288 1 . . . . . 6.0 1.8 6.0 1 1 289 1 . . . . . 2.8 1.8 2.8 1 1 290 1 . . . . . 4.0 1.8 4.0 1 1 291 1 . . . . . 2.8 1.8 2.8 1 1 292 1 . . . . . 3.4 1.8 3.4 1 1 293 1 . . . . . 6.0 1.8 6.0 1 1 294 1 . . . . . 6.0 1.8 6.0 1 1 295 1 . . . . . 6.0 1.8 6.0 1 1 296 1 . . . . . 3.4 1.8 3.4 1 1 297 1 . . . . . 6.0 1.8 6.0 1 1 298 1 . . . . . 6.0 1.8 6.0 1 1 299 1 . . . . . 6.0 1.8 6.0 1 1 300 1 . . . . . 6.0 1.8 6.0 1 1 301 1 . . . . . 6.0 1.8 6.0 1 1 302 1 . . . . . 6.0 1.8 6.0 1 1 303 1 . . . . . 3.4 1.8 3.4 1 1 304 1 . . . . . 3.4 1.8 3.4 1 1 305 1 . . . . . 6.0 1.8 6.0 1 1 306 1 . . . . . 6.0 1.8 6.0 1 1 307 1 . . . . . 6.0 1.8 6.0 1 1 308 1 . . . . . 6.0 1.8 6.0 1 1 309 1 . . . . . 6.0 1.8 6.0 1 1 310 1 . . . . . 3.4 1.8 3.4 1 1 311 1 . . . . . 6.0 1.8 6.0 1 1 312 1 . . . . . 3.4 1.8 3.4 1 1 313 1 . . . . . 6.0 1.8 6.0 1 1 314 1 . . . . . 6.0 1.8 6.0 1 1 315 1 . . . . . 6.0 1.8 6.0 1 1 316 1 . . . . . 6.0 1.8 6.0 1 1 317 1 . . . . . 6.0 1.8 6.0 1 1 318 1 . . . . . 6.0 1.8 6.0 1 1 319 1 . . . . . 6.0 1.8 6.0 1 1 320 1 . . . . . 3.4 1.8 3.4 1 1 321 1 . . . . . 3.4 1.8 3.4 1 1 322 1 . . . . . 6.0 1.8 6.0 1 1 323 1 . . . . . 6.0 1.8 6.0 1 1 324 1 . . . . . 6.0 1.8 6.0 1 1 325 1 . . . . . 4.0 1.8 4.0 1 1 326 1 . . . . . 6.0 1.8 6.0 1 1 327 1 . . . . . 6.0 1.8 6.0 1 1 328 1 . . . . . 6.0 1.8 6.0 1 1 329 1 . . . . . 6.0 1.8 6.0 1 1 330 1 . . . . . 6.0 1.8 6.0 1 1 331 1 . . . . . 6.0 1.8 6.0 1 1 332 1 . . . . . 6.0 1.8 6.0 1 1 333 1 . . . . . 6.0 1.8 6.0 1 1 334 1 . . . . . 6.0 1.8 6.0 1 1 335 1 . . . . . 6.0 1.8 6.0 1 1 336 1 . . . . . 6.0 1.8 6.0 1 1 337 1 . . . . . 6.0 1.8 6.0 1 1 338 1 . . . . . 6.0 1.8 6.0 1 1 339 1 . . . . . 3.4 1.8 3.4 1 1 340 1 . . . . . 6.0 1.8 6.0 1 1 341 1 . . . . . 6.0 1.8 6.0 1 1 342 1 . . . . . 4.0 1.8 4.0 1 1 343 1 . . . . . 6.0 1.8 6.0 1 1 344 1 . . . . . 6.0 1.8 6.0 1 1 345 1 . . . . . 6.0 1.8 6.0 1 1 346 1 . . . . . 6.0 1.8 6.0 1 1 347 1 . . . . . 6.0 1.8 6.0 1 1 348 1 . . . . . 6.0 1.8 6.0 1 1 349 1 . . . . . 6.0 1.8 6.0 1 1 350 1 . . . . . 6.0 1.8 6.0 1 1 351 1 . . . . . 6.0 1.8 6.0 1 1 352 1 . . . . . 6.0 1.8 6.0 1 1 353 1 . . . . . 6.0 1.8 6.0 1 1 354 1 . . . . . 3.4 1.8 3.4 1 1 355 1 . . . . . 6.0 1.8 6.0 1 1 356 1 . . . . . 6.0 1.8 6.0 1 1 357 1 . . . . . 6.0 1.8 6.0 1 1 358 1 . . . . . 6.0 1.8 6.0 1 1 359 1 . . . . . 3.4 1.8 3.4 1 1 360 1 . . . . . 3.4 1.8 3.4 1 1 361 1 . . . . . 6.0 1.8 6.0 1 1 362 1 . . . . . 6.0 1.8 6.0 1 1 363 1 . . . . . 6.0 1.8 6.0 1 1 364 1 . . . . . 6.0 1.8 6.0 1 1 365 1 . . . . . 6.0 1.8 6.0 1 1 366 1 . . . . . 6.0 1.8 6.0 1 1 367 1 . . . . . 6.0 1.8 6.0 1 1 368 1 . . . . . 6.0 1.8 6.0 1 1 369 1 . . . . . 3.4 1.8 3.4 1 1 370 1 . . . . . 3.4 1.8 3.4 1 1 371 1 . . . . . 3.4 1.8 3.4 1 1 372 1 . . . . . 6.0 1.8 6.0 1 1 373 1 . . . . . 6.0 1.8 6.0 1 1 374 1 . . . . . 6.0 1.8 6.0 1 1 375 1 . . . . . 6.0 1.8 6.0 1 1 376 1 . . . . . 6.0 1.8 6.0 1 1 377 1 . . . . . 6.0 1.8 6.0 1 1 378 1 . . . . . 2.8 1.8 2.8 1 1 379 1 . . . . . 6.0 1.8 6.0 1 1 380 1 . . . . . 3.4 1.8 3.4 1 1 381 1 . . . . . 3.4 1.8 3.4 1 1 382 1 . . . . . 6.0 1.8 6.0 1 1 383 1 . . . . . 6.0 1.8 6.0 1 1 384 1 . . . . . 6.0 1.8 6.0 1 1 385 1 . . . . . 3.4 1.8 3.4 1 1 386 1 . . . . . 3.4 1.8 3.4 1 1 387 1 . . . . . 6.0 1.8 6.0 1 1 388 1 . . . . . 6.0 1.8 6.0 1 1 389 1 . . . . . 6.0 1.8 6.0 1 1 390 1 . . . . . 6.0 1.8 6.0 1 1 391 1 . . . . . 6.0 1.8 6.0 1 1 392 1 . . . . . 3.4 1.8 3.4 1 1 393 1 . . . . . 6.0 1.8 6.0 1 1 394 1 . . . . . 6.0 1.8 6.0 1 1 395 1 . . . . . 6.0 1.8 6.0 1 1 396 1 . . . . . 6.0 1.8 6.0 1 1 397 1 . . . . . 6.0 1.8 6.0 1 1 398 1 . . . . . 6.0 1.8 6.0 1 1 399 1 . . . . . 3.4 1.8 3.4 1 1 400 1 . . . . . 6.0 1.8 6.0 1 1 401 1 . . . . . 3.4 1.8 3.4 1 1 402 1 . . . . . 6.0 1.8 6.0 1 1 403 1 . . . . . 6.0 1.8 6.0 1 1 404 1 . . . . . 6.0 1.8 6.0 1 1 405 1 . . . . . 3.4 1.8 3.4 1 1 406 1 . . . . . 6.0 1.8 6.0 1 1 407 1 . . . . . 6.0 1.8 6.0 1 1 408 1 . . . . . 6.0 1.8 6.0 1 1 409 1 . . . . . 6.0 1.8 6.0 1 1 410 1 . . . . . 4.0 1.8 4.0 1 1 411 1 . . . . . 3.4 1.8 3.4 1 1 412 1 . . . . . 6.0 1.8 6.0 1 1 413 1 . . . . . 6.0 1.8 6.0 1 1 414 1 . . . . . 6.0 1.8 6.0 1 1 415 1 . . . . . 6.0 1.8 6.0 1 1 416 1 . . . . . 6.0 1.8 6.0 1 1 417 1 . . . . . 6.0 1.8 6.0 1 1 418 1 . . . . . 6.0 1.8 6.0 1 1 419 1 . . . . . 6.0 1.8 6.0 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_3_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 2 _Distance_constraint_list.Constraint_type "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 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 5 THR H . 4 . HN 1 2 1 1 2 1 1 48 VAL O . 47 . O 1 2 2 1 1 1 1 5 THR N . 4 . N 1 2 2 1 2 1 1 48 VAL O . 47 . O 1 2 3 1 1 1 1 7 TYR H . 6 . HN 1 2 3 1 2 1 1 46 LEU O . 45 . O 1 2 4 1 1 1 1 7 TYR N . 6 . N 1 2 4 1 2 1 1 46 LEU O . 45 . O 1 2 5 1 1 1 1 9 VAL H . 8 . HN 1 2 5 1 2 1 1 44 GLN O . 43 . O 1 2 6 1 1 1 1 9 VAL N . 8 . N 1 2 6 1 2 1 1 44 GLN O . 43 . O 1 2 7 1 1 1 1 14 THR O . 13 . O 1 2 7 1 2 1 1 18 ILE H . 17 . HN 1 2 8 1 1 1 1 14 THR O . 13 . O 1 2 8 1 2 1 1 18 ILE N . 17 . N 1 2 9 1 1 1 1 15 LEU O . 14 . O 1 2 9 1 2 1 1 19 ALA H . 18 . HN 1 2 10 1 1 1 1 15 LEU O . 14 . O 1 2 10 1 2 1 1 19 ALA N . 18 . N 1 2 11 1 1 1 1 16 ASN O . 15 . O 1 2 11 1 2 1 1 20 ALA H . 19 . HN 1 2 12 1 1 1 1 16 ASN O . 15 . O 1 2 12 1 2 1 1 20 ALA N . 19 . N 1 2 13 1 1 1 1 17 LYS O . 16 . O 1 2 13 1 2 1 1 21 GLN H . 20 . HN 1 2 14 1 1 1 1 17 LYS O . 16 . O 1 2 14 1 2 1 1 21 GLN N . 20 . N 1 2 15 1 1 1 1 25 SER O . 24 . O 1 2 15 1 2 1 1 29 LEU H . 28 . HN 1 2 16 1 1 1 1 25 SER O . 24 . O 1 2 16 1 2 1 1 29 LEU N . 28 . N 1 2 17 1 1 1 1 26 VAL O . 25 . O 1 2 17 1 2 1 1 30 ARG H . 29 . HN 1 2 18 1 1 1 1 26 VAL O . 25 . O 1 2 18 1 2 1 1 30 ARG N . 29 . N 1 2 19 1 1 1 1 27 ALA O . 26 . O 1 2 19 1 2 1 1 31 SER H . 30 . HN 1 2 20 1 1 1 1 27 ALA O . 26 . O 1 2 20 1 2 1 1 31 SER N . 30 . N 1 2 21 1 1 1 1 28 ASN O . 27 . O 1 2 21 1 2 1 1 32 TRP H . 31 . HN 1 2 22 1 1 1 1 28 ASN O . 27 . O 1 2 22 1 2 1 1 32 TRP N . 31 . N 1 2 23 1 1 1 1 9 VAL O . 8 . O 1 2 23 1 2 1 1 43 GLY H . 42 . HN 1 2 24 1 1 1 1 9 VAL O . 8 . O 1 2 24 1 2 1 1 43 GLY N . 42 . N 1 2 25 1 1 1 1 7 TYR O . 6 . O 1 2 25 1 2 1 1 46 LEU H . 45 . HN 1 2 26 1 1 1 1 7 TYR O . 6 . O 1 2 26 1 2 1 1 46 LEU N . 45 . N 1 2 27 1 1 1 1 5 THR O . 4 . O 1 2 27 1 2 1 1 48 VAL H . 47 . HN 1 2 28 1 1 1 1 5 THR O . 4 . O 1 2 28 1 2 1 1 48 VAL N . 47 . N 1 2 29 1 1 1 1 29 LEU O . 28 . O 1 2 29 1 2 1 1 33 ASN HD21 . 32 . HD21 1 2 30 1 1 1 1 29 LEU O . 28 . O 1 2 30 1 2 1 1 33 ASN ND2 . 32 . ND2 1 2 31 1 1 1 1 33 ASN HD22 . 32 . HD22 1 2 31 1 2 1 1 47 ILE O . 46 . O 1 2 32 1 1 1 1 33 ASN ND2 . 32 . ND2 1 2 32 1 2 1 1 47 ILE O . 46 . O 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 . . . . . 2.0 1.7 2.3 1 2 2 1 . . . . . 2.9 2.6 3.2 1 2 3 1 . . . . . 2.0 1.7 2.3 1 2 4 1 . . . . . 2.9 2.6 3.2 1 2 5 1 . . . . . 2.0 1.7 2.3 1 2 6 1 . . . . . 2.9 2.6 3.2 1 2 7 1 . . . . . 2.0 1.7 2.3 1 2 8 1 . . . . . 2.9 2.6 3.2 1 2 9 1 . . . . . 2.0 1.7 2.3 1 2 10 1 . . . . . 2.9 2.6 3.2 1 2 11 1 . . . . . 2.0 1.7 2.3 1 2 12 1 . . . . . 2.9 2.6 3.2 1 2 13 1 . . . . . 2.0 1.7 2.3 1 2 14 1 . . . . . 2.9 2.6 3.2 1 2 15 1 . . . . . 2.0 1.7 2.3 1 2 16 1 . . . . . 2.9 2.6 3.2 1 2 17 1 . . . . . 2.0 1.7 2.3 1 2 18 1 . . . . . 2.9 2.6 3.2 1 2 19 1 . . . . . 2.0 1.7 2.3 1 2 20 1 . . . . . 2.9 2.6 3.2 1 2 21 1 . . . . . 2.0 1.7 2.3 1 2 22 1 . . . . . 2.9 2.6 3.2 1 2 23 1 . . . . . 2.0 1.7 2.3 1 2 24 1 . . . . . 2.9 2.6 3.2 1 2 25 1 . . . . . 2.0 1.7 2.3 1 2 26 1 . . . . . 2.9 2.6 3.2 1 2 27 1 . . . . . 2.0 1.7 2.3 1 2 28 1 . . . . . 2.9 2.6 3.2 1 2 29 1 . . . . . 1.9 1.7 2.1 1 2 30 1 . . . . . 2.9 2.7 3.1 1 2 31 1 . . . . . 1.9 1.7 2.1 1 2 32 1 . . . . . 2.8 2.6 3.0 1 2 stop_ save_ save_CNS/XPLOR_dihedral_4 _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 5 THR C 1 1 6 TYR N 1 1 6 TYR CA 1 1 6 TYR C -130.0 -86.0 . 4 . C . 5 . N . 5 . CA . 5 . C 1 1 2 . 1 1 6 TYR N 1 1 6 TYR CA 1 1 6 TYR C 1 1 7 TYR N 116.0 154.0 . 5 . N . 5 . CA . 5 . C . 6 . N 1 1 3 . 1 1 6 TYR C 1 1 7 TYR N 1 1 7 TYR CA 1 1 7 TYR C -146.0 -118.0 . 5 . C . 6 . N . 6 . CA . 6 . C 1 1 4 . 1 1 7 TYR N 1 1 7 TYR CA 1 1 7 TYR C 1 1 8 THR N 111.0 147.0 . 6 . N . 6 . CA . 6 . C . 7 . N 1 1 5 . 1 1 7 TYR C 1 1 8 THR N 1 1 8 THR CA 1 1 8 THR C -121.0 -63.0 . 6 . C . 7 . N . 7 . CA . 7 . C 1 1 6 . 1 1 8 THR N 1 1 8 THR CA 1 1 8 THR C 1 1 9 VAL N 98.0 142.0 . 7 . N . 7 . CA . 7 . C . 8 . N 1 1 7 . 1 1 8 THR C 1 1 9 VAL N 1 1 9 VAL CA 1 1 9 VAL C -86.0 -58.0 . 7 . C . 8 . N . 8 . CA . 8 . C 1 1 8 . 1 1 9 VAL N 1 1 9 VAL CA 1 1 9 VAL C 1 1 10 LYS N 116.99999 145.0 . 8 . N . 8 . CA . 8 . C . 9 . N 1 1 9 . 1 1 9 VAL C 1 1 10 LYS N 1 1 10 LYS CA 1 1 10 LYS C -168.0 -74.0 . 8 . C . 9 . N . 9 . CA . 9 . C 1 1 10 . 1 1 10 LYS N 1 1 10 LYS CA 1 1 10 LYS C 1 1 11 SER N 145.0 177.0 . 9 . N . 9 . CA . 9 . C . 10 . N 1 1 11 . 1 1 10 LYS C 1 1 11 SER N 1 1 11 SER CA 1 1 11 SER C -82.0 -44.0 . 9 . C . 10 . N . 10 . CA . 10 . C 1 1 12 . 1 1 12 GLY C 1 1 13 ASP N 1 1 13 ASP CA 1 1 13 ASP C -89.0 -53.0 . 11 . C . 12 . N . 12 . CA . 12 . C 1 1 13 . 1 1 13 ASP N 1 1 13 ASP CA 1 1 13 ASP C 1 1 14 THR N -44.0 -10.0 . 12 . N . 12 . CA . 12 . C . 13 . N 1 1 14 . 1 1 13 ASP C 1 1 14 THR N 1 1 14 THR CA 1 1 14 THR C -143.0 -116.99999 . 12 . C . 13 . N . 13 . CA . 13 . C 1 1 15 . 1 1 14 THR N 1 1 14 THR CA 1 1 14 THR C 1 1 15 LEU N 146.0 170.0 . 13 . N . 13 . CA . 13 . C . 14 . N 1 1 16 . 1 1 14 THR C 1 1 15 LEU N 1 1 15 LEU CA 1 1 15 LEU C -70.0 -56.0 . 13 . C . 14 . N . 14 . CA . 14 . C 1 1 17 . 1 1 15 LEU N 1 1 15 LEU CA 1 1 15 LEU C 1 1 16 ASN N -46.0 -28.0 . 14 . N . 14 . CA . 14 . C . 15 . N 1 1 18 . 1 1 15 LEU C 1 1 16 ASN N 1 1 16 ASN CA 1 1 16 ASN C -69.0 -55.0 . 14 . C . 15 . N . 15 . CA . 15 . C 1 1 19 . 1 1 16 ASN N 1 1 16 ASN CA 1 1 16 ASN C 1 1 17 LYS N -49.0 -29.0 . 15 . N . 15 . CA . 15 . C . 16 . N 1 1 20 . 1 1 16 ASN C 1 1 17 LYS N 1 1 17 LYS CA 1 1 17 LYS C -70.0 -61.999996 . 15 . C . 16 . N . 16 . CA . 16 . C 1 1 21 . 1 1 17 LYS N 1 1 17 LYS CA 1 1 17 LYS C 1 1 18 ILE N -44.0 -32.0 . 16 . N . 16 . CA . 16 . C . 17 . N 1 1 22 . 1 1 17 LYS C 1 1 18 ILE N 1 1 18 ILE CA 1 1 18 ILE C -73.0 -57.0 . 16 . C . 17 . N . 17 . CA . 17 . C 1 1 23 . 1 1 18 ILE N 1 1 18 ILE CA 1 1 18 ILE C 1 1 19 ALA N -50.0 -38.0 . 17 . N . 17 . CA . 17 . C . 18 . N 1 1 24 . 1 1 18 ILE C 1 1 19 ALA N 1 1 19 ALA CA 1 1 19 ALA C -66.0 -58.0 . 17 . C . 18 . N . 18 . CA . 18 . C 1 1 25 . 1 1 19 ALA N 1 1 19 ALA CA 1 1 19 ALA C 1 1 20 ALA N -47.999996 -30.0 . 18 . N . 18 . CA . 18 . C . 19 . N 1 1 26 . 1 1 19 ALA C 1 1 20 ALA N 1 1 20 ALA CA 1 1 20 ALA C -73.0 -59.0 . 18 . C . 19 . N . 19 . CA . 19 . C 1 1 27 . 1 1 20 ALA N 1 1 20 ALA CA 1 1 20 ALA C 1 1 21 GLN N -50.999996 -23.0 . 19 . N . 19 . CA . 19 . C . 20 . N 1 1 28 . 1 1 20 ALA C 1 1 21 GLN N 1 1 21 GLN CA 1 1 21 GLN C -74.0 -60.0 . 19 . C . 20 . N . 20 . CA . 20 . C 1 1 29 . 1 1 21 GLN N 1 1 21 GLN CA 1 1 21 GLN C 1 1 22 TYR N -46.0 -22.0 . 20 . N . 20 . CA . 20 . C . 21 . N 1 1 30 . 1 1 21 GLN C 1 1 22 TYR N 1 1 22 TYR CA 1 1 22 TYR C -107.0 -75.0 . 20 . C . 21 . N . 21 . CA . 21 . C 1 1 31 . 1 1 22 TYR N 1 1 22 TYR CA 1 1 22 TYR C 1 1 23 GLY N -15.0 13.0 . 21 . N . 21 . CA . 21 . C . 22 . N 1 1 32 . 1 1 22 TYR C 1 1 23 GLY N 1 1 23 GLY CA 1 1 23 GLY C 58.0 78.0 . 21 . C . 22 . N . 22 . CA . 22 . C 1 1 33 . 1 1 23 GLY N 1 1 23 GLY CA 1 1 23 GLY C 1 1 24 VAL N 26.0 47.999996 . 22 . N . 22 . CA . 22 . C . 23 . N 1 1 34 . 1 1 23 GLY C 1 1 24 VAL N 1 1 24 VAL CA 1 1 24 VAL C -139.0 -115.00001 . 22 . C . 23 . N . 23 . CA . 23 . C 1 1 35 . 1 1 24 VAL N 1 1 24 VAL CA 1 1 24 VAL C 1 1 25 SER N 144.0 182.0 . 23 . N . 23 . CA . 23 . C . 24 . N 1 1 36 . 1 1 24 VAL C 1 1 25 SER N 1 1 25 SER CA 1 1 25 SER C -111.0 -55.0 . 23 . C . 24 . N . 24 . CA . 24 . C 1 1 37 . 1 1 25 SER N 1 1 25 SER CA 1 1 25 SER C 1 1 26 VAL N 147.0 169.0 . 24 . N . 24 . CA . 24 . C . 25 . N 1 1 38 . 1 1 25 SER C 1 1 26 VAL N 1 1 26 VAL CA 1 1 26 VAL C -66.99999 -53.0 . 24 . C . 25 . N . 25 . CA . 25 . C 1 1 39 . 1 1 26 VAL N 1 1 26 VAL CA 1 1 26 VAL C 1 1 27 ALA N -50.0 -28.0 . 25 . N . 25 . CA . 25 . C . 26 . N 1 1 40 . 1 1 26 VAL C 1 1 27 ALA N 1 1 27 ALA CA 1 1 27 ALA C -73.0 -55.0 . 25 . C . 26 . N . 26 . CA . 26 . C 1 1 41 . 1 1 27 ALA N 1 1 27 ALA CA 1 1 27 ALA C 1 1 28 ASN N -46.0 -28.0 . 26 . N . 26 . CA . 26 . C . 27 . N 1 1 42 . 1 1 27 ALA C 1 1 28 ASN N 1 1 28 ASN CA 1 1 28 ASN C -75.0 -60.999996 . 26 . C . 27 . N . 27 . CA . 27 . C 1 1 43 . 1 1 28 ASN N 1 1 28 ASN CA 1 1 28 ASN C 1 1 29 LEU N -47.999996 -28.0 . 27 . N . 27 . CA . 27 . C . 28 . N 1 1 44 . 1 1 28 ASN C 1 1 29 LEU N 1 1 29 LEU CA 1 1 29 LEU C -73.0 -55.0 . 27 . C . 28 . N . 28 . CA . 28 . C 1 1 45 . 1 1 29 LEU N 1 1 29 LEU CA 1 1 29 LEU C 1 1 30 ARG N -47.999996 -34.0 . 28 . N . 28 . CA . 28 . C . 29 . N 1 1 46 . 1 1 29 LEU C 1 1 30 ARG N 1 1 30 ARG CA 1 1 30 ARG C -71.0 -55.0 . 28 . C . 29 . N . 29 . CA . 29 . C 1 1 47 . 1 1 30 ARG N 1 1 30 ARG CA 1 1 30 ARG C 1 1 31 SER N -52.0 -34.0 . 29 . N . 29 . CA . 29 . C . 30 . N 1 1 48 . 1 1 30 ARG C 1 1 31 SER N 1 1 31 SER CA 1 1 31 SER C -78.0 -60.0 . 29 . C . 30 . N . 30 . CA . 30 . C 1 1 49 . 1 1 31 SER N 1 1 31 SER CA 1 1 31 SER C 1 1 32 TRP N -43.0 -26.999998 . 30 . N . 30 . CA . 30 . C . 31 . N 1 1 50 . 1 1 31 SER C 1 1 32 TRP N 1 1 32 TRP CA 1 1 32 TRP C -113.0 -59.0 . 30 . C . 31 . N . 31 . CA . 31 . C 1 1 51 . 1 1 32 TRP N 1 1 32 TRP CA 1 1 32 TRP C 1 1 33 ASN N -44.999996 -2.9999998 . 31 . N . 31 . CA . 31 . C . 32 . N 1 1 52 . 1 1 32 TRP C 1 1 33 ASN N 1 1 33 ASN CA 1 1 33 ASN C -128.0 -95.99999 . 31 . C . 32 . N . 32 . CA . 32 . C 1 1 53 . 1 1 33 ASN N 1 1 33 ASN CA 1 1 33 ASN C 1 1 34 GLY N -21.0 21.0 . 32 . N . 32 . CA . 32 . C . 33 . N 1 1 54 . 1 1 33 ASN C 1 1 34 GLY N 1 1 34 GLY CA 1 1 34 GLY C 55.0 77.0 . 32 . C . 33 . N . 33 . CA . 33 . C 1 1 55 . 1 1 34 GLY N 1 1 34 GLY CA 1 1 34 GLY C 1 1 35 ILE N 8.0 44.0 . 33 . N . 33 . CA . 33 . C . 34 . N 1 1 56 . 1 1 34 GLY C 1 1 35 ILE N 1 1 35 ILE CA 1 1 35 ILE C -129.0 -79.0 . 33 . C . 34 . N . 34 . CA . 34 . C 1 1 57 . 1 1 35 ILE N 1 1 35 ILE CA 1 1 35 ILE C 1 1 36 SER N 109.0 161.0 . 34 . N . 34 . CA . 34 . C . 35 . N 1 1 58 . 1 1 35 ILE C 1 1 36 SER N 1 1 36 SER CA 1 1 36 SER C -107.0 -53.0 . 34 . C . 35 . N . 35 . CA . 35 . C 1 1 59 . 1 1 36 SER N 1 1 36 SER CA 1 1 36 SER C 1 1 37 GLY N 111.0 162.99998 . 35 . N . 35 . CA . 35 . C . 36 . N 1 1 60 . 1 1 37 GLY C 1 1 38 ASP N 1 1 38 ASP CA 1 1 38 ASP C -116.0 -60.0 . 36 . C . 37 . N . 37 . CA . 37 . C 1 1 61 . 1 1 38 ASP C 1 1 39 LEU N 1 1 39 LEU CA 1 1 39 LEU C -95.99999 -61.999996 . 37 . C . 38 . N . 38 . CA . 38 . C 1 1 62 . 1 1 39 LEU C 1 1 40 ILE N 1 1 40 ILE CA 1 1 40 ILE C -139.0 -97.0 . 38 . C . 39 . N . 39 . CA . 39 . C 1 1 63 . 1 1 40 ILE N 1 1 40 ILE CA 1 1 40 ILE C 1 1 41 PHE N 118.0 164.0 . 39 . N . 39 . CA . 39 . C . 40 . N 1 1 64 . 1 1 40 ILE C 1 1 41 PHE N 1 1 41 PHE CA 1 1 41 PHE C -150.0 -94.0 . 39 . C . 40 . N . 40 . CA . 40 . C 1 1 65 . 1 1 41 PHE N 1 1 41 PHE CA 1 1 41 PHE C 1 1 42 VAL N 133.0 173.0 . 40 . N . 40 . CA . 40 . C . 41 . N 1 1 66 . 1 1 41 PHE C 1 1 42 VAL N 1 1 42 VAL CA 1 1 42 VAL C -65.0 -49.0 . 40 . C . 41 . N . 41 . CA . 41 . C 1 1 67 . 1 1 42 VAL N 1 1 42 VAL CA 1 1 42 VAL C 1 1 43 GLY N 127.00001 139.0 . 41 . N . 41 . CA . 41 . C . 42 . N 1 1 68 . 1 1 42 VAL C 1 1 43 GLY N 1 1 43 GLY CA 1 1 43 GLY C 85.0 105.0 . 41 . C . 42 . N . 42 . CA . 42 . C 1 1 69 . 1 1 43 GLY N 1 1 43 GLY CA 1 1 43 GLY C 1 1 44 GLN N -21.0 -2.9999998 . 42 . N . 42 . CA . 42 . C . 43 . N 1 1 70 . 1 1 43 GLY C 1 1 44 GLN N 1 1 44 GLN CA 1 1 44 GLN C -75.0 -59.0 . 42 . C . 43 . N . 43 . CA . 43 . C 1 1 71 . 1 1 44 GLN N 1 1 44 GLN CA 1 1 44 GLN C 1 1 45 LYS N 128.0 150.0 . 43 . N . 43 . CA . 43 . C . 44 . N 1 1 72 . 1 1 44 GLN C 1 1 45 LYS N 1 1 45 LYS CA 1 1 45 LYS C -107.0 -73.0 . 43 . C . 44 . N . 44 . CA . 44 . C 1 1 73 . 1 1 45 LYS N 1 1 45 LYS CA 1 1 45 LYS C 1 1 46 LEU N 107.99999 146.0 . 44 . N . 44 . CA . 44 . C . 45 . N 1 1 74 . 1 1 45 LYS C 1 1 46 LEU N 1 1 46 LEU CA 1 1 46 LEU C -140.0 -86.0 . 44 . C . 45 . N . 45 . CA . 45 . C 1 1 75 . 1 1 46 LEU N 1 1 46 LEU CA 1 1 46 LEU C 1 1 47 ILE N 107.99999 152.0 . 45 . N . 45 . CA . 45 . C . 46 . N 1 1 76 . 1 1 48 VAL C 1 1 49 LYS N 1 1 49 LYS CA 1 1 49 LYS C -181.0 -105.0 . 47 . C . 48 . N . 48 . CA . 48 . C 1 1 77 . 1 1 49 LYS N 1 1 49 LYS CA 1 1 49 LYS C 1 1 50 LYS N 118.0 154.0 . 48 . N . 48 . CA . 48 . C . 49 . N 1 1 78 . 1 1 49 LYS C 1 1 50 LYS N 1 1 50 LYS CA 1 1 50 LYS C -126.0 -61.999996 . 48 . C . 49 . N . 49 . CA . 49 . C 1 1 79 . 1 1 50 LYS N 1 1 50 LYS CA 1 1 50 LYS C 1 1 51 GLY N 109.0 165.0 . 49 . N . 49 . CA . 49 . C . 50 . N 1 1 80 . 1 1 6 TYR N 1 1 6 TYR CA 1 1 6 TYR CB 1 1 6 TYR CG 30.0 89.99999 . 5 . N . 5 . CA . 5 . CB . 5 . CG 1 1 81 . 1 1 7 TYR N 1 1 7 TYR CA 1 1 7 TYR CB 1 1 7 TYR CG 150.0 210.0 . 6 . N . 6 . CA . 6 . CB . 6 . CG 1 1 82 . 1 1 8 THR N 1 1 8 THR CA 1 1 8 THR CB 1 1 8 THR OG1 30.0 89.99999 . 7 . N . 7 . CA . 7 . CB . 7 . OG1 1 1 83 . 1 1 9 VAL N 1 1 9 VAL CA 1 1 9 VAL CB 1 1 9 VAL CG1 150.0 210.0 . 8 . N . 8 . CA . 8 . CB . 8 . CG1 1 1 84 . 1 1 13 ASP N 1 1 13 ASP CA 1 1 13 ASP CB 1 1 13 ASP CG 30.0 89.99999 . 12 . N . 12 . CA . 12 . CB . 12 . CG 1 1 85 . 1 1 14 THR N 1 1 14 THR CA 1 1 14 THR CB 1 1 14 THR OG1 -89.99999 -30.0 . 13 . N . 13 . CA . 13 . CB . 13 . OG1 1 1 86 . 1 1 16 ASN N 1 1 16 ASN CA 1 1 16 ASN CB 1 1 16 ASN CG 30.0 89.99999 . 15 . N . 15 . CA . 15 . CB . 15 . CG 1 1 87 . 1 1 18 ILE N 1 1 18 ILE CA 1 1 18 ILE CB 1 1 18 ILE CG1 30.0 89.99999 . 17 . N . 17 . CA . 17 . CB . 17 . CG1 1 1 88 . 1 1 22 TYR N 1 1 22 TYR CA 1 1 22 TYR CB 1 1 22 TYR CG 30.0 89.99999 . 21 . N . 21 . CA . 21 . CB . 21 . CG 1 1 89 . 1 1 24 VAL N 1 1 24 VAL CA 1 1 24 VAL CB 1 1 24 VAL CG1 30.0 89.99999 . 23 . N . 23 . CA . 23 . CB . 23 . CG1 1 1 90 . 1 1 26 VAL N 1 1 26 VAL CA 1 1 26 VAL CB 1 1 26 VAL CG1 150.0 210.0 . 25 . N . 25 . CA . 25 . CB . 25 . CG1 1 1 91 . 1 1 28 ASN N 1 1 28 ASN CA 1 1 28 ASN CB 1 1 28 ASN CG 30.0 89.99999 . 27 . N . 27 . CA . 27 . CB . 27 . CG 1 1 92 . 1 1 29 LEU N 1 1 29 LEU CA 1 1 29 LEU CB 1 1 29 LEU CG 30.0 89.99999 . 28 . N . 28 . CA . 28 . CB . 28 . CG 1 1 93 . 1 1 32 TRP N 1 1 32 TRP CA 1 1 32 TRP CB 1 1 32 TRP CG 44.999996 75.0 . 31 . N . 31 . CA . 31 . CB . 31 . CG 1 1 94 . 1 1 39 LEU N 1 1 39 LEU CA 1 1 39 LEU CB 1 1 39 LEU CG 30.0 89.99999 . 38 . N . 38 . CA . 38 . CB . 38 . CG 1 1 95 . 1 1 41 PHE N 1 1 41 PHE CA 1 1 41 PHE CB 1 1 41 PHE CG 30.0 89.99999 . 40 . N . 40 . CA . 40 . CB . 40 . CG 1 1 96 . 1 1 42 VAL N 1 1 42 VAL CA 1 1 42 VAL CB 1 1 42 VAL CG1 150.0 210.0 . 41 . N . 41 . CA . 41 . CB . 41 . CG1 1 1 97 . 1 1 46 LEU N 1 1 46 LEU CA 1 1 46 LEU CB 1 1 46 LEU CG 30.0 89.99999 . 45 . N . 45 . CA . 45 . CB . 45 . CG 1 1 98 . 1 1 48 VAL N 1 1 48 VAL CA 1 1 48 VAL CB 1 1 48 VAL CG1 30.0 89.99999 . 47 . N . 47 . CA . 47 . CB . 47 . CG1 1 1 stop_ save_ save_conformer_family_coord_set_1 _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Entry_ID 1 _Conformer_family_coord_set.ID 1 loop_ _Atom_site.Model_ID _Atom_site.ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Occupancy _Atom_site.Uncertainty _Atom_site.PDBX_label_asym_ID _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID 1 1 1 1 2 GLY C C 2.543 11.683 -11.829 1.00 . A A . 1 GLY C 1 1 1 2 1 1 2 GLY CA C 1.446 12.699 -12.053 1.00 . A A . 1 GLY CA 1 1 1 3 1 1 2 GLY H H -0.300 12.937 -13.168 1.00 . A A . 1 GLY H 1 1 1 4 1 1 2 GLY HA2 H 1.892 13.634 -12.356 1.00 . A A . 1 GLY HA2 1 1 1 5 1 1 2 GLY HA3 H 0.910 12.847 -11.128 1.00 . A A . 1 GLY HA3 1 1 1 6 1 1 2 GLY N N 0.489 12.260 -13.096 1.00 . A A . 1 GLY N 1 1 1 7 1 1 2 GLY O O 3.384 11.459 -12.705 1.00 . A A . 1 GLY O 1 1 1 8 1 1 3 THR C C 2.889 9.003 -9.405 1.00 . A A . 2 THR C 1 1 1 9 1 1 3 THR CA C 3.514 10.044 -10.333 1.00 . A A . 2 THR CA 1 1 1 10 1 1 3 THR CB C 4.779 10.657 -9.684 1.00 . A A . 2 THR CB 1 1 1 11 1 1 3 THR CG2 C 4.470 11.258 -8.318 1.00 . A A . 2 THR CG2 1 1 1 12 1 1 3 THR H H 1.859 11.309 -9.987 1.00 . A A . 2 THR H 1 1 1 13 1 1 3 THR HA H 3.806 9.559 -11.255 1.00 . A A . 2 THR HA 1 1 1 14 1 1 3 THR HB H 5.142 11.445 -10.329 1.00 . A A . 2 THR HB 1 1 1 15 1 1 3 THR HG1 H 6.568 10.054 -9.106 1.00 . A A . 2 THR HG1 1 1 1 16 1 1 3 THR HG21 H 3.768 12.070 -8.434 1.00 . A A . 2 THR HG21 1 1 1 17 1 1 3 THR HG22 H 5.381 11.631 -7.874 1.00 . A A . 2 THR HG22 1 1 1 18 1 1 3 THR HG23 H 4.042 10.499 -7.680 1.00 . A A . 2 THR HG23 1 1 1 19 1 1 3 THR N N 2.540 11.067 -10.658 1.00 . A A . 2 THR N 1 1 1 20 1 1 3 THR O O 1.980 9.316 -8.633 1.00 . A A . 2 THR O 1 1 1 21 1 1 3 THR OG1 O 5.803 9.664 -9.551 1.00 . A A . 2 THR OG1 1 1 1 22 1 1 4 ASN C C 3.946 5.803 -8.188 1.00 . A A . 3 ASN C 1 1 1 23 1 1 4 ASN CA C 2.814 6.677 -8.701 1.00 . A A . 3 ASN CA 1 1 1 24 1 1 4 ASN CB C 1.848 5.817 -9.531 1.00 . A A . 3 ASN CB 1 1 1 25 1 1 4 ASN CG C 0.678 6.606 -10.093 1.00 . A A . 3 ASN CG 1 1 1 26 1 1 4 ASN H H 4.088 7.575 -10.135 1.00 . A A . 3 ASN H 1 1 1 27 1 1 4 ASN HA H 2.284 7.102 -7.862 1.00 . A A . 3 ASN HA 1 1 1 28 1 1 4 ASN HB2 H 2.389 5.383 -10.358 1.00 . A A . 3 ASN HB2 1 1 1 29 1 1 4 ASN HB3 H 1.460 5.024 -8.908 1.00 . A A . 3 ASN HB3 1 1 1 30 1 1 4 ASN HD21 H -0.440 6.154 -8.517 1.00 . A A . 3 ASN HD21 1 1 1 31 1 1 4 ASN HD22 H -1.197 7.149 -9.714 1.00 . A A . 3 ASN HD22 1 1 1 32 1 1 4 ASN N N 3.352 7.766 -9.504 1.00 . A A . 3 ASN N 1 1 1 33 1 1 4 ASN ND2 N -0.429 6.637 -9.366 1.00 . A A . 3 ASN ND2 1 1 1 34 1 1 4 ASN O O 4.824 5.411 -8.954 1.00 . A A . 3 ASN O 1 1 1 35 1 1 4 ASN OD1 O 0.765 7.173 -11.181 1.00 . A A . 3 ASN OD1 1 1 1 36 1 1 5 THR C C 4.273 3.289 -5.984 1.00 . A A . 4 THR C 1 1 1 37 1 1 5 THR CA C 4.934 4.610 -6.352 1.00 . A A . 4 THR CA 1 1 1 38 1 1 5 THR CB C 5.614 5.241 -5.118 1.00 . A A . 4 THR CB 1 1 1 39 1 1 5 THR CG2 C 6.717 4.344 -4.568 1.00 . A A . 4 THR CG2 1 1 1 40 1 1 5 THR H H 3.260 5.875 -6.301 1.00 . A A . 4 THR H 1 1 1 41 1 1 5 THR HA H 5.687 4.435 -7.108 1.00 . A A . 4 THR HA 1 1 1 42 1 1 5 THR HB H 4.864 5.387 -4.353 1.00 . A A . 4 THR HB 1 1 1 43 1 1 5 THR HG1 H 6.588 6.453 -6.340 1.00 . A A . 4 THR HG1 1 1 1 44 1 1 5 THR HG21 H 6.289 3.407 -4.242 1.00 . A A . 4 THR HG21 1 1 1 45 1 1 5 THR HG22 H 7.196 4.832 -3.733 1.00 . A A . 4 THR HG22 1 1 1 46 1 1 5 THR HG23 H 7.447 4.157 -5.342 1.00 . A A . 4 THR HG23 1 1 1 47 1 1 5 THR N N 3.942 5.499 -6.901 1.00 . A A . 4 THR N 1 1 1 48 1 1 5 THR O O 3.828 3.094 -4.860 1.00 . A A . 4 THR O 1 1 1 49 1 1 5 THR OG1 O 6.162 6.518 -5.472 1.00 . A A . 4 THR OG1 1 1 1 50 1 1 6 TYR C C 4.532 0.156 -6.080 1.00 . A A . 5 TYR C 1 1 1 51 1 1 6 TYR CA C 3.507 1.128 -6.656 1.00 . A A . 5 TYR CA 1 1 1 52 1 1 6 TYR CB C 2.802 0.539 -7.887 1.00 . A A . 5 TYR CB 1 1 1 53 1 1 6 TYR CD1 C 4.592 0.082 -9.617 1.00 . A A . 5 TYR CD1 1 1 1 54 1 1 6 TYR CD2 C 2.997 1.792 -10.066 1.00 . A A . 5 TYR CD2 1 1 1 55 1 1 6 TYR CE1 C 5.199 0.323 -10.835 1.00 . A A . 5 TYR CE1 1 1 1 56 1 1 6 TYR CE2 C 3.599 2.043 -11.286 1.00 . A A . 5 TYR CE2 1 1 1 57 1 1 6 TYR CG C 3.484 0.811 -9.212 1.00 . A A . 5 TYR CG 1 1 1 58 1 1 6 TYR CZ C 4.701 1.306 -11.666 1.00 . A A . 5 TYR CZ 1 1 1 59 1 1 6 TYR H H 4.510 2.575 -7.839 1.00 . A A . 5 TYR H 1 1 1 60 1 1 6 TYR HA H 2.758 1.336 -5.889 1.00 . A A . 5 TYR HA 1 1 1 61 1 1 6 TYR HB2 H 2.736 -0.531 -7.771 1.00 . A A . 5 TYR HB2 1 1 1 62 1 1 6 TYR HB3 H 1.802 0.946 -7.941 1.00 . A A . 5 TYR HB3 1 1 1 63 1 1 6 TYR HD1 H 4.983 -0.684 -8.964 1.00 . A A . 5 TYR HD1 1 1 1 64 1 1 6 TYR HD2 H 2.132 2.367 -9.763 1.00 . A A . 5 TYR HD2 1 1 1 65 1 1 6 TYR HE1 H 6.060 -0.257 -11.133 1.00 . A A . 5 TYR HE1 1 1 1 66 1 1 6 TYR HE2 H 3.205 2.813 -11.933 1.00 . A A . 5 TYR HE2 1 1 1 67 1 1 6 TYR HH H 5.168 2.468 -13.135 1.00 . A A . 5 TYR HH 1 1 1 68 1 1 6 TYR N N 4.147 2.394 -6.943 1.00 . A A . 5 TYR N 1 1 1 69 1 1 6 TYR O O 5.563 -0.128 -6.694 1.00 . A A . 5 TYR O 1 1 1 70 1 1 6 TYR OH O 5.301 1.542 -12.885 1.00 . A A . 5 TYR OH 1 1 1 71 1 1 7 TYR C C 4.738 -2.506 -3.850 1.00 . A A . 6 TYR C 1 1 1 72 1 1 7 TYR CA C 5.186 -1.065 -4.081 1.00 . A A . 6 TYR CA 1 1 1 73 1 1 7 TYR CB C 5.337 -0.289 -2.759 1.00 . A A . 6 TYR CB 1 1 1 74 1 1 7 TYR CD1 C 7.004 -1.343 -1.165 1.00 . A A . 6 TYR CD1 1 1 1 75 1 1 7 TYR CD2 C 4.679 -1.608 -0.707 1.00 . A A . 6 TYR CD2 1 1 1 76 1 1 7 TYR CE1 C 7.312 -2.065 -0.024 1.00 . A A . 6 TYR CE1 1 1 1 77 1 1 7 TYR CE2 C 4.979 -2.324 0.435 1.00 . A A . 6 TYR CE2 1 1 1 78 1 1 7 TYR CG C 5.684 -1.106 -1.528 1.00 . A A . 6 TYR CG 1 1 1 79 1 1 7 TYR CZ C 6.295 -2.551 0.772 1.00 . A A . 6 TYR CZ 1 1 1 80 1 1 7 TYR H H 3.312 -0.235 -4.562 1.00 . A A . 6 TYR H 1 1 1 81 1 1 7 TYR HA H 6.134 -1.069 -4.597 1.00 . A A . 6 TYR HA 1 1 1 82 1 1 7 TYR HB2 H 6.116 0.447 -2.881 1.00 . A A . 6 TYR HB2 1 1 1 83 1 1 7 TYR HB3 H 4.407 0.225 -2.558 1.00 . A A . 6 TYR HB3 1 1 1 84 1 1 7 TYR HD1 H 7.797 -0.962 -1.790 1.00 . A A . 6 TYR HD1 1 1 1 85 1 1 7 TYR HD2 H 3.647 -1.434 -0.975 1.00 . A A . 6 TYR HD2 1 1 1 86 1 1 7 TYR HE1 H 8.344 -2.242 0.241 1.00 . A A . 6 TYR HE1 1 1 1 87 1 1 7 TYR HE2 H 4.183 -2.704 1.058 1.00 . A A . 6 TYR HE2 1 1 1 88 1 1 7 TYR HH H 7.310 -2.821 2.391 1.00 . A A . 6 TYR HH 1 1 1 89 1 1 7 TYR N N 4.229 -0.345 -4.900 1.00 . A A . 6 TYR N 1 1 1 90 1 1 7 TYR O O 3.560 -2.768 -3.601 1.00 . A A . 6 TYR O 1 1 1 91 1 1 7 TYR OH O 6.595 -3.265 1.910 1.00 . A A . 6 TYR OH 1 1 1 92 1 1 8 THR C C 5.506 -5.019 -2.144 1.00 . A A . 7 THR C 1 1 1 93 1 1 8 THR CA C 5.393 -4.826 -3.634 1.00 . A A . 7 THR CA 1 1 1 94 1 1 8 THR CB C 6.322 -5.833 -4.334 1.00 . A A . 7 THR CB 1 1 1 95 1 1 8 THR CG2 C 5.738 -6.250 -5.666 1.00 . A A . 7 THR CG2 1 1 1 96 1 1 8 THR H H 6.569 -3.189 -4.292 1.00 . A A . 7 THR H 1 1 1 97 1 1 8 THR HA H 4.376 -5.040 -3.934 1.00 . A A . 7 THR HA 1 1 1 98 1 1 8 THR HB H 6.388 -6.712 -3.708 1.00 . A A . 7 THR HB 1 1 1 99 1 1 8 THR HG1 H 7.589 -4.387 -4.820 1.00 . A A . 7 THR HG1 1 1 1 100 1 1 8 THR HG21 H 6.443 -6.878 -6.190 1.00 . A A . 7 THR HG21 1 1 1 101 1 1 8 THR HG22 H 5.522 -5.373 -6.257 1.00 . A A . 7 THR HG22 1 1 1 102 1 1 8 THR HG23 H 4.825 -6.803 -5.490 1.00 . A A . 7 THR HG23 1 1 1 103 1 1 8 THR N N 5.671 -3.442 -3.977 1.00 . A A . 7 THR N 1 1 1 104 1 1 8 THR O O 6.527 -4.683 -1.544 1.00 . A A . 7 THR O 1 1 1 105 1 1 8 THR OG1 O 7.642 -5.296 -4.496 1.00 . A A . 7 THR OG1 1 1 1 106 1 1 9 VAL C C 5.556 -6.568 0.388 1.00 . A A . 8 VAL C 1 1 1 107 1 1 9 VAL CA C 4.383 -5.734 -0.125 1.00 . A A . 8 VAL CA 1 1 1 108 1 1 9 VAL CB C 3.058 -6.392 0.284 1.00 . A A . 8 VAL CB 1 1 1 109 1 1 9 VAL CG1 C 2.934 -6.437 1.799 1.00 . A A . 8 VAL CG1 1 1 1 110 1 1 9 VAL CG2 C 1.882 -5.647 -0.343 1.00 . A A . 8 VAL CG2 1 1 1 111 1 1 9 VAL H H 3.697 -5.843 -2.120 1.00 . A A . 8 VAL H 1 1 1 112 1 1 9 VAL HA H 4.426 -4.754 0.332 1.00 . A A . 8 VAL HA 1 1 1 113 1 1 9 VAL HB H 3.053 -7.407 -0.086 1.00 . A A . 8 VAL HB 1 1 1 114 1 1 9 VAL HG11 H 2.964 -5.431 2.193 1.00 . A A . 8 VAL HG11 1 1 1 115 1 1 9 VAL HG12 H 3.752 -7.010 2.211 1.00 . A A . 8 VAL HG12 1 1 1 116 1 1 9 VAL HG13 H 1.998 -6.902 2.069 1.00 . A A . 8 VAL HG13 1 1 1 117 1 1 9 VAL HG21 H 1.953 -4.592 -0.113 1.00 . A A . 8 VAL HG21 1 1 1 118 1 1 9 VAL HG22 H 0.957 -6.037 0.053 1.00 . A A . 8 VAL HG22 1 1 1 119 1 1 9 VAL HG23 H 1.896 -5.779 -1.416 1.00 . A A . 8 VAL HG23 1 1 1 120 1 1 9 VAL N N 4.457 -5.559 -1.562 1.00 . A A . 8 VAL N 1 1 1 121 1 1 9 VAL O O 5.768 -7.704 -0.036 1.00 . A A . 8 VAL O 1 1 1 122 1 1 10 LYS C C 7.152 -6.851 3.352 1.00 . A A . 9 LYS C 1 1 1 123 1 1 10 LYS CA C 7.481 -6.581 1.893 1.00 . A A . 9 LYS CA 1 1 1 124 1 1 10 LYS CB C 8.708 -5.673 1.781 1.00 . A A . 9 LYS CB 1 1 1 125 1 1 10 LYS CD C 9.982 -6.321 -0.312 1.00 . A A . 9 LYS CD 1 1 1 126 1 1 10 LYS CE C 8.989 -7.282 -0.953 1.00 . A A . 9 LYS CE 1 1 1 127 1 1 10 LYS CG C 9.946 -6.357 1.213 1.00 . A A . 9 LYS CG 1 1 1 128 1 1 10 LYS H H 6.096 -5.037 1.535 1.00 . A A . 9 LYS H 1 1 1 129 1 1 10 LYS HA H 7.674 -7.519 1.392 1.00 . A A . 9 LYS HA 1 1 1 130 1 1 10 LYS HB2 H 8.461 -4.840 1.141 1.00 . A A . 9 LYS HB2 1 1 1 131 1 1 10 LYS HB3 H 8.951 -5.296 2.765 1.00 . A A . 9 LYS HB3 1 1 1 132 1 1 10 LYS HD2 H 9.750 -5.319 -0.639 1.00 . A A . 9 LYS HD2 1 1 1 133 1 1 10 LYS HD3 H 10.979 -6.580 -0.642 1.00 . A A . 9 LYS HD3 1 1 1 134 1 1 10 LYS HE2 H 9.180 -8.278 -0.584 1.00 . A A . 9 LYS HE2 1 1 1 135 1 1 10 LYS HE3 H 7.985 -6.983 -0.683 1.00 . A A . 9 LYS HE3 1 1 1 136 1 1 10 LYS HG2 H 10.824 -5.855 1.592 1.00 . A A . 9 LYS HG2 1 1 1 137 1 1 10 LYS HG3 H 9.953 -7.387 1.540 1.00 . A A . 9 LYS HG3 1 1 1 138 1 1 10 LYS HZ1 H 10.101 -7.451 -2.713 1.00 . A A . 9 LYS HZ1 1 1 1 139 1 1 10 LYS HZ2 H 8.800 -6.373 -2.827 1.00 . A A . 9 LYS HZ2 1 1 1 140 1 1 10 LYS HZ3 H 8.518 -8.043 -2.843 1.00 . A A . 9 LYS HZ3 1 1 1 141 1 1 10 LYS N N 6.325 -5.960 1.271 1.00 . A A . 9 LYS N 1 1 1 142 1 1 10 LYS NZ N 9.111 -7.284 -2.436 1.00 . A A . 9 LYS NZ 1 1 1 143 1 1 10 LYS O O 6.002 -6.672 3.750 1.00 . A A . 9 LYS O 1 1 1 144 1 1 11 SER C C 7.146 -6.437 6.182 1.00 . A A . 10 SER C 1 1 1 145 1 1 11 SER CA C 7.939 -7.584 5.551 1.00 . A A . 10 SER CA 1 1 1 146 1 1 11 SER CB C 9.292 -7.744 6.251 1.00 . A A . 10 SER CB 1 1 1 147 1 1 11 SER H H 9.003 -7.528 3.717 1.00 . A A . 10 SER H 1 1 1 148 1 1 11 SER HA H 7.376 -8.499 5.657 1.00 . A A . 10 SER HA 1 1 1 149 1 1 11 SER HB2 H 9.855 -8.527 5.765 1.00 . A A . 10 SER HB2 1 1 1 150 1 1 11 SER HB3 H 9.840 -6.814 6.186 1.00 . A A . 10 SER HB3 1 1 1 151 1 1 11 SER HG H 8.962 -7.279 8.134 1.00 . A A . 10 SER HG 1 1 1 152 1 1 11 SER N N 8.132 -7.336 4.121 1.00 . A A . 10 SER N 1 1 1 153 1 1 11 SER O O 7.607 -5.292 6.248 1.00 . A A . 10 SER O 1 1 1 154 1 1 11 SER OG O 9.129 -8.084 7.619 1.00 . A A . 10 SER OG 1 1 1 155 1 1 12 GLY C C 3.677 -6.060 6.196 1.00 . A A . 11 GLY C 1 1 1 156 1 1 12 GLY CA C 4.951 -5.779 6.970 1.00 . A A . 11 GLY CA 1 1 1 157 1 1 12 GLY H H 5.743 -7.726 6.761 1.00 . A A . 11 GLY H 1 1 1 158 1 1 12 GLY HA2 H 4.746 -5.815 8.030 1.00 . A A . 11 GLY HA2 1 1 1 159 1 1 12 GLY HA3 H 5.317 -4.798 6.706 1.00 . A A . 11 GLY HA3 1 1 1 160 1 1 12 GLY N N 5.951 -6.773 6.640 1.00 . A A . 11 GLY N 1 1 1 161 1 1 12 GLY O O 2.918 -5.159 5.877 1.00 . A A . 11 GLY O 1 1 1 162 1 1 13 ASP C C 0.986 -7.378 5.351 1.00 . A A . 12 ASP C 1 1 1 163 1 1 13 ASP CA C 2.399 -7.878 5.061 1.00 . A A . 12 ASP CA 1 1 1 164 1 1 13 ASP CB C 2.363 -9.396 5.121 1.00 . A A . 12 ASP CB 1 1 1 165 1 1 13 ASP CG C 1.822 -9.899 6.449 1.00 . A A . 12 ASP CG 1 1 1 166 1 1 13 ASP H H 4.044 -8.000 6.386 1.00 . A A . 12 ASP H 1 1 1 167 1 1 13 ASP HA H 2.658 -7.591 4.054 1.00 . A A . 12 ASP HA 1 1 1 168 1 1 13 ASP HB2 H 1.719 -9.754 4.328 1.00 . A A . 12 ASP HB2 1 1 1 169 1 1 13 ASP HB3 H 3.360 -9.785 4.979 1.00 . A A . 12 ASP HB3 1 1 1 170 1 1 13 ASP N N 3.453 -7.350 5.950 1.00 . A A . 12 ASP N 1 1 1 171 1 1 13 ASP O O 0.054 -7.757 4.656 1.00 . A A . 12 ASP O 1 1 1 172 1 1 13 ASP OD1 O 2.547 -9.811 7.465 1.00 . A A . 12 ASP OD1 1 1 1 173 1 1 13 ASP OD2 O 0.669 -10.374 6.490 1.00 . A A . 12 ASP OD2 1 1 1 174 1 1 14 THR C C -0.737 -4.736 6.522 1.00 . A A . 13 THR C 1 1 1 175 1 1 14 THR CA C -0.547 -6.222 6.765 1.00 . A A . 13 THR CA 1 1 1 176 1 1 14 THR CB C -0.800 -6.570 8.242 1.00 . A A . 13 THR CB 1 1 1 177 1 1 14 THR CG2 C -2.281 -6.509 8.582 1.00 . A A . 13 THR CG2 1 1 1 178 1 1 14 THR H H 1.563 -6.190 6.832 1.00 . A A . 13 THR H 1 1 1 179 1 1 14 THR HA H -1.242 -6.774 6.148 1.00 . A A . 13 THR HA 1 1 1 180 1 1 14 THR HB H -0.272 -5.859 8.861 1.00 . A A . 13 THR HB 1 1 1 181 1 1 14 THR HG1 H -0.322 -8.415 7.696 1.00 . A A . 13 THR HG1 1 1 1 182 1 1 14 THR HG21 H -2.420 -6.743 9.627 1.00 . A A . 13 THR HG21 1 1 1 183 1 1 14 THR HG22 H -2.819 -7.225 7.978 1.00 . A A . 13 THR HG22 1 1 1 184 1 1 14 THR HG23 H -2.655 -5.516 8.382 1.00 . A A . 13 THR HG23 1 1 1 185 1 1 14 THR N N 0.794 -6.592 6.378 1.00 . A A . 13 THR N 1 1 1 186 1 1 14 THR O O 0.186 -3.950 6.728 1.00 . A A . 13 THR O 1 1 1 187 1 1 14 THR OG1 O -0.303 -7.892 8.513 1.00 . A A . 13 THR OG1 1 1 1 188 1 1 15 LEU C C -1.807 -1.937 6.537 1.00 . A A . 14 LEU C 1 1 1 189 1 1 15 LEU CA C -2.193 -3.035 5.559 1.00 . A A . 14 LEU CA 1 1 1 190 1 1 15 LEU CB C -3.665 -2.912 5.178 1.00 . A A . 14 LEU CB 1 1 1 191 1 1 15 LEU CD1 C -3.275 -1.242 3.350 1.00 . A A . 14 LEU CD1 1 1 1 192 1 1 15 LEU CD2 C -5.568 -1.568 4.279 1.00 . A A . 14 LEU CD2 1 1 1 193 1 1 15 LEU CG C -4.083 -1.562 4.596 1.00 . A A . 14 LEU CG 1 1 1 194 1 1 15 LEU H H -2.683 -4.998 6.165 1.00 . A A . 14 LEU H 1 1 1 195 1 1 15 LEU HA H -1.595 -2.925 4.668 1.00 . A A . 14 LEU HA 1 1 1 196 1 1 15 LEU HB2 H -3.886 -3.678 4.451 1.00 . A A . 14 LEU HB2 1 1 1 197 1 1 15 LEU HB3 H -4.258 -3.098 6.061 1.00 . A A . 14 LEU HB3 1 1 1 198 1 1 15 LEU HD11 H -2.221 -1.243 3.591 1.00 . A A . 14 LEU HD11 1 1 1 199 1 1 15 LEU HD12 H -3.558 -0.268 2.976 1.00 . A A . 14 LEU HD12 1 1 1 200 1 1 15 LEU HD13 H -3.470 -1.988 2.593 1.00 . A A . 14 LEU HD13 1 1 1 201 1 1 15 LEU HD21 H -5.847 -0.619 3.844 1.00 . A A . 14 LEU HD21 1 1 1 202 1 1 15 LEU HD22 H -6.131 -1.726 5.188 1.00 . A A . 14 LEU HD22 1 1 1 203 1 1 15 LEU HD23 H -5.784 -2.362 3.580 1.00 . A A . 14 LEU HD23 1 1 1 204 1 1 15 LEU HG H -3.898 -0.788 5.327 1.00 . A A . 14 LEU HG 1 1 1 205 1 1 15 LEU N N -1.937 -4.363 6.099 1.00 . A A . 14 LEU N 1 1 1 206 1 1 15 LEU O O -1.118 -0.989 6.172 1.00 . A A . 14 LEU O 1 1 1 207 1 1 16 ASN C C -0.408 -1.037 9.089 1.00 . A A . 15 ASN C 1 1 1 208 1 1 16 ASN CA C -1.911 -1.091 8.803 1.00 . A A . 15 ASN CA 1 1 1 209 1 1 16 ASN CB C -2.711 -1.363 10.088 1.00 . A A . 15 ASN CB 1 1 1 210 1 1 16 ASN CG C -2.688 -2.822 10.525 1.00 . A A . 15 ASN CG 1 1 1 211 1 1 16 ASN H H -2.761 -2.871 8.023 1.00 . A A . 15 ASN H 1 1 1 212 1 1 16 ASN HA H -2.212 -0.128 8.412 1.00 . A A . 15 ASN HA 1 1 1 213 1 1 16 ASN HB2 H -2.301 -0.766 10.888 1.00 . A A . 15 ASN HB2 1 1 1 214 1 1 16 ASN HB3 H -3.739 -1.074 9.927 1.00 . A A . 15 ASN HB3 1 1 1 215 1 1 16 ASN HD21 H -4.564 -2.673 11.160 1.00 . A A . 15 ASN HD21 1 1 1 216 1 1 16 ASN HD22 H -3.827 -4.228 11.347 1.00 . A A . 15 ASN HD22 1 1 1 217 1 1 16 ASN N N -2.223 -2.083 7.783 1.00 . A A . 15 ASN N 1 1 1 218 1 1 16 ASN ND2 N -3.800 -3.284 11.070 1.00 . A A . 15 ASN ND2 1 1 1 219 1 1 16 ASN O O 0.134 0.026 9.404 1.00 . A A . 15 ASN O 1 1 1 220 1 1 16 ASN OD1 O -1.696 -3.532 10.355 1.00 . A A . 15 ASN OD1 1 1 1 221 1 1 17 LYS C C 2.513 -1.529 8.167 1.00 . A A . 16 LYS C 1 1 1 222 1 1 17 LYS CA C 1.693 -2.261 9.226 1.00 . A A . 16 LYS CA 1 1 1 223 1 1 17 LYS CB C 2.123 -3.732 9.319 1.00 . A A . 16 LYS CB 1 1 1 224 1 1 17 LYS CD C 1.525 -5.884 10.509 1.00 . A A . 16 LYS CD 1 1 1 225 1 1 17 LYS CE C 2.668 -6.600 9.807 1.00 . A A . 16 LYS CE 1 1 1 226 1 1 17 LYS CG C 1.771 -4.385 10.650 1.00 . A A . 16 LYS CG 1 1 1 227 1 1 17 LYS H H -0.208 -2.972 8.620 1.00 . A A . 16 LYS H 1 1 1 228 1 1 17 LYS HA H 1.865 -1.788 10.181 1.00 . A A . 16 LYS HA 1 1 1 229 1 1 17 LYS HB2 H 1.639 -4.289 8.530 1.00 . A A . 16 LYS HB2 1 1 1 230 1 1 17 LYS HB3 H 3.194 -3.792 9.185 1.00 . A A . 16 LYS HB3 1 1 1 231 1 1 17 LYS HD2 H 1.404 -6.309 11.495 1.00 . A A . 16 LYS HD2 1 1 1 232 1 1 17 LYS HD3 H 0.619 -6.034 9.942 1.00 . A A . 16 LYS HD3 1 1 1 233 1 1 17 LYS HE2 H 2.850 -6.119 8.857 1.00 . A A . 16 LYS HE2 1 1 1 234 1 1 17 LYS HE3 H 3.552 -6.528 10.422 1.00 . A A . 16 LYS HE3 1 1 1 235 1 1 17 LYS HG2 H 2.587 -4.231 11.340 1.00 . A A . 16 LYS HG2 1 1 1 236 1 1 17 LYS HG3 H 0.878 -3.919 11.040 1.00 . A A . 16 LYS HG3 1 1 1 237 1 1 17 LYS HZ1 H 2.438 -8.581 10.459 1.00 . A A . 16 LYS HZ1 1 1 1 238 1 1 17 LYS HZ2 H 3.014 -8.444 8.873 1.00 . A A . 16 LYS HZ2 1 1 1 239 1 1 17 LYS HZ3 H 1.384 -8.141 9.206 1.00 . A A . 16 LYS HZ3 1 1 1 240 1 1 17 LYS N N 0.266 -2.175 8.943 1.00 . A A . 16 LYS N 1 1 1 241 1 1 17 LYS NZ N 2.356 -8.038 9.569 1.00 . A A . 16 LYS NZ 1 1 1 242 1 1 17 LYS O O 3.385 -0.726 8.498 1.00 . A A . 16 LYS O 1 1 1 243 1 1 18 ILE C C 2.534 0.334 5.666 1.00 . A A . 17 ILE C 1 1 1 244 1 1 18 ILE CA C 2.931 -1.128 5.809 1.00 . A A . 17 ILE CA 1 1 1 245 1 1 18 ILE CB C 2.742 -1.844 4.454 1.00 . A A . 17 ILE CB 1 1 1 246 1 1 18 ILE CD1 C 1.080 -3.096 2.987 1.00 . A A . 17 ILE CD1 1 1 1 247 1 1 18 ILE CG1 C 1.340 -2.446 4.328 1.00 . A A . 17 ILE CG1 1 1 1 248 1 1 18 ILE CG2 C 3.817 -2.898 4.244 1.00 . A A . 17 ILE CG2 1 1 1 249 1 1 18 ILE H H 1.485 -2.406 6.688 1.00 . A A . 17 ILE H 1 1 1 250 1 1 18 ILE HA H 3.983 -1.166 6.057 1.00 . A A . 17 ILE HA 1 1 1 251 1 1 18 ILE HB H 2.863 -1.107 3.682 1.00 . A A . 17 ILE HB 1 1 1 252 1 1 18 ILE HD11 H 0.088 -3.523 2.978 1.00 . A A . 17 ILE HD11 1 1 1 253 1 1 18 ILE HD12 H 1.812 -3.873 2.813 1.00 . A A . 17 ILE HD12 1 1 1 254 1 1 18 ILE HD13 H 1.157 -2.351 2.207 1.00 . A A . 17 ILE HD13 1 1 1 255 1 1 18 ILE HG12 H 1.205 -3.199 5.092 1.00 . A A . 17 ILE HG12 1 1 1 256 1 1 18 ILE HG13 H 0.606 -1.666 4.466 1.00 . A A . 17 ILE HG13 1 1 1 257 1 1 18 ILE HG21 H 3.778 -3.616 5.050 1.00 . A A . 17 ILE HG21 1 1 1 258 1 1 18 ILE HG22 H 4.788 -2.425 4.228 1.00 . A A . 17 ILE HG22 1 1 1 259 1 1 18 ILE HG23 H 3.646 -3.401 3.304 1.00 . A A . 17 ILE HG23 1 1 1 260 1 1 18 ILE N N 2.208 -1.775 6.898 1.00 . A A . 17 ILE N 1 1 1 261 1 1 18 ILE O O 3.378 1.188 5.398 1.00 . A A . 17 ILE O 1 1 1 262 1 1 19 ALA C C 1.504 2.916 6.692 1.00 . A A . 18 ALA C 1 1 1 263 1 1 19 ALA CA C 0.760 1.987 5.745 1.00 . A A . 18 ALA CA 1 1 1 264 1 1 19 ALA CB C -0.724 2.032 6.048 1.00 . A A . 18 ALA CB 1 1 1 265 1 1 19 ALA H H 0.625 -0.101 6.076 1.00 . A A . 18 ALA H 1 1 1 266 1 1 19 ALA HA H 0.913 2.316 4.728 1.00 . A A . 18 ALA HA 1 1 1 267 1 1 19 ALA HB1 H -0.890 1.703 7.064 1.00 . A A . 18 ALA HB1 1 1 1 268 1 1 19 ALA HB2 H -1.250 1.382 5.366 1.00 . A A . 18 ALA HB2 1 1 1 269 1 1 19 ALA HB3 H -1.081 3.043 5.932 1.00 . A A . 18 ALA HB3 1 1 1 270 1 1 19 ALA N N 1.255 0.622 5.862 1.00 . A A . 18 ALA N 1 1 1 271 1 1 19 ALA O O 2.018 3.959 6.285 1.00 . A A . 18 ALA O 1 1 1 272 1 1 20 ALA C C 3.805 3.195 8.738 1.00 . A A . 19 ALA C 1 1 1 273 1 1 20 ALA CA C 2.299 3.296 8.946 1.00 . A A . 19 ALA CA 1 1 1 274 1 1 20 ALA CB C 1.915 2.845 10.345 1.00 . A A . 19 ALA CB 1 1 1 275 1 1 20 ALA H H 1.161 1.670 8.217 1.00 . A A . 19 ALA H 1 1 1 276 1 1 20 ALA HA H 2.000 4.328 8.831 1.00 . A A . 19 ALA HA 1 1 1 277 1 1 20 ALA HB1 H 2.256 1.832 10.504 1.00 . A A . 19 ALA HB1 1 1 1 278 1 1 20 ALA HB2 H 0.840 2.883 10.450 1.00 . A A . 19 ALA HB2 1 1 1 279 1 1 20 ALA HB3 H 2.371 3.499 11.072 1.00 . A A . 19 ALA HB3 1 1 1 280 1 1 20 ALA N N 1.591 2.513 7.950 1.00 . A A . 19 ALA N 1 1 1 281 1 1 20 ALA O O 4.564 4.068 9.164 1.00 . A A . 19 ALA O 1 1 1 282 1 1 21 GLN C C 6.248 2.931 6.899 1.00 . A A . 20 GLN C 1 1 1 283 1 1 21 GLN CA C 5.645 1.883 7.839 1.00 . A A . 20 GLN CA 1 1 1 284 1 1 21 GLN CB C 5.850 0.481 7.260 1.00 . A A . 20 GLN CB 1 1 1 285 1 1 21 GLN CD C 7.451 -1.387 6.715 1.00 . A A . 20 GLN CD 1 1 1 286 1 1 21 GLN CG C 7.278 -0.024 7.355 1.00 . A A . 20 GLN CG 1 1 1 287 1 1 21 GLN H H 3.565 1.480 7.732 1.00 . A A . 20 GLN H 1 1 1 288 1 1 21 GLN HA H 6.149 1.943 8.793 1.00 . A A . 20 GLN HA 1 1 1 289 1 1 21 GLN HB2 H 5.212 -0.211 7.789 1.00 . A A . 20 GLN HB2 1 1 1 290 1 1 21 GLN HB3 H 5.565 0.492 6.217 1.00 . A A . 20 GLN HB3 1 1 1 291 1 1 21 GLN HE21 H 6.971 -2.292 8.424 1.00 . A A . 20 GLN HE21 1 1 1 292 1 1 21 GLN HE22 H 7.333 -3.334 7.086 1.00 . A A . 20 GLN HE22 1 1 1 293 1 1 21 GLN HG2 H 7.929 0.677 6.855 1.00 . A A . 20 GLN HG2 1 1 1 294 1 1 21 GLN HG3 H 7.555 -0.093 8.396 1.00 . A A . 20 GLN HG3 1 1 1 295 1 1 21 GLN N N 4.228 2.129 8.069 1.00 . A A . 20 GLN N 1 1 1 296 1 1 21 GLN NE2 N 7.232 -2.442 7.485 1.00 . A A . 20 GLN NE2 1 1 1 297 1 1 21 GLN O O 7.299 3.499 7.201 1.00 . A A . 20 GLN O 1 1 1 298 1 1 21 GLN OE1 O 7.771 -1.490 5.534 1.00 . A A . 20 GLN OE1 1 1 1 299 1 1 22 TYR C C 5.320 5.503 4.835 1.00 . A A . 21 TYR C 1 1 1 300 1 1 22 TYR CA C 6.116 4.198 4.834 1.00 . A A . 21 TYR CA 1 1 1 301 1 1 22 TYR CB C 6.266 3.638 3.408 1.00 . A A . 21 TYR CB 1 1 1 302 1 1 22 TYR CD1 C 3.983 3.142 2.457 1.00 . A A . 21 TYR CD1 1 1 1 303 1 1 22 TYR CD2 C 5.412 1.310 2.974 1.00 . A A . 21 TYR CD2 1 1 1 304 1 1 22 TYR CE1 C 3.019 2.264 2.006 1.00 . A A . 21 TYR CE1 1 1 1 305 1 1 22 TYR CE2 C 4.451 0.427 2.528 1.00 . A A . 21 TYR CE2 1 1 1 306 1 1 22 TYR CG C 5.193 2.680 2.949 1.00 . A A . 21 TYR CG 1 1 1 307 1 1 22 TYR CZ C 3.257 0.910 2.044 1.00 . A A . 21 TYR CZ 1 1 1 308 1 1 22 TYR H H 4.744 2.742 5.574 1.00 . A A . 21 TYR H 1 1 1 309 1 1 22 TYR HA H 7.108 4.438 5.191 1.00 . A A . 21 TYR HA 1 1 1 310 1 1 22 TYR HB2 H 6.267 4.463 2.713 1.00 . A A . 21 TYR HB2 1 1 1 311 1 1 22 TYR HB3 H 7.213 3.124 3.337 1.00 . A A . 21 TYR HB3 1 1 1 312 1 1 22 TYR HD1 H 3.797 4.205 2.432 1.00 . A A . 21 TYR HD1 1 1 1 313 1 1 22 TYR HD2 H 6.350 0.934 3.354 1.00 . A A . 21 TYR HD2 1 1 1 314 1 1 22 TYR HE1 H 2.083 2.643 1.624 1.00 . A A . 21 TYR HE1 1 1 1 315 1 1 22 TYR HE2 H 4.639 -0.637 2.557 1.00 . A A . 21 TYR HE2 1 1 1 316 1 1 22 TYR HH H 1.961 0.337 0.748 1.00 . A A . 21 TYR HH 1 1 1 317 1 1 22 TYR N N 5.587 3.209 5.775 1.00 . A A . 21 TYR N 1 1 1 318 1 1 22 TYR O O 5.498 6.342 3.952 1.00 . A A . 21 TYR O 1 1 1 319 1 1 22 TYR OH O 2.297 0.036 1.596 1.00 . A A . 21 TYR OH 1 1 1 320 1 1 23 GLY C C 2.715 7.339 5.135 1.00 . A A . 22 GLY C 1 1 1 321 1 1 23 GLY CA C 3.864 6.994 6.067 1.00 . A A . 22 GLY CA 1 1 1 322 1 1 23 GLY H H 4.234 4.928 6.413 1.00 . A A . 22 GLY H 1 1 1 323 1 1 23 GLY HA2 H 3.495 7.022 7.081 1.00 . A A . 22 GLY HA2 1 1 1 324 1 1 23 GLY HA3 H 4.632 7.746 5.961 1.00 . A A . 22 GLY HA3 1 1 1 325 1 1 23 GLY N N 4.465 5.685 5.833 1.00 . A A . 22 GLY N 1 1 1 326 1 1 23 GLY O O 2.698 8.417 4.531 1.00 . A A . 22 GLY O 1 1 1 327 1 1 24 VAL C C -0.657 6.248 5.035 1.00 . A A . 23 VAL C 1 1 1 328 1 1 24 VAL CA C 0.556 6.708 4.241 1.00 . A A . 23 VAL CA 1 1 1 329 1 1 24 VAL CB C 0.574 6.028 2.850 1.00 . A A . 23 VAL CB 1 1 1 330 1 1 24 VAL CG1 C 0.836 4.542 2.986 1.00 . A A . 23 VAL CG1 1 1 1 331 1 1 24 VAL CG2 C -0.723 6.266 2.095 1.00 . A A . 23 VAL CG2 1 1 1 332 1 1 24 VAL H H 1.873 5.554 5.431 1.00 . A A . 23 VAL H 1 1 1 333 1 1 24 VAL HA H 0.493 7.778 4.096 1.00 . A A . 23 VAL HA 1 1 1 334 1 1 24 VAL HB H 1.373 6.462 2.270 1.00 . A A . 23 VAL HB 1 1 1 335 1 1 24 VAL HG11 H 0.874 4.091 2.006 1.00 . A A . 23 VAL HG11 1 1 1 336 1 1 24 VAL HG12 H 0.040 4.088 3.559 1.00 . A A . 23 VAL HG12 1 1 1 337 1 1 24 VAL HG13 H 1.777 4.388 3.492 1.00 . A A . 23 VAL HG13 1 1 1 338 1 1 24 VAL HG21 H -1.547 5.848 2.655 1.00 . A A . 23 VAL HG21 1 1 1 339 1 1 24 VAL HG22 H -0.668 5.792 1.126 1.00 . A A . 23 VAL HG22 1 1 1 340 1 1 24 VAL HG23 H -0.877 7.326 1.969 1.00 . A A . 23 VAL HG23 1 1 1 341 1 1 24 VAL N N 1.768 6.433 4.998 1.00 . A A . 23 VAL N 1 1 1 342 1 1 24 VAL O O -0.598 5.250 5.751 1.00 . A A . 23 VAL O 1 1 1 343 1 1 25 SER C C -3.595 5.402 5.000 1.00 . A A . 24 SER C 1 1 1 344 1 1 25 SER CA C -2.960 6.644 5.626 1.00 . A A . 24 SER CA 1 1 1 345 1 1 25 SER CB C -3.935 7.827 5.599 1.00 . A A . 24 SER CB 1 1 1 346 1 1 25 SER H H -1.721 7.795 4.376 1.00 . A A . 24 SER H 1 1 1 347 1 1 25 SER HA H -2.706 6.424 6.651 1.00 . A A . 24 SER HA 1 1 1 348 1 1 25 SER HB2 H -3.476 8.678 6.080 1.00 . A A . 24 SER HB2 1 1 1 349 1 1 25 SER HB3 H -4.164 8.076 4.574 1.00 . A A . 24 SER HB3 1 1 1 350 1 1 25 SER HG H -5.559 8.348 6.567 1.00 . A A . 24 SER HG 1 1 1 351 1 1 25 SER N N -1.740 6.992 4.934 1.00 . A A . 24 SER N 1 1 1 352 1 1 25 SER O O -3.484 5.157 3.788 1.00 . A A . 24 SER O 1 1 1 353 1 1 25 SER OG O -5.143 7.523 6.275 1.00 . A A . 24 SER OG 1 1 1 354 1 1 26 VAL C C -6.034 3.861 4.357 1.00 . A A . 25 VAL C 1 1 1 355 1 1 26 VAL CA C -4.975 3.445 5.375 1.00 . A A . 25 VAL CA 1 1 1 356 1 1 26 VAL CB C -5.644 2.709 6.559 1.00 . A A . 25 VAL CB 1 1 1 357 1 1 26 VAL CG1 C -6.293 1.414 6.099 1.00 . A A . 25 VAL CG1 1 1 1 358 1 1 26 VAL CG2 C -4.628 2.435 7.660 1.00 . A A . 25 VAL CG2 1 1 1 359 1 1 26 VAL H H -4.228 4.815 6.801 1.00 . A A . 25 VAL H 1 1 1 360 1 1 26 VAL HA H -4.279 2.769 4.901 1.00 . A A . 25 VAL HA 1 1 1 361 1 1 26 VAL HB H -6.415 3.348 6.963 1.00 . A A . 25 VAL HB 1 1 1 362 1 1 26 VAL HG11 H -5.548 0.783 5.638 1.00 . A A . 25 VAL HG11 1 1 1 363 1 1 26 VAL HG12 H -7.072 1.634 5.384 1.00 . A A . 25 VAL HG12 1 1 1 364 1 1 26 VAL HG13 H -6.719 0.903 6.951 1.00 . A A . 25 VAL HG13 1 1 1 365 1 1 26 VAL HG21 H -5.126 1.978 8.503 1.00 . A A . 25 VAL HG21 1 1 1 366 1 1 26 VAL HG22 H -4.173 3.364 7.970 1.00 . A A . 25 VAL HG22 1 1 1 367 1 1 26 VAL HG23 H -3.865 1.768 7.287 1.00 . A A . 25 VAL HG23 1 1 1 368 1 1 26 VAL N N -4.245 4.610 5.837 1.00 . A A . 25 VAL N 1 1 1 369 1 1 26 VAL O O -6.298 3.145 3.398 1.00 . A A . 25 VAL O 1 1 1 370 1 1 27 ALA C C -7.258 5.786 2.262 1.00 . A A . 26 ALA C 1 1 1 371 1 1 27 ALA CA C -7.690 5.515 3.704 1.00 . A A . 26 ALA CA 1 1 1 372 1 1 27 ALA CB C -8.313 6.762 4.312 1.00 . A A . 26 ALA CB 1 1 1 373 1 1 27 ALA H H -6.251 5.636 5.253 1.00 . A A . 26 ALA H 1 1 1 374 1 1 27 ALA HA H -8.442 4.741 3.697 1.00 . A A . 26 ALA HA 1 1 1 375 1 1 27 ALA HB1 H -8.638 6.546 5.319 1.00 . A A . 26 ALA HB1 1 1 1 376 1 1 27 ALA HB2 H -9.161 7.068 3.717 1.00 . A A . 26 ALA HB2 1 1 1 377 1 1 27 ALA HB3 H -7.582 7.556 4.332 1.00 . A A . 26 ALA HB3 1 1 1 378 1 1 27 ALA N N -6.590 5.053 4.539 1.00 . A A . 26 ALA N 1 1 1 379 1 1 27 ALA O O -7.899 5.306 1.326 1.00 . A A . 26 ALA O 1 1 1 380 1 1 28 ASN C C -5.121 5.750 -0.036 1.00 . A A . 27 ASN C 1 1 1 381 1 1 28 ASN CA C -5.757 6.900 0.712 1.00 . A A . 27 ASN CA 1 1 1 382 1 1 28 ASN CB C -4.863 8.159 0.667 1.00 . A A . 27 ASN CB 1 1 1 383 1 1 28 ASN CG C -3.672 8.136 1.595 1.00 . A A . 27 ASN CG 1 1 1 384 1 1 28 ASN H H -5.622 6.805 2.838 1.00 . A A . 27 ASN H 1 1 1 385 1 1 28 ASN HA H -6.663 7.129 0.181 1.00 . A A . 27 ASN HA 1 1 1 386 1 1 28 ASN HB2 H -4.480 8.272 -0.334 1.00 . A A . 27 ASN HB2 1 1 1 387 1 1 28 ASN HB3 H -5.463 9.022 0.911 1.00 . A A . 27 ASN HB3 1 1 1 388 1 1 28 ASN HD21 H -2.678 9.346 0.375 1.00 . A A . 27 ASN HD21 1 1 1 389 1 1 28 ASN HD22 H -1.839 8.866 1.807 1.00 . A A . 27 ASN HD22 1 1 1 390 1 1 28 ASN N N -6.165 6.522 2.068 1.00 . A A . 27 ASN N 1 1 1 391 1 1 28 ASN ND2 N -2.622 8.851 1.220 1.00 . A A . 27 ASN ND2 1 1 1 392 1 1 28 ASN O O -5.421 5.553 -1.220 1.00 . A A . 27 ASN O 1 1 1 393 1 1 28 ASN OD1 O -3.696 7.512 2.640 1.00 . A A . 27 ASN OD1 1 1 1 394 1 1 29 LEU C C -4.703 2.823 -0.486 1.00 . A A . 28 LEU C 1 1 1 395 1 1 29 LEU CA C -3.653 3.870 -0.109 1.00 . A A . 28 LEU CA 1 1 1 396 1 1 29 LEU CB C -2.437 3.282 0.628 1.00 . A A . 28 LEU CB 1 1 1 397 1 1 29 LEU CD1 C -2.594 0.790 0.687 1.00 . A A . 28 LEU CD1 1 1 1 398 1 1 29 LEU CD2 C -1.576 2.035 2.592 1.00 . A A . 28 LEU CD2 1 1 1 399 1 1 29 LEU CG C -2.649 2.064 1.522 1.00 . A A . 28 LEU CG 1 1 1 400 1 1 29 LEU H H -4.102 5.090 1.576 1.00 . A A . 28 LEU H 1 1 1 401 1 1 29 LEU HA H -3.298 4.307 -1.036 1.00 . A A . 28 LEU HA 1 1 1 402 1 1 29 LEU HB2 H -1.704 3.012 -0.116 1.00 . A A . 28 LEU HB2 1 1 1 403 1 1 29 LEU HB3 H -2.015 4.069 1.238 1.00 . A A . 28 LEU HB3 1 1 1 404 1 1 29 LEU HD11 H -1.660 0.763 0.141 1.00 . A A . 28 LEU HD11 1 1 1 405 1 1 29 LEU HD12 H -3.419 0.782 -0.010 1.00 . A A . 28 LEU HD12 1 1 1 406 1 1 29 LEU HD13 H -2.658 -0.075 1.335 1.00 . A A . 28 LEU HD13 1 1 1 407 1 1 29 LEU HD21 H -1.757 2.825 3.305 1.00 . A A . 28 LEU HD21 1 1 1 408 1 1 29 LEU HD22 H -0.606 2.189 2.128 1.00 . A A . 28 LEU HD22 1 1 1 409 1 1 29 LEU HD23 H -1.590 1.080 3.095 1.00 . A A . 28 LEU HD23 1 1 1 410 1 1 29 LEU HG H -3.615 2.123 2.001 1.00 . A A . 28 LEU HG 1 1 1 411 1 1 29 LEU N N -4.288 4.949 0.620 1.00 . A A . 28 LEU N 1 1 1 412 1 1 29 LEU O O -4.606 2.184 -1.529 1.00 . A A . 28 LEU O 1 1 1 413 1 1 30 ARG C C -7.630 2.416 -1.182 1.00 . A A . 29 ARG C 1 1 1 414 1 1 30 ARG CA C -6.866 1.833 0.005 1.00 . A A . 29 ARG CA 1 1 1 415 1 1 30 ARG CB C -7.825 1.690 1.183 1.00 . A A . 29 ARG CB 1 1 1 416 1 1 30 ARG CD C -8.407 0.604 3.350 1.00 . A A . 29 ARG CD 1 1 1 417 1 1 30 ARG CG C -7.408 0.654 2.210 1.00 . A A . 29 ARG CG 1 1 1 418 1 1 30 ARG CZ C -10.844 1.040 3.334 1.00 . A A . 29 ARG CZ 1 1 1 419 1 1 30 ARG H H -5.702 3.122 1.222 1.00 . A A . 29 ARG H 1 1 1 420 1 1 30 ARG HA H -6.493 0.857 -0.267 1.00 . A A . 29 ARG HA 1 1 1 421 1 1 30 ARG HB2 H -7.901 2.644 1.685 1.00 . A A . 29 ARG HB2 1 1 1 422 1 1 30 ARG HB3 H -8.799 1.416 0.803 1.00 . A A . 29 ARG HB3 1 1 1 423 1 1 30 ARG HD2 H -8.147 -0.213 4.008 1.00 . A A . 29 ARG HD2 1 1 1 424 1 1 30 ARG HD3 H -8.358 1.535 3.896 1.00 . A A . 29 ARG HD3 1 1 1 425 1 1 30 ARG HE H -9.886 -0.218 2.100 1.00 . A A . 29 ARG HE 1 1 1 426 1 1 30 ARG HG2 H -7.364 -0.316 1.737 1.00 . A A . 29 ARG HG2 1 1 1 427 1 1 30 ARG HG3 H -6.437 0.916 2.602 1.00 . A A . 29 ARG HG3 1 1 1 428 1 1 30 ARG HH11 H -9.831 2.058 4.771 1.00 . A A . 29 ARG HH11 1 1 1 429 1 1 30 ARG HH12 H -11.537 2.357 4.707 1.00 . A A . 29 ARG HH12 1 1 1 430 1 1 30 ARG HH21 H -12.131 0.218 1.999 1.00 . A A . 29 ARG HH21 1 1 1 431 1 1 30 ARG HH22 H -12.847 1.311 3.147 1.00 . A A . 29 ARG HH22 1 1 1 432 1 1 30 ARG N N -5.721 2.669 0.352 1.00 . A A . 29 ARG N 1 1 1 433 1 1 30 ARG NE N -9.770 0.410 2.853 1.00 . A A . 29 ARG NE 1 1 1 434 1 1 30 ARG NH1 N -10.728 1.885 4.351 1.00 . A A . 29 ARG NH1 1 1 1 435 1 1 30 ARG NH2 N -12.034 0.841 2.780 1.00 . A A . 29 ARG NH2 1 1 1 436 1 1 30 ARG O O -8.136 1.675 -2.018 1.00 . A A . 29 ARG O 1 1 1 437 1 1 31 SER C C -7.978 4.142 -3.690 1.00 . A A . 30 SER C 1 1 1 438 1 1 31 SER CA C -8.491 4.419 -2.278 1.00 . A A . 30 SER CA 1 1 1 439 1 1 31 SER CB C -8.535 5.928 -2.017 1.00 . A A . 30 SER CB 1 1 1 440 1 1 31 SER H H -7.186 4.284 -0.615 1.00 . A A . 30 SER H 1 1 1 441 1 1 31 SER HA H -9.496 4.032 -2.204 1.00 . A A . 30 SER HA 1 1 1 442 1 1 31 SER HB2 H -7.527 6.314 -1.982 1.00 . A A . 30 SER HB2 1 1 1 443 1 1 31 SER HB3 H -9.077 6.413 -2.816 1.00 . A A . 30 SER HB3 1 1 1 444 1 1 31 SER HG H -8.718 5.771 -0.061 1.00 . A A . 30 SER HG 1 1 1 445 1 1 31 SER N N -7.692 3.743 -1.259 1.00 . A A . 30 SER N 1 1 1 446 1 1 31 SER O O -8.768 3.862 -4.591 1.00 . A A . 30 SER O 1 1 1 447 1 1 31 SER OG O -9.181 6.220 -0.784 1.00 . A A . 30 SER OG 1 1 1 448 1 1 32 TRP C C -5.834 2.454 -5.475 1.00 . A A . 31 TRP C 1 1 1 449 1 1 32 TRP CA C -6.121 3.938 -5.231 1.00 . A A . 31 TRP CA 1 1 1 450 1 1 32 TRP CB C -4.873 4.791 -5.509 1.00 . A A . 31 TRP CB 1 1 1 451 1 1 32 TRP CD1 C -3.301 3.819 -3.754 1.00 . A A . 31 TRP CD1 1 1 1 452 1 1 32 TRP CD2 C -3.459 6.045 -3.694 1.00 . A A . 31 TRP CD2 1 1 1 453 1 1 32 TRP CE2 C -2.587 5.628 -2.676 1.00 . A A . 31 TRP CE2 1 1 1 454 1 1 32 TRP CE3 C -3.703 7.413 -3.845 1.00 . A A . 31 TRP CE3 1 1 1 455 1 1 32 TRP CG C -3.917 4.863 -4.364 1.00 . A A . 31 TRP CG 1 1 1 456 1 1 32 TRP CH2 C -2.213 7.843 -1.983 1.00 . A A . 31 TRP CH2 1 1 1 457 1 1 32 TRP CZ2 C -1.960 6.517 -1.813 1.00 . A A . 31 TRP CZ2 1 1 1 458 1 1 32 TRP CZ3 C -3.073 8.297 -2.988 1.00 . A A . 31 TRP CZ3 1 1 1 459 1 1 32 TRP H H -6.064 4.427 -3.151 1.00 . A A . 31 TRP H 1 1 1 460 1 1 32 TRP HA H -6.886 4.236 -5.933 1.00 . A A . 31 TRP HA 1 1 1 461 1 1 32 TRP HB2 H -4.340 4.364 -6.350 1.00 . A A . 31 TRP HB2 1 1 1 462 1 1 32 TRP HB3 H -5.182 5.796 -5.756 1.00 . A A . 31 TRP HB3 1 1 1 463 1 1 32 TRP HD1 H -3.438 2.785 -4.035 1.00 . A A . 31 TRP HD1 1 1 1 464 1 1 32 TRP HE1 H -1.982 3.710 -2.136 1.00 . A A . 31 TRP HE1 1 1 1 465 1 1 32 TRP HE3 H -4.362 7.783 -4.616 1.00 . A A . 31 TRP HE3 1 1 1 466 1 1 32 TRP HH2 H -1.744 8.569 -1.337 1.00 . A A . 31 TRP HH2 1 1 1 467 1 1 32 TRP HZ2 H -1.294 6.183 -1.032 1.00 . A A . 31 TRP HZ2 1 1 1 468 1 1 32 TRP HZ3 H -3.234 9.358 -3.093 1.00 . A A . 31 TRP HZ3 1 1 1 469 1 1 32 TRP N N -6.668 4.196 -3.895 1.00 . A A . 31 TRP N 1 1 1 470 1 1 32 TRP NE1 N -2.513 4.272 -2.733 1.00 . A A . 31 TRP NE1 1 1 1 471 1 1 32 TRP O O -5.432 2.072 -6.573 1.00 . A A . 31 TRP O 1 1 1 472 1 1 33 ASN C C -7.238 -0.546 -4.717 1.00 . A A . 32 ASN C 1 1 1 473 1 1 33 ASN CA C -5.890 0.164 -4.653 1.00 . A A . 32 ASN CA 1 1 1 474 1 1 33 ASN CB C -5.048 -0.459 -3.534 1.00 . A A . 32 ASN CB 1 1 1 475 1 1 33 ASN CG C -3.562 -0.279 -3.741 1.00 . A A . 32 ASN CG 1 1 1 476 1 1 33 ASN H H -6.320 1.961 -3.595 1.00 . A A . 32 ASN H 1 1 1 477 1 1 33 ASN HA H -5.379 0.012 -5.593 1.00 . A A . 32 ASN HA 1 1 1 478 1 1 33 ASN HB2 H -5.314 0.001 -2.593 1.00 . A A . 32 ASN HB2 1 1 1 479 1 1 33 ASN HB3 H -5.258 -1.516 -3.481 1.00 . A A . 32 ASN HB3 1 1 1 480 1 1 33 ASN HD21 H -3.563 1.284 -2.524 1.00 . A A . 32 ASN HD21 1 1 1 481 1 1 33 ASN HD22 H -2.028 0.864 -3.211 1.00 . A A . 32 ASN HD22 1 1 1 482 1 1 33 ASN N N -6.053 1.610 -4.469 1.00 . A A . 32 ASN N 1 1 1 483 1 1 33 ASN ND2 N -2.994 0.720 -3.097 1.00 . A A . 32 ASN ND2 1 1 1 484 1 1 33 ASN O O -7.351 -1.636 -5.279 1.00 . A A . 32 ASN O 1 1 1 485 1 1 33 ASN OD1 O -2.927 -1.052 -4.454 1.00 . A A . 32 ASN OD1 1 1 1 486 1 1 34 GLY C C -9.610 -1.722 -3.178 1.00 . A A . 33 GLY C 1 1 1 487 1 1 34 GLY CA C -9.576 -0.529 -4.113 1.00 . A A . 33 GLY CA 1 1 1 488 1 1 34 GLY H H -8.126 0.969 -3.759 1.00 . A A . 33 GLY H 1 1 1 489 1 1 34 GLY HA2 H -10.294 0.205 -3.774 1.00 . A A . 33 GLY HA2 1 1 1 490 1 1 34 GLY HA3 H -9.847 -0.854 -5.107 1.00 . A A . 33 GLY HA3 1 1 1 491 1 1 34 GLY N N -8.263 0.083 -4.158 1.00 . A A . 33 GLY N 1 1 1 492 1 1 34 GLY O O -10.249 -2.736 -3.468 1.00 . A A . 33 GLY O 1 1 1 493 1 1 35 ILE C C -9.695 -2.452 0.124 1.00 . A A . 34 ILE C 1 1 1 494 1 1 35 ILE CA C -8.825 -2.698 -1.099 1.00 . A A . 34 ILE CA 1 1 1 495 1 1 35 ILE CB C -7.375 -2.929 -0.623 1.00 . A A . 34 ILE CB 1 1 1 496 1 1 35 ILE CD1 C -5.047 -3.613 -1.394 1.00 . A A . 34 ILE CD1 1 1 1 497 1 1 35 ILE CG1 C -6.487 -3.362 -1.790 1.00 . A A . 34 ILE CG1 1 1 1 498 1 1 35 ILE CG2 C -7.348 -3.974 0.487 1.00 . A A . 34 ILE CG2 1 1 1 499 1 1 35 ILE H H -8.472 -0.754 -1.853 1.00 . A A . 34 ILE H 1 1 1 500 1 1 35 ILE HA H -9.164 -3.596 -1.594 1.00 . A A . 34 ILE HA 1 1 1 501 1 1 35 ILE HB H -7.000 -2.001 -0.218 1.00 . A A . 34 ILE HB 1 1 1 502 1 1 35 ILE HD11 H -4.484 -3.923 -2.262 1.00 . A A . 34 ILE HD11 1 1 1 503 1 1 35 ILE HD12 H -5.012 -4.390 -0.645 1.00 . A A . 34 ILE HD12 1 1 1 504 1 1 35 ILE HD13 H -4.621 -2.705 -0.992 1.00 . A A . 34 ILE HD13 1 1 1 505 1 1 35 ILE HG12 H -6.878 -4.275 -2.211 1.00 . A A . 34 ILE HG12 1 1 1 506 1 1 35 ILE HG13 H -6.494 -2.590 -2.546 1.00 . A A . 34 ILE HG13 1 1 1 507 1 1 35 ILE HG21 H -6.356 -4.030 0.907 1.00 . A A . 34 ILE HG21 1 1 1 508 1 1 35 ILE HG22 H -7.622 -4.937 0.080 1.00 . A A . 34 ILE HG22 1 1 1 509 1 1 35 ILE HG23 H -8.054 -3.698 1.259 1.00 . A A . 34 ILE HG23 1 1 1 510 1 1 35 ILE N N -8.920 -1.601 -2.052 1.00 . A A . 34 ILE N 1 1 1 511 1 1 35 ILE O O -9.633 -1.389 0.743 1.00 . A A . 34 ILE O 1 1 1 512 1 1 36 SER C C -10.692 -4.460 2.657 1.00 . A A . 35 SER C 1 1 1 513 1 1 36 SER CA C -11.261 -3.423 1.694 1.00 . A A . 35 SER CA 1 1 1 514 1 1 36 SER CB C -12.728 -3.717 1.410 1.00 . A A . 35 SER CB 1 1 1 515 1 1 36 SER H H -10.615 -4.199 -0.162 1.00 . A A . 35 SER H 1 1 1 516 1 1 36 SER HA H -11.172 -2.442 2.137 1.00 . A A . 35 SER HA 1 1 1 517 1 1 36 SER HB2 H -12.814 -4.701 0.975 1.00 . A A . 35 SER HB2 1 1 1 518 1 1 36 SER HB3 H -13.286 -3.679 2.332 1.00 . A A . 35 SER HB3 1 1 1 519 1 1 36 SER HG H -12.555 -2.387 -0.020 1.00 . A A . 35 SER HG 1 1 1 520 1 1 36 SER N N -10.512 -3.434 0.454 1.00 . A A . 35 SER N 1 1 1 521 1 1 36 SER O O -10.807 -5.661 2.421 1.00 . A A . 35 SER O 1 1 1 522 1 1 36 SER OG O -13.269 -2.768 0.505 1.00 . A A . 35 SER OG 1 1 1 523 1 1 37 GLY C C -8.022 -5.060 4.615 1.00 . A A . 36 GLY C 1 1 1 524 1 1 37 GLY CA C -9.527 -4.906 4.720 1.00 . A A . 36 GLY CA 1 1 1 525 1 1 37 GLY H H -9.962 -3.028 3.844 1.00 . A A . 36 GLY H 1 1 1 526 1 1 37 GLY HA2 H -9.773 -4.533 5.704 1.00 . A A . 36 GLY HA2 1 1 1 527 1 1 37 GLY HA3 H -9.986 -5.874 4.590 1.00 . A A . 36 GLY HA3 1 1 1 528 1 1 37 GLY N N -10.065 -3.996 3.727 1.00 . A A . 36 GLY N 1 1 1 529 1 1 37 GLY O O -7.363 -4.299 3.909 1.00 . A A . 36 GLY O 1 1 1 530 1 1 38 ASP C C -5.650 -7.473 4.464 1.00 . A A . 37 ASP C 1 1 1 531 1 1 38 ASP CA C -6.044 -6.292 5.345 1.00 . A A . 37 ASP CA 1 1 1 532 1 1 38 ASP CB C -5.578 -6.572 6.781 1.00 . A A . 37 ASP CB 1 1 1 533 1 1 38 ASP CG C -5.621 -5.358 7.687 1.00 . A A . 37 ASP CG 1 1 1 534 1 1 38 ASP H H -8.082 -6.677 5.788 1.00 . A A . 37 ASP H 1 1 1 535 1 1 38 ASP HA H -5.552 -5.402 4.982 1.00 . A A . 37 ASP HA 1 1 1 536 1 1 38 ASP HB2 H -6.211 -7.333 7.210 1.00 . A A . 37 ASP HB2 1 1 1 537 1 1 38 ASP HB3 H -4.561 -6.938 6.752 1.00 . A A . 37 ASP HB3 1 1 1 538 1 1 38 ASP N N -7.487 -6.062 5.301 1.00 . A A . 37 ASP N 1 1 1 539 1 1 38 ASP O O -4.742 -8.229 4.810 1.00 . A A . 37 ASP O 1 1 1 540 1 1 38 ASP OD1 O -4.701 -4.521 7.611 1.00 . A A . 37 ASP OD1 1 1 1 541 1 1 38 ASP OD2 O -6.560 -5.257 8.507 1.00 . A A . 37 ASP OD2 1 1 1 542 1 1 39 LEU C C -4.742 -8.489 1.619 1.00 . A A . 38 LEU C 1 1 1 543 1 1 39 LEU CA C -6.024 -8.748 2.419 1.00 . A A . 38 LEU CA 1 1 1 544 1 1 39 LEU CB C -7.226 -9.057 1.507 1.00 . A A . 38 LEU CB 1 1 1 545 1 1 39 LEU CD1 C -7.423 -7.466 -0.444 1.00 . A A . 38 LEU CD1 1 1 1 546 1 1 39 LEU CD2 C -9.456 -8.137 0.838 1.00 . A A . 38 LEU CD2 1 1 1 547 1 1 39 LEU CG C -7.967 -7.847 0.923 1.00 . A A . 38 LEU CG 1 1 1 548 1 1 39 LEU H H -7.016 -6.987 3.085 1.00 . A A . 38 LEU H 1 1 1 549 1 1 39 LEU HA H -5.846 -9.611 3.044 1.00 . A A . 38 LEU HA 1 1 1 550 1 1 39 LEU HB2 H -6.874 -9.660 0.682 1.00 . A A . 38 LEU HB2 1 1 1 551 1 1 39 LEU HB3 H -7.935 -9.642 2.074 1.00 . A A . 38 LEU HB3 1 1 1 552 1 1 39 LEU HD11 H -6.375 -7.219 -0.358 1.00 . A A . 38 LEU HD11 1 1 1 553 1 1 39 LEU HD12 H -7.965 -6.613 -0.823 1.00 . A A . 38 LEU HD12 1 1 1 554 1 1 39 LEU HD13 H -7.542 -8.299 -1.122 1.00 . A A . 38 LEU HD13 1 1 1 555 1 1 39 LEU HD21 H -9.843 -8.335 1.827 1.00 . A A . 38 LEU HD21 1 1 1 556 1 1 39 LEU HD22 H -9.620 -8.999 0.208 1.00 . A A . 38 LEU HD22 1 1 1 557 1 1 39 LEU HD23 H -9.964 -7.282 0.416 1.00 . A A . 38 LEU HD23 1 1 1 558 1 1 39 LEU HG H -7.831 -7.000 1.581 1.00 . A A . 38 LEU HG 1 1 1 559 1 1 39 LEU N N -6.319 -7.632 3.324 1.00 . A A . 38 LEU N 1 1 1 560 1 1 39 LEU O O -4.741 -8.381 0.392 1.00 . A A . 38 LEU O 1 1 1 561 1 1 40 ILE C C -1.342 -9.183 2.124 1.00 . A A . 39 ILE C 1 1 1 562 1 1 40 ILE CA C -2.354 -8.092 1.772 1.00 . A A . 39 ILE CA 1 1 1 563 1 1 40 ILE CB C -1.873 -6.705 2.264 1.00 . A A . 39 ILE CB 1 1 1 564 1 1 40 ILE CD1 C -2.217 -4.196 1.912 1.00 . A A . 39 ILE CD1 1 1 1 565 1 1 40 ILE CG1 C -2.670 -5.597 1.562 1.00 . A A . 39 ILE CG1 1 1 1 566 1 1 40 ILE CG2 C -0.382 -6.520 2.052 1.00 . A A . 39 ILE CG2 1 1 1 567 1 1 40 ILE H H -3.705 -8.563 3.315 1.00 . A A . 39 ILE H 1 1 1 568 1 1 40 ILE HA H -2.466 -8.051 0.698 1.00 . A A . 39 ILE HA 1 1 1 569 1 1 40 ILE HB H -2.063 -6.647 3.325 1.00 . A A . 39 ILE HB 1 1 1 570 1 1 40 ILE HD11 H -2.267 -4.058 2.983 1.00 . A A . 39 ILE HD11 1 1 1 571 1 1 40 ILE HD12 H -2.857 -3.471 1.425 1.00 . A A . 39 ILE HD12 1 1 1 572 1 1 40 ILE HD13 H -1.200 -4.053 1.579 1.00 . A A . 39 ILE HD13 1 1 1 573 1 1 40 ILE HG12 H -2.574 -5.716 0.493 1.00 . A A . 39 ILE HG12 1 1 1 574 1 1 40 ILE HG13 H -3.712 -5.688 1.834 1.00 . A A . 39 ILE HG13 1 1 1 575 1 1 40 ILE HG21 H -0.083 -5.549 2.421 1.00 . A A . 39 ILE HG21 1 1 1 576 1 1 40 ILE HG22 H -0.153 -6.594 0.999 1.00 . A A . 39 ILE HG22 1 1 1 577 1 1 40 ILE HG23 H 0.158 -7.292 2.596 1.00 . A A . 39 ILE HG23 1 1 1 578 1 1 40 ILE N N -3.644 -8.403 2.345 1.00 . A A . 39 ILE N 1 1 1 579 1 1 40 ILE O O -1.436 -9.810 3.180 1.00 . A A . 39 ILE O 1 1 1 580 1 1 41 PHE C C 1.885 -10.036 0.672 1.00 . A A . 40 PHE C 1 1 1 581 1 1 41 PHE CA C 0.618 -10.442 1.410 1.00 . A A . 40 PHE CA 1 1 1 582 1 1 41 PHE CB C 0.132 -11.811 0.917 1.00 . A A . 40 PHE CB 1 1 1 583 1 1 41 PHE CD1 C 0.470 -11.979 -1.569 1.00 . A A . 40 PHE CD1 1 1 1 584 1 1 41 PHE CD2 C -1.740 -11.639 -0.743 1.00 . A A . 40 PHE CD2 1 1 1 585 1 1 41 PHE CE1 C -0.011 -11.979 -2.864 1.00 . A A . 40 PHE CE1 1 1 1 586 1 1 41 PHE CE2 C -2.226 -11.638 -2.034 1.00 . A A . 40 PHE CE2 1 1 1 587 1 1 41 PHE CG C -0.388 -11.808 -0.494 1.00 . A A . 40 PHE CG 1 1 1 588 1 1 41 PHE CZ C -1.361 -11.808 -3.096 1.00 . A A . 40 PHE CZ 1 1 1 589 1 1 41 PHE H H -0.396 -8.903 0.392 1.00 . A A . 40 PHE H 1 1 1 590 1 1 41 PHE HA H 0.831 -10.500 2.468 1.00 . A A . 40 PHE HA 1 1 1 591 1 1 41 PHE HB2 H 0.953 -12.511 0.962 1.00 . A A . 40 PHE HB2 1 1 1 592 1 1 41 PHE HB3 H -0.662 -12.155 1.562 1.00 . A A . 40 PHE HB3 1 1 1 593 1 1 41 PHE HD1 H 1.527 -12.111 -1.388 1.00 . A A . 40 PHE HD1 1 1 1 594 1 1 41 PHE HD2 H -2.417 -11.506 0.088 1.00 . A A . 40 PHE HD2 1 1 1 595 1 1 41 PHE HE1 H 0.668 -12.114 -3.693 1.00 . A A . 40 PHE HE1 1 1 1 596 1 1 41 PHE HE2 H -3.281 -11.506 -2.213 1.00 . A A . 40 PHE HE2 1 1 1 597 1 1 41 PHE HZ H -1.740 -11.808 -4.108 1.00 . A A . 40 PHE HZ 1 1 1 598 1 1 41 PHE N N -0.408 -9.431 1.216 1.00 . A A . 40 PHE N 1 1 1 599 1 1 41 PHE O O 1.826 -9.238 -0.266 1.00 . A A . 40 PHE O 1 1 1 600 1 1 42 VAL C C 4.293 -10.635 -1.014 1.00 . A A . 41 VAL C 1 1 1 601 1 1 42 VAL CA C 4.305 -10.271 0.470 1.00 . A A . 41 VAL CA 1 1 1 602 1 1 42 VAL CB C 5.463 -11.011 1.180 1.00 . A A . 41 VAL CB 1 1 1 603 1 1 42 VAL CG1 C 6.795 -10.743 0.493 1.00 . A A . 41 VAL CG1 1 1 1 604 1 1 42 VAL CG2 C 5.528 -10.605 2.644 1.00 . A A . 41 VAL CG2 1 1 1 605 1 1 42 VAL H H 2.992 -11.224 1.839 1.00 . A A . 41 VAL H 1 1 1 606 1 1 42 VAL HA H 4.472 -9.207 0.568 1.00 . A A . 41 VAL HA 1 1 1 607 1 1 42 VAL HB H 5.268 -12.072 1.133 1.00 . A A . 41 VAL HB 1 1 1 608 1 1 42 VAL HG11 H 6.985 -9.680 0.478 1.00 . A A . 41 VAL HG11 1 1 1 609 1 1 42 VAL HG12 H 6.760 -11.118 -0.518 1.00 . A A . 41 VAL HG12 1 1 1 610 1 1 42 VAL HG13 H 7.587 -11.242 1.034 1.00 . A A . 41 VAL HG13 1 1 1 611 1 1 42 VAL HG21 H 6.318 -11.151 3.136 1.00 . A A . 41 VAL HG21 1 1 1 612 1 1 42 VAL HG22 H 4.584 -10.827 3.119 1.00 . A A . 41 VAL HG22 1 1 1 613 1 1 42 VAL HG23 H 5.724 -9.545 2.714 1.00 . A A . 41 VAL HG23 1 1 1 614 1 1 42 VAL N N 3.019 -10.584 1.091 1.00 . A A . 41 VAL N 1 1 1 615 1 1 42 VAL O O 3.958 -11.763 -1.382 1.00 . A A . 41 VAL O 1 1 1 616 1 1 43 GLY C C 3.434 -9.214 -3.958 1.00 . A A . 42 GLY C 1 1 1 617 1 1 43 GLY CA C 4.602 -9.911 -3.294 1.00 . A A . 42 GLY CA 1 1 1 618 1 1 43 GLY H H 4.962 -8.809 -1.522 1.00 . A A . 42 GLY H 1 1 1 619 1 1 43 GLY HA2 H 5.519 -9.551 -3.735 1.00 . A A . 42 GLY HA2 1 1 1 620 1 1 43 GLY HA3 H 4.521 -10.973 -3.472 1.00 . A A . 42 GLY HA3 1 1 1 621 1 1 43 GLY N N 4.648 -9.678 -1.866 1.00 . A A . 42 GLY N 1 1 1 622 1 1 43 GLY O O 3.454 -8.982 -5.166 1.00 . A A . 42 GLY O 1 1 1 623 1 1 44 GLN C C 1.688 -6.763 -4.152 1.00 . A A . 43 GLN C 1 1 1 624 1 1 44 GLN CA C 1.265 -8.155 -3.698 1.00 . A A . 43 GLN CA 1 1 1 625 1 1 44 GLN CB C 0.146 -8.058 -2.649 1.00 . A A . 43 GLN CB 1 1 1 626 1 1 44 GLN CD C -2.178 -7.170 -2.105 1.00 . A A . 43 GLN CD 1 1 1 627 1 1 44 GLN CG C -1.008 -7.155 -3.073 1.00 . A A . 43 GLN CG 1 1 1 628 1 1 44 GLN H H 2.440 -9.119 -2.221 1.00 . A A . 43 GLN H 1 1 1 629 1 1 44 GLN HA H 0.898 -8.701 -4.556 1.00 . A A . 43 GLN HA 1 1 1 630 1 1 44 GLN HB2 H -0.248 -9.047 -2.468 1.00 . A A . 43 GLN HB2 1 1 1 631 1 1 44 GLN HB3 H 0.561 -7.670 -1.731 1.00 . A A . 43 GLN HB3 1 1 1 632 1 1 44 GLN HE21 H -1.827 -9.067 -1.635 1.00 . A A . 43 GLN HE21 1 1 1 633 1 1 44 GLN HE22 H -3.169 -8.329 -0.826 1.00 . A A . 43 GLN HE22 1 1 1 634 1 1 44 GLN HG2 H -0.641 -6.140 -3.144 1.00 . A A . 43 GLN HG2 1 1 1 635 1 1 44 GLN HG3 H -1.357 -7.477 -4.043 1.00 . A A . 43 GLN HG3 1 1 1 636 1 1 44 GLN N N 2.415 -8.879 -3.173 1.00 . A A . 43 GLN N 1 1 1 637 1 1 44 GLN NE2 N -2.412 -8.303 -1.457 1.00 . A A . 43 GLN NE2 1 1 1 638 1 1 44 GLN O O 2.431 -6.070 -3.455 1.00 . A A . 43 GLN O 1 1 1 639 1 1 44 GLN OE1 O -2.881 -6.171 -1.958 1.00 . A A . 43 GLN OE1 1 1 1 640 1 1 45 LYS C C 0.509 -4.051 -5.490 1.00 . A A . 44 LYS C 1 1 1 641 1 1 45 LYS CA C 1.562 -5.076 -5.885 1.00 . A A . 44 LYS CA 1 1 1 642 1 1 45 LYS CB C 1.640 -5.185 -7.408 1.00 . A A . 44 LYS CB 1 1 1 643 1 1 45 LYS CD C 3.740 -3.853 -7.713 1.00 . A A . 44 LYS CD 1 1 1 644 1 1 45 LYS CE C 4.556 -3.328 -8.880 1.00 . A A . 44 LYS CE 1 1 1 645 1 1 45 LYS CG C 2.276 -3.987 -8.088 1.00 . A A . 44 LYS CG 1 1 1 646 1 1 45 LYS H H 0.635 -6.970 -5.831 1.00 . A A . 44 LYS H 1 1 1 647 1 1 45 LYS HA H 2.521 -4.773 -5.495 1.00 . A A . 44 LYS HA 1 1 1 648 1 1 45 LYS HB2 H 2.218 -6.062 -7.664 1.00 . A A . 44 LYS HB2 1 1 1 649 1 1 45 LYS HB3 H 0.640 -5.302 -7.798 1.00 . A A . 44 LYS HB3 1 1 1 650 1 1 45 LYS HD2 H 3.829 -3.169 -6.882 1.00 . A A . 44 LYS HD2 1 1 1 651 1 1 45 LYS HD3 H 4.120 -4.824 -7.427 1.00 . A A . 44 LYS HD3 1 1 1 652 1 1 45 LYS HE2 H 4.113 -2.407 -9.230 1.00 . A A . 44 LYS HE2 1 1 1 653 1 1 45 LYS HE3 H 5.564 -3.137 -8.541 1.00 . A A . 44 LYS HE3 1 1 1 654 1 1 45 LYS HG2 H 2.198 -4.106 -9.159 1.00 . A A . 44 LYS HG2 1 1 1 655 1 1 45 LYS HG3 H 1.752 -3.093 -7.783 1.00 . A A . 44 LYS HG3 1 1 1 656 1 1 45 LYS HZ1 H 3.639 -4.646 -10.225 1.00 . A A . 44 LYS HZ1 1 1 1 657 1 1 45 LYS HZ2 H 5.196 -5.124 -9.752 1.00 . A A . 44 LYS HZ2 1 1 1 658 1 1 45 LYS HZ3 H 4.994 -3.850 -10.856 1.00 . A A . 44 LYS HZ3 1 1 1 659 1 1 45 LYS N N 1.226 -6.370 -5.325 1.00 . A A . 44 LYS N 1 1 1 660 1 1 45 LYS NZ N 4.600 -4.304 -10.004 1.00 . A A . 44 LYS NZ 1 1 1 661 1 1 45 LYS O O -0.618 -4.088 -5.987 1.00 . A A . 44 LYS O 1 1 1 662 1 1 46 LEU C C 0.450 -0.738 -4.463 1.00 . A A . 45 LEU C 1 1 1 663 1 1 46 LEU CA C -0.080 -2.136 -4.151 1.00 . A A . 45 LEU CA 1 1 1 664 1 1 46 LEU CB C -0.413 -2.320 -2.653 1.00 . A A . 45 LEU CB 1 1 1 665 1 1 46 LEU CD1 C 0.609 -0.388 -1.390 1.00 . A A . 45 LEU CD1 1 1 1 666 1 1 46 LEU CD2 C 0.414 -2.631 -0.330 1.00 . A A . 45 LEU CD2 1 1 1 667 1 1 46 LEU CG C 0.646 -1.892 -1.631 1.00 . A A . 45 LEU CG 1 1 1 668 1 1 46 LEU H H 1.774 -3.155 -4.216 1.00 . A A . 45 LEU H 1 1 1 669 1 1 46 LEU HA H -0.987 -2.281 -4.721 1.00 . A A . 45 LEU HA 1 1 1 670 1 1 46 LEU HB2 H -1.316 -1.770 -2.442 1.00 . A A . 45 LEU HB2 1 1 1 671 1 1 46 LEU HB3 H -0.613 -3.373 -2.485 1.00 . A A . 45 LEU HB3 1 1 1 672 1 1 46 LEU HD11 H 1.314 -0.127 -0.615 1.00 . A A . 45 LEU HD11 1 1 1 673 1 1 46 LEU HD12 H -0.388 -0.098 -1.086 1.00 . A A . 45 LEU HD12 1 1 1 674 1 1 46 LEU HD13 H 0.869 0.127 -2.303 1.00 . A A . 45 LEU HD13 1 1 1 675 1 1 46 LEU HD21 H -0.536 -2.332 0.088 1.00 . A A . 45 LEU HD21 1 1 1 676 1 1 46 LEU HD22 H 1.205 -2.396 0.366 1.00 . A A . 45 LEU HD22 1 1 1 677 1 1 46 LEU HD23 H 0.403 -3.697 -0.519 1.00 . A A . 45 LEU HD23 1 1 1 678 1 1 46 LEU HG H 1.628 -2.157 -1.996 1.00 . A A . 45 LEU HG 1 1 1 679 1 1 46 LEU N N 0.862 -3.146 -4.590 1.00 . A A . 45 LEU N 1 1 1 680 1 1 46 LEU O O 1.641 -0.467 -4.329 1.00 . A A . 45 LEU O 1 1 1 681 1 1 47 ILE C C 0.079 2.325 -3.958 1.00 . A A . 46 ILE C 1 1 1 682 1 1 47 ILE CA C -0.084 1.507 -5.238 1.00 . A A . 46 ILE CA 1 1 1 683 1 1 47 ILE CB C -1.164 2.204 -6.121 1.00 . A A . 46 ILE CB 1 1 1 684 1 1 47 ILE CD1 C -2.040 0.161 -7.411 1.00 . A A . 46 ILE CD1 1 1 1 685 1 1 47 ILE CG1 C -1.360 1.513 -7.478 1.00 . A A . 46 ILE CG1 1 1 1 686 1 1 47 ILE CG2 C -0.800 3.664 -6.356 1.00 . A A . 46 ILE CG2 1 1 1 687 1 1 47 ILE H H -1.369 -0.161 -5.036 1.00 . A A . 46 ILE H 1 1 1 688 1 1 47 ILE HA H 0.851 1.497 -5.778 1.00 . A A . 46 ILE HA 1 1 1 689 1 1 47 ILE HB H -2.099 2.182 -5.579 1.00 . A A . 46 ILE HB 1 1 1 690 1 1 47 ILE HD11 H -3.022 0.274 -6.975 1.00 . A A . 46 ILE HD11 1 1 1 691 1 1 47 ILE HD12 H -1.451 -0.508 -6.801 1.00 . A A . 46 ILE HD12 1 1 1 692 1 1 47 ILE HD13 H -2.132 -0.247 -8.407 1.00 . A A . 46 ILE HD13 1 1 1 693 1 1 47 ILE HG12 H -1.972 2.153 -8.100 1.00 . A A . 46 ILE HG12 1 1 1 694 1 1 47 ILE HG13 H -0.395 1.381 -7.947 1.00 . A A . 46 ILE HG13 1 1 1 695 1 1 47 ILE HG21 H -0.716 4.172 -5.408 1.00 . A A . 46 ILE HG21 1 1 1 696 1 1 47 ILE HG22 H -1.569 4.137 -6.951 1.00 . A A . 46 ILE HG22 1 1 1 697 1 1 47 ILE HG23 H 0.143 3.719 -6.879 1.00 . A A . 46 ILE HG23 1 1 1 698 1 1 47 ILE N N -0.439 0.132 -4.913 1.00 . A A . 46 ILE N 1 1 1 699 1 1 47 ILE O O -0.706 2.182 -3.022 1.00 . A A . 46 ILE O 1 1 1 700 1 1 48 VAL C C 1.847 5.436 -3.454 1.00 . A A . 47 VAL C 1 1 1 701 1 1 48 VAL CA C 1.195 4.171 -2.870 1.00 . A A . 47 VAL CA 1 1 1 702 1 1 48 VAL CB C 1.946 3.667 -1.601 1.00 . A A . 47 VAL CB 1 1 1 703 1 1 48 VAL CG1 C 3.420 3.395 -1.862 1.00 . A A . 47 VAL CG1 1 1 1 704 1 1 48 VAL CG2 C 1.764 4.647 -0.450 1.00 . A A . 47 VAL CG2 1 1 1 705 1 1 48 VAL H H 1.833 3.076 -4.559 1.00 . A A . 47 VAL H 1 1 1 706 1 1 48 VAL HA H 0.179 4.414 -2.575 1.00 . A A . 47 VAL HA 1 1 1 707 1 1 48 VAL HB H 1.495 2.732 -1.300 1.00 . A A . 47 VAL HB 1 1 1 708 1 1 48 VAL HG11 H 3.516 2.645 -2.634 1.00 . A A . 47 VAL HG11 1 1 1 709 1 1 48 VAL HG12 H 3.887 3.040 -0.956 1.00 . A A . 47 VAL HG12 1 1 1 710 1 1 48 VAL HG13 H 3.903 4.306 -2.184 1.00 . A A . 47 VAL HG13 1 1 1 711 1 1 48 VAL HG21 H 1.999 5.646 -0.784 1.00 . A A . 47 VAL HG21 1 1 1 712 1 1 48 VAL HG22 H 2.425 4.374 0.360 1.00 . A A . 47 VAL HG22 1 1 1 713 1 1 48 VAL HG23 H 0.739 4.610 -0.103 1.00 . A A . 47 VAL HG23 1 1 1 714 1 1 48 VAL N N 1.106 3.155 -3.902 1.00 . A A . 47 VAL N 1 1 1 715 1 1 48 VAL O O 2.969 5.414 -3.949 1.00 . A A . 47 VAL O 1 1 1 716 1 1 49 LYS C C 1.024 8.988 -3.245 1.00 . A A . 48 LYS C 1 1 1 717 1 1 49 LYS CA C 1.647 7.792 -3.956 1.00 . A A . 48 LYS CA 1 1 1 718 1 1 49 LYS CB C 1.537 7.922 -5.486 1.00 . A A . 48 LYS CB 1 1 1 719 1 1 49 LYS CD C -0.686 8.892 -6.203 1.00 . A A . 48 LYS CD 1 1 1 720 1 1 49 LYS CE C -2.075 8.573 -6.726 1.00 . A A . 48 LYS CE 1 1 1 721 1 1 49 LYS CG C 0.155 7.631 -6.062 1.00 . A A . 48 LYS CG 1 1 1 722 1 1 49 LYS H H 0.156 6.450 -3.257 1.00 . A A . 48 LYS H 1 1 1 723 1 1 49 LYS HA H 2.689 7.781 -3.700 1.00 . A A . 48 LYS HA 1 1 1 724 1 1 49 LYS HB2 H 1.808 8.928 -5.766 1.00 . A A . 48 LYS HB2 1 1 1 725 1 1 49 LYS HB3 H 2.240 7.237 -5.936 1.00 . A A . 48 LYS HB3 1 1 1 726 1 1 49 LYS HD2 H -0.775 9.364 -5.236 1.00 . A A . 48 LYS HD2 1 1 1 727 1 1 49 LYS HD3 H -0.196 9.565 -6.891 1.00 . A A . 48 LYS HD3 1 1 1 728 1 1 49 LYS HE2 H -1.983 8.154 -7.715 1.00 . A A . 48 LYS HE2 1 1 1 729 1 1 49 LYS HE3 H -2.533 7.848 -6.070 1.00 . A A . 48 LYS HE3 1 1 1 730 1 1 49 LYS HG2 H 0.271 7.180 -7.036 1.00 . A A . 48 LYS HG2 1 1 1 731 1 1 49 LYS HG3 H -0.357 6.942 -5.406 1.00 . A A . 48 LYS HG3 1 1 1 732 1 1 49 LYS HZ1 H -2.573 10.451 -7.498 1.00 . A A . 48 LYS HZ1 1 1 1 733 1 1 49 LYS HZ2 H -2.973 10.254 -5.863 1.00 . A A . 48 LYS HZ2 1 1 1 734 1 1 49 LYS HZ3 H -3.915 9.506 -7.059 1.00 . A A . 48 LYS HZ3 1 1 1 735 1 1 49 LYS N N 1.095 6.517 -3.499 1.00 . A A . 48 LYS N 1 1 1 736 1 1 49 LYS NZ N -2.942 9.778 -6.792 1.00 . A A . 48 LYS NZ 1 1 1 737 1 1 49 LYS O O -0.174 9.219 -3.319 1.00 . A A . 48 LYS O 1 1 1 738 1 1 50 LYS C C 2.008 12.191 -2.374 1.00 . A A . 49 LYS C 1 1 1 739 1 1 50 LYS CA C 1.387 10.916 -1.815 1.00 . A A . 49 LYS CA 1 1 1 740 1 1 50 LYS CB C 1.716 10.787 -0.319 1.00 . A A . 49 LYS CB 1 1 1 741 1 1 50 LYS CD C 4.111 9.984 -0.484 1.00 . A A . 49 LYS CD 1 1 1 742 1 1 50 LYS CE C 5.564 10.324 -0.193 1.00 . A A . 49 LYS CE 1 1 1 743 1 1 50 LYS CG C 3.174 11.063 0.035 1.00 . A A . 49 LYS CG 1 1 1 744 1 1 50 LYS H H 2.816 9.546 -2.571 1.00 . A A . 49 LYS H 1 1 1 745 1 1 50 LYS HA H 0.315 10.971 -1.934 1.00 . A A . 49 LYS HA 1 1 1 746 1 1 50 LYS HB2 H 1.102 11.483 0.231 1.00 . A A . 49 LYS HB2 1 1 1 747 1 1 50 LYS HB3 H 1.478 9.784 0.001 1.00 . A A . 49 LYS HB3 1 1 1 748 1 1 50 LYS HD2 H 3.866 9.048 -0.005 1.00 . A A . 49 LYS HD2 1 1 1 749 1 1 50 LYS HD3 H 3.978 9.890 -1.552 1.00 . A A . 49 LYS HD3 1 1 1 750 1 1 50 LYS HE2 H 6.187 9.510 -0.533 1.00 . A A . 49 LYS HE2 1 1 1 751 1 1 50 LYS HE3 H 5.825 11.225 -0.730 1.00 . A A . 49 LYS HE3 1 1 1 752 1 1 50 LYS HG2 H 3.463 12.009 -0.398 1.00 . A A . 49 LYS HG2 1 1 1 753 1 1 50 LYS HG3 H 3.266 11.119 1.110 1.00 . A A . 49 LYS HG3 1 1 1 754 1 1 50 LYS HZ1 H 5.283 11.386 1.587 1.00 . A A . 49 LYS HZ1 1 1 1 755 1 1 50 LYS HZ2 H 6.819 10.683 1.438 1.00 . A A . 49 LYS HZ2 1 1 1 756 1 1 50 LYS HZ3 H 5.474 9.713 1.801 1.00 . A A . 49 LYS HZ3 1 1 1 757 1 1 50 LYS N N 1.857 9.754 -2.559 1.00 . A A . 49 LYS N 1 1 1 758 1 1 50 LYS NZ N 5.801 10.541 1.257 1.00 . A A . 49 LYS NZ 1 1 1 759 1 1 50 LYS O O 3.003 12.139 -3.100 1.00 . A A . 49 LYS O 1 1 1 760 1 1 51 GLY C C 0.813 15.511 -2.968 1.00 . A A . 50 GLY C 1 1 1 761 1 1 51 GLY CA C 1.930 14.598 -2.513 1.00 . A A . 50 GLY CA 1 1 1 762 1 1 51 GLY H H 0.653 13.314 -1.420 1.00 . A A . 50 GLY H 1 1 1 763 1 1 51 GLY HA2 H 2.483 15.085 -1.723 1.00 . A A . 50 GLY HA2 1 1 1 764 1 1 51 GLY HA3 H 2.593 14.415 -3.345 1.00 . A A . 50 GLY HA3 1 1 1 765 1 1 51 GLY N N 1.427 13.331 -2.025 1.00 . A A . 50 GLY N 1 1 1 766 1 1 51 GLY O O 0.863 16.724 -2.756 1.00 . A A . 50 GLY O 1 1 1 767 1 1 52 SER C C -2.570 14.775 -4.159 1.00 . A A . 51 SER C 1 1 1 768 1 1 52 SER CA C -1.344 15.683 -4.074 1.00 . A A . 51 SER CA 1 1 1 769 1 1 52 SER CB C -1.054 16.305 -5.441 1.00 . A A . 51 SER CB 1 1 1 770 1 1 52 SER H H -0.160 13.963 -3.769 1.00 . A A . 51 SER H 1 1 1 771 1 1 52 SER HA H -1.540 16.470 -3.360 1.00 . A A . 51 SER HA 1 1 1 772 1 1 52 SER HB2 H -0.942 15.521 -6.173 1.00 . A A . 51 SER HB2 1 1 1 773 1 1 52 SER HB3 H -1.878 16.945 -5.724 1.00 . A A . 51 SER HB3 1 1 1 774 1 1 52 SER HG H 0.395 17.230 -4.498 1.00 . A A . 51 SER HG 1 1 1 775 1 1 52 SER N N -0.192 14.929 -3.606 1.00 . A A . 51 SER N 1 1 1 776 1 1 52 SER O O -3.397 14.793 -3.226 1.00 . A A . 51 SER O 1 1 1 777 1 1 52 SER OG O 0.136 17.078 -5.416 1.00 . A A . 51 SER OG 1 1 2 778 1 1 2 GLY C C 1.619 12.173 -10.739 1.00 . A A . 1 GLY C 1 1 2 779 1 1 2 GLY CA C 0.735 13.398 -10.794 1.00 . A A . 1 GLY CA 1 1 2 780 1 1 2 GLY H H 0.861 13.717 -12.848 1.00 . A A . 1 GLY H 1 1 2 781 1 1 2 GLY HA2 H 0.879 13.976 -9.893 1.00 . A A . 1 GLY HA2 1 1 2 782 1 1 2 GLY HA3 H -0.298 13.087 -10.853 1.00 . A A . 1 GLY HA3 1 1 2 783 1 1 2 GLY N N 1.053 14.243 -11.968 1.00 . A A . 1 GLY N 1 1 2 784 1 1 2 GLY O O 1.842 11.517 -11.759 1.00 . A A . 1 GLY O 1 1 2 785 1 1 3 THR C C 2.170 9.482 -9.073 1.00 . A A . 2 THR C 1 1 2 786 1 1 3 THR CA C 3.004 10.727 -9.377 1.00 . A A . 2 THR CA 1 1 2 787 1 1 3 THR CB C 3.990 10.992 -8.221 1.00 . A A . 2 THR CB 1 1 2 788 1 1 3 THR CG2 C 5.123 9.975 -8.202 1.00 . A A . 2 THR CG2 1 1 2 789 1 1 3 THR H H 1.902 12.424 -8.778 1.00 . A A . 2 THR H 1 1 2 790 1 1 3 THR HA H 3.566 10.573 -10.287 1.00 . A A . 2 THR HA 1 1 2 791 1 1 3 THR HB H 3.452 10.930 -7.285 1.00 . A A . 2 THR HB 1 1 2 792 1 1 3 THR HG1 H 3.907 12.960 -8.008 1.00 . A A . 2 THR HG1 1 1 2 793 1 1 3 THR HG21 H 5.781 10.182 -7.371 1.00 . A A . 2 THR HG21 1 1 2 794 1 1 3 THR HG22 H 5.679 10.038 -9.126 1.00 . A A . 2 THR HG22 1 1 2 795 1 1 3 THR HG23 H 4.713 8.981 -8.096 1.00 . A A . 2 THR HG23 1 1 2 796 1 1 3 THR N N 2.130 11.869 -9.560 1.00 . A A . 2 THR N 1 1 2 797 1 1 3 THR O O 1.012 9.591 -8.667 1.00 . A A . 2 THR O 1 1 2 798 1 1 3 THR OG1 O 4.544 12.310 -8.354 1.00 . A A . 2 THR OG1 1 1 2 799 1 1 4 ASN C C 3.120 5.993 -8.655 1.00 . A A . 3 ASN C 1 1 2 800 1 1 4 ASN CA C 2.078 7.067 -8.924 1.00 . A A . 3 ASN CA 1 1 2 801 1 1 4 ASN CB C 1.070 6.611 -10.003 1.00 . A A . 3 ASN CB 1 1 2 802 1 1 4 ASN CG C 1.695 6.365 -11.369 1.00 . A A . 3 ASN CG 1 1 2 803 1 1 4 ASN H H 3.609 8.272 -9.753 1.00 . A A . 3 ASN H 1 1 2 804 1 1 4 ASN HA H 1.540 7.255 -8.008 1.00 . A A . 3 ASN HA 1 1 2 805 1 1 4 ASN HB2 H 0.604 5.694 -9.678 1.00 . A A . 3 ASN HB2 1 1 2 806 1 1 4 ASN HB3 H 0.308 7.370 -10.111 1.00 . A A . 3 ASN HB3 1 1 2 807 1 1 4 ASN HD21 H 1.791 4.407 -11.016 1.00 . A A . 3 ASN HD21 1 1 2 808 1 1 4 ASN HD22 H 2.407 4.931 -12.544 1.00 . A A . 3 ASN HD22 1 1 2 809 1 1 4 ASN N N 2.732 8.308 -9.304 1.00 . A A . 3 ASN N 1 1 2 810 1 1 4 ASN ND2 N 1.992 5.109 -11.676 1.00 . A A . 3 ASN ND2 1 1 2 811 1 1 4 ASN O O 3.858 5.589 -9.552 1.00 . A A . 3 ASN O 1 1 2 812 1 1 4 ASN OD1 O 1.866 7.291 -12.164 1.00 . A A . 3 ASN OD1 1 1 2 813 1 1 5 THR C C 3.356 3.283 -6.656 1.00 . A A . 4 THR C 1 1 2 814 1 1 5 THR CA C 4.144 4.518 -7.058 1.00 . A A . 4 THR CA 1 1 2 815 1 1 5 THR CB C 5.060 4.990 -5.902 1.00 . A A . 4 THR CB 1 1 2 816 1 1 5 THR CG2 C 6.030 3.903 -5.450 1.00 . A A . 4 THR CG2 1 1 2 817 1 1 5 THR H H 2.641 5.932 -6.697 1.00 . A A . 4 THR H 1 1 2 818 1 1 5 THR HA H 4.753 4.294 -7.921 1.00 . A A . 4 THR HA 1 1 2 819 1 1 5 THR HB H 4.432 5.261 -5.065 1.00 . A A . 4 THR HB 1 1 2 820 1 1 5 THR HG1 H 5.695 6.841 -5.649 1.00 . A A . 4 THR HG1 1 1 2 821 1 1 5 THR HG21 H 6.615 3.569 -6.291 1.00 . A A . 4 THR HG21 1 1 2 822 1 1 5 THR HG22 H 5.473 3.069 -5.042 1.00 . A A . 4 THR HG22 1 1 2 823 1 1 5 THR HG23 H 6.686 4.301 -4.689 1.00 . A A . 4 THR HG23 1 1 2 824 1 1 5 THR N N 3.215 5.557 -7.408 1.00 . A A . 4 THR N 1 1 2 825 1 1 5 THR O O 2.191 3.378 -6.274 1.00 . A A . 4 THR O 1 1 2 826 1 1 5 THR OG1 O 5.801 6.147 -6.309 1.00 . A A . 4 THR OG1 1 1 2 827 1 1 6 TYR C C 4.437 0.199 -5.471 1.00 . A A . 5 TYR C 1 1 2 828 1 1 6 TYR CA C 3.370 0.944 -6.238 1.00 . A A . 5 TYR CA 1 1 2 829 1 1 6 TYR CB C 2.714 0.057 -7.301 1.00 . A A . 5 TYR CB 1 1 2 830 1 1 6 TYR CD1 C 4.532 -0.670 -8.897 1.00 . A A . 5 TYR CD1 1 1 2 831 1 1 6 TYR CD2 C 2.880 0.860 -9.677 1.00 . A A . 5 TYR CD2 1 1 2 832 1 1 6 TYR CE1 C 5.144 -0.643 -10.135 1.00 . A A . 5 TYR CE1 1 1 2 833 1 1 6 TYR CE2 C 3.484 0.893 -10.915 1.00 . A A . 5 TYR CE2 1 1 2 834 1 1 6 TYR CG C 3.393 0.083 -8.650 1.00 . A A . 5 TYR CG 1 1 2 835 1 1 6 TYR CZ C 4.617 0.140 -11.142 1.00 . A A . 5 TYR CZ 1 1 2 836 1 1 6 TYR H H 4.791 2.073 -7.296 1.00 . A A . 5 TYR H 1 1 2 837 1 1 6 TYR HA H 2.606 1.274 -5.533 1.00 . A A . 5 TYR HA 1 1 2 838 1 1 6 TYR HB2 H 2.718 -0.964 -6.955 1.00 . A A . 5 TYR HB2 1 1 2 839 1 1 6 TYR HB3 H 1.692 0.379 -7.440 1.00 . A A . 5 TYR HB3 1 1 2 840 1 1 6 TYR HD1 H 4.940 -1.281 -8.107 1.00 . A A . 5 TYR HD1 1 1 2 841 1 1 6 TYR HD2 H 1.994 1.451 -9.497 1.00 . A A . 5 TYR HD2 1 1 2 842 1 1 6 TYR HE1 H 6.031 -1.235 -10.309 1.00 . A A . 5 TYR HE1 1 1 2 843 1 1 6 TYR HE2 H 3.063 1.505 -11.700 1.00 . A A . 5 TYR HE2 1 1 2 844 1 1 6 TYR HH H 5.372 1.091 -12.637 1.00 . A A . 5 TYR HH 1 1 2 845 1 1 6 TYR N N 3.946 2.131 -6.805 1.00 . A A . 5 TYR N 1 1 2 846 1 1 6 TYR O O 5.613 0.208 -5.845 1.00 . A A . 5 TYR O 1 1 2 847 1 1 6 TYR OH O 5.229 0.173 -12.375 1.00 . A A . 5 TYR OH 1 1 2 848 1 1 7 TYR C C 4.696 -2.551 -3.459 1.00 . A A . 6 TYR C 1 1 2 849 1 1 7 TYR CA C 4.948 -1.058 -3.490 1.00 . A A . 6 TYR CA 1 1 2 850 1 1 7 TYR CB C 4.775 -0.432 -2.098 1.00 . A A . 6 TYR CB 1 1 2 851 1 1 7 TYR CD1 C 6.870 -1.095 -0.837 1.00 . A A . 6 TYR CD1 1 1 2 852 1 1 7 TYR CD2 C 4.761 -1.816 0.005 1.00 . A A . 6 TYR CD2 1 1 2 853 1 1 7 TYR CE1 C 7.505 -1.719 0.221 1.00 . A A . 6 TYR CE1 1 1 2 854 1 1 7 TYR CE2 C 5.384 -2.435 1.065 1.00 . A A . 6 TYR CE2 1 1 2 855 1 1 7 TYR CG C 5.488 -1.135 -0.963 1.00 . A A . 6 TYR CG 1 1 2 856 1 1 7 TYR CZ C 6.757 -2.385 1.170 1.00 . A A . 6 TYR CZ 1 1 2 857 1 1 7 TYR H H 3.061 -0.470 -4.208 1.00 . A A . 6 TYR H 1 1 2 858 1 1 7 TYR HA H 5.952 -0.875 -3.841 1.00 . A A . 6 TYR HA 1 1 2 859 1 1 7 TYR HB2 H 5.144 0.582 -2.127 1.00 . A A . 6 TYR HB2 1 1 2 860 1 1 7 TYR HB3 H 3.721 -0.410 -1.860 1.00 . A A . 6 TYR HB3 1 1 2 861 1 1 7 TYR HD1 H 7.452 -0.570 -1.581 1.00 . A A . 6 TYR HD1 1 1 2 862 1 1 7 TYR HD2 H 3.687 -1.853 -0.080 1.00 . A A . 6 TYR HD2 1 1 2 863 1 1 7 TYR HE1 H 8.582 -1.680 0.304 1.00 . A A . 6 TYR HE1 1 1 2 864 1 1 7 TYR HE2 H 4.796 -2.958 1.807 1.00 . A A . 6 TYR HE2 1 1 2 865 1 1 7 TYR HH H 8.062 -2.408 2.579 1.00 . A A . 6 TYR HH 1 1 2 866 1 1 7 TYR N N 4.027 -0.425 -4.399 1.00 . A A . 6 TYR N 1 1 2 867 1 1 7 TYR O O 3.553 -2.995 -3.409 1.00 . A A . 6 TYR O 1 1 2 868 1 1 7 TYR OH O 7.382 -2.993 2.232 1.00 . A A . 6 TYR OH 1 1 2 869 1 1 8 THR C C 5.664 -4.979 -1.817 1.00 . A A . 7 THR C 1 1 2 870 1 1 8 THR CA C 5.653 -4.739 -3.304 1.00 . A A . 7 THR CA 1 1 2 871 1 1 8 THR CB C 6.772 -5.540 -3.974 1.00 . A A . 7 THR CB 1 1 2 872 1 1 8 THR CG2 C 6.298 -6.100 -5.300 1.00 . A A . 7 THR CG2 1 1 2 873 1 1 8 THR H H 6.617 -2.940 -3.825 1.00 . A A . 7 THR H 1 1 2 874 1 1 8 THR HA H 4.707 -5.080 -3.701 1.00 . A A . 7 THR HA 1 1 2 875 1 1 8 THR HB H 7.024 -6.369 -3.328 1.00 . A A . 7 THR HB 1 1 2 876 1 1 8 THR HG1 H 7.839 -4.180 -4.943 1.00 . A A . 7 THR HG1 1 1 2 877 1 1 8 THR HG21 H 7.097 -6.661 -5.763 1.00 . A A . 7 THR HG21 1 1 2 878 1 1 8 THR HG22 H 5.999 -5.291 -5.949 1.00 . A A . 7 THR HG22 1 1 2 879 1 1 8 THR HG23 H 5.453 -6.754 -5.122 1.00 . A A . 7 THR HG23 1 1 2 880 1 1 8 THR N N 5.754 -3.325 -3.565 1.00 . A A . 7 THR N 1 1 2 881 1 1 8 THR O O 6.635 -4.656 -1.133 1.00 . A A . 7 THR O 1 1 2 882 1 1 8 THR OG1 O 7.938 -4.721 -4.141 1.00 . A A . 7 THR OG1 1 1 2 883 1 1 9 VAL C C 5.525 -6.643 0.615 1.00 . A A . 8 VAL C 1 1 2 884 1 1 9 VAL CA C 4.416 -5.734 0.104 1.00 . A A . 8 VAL CA 1 1 2 885 1 1 9 VAL CB C 3.044 -6.338 0.444 1.00 . A A . 8 VAL CB 1 1 2 886 1 1 9 VAL CG1 C 2.922 -6.536 1.946 1.00 . A A . 8 VAL CG1 1 1 2 887 1 1 9 VAL CG2 C 1.915 -5.451 -0.085 1.00 . A A . 8 VAL CG2 1 1 2 888 1 1 9 VAL H H 3.833 -5.751 -1.929 1.00 . A A . 8 VAL H 1 1 2 889 1 1 9 VAL HA H 4.496 -4.777 0.602 1.00 . A A . 8 VAL HA 1 1 2 890 1 1 9 VAL HB H 2.969 -7.306 -0.034 1.00 . A A . 8 VAL HB 1 1 2 891 1 1 9 VAL HG11 H 3.690 -7.216 2.283 1.00 . A A . 8 VAL HG11 1 1 2 892 1 1 9 VAL HG12 H 1.949 -6.947 2.178 1.00 . A A . 8 VAL HG12 1 1 2 893 1 1 9 VAL HG13 H 3.038 -5.586 2.445 1.00 . A A . 8 VAL HG13 1 1 2 894 1 1 9 VAL HG21 H 1.968 -5.395 -1.164 1.00 . A A . 8 VAL HG21 1 1 2 895 1 1 9 VAL HG22 H 2.011 -4.458 0.327 1.00 . A A . 8 VAL HG22 1 1 2 896 1 1 9 VAL HG23 H 0.962 -5.867 0.205 1.00 . A A . 8 VAL HG23 1 1 2 897 1 1 9 VAL N N 4.565 -5.507 -1.318 1.00 . A A . 8 VAL N 1 1 2 898 1 1 9 VAL O O 5.757 -7.723 0.082 1.00 . A A . 8 VAL O 1 1 2 899 1 1 10 LYS C C 6.922 -7.511 3.529 1.00 . A A . 9 LYS C 1 1 2 900 1 1 10 LYS CA C 7.340 -6.896 2.205 1.00 . A A . 9 LYS CA 1 1 2 901 1 1 10 LYS CB C 8.554 -5.984 2.347 1.00 . A A . 9 LYS CB 1 1 2 902 1 1 10 LYS CD C 9.478 -6.716 0.127 1.00 . A A . 9 LYS CD 1 1 2 903 1 1 10 LYS CE C 9.145 -6.475 -1.338 1.00 . A A . 9 LYS CE 1 1 2 904 1 1 10 LYS CG C 9.090 -5.528 0.999 1.00 . A A . 9 LYS CG 1 1 2 905 1 1 10 LYS H H 5.992 -5.295 1.992 1.00 . A A . 9 LYS H 1 1 2 906 1 1 10 LYS HA H 7.589 -7.699 1.526 1.00 . A A . 9 LYS HA 1 1 2 907 1 1 10 LYS HB2 H 8.276 -5.112 2.919 1.00 . A A . 9 LYS HB2 1 1 2 908 1 1 10 LYS HB3 H 9.339 -6.516 2.865 1.00 . A A . 9 LYS HB3 1 1 2 909 1 1 10 LYS HD2 H 10.540 -6.885 0.220 1.00 . A A . 9 LYS HD2 1 1 2 910 1 1 10 LYS HD3 H 8.943 -7.589 0.470 1.00 . A A . 9 LYS HD3 1 1 2 911 1 1 10 LYS HE2 H 8.067 -6.479 -1.449 1.00 . A A . 9 LYS HE2 1 1 2 912 1 1 10 LYS HE3 H 9.535 -5.511 -1.631 1.00 . A A . 9 LYS HE3 1 1 2 913 1 1 10 LYS HG2 H 8.327 -4.954 0.494 1.00 . A A . 9 LYS HG2 1 1 2 914 1 1 10 LYS HG3 H 9.962 -4.912 1.160 1.00 . A A . 9 LYS HG3 1 1 2 915 1 1 10 LYS HZ1 H 9.262 -8.448 -2.035 1.00 . A A . 9 LYS HZ1 1 1 2 916 1 1 10 LYS HZ2 H 10.741 -7.619 -2.060 1.00 . A A . 9 LYS HZ2 1 1 2 917 1 1 10 LYS HZ3 H 9.561 -7.276 -3.228 1.00 . A A . 9 LYS HZ3 1 1 2 918 1 1 10 LYS N N 6.228 -6.171 1.620 1.00 . A A . 9 LYS N 1 1 2 919 1 1 10 LYS NZ N 9.716 -7.526 -2.225 1.00 . A A . 9 LYS NZ 1 1 2 920 1 1 10 LYS O O 5.740 -7.493 3.859 1.00 . A A . 9 LYS O 1 1 2 921 1 1 11 SER C C 6.623 -8.196 6.418 1.00 . A A . 10 SER C 1 1 2 922 1 1 11 SER CA C 7.633 -8.869 5.471 1.00 . A A . 10 SER CA 1 1 2 923 1 1 11 SER CB C 8.959 -9.103 6.197 1.00 . A A . 10 SER CB 1 1 2 924 1 1 11 SER H H 8.810 -8.037 3.914 1.00 . A A . 10 SER H 1 1 2 925 1 1 11 SER HA H 7.233 -9.822 5.182 1.00 . A A . 10 SER HA 1 1 2 926 1 1 11 SER HB2 H 9.370 -8.153 6.507 1.00 . A A . 10 SER HB2 1 1 2 927 1 1 11 SER HB3 H 8.790 -9.724 7.064 1.00 . A A . 10 SER HB3 1 1 2 928 1 1 11 SER HG H 10.214 -9.121 4.675 1.00 . A A . 10 SER HG 1 1 2 929 1 1 11 SER N N 7.884 -8.109 4.237 1.00 . A A . 10 SER N 1 1 2 930 1 1 11 SER O O 5.959 -8.877 7.203 1.00 . A A . 10 SER O 1 1 2 931 1 1 11 SER OG O 9.894 -9.752 5.343 1.00 . A A . 10 SER OG 1 1 2 932 1 1 12 GLY C C 4.126 -6.345 6.242 1.00 . A A . 11 GLY C 1 1 2 933 1 1 12 GLY CA C 5.422 -6.187 7.021 1.00 . A A . 11 GLY CA 1 1 2 934 1 1 12 GLY H H 7.159 -6.372 5.822 1.00 . A A . 11 GLY H 1 1 2 935 1 1 12 GLY HA2 H 5.297 -6.602 8.011 1.00 . A A . 11 GLY HA2 1 1 2 936 1 1 12 GLY HA3 H 5.660 -5.137 7.101 1.00 . A A . 11 GLY HA3 1 1 2 937 1 1 12 GLY N N 6.512 -6.877 6.349 1.00 . A A . 11 GLY N 1 1 2 938 1 1 12 GLY O O 3.579 -5.379 5.722 1.00 . A A . 11 GLY O 1 1 2 939 1 1 13 ASP C C 1.212 -7.305 5.572 1.00 . A A . 12 ASP C 1 1 2 940 1 1 13 ASP CA C 2.545 -7.995 5.306 1.00 . A A . 12 ASP CA 1 1 2 941 1 1 13 ASP CB C 2.315 -9.500 5.384 1.00 . A A . 12 ASP CB 1 1 2 942 1 1 13 ASP CG C 1.884 -9.949 6.770 1.00 . A A . 12 ASP CG 1 1 2 943 1 1 13 ASP H H 4.040 -8.254 6.786 1.00 . A A . 12 ASP H 1 1 2 944 1 1 13 ASP HA H 2.848 -7.757 4.299 1.00 . A A . 12 ASP HA 1 1 2 945 1 1 13 ASP HB2 H 1.537 -9.763 4.679 1.00 . A A . 12 ASP HB2 1 1 2 946 1 1 13 ASP HB3 H 3.227 -10.016 5.120 1.00 . A A . 12 ASP HB3 1 1 2 947 1 1 13 ASP N N 3.639 -7.578 6.195 1.00 . A A . 12 ASP N 1 1 2 948 1 1 13 ASP O O 0.241 -7.570 4.874 1.00 . A A . 12 ASP O 1 1 2 949 1 1 13 ASP OD1 O 0.689 -9.812 7.111 1.00 . A A . 12 ASP OD1 1 1 2 950 1 1 13 ASP OD2 O 2.744 -10.440 7.532 1.00 . A A . 12 ASP OD2 1 1 2 951 1 1 14 THR C C -0.336 -4.532 6.727 1.00 . A A . 13 THR C 1 1 2 952 1 1 14 THR CA C -0.187 -6.014 6.998 1.00 . A A . 13 THR CA 1 1 2 953 1 1 14 THR CB C -0.419 -6.309 8.490 1.00 . A A . 13 THR CB 1 1 2 954 1 1 14 THR CG2 C -1.906 -6.365 8.801 1.00 . A A . 13 THR CG2 1 1 2 955 1 1 14 THR H H 1.930 -6.086 6.979 1.00 . A A . 13 THR H 1 1 2 956 1 1 14 THR HA H -0.928 -6.549 6.422 1.00 . A A . 13 THR HA 1 1 2 957 1 1 14 THR HB H 0.033 -5.523 9.077 1.00 . A A . 13 THR HB 1 1 2 958 1 1 14 THR HG1 H 0.365 -8.065 8.013 1.00 . A A . 13 THR HG1 1 1 2 959 1 1 14 THR HG21 H -2.361 -5.411 8.572 1.00 . A A . 13 THR HG21 1 1 2 960 1 1 14 THR HG22 H -2.046 -6.587 9.847 1.00 . A A . 13 THR HG22 1 1 2 961 1 1 14 THR HG23 H -2.370 -7.138 8.203 1.00 . A A . 13 THR HG23 1 1 2 962 1 1 14 THR N N 1.120 -6.466 6.578 1.00 . A A . 13 THR N 1 1 2 963 1 1 14 THR O O 0.612 -3.763 6.888 1.00 . A A . 13 THR O 1 1 2 964 1 1 14 THR OG1 O 0.181 -7.568 8.829 1.00 . A A . 13 THR OG1 1 1 2 965 1 1 15 LEU C C -1.378 -1.731 6.811 1.00 . A A . 14 LEU C 1 1 2 966 1 1 15 LEU CA C -1.807 -2.807 5.826 1.00 . A A . 14 LEU CA 1 1 2 967 1 1 15 LEU CB C -3.291 -2.667 5.483 1.00 . A A . 14 LEU CB 1 1 2 968 1 1 15 LEU CD1 C -2.731 -1.037 3.671 1.00 . A A . 14 LEU CD1 1 1 2 969 1 1 15 LEU CD2 C -5.109 -1.465 4.258 1.00 . A A . 14 LEU CD2 1 1 2 970 1 1 15 LEU CG C -3.692 -1.360 4.799 1.00 . A A . 14 LEU CG 1 1 2 971 1 1 15 LEU H H -2.289 -4.781 6.396 1.00 . A A . 14 LEU H 1 1 2 972 1 1 15 LEU HA H -1.234 -2.688 4.920 1.00 . A A . 14 LEU HA 1 1 2 973 1 1 15 LEU HB2 H -3.566 -3.488 4.835 1.00 . A A . 14 LEU HB2 1 1 2 974 1 1 15 LEU HB3 H -3.858 -2.756 6.399 1.00 . A A . 14 LEU HB3 1 1 2 975 1 1 15 LEU HD11 H -3.011 -0.097 3.219 1.00 . A A . 14 LEU HD11 1 1 2 976 1 1 15 LEU HD12 H -2.773 -1.820 2.930 1.00 . A A . 14 LEU HD12 1 1 2 977 1 1 15 LEU HD13 H -1.727 -0.963 4.062 1.00 . A A . 14 LEU HD13 1 1 2 978 1 1 15 LEU HD21 H -5.156 -2.261 3.529 1.00 . A A . 14 LEU HD21 1 1 2 979 1 1 15 LEU HD22 H -5.384 -0.532 3.789 1.00 . A A . 14 LEU HD22 1 1 2 980 1 1 15 LEU HD23 H -5.789 -1.676 5.070 1.00 . A A . 14 LEU HD23 1 1 2 981 1 1 15 LEU HG H -3.660 -0.554 5.515 1.00 . A A . 14 LEU HG 1 1 2 982 1 1 15 LEU N N -1.544 -4.143 6.337 1.00 . A A . 14 LEU N 1 1 2 983 1 1 15 LEU O O -0.713 -0.772 6.430 1.00 . A A . 14 LEU O 1 1 2 984 1 1 16 ASN C C 0.131 -0.766 9.230 1.00 . A A . 15 ASN C 1 1 2 985 1 1 16 ASN CA C -1.385 -0.922 9.095 1.00 . A A . 15 ASN CA 1 1 2 986 1 1 16 ASN CB C -2.001 -1.295 10.452 1.00 . A A . 15 ASN CB 1 1 2 987 1 1 16 ASN CG C -1.424 -2.568 11.047 1.00 . A A . 15 ASN CG 1 1 2 988 1 1 16 ASN H H -2.240 -2.710 8.327 1.00 . A A . 15 ASN H 1 1 2 989 1 1 16 ASN HA H -1.796 0.025 8.781 1.00 . A A . 15 ASN HA 1 1 2 990 1 1 16 ASN HB2 H -1.831 -0.489 11.150 1.00 . A A . 15 ASN HB2 1 1 2 991 1 1 16 ASN HB3 H -3.067 -1.434 10.327 1.00 . A A . 15 ASN HB3 1 1 2 992 1 1 16 ASN HD21 H -2.865 -3.647 10.199 1.00 . A A . 15 ASN HD21 1 1 2 993 1 1 16 ASN HD22 H -1.713 -4.531 11.155 1.00 . A A . 15 ASN HD22 1 1 2 994 1 1 16 ASN N N -1.730 -1.906 8.075 1.00 . A A . 15 ASN N 1 1 2 995 1 1 16 ASN ND2 N -2.062 -3.692 10.771 1.00 . A A . 15 ASN ND2 1 1 2 996 1 1 16 ASN O O 0.627 0.339 9.454 1.00 . A A . 15 ASN O 1 1 2 997 1 1 16 ASN OD1 O -0.414 -2.542 11.751 1.00 . A A . 15 ASN OD1 1 1 2 998 1 1 17 LYS C C 2.990 -1.081 8.127 1.00 . A A . 16 LYS C 1 1 2 999 1 1 17 LYS CA C 2.313 -1.827 9.267 1.00 . A A . 16 LYS CA 1 1 2 1000 1 1 17 LYS CB C 2.897 -3.240 9.357 1.00 . A A . 16 LYS CB 1 1 2 1001 1 1 17 LYS CD C 3.251 -5.295 10.737 1.00 . A A . 16 LYS CD 1 1 2 1002 1 1 17 LYS CE C 2.703 -6.208 11.826 1.00 . A A . 16 LYS CE 1 1 2 1003 1 1 17 LYS CG C 2.384 -4.063 10.526 1.00 . A A . 16 LYS CG 1 1 2 1004 1 1 17 LYS H H 0.439 -2.705 8.804 1.00 . A A . 16 LYS H 1 1 2 1005 1 1 17 LYS HA H 2.511 -1.304 10.191 1.00 . A A . 16 LYS HA 1 1 2 1006 1 1 17 LYS HB2 H 2.662 -3.769 8.444 1.00 . A A . 16 LYS HB2 1 1 2 1007 1 1 17 LYS HB3 H 3.971 -3.163 9.445 1.00 . A A . 16 LYS HB3 1 1 2 1008 1 1 17 LYS HD2 H 3.297 -5.851 9.813 1.00 . A A . 16 LYS HD2 1 1 2 1009 1 1 17 LYS HD3 H 4.245 -4.977 11.015 1.00 . A A . 16 LYS HD3 1 1 2 1010 1 1 17 LYS HE2 H 3.475 -6.906 12.114 1.00 . A A . 16 LYS HE2 1 1 2 1011 1 1 17 LYS HE3 H 2.433 -5.603 12.680 1.00 . A A . 16 LYS HE3 1 1 2 1012 1 1 17 LYS HG2 H 2.403 -3.457 11.420 1.00 . A A . 16 LYS HG2 1 1 2 1013 1 1 17 LYS HG3 H 1.371 -4.375 10.319 1.00 . A A . 16 LYS HG3 1 1 2 1014 1 1 17 LYS HZ1 H 1.715 -7.464 10.478 1.00 . A A . 16 LYS HZ1 1 1 2 1015 1 1 17 LYS HZ2 H 0.702 -6.325 11.224 1.00 . A A . 16 LYS HZ2 1 1 2 1016 1 1 17 LYS HZ3 H 1.236 -7.675 12.092 1.00 . A A . 16 LYS HZ3 1 1 2 1017 1 1 17 LYS N N 0.869 -1.866 9.075 1.00 . A A . 16 LYS N 1 1 2 1018 1 1 17 LYS NZ N 1.507 -6.967 11.374 1.00 . A A . 16 LYS NZ 1 1 2 1019 1 1 17 LYS O O 3.814 -0.196 8.354 1.00 . A A . 16 LYS O 1 1 2 1020 1 1 18 ILE C C 2.759 0.619 5.524 1.00 . A A . 17 ILE C 1 1 2 1021 1 1 18 ILE CA C 3.225 -0.815 5.731 1.00 . A A . 17 ILE CA 1 1 2 1022 1 1 18 ILE CB C 2.996 -1.640 4.447 1.00 . A A . 17 ILE CB 1 1 2 1023 1 1 18 ILE CD1 C 1.286 -2.905 3.062 1.00 . A A . 17 ILE CD1 1 1 2 1024 1 1 18 ILE CG1 C 1.584 -2.224 4.381 1.00 . A A . 17 ILE CG1 1 1 2 1025 1 1 18 ILE CG2 C 4.042 -2.735 4.334 1.00 . A A . 17 ILE CG2 1 1 2 1026 1 1 18 ILE H H 1.901 -2.088 6.783 1.00 . A A . 17 ILE H 1 1 2 1027 1 1 18 ILE HA H 4.289 -0.792 5.913 1.00 . A A . 17 ILE HA 1 1 2 1028 1 1 18 ILE HB H 3.129 -0.983 3.616 1.00 . A A . 17 ILE HB 1 1 2 1029 1 1 18 ILE HD11 H 2.020 -3.678 2.880 1.00 . A A . 17 ILE HD11 1 1 2 1030 1 1 18 ILE HD12 H 1.328 -2.178 2.266 1.00 . A A . 17 ILE HD12 1 1 2 1031 1 1 18 ILE HD13 H 0.300 -3.346 3.095 1.00 . A A . 17 ILE HD13 1 1 2 1032 1 1 18 ILE HG12 H 1.462 -2.956 5.165 1.00 . A A . 17 ILE HG12 1 1 2 1033 1 1 18 ILE HG13 H 0.864 -1.431 4.516 1.00 . A A . 17 ILE HG13 1 1 2 1034 1 1 18 ILE HG21 H 5.022 -2.290 4.253 1.00 . A A . 17 ILE HG21 1 1 2 1035 1 1 18 ILE HG22 H 3.845 -3.333 3.456 1.00 . A A . 17 ILE HG22 1 1 2 1036 1 1 18 ILE HG23 H 4.002 -3.363 5.212 1.00 . A A . 17 ILE HG23 1 1 2 1037 1 1 18 ILE N N 2.610 -1.418 6.901 1.00 . A A . 17 ILE N 1 1 2 1038 1 1 18 ILE O O 3.546 1.478 5.133 1.00 . A A . 17 ILE O 1 1 2 1039 1 1 19 ALA C C 1.711 3.196 6.567 1.00 . A A . 18 ALA C 1 1 2 1040 1 1 19 ALA CA C 0.936 2.221 5.695 1.00 . A A . 18 ALA CA 1 1 2 1041 1 1 19 ALA CB C -0.521 2.221 6.113 1.00 . A A . 18 ALA CB 1 1 2 1042 1 1 19 ALA H H 0.901 0.136 6.066 1.00 . A A . 18 ALA H 1 1 2 1043 1 1 19 ALA HA H 0.997 2.533 4.664 1.00 . A A . 18 ALA HA 1 1 2 1044 1 1 19 ALA HB1 H -1.062 1.487 5.534 1.00 . A A . 18 ALA HB1 1 1 2 1045 1 1 19 ALA HB2 H -0.945 3.200 5.943 1.00 . A A . 18 ALA HB2 1 1 2 1046 1 1 19 ALA HB3 H -0.592 1.974 7.162 1.00 . A A . 18 ALA HB3 1 1 2 1047 1 1 19 ALA N N 1.490 0.876 5.802 1.00 . A A . 18 ALA N 1 1 2 1048 1 1 19 ALA O O 2.139 4.257 6.110 1.00 . A A . 18 ALA O 1 1 2 1049 1 1 20 ALA C C 4.138 3.640 8.425 1.00 . A A . 19 ALA C 1 1 2 1050 1 1 20 ALA CA C 2.651 3.645 8.755 1.00 . A A . 19 ALA CA 1 1 2 1051 1 1 20 ALA CB C 2.409 3.175 10.180 1.00 . A A . 19 ALA CB 1 1 2 1052 1 1 20 ALA H H 1.558 1.950 8.120 1.00 . A A . 19 ALA H 1 1 2 1053 1 1 20 ALA HA H 2.276 4.655 8.665 1.00 . A A . 19 ALA HA 1 1 2 1054 1 1 20 ALA HB1 H 2.787 2.170 10.297 1.00 . A A . 19 ALA HB1 1 1 2 1055 1 1 20 ALA HB2 H 1.346 3.187 10.386 1.00 . A A . 19 ALA HB2 1 1 2 1056 1 1 20 ALA HB3 H 2.916 3.835 10.869 1.00 . A A . 19 ALA HB3 1 1 2 1057 1 1 20 ALA N N 1.914 2.814 7.819 1.00 . A A . 19 ALA N 1 1 2 1058 1 1 20 ALA O O 4.873 4.551 8.806 1.00 . A A . 19 ALA O 1 1 2 1059 1 1 21 GLN C C 6.431 3.576 6.411 1.00 . A A . 20 GLN C 1 1 2 1060 1 1 21 GLN CA C 5.977 2.454 7.350 1.00 . A A . 20 GLN CA 1 1 2 1061 1 1 21 GLN CB C 6.213 1.074 6.715 1.00 . A A . 20 GLN CB 1 1 2 1062 1 1 21 GLN CD C 8.472 1.310 5.571 1.00 . A A . 20 GLN CD 1 1 2 1063 1 1 21 GLN CG C 7.673 0.640 6.670 1.00 . A A . 20 GLN CG 1 1 2 1064 1 1 21 GLN H H 3.925 1.923 7.423 1.00 . A A . 20 GLN H 1 1 2 1065 1 1 21 GLN HA H 6.554 2.518 8.262 1.00 . A A . 20 GLN HA 1 1 2 1066 1 1 21 GLN HB2 H 5.664 0.336 7.280 1.00 . A A . 20 GLN HB2 1 1 2 1067 1 1 21 GLN HB3 H 5.834 1.091 5.705 1.00 . A A . 20 GLN HB3 1 1 2 1068 1 1 21 GLN HE21 H 10.110 1.210 6.682 1.00 . A A . 20 GLN HE21 1 1 2 1069 1 1 21 GLN HE22 H 10.307 1.935 5.122 1.00 . A A . 20 GLN HE22 1 1 2 1070 1 1 21 GLN HG2 H 8.131 0.883 7.616 1.00 . A A . 20 GLN HG2 1 1 2 1071 1 1 21 GLN HG3 H 7.711 -0.430 6.520 1.00 . A A . 20 GLN HG3 1 1 2 1072 1 1 21 GLN N N 4.571 2.608 7.710 1.00 . A A . 20 GLN N 1 1 2 1073 1 1 21 GLN NE2 N 9.758 1.505 5.817 1.00 . A A . 20 GLN NE2 1 1 2 1074 1 1 21 GLN O O 7.474 4.188 6.637 1.00 . A A . 20 GLN O 1 1 2 1075 1 1 21 GLN OE1 O 7.941 1.649 4.514 1.00 . A A . 20 GLN OE1 1 1 2 1076 1 1 22 TYR C C 5.161 6.188 4.607 1.00 . A A . 21 TYR C 1 1 2 1077 1 1 22 TYR CA C 6.024 4.935 4.441 1.00 . A A . 21 TYR CA 1 1 2 1078 1 1 22 TYR CB C 6.034 4.464 2.976 1.00 . A A . 21 TYR CB 1 1 2 1079 1 1 22 TYR CD1 C 3.699 3.542 2.626 1.00 . A A . 21 TYR CD1 1 1 2 1080 1 1 22 TYR CD2 C 5.555 2.092 2.272 1.00 . A A . 21 TYR CD2 1 1 2 1081 1 1 22 TYR CE1 C 2.834 2.516 2.286 1.00 . A A . 21 TYR CE1 1 1 2 1082 1 1 22 TYR CE2 C 4.696 1.066 1.927 1.00 . A A . 21 TYR CE2 1 1 2 1083 1 1 22 TYR CG C 5.072 3.347 2.627 1.00 . A A . 21 TYR CG 1 1 2 1084 1 1 22 TYR CZ C 3.337 1.284 1.936 1.00 . A A . 21 TYR CZ 1 1 2 1085 1 1 22 TYR H H 4.824 3.361 5.223 1.00 . A A . 21 TYR H 1 1 2 1086 1 1 22 TYR HA H 7.037 5.214 4.699 1.00 . A A . 21 TYR HA 1 1 2 1087 1 1 22 TYR HB2 H 5.791 5.302 2.343 1.00 . A A . 21 TYR HB2 1 1 2 1088 1 1 22 TYR HB3 H 7.031 4.124 2.731 1.00 . A A . 21 TYR HB3 1 1 2 1089 1 1 22 TYR HD1 H 3.304 4.509 2.900 1.00 . A A . 21 TYR HD1 1 1 2 1090 1 1 22 TYR HD2 H 6.622 1.923 2.269 1.00 . A A . 21 TYR HD2 1 1 2 1091 1 1 22 TYR HE1 H 1.768 2.688 2.293 1.00 . A A . 21 TYR HE1 1 1 2 1092 1 1 22 TYR HE2 H 5.094 0.100 1.652 1.00 . A A . 21 TYR HE2 1 1 2 1093 1 1 22 TYR HH H 2.749 -0.546 2.023 1.00 . A A . 21 TYR HH 1 1 2 1094 1 1 22 TYR N N 5.651 3.867 5.369 1.00 . A A . 21 TYR N 1 1 2 1095 1 1 22 TYR O O 5.265 7.129 3.822 1.00 . A A . 21 TYR O 1 1 2 1096 1 1 22 TYR OH O 2.478 0.267 1.589 1.00 . A A . 21 TYR OH 1 1 2 1097 1 1 23 GLY C C 2.434 7.752 5.139 1.00 . A A . 22 GLY C 1 1 2 1098 1 1 23 GLY CA C 3.637 7.431 6.006 1.00 . A A . 22 GLY CA 1 1 2 1099 1 1 23 GLY H H 4.183 5.388 6.156 1.00 . A A . 22 GLY H 1 1 2 1100 1 1 23 GLY HA2 H 3.306 7.346 7.030 1.00 . A A . 22 GLY HA2 1 1 2 1101 1 1 23 GLY HA3 H 4.337 8.252 5.940 1.00 . A A . 22 GLY HA3 1 1 2 1102 1 1 23 GLY N N 4.331 6.207 5.639 1.00 . A A . 22 GLY N 1 1 2 1103 1 1 23 GLY O O 2.300 8.874 4.647 1.00 . A A . 22 GLY O 1 1 2 1104 1 1 24 VAL C C -0.821 6.366 5.081 1.00 . A A . 23 VAL C 1 1 2 1105 1 1 24 VAL CA C 0.295 7.006 4.271 1.00 . A A . 23 VAL CA 1 1 2 1106 1 1 24 VAL CB C 0.287 6.450 2.823 1.00 . A A . 23 VAL CB 1 1 2 1107 1 1 24 VAL CG1 C 0.645 4.978 2.811 1.00 . A A . 23 VAL CG1 1 1 2 1108 1 1 24 VAL CG2 C -1.060 6.667 2.155 1.00 . A A . 23 VAL CG2 1 1 2 1109 1 1 24 VAL H H 1.775 5.873 5.276 1.00 . A A . 23 VAL H 1 1 2 1110 1 1 24 VAL HA H 0.127 8.073 4.230 1.00 . A A . 23 VAL HA 1 1 2 1111 1 1 24 VAL HB H 1.027 6.984 2.250 1.00 . A A . 23 VAL HB 1 1 2 1112 1 1 24 VAL HG11 H 1.633 4.846 3.226 1.00 . A A . 23 VAL HG11 1 1 2 1113 1 1 24 VAL HG12 H 0.628 4.611 1.795 1.00 . A A . 23 VAL HG12 1 1 2 1114 1 1 24 VAL HG13 H -0.071 4.430 3.406 1.00 . A A . 23 VAL HG13 1 1 2 1115 1 1 24 VAL HG21 H -1.827 6.147 2.710 1.00 . A A . 23 VAL HG21 1 1 2 1116 1 1 24 VAL HG22 H -1.028 6.286 1.144 1.00 . A A . 23 VAL HG22 1 1 2 1117 1 1 24 VAL HG23 H -1.283 7.723 2.136 1.00 . A A . 23 VAL HG23 1 1 2 1118 1 1 24 VAL N N 1.566 6.776 4.945 1.00 . A A . 23 VAL N 1 1 2 1119 1 1 24 VAL O O -0.626 5.320 5.697 1.00 . A A . 23 VAL O 1 1 2 1120 1 1 25 SER C C -3.647 5.227 5.167 1.00 . A A . 24 SER C 1 1 2 1121 1 1 25 SER CA C -3.099 6.475 5.849 1.00 . A A . 24 SER CA 1 1 2 1122 1 1 25 SER CB C -4.201 7.531 5.984 1.00 . A A . 24 SER CB 1 1 2 1123 1 1 25 SER H H -2.071 7.850 4.621 1.00 . A A . 24 SER H 1 1 2 1124 1 1 25 SER HA H -2.750 6.207 6.835 1.00 . A A . 24 SER HA 1 1 2 1125 1 1 25 SER HB2 H -3.817 8.381 6.527 1.00 . A A . 24 SER HB2 1 1 2 1126 1 1 25 SER HB3 H -4.516 7.844 4.999 1.00 . A A . 24 SER HB3 1 1 2 1127 1 1 25 SER HG H -5.326 7.355 7.585 1.00 . A A . 24 SER HG 1 1 2 1128 1 1 25 SER N N -1.974 7.005 5.112 1.00 . A A . 24 SER N 1 1 2 1129 1 1 25 SER O O -3.582 5.080 3.936 1.00 . A A . 24 SER O 1 1 2 1130 1 1 25 SER OG O -5.325 7.015 6.679 1.00 . A A . 24 SER OG 1 1 2 1131 1 1 26 VAL C C -5.922 3.512 4.489 1.00 . A A . 25 VAL C 1 1 2 1132 1 1 26 VAL CA C -4.839 3.136 5.490 1.00 . A A . 25 VAL CA 1 1 2 1133 1 1 26 VAL CB C -5.466 2.350 6.664 1.00 . A A . 25 VAL CB 1 1 2 1134 1 1 26 VAL CG1 C -6.193 1.109 6.173 1.00 . A A . 25 VAL CG1 1 1 2 1135 1 1 26 VAL CG2 C -4.402 1.977 7.684 1.00 . A A . 25 VAL CG2 1 1 2 1136 1 1 26 VAL H H -4.093 4.463 6.947 1.00 . A A . 25 VAL H 1 1 2 1137 1 1 26 VAL HA H -4.113 2.504 5.000 1.00 . A A . 25 VAL HA 1 1 2 1138 1 1 26 VAL HB H -6.187 2.990 7.150 1.00 . A A . 25 VAL HB 1 1 2 1139 1 1 26 VAL HG11 H -5.493 0.457 5.674 1.00 . A A . 25 VAL HG11 1 1 2 1140 1 1 26 VAL HG12 H -6.970 1.396 5.480 1.00 . A A . 25 VAL HG12 1 1 2 1141 1 1 26 VAL HG13 H -6.631 0.592 7.013 1.00 . A A . 25 VAL HG13 1 1 2 1142 1 1 26 VAL HG21 H -3.656 1.350 7.215 1.00 . A A . 25 VAL HG21 1 1 2 1143 1 1 26 VAL HG22 H -4.861 1.441 8.501 1.00 . A A . 25 VAL HG22 1 1 2 1144 1 1 26 VAL HG23 H -3.934 2.875 8.059 1.00 . A A . 25 VAL HG23 1 1 2 1145 1 1 26 VAL N N -4.169 4.324 5.981 1.00 . A A . 25 VAL N 1 1 2 1146 1 1 26 VAL O O -6.045 2.882 3.442 1.00 . A A . 25 VAL O 1 1 2 1147 1 1 27 ALA C C -7.495 5.305 2.563 1.00 . A A . 26 ALA C 1 1 2 1148 1 1 27 ALA CA C -7.832 4.949 4.010 1.00 . A A . 26 ALA CA 1 1 2 1149 1 1 27 ALA CB C -8.560 6.106 4.679 1.00 . A A . 26 ALA CB 1 1 2 1150 1 1 27 ALA H H -6.391 5.141 5.551 1.00 . A A . 26 ALA H 1 1 2 1151 1 1 27 ALA HA H -8.498 4.099 4.008 1.00 . A A . 26 ALA HA 1 1 2 1152 1 1 27 ALA HB1 H -9.471 6.317 4.140 1.00 . A A . 26 ALA HB1 1 1 2 1153 1 1 27 ALA HB2 H -7.927 6.982 4.674 1.00 . A A . 26 ALA HB2 1 1 2 1154 1 1 27 ALA HB3 H -8.798 5.840 5.699 1.00 . A A . 26 ALA HB3 1 1 2 1155 1 1 27 ALA N N -6.656 4.581 4.788 1.00 . A A . 26 ALA N 1 1 2 1156 1 1 27 ALA O O -8.114 4.784 1.637 1.00 . A A . 26 ALA O 1 1 2 1157 1 1 28 ASN C C -5.442 5.567 0.203 1.00 . A A . 27 ASN C 1 1 2 1158 1 1 28 ASN CA C -6.190 6.613 0.996 1.00 . A A . 27 ASN CA 1 1 2 1159 1 1 28 ASN CB C -5.451 7.967 0.963 1.00 . A A . 27 ASN CB 1 1 2 1160 1 1 28 ASN CG C -4.290 8.093 1.926 1.00 . A A . 27 ASN CG 1 1 2 1161 1 1 28 ASN H H -5.969 6.487 3.110 1.00 . A A . 27 ASN H 1 1 2 1162 1 1 28 ASN HA H -7.133 6.746 0.497 1.00 . A A . 27 ASN HA 1 1 2 1163 1 1 28 ASN HB2 H -5.058 8.120 -0.030 1.00 . A A . 27 ASN HB2 1 1 2 1164 1 1 28 ASN HB3 H -6.157 8.753 1.182 1.00 . A A . 27 ASN HB3 1 1 2 1165 1 1 28 ASN HD21 H -3.412 9.405 0.717 1.00 . A A . 27 ASN HD21 1 1 2 1166 1 1 28 ASN HD22 H -2.567 9.044 2.190 1.00 . A A . 27 ASN HD22 1 1 2 1167 1 1 28 ASN N N -6.504 6.162 2.352 1.00 . A A . 27 ASN N 1 1 2 1168 1 1 28 ASN ND2 N -3.324 8.926 1.574 1.00 . A A . 27 ASN ND2 1 1 2 1169 1 1 28 ASN O O -5.688 5.417 -1.002 1.00 . A A . 27 ASN O 1 1 2 1170 1 1 28 ASN OD1 O -4.269 7.478 2.981 1.00 . A A . 27 ASN OD1 1 1 2 1171 1 1 29 LEU C C -4.667 2.662 -0.325 1.00 . A A . 28 LEU C 1 1 2 1172 1 1 29 LEU CA C -3.789 3.840 0.102 1.00 . A A . 28 LEU CA 1 1 2 1173 1 1 29 LEU CB C -2.522 3.401 0.857 1.00 . A A . 28 LEU CB 1 1 2 1174 1 1 29 LEU CD1 C -2.472 0.896 0.928 1.00 . A A . 28 LEU CD1 1 1 2 1175 1 1 29 LEU CD2 C -1.532 2.229 2.811 1.00 . A A . 28 LEU CD2 1 1 2 1176 1 1 29 LEU CG C -2.616 2.168 1.755 1.00 . A A . 28 LEU CG 1 1 2 1177 1 1 29 LEU H H -4.448 4.902 1.820 1.00 . A A . 28 LEU H 1 1 2 1178 1 1 29 LEU HA H -3.475 4.345 -0.802 1.00 . A A . 28 LEU HA 1 1 2 1179 1 1 29 LEU HB2 H -1.754 3.209 0.124 1.00 . A A . 28 LEU HB2 1 1 2 1180 1 1 29 LEU HB3 H -2.199 4.231 1.468 1.00 . A A . 28 LEU HB3 1 1 2 1181 1 1 29 LEU HD11 H -3.290 0.829 0.224 1.00 . A A . 28 LEU HD11 1 1 2 1182 1 1 29 LEU HD12 H -2.487 0.032 1.579 1.00 . A A . 28 LEU HD12 1 1 2 1183 1 1 29 LEU HD13 H -1.536 0.925 0.387 1.00 . A A . 28 LEU HD13 1 1 2 1184 1 1 29 LEU HD21 H -1.721 3.059 3.475 1.00 . A A . 28 LEU HD21 1 1 2 1185 1 1 29 LEU HD22 H -0.572 2.365 2.329 1.00 . A A . 28 LEU HD22 1 1 2 1186 1 1 29 LEU HD23 H -1.524 1.308 3.376 1.00 . A A . 28 LEU HD23 1 1 2 1187 1 1 29 LEU HG H -3.576 2.152 2.250 1.00 . A A . 28 LEU HG 1 1 2 1188 1 1 29 LEU N N -4.568 4.807 0.848 1.00 . A A . 28 LEU N 1 1 2 1189 1 1 29 LEU O O -4.454 2.077 -1.380 1.00 . A A . 28 LEU O 1 1 2 1190 1 1 30 ARG C C -7.544 1.802 -1.025 1.00 . A A . 29 ARG C 1 1 2 1191 1 1 30 ARG CA C -6.596 1.272 0.056 1.00 . A A . 29 ARG CA 1 1 2 1192 1 1 30 ARG CB C -7.365 0.672 1.239 1.00 . A A . 29 ARG CB 1 1 2 1193 1 1 30 ARG CD C -8.647 1.021 3.345 1.00 . A A . 29 ARG CD 1 1 2 1194 1 1 30 ARG CG C -8.208 1.651 2.034 1.00 . A A . 29 ARG CG 1 1 2 1195 1 1 30 ARG CZ C -10.608 2.316 4.128 1.00 . A A . 29 ARG CZ 1 1 2 1196 1 1 30 ARG H H -5.746 2.719 1.364 1.00 . A A . 29 ARG H 1 1 2 1197 1 1 30 ARG HA H -6.004 0.484 -0.389 1.00 . A A . 29 ARG HA 1 1 2 1198 1 1 30 ARG HB2 H -8.022 -0.098 0.864 1.00 . A A . 29 ARG HB2 1 1 2 1199 1 1 30 ARG HB3 H -6.653 0.218 1.914 1.00 . A A . 29 ARG HB3 1 1 2 1200 1 1 30 ARG HD2 H -9.311 0.199 3.132 1.00 . A A . 29 ARG HD2 1 1 2 1201 1 1 30 ARG HD3 H -7.762 0.647 3.850 1.00 . A A . 29 ARG HD3 1 1 2 1202 1 1 30 ARG HE H -8.806 2.316 4.994 1.00 . A A . 29 ARG HE 1 1 2 1203 1 1 30 ARG HG2 H -7.623 2.536 2.241 1.00 . A A . 29 ARG HG2 1 1 2 1204 1 1 30 ARG HG3 H -9.082 1.915 1.458 1.00 . A A . 29 ARG HG3 1 1 2 1205 1 1 30 ARG HH11 H -10.959 1.303 2.397 1.00 . A A . 29 ARG HH11 1 1 2 1206 1 1 30 ARG HH12 H -12.313 2.185 3.037 1.00 . A A . 29 ARG HH12 1 1 2 1207 1 1 30 ARG HH21 H -10.582 3.428 5.820 1.00 . A A . 29 ARG HH21 1 1 2 1208 1 1 30 ARG HH22 H -12.108 3.372 4.993 1.00 . A A . 29 ARG HH22 1 1 2 1209 1 1 30 ARG N N -5.655 2.302 0.478 1.00 . A A . 29 ARG N 1 1 2 1210 1 1 30 ARG NE N -9.330 1.958 4.236 1.00 . A A . 29 ARG NE 1 1 2 1211 1 1 30 ARG NH1 N -11.353 1.902 3.109 1.00 . A A . 29 ARG NH1 1 1 2 1212 1 1 30 ARG NH2 N -11.141 3.105 5.051 1.00 . A A . 29 ARG NH2 1 1 2 1213 1 1 30 ARG O O -7.970 1.049 -1.901 1.00 . A A . 29 ARG O 1 1 2 1214 1 1 31 SER C C -8.304 3.663 -3.364 1.00 . A A . 30 SER C 1 1 2 1215 1 1 31 SER CA C -8.807 3.691 -1.914 1.00 . A A . 30 SER CA 1 1 2 1216 1 1 31 SER CB C -9.148 5.125 -1.506 1.00 . A A . 30 SER CB 1 1 2 1217 1 1 31 SER H H -7.450 3.664 -0.282 1.00 . A A . 30 SER H 1 1 2 1218 1 1 31 SER HA H -9.710 3.103 -1.863 1.00 . A A . 30 SER HA 1 1 2 1219 1 1 31 SER HB2 H -8.236 5.691 -1.389 1.00 . A A . 30 SER HB2 1 1 2 1220 1 1 31 SER HB3 H -9.760 5.580 -2.271 1.00 . A A . 30 SER HB3 1 1 2 1221 1 1 31 SER HG H -9.240 5.030 0.456 1.00 . A A . 30 SER HG 1 1 2 1222 1 1 31 SER N N -7.857 3.098 -0.974 1.00 . A A . 30 SER N 1 1 2 1223 1 1 31 SER O O -9.055 3.278 -4.261 1.00 . A A . 30 SER O 1 1 2 1224 1 1 31 SER OG O -9.860 5.147 -0.279 1.00 . A A . 30 SER OG 1 1 2 1225 1 1 32 TRP C C -6.193 2.582 -5.442 1.00 . A A . 31 TRP C 1 1 2 1226 1 1 32 TRP CA C -6.540 4.000 -4.999 1.00 . A A . 31 TRP CA 1 1 2 1227 1 1 32 TRP CB C -5.345 4.946 -5.233 1.00 . A A . 31 TRP CB 1 1 2 1228 1 1 32 TRP CD1 C -3.828 3.831 -3.517 1.00 . A A . 31 TRP CD1 1 1 2 1229 1 1 32 TRP CD2 C -3.539 6.040 -3.674 1.00 . A A . 31 TRP CD2 1 1 2 1230 1 1 32 TRP CE2 C -2.665 5.542 -2.694 1.00 . A A . 31 TRP CE2 1 1 2 1231 1 1 32 TRP CE3 C -3.526 7.412 -3.948 1.00 . A A . 31 TRP CE3 1 1 2 1232 1 1 32 TRP CG C -4.291 4.921 -4.174 1.00 . A A . 31 TRP CG 1 1 2 1233 1 1 32 TRP CH2 C -1.791 7.689 -2.278 1.00 . A A . 31 TRP CH2 1 1 2 1234 1 1 32 TRP CZ2 C -1.788 6.358 -1.987 1.00 . A A . 31 TRP CZ2 1 1 2 1235 1 1 32 TRP CZ3 C -2.648 8.220 -3.246 1.00 . A A . 31 TRP CZ3 1 1 2 1236 1 1 32 TRP H H -6.457 4.323 -2.883 1.00 . A A . 31 TRP H 1 1 2 1237 1 1 32 TRP HA H -7.357 4.337 -5.621 1.00 . A A . 31 TRP HA 1 1 2 1238 1 1 32 TRP HB2 H -4.864 4.667 -6.164 1.00 . A A . 31 TRP HB2 1 1 2 1239 1 1 32 TRP HB3 H -5.712 5.959 -5.314 1.00 . A A . 31 TRP HB3 1 1 2 1240 1 1 32 TRP HD1 H -4.193 2.827 -3.676 1.00 . A A . 31 TRP HD1 1 1 2 1241 1 1 32 TRP HE1 H -2.400 3.587 -2.008 1.00 . A A . 31 TRP HE1 1 1 2 1242 1 1 32 TRP HE3 H -4.180 7.839 -4.693 1.00 . A A . 31 TRP HE3 1 1 2 1243 1 1 32 TRP HH2 H -1.124 8.359 -1.755 1.00 . A A . 31 TRP HH2 1 1 2 1244 1 1 32 TRP HZ2 H -1.121 5.964 -1.234 1.00 . A A . 31 TRP HZ2 1 1 2 1245 1 1 32 TRP HZ3 H -2.610 9.277 -3.449 1.00 . A A . 31 TRP HZ3 1 1 2 1246 1 1 32 TRP N N -7.042 4.026 -3.616 1.00 . A A . 31 TRP N 1 1 2 1247 1 1 32 TRP NE1 N -2.866 4.196 -2.614 1.00 . A A . 31 TRP NE1 1 1 2 1248 1 1 32 TRP O O -5.817 2.357 -6.595 1.00 . A A . 31 TRP O 1 1 2 1249 1 1 33 ASN C C -7.482 -0.469 -5.077 1.00 . A A . 32 ASN C 1 1 2 1250 1 1 33 ASN CA C -6.144 0.221 -4.869 1.00 . A A . 32 ASN CA 1 1 2 1251 1 1 33 ASN CB C -5.356 -0.517 -3.785 1.00 . A A . 32 ASN CB 1 1 2 1252 1 1 33 ASN CG C -3.861 -0.380 -3.956 1.00 . A A . 32 ASN CG 1 1 2 1253 1 1 33 ASN H H -6.566 1.873 -3.612 1.00 . A A . 32 ASN H 1 1 2 1254 1 1 33 ASN HA H -5.586 0.178 -5.793 1.00 . A A . 32 ASN HA 1 1 2 1255 1 1 33 ASN HB2 H -5.624 -0.116 -2.819 1.00 . A A . 32 ASN HB2 1 1 2 1256 1 1 33 ASN HB3 H -5.609 -1.568 -3.817 1.00 . A A . 32 ASN HB3 1 1 2 1257 1 1 33 ASN HD21 H -3.812 1.097 -2.626 1.00 . A A . 32 ASN HD21 1 1 2 1258 1 1 33 ASN HD22 H -2.289 0.660 -3.327 1.00 . A A . 32 ASN HD22 1 1 2 1259 1 1 33 ASN N N -6.332 1.627 -4.532 1.00 . A A . 32 ASN N 1 1 2 1260 1 1 33 ASN ND2 N -3.262 0.549 -3.233 1.00 . A A . 32 ASN ND2 1 1 2 1261 1 1 33 ASN O O -7.556 -1.515 -5.720 1.00 . A A . 32 ASN O 1 1 2 1262 1 1 33 ASN OD1 O -3.244 -1.125 -4.715 1.00 . A A . 32 ASN OD1 1 1 2 1263 1 1 34 GLY C C -9.941 -1.770 -3.849 1.00 . A A . 33 GLY C 1 1 2 1264 1 1 34 GLY CA C -9.854 -0.478 -4.636 1.00 . A A . 33 GLY CA 1 1 2 1265 1 1 34 GLY H H -8.424 0.964 -4.047 1.00 . A A . 33 GLY H 1 1 2 1266 1 1 34 GLY HA2 H -10.588 0.219 -4.256 1.00 . A A . 33 GLY HA2 1 1 2 1267 1 1 34 GLY HA3 H -10.067 -0.683 -5.675 1.00 . A A . 33 GLY HA3 1 1 2 1268 1 1 34 GLY N N -8.539 0.120 -4.532 1.00 . A A . 33 GLY N 1 1 2 1269 1 1 34 GLY O O -10.456 -2.775 -4.342 1.00 . A A . 33 GLY O 1 1 2 1270 1 1 35 ILE C C -10.343 -2.767 -0.614 1.00 . A A . 34 ILE C 1 1 2 1271 1 1 35 ILE CA C -9.390 -2.932 -1.786 1.00 . A A . 34 ILE CA 1 1 2 1272 1 1 35 ILE CB C -7.981 -3.212 -1.222 1.00 . A A . 34 ILE CB 1 1 2 1273 1 1 35 ILE CD1 C -5.553 -3.593 -1.842 1.00 . A A . 34 ILE CD1 1 1 2 1274 1 1 35 ILE CG1 C -6.963 -3.376 -2.346 1.00 . A A . 34 ILE CG1 1 1 2 1275 1 1 35 ILE CG2 C -7.998 -4.456 -0.345 1.00 . A A . 34 ILE CG2 1 1 2 1276 1 1 35 ILE H H -9.031 -0.910 -2.290 1.00 . A A . 34 ILE H 1 1 2 1277 1 1 35 ILE HA H -9.697 -3.781 -2.379 1.00 . A A . 34 ILE HA 1 1 2 1278 1 1 35 ILE HB H -7.692 -2.374 -0.605 1.00 . A A . 34 ILE HB 1 1 2 1279 1 1 35 ILE HD11 H -4.882 -3.699 -2.680 1.00 . A A . 34 ILE HD11 1 1 2 1280 1 1 35 ILE HD12 H -5.523 -4.488 -1.237 1.00 . A A . 34 ILE HD12 1 1 2 1281 1 1 35 ILE HD13 H -5.253 -2.745 -1.244 1.00 . A A . 34 ILE HD13 1 1 2 1282 1 1 35 ILE HG12 H -7.236 -4.229 -2.951 1.00 . A A . 34 ILE HG12 1 1 2 1283 1 1 35 ILE HG13 H -6.965 -2.488 -2.960 1.00 . A A . 34 ILE HG13 1 1 2 1284 1 1 35 ILE HG21 H -8.681 -4.305 0.479 1.00 . A A . 34 ILE HG21 1 1 2 1285 1 1 35 ILE HG22 H -7.006 -4.642 0.038 1.00 . A A . 34 ILE HG22 1 1 2 1286 1 1 35 ILE HG23 H -8.322 -5.303 -0.931 1.00 . A A . 34 ILE HG23 1 1 2 1287 1 1 35 ILE N N -9.409 -1.749 -2.633 1.00 . A A . 34 ILE N 1 1 2 1288 1 1 35 ILE O O -10.297 -1.757 0.089 1.00 . A A . 34 ILE O 1 1 2 1289 1 1 36 SER C C -11.336 -4.497 1.899 1.00 . A A . 35 SER C 1 1 2 1290 1 1 36 SER CA C -12.050 -3.762 0.769 1.00 . A A . 35 SER CA 1 1 2 1291 1 1 36 SER CB C -13.380 -4.448 0.458 1.00 . A A . 35 SER CB 1 1 2 1292 1 1 36 SER H H -11.271 -4.478 -1.061 1.00 . A A . 35 SER H 1 1 2 1293 1 1 36 SER HA H -12.233 -2.739 1.068 1.00 . A A . 35 SER HA 1 1 2 1294 1 1 36 SER HB2 H -13.211 -5.505 0.328 1.00 . A A . 35 SER HB2 1 1 2 1295 1 1 36 SER HB3 H -14.065 -4.291 1.278 1.00 . A A . 35 SER HB3 1 1 2 1296 1 1 36 SER HG H -14.024 -4.642 -1.389 1.00 . A A . 35 SER HG 1 1 2 1297 1 1 36 SER N N -11.203 -3.749 -0.408 1.00 . A A . 35 SER N 1 1 2 1298 1 1 36 SER O O -11.194 -5.721 1.860 1.00 . A A . 35 SER O 1 1 2 1299 1 1 36 SER OG O -13.964 -3.930 -0.730 1.00 . A A . 35 SER OG 1 1 2 1300 1 1 37 GLY C C -8.691 -4.424 3.754 1.00 . A A . 36 GLY C 1 1 2 1301 1 1 37 GLY CA C -10.180 -4.350 4.010 1.00 . A A . 36 GLY CA 1 1 2 1302 1 1 37 GLY H H -11.005 -2.775 2.858 1.00 . A A . 36 GLY H 1 1 2 1303 1 1 37 GLY HA2 H -10.355 -3.756 4.894 1.00 . A A . 36 GLY HA2 1 1 2 1304 1 1 37 GLY HA3 H -10.559 -5.348 4.172 1.00 . A A . 36 GLY HA3 1 1 2 1305 1 1 37 GLY N N -10.885 -3.752 2.894 1.00 . A A . 36 GLY N 1 1 2 1306 1 1 37 GLY O O -8.187 -3.804 2.819 1.00 . A A . 36 GLY O 1 1 2 1307 1 1 38 ASP C C -6.097 -6.703 4.069 1.00 . A A . 37 ASP C 1 1 2 1308 1 1 38 ASP CA C -6.535 -5.283 4.431 1.00 . A A . 37 ASP CA 1 1 2 1309 1 1 38 ASP CB C -5.823 -4.793 5.703 1.00 . A A . 37 ASP CB 1 1 2 1310 1 1 38 ASP CG C -6.149 -5.600 6.948 1.00 . A A . 37 ASP CG 1 1 2 1311 1 1 38 ASP H H -8.424 -5.664 5.301 1.00 . A A . 37 ASP H 1 1 2 1312 1 1 38 ASP HA H -6.252 -4.633 3.617 1.00 . A A . 37 ASP HA 1 1 2 1313 1 1 38 ASP HB2 H -4.758 -4.843 5.543 1.00 . A A . 37 ASP HB2 1 1 2 1314 1 1 38 ASP HB3 H -6.102 -3.765 5.884 1.00 . A A . 37 ASP HB3 1 1 2 1315 1 1 38 ASP N N -7.978 -5.179 4.574 1.00 . A A . 37 ASP N 1 1 2 1316 1 1 38 ASP O O -5.427 -7.387 4.842 1.00 . A A . 37 ASP O 1 1 2 1317 1 1 38 ASP OD1 O -7.344 -5.848 7.213 1.00 . A A . 37 ASP OD1 1 1 2 1318 1 1 38 ASP OD2 O -5.206 -5.958 7.688 1.00 . A A . 37 ASP OD2 1 1 2 1319 1 1 39 LEU C C -4.686 -8.117 1.589 1.00 . A A . 38 LEU C 1 1 2 1320 1 1 39 LEU CA C -5.977 -8.399 2.346 1.00 . A A . 38 LEU CA 1 1 2 1321 1 1 39 LEU CB C -6.999 -9.113 1.441 1.00 . A A . 38 LEU CB 1 1 2 1322 1 1 39 LEU CD1 C -7.959 -9.133 -0.876 1.00 . A A . 38 LEU CD1 1 1 2 1323 1 1 39 LEU CD2 C -8.902 -7.596 0.844 1.00 . A A . 38 LEU CD2 1 1 2 1324 1 1 39 LEU CG C -7.635 -8.266 0.334 1.00 . A A . 38 LEU CG 1 1 2 1325 1 1 39 LEU H H -7.128 -6.622 2.359 1.00 . A A . 38 LEU H 1 1 2 1326 1 1 39 LEU HA H -5.745 -9.039 3.185 1.00 . A A . 38 LEU HA 1 1 2 1327 1 1 39 LEU HB2 H -6.505 -9.952 0.977 1.00 . A A . 38 LEU HB2 1 1 2 1328 1 1 39 LEU HB3 H -7.793 -9.491 2.068 1.00 . A A . 38 LEU HB3 1 1 2 1329 1 1 39 LEU HD11 H -8.669 -9.897 -0.592 1.00 . A A . 38 LEU HD11 1 1 2 1330 1 1 39 LEU HD12 H -7.054 -9.600 -1.237 1.00 . A A . 38 LEU HD12 1 1 2 1331 1 1 39 LEU HD13 H -8.383 -8.518 -1.657 1.00 . A A . 38 LEU HD13 1 1 2 1332 1 1 39 LEU HD21 H -9.335 -6.996 0.057 1.00 . A A . 38 LEU HD21 1 1 2 1333 1 1 39 LEU HD22 H -8.661 -6.965 1.689 1.00 . A A . 38 LEU HD22 1 1 2 1334 1 1 39 LEU HD23 H -9.609 -8.354 1.151 1.00 . A A . 38 LEU HD23 1 1 2 1335 1 1 39 LEU HG H -6.941 -7.495 0.025 1.00 . A A . 38 LEU HG 1 1 2 1336 1 1 39 LEU N N -6.491 -7.148 2.884 1.00 . A A . 38 LEU N 1 1 2 1337 1 1 39 LEU O O -4.700 -7.696 0.431 1.00 . A A . 38 LEU O 1 1 2 1338 1 1 40 ILE C C -1.251 -9.053 2.025 1.00 . A A . 39 ILE C 1 1 2 1339 1 1 40 ILE CA C -2.273 -7.955 1.744 1.00 . A A . 39 ILE CA 1 1 2 1340 1 1 40 ILE CB C -1.820 -6.609 2.366 1.00 . A A . 39 ILE CB 1 1 2 1341 1 1 40 ILE CD1 C -2.059 -4.079 2.113 1.00 . A A . 39 ILE CD1 1 1 2 1342 1 1 40 ILE CG1 C -2.550 -5.444 1.687 1.00 . A A . 39 ILE CG1 1 1 2 1343 1 1 40 ILE CG2 C -0.314 -6.432 2.284 1.00 . A A . 39 ILE CG2 1 1 2 1344 1 1 40 ILE H H -3.625 -8.777 3.138 1.00 . A A . 39 ILE H 1 1 2 1345 1 1 40 ILE HA H -2.363 -7.823 0.675 1.00 . A A . 39 ILE HA 1 1 2 1346 1 1 40 ILE HB H -2.091 -6.622 3.410 1.00 . A A . 39 ILE HB 1 1 2 1347 1 1 40 ILE HD11 H -2.179 -3.974 3.182 1.00 . A A . 39 ILE HD11 1 1 2 1348 1 1 40 ILE HD12 H -2.629 -3.312 1.607 1.00 . A A . 39 ILE HD12 1 1 2 1349 1 1 40 ILE HD13 H -1.013 -3.977 1.858 1.00 . A A . 39 ILE HD13 1 1 2 1350 1 1 40 ILE HG12 H -2.420 -5.520 0.618 1.00 . A A . 39 ILE HG12 1 1 2 1351 1 1 40 ILE HG13 H -3.603 -5.504 1.920 1.00 . A A . 39 ILE HG13 1 1 2 1352 1 1 40 ILE HG21 H 0.177 -7.256 2.798 1.00 . A A . 39 ILE HG21 1 1 2 1353 1 1 40 ILE HG22 H -0.033 -5.498 2.758 1.00 . A A . 39 ILE HG22 1 1 2 1354 1 1 40 ILE HG23 H -0.007 -6.419 1.249 1.00 . A A . 39 ILE HG23 1 1 2 1355 1 1 40 ILE N N -3.573 -8.331 2.261 1.00 . A A . 39 ILE N 1 1 2 1356 1 1 40 ILE O O -1.183 -9.572 3.137 1.00 . A A . 39 ILE O 1 1 2 1357 1 1 41 PHE C C 1.864 -10.004 0.581 1.00 . A A . 40 PHE C 1 1 2 1358 1 1 41 PHE CA C 0.523 -10.465 1.146 1.00 . A A . 40 PHE CA 1 1 2 1359 1 1 41 PHE CB C 0.065 -11.754 0.443 1.00 . A A . 40 PHE CB 1 1 2 1360 1 1 41 PHE CD1 C -1.376 -11.215 -1.546 1.00 . A A . 40 PHE CD1 1 1 2 1361 1 1 41 PHE CD2 C 0.876 -11.890 -1.937 1.00 . A A . 40 PHE CD2 1 1 2 1362 1 1 41 PHE CE1 C -1.578 -11.089 -2.909 1.00 . A A . 40 PHE CE1 1 1 2 1363 1 1 41 PHE CE2 C 0.680 -11.765 -3.300 1.00 . A A . 40 PHE CE2 1 1 2 1364 1 1 41 PHE CG C -0.149 -11.615 -1.044 1.00 . A A . 40 PHE CG 1 1 2 1365 1 1 41 PHE CZ C -0.547 -11.364 -3.787 1.00 . A A . 40 PHE CZ 1 1 2 1366 1 1 41 PHE H H -0.579 -8.964 0.146 1.00 . A A . 40 PHE H 1 1 2 1367 1 1 41 PHE HA H 0.645 -10.666 2.200 1.00 . A A . 40 PHE HA 1 1 2 1368 1 1 41 PHE HB2 H 0.811 -12.518 0.597 1.00 . A A . 40 PHE HB2 1 1 2 1369 1 1 41 PHE HB3 H -0.866 -12.079 0.884 1.00 . A A . 40 PHE HB3 1 1 2 1370 1 1 41 PHE HD1 H -2.183 -10.999 -0.861 1.00 . A A . 40 PHE HD1 1 1 2 1371 1 1 41 PHE HD2 H 1.837 -12.205 -1.559 1.00 . A A . 40 PHE HD2 1 1 2 1372 1 1 41 PHE HE1 H -2.541 -10.776 -3.287 1.00 . A A . 40 PHE HE1 1 1 2 1373 1 1 41 PHE HE2 H 1.488 -11.982 -3.984 1.00 . A A . 40 PHE HE2 1 1 2 1374 1 1 41 PHE HZ H -0.702 -11.266 -4.852 1.00 . A A . 40 PHE HZ 1 1 2 1375 1 1 41 PHE N N -0.480 -9.417 1.008 1.00 . A A . 40 PHE N 1 1 2 1376 1 1 41 PHE O O 1.919 -9.078 -0.228 1.00 . A A . 40 PHE O 1 1 2 1377 1 1 42 VAL C C 4.426 -10.557 -0.951 1.00 . A A . 41 VAL C 1 1 2 1378 1 1 42 VAL CA C 4.280 -10.319 0.554 1.00 . A A . 41 VAL CA 1 1 2 1379 1 1 42 VAL CB C 5.340 -11.145 1.317 1.00 . A A . 41 VAL CB 1 1 2 1380 1 1 42 VAL CG1 C 6.747 -10.754 0.897 1.00 . A A . 41 VAL CG1 1 1 2 1381 1 1 42 VAL CG2 C 5.166 -10.973 2.819 1.00 . A A . 41 VAL CG2 1 1 2 1382 1 1 42 VAL H H 2.817 -11.410 1.632 1.00 . A A . 41 VAL H 1 1 2 1383 1 1 42 VAL HA H 4.447 -9.273 0.763 1.00 . A A . 41 VAL HA 1 1 2 1384 1 1 42 VAL HB H 5.195 -12.188 1.079 1.00 . A A . 41 VAL HB 1 1 2 1385 1 1 42 VAL HG11 H 6.914 -9.710 1.123 1.00 . A A . 41 VAL HG11 1 1 2 1386 1 1 42 VAL HG12 H 6.864 -10.914 -0.164 1.00 . A A . 41 VAL HG12 1 1 2 1387 1 1 42 VAL HG13 H 7.466 -11.357 1.433 1.00 . A A . 41 VAL HG13 1 1 2 1388 1 1 42 VAL HG21 H 5.911 -11.558 3.336 1.00 . A A . 41 VAL HG21 1 1 2 1389 1 1 42 VAL HG22 H 4.180 -11.306 3.108 1.00 . A A . 41 VAL HG22 1 1 2 1390 1 1 42 VAL HG23 H 5.284 -9.930 3.077 1.00 . A A . 41 VAL HG23 1 1 2 1391 1 1 42 VAL N N 2.935 -10.662 1.002 1.00 . A A . 41 VAL N 1 1 2 1392 1 1 42 VAL O O 4.053 -11.618 -1.458 1.00 . A A . 41 VAL O 1 1 2 1393 1 1 43 GLY C C 3.950 -8.983 -3.823 1.00 . A A . 42 GLY C 1 1 2 1394 1 1 43 GLY CA C 5.085 -9.672 -3.095 1.00 . A A . 42 GLY CA 1 1 2 1395 1 1 43 GLY H H 5.285 -8.751 -1.202 1.00 . A A . 42 GLY H 1 1 2 1396 1 1 43 GLY HA2 H 6.019 -9.222 -3.396 1.00 . A A . 42 GLY HA2 1 1 2 1397 1 1 43 GLY HA3 H 5.093 -10.715 -3.369 1.00 . A A . 42 GLY HA3 1 1 2 1398 1 1 43 GLY N N 4.958 -9.565 -1.662 1.00 . A A . 42 GLY N 1 1 2 1399 1 1 43 GLY O O 4.025 -8.757 -5.030 1.00 . A A . 42 GLY O 1 1 2 1400 1 1 44 GLN C C 2.077 -6.549 -4.077 1.00 . A A . 43 GLN C 1 1 2 1401 1 1 44 GLN CA C 1.743 -7.975 -3.672 1.00 . A A . 43 GLN CA 1 1 2 1402 1 1 44 GLN CB C 0.566 -7.957 -2.698 1.00 . A A . 43 GLN CB 1 1 2 1403 1 1 44 GLN CD C -1.778 -7.123 -2.231 1.00 . A A . 43 GLN CD 1 1 2 1404 1 1 44 GLN CG C -0.629 -7.166 -3.213 1.00 . A A . 43 GLN CG 1 1 2 1405 1 1 44 GLN H H 2.902 -8.838 -2.124 1.00 . A A . 43 GLN H 1 1 2 1406 1 1 44 GLN HA H 1.456 -8.528 -4.554 1.00 . A A . 43 GLN HA 1 1 2 1407 1 1 44 GLN HB2 H 0.250 -8.974 -2.514 1.00 . A A . 43 GLN HB2 1 1 2 1408 1 1 44 GLN HB3 H 0.890 -7.516 -1.766 1.00 . A A . 43 GLN HB3 1 1 2 1409 1 1 44 GLN HE21 H -1.090 -5.425 -1.472 1.00 . A A . 43 GLN HE21 1 1 2 1410 1 1 44 GLN HE22 H -2.544 -6.035 -0.762 1.00 . A A . 43 GLN HE22 1 1 2 1411 1 1 44 GLN HG2 H -0.312 -6.151 -3.409 1.00 . A A . 43 GLN HG2 1 1 2 1412 1 1 44 GLN HG3 H -0.975 -7.617 -4.131 1.00 . A A . 43 GLN HG3 1 1 2 1413 1 1 44 GLN N N 2.898 -8.639 -3.086 1.00 . A A . 43 GLN N 1 1 2 1414 1 1 44 GLN NE2 N -1.805 -6.093 -1.404 1.00 . A A . 43 GLN NE2 1 1 2 1415 1 1 44 GLN O O 2.610 -5.774 -3.284 1.00 . A A . 43 GLN O 1 1 2 1416 1 1 44 GLN OE1 O -2.641 -7.999 -2.226 1.00 . A A . 43 GLN OE1 1 1 2 1417 1 1 45 LYS C C 0.640 -4.069 -5.382 1.00 . A A . 44 LYS C 1 1 2 1418 1 1 45 LYS CA C 1.870 -4.862 -5.804 1.00 . A A . 44 LYS CA 1 1 2 1419 1 1 45 LYS CB C 1.993 -4.868 -7.331 1.00 . A A . 44 LYS CB 1 1 2 1420 1 1 45 LYS CD C 1.837 -3.572 -9.474 1.00 . A A . 44 LYS CD 1 1 2 1421 1 1 45 LYS CE C 3.026 -4.266 -10.119 1.00 . A A . 44 LYS CE 1 1 2 1422 1 1 45 LYS CG C 1.986 -3.486 -7.963 1.00 . A A . 44 LYS CG 1 1 2 1423 1 1 45 LYS H H 1.440 -6.922 -5.927 1.00 . A A . 44 LYS H 1 1 2 1424 1 1 45 LYS HA H 2.750 -4.411 -5.374 1.00 . A A . 44 LYS HA 1 1 2 1425 1 1 45 LYS HB2 H 2.918 -5.354 -7.601 1.00 . A A . 44 LYS HB2 1 1 2 1426 1 1 45 LYS HB3 H 1.169 -5.431 -7.743 1.00 . A A . 44 LYS HB3 1 1 2 1427 1 1 45 LYS HD2 H 0.941 -4.127 -9.705 1.00 . A A . 44 LYS HD2 1 1 2 1428 1 1 45 LYS HD3 H 1.756 -2.573 -9.874 1.00 . A A . 44 LYS HD3 1 1 2 1429 1 1 45 LYS HE2 H 3.896 -3.638 -10.009 1.00 . A A . 44 LYS HE2 1 1 2 1430 1 1 45 LYS HE3 H 3.195 -5.205 -9.615 1.00 . A A . 44 LYS HE3 1 1 2 1431 1 1 45 LYS HG2 H 1.160 -2.921 -7.559 1.00 . A A . 44 LYS HG2 1 1 2 1432 1 1 45 LYS HG3 H 2.915 -2.987 -7.728 1.00 . A A . 44 LYS HG3 1 1 2 1433 1 1 45 LYS HZ1 H 2.063 -5.259 -11.685 1.00 . A A . 44 LYS HZ1 1 1 2 1434 1 1 45 LYS HZ2 H 3.679 -4.857 -12.013 1.00 . A A . 44 LYS HZ2 1 1 2 1435 1 1 45 LYS HZ3 H 2.484 -3.654 -12.043 1.00 . A A . 44 LYS HZ3 1 1 2 1436 1 1 45 LYS N N 1.762 -6.220 -5.315 1.00 . A A . 44 LYS N 1 1 2 1437 1 1 45 LYS NZ N 2.799 -4.527 -11.563 1.00 . A A . 44 LYS NZ 1 1 2 1438 1 1 45 LYS O O -0.464 -4.320 -5.873 1.00 . A A . 44 LYS O 1 1 2 1439 1 1 46 LEU C C 0.133 -0.809 -4.280 1.00 . A A . 45 LEU C 1 1 2 1440 1 1 46 LEU CA C -0.280 -2.270 -4.059 1.00 . A A . 45 LEU CA 1 1 2 1441 1 1 46 LEU CB C -0.766 -2.581 -2.602 1.00 . A A . 45 LEU CB 1 1 2 1442 1 1 46 LEU CD1 C 1.494 -2.361 -1.488 1.00 . A A . 45 LEU CD1 1 1 2 1443 1 1 46 LEU CD2 C -0.191 -0.536 -1.212 1.00 . A A . 45 LEU CD2 1 1 2 1444 1 1 46 LEU CG C 0.025 -2.031 -1.396 1.00 . A A . 45 LEU CG 1 1 2 1445 1 1 46 LEU H H 1.694 -3.048 -4.019 1.00 . A A . 45 LEU H 1 1 2 1446 1 1 46 LEU HA H -1.097 -2.479 -4.738 1.00 . A A . 45 LEU HA 1 1 2 1447 1 1 46 LEU HB2 H -1.777 -2.224 -2.509 1.00 . A A . 45 LEU HB2 1 1 2 1448 1 1 46 LEU HB3 H -0.787 -3.662 -2.494 1.00 . A A . 45 LEU HB3 1 1 2 1449 1 1 46 LEU HD11 H 1.988 -2.053 -0.581 1.00 . A A . 45 LEU HD11 1 1 2 1450 1 1 46 LEU HD12 H 1.928 -1.841 -2.330 1.00 . A A . 45 LEU HD12 1 1 2 1451 1 1 46 LEU HD13 H 1.615 -3.428 -1.622 1.00 . A A . 45 LEU HD13 1 1 2 1452 1 1 46 LEU HD21 H 0.182 -0.009 -2.079 1.00 . A A . 45 LEU HD21 1 1 2 1453 1 1 46 LEU HD22 H 0.337 -0.201 -0.332 1.00 . A A . 45 LEU HD22 1 1 2 1454 1 1 46 LEU HD23 H -1.247 -0.337 -1.098 1.00 . A A . 45 LEU HD23 1 1 2 1455 1 1 46 LEU HG H -0.347 -2.518 -0.506 1.00 . A A . 45 LEU HG 1 1 2 1456 1 1 46 LEU N N 0.813 -3.145 -4.450 1.00 . A A . 45 LEU N 1 1 2 1457 1 1 46 LEU O O 1.283 -0.440 -4.033 1.00 . A A . 45 LEU O 1 1 2 1458 1 1 47 ILE C C -0.222 2.207 -3.872 1.00 . A A . 46 ILE C 1 1 2 1459 1 1 47 ILE CA C -0.504 1.400 -5.126 1.00 . A A . 46 ILE CA 1 1 2 1460 1 1 47 ILE CB C -1.672 2.094 -5.877 1.00 . A A . 46 ILE CB 1 1 2 1461 1 1 47 ILE CD1 C -0.741 1.423 -8.151 1.00 . A A . 46 ILE CD1 1 1 2 1462 1 1 47 ILE CG1 C -1.939 1.427 -7.227 1.00 . A A . 46 ILE CG1 1 1 2 1463 1 1 47 ILE CG2 C -1.382 3.584 -6.075 1.00 . A A . 46 ILE CG2 1 1 2 1464 1 1 47 ILE H H -1.689 -0.359 -4.983 1.00 . A A . 46 ILE H 1 1 2 1465 1 1 47 ILE HA H 0.369 1.425 -5.761 1.00 . A A . 46 ILE HA 1 1 2 1466 1 1 47 ILE HB H -2.557 2.009 -5.265 1.00 . A A . 46 ILE HB 1 1 2 1467 1 1 47 ILE HD11 H 0.069 0.878 -7.687 1.00 . A A . 46 ILE HD11 1 1 2 1468 1 1 47 ILE HD12 H -0.430 2.439 -8.340 1.00 . A A . 46 ILE HD12 1 1 2 1469 1 1 47 ILE HD13 H -1.007 0.948 -9.083 1.00 . A A . 46 ILE HD13 1 1 2 1470 1 1 47 ILE HG12 H -2.236 0.404 -7.066 1.00 . A A . 46 ILE HG12 1 1 2 1471 1 1 47 ILE HG13 H -2.740 1.962 -7.723 1.00 . A A . 46 ILE HG13 1 1 2 1472 1 1 47 ILE HG21 H -0.521 3.701 -6.716 1.00 . A A . 46 ILE HG21 1 1 2 1473 1 1 47 ILE HG22 H -1.180 4.045 -5.114 1.00 . A A . 46 ILE HG22 1 1 2 1474 1 1 47 ILE HG23 H -2.237 4.060 -6.530 1.00 . A A . 46 ILE HG23 1 1 2 1475 1 1 47 ILE N N -0.788 -0.002 -4.808 1.00 . A A . 46 ILE N 1 1 2 1476 1 1 47 ILE O O -0.902 2.062 -2.854 1.00 . A A . 46 ILE O 1 1 2 1477 1 1 48 VAL C C 1.803 5.203 -3.539 1.00 . A A . 47 VAL C 1 1 2 1478 1 1 48 VAL CA C 1.061 4.013 -2.927 1.00 . A A . 47 VAL CA 1 1 2 1479 1 1 48 VAL CB C 1.887 3.384 -1.772 1.00 . A A . 47 VAL CB 1 1 2 1480 1 1 48 VAL CG1 C 3.296 3.016 -2.217 1.00 . A A . 47 VAL CG1 1 1 2 1481 1 1 48 VAL CG2 C 1.916 4.310 -0.567 1.00 . A A . 47 VAL CG2 1 1 2 1482 1 1 48 VAL H H 1.336 3.056 -4.771 1.00 . A A . 47 VAL H 1 1 2 1483 1 1 48 VAL HA H 0.117 4.353 -2.519 1.00 . A A . 47 VAL HA 1 1 2 1484 1 1 48 VAL HB H 1.394 2.471 -1.471 1.00 . A A . 47 VAL HB 1 1 2 1485 1 1 48 VAL HG11 H 3.840 2.601 -1.383 1.00 . A A . 47 VAL HG11 1 1 2 1486 1 1 48 VAL HG12 H 3.803 3.900 -2.574 1.00 . A A . 47 VAL HG12 1 1 2 1487 1 1 48 VAL HG13 H 3.244 2.285 -3.013 1.00 . A A . 47 VAL HG13 1 1 2 1488 1 1 48 VAL HG21 H 2.581 3.905 0.180 1.00 . A A . 47 VAL HG21 1 1 2 1489 1 1 48 VAL HG22 H 0.920 4.391 -0.152 1.00 . A A . 47 VAL HG22 1 1 2 1490 1 1 48 VAL HG23 H 2.263 5.286 -0.868 1.00 . A A . 47 VAL HG23 1 1 2 1491 1 1 48 VAL N N 0.774 3.059 -3.963 1.00 . A A . 47 VAL N 1 1 2 1492 1 1 48 VAL O O 2.711 5.047 -4.350 1.00 . A A . 47 VAL O 1 1 2 1493 1 1 49 LYS C C 2.240 8.532 -2.426 1.00 . A A . 48 LYS C 1 1 2 1494 1 1 49 LYS CA C 2.147 7.560 -3.591 1.00 . A A . 48 LYS CA 1 1 2 1495 1 1 49 LYS CB C 1.635 8.254 -4.859 1.00 . A A . 48 LYS CB 1 1 2 1496 1 1 49 LYS CD C 0.099 9.904 -5.908 1.00 . A A . 48 LYS CD 1 1 2 1497 1 1 49 LYS CE C -1.129 10.783 -5.760 1.00 . A A . 48 LYS CE 1 1 2 1498 1 1 49 LYS CG C 0.326 9.008 -4.708 1.00 . A A . 48 LYS CG 1 1 2 1499 1 1 49 LYS H H 0.483 6.484 -2.829 1.00 . A A . 48 LYS H 1 1 2 1500 1 1 49 LYS HA H 3.142 7.204 -3.791 1.00 . A A . 48 LYS HA 1 1 2 1501 1 1 49 LYS HB2 H 2.385 8.954 -5.192 1.00 . A A . 48 LYS HB2 1 1 2 1502 1 1 49 LYS HB3 H 1.503 7.502 -5.624 1.00 . A A . 48 LYS HB3 1 1 2 1503 1 1 49 LYS HD2 H 0.965 10.537 -6.038 1.00 . A A . 48 LYS HD2 1 1 2 1504 1 1 49 LYS HD3 H -0.022 9.281 -6.783 1.00 . A A . 48 LYS HD3 1 1 2 1505 1 1 49 LYS HE2 H -2.008 10.155 -5.744 1.00 . A A . 48 LYS HE2 1 1 2 1506 1 1 49 LYS HE3 H -1.057 11.331 -4.832 1.00 . A A . 48 LYS HE3 1 1 2 1507 1 1 49 LYS HG2 H -0.486 8.299 -4.635 1.00 . A A . 48 LYS HG2 1 1 2 1508 1 1 49 LYS HG3 H 0.366 9.615 -3.815 1.00 . A A . 48 LYS HG3 1 1 2 1509 1 1 49 LYS HZ1 H -0.346 12.280 -6.994 1.00 . A A . 48 LYS HZ1 1 1 2 1510 1 1 49 LYS HZ2 H -2.010 12.424 -6.712 1.00 . A A . 48 LYS HZ2 1 1 2 1511 1 1 49 LYS HZ3 H -1.435 11.241 -7.780 1.00 . A A . 48 LYS HZ3 1 1 2 1512 1 1 49 LYS N N 1.357 6.392 -3.244 1.00 . A A . 48 LYS N 1 1 2 1513 1 1 49 LYS NZ N -1.240 11.746 -6.888 1.00 . A A . 48 LYS NZ 1 1 2 1514 1 1 49 LYS O O 1.231 8.996 -1.890 1.00 . A A . 48 LYS O 1 1 2 1515 1 1 50 LYS C C 4.127 11.084 -1.548 1.00 . A A . 49 LYS C 1 1 2 1516 1 1 50 LYS CA C 3.722 9.745 -0.945 1.00 . A A . 49 LYS CA 1 1 2 1517 1 1 50 LYS CB C 4.823 9.181 -0.033 1.00 . A A . 49 LYS CB 1 1 2 1518 1 1 50 LYS CD C 5.512 11.150 1.397 1.00 . A A . 49 LYS CD 1 1 2 1519 1 1 50 LYS CE C 5.546 11.718 2.808 1.00 . A A . 49 LYS CE 1 1 2 1520 1 1 50 LYS CG C 4.857 9.779 1.369 1.00 . A A . 49 LYS CG 1 1 2 1521 1 1 50 LYS H H 4.230 8.385 -2.471 1.00 . A A . 49 LYS H 1 1 2 1522 1 1 50 LYS HA H 2.812 9.870 -0.378 1.00 . A A . 49 LYS HA 1 1 2 1523 1 1 50 LYS HB2 H 4.678 8.116 0.061 1.00 . A A . 49 LYS HB2 1 1 2 1524 1 1 50 LYS HB3 H 5.781 9.361 -0.498 1.00 . A A . 49 LYS HB3 1 1 2 1525 1 1 50 LYS HD2 H 6.523 11.064 1.029 1.00 . A A . 49 LYS HD2 1 1 2 1526 1 1 50 LYS HD3 H 4.951 11.819 0.760 1.00 . A A . 49 LYS HD3 1 1 2 1527 1 1 50 LYS HE2 H 4.532 11.862 3.148 1.00 . A A . 49 LYS HE2 1 1 2 1528 1 1 50 LYS HE3 H 6.045 11.013 3.455 1.00 . A A . 49 LYS HE3 1 1 2 1529 1 1 50 LYS HG2 H 3.844 9.871 1.730 1.00 . A A . 49 LYS HG2 1 1 2 1530 1 1 50 LYS HG3 H 5.408 9.113 2.016 1.00 . A A . 49 LYS HG3 1 1 2 1531 1 1 50 LYS HZ1 H 5.793 13.717 2.249 1.00 . A A . 49 LYS HZ1 1 1 2 1532 1 1 50 LYS HZ2 H 7.250 12.901 2.551 1.00 . A A . 49 LYS HZ2 1 1 2 1533 1 1 50 LYS HZ3 H 6.265 13.385 3.846 1.00 . A A . 49 LYS HZ3 1 1 2 1534 1 1 50 LYS N N 3.466 8.814 -2.023 1.00 . A A . 49 LYS N 1 1 2 1535 1 1 50 LYS NZ N 6.262 13.019 2.867 1.00 . A A . 49 LYS NZ 1 1 2 1536 1 1 50 LYS O O 5.213 11.219 -2.113 1.00 . A A . 49 LYS O 1 1 2 1537 1 1 51 GLY C C 2.349 13.782 -2.955 1.00 . A A . 50 GLY C 1 1 2 1538 1 1 51 GLY CA C 3.482 13.352 -2.048 1.00 . A A . 50 GLY CA 1 1 2 1539 1 1 51 GLY H H 2.398 11.896 -0.971 1.00 . A A . 50 GLY H 1 1 2 1540 1 1 51 GLY HA2 H 3.602 14.083 -1.263 1.00 . A A . 50 GLY HA2 1 1 2 1541 1 1 51 GLY HA3 H 4.394 13.304 -2.627 1.00 . A A . 50 GLY HA3 1 1 2 1542 1 1 51 GLY N N 3.235 12.056 -1.454 1.00 . A A . 50 GLY N 1 1 2 1543 1 1 51 GLY O O 1.226 13.997 -2.493 1.00 . A A . 50 GLY O 1 1 2 1544 1 1 52 SER C C 1.960 13.698 -6.588 1.00 . A A . 51 SER C 1 1 2 1545 1 1 52 SER CA C 1.646 14.312 -5.227 1.00 . A A . 51 SER CA 1 1 2 1546 1 1 52 SER CB C 1.614 15.839 -5.334 1.00 . A A . 51 SER CB 1 1 2 1547 1 1 52 SER H H 3.542 13.678 -4.551 1.00 . A A . 51 SER H 1 1 2 1548 1 1 52 SER HA H 0.680 13.960 -4.899 1.00 . A A . 51 SER HA 1 1 2 1549 1 1 52 SER HB2 H 2.579 16.195 -5.663 1.00 . A A . 51 SER HB2 1 1 2 1550 1 1 52 SER HB3 H 0.858 16.129 -6.052 1.00 . A A . 51 SER HB3 1 1 2 1551 1 1 52 SER HG H 0.690 15.854 -3.607 1.00 . A A . 51 SER HG 1 1 2 1552 1 1 52 SER N N 2.636 13.891 -4.245 1.00 . A A . 51 SER N 1 1 2 1553 1 1 52 SER O O 1.180 12.843 -7.054 1.00 . A A . 51 SER O 1 1 2 1554 1 1 52 SER OG O 1.308 16.430 -4.081 1.00 . A A . 51 SER OG 1 1 3 1555 1 1 2 GLY C C 2.806 12.684 -10.936 1.00 . A A . 1 GLY C 1 1 3 1556 1 1 2 GLY CA C 1.923 13.454 -11.888 1.00 . A A . 1 GLY CA 1 1 3 1557 1 1 2 GLY H H 3.359 13.702 -13.375 1.00 . A A . 1 GLY H 1 1 3 1558 1 1 2 GLY HA2 H 1.932 14.498 -11.610 1.00 . A A . 1 GLY HA2 1 1 3 1559 1 1 2 GLY HA3 H 0.913 13.079 -11.818 1.00 . A A . 1 GLY HA3 1 1 3 1560 1 1 2 GLY N N 2.392 13.321 -13.287 1.00 . A A . 1 GLY N 1 1 3 1561 1 1 2 GLY O O 4.031 12.818 -10.973 1.00 . A A . 1 GLY O 1 1 3 1562 1 1 3 THR C C 2.174 9.755 -8.890 1.00 . A A . 2 THR C 1 1 3 1563 1 1 3 THR CA C 2.938 11.041 -9.166 1.00 . A A . 2 THR CA 1 1 3 1564 1 1 3 THR CB C 3.233 11.778 -7.837 1.00 . A A . 2 THR CB 1 1 3 1565 1 1 3 THR CG2 C 1.949 12.173 -7.119 1.00 . A A . 2 THR CG2 1 1 3 1566 1 1 3 THR H H 1.213 11.813 -10.105 1.00 . A A . 2 THR H 1 1 3 1567 1 1 3 THR HA H 3.882 10.790 -9.630 1.00 . A A . 2 THR HA 1 1 3 1568 1 1 3 THR HB H 3.790 12.676 -8.062 1.00 . A A . 2 THR HB 1 1 3 1569 1 1 3 THR HG1 H 4.559 11.504 -6.393 1.00 . A A . 2 THR HG1 1 1 3 1570 1 1 3 THR HG21 H 1.368 11.288 -6.908 1.00 . A A . 2 THR HG21 1 1 3 1571 1 1 3 THR HG22 H 1.376 12.839 -7.749 1.00 . A A . 2 THR HG22 1 1 3 1572 1 1 3 THR HG23 H 2.194 12.674 -6.194 1.00 . A A . 2 THR HG23 1 1 3 1573 1 1 3 THR N N 2.194 11.871 -10.094 1.00 . A A . 2 THR N 1 1 3 1574 1 1 3 THR O O 0.948 9.763 -8.764 1.00 . A A . 2 THR O 1 1 3 1575 1 1 3 THR OG1 O 4.023 10.946 -6.977 1.00 . A A . 2 THR OG1 1 1 3 1576 1 1 4 ASN C C 3.437 6.327 -8.358 1.00 . A A . 3 ASN C 1 1 3 1577 1 1 4 ASN CA C 2.325 7.342 -8.564 1.00 . A A . 3 ASN CA 1 1 3 1578 1 1 4 ASN CB C 1.388 6.899 -9.707 1.00 . A A . 3 ASN CB 1 1 3 1579 1 1 4 ASN CG C 2.074 6.819 -11.063 1.00 . A A . 3 ASN CG 1 1 3 1580 1 1 4 ASN H H 3.871 8.716 -8.977 1.00 . A A . 3 ASN H 1 1 3 1581 1 1 4 ASN HA H 1.753 7.417 -7.651 1.00 . A A . 3 ASN HA 1 1 3 1582 1 1 4 ASN HB2 H 0.989 5.924 -9.474 1.00 . A A . 3 ASN HB2 1 1 3 1583 1 1 4 ASN HB3 H 0.571 7.602 -9.781 1.00 . A A . 3 ASN HB3 1 1 3 1584 1 1 4 ASN HD21 H 2.364 4.862 -10.835 1.00 . A A . 3 ASN HD21 1 1 3 1585 1 1 4 ASN HD22 H 2.958 5.550 -12.311 1.00 . A A . 3 ASN HD22 1 1 3 1586 1 1 4 ASN N N 2.903 8.650 -8.833 1.00 . A A . 3 ASN N 1 1 3 1587 1 1 4 ASN ND2 N 2.509 5.626 -11.443 1.00 . A A . 3 ASN ND2 1 1 3 1588 1 1 4 ASN O O 4.356 6.226 -9.170 1.00 . A A . 3 ASN O 1 1 3 1589 1 1 4 ASN OD1 O 2.174 7.816 -11.781 1.00 . A A . 3 ASN OD1 1 1 3 1590 1 1 5 THR C C 3.634 3.332 -6.515 1.00 . A A . 4 THR C 1 1 3 1591 1 1 5 THR CA C 4.366 4.586 -6.976 1.00 . A A . 4 THR CA 1 1 3 1592 1 1 5 THR CB C 5.358 5.083 -5.898 1.00 . A A . 4 THR CB 1 1 3 1593 1 1 5 THR CG2 C 6.376 4.018 -5.508 1.00 . A A . 4 THR CG2 1 1 3 1594 1 1 5 THR H H 2.702 5.800 -6.568 1.00 . A A . 4 THR H 1 1 3 1595 1 1 5 THR HA H 4.910 4.377 -7.886 1.00 . A A . 4 THR HA 1 1 3 1596 1 1 5 THR HB H 4.788 5.361 -5.019 1.00 . A A . 4 THR HB 1 1 3 1597 1 1 5 THR HG1 H 5.746 6.440 -7.281 1.00 . A A . 4 THR HG1 1 1 3 1598 1 1 5 THR HG21 H 6.944 3.726 -6.381 1.00 . A A . 4 THR HG21 1 1 3 1599 1 1 5 THR HG22 H 5.859 3.156 -5.110 1.00 . A A . 4 THR HG22 1 1 3 1600 1 1 5 THR HG23 H 7.044 4.413 -4.756 1.00 . A A . 4 THR HG23 1 1 3 1601 1 1 5 THR N N 3.396 5.619 -7.247 1.00 . A A . 4 THR N 1 1 3 1602 1 1 5 THR O O 2.475 3.407 -6.117 1.00 . A A . 4 THR O 1 1 3 1603 1 1 5 THR OG1 O 6.043 6.247 -6.383 1.00 . A A . 4 THR OG1 1 1 3 1604 1 1 6 TYR C C 4.779 0.261 -5.222 1.00 . A A . 5 TYR C 1 1 3 1605 1 1 6 TYR CA C 3.720 0.976 -6.038 1.00 . A A . 5 TYR CA 1 1 3 1606 1 1 6 TYR CB C 3.113 0.037 -7.094 1.00 . A A . 5 TYR CB 1 1 3 1607 1 1 6 TYR CD1 C 4.925 -0.501 -8.779 1.00 . A A . 5 TYR CD1 1 1 3 1608 1 1 6 TYR CD2 C 3.108 0.882 -9.457 1.00 . A A . 5 TYR CD2 1 1 3 1609 1 1 6 TYR CE1 C 5.472 -0.405 -10.046 1.00 . A A . 5 TYR CE1 1 1 3 1610 1 1 6 TYR CE2 C 3.646 0.986 -10.720 1.00 . A A . 5 TYR CE2 1 1 3 1611 1 1 6 TYR CG C 3.734 0.142 -8.466 1.00 . A A . 5 TYR CG 1 1 3 1612 1 1 6 TYR CZ C 4.828 0.340 -11.013 1.00 . A A . 5 TYR CZ 1 1 3 1613 1 1 6 TYR H H 5.125 2.142 -7.099 1.00 . A A . 5 TYR H 1 1 3 1614 1 1 6 TYR HA H 2.927 1.296 -5.361 1.00 . A A . 5 TYR HA 1 1 3 1615 1 1 6 TYR HB2 H 3.238 -0.988 -6.764 1.00 . A A . 5 TYR HB2 1 1 3 1616 1 1 6 TYR HB3 H 2.058 0.249 -7.190 1.00 . A A . 5 TYR HB3 1 1 3 1617 1 1 6 TYR HD1 H 5.426 -1.081 -8.018 1.00 . A A . 5 TYR HD1 1 1 3 1618 1 1 6 TYR HD2 H 2.183 1.389 -9.226 1.00 . A A . 5 TYR HD2 1 1 3 1619 1 1 6 TYR HE1 H 6.400 -0.910 -10.273 1.00 . A A . 5 TYR HE1 1 1 3 1620 1 1 6 TYR HE2 H 3.139 1.568 -11.474 1.00 . A A . 5 TYR HE2 1 1 3 1621 1 1 6 TYR HH H 5.393 1.367 -12.543 1.00 . A A . 5 TYR HH 1 1 3 1622 1 1 6 TYR N N 4.267 2.183 -6.625 1.00 . A A . 5 TYR N 1 1 3 1623 1 1 6 TYR O O 5.966 0.297 -5.550 1.00 . A A . 5 TYR O 1 1 3 1624 1 1 6 TYR OH O 5.363 0.436 -12.279 1.00 . A A . 5 TYR OH 1 1 3 1625 1 1 7 TYR C C 4.925 -2.528 -3.194 1.00 . A A . 6 TYR C 1 1 3 1626 1 1 7 TYR CA C 5.215 -1.035 -3.223 1.00 . A A . 6 TYR CA 1 1 3 1627 1 1 7 TYR CB C 5.016 -0.407 -1.836 1.00 . A A . 6 TYR CB 1 1 3 1628 1 1 7 TYR CD1 C 6.966 -1.118 -0.392 1.00 . A A . 6 TYR CD1 1 1 3 1629 1 1 7 TYR CD2 C 4.797 -1.952 0.140 1.00 . A A . 6 TYR CD2 1 1 3 1630 1 1 7 TYR CE1 C 7.496 -1.808 0.683 1.00 . A A . 6 TYR CE1 1 1 3 1631 1 1 7 TYR CE2 C 5.319 -2.646 1.211 1.00 . A A . 6 TYR CE2 1 1 3 1632 1 1 7 TYR CG C 5.610 -1.180 -0.680 1.00 . A A . 6 TYR CG 1 1 3 1633 1 1 7 TYR CZ C 6.667 -2.570 1.481 1.00 . A A . 6 TYR CZ 1 1 3 1634 1 1 7 TYR H H 3.363 -0.404 -3.998 1.00 . A A . 6 TYR H 1 1 3 1635 1 1 7 TYR HA H 6.234 -0.876 -3.542 1.00 . A A . 6 TYR HA 1 1 3 1636 1 1 7 TYR HB2 H 5.466 0.574 -1.832 1.00 . A A . 6 TYR HB2 1 1 3 1637 1 1 7 TYR HB3 H 3.956 -0.304 -1.653 1.00 . A A . 6 TYR HB3 1 1 3 1638 1 1 7 TYR HD1 H 7.612 -0.523 -1.021 1.00 . A A . 6 TYR HD1 1 1 3 1639 1 1 7 TYR HD2 H 3.741 -2.010 -0.074 1.00 . A A . 6 TYR HD2 1 1 3 1640 1 1 7 TYR HE1 H 8.555 -1.749 0.893 1.00 . A A . 6 TYR HE1 1 1 3 1641 1 1 7 TYR HE2 H 4.668 -3.242 1.837 1.00 . A A . 6 TYR HE2 1 1 3 1642 1 1 7 TYR HH H 7.744 -2.657 3.073 1.00 . A A . 6 TYR HH 1 1 3 1643 1 1 7 TYR N N 4.335 -0.374 -4.160 1.00 . A A . 6 TYR N 1 1 3 1644 1 1 7 TYR O O 3.776 -2.940 -3.016 1.00 . A A . 6 TYR O 1 1 3 1645 1 1 7 TYR OH O 7.188 -3.253 2.557 1.00 . A A . 6 TYR OH 1 1 3 1646 1 1 8 THR C C 5.645 -5.145 -1.815 1.00 . A A . 7 THR C 1 1 3 1647 1 1 8 THR CA C 5.814 -4.767 -3.271 1.00 . A A . 7 THR CA 1 1 3 1648 1 1 8 THR CB C 7.002 -5.532 -3.877 1.00 . A A . 7 THR CB 1 1 3 1649 1 1 8 THR CG2 C 6.687 -5.975 -5.294 1.00 . A A . 7 THR CG2 1 1 3 1650 1 1 8 THR H H 6.831 -2.949 -3.634 1.00 . A A . 7 THR H 1 1 3 1651 1 1 8 THR HA H 4.922 -5.057 -3.806 1.00 . A A . 7 THR HA 1 1 3 1652 1 1 8 THR HB H 7.173 -6.415 -3.278 1.00 . A A . 7 THR HB 1 1 3 1653 1 1 8 THR HG1 H 8.267 -4.238 -4.685 1.00 . A A . 7 THR HG1 1 1 3 1654 1 1 8 THR HG21 H 5.816 -6.614 -5.279 1.00 . A A . 7 THR HG21 1 1 3 1655 1 1 8 THR HG22 H 7.527 -6.519 -5.697 1.00 . A A . 7 THR HG22 1 1 3 1656 1 1 8 THR HG23 H 6.488 -5.110 -5.907 1.00 . A A . 7 THR HG23 1 1 3 1657 1 1 8 THR N N 5.955 -3.332 -3.404 1.00 . A A . 7 THR N 1 1 3 1658 1 1 8 THR O O 6.509 -4.861 -0.984 1.00 . A A . 7 THR O 1 1 3 1659 1 1 8 THR OG1 O 8.190 -4.725 -3.848 1.00 . A A . 7 THR OG1 1 1 3 1660 1 1 9 VAL C C 5.259 -7.031 0.448 1.00 . A A . 8 VAL C 1 1 3 1661 1 1 9 VAL CA C 4.182 -6.139 -0.157 1.00 . A A . 8 VAL CA 1 1 3 1662 1 1 9 VAL CB C 2.831 -6.862 -0.089 1.00 . A A . 8 VAL CB 1 1 3 1663 1 1 9 VAL CG1 C 2.552 -7.310 1.336 1.00 . A A . 8 VAL CG1 1 1 3 1664 1 1 9 VAL CG2 C 1.713 -5.963 -0.606 1.00 . A A . 8 VAL CG2 1 1 3 1665 1 1 9 VAL H H 3.882 -5.971 -2.239 1.00 . A A . 8 VAL H 1 1 3 1666 1 1 9 VAL HA H 4.106 -5.231 0.431 1.00 . A A . 8 VAL HA 1 1 3 1667 1 1 9 VAL HB H 2.881 -7.740 -0.717 1.00 . A A . 8 VAL HB 1 1 3 1668 1 1 9 VAL HG11 H 1.601 -7.819 1.373 1.00 . A A . 8 VAL HG11 1 1 3 1669 1 1 9 VAL HG12 H 2.526 -6.448 1.985 1.00 . A A . 8 VAL HG12 1 1 3 1670 1 1 9 VAL HG13 H 3.333 -7.982 1.661 1.00 . A A . 8 VAL HG13 1 1 3 1671 1 1 9 VAL HG21 H 1.896 -5.710 -1.640 1.00 . A A . 8 VAL HG21 1 1 3 1672 1 1 9 VAL HG22 H 1.678 -5.055 -0.020 1.00 . A A . 8 VAL HG22 1 1 3 1673 1 1 9 VAL HG23 H 0.767 -6.479 -0.524 1.00 . A A . 8 VAL HG23 1 1 3 1674 1 1 9 VAL N N 4.517 -5.766 -1.516 1.00 . A A . 8 VAL N 1 1 3 1675 1 1 9 VAL O O 5.528 -8.134 -0.033 1.00 . A A . 8 VAL O 1 1 3 1676 1 1 10 LYS C C 6.280 -7.728 3.541 1.00 . A A . 9 LYS C 1 1 3 1677 1 1 10 LYS CA C 6.891 -7.214 2.245 1.00 . A A . 9 LYS CA 1 1 3 1678 1 1 10 LYS CB C 8.078 -6.298 2.523 1.00 . A A . 9 LYS CB 1 1 3 1679 1 1 10 LYS CD C 9.605 -7.003 0.623 1.00 . A A . 9 LYS CD 1 1 3 1680 1 1 10 LYS CE C 8.727 -7.870 -0.273 1.00 . A A . 9 LYS CE 1 1 3 1681 1 1 10 LYS CG C 8.833 -5.857 1.270 1.00 . A A . 9 LYS CG 1 1 3 1682 1 1 10 LYS H H 5.639 -5.601 1.760 1.00 . A A . 9 LYS H 1 1 3 1683 1 1 10 LYS HA H 7.223 -8.058 1.657 1.00 . A A . 9 LYS HA 1 1 3 1684 1 1 10 LYS HB2 H 7.722 -5.413 3.029 1.00 . A A . 9 LYS HB2 1 1 3 1685 1 1 10 LYS HB3 H 8.770 -6.815 3.170 1.00 . A A . 9 LYS HB3 1 1 3 1686 1 1 10 LYS HD2 H 10.403 -6.591 0.027 1.00 . A A . 9 LYS HD2 1 1 3 1687 1 1 10 LYS HD3 H 10.025 -7.623 1.403 1.00 . A A . 9 LYS HD3 1 1 3 1688 1 1 10 LYS HE2 H 7.851 -8.177 0.282 1.00 . A A . 9 LYS HE2 1 1 3 1689 1 1 10 LYS HE3 H 8.423 -7.289 -1.131 1.00 . A A . 9 LYS HE3 1 1 3 1690 1 1 10 LYS HG2 H 8.122 -5.473 0.556 1.00 . A A . 9 LYS HG2 1 1 3 1691 1 1 10 LYS HG3 H 9.529 -5.077 1.543 1.00 . A A . 9 LYS HG3 1 1 3 1692 1 1 10 LYS HZ1 H 10.337 -8.803 -1.225 1.00 . A A . 9 LYS HZ1 1 1 3 1693 1 1 10 LYS HZ2 H 8.866 -9.627 -1.403 1.00 . A A . 9 LYS HZ2 1 1 3 1694 1 1 10 LYS HZ3 H 9.697 -9.686 0.074 1.00 . A A . 9 LYS HZ3 1 1 3 1695 1 1 10 LYS N N 5.877 -6.513 1.485 1.00 . A A . 9 LYS N 1 1 3 1696 1 1 10 LYS NZ N 9.456 -9.079 -0.739 1.00 . A A . 9 LYS NZ 1 1 3 1697 1 1 10 LYS O O 5.060 -7.690 3.693 1.00 . A A . 9 LYS O 1 1 3 1698 1 1 11 SER C C 5.696 -7.821 6.450 1.00 . A A . 10 SER C 1 1 3 1699 1 1 11 SER CA C 6.665 -8.784 5.734 1.00 . A A . 10 SER CA 1 1 3 1700 1 1 11 SER CB C 7.875 -9.057 6.624 1.00 . A A . 10 SER CB 1 1 3 1701 1 1 11 SER H H 8.066 -8.361 4.196 1.00 . A A . 10 SER H 1 1 3 1702 1 1 11 SER HA H 6.149 -9.711 5.564 1.00 . A A . 10 SER HA 1 1 3 1703 1 1 11 SER HB2 H 8.399 -8.131 6.810 1.00 . A A . 10 SER HB2 1 1 3 1704 1 1 11 SER HB3 H 7.543 -9.479 7.561 1.00 . A A . 10 SER HB3 1 1 3 1705 1 1 11 SER HG H 9.623 -9.931 6.446 1.00 . A A . 10 SER HG 1 1 3 1706 1 1 11 SER N N 7.113 -8.284 4.425 1.00 . A A . 10 SER N 1 1 3 1707 1 1 11 SER O O 4.990 -8.220 7.380 1.00 . A A . 10 SER O 1 1 3 1708 1 1 11 SER OG O 8.765 -9.968 5.999 1.00 . A A . 10 SER OG 1 1 3 1709 1 1 12 GLY C C 3.301 -6.019 5.753 1.00 . A A . 11 GLY C 1 1 3 1710 1 1 12 GLY CA C 4.616 -5.648 6.425 1.00 . A A . 11 GLY CA 1 1 3 1711 1 1 12 GLY H H 6.390 -6.247 5.432 1.00 . A A . 11 GLY H 1 1 3 1712 1 1 12 GLY HA2 H 4.494 -5.695 7.498 1.00 . A A . 11 GLY HA2 1 1 3 1713 1 1 12 GLY HA3 H 4.885 -4.644 6.140 1.00 . A A . 11 GLY HA3 1 1 3 1714 1 1 12 GLY N N 5.677 -6.558 6.028 1.00 . A A . 11 GLY N 1 1 3 1715 1 1 12 GLY O O 2.711 -5.234 5.024 1.00 . A A . 11 GLY O 1 1 3 1716 1 1 13 ASP C C 0.374 -7.143 5.726 1.00 . A A . 12 ASP C 1 1 3 1717 1 1 13 ASP CA C 1.690 -7.828 5.371 1.00 . A A . 12 ASP CA 1 1 3 1718 1 1 13 ASP CB C 1.593 -9.301 5.732 1.00 . A A . 12 ASP CB 1 1 3 1719 1 1 13 ASP CG C 1.149 -9.513 7.165 1.00 . A A . 12 ASP CG 1 1 3 1720 1 1 13 ASP H H 3.326 -7.758 6.706 1.00 . A A . 12 ASP H 1 1 3 1721 1 1 13 ASP HA H 1.843 -7.747 4.307 1.00 . A A . 12 ASP HA 1 1 3 1722 1 1 13 ASP HB2 H 0.875 -9.774 5.075 1.00 . A A . 12 ASP HB2 1 1 3 1723 1 1 13 ASP HB3 H 2.558 -9.763 5.598 1.00 . A A . 12 ASP HB3 1 1 3 1724 1 1 13 ASP N N 2.847 -7.226 6.030 1.00 . A A . 12 ASP N 1 1 3 1725 1 1 13 ASP O O -0.685 -7.537 5.239 1.00 . A A . 12 ASP O 1 1 3 1726 1 1 13 ASP OD1 O 1.943 -9.231 8.092 1.00 . A A . 12 ASP OD1 1 1 3 1727 1 1 13 ASP OD2 O 0.002 -9.949 7.374 1.00 . A A . 12 ASP OD2 1 1 3 1728 1 1 14 THR C C -0.855 -4.099 6.702 1.00 . A A . 13 THR C 1 1 3 1729 1 1 14 THR CA C -0.805 -5.566 7.101 1.00 . A A . 13 THR CA 1 1 3 1730 1 1 14 THR CB C -0.898 -5.717 8.632 1.00 . A A . 13 THR CB 1 1 3 1731 1 1 14 THR CG2 C -2.249 -5.265 9.155 1.00 . A A . 13 THR CG2 1 1 3 1732 1 1 14 THR H H 1.283 -5.790 6.871 1.00 . A A . 13 THR H 1 1 3 1733 1 1 14 THR HA H -1.642 -6.083 6.652 1.00 . A A . 13 THR HA 1 1 3 1734 1 1 14 THR HB H -0.128 -5.111 9.088 1.00 . A A . 13 THR HB 1 1 3 1735 1 1 14 THR HG1 H -0.727 -7.639 8.192 1.00 . A A . 13 THR HG1 1 1 3 1736 1 1 14 THR HG21 H -2.283 -5.396 10.225 1.00 . A A . 13 THR HG21 1 1 3 1737 1 1 14 THR HG22 H -3.027 -5.854 8.695 1.00 . A A . 13 THR HG22 1 1 3 1738 1 1 14 THR HG23 H -2.398 -4.223 8.914 1.00 . A A . 13 THR HG23 1 1 3 1739 1 1 14 THR N N 0.417 -6.168 6.608 1.00 . A A . 13 THR N 1 1 3 1740 1 1 14 THR O O 0.176 -3.419 6.704 1.00 . A A . 13 THR O 1 1 3 1741 1 1 14 THR OG1 O -0.689 -7.091 8.990 1.00 . A A . 13 THR OG1 1 1 3 1742 1 1 15 LEU C C -1.622 -1.226 6.752 1.00 . A A . 14 LEU C 1 1 3 1743 1 1 15 LEU CA C -2.238 -2.277 5.843 1.00 . A A . 14 LEU CA 1 1 3 1744 1 1 15 LEU CB C -3.729 -1.957 5.686 1.00 . A A . 14 LEU CB 1 1 3 1745 1 1 15 LEU CD1 C -4.003 -1.993 3.191 1.00 . A A . 14 LEU CD1 1 1 3 1746 1 1 15 LEU CD2 C -4.328 -4.099 4.485 1.00 . A A . 14 LEU CD2 1 1 3 1747 1 1 15 LEU CG C -4.477 -2.587 4.502 1.00 . A A . 14 LEU CG 1 1 3 1748 1 1 15 LEU H H -2.846 -4.188 6.525 1.00 . A A . 14 LEU H 1 1 3 1749 1 1 15 LEU HA H -1.764 -2.236 4.875 1.00 . A A . 14 LEU HA 1 1 3 1750 1 1 15 LEU HB2 H -4.224 -2.264 6.592 1.00 . A A . 14 LEU HB2 1 1 3 1751 1 1 15 LEU HB3 H -3.818 -0.885 5.602 1.00 . A A . 14 LEU HB3 1 1 3 1752 1 1 15 LEU HD11 H -2.950 -2.202 3.058 1.00 . A A . 14 LEU HD11 1 1 3 1753 1 1 15 LEU HD12 H -4.160 -0.924 3.201 1.00 . A A . 14 LEU HD12 1 1 3 1754 1 1 15 LEU HD13 H -4.561 -2.429 2.376 1.00 . A A . 14 LEU HD13 1 1 3 1755 1 1 15 LEU HD21 H -4.736 -4.512 5.395 1.00 . A A . 14 LEU HD21 1 1 3 1756 1 1 15 LEU HD22 H -3.281 -4.357 4.409 1.00 . A A . 14 LEU HD22 1 1 3 1757 1 1 15 LEU HD23 H -4.860 -4.503 3.637 1.00 . A A . 14 LEU HD23 1 1 3 1758 1 1 15 LEU HG H -5.529 -2.361 4.598 1.00 . A A . 14 LEU HG 1 1 3 1759 1 1 15 LEU N N -2.055 -3.620 6.388 1.00 . A A . 14 LEU N 1 1 3 1760 1 1 15 LEU O O -0.881 -0.355 6.297 1.00 . A A . 14 LEU O 1 1 3 1761 1 1 16 ASN C C 0.053 -0.343 9.182 1.00 . A A . 15 ASN C 1 1 3 1762 1 1 16 ASN CA C -1.466 -0.340 9.007 1.00 . A A . 15 ASN CA 1 1 3 1763 1 1 16 ASN CB C -2.178 -0.525 10.360 1.00 . A A . 15 ASN CB 1 1 3 1764 1 1 16 ASN CG C -2.108 -1.941 10.916 1.00 . A A . 15 ASN CG 1 1 3 1765 1 1 16 ASN H H -2.457 -2.092 8.347 1.00 . A A . 15 ASN H 1 1 3 1766 1 1 16 ASN HA H -1.746 0.627 8.611 1.00 . A A . 15 ASN HA 1 1 3 1767 1 1 16 ASN HB2 H -1.729 0.136 11.082 1.00 . A A . 15 ASN HB2 1 1 3 1768 1 1 16 ASN HB3 H -3.218 -0.260 10.243 1.00 . A A . 15 ASN HB3 1 1 3 1769 1 1 16 ASN HD21 H -3.871 -1.691 11.803 1.00 . A A . 15 ASN HD21 1 1 3 1770 1 1 16 ASN HD22 H -3.120 -3.232 12.039 1.00 . A A . 15 ASN HD22 1 1 3 1771 1 1 16 ASN N N -1.912 -1.332 8.040 1.00 . A A . 15 ASN N 1 1 3 1772 1 1 16 ASN ND2 N -3.135 -2.328 11.659 1.00 . A A . 15 ASN ND2 1 1 3 1773 1 1 16 ASN O O 0.644 0.705 9.444 1.00 . A A . 15 ASN O 1 1 3 1774 1 1 16 ASN OD1 O -1.155 -2.683 10.681 1.00 . A A . 15 ASN OD1 1 1 3 1775 1 1 17 LYS C C 2.885 -0.905 8.096 1.00 . A A . 16 LYS C 1 1 3 1776 1 1 17 LYS CA C 2.133 -1.594 9.227 1.00 . A A . 16 LYS CA 1 1 3 1777 1 1 17 LYS CB C 2.586 -3.057 9.331 1.00 . A A . 16 LYS CB 1 1 3 1778 1 1 17 LYS CD C 2.685 -5.157 10.739 1.00 . A A . 16 LYS CD 1 1 3 1779 1 1 17 LYS CE C 2.443 -6.090 9.564 1.00 . A A . 16 LYS CE 1 1 3 1780 1 1 17 LYS CG C 2.020 -3.799 10.535 1.00 . A A . 16 LYS CG 1 1 3 1781 1 1 17 LYS H H 0.187 -2.297 8.743 1.00 . A A . 16 LYS H 1 1 3 1782 1 1 17 LYS HA H 2.365 -1.088 10.154 1.00 . A A . 16 LYS HA 1 1 3 1783 1 1 17 LYS HB2 H 2.276 -3.580 8.439 1.00 . A A . 16 LYS HB2 1 1 3 1784 1 1 17 LYS HB3 H 3.664 -3.082 9.396 1.00 . A A . 16 LYS HB3 1 1 3 1785 1 1 17 LYS HD2 H 3.749 -5.012 10.856 1.00 . A A . 16 LYS HD2 1 1 3 1786 1 1 17 LYS HD3 H 2.283 -5.610 11.634 1.00 . A A . 16 LYS HD3 1 1 3 1787 1 1 17 LYS HE2 H 1.379 -6.237 9.451 1.00 . A A . 16 LYS HE2 1 1 3 1788 1 1 17 LYS HE3 H 2.841 -5.634 8.669 1.00 . A A . 16 LYS HE3 1 1 3 1789 1 1 17 LYS HG2 H 2.175 -3.201 11.422 1.00 . A A . 16 LYS HG2 1 1 3 1790 1 1 17 LYS HG3 H 0.961 -3.947 10.383 1.00 . A A . 16 LYS HG3 1 1 3 1791 1 1 17 LYS HZ1 H 2.842 -7.797 10.700 1.00 . A A . 16 LYS HZ1 1 1 3 1792 1 1 17 LYS HZ2 H 4.129 -7.320 9.708 1.00 . A A . 16 LYS HZ2 1 1 3 1793 1 1 17 LYS HZ3 H 2.778 -8.087 9.029 1.00 . A A . 16 LYS HZ3 1 1 3 1794 1 1 17 LYS N N 0.691 -1.502 9.021 1.00 . A A . 16 LYS N 1 1 3 1795 1 1 17 LYS NZ N 3.095 -7.412 9.763 1.00 . A A . 16 LYS NZ 1 1 3 1796 1 1 17 LYS O O 3.777 -0.083 8.333 1.00 . A A . 16 LYS O 1 1 3 1797 1 1 18 ILE C C 2.829 0.810 5.489 1.00 . A A . 17 ILE C 1 1 3 1798 1 1 18 ILE CA C 3.180 -0.654 5.709 1.00 . A A . 17 ILE CA 1 1 3 1799 1 1 18 ILE CB C 2.920 -1.465 4.426 1.00 . A A . 17 ILE CB 1 1 3 1800 1 1 18 ILE CD1 C 1.174 -2.638 3.013 1.00 . A A . 17 ILE CD1 1 1 3 1801 1 1 18 ILE CG1 C 1.473 -1.949 4.325 1.00 . A A . 17 ILE CG1 1 1 3 1802 1 1 18 ILE CG2 C 3.870 -2.639 4.365 1.00 . A A . 17 ILE CG2 1 1 3 1803 1 1 18 ILE H H 1.736 -1.816 6.732 1.00 . A A . 17 ILE H 1 1 3 1804 1 1 18 ILE HA H 4.240 -0.711 5.919 1.00 . A A . 17 ILE HA 1 1 3 1805 1 1 18 ILE HB H 3.130 -0.833 3.591 1.00 . A A . 17 ILE HB 1 1 3 1806 1 1 18 ILE HD11 H 0.171 -3.043 3.040 1.00 . A A . 17 ILE HD11 1 1 3 1807 1 1 18 ILE HD12 H 1.885 -3.440 2.851 1.00 . A A . 17 ILE HD12 1 1 3 1808 1 1 18 ILE HD13 H 1.250 -1.925 2.207 1.00 . A A . 17 ILE HD13 1 1 3 1809 1 1 18 ILE HG12 H 1.274 -2.655 5.118 1.00 . A A . 17 ILE HG12 1 1 3 1810 1 1 18 ILE HG13 H 0.806 -1.106 4.418 1.00 . A A . 17 ILE HG13 1 1 3 1811 1 1 18 ILE HG21 H 4.887 -2.287 4.436 1.00 . A A . 17 ILE HG21 1 1 3 1812 1 1 18 ILE HG22 H 3.730 -3.162 3.431 1.00 . A A . 17 ILE HG22 1 1 3 1813 1 1 18 ILE HG23 H 3.660 -3.308 5.187 1.00 . A A . 17 ILE HG23 1 1 3 1814 1 1 18 ILE N N 2.496 -1.208 6.865 1.00 . A A . 17 ILE N 1 1 3 1815 1 1 18 ILE O O 3.687 1.613 5.127 1.00 . A A . 17 ILE O 1 1 3 1816 1 1 19 ALA C C 1.936 3.450 6.522 1.00 . A A . 18 ALA C 1 1 3 1817 1 1 19 ALA CA C 1.127 2.544 5.608 1.00 . A A . 18 ALA CA 1 1 3 1818 1 1 19 ALA CB C -0.341 2.654 5.963 1.00 . A A . 18 ALA CB 1 1 3 1819 1 1 19 ALA H H 0.923 0.461 5.955 1.00 . A A . 18 ALA H 1 1 3 1820 1 1 19 ALA HA H 1.256 2.861 4.584 1.00 . A A . 18 ALA HA 1 1 3 1821 1 1 19 ALA HB1 H -0.477 2.363 6.995 1.00 . A A . 18 ALA HB1 1 1 3 1822 1 1 19 ALA HB2 H -0.917 2.003 5.324 1.00 . A A . 18 ALA HB2 1 1 3 1823 1 1 19 ALA HB3 H -0.666 3.675 5.829 1.00 . A A . 18 ALA HB3 1 1 3 1824 1 1 19 ALA N N 1.573 1.158 5.722 1.00 . A A . 18 ALA N 1 1 3 1825 1 1 19 ALA O O 2.438 4.495 6.101 1.00 . A A . 18 ALA O 1 1 3 1826 1 1 20 ALA C C 4.312 3.777 8.432 1.00 . A A . 19 ALA C 1 1 3 1827 1 1 20 ALA CA C 2.823 3.796 8.756 1.00 . A A . 19 ALA CA 1 1 3 1828 1 1 20 ALA CB C 2.575 3.254 10.154 1.00 . A A . 19 ALA CB 1 1 3 1829 1 1 20 ALA H H 1.655 2.185 8.044 1.00 . A A . 19 ALA H 1 1 3 1830 1 1 20 ALA HA H 2.472 4.817 8.723 1.00 . A A . 19 ALA HA 1 1 3 1831 1 1 20 ALA HB1 H 3.110 3.856 10.874 1.00 . A A . 19 ALA HB1 1 1 3 1832 1 1 20 ALA HB2 H 2.920 2.231 10.211 1.00 . A A . 19 ALA HB2 1 1 3 1833 1 1 20 ALA HB3 H 1.518 3.291 10.372 1.00 . A A . 19 ALA HB3 1 1 3 1834 1 1 20 ALA N N 2.072 3.032 7.773 1.00 . A A . 19 ALA N 1 1 3 1835 1 1 20 ALA O O 5.048 4.683 8.817 1.00 . A A . 19 ALA O 1 1 3 1836 1 1 21 GLN C C 6.646 3.799 6.520 1.00 . A A . 20 GLN C 1 1 3 1837 1 1 21 GLN CA C 6.160 2.610 7.350 1.00 . A A . 20 GLN CA 1 1 3 1838 1 1 21 GLN CB C 6.411 1.319 6.572 1.00 . A A . 20 GLN CB 1 1 3 1839 1 1 21 GLN CD C 8.096 -0.028 5.242 1.00 . A A . 20 GLN CD 1 1 3 1840 1 1 21 GLN CG C 7.871 1.135 6.185 1.00 . A A . 20 GLN CG 1 1 3 1841 1 1 21 GLN H H 4.100 2.055 7.423 1.00 . A A . 20 GLN H 1 1 3 1842 1 1 21 GLN HA H 6.727 2.577 8.268 1.00 . A A . 20 GLN HA 1 1 3 1843 1 1 21 GLN HB2 H 6.111 0.477 7.181 1.00 . A A . 20 GLN HB2 1 1 3 1844 1 1 21 GLN HB3 H 5.820 1.332 5.670 1.00 . A A . 20 GLN HB3 1 1 3 1845 1 1 21 GLN HE21 H 9.652 0.905 4.430 1.00 . A A . 20 GLN HE21 1 1 3 1846 1 1 21 GLN HE22 H 9.281 -0.659 3.779 1.00 . A A . 20 GLN HE22 1 1 3 1847 1 1 21 GLN HG2 H 8.216 2.037 5.704 1.00 . A A . 20 GLN HG2 1 1 3 1848 1 1 21 GLN HG3 H 8.446 0.966 7.083 1.00 . A A . 20 GLN HG3 1 1 3 1849 1 1 21 GLN N N 4.746 2.747 7.708 1.00 . A A . 20 GLN N 1 1 3 1850 1 1 21 GLN NE2 N 9.110 0.086 4.400 1.00 . A A . 20 GLN NE2 1 1 3 1851 1 1 21 GLN O O 7.699 4.371 6.806 1.00 . A A . 20 GLN O 1 1 3 1852 1 1 21 GLN OE1 O 7.368 -1.019 5.267 1.00 . A A . 20 GLN OE1 1 1 3 1853 1 1 22 TYR C C 5.449 6.550 4.941 1.00 . A A . 21 TYR C 1 1 3 1854 1 1 22 TYR CA C 6.273 5.299 4.648 1.00 . A A . 21 TYR CA 1 1 3 1855 1 1 22 TYR CB C 6.213 4.937 3.155 1.00 . A A . 21 TYR CB 1 1 3 1856 1 1 22 TYR CD1 C 3.821 4.139 2.906 1.00 . A A . 21 TYR CD1 1 1 3 1857 1 1 22 TYR CD2 C 5.581 2.668 2.259 1.00 . A A . 21 TYR CD2 1 1 3 1858 1 1 22 TYR CE1 C 2.888 3.187 2.536 1.00 . A A . 21 TYR CE1 1 1 3 1859 1 1 22 TYR CE2 C 4.656 1.711 1.889 1.00 . A A . 21 TYR CE2 1 1 3 1860 1 1 22 TYR CG C 5.181 3.896 2.775 1.00 . A A . 21 TYR CG 1 1 3 1861 1 1 22 TYR CZ C 3.312 1.976 2.028 1.00 . A A . 21 TYR CZ 1 1 3 1862 1 1 22 TYR H H 5.048 3.692 5.316 1.00 . A A . 21 TYR H 1 1 3 1863 1 1 22 TYR HA H 7.301 5.527 4.893 1.00 . A A . 21 TYR HA 1 1 3 1864 1 1 22 TYR HB2 H 5.993 5.829 2.590 1.00 . A A . 21 TYR HB2 1 1 3 1865 1 1 22 TYR HB3 H 7.181 4.564 2.852 1.00 . A A . 21 TYR HB3 1 1 3 1866 1 1 22 TYR HD1 H 3.492 5.087 3.305 1.00 . A A . 21 TYR HD1 1 1 3 1867 1 1 22 TYR HD2 H 6.636 2.464 2.152 1.00 . A A . 21 TYR HD2 1 1 3 1868 1 1 22 TYR HE1 H 1.835 3.394 2.645 1.00 . A A . 21 TYR HE1 1 1 3 1869 1 1 22 TYR HE2 H 4.990 0.763 1.491 1.00 . A A . 21 TYR HE2 1 1 3 1870 1 1 22 TYR HH H 1.700 1.436 1.131 1.00 . A A . 21 TYR HH 1 1 3 1871 1 1 22 TYR N N 5.883 4.177 5.500 1.00 . A A . 21 TYR N 1 1 3 1872 1 1 22 TYR O O 5.473 7.516 4.175 1.00 . A A . 21 TYR O 1 1 3 1873 1 1 22 TYR OH O 2.388 1.026 1.658 1.00 . A A . 21 TYR OH 1 1 3 1874 1 1 23 GLY C C 2.900 8.158 5.687 1.00 . A A . 22 GLY C 1 1 3 1875 1 1 23 GLY CA C 4.070 7.718 6.541 1.00 . A A . 22 GLY CA 1 1 3 1876 1 1 23 GLY H H 4.651 5.685 6.551 1.00 . A A . 22 GLY H 1 1 3 1877 1 1 23 GLY HA2 H 3.715 7.529 7.542 1.00 . A A . 22 GLY HA2 1 1 3 1878 1 1 23 GLY HA3 H 4.794 8.520 6.578 1.00 . A A . 22 GLY HA3 1 1 3 1879 1 1 23 GLY N N 4.731 6.524 6.053 1.00 . A A . 22 GLY N 1 1 3 1880 1 1 23 GLY O O 2.803 9.326 5.312 1.00 . A A . 22 GLY O 1 1 3 1881 1 1 24 VAL C C -0.388 6.913 5.352 1.00 . A A . 23 VAL C 1 1 3 1882 1 1 24 VAL CA C 0.801 7.567 4.646 1.00 . A A . 23 VAL CA 1 1 3 1883 1 1 24 VAL CB C 0.867 7.140 3.155 1.00 . A A . 23 VAL CB 1 1 3 1884 1 1 24 VAL CG1 C 0.441 5.689 2.963 1.00 . A A . 23 VAL CG1 1 1 3 1885 1 1 24 VAL CG2 C 0.060 8.089 2.280 1.00 . A A . 23 VAL CG2 1 1 3 1886 1 1 24 VAL H H 2.183 6.293 5.623 1.00 . A A . 23 VAL H 1 1 3 1887 1 1 24 VAL HA H 0.679 8.641 4.690 1.00 . A A . 23 VAL HA 1 1 3 1888 1 1 24 VAL HB H 1.891 7.211 2.840 1.00 . A A . 23 VAL HB 1 1 3 1889 1 1 24 VAL HG11 H 1.106 5.044 3.520 1.00 . A A . 23 VAL HG11 1 1 3 1890 1 1 24 VAL HG12 H 0.490 5.435 1.915 1.00 . A A . 23 VAL HG12 1 1 3 1891 1 1 24 VAL HG13 H -0.571 5.556 3.322 1.00 . A A . 23 VAL HG13 1 1 3 1892 1 1 24 VAL HG21 H -0.977 8.062 2.576 1.00 . A A . 23 VAL HG21 1 1 3 1893 1 1 24 VAL HG22 H 0.147 7.789 1.246 1.00 . A A . 23 VAL HG22 1 1 3 1894 1 1 24 VAL HG23 H 0.440 9.093 2.394 1.00 . A A . 23 VAL HG23 1 1 3 1895 1 1 24 VAL N N 2.019 7.229 5.362 1.00 . A A . 23 VAL N 1 1 3 1896 1 1 24 VAL O O -0.203 6.110 6.272 1.00 . A A . 23 VAL O 1 1 3 1897 1 1 25 SER C C -3.218 5.403 4.993 1.00 . A A . 24 SER C 1 1 3 1898 1 1 25 SER CA C -2.775 6.733 5.602 1.00 . A A . 24 SER CA 1 1 3 1899 1 1 25 SER CB C -3.918 7.752 5.537 1.00 . A A . 24 SER CB 1 1 3 1900 1 1 25 SER H H -1.700 7.863 4.185 1.00 . A A . 24 SER H 1 1 3 1901 1 1 25 SER HA H -2.521 6.568 6.637 1.00 . A A . 24 SER HA 1 1 3 1902 1 1 25 SER HB2 H -3.615 8.663 6.033 1.00 . A A . 24 SER HB2 1 1 3 1903 1 1 25 SER HB3 H -4.148 7.966 4.503 1.00 . A A . 24 SER HB3 1 1 3 1904 1 1 25 SER HG H -4.963 7.277 7.134 1.00 . A A . 24 SER HG 1 1 3 1905 1 1 25 SER N N -1.596 7.255 4.945 1.00 . A A . 24 SER N 1 1 3 1906 1 1 25 SER O O -3.119 5.159 3.770 1.00 . A A . 24 SER O 1 1 3 1907 1 1 25 SER OG O -5.086 7.257 6.171 1.00 . A A . 24 SER OG 1 1 3 1908 1 1 26 VAL C C -5.466 3.502 4.529 1.00 . A A . 25 VAL C 1 1 3 1909 1 1 26 VAL CA C -4.287 3.280 5.472 1.00 . A A . 25 VAL CA 1 1 3 1910 1 1 26 VAL CB C -4.751 2.482 6.711 1.00 . A A . 25 VAL CB 1 1 3 1911 1 1 26 VAL CG1 C -5.141 1.067 6.332 1.00 . A A . 25 VAL CG1 1 1 3 1912 1 1 26 VAL CG2 C -3.666 2.466 7.779 1.00 . A A . 25 VAL CG2 1 1 3 1913 1 1 26 VAL H H -3.729 4.796 6.817 1.00 . A A . 25 VAL H 1 1 3 1914 1 1 26 VAL HA H -3.520 2.716 4.961 1.00 . A A . 25 VAL HA 1 1 3 1915 1 1 26 VAL HB H -5.621 2.971 7.123 1.00 . A A . 25 VAL HB 1 1 3 1916 1 1 26 VAL HG11 H -5.530 0.554 7.201 1.00 . A A . 25 VAL HG11 1 1 3 1917 1 1 26 VAL HG12 H -4.272 0.543 5.964 1.00 . A A . 25 VAL HG12 1 1 3 1918 1 1 26 VAL HG13 H -5.896 1.097 5.563 1.00 . A A . 25 VAL HG13 1 1 3 1919 1 1 26 VAL HG21 H -4.008 1.901 8.631 1.00 . A A . 25 VAL HG21 1 1 3 1920 1 1 26 VAL HG22 H -3.447 3.479 8.084 1.00 . A A . 25 VAL HG22 1 1 3 1921 1 1 26 VAL HG23 H -2.773 2.011 7.377 1.00 . A A . 25 VAL HG23 1 1 3 1922 1 1 26 VAL N N -3.732 4.554 5.865 1.00 . A A . 25 VAL N 1 1 3 1923 1 1 26 VAL O O -5.706 2.716 3.614 1.00 . A A . 25 VAL O 1 1 3 1924 1 1 27 ALA C C -6.959 5.191 2.480 1.00 . A A . 26 ALA C 1 1 3 1925 1 1 27 ALA CA C -7.335 4.943 3.937 1.00 . A A . 26 ALA CA 1 1 3 1926 1 1 27 ALA CB C -8.042 6.160 4.511 1.00 . A A . 26 ALA CB 1 1 3 1927 1 1 27 ALA H H -5.906 5.211 5.470 1.00 . A A . 26 ALA H 1 1 3 1928 1 1 27 ALA HA H -8.021 4.109 3.981 1.00 . A A . 26 ALA HA 1 1 3 1929 1 1 27 ALA HB1 H -8.946 6.349 3.953 1.00 . A A . 26 ALA HB1 1 1 3 1930 1 1 27 ALA HB2 H -7.391 7.019 4.444 1.00 . A A . 26 ALA HB2 1 1 3 1931 1 1 27 ALA HB3 H -8.290 5.976 5.547 1.00 . A A . 26 ALA HB3 1 1 3 1932 1 1 27 ALA N N -6.174 4.605 4.743 1.00 . A A . 26 ALA N 1 1 3 1933 1 1 27 ALA O O -7.602 4.659 1.577 1.00 . A A . 26 ALA O 1 1 3 1934 1 1 28 ASN C C -5.025 5.082 0.126 1.00 . A A . 27 ASN C 1 1 3 1935 1 1 28 ASN CA C -5.526 6.305 0.872 1.00 . A A . 27 ASN CA 1 1 3 1936 1 1 28 ASN CB C -4.494 7.446 0.781 1.00 . A A . 27 ASN CB 1 1 3 1937 1 1 28 ASN CG C -3.242 7.211 1.583 1.00 . A A . 27 ASN CG 1 1 3 1938 1 1 28 ASN H H -5.389 6.333 2.993 1.00 . A A . 27 ASN H 1 1 3 1939 1 1 28 ASN HA H -6.424 6.630 0.374 1.00 . A A . 27 ASN HA 1 1 3 1940 1 1 28 ASN HB2 H -4.200 7.574 -0.248 1.00 . A A . 27 ASN HB2 1 1 3 1941 1 1 28 ASN HB3 H -4.950 8.360 1.130 1.00 . A A . 27 ASN HB3 1 1 3 1942 1 1 28 ASN HD21 H -2.492 6.076 0.141 1.00 . A A . 27 ASN HD21 1 1 3 1943 1 1 28 ASN HD22 H -1.498 6.274 1.537 1.00 . A A . 27 ASN HD22 1 1 3 1944 1 1 28 ASN N N -5.908 5.976 2.243 1.00 . A A . 27 ASN N 1 1 3 1945 1 1 28 ASN ND2 N -2.317 6.445 1.031 1.00 . A A . 27 ASN ND2 1 1 3 1946 1 1 28 ASN O O -5.449 4.846 -1.006 1.00 . A A . 27 ASN O 1 1 3 1947 1 1 28 ASN OD1 O -3.105 7.718 2.687 1.00 . A A . 27 ASN OD1 1 1 3 1948 1 1 29 LEU C C -4.672 2.054 -0.225 1.00 . A A . 28 LEU C 1 1 3 1949 1 1 29 LEU CA C -3.620 3.138 -0.011 1.00 . A A . 28 LEU CA 1 1 3 1950 1 1 29 LEU CB C -2.300 2.581 0.544 1.00 . A A . 28 LEU CB 1 1 3 1951 1 1 29 LEU CD1 C -2.898 1.145 2.523 1.00 . A A . 28 LEU CD1 1 1 3 1952 1 1 29 LEU CD2 C -0.695 2.326 2.411 1.00 . A A . 28 LEU CD2 1 1 3 1953 1 1 29 LEU CG C -2.170 2.396 2.052 1.00 . A A . 28 LEU CG 1 1 3 1954 1 1 29 LEU H H -3.858 4.455 1.659 1.00 . A A . 28 LEU H 1 1 3 1955 1 1 29 LEU HA H -3.402 3.529 -0.996 1.00 . A A . 28 LEU HA 1 1 3 1956 1 1 29 LEU HB2 H -2.131 1.619 0.084 1.00 . A A . 28 LEU HB2 1 1 3 1957 1 1 29 LEU HB3 H -1.507 3.244 0.224 1.00 . A A . 28 LEU HB3 1 1 3 1958 1 1 29 LEU HD11 H -2.466 0.269 2.049 1.00 . A A . 28 LEU HD11 1 1 3 1959 1 1 29 LEU HD12 H -3.943 1.216 2.259 1.00 . A A . 28 LEU HD12 1 1 3 1960 1 1 29 LEU HD13 H -2.803 1.055 3.596 1.00 . A A . 28 LEU HD13 1 1 3 1961 1 1 29 LEU HD21 H -0.277 1.404 2.033 1.00 . A A . 28 LEU HD21 1 1 3 1962 1 1 29 LEU HD22 H -0.580 2.365 3.483 1.00 . A A . 28 LEU HD22 1 1 3 1963 1 1 29 LEU HD23 H -0.176 3.163 1.957 1.00 . A A . 28 LEU HD23 1 1 3 1964 1 1 29 LEU HG H -2.598 3.248 2.556 1.00 . A A . 28 LEU HG 1 1 3 1965 1 1 29 LEU N N -4.147 4.279 0.731 1.00 . A A . 28 LEU N 1 1 3 1966 1 1 29 LEU O O -4.644 1.358 -1.236 1.00 . A A . 28 LEU O 1 1 3 1967 1 1 30 ARG C C -7.611 1.464 -0.659 1.00 . A A . 29 ARG C 1 1 3 1968 1 1 30 ARG CA C -6.728 1.000 0.500 1.00 . A A . 29 ARG CA 1 1 3 1969 1 1 30 ARG CB C -7.568 0.888 1.771 1.00 . A A . 29 ARG CB 1 1 3 1970 1 1 30 ARG CD C -7.650 0.134 4.163 1.00 . A A . 29 ARG CD 1 1 3 1971 1 1 30 ARG CG C -6.998 -0.068 2.805 1.00 . A A . 29 ARG CG 1 1 3 1972 1 1 30 ARG CZ C -9.952 0.993 4.335 1.00 . A A . 29 ARG CZ 1 1 3 1973 1 1 30 ARG H H -5.537 2.418 1.542 1.00 . A A . 29 ARG H 1 1 3 1974 1 1 30 ARG HA H -6.325 0.029 0.259 1.00 . A A . 29 ARG HA 1 1 3 1975 1 1 30 ARG HB2 H -7.645 1.867 2.222 1.00 . A A . 29 ARG HB2 1 1 3 1976 1 1 30 ARG HB3 H -8.559 0.548 1.506 1.00 . A A . 29 ARG HB3 1 1 3 1977 1 1 30 ARG HD2 H -7.251 -0.596 4.850 1.00 . A A . 29 ARG HD2 1 1 3 1978 1 1 30 ARG HD3 H -7.410 1.128 4.515 1.00 . A A . 29 ARG HD3 1 1 3 1979 1 1 30 ARG HE H -9.465 -0.915 3.950 1.00 . A A . 29 ARG HE 1 1 3 1980 1 1 30 ARG HG2 H -7.170 -1.083 2.481 1.00 . A A . 29 ARG HG2 1 1 3 1981 1 1 30 ARG HG3 H -5.935 0.108 2.897 1.00 . A A . 29 ARG HG3 1 1 3 1982 1 1 30 ARG HH11 H -8.513 2.408 4.498 1.00 . A A . 29 ARG HH11 1 1 3 1983 1 1 30 ARG HH12 H -10.140 2.988 4.669 1.00 . A A . 29 ARG HH12 1 1 3 1984 1 1 30 ARG HH21 H -11.610 -0.162 4.203 1.00 . A A . 29 ARG HH21 1 1 3 1985 1 1 30 ARG HH22 H -11.898 1.518 4.522 1.00 . A A . 29 ARG HH22 1 1 3 1986 1 1 30 ARG N N -5.604 1.910 0.703 1.00 . A A . 29 ARG N 1 1 3 1987 1 1 30 ARG NE N -9.102 -0.011 4.118 1.00 . A A . 29 ARG NE 1 1 3 1988 1 1 30 ARG NH1 N -9.495 2.228 4.517 1.00 . A A . 29 ARG NH1 1 1 3 1989 1 1 30 ARG NH2 N -11.257 0.766 4.351 1.00 . A A . 29 ARG NH2 1 1 3 1990 1 1 30 ARG O O -8.117 0.646 -1.430 1.00 . A A . 29 ARG O 1 1 3 1991 1 1 31 SER C C -8.240 3.194 -3.195 1.00 . A A . 30 SER C 1 1 3 1992 1 1 31 SER CA C -8.717 3.334 -1.748 1.00 . A A . 30 SER CA 1 1 3 1993 1 1 31 SER CB C -8.975 4.809 -1.422 1.00 . A A . 30 SER CB 1 1 3 1994 1 1 31 SER H H -7.237 3.385 -0.236 1.00 . A A . 30 SER H 1 1 3 1995 1 1 31 SER HA H -9.643 2.791 -1.637 1.00 . A A . 30 SER HA 1 1 3 1996 1 1 31 SER HB2 H -9.287 4.897 -0.392 1.00 . A A . 30 SER HB2 1 1 3 1997 1 1 31 SER HB3 H -8.065 5.372 -1.571 1.00 . A A . 30 SER HB3 1 1 3 1998 1 1 31 SER HG H -10.824 5.376 -1.756 1.00 . A A . 30 SER HG 1 1 3 1999 1 1 31 SER N N -7.766 2.777 -0.795 1.00 . A A . 30 SER N 1 1 3 2000 1 1 31 SER O O -8.998 2.734 -4.050 1.00 . A A . 30 SER O 1 1 3 2001 1 1 31 SER OG O -9.989 5.350 -2.250 1.00 . A A . 30 SER OG 1 1 3 2002 1 1 32 TRP C C -6.056 2.093 -5.263 1.00 . A A . 31 TRP C 1 1 3 2003 1 1 32 TRP CA C -6.496 3.496 -4.854 1.00 . A A . 31 TRP CA 1 1 3 2004 1 1 32 TRP CB C -5.373 4.518 -5.107 1.00 . A A . 31 TRP CB 1 1 3 2005 1 1 32 TRP CD1 C -3.663 3.397 -3.577 1.00 . A A . 31 TRP CD1 1 1 3 2006 1 1 32 TRP CD2 C -3.569 5.629 -3.566 1.00 . A A . 31 TRP CD2 1 1 3 2007 1 1 32 TRP CE2 C -2.585 5.133 -2.697 1.00 . A A . 31 TRP CE2 1 1 3 2008 1 1 32 TRP CE3 C -3.692 7.011 -3.718 1.00 . A A . 31 TRP CE3 1 1 3 2009 1 1 32 TRP CG C -4.255 4.495 -4.115 1.00 . A A . 31 TRP CG 1 1 3 2010 1 1 32 TRP CH2 C -1.869 7.308 -2.156 1.00 . A A . 31 TRP CH2 1 1 3 2011 1 1 32 TRP CZ2 C -1.730 5.964 -1.985 1.00 . A A . 31 TRP CZ2 1 1 3 2012 1 1 32 TRP CZ3 C -2.839 7.836 -3.010 1.00 . A A . 31 TRP CZ3 1 1 3 2013 1 1 32 TRP H H -6.379 3.815 -2.749 1.00 . A A . 31 TRP H 1 1 3 2014 1 1 32 TRP HA H -7.336 3.764 -5.479 1.00 . A A . 31 TRP HA 1 1 3 2015 1 1 32 TRP HB2 H -4.943 4.324 -6.081 1.00 . A A . 31 TRP HB2 1 1 3 2016 1 1 32 TRP HB3 H -5.800 5.511 -5.104 1.00 . A A . 31 TRP HB3 1 1 3 2017 1 1 32 TRP HD1 H -3.955 2.379 -3.797 1.00 . A A . 31 TRP HD1 1 1 3 2018 1 1 32 TRP HE1 H -2.097 3.160 -2.207 1.00 . A A . 31 TRP HE1 1 1 3 2019 1 1 32 TRP HE3 H -4.437 7.437 -4.371 1.00 . A A . 31 TRP HE3 1 1 3 2020 1 1 32 TRP HH2 H -1.224 7.991 -1.623 1.00 . A A . 31 TRP HH2 1 1 3 2021 1 1 32 TRP HZ2 H -0.972 5.573 -1.321 1.00 . A A . 31 TRP HZ2 1 1 3 2022 1 1 32 TRP HZ3 H -2.911 8.906 -3.119 1.00 . A A . 31 TRP HZ3 1 1 3 2023 1 1 32 TRP N N -6.980 3.531 -3.472 1.00 . A A . 31 TRP N 1 1 3 2024 1 1 32 TRP NE1 N -2.666 3.773 -2.720 1.00 . A A . 31 TRP NE1 1 1 3 2025 1 1 32 TRP O O -5.717 1.853 -6.420 1.00 . A A . 31 TRP O 1 1 3 2026 1 1 33 ASN C C -7.123 -0.990 -4.757 1.00 . A A . 32 ASN C 1 1 3 2027 1 1 33 ASN CA C -5.810 -0.234 -4.634 1.00 . A A . 32 ASN CA 1 1 3 2028 1 1 33 ASN CB C -4.916 -0.904 -3.586 1.00 . A A . 32 ASN CB 1 1 3 2029 1 1 33 ASN CG C -3.448 -0.603 -3.795 1.00 . A A . 32 ASN CG 1 1 3 2030 1 1 33 ASN H H -6.240 1.427 -3.387 1.00 . A A . 32 ASN H 1 1 3 2031 1 1 33 ASN HA H -5.309 -0.264 -5.590 1.00 . A A . 32 ASN HA 1 1 3 2032 1 1 33 ASN HB2 H -5.195 -0.555 -2.605 1.00 . A A . 32 ASN HB2 1 1 3 2033 1 1 33 ASN HB3 H -5.053 -1.975 -3.635 1.00 . A A . 32 ASN HB3 1 1 3 2034 1 1 33 ASN HD21 H -3.503 0.806 -2.394 1.00 . A A . 32 ASN HD21 1 1 3 2035 1 1 33 ASN HD22 H -1.968 0.569 -3.165 1.00 . A A . 32 ASN HD22 1 1 3 2036 1 1 33 ASN N N -6.063 1.166 -4.315 1.00 . A A . 32 ASN N 1 1 3 2037 1 1 33 ASN ND2 N -2.919 0.350 -3.044 1.00 . A A . 32 ASN ND2 1 1 3 2038 1 1 33 ASN O O -7.170 -2.090 -5.308 1.00 . A A . 32 ASN O 1 1 3 2039 1 1 33 ASN OD1 O -2.785 -1.247 -4.603 1.00 . A A . 32 ASN OD1 1 1 3 2040 1 1 34 GLY C C -9.571 -2.219 -3.389 1.00 . A A . 33 GLY C 1 1 3 2041 1 1 34 GLY CA C -9.496 -1.012 -4.298 1.00 . A A . 33 GLY CA 1 1 3 2042 1 1 34 GLY H H -8.096 0.509 -3.860 1.00 . A A . 33 GLY H 1 1 3 2043 1 1 34 GLY HA2 H -10.243 -0.295 -3.992 1.00 . A A . 33 GLY HA2 1 1 3 2044 1 1 34 GLY HA3 H -9.702 -1.325 -5.311 1.00 . A A . 33 GLY HA3 1 1 3 2045 1 1 34 GLY N N -8.193 -0.382 -4.257 1.00 . A A . 33 GLY N 1 1 3 2046 1 1 34 GLY O O -10.178 -3.234 -3.739 1.00 . A A . 33 GLY O 1 1 3 2047 1 1 35 ILE C C -10.044 -3.127 -0.288 1.00 . A A . 34 ILE C 1 1 3 2048 1 1 35 ILE CA C -8.907 -3.217 -1.287 1.00 . A A . 34 ILE CA 1 1 3 2049 1 1 35 ILE CB C -7.576 -3.265 -0.509 1.00 . A A . 34 ILE CB 1 1 3 2050 1 1 35 ILE CD1 C -5.056 -3.507 -0.764 1.00 . A A . 34 ILE CD1 1 1 3 2051 1 1 35 ILE CG1 C -6.398 -3.458 -1.465 1.00 . A A . 34 ILE CG1 1 1 3 2052 1 1 35 ILE CG2 C -7.614 -4.380 0.532 1.00 . A A . 34 ILE CG2 1 1 3 2053 1 1 35 ILE H H -8.536 -1.256 -1.978 1.00 . A A . 34 ILE H 1 1 3 2054 1 1 35 ILE HA H -9.005 -4.134 -1.849 1.00 . A A . 34 ILE HA 1 1 3 2055 1 1 35 ILE HB H -7.459 -2.325 0.011 1.00 . A A . 34 ILE HB 1 1 3 2056 1 1 35 ILE HD11 H -4.271 -3.641 -1.493 1.00 . A A . 34 ILE HD11 1 1 3 2057 1 1 35 ILE HD12 H -5.046 -4.333 -0.068 1.00 . A A . 34 ILE HD12 1 1 3 2058 1 1 35 ILE HD13 H -4.899 -2.583 -0.229 1.00 . A A . 34 ILE HD13 1 1 3 2059 1 1 35 ILE HG12 H -6.526 -4.384 -2.005 1.00 . A A . 34 ILE HG12 1 1 3 2060 1 1 35 ILE HG13 H -6.376 -2.637 -2.168 1.00 . A A . 34 ILE HG13 1 1 3 2061 1 1 35 ILE HG21 H -6.704 -4.364 1.112 1.00 . A A . 34 ILE HG21 1 1 3 2062 1 1 35 ILE HG22 H -7.707 -5.334 0.032 1.00 . A A . 34 ILE HG22 1 1 3 2063 1 1 35 ILE HG23 H -8.464 -4.234 1.184 1.00 . A A . 34 ILE HG23 1 1 3 2064 1 1 35 ILE N N -8.954 -2.110 -2.223 1.00 . A A . 34 ILE N 1 1 3 2065 1 1 35 ILE O O -10.253 -2.090 0.346 1.00 . A A . 34 ILE O 1 1 3 2066 1 1 36 SER C C -11.323 -5.271 1.939 1.00 . A A . 35 SER C 1 1 3 2067 1 1 36 SER CA C -11.798 -4.311 0.857 1.00 . A A . 35 SER CA 1 1 3 2068 1 1 36 SER CB C -13.108 -4.798 0.244 1.00 . A A . 35 SER CB 1 1 3 2069 1 1 36 SER H H -10.644 -4.964 -0.784 1.00 . A A . 35 SER H 1 1 3 2070 1 1 36 SER HA H -11.943 -3.334 1.289 1.00 . A A . 35 SER HA 1 1 3 2071 1 1 36 SER HB2 H -13.410 -4.116 -0.535 1.00 . A A . 35 SER HB2 1 1 3 2072 1 1 36 SER HB3 H -12.955 -5.779 -0.178 1.00 . A A . 35 SER HB3 1 1 3 2073 1 1 36 SER HG H -14.853 -5.434 0.869 1.00 . A A . 35 SER HG 1 1 3 2074 1 1 36 SER N N -10.785 -4.209 -0.165 1.00 . A A . 35 SER N 1 1 3 2075 1 1 36 SER O O -11.244 -6.479 1.722 1.00 . A A . 35 SER O 1 1 3 2076 1 1 36 SER OG O -14.143 -4.870 1.209 1.00 . A A . 35 SER OG 1 1 3 2077 1 1 37 GLY C C -9.060 -5.303 4.493 1.00 . A A . 36 GLY C 1 1 3 2078 1 1 37 GLY CA C -10.522 -5.543 4.188 1.00 . A A . 36 GLY CA 1 1 3 2079 1 1 37 GLY H H -11.055 -3.751 3.206 1.00 . A A . 36 GLY H 1 1 3 2080 1 1 37 GLY HA2 H -11.105 -5.319 5.069 1.00 . A A . 36 GLY HA2 1 1 3 2081 1 1 37 GLY HA3 H -10.658 -6.582 3.930 1.00 . A A . 36 GLY HA3 1 1 3 2082 1 1 37 GLY N N -10.995 -4.726 3.096 1.00 . A A . 36 GLY N 1 1 3 2083 1 1 37 GLY O O -8.543 -4.207 4.264 1.00 . A A . 36 GLY O 1 1 3 2084 1 1 38 ASP C C -6.153 -7.190 4.531 1.00 . A A . 37 ASP C 1 1 3 2085 1 1 38 ASP CA C -6.987 -6.222 5.375 1.00 . A A . 37 ASP CA 1 1 3 2086 1 1 38 ASP CB C -6.822 -6.514 6.875 1.00 . A A . 37 ASP CB 1 1 3 2087 1 1 38 ASP CG C -5.422 -6.232 7.395 1.00 . A A . 37 ASP CG 1 1 3 2088 1 1 38 ASP H H -8.867 -7.174 5.157 1.00 . A A . 37 ASP H 1 1 3 2089 1 1 38 ASP HA H -6.663 -5.211 5.175 1.00 . A A . 37 ASP HA 1 1 3 2090 1 1 38 ASP HB2 H -7.518 -5.903 7.430 1.00 . A A . 37 ASP HB2 1 1 3 2091 1 1 38 ASP HB3 H -7.048 -7.556 7.054 1.00 . A A . 37 ASP HB3 1 1 3 2092 1 1 38 ASP N N -8.396 -6.323 5.012 1.00 . A A . 37 ASP N 1 1 3 2093 1 1 38 ASP O O -5.038 -7.556 4.893 1.00 . A A . 37 ASP O 1 1 3 2094 1 1 38 ASP OD1 O -5.052 -5.044 7.510 1.00 . A A . 37 ASP OD1 1 1 3 2095 1 1 38 ASP OD2 O -4.695 -7.199 7.708 1.00 . A A . 37 ASP OD2 1 1 3 2096 1 1 39 LEU C C -4.824 -7.956 1.803 1.00 . A A . 38 LEU C 1 1 3 2097 1 1 39 LEU CA C -6.026 -8.564 2.529 1.00 . A A . 38 LEU CA 1 1 3 2098 1 1 39 LEU CB C -7.019 -9.211 1.546 1.00 . A A . 38 LEU CB 1 1 3 2099 1 1 39 LEU CD1 C -7.367 -8.052 -0.668 1.00 . A A . 38 LEU CD1 1 1 3 2100 1 1 39 LEU CD2 C -9.330 -8.804 0.675 1.00 . A A . 38 LEU CD2 1 1 3 2101 1 1 39 LEU CG C -7.913 -8.260 0.738 1.00 . A A . 38 LEU CG 1 1 3 2102 1 1 39 LEU H H -7.552 -7.210 3.101 1.00 . A A . 38 LEU H 1 1 3 2103 1 1 39 LEU HA H -5.653 -9.338 3.183 1.00 . A A . 38 LEU HA 1 1 3 2104 1 1 39 LEU HB2 H -6.454 -9.809 0.848 1.00 . A A . 38 LEU HB2 1 1 3 2105 1 1 39 LEU HB3 H -7.663 -9.872 2.111 1.00 . A A . 38 LEU HB3 1 1 3 2106 1 1 39 LEU HD11 H -7.332 -8.999 -1.185 1.00 . A A . 38 LEU HD11 1 1 3 2107 1 1 39 LEU HD12 H -6.372 -7.637 -0.610 1.00 . A A . 38 LEU HD12 1 1 3 2108 1 1 39 LEU HD13 H -8.009 -7.371 -1.207 1.00 . A A . 38 LEU HD13 1 1 3 2109 1 1 39 LEU HD21 H -9.947 -8.133 0.096 1.00 . A A . 38 LEU HD21 1 1 3 2110 1 1 39 LEU HD22 H -9.728 -8.888 1.675 1.00 . A A . 38 LEU HD22 1 1 3 2111 1 1 39 LEU HD23 H -9.320 -9.778 0.207 1.00 . A A . 38 LEU HD23 1 1 3 2112 1 1 39 LEU HG H -7.945 -7.298 1.230 1.00 . A A . 38 LEU HG 1 1 3 2113 1 1 39 LEU N N -6.695 -7.588 3.383 1.00 . A A . 38 LEU N 1 1 3 2114 1 1 39 LEU O O -4.961 -7.210 0.836 1.00 . A A . 38 LEU O 1 1 3 2115 1 1 40 ILE C C -1.374 -8.966 1.795 1.00 . A A . 39 ILE C 1 1 3 2116 1 1 40 ILE CA C -2.395 -7.829 1.708 1.00 . A A . 39 ILE CA 1 1 3 2117 1 1 40 ILE CB C -1.870 -6.517 2.361 1.00 . A A . 39 ILE CB 1 1 3 2118 1 1 40 ILE CD1 C -1.785 -3.988 2.011 1.00 . A A . 39 ILE CD1 1 1 3 2119 1 1 40 ILE CG1 C -2.401 -5.304 1.587 1.00 . A A . 39 ILE CG1 1 1 3 2120 1 1 40 ILE CG2 C -0.350 -6.469 2.455 1.00 . A A . 39 ILE CG2 1 1 3 2121 1 1 40 ILE H H -3.608 -8.775 3.150 1.00 . A A . 39 ILE H 1 1 3 2122 1 1 40 ILE HA H -2.597 -7.631 0.663 1.00 . A A . 39 ILE HA 1 1 3 2123 1 1 40 ILE HB H -2.257 -6.477 3.367 1.00 . A A . 39 ILE HB 1 1 3 2124 1 1 40 ILE HD11 H -0.724 -4.010 1.815 1.00 . A A . 39 ILE HD11 1 1 3 2125 1 1 40 ILE HD12 H -1.953 -3.837 3.068 1.00 . A A . 39 ILE HD12 1 1 3 2126 1 1 40 ILE HD13 H -2.237 -3.175 1.455 1.00 . A A . 39 ILE HD13 1 1 3 2127 1 1 40 ILE HG12 H -2.196 -5.438 0.536 1.00 . A A . 39 ILE HG12 1 1 3 2128 1 1 40 ILE HG13 H -3.470 -5.233 1.733 1.00 . A A . 39 ILE HG13 1 1 3 2129 1 1 40 ILE HG21 H 0.005 -7.328 3.014 1.00 . A A . 39 ILE HG21 1 1 3 2130 1 1 40 ILE HG22 H -0.049 -5.559 2.967 1.00 . A A . 39 ILE HG22 1 1 3 2131 1 1 40 ILE HG23 H 0.076 -6.481 1.463 1.00 . A A . 39 ILE HG23 1 1 3 2132 1 1 40 ILE N N -3.644 -8.253 2.319 1.00 . A A . 39 ILE N 1 1 3 2133 1 1 40 ILE O O -1.095 -9.484 2.878 1.00 . A A . 39 ILE O 1 1 3 2134 1 1 41 PHE C C 1.336 -10.207 -0.127 1.00 . A A . 40 PHE C 1 1 3 2135 1 1 41 PHE CA C 0.027 -10.540 0.582 1.00 . A A . 40 PHE CA 1 1 3 2136 1 1 41 PHE CB C -0.683 -11.709 -0.115 1.00 . A A . 40 PHE CB 1 1 3 2137 1 1 41 PHE CD1 C -0.486 -11.485 -2.614 1.00 . A A . 40 PHE CD1 1 1 3 2138 1 1 41 PHE CD2 C -2.572 -10.952 -1.590 1.00 . A A . 40 PHE CD2 1 1 3 2139 1 1 41 PHE CE1 C -1.014 -11.186 -3.855 1.00 . A A . 40 PHE CE1 1 1 3 2140 1 1 41 PHE CE2 C -3.107 -10.652 -2.828 1.00 . A A . 40 PHE CE2 1 1 3 2141 1 1 41 PHE CG C -1.257 -11.373 -1.467 1.00 . A A . 40 PHE CG 1 1 3 2142 1 1 41 PHE CZ C -2.327 -10.769 -3.962 1.00 . A A . 40 PHE CZ 1 1 3 2143 1 1 41 PHE H H -1.056 -8.889 -0.177 1.00 . A A . 40 PHE H 1 1 3 2144 1 1 41 PHE HA H 0.253 -10.829 1.599 1.00 . A A . 40 PHE HA 1 1 3 2145 1 1 41 PHE HB2 H 0.022 -12.516 -0.248 1.00 . A A . 40 PHE HB2 1 1 3 2146 1 1 41 PHE HB3 H -1.493 -12.052 0.512 1.00 . A A . 40 PHE HB3 1 1 3 2147 1 1 41 PHE HD1 H 0.541 -11.810 -2.532 1.00 . A A . 40 PHE HD1 1 1 3 2148 1 1 41 PHE HD2 H -3.183 -10.858 -0.703 1.00 . A A . 40 PHE HD2 1 1 3 2149 1 1 41 PHE HE1 H -0.403 -11.279 -4.741 1.00 . A A . 40 PHE HE1 1 1 3 2150 1 1 41 PHE HE2 H -4.133 -10.325 -2.909 1.00 . A A . 40 PHE HE2 1 1 3 2151 1 1 41 PHE HZ H -2.744 -10.536 -4.932 1.00 . A A . 40 PHE HZ 1 1 3 2152 1 1 41 PHE N N -0.853 -9.379 0.646 1.00 . A A . 40 PHE N 1 1 3 2153 1 1 41 PHE O O 1.373 -9.339 -1.000 1.00 . A A . 40 PHE O 1 1 3 2154 1 1 42 VAL C C 3.809 -10.828 -1.777 1.00 . A A . 41 VAL C 1 1 3 2155 1 1 42 VAL CA C 3.745 -10.671 -0.259 1.00 . A A . 41 VAL CA 1 1 3 2156 1 1 42 VAL CB C 4.772 -11.629 0.395 1.00 . A A . 41 VAL CB 1 1 3 2157 1 1 42 VAL CG1 C 6.186 -11.344 -0.097 1.00 . A A . 41 VAL CG1 1 1 3 2158 1 1 42 VAL CG2 C 4.710 -11.528 1.910 1.00 . A A . 41 VAL CG2 1 1 3 2159 1 1 42 VAL H H 2.265 -11.655 0.891 1.00 . A A . 41 VAL H 1 1 3 2160 1 1 42 VAL HA H 4.015 -9.657 -0.001 1.00 . A A . 41 VAL HA 1 1 3 2161 1 1 42 VAL HB H 4.518 -12.640 0.114 1.00 . A A . 41 VAL HB 1 1 3 2162 1 1 42 VAL HG11 H 6.218 -11.447 -1.171 1.00 . A A . 41 VAL HG11 1 1 3 2163 1 1 42 VAL HG12 H 6.873 -12.044 0.354 1.00 . A A . 41 VAL HG12 1 1 3 2164 1 1 42 VAL HG13 H 6.468 -10.337 0.177 1.00 . A A . 41 VAL HG13 1 1 3 2165 1 1 42 VAL HG21 H 5.449 -12.184 2.345 1.00 . A A . 41 VAL HG21 1 1 3 2166 1 1 42 VAL HG22 H 3.728 -11.819 2.250 1.00 . A A . 41 VAL HG22 1 1 3 2167 1 1 42 VAL HG23 H 4.909 -10.510 2.211 1.00 . A A . 41 VAL HG23 1 1 3 2168 1 1 42 VAL N N 2.396 -10.921 0.251 1.00 . A A . 41 VAL N 1 1 3 2169 1 1 42 VAL O O 3.182 -11.726 -2.344 1.00 . A A . 41 VAL O 1 1 3 2170 1 1 43 GLY C C 3.781 -9.090 -4.611 1.00 . A A . 42 GLY C 1 1 3 2171 1 1 43 GLY CA C 4.719 -10.016 -3.867 1.00 . A A . 42 GLY CA 1 1 3 2172 1 1 43 GLY H H 4.999 -9.219 -1.921 1.00 . A A . 42 GLY H 1 1 3 2173 1 1 43 GLY HA2 H 5.738 -9.752 -4.114 1.00 . A A . 42 GLY HA2 1 1 3 2174 1 1 43 GLY HA3 H 4.536 -11.031 -4.185 1.00 . A A . 42 GLY HA3 1 1 3 2175 1 1 43 GLY N N 4.550 -9.936 -2.428 1.00 . A A . 42 GLY N 1 1 3 2176 1 1 43 GLY O O 4.035 -8.724 -5.758 1.00 . A A . 42 GLY O 1 1 3 2177 1 1 44 GLN C C 2.266 -6.389 -4.595 1.00 . A A . 43 GLN C 1 1 3 2178 1 1 44 GLN CA C 1.721 -7.808 -4.534 1.00 . A A . 43 GLN CA 1 1 3 2179 1 1 44 GLN CB C 0.429 -7.833 -3.709 1.00 . A A . 43 GLN CB 1 1 3 2180 1 1 44 GLN CD C -1.775 -6.732 -3.153 1.00 . A A . 43 GLN CD 1 1 3 2181 1 1 44 GLN CG C -0.543 -6.706 -4.034 1.00 . A A . 43 GLN CG 1 1 3 2182 1 1 44 GLN H H 2.556 -9.046 -3.040 1.00 . A A . 43 GLN H 1 1 3 2183 1 1 44 GLN HA H 1.508 -8.148 -5.537 1.00 . A A . 43 GLN HA 1 1 3 2184 1 1 44 GLN HB2 H -0.077 -8.773 -3.885 1.00 . A A . 43 GLN HB2 1 1 3 2185 1 1 44 GLN HB3 H 0.685 -7.767 -2.662 1.00 . A A . 43 GLN HB3 1 1 3 2186 1 1 44 GLN HE21 H -0.874 -5.566 -1.822 1.00 . A A . 43 GLN HE21 1 1 3 2187 1 1 44 GLN HE22 H -2.490 -6.042 -1.435 1.00 . A A . 43 GLN HE22 1 1 3 2188 1 1 44 GLN HG2 H -0.039 -5.762 -3.885 1.00 . A A . 43 GLN HG2 1 1 3 2189 1 1 44 GLN HG3 H -0.850 -6.796 -5.066 1.00 . A A . 43 GLN HG3 1 1 3 2190 1 1 44 GLN N N 2.699 -8.710 -3.950 1.00 . A A . 43 GLN N 1 1 3 2191 1 1 44 GLN NE2 N -1.706 -6.045 -2.023 1.00 . A A . 43 GLN NE2 1 1 3 2192 1 1 44 GLN O O 2.736 -5.856 -3.593 1.00 . A A . 43 GLN O 1 1 3 2193 1 1 44 GLN OE1 O -2.778 -7.362 -3.481 1.00 . A A . 43 GLN OE1 1 1 3 2194 1 1 45 LYS C C 1.299 -3.555 -5.612 1.00 . A A . 44 LYS C 1 1 3 2195 1 1 45 LYS CA C 2.537 -4.375 -5.897 1.00 . A A . 44 LYS CA 1 1 3 2196 1 1 45 LYS CB C 3.063 -4.037 -7.292 1.00 . A A . 44 LYS CB 1 1 3 2197 1 1 45 LYS CD C 4.911 -4.229 -8.972 1.00 . A A . 44 LYS CD 1 1 3 2198 1 1 45 LYS CE C 6.213 -4.926 -9.320 1.00 . A A . 44 LYS CE 1 1 3 2199 1 1 45 LYS CG C 4.453 -4.573 -7.568 1.00 . A A . 44 LYS CG 1 1 3 2200 1 1 45 LYS H H 1.954 -6.296 -6.570 1.00 . A A . 44 LYS H 1 1 3 2201 1 1 45 LYS HA H 3.293 -4.136 -5.163 1.00 . A A . 44 LYS HA 1 1 3 2202 1 1 45 LYS HB2 H 2.389 -4.452 -8.027 1.00 . A A . 44 LYS HB2 1 1 3 2203 1 1 45 LYS HB3 H 3.086 -2.963 -7.404 1.00 . A A . 44 LYS HB3 1 1 3 2204 1 1 45 LYS HD2 H 4.151 -4.537 -9.674 1.00 . A A . 44 LYS HD2 1 1 3 2205 1 1 45 LYS HD3 H 5.055 -3.160 -9.041 1.00 . A A . 44 LYS HD3 1 1 3 2206 1 1 45 LYS HE2 H 6.963 -4.641 -8.596 1.00 . A A . 44 LYS HE2 1 1 3 2207 1 1 45 LYS HE3 H 6.057 -5.994 -9.276 1.00 . A A . 44 LYS HE3 1 1 3 2208 1 1 45 LYS HG2 H 5.140 -4.130 -6.860 1.00 . A A . 44 LYS HG2 1 1 3 2209 1 1 45 LYS HG3 H 4.448 -5.647 -7.449 1.00 . A A . 44 LYS HG3 1 1 3 2210 1 1 45 LYS HZ1 H 5.878 -4.454 -11.328 1.00 . A A . 44 LYS HZ1 1 1 3 2211 1 1 45 LYS HZ2 H 7.317 -5.307 -11.049 1.00 . A A . 44 LYS HZ2 1 1 3 2212 1 1 45 LYS HZ3 H 7.220 -3.665 -10.644 1.00 . A A . 44 LYS HZ3 1 1 3 2213 1 1 45 LYS N N 2.217 -5.784 -5.771 1.00 . A A . 44 LYS N 1 1 3 2214 1 1 45 LYS NZ N 6.690 -4.560 -10.679 1.00 . A A . 44 LYS NZ 1 1 3 2215 1 1 45 LYS O O 0.374 -3.511 -6.423 1.00 . A A . 44 LYS O 1 1 3 2216 1 1 46 LEU C C 0.503 -0.637 -4.310 1.00 . A A . 45 LEU C 1 1 3 2217 1 1 46 LEU CA C 0.150 -2.098 -4.092 1.00 . A A . 45 LEU CA 1 1 3 2218 1 1 46 LEU CB C -0.285 -2.385 -2.641 1.00 . A A . 45 LEU CB 1 1 3 2219 1 1 46 LEU CD1 C 0.728 -0.603 -1.161 1.00 . A A . 45 LEU CD1 1 1 3 2220 1 1 46 LEU CD2 C 0.414 -2.925 -0.323 1.00 . A A . 45 LEU CD2 1 1 3 2221 1 1 46 LEU CG C 0.729 -2.081 -1.535 1.00 . A A . 45 LEU CG 1 1 3 2222 1 1 46 LEU H H 2.039 -3.012 -3.842 1.00 . A A . 45 LEU H 1 1 3 2223 1 1 46 LEU HA H -0.663 -2.354 -4.755 1.00 . A A . 45 LEU HA 1 1 3 2224 1 1 46 LEU HB2 H -1.176 -1.814 -2.439 1.00 . A A . 45 LEU HB2 1 1 3 2225 1 1 46 LEU HB3 H -0.533 -3.438 -2.571 1.00 . A A . 45 LEU HB3 1 1 3 2226 1 1 46 LEU HD11 H 1.441 -0.430 -0.368 1.00 . A A . 45 LEU HD11 1 1 3 2227 1 1 46 LEU HD12 H -0.260 -0.317 -0.825 1.00 . A A . 45 LEU HD12 1 1 3 2228 1 1 46 LEU HD13 H 0.997 -0.013 -2.024 1.00 . A A . 45 LEU HD13 1 1 3 2229 1 1 46 LEU HD21 H 1.147 -2.741 0.448 1.00 . A A . 45 LEU HD21 1 1 3 2230 1 1 46 LEU HD22 H 0.432 -3.970 -0.599 1.00 . A A . 45 LEU HD22 1 1 3 2231 1 1 46 LEU HD23 H -0.570 -2.669 0.047 1.00 . A A . 45 LEU HD23 1 1 3 2232 1 1 46 LEU HG H 1.720 -2.348 -1.875 1.00 . A A . 45 LEU HG 1 1 3 2233 1 1 46 LEU N N 1.275 -2.925 -4.459 1.00 . A A . 45 LEU N 1 1 3 2234 1 1 46 LEU O O 1.635 -0.222 -4.064 1.00 . A A . 45 LEU O 1 1 3 2235 1 1 47 ILE C C 0.072 2.301 -3.802 1.00 . A A . 46 ILE C 1 1 3 2236 1 1 47 ILE CA C -0.223 1.539 -5.086 1.00 . A A . 46 ILE CA 1 1 3 2237 1 1 47 ILE CB C -1.427 2.202 -5.795 1.00 . A A . 46 ILE CB 1 1 3 2238 1 1 47 ILE CD1 C -0.627 1.432 -8.094 1.00 . A A . 46 ILE CD1 1 1 3 2239 1 1 47 ILE CG1 C -1.766 1.469 -7.096 1.00 . A A . 46 ILE CG1 1 1 3 2240 1 1 47 ILE CG2 C -1.146 3.676 -6.077 1.00 . A A . 46 ILE CG2 1 1 3 2241 1 1 47 ILE H H -1.334 -0.261 -4.998 1.00 . A A . 46 ILE H 1 1 3 2242 1 1 47 ILE HA H 0.635 1.613 -5.738 1.00 . A A . 46 ILE HA 1 1 3 2243 1 1 47 ILE HB H -2.276 2.147 -5.131 1.00 . A A . 46 ILE HB 1 1 3 2244 1 1 47 ILE HD11 H -0.940 0.894 -8.978 1.00 . A A . 46 ILE HD11 1 1 3 2245 1 1 47 ILE HD12 H 0.224 0.934 -7.651 1.00 . A A . 46 ILE HD12 1 1 3 2246 1 1 47 ILE HD13 H -0.354 2.440 -8.364 1.00 . A A . 46 ILE HD13 1 1 3 2247 1 1 47 ILE HG12 H -2.037 0.451 -6.868 1.00 . A A . 46 ILE HG12 1 1 3 2248 1 1 47 ILE HG13 H -2.605 1.964 -7.568 1.00 . A A . 46 ILE HG13 1 1 3 2249 1 1 47 ILE HG21 H -0.923 4.186 -5.149 1.00 . A A . 46 ILE HG21 1 1 3 2250 1 1 47 ILE HG22 H -2.015 4.125 -6.535 1.00 . A A . 46 ILE HG22 1 1 3 2251 1 1 47 ILE HG23 H -0.302 3.761 -6.745 1.00 . A A . 46 ILE HG23 1 1 3 2252 1 1 47 ILE N N -0.451 0.131 -4.810 1.00 . A A . 46 ILE N 1 1 3 2253 1 1 47 ILE O O -0.582 2.105 -2.772 1.00 . A A . 46 ILE O 1 1 3 2254 1 1 48 VAL C C 2.022 5.318 -3.459 1.00 . A A . 47 VAL C 1 1 3 2255 1 1 48 VAL CA C 1.396 4.076 -2.825 1.00 . A A . 47 VAL CA 1 1 3 2256 1 1 48 VAL CB C 2.333 3.465 -1.752 1.00 . A A . 47 VAL CB 1 1 3 2257 1 1 48 VAL CG1 C 3.625 2.943 -2.364 1.00 . A A . 47 VAL CG1 1 1 3 2258 1 1 48 VAL CG2 C 2.621 4.481 -0.658 1.00 . A A . 47 VAL CG2 1 1 3 2259 1 1 48 VAL H H 1.637 3.140 -4.684 1.00 . A A . 47 VAL H 1 1 3 2260 1 1 48 VAL HA H 0.468 4.360 -2.341 1.00 . A A . 47 VAL HA 1 1 3 2261 1 1 48 VAL HB H 1.821 2.628 -1.298 1.00 . A A . 47 VAL HB 1 1 3 2262 1 1 48 VAL HG11 H 3.393 2.192 -3.104 1.00 . A A . 47 VAL HG11 1 1 3 2263 1 1 48 VAL HG12 H 4.241 2.509 -1.591 1.00 . A A . 47 VAL HG12 1 1 3 2264 1 1 48 VAL HG13 H 4.157 3.759 -2.832 1.00 . A A . 47 VAL HG13 1 1 3 2265 1 1 48 VAL HG21 H 1.707 4.699 -0.121 1.00 . A A . 47 VAL HG21 1 1 3 2266 1 1 48 VAL HG22 H 3.005 5.388 -1.101 1.00 . A A . 47 VAL HG22 1 1 3 2267 1 1 48 VAL HG23 H 3.351 4.077 0.026 1.00 . A A . 47 VAL HG23 1 1 3 2268 1 1 48 VAL N N 1.078 3.142 -3.875 1.00 . A A . 47 VAL N 1 1 3 2269 1 1 48 VAL O O 2.996 5.241 -4.206 1.00 . A A . 47 VAL O 1 1 3 2270 1 1 49 LYS C C 1.612 8.871 -2.867 1.00 . A A . 48 LYS C 1 1 3 2271 1 1 49 LYS CA C 1.925 7.696 -3.780 1.00 . A A . 48 LYS CA 1 1 3 2272 1 1 49 LYS CB C 1.373 7.949 -5.185 1.00 . A A . 48 LYS CB 1 1 3 2273 1 1 49 LYS CD C -0.659 8.357 -6.614 1.00 . A A . 48 LYS CD 1 1 3 2274 1 1 49 LYS CE C -2.175 8.316 -6.672 1.00 . A A . 48 LYS CE 1 1 3 2275 1 1 49 LYS CG C -0.145 7.888 -5.265 1.00 . A A . 48 LYS CG 1 1 3 2276 1 1 49 LYS H H 0.567 6.449 -2.747 1.00 . A A . 48 LYS H 1 1 3 2277 1 1 49 LYS HA H 2.993 7.596 -3.847 1.00 . A A . 48 LYS HA 1 1 3 2278 1 1 49 LYS HB2 H 1.689 8.928 -5.511 1.00 . A A . 48 LYS HB2 1 1 3 2279 1 1 49 LYS HB3 H 1.781 7.203 -5.855 1.00 . A A . 48 LYS HB3 1 1 3 2280 1 1 49 LYS HD2 H -0.328 9.370 -6.782 1.00 . A A . 48 LYS HD2 1 1 3 2281 1 1 49 LYS HD3 H -0.261 7.712 -7.382 1.00 . A A . 48 LYS HD3 1 1 3 2282 1 1 49 LYS HE2 H -2.498 7.288 -6.613 1.00 . A A . 48 LYS HE2 1 1 3 2283 1 1 49 LYS HE3 H -2.569 8.864 -5.827 1.00 . A A . 48 LYS HE3 1 1 3 2284 1 1 49 LYS HG2 H -0.461 6.868 -5.108 1.00 . A A . 48 LYS HG2 1 1 3 2285 1 1 49 LYS HG3 H -0.561 8.519 -4.491 1.00 . A A . 48 LYS HG3 1 1 3 2286 1 1 49 LYS HZ1 H -2.240 8.486 -8.755 1.00 . A A . 48 LYS HZ1 1 1 3 2287 1 1 49 LYS HZ2 H -2.530 9.943 -7.934 1.00 . A A . 48 LYS HZ2 1 1 3 2288 1 1 49 LYS HZ3 H -3.731 8.750 -7.992 1.00 . A A . 48 LYS HZ3 1 1 3 2289 1 1 49 LYS N N 1.402 6.450 -3.247 1.00 . A A . 48 LYS N 1 1 3 2290 1 1 49 LYS NZ N -2.703 8.916 -7.923 1.00 . A A . 48 LYS NZ 1 1 3 2291 1 1 49 LYS O O 0.486 9.034 -2.407 1.00 . A A . 48 LYS O 1 1 3 2292 1 1 50 LYS C C 3.004 12.067 -2.566 1.00 . A A . 49 LYS C 1 1 3 2293 1 1 50 LYS CA C 2.456 10.870 -1.796 1.00 . A A . 49 LYS CA 1 1 3 2294 1 1 50 LYS CB C 3.166 10.701 -0.445 1.00 . A A . 49 LYS CB 1 1 3 2295 1 1 50 LYS CD C 3.454 13.036 0.485 1.00 . A A . 49 LYS CD 1 1 3 2296 1 1 50 LYS CE C 4.936 12.904 0.784 1.00 . A A . 49 LYS CE 1 1 3 2297 1 1 50 LYS CG C 2.738 11.700 0.621 1.00 . A A . 49 LYS CG 1 1 3 2298 1 1 50 LYS H H 3.513 9.459 -2.952 1.00 . A A . 49 LYS H 1 1 3 2299 1 1 50 LYS HA H 1.398 11.014 -1.629 1.00 . A A . 49 LYS HA 1 1 3 2300 1 1 50 LYS HB2 H 2.966 9.708 -0.071 1.00 . A A . 49 LYS HB2 1 1 3 2301 1 1 50 LYS HB3 H 4.229 10.807 -0.599 1.00 . A A . 49 LYS HB3 1 1 3 2302 1 1 50 LYS HD2 H 3.334 13.397 -0.524 1.00 . A A . 49 LYS HD2 1 1 3 2303 1 1 50 LYS HD3 H 3.016 13.740 1.177 1.00 . A A . 49 LYS HD3 1 1 3 2304 1 1 50 LYS HE2 H 5.054 12.487 1.772 1.00 . A A . 49 LYS HE2 1 1 3 2305 1 1 50 LYS HE3 H 5.376 12.235 0.060 1.00 . A A . 49 LYS HE3 1 1 3 2306 1 1 50 LYS HG2 H 1.675 11.868 0.536 1.00 . A A . 49 LYS HG2 1 1 3 2307 1 1 50 LYS HG3 H 2.958 11.284 1.594 1.00 . A A . 49 LYS HG3 1 1 3 2308 1 1 50 LYS HZ1 H 6.645 14.087 0.957 1.00 . A A . 49 LYS HZ1 1 1 3 2309 1 1 50 LYS HZ2 H 5.218 14.878 1.410 1.00 . A A . 49 LYS HZ2 1 1 3 2310 1 1 50 LYS HZ3 H 5.561 14.619 -0.234 1.00 . A A . 49 LYS HZ3 1 1 3 2311 1 1 50 LYS N N 2.624 9.674 -2.598 1.00 . A A . 49 LYS N 1 1 3 2312 1 1 50 LYS NZ N 5.637 14.211 0.725 1.00 . A A . 49 LYS NZ 1 1 3 2313 1 1 50 LYS O O 4.208 12.155 -2.814 1.00 . A A . 49 LYS O 1 1 3 2314 1 1 51 GLY C C 2.512 15.402 -3.011 1.00 . A A . 50 GLY C 1 1 3 2315 1 1 51 GLY CA C 2.529 14.097 -3.775 1.00 . A A . 50 GLY CA 1 1 3 2316 1 1 51 GLY H H 1.179 12.878 -2.688 1.00 . A A . 50 GLY H 1 1 3 2317 1 1 51 GLY HA2 H 3.529 13.919 -4.142 1.00 . A A . 50 GLY HA2 1 1 3 2318 1 1 51 GLY HA3 H 1.858 14.179 -4.616 1.00 . A A . 50 GLY HA3 1 1 3 2319 1 1 51 GLY N N 2.120 12.970 -2.962 1.00 . A A . 50 GLY N 1 1 3 2320 1 1 51 GLY O O 3.028 16.415 -3.487 1.00 . A A . 50 GLY O 1 1 3 2321 1 1 52 SER C C 3.047 16.685 -0.093 1.00 . A A . 51 SER C 1 1 3 2322 1 1 52 SER CA C 1.830 16.577 -1.009 1.00 . A A . 51 SER CA 1 1 3 2323 1 1 52 SER CB C 0.541 16.541 -0.190 1.00 . A A . 51 SER CB 1 1 3 2324 1 1 52 SER H H 1.528 14.547 -1.500 1.00 . A A . 51 SER H 1 1 3 2325 1 1 52 SER HA H 1.808 17.433 -1.666 1.00 . A A . 51 SER HA 1 1 3 2326 1 1 52 SER HB2 H 0.610 15.765 0.558 1.00 . A A . 51 SER HB2 1 1 3 2327 1 1 52 SER HB3 H 0.395 17.496 0.293 1.00 . A A . 51 SER HB3 1 1 3 2328 1 1 52 SER HG H -0.576 15.337 -1.268 1.00 . A A . 51 SER HG 1 1 3 2329 1 1 52 SER N N 1.919 15.384 -1.829 1.00 . A A . 51 SER N 1 1 3 2330 1 1 52 SER O O 4.051 17.300 -0.509 1.00 . A A . 51 SER O 1 1 3 2331 1 1 52 SER OG O -0.578 16.273 -1.025 1.00 . A A . 51 SER OG 1 1 4 2332 1 1 2 GLY C C 3.088 10.568 -11.221 1.00 . A A . 1 GLY C 1 1 4 2333 1 1 2 GLY CA C 2.916 11.188 -12.586 1.00 . A A . 1 GLY CA 1 1 4 2334 1 1 2 GLY H H 3.224 13.022 -13.534 1.00 . A A . 1 GLY H 1 1 4 2335 1 1 2 GLY HA2 H 1.867 11.188 -12.844 1.00 . A A . 1 GLY HA2 1 1 4 2336 1 1 2 GLY HA3 H 3.459 10.600 -13.315 1.00 . A A . 1 GLY HA3 1 1 4 2337 1 1 2 GLY N N 3.425 12.580 -12.611 1.00 . A A . 1 GLY N 1 1 4 2338 1 1 2 GLY O O 3.955 9.717 -11.018 1.00 . A A . 1 GLY O 1 1 4 2339 1 1 3 THR C C 1.703 9.213 -8.696 1.00 . A A . 2 THR C 1 1 4 2340 1 1 3 THR CA C 2.382 10.558 -8.906 1.00 . A A . 2 THR CA 1 1 4 2341 1 1 3 THR CB C 1.786 11.602 -7.945 1.00 . A A . 2 THR CB 1 1 4 2342 1 1 3 THR CG2 C 2.876 12.285 -7.137 1.00 . A A . 2 THR CG2 1 1 4 2343 1 1 3 THR H H 1.543 11.625 -10.521 1.00 . A A . 2 THR H 1 1 4 2344 1 1 3 THR HA H 3.434 10.455 -8.681 1.00 . A A . 2 THR HA 1 1 4 2345 1 1 3 THR HB H 1.112 11.102 -7.265 1.00 . A A . 2 THR HB 1 1 4 2346 1 1 3 THR HG1 H 0.202 12.747 -8.260 1.00 . A A . 2 THR HG1 1 1 4 2347 1 1 3 THR HG21 H 2.430 13.017 -6.480 1.00 . A A . 2 THR HG21 1 1 4 2348 1 1 3 THR HG22 H 3.567 12.774 -7.806 1.00 . A A . 2 THR HG22 1 1 4 2349 1 1 3 THR HG23 H 3.403 11.548 -6.550 1.00 . A A . 2 THR HG23 1 1 4 2350 1 1 3 THR N N 2.265 10.998 -10.281 1.00 . A A . 2 THR N 1 1 4 2351 1 1 3 THR O O 0.539 9.147 -8.311 1.00 . A A . 2 THR O 1 1 4 2352 1 1 3 THR OG1 O 1.055 12.585 -8.691 1.00 . A A . 2 THR OG1 1 1 4 2353 1 1 4 ASN C C 3.152 5.901 -8.420 1.00 . A A . 3 ASN C 1 1 4 2354 1 1 4 ASN CA C 1.968 6.793 -8.739 1.00 . A A . 3 ASN CA 1 1 4 2355 1 1 4 ASN CB C 1.213 6.192 -9.936 1.00 . A A . 3 ASN CB 1 1 4 2356 1 1 4 ASN CG C -0.194 6.732 -10.111 1.00 . A A . 3 ASN CG 1 1 4 2357 1 1 4 ASN H H 3.304 8.279 -9.425 1.00 . A A . 3 ASN H 1 1 4 2358 1 1 4 ASN HA H 1.312 6.823 -7.883 1.00 . A A . 3 ASN HA 1 1 4 2359 1 1 4 ASN HB2 H 1.767 6.396 -10.839 1.00 . A A . 3 ASN HB2 1 1 4 2360 1 1 4 ASN HB3 H 1.147 5.120 -9.797 1.00 . A A . 3 ASN HB3 1 1 4 2361 1 1 4 ASN HD21 H -0.918 5.288 -8.957 1.00 . A A . 3 ASN HD21 1 1 4 2362 1 1 4 ASN HD22 H -2.087 6.400 -9.588 1.00 . A A . 3 ASN HD22 1 1 4 2363 1 1 4 ASN N N 2.427 8.149 -9.002 1.00 . A A . 3 ASN N 1 1 4 2364 1 1 4 ASN ND2 N -1.160 6.074 -9.488 1.00 . A A . 3 ASN ND2 1 1 4 2365 1 1 4 ASN O O 3.917 5.539 -9.311 1.00 . A A . 3 ASN O 1 1 4 2366 1 1 4 ASN OD1 O -0.416 7.714 -10.819 1.00 . A A . 3 ASN OD1 1 1 4 2367 1 1 5 THR C C 3.614 3.324 -6.381 1.00 . A A . 4 THR C 1 1 4 2368 1 1 5 THR CA C 4.324 4.614 -6.766 1.00 . A A . 4 THR CA 1 1 4 2369 1 1 5 THR CB C 5.150 5.162 -5.579 1.00 . A A . 4 THR CB 1 1 4 2370 1 1 5 THR CG2 C 6.201 4.169 -5.103 1.00 . A A . 4 THR CG2 1 1 4 2371 1 1 5 THR H H 2.742 5.959 -6.457 1.00 . A A . 4 THR H 1 1 4 2372 1 1 5 THR HA H 4.979 4.434 -7.606 1.00 . A A . 4 THR HA 1 1 4 2373 1 1 5 THR HB H 4.466 5.365 -4.762 1.00 . A A . 4 THR HB 1 1 4 2374 1 1 5 THR HG1 H 5.155 6.954 -6.427 1.00 . A A . 4 THR HG1 1 1 4 2375 1 1 5 THR HG21 H 5.716 3.263 -4.769 1.00 . A A . 4 THR HG21 1 1 4 2376 1 1 5 THR HG22 H 6.758 4.600 -4.285 1.00 . A A . 4 THR HG22 1 1 4 2377 1 1 5 THR HG23 H 6.876 3.940 -5.916 1.00 . A A . 4 THR HG23 1 1 4 2378 1 1 5 THR N N 3.320 5.568 -7.156 1.00 . A A . 4 THR N 1 1 4 2379 1 1 5 THR O O 2.432 3.354 -6.043 1.00 . A A . 4 THR O 1 1 4 2380 1 1 5 THR OG1 O 5.789 6.393 -5.954 1.00 . A A . 4 THR OG1 1 1 4 2381 1 1 6 TYR C C 4.703 0.252 -5.087 1.00 . A A . 5 TYR C 1 1 4 2382 1 1 6 TYR CA C 3.705 0.971 -5.968 1.00 . A A . 5 TYR CA 1 1 4 2383 1 1 6 TYR CB C 3.193 0.044 -7.085 1.00 . A A . 5 TYR CB 1 1 4 2384 1 1 6 TYR CD1 C 5.261 -0.784 -8.284 1.00 . A A . 5 TYR CD1 1 1 4 2385 1 1 6 TYR CD2 C 3.709 0.555 -9.498 1.00 . A A . 5 TYR CD2 1 1 4 2386 1 1 6 TYR CE1 C 6.052 -0.897 -9.412 1.00 . A A . 5 TYR CE1 1 1 4 2387 1 1 6 TYR CE2 C 4.495 0.450 -10.627 1.00 . A A . 5 TYR CE2 1 1 4 2388 1 1 6 TYR CG C 4.080 -0.056 -8.307 1.00 . A A . 5 TYR CG 1 1 4 2389 1 1 6 TYR CZ C 5.664 -0.279 -10.582 1.00 . A A . 5 TYR CZ 1 1 4 2390 1 1 6 TYR H H 5.174 2.184 -6.885 1.00 . A A . 5 TYR H 1 1 4 2391 1 1 6 TYR HA H 2.858 1.269 -5.347 1.00 . A A . 5 TYR HA 1 1 4 2392 1 1 6 TYR HB2 H 3.094 -0.959 -6.687 1.00 . A A . 5 TYR HB2 1 1 4 2393 1 1 6 TYR HB3 H 2.222 0.389 -7.410 1.00 . A A . 5 TYR HB3 1 1 4 2394 1 1 6 TYR HD1 H 5.562 -1.265 -7.364 1.00 . A A . 5 TYR HD1 1 1 4 2395 1 1 6 TYR HD2 H 2.793 1.126 -9.531 1.00 . A A . 5 TYR HD2 1 1 4 2396 1 1 6 TYR HE1 H 6.967 -1.471 -9.372 1.00 . A A . 5 TYR HE1 1 1 4 2397 1 1 6 TYR HE2 H 4.187 0.934 -11.543 1.00 . A A . 5 TYR HE2 1 1 4 2398 1 1 6 TYR HH H 6.448 0.452 -12.186 1.00 . A A . 5 TYR HH 1 1 4 2399 1 1 6 TYR N N 4.279 2.196 -6.480 1.00 . A A . 5 TYR N 1 1 4 2400 1 1 6 TYR O O 5.911 0.297 -5.320 1.00 . A A . 5 TYR O 1 1 4 2401 1 1 6 TYR OH O 6.445 -0.394 -11.711 1.00 . A A . 5 TYR OH 1 1 4 2402 1 1 7 TYR C C 4.664 -2.574 -3.127 1.00 . A A . 6 TYR C 1 1 4 2403 1 1 7 TYR CA C 4.996 -1.094 -3.107 1.00 . A A . 6 TYR CA 1 1 4 2404 1 1 7 TYR CB C 4.757 -0.503 -1.713 1.00 . A A . 6 TYR CB 1 1 4 2405 1 1 7 TYR CD1 C 6.708 -1.230 -0.277 1.00 . A A . 6 TYR CD1 1 1 4 2406 1 1 7 TYR CD2 C 4.551 -2.115 0.216 1.00 . A A . 6 TYR CD2 1 1 4 2407 1 1 7 TYR CE1 C 7.244 -1.949 0.774 1.00 . A A . 6 TYR CE1 1 1 4 2408 1 1 7 TYR CE2 C 5.081 -2.836 1.265 1.00 . A A . 6 TYR CE2 1 1 4 2409 1 1 7 TYR CG C 5.353 -1.301 -0.574 1.00 . A A . 6 TYR CG 1 1 4 2410 1 1 7 TYR CZ C 6.426 -2.751 1.540 1.00 . A A . 6 TYR CZ 1 1 4 2411 1 1 7 TYR H H 3.206 -0.390 -3.952 1.00 . A A . 6 TYR H 1 1 4 2412 1 1 7 TYR HA H 6.033 -0.960 -3.376 1.00 . A A . 6 TYR HA 1 1 4 2413 1 1 7 TYR HB2 H 5.184 0.487 -1.678 1.00 . A A . 6 TYR HB2 1 1 4 2414 1 1 7 TYR HB3 H 3.692 -0.432 -1.546 1.00 . A A . 6 TYR HB3 1 1 4 2415 1 1 7 TYR HD1 H 7.346 -0.602 -0.881 1.00 . A A . 6 TYR HD1 1 1 4 2416 1 1 7 TYR HD2 H 3.494 -2.181 -0.002 1.00 . A A . 6 TYR HD2 1 1 4 2417 1 1 7 TYR HE1 H 8.299 -1.880 0.990 1.00 . A A . 6 TYR HE1 1 1 4 2418 1 1 7 TYR HE2 H 4.441 -3.465 1.866 1.00 . A A . 6 TYR HE2 1 1 4 2419 1 1 7 TYR HH H 7.623 -2.937 3.036 1.00 . A A . 6 TYR HH 1 1 4 2420 1 1 7 TYR N N 4.185 -0.389 -4.067 1.00 . A A . 6 TYR N 1 1 4 2421 1 1 7 TYR O O 3.531 -2.967 -2.840 1.00 . A A . 6 TYR O 1 1 4 2422 1 1 7 TYR OH O 6.954 -3.469 2.588 1.00 . A A . 6 TYR OH 1 1 4 2423 1 1 8 THR C C 5.479 -5.158 -1.885 1.00 . A A . 7 THR C 1 1 4 2424 1 1 8 THR CA C 5.502 -4.815 -3.354 1.00 . A A . 7 THR CA 1 1 4 2425 1 1 8 THR CB C 6.623 -5.589 -4.061 1.00 . A A . 7 THR CB 1 1 4 2426 1 1 8 THR CG2 C 6.170 -6.048 -5.432 1.00 . A A . 7 THR CG2 1 1 4 2427 1 1 8 THR H H 6.448 -3.016 -3.912 1.00 . A A . 7 THR H 1 1 4 2428 1 1 8 THR HA H 4.560 -5.111 -3.790 1.00 . A A . 7 THR HA 1 1 4 2429 1 1 8 THR HB H 6.853 -6.465 -3.472 1.00 . A A . 7 THR HB 1 1 4 2430 1 1 8 THR HG1 H 7.973 -4.345 -3.307 1.00 . A A . 7 THR HG1 1 1 4 2431 1 1 8 THR HG21 H 5.317 -6.705 -5.319 1.00 . A A . 7 THR HG21 1 1 4 2432 1 1 8 THR HG22 H 6.974 -6.578 -5.918 1.00 . A A . 7 THR HG22 1 1 4 2433 1 1 8 THR HG23 H 5.889 -5.191 -6.024 1.00 . A A . 7 THR HG23 1 1 4 2434 1 1 8 THR N N 5.631 -3.387 -3.516 1.00 . A A . 7 THR N 1 1 4 2435 1 1 8 THR O O 6.438 -4.891 -1.162 1.00 . A A . 7 THR O 1 1 4 2436 1 1 8 THR OG1 O 7.806 -4.783 -4.159 1.00 . A A . 7 THR OG1 1 1 4 2437 1 1 9 VAL C C 5.275 -6.940 0.456 1.00 . A A . 8 VAL C 1 1 4 2438 1 1 9 VAL CA C 4.164 -6.033 -0.056 1.00 . A A . 8 VAL CA 1 1 4 2439 1 1 9 VAL CB C 2.808 -6.709 0.183 1.00 . A A . 8 VAL CB 1 1 4 2440 1 1 9 VAL CG1 C 2.640 -7.037 1.657 1.00 . A A . 8 VAL CG1 1 1 4 2441 1 1 9 VAL CG2 C 1.672 -5.823 -0.310 1.00 . A A . 8 VAL CG2 1 1 4 2442 1 1 9 VAL H H 3.656 -5.924 -2.103 1.00 . A A . 8 VAL H 1 1 4 2443 1 1 9 VAL HA H 4.177 -5.103 0.505 1.00 . A A . 8 VAL HA 1 1 4 2444 1 1 9 VAL HB H 2.785 -7.634 -0.375 1.00 . A A . 8 VAL HB 1 1 4 2445 1 1 9 VAL HG11 H 1.676 -7.497 1.815 1.00 . A A . 8 VAL HG11 1 1 4 2446 1 1 9 VAL HG12 H 2.705 -6.127 2.235 1.00 . A A . 8 VAL HG12 1 1 4 2447 1 1 9 VAL HG13 H 3.419 -7.717 1.965 1.00 . A A . 8 VAL HG13 1 1 4 2448 1 1 9 VAL HG21 H 0.726 -6.294 -0.091 1.00 . A A . 8 VAL HG21 1 1 4 2449 1 1 9 VAL HG22 H 1.761 -5.676 -1.378 1.00 . A A . 8 VAL HG22 1 1 4 2450 1 1 9 VAL HG23 H 1.719 -4.862 0.184 1.00 . A A . 8 VAL HG23 1 1 4 2451 1 1 9 VAL N N 4.367 -5.720 -1.454 1.00 . A A . 8 VAL N 1 1 4 2452 1 1 9 VAL O O 5.480 -8.041 -0.048 1.00 . A A . 8 VAL O 1 1 4 2453 1 1 10 LYS C C 6.582 -7.717 3.393 1.00 . A A . 9 LYS C 1 1 4 2454 1 1 10 LYS CA C 7.084 -7.156 2.073 1.00 . A A . 9 LYS CA 1 1 4 2455 1 1 10 LYS CB C 8.299 -6.248 2.291 1.00 . A A . 9 LYS CB 1 1 4 2456 1 1 10 LYS CD C 9.697 -6.698 0.207 1.00 . A A . 9 LYS CD 1 1 4 2457 1 1 10 LYS CE C 8.810 -7.707 -0.510 1.00 . A A . 9 LYS CE 1 1 4 2458 1 1 10 LYS CG C 8.897 -5.672 1.007 1.00 . A A . 9 LYS CG 1 1 4 2459 1 1 10 LYS H H 5.805 -5.521 1.734 1.00 . A A . 9 LYS H 1 1 4 2460 1 1 10 LYS HA H 7.364 -7.979 1.431 1.00 . A A . 9 LYS HA 1 1 4 2461 1 1 10 LYS HB2 H 8.005 -5.423 2.924 1.00 . A A . 9 LYS HB2 1 1 4 2462 1 1 10 LYS HB3 H 9.067 -6.816 2.794 1.00 . A A . 9 LYS HB3 1 1 4 2463 1 1 10 LYS HD2 H 10.289 -6.177 -0.530 1.00 . A A . 9 LYS HD2 1 1 4 2464 1 1 10 LYS HD3 H 10.353 -7.229 0.882 1.00 . A A . 9 LYS HD3 1 1 4 2465 1 1 10 LYS HE2 H 8.271 -8.283 0.228 1.00 . A A . 9 LYS HE2 1 1 4 2466 1 1 10 LYS HE3 H 8.107 -7.171 -1.131 1.00 . A A . 9 LYS HE3 1 1 4 2467 1 1 10 LYS HG2 H 8.094 -5.306 0.387 1.00 . A A . 9 LYS HG2 1 1 4 2468 1 1 10 LYS HG3 H 9.549 -4.850 1.267 1.00 . A A . 9 LYS HG3 1 1 4 2469 1 1 10 LYS HZ1 H 9.002 -9.400 -1.727 1.00 . A A . 9 LYS HZ1 1 1 4 2470 1 1 10 LYS HZ2 H 10.387 -9.050 -0.807 1.00 . A A . 9 LYS HZ2 1 1 4 2471 1 1 10 LYS HZ3 H 10.010 -8.112 -2.170 1.00 . A A . 9 LYS HZ3 1 1 4 2472 1 1 10 LYS N N 6.006 -6.432 1.426 1.00 . A A . 9 LYS N 1 1 4 2473 1 1 10 LYS NZ N 9.607 -8.630 -1.362 1.00 . A A . 9 LYS NZ 1 1 4 2474 1 1 10 LYS O O 5.380 -7.696 3.648 1.00 . A A . 9 LYS O 1 1 4 2475 1 1 11 SER C C 6.271 -7.853 6.331 1.00 . A A . 10 SER C 1 1 4 2476 1 1 11 SER CA C 7.175 -8.806 5.519 1.00 . A A . 10 SER CA 1 1 4 2477 1 1 11 SER CB C 8.480 -9.072 6.275 1.00 . A A . 10 SER CB 1 1 4 2478 1 1 11 SER H H 8.404 -8.403 3.837 1.00 . A A . 10 SER H 1 1 4 2479 1 1 11 SER HA H 6.656 -9.739 5.393 1.00 . A A . 10 SER HA 1 1 4 2480 1 1 11 SER HB2 H 9.116 -9.702 5.671 1.00 . A A . 10 SER HB2 1 1 4 2481 1 1 11 SER HB3 H 8.981 -8.133 6.465 1.00 . A A . 10 SER HB3 1 1 4 2482 1 1 11 SER HG H 7.419 -9.395 7.898 1.00 . A A . 10 SER HG 1 1 4 2483 1 1 11 SER N N 7.488 -8.292 4.179 1.00 . A A . 10 SER N 1 1 4 2484 1 1 11 SER O O 5.669 -8.261 7.327 1.00 . A A . 10 SER O 1 1 4 2485 1 1 11 SER OG O 8.245 -9.722 7.514 1.00 . A A . 10 SER OG 1 1 4 2486 1 1 12 GLY C C 3.799 -6.028 5.849 1.00 . A A . 11 GLY C 1 1 4 2487 1 1 12 GLY CA C 5.171 -5.698 6.434 1.00 . A A . 11 GLY CA 1 1 4 2488 1 1 12 GLY H H 6.818 -6.277 5.238 1.00 . A A . 11 GLY H 1 1 4 2489 1 1 12 GLY HA2 H 5.131 -5.793 7.510 1.00 . A A . 11 GLY HA2 1 1 4 2490 1 1 12 GLY HA3 H 5.428 -4.683 6.176 1.00 . A A . 11 GLY HA3 1 1 4 2491 1 1 12 GLY N N 6.191 -6.594 5.917 1.00 . A A . 11 GLY N 1 1 4 2492 1 1 12 GLY O O 3.179 -5.210 5.187 1.00 . A A . 11 GLY O 1 1 4 2493 1 1 13 ASP C C 0.839 -7.022 5.971 1.00 . A A . 12 ASP C 1 1 4 2494 1 1 13 ASP CA C 2.100 -7.763 5.533 1.00 . A A . 12 ASP CA 1 1 4 2495 1 1 13 ASP CB C 1.944 -9.239 5.873 1.00 . A A . 12 ASP CB 1 1 4 2496 1 1 13 ASP CG C 1.789 -9.469 7.363 1.00 . A A . 12 ASP CG 1 1 4 2497 1 1 13 ASP H H 3.837 -7.802 6.739 1.00 . A A . 12 ASP H 1 1 4 2498 1 1 13 ASP HA H 2.191 -7.671 4.462 1.00 . A A . 12 ASP HA 1 1 4 2499 1 1 13 ASP HB2 H 1.067 -9.619 5.371 1.00 . A A . 12 ASP HB2 1 1 4 2500 1 1 13 ASP HB3 H 2.818 -9.776 5.528 1.00 . A A . 12 ASP HB3 1 1 4 2501 1 1 13 ASP N N 3.329 -7.230 6.124 1.00 . A A . 12 ASP N 1 1 4 2502 1 1 13 ASP O O -0.256 -7.359 5.534 1.00 . A A . 12 ASP O 1 1 4 2503 1 1 13 ASP OD1 O 0.643 -9.452 7.863 1.00 . A A . 12 ASP OD1 1 1 4 2504 1 1 13 ASP OD2 O 2.818 -9.661 8.045 1.00 . A A . 12 ASP OD2 1 1 4 2505 1 1 14 THR C C -0.362 -4.002 7.062 1.00 . A A . 13 THR C 1 1 4 2506 1 1 14 THR CA C -0.234 -5.473 7.442 1.00 . A A . 13 THR CA 1 1 4 2507 1 1 14 THR CB C -0.225 -5.634 8.974 1.00 . A A . 13 THR CB 1 1 4 2508 1 1 14 THR CG2 C -1.625 -5.487 9.542 1.00 . A A . 13 THR CG2 1 1 4 2509 1 1 14 THR H H 1.840 -5.690 7.076 1.00 . A A . 13 THR H 1 1 4 2510 1 1 14 THR HA H -1.089 -6.003 7.048 1.00 . A A . 13 THR HA 1 1 4 2511 1 1 14 THR HB H 0.410 -4.871 9.404 1.00 . A A . 13 THR HB 1 1 4 2512 1 1 14 THR HG1 H 0.179 -7.534 8.564 1.00 . A A . 13 THR HG1 1 1 4 2513 1 1 14 THR HG21 H -1.591 -5.589 10.616 1.00 . A A . 13 THR HG21 1 1 4 2514 1 1 14 THR HG22 H -2.263 -6.254 9.127 1.00 . A A . 13 THR HG22 1 1 4 2515 1 1 14 THR HG23 H -2.017 -4.514 9.284 1.00 . A A . 13 THR HG23 1 1 4 2516 1 1 14 THR N N 0.957 -6.057 6.862 1.00 . A A . 13 THR N 1 1 4 2517 1 1 14 THR O O 0.636 -3.281 6.995 1.00 . A A . 13 THR O 1 1 4 2518 1 1 14 THR OG1 O 0.290 -6.931 9.317 1.00 . A A . 13 THR OG1 1 1 4 2519 1 1 15 LEU C C -1.283 -1.131 7.125 1.00 . A A . 14 LEU C 1 1 4 2520 1 1 15 LEU CA C -1.911 -2.247 6.308 1.00 . A A . 14 LEU CA 1 1 4 2521 1 1 15 LEU CB C -3.427 -2.022 6.310 1.00 . A A . 14 LEU CB 1 1 4 2522 1 1 15 LEU CD1 C -3.916 -2.014 3.856 1.00 . A A . 14 LEU CD1 1 1 4 2523 1 1 15 LEU CD2 C -4.012 -4.171 5.120 1.00 . A A . 14 LEU CD2 1 1 4 2524 1 1 15 LEU CG C -4.242 -2.667 5.183 1.00 . A A . 14 LEU CG 1 1 4 2525 1 1 15 LEU H H -2.352 -4.171 7.064 1.00 . A A . 14 LEU H 1 1 4 2526 1 1 15 LEU HA H -1.549 -2.199 5.296 1.00 . A A . 14 LEU HA 1 1 4 2527 1 1 15 LEU HB2 H -3.810 -2.390 7.246 1.00 . A A . 14 LEU HB2 1 1 4 2528 1 1 15 LEU HB3 H -3.594 -0.957 6.272 1.00 . A A . 14 LEU HB3 1 1 4 2529 1 1 15 LEU HD11 H -4.136 -0.958 3.911 1.00 . A A . 14 LEU HD11 1 1 4 2530 1 1 15 LEU HD12 H -4.511 -2.465 3.076 1.00 . A A . 14 LEU HD12 1 1 4 2531 1 1 15 LEU HD13 H -2.866 -2.152 3.635 1.00 . A A . 14 LEU HD13 1 1 4 2532 1 1 15 LEU HD21 H -2.967 -4.367 4.931 1.00 . A A . 14 LEU HD21 1 1 4 2533 1 1 15 LEU HD22 H -4.608 -4.592 4.325 1.00 . A A . 14 LEU HD22 1 1 4 2534 1 1 15 LEU HD23 H -4.297 -4.618 6.060 1.00 . A A . 14 LEU HD23 1 1 4 2535 1 1 15 LEU HG H -5.292 -2.501 5.379 1.00 . A A . 14 LEU HG 1 1 4 2536 1 1 15 LEU N N -1.606 -3.570 6.852 1.00 . A A . 14 LEU N 1 1 4 2537 1 1 15 LEU O O -0.603 -0.262 6.586 1.00 . A A . 14 LEU O 1 1 4 2538 1 1 16 ASN C C 0.479 -0.111 9.416 1.00 . A A . 15 ASN C 1 1 4 2539 1 1 16 ASN CA C -1.035 -0.121 9.317 1.00 . A A . 15 ASN CA 1 1 4 2540 1 1 16 ASN CB C -1.655 -0.272 10.714 1.00 . A A . 15 ASN CB 1 1 4 2541 1 1 16 ASN CG C -1.251 -1.554 11.428 1.00 . A A . 15 ASN CG 1 1 4 2542 1 1 16 ASN H H -1.958 -1.953 8.812 1.00 . A A . 15 ASN H 1 1 4 2543 1 1 16 ASN HA H -1.360 0.817 8.893 1.00 . A A . 15 ASN HA 1 1 4 2544 1 1 16 ASN HB2 H -1.348 0.562 11.325 1.00 . A A . 15 ASN HB2 1 1 4 2545 1 1 16 ASN HB3 H -2.731 -0.261 10.621 1.00 . A A . 15 ASN HB3 1 1 4 2546 1 1 16 ASN HD21 H -1.309 -0.614 13.176 1.00 . A A . 15 ASN HD21 1 1 4 2547 1 1 16 ASN HD22 H -0.892 -2.293 13.234 1.00 . A A . 15 ASN HD22 1 1 4 2548 1 1 16 ASN N N -1.490 -1.181 8.432 1.00 . A A . 15 ASN N 1 1 4 2549 1 1 16 ASN ND2 N -1.136 -1.481 12.744 1.00 . A A . 15 ASN ND2 1 1 4 2550 1 1 16 ASN O O 1.092 0.939 9.610 1.00 . A A . 15 ASN O 1 1 4 2551 1 1 16 ASN OD1 O -1.034 -2.594 10.804 1.00 . A A . 15 ASN OD1 1 1 4 2552 1 1 17 LYS C C 3.253 -0.805 8.242 1.00 . A A . 16 LYS C 1 1 4 2553 1 1 17 LYS CA C 2.510 -1.427 9.423 1.00 . A A . 16 LYS CA 1 1 4 2554 1 1 17 LYS CB C 2.848 -2.911 9.583 1.00 . A A . 16 LYS CB 1 1 4 2555 1 1 17 LYS CD C 4.541 -4.591 10.344 1.00 . A A . 16 LYS CD 1 1 4 2556 1 1 17 LYS CE C 3.794 -5.678 9.585 1.00 . A A . 16 LYS CE 1 1 4 2557 1 1 17 LYS CG C 4.327 -3.214 9.732 1.00 . A A . 16 LYS CG 1 1 4 2558 1 1 17 LYS H H 0.537 -2.068 9.032 1.00 . A A . 16 LYS H 1 1 4 2559 1 1 17 LYS HA H 2.797 -0.906 10.323 1.00 . A A . 16 LYS HA 1 1 4 2560 1 1 17 LYS HB2 H 2.342 -3.286 10.459 1.00 . A A . 16 LYS HB2 1 1 4 2561 1 1 17 LYS HB3 H 2.481 -3.442 8.716 1.00 . A A . 16 LYS HB3 1 1 4 2562 1 1 17 LYS HD2 H 5.596 -4.819 10.329 1.00 . A A . 16 LYS HD2 1 1 4 2563 1 1 17 LYS HD3 H 4.192 -4.577 11.367 1.00 . A A . 16 LYS HD3 1 1 4 2564 1 1 17 LYS HE2 H 2.750 -5.406 9.530 1.00 . A A . 16 LYS HE2 1 1 4 2565 1 1 17 LYS HE3 H 4.200 -5.745 8.586 1.00 . A A . 16 LYS HE3 1 1 4 2566 1 1 17 LYS HG2 H 4.793 -3.186 8.758 1.00 . A A . 16 LYS HG2 1 1 4 2567 1 1 17 LYS HG3 H 4.778 -2.471 10.373 1.00 . A A . 16 LYS HG3 1 1 4 2568 1 1 17 LYS HZ1 H 4.922 -7.253 10.363 1.00 . A A . 16 LYS HZ1 1 1 4 2569 1 1 17 LYS HZ2 H 3.448 -7.737 9.682 1.00 . A A . 16 LYS HZ2 1 1 4 2570 1 1 17 LYS HZ3 H 3.471 -6.973 11.193 1.00 . A A . 16 LYS HZ3 1 1 4 2571 1 1 17 LYS N N 1.077 -1.282 9.268 1.00 . A A . 16 LYS N 1 1 4 2572 1 1 17 LYS NZ N 3.915 -7.002 10.248 1.00 . A A . 16 LYS NZ 1 1 4 2573 1 1 17 LYS O O 4.186 -0.020 8.427 1.00 . A A . 16 LYS O 1 1 4 2574 1 1 18 ILE C C 3.082 0.891 5.626 1.00 . A A . 17 ILE C 1 1 4 2575 1 1 18 ILE CA C 3.443 -0.571 5.838 1.00 . A A . 17 ILE CA 1 1 4 2576 1 1 18 ILE CB C 3.128 -1.383 4.568 1.00 . A A . 17 ILE CB 1 1 4 2577 1 1 18 ILE CD1 C 1.311 -2.543 3.217 1.00 . A A . 17 ILE CD1 1 1 4 2578 1 1 18 ILE CG1 C 1.665 -1.840 4.510 1.00 . A A . 17 ILE CG1 1 1 4 2579 1 1 18 ILE CG2 C 4.053 -2.574 4.485 1.00 . A A . 17 ILE CG2 1 1 4 2580 1 1 18 ILE H H 2.044 -1.726 6.933 1.00 . A A . 17 ILE H 1 1 4 2581 1 1 18 ILE HA H 4.512 -0.624 5.999 1.00 . A A . 17 ILE HA 1 1 4 2582 1 1 18 ILE HB H 3.325 -0.756 3.720 1.00 . A A . 17 ILE HB 1 1 4 2583 1 1 18 ILE HD11 H 0.279 -2.869 3.254 1.00 . A A . 17 ILE HD11 1 1 4 2584 1 1 18 ILE HD12 H 1.959 -3.401 3.076 1.00 . A A . 17 ILE HD12 1 1 4 2585 1 1 18 ILE HD13 H 1.440 -1.860 2.390 1.00 . A A . 17 ILE HD13 1 1 4 2586 1 1 18 ILE HG12 H 1.475 -2.532 5.319 1.00 . A A . 17 ILE HG12 1 1 4 2587 1 1 18 ILE HG13 H 1.019 -0.981 4.613 1.00 . A A . 17 ILE HG13 1 1 4 2588 1 1 18 ILE HG21 H 5.077 -2.236 4.476 1.00 . A A . 17 ILE HG21 1 1 4 2589 1 1 18 ILE HG22 H 3.845 -3.126 3.581 1.00 . A A . 17 ILE HG22 1 1 4 2590 1 1 18 ILE HG23 H 3.889 -3.211 5.342 1.00 . A A . 17 ILE HG23 1 1 4 2591 1 1 18 ILE N N 2.810 -1.117 7.029 1.00 . A A . 17 ILE N 1 1 4 2592 1 1 18 ILE O O 3.934 1.701 5.256 1.00 . A A . 17 ILE O 1 1 4 2593 1 1 19 ALA C C 2.197 3.544 6.621 1.00 . A A . 18 ALA C 1 1 4 2594 1 1 19 ALA CA C 1.367 2.607 5.754 1.00 . A A . 18 ALA CA 1 1 4 2595 1 1 19 ALA CB C -0.092 2.703 6.149 1.00 . A A . 18 ALA CB 1 1 4 2596 1 1 19 ALA H H 1.195 0.535 6.158 1.00 . A A . 18 ALA H 1 1 4 2597 1 1 19 ALA HA H 1.461 2.899 4.719 1.00 . A A . 18 ALA HA 1 1 4 2598 1 1 19 ALA HB1 H -0.189 2.467 7.199 1.00 . A A . 18 ALA HB1 1 1 4 2599 1 1 19 ALA HB2 H -0.670 2.001 5.569 1.00 . A A . 18 ALA HB2 1 1 4 2600 1 1 19 ALA HB3 H -0.450 3.705 5.970 1.00 . A A . 18 ALA HB3 1 1 4 2601 1 1 19 ALA N N 1.830 1.231 5.886 1.00 . A A . 18 ALA N 1 1 4 2602 1 1 19 ALA O O 2.696 4.569 6.151 1.00 . A A . 18 ALA O 1 1 4 2603 1 1 20 ALA C C 4.625 3.900 8.498 1.00 . A A . 19 ALA C 1 1 4 2604 1 1 20 ALA CA C 3.137 3.973 8.816 1.00 . A A . 19 ALA CA 1 1 4 2605 1 1 20 ALA CB C 2.863 3.529 10.243 1.00 . A A . 19 ALA CB 1 1 4 2606 1 1 20 ALA H H 1.970 2.327 8.188 1.00 . A A . 19 ALA H 1 1 4 2607 1 1 20 ALA HA H 2.809 4.998 8.714 1.00 . A A . 19 ALA HA 1 1 4 2608 1 1 20 ALA HB1 H 1.801 3.581 10.438 1.00 . A A . 19 ALA HB1 1 1 4 2609 1 1 20 ALA HB2 H 3.388 4.178 10.930 1.00 . A A . 19 ALA HB2 1 1 4 2610 1 1 20 ALA HB3 H 3.204 2.513 10.377 1.00 . A A . 19 ALA HB3 1 1 4 2611 1 1 20 ALA N N 2.371 3.169 7.880 1.00 . A A . 19 ALA N 1 1 4 2612 1 1 20 ALA O O 5.396 4.783 8.877 1.00 . A A . 19 ALA O 1 1 4 2613 1 1 21 GLN C C 6.888 3.759 6.448 1.00 . A A . 20 GLN C 1 1 4 2614 1 1 21 GLN CA C 6.423 2.665 7.419 1.00 . A A . 20 GLN CA 1 1 4 2615 1 1 21 GLN CB C 6.643 1.283 6.792 1.00 . A A . 20 GLN CB 1 1 4 2616 1 1 21 GLN CD C 8.239 -0.286 5.608 1.00 . A A . 20 GLN CD 1 1 4 2617 1 1 21 GLN CG C 8.047 1.076 6.246 1.00 . A A . 20 GLN CG 1 1 4 2618 1 1 21 GLN H H 4.361 2.153 7.546 1.00 . A A . 20 GLN H 1 1 4 2619 1 1 21 GLN HA H 7.014 2.735 8.319 1.00 . A A . 20 GLN HA 1 1 4 2620 1 1 21 GLN HB2 H 6.456 0.528 7.541 1.00 . A A . 20 GLN HB2 1 1 4 2621 1 1 21 GLN HB3 H 5.943 1.153 5.982 1.00 . A A . 20 GLN HB3 1 1 4 2622 1 1 21 GLN HE21 H 9.526 0.493 4.306 1.00 . A A . 20 GLN HE21 1 1 4 2623 1 1 21 GLN HE22 H 9.221 -1.211 4.147 1.00 . A A . 20 GLN HE22 1 1 4 2624 1 1 21 GLN HG2 H 8.241 1.834 5.502 1.00 . A A . 20 GLN HG2 1 1 4 2625 1 1 21 GLN HG3 H 8.753 1.182 7.056 1.00 . A A . 20 GLN HG3 1 1 4 2626 1 1 21 GLN N N 5.024 2.841 7.799 1.00 . A A . 20 GLN N 1 1 4 2627 1 1 21 GLN NE2 N 9.080 -0.342 4.588 1.00 . A A . 20 GLN NE2 1 1 4 2628 1 1 21 GLN O O 7.943 4.364 6.652 1.00 . A A . 20 GLN O 1 1 4 2629 1 1 21 GLN OE1 O 7.636 -1.275 6.020 1.00 . A A . 20 GLN OE1 1 1 4 2630 1 1 22 TYR C C 5.673 6.324 4.519 1.00 . A A . 21 TYR C 1 1 4 2631 1 1 22 TYR CA C 6.506 5.043 4.425 1.00 . A A . 21 TYR CA 1 1 4 2632 1 1 22 TYR CB C 6.509 4.485 2.992 1.00 . A A . 21 TYR CB 1 1 4 2633 1 1 22 TYR CD1 C 4.132 3.706 2.612 1.00 . A A . 21 TYR CD1 1 1 4 2634 1 1 22 TYR CD2 C 5.882 2.095 2.494 1.00 . A A . 21 TYR CD2 1 1 4 2635 1 1 22 TYR CE1 C 3.204 2.721 2.330 1.00 . A A . 21 TYR CE1 1 1 4 2636 1 1 22 TYR CE2 C 4.960 1.106 2.206 1.00 . A A . 21 TYR CE2 1 1 4 2637 1 1 22 TYR CG C 5.484 3.410 2.701 1.00 . A A . 21 TYR CG 1 1 4 2638 1 1 22 TYR CZ C 3.621 1.425 2.125 1.00 . A A . 21 TYR CZ 1 1 4 2639 1 1 22 TYR H H 5.259 3.547 5.288 1.00 . A A . 21 TYR H 1 1 4 2640 1 1 22 TYR HA H 7.524 5.311 4.673 1.00 . A A . 21 TYR HA 1 1 4 2641 1 1 22 TYR HB2 H 6.325 5.296 2.306 1.00 . A A . 21 TYR HB2 1 1 4 2642 1 1 22 TYR HB3 H 7.486 4.070 2.786 1.00 . A A . 21 TYR HB3 1 1 4 2643 1 1 22 TYR HD1 H 3.807 4.724 2.773 1.00 . A A . 21 TYR HD1 1 1 4 2644 1 1 22 TYR HD2 H 6.930 1.848 2.560 1.00 . A A . 21 TYR HD2 1 1 4 2645 1 1 22 TYR HE1 H 2.157 2.974 2.264 1.00 . A A . 21 TYR HE1 1 1 4 2646 1 1 22 TYR HE2 H 5.290 0.091 2.047 1.00 . A A . 21 TYR HE2 1 1 4 2647 1 1 22 TYR HH H 2.067 0.781 1.193 1.00 . A A . 21 TYR HH 1 1 4 2648 1 1 22 TYR N N 6.107 4.032 5.405 1.00 . A A . 21 TYR N 1 1 4 2649 1 1 22 TYR O O 5.751 7.187 3.645 1.00 . A A . 21 TYR O 1 1 4 2650 1 1 22 TYR OH O 2.697 0.447 1.835 1.00 . A A . 21 TYR OH 1 1 4 2651 1 1 23 GLY C C 3.019 8.013 5.031 1.00 . A A . 22 GLY C 1 1 4 2652 1 1 23 GLY CA C 4.247 7.724 5.875 1.00 . A A . 22 GLY CA 1 1 4 2653 1 1 23 GLY H H 4.740 5.681 6.163 1.00 . A A . 22 GLY H 1 1 4 2654 1 1 23 GLY HA2 H 3.954 7.725 6.913 1.00 . A A . 22 GLY HA2 1 1 4 2655 1 1 23 GLY HA3 H 4.967 8.515 5.720 1.00 . A A . 22 GLY HA3 1 1 4 2656 1 1 23 GLY N N 4.890 6.453 5.580 1.00 . A A . 22 GLY N 1 1 4 2657 1 1 23 GLY O O 2.890 9.102 4.470 1.00 . A A . 22 GLY O 1 1 4 2658 1 1 24 VAL C C -0.251 6.645 5.166 1.00 . A A . 23 VAL C 1 1 4 2659 1 1 24 VAL CA C 0.838 7.251 4.289 1.00 . A A . 23 VAL CA 1 1 4 2660 1 1 24 VAL CB C 0.802 6.624 2.871 1.00 . A A . 23 VAL CB 1 1 4 2661 1 1 24 VAL CG1 C 0.954 5.117 2.939 1.00 . A A . 23 VAL CG1 1 1 4 2662 1 1 24 VAL CG2 C -0.467 6.996 2.127 1.00 . A A . 23 VAL CG2 1 1 4 2663 1 1 24 VAL H H 2.328 6.167 5.326 1.00 . A A . 23 VAL H 1 1 4 2664 1 1 24 VAL HA H 0.670 8.315 4.202 1.00 . A A . 23 VAL HA 1 1 4 2665 1 1 24 VAL HB H 1.635 7.016 2.310 1.00 . A A . 23 VAL HB 1 1 4 2666 1 1 24 VAL HG11 H 1.920 4.868 3.355 1.00 . A A . 23 VAL HG11 1 1 4 2667 1 1 24 VAL HG12 H 0.872 4.701 1.945 1.00 . A A . 23 VAL HG12 1 1 4 2668 1 1 24 VAL HG13 H 0.176 4.705 3.566 1.00 . A A . 23 VAL HG13 1 1 4 2669 1 1 24 VAL HG21 H -1.327 6.676 2.698 1.00 . A A . 23 VAL HG21 1 1 4 2670 1 1 24 VAL HG22 H -0.473 6.508 1.164 1.00 . A A . 23 VAL HG22 1 1 4 2671 1 1 24 VAL HG23 H -0.505 8.067 1.990 1.00 . A A . 23 VAL HG23 1 1 4 2672 1 1 24 VAL N N 2.125 7.047 4.938 1.00 . A A . 23 VAL N 1 1 4 2673 1 1 24 VAL O O 0.042 5.828 6.036 1.00 . A A . 23 VAL O 1 1 4 2674 1 1 25 SER C C -3.189 5.290 5.069 1.00 . A A . 24 SER C 1 1 4 2675 1 1 25 SER CA C -2.575 6.510 5.758 1.00 . A A . 24 SER CA 1 1 4 2676 1 1 25 SER CB C -3.634 7.580 6.019 1.00 . A A . 24 SER CB 1 1 4 2677 1 1 25 SER H H -1.675 7.740 4.302 1.00 . A A . 24 SER H 1 1 4 2678 1 1 25 SER HA H -2.164 6.194 6.706 1.00 . A A . 24 SER HA 1 1 4 2679 1 1 25 SER HB2 H -4.003 7.959 5.079 1.00 . A A . 24 SER HB2 1 1 4 2680 1 1 25 SER HB3 H -4.449 7.148 6.581 1.00 . A A . 24 SER HB3 1 1 4 2681 1 1 25 SER HG H -2.830 8.330 7.643 1.00 . A A . 24 SER HG 1 1 4 2682 1 1 25 SER N N -1.488 7.057 4.976 1.00 . A A . 24 SER N 1 1 4 2683 1 1 25 SER O O -3.201 5.174 3.831 1.00 . A A . 24 SER O 1 1 4 2684 1 1 25 SER OG O -3.086 8.655 6.763 1.00 . A A . 24 SER OG 1 1 4 2685 1 1 26 VAL C C -5.502 3.480 4.517 1.00 . A A . 25 VAL C 1 1 4 2686 1 1 26 VAL CA C -4.312 3.158 5.413 1.00 . A A . 25 VAL CA 1 1 4 2687 1 1 26 VAL CB C -4.780 2.285 6.595 1.00 . A A . 25 VAL CB 1 1 4 2688 1 1 26 VAL CG1 C -5.191 0.908 6.119 1.00 . A A . 25 VAL CG1 1 1 4 2689 1 1 26 VAL CG2 C -3.694 2.182 7.655 1.00 . A A . 25 VAL CG2 1 1 4 2690 1 1 26 VAL H H -3.630 4.535 6.861 1.00 . A A . 25 VAL H 1 1 4 2691 1 1 26 VAL HA H -3.588 2.600 4.844 1.00 . A A . 25 VAL HA 1 1 4 2692 1 1 26 VAL HB H -5.643 2.757 7.042 1.00 . A A . 25 VAL HB 1 1 4 2693 1 1 26 VAL HG11 H -4.342 0.412 5.671 1.00 . A A . 25 VAL HG11 1 1 4 2694 1 1 26 VAL HG12 H -5.979 1.000 5.387 1.00 . A A . 25 VAL HG12 1 1 4 2695 1 1 26 VAL HG13 H -5.546 0.328 6.958 1.00 . A A . 25 VAL HG13 1 1 4 2696 1 1 26 VAL HG21 H -3.502 3.160 8.070 1.00 . A A . 25 VAL HG21 1 1 4 2697 1 1 26 VAL HG22 H -2.789 1.797 7.206 1.00 . A A . 25 VAL HG22 1 1 4 2698 1 1 26 VAL HG23 H -4.019 1.514 8.439 1.00 . A A . 25 VAL HG23 1 1 4 2699 1 1 26 VAL N N -3.686 4.379 5.891 1.00 . A A . 25 VAL N 1 1 4 2700 1 1 26 VAL O O -5.737 2.804 3.516 1.00 . A A . 25 VAL O 1 1 4 2701 1 1 27 ALA C C -7.134 5.190 2.655 1.00 . A A . 26 ALA C 1 1 4 2702 1 1 27 ALA CA C -7.427 4.919 4.131 1.00 . A A . 26 ALA CA 1 1 4 2703 1 1 27 ALA CB C -8.062 6.144 4.768 1.00 . A A . 26 ALA CB 1 1 4 2704 1 1 27 ALA H H -5.947 5.076 5.635 1.00 . A A . 26 ALA H 1 1 4 2705 1 1 27 ALA HA H -8.131 4.104 4.202 1.00 . A A . 26 ALA HA 1 1 4 2706 1 1 27 ALA HB1 H -7.394 6.988 4.670 1.00 . A A . 26 ALA HB1 1 1 4 2707 1 1 27 ALA HB2 H -8.248 5.951 5.814 1.00 . A A . 26 ALA HB2 1 1 4 2708 1 1 27 ALA HB3 H -8.995 6.364 4.271 1.00 . A A . 26 ALA HB3 1 1 4 2709 1 1 27 ALA N N -6.227 4.540 4.862 1.00 . A A . 26 ALA N 1 1 4 2710 1 1 27 ALA O O -7.813 4.656 1.779 1.00 . A A . 26 ALA O 1 1 4 2711 1 1 28 ASN C C -5.165 5.211 0.222 1.00 . A A . 27 ASN C 1 1 4 2712 1 1 28 ASN CA C -5.804 6.342 0.995 1.00 . A A . 27 ASN CA 1 1 4 2713 1 1 28 ASN CB C -4.994 7.652 0.842 1.00 . A A . 27 ASN CB 1 1 4 2714 1 1 28 ASN CG C -4.053 7.998 1.980 1.00 . A A . 27 ASN CG 1 1 4 2715 1 1 28 ASN H H -5.533 6.320 3.102 1.00 . A A . 27 ASN H 1 1 4 2716 1 1 28 ASN HA H -6.759 6.507 0.528 1.00 . A A . 27 ASN HA 1 1 4 2717 1 1 28 ASN HB2 H -4.393 7.577 -0.051 1.00 . A A . 27 ASN HB2 1 1 4 2718 1 1 28 ASN HB3 H -5.688 8.471 0.720 1.00 . A A . 27 ASN HB3 1 1 4 2719 1 1 28 ASN HD21 H -2.934 9.059 0.728 1.00 . A A . 27 ASN HD21 1 1 4 2720 1 1 28 ASN HD22 H -2.408 9.043 2.376 1.00 . A A . 27 ASN HD22 1 1 4 2721 1 1 28 ASN N N -6.101 5.978 2.374 1.00 . A A . 27 ASN N 1 1 4 2722 1 1 28 ASN ND2 N -3.024 8.768 1.662 1.00 . A A . 27 ASN ND2 1 1 4 2723 1 1 28 ASN O O -5.473 5.047 -0.960 1.00 . A A . 27 ASN O 1 1 4 2724 1 1 28 ASN OD1 O -4.257 7.621 3.127 1.00 . A A . 27 ASN OD1 1 1 4 2725 1 1 29 LEU C C -4.798 2.210 -0.187 1.00 . A A . 28 LEU C 1 1 4 2726 1 1 29 LEU CA C -3.753 3.285 0.090 1.00 . A A . 28 LEU CA 1 1 4 2727 1 1 29 LEU CB C -2.434 2.721 0.653 1.00 . A A . 28 LEU CB 1 1 4 2728 1 1 29 LEU CD1 C -3.134 1.102 2.448 1.00 . A A . 28 LEU CD1 1 1 4 2729 1 1 29 LEU CD2 C -0.888 2.200 2.510 1.00 . A A . 28 LEU CD2 1 1 4 2730 1 1 29 LEU CG C -2.354 2.370 2.136 1.00 . A A . 28 LEU CG 1 1 4 2731 1 1 29 LEU H H -4.073 4.544 1.786 1.00 . A A . 28 LEU H 1 1 4 2732 1 1 29 LEU HA H -3.516 3.711 -0.880 1.00 . A A . 28 LEU HA 1 1 4 2733 1 1 29 LEU HB2 H -2.204 1.824 0.099 1.00 . A A . 28 LEU HB2 1 1 4 2734 1 1 29 LEU HB3 H -1.658 3.444 0.444 1.00 . A A . 28 LEU HB3 1 1 4 2735 1 1 29 LEU HD11 H -3.077 0.896 3.506 1.00 . A A . 28 LEU HD11 1 1 4 2736 1 1 29 LEU HD12 H -2.710 0.272 1.897 1.00 . A A . 28 LEU HD12 1 1 4 2737 1 1 29 LEU HD13 H -4.167 1.235 2.162 1.00 . A A . 28 LEU HD13 1 1 4 2738 1 1 29 LEU HD21 H -0.516 1.275 2.092 1.00 . A A . 28 LEU HD21 1 1 4 2739 1 1 29 LEU HD22 H -0.783 2.181 3.585 1.00 . A A . 28 LEU HD22 1 1 4 2740 1 1 29 LEU HD23 H -0.314 3.027 2.102 1.00 . A A . 28 LEU HD23 1 1 4 2741 1 1 29 LEU HG H -2.763 3.178 2.723 1.00 . A A . 28 LEU HG 1 1 4 2742 1 1 29 LEU N N -4.315 4.398 0.845 1.00 . A A . 28 LEU N 1 1 4 2743 1 1 29 LEU O O -4.732 1.531 -1.210 1.00 . A A . 28 LEU O 1 1 4 2744 1 1 30 ARG C C -7.671 1.653 -0.800 1.00 . A A . 29 ARG C 1 1 4 2745 1 1 30 ARG CA C -6.905 1.187 0.443 1.00 . A A . 29 ARG CA 1 1 4 2746 1 1 30 ARG CB C -7.855 1.174 1.639 1.00 . A A . 29 ARG CB 1 1 4 2747 1 1 30 ARG CD C -8.118 0.696 4.074 1.00 . A A . 29 ARG CD 1 1 4 2748 1 1 30 ARG CG C -7.412 0.288 2.791 1.00 . A A . 29 ARG CG 1 1 4 2749 1 1 30 ARG CZ C -8.514 -0.150 6.355 1.00 . A A . 29 ARG CZ 1 1 4 2750 1 1 30 ARG H H -5.707 2.533 1.566 1.00 . A A . 29 ARG H 1 1 4 2751 1 1 30 ARG HA H -6.533 0.188 0.274 1.00 . A A . 29 ARG HA 1 1 4 2752 1 1 30 ARG HB2 H -7.953 2.183 2.013 1.00 . A A . 29 ARG HB2 1 1 4 2753 1 1 30 ARG HB3 H -8.823 0.831 1.305 1.00 . A A . 29 ARG HB3 1 1 4 2754 1 1 30 ARG HD2 H -7.659 1.607 4.436 1.00 . A A . 29 ARG HD2 1 1 4 2755 1 1 30 ARG HD3 H -9.159 0.884 3.851 1.00 . A A . 29 ARG HD3 1 1 4 2756 1 1 30 ARG HE H -7.582 -1.166 4.898 1.00 . A A . 29 ARG HE 1 1 4 2757 1 1 30 ARG HG2 H -7.657 -0.739 2.563 1.00 . A A . 29 ARG HG2 1 1 4 2758 1 1 30 ARG HG3 H -6.346 0.390 2.927 1.00 . A A . 29 ARG HG3 1 1 4 2759 1 1 30 ARG HH11 H -9.267 1.704 5.996 1.00 . A A . 29 ARG HH11 1 1 4 2760 1 1 30 ARG HH12 H -9.493 1.107 7.614 1.00 . A A . 29 ARG HH12 1 1 4 2761 1 1 30 ARG HH21 H -7.925 -1.983 7.018 1.00 . A A . 29 ARG HH21 1 1 4 2762 1 1 30 ARG HH22 H -8.750 -0.984 8.186 1.00 . A A . 29 ARG HH22 1 1 4 2763 1 1 30 ARG N N -5.763 2.056 0.707 1.00 . A A . 29 ARG N 1 1 4 2764 1 1 30 ARG NE N -8.029 -0.319 5.122 1.00 . A A . 29 ARG NE 1 1 4 2765 1 1 30 ARG NH1 N -9.146 0.975 6.678 1.00 . A A . 29 ARG NH1 1 1 4 2766 1 1 30 ARG NH2 N -8.389 -1.114 7.257 1.00 . A A . 29 ARG NH2 1 1 4 2767 1 1 30 ARG O O -8.027 0.847 -1.661 1.00 . A A . 29 ARG O 1 1 4 2768 1 1 31 SER C C -8.195 3.437 -3.338 1.00 . A A . 30 SER C 1 1 4 2769 1 1 31 SER CA C -8.775 3.522 -1.917 1.00 . A A . 30 SER CA 1 1 4 2770 1 1 31 SER CB C -9.118 4.967 -1.565 1.00 . A A . 30 SER CB 1 1 4 2771 1 1 31 SER H H -7.484 3.566 -0.239 1.00 . A A . 30 SER H 1 1 4 2772 1 1 31 SER HA H -9.690 2.949 -1.899 1.00 . A A . 30 SER HA 1 1 4 2773 1 1 31 SER HB2 H -8.207 5.545 -1.485 1.00 . A A . 30 SER HB2 1 1 4 2774 1 1 31 SER HB3 H -9.748 5.386 -2.334 1.00 . A A . 30 SER HB3 1 1 4 2775 1 1 31 SER HG H -10.189 4.158 -0.133 1.00 . A A . 30 SER HG 1 1 4 2776 1 1 31 SER N N -7.901 2.961 -0.893 1.00 . A A . 30 SER N 1 1 4 2777 1 1 31 SER O O -8.915 3.072 -4.268 1.00 . A A . 30 SER O 1 1 4 2778 1 1 31 SER OG O -9.809 5.026 -0.327 1.00 . A A . 30 SER OG 1 1 4 2779 1 1 32 TRP C C -5.935 2.297 -5.273 1.00 . A A . 31 TRP C 1 1 4 2780 1 1 32 TRP CA C -6.342 3.713 -4.879 1.00 . A A . 31 TRP CA 1 1 4 2781 1 1 32 TRP CB C -5.158 4.684 -5.053 1.00 . A A . 31 TRP CB 1 1 4 2782 1 1 32 TRP CD1 C -3.540 3.516 -3.459 1.00 . A A . 31 TRP CD1 1 1 4 2783 1 1 32 TRP CD2 C -3.549 5.741 -3.267 1.00 . A A . 31 TRP CD2 1 1 4 2784 1 1 32 TRP CE2 C -2.632 5.215 -2.345 1.00 . A A . 31 TRP CE2 1 1 4 2785 1 1 32 TRP CE3 C -3.717 7.126 -3.323 1.00 . A A . 31 TRP CE3 1 1 4 2786 1 1 32 TRP CG C -4.131 4.630 -3.965 1.00 . A A . 31 TRP CG 1 1 4 2787 1 1 32 TRP CH2 C -2.070 7.359 -1.563 1.00 . A A . 31 TRP CH2 1 1 4 2788 1 1 32 TRP CZ2 C -1.888 6.013 -1.487 1.00 . A A . 31 TRP CZ2 1 1 4 2789 1 1 32 TRP CZ3 C -2.973 7.920 -2.469 1.00 . A A . 31 TRP CZ3 1 1 4 2790 1 1 32 TRP H H -6.353 4.017 -2.765 1.00 . A A . 31 TRP H 1 1 4 2791 1 1 32 TRP HA H -7.129 4.023 -5.553 1.00 . A A . 31 TRP HA 1 1 4 2792 1 1 32 TRP HB2 H -4.654 4.452 -5.983 1.00 . A A . 31 TRP HB2 1 1 4 2793 1 1 32 TRP HB3 H -5.539 5.695 -5.103 1.00 . A A . 31 TRP HB3 1 1 4 2794 1 1 32 TRP HD1 H -3.762 2.510 -3.782 1.00 . A A . 31 TRP HD1 1 1 4 2795 1 1 32 TRP HE1 H -2.107 3.235 -1.962 1.00 . A A . 31 TRP HE1 1 1 4 2796 1 1 32 TRP HE3 H -4.410 7.578 -4.017 1.00 . A A . 31 TRP HE3 1 1 4 2797 1 1 32 TRP HH2 H -1.511 8.020 -0.916 1.00 . A A . 31 TRP HH2 1 1 4 2798 1 1 32 TRP HZ2 H -1.186 5.595 -0.780 1.00 . A A . 31 TRP HZ2 1 1 4 2799 1 1 32 TRP HZ3 H -3.081 8.992 -2.500 1.00 . A A . 31 TRP HZ3 1 1 4 2800 1 1 32 TRP N N -6.913 3.753 -3.528 1.00 . A A . 31 TRP N 1 1 4 2801 1 1 32 TRP NE1 N -2.647 3.862 -2.483 1.00 . A A . 31 TRP NE1 1 1 4 2802 1 1 32 TRP O O -5.499 2.057 -6.399 1.00 . A A . 31 TRP O 1 1 4 2803 1 1 33 ASN C C -7.143 -0.774 -4.887 1.00 . A A . 32 ASN C 1 1 4 2804 1 1 33 ASN CA C -5.831 -0.045 -4.657 1.00 . A A . 32 ASN CA 1 1 4 2805 1 1 33 ASN CB C -5.036 -0.747 -3.552 1.00 . A A . 32 ASN CB 1 1 4 2806 1 1 33 ASN CG C -3.549 -0.544 -3.690 1.00 . A A . 32 ASN CG 1 1 4 2807 1 1 33 ASN H H -6.335 1.613 -3.436 1.00 . A A . 32 ASN H 1 1 4 2808 1 1 33 ASN HA H -5.258 -0.079 -5.571 1.00 . A A . 32 ASN HA 1 1 4 2809 1 1 33 ASN HB2 H -5.339 -0.359 -2.592 1.00 . A A . 32 ASN HB2 1 1 4 2810 1 1 33 ASN HB3 H -5.239 -1.806 -3.585 1.00 . A A . 32 ASN HB3 1 1 4 2811 1 1 33 ASN HD21 H -3.606 0.939 -2.375 1.00 . A A . 32 ASN HD21 1 1 4 2812 1 1 33 ASN HD22 H -2.045 0.576 -3.034 1.00 . A A . 32 ASN HD22 1 1 4 2813 1 1 33 ASN N N -6.070 1.359 -4.345 1.00 . A A . 32 ASN N 1 1 4 2814 1 1 33 ASN ND2 N -3.012 0.417 -2.962 1.00 . A A . 32 ASN ND2 1 1 4 2815 1 1 33 ASN O O -7.157 -1.895 -5.395 1.00 . A A . 32 ASN O 1 1 4 2816 1 1 33 ASN OD1 O -2.884 -1.267 -4.427 1.00 . A A . 32 ASN OD1 1 1 4 2817 1 1 34 GLY C C -9.715 -1.994 -3.872 1.00 . A A . 33 GLY C 1 1 4 2818 1 1 34 GLY CA C -9.553 -0.722 -4.677 1.00 . A A . 33 GLY CA 1 1 4 2819 1 1 34 GLY H H -8.159 0.762 -4.111 1.00 . A A . 33 GLY H 1 1 4 2820 1 1 34 GLY HA2 H -10.301 -0.011 -4.361 1.00 . A A . 33 GLY HA2 1 1 4 2821 1 1 34 GLY HA3 H -9.703 -0.948 -5.722 1.00 . A A . 33 GLY HA3 1 1 4 2822 1 1 34 GLY N N -8.241 -0.129 -4.508 1.00 . A A . 33 GLY N 1 1 4 2823 1 1 34 GLY O O -10.385 -2.933 -4.302 1.00 . A A . 33 GLY O 1 1 4 2824 1 1 35 ILE C C -10.412 -3.290 -1.064 1.00 . A A . 34 ILE C 1 1 4 2825 1 1 35 ILE CA C -9.127 -3.220 -1.870 1.00 . A A . 34 ILE CA 1 1 4 2826 1 1 35 ILE CB C -7.940 -3.276 -0.887 1.00 . A A . 34 ILE CB 1 1 4 2827 1 1 35 ILE CD1 C -5.411 -3.146 -0.703 1.00 . A A . 34 ILE CD1 1 1 4 2828 1 1 35 ILE CG1 C -6.608 -3.175 -1.630 1.00 . A A . 34 ILE CG1 1 1 4 2829 1 1 35 ILE CG2 C -7.993 -4.564 -0.078 1.00 . A A . 34 ILE CG2 1 1 4 2830 1 1 35 ILE H H -8.631 -1.229 -2.378 1.00 . A A . 34 ILE H 1 1 4 2831 1 1 35 ILE HA H -9.072 -4.082 -2.519 1.00 . A A . 34 ILE HA 1 1 4 2832 1 1 35 ILE HB H -8.028 -2.447 -0.203 1.00 . A A . 34 ILE HB 1 1 4 2833 1 1 35 ILE HD11 H -5.501 -2.306 -0.030 1.00 . A A . 34 ILE HD11 1 1 4 2834 1 1 35 ILE HD12 H -4.506 -3.047 -1.284 1.00 . A A . 34 ILE HD12 1 1 4 2835 1 1 35 ILE HD13 H -5.376 -4.062 -0.131 1.00 . A A . 34 ILE HD13 1 1 4 2836 1 1 35 ILE HG12 H -6.502 -4.027 -2.284 1.00 . A A . 34 ILE HG12 1 1 4 2837 1 1 35 ILE HG13 H -6.598 -2.270 -2.218 1.00 . A A . 34 ILE HG13 1 1 4 2838 1 1 35 ILE HG21 H -7.925 -5.411 -0.745 1.00 . A A . 34 ILE HG21 1 1 4 2839 1 1 35 ILE HG22 H -8.926 -4.611 0.465 1.00 . A A . 34 ILE HG22 1 1 4 2840 1 1 35 ILE HG23 H -7.168 -4.587 0.618 1.00 . A A . 34 ILE HG23 1 1 4 2841 1 1 35 ILE N N -9.100 -2.028 -2.698 1.00 . A A . 34 ILE N 1 1 4 2842 1 1 35 ILE O O -10.768 -2.343 -0.356 1.00 . A A . 34 ILE O 1 1 4 2843 1 1 36 SER C C -11.772 -5.580 0.809 1.00 . A A . 35 SER C 1 1 4 2844 1 1 36 SER CA C -12.240 -4.683 -0.333 1.00 . A A . 35 SER CA 1 1 4 2845 1 1 36 SER CB C -13.349 -5.359 -1.141 1.00 . A A . 35 SER CB 1 1 4 2846 1 1 36 SER H H -10.852 -5.056 -1.871 1.00 . A A . 35 SER H 1 1 4 2847 1 1 36 SER HA H -12.602 -3.749 0.071 1.00 . A A . 35 SER HA 1 1 4 2848 1 1 36 SER HB2 H -13.510 -4.806 -2.054 1.00 . A A . 35 SER HB2 1 1 4 2849 1 1 36 SER HB3 H -13.048 -6.369 -1.381 1.00 . A A . 35 SER HB3 1 1 4 2850 1 1 36 SER HG H -14.840 -4.497 -0.186 1.00 . A A . 35 SER HG 1 1 4 2851 1 1 36 SER N N -11.108 -4.404 -1.188 1.00 . A A . 35 SER N 1 1 4 2852 1 1 36 SER O O -11.451 -6.753 0.602 1.00 . A A . 35 SER O 1 1 4 2853 1 1 36 SER OG O -14.569 -5.404 -0.416 1.00 . A A . 35 SER OG 1 1 4 2854 1 1 37 GLY C C -9.730 -5.376 3.387 1.00 . A A . 36 GLY C 1 1 4 2855 1 1 37 GLY CA C -11.177 -5.749 3.140 1.00 . A A . 36 GLY CA 1 1 4 2856 1 1 37 GLY H H -11.997 -4.085 2.117 1.00 . A A . 36 GLY H 1 1 4 2857 1 1 37 GLY HA2 H -11.761 -5.513 4.018 1.00 . A A . 36 GLY HA2 1 1 4 2858 1 1 37 GLY HA3 H -11.240 -6.810 2.946 1.00 . A A . 36 GLY HA3 1 1 4 2859 1 1 37 GLY N N -11.708 -5.022 2.006 1.00 . A A . 36 GLY N 1 1 4 2860 1 1 37 GLY O O -9.235 -4.404 2.817 1.00 . A A . 36 GLY O 1 1 4 2861 1 1 38 ASP C C -6.770 -7.008 4.024 1.00 . A A . 37 ASP C 1 1 4 2862 1 1 38 ASP CA C -7.641 -5.858 4.507 1.00 . A A . 37 ASP CA 1 1 4 2863 1 1 38 ASP CB C -7.411 -5.613 6.004 1.00 . A A . 37 ASP CB 1 1 4 2864 1 1 38 ASP CG C -7.905 -4.255 6.469 1.00 . A A . 37 ASP CG 1 1 4 2865 1 1 38 ASP H H -9.488 -6.884 4.671 1.00 . A A . 37 ASP H 1 1 4 2866 1 1 38 ASP HA H -7.367 -4.969 3.961 1.00 . A A . 37 ASP HA 1 1 4 2867 1 1 38 ASP HB2 H -7.929 -6.372 6.568 1.00 . A A . 37 ASP HB2 1 1 4 2868 1 1 38 ASP HB3 H -6.352 -5.678 6.211 1.00 . A A . 37 ASP HB3 1 1 4 2869 1 1 38 ASP N N -9.046 -6.129 4.227 1.00 . A A . 37 ASP N 1 1 4 2870 1 1 38 ASP O O -6.074 -7.655 4.809 1.00 . A A . 37 ASP O 1 1 4 2871 1 1 38 ASP OD1 O -9.126 -4.092 6.668 1.00 . A A . 37 ASP OD1 1 1 4 2872 1 1 38 ASP OD2 O -7.067 -3.346 6.665 1.00 . A A . 37 ASP OD2 1 1 4 2873 1 1 39 LEU C C -4.708 -7.802 1.607 1.00 . A A . 38 LEU C 1 1 4 2874 1 1 39 LEU CA C -6.033 -8.339 2.146 1.00 . A A . 38 LEU CA 1 1 4 2875 1 1 39 LEU CB C -6.835 -9.083 1.062 1.00 . A A . 38 LEU CB 1 1 4 2876 1 1 39 LEU CD1 C -6.629 -8.235 -1.298 1.00 . A A . 38 LEU CD1 1 1 4 2877 1 1 39 LEU CD2 C -8.881 -8.702 -0.337 1.00 . A A . 38 LEU CD2 1 1 4 2878 1 1 39 LEU CG C -7.472 -8.219 -0.035 1.00 . A A . 38 LEU CG 1 1 4 2879 1 1 39 LEU H H -7.401 -6.730 2.153 1.00 . A A . 38 LEU H 1 1 4 2880 1 1 39 LEU HA H -5.810 -9.035 2.941 1.00 . A A . 38 LEU HA 1 1 4 2881 1 1 39 LEU HB2 H -6.173 -9.789 0.585 1.00 . A A . 38 LEU HB2 1 1 4 2882 1 1 39 LEU HB3 H -7.622 -9.636 1.551 1.00 . A A . 38 LEU HB3 1 1 4 2883 1 1 39 LEU HD11 H -6.567 -9.244 -1.677 1.00 . A A . 38 LEU HD11 1 1 4 2884 1 1 39 LEU HD12 H -5.636 -7.872 -1.074 1.00 . A A . 38 LEU HD12 1 1 4 2885 1 1 39 LEU HD13 H -7.084 -7.599 -2.043 1.00 . A A . 38 LEU HD13 1 1 4 2886 1 1 39 LEU HD21 H -9.306 -8.100 -1.126 1.00 . A A . 38 LEU HD21 1 1 4 2887 1 1 39 LEU HD22 H -9.490 -8.616 0.550 1.00 . A A . 38 LEU HD22 1 1 4 2888 1 1 39 LEU HD23 H -8.847 -9.735 -0.652 1.00 . A A . 38 LEU HD23 1 1 4 2889 1 1 39 LEU HG H -7.537 -7.198 0.313 1.00 . A A . 38 LEU HG 1 1 4 2890 1 1 39 LEU N N -6.823 -7.270 2.728 1.00 . A A . 38 LEU N 1 1 4 2891 1 1 39 LEU O O -4.659 -7.085 0.609 1.00 . A A . 38 LEU O 1 1 4 2892 1 1 40 ILE C C -1.322 -8.859 2.149 1.00 . A A . 39 ILE C 1 1 4 2893 1 1 40 ILE CA C -2.303 -7.719 1.915 1.00 . A A . 39 ILE CA 1 1 4 2894 1 1 40 ILE CB C -1.856 -6.422 2.646 1.00 . A A . 39 ILE CB 1 1 4 2895 1 1 40 ILE CD1 C -1.783 -3.892 2.339 1.00 . A A . 39 ILE CD1 1 1 4 2896 1 1 40 ILE CG1 C -2.409 -5.198 1.908 1.00 . A A . 39 ILE CG1 1 1 4 2897 1 1 40 ILE CG2 C -0.341 -6.327 2.782 1.00 . A A . 39 ILE CG2 1 1 4 2898 1 1 40 ILE H H -3.750 -8.667 3.126 1.00 . A A . 39 ILE H 1 1 4 2899 1 1 40 ILE HA H -2.333 -7.511 0.854 1.00 . A A . 39 ILE HA 1 1 4 2900 1 1 40 ILE HB H -2.274 -6.442 3.640 1.00 . A A . 39 ILE HB 1 1 4 2901 1 1 40 ILE HD11 H -1.886 -3.778 3.410 1.00 . A A . 39 ILE HD11 1 1 4 2902 1 1 40 ILE HD12 H -2.279 -3.069 1.839 1.00 . A A . 39 ILE HD12 1 1 4 2903 1 1 40 ILE HD13 H -0.735 -3.891 2.077 1.00 . A A . 39 ILE HD13 1 1 4 2904 1 1 40 ILE HG12 H -2.231 -5.316 0.850 1.00 . A A . 39 ILE HG12 1 1 4 2905 1 1 40 ILE HG13 H -3.473 -5.133 2.084 1.00 . A A . 39 ILE HG13 1 1 4 2906 1 1 40 ILE HG21 H 0.111 -6.325 1.802 1.00 . A A . 39 ILE HG21 1 1 4 2907 1 1 40 ILE HG22 H 0.026 -7.176 3.349 1.00 . A A . 39 ILE HG22 1 1 4 2908 1 1 40 ILE HG23 H -0.083 -5.409 3.302 1.00 . A A . 39 ILE HG23 1 1 4 2909 1 1 40 ILE N N -3.639 -8.125 2.313 1.00 . A A . 39 ILE N 1 1 4 2910 1 1 40 ILE O O -1.169 -9.350 3.268 1.00 . A A . 39 ILE O 1 1 4 2911 1 1 41 PHE C C 1.489 -10.123 0.338 1.00 . A A . 40 PHE C 1 1 4 2912 1 1 41 PHE CA C 0.208 -10.434 1.101 1.00 . A A . 40 PHE CA 1 1 4 2913 1 1 41 PHE CB C -0.488 -11.671 0.515 1.00 . A A . 40 PHE CB 1 1 4 2914 1 1 41 PHE CD1 C -0.548 -11.487 -1.993 1.00 . A A . 40 PHE CD1 1 1 4 2915 1 1 41 PHE CD2 C -2.561 -11.085 -0.783 1.00 . A A . 40 PHE CD2 1 1 4 2916 1 1 41 PHE CE1 C -1.211 -11.245 -3.181 1.00 . A A . 40 PHE CE1 1 1 4 2917 1 1 41 PHE CE2 C -3.230 -10.841 -1.968 1.00 . A A . 40 PHE CE2 1 1 4 2918 1 1 41 PHE CG C -1.212 -11.411 -0.781 1.00 . A A . 40 PHE CG 1 1 4 2919 1 1 41 PHE CZ C -2.553 -10.921 -3.168 1.00 . A A . 40 PHE CZ 1 1 4 2920 1 1 41 PHE H H -0.825 -8.823 0.221 1.00 . A A . 40 PHE H 1 1 4 2921 1 1 41 PHE HA H 0.459 -10.628 2.134 1.00 . A A . 40 PHE HA 1 1 4 2922 1 1 41 PHE HB2 H 0.249 -12.438 0.333 1.00 . A A . 40 PHE HB2 1 1 4 2923 1 1 41 PHE HB3 H -1.210 -12.038 1.229 1.00 . A A . 40 PHE HB3 1 1 4 2924 1 1 41 PHE HD1 H 0.503 -11.740 -2.006 1.00 . A A . 40 PHE HD1 1 1 4 2925 1 1 41 PHE HD2 H -3.092 -11.022 0.155 1.00 . A A . 40 PHE HD2 1 1 4 2926 1 1 41 PHE HE1 H -0.681 -11.308 -4.119 1.00 . A A . 40 PHE HE1 1 1 4 2927 1 1 41 PHE HE2 H -4.280 -10.588 -1.955 1.00 . A A . 40 PHE HE2 1 1 4 2928 1 1 41 PHE HZ H -3.072 -10.731 -4.097 1.00 . A A . 40 PHE HZ 1 1 4 2929 1 1 41 PHE N N -0.691 -9.292 1.069 1.00 . A A . 40 PHE N 1 1 4 2930 1 1 41 PHE O O 1.491 -9.288 -0.569 1.00 . A A . 40 PHE O 1 1 4 2931 1 1 42 VAL C C 3.933 -10.769 -1.347 1.00 . A A . 41 VAL C 1 1 4 2932 1 1 42 VAL CA C 3.886 -10.530 0.159 1.00 . A A . 41 VAL CA 1 1 4 2933 1 1 42 VAL CB C 4.959 -11.396 0.855 1.00 . A A . 41 VAL CB 1 1 4 2934 1 1 42 VAL CG1 C 6.353 -11.029 0.373 1.00 . A A . 41 VAL CG1 1 1 4 2935 1 1 42 VAL CG2 C 4.859 -11.255 2.368 1.00 . A A . 41 VAL CG2 1 1 4 2936 1 1 42 VAL H H 2.458 -11.549 1.338 1.00 . A A . 41 VAL H 1 1 4 2937 1 1 42 VAL HA H 4.113 -9.492 0.354 1.00 . A A . 41 VAL HA 1 1 4 2938 1 1 42 VAL HB H 4.777 -12.430 0.601 1.00 . A A . 41 VAL HB 1 1 4 2939 1 1 42 VAL HG11 H 7.083 -11.625 0.900 1.00 . A A . 41 VAL HG11 1 1 4 2940 1 1 42 VAL HG12 H 6.536 -9.982 0.562 1.00 . A A . 41 VAL HG12 1 1 4 2941 1 1 42 VAL HG13 H 6.428 -11.223 -0.688 1.00 . A A . 41 VAL HG13 1 1 4 2942 1 1 42 VAL HG21 H 5.611 -11.874 2.837 1.00 . A A . 41 VAL HG21 1 1 4 2943 1 1 42 VAL HG22 H 3.879 -11.571 2.696 1.00 . A A . 41 VAL HG22 1 1 4 2944 1 1 42 VAL HG23 H 5.017 -10.224 2.646 1.00 . A A . 41 VAL HG23 1 1 4 2945 1 1 42 VAL N N 2.561 -10.811 0.698 1.00 . A A . 41 VAL N 1 1 4 2946 1 1 42 VAL O O 3.462 -11.795 -1.837 1.00 . A A . 41 VAL O 1 1 4 2947 1 1 43 GLY C C 3.573 -9.123 -4.257 1.00 . A A . 42 GLY C 1 1 4 2948 1 1 43 GLY CA C 4.598 -9.952 -3.516 1.00 . A A . 42 GLY CA 1 1 4 2949 1 1 43 GLY H H 4.836 -9.002 -1.636 1.00 . A A . 42 GLY H 1 1 4 2950 1 1 43 GLY HA2 H 5.584 -9.644 -3.823 1.00 . A A . 42 GLY HA2 1 1 4 2951 1 1 43 GLY HA3 H 4.459 -10.990 -3.775 1.00 . A A . 42 GLY HA3 1 1 4 2952 1 1 43 GLY N N 4.488 -9.811 -2.079 1.00 . A A . 42 GLY N 1 1 4 2953 1 1 43 GLY O O 3.744 -8.820 -5.440 1.00 . A A . 42 GLY O 1 1 4 2954 1 1 44 GLN C C 1.944 -6.508 -4.342 1.00 . A A . 43 GLN C 1 1 4 2955 1 1 44 GLN CA C 1.455 -7.936 -4.147 1.00 . A A . 43 GLN CA 1 1 4 2956 1 1 44 GLN CB C 0.215 -7.947 -3.242 1.00 . A A . 43 GLN CB 1 1 4 2957 1 1 44 GLN CD C -2.063 -6.980 -2.729 1.00 . A A . 43 GLN CD 1 1 4 2958 1 1 44 GLN CG C -0.814 -6.878 -3.583 1.00 . A A . 43 GLN CG 1 1 4 2959 1 1 44 GLN H H 2.418 -9.060 -2.633 1.00 . A A . 43 GLN H 1 1 4 2960 1 1 44 GLN HA H 1.196 -8.354 -5.108 1.00 . A A . 43 GLN HA 1 1 4 2961 1 1 44 GLN HB2 H -0.264 -8.912 -3.324 1.00 . A A . 43 GLN HB2 1 1 4 2962 1 1 44 GLN HB3 H 0.528 -7.800 -2.220 1.00 . A A . 43 GLN HB3 1 1 4 2963 1 1 44 GLN HE21 H -1.273 -5.762 -1.374 1.00 . A A . 43 GLN HE21 1 1 4 2964 1 1 44 GLN HE22 H -2.866 -6.340 -1.027 1.00 . A A . 43 GLN HE22 1 1 4 2965 1 1 44 GLN HG2 H -0.369 -5.904 -3.426 1.00 . A A . 43 GLN HG2 1 1 4 2966 1 1 44 GLN HG3 H -1.093 -6.979 -4.621 1.00 . A A . 43 GLN HG3 1 1 4 2967 1 1 44 GLN N N 2.504 -8.761 -3.565 1.00 . A A . 43 GLN N 1 1 4 2968 1 1 44 GLN NE2 N -2.065 -6.293 -1.595 1.00 . A A . 43 GLN NE2 1 1 4 2969 1 1 44 GLN O O 2.452 -5.892 -3.410 1.00 . A A . 43 GLN O 1 1 4 2970 1 1 44 GLN OE1 O -3.021 -7.666 -3.086 1.00 . A A . 43 GLN OE1 1 1 4 2971 1 1 45 LYS C C 0.871 -3.757 -5.408 1.00 . A A . 44 LYS C 1 1 4 2972 1 1 45 LYS CA C 2.072 -4.586 -5.801 1.00 . A A . 44 LYS CA 1 1 4 2973 1 1 45 LYS CB C 2.402 -4.324 -7.270 1.00 . A A . 44 LYS CB 1 1 4 2974 1 1 45 LYS CD C 4.061 -4.472 -9.146 1.00 . A A . 44 LYS CD 1 1 4 2975 1 1 45 LYS CE C 3.005 -5.049 -10.083 1.00 . A A . 44 LYS CE 1 1 4 2976 1 1 45 LYS CG C 3.775 -4.805 -7.690 1.00 . A A . 44 LYS CG 1 1 4 2977 1 1 45 LYS H H 1.512 -6.568 -6.297 1.00 . A A . 44 LYS H 1 1 4 2978 1 1 45 LYS HA H 2.914 -4.296 -5.190 1.00 . A A . 44 LYS HA 1 1 4 2979 1 1 45 LYS HB2 H 1.667 -4.820 -7.887 1.00 . A A . 44 LYS HB2 1 1 4 2980 1 1 45 LYS HB3 H 2.349 -3.260 -7.451 1.00 . A A . 44 LYS HB3 1 1 4 2981 1 1 45 LYS HD2 H 4.076 -3.399 -9.258 1.00 . A A . 44 LYS HD2 1 1 4 2982 1 1 45 LYS HD3 H 5.026 -4.877 -9.413 1.00 . A A . 44 LYS HD3 1 1 4 2983 1 1 45 LYS HE2 H 2.057 -4.580 -9.866 1.00 . A A . 44 LYS HE2 1 1 4 2984 1 1 45 LYS HE3 H 3.289 -4.826 -11.102 1.00 . A A . 44 LYS HE3 1 1 4 2985 1 1 45 LYS HG2 H 4.515 -4.316 -7.070 1.00 . A A . 44 LYS HG2 1 1 4 2986 1 1 45 LYS HG3 H 3.834 -5.874 -7.552 1.00 . A A . 44 LYS HG3 1 1 4 2987 1 1 45 LYS HZ1 H 3.785 -6.993 -10.049 1.00 . A A . 44 LYS HZ1 1 1 4 2988 1 1 45 LYS HZ2 H 2.204 -6.892 -10.653 1.00 . A A . 44 LYS HZ2 1 1 4 2989 1 1 45 LYS HZ3 H 2.481 -6.753 -8.990 1.00 . A A . 44 LYS HZ3 1 1 4 2990 1 1 45 LYS N N 1.803 -5.992 -5.552 1.00 . A A . 44 LYS N 1 1 4 2991 1 1 45 LYS NZ N 2.860 -6.522 -9.933 1.00 . A A . 44 LYS NZ 1 1 4 2992 1 1 45 LYS O O -0.161 -3.782 -6.082 1.00 . A A . 44 LYS O 1 1 4 2993 1 1 46 LEU C C 0.362 -0.707 -4.196 1.00 . A A . 45 LEU C 1 1 4 2994 1 1 46 LEU CA C -0.064 -2.142 -3.912 1.00 . A A . 45 LEU CA 1 1 4 2995 1 1 46 LEU CB C -0.447 -2.371 -2.432 1.00 . A A . 45 LEU CB 1 1 4 2996 1 1 46 LEU CD1 C 0.552 -0.512 -1.050 1.00 . A A . 45 LEU CD1 1 1 4 2997 1 1 46 LEU CD2 C 0.336 -2.803 -0.113 1.00 . A A . 45 LEU CD2 1 1 4 2998 1 1 46 LEU CG C 0.590 -1.999 -1.367 1.00 . A A . 45 LEU CG 1 1 4 2999 1 1 46 LEU H H 1.805 -3.115 -3.766 1.00 . A A . 45 LEU H 1 1 4 3000 1 1 46 LEU HA H -0.922 -2.362 -4.528 1.00 . A A . 45 LEU HA 1 1 4 3001 1 1 46 LEU HB2 H -1.345 -1.812 -2.228 1.00 . A A . 45 LEU HB2 1 1 4 3002 1 1 46 LEU HB3 H -0.673 -3.425 -2.310 1.00 . A A . 45 LEU HB3 1 1 4 3003 1 1 46 LEU HD11 H 0.812 0.052 -1.935 1.00 . A A . 45 LEU HD11 1 1 4 3004 1 1 46 LEU HD12 H 1.257 -0.291 -0.262 1.00 . A A . 45 LEU HD12 1 1 4 3005 1 1 46 LEU HD13 H -0.445 -0.239 -0.731 1.00 . A A . 45 LEU HD13 1 1 4 3006 1 1 46 LEU HD21 H -0.646 -2.570 0.271 1.00 . A A . 45 LEU HD21 1 1 4 3007 1 1 46 LEU HD22 H 1.082 -2.561 0.629 1.00 . A A . 45 LEU HD22 1 1 4 3008 1 1 46 LEU HD23 H 0.389 -3.858 -0.348 1.00 . A A . 45 LEU HD23 1 1 4 3009 1 1 46 LEU HG H 1.578 -2.248 -1.726 1.00 . A A . 45 LEU HG 1 1 4 3010 1 1 46 LEU N N 0.990 -3.040 -4.314 1.00 . A A . 45 LEU N 1 1 4 3011 1 1 46 LEU O O 1.505 -0.329 -3.937 1.00 . A A . 45 LEU O 1 1 4 3012 1 1 47 ILE C C -0.001 2.219 -3.788 1.00 . A A . 46 ILE C 1 1 4 3013 1 1 47 ILE CA C -0.255 1.461 -5.082 1.00 . A A . 46 ILE CA 1 1 4 3014 1 1 47 ILE CB C -1.409 2.172 -5.857 1.00 . A A . 46 ILE CB 1 1 4 3015 1 1 47 ILE CD1 C -2.070 0.174 -7.336 1.00 . A A . 46 ILE CD1 1 1 4 3016 1 1 47 ILE CG1 C -1.602 1.611 -7.274 1.00 . A A . 46 ILE CG1 1 1 4 3017 1 1 47 ILE CG2 C -1.139 3.671 -5.958 1.00 . A A . 46 ILE CG2 1 1 4 3018 1 1 47 ILE H H -1.413 -0.309 -5.014 1.00 . A A . 46 ILE H 1 1 4 3019 1 1 47 ILE HA H 0.637 1.497 -5.689 1.00 . A A . 46 ILE HA 1 1 4 3020 1 1 47 ILE HB H -2.322 2.037 -5.298 1.00 . A A . 46 ILE HB 1 1 4 3021 1 1 47 ILE HD11 H -2.138 -0.138 -8.368 1.00 . A A . 46 ILE HD11 1 1 4 3022 1 1 47 ILE HD12 H -3.041 0.088 -6.869 1.00 . A A . 46 ILE HD12 1 1 4 3023 1 1 47 ILE HD13 H -1.363 -0.457 -6.816 1.00 . A A . 46 ILE HD13 1 1 4 3024 1 1 47 ILE HG12 H -2.345 2.215 -7.780 1.00 . A A . 46 ILE HG12 1 1 4 3025 1 1 47 ILE HG13 H -0.666 1.681 -7.809 1.00 . A A . 46 ILE HG13 1 1 4 3026 1 1 47 ILE HG21 H -0.956 4.072 -4.970 1.00 . A A . 46 ILE HG21 1 1 4 3027 1 1 47 ILE HG22 H -1.995 4.164 -6.393 1.00 . A A . 46 ILE HG22 1 1 4 3028 1 1 47 ILE HG23 H -0.272 3.839 -6.583 1.00 . A A . 46 ILE HG23 1 1 4 3029 1 1 47 ILE N N -0.537 0.067 -4.781 1.00 . A A . 46 ILE N 1 1 4 3030 1 1 47 ILE O O -0.695 2.022 -2.789 1.00 . A A . 46 ILE O 1 1 4 3031 1 1 48 VAL C C 1.846 5.246 -3.305 1.00 . A A . 47 VAL C 1 1 4 3032 1 1 48 VAL CA C 1.278 3.958 -2.727 1.00 . A A . 47 VAL CA 1 1 4 3033 1 1 48 VAL CB C 2.233 3.358 -1.666 1.00 . A A . 47 VAL CB 1 1 4 3034 1 1 48 VAL CG1 C 3.551 2.915 -2.287 1.00 . A A . 47 VAL CG1 1 1 4 3035 1 1 48 VAL CG2 C 2.468 4.356 -0.543 1.00 . A A . 47 VAL CG2 1 1 4 3036 1 1 48 VAL H H 1.603 3.065 -4.593 1.00 . A A . 47 VAL H 1 1 4 3037 1 1 48 VAL HA H 0.334 4.182 -2.241 1.00 . A A . 47 VAL HA 1 1 4 3038 1 1 48 VAL HB H 1.753 2.487 -1.237 1.00 . A A . 47 VAL HB 1 1 4 3039 1 1 48 VAL HG11 H 4.208 2.550 -1.511 1.00 . A A . 47 VAL HG11 1 1 4 3040 1 1 48 VAL HG12 H 4.014 3.752 -2.787 1.00 . A A . 47 VAL HG12 1 1 4 3041 1 1 48 VAL HG13 H 3.365 2.127 -3.000 1.00 . A A . 47 VAL HG13 1 1 4 3042 1 1 48 VAL HG21 H 3.192 3.953 0.150 1.00 . A A . 47 VAL HG21 1 1 4 3043 1 1 48 VAL HG22 H 1.536 4.537 -0.024 1.00 . A A . 47 VAL HG22 1 1 4 3044 1 1 48 VAL HG23 H 2.839 5.284 -0.954 1.00 . A A . 47 VAL HG23 1 1 4 3045 1 1 48 VAL N N 1.011 3.051 -3.807 1.00 . A A . 47 VAL N 1 1 4 3046 1 1 48 VAL O O 2.767 5.239 -4.121 1.00 . A A . 47 VAL O 1 1 4 3047 1 1 49 LYS C C 1.423 8.686 -2.297 1.00 . A A . 48 LYS C 1 1 4 3048 1 1 49 LYS CA C 1.716 7.640 -3.362 1.00 . A A . 48 LYS CA 1 1 4 3049 1 1 49 LYS CB C 1.114 8.054 -4.709 1.00 . A A . 48 LYS CB 1 1 4 3050 1 1 49 LYS CD C -1.003 8.732 -5.902 1.00 . A A . 48 LYS CD 1 1 4 3051 1 1 49 LYS CE C -2.496 8.492 -6.042 1.00 . A A . 48 LYS CE 1 1 4 3052 1 1 49 LYS CG C -0.401 7.899 -4.781 1.00 . A A . 48 LYS CG 1 1 4 3053 1 1 49 LYS H H 0.405 6.264 -2.446 1.00 . A A . 48 LYS H 1 1 4 3054 1 1 49 LYS HA H 2.781 7.562 -3.474 1.00 . A A . 48 LYS HA 1 1 4 3055 1 1 49 LYS HB2 H 1.361 9.088 -4.896 1.00 . A A . 48 LYS HB2 1 1 4 3056 1 1 49 LYS HB3 H 1.558 7.441 -5.482 1.00 . A A . 48 LYS HB3 1 1 4 3057 1 1 49 LYS HD2 H -0.837 9.777 -5.688 1.00 . A A . 48 LYS HD2 1 1 4 3058 1 1 49 LYS HD3 H -0.517 8.471 -6.832 1.00 . A A . 48 LYS HD3 1 1 4 3059 1 1 49 LYS HE2 H -2.654 7.482 -6.390 1.00 . A A . 48 LYS HE2 1 1 4 3060 1 1 49 LYS HE3 H -2.956 8.610 -5.071 1.00 . A A . 48 LYS HE3 1 1 4 3061 1 1 49 LYS HG2 H -0.639 6.859 -4.953 1.00 . A A . 48 LYS HG2 1 1 4 3062 1 1 49 LYS HG3 H -0.829 8.215 -3.841 1.00 . A A . 48 LYS HG3 1 1 4 3063 1 1 49 LYS HZ1 H -4.151 9.205 -7.100 1.00 . A A . 48 LYS HZ1 1 1 4 3064 1 1 49 LYS HZ2 H -2.685 9.368 -7.935 1.00 . A A . 48 LYS HZ2 1 1 4 3065 1 1 49 LYS HZ3 H -3.050 10.414 -6.647 1.00 . A A . 48 LYS HZ3 1 1 4 3066 1 1 49 LYS N N 1.225 6.337 -2.962 1.00 . A A . 48 LYS N 1 1 4 3067 1 1 49 LYS NZ N -3.138 9.435 -6.997 1.00 . A A . 48 LYS NZ 1 1 4 3068 1 1 49 LYS O O 0.270 8.974 -1.992 1.00 . A A . 48 LYS O 1 1 4 3069 1 1 50 LYS C C 2.012 11.615 -1.453 1.00 . A A . 49 LYS C 1 1 4 3070 1 1 50 LYS CA C 2.306 10.301 -0.745 1.00 . A A . 49 LYS CA 1 1 4 3071 1 1 50 LYS CB C 3.552 10.417 0.138 1.00 . A A . 49 LYS CB 1 1 4 3072 1 1 50 LYS CD C 4.528 11.277 2.281 1.00 . A A . 49 LYS CD 1 1 4 3073 1 1 50 LYS CE C 4.383 12.271 3.420 1.00 . A A . 49 LYS CE 1 1 4 3074 1 1 50 LYS CG C 3.397 11.408 1.281 1.00 . A A . 49 LYS CG 1 1 4 3075 1 1 50 LYS H H 3.373 8.968 -1.989 1.00 . A A . 49 LYS H 1 1 4 3076 1 1 50 LYS HA H 1.457 10.042 -0.127 1.00 . A A . 49 LYS HA 1 1 4 3077 1 1 50 LYS HB2 H 3.773 9.449 0.559 1.00 . A A . 49 LYS HB2 1 1 4 3078 1 1 50 LYS HB3 H 4.385 10.734 -0.474 1.00 . A A . 49 LYS HB3 1 1 4 3079 1 1 50 LYS HD2 H 4.525 10.277 2.688 1.00 . A A . 49 LYS HD2 1 1 4 3080 1 1 50 LYS HD3 H 5.465 11.457 1.776 1.00 . A A . 49 LYS HD3 1 1 4 3081 1 1 50 LYS HE2 H 4.505 13.268 3.028 1.00 . A A . 49 LYS HE2 1 1 4 3082 1 1 50 LYS HE3 H 3.397 12.168 3.849 1.00 . A A . 49 LYS HE3 1 1 4 3083 1 1 50 LYS HG2 H 3.401 12.408 0.879 1.00 . A A . 49 LYS HG2 1 1 4 3084 1 1 50 LYS HG3 H 2.459 11.219 1.783 1.00 . A A . 49 LYS HG3 1 1 4 3085 1 1 50 LYS HZ1 H 5.326 12.777 5.213 1.00 . A A . 49 LYS HZ1 1 1 4 3086 1 1 50 LYS HZ2 H 6.357 12.062 4.067 1.00 . A A . 49 LYS HZ2 1 1 4 3087 1 1 50 LYS HZ3 H 5.244 11.112 4.920 1.00 . A A . 49 LYS HZ3 1 1 4 3088 1 1 50 LYS N N 2.471 9.254 -1.733 1.00 . A A . 49 LYS N 1 1 4 3089 1 1 50 LYS NZ N 5.398 12.040 4.477 1.00 . A A . 49 LYS NZ 1 1 4 3090 1 1 50 LYS O O 2.881 12.194 -2.105 1.00 . A A . 49 LYS O 1 1 4 3091 1 1 51 GLY C C -1.110 13.164 -2.432 1.00 . A A . 50 GLY C 1 1 4 3092 1 1 51 GLY CA C 0.347 13.250 -2.039 1.00 . A A . 50 GLY CA 1 1 4 3093 1 1 51 GLY H H 0.135 11.567 -0.788 1.00 . A A . 50 GLY H 1 1 4 3094 1 1 51 GLY HA2 H 0.491 14.107 -1.397 1.00 . A A . 50 GLY HA2 1 1 4 3095 1 1 51 GLY HA3 H 0.944 13.371 -2.930 1.00 . A A . 50 GLY HA3 1 1 4 3096 1 1 51 GLY N N 0.775 12.060 -1.343 1.00 . A A . 50 GLY N 1 1 4 3097 1 1 51 GLY O O -1.443 12.757 -3.546 1.00 . A A . 50 GLY O 1 1 4 3098 1 1 52 SER C C -4.061 14.684 -1.037 1.00 . A A . 51 SER C 1 1 4 3099 1 1 52 SER CA C -3.411 13.504 -1.749 1.00 . A A . 51 SER CA 1 1 4 3100 1 1 52 SER CB C -4.025 12.184 -1.280 1.00 . A A . 51 SER CB 1 1 4 3101 1 1 52 SER H H -1.651 13.776 -0.616 1.00 . A A . 51 SER H 1 1 4 3102 1 1 52 SER HA H -3.565 13.609 -2.812 1.00 . A A . 51 SER HA 1 1 4 3103 1 1 52 SER HB2 H -3.879 12.074 -0.216 1.00 . A A . 51 SER HB2 1 1 4 3104 1 1 52 SER HB3 H -5.083 12.182 -1.499 1.00 . A A . 51 SER HB3 1 1 4 3105 1 1 52 SER HG H -2.789 11.420 -2.590 1.00 . A A . 51 SER HG 1 1 4 3106 1 1 52 SER N N -1.980 13.507 -1.502 1.00 . A A . 51 SER N 1 1 4 3107 1 1 52 SER O O -4.639 14.484 0.050 1.00 . A A . 51 SER O 1 1 4 3108 1 1 52 SER OG O -3.417 11.086 -1.938 1.00 . A A . 51 SER OG 1 1 5 3109 1 1 2 GLY C C 4.992 9.089 -10.816 1.00 . A A . 1 GLY C 1 1 5 3110 1 1 2 GLY CA C 5.734 8.379 -11.923 1.00 . A A . 1 GLY CA 1 1 5 3111 1 1 2 GLY H H 7.676 7.793 -12.405 1.00 . A A . 1 GLY H 1 1 5 3112 1 1 2 GLY HA2 H 5.625 8.944 -12.837 1.00 . A A . 1 GLY HA2 1 1 5 3113 1 1 2 GLY HA3 H 5.307 7.396 -12.063 1.00 . A A . 1 GLY HA3 1 1 5 3114 1 1 2 GLY N N 7.173 8.239 -11.608 1.00 . A A . 1 GLY N 1 1 5 3115 1 1 2 GLY O O 5.427 9.063 -9.662 1.00 . A A . 1 GLY O 1 1 5 3116 1 1 3 THR C C 2.529 9.511 -9.122 1.00 . A A . 2 THR C 1 1 5 3117 1 1 3 THR CA C 3.073 10.455 -10.191 1.00 . A A . 2 THR CA 1 1 5 3118 1 1 3 THR CB C 1.911 11.187 -10.887 1.00 . A A . 2 THR CB 1 1 5 3119 1 1 3 THR CG2 C 1.146 12.063 -9.906 1.00 . A A . 2 THR CG2 1 1 5 3120 1 1 3 THR H H 3.599 9.720 -12.104 1.00 . A A . 2 THR H 1 1 5 3121 1 1 3 THR HA H 3.705 11.193 -9.717 1.00 . A A . 2 THR HA 1 1 5 3122 1 1 3 THR HB H 1.234 10.454 -11.297 1.00 . A A . 2 THR HB 1 1 5 3123 1 1 3 THR HG1 H 3.067 12.636 -11.585 1.00 . A A . 2 THR HG1 1 1 5 3124 1 1 3 THR HG21 H 1.813 12.801 -9.485 1.00 . A A . 2 THR HG21 1 1 5 3125 1 1 3 THR HG22 H 0.743 11.449 -9.114 1.00 . A A . 2 THR HG22 1 1 5 3126 1 1 3 THR HG23 H 0.338 12.560 -10.422 1.00 . A A . 2 THR HG23 1 1 5 3127 1 1 3 THR N N 3.882 9.730 -11.162 1.00 . A A . 2 THR N 1 1 5 3128 1 1 3 THR O O 2.522 9.837 -7.934 1.00 . A A . 2 THR O 1 1 5 3129 1 1 3 THR OG1 O 2.427 11.999 -11.949 1.00 . A A . 2 THR OG1 1 1 5 3130 1 1 4 ASN C C 2.849 6.345 -8.417 1.00 . A A . 3 ASN C 1 1 5 3131 1 1 4 ASN CA C 1.679 7.297 -8.620 1.00 . A A . 3 ASN CA 1 1 5 3132 1 1 4 ASN CB C 0.449 6.520 -9.124 1.00 . A A . 3 ASN CB 1 1 5 3133 1 1 4 ASN CG C 0.702 5.724 -10.400 1.00 . A A . 3 ASN CG 1 1 5 3134 1 1 4 ASN H H 2.004 8.178 -10.516 1.00 . A A . 3 ASN H 1 1 5 3135 1 1 4 ASN HA H 1.442 7.766 -7.676 1.00 . A A . 3 ASN HA 1 1 5 3136 1 1 4 ASN HB2 H 0.135 5.829 -8.356 1.00 . A A . 3 ASN HB2 1 1 5 3137 1 1 4 ASN HB3 H -0.350 7.220 -9.315 1.00 . A A . 3 ASN HB3 1 1 5 3138 1 1 4 ASN HD21 H -0.571 4.319 -9.802 1.00 . A A . 3 ASN HD21 1 1 5 3139 1 1 4 ASN HD22 H 0.182 4.048 -11.332 1.00 . A A . 3 ASN HD22 1 1 5 3140 1 1 4 ASN N N 2.072 8.343 -9.550 1.00 . A A . 3 ASN N 1 1 5 3141 1 1 4 ASN ND2 N 0.038 4.585 -10.524 1.00 . A A . 3 ASN ND2 1 1 5 3142 1 1 4 ASN O O 3.607 6.082 -9.350 1.00 . A A . 3 ASN O 1 1 5 3143 1 1 4 ASN OD1 O 1.480 6.128 -11.266 1.00 . A A . 3 ASN OD1 1 1 5 3144 1 1 5 THR C C 3.451 3.581 -6.554 1.00 . A A . 4 THR C 1 1 5 3145 1 1 5 THR CA C 4.077 4.919 -6.924 1.00 . A A . 4 THR CA 1 1 5 3146 1 1 5 THR CB C 4.968 5.474 -5.790 1.00 . A A . 4 THR CB 1 1 5 3147 1 1 5 THR CG2 C 5.983 4.451 -5.288 1.00 . A A . 4 THR CG2 1 1 5 3148 1 1 5 THR H H 2.425 6.125 -6.462 1.00 . A A . 4 THR H 1 1 5 3149 1 1 5 THR HA H 4.676 4.801 -7.816 1.00 . A A . 4 THR HA 1 1 5 3150 1 1 5 THR HB H 4.318 5.757 -4.968 1.00 . A A . 4 THR HB 1 1 5 3151 1 1 5 THR HG1 H 5.596 6.683 -7.217 1.00 . A A . 4 THR HG1 1 1 5 3152 1 1 5 THR HG21 H 5.460 3.591 -4.890 1.00 . A A . 4 THR HG21 1 1 5 3153 1 1 5 THR HG22 H 6.586 4.894 -4.510 1.00 . A A . 4 THR HG22 1 1 5 3154 1 1 5 THR HG23 H 6.618 4.141 -6.105 1.00 . A A . 4 THR HG23 1 1 5 3155 1 1 5 THR N N 3.023 5.856 -7.204 1.00 . A A . 4 THR N 1 1 5 3156 1 1 5 THR O O 2.311 3.532 -6.104 1.00 . A A . 4 THR O 1 1 5 3157 1 1 5 THR OG1 O 5.649 6.651 -6.255 1.00 . A A . 4 THR OG1 1 1 5 3158 1 1 6 TYR C C 4.779 0.428 -5.704 1.00 . A A . 5 TYR C 1 1 5 3159 1 1 6 TYR CA C 3.661 1.201 -6.380 1.00 . A A . 5 TYR CA 1 1 5 3160 1 1 6 TYR CB C 3.055 0.405 -7.543 1.00 . A A . 5 TYR CB 1 1 5 3161 1 1 6 TYR CD1 C 4.801 0.065 -9.342 1.00 . A A . 5 TYR CD1 1 1 5 3162 1 1 6 TYR CD2 C 3.089 1.679 -9.713 1.00 . A A . 5 TYR CD2 1 1 5 3163 1 1 6 TYR CE1 C 5.352 0.365 -10.573 1.00 . A A . 5 TYR CE1 1 1 5 3164 1 1 6 TYR CE2 C 3.630 1.982 -10.944 1.00 . A A . 5 TYR CE2 1 1 5 3165 1 1 6 TYR CG C 3.662 0.718 -8.892 1.00 . A A . 5 TYR CG 1 1 5 3166 1 1 6 TYR CZ C 4.763 1.324 -11.371 1.00 . A A . 5 TYR CZ 1 1 5 3167 1 1 6 TYR H H 4.984 2.555 -7.308 1.00 . A A . 5 TYR H 1 1 5 3168 1 1 6 TYR HA H 2.883 1.392 -5.644 1.00 . A A . 5 TYR HA 1 1 5 3169 1 1 6 TYR HB2 H 3.194 -0.649 -7.358 1.00 . A A . 5 TYR HB2 1 1 5 3170 1 1 6 TYR HB3 H 1.997 0.616 -7.598 1.00 . A A . 5 TYR HB3 1 1 5 3171 1 1 6 TYR HD1 H 5.258 -0.685 -8.714 1.00 . A A . 5 TYR HD1 1 1 5 3172 1 1 6 TYR HD2 H 2.202 2.196 -9.376 1.00 . A A . 5 TYR HD2 1 1 5 3173 1 1 6 TYR HE1 H 6.239 -0.153 -10.908 1.00 . A A . 5 TYR HE1 1 1 5 3174 1 1 6 TYR HE2 H 3.166 2.734 -11.566 1.00 . A A . 5 TYR HE2 1 1 5 3175 1 1 6 TYR HH H 5.392 0.827 -13.129 1.00 . A A . 5 TYR HH 1 1 5 3176 1 1 6 TYR N N 4.138 2.493 -6.817 1.00 . A A . 5 TYR N 1 1 5 3177 1 1 6 TYR O O 5.960 0.650 -5.982 1.00 . A A . 5 TYR O 1 1 5 3178 1 1 6 TYR OH O 5.313 1.635 -12.595 1.00 . A A . 5 TYR OH 1 1 5 3179 1 1 7 TYR C C 4.840 -2.613 -3.734 1.00 . A A . 6 TYR C 1 1 5 3180 1 1 7 TYR CA C 5.339 -1.192 -3.983 1.00 . A A . 6 TYR CA 1 1 5 3181 1 1 7 TYR CB C 5.519 -0.393 -2.675 1.00 . A A . 6 TYR CB 1 1 5 3182 1 1 7 TYR CD1 C 7.137 -1.566 -1.110 1.00 . A A . 6 TYR CD1 1 1 5 3183 1 1 7 TYR CD2 C 4.820 -1.550 -0.551 1.00 . A A . 6 TYR CD2 1 1 5 3184 1 1 7 TYR CE1 C 7.412 -2.268 0.051 1.00 . A A . 6 TYR CE1 1 1 5 3185 1 1 7 TYR CE2 C 5.083 -2.253 0.605 1.00 . A A . 6 TYR CE2 1 1 5 3186 1 1 7 TYR CG C 5.836 -1.195 -1.429 1.00 . A A . 6 TYR CG 1 1 5 3187 1 1 7 TYR CZ C 6.379 -2.610 0.903 1.00 . A A . 6 TYR CZ 1 1 5 3188 1 1 7 TYR H H 3.436 -0.661 -4.719 1.00 . A A . 6 TYR H 1 1 5 3189 1 1 7 TYR HA H 6.282 -1.237 -4.503 1.00 . A A . 6 TYR HA 1 1 5 3190 1 1 7 TYR HB2 H 6.326 0.310 -2.810 1.00 . A A . 6 TYR HB2 1 1 5 3191 1 1 7 TYR HB3 H 4.610 0.161 -2.483 1.00 . A A . 6 TYR HB3 1 1 5 3192 1 1 7 TYR HD1 H 7.941 -1.300 -1.781 1.00 . A A . 6 TYR HD1 1 1 5 3193 1 1 7 TYR HD2 H 3.808 -1.268 -0.787 1.00 . A A . 6 TYR HD2 1 1 5 3194 1 1 7 TYR HE1 H 8.427 -2.549 0.285 1.00 . A A . 6 TYR HE1 1 1 5 3195 1 1 7 TYR HE2 H 4.269 -2.521 1.270 1.00 . A A . 6 TYR HE2 1 1 5 3196 1 1 7 TYR HH H 7.414 -2.913 2.500 1.00 . A A . 6 TYR HH 1 1 5 3197 1 1 7 TYR N N 4.396 -0.473 -4.822 1.00 . A A . 6 TYR N 1 1 5 3198 1 1 7 TYR O O 3.635 -2.843 -3.628 1.00 . A A . 6 TYR O 1 1 5 3199 1 1 7 TYR OH O 6.645 -3.305 2.060 1.00 . A A . 6 TYR OH 1 1 5 3200 1 1 8 THR C C 5.436 -5.130 -1.863 1.00 . A A . 7 THR C 1 1 5 3201 1 1 8 THR CA C 5.401 -4.941 -3.361 1.00 . A A . 7 THR CA 1 1 5 3202 1 1 8 THR CB C 6.329 -5.967 -4.027 1.00 . A A . 7 THR CB 1 1 5 3203 1 1 8 THR CG2 C 5.743 -6.446 -5.340 1.00 . A A . 7 THR CG2 1 1 5 3204 1 1 8 THR H H 6.687 -3.362 -3.914 1.00 . A A . 7 THR H 1 1 5 3205 1 1 8 THR HA H 4.395 -5.118 -3.709 1.00 . A A . 7 THR HA 1 1 5 3206 1 1 8 THR HB H 6.422 -6.819 -3.366 1.00 . A A . 7 THR HB 1 1 5 3207 1 1 8 THR HG1 H 7.742 -5.162 -5.159 1.00 . A A . 7 THR HG1 1 1 5 3208 1 1 8 THR HG21 H 6.431 -7.131 -5.814 1.00 . A A . 7 THR HG21 1 1 5 3209 1 1 8 THR HG22 H 5.569 -5.600 -5.987 1.00 . A A . 7 THR HG22 1 1 5 3210 1 1 8 THR HG23 H 4.808 -6.952 -5.145 1.00 . A A . 7 THR HG23 1 1 5 3211 1 1 8 THR N N 5.755 -3.574 -3.704 1.00 . A A . 7 THR N 1 1 5 3212 1 1 8 THR O O 6.474 -4.933 -1.230 1.00 . A A . 7 THR O 1 1 5 3213 1 1 8 THR OG1 O 7.631 -5.400 -4.225 1.00 . A A . 7 THR OG1 1 1 5 3214 1 1 9 VAL C C 5.185 -6.598 0.726 1.00 . A A . 8 VAL C 1 1 5 3215 1 1 9 VAL CA C 4.146 -5.649 0.126 1.00 . A A . 8 VAL CA 1 1 5 3216 1 1 9 VAL CB C 2.726 -6.123 0.490 1.00 . A A . 8 VAL CB 1 1 5 3217 1 1 9 VAL CG1 C 2.605 -6.323 1.992 1.00 . A A . 8 VAL CG1 1 1 5 3218 1 1 9 VAL CG2 C 1.686 -5.123 -0.007 1.00 . A A . 8 VAL CG2 1 1 5 3219 1 1 9 VAL H H 3.539 -5.726 -1.897 1.00 . A A . 8 VAL H 1 1 5 3220 1 1 9 VAL HA H 4.289 -4.669 0.557 1.00 . A A . 8 VAL HA 1 1 5 3221 1 1 9 VAL HB H 2.545 -7.072 0.006 1.00 . A A . 8 VAL HB 1 1 5 3222 1 1 9 VAL HG11 H 1.593 -6.611 2.238 1.00 . A A . 8 VAL HG11 1 1 5 3223 1 1 9 VAL HG12 H 2.850 -5.402 2.497 1.00 . A A . 8 VAL HG12 1 1 5 3224 1 1 9 VAL HG13 H 3.287 -7.100 2.306 1.00 . A A . 8 VAL HG13 1 1 5 3225 1 1 9 VAL HG21 H 1.858 -4.162 0.454 1.00 . A A . 8 VAL HG21 1 1 5 3226 1 1 9 VAL HG22 H 0.695 -5.471 0.248 1.00 . A A . 8 VAL HG22 1 1 5 3227 1 1 9 VAL HG23 H 1.761 -5.023 -1.080 1.00 . A A . 8 VAL HG23 1 1 5 3228 1 1 9 VAL N N 4.305 -5.524 -1.311 1.00 . A A . 8 VAL N 1 1 5 3229 1 1 9 VAL O O 5.355 -7.732 0.273 1.00 . A A . 8 VAL O 1 1 5 3230 1 1 10 LYS C C 6.264 -7.452 3.697 1.00 . A A . 9 LYS C 1 1 5 3231 1 1 10 LYS CA C 6.901 -6.833 2.462 1.00 . A A . 9 LYS CA 1 1 5 3232 1 1 10 LYS CB C 8.076 -5.937 2.868 1.00 . A A . 9 LYS CB 1 1 5 3233 1 1 10 LYS CD C 9.195 -5.879 0.587 1.00 . A A . 9 LYS CD 1 1 5 3234 1 1 10 LYS CE C 8.678 -7.089 -0.178 1.00 . A A . 9 LYS CE 1 1 5 3235 1 1 10 LYS CG C 9.359 -6.170 2.072 1.00 . A A . 9 LYS CG 1 1 5 3236 1 1 10 LYS H H 5.754 -5.142 1.951 1.00 . A A . 9 LYS H 1 1 5 3237 1 1 10 LYS HA H 7.264 -7.625 1.824 1.00 . A A . 9 LYS HA 1 1 5 3238 1 1 10 LYS HB2 H 7.786 -4.906 2.740 1.00 . A A . 9 LYS HB2 1 1 5 3239 1 1 10 LYS HB3 H 8.293 -6.109 3.913 1.00 . A A . 9 LYS HB3 1 1 5 3240 1 1 10 LYS HD2 H 8.494 -5.068 0.469 1.00 . A A . 9 LYS HD2 1 1 5 3241 1 1 10 LYS HD3 H 10.154 -5.592 0.182 1.00 . A A . 9 LYS HD3 1 1 5 3242 1 1 10 LYS HE2 H 9.371 -7.907 -0.047 1.00 . A A . 9 LYS HE2 1 1 5 3243 1 1 10 LYS HE3 H 7.712 -7.369 0.220 1.00 . A A . 9 LYS HE3 1 1 5 3244 1 1 10 LYS HG2 H 10.132 -5.527 2.465 1.00 . A A . 9 LYS HG2 1 1 5 3245 1 1 10 LYS HG3 H 9.658 -7.202 2.194 1.00 . A A . 9 LYS HG3 1 1 5 3246 1 1 10 LYS HZ1 H 9.460 -6.518 -2.033 1.00 . A A . 9 LYS HZ1 1 1 5 3247 1 1 10 LYS HZ2 H 7.854 -6.034 -1.781 1.00 . A A . 9 LYS HZ2 1 1 5 3248 1 1 10 LYS HZ3 H 8.205 -7.657 -2.133 1.00 . A A . 9 LYS HZ3 1 1 5 3249 1 1 10 LYS N N 5.903 -6.082 1.711 1.00 . A A . 9 LYS N 1 1 5 3250 1 1 10 LYS NZ N 8.538 -6.805 -1.630 1.00 . A A . 9 LYS NZ 1 1 5 3251 1 1 10 LYS O O 5.043 -7.438 3.835 1.00 . A A . 9 LYS O 1 1 5 3252 1 1 11 SER C C 5.662 -7.806 6.596 1.00 . A A . 10 SER C 1 1 5 3253 1 1 11 SER CA C 6.657 -8.674 5.801 1.00 . A A . 10 SER CA 1 1 5 3254 1 1 11 SER CB C 7.878 -8.983 6.662 1.00 . A A . 10 SER CB 1 1 5 3255 1 1 11 SER H H 8.050 -8.103 4.312 1.00 . A A . 10 SER H 1 1 5 3256 1 1 11 SER HA H 6.171 -9.601 5.555 1.00 . A A . 10 SER HA 1 1 5 3257 1 1 11 SER HB2 H 8.423 -8.067 6.846 1.00 . A A . 10 SER HB2 1 1 5 3258 1 1 11 SER HB3 H 7.561 -9.411 7.602 1.00 . A A . 10 SER HB3 1 1 5 3259 1 1 11 SER HG H 9.429 -9.404 5.537 1.00 . A A . 10 SER HG 1 1 5 3260 1 1 11 SER N N 7.096 -8.061 4.542 1.00 . A A . 10 SER N 1 1 5 3261 1 1 11 SER O O 4.976 -8.304 7.491 1.00 . A A . 10 SER O 1 1 5 3262 1 1 11 SER OG O 8.739 -9.899 6.005 1.00 . A A . 10 SER OG 1 1 5 3263 1 1 12 GLY C C 3.213 -5.950 6.069 1.00 . A A . 11 GLY C 1 1 5 3264 1 1 12 GLY CA C 4.522 -5.675 6.795 1.00 . A A . 11 GLY CA 1 1 5 3265 1 1 12 GLY H H 6.268 -6.136 5.688 1.00 . A A . 11 GLY H 1 1 5 3266 1 1 12 GLY HA2 H 4.391 -5.872 7.849 1.00 . A A . 11 GLY HA2 1 1 5 3267 1 1 12 GLY HA3 H 4.789 -4.639 6.657 1.00 . A A . 11 GLY HA3 1 1 5 3268 1 1 12 GLY N N 5.592 -6.516 6.282 1.00 . A A . 11 GLY N 1 1 5 3269 1 1 12 GLY O O 2.545 -5.041 5.599 1.00 . A A . 11 GLY O 1 1 5 3270 1 1 13 ASP C C 0.380 -7.138 5.479 1.00 . A A . 12 ASP C 1 1 5 3271 1 1 13 ASP CA C 1.747 -7.766 5.224 1.00 . A A . 12 ASP CA 1 1 5 3272 1 1 13 ASP CB C 1.632 -9.266 5.440 1.00 . A A . 12 ASP CB 1 1 5 3273 1 1 13 ASP CG C 1.374 -9.611 6.895 1.00 . A A . 12 ASP CG 1 1 5 3274 1 1 13 ASP H H 3.354 -7.857 6.591 1.00 . A A . 12 ASP H 1 1 5 3275 1 1 13 ASP HA H 2.004 -7.599 4.190 1.00 . A A . 12 ASP HA 1 1 5 3276 1 1 13 ASP HB2 H 0.810 -9.637 4.842 1.00 . A A . 12 ASP HB2 1 1 5 3277 1 1 13 ASP HB3 H 2.549 -9.744 5.126 1.00 . A A . 12 ASP HB3 1 1 5 3278 1 1 13 ASP N N 2.847 -7.225 6.036 1.00 . A A . 12 ASP N 1 1 5 3279 1 1 13 ASP O O -0.591 -7.513 4.835 1.00 . A A . 12 ASP O 1 1 5 3280 1 1 13 ASP OD1 O 2.348 -9.646 7.683 1.00 . A A . 12 ASP OD1 1 1 5 3281 1 1 13 ASP OD2 O 0.203 -9.843 7.260 1.00 . A A . 12 ASP OD2 1 1 5 3282 1 1 14 THR C C -1.114 -4.248 6.425 1.00 . A A . 13 THR C 1 1 5 3283 1 1 14 THR CA C -1.043 -5.725 6.775 1.00 . A A . 13 THR CA 1 1 5 3284 1 1 14 THR CB C -1.352 -5.947 8.271 1.00 . A A . 13 THR CB 1 1 5 3285 1 1 14 THR CG2 C -2.830 -5.719 8.568 1.00 . A A . 13 THR CG2 1 1 5 3286 1 1 14 THR H H 1.068 -5.838 6.822 1.00 . A A . 13 THR H 1 1 5 3287 1 1 14 THR HA H -1.780 -6.259 6.188 1.00 . A A . 13 THR HA 1 1 5 3288 1 1 14 THR HB H -0.770 -5.248 8.853 1.00 . A A . 13 THR HB 1 1 5 3289 1 1 14 THR HG1 H -0.771 -7.799 7.858 1.00 . A A . 13 THR HG1 1 1 5 3290 1 1 14 THR HG21 H -3.009 -5.862 9.622 1.00 . A A . 13 THR HG21 1 1 5 3291 1 1 14 THR HG22 H -3.425 -6.422 8.003 1.00 . A A . 13 THR HG22 1 1 5 3292 1 1 14 THR HG23 H -3.102 -4.711 8.291 1.00 . A A . 13 THR HG23 1 1 5 3293 1 1 14 THR N N 0.264 -6.236 6.423 1.00 . A A . 13 THR N 1 1 5 3294 1 1 14 THR O O -0.100 -3.550 6.475 1.00 . A A . 13 THR O 1 1 5 3295 1 1 14 THR OG1 O -1.000 -7.287 8.649 1.00 . A A . 13 THR OG1 1 1 5 3296 1 1 15 LEU C C -1.908 -1.399 6.494 1.00 . A A . 14 LEU C 1 1 5 3297 1 1 15 LEU CA C -2.508 -2.437 5.554 1.00 . A A . 14 LEU CA 1 1 5 3298 1 1 15 LEU CB C -4.014 -2.188 5.382 1.00 . A A . 14 LEU CB 1 1 5 3299 1 1 15 LEU CD1 C -3.901 0.267 4.759 1.00 . A A . 14 LEU CD1 1 1 5 3300 1 1 15 LEU CD2 C -4.011 -1.477 2.978 1.00 . A A . 14 LEU CD2 1 1 5 3301 1 1 15 LEU CG C -4.442 -1.101 4.383 1.00 . A A . 14 LEU CG 1 1 5 3302 1 1 15 LEU H H -3.090 -4.370 6.180 1.00 . A A . 14 LEU H 1 1 5 3303 1 1 15 LEU HA H -2.024 -2.375 4.592 1.00 . A A . 14 LEU HA 1 1 5 3304 1 1 15 LEU HB2 H -4.463 -3.118 5.069 1.00 . A A . 14 LEU HB2 1 1 5 3305 1 1 15 LEU HB3 H -4.415 -1.929 6.348 1.00 . A A . 14 LEU HB3 1 1 5 3306 1 1 15 LEU HD11 H -2.823 0.231 4.792 1.00 . A A . 14 LEU HD11 1 1 5 3307 1 1 15 LEU HD12 H -4.282 0.551 5.729 1.00 . A A . 14 LEU HD12 1 1 5 3308 1 1 15 LEU HD13 H -4.215 0.993 4.024 1.00 . A A . 14 LEU HD13 1 1 5 3309 1 1 15 LEU HD21 H -4.476 -2.410 2.696 1.00 . A A . 14 LEU HD21 1 1 5 3310 1 1 15 LEU HD22 H -2.937 -1.585 2.947 1.00 . A A . 14 LEU HD22 1 1 5 3311 1 1 15 LEU HD23 H -4.315 -0.702 2.290 1.00 . A A . 14 LEU HD23 1 1 5 3312 1 1 15 LEU HG H -5.521 -1.034 4.387 1.00 . A A . 14 LEU HG 1 1 5 3313 1 1 15 LEU N N -2.311 -3.783 6.082 1.00 . A A . 14 LEU N 1 1 5 3314 1 1 15 LEU O O -1.162 -0.523 6.066 1.00 . A A . 14 LEU O 1 1 5 3315 1 1 16 ASN C C -0.216 -0.674 8.953 1.00 . A A . 15 ASN C 1 1 5 3316 1 1 16 ASN CA C -1.729 -0.572 8.768 1.00 . A A . 15 ASN CA 1 1 5 3317 1 1 16 ASN CB C -2.448 -0.770 10.111 1.00 . A A . 15 ASN CB 1 1 5 3318 1 1 16 ASN CG C -2.150 -2.107 10.770 1.00 . A A . 15 ASN CG 1 1 5 3319 1 1 16 ASN H H -2.739 -2.296 8.072 1.00 . A A . 15 ASN H 1 1 5 3320 1 1 16 ASN HA H -1.960 0.415 8.396 1.00 . A A . 15 ASN HA 1 1 5 3321 1 1 16 ASN HB2 H -2.142 0.012 10.790 1.00 . A A . 15 ASN HB2 1 1 5 3322 1 1 16 ASN HB3 H -3.514 -0.700 9.953 1.00 . A A . 15 ASN HB3 1 1 5 3323 1 1 16 ASN HD21 H -2.409 -1.297 12.565 1.00 . A A . 15 ASN HD21 1 1 5 3324 1 1 16 ASN HD22 H -2.001 -2.980 12.545 1.00 . A A . 15 ASN HD22 1 1 5 3325 1 1 16 ASN N N -2.201 -1.531 7.779 1.00 . A A . 15 ASN N 1 1 5 3326 1 1 16 ASN ND2 N -2.191 -2.133 12.091 1.00 . A A . 15 ASN ND2 1 1 5 3327 1 1 16 ASN O O 0.444 0.316 9.263 1.00 . A A . 15 ASN O 1 1 5 3328 1 1 16 ASN OD1 O -1.895 -3.106 10.098 1.00 . A A . 15 ASN OD1 1 1 5 3329 1 1 17 LYS C C 2.557 -1.379 7.825 1.00 . A A . 16 LYS C 1 1 5 3330 1 1 17 LYS CA C 1.763 -2.080 8.924 1.00 . A A . 16 LYS CA 1 1 5 3331 1 1 17 LYS CB C 2.081 -3.581 8.928 1.00 . A A . 16 LYS CB 1 1 5 3332 1 1 17 LYS CD C 1.538 -5.860 9.896 1.00 . A A . 16 LYS CD 1 1 5 3333 1 1 17 LYS CE C 2.973 -6.346 10.002 1.00 . A A . 16 LYS CE 1 1 5 3334 1 1 17 LYS CG C 1.416 -4.348 10.068 1.00 . A A . 16 LYS CG 1 1 5 3335 1 1 17 LYS H H -0.228 -2.610 8.432 1.00 . A A . 16 LYS H 1 1 5 3336 1 1 17 LYS HA H 2.039 -1.658 9.879 1.00 . A A . 16 LYS HA 1 1 5 3337 1 1 17 LYS HB2 H 1.750 -4.011 7.995 1.00 . A A . 16 LYS HB2 1 1 5 3338 1 1 17 LYS HB3 H 3.151 -3.709 9.014 1.00 . A A . 16 LYS HB3 1 1 5 3339 1 1 17 LYS HD2 H 0.953 -6.346 10.663 1.00 . A A . 16 LYS HD2 1 1 5 3340 1 1 17 LYS HD3 H 1.149 -6.131 8.926 1.00 . A A . 16 LYS HD3 1 1 5 3341 1 1 17 LYS HE2 H 3.555 -5.882 9.219 1.00 . A A . 16 LYS HE2 1 1 5 3342 1 1 17 LYS HE3 H 3.369 -6.056 10.964 1.00 . A A . 16 LYS HE3 1 1 5 3343 1 1 17 LYS HG2 H 1.888 -4.067 10.998 1.00 . A A . 16 LYS HG2 1 1 5 3344 1 1 17 LYS HG3 H 0.370 -4.083 10.101 1.00 . A A . 16 LYS HG3 1 1 5 3345 1 1 17 LYS HZ1 H 4.027 -8.152 10.115 1.00 . A A . 16 LYS HZ1 1 1 5 3346 1 1 17 LYS HZ2 H 2.863 -8.120 8.884 1.00 . A A . 16 LYS HZ2 1 1 5 3347 1 1 17 LYS HZ3 H 2.381 -8.294 10.499 1.00 . A A . 16 LYS HZ3 1 1 5 3348 1 1 17 LYS N N 0.335 -1.867 8.737 1.00 . A A . 16 LYS N 1 1 5 3349 1 1 17 LYS NZ N 3.069 -7.827 9.864 1.00 . A A . 16 LYS NZ 1 1 5 3350 1 1 17 LYS O O 3.484 -0.616 8.109 1.00 . A A . 16 LYS O 1 1 5 3351 1 1 18 ILE C C 2.564 0.510 5.349 1.00 . A A . 17 ILE C 1 1 5 3352 1 1 18 ILE CA C 2.857 -0.980 5.457 1.00 . A A . 17 ILE CA 1 1 5 3353 1 1 18 ILE CB C 2.558 -1.665 4.107 1.00 . A A . 17 ILE CB 1 1 5 3354 1 1 18 ILE CD1 C 0.734 -2.522 2.569 1.00 . A A . 17 ILE CD1 1 1 5 3355 1 1 18 ILE CG1 C 1.086 -2.058 3.967 1.00 . A A . 17 ILE CG1 1 1 5 3356 1 1 18 ILE CG2 C 3.451 -2.874 3.916 1.00 . A A . 17 ILE CG2 1 1 5 3357 1 1 18 ILE H H 1.374 -2.162 6.408 1.00 . A A . 17 ILE H 1 1 5 3358 1 1 18 ILE HA H 3.916 -1.095 5.654 1.00 . A A . 17 ILE HA 1 1 5 3359 1 1 18 ILE HB H 2.798 -0.967 3.336 1.00 . A A . 17 ILE HB 1 1 5 3360 1 1 18 ILE HD11 H 1.444 -3.275 2.248 1.00 . A A . 17 ILE HD11 1 1 5 3361 1 1 18 ILE HD12 H 0.773 -1.682 1.893 1.00 . A A . 17 ILE HD12 1 1 5 3362 1 1 18 ILE HD13 H -0.261 -2.942 2.568 1.00 . A A . 17 ILE HD13 1 1 5 3363 1 1 18 ILE HG12 H 0.866 -2.866 4.648 1.00 . A A . 17 ILE HG12 1 1 5 3364 1 1 18 ILE HG13 H 0.465 -1.207 4.205 1.00 . A A . 17 ILE HG13 1 1 5 3365 1 1 18 ILE HG21 H 4.485 -2.566 3.926 1.00 . A A . 17 ILE HG21 1 1 5 3366 1 1 18 ILE HG22 H 3.219 -3.342 2.971 1.00 . A A . 17 ILE HG22 1 1 5 3367 1 1 18 ILE HG23 H 3.275 -3.577 4.718 1.00 . A A . 17 ILE HG23 1 1 5 3368 1 1 18 ILE N N 2.153 -1.586 6.577 1.00 . A A . 17 ILE N 1 1 5 3369 1 1 18 ILE O O 3.473 1.308 5.112 1.00 . A A . 17 ILE O 1 1 5 3370 1 1 19 ALA C C 1.689 3.151 6.413 1.00 . A A . 18 ALA C 1 1 5 3371 1 1 19 ALA CA C 0.896 2.283 5.453 1.00 . A A . 18 ALA CA 1 1 5 3372 1 1 19 ALA CB C -0.580 2.422 5.757 1.00 . A A . 18 ALA CB 1 1 5 3373 1 1 19 ALA H H 0.629 0.198 5.747 1.00 . A A . 18 ALA H 1 1 5 3374 1 1 19 ALA HA H 1.068 2.619 4.441 1.00 . A A . 18 ALA HA 1 1 5 3375 1 1 19 ALA HB1 H -0.876 3.450 5.626 1.00 . A A . 18 ALA HB1 1 1 5 3376 1 1 19 ALA HB2 H -0.761 2.120 6.777 1.00 . A A . 18 ALA HB2 1 1 5 3377 1 1 19 ALA HB3 H -1.147 1.794 5.087 1.00 . A A . 18 ALA HB3 1 1 5 3378 1 1 19 ALA N N 1.305 0.884 5.547 1.00 . A A . 18 ALA N 1 1 5 3379 1 1 19 ALA O O 2.243 4.179 6.026 1.00 . A A . 18 ALA O 1 1 5 3380 1 1 20 ALA C C 3.981 3.331 8.484 1.00 . A A . 19 ALA C 1 1 5 3381 1 1 20 ALA CA C 2.477 3.460 8.682 1.00 . A A . 19 ALA CA 1 1 5 3382 1 1 20 ALA CB C 2.069 2.979 10.063 1.00 . A A . 19 ALA CB 1 1 5 3383 1 1 20 ALA H H 1.313 1.879 7.906 1.00 . A A . 19 ALA H 1 1 5 3384 1 1 20 ALA HA H 2.200 4.501 8.592 1.00 . A A . 19 ALA HA 1 1 5 3385 1 1 20 ALA HB1 H 0.999 3.088 10.181 1.00 . A A . 19 ALA HB1 1 1 5 3386 1 1 20 ALA HB2 H 2.576 3.568 10.813 1.00 . A A . 19 ALA HB2 1 1 5 3387 1 1 20 ALA HB3 H 2.340 1.940 10.176 1.00 . A A . 19 ALA HB3 1 1 5 3388 1 1 20 ALA N N 1.759 2.719 7.662 1.00 . A A . 19 ALA N 1 1 5 3389 1 1 20 ALA O O 4.751 4.178 8.943 1.00 . A A . 19 ALA O 1 1 5 3390 1 1 21 GLN C C 6.441 3.083 6.663 1.00 . A A . 20 GLN C 1 1 5 3391 1 1 21 GLN CA C 5.820 2.028 7.582 1.00 . A A . 20 GLN CA 1 1 5 3392 1 1 21 GLN CB C 6.049 0.626 7.007 1.00 . A A . 20 GLN CB 1 1 5 3393 1 1 21 GLN CD C 7.930 -0.029 8.574 1.00 . A A . 20 GLN CD 1 1 5 3394 1 1 21 GLN CG C 7.487 0.146 7.129 1.00 . A A . 20 GLN CG 1 1 5 3395 1 1 21 GLN H H 3.734 1.637 7.433 1.00 . A A . 20 GLN H 1 1 5 3396 1 1 21 GLN HA H 6.304 2.089 8.546 1.00 . A A . 20 GLN HA 1 1 5 3397 1 1 21 GLN HB2 H 5.411 -0.075 7.527 1.00 . A A . 20 GLN HB2 1 1 5 3398 1 1 21 GLN HB3 H 5.783 0.631 5.961 1.00 . A A . 20 GLN HB3 1 1 5 3399 1 1 21 GLN HE21 H 9.207 -1.455 8.044 1.00 . A A . 20 GLN HE21 1 1 5 3400 1 1 21 GLN HE22 H 9.159 -1.065 9.734 1.00 . A A . 20 GLN HE22 1 1 5 3401 1 1 21 GLN HG2 H 7.581 -0.804 6.624 1.00 . A A . 20 GLN HG2 1 1 5 3402 1 1 21 GLN HG3 H 8.135 0.869 6.654 1.00 . A A . 20 GLN HG3 1 1 5 3403 1 1 21 GLN N N 4.398 2.274 7.793 1.00 . A A . 20 GLN N 1 1 5 3404 1 1 21 GLN NE2 N 8.856 -0.942 8.807 1.00 . A A . 20 GLN NE2 1 1 5 3405 1 1 21 GLN O O 7.494 3.638 6.979 1.00 . A A . 20 GLN O 1 1 5 3406 1 1 21 GLN OE1 O 7.449 0.656 9.474 1.00 . A A . 20 GLN OE1 1 1 5 3407 1 1 22 TYR C C 5.576 5.728 4.785 1.00 . A A . 21 TYR C 1 1 5 3408 1 1 22 TYR CA C 6.311 4.399 4.626 1.00 . A A . 21 TYR CA 1 1 5 3409 1 1 22 TYR CB C 6.294 3.931 3.163 1.00 . A A . 21 TYR CB 1 1 5 3410 1 1 22 TYR CD1 C 3.790 3.617 2.908 1.00 . A A . 21 TYR CD1 1 1 5 3411 1 1 22 TYR CD2 C 5.237 1.879 2.157 1.00 . A A . 21 TYR CD2 1 1 5 3412 1 1 22 TYR CE1 C 2.693 2.877 2.508 1.00 . A A . 21 TYR CE1 1 1 5 3413 1 1 22 TYR CE2 C 4.145 1.136 1.755 1.00 . A A . 21 TYR CE2 1 1 5 3414 1 1 22 TYR CG C 5.079 3.127 2.744 1.00 . A A . 21 TYR CG 1 1 5 3415 1 1 22 TYR CZ C 2.875 1.640 1.929 1.00 . A A . 21 TYR CZ 1 1 5 3416 1 1 22 TYR H H 4.960 2.904 5.319 1.00 . A A . 21 TYR H 1 1 5 3417 1 1 22 TYR HA H 7.341 4.564 4.909 1.00 . A A . 21 TYR HA 1 1 5 3418 1 1 22 TYR HB2 H 6.341 4.798 2.522 1.00 . A A . 21 TYR HB2 1 1 5 3419 1 1 22 TYR HB3 H 7.168 3.321 2.985 1.00 . A A . 21 TYR HB3 1 1 5 3420 1 1 22 TYR HD1 H 3.651 4.587 3.361 1.00 . A A . 21 TYR HD1 1 1 5 3421 1 1 22 TYR HD2 H 6.233 1.485 2.020 1.00 . A A . 21 TYR HD2 1 1 5 3422 1 1 22 TYR HE1 H 1.700 3.274 2.643 1.00 . A A . 21 TYR HE1 1 1 5 3423 1 1 22 TYR HE2 H 4.290 0.167 1.301 1.00 . A A . 21 TYR HE2 1 1 5 3424 1 1 22 TYR HH H 1.146 1.475 1.100 1.00 . A A . 21 TYR HH 1 1 5 3425 1 1 22 TYR N N 5.792 3.379 5.539 1.00 . A A . 21 TYR N 1 1 5 3426 1 1 22 TYR O O 5.844 6.690 4.059 1.00 . A A . 21 TYR O 1 1 5 3427 1 1 22 TYR OH O 1.783 0.901 1.533 1.00 . A A . 21 TYR OH 1 1 5 3428 1 1 23 GLY C C 2.986 7.553 5.192 1.00 . A A . 22 GLY C 1 1 5 3429 1 1 23 GLY CA C 4.053 7.032 6.138 1.00 . A A . 22 GLY CA 1 1 5 3430 1 1 23 GLY H H 4.365 4.937 6.161 1.00 . A A . 22 GLY H 1 1 5 3431 1 1 23 GLY HA2 H 3.608 6.902 7.113 1.00 . A A . 22 GLY HA2 1 1 5 3432 1 1 23 GLY HA3 H 4.836 7.773 6.216 1.00 . A A . 22 GLY HA3 1 1 5 3433 1 1 23 GLY N N 4.651 5.771 5.735 1.00 . A A . 22 GLY N 1 1 5 3434 1 1 23 GLY O O 3.020 8.718 4.801 1.00 . A A . 22 GLY O 1 1 5 3435 1 1 24 VAL C C -0.382 6.791 4.846 1.00 . A A . 23 VAL C 1 1 5 3436 1 1 24 VAL CA C 0.877 7.173 4.074 1.00 . A A . 23 VAL CA 1 1 5 3437 1 1 24 VAL CB C 0.815 6.609 2.627 1.00 . A A . 23 VAL CB 1 1 5 3438 1 1 24 VAL CG1 C 0.263 5.193 2.603 1.00 . A A . 23 VAL CG1 1 1 5 3439 1 1 24 VAL CG2 C 0.006 7.524 1.721 1.00 . A A . 23 VAL CG2 1 1 5 3440 1 1 24 VAL H H 2.115 5.758 5.054 1.00 . A A . 23 VAL H 1 1 5 3441 1 1 24 VAL HA H 0.932 8.253 4.017 1.00 . A A . 23 VAL HA 1 1 5 3442 1 1 24 VAL HB H 1.813 6.576 2.237 1.00 . A A . 23 VAL HB 1 1 5 3443 1 1 24 VAL HG11 H -0.740 5.187 3.009 1.00 . A A . 23 VAL HG11 1 1 5 3444 1 1 24 VAL HG12 H 0.895 4.550 3.197 1.00 . A A . 23 VAL HG12 1 1 5 3445 1 1 24 VAL HG13 H 0.241 4.834 1.584 1.00 . A A . 23 VAL HG13 1 1 5 3446 1 1 24 VAL HG21 H -0.003 7.121 0.717 1.00 . A A . 23 VAL HG21 1 1 5 3447 1 1 24 VAL HG22 H 0.452 8.507 1.709 1.00 . A A . 23 VAL HG22 1 1 5 3448 1 1 24 VAL HG23 H -1.007 7.592 2.088 1.00 . A A . 23 VAL HG23 1 1 5 3449 1 1 24 VAL N N 2.041 6.708 4.814 1.00 . A A . 23 VAL N 1 1 5 3450 1 1 24 VAL O O -0.331 5.944 5.743 1.00 . A A . 23 VAL O 1 1 5 3451 1 1 25 SER C C -3.336 5.823 4.792 1.00 . A A . 24 SER C 1 1 5 3452 1 1 25 SER CA C -2.735 7.162 5.213 1.00 . A A . 24 SER CA 1 1 5 3453 1 1 25 SER CB C -3.731 8.298 4.956 1.00 . A A . 24 SER CB 1 1 5 3454 1 1 25 SER H H -1.481 8.065 3.784 1.00 . A A . 24 SER H 1 1 5 3455 1 1 25 SER HA H -2.519 7.124 6.269 1.00 . A A . 24 SER HA 1 1 5 3456 1 1 25 SER HB2 H -3.330 9.220 5.348 1.00 . A A . 24 SER HB2 1 1 5 3457 1 1 25 SER HB3 H -3.888 8.401 3.892 1.00 . A A . 24 SER HB3 1 1 5 3458 1 1 25 SER HG H -5.012 8.514 6.430 1.00 . A A . 24 SER HG 1 1 5 3459 1 1 25 SER N N -1.492 7.420 4.519 1.00 . A A . 24 SER N 1 1 5 3460 1 1 25 SER O O -3.206 5.380 3.640 1.00 . A A . 24 SER O 1 1 5 3461 1 1 25 SER OG O -4.980 8.050 5.578 1.00 . A A . 24 SER OG 1 1 5 3462 1 1 26 VAL C C -5.821 4.299 4.422 1.00 . A A . 25 VAL C 1 1 5 3463 1 1 26 VAL CA C -4.747 3.984 5.462 1.00 . A A . 25 VAL CA 1 1 5 3464 1 1 26 VAL CB C -5.401 3.453 6.757 1.00 . A A . 25 VAL CB 1 1 5 3465 1 1 26 VAL CG1 C -6.244 2.224 6.484 1.00 . A A . 25 VAL CG1 1 1 5 3466 1 1 26 VAL CG2 C -4.341 3.144 7.803 1.00 . A A . 25 VAL CG2 1 1 5 3467 1 1 26 VAL H H -3.962 5.531 6.661 1.00 . A A . 25 VAL H 1 1 5 3468 1 1 26 VAL HA H -4.080 3.231 5.071 1.00 . A A . 25 VAL HA 1 1 5 3469 1 1 26 VAL HB H -6.047 4.223 7.151 1.00 . A A . 25 VAL HB 1 1 5 3470 1 1 26 VAL HG11 H -5.621 1.442 6.075 1.00 . A A . 25 VAL HG11 1 1 5 3471 1 1 26 VAL HG12 H -7.022 2.472 5.775 1.00 . A A . 25 VAL HG12 1 1 5 3472 1 1 26 VAL HG13 H -6.691 1.882 7.405 1.00 . A A . 25 VAL HG13 1 1 5 3473 1 1 26 VAL HG21 H -4.816 2.778 8.701 1.00 . A A . 25 VAL HG21 1 1 5 3474 1 1 26 VAL HG22 H -3.786 4.043 8.030 1.00 . A A . 25 VAL HG22 1 1 5 3475 1 1 26 VAL HG23 H -3.667 2.391 7.422 1.00 . A A . 25 VAL HG23 1 1 5 3476 1 1 26 VAL N N -3.988 5.182 5.738 1.00 . A A . 25 VAL N 1 1 5 3477 1 1 26 VAL O O -6.097 3.499 3.528 1.00 . A A . 25 VAL O 1 1 5 3478 1 1 27 ALA C C -7.044 6.088 2.209 1.00 . A A . 26 ALA C 1 1 5 3479 1 1 27 ALA CA C -7.467 5.929 3.666 1.00 . A A . 26 ALA CA 1 1 5 3480 1 1 27 ALA CB C -8.050 7.232 4.187 1.00 . A A . 26 ALA CB 1 1 5 3481 1 1 27 ALA H H -6.004 6.140 5.176 1.00 . A A . 26 ALA H 1 1 5 3482 1 1 27 ALA HA H -8.237 5.173 3.725 1.00 . A A . 26 ALA HA 1 1 5 3483 1 1 27 ALA HB1 H -8.914 7.499 3.596 1.00 . A A . 26 ALA HB1 1 1 5 3484 1 1 27 ALA HB2 H -7.309 8.013 4.112 1.00 . A A . 26 ALA HB2 1 1 5 3485 1 1 27 ALA HB3 H -8.343 7.109 5.219 1.00 . A A . 26 ALA HB3 1 1 5 3486 1 1 27 ALA N N -6.365 5.508 4.516 1.00 . A A . 26 ALA N 1 1 5 3487 1 1 27 ALA O O -7.724 5.595 1.311 1.00 . A A . 26 ALA O 1 1 5 3488 1 1 28 ASN C C -4.988 5.824 -0.139 1.00 . A A . 27 ASN C 1 1 5 3489 1 1 28 ASN CA C -5.523 7.047 0.584 1.00 . A A . 27 ASN CA 1 1 5 3490 1 1 28 ASN CB C -4.547 8.233 0.466 1.00 . A A . 27 ASN CB 1 1 5 3491 1 1 28 ASN CG C -3.459 8.260 1.503 1.00 . A A . 27 ASN CG 1 1 5 3492 1 1 28 ASN H H -5.345 7.040 2.704 1.00 . A A . 27 ASN H 1 1 5 3493 1 1 28 ASN HA H -6.432 7.327 0.071 1.00 . A A . 27 ASN HA 1 1 5 3494 1 1 28 ASN HB2 H -4.064 8.187 -0.498 1.00 . A A . 27 ASN HB2 1 1 5 3495 1 1 28 ASN HB3 H -5.105 9.153 0.535 1.00 . A A . 27 ASN HB3 1 1 5 3496 1 1 28 ASN HD21 H -3.543 10.247 1.540 1.00 . A A . 27 ASN HD21 1 1 5 3497 1 1 28 ASN HD22 H -2.374 9.521 2.597 1.00 . A A . 27 ASN HD22 1 1 5 3498 1 1 28 ASN N N -5.916 6.755 1.961 1.00 . A A . 27 ASN N 1 1 5 3499 1 1 28 ASN ND2 N -3.087 9.460 1.925 1.00 . A A . 27 ASN ND2 1 1 5 3500 1 1 28 ASN O O -5.376 5.584 -1.287 1.00 . A A . 27 ASN O 1 1 5 3501 1 1 28 ASN OD1 O -2.962 7.232 1.923 1.00 . A A . 27 ASN OD1 1 1 5 3502 1 1 29 LEU C C -4.706 2.853 -0.483 1.00 . A A . 28 LEU C 1 1 5 3503 1 1 29 LEU CA C -3.597 3.870 -0.218 1.00 . A A . 28 LEU CA 1 1 5 3504 1 1 29 LEU CB C -2.356 3.258 0.469 1.00 . A A . 28 LEU CB 1 1 5 3505 1 1 29 LEU CD1 C -2.776 0.781 0.757 1.00 . A A . 28 LEU CD1 1 1 5 3506 1 1 29 LEU CD2 C -1.343 2.025 2.373 1.00 . A A . 28 LEU CD2 1 1 5 3507 1 1 29 LEU CG C -2.558 2.116 1.470 1.00 . A A . 28 LEU CG 1 1 5 3508 1 1 29 LEU H H -3.874 5.202 1.432 1.00 . A A . 28 LEU H 1 1 5 3509 1 1 29 LEU HA H -3.285 4.248 -1.184 1.00 . A A . 28 LEU HA 1 1 5 3510 1 1 29 LEU HB2 H -1.700 2.894 -0.307 1.00 . A A . 28 LEU HB2 1 1 5 3511 1 1 29 LEU HB3 H -1.842 4.058 0.985 1.00 . A A . 28 LEU HB3 1 1 5 3512 1 1 29 LEU HD11 H -2.876 -0.013 1.487 1.00 . A A . 28 LEU HD11 1 1 5 3513 1 1 29 LEU HD12 H -1.929 0.573 0.116 1.00 . A A . 28 LEU HD12 1 1 5 3514 1 1 29 LEU HD13 H -3.673 0.834 0.157 1.00 . A A . 28 LEU HD13 1 1 5 3515 1 1 29 LEU HD21 H -0.444 2.021 1.767 1.00 . A A . 28 LEU HD21 1 1 5 3516 1 1 29 LEU HD22 H -1.392 1.114 2.951 1.00 . A A . 28 LEU HD22 1 1 5 3517 1 1 29 LEU HD23 H -1.323 2.876 3.038 1.00 . A A . 28 LEU HD23 1 1 5 3518 1 1 29 LEU HG H -3.422 2.321 2.083 1.00 . A A . 28 LEU HG 1 1 5 3519 1 1 29 LEU N N -4.139 5.017 0.500 1.00 . A A . 28 LEU N 1 1 5 3520 1 1 29 LEU O O -4.696 2.170 -1.504 1.00 . A A . 28 LEU O 1 1 5 3521 1 1 30 ARG C C -7.696 2.519 -0.970 1.00 . A A . 29 ARG C 1 1 5 3522 1 1 30 ARG CA C -6.859 1.942 0.172 1.00 . A A . 29 ARG CA 1 1 5 3523 1 1 30 ARG CB C -7.726 1.832 1.426 1.00 . A A . 29 ARG CB 1 1 5 3524 1 1 30 ARG CD C -8.071 0.891 3.718 1.00 . A A . 29 ARG CD 1 1 5 3525 1 1 30 ARG CG C -7.214 0.846 2.462 1.00 . A A . 29 ARG CG 1 1 5 3526 1 1 30 ARG CZ C -8.304 -0.301 5.866 1.00 . A A . 29 ARG CZ 1 1 5 3527 1 1 30 ARG H H -5.606 3.262 1.268 1.00 . A A . 29 ARG H 1 1 5 3528 1 1 30 ARG HA H -6.520 0.957 -0.109 1.00 . A A . 29 ARG HA 1 1 5 3529 1 1 30 ARG HB2 H -7.789 2.804 1.890 1.00 . A A . 29 ARG HB2 1 1 5 3530 1 1 30 ARG HB3 H -8.719 1.523 1.133 1.00 . A A . 29 ARG HB3 1 1 5 3531 1 1 30 ARG HD2 H -7.913 1.843 4.208 1.00 . A A . 29 ARG HD2 1 1 5 3532 1 1 30 ARG HD3 H -9.110 0.801 3.437 1.00 . A A . 29 ARG HD3 1 1 5 3533 1 1 30 ARG HE H -7.060 -0.824 4.383 1.00 . A A . 29 ARG HE 1 1 5 3534 1 1 30 ARG HG2 H -7.248 -0.151 2.047 1.00 . A A . 29 ARG HG2 1 1 5 3535 1 1 30 ARG HG3 H -6.195 1.101 2.719 1.00 . A A . 29 ARG HG3 1 1 5 3536 1 1 30 ARG HH11 H -9.539 1.300 5.653 1.00 . A A . 29 ARG HH11 1 1 5 3537 1 1 30 ARG HH12 H -9.662 0.463 7.174 1.00 . A A . 29 ARG HH12 1 1 5 3538 1 1 30 ARG HH21 H -7.227 -1.930 6.396 1.00 . A A . 29 ARG HH21 1 1 5 3539 1 1 30 ARG HH22 H -8.357 -1.374 7.592 1.00 . A A . 29 ARG HH22 1 1 5 3540 1 1 30 ARG N N -5.680 2.766 0.421 1.00 . A A . 29 ARG N 1 1 5 3541 1 1 30 ARG NE N -7.742 -0.177 4.661 1.00 . A A . 29 ARG NE 1 1 5 3542 1 1 30 ARG NH1 N -9.242 0.554 6.260 1.00 . A A . 29 ARG NH1 1 1 5 3543 1 1 30 ARG NH2 N -7.930 -1.279 6.678 1.00 . A A . 29 ARG NH2 1 1 5 3544 1 1 30 ARG O O -8.260 1.775 -1.771 1.00 . A A . 29 ARG O 1 1 5 3545 1 1 31 SER C C -8.274 4.256 -3.444 1.00 . A A . 30 SER C 1 1 5 3546 1 1 31 SER CA C -8.631 4.535 -1.983 1.00 . A A . 30 SER CA 1 1 5 3547 1 1 31 SER CB C -8.587 6.044 -1.716 1.00 . A A . 30 SER CB 1 1 5 3548 1 1 31 SER H H -7.175 4.378 -0.458 1.00 . A A . 30 SER H 1 1 5 3549 1 1 31 SER HA H -9.636 4.183 -1.802 1.00 . A A . 30 SER HA 1 1 5 3550 1 1 31 SER HB2 H -8.857 6.232 -0.687 1.00 . A A . 30 SER HB2 1 1 5 3551 1 1 31 SER HB3 H -7.586 6.408 -1.898 1.00 . A A . 30 SER HB3 1 1 5 3552 1 1 31 SER HG H -10.396 6.468 -2.352 1.00 . A A . 30 SER HG 1 1 5 3553 1 1 31 SER N N -7.747 3.845 -1.050 1.00 . A A . 30 SER N 1 1 5 3554 1 1 31 SER O O -9.156 3.964 -4.255 1.00 . A A . 30 SER O 1 1 5 3555 1 1 31 SER OG O -9.486 6.746 -2.557 1.00 . A A . 30 SER OG 1 1 5 3556 1 1 32 TRP C C -6.324 2.657 -5.514 1.00 . A A . 31 TRP C 1 1 5 3557 1 1 32 TRP CA C -6.588 4.121 -5.180 1.00 . A A . 31 TRP CA 1 1 5 3558 1 1 32 TRP CB C -5.375 4.985 -5.556 1.00 . A A . 31 TRP CB 1 1 5 3559 1 1 32 TRP CD1 C -3.693 3.941 -3.941 1.00 . A A . 31 TRP CD1 1 1 5 3560 1 1 32 TRP CD2 C -3.675 6.174 -3.957 1.00 . A A . 31 TRP CD2 1 1 5 3561 1 1 32 TRP CE2 C -2.722 5.726 -3.028 1.00 . A A . 31 TRP CE2 1 1 5 3562 1 1 32 TRP CE3 C -3.840 7.549 -4.138 1.00 . A A . 31 TRP CE3 1 1 5 3563 1 1 32 TRP CG C -4.294 5.011 -4.520 1.00 . A A . 31 TRP CG 1 1 5 3564 1 1 32 TRP CH2 C -2.117 7.939 -2.488 1.00 . A A . 31 TRP CH2 1 1 5 3565 1 1 32 TRP CZ2 C -1.933 6.600 -2.288 1.00 . A A . 31 TRP CZ2 1 1 5 3566 1 1 32 TRP CZ3 C -3.053 8.416 -3.404 1.00 . A A . 31 TRP CZ3 1 1 5 3567 1 1 32 TRP H H -6.310 4.506 -3.101 1.00 . A A . 31 TRP H 1 1 5 3568 1 1 32 TRP HA H -7.424 4.443 -5.785 1.00 . A A . 31 TRP HA 1 1 5 3569 1 1 32 TRP HB2 H -4.941 4.596 -6.470 1.00 . A A . 31 TRP HB2 1 1 5 3570 1 1 32 TRP HB3 H -5.704 6.001 -5.724 1.00 . A A . 31 TRP HB3 1 1 5 3571 1 1 32 TRP HD1 H -3.941 2.911 -4.159 1.00 . A A . 31 TRP HD1 1 1 5 3572 1 1 32 TRP HE1 H -2.193 3.774 -2.486 1.00 . A A . 31 TRP HE1 1 1 5 3573 1 1 32 TRP HE3 H -4.560 7.935 -4.839 1.00 . A A . 31 TRP HE3 1 1 5 3574 1 1 32 TRP HH2 H -1.525 8.654 -1.936 1.00 . A A . 31 TRP HH2 1 1 5 3575 1 1 32 TRP HZ2 H -1.202 6.249 -1.577 1.00 . A A . 31 TRP HZ2 1 1 5 3576 1 1 32 TRP HZ3 H -3.159 9.480 -3.534 1.00 . A A . 31 TRP HZ3 1 1 5 3577 1 1 32 TRP N N -6.991 4.316 -3.786 1.00 . A A . 31 TRP N 1 1 5 3578 1 1 32 TRP NE1 N -2.754 4.360 -3.036 1.00 . A A . 31 TRP NE1 1 1 5 3579 1 1 32 TRP O O -6.010 2.329 -6.655 1.00 . A A . 31 TRP O 1 1 5 3580 1 1 33 ASN C C -7.619 -0.373 -4.745 1.00 . A A . 32 ASN C 1 1 5 3581 1 1 33 ASN CA C -6.285 0.348 -4.799 1.00 . A A . 32 ASN CA 1 1 5 3582 1 1 33 ASN CB C -5.328 -0.313 -3.801 1.00 . A A . 32 ASN CB 1 1 5 3583 1 1 33 ASN CG C -3.874 -0.049 -4.111 1.00 . A A . 32 ASN CG 1 1 5 3584 1 1 33 ASN H H -6.636 2.080 -3.621 1.00 . A A . 32 ASN H 1 1 5 3585 1 1 33 ASN HA H -5.877 0.245 -5.793 1.00 . A A . 32 ASN HA 1 1 5 3586 1 1 33 ASN HB2 H -5.537 0.064 -2.812 1.00 . A A . 32 ASN HB2 1 1 5 3587 1 1 33 ASN HB3 H -5.491 -1.381 -3.815 1.00 . A A . 32 ASN HB3 1 1 5 3588 1 1 33 ASN HD21 H -3.827 1.389 -2.745 1.00 . A A . 32 ASN HD21 1 1 5 3589 1 1 33 ASN HD22 H -2.344 1.105 -3.596 1.00 . A A . 32 ASN HD22 1 1 5 3590 1 1 33 ASN N N -6.442 1.773 -4.531 1.00 . A A . 32 ASN N 1 1 5 3591 1 1 33 ASN ND2 N -3.290 0.907 -3.418 1.00 . A A . 32 ASN ND2 1 1 5 3592 1 1 33 ASN O O -7.781 -1.427 -5.362 1.00 . A A . 32 ASN O 1 1 5 3593 1 1 33 ASN OD1 O -3.273 -0.731 -4.939 1.00 . A A . 32 ASN OD1 1 1 5 3594 1 1 34 GLY C C -9.576 -1.824 -3.116 1.00 . A A . 33 GLY C 1 1 5 3595 1 1 34 GLY CA C -9.831 -0.486 -3.777 1.00 . A A . 33 GLY CA 1 1 5 3596 1 1 34 GLY H H -8.439 1.106 -3.668 1.00 . A A . 33 GLY H 1 1 5 3597 1 1 34 GLY HA2 H -10.448 0.119 -3.127 1.00 . A A . 33 GLY HA2 1 1 5 3598 1 1 34 GLY HA3 H -10.345 -0.646 -4.712 1.00 . A A . 33 GLY HA3 1 1 5 3599 1 1 34 GLY N N -8.580 0.205 -4.030 1.00 . A A . 33 GLY N 1 1 5 3600 1 1 34 GLY O O -10.234 -2.823 -3.420 1.00 . A A . 33 GLY O 1 1 5 3601 1 1 35 ILE C C -8.404 -3.133 -0.137 1.00 . A A . 34 ILE C 1 1 5 3602 1 1 35 ILE CA C -8.110 -3.066 -1.624 1.00 . A A . 34 ILE CA 1 1 5 3603 1 1 35 ILE CB C -6.585 -3.228 -1.857 1.00 . A A . 34 ILE CB 1 1 5 3604 1 1 35 ILE CD1 C -7.009 -4.868 -3.734 1.00 . A A . 34 ILE CD1 1 1 5 3605 1 1 35 ILE CG1 C -6.312 -3.600 -3.312 1.00 . A A . 34 ILE CG1 1 1 5 3606 1 1 35 ILE CG2 C -5.977 -4.271 -0.922 1.00 . A A . 34 ILE CG2 1 1 5 3607 1 1 35 ILE H H -8.208 -0.981 -1.936 1.00 . A A . 34 ILE H 1 1 5 3608 1 1 35 ILE HA H -8.612 -3.889 -2.114 1.00 . A A . 34 ILE HA 1 1 5 3609 1 1 35 ILE HB H -6.115 -2.280 -1.648 1.00 . A A . 34 ILE HB 1 1 5 3610 1 1 35 ILE HD11 H -6.702 -5.674 -3.083 1.00 . A A . 34 ILE HD11 1 1 5 3611 1 1 35 ILE HD12 H -6.747 -5.102 -4.753 1.00 . A A . 34 ILE HD12 1 1 5 3612 1 1 35 ILE HD13 H -8.076 -4.729 -3.653 1.00 . A A . 34 ILE HD13 1 1 5 3613 1 1 35 ILE HG12 H -6.658 -2.804 -3.953 1.00 . A A . 34 ILE HG12 1 1 5 3614 1 1 35 ILE HG13 H -5.250 -3.740 -3.455 1.00 . A A . 34 ILE HG13 1 1 5 3615 1 1 35 ILE HG21 H -6.428 -5.234 -1.115 1.00 . A A . 34 ILE HG21 1 1 5 3616 1 1 35 ILE HG22 H -6.162 -3.987 0.106 1.00 . A A . 34 ILE HG22 1 1 5 3617 1 1 35 ILE HG23 H -4.913 -4.330 -1.093 1.00 . A A . 34 ILE HG23 1 1 5 3618 1 1 35 ILE N N -8.601 -1.835 -2.216 1.00 . A A . 34 ILE N 1 1 5 3619 1 1 35 ILE O O -8.141 -2.187 0.608 1.00 . A A . 34 ILE O 1 1 5 3620 1 1 36 SER C C -7.775 -5.056 2.212 1.00 . A A . 35 SER C 1 1 5 3621 1 1 36 SER CA C -9.113 -4.546 1.689 1.00 . A A . 35 SER CA 1 1 5 3622 1 1 36 SER CB C -10.213 -5.588 1.899 1.00 . A A . 35 SER CB 1 1 5 3623 1 1 36 SER H H -9.311 -4.897 -0.383 1.00 . A A . 35 SER H 1 1 5 3624 1 1 36 SER HA H -9.375 -3.636 2.205 1.00 . A A . 35 SER HA 1 1 5 3625 1 1 36 SER HB2 H -9.866 -6.552 1.558 1.00 . A A . 35 SER HB2 1 1 5 3626 1 1 36 SER HB3 H -10.459 -5.645 2.949 1.00 . A A . 35 SER HB3 1 1 5 3627 1 1 36 SER HG H -11.182 -5.260 0.222 1.00 . A A . 35 SER HG 1 1 5 3628 1 1 36 SER N N -8.973 -4.249 0.281 1.00 . A A . 35 SER N 1 1 5 3629 1 1 36 SER O O -7.265 -6.074 1.742 1.00 . A A . 35 SER O 1 1 5 3630 1 1 36 SER OG O -11.379 -5.236 1.174 1.00 . A A . 35 SER OG 1 1 5 3631 1 1 37 GLY C C -5.806 -6.006 4.382 1.00 . A A . 36 GLY C 1 1 5 3632 1 1 37 GLY CA C -5.880 -4.658 3.680 1.00 . A A . 36 GLY CA 1 1 5 3633 1 1 37 GLY H H -7.672 -3.545 3.495 1.00 . A A . 36 GLY H 1 1 5 3634 1 1 37 GLY HA2 H -5.178 -4.662 2.859 1.00 . A A . 36 GLY HA2 1 1 5 3635 1 1 37 GLY HA3 H -5.586 -3.888 4.378 1.00 . A A . 36 GLY HA3 1 1 5 3636 1 1 37 GLY N N -7.201 -4.329 3.158 1.00 . A A . 36 GLY N 1 1 5 3637 1 1 37 GLY O O -4.743 -6.404 4.853 1.00 . A A . 36 GLY O 1 1 5 3638 1 1 38 ASP C C -6.359 -9.062 4.150 1.00 . A A . 37 ASP C 1 1 5 3639 1 1 38 ASP CA C -6.990 -8.019 5.065 1.00 . A A . 37 ASP CA 1 1 5 3640 1 1 38 ASP CB C -8.445 -8.393 5.358 1.00 . A A . 37 ASP CB 1 1 5 3641 1 1 38 ASP CG C -9.146 -7.365 6.222 1.00 . A A . 37 ASP CG 1 1 5 3642 1 1 38 ASP H H -7.751 -6.312 4.084 1.00 . A A . 37 ASP H 1 1 5 3643 1 1 38 ASP HA H -6.440 -7.985 5.993 1.00 . A A . 37 ASP HA 1 1 5 3644 1 1 38 ASP HB2 H -8.982 -8.475 4.425 1.00 . A A . 37 ASP HB2 1 1 5 3645 1 1 38 ASP HB3 H -8.471 -9.346 5.869 1.00 . A A . 37 ASP HB3 1 1 5 3646 1 1 38 ASP N N -6.930 -6.701 4.452 1.00 . A A . 37 ASP N 1 1 5 3647 1 1 38 ASP O O -5.681 -9.976 4.612 1.00 . A A . 37 ASP O 1 1 5 3648 1 1 38 ASP OD1 O -9.614 -6.344 5.672 1.00 . A A . 37 ASP OD1 1 1 5 3649 1 1 38 ASP OD2 O -9.222 -7.559 7.455 1.00 . A A . 37 ASP OD2 1 1 5 3650 1 1 39 LEU C C -4.728 -9.343 1.272 1.00 . A A . 38 LEU C 1 1 5 3651 1 1 39 LEU CA C -6.035 -9.853 1.871 1.00 . A A . 38 LEU CA 1 1 5 3652 1 1 39 LEU CB C -7.046 -10.150 0.754 1.00 . A A . 38 LEU CB 1 1 5 3653 1 1 39 LEU CD1 C -7.977 -9.231 -1.381 1.00 . A A . 38 LEU CD1 1 1 5 3654 1 1 39 LEU CD2 C -8.995 -8.583 0.794 1.00 . A A . 38 LEU CD2 1 1 5 3655 1 1 39 LEU CG C -7.698 -8.936 0.084 1.00 . A A . 38 LEU CG 1 1 5 3656 1 1 39 LEU H H -7.098 -8.143 2.534 1.00 . A A . 38 LEU H 1 1 5 3657 1 1 39 LEU HA H -5.827 -10.773 2.397 1.00 . A A . 38 LEU HA 1 1 5 3658 1 1 39 LEU HB2 H -6.538 -10.717 -0.011 1.00 . A A . 38 LEU HB2 1 1 5 3659 1 1 39 LEU HB3 H -7.830 -10.765 1.167 1.00 . A A . 38 LEU HB3 1 1 5 3660 1 1 39 LEU HD11 H -7.052 -9.473 -1.882 1.00 . A A . 38 LEU HD11 1 1 5 3661 1 1 39 LEU HD12 H -8.422 -8.364 -1.845 1.00 . A A . 38 LEU HD12 1 1 5 3662 1 1 39 LEU HD13 H -8.656 -10.068 -1.455 1.00 . A A . 38 LEU HD13 1 1 5 3663 1 1 39 LEU HD21 H -8.785 -8.323 1.821 1.00 . A A . 38 LEU HD21 1 1 5 3664 1 1 39 LEU HD22 H -9.662 -9.433 0.767 1.00 . A A . 38 LEU HD22 1 1 5 3665 1 1 39 LEU HD23 H -9.460 -7.745 0.298 1.00 . A A . 38 LEU HD23 1 1 5 3666 1 1 39 LEU HG H -7.034 -8.087 0.143 1.00 . A A . 38 LEU HG 1 1 5 3667 1 1 39 LEU N N -6.575 -8.911 2.847 1.00 . A A . 38 LEU N 1 1 5 3668 1 1 39 LEU O O -4.439 -9.566 0.096 1.00 . A A . 38 LEU O 1 1 5 3669 1 1 40 ILE C C -1.558 -9.232 2.114 1.00 . A A . 39 ILE C 1 1 5 3670 1 1 40 ILE CA C -2.615 -8.228 1.656 1.00 . A A . 39 ILE CA 1 1 5 3671 1 1 40 ILE CB C -2.276 -6.807 2.178 1.00 . A A . 39 ILE CB 1 1 5 3672 1 1 40 ILE CD1 C -2.685 -4.317 1.736 1.00 . A A . 39 ILE CD1 1 1 5 3673 1 1 40 ILE CG1 C -3.081 -5.749 1.409 1.00 . A A . 39 ILE CG1 1 1 5 3674 1 1 40 ILE CG2 C -0.787 -6.530 2.064 1.00 . A A . 39 ILE CG2 1 1 5 3675 1 1 40 ILE H H -4.226 -8.474 2.999 1.00 . A A . 39 ILE H 1 1 5 3676 1 1 40 ILE HA H -2.614 -8.199 0.574 1.00 . A A . 39 ILE HA 1 1 5 3677 1 1 40 ILE HB H -2.545 -6.759 3.225 1.00 . A A . 39 ILE HB 1 1 5 3678 1 1 40 ILE HD11 H -1.633 -4.180 1.541 1.00 . A A . 39 ILE HD11 1 1 5 3679 1 1 40 ILE HD12 H -2.887 -4.115 2.778 1.00 . A A . 39 ILE HD12 1 1 5 3680 1 1 40 ILE HD13 H -3.256 -3.631 1.123 1.00 . A A . 39 ILE HD13 1 1 5 3681 1 1 40 ILE HG12 H -2.934 -5.897 0.350 1.00 . A A . 39 ILE HG12 1 1 5 3682 1 1 40 ILE HG13 H -4.130 -5.864 1.640 1.00 . A A . 39 ILE HG13 1 1 5 3683 1 1 40 ILE HG21 H -0.577 -5.533 2.430 1.00 . A A . 39 ILE HG21 1 1 5 3684 1 1 40 ILE HG22 H -0.487 -6.609 1.029 1.00 . A A . 39 ILE HG22 1 1 5 3685 1 1 40 ILE HG23 H -0.239 -7.255 2.658 1.00 . A A . 39 ILE HG23 1 1 5 3686 1 1 40 ILE N N -3.930 -8.668 2.086 1.00 . A A . 39 ILE N 1 1 5 3687 1 1 40 ILE O O -1.604 -9.733 3.236 1.00 . A A . 39 ILE O 1 1 5 3688 1 1 41 PHE C C 1.722 -10.094 0.880 1.00 . A A . 40 PHE C 1 1 5 3689 1 1 41 PHE CA C 0.396 -10.535 1.493 1.00 . A A . 40 PHE CA 1 1 5 3690 1 1 41 PHE CB C -0.029 -11.894 0.924 1.00 . A A . 40 PHE CB 1 1 5 3691 1 1 41 PHE CD1 C 0.462 -11.953 -1.541 1.00 . A A . 40 PHE CD1 1 1 5 3692 1 1 41 PHE CD2 C -1.799 -11.667 -0.844 1.00 . A A . 40 PHE CD2 1 1 5 3693 1 1 41 PHE CE1 C 0.064 -11.899 -2.862 1.00 . A A . 40 PHE CE1 1 1 5 3694 1 1 41 PHE CE2 C -2.203 -11.613 -2.164 1.00 . A A . 40 PHE CE2 1 1 5 3695 1 1 41 PHE CG C -0.463 -11.839 -0.516 1.00 . A A . 40 PHE CG 1 1 5 3696 1 1 41 PHE CZ C -1.270 -11.729 -3.173 1.00 . A A . 40 PHE CZ 1 1 5 3697 1 1 41 PHE H H -0.629 -9.087 0.359 1.00 . A A . 40 PHE H 1 1 5 3698 1 1 41 PHE HA H 0.512 -10.617 2.565 1.00 . A A . 40 PHE HA 1 1 5 3699 1 1 41 PHE HB2 H 0.801 -12.579 0.994 1.00 . A A . 40 PHE HB2 1 1 5 3700 1 1 41 PHE HB3 H -0.856 -12.275 1.507 1.00 . A A . 40 PHE HB3 1 1 5 3701 1 1 41 PHE HD1 H 1.505 -12.086 -1.299 1.00 . A A . 40 PHE HD1 1 1 5 3702 1 1 41 PHE HD2 H -2.529 -11.576 -0.054 1.00 . A A . 40 PHE HD2 1 1 5 3703 1 1 41 PHE HE1 H 0.797 -11.990 -3.652 1.00 . A A . 40 PHE HE1 1 1 5 3704 1 1 41 PHE HE2 H -3.248 -11.481 -2.405 1.00 . A A . 40 PHE HE2 1 1 5 3705 1 1 41 PHE HZ H -1.582 -11.687 -4.206 1.00 . A A . 40 PHE HZ 1 1 5 3706 1 1 41 PHE N N -0.631 -9.543 1.223 1.00 . A A . 40 PHE N 1 1 5 3707 1 1 41 PHE O O 1.762 -9.124 0.123 1.00 . A A . 40 PHE O 1 1 5 3708 1 1 42 VAL C C 4.090 -10.703 -0.878 1.00 . A A . 41 VAL C 1 1 5 3709 1 1 42 VAL CA C 4.101 -10.484 0.634 1.00 . A A . 41 VAL CA 1 1 5 3710 1 1 42 VAL CB C 5.218 -11.336 1.272 1.00 . A A . 41 VAL CB 1 1 5 3711 1 1 42 VAL CG1 C 6.574 -10.987 0.676 1.00 . A A . 41 VAL CG1 1 1 5 3712 1 1 42 VAL CG2 C 5.235 -11.149 2.783 1.00 . A A . 41 VAL CG2 1 1 5 3713 1 1 42 VAL H H 2.707 -11.567 1.812 1.00 . A A . 41 VAL H 1 1 5 3714 1 1 42 VAL HA H 4.307 -9.440 0.838 1.00 . A A . 41 VAL HA 1 1 5 3715 1 1 42 VAL HB H 5.015 -12.376 1.063 1.00 . A A . 41 VAL HB 1 1 5 3716 1 1 42 VAL HG11 H 7.333 -11.617 1.113 1.00 . A A . 41 VAL HG11 1 1 5 3717 1 1 42 VAL HG12 H 6.802 -9.952 0.884 1.00 . A A . 41 VAL HG12 1 1 5 3718 1 1 42 VAL HG13 H 6.549 -11.141 -0.392 1.00 . A A . 41 VAL HG13 1 1 5 3719 1 1 42 VAL HG21 H 6.017 -11.758 3.213 1.00 . A A . 41 VAL HG21 1 1 5 3720 1 1 42 VAL HG22 H 4.281 -11.447 3.192 1.00 . A A . 41 VAL HG22 1 1 5 3721 1 1 42 VAL HG23 H 5.419 -10.111 3.014 1.00 . A A . 41 VAL HG23 1 1 5 3722 1 1 42 VAL N N 2.795 -10.802 1.195 1.00 . A A . 41 VAL N 1 1 5 3723 1 1 42 VAL O O 3.670 -11.758 -1.356 1.00 . A A . 41 VAL O 1 1 5 3724 1 1 43 GLY C C 3.320 -9.070 -3.674 1.00 . A A . 42 GLY C 1 1 5 3725 1 1 43 GLY CA C 4.510 -9.790 -3.074 1.00 . A A . 42 GLY CA 1 1 5 3726 1 1 43 GLY H H 4.873 -8.886 -1.191 1.00 . A A . 42 GLY H 1 1 5 3727 1 1 43 GLY HA2 H 5.418 -9.353 -3.463 1.00 . A A . 42 GLY HA2 1 1 5 3728 1 1 43 GLY HA3 H 4.471 -10.830 -3.358 1.00 . A A . 42 GLY HA3 1 1 5 3729 1 1 43 GLY N N 4.527 -9.699 -1.626 1.00 . A A . 42 GLY N 1 1 5 3730 1 1 43 GLY O O 3.240 -8.887 -4.891 1.00 . A A . 42 GLY O 1 1 5 3731 1 1 44 GLN C C 1.627 -6.586 -3.840 1.00 . A A . 43 GLN C 1 1 5 3732 1 1 44 GLN CA C 1.216 -7.914 -3.219 1.00 . A A . 43 GLN CA 1 1 5 3733 1 1 44 GLN CB C 0.311 -7.658 -2.008 1.00 . A A . 43 GLN CB 1 1 5 3734 1 1 44 GLN CD C -1.952 -7.544 -3.118 1.00 . A A . 43 GLN CD 1 1 5 3735 1 1 44 GLN CG C -0.910 -6.805 -2.306 1.00 . A A . 43 GLN CG 1 1 5 3736 1 1 44 GLN H H 2.502 -8.893 -1.860 1.00 . A A . 43 GLN H 1 1 5 3737 1 1 44 GLN HA H 0.677 -8.495 -3.951 1.00 . A A . 43 GLN HA 1 1 5 3738 1 1 44 GLN HB2 H -0.030 -8.608 -1.627 1.00 . A A . 43 GLN HB2 1 1 5 3739 1 1 44 GLN HB3 H 0.890 -7.162 -1.242 1.00 . A A . 43 GLN HB3 1 1 5 3740 1 1 44 GLN HE21 H -2.847 -8.152 -1.453 1.00 . A A . 43 GLN HE21 1 1 5 3741 1 1 44 GLN HE22 H -3.580 -8.675 -2.937 1.00 . A A . 43 GLN HE22 1 1 5 3742 1 1 44 GLN HG2 H -1.353 -6.493 -1.373 1.00 . A A . 43 GLN HG2 1 1 5 3743 1 1 44 GLN HG3 H -0.593 -5.935 -2.862 1.00 . A A . 43 GLN HG3 1 1 5 3744 1 1 44 GLN N N 2.392 -8.669 -2.809 1.00 . A A . 43 GLN N 1 1 5 3745 1 1 44 GLN NE2 N -2.883 -8.186 -2.434 1.00 . A A . 43 GLN NE2 1 1 5 3746 1 1 44 GLN O O 2.401 -5.834 -3.251 1.00 . A A . 43 GLN O 1 1 5 3747 1 1 44 GLN OE1 O -1.922 -7.529 -4.346 1.00 . A A . 43 GLN OE1 1 1 5 3748 1 1 45 LYS C C 0.298 -4.045 -5.341 1.00 . A A . 44 LYS C 1 1 5 3749 1 1 45 LYS CA C 1.394 -5.043 -5.683 1.00 . A A . 44 LYS CA 1 1 5 3750 1 1 45 LYS CB C 1.465 -5.232 -7.199 1.00 . A A . 44 LYS CB 1 1 5 3751 1 1 45 LYS CD C 3.326 -3.635 -7.776 1.00 . A A . 44 LYS CD 1 1 5 3752 1 1 45 LYS CE C 4.213 -4.743 -8.327 1.00 . A A . 44 LYS CE 1 1 5 3753 1 1 45 LYS CG C 1.852 -3.970 -7.955 1.00 . A A . 44 LYS CG 1 1 5 3754 1 1 45 LYS H H 0.546 -6.963 -5.469 1.00 . A A . 44 LYS H 1 1 5 3755 1 1 45 LYS HA H 2.343 -4.669 -5.321 1.00 . A A . 44 LYS HA 1 1 5 3756 1 1 45 LYS HB2 H 2.195 -5.997 -7.421 1.00 . A A . 44 LYS HB2 1 1 5 3757 1 1 45 LYS HB3 H 0.499 -5.555 -7.556 1.00 . A A . 44 LYS HB3 1 1 5 3758 1 1 45 LYS HD2 H 3.541 -2.716 -8.300 1.00 . A A . 44 LYS HD2 1 1 5 3759 1 1 45 LYS HD3 H 3.530 -3.509 -6.723 1.00 . A A . 44 LYS HD3 1 1 5 3760 1 1 45 LYS HE2 H 5.246 -4.485 -8.144 1.00 . A A . 44 LYS HE2 1 1 5 3761 1 1 45 LYS HE3 H 3.977 -5.664 -7.812 1.00 . A A . 44 LYS HE3 1 1 5 3762 1 1 45 LYS HG2 H 1.655 -4.119 -9.007 1.00 . A A . 44 LYS HG2 1 1 5 3763 1 1 45 LYS HG3 H 1.256 -3.147 -7.589 1.00 . A A . 44 LYS HG3 1 1 5 3764 1 1 45 LYS HZ1 H 3.044 -4.684 -10.068 1.00 . A A . 44 LYS HZ1 1 1 5 3765 1 1 45 LYS HZ2 H 4.175 -5.945 -10.037 1.00 . A A . 44 LYS HZ2 1 1 5 3766 1 1 45 LYS HZ3 H 4.691 -4.355 -10.329 1.00 . A A . 44 LYS HZ3 1 1 5 3767 1 1 45 LYS N N 1.122 -6.307 -5.026 1.00 . A A . 44 LYS N 1 1 5 3768 1 1 45 LYS NZ N 4.018 -4.943 -9.791 1.00 . A A . 44 LYS NZ 1 1 5 3769 1 1 45 LYS O O -0.833 -4.167 -5.819 1.00 . A A . 44 LYS O 1 1 5 3770 1 1 46 LEU C C 0.161 -0.673 -4.442 1.00 . A A . 45 LEU C 1 1 5 3771 1 1 46 LEU CA C -0.368 -2.074 -4.132 1.00 . A A . 45 LEU CA 1 1 5 3772 1 1 46 LEU CB C -0.812 -2.263 -2.648 1.00 . A A . 45 LEU CB 1 1 5 3773 1 1 46 LEU CD1 C 1.521 -2.070 -1.671 1.00 . A A . 45 LEU CD1 1 1 5 3774 1 1 46 LEU CD2 C -0.094 -0.189 -1.373 1.00 . A A . 45 LEU CD2 1 1 5 3775 1 1 46 LEU CG C 0.067 -1.693 -1.510 1.00 . A A . 45 LEU CG 1 1 5 3776 1 1 46 LEU H H 1.525 -3.021 -4.140 1.00 . A A . 45 LEU H 1 1 5 3777 1 1 46 LEU HA H -1.232 -2.239 -4.763 1.00 . A A . 45 LEU HA 1 1 5 3778 1 1 46 LEU HB2 H -1.792 -1.830 -2.542 1.00 . A A . 45 LEU HB2 1 1 5 3779 1 1 46 LEU HB3 H -0.901 -3.331 -2.474 1.00 . A A . 45 LEU HB3 1 1 5 3780 1 1 46 LEU HD11 H 2.085 -1.677 -0.841 1.00 . A A . 45 LEU HD11 1 1 5 3781 1 1 46 LEU HD12 H 1.900 -1.657 -2.594 1.00 . A A . 45 LEU HD12 1 1 5 3782 1 1 46 LEU HD13 H 1.614 -3.146 -1.692 1.00 . A A . 45 LEU HD13 1 1 5 3783 1 1 46 LEU HD21 H -1.125 0.043 -1.153 1.00 . A A . 45 LEU HD21 1 1 5 3784 1 1 46 LEU HD22 H 0.194 0.289 -2.297 1.00 . A A . 45 LEU HD22 1 1 5 3785 1 1 46 LEU HD23 H 0.534 0.170 -0.570 1.00 . A A . 45 LEU HD23 1 1 5 3786 1 1 46 LEU HG H -0.268 -2.135 -0.582 1.00 . A A . 45 LEU HG 1 1 5 3787 1 1 46 LEU N N 0.614 -3.073 -4.506 1.00 . A A . 45 LEU N 1 1 5 3788 1 1 46 LEU O O 1.356 -0.399 -4.298 1.00 . A A . 45 LEU O 1 1 5 3789 1 1 47 ILE C C -0.125 2.336 -3.957 1.00 . A A . 46 ILE C 1 1 5 3790 1 1 47 ILE CA C -0.368 1.563 -5.236 1.00 . A A . 46 ILE CA 1 1 5 3791 1 1 47 ILE CB C -1.472 2.297 -6.037 1.00 . A A . 46 ILE CB 1 1 5 3792 1 1 47 ILE CD1 C -0.564 1.480 -8.277 1.00 . A A . 46 ILE CD1 1 1 5 3793 1 1 47 ILE CG1 C -1.765 1.594 -7.363 1.00 . A A . 46 ILE CG1 1 1 5 3794 1 1 47 ILE CG2 C -1.075 3.749 -6.283 1.00 . A A . 46 ILE CG2 1 1 5 3795 1 1 47 ILE H H -1.647 -0.113 -5.089 1.00 . A A . 46 ILE H 1 1 5 3796 1 1 47 ILE HA H 0.538 1.557 -5.827 1.00 . A A . 46 ILE HA 1 1 5 3797 1 1 47 ILE HB H -2.371 2.299 -5.436 1.00 . A A . 46 ILE HB 1 1 5 3798 1 1 47 ILE HD11 H -0.854 0.981 -9.192 1.00 . A A . 46 ILE HD11 1 1 5 3799 1 1 47 ILE HD12 H 0.210 0.908 -7.786 1.00 . A A . 46 ILE HD12 1 1 5 3800 1 1 47 ILE HD13 H -0.194 2.466 -8.507 1.00 . A A . 46 ILE HD13 1 1 5 3801 1 1 47 ILE HG12 H -2.124 0.597 -7.162 1.00 . A A . 46 ILE HG12 1 1 5 3802 1 1 47 ILE HG13 H -2.533 2.151 -7.888 1.00 . A A . 46 ILE HG13 1 1 5 3803 1 1 47 ILE HG21 H -0.175 3.778 -6.879 1.00 . A A . 46 ILE HG21 1 1 5 3804 1 1 47 ILE HG22 H -0.896 4.242 -5.336 1.00 . A A . 46 ILE HG22 1 1 5 3805 1 1 47 ILE HG23 H -1.874 4.256 -6.808 1.00 . A A . 46 ILE HG23 1 1 5 3806 1 1 47 ILE N N -0.725 0.188 -4.931 1.00 . A A . 46 ILE N 1 1 5 3807 1 1 47 ILE O O -0.929 2.288 -3.026 1.00 . A A . 46 ILE O 1 1 5 3808 1 1 48 VAL C C 1.818 5.235 -3.356 1.00 . A A . 47 VAL C 1 1 5 3809 1 1 48 VAL CA C 1.260 3.922 -2.818 1.00 . A A . 47 VAL CA 1 1 5 3810 1 1 48 VAL CB C 2.212 3.281 -1.780 1.00 . A A . 47 VAL CB 1 1 5 3811 1 1 48 VAL CG1 C 3.562 2.941 -2.394 1.00 . A A . 47 VAL CG1 1 1 5 3812 1 1 48 VAL CG2 C 2.367 4.188 -0.569 1.00 . A A . 47 VAL CG2 1 1 5 3813 1 1 48 VAL H H 1.609 2.990 -4.662 1.00 . A A . 47 VAL H 1 1 5 3814 1 1 48 VAL HA H 0.321 4.131 -2.323 1.00 . A A . 47 VAL HA 1 1 5 3815 1 1 48 VAL HB H 1.759 2.357 -1.442 1.00 . A A . 47 VAL HB 1 1 5 3816 1 1 48 VAL HG11 H 4.032 3.845 -2.751 1.00 . A A . 47 VAL HG11 1 1 5 3817 1 1 48 VAL HG12 H 3.417 2.261 -3.219 1.00 . A A . 47 VAL HG12 1 1 5 3818 1 1 48 VAL HG13 H 4.193 2.477 -1.649 1.00 . A A . 47 VAL HG13 1 1 5 3819 1 1 48 VAL HG21 H 3.152 3.807 0.070 1.00 . A A . 47 VAL HG21 1 1 5 3820 1 1 48 VAL HG22 H 1.435 4.206 -0.016 1.00 . A A . 47 VAL HG22 1 1 5 3821 1 1 48 VAL HG23 H 2.617 5.188 -0.892 1.00 . A A . 47 VAL HG23 1 1 5 3822 1 1 48 VAL N N 0.975 3.041 -3.915 1.00 . A A . 47 VAL N 1 1 5 3823 1 1 48 VAL O O 2.748 5.277 -4.153 1.00 . A A . 47 VAL O 1 1 5 3824 1 1 49 LYS C C 1.482 8.541 -2.131 1.00 . A A . 48 LYS C 1 1 5 3825 1 1 49 LYS CA C 1.604 7.632 -3.343 1.00 . A A . 48 LYS CA 1 1 5 3826 1 1 49 LYS CB C 0.801 8.138 -4.544 1.00 . A A . 48 LYS CB 1 1 5 3827 1 1 49 LYS CD C 0.030 10.035 -5.987 1.00 . A A . 48 LYS CD 1 1 5 3828 1 1 49 LYS CE C -0.078 11.543 -6.152 1.00 . A A . 48 LYS CE 1 1 5 3829 1 1 49 LYS CG C 0.868 9.642 -4.778 1.00 . A A . 48 LYS CG 1 1 5 3830 1 1 49 LYS H H 0.331 6.175 -2.506 1.00 . A A . 48 LYS H 1 1 5 3831 1 1 49 LYS HA H 2.643 7.571 -3.622 1.00 . A A . 48 LYS HA 1 1 5 3832 1 1 49 LYS HB2 H 1.185 7.647 -5.429 1.00 . A A . 48 LYS HB2 1 1 5 3833 1 1 49 LYS HB3 H -0.235 7.858 -4.411 1.00 . A A . 48 LYS HB3 1 1 5 3834 1 1 49 LYS HD2 H 0.486 9.622 -6.873 1.00 . A A . 48 LYS HD2 1 1 5 3835 1 1 49 LYS HD3 H -0.963 9.625 -5.870 1.00 . A A . 48 LYS HD3 1 1 5 3836 1 1 49 LYS HE2 H -0.634 11.752 -7.053 1.00 . A A . 48 LYS HE2 1 1 5 3837 1 1 49 LYS HE3 H -0.610 11.948 -5.302 1.00 . A A . 48 LYS HE3 1 1 5 3838 1 1 49 LYS HG2 H 0.489 10.153 -3.905 1.00 . A A . 48 LYS HG2 1 1 5 3839 1 1 49 LYS HG3 H 1.894 9.927 -4.951 1.00 . A A . 48 LYS HG3 1 1 5 3840 1 1 49 LYS HZ1 H 1.664 12.311 -5.296 1.00 . A A . 48 LYS HZ1 1 1 5 3841 1 1 49 LYS HZ2 H 1.149 13.148 -6.676 1.00 . A A . 48 LYS HZ2 1 1 5 3842 1 1 49 LYS HZ3 H 1.899 11.636 -6.833 1.00 . A A . 48 LYS HZ3 1 1 5 3843 1 1 49 LYS N N 1.161 6.295 -2.998 1.00 . A A . 48 LYS N 1 1 5 3844 1 1 49 LYS NZ N 1.249 12.203 -6.247 1.00 . A A . 48 LYS NZ 1 1 5 3845 1 1 49 LYS O O 0.505 8.472 -1.391 1.00 . A A . 48 LYS O 1 1 5 3846 1 1 50 LYS C C 1.632 11.400 -0.860 1.00 . A A . 49 LYS C 1 1 5 3847 1 1 50 LYS CA C 2.522 10.181 -0.710 1.00 . A A . 49 LYS CA 1 1 5 3848 1 1 50 LYS CB C 3.955 10.602 -0.390 1.00 . A A . 49 LYS CB 1 1 5 3849 1 1 50 LYS CD C 6.244 9.883 0.362 1.00 . A A . 49 LYS CD 1 1 5 3850 1 1 50 LYS CE C 6.993 8.895 1.242 1.00 . A A . 49 LYS CE 1 1 5 3851 1 1 50 LYS CG C 4.786 9.485 0.215 1.00 . A A . 49 LYS CG 1 1 5 3852 1 1 50 LYS H H 3.224 9.425 -2.560 1.00 . A A . 49 LYS H 1 1 5 3853 1 1 50 LYS HA H 2.147 9.583 0.106 1.00 . A A . 49 LYS HA 1 1 5 3854 1 1 50 LYS HB2 H 4.437 10.926 -1.302 1.00 . A A . 49 LYS HB2 1 1 5 3855 1 1 50 LYS HB3 H 3.931 11.425 0.309 1.00 . A A . 49 LYS HB3 1 1 5 3856 1 1 50 LYS HD2 H 6.704 9.905 -0.616 1.00 . A A . 49 LYS HD2 1 1 5 3857 1 1 50 LYS HD3 H 6.296 10.865 0.810 1.00 . A A . 49 LYS HD3 1 1 5 3858 1 1 50 LYS HE2 H 6.742 7.892 0.931 1.00 . A A . 49 LYS HE2 1 1 5 3859 1 1 50 LYS HE3 H 8.054 9.056 1.118 1.00 . A A . 49 LYS HE3 1 1 5 3860 1 1 50 LYS HG2 H 4.389 9.241 1.188 1.00 . A A . 49 LYS HG2 1 1 5 3861 1 1 50 LYS HG3 H 4.724 8.617 -0.428 1.00 . A A . 49 LYS HG3 1 1 5 3862 1 1 50 LYS HZ1 H 7.150 9.881 3.079 1.00 . A A . 49 LYS HZ1 1 1 5 3863 1 1 50 LYS HZ2 H 6.901 8.207 3.220 1.00 . A A . 49 LYS HZ2 1 1 5 3864 1 1 50 LYS HZ3 H 5.619 9.224 2.784 1.00 . A A . 49 LYS HZ3 1 1 5 3865 1 1 50 LYS N N 2.491 9.359 -1.903 1.00 . A A . 49 LYS N 1 1 5 3866 1 1 50 LYS NZ N 6.640 9.059 2.680 1.00 . A A . 49 LYS NZ 1 1 5 3867 1 1 50 LYS O O 1.960 12.346 -1.573 1.00 . A A . 49 LYS O 1 1 5 3868 1 1 51 GLY C C -0.632 12.855 1.344 1.00 . A A . 50 GLY C 1 1 5 3869 1 1 51 GLY CA C -0.378 12.500 -0.097 1.00 . A A . 50 GLY CA 1 1 5 3870 1 1 51 GLY H H 0.253 10.525 0.274 1.00 . A A . 50 GLY H 1 1 5 3871 1 1 51 GLY HA2 H 0.079 13.340 -0.600 1.00 . A A . 50 GLY HA2 1 1 5 3872 1 1 51 GLY HA3 H -1.316 12.262 -0.577 1.00 . A A . 50 GLY HA3 1 1 5 3873 1 1 51 GLY N N 0.504 11.357 -0.177 1.00 . A A . 50 GLY N 1 1 5 3874 1 1 51 GLY O O -1.618 13.509 1.683 1.00 . A A . 50 GLY O 1 1 5 3875 1 1 52 SER C C 1.515 13.134 4.127 1.00 . A A . 51 SER C 1 1 5 3876 1 1 52 SER CA C 0.185 12.599 3.617 1.00 . A A . 51 SER CA 1 1 5 3877 1 1 52 SER CB C -0.173 11.281 4.310 1.00 . A A . 51 SER CB 1 1 5 3878 1 1 52 SER H H 1.043 11.908 1.836 1.00 . A A . 51 SER H 1 1 5 3879 1 1 52 SER HA H -0.588 13.328 3.810 1.00 . A A . 51 SER HA 1 1 5 3880 1 1 52 SER HB2 H 0.632 10.574 4.179 1.00 . A A . 51 SER HB2 1 1 5 3881 1 1 52 SER HB3 H -0.329 11.460 5.364 1.00 . A A . 51 SER HB3 1 1 5 3882 1 1 52 SER HG H -1.955 11.452 3.515 1.00 . A A . 51 SER HG 1 1 5 3883 1 1 52 SER N N 0.273 12.397 2.190 1.00 . A A . 51 SER N 1 1 5 3884 1 1 52 SER O O 1.529 14.222 4.734 1.00 . A A . 51 SER O 1 1 5 3885 1 1 52 SER OG O -1.362 10.732 3.759 1.00 . A A . 51 SER OG 1 1 6 3886 1 1 2 GLY C C 1.951 9.617 -12.147 1.00 . A A . 1 GLY C 1 1 6 3887 1 1 2 GLY CA C 0.927 10.158 -13.121 1.00 . A A . 1 GLY CA 1 1 6 3888 1 1 2 GLY H H -0.507 8.670 -12.836 1.00 . A A . 1 GLY H 1 1 6 3889 1 1 2 GLY HA2 H 1.444 10.606 -13.957 1.00 . A A . 1 GLY HA2 1 1 6 3890 1 1 2 GLY HA3 H 0.333 10.914 -12.628 1.00 . A A . 1 GLY HA3 1 1 6 3891 1 1 2 GLY N N 0.029 9.089 -13.627 1.00 . A A . 1 GLY N 1 1 6 3892 1 1 2 GLY O O 2.572 8.585 -12.405 1.00 . A A . 1 GLY O 1 1 6 3893 1 1 3 THR C C 2.385 8.845 -9.083 1.00 . A A . 2 THR C 1 1 6 3894 1 1 3 THR CA C 3.062 9.850 -10.010 1.00 . A A . 2 THR CA 1 1 6 3895 1 1 3 THR CB C 3.625 11.035 -9.200 1.00 . A A . 2 THR CB 1 1 6 3896 1 1 3 THR CG2 C 4.753 10.590 -8.280 1.00 . A A . 2 THR CG2 1 1 6 3897 1 1 3 THR H H 1.617 11.127 -10.875 1.00 . A A . 2 THR H 1 1 6 3898 1 1 3 THR HA H 3.886 9.359 -10.510 1.00 . A A . 2 THR HA 1 1 6 3899 1 1 3 THR HB H 2.832 11.460 -8.600 1.00 . A A . 2 THR HB 1 1 6 3900 1 1 3 THR HG1 H 4.579 11.598 -10.835 1.00 . A A . 2 THR HG1 1 1 6 3901 1 1 3 THR HG21 H 5.126 11.441 -7.732 1.00 . A A . 2 THR HG21 1 1 6 3902 1 1 3 THR HG22 H 5.552 10.164 -8.870 1.00 . A A . 2 THR HG22 1 1 6 3903 1 1 3 THR HG23 H 4.381 9.851 -7.588 1.00 . A A . 2 THR HG23 1 1 6 3904 1 1 3 THR N N 2.130 10.299 -11.026 1.00 . A A . 2 THR N 1 1 6 3905 1 1 3 THR O O 2.111 9.125 -7.917 1.00 . A A . 2 THR O 1 1 6 3906 1 1 3 THR OG1 O 4.119 12.034 -10.102 1.00 . A A . 2 THR OG1 1 1 6 3907 1 1 4 ASN C C 2.501 5.554 -8.586 1.00 . A A . 3 ASN C 1 1 6 3908 1 1 4 ASN CA C 1.457 6.615 -8.875 1.00 . A A . 3 ASN CA 1 1 6 3909 1 1 4 ASN CB C 0.304 5.994 -9.669 1.00 . A A . 3 ASN CB 1 1 6 3910 1 1 4 ASN CG C -0.807 5.472 -8.787 1.00 . A A . 3 ASN CG 1 1 6 3911 1 1 4 ASN H H 2.277 7.539 -10.587 1.00 . A A . 3 ASN H 1 1 6 3912 1 1 4 ASN HA H 1.086 7.021 -7.947 1.00 . A A . 3 ASN HA 1 1 6 3913 1 1 4 ASN HB2 H -0.109 6.733 -10.333 1.00 . A A . 3 ASN HB2 1 1 6 3914 1 1 4 ASN HB3 H 0.688 5.168 -10.249 1.00 . A A . 3 ASN HB3 1 1 6 3915 1 1 4 ASN HD21 H -1.158 3.994 -10.075 1.00 . A A . 3 ASN HD21 1 1 6 3916 1 1 4 ASN HD22 H -2.166 4.031 -8.666 1.00 . A A . 3 ASN HD22 1 1 6 3917 1 1 4 ASN N N 2.078 7.682 -9.636 1.00 . A A . 3 ASN N 1 1 6 3918 1 1 4 ASN ND2 N -1.442 4.393 -9.215 1.00 . A A . 3 ASN ND2 1 1 6 3919 1 1 4 ASN O O 3.000 4.910 -9.513 1.00 . A A . 3 ASN O 1 1 6 3920 1 1 4 ASN OD1 O -1.102 6.038 -7.739 1.00 . A A . 3 ASN OD1 1 1 6 3921 1 1 5 THR C C 3.147 3.160 -6.475 1.00 . A A . 4 THR C 1 1 6 3922 1 1 5 THR CA C 3.858 4.404 -6.979 1.00 . A A . 4 THR CA 1 1 6 3923 1 1 5 THR CB C 4.813 4.976 -5.904 1.00 . A A . 4 THR CB 1 1 6 3924 1 1 5 THR CG2 C 5.902 3.985 -5.514 1.00 . A A . 4 THR CG2 1 1 6 3925 1 1 5 THR H H 2.425 5.898 -6.608 1.00 . A A . 4 THR H 1 1 6 3926 1 1 5 THR HA H 4.427 4.158 -7.863 1.00 . A A . 4 THR HA 1 1 6 3927 1 1 5 THR HB H 4.226 5.212 -5.024 1.00 . A A . 4 THR HB 1 1 6 3928 1 1 5 THR HG1 H 4.730 6.836 -6.559 1.00 . A A . 4 THR HG1 1 1 6 3929 1 1 5 THR HG21 H 6.479 3.722 -6.388 1.00 . A A . 4 THR HG21 1 1 6 3930 1 1 5 THR HG22 H 5.447 3.096 -5.098 1.00 . A A . 4 THR HG22 1 1 6 3931 1 1 5 THR HG23 H 6.549 4.434 -4.775 1.00 . A A . 4 THR HG23 1 1 6 3932 1 1 5 THR N N 2.863 5.385 -7.330 1.00 . A A . 4 THR N 1 1 6 3933 1 1 5 THR O O 1.983 3.225 -6.096 1.00 . A A . 4 THR O 1 1 6 3934 1 1 5 THR OG1 O 5.417 6.183 -6.394 1.00 . A A . 4 THR OG1 1 1 6 3935 1 1 6 TYR C C 4.332 0.258 -4.978 1.00 . A A . 5 TYR C 1 1 6 3936 1 1 6 TYR CA C 3.270 0.856 -5.875 1.00 . A A . 5 TYR CA 1 1 6 3937 1 1 6 TYR CB C 2.745 -0.193 -6.873 1.00 . A A . 5 TYR CB 1 1 6 3938 1 1 6 TYR CD1 C 4.878 -1.164 -7.813 1.00 . A A . 5 TYR CD1 1 1 6 3939 1 1 6 TYR CD2 C 3.339 -0.149 -9.323 1.00 . A A . 5 TYR CD2 1 1 6 3940 1 1 6 TYR CE1 C 5.717 -1.465 -8.863 1.00 . A A . 5 TYR CE1 1 1 6 3941 1 1 6 TYR CE2 C 4.176 -0.443 -10.379 1.00 . A A . 5 TYR CE2 1 1 6 3942 1 1 6 TYR CG C 3.677 -0.501 -8.023 1.00 . A A . 5 TYR CG 1 1 6 3943 1 1 6 TYR CZ C 5.364 -1.103 -10.141 1.00 . A A . 5 TYR CZ 1 1 6 3944 1 1 6 TYR H H 4.645 1.970 -7.030 1.00 . A A . 5 TYR H 1 1 6 3945 1 1 6 TYR HA H 2.442 1.196 -5.249 1.00 . A A . 5 TYR HA 1 1 6 3946 1 1 6 TYR HB2 H 2.573 -1.125 -6.351 1.00 . A A . 5 TYR HB2 1 1 6 3947 1 1 6 TYR HB3 H 1.812 0.155 -7.290 1.00 . A A . 5 TYR HB3 1 1 6 3948 1 1 6 TYR HD1 H 5.155 -1.445 -6.808 1.00 . A A . 5 TYR HD1 1 1 6 3949 1 1 6 TYR HD2 H 2.408 0.369 -9.502 1.00 . A A . 5 TYR HD2 1 1 6 3950 1 1 6 TYR HE1 H 6.647 -1.981 -8.678 1.00 . A A . 5 TYR HE1 1 1 6 3951 1 1 6 TYR HE2 H 3.898 -0.159 -11.383 1.00 . A A . 5 TYR HE2 1 1 6 3952 1 1 6 TYR HH H 6.125 -0.736 -11.876 1.00 . A A . 5 TYR HH 1 1 6 3953 1 1 6 TYR N N 3.796 2.026 -6.535 1.00 . A A . 5 TYR N 1 1 6 3954 1 1 6 TYR O O 5.533 0.390 -5.232 1.00 . A A . 5 TYR O 1 1 6 3955 1 1 6 TYR OH O 6.199 -1.417 -11.184 1.00 . A A . 5 TYR OH 1 1 6 3956 1 1 7 TYR C C 4.536 -2.492 -2.949 1.00 . A A . 6 TYR C 1 1 6 3957 1 1 7 TYR CA C 4.763 -0.995 -2.973 1.00 . A A . 6 TYR CA 1 1 6 3958 1 1 7 TYR CB C 4.525 -0.394 -1.585 1.00 . A A . 6 TYR CB 1 1 6 3959 1 1 7 TYR CD1 C 6.554 -1.089 -0.253 1.00 . A A . 6 TYR CD1 1 1 6 3960 1 1 7 TYR CD2 C 4.429 -1.948 0.397 1.00 . A A . 6 TYR CD2 1 1 6 3961 1 1 7 TYR CE1 C 7.154 -1.789 0.776 1.00 . A A . 6 TYR CE1 1 1 6 3962 1 1 7 TYR CE2 C 5.021 -2.649 1.428 1.00 . A A . 6 TYR CE2 1 1 6 3963 1 1 7 TYR CG C 5.184 -1.156 -0.458 1.00 . A A . 6 TYR CG 1 1 6 3964 1 1 7 TYR CZ C 6.385 -2.566 1.612 1.00 . A A . 6 TYR CZ 1 1 6 3965 1 1 7 TYR H H 2.907 -0.434 -3.784 1.00 . A A . 6 TYR H 1 1 6 3966 1 1 7 TYR HA H 5.779 -0.795 -3.278 1.00 . A A . 6 TYR HA 1 1 6 3967 1 1 7 TYR HB2 H 4.907 0.616 -1.568 1.00 . A A . 6 TYR HB2 1 1 6 3968 1 1 7 TYR HB3 H 3.461 -0.372 -1.391 1.00 . A A . 6 TYR HB3 1 1 6 3969 1 1 7 TYR HD1 H 7.155 -0.479 -0.909 1.00 . A A . 6 TYR HD1 1 1 6 3970 1 1 7 TYR HD2 H 3.359 -2.009 0.250 1.00 . A A . 6 TYR HD2 1 1 6 3971 1 1 7 TYR HE1 H 8.223 -1.722 0.920 1.00 . A A . 6 TYR HE1 1 1 6 3972 1 1 7 TYR HE2 H 4.413 -3.258 2.082 1.00 . A A . 6 TYR HE2 1 1 6 3973 1 1 7 TYR HH H 7.818 -2.826 2.876 1.00 . A A . 6 TYR HH 1 1 6 3974 1 1 7 TYR N N 3.880 -0.379 -3.928 1.00 . A A . 6 TYR N 1 1 6 3975 1 1 7 TYR O O 3.420 -2.953 -2.705 1.00 . A A . 6 TYR O 1 1 6 3976 1 1 7 TYR OH O 6.987 -3.267 2.633 1.00 . A A . 6 TYR OH 1 1 6 3977 1 1 8 THR C C 5.510 -5.005 -1.583 1.00 . A A . 7 THR C 1 1 6 3978 1 1 8 THR CA C 5.537 -4.677 -3.056 1.00 . A A . 7 THR CA 1 1 6 3979 1 1 8 THR CB C 6.716 -5.385 -3.733 1.00 . A A . 7 THR CB 1 1 6 3980 1 1 8 THR CG2 C 6.312 -5.875 -5.110 1.00 . A A . 7 THR CG2 1 1 6 3981 1 1 8 THR H H 6.398 -2.830 -3.591 1.00 . A A . 7 THR H 1 1 6 3982 1 1 8 THR HA H 4.625 -5.038 -3.507 1.00 . A A . 7 THR HA 1 1 6 3983 1 1 8 THR HB H 6.987 -6.241 -3.134 1.00 . A A . 7 THR HB 1 1 6 3984 1 1 8 THR HG1 H 8.161 -4.293 -2.924 1.00 . A A . 7 THR HG1 1 1 6 3985 1 1 8 THR HG21 H 7.116 -6.454 -5.538 1.00 . A A . 7 THR HG21 1 1 6 3986 1 1 8 THR HG22 H 6.098 -5.028 -5.744 1.00 . A A . 7 THR HG22 1 1 6 3987 1 1 8 THR HG23 H 5.428 -6.492 -5.018 1.00 . A A . 7 THR HG23 1 1 6 3988 1 1 8 THR N N 5.581 -3.245 -3.242 1.00 . A A . 7 THR N 1 1 6 3989 1 1 8 THR O O 6.478 -4.761 -0.859 1.00 . A A . 7 THR O 1 1 6 3990 1 1 8 THR OG1 O 7.847 -4.505 -3.818 1.00 . A A . 7 THR OG1 1 1 6 3991 1 1 9 VAL C C 5.230 -6.818 0.744 1.00 . A A . 8 VAL C 1 1 6 3992 1 1 9 VAL CA C 4.167 -5.849 0.244 1.00 . A A . 8 VAL CA 1 1 6 3993 1 1 9 VAL CB C 2.776 -6.454 0.470 1.00 . A A . 8 VAL CB 1 1 6 3994 1 1 9 VAL CG1 C 2.585 -6.794 1.939 1.00 . A A . 8 VAL CG1 1 1 6 3995 1 1 9 VAL CG2 C 1.687 -5.504 -0.024 1.00 . A A . 8 VAL CG2 1 1 6 3996 1 1 9 VAL H H 3.657 -5.701 -1.799 1.00 . A A . 8 VAL H 1 1 6 3997 1 1 9 VAL HA H 4.230 -4.932 0.816 1.00 . A A . 8 VAL HA 1 1 6 3998 1 1 9 VAL HB H 2.708 -7.371 -0.099 1.00 . A A . 8 VAL HB 1 1 6 3999 1 1 9 VAL HG11 H 3.332 -7.516 2.239 1.00 . A A . 8 VAL HG11 1 1 6 4000 1 1 9 VAL HG12 H 1.599 -7.210 2.089 1.00 . A A . 8 VAL HG12 1 1 6 4001 1 1 9 VAL HG13 H 2.692 -5.898 2.533 1.00 . A A . 8 VAL HG13 1 1 6 4002 1 1 9 VAL HG21 H 1.811 -5.324 -1.084 1.00 . A A . 8 VAL HG21 1 1 6 4003 1 1 9 VAL HG22 H 1.758 -4.565 0.504 1.00 . A A . 8 VAL HG22 1 1 6 4004 1 1 9 VAL HG23 H 0.714 -5.940 0.153 1.00 . A A . 8 VAL HG23 1 1 6 4005 1 1 9 VAL N N 4.380 -5.527 -1.149 1.00 . A A . 8 VAL N 1 1 6 4006 1 1 9 VAL O O 5.493 -7.850 0.125 1.00 . A A . 8 VAL O 1 1 6 4007 1 1 10 LYS C C 6.374 -7.758 3.823 1.00 . A A . 9 LYS C 1 1 6 4008 1 1 10 LYS CA C 6.878 -7.254 2.481 1.00 . A A . 9 LYS CA 1 1 6 4009 1 1 10 LYS CB C 8.193 -6.484 2.614 1.00 . A A . 9 LYS CB 1 1 6 4010 1 1 10 LYS CD C 8.681 -6.886 0.178 1.00 . A A . 9 LYS CD 1 1 6 4011 1 1 10 LYS CE C 9.341 -7.917 -0.729 1.00 . A A . 9 LYS CE 1 1 6 4012 1 1 10 LYS CG C 9.234 -6.935 1.598 1.00 . A A . 9 LYS CG 1 1 6 4013 1 1 10 LYS H H 5.621 -5.585 2.247 1.00 . A A . 9 LYS H 1 1 6 4014 1 1 10 LYS HA H 7.047 -8.112 1.844 1.00 . A A . 9 LYS HA 1 1 6 4015 1 1 10 LYS HB2 H 8.002 -5.431 2.468 1.00 . A A . 9 LYS HB2 1 1 6 4016 1 1 10 LYS HB3 H 8.594 -6.639 3.604 1.00 . A A . 9 LYS HB3 1 1 6 4017 1 1 10 LYS HD2 H 7.620 -7.080 0.210 1.00 . A A . 9 LYS HD2 1 1 6 4018 1 1 10 LYS HD3 H 8.854 -5.901 -0.228 1.00 . A A . 9 LYS HD3 1 1 6 4019 1 1 10 LYS HE2 H 9.266 -8.886 -0.260 1.00 . A A . 9 LYS HE2 1 1 6 4020 1 1 10 LYS HE3 H 8.815 -7.935 -1.673 1.00 . A A . 9 LYS HE3 1 1 6 4021 1 1 10 LYS HG2 H 10.094 -6.285 1.662 1.00 . A A . 9 LYS HG2 1 1 6 4022 1 1 10 LYS HG3 H 9.529 -7.949 1.827 1.00 . A A . 9 LYS HG3 1 1 6 4023 1 1 10 LYS HZ1 H 10.862 -6.763 -1.574 1.00 . A A . 9 LYS HZ1 1 1 6 4024 1 1 10 LYS HZ2 H 11.231 -8.411 -1.470 1.00 . A A . 9 LYS HZ2 1 1 6 4025 1 1 10 LYS HZ3 H 11.273 -7.448 -0.076 1.00 . A A . 9 LYS HZ3 1 1 6 4026 1 1 10 LYS N N 5.857 -6.446 1.842 1.00 . A A . 9 LYS N 1 1 6 4027 1 1 10 LYS NZ N 10.774 -7.615 -0.979 1.00 . A A . 9 LYS NZ 1 1 6 4028 1 1 10 LYS O O 5.194 -7.602 4.126 1.00 . A A . 9 LYS O 1 1 6 4029 1 1 11 SER C C 5.943 -8.295 6.732 1.00 . A A . 10 SER C 1 1 6 4030 1 1 11 SER CA C 6.913 -9.087 5.840 1.00 . A A . 10 SER CA 1 1 6 4031 1 1 11 SER CB C 8.201 -9.364 6.600 1.00 . A A . 10 SER CB 1 1 6 4032 1 1 11 SER H H 8.186 -8.461 4.273 1.00 . A A . 10 SER H 1 1 6 4033 1 1 11 SER HA H 6.454 -10.025 5.593 1.00 . A A . 10 SER HA 1 1 6 4034 1 1 11 SER HB2 H 8.657 -8.427 6.890 1.00 . A A . 10 SER HB2 1 1 6 4035 1 1 11 SER HB3 H 7.981 -9.948 7.482 1.00 . A A . 10 SER HB3 1 1 6 4036 1 1 11 SER HG H 8.981 -11.033 5.933 1.00 . A A . 10 SER HG 1 1 6 4037 1 1 11 SER N N 7.255 -8.414 4.577 1.00 . A A . 10 SER N 1 1 6 4038 1 1 11 SER O O 5.211 -8.886 7.529 1.00 . A A . 10 SER O 1 1 6 4039 1 1 11 SER OG O 9.115 -10.084 5.790 1.00 . A A . 10 SER OG 1 1 6 4040 1 1 12 GLY C C 3.590 -6.259 6.518 1.00 . A A . 11 GLY C 1 1 6 4041 1 1 12 GLY CA C 4.913 -6.178 7.263 1.00 . A A . 11 GLY CA 1 1 6 4042 1 1 12 GLY H H 6.611 -6.549 6.051 1.00 . A A . 11 GLY H 1 1 6 4043 1 1 12 GLY HA2 H 4.774 -6.539 8.272 1.00 . A A . 11 GLY HA2 1 1 6 4044 1 1 12 GLY HA3 H 5.237 -5.148 7.296 1.00 . A A . 11 GLY HA3 1 1 6 4045 1 1 12 GLY N N 5.933 -6.977 6.606 1.00 . A A . 11 GLY N 1 1 6 4046 1 1 12 GLY O O 3.046 -5.248 6.092 1.00 . A A . 11 GLY O 1 1 6 4047 1 1 13 ASP C C 0.629 -7.037 5.935 1.00 . A A . 12 ASP C 1 1 6 4048 1 1 13 ASP CA C 1.903 -7.799 5.562 1.00 . A A . 12 ASP CA 1 1 6 4049 1 1 13 ASP CB C 1.608 -9.303 5.580 1.00 . A A . 12 ASP CB 1 1 6 4050 1 1 13 ASP CG C 1.112 -9.806 6.922 1.00 . A A . 12 ASP CG 1 1 6 4051 1 1 13 ASP H H 3.502 -8.207 6.891 1.00 . A A . 12 ASP H 1 1 6 4052 1 1 13 ASP HA H 2.163 -7.526 4.552 1.00 . A A . 12 ASP HA 1 1 6 4053 1 1 13 ASP HB2 H 0.852 -9.517 4.839 1.00 . A A . 12 ASP HB2 1 1 6 4054 1 1 13 ASP HB3 H 2.511 -9.840 5.327 1.00 . A A . 12 ASP HB3 1 1 6 4055 1 1 13 ASP N N 3.071 -7.475 6.398 1.00 . A A . 12 ASP N 1 1 6 4056 1 1 13 ASP O O -0.409 -7.237 5.314 1.00 . A A . 12 ASP O 1 1 6 4057 1 1 13 ASP OD1 O -0.031 -9.482 7.311 1.00 . A A . 12 ASP OD1 1 1 6 4058 1 1 13 ASP OD2 O 1.854 -10.557 7.585 1.00 . A A . 12 ASP OD2 1 1 6 4059 1 1 14 THR C C -0.617 -4.150 7.233 1.00 . A A . 13 THR C 1 1 6 4060 1 1 14 THR CA C -0.551 -5.650 7.496 1.00 . A A . 13 THR CA 1 1 6 4061 1 1 14 THR CB C -0.645 -5.935 9.007 1.00 . A A . 13 THR CB 1 1 6 4062 1 1 14 THR CG2 C -2.083 -5.850 9.493 1.00 . A A . 13 THR CG2 1 1 6 4063 1 1 14 THR H H 1.539 -5.902 7.298 1.00 . A A . 13 THR H 1 1 6 4064 1 1 14 THR HA H -1.386 -6.127 7.001 1.00 . A A . 13 THR HA 1 1 6 4065 1 1 14 THR HB H -0.051 -5.204 9.537 1.00 . A A . 13 THR HB 1 1 6 4066 1 1 14 THR HG1 H 0.040 -7.707 8.443 1.00 . A A . 13 THR HG1 1 1 6 4067 1 1 14 THR HG21 H -2.685 -6.570 8.961 1.00 . A A . 13 THR HG21 1 1 6 4068 1 1 14 THR HG22 H -2.467 -4.858 9.313 1.00 . A A . 13 THR HG22 1 1 6 4069 1 1 14 THR HG23 H -2.118 -6.064 10.550 1.00 . A A . 13 THR HG23 1 1 6 4070 1 1 14 THR N N 0.672 -6.204 6.953 1.00 . A A . 13 THR N 1 1 6 4071 1 1 14 THR O O 0.410 -3.468 7.208 1.00 . A A . 13 THR O 1 1 6 4072 1 1 14 THR OG1 O -0.137 -7.252 9.281 1.00 . A A . 13 THR OG1 1 1 6 4073 1 1 15 LEU C C -1.375 -1.256 7.429 1.00 . A A . 14 LEU C 1 1 6 4074 1 1 15 LEU CA C -2.083 -2.289 6.575 1.00 . A A . 14 LEU CA 1 1 6 4075 1 1 15 LEU CB C -3.586 -1.984 6.603 1.00 . A A . 14 LEU CB 1 1 6 4076 1 1 15 LEU CD1 C -4.077 -1.909 4.148 1.00 . A A . 14 LEU CD1 1 1 6 4077 1 1 15 LEU CD2 C -4.276 -4.079 5.375 1.00 . A A . 14 LEU CD2 1 1 6 4078 1 1 15 LEU CG C -4.435 -2.567 5.467 1.00 . A A . 14 LEU CG 1 1 6 4079 1 1 15 LEU H H -2.612 -4.218 7.253 1.00 . A A . 14 LEU H 1 1 6 4080 1 1 15 LEU HA H -1.728 -2.216 5.559 1.00 . A A . 14 LEU HA 1 1 6 4081 1 1 15 LEU HB2 H -3.979 -2.351 7.538 1.00 . A A . 14 LEU HB2 1 1 6 4082 1 1 15 LEU HB3 H -3.700 -0.910 6.588 1.00 . A A . 14 LEU HB3 1 1 6 4083 1 1 15 LEU HD11 H -4.684 -2.326 3.358 1.00 . A A . 14 LEU HD11 1 1 6 4084 1 1 15 LEU HD12 H -3.033 -2.086 3.930 1.00 . A A . 14 LEU HD12 1 1 6 4085 1 1 15 LEU HD13 H -4.255 -0.846 4.215 1.00 . A A . 14 LEU HD13 1 1 6 4086 1 1 15 LEU HD21 H -4.591 -4.534 6.302 1.00 . A A . 14 LEU HD21 1 1 6 4087 1 1 15 LEU HD22 H -3.239 -4.321 5.190 1.00 . A A . 14 LEU HD22 1 1 6 4088 1 1 15 LEU HD23 H -4.883 -4.456 4.564 1.00 . A A . 14 LEU HD23 1 1 6 4089 1 1 15 LEU HG H -5.477 -2.353 5.667 1.00 . A A . 14 LEU HG 1 1 6 4090 1 1 15 LEU N N -1.840 -3.651 7.053 1.00 . A A . 14 LEU N 1 1 6 4091 1 1 15 LEU O O -0.687 -0.381 6.910 1.00 . A A . 14 LEU O 1 1 6 4092 1 1 16 ASN C C 0.574 -0.414 9.562 1.00 . A A . 15 ASN C 1 1 6 4093 1 1 16 ASN CA C -0.946 -0.426 9.666 1.00 . A A . 15 ASN CA 1 1 6 4094 1 1 16 ASN CB C -1.386 -0.724 11.111 1.00 . A A . 15 ASN CB 1 1 6 4095 1 1 16 ASN CG C -0.949 -2.093 11.619 1.00 . A A . 15 ASN CG 1 1 6 4096 1 1 16 ASN H H -2.045 -2.139 9.088 1.00 . A A . 15 ASN H 1 1 6 4097 1 1 16 ASN HA H -1.311 0.552 9.389 1.00 . A A . 15 ASN HA 1 1 6 4098 1 1 16 ASN HB2 H -0.965 0.025 11.766 1.00 . A A . 15 ASN HB2 1 1 6 4099 1 1 16 ASN HB3 H -2.464 -0.670 11.164 1.00 . A A . 15 ASN HB3 1 1 6 4100 1 1 16 ASN HD21 H -0.858 -1.409 13.482 1.00 . A A . 15 ASN HD21 1 1 6 4101 1 1 16 ASN HD22 H -0.449 -3.073 13.272 1.00 . A A . 15 ASN HD22 1 1 6 4102 1 1 16 ASN N N -1.525 -1.383 8.736 1.00 . A A . 15 ASN N 1 1 6 4103 1 1 16 ASN ND2 N -0.730 -2.201 12.920 1.00 . A A . 15 ASN ND2 1 1 6 4104 1 1 16 ASN O O 1.198 0.641 9.647 1.00 . A A . 15 ASN O 1 1 6 4105 1 1 16 ASN OD1 O -0.820 -3.050 10.852 1.00 . A A . 15 ASN OD1 1 1 6 4106 1 1 17 LYS C C 3.230 -1.054 8.119 1.00 . A A . 16 LYS C 1 1 6 4107 1 1 17 LYS CA C 2.619 -1.680 9.357 1.00 . A A . 16 LYS CA 1 1 6 4108 1 1 17 LYS CB C 3.065 -3.138 9.493 1.00 . A A . 16 LYS CB 1 1 6 4109 1 1 17 LYS CD C 3.387 -2.888 11.976 1.00 . A A . 16 LYS CD 1 1 6 4110 1 1 17 LYS CE C 4.902 -2.830 11.874 1.00 . A A . 16 LYS CE 1 1 6 4111 1 1 17 LYS CG C 2.777 -3.730 10.863 1.00 . A A . 16 LYS CG 1 1 6 4112 1 1 17 LYS H H 0.625 -2.371 9.110 1.00 . A A . 16 LYS H 1 1 6 4113 1 1 17 LYS HA H 2.967 -1.134 10.221 1.00 . A A . 16 LYS HA 1 1 6 4114 1 1 17 LYS HB2 H 2.551 -3.731 8.751 1.00 . A A . 16 LYS HB2 1 1 6 4115 1 1 17 LYS HB3 H 4.129 -3.197 9.315 1.00 . A A . 16 LYS HB3 1 1 6 4116 1 1 17 LYS HD2 H 2.993 -1.884 11.909 1.00 . A A . 16 LYS HD2 1 1 6 4117 1 1 17 LYS HD3 H 3.115 -3.317 12.929 1.00 . A A . 16 LYS HD3 1 1 6 4118 1 1 17 LYS HE2 H 5.302 -3.808 12.093 1.00 . A A . 16 LYS HE2 1 1 6 4119 1 1 17 LYS HE3 H 5.170 -2.550 10.865 1.00 . A A . 16 LYS HE3 1 1 6 4120 1 1 17 LYS HG2 H 1.707 -3.778 11.005 1.00 . A A . 16 LYS HG2 1 1 6 4121 1 1 17 LYS HG3 H 3.193 -4.725 10.907 1.00 . A A . 16 LYS HG3 1 1 6 4122 1 1 17 LYS HZ1 H 6.526 -1.895 12.802 1.00 . A A . 16 LYS HZ1 1 1 6 4123 1 1 17 LYS HZ2 H 5.156 -2.039 13.796 1.00 . A A . 16 LYS HZ2 1 1 6 4124 1 1 17 LYS HZ3 H 5.190 -0.874 12.561 1.00 . A A . 16 LYS HZ3 1 1 6 4125 1 1 17 LYS N N 1.170 -1.580 9.338 1.00 . A A . 16 LYS N 1 1 6 4126 1 1 17 LYS NZ N 5.483 -1.843 12.824 1.00 . A A . 16 LYS NZ 1 1 6 4127 1 1 17 LYS O O 4.164 -0.258 8.209 1.00 . A A . 16 LYS O 1 1 6 4128 1 1 18 ILE C C 2.902 0.568 5.478 1.00 . A A . 17 ILE C 1 1 6 4129 1 1 18 ILE CA C 3.236 -0.894 5.714 1.00 . A A . 17 ILE CA 1 1 6 4130 1 1 18 ILE CB C 2.808 -1.738 4.502 1.00 . A A . 17 ILE CB 1 1 6 4131 1 1 18 ILE CD1 C 0.886 -2.890 3.329 1.00 . A A . 17 ILE CD1 1 1 6 4132 1 1 18 ILE CG1 C 1.325 -2.102 4.541 1.00 . A A . 17 ILE CG1 1 1 6 4133 1 1 18 ILE CG2 C 3.657 -2.988 4.422 1.00 . A A . 17 ILE CG2 1 1 6 4134 1 1 18 ILE H H 1.903 -1.981 6.947 1.00 . A A . 17 ILE H 1 1 6 4135 1 1 18 ILE HA H 4.311 -0.975 5.797 1.00 . A A . 17 ILE HA 1 1 6 4136 1 1 18 ILE HB H 2.996 -1.159 3.621 1.00 . A A . 17 ILE HB 1 1 6 4137 1 1 18 ILE HD11 H 1.614 -3.667 3.121 1.00 . A A . 17 ILE HD11 1 1 6 4138 1 1 18 ILE HD12 H 0.814 -2.230 2.477 1.00 . A A . 17 ILE HD12 1 1 6 4139 1 1 18 ILE HD13 H -0.078 -3.341 3.519 1.00 . A A . 17 ILE HD13 1 1 6 4140 1 1 18 ILE HG12 H 1.126 -2.701 5.417 1.00 . A A . 17 ILE HG12 1 1 6 4141 1 1 18 ILE HG13 H 0.736 -1.197 4.582 1.00 . A A . 17 ILE HG13 1 1 6 4142 1 1 18 ILE HG21 H 3.531 -3.560 5.329 1.00 . A A . 17 ILE HG21 1 1 6 4143 1 1 18 ILE HG22 H 4.695 -2.713 4.306 1.00 . A A . 17 ILE HG22 1 1 6 4144 1 1 18 ILE HG23 H 3.339 -3.579 3.577 1.00 . A A . 17 ILE HG23 1 1 6 4145 1 1 18 ILE N N 2.686 -1.388 6.961 1.00 . A A . 17 ILE N 1 1 6 4146 1 1 18 ILE O O 3.757 1.333 5.035 1.00 . A A . 17 ILE O 1 1 6 4147 1 1 19 ALA C C 2.091 3.289 6.421 1.00 . A A . 18 ALA C 1 1 6 4148 1 1 19 ALA CA C 1.242 2.335 5.596 1.00 . A A . 18 ALA CA 1 1 6 4149 1 1 19 ALA CB C -0.217 2.485 5.977 1.00 . A A . 18 ALA CB 1 1 6 4150 1 1 19 ALA H H 1.035 0.291 6.123 1.00 . A A . 18 ALA H 1 1 6 4151 1 1 19 ALA HA H 1.346 2.585 4.550 1.00 . A A . 18 ALA HA 1 1 6 4152 1 1 19 ALA HB1 H -0.814 1.800 5.394 1.00 . A A . 18 ALA HB1 1 1 6 4153 1 1 19 ALA HB2 H -0.539 3.496 5.786 1.00 . A A . 18 ALA HB2 1 1 6 4154 1 1 19 ALA HB3 H -0.334 2.259 7.026 1.00 . A A . 18 ALA HB3 1 1 6 4155 1 1 19 ALA N N 1.672 0.954 5.779 1.00 . A A . 18 ALA N 1 1 6 4156 1 1 19 ALA O O 2.628 4.266 5.896 1.00 . A A . 18 ALA O 1 1 6 4157 1 1 20 ALA C C 4.509 3.733 8.264 1.00 . A A . 19 ALA C 1 1 6 4158 1 1 20 ALA CA C 3.025 3.827 8.597 1.00 . A A . 19 ALA CA 1 1 6 4159 1 1 20 ALA CB C 2.774 3.443 10.046 1.00 . A A . 19 ALA CB 1 1 6 4160 1 1 20 ALA H H 1.839 2.160 8.056 1.00 . A A . 19 ALA H 1 1 6 4161 1 1 20 ALA HA H 2.700 4.849 8.455 1.00 . A A . 19 ALA HA 1 1 6 4162 1 1 20 ALA HB1 H 3.282 4.138 10.697 1.00 . A A . 19 ALA HB1 1 1 6 4163 1 1 20 ALA HB2 H 3.144 2.445 10.227 1.00 . A A . 19 ALA HB2 1 1 6 4164 1 1 20 ALA HB3 H 1.712 3.474 10.249 1.00 . A A . 19 ALA HB3 1 1 6 4165 1 1 20 ALA N N 2.251 2.979 7.702 1.00 . A A . 19 ALA N 1 1 6 4166 1 1 20 ALA O O 5.281 4.650 8.540 1.00 . A A . 19 ALA O 1 1 6 4167 1 1 21 GLN C C 6.809 3.460 6.335 1.00 . A A . 20 GLN C 1 1 6 4168 1 1 21 GLN CA C 6.280 2.375 7.277 1.00 . A A . 20 GLN CA 1 1 6 4169 1 1 21 GLN CB C 6.403 1.002 6.621 1.00 . A A . 20 GLN CB 1 1 6 4170 1 1 21 GLN CD C 7.879 -0.825 5.710 1.00 . A A . 20 GLN CD 1 1 6 4171 1 1 21 GLN CG C 7.827 0.553 6.342 1.00 . A A . 20 GLN CG 1 1 6 4172 1 1 21 GLN H H 4.205 1.946 7.420 1.00 . A A . 20 GLN H 1 1 6 4173 1 1 21 GLN HA H 6.865 2.385 8.184 1.00 . A A . 20 GLN HA 1 1 6 4174 1 1 21 GLN HB2 H 5.940 0.267 7.265 1.00 . A A . 20 GLN HB2 1 1 6 4175 1 1 21 GLN HB3 H 5.868 1.025 5.682 1.00 . A A . 20 GLN HB3 1 1 6 4176 1 1 21 GLN HE21 H 6.135 -0.505 4.816 1.00 . A A . 20 GLN HE21 1 1 6 4177 1 1 21 GLN HE22 H 6.855 -2.047 4.521 1.00 . A A . 20 GLN HE22 1 1 6 4178 1 1 21 GLN HG2 H 8.290 1.260 5.668 1.00 . A A . 20 GLN HG2 1 1 6 4179 1 1 21 GLN HG3 H 8.377 0.530 7.273 1.00 . A A . 20 GLN HG3 1 1 6 4180 1 1 21 GLN N N 4.888 2.624 7.639 1.00 . A A . 20 GLN N 1 1 6 4181 1 1 21 GLN NE2 N 6.855 -1.158 4.936 1.00 . A A . 20 GLN NE2 1 1 6 4182 1 1 21 GLN O O 7.894 3.998 6.546 1.00 . A A . 20 GLN O 1 1 6 4183 1 1 21 GLN OE1 O 8.830 -1.581 5.908 1.00 . A A . 20 GLN OE1 1 1 6 4184 1 1 22 TYR C C 5.667 6.124 4.557 1.00 . A A . 21 TYR C 1 1 6 4185 1 1 22 TYR CA C 6.453 4.831 4.361 1.00 . A A . 21 TYR CA 1 1 6 4186 1 1 22 TYR CB C 6.368 4.356 2.903 1.00 . A A . 21 TYR CB 1 1 6 4187 1 1 22 TYR CD1 C 3.909 3.789 2.699 1.00 . A A . 21 TYR CD1 1 1 6 4188 1 1 22 TYR CD2 C 5.512 2.113 2.163 1.00 . A A . 21 TYR CD2 1 1 6 4189 1 1 22 TYR CE1 C 2.887 2.909 2.395 1.00 . A A . 21 TYR CE1 1 1 6 4190 1 1 22 TYR CE2 C 4.498 1.232 1.854 1.00 . A A . 21 TYR CE2 1 1 6 4191 1 1 22 TYR CG C 5.237 3.403 2.590 1.00 . A A . 21 TYR CG 1 1 6 4192 1 1 22 TYR CZ C 3.187 1.633 1.971 1.00 . A A . 21 TYR CZ 1 1 6 4193 1 1 22 TYR H H 5.172 3.340 5.176 1.00 . A A . 21 TYR H 1 1 6 4194 1 1 22 TYR HA H 7.488 5.045 4.584 1.00 . A A . 21 TYR HA 1 1 6 4195 1 1 22 TYR HB2 H 6.247 5.216 2.265 1.00 . A A . 21 TYR HB2 1 1 6 4196 1 1 22 TYR HB3 H 7.295 3.860 2.648 1.00 . A A . 21 TYR HB3 1 1 6 4197 1 1 22 TYR HD1 H 3.678 4.789 3.031 1.00 . A A . 21 TYR HD1 1 1 6 4198 1 1 22 TYR HD2 H 6.541 1.800 2.073 1.00 . A A . 21 TYR HD2 1 1 6 4199 1 1 22 TYR HE1 H 1.858 3.226 2.484 1.00 . A A . 21 TYR HE1 1 1 6 4200 1 1 22 TYR HE2 H 4.736 0.233 1.518 1.00 . A A . 21 TYR HE2 1 1 6 4201 1 1 22 TYR HH H 2.355 -0.100 2.065 1.00 . A A . 21 TYR HH 1 1 6 4202 1 1 22 TYR N N 6.034 3.794 5.304 1.00 . A A . 21 TYR N 1 1 6 4203 1 1 22 TYR O O 5.702 7.019 3.711 1.00 . A A . 21 TYR O 1 1 6 4204 1 1 22 TYR OH O 2.173 0.755 1.665 1.00 . A A . 21 TYR OH 1 1 6 4205 1 1 23 GLY C C 3.101 7.794 5.204 1.00 . A A . 22 GLY C 1 1 6 4206 1 1 23 GLY CA C 4.322 7.468 6.042 1.00 . A A . 22 GLY CA 1 1 6 4207 1 1 23 GLY H H 4.881 5.438 6.261 1.00 . A A . 22 GLY H 1 1 6 4208 1 1 23 GLY HA2 H 4.024 7.408 7.079 1.00 . A A . 22 GLY HA2 1 1 6 4209 1 1 23 GLY HA3 H 5.041 8.268 5.937 1.00 . A A . 22 GLY HA3 1 1 6 4210 1 1 23 GLY N N 4.963 6.220 5.675 1.00 . A A . 22 GLY N 1 1 6 4211 1 1 23 GLY O O 2.987 8.897 4.671 1.00 . A A . 22 GLY O 1 1 6 4212 1 1 24 VAL C C -0.179 6.495 5.285 1.00 . A A . 23 VAL C 1 1 6 4213 1 1 24 VAL CA C 0.931 7.069 4.400 1.00 . A A . 23 VAL CA 1 1 6 4214 1 1 24 VAL CB C 0.896 6.448 2.979 1.00 . A A . 23 VAL CB 1 1 6 4215 1 1 24 VAL CG1 C 0.371 5.021 2.998 1.00 . A A . 23 VAL CG1 1 1 6 4216 1 1 24 VAL CG2 C 0.103 7.324 2.024 1.00 . A A . 23 VAL CG2 1 1 6 4217 1 1 24 VAL H H 2.401 5.933 5.410 1.00 . A A . 23 VAL H 1 1 6 4218 1 1 24 VAL HA H 0.793 8.138 4.315 1.00 . A A . 23 VAL HA 1 1 6 4219 1 1 24 VAL HB H 1.909 6.412 2.612 1.00 . A A . 23 VAL HB 1 1 6 4220 1 1 24 VAL HG11 H 1.024 4.406 3.600 1.00 . A A . 23 VAL HG11 1 1 6 4221 1 1 24 VAL HG12 H 0.340 4.634 1.991 1.00 . A A . 23 VAL HG12 1 1 6 4222 1 1 24 VAL HG13 H -0.624 5.008 3.419 1.00 . A A . 23 VAL HG13 1 1 6 4223 1 1 24 VAL HG21 H 0.553 8.305 1.978 1.00 . A A . 23 VAL HG21 1 1 6 4224 1 1 24 VAL HG22 H -0.914 7.410 2.378 1.00 . A A . 23 VAL HG22 1 1 6 4225 1 1 24 VAL HG23 H 0.105 6.879 1.039 1.00 . A A . 23 VAL HG23 1 1 6 4226 1 1 24 VAL N N 2.207 6.831 5.057 1.00 . A A . 23 VAL N 1 1 6 4227 1 1 24 VAL O O 0.113 5.893 6.320 1.00 . A A . 23 VAL O 1 1 6 4228 1 1 25 SER C C -3.265 5.035 5.079 1.00 . A A . 24 SER C 1 1 6 4229 1 1 25 SER CA C -2.528 6.198 5.740 1.00 . A A . 24 SER CA 1 1 6 4230 1 1 25 SER CB C -3.496 7.338 6.054 1.00 . A A . 24 SER CB 1 1 6 4231 1 1 25 SER H H -1.632 7.132 4.062 1.00 . A A . 24 SER H 1 1 6 4232 1 1 25 SER HA H -2.099 5.847 6.667 1.00 . A A . 24 SER HA 1 1 6 4233 1 1 25 SER HB2 H -3.926 7.709 5.135 1.00 . A A . 24 SER HB2 1 1 6 4234 1 1 25 SER HB3 H -4.282 6.975 6.701 1.00 . A A . 24 SER HB3 1 1 6 4235 1 1 25 SER HG H -2.347 8.049 7.478 1.00 . A A . 24 SER HG 1 1 6 4236 1 1 25 SER N N -1.435 6.681 4.913 1.00 . A A . 24 SER N 1 1 6 4237 1 1 25 SER O O -3.305 4.913 3.848 1.00 . A A . 24 SER O 1 1 6 4238 1 1 25 SER OG O -2.824 8.401 6.708 1.00 . A A . 24 SER OG 1 1 6 4239 1 1 26 VAL C C -5.731 3.461 4.507 1.00 . A A . 25 VAL C 1 1 6 4240 1 1 26 VAL CA C -4.592 3.027 5.432 1.00 . A A . 25 VAL CA 1 1 6 4241 1 1 26 VAL CB C -5.160 2.215 6.618 1.00 . A A . 25 VAL CB 1 1 6 4242 1 1 26 VAL CG1 C -5.858 0.954 6.140 1.00 . A A . 25 VAL CG1 1 1 6 4243 1 1 26 VAL CG2 C -4.056 1.869 7.605 1.00 . A A . 25 VAL CG2 1 1 6 4244 1 1 26 VAL H H -3.771 4.335 6.880 1.00 . A A . 25 VAL H 1 1 6 4245 1 1 26 VAL HA H -3.915 2.395 4.876 1.00 . A A . 25 VAL HA 1 1 6 4246 1 1 26 VAL HB H -5.888 2.829 7.128 1.00 . A A . 25 VAL HB 1 1 6 4247 1 1 26 VAL HG11 H -5.149 0.321 5.625 1.00 . A A . 25 VAL HG11 1 1 6 4248 1 1 26 VAL HG12 H -6.661 1.218 5.467 1.00 . A A . 25 VAL HG12 1 1 6 4249 1 1 26 VAL HG13 H -6.261 0.422 6.992 1.00 . A A . 25 VAL HG13 1 1 6 4250 1 1 26 VAL HG21 H -3.293 1.296 7.103 1.00 . A A . 25 VAL HG21 1 1 6 4251 1 1 26 VAL HG22 H -4.471 1.288 8.417 1.00 . A A . 25 VAL HG22 1 1 6 4252 1 1 26 VAL HG23 H -3.625 2.779 7.997 1.00 . A A . 25 VAL HG23 1 1 6 4253 1 1 26 VAL N N -3.846 4.182 5.909 1.00 . A A . 25 VAL N 1 1 6 4254 1 1 26 VAL O O -5.978 2.835 3.478 1.00 . A A . 25 VAL O 1 1 6 4255 1 1 27 ALA C C -7.160 5.393 2.661 1.00 . A A . 26 ALA C 1 1 6 4256 1 1 27 ALA CA C -7.532 5.060 4.106 1.00 . A A . 26 ALA CA 1 1 6 4257 1 1 27 ALA CB C -8.121 6.284 4.792 1.00 . A A . 26 ALA CB 1 1 6 4258 1 1 27 ALA H H -6.119 5.031 5.686 1.00 . A A . 26 ALA H 1 1 6 4259 1 1 27 ALA HA H -8.289 4.289 4.099 1.00 . A A . 26 ALA HA 1 1 6 4260 1 1 27 ALA HB1 H -9.024 6.584 4.282 1.00 . A A . 26 ALA HB1 1 1 6 4261 1 1 27 ALA HB2 H -7.406 7.094 4.762 1.00 . A A . 26 ALA HB2 1 1 6 4262 1 1 27 ALA HB3 H -8.350 6.046 5.820 1.00 . A A . 26 ALA HB3 1 1 6 4263 1 1 27 ALA N N -6.393 4.556 4.870 1.00 . A A . 26 ALA N 1 1 6 4264 1 1 27 ALA O O -7.854 4.985 1.725 1.00 . A A . 26 ALA O 1 1 6 4265 1 1 28 ASN C C -5.185 5.391 0.259 1.00 . A A . 27 ASN C 1 1 6 4266 1 1 28 ASN CA C -5.673 6.540 1.124 1.00 . A A . 27 ASN CA 1 1 6 4267 1 1 28 ASN CB C -4.657 7.696 1.123 1.00 . A A . 27 ASN CB 1 1 6 4268 1 1 28 ASN CG C -3.754 7.731 2.328 1.00 . A A . 27 ASN CG 1 1 6 4269 1 1 28 ASN H H -5.485 6.335 3.230 1.00 . A A . 27 ASN H 1 1 6 4270 1 1 28 ASN HA H -6.577 6.906 0.665 1.00 . A A . 27 ASN HA 1 1 6 4271 1 1 28 ASN HB2 H -4.026 7.604 0.251 1.00 . A A . 27 ASN HB2 1 1 6 4272 1 1 28 ASN HB3 H -5.192 8.634 1.070 1.00 . A A . 27 ASN HB3 1 1 6 4273 1 1 28 ASN HD21 H -4.903 9.120 3.168 1.00 . A A . 27 ASN HD21 1 1 6 4274 1 1 28 ASN HD22 H -3.507 8.643 4.079 1.00 . A A . 27 ASN HD22 1 1 6 4275 1 1 28 ASN N N -6.053 6.106 2.467 1.00 . A A . 27 ASN N 1 1 6 4276 1 1 28 ASN ND2 N -4.091 8.575 3.292 1.00 . A A . 27 ASN ND2 1 1 6 4277 1 1 28 ASN O O -5.565 5.319 -0.910 1.00 . A A . 27 ASN O 1 1 6 4278 1 1 28 ASN OD1 O -2.753 7.039 2.382 1.00 . A A . 27 ASN OD1 1 1 6 4279 1 1 29 LEU C C -5.055 2.429 -0.413 1.00 . A A . 28 LEU C 1 1 6 4280 1 1 29 LEU CA C -3.920 3.382 -0.054 1.00 . A A . 28 LEU CA 1 1 6 4281 1 1 29 LEU CB C -2.666 2.658 0.473 1.00 . A A . 28 LEU CB 1 1 6 4282 1 1 29 LEU CD1 C -3.480 0.945 2.122 1.00 . A A . 28 LEU CD1 1 1 6 4283 1 1 29 LEU CD2 C -1.198 1.954 2.335 1.00 . A A . 28 LEU CD2 1 1 6 4284 1 1 29 LEU CG C -2.643 2.202 1.928 1.00 . A A . 28 LEU CG 1 1 6 4285 1 1 29 LEU H H -4.093 4.539 1.730 1.00 . A A . 28 LEU H 1 1 6 4286 1 1 29 LEU HA H -3.636 3.857 -0.986 1.00 . A A . 28 LEU HA 1 1 6 4287 1 1 29 LEU HB2 H -2.515 1.784 -0.138 1.00 . A A . 28 LEU HB2 1 1 6 4288 1 1 29 LEU HB3 H -1.822 3.318 0.320 1.00 . A A . 28 LEU HB3 1 1 6 4289 1 1 29 LEU HD11 H -3.050 0.132 1.555 1.00 . A A . 28 LEU HD11 1 1 6 4290 1 1 29 LEU HD12 H -4.487 1.127 1.780 1.00 . A A . 28 LEU HD12 1 1 6 4291 1 1 29 LEU HD13 H -3.501 0.682 3.168 1.00 . A A . 28 LEU HD13 1 1 6 4292 1 1 29 LEU HD21 H -1.127 1.893 3.411 1.00 . A A . 28 LEU HD21 1 1 6 4293 1 1 29 LEU HD22 H -0.577 2.766 1.970 1.00 . A A . 28 LEU HD22 1 1 6 4294 1 1 29 LEU HD23 H -0.858 1.025 1.898 1.00 . A A . 28 LEU HD23 1 1 6 4295 1 1 29 LEU HG H -3.043 2.981 2.559 1.00 . A A . 28 LEU HG 1 1 6 4296 1 1 29 LEU N N -4.379 4.475 0.792 1.00 . A A . 28 LEU N 1 1 6 4297 1 1 29 LEU O O -5.079 1.888 -1.512 1.00 . A A . 28 LEU O 1 1 6 4298 1 1 30 ARG C C -7.986 2.183 -0.983 1.00 . A A . 29 ARG C 1 1 6 4299 1 1 30 ARG CA C -7.211 1.483 0.136 1.00 . A A . 29 ARG CA 1 1 6 4300 1 1 30 ARG CB C -8.112 1.304 1.361 1.00 . A A . 29 ARG CB 1 1 6 4301 1 1 30 ARG CD C -8.308 0.522 3.739 1.00 . A A . 29 ARG CD 1 1 6 4302 1 1 30 ARG CG C -7.507 0.433 2.449 1.00 . A A . 29 ARG CG 1 1 6 4303 1 1 30 ARG CZ C -10.773 0.699 3.524 1.00 . A A . 29 ARG CZ 1 1 6 4304 1 1 30 ARG H H -5.934 2.645 1.375 1.00 . A A . 29 ARG H 1 1 6 4305 1 1 30 ARG HA H -6.891 0.512 -0.213 1.00 . A A . 29 ARG HA 1 1 6 4306 1 1 30 ARG HB2 H -8.321 2.274 1.785 1.00 . A A . 29 ARG HB2 1 1 6 4307 1 1 30 ARG HB3 H -9.043 0.853 1.047 1.00 . A A . 29 ARG HB3 1 1 6 4308 1 1 30 ARG HD2 H -7.780 -0.019 4.511 1.00 . A A . 29 ARG HD2 1 1 6 4309 1 1 30 ARG HD3 H -8.383 1.563 4.022 1.00 . A A . 29 ARG HD3 1 1 6 4310 1 1 30 ARG HE H -9.736 -1.015 3.567 1.00 . A A . 29 ARG HE 1 1 6 4311 1 1 30 ARG HG2 H -7.497 -0.593 2.112 1.00 . A A . 29 ARG HG2 1 1 6 4312 1 1 30 ARG HG3 H -6.495 0.761 2.638 1.00 . A A . 29 ARG HG3 1 1 6 4313 1 1 30 ARG HH11 H -9.831 2.477 3.778 1.00 . A A . 29 ARG HH11 1 1 6 4314 1 1 30 ARG HH12 H -11.553 2.578 3.549 1.00 . A A . 29 ARG HH12 1 1 6 4315 1 1 30 ARG HH21 H -12.006 -0.893 3.320 1.00 . A A . 29 ARG HH21 1 1 6 4316 1 1 30 ARG HH22 H -12.793 0.656 3.298 1.00 . A A . 29 ARG HH22 1 1 6 4317 1 1 30 ARG N N -6.020 2.254 0.478 1.00 . A A . 29 ARG N 1 1 6 4318 1 1 30 ARG NE N -9.658 -0.036 3.602 1.00 . A A . 29 ARG NE 1 1 6 4319 1 1 30 ARG NH1 N -10.712 2.022 3.627 1.00 . A A . 29 ARG NH1 1 1 6 4320 1 1 30 ARG NH2 N -11.948 0.104 3.370 1.00 . A A . 29 ARG NH2 1 1 6 4321 1 1 30 ARG O O -8.569 1.534 -1.852 1.00 . A A . 29 ARG O 1 1 6 4322 1 1 31 SER C C -8.237 4.194 -3.346 1.00 . A A . 30 SER C 1 1 6 4323 1 1 31 SER CA C -8.732 4.319 -1.897 1.00 . A A . 30 SER CA 1 1 6 4324 1 1 31 SER CB C -8.695 5.782 -1.443 1.00 . A A . 30 SER CB 1 1 6 4325 1 1 31 SER H H -7.384 3.965 -0.308 1.00 . A A . 30 SER H 1 1 6 4326 1 1 31 SER HA H -9.751 3.970 -1.854 1.00 . A A . 30 SER HA 1 1 6 4327 1 1 31 SER HB2 H -9.068 5.849 -0.432 1.00 . A A . 30 SER HB2 1 1 6 4328 1 1 31 SER HB3 H -7.675 6.136 -1.470 1.00 . A A . 30 SER HB3 1 1 6 4329 1 1 31 SER HG H -10.239 6.106 -2.621 1.00 . A A . 30 SER HG 1 1 6 4330 1 1 31 SER N N -7.948 3.511 -0.972 1.00 . A A . 30 SER N 1 1 6 4331 1 1 31 SER O O -9.042 4.012 -4.258 1.00 . A A . 30 SER O 1 1 6 4332 1 1 31 SER OG O -9.489 6.615 -2.271 1.00 . A A . 30 SER OG 1 1 6 4333 1 1 32 TRP C C -6.087 2.742 -5.343 1.00 . A A . 31 TRP C 1 1 6 4334 1 1 32 TRP CA C -6.398 4.178 -4.931 1.00 . A A . 31 TRP CA 1 1 6 4335 1 1 32 TRP CB C -5.161 5.071 -5.138 1.00 . A A . 31 TRP CB 1 1 6 4336 1 1 32 TRP CD1 C -3.600 3.888 -3.503 1.00 . A A . 31 TRP CD1 1 1 6 4337 1 1 32 TRP CD2 C -3.574 6.115 -3.340 1.00 . A A . 31 TRP CD2 1 1 6 4338 1 1 32 TRP CE2 C -2.679 5.584 -2.395 1.00 . A A . 31 TRP CE2 1 1 6 4339 1 1 32 TRP CE3 C -3.720 7.502 -3.418 1.00 . A A . 31 TRP CE3 1 1 6 4340 1 1 32 TRP CG C -4.156 5.008 -4.034 1.00 . A A . 31 TRP CG 1 1 6 4341 1 1 32 TRP CH2 C -2.104 7.736 -1.632 1.00 . A A . 31 TRP CH2 1 1 6 4342 1 1 32 TRP CZ2 C -1.941 6.387 -1.533 1.00 . A A . 31 TRP CZ2 1 1 6 4343 1 1 32 TRP CZ3 C -2.979 8.298 -2.564 1.00 . A A . 31 TRP CZ3 1 1 6 4344 1 1 32 TRP H H -6.308 4.368 -2.809 1.00 . A A . 31 TRP H 1 1 6 4345 1 1 32 TRP HA H -7.182 4.538 -5.582 1.00 . A A . 31 TRP HA 1 1 6 4346 1 1 32 TRP HB2 H -4.660 4.758 -6.049 1.00 . A A . 31 TRP HB2 1 1 6 4347 1 1 32 TRP HB3 H -5.480 6.098 -5.244 1.00 . A A . 31 TRP HB3 1 1 6 4348 1 1 32 TRP HD1 H -3.835 2.883 -3.821 1.00 . A A . 31 TRP HD1 1 1 6 4349 1 1 32 TRP HE1 H -2.186 3.592 -1.985 1.00 . A A . 31 TRP HE1 1 1 6 4350 1 1 32 TRP HE3 H -4.391 7.953 -4.131 1.00 . A A . 31 TRP HE3 1 1 6 4351 1 1 32 TRP HH2 H -1.546 8.397 -0.985 1.00 . A A . 31 TRP HH2 1 1 6 4352 1 1 32 TRP HZ2 H -1.257 5.970 -0.806 1.00 . A A . 31 TRP HZ2 1 1 6 4353 1 1 32 TRP HZ3 H -3.067 9.369 -2.613 1.00 . A A . 31 TRP HZ3 1 1 6 4354 1 1 32 TRP N N -6.925 4.258 -3.566 1.00 . A A . 31 TRP N 1 1 6 4355 1 1 32 TRP NE1 N -2.712 4.227 -2.520 1.00 . A A . 31 TRP NE1 1 1 6 4356 1 1 32 TRP O O -5.677 2.493 -6.475 1.00 . A A . 31 TRP O 1 1 6 4357 1 1 33 ASN C C -7.481 -0.201 -5.134 1.00 . A A . 32 ASN C 1 1 6 4358 1 1 33 ASN CA C -6.125 0.390 -4.780 1.00 . A A . 32 ASN CA 1 1 6 4359 1 1 33 ASN CB C -5.482 -0.408 -3.637 1.00 . A A . 32 ASN CB 1 1 6 4360 1 1 33 ASN CG C -3.968 -0.412 -3.704 1.00 . A A . 32 ASN CG 1 1 6 4361 1 1 33 ASN H H -6.516 2.051 -3.516 1.00 . A A . 32 ASN H 1 1 6 4362 1 1 33 ASN HA H -5.488 0.333 -5.650 1.00 . A A . 32 ASN HA 1 1 6 4363 1 1 33 ASN HB2 H -5.775 0.025 -2.691 1.00 . A A . 32 ASN HB2 1 1 6 4364 1 1 33 ASN HB3 H -5.827 -1.431 -3.681 1.00 . A A . 32 ASN HB3 1 1 6 4365 1 1 33 ASN HD21 H -3.883 1.168 -2.509 1.00 . A A . 32 ASN HD21 1 1 6 4366 1 1 33 ASN HD22 H -2.358 0.556 -3.050 1.00 . A A . 32 ASN HD22 1 1 6 4367 1 1 33 ASN N N -6.275 1.798 -4.431 1.00 . A A . 32 ASN N 1 1 6 4368 1 1 33 ASN ND2 N -3.338 0.528 -3.020 1.00 . A A . 32 ASN ND2 1 1 6 4369 1 1 33 ASN O O -7.570 -1.204 -5.839 1.00 . A A . 32 ASN O 1 1 6 4370 1 1 33 ASN OD1 O -3.367 -1.264 -4.355 1.00 . A A . 32 ASN OD1 1 1 6 4371 1 1 34 GLY C C -10.301 -1.255 -4.326 1.00 . A A . 33 GLY C 1 1 6 4372 1 1 34 GLY CA C -9.887 0.039 -4.995 1.00 . A A . 33 GLY CA 1 1 6 4373 1 1 34 GLY H H -8.399 1.198 -4.037 1.00 . A A . 33 GLY H 1 1 6 4374 1 1 34 GLY HA2 H -10.573 0.818 -4.698 1.00 . A A . 33 GLY HA2 1 1 6 4375 1 1 34 GLY HA3 H -9.946 -0.086 -6.066 1.00 . A A . 33 GLY HA3 1 1 6 4376 1 1 34 GLY N N -8.538 0.443 -4.649 1.00 . A A . 33 GLY N 1 1 6 4377 1 1 34 GLY O O -11.301 -1.862 -4.707 1.00 . A A . 33 GLY O 1 1 6 4378 1 1 35 ILE C C -9.946 -2.711 -1.147 1.00 . A A . 34 ILE C 1 1 6 4379 1 1 35 ILE CA C -9.808 -2.920 -2.636 1.00 . A A . 34 ILE CA 1 1 6 4380 1 1 35 ILE CB C -8.709 -3.980 -2.853 1.00 . A A . 34 ILE CB 1 1 6 4381 1 1 35 ILE CD1 C -6.240 -4.297 -3.403 1.00 . A A . 34 ILE CD1 1 1 6 4382 1 1 35 ILE CG1 C -7.416 -3.345 -3.370 1.00 . A A . 34 ILE CG1 1 1 6 4383 1 1 35 ILE CG2 C -9.210 -5.070 -3.781 1.00 . A A . 34 ILE CG2 1 1 6 4384 1 1 35 ILE H H -8.779 -1.121 -3.045 1.00 . A A . 34 ILE H 1 1 6 4385 1 1 35 ILE HA H -10.737 -3.318 -3.018 1.00 . A A . 34 ILE HA 1 1 6 4386 1 1 35 ILE HB H -8.510 -4.437 -1.895 1.00 . A A . 34 ILE HB 1 1 6 4387 1 1 35 ILE HD11 H -6.457 -5.115 -4.075 1.00 . A A . 34 ILE HD11 1 1 6 4388 1 1 35 ILE HD12 H -6.063 -4.685 -2.410 1.00 . A A . 34 ILE HD12 1 1 6 4389 1 1 35 ILE HD13 H -5.361 -3.771 -3.746 1.00 . A A . 34 ILE HD13 1 1 6 4390 1 1 35 ILE HG12 H -7.577 -2.985 -4.375 1.00 . A A . 34 ILE HG12 1 1 6 4391 1 1 35 ILE HG13 H -7.152 -2.513 -2.733 1.00 . A A . 34 ILE HG13 1 1 6 4392 1 1 35 ILE HG21 H -9.499 -4.635 -4.725 1.00 . A A . 34 ILE HG21 1 1 6 4393 1 1 35 ILE HG22 H -10.063 -5.554 -3.329 1.00 . A A . 34 ILE HG22 1 1 6 4394 1 1 35 ILE HG23 H -8.426 -5.796 -3.939 1.00 . A A . 34 ILE HG23 1 1 6 4395 1 1 35 ILE N N -9.538 -1.672 -3.329 1.00 . A A . 34 ILE N 1 1 6 4396 1 1 35 ILE O O -9.519 -1.693 -0.602 1.00 . A A . 34 ILE O 1 1 6 4397 1 1 36 SER C C -9.256 -4.241 1.447 1.00 . A A . 35 SER C 1 1 6 4398 1 1 36 SER CA C -10.595 -3.721 0.934 1.00 . A A . 35 SER CA 1 1 6 4399 1 1 36 SER CB C -11.744 -4.617 1.388 1.00 . A A . 35 SER CB 1 1 6 4400 1 1 36 SER H H -10.967 -4.416 -1.011 1.00 . A A . 35 SER H 1 1 6 4401 1 1 36 SER HA H -10.753 -2.716 1.295 1.00 . A A . 35 SER HA 1 1 6 4402 1 1 36 SER HB2 H -12.643 -4.337 0.861 1.00 . A A . 35 SER HB2 1 1 6 4403 1 1 36 SER HB3 H -11.504 -5.646 1.160 1.00 . A A . 35 SER HB3 1 1 6 4404 1 1 36 SER HG H -11.719 -5.330 3.215 1.00 . A A . 35 SER HG 1 1 6 4405 1 1 36 SER N N -10.547 -3.687 -0.500 1.00 . A A . 35 SER N 1 1 6 4406 1 1 36 SER O O -8.664 -5.142 0.847 1.00 . A A . 35 SER O 1 1 6 4407 1 1 36 SER OG O -11.976 -4.498 2.779 1.00 . A A . 35 SER OG 1 1 6 4408 1 1 37 GLY C C -7.493 -5.361 3.812 1.00 . A A . 36 GLY C 1 1 6 4409 1 1 37 GLY CA C -7.480 -4.036 3.076 1.00 . A A . 36 GLY CA 1 1 6 4410 1 1 37 GLY H H -9.333 -3.019 3.013 1.00 . A A . 36 GLY H 1 1 6 4411 1 1 37 GLY HA2 H -6.774 -4.097 2.260 1.00 . A A . 36 GLY HA2 1 1 6 4412 1 1 37 GLY HA3 H -7.156 -3.262 3.757 1.00 . A A . 36 GLY HA3 1 1 6 4413 1 1 37 GLY N N -8.783 -3.677 2.545 1.00 . A A . 36 GLY N 1 1 6 4414 1 1 37 GLY O O -7.043 -5.451 4.953 1.00 . A A . 36 GLY O 1 1 6 4415 1 1 38 ASP C C -6.936 -8.561 3.128 1.00 . A A . 37 ASP C 1 1 6 4416 1 1 38 ASP CA C -8.045 -7.721 3.738 1.00 . A A . 37 ASP CA 1 1 6 4417 1 1 38 ASP CB C -9.398 -8.393 3.493 1.00 . A A . 37 ASP CB 1 1 6 4418 1 1 38 ASP CG C -10.547 -7.648 4.136 1.00 . A A . 37 ASP CG 1 1 6 4419 1 1 38 ASP H H -8.398 -6.238 2.270 1.00 . A A . 37 ASP H 1 1 6 4420 1 1 38 ASP HA H -7.878 -7.633 4.801 1.00 . A A . 37 ASP HA 1 1 6 4421 1 1 38 ASP HB2 H -9.581 -8.444 2.429 1.00 . A A . 37 ASP HB2 1 1 6 4422 1 1 38 ASP HB3 H -9.372 -9.395 3.896 1.00 . A A . 37 ASP HB3 1 1 6 4423 1 1 38 ASP N N -8.018 -6.385 3.165 1.00 . A A . 37 ASP N 1 1 6 4424 1 1 38 ASP O O -6.240 -9.301 3.824 1.00 . A A . 37 ASP O 1 1 6 4425 1 1 38 ASP OD1 O -10.692 -7.722 5.372 1.00 . A A . 37 ASP OD1 1 1 6 4426 1 1 38 ASP OD2 O -11.315 -6.983 3.408 1.00 . A A . 37 ASP OD2 1 1 6 4427 1 1 39 LEU C C -4.491 -8.331 0.912 1.00 . A A . 38 LEU C 1 1 6 4428 1 1 39 LEU CA C -5.754 -9.168 1.096 1.00 . A A . 38 LEU CA 1 1 6 4429 1 1 39 LEU CB C -6.280 -9.654 -0.269 1.00 . A A . 38 LEU CB 1 1 6 4430 1 1 39 LEU CD1 C -6.797 -9.101 -2.664 1.00 . A A . 38 LEU CD1 1 1 6 4431 1 1 39 LEU CD2 C -8.173 -8.085 -0.854 1.00 . A A . 38 LEU CD2 1 1 6 4432 1 1 39 LEU CG C -6.780 -8.569 -1.240 1.00 . A A . 38 LEU CG 1 1 6 4433 1 1 39 LEU H H -7.348 -7.807 1.328 1.00 . A A . 38 LEU H 1 1 6 4434 1 1 39 LEU HA H -5.500 -10.031 1.694 1.00 . A A . 38 LEU HA 1 1 6 4435 1 1 39 LEU HB2 H -5.485 -10.198 -0.760 1.00 . A A . 38 LEU HB2 1 1 6 4436 1 1 39 LEU HB3 H -7.095 -10.340 -0.087 1.00 . A A . 38 LEU HB3 1 1 6 4437 1 1 39 LEU HD11 H -5.804 -9.428 -2.940 1.00 . A A . 38 LEU HD11 1 1 6 4438 1 1 39 LEU HD12 H -7.117 -8.319 -3.338 1.00 . A A . 38 LEU HD12 1 1 6 4439 1 1 39 LEU HD13 H -7.482 -9.935 -2.731 1.00 . A A . 38 LEU HD13 1 1 6 4440 1 1 39 LEU HD21 H -8.509 -7.348 -1.570 1.00 . A A . 38 LEU HD21 1 1 6 4441 1 1 39 LEU HD22 H -8.140 -7.641 0.131 1.00 . A A . 38 LEU HD22 1 1 6 4442 1 1 39 LEU HD23 H -8.857 -8.921 -0.849 1.00 . A A . 38 LEU HD23 1 1 6 4443 1 1 39 LEU HG H -6.107 -7.726 -1.204 1.00 . A A . 38 LEU HG 1 1 6 4444 1 1 39 LEU N N -6.772 -8.426 1.820 1.00 . A A . 38 LEU N 1 1 6 4445 1 1 39 LEU O O -4.417 -7.479 0.027 1.00 . A A . 38 LEU O 1 1 6 4446 1 1 40 ILE C C -1.147 -8.980 2.055 1.00 . A A . 39 ILE C 1 1 6 4447 1 1 40 ILE CA C -2.203 -7.950 1.653 1.00 . A A . 39 ILE CA 1 1 6 4448 1 1 40 ILE CB C -2.039 -6.648 2.488 1.00 . A A . 39 ILE CB 1 1 6 4449 1 1 40 ILE CD1 C -2.422 -4.126 2.321 1.00 . A A . 39 ILE CD1 1 1 6 4450 1 1 40 ILE CG1 C -2.879 -5.508 1.891 1.00 . A A . 39 ILE CG1 1 1 6 4451 1 1 40 ILE CG2 C -0.579 -6.230 2.571 1.00 . A A . 39 ILE CG2 1 1 6 4452 1 1 40 ILE H H -3.706 -9.116 2.568 1.00 . A A . 39 ILE H 1 1 6 4453 1 1 40 ILE HA H -2.064 -7.704 0.609 1.00 . A A . 39 ILE HA 1 1 6 4454 1 1 40 ILE HB H -2.384 -6.849 3.490 1.00 . A A . 39 ILE HB 1 1 6 4455 1 1 40 ILE HD11 H -1.446 -3.926 1.899 1.00 . A A . 39 ILE HD11 1 1 6 4456 1 1 40 ILE HD12 H -2.360 -4.087 3.401 1.00 . A A . 39 ILE HD12 1 1 6 4457 1 1 40 ILE HD13 H -3.124 -3.381 1.972 1.00 . A A . 39 ILE HD13 1 1 6 4458 1 1 40 ILE HG12 H -2.823 -5.554 0.814 1.00 . A A . 39 ILE HG12 1 1 6 4459 1 1 40 ILE HG13 H -3.908 -5.630 2.198 1.00 . A A . 39 ILE HG13 1 1 6 4460 1 1 40 ILE HG21 H -0.489 -5.351 3.199 1.00 . A A . 39 ILE HG21 1 1 6 4461 1 1 40 ILE HG22 H -0.212 -6.003 1.581 1.00 . A A . 39 ILE HG22 1 1 6 4462 1 1 40 ILE HG23 H 0.004 -7.037 2.998 1.00 . A A . 39 ILE HG23 1 1 6 4463 1 1 40 ILE N N -3.527 -8.540 1.795 1.00 . A A . 39 ILE N 1 1 6 4464 1 1 40 ILE O O -1.125 -9.447 3.196 1.00 . A A . 39 ILE O 1 1 6 4465 1 1 41 PHE C C 2.000 -10.074 0.599 1.00 . A A . 40 PHE C 1 1 6 4466 1 1 41 PHE CA C 0.709 -10.383 1.349 1.00 . A A . 40 PHE CA 1 1 6 4467 1 1 41 PHE CB C 0.176 -11.764 0.944 1.00 . A A . 40 PHE CB 1 1 6 4468 1 1 41 PHE CD1 C 0.627 -12.204 -1.489 1.00 . A A . 40 PHE CD1 1 1 6 4469 1 1 41 PHE CD2 C -1.590 -11.617 -0.838 1.00 . A A . 40 PHE CD2 1 1 6 4470 1 1 41 PHE CE1 C 0.220 -12.299 -2.804 1.00 . A A . 40 PHE CE1 1 1 6 4471 1 1 41 PHE CE2 C -2.003 -11.712 -2.151 1.00 . A A . 40 PHE CE2 1 1 6 4472 1 1 41 PHE CG C -0.270 -11.863 -0.490 1.00 . A A . 40 PHE CG 1 1 6 4473 1 1 41 PHE CZ C -1.097 -12.051 -3.136 1.00 . A A . 40 PHE CZ 1 1 6 4474 1 1 41 PHE H H -0.352 -8.942 0.220 1.00 . A A . 40 PHE H 1 1 6 4475 1 1 41 PHE HA H 0.920 -10.389 2.408 1.00 . A A . 40 PHE HA 1 1 6 4476 1 1 41 PHE HB2 H 0.951 -12.499 1.098 1.00 . A A . 40 PHE HB2 1 1 6 4477 1 1 41 PHE HB3 H -0.670 -12.010 1.571 1.00 . A A . 40 PHE HB3 1 1 6 4478 1 1 41 PHE HD1 H 1.659 -12.399 -1.229 1.00 . A A . 40 PHE HD1 1 1 6 4479 1 1 41 PHE HD2 H -2.301 -11.350 -0.069 1.00 . A A . 40 PHE HD2 1 1 6 4480 1 1 41 PHE HE1 H 0.930 -12.565 -3.573 1.00 . A A . 40 PHE HE1 1 1 6 4481 1 1 41 PHE HE2 H -3.035 -11.519 -2.408 1.00 . A A . 40 PHE HE2 1 1 6 4482 1 1 41 PHE HZ H -1.421 -12.126 -4.164 1.00 . A A . 40 PHE HZ 1 1 6 4483 1 1 41 PHE N N -0.298 -9.358 1.107 1.00 . A A . 40 PHE N 1 1 6 4484 1 1 41 PHE O O 2.023 -9.220 -0.287 1.00 . A A . 40 PHE O 1 1 6 4485 1 1 42 VAL C C 4.361 -10.777 -1.145 1.00 . A A . 41 VAL C 1 1 6 4486 1 1 42 VAL CA C 4.381 -10.554 0.367 1.00 . A A . 41 VAL CA 1 1 6 4487 1 1 42 VAL CB C 5.444 -11.473 1.009 1.00 . A A . 41 VAL CB 1 1 6 4488 1 1 42 VAL CG1 C 6.829 -11.172 0.456 1.00 . A A . 41 VAL CG1 1 1 6 4489 1 1 42 VAL CG2 C 5.425 -11.331 2.525 1.00 . A A . 41 VAL CG2 1 1 6 4490 1 1 42 VAL H H 2.962 -11.490 1.623 1.00 . A A . 41 VAL H 1 1 6 4491 1 1 42 VAL HA H 4.658 -9.527 0.565 1.00 . A A . 41 VAL HA 1 1 6 4492 1 1 42 VAL HB H 5.201 -12.496 0.762 1.00 . A A . 41 VAL HB 1 1 6 4493 1 1 42 VAL HG11 H 6.837 -11.350 -0.609 1.00 . A A . 41 VAL HG11 1 1 6 4494 1 1 42 VAL HG12 H 7.556 -11.812 0.934 1.00 . A A . 41 VAL HG12 1 1 6 4495 1 1 42 VAL HG13 H 7.078 -10.139 0.649 1.00 . A A . 41 VAL HG13 1 1 6 4496 1 1 42 VAL HG21 H 5.621 -10.303 2.793 1.00 . A A . 41 VAL HG21 1 1 6 4497 1 1 42 VAL HG22 H 6.183 -11.967 2.957 1.00 . A A . 41 VAL HG22 1 1 6 4498 1 1 42 VAL HG23 H 4.455 -11.621 2.902 1.00 . A A . 41 VAL HG23 1 1 6 4499 1 1 42 VAL N N 3.065 -10.784 0.954 1.00 . A A . 41 VAL N 1 1 6 4500 1 1 42 VAL O O 3.881 -11.806 -1.622 1.00 . A A . 41 VAL O 1 1 6 4501 1 1 43 GLY C C 3.784 -9.126 -3.995 1.00 . A A . 42 GLY C 1 1 6 4502 1 1 43 GLY CA C 4.908 -9.900 -3.338 1.00 . A A . 42 GLY CA 1 1 6 4503 1 1 43 GLY H H 5.246 -9.000 -1.446 1.00 . A A . 42 GLY H 1 1 6 4504 1 1 43 GLY HA2 H 5.851 -9.514 -3.694 1.00 . A A . 42 GLY HA2 1 1 6 4505 1 1 43 GLY HA3 H 4.827 -10.940 -3.616 1.00 . A A . 42 GLY HA3 1 1 6 4506 1 1 43 GLY N N 4.876 -9.799 -1.888 1.00 . A A . 42 GLY N 1 1 6 4507 1 1 43 GLY O O 3.810 -8.870 -5.199 1.00 . A A . 42 GLY O 1 1 6 4508 1 1 44 GLN C C 1.994 -6.562 -3.969 1.00 . A A . 43 GLN C 1 1 6 4509 1 1 44 GLN CA C 1.641 -8.022 -3.702 1.00 . A A . 43 GLN CA 1 1 6 4510 1 1 44 GLN CB C 0.508 -8.117 -2.682 1.00 . A A . 43 GLN CB 1 1 6 4511 1 1 44 GLN CD C -1.765 -7.386 -1.918 1.00 . A A . 43 GLN CD 1 1 6 4512 1 1 44 GLN CG C -0.677 -7.206 -2.953 1.00 . A A . 43 GLN CG 1 1 6 4513 1 1 44 GLN H H 2.839 -8.987 -2.250 1.00 . A A . 43 GLN H 1 1 6 4514 1 1 44 GLN HA H 1.325 -8.484 -4.626 1.00 . A A . 43 GLN HA 1 1 6 4515 1 1 44 GLN HB2 H 0.146 -9.135 -2.663 1.00 . A A . 43 GLN HB2 1 1 6 4516 1 1 44 GLN HB3 H 0.904 -7.872 -1.708 1.00 . A A . 43 GLN HB3 1 1 6 4517 1 1 44 GLN HE21 H -2.311 -5.489 -2.111 1.00 . A A . 43 GLN HE21 1 1 6 4518 1 1 44 GLN HE22 H -3.218 -6.425 -0.970 1.00 . A A . 43 GLN HE22 1 1 6 4519 1 1 44 GLN HG2 H -0.343 -6.177 -2.928 1.00 . A A . 43 GLN HG2 1 1 6 4520 1 1 44 GLN HG3 H -1.083 -7.430 -3.930 1.00 . A A . 43 GLN HG3 1 1 6 4521 1 1 44 GLN N N 2.795 -8.757 -3.203 1.00 . A A . 43 GLN N 1 1 6 4522 1 1 44 GLN NE2 N -2.503 -6.327 -1.639 1.00 . A A . 43 GLN NE2 1 1 6 4523 1 1 44 GLN O O 2.567 -5.892 -3.114 1.00 . A A . 43 GLN O 1 1 6 4524 1 1 44 GLN OE1 O -1.930 -8.469 -1.363 1.00 . A A . 43 GLN OE1 1 1 6 4525 1 1 45 LYS C C 0.619 -3.874 -5.163 1.00 . A A . 44 LYS C 1 1 6 4526 1 1 45 LYS CA C 1.864 -4.675 -5.486 1.00 . A A . 44 LYS CA 1 1 6 4527 1 1 45 LYS CB C 2.206 -4.487 -6.966 1.00 . A A . 44 LYS CB 1 1 6 4528 1 1 45 LYS CD C 3.906 -4.590 -8.794 1.00 . A A . 44 LYS CD 1 1 6 4529 1 1 45 LYS CE C 5.216 -5.213 -9.250 1.00 . A A . 44 LYS CE 1 1 6 4530 1 1 45 LYS CG C 3.619 -4.890 -7.334 1.00 . A A . 44 LYS CG 1 1 6 4531 1 1 45 LYS H H 1.246 -6.677 -5.822 1.00 . A A . 44 LYS H 1 1 6 4532 1 1 45 LYS HA H 2.683 -4.308 -4.885 1.00 . A A . 44 LYS HA 1 1 6 4533 1 1 45 LYS HB2 H 1.525 -5.083 -7.556 1.00 . A A . 44 LYS HB2 1 1 6 4534 1 1 45 LYS HB3 H 2.072 -3.446 -7.224 1.00 . A A . 44 LYS HB3 1 1 6 4535 1 1 45 LYS HD2 H 3.103 -4.983 -9.397 1.00 . A A . 44 LYS HD2 1 1 6 4536 1 1 45 LYS HD3 H 3.963 -3.517 -8.922 1.00 . A A . 44 LYS HD3 1 1 6 4537 1 1 45 LYS HE2 H 6.019 -4.815 -8.648 1.00 . A A . 44 LYS HE2 1 1 6 4538 1 1 45 LYS HE3 H 5.160 -6.284 -9.111 1.00 . A A . 44 LYS HE3 1 1 6 4539 1 1 45 LYS HG2 H 4.308 -4.329 -6.719 1.00 . A A . 44 LYS HG2 1 1 6 4540 1 1 45 LYS HG3 H 3.745 -5.947 -7.157 1.00 . A A . 44 LYS HG3 1 1 6 4541 1 1 45 LYS HZ1 H 6.063 -5.692 -11.098 1.00 . A A . 44 LYS HZ1 1 1 6 4542 1 1 45 LYS HZ2 H 6.026 -4.035 -10.773 1.00 . A A . 44 LYS HZ2 1 1 6 4543 1 1 45 LYS HZ3 H 4.600 -4.841 -11.212 1.00 . A A . 44 LYS HZ3 1 1 6 4544 1 1 45 LYS N N 1.660 -6.077 -5.156 1.00 . A A . 44 LYS N 1 1 6 4545 1 1 45 LYS NZ N 5.495 -4.926 -10.680 1.00 . A A . 44 LYS NZ 1 1 6 4546 1 1 45 LYS O O -0.396 -3.978 -5.855 1.00 . A A . 44 LYS O 1 1 6 4547 1 1 46 LEU C C 0.035 -0.762 -4.040 1.00 . A A . 45 LEU C 1 1 6 4548 1 1 46 LEU CA C -0.398 -2.198 -3.770 1.00 . A A . 45 LEU CA 1 1 6 4549 1 1 46 LEU CB C -0.845 -2.422 -2.308 1.00 . A A . 45 LEU CB 1 1 6 4550 1 1 46 LEU CD1 C -0.141 -0.428 -0.930 1.00 . A A . 45 LEU CD1 1 1 6 4551 1 1 46 LEU CD2 C -0.147 -2.703 0.061 1.00 . A A . 45 LEU CD2 1 1 6 4552 1 1 46 LEU CG C 0.082 -1.908 -1.202 1.00 . A A . 45 LEU CG 1 1 6 4553 1 1 46 LEU H H 1.500 -3.095 -3.551 1.00 . A A . 45 LEU H 1 1 6 4554 1 1 46 LEU HA H -1.224 -2.432 -4.428 1.00 . A A . 45 LEU HA 1 1 6 4555 1 1 46 LEU HB2 H -1.809 -1.956 -2.176 1.00 . A A . 45 LEU HB2 1 1 6 4556 1 1 46 LEU HB3 H -0.963 -3.491 -2.158 1.00 . A A . 45 LEU HB3 1 1 6 4557 1 1 46 LEU HD11 H 0.467 -0.121 -0.090 1.00 . A A . 45 LEU HD11 1 1 6 4558 1 1 46 LEU HD12 H -1.185 -0.259 -0.702 1.00 . A A . 45 LEU HD12 1 1 6 4559 1 1 46 LEU HD13 H 0.133 0.146 -1.804 1.00 . A A . 45 LEU HD13 1 1 6 4560 1 1 46 LEU HD21 H 0.035 -3.750 -0.136 1.00 . A A . 45 LEU HD21 1 1 6 4561 1 1 46 LEU HD22 H -1.169 -2.570 0.391 1.00 . A A . 45 LEU HD22 1 1 6 4562 1 1 46 LEU HD23 H 0.528 -2.358 0.829 1.00 . A A . 45 LEU HD23 1 1 6 4563 1 1 46 LEU HG H 1.110 -2.049 -1.503 1.00 . A A . 45 LEU HG 1 1 6 4564 1 1 46 LEU N N 0.692 -3.084 -4.109 1.00 . A A . 45 LEU N 1 1 6 4565 1 1 46 LEU O O 1.182 -0.399 -3.778 1.00 . A A . 45 LEU O 1 1 6 4566 1 1 47 ILE C C -0.276 2.233 -3.698 1.00 . A A . 46 ILE C 1 1 6 4567 1 1 47 ILE CA C -0.546 1.416 -4.955 1.00 . A A . 46 ILE CA 1 1 6 4568 1 1 47 ILE CB C -1.678 2.127 -5.761 1.00 . A A . 46 ILE CB 1 1 6 4569 1 1 47 ILE CD1 C -2.415 0.081 -7.136 1.00 . A A . 46 ILE CD1 1 1 6 4570 1 1 47 ILE CG1 C -1.905 1.507 -7.146 1.00 . A A . 46 ILE CG1 1 1 6 4571 1 1 47 ILE CG2 C -1.352 3.605 -5.939 1.00 . A A . 46 ILE CG2 1 1 6 4572 1 1 47 ILE H H -1.764 -0.315 -4.788 1.00 . A A . 46 ILE H 1 1 6 4573 1 1 47 ILE HA H 0.347 1.405 -5.562 1.00 . A A . 46 ILE HA 1 1 6 4574 1 1 47 ILE HB H -2.591 2.055 -5.188 1.00 . A A . 46 ILE HB 1 1 6 4575 1 1 47 ILE HD11 H -3.348 0.036 -6.594 1.00 . A A . 46 ILE HD11 1 1 6 4576 1 1 47 ILE HD12 H -1.687 -0.558 -6.658 1.00 . A A . 46 ILE HD12 1 1 6 4577 1 1 47 ILE HD13 H -2.573 -0.249 -8.154 1.00 . A A . 46 ILE HD13 1 1 6 4578 1 1 47 ILE HG12 H -2.636 2.109 -7.670 1.00 . A A . 46 ILE HG12 1 1 6 4579 1 1 47 ILE HG13 H -0.974 1.525 -7.695 1.00 . A A . 46 ILE HG13 1 1 6 4580 1 1 47 ILE HG21 H -0.498 3.711 -6.599 1.00 . A A . 46 ILE HG21 1 1 6 4581 1 1 47 ILE HG22 H -1.119 4.046 -4.978 1.00 . A A . 46 ILE HG22 1 1 6 4582 1 1 47 ILE HG23 H -2.201 4.113 -6.371 1.00 . A A . 46 ILE HG23 1 1 6 4583 1 1 47 ILE N N -0.863 0.035 -4.605 1.00 . A A . 46 ILE N 1 1 6 4584 1 1 47 ILE O O -0.960 2.085 -2.685 1.00 . A A . 46 ILE O 1 1 6 4585 1 1 48 VAL C C 1.632 5.287 -3.404 1.00 . A A . 47 VAL C 1 1 6 4586 1 1 48 VAL CA C 1.016 4.048 -2.749 1.00 . A A . 47 VAL CA 1 1 6 4587 1 1 48 VAL CB C 1.953 3.472 -1.659 1.00 . A A . 47 VAL CB 1 1 6 4588 1 1 48 VAL CG1 C 3.301 3.065 -2.234 1.00 . A A . 47 VAL CG1 1 1 6 4589 1 1 48 VAL CG2 C 2.123 4.467 -0.522 1.00 . A A . 47 VAL CG2 1 1 6 4590 1 1 48 VAL H H 1.286 3.078 -4.582 1.00 . A A . 47 VAL H 1 1 6 4591 1 1 48 VAL HA H 0.079 4.324 -2.278 1.00 . A A . 47 VAL HA 1 1 6 4592 1 1 48 VAL HB H 1.484 2.584 -1.252 1.00 . A A . 47 VAL HB 1 1 6 4593 1 1 48 VAL HG11 H 3.918 2.656 -1.448 1.00 . A A . 47 VAL HG11 1 1 6 4594 1 1 48 VAL HG12 H 3.786 3.932 -2.659 1.00 . A A . 47 VAL HG12 1 1 6 4595 1 1 48 VAL HG13 H 3.154 2.321 -3.003 1.00 . A A . 47 VAL HG13 1 1 6 4596 1 1 48 VAL HG21 H 2.470 5.410 -0.915 1.00 . A A . 47 VAL HG21 1 1 6 4597 1 1 48 VAL HG22 H 2.846 4.085 0.183 1.00 . A A . 47 VAL HG22 1 1 6 4598 1 1 48 VAL HG23 H 1.175 4.609 -0.022 1.00 . A A . 47 VAL HG23 1 1 6 4599 1 1 48 VAL N N 0.725 3.085 -3.778 1.00 . A A . 47 VAL N 1 1 6 4600 1 1 48 VAL O O 2.517 5.191 -4.257 1.00 . A A . 47 VAL O 1 1 6 4601 1 1 49 LYS C C 1.400 8.852 -2.624 1.00 . A A . 48 LYS C 1 1 6 4602 1 1 49 LYS CA C 1.657 7.693 -3.579 1.00 . A A . 48 LYS CA 1 1 6 4603 1 1 49 LYS CB C 1.110 8.031 -4.967 1.00 . A A . 48 LYS CB 1 1 6 4604 1 1 49 LYS CD C -0.836 8.821 -6.339 1.00 . A A . 48 LYS CD 1 1 6 4605 1 1 49 LYS CE C -2.310 9.182 -6.330 1.00 . A A . 48 LYS CE 1 1 6 4606 1 1 49 LYS CG C -0.383 8.301 -4.988 1.00 . A A . 48 LYS CG 1 1 6 4607 1 1 49 LYS H H 0.281 6.441 -2.555 1.00 . A A . 48 LYS H 1 1 6 4608 1 1 49 LYS HA H 2.719 7.555 -3.657 1.00 . A A . 48 LYS HA 1 1 6 4609 1 1 49 LYS HB2 H 1.619 8.909 -5.337 1.00 . A A . 48 LYS HB2 1 1 6 4610 1 1 49 LYS HB3 H 1.313 7.202 -5.630 1.00 . A A . 48 LYS HB3 1 1 6 4611 1 1 49 LYS HD2 H -0.260 9.701 -6.587 1.00 . A A . 48 LYS HD2 1 1 6 4612 1 1 49 LYS HD3 H -0.666 8.055 -7.081 1.00 . A A . 48 LYS HD3 1 1 6 4613 1 1 49 LYS HE2 H -2.883 8.294 -6.109 1.00 . A A . 48 LYS HE2 1 1 6 4614 1 1 49 LYS HE3 H -2.481 9.921 -5.562 1.00 . A A . 48 LYS HE3 1 1 6 4615 1 1 49 LYS HG2 H -0.908 7.382 -4.773 1.00 . A A . 48 LYS HG2 1 1 6 4616 1 1 49 LYS HG3 H -0.615 9.037 -4.231 1.00 . A A . 48 LYS HG3 1 1 6 4617 1 1 49 LYS HZ1 H -2.122 10.503 -7.939 1.00 . A A . 48 LYS HZ1 1 1 6 4618 1 1 49 LYS HZ2 H -3.724 10.110 -7.551 1.00 . A A . 48 LYS HZ2 1 1 6 4619 1 1 49 LYS HZ3 H -2.754 8.983 -8.363 1.00 . A A . 48 LYS HZ3 1 1 6 4620 1 1 49 LYS N N 1.093 6.438 -3.089 1.00 . A A . 48 LYS N 1 1 6 4621 1 1 49 LYS NZ N -2.758 9.731 -7.636 1.00 . A A . 48 LYS NZ 1 1 6 4622 1 1 49 LYS O O 0.489 8.813 -1.806 1.00 . A A . 48 LYS O 1 1 6 4623 1 1 50 LYS C C 1.747 12.231 -2.944 1.00 . A A . 49 LYS C 1 1 6 4624 1 1 50 LYS CA C 2.036 11.100 -1.970 1.00 . A A . 49 LYS CA 1 1 6 4625 1 1 50 LYS CB C 3.248 11.461 -1.101 1.00 . A A . 49 LYS CB 1 1 6 4626 1 1 50 LYS CD C 3.829 9.233 -0.060 1.00 . A A . 49 LYS CD 1 1 6 4627 1 1 50 LYS CE C 3.915 8.446 1.235 1.00 . A A . 49 LYS CE 1 1 6 4628 1 1 50 LYS CG C 3.356 10.657 0.187 1.00 . A A . 49 LYS CG 1 1 6 4629 1 1 50 LYS H H 3.047 9.775 -3.276 1.00 . A A . 49 LYS H 1 1 6 4630 1 1 50 LYS HA H 1.173 10.962 -1.335 1.00 . A A . 49 LYS HA 1 1 6 4631 1 1 50 LYS HB2 H 4.147 11.294 -1.676 1.00 . A A . 49 LYS HB2 1 1 6 4632 1 1 50 LYS HB3 H 3.190 12.509 -0.843 1.00 . A A . 49 LYS HB3 1 1 6 4633 1 1 50 LYS HD2 H 3.132 8.741 -0.721 1.00 . A A . 49 LYS HD2 1 1 6 4634 1 1 50 LYS HD3 H 4.806 9.262 -0.519 1.00 . A A . 49 LYS HD3 1 1 6 4635 1 1 50 LYS HE2 H 2.918 8.319 1.630 1.00 . A A . 49 LYS HE2 1 1 6 4636 1 1 50 LYS HE3 H 4.346 7.479 1.026 1.00 . A A . 49 LYS HE3 1 1 6 4637 1 1 50 LYS HG2 H 4.059 11.146 0.846 1.00 . A A . 49 LYS HG2 1 1 6 4638 1 1 50 LYS HG3 H 2.386 10.625 0.660 1.00 . A A . 49 LYS HG3 1 1 6 4639 1 1 50 LYS HZ1 H 4.930 8.501 3.059 1.00 . A A . 49 LYS HZ1 1 1 6 4640 1 1 50 LYS HZ2 H 4.258 9.988 2.602 1.00 . A A . 49 LYS HZ2 1 1 6 4641 1 1 50 LYS HZ3 H 5.665 9.421 1.836 1.00 . A A . 49 LYS HZ3 1 1 6 4642 1 1 50 LYS N N 2.248 9.862 -2.702 1.00 . A A . 49 LYS N 1 1 6 4643 1 1 50 LYS NZ N 4.750 9.136 2.253 1.00 . A A . 49 LYS NZ 1 1 6 4644 1 1 50 LYS O O 2.460 12.406 -3.933 1.00 . A A . 49 LYS O 1 1 6 4645 1 1 51 GLY C C -1.154 14.151 -3.780 1.00 . A A . 50 GLY C 1 1 6 4646 1 1 51 GLY CA C 0.335 14.087 -3.533 1.00 . A A . 50 GLY CA 1 1 6 4647 1 1 51 GLY H H 0.158 12.793 -1.869 1.00 . A A . 50 GLY H 1 1 6 4648 1 1 51 GLY HA2 H 0.655 15.011 -3.075 1.00 . A A . 50 GLY HA2 1 1 6 4649 1 1 51 GLY HA3 H 0.842 13.971 -4.482 1.00 . A A . 50 GLY HA3 1 1 6 4650 1 1 51 GLY N N 0.697 12.985 -2.670 1.00 . A A . 50 GLY N 1 1 6 4651 1 1 51 GLY O O -1.933 14.404 -2.857 1.00 . A A . 50 GLY O 1 1 6 4652 1 1 52 SER C C -3.297 12.738 -6.251 1.00 . A A . 51 SER C 1 1 6 4653 1 1 52 SER CA C -2.951 13.951 -5.393 1.00 . A A . 51 SER CA 1 1 6 4654 1 1 52 SER CB C -3.253 15.256 -6.141 1.00 . A A . 51 SER CB 1 1 6 4655 1 1 52 SER H H -0.886 13.659 -5.694 1.00 . A A . 51 SER H 1 1 6 4656 1 1 52 SER HA H -3.542 13.918 -4.489 1.00 . A A . 51 SER HA 1 1 6 4657 1 1 52 SER HB2 H -2.858 16.088 -5.579 1.00 . A A . 51 SER HB2 1 1 6 4658 1 1 52 SER HB3 H -2.787 15.227 -7.115 1.00 . A A . 51 SER HB3 1 1 6 4659 1 1 52 SER HG H -4.893 15.242 -7.227 1.00 . A A . 51 SER HG 1 1 6 4660 1 1 52 SER N N -1.552 13.899 -5.016 1.00 . A A . 51 SER N 1 1 6 4661 1 1 52 SER O O -2.802 12.654 -7.397 1.00 . A A . 51 SER O 1 1 6 4662 1 1 52 SER OG O -4.650 15.443 -6.308 1.00 . A A . 51 SER OG 1 1 7 4663 1 1 2 GLY C C 2.284 12.358 -10.749 1.00 . A A . 1 GLY C 1 1 7 4664 1 1 2 GLY CA C 2.230 13.795 -10.281 1.00 . A A . 1 GLY CA 1 1 7 4665 1 1 2 GLY H H 0.433 14.290 -11.206 1.00 . A A . 1 GLY H 1 1 7 4666 1 1 2 GLY HA2 H 3.234 14.189 -10.245 1.00 . A A . 1 GLY HA2 1 1 7 4667 1 1 2 GLY HA3 H 1.805 13.825 -9.288 1.00 . A A . 1 GLY HA3 1 1 7 4668 1 1 2 GLY N N 1.415 14.639 -11.184 1.00 . A A . 1 GLY N 1 1 7 4669 1 1 2 GLY O O 1.675 12.009 -11.762 1.00 . A A . 1 GLY O 1 1 7 4670 1 1 3 THR C C 2.895 9.242 -9.157 1.00 . A A . 2 THR C 1 1 7 4671 1 1 3 THR CA C 3.149 10.123 -10.376 1.00 . A A . 2 THR CA 1 1 7 4672 1 1 3 THR CB C 4.557 9.824 -10.932 1.00 . A A . 2 THR CB 1 1 7 4673 1 1 3 THR CG2 C 4.609 8.442 -11.567 1.00 . A A . 2 THR CG2 1 1 7 4674 1 1 3 THR H H 3.487 11.863 -9.227 1.00 . A A . 2 THR H 1 1 7 4675 1 1 3 THR HA H 2.420 9.894 -11.141 1.00 . A A . 2 THR HA 1 1 7 4676 1 1 3 THR HB H 5.265 9.856 -10.115 1.00 . A A . 2 THR HB 1 1 7 4677 1 1 3 THR HG1 H 4.232 10.871 -12.585 1.00 . A A . 2 THR HG1 1 1 7 4678 1 1 3 THR HG21 H 3.898 8.391 -12.377 1.00 . A A . 2 THR HG21 1 1 7 4679 1 1 3 THR HG22 H 4.362 7.697 -10.824 1.00 . A A . 2 THR HG22 1 1 7 4680 1 1 3 THR HG23 H 5.603 8.256 -11.946 1.00 . A A . 2 THR HG23 1 1 7 4681 1 1 3 THR N N 3.016 11.525 -10.025 1.00 . A A . 2 THR N 1 1 7 4682 1 1 3 THR O O 3.529 9.415 -8.113 1.00 . A A . 2 THR O 1 1 7 4683 1 1 3 THR OG1 O 4.923 10.815 -11.905 1.00 . A A . 2 THR OG1 1 1 7 4684 1 1 4 ASN C C 2.801 6.347 -8.129 1.00 . A A . 3 ASN C 1 1 7 4685 1 1 4 ASN CA C 1.685 7.370 -8.207 1.00 . A A . 3 ASN CA 1 1 7 4686 1 1 4 ASN CB C 0.351 6.646 -8.423 1.00 . A A . 3 ASN CB 1 1 7 4687 1 1 4 ASN CG C -0.847 7.573 -8.393 1.00 . A A . 3 ASN CG 1 1 7 4688 1 1 4 ASN H H 1.461 8.242 -10.127 1.00 . A A . 3 ASN H 1 1 7 4689 1 1 4 ASN HA H 1.646 7.921 -7.281 1.00 . A A . 3 ASN HA 1 1 7 4690 1 1 4 ASN HB2 H 0.372 6.153 -9.383 1.00 . A A . 3 ASN HB2 1 1 7 4691 1 1 4 ASN HB3 H 0.226 5.905 -7.647 1.00 . A A . 3 ASN HB3 1 1 7 4692 1 1 4 ASN HD21 H -1.851 6.350 -9.598 1.00 . A A . 3 ASN HD21 1 1 7 4693 1 1 4 ASN HD22 H -2.689 7.779 -9.100 1.00 . A A . 3 ASN HD22 1 1 7 4694 1 1 4 ASN N N 1.963 8.311 -9.283 1.00 . A A . 3 ASN N 1 1 7 4695 1 1 4 ASN ND2 N -1.901 7.199 -9.099 1.00 . A A . 3 ASN ND2 1 1 7 4696 1 1 4 ASN O O 3.429 6.026 -9.140 1.00 . A A . 3 ASN O 1 1 7 4697 1 1 4 ASN OD1 O -0.832 8.615 -7.736 1.00 . A A . 3 ASN OD1 1 1 7 4698 1 1 5 THR C C 3.395 3.519 -6.424 1.00 . A A . 4 THR C 1 1 7 4699 1 1 5 THR CA C 4.076 4.842 -6.751 1.00 . A A . 4 THR CA 1 1 7 4700 1 1 5 THR CB C 5.033 5.294 -5.624 1.00 . A A . 4 THR CB 1 1 7 4701 1 1 5 THR CG2 C 6.051 4.219 -5.251 1.00 . A A . 4 THR CG2 1 1 7 4702 1 1 5 THR H H 2.547 6.141 -6.150 1.00 . A A . 4 THR H 1 1 7 4703 1 1 5 THR HA H 4.636 4.741 -7.669 1.00 . A A . 4 THR HA 1 1 7 4704 1 1 5 THR HB H 4.433 5.525 -4.751 1.00 . A A . 4 THR HB 1 1 7 4705 1 1 5 THR HG1 H 5.610 6.597 -6.991 1.00 . A A . 4 THR HG1 1 1 7 4706 1 1 5 THR HG21 H 5.531 3.335 -4.907 1.00 . A A . 4 THR HG21 1 1 7 4707 1 1 5 THR HG22 H 6.693 4.586 -4.464 1.00 . A A . 4 THR HG22 1 1 7 4708 1 1 5 THR HG23 H 6.649 3.974 -6.117 1.00 . A A . 4 THR HG23 1 1 7 4709 1 1 5 THR N N 3.062 5.844 -6.938 1.00 . A A . 4 THR N 1 1 7 4710 1 1 5 THR O O 2.243 3.507 -6.001 1.00 . A A . 4 THR O 1 1 7 4711 1 1 5 THR OG1 O 5.714 6.490 -6.037 1.00 . A A . 4 THR OG1 1 1 7 4712 1 1 6 TYR C C 4.591 0.310 -5.579 1.00 . A A . 5 TYR C 1 1 7 4713 1 1 6 TYR CA C 3.520 1.129 -6.278 1.00 . A A . 5 TYR CA 1 1 7 4714 1 1 6 TYR CB C 2.901 0.365 -7.456 1.00 . A A . 5 TYR CB 1 1 7 4715 1 1 6 TYR CD1 C 4.672 0.087 -9.245 1.00 . A A . 5 TYR CD1 1 1 7 4716 1 1 6 TYR CD2 C 2.893 1.627 -9.631 1.00 . A A . 5 TYR CD2 1 1 7 4717 1 1 6 TYR CE1 C 5.214 0.403 -10.479 1.00 . A A . 5 TYR CE1 1 1 7 4718 1 1 6 TYR CE2 C 3.425 1.944 -10.861 1.00 . A A . 5 TYR CE2 1 1 7 4719 1 1 6 TYR CG C 3.505 0.696 -8.801 1.00 . A A . 5 TYR CG 1 1 7 4720 1 1 6 TYR CZ C 4.584 1.332 -11.282 1.00 . A A . 5 TYR CZ 1 1 7 4721 1 1 6 TYR H H 4.906 2.456 -7.176 1.00 . A A . 5 TYR H 1 1 7 4722 1 1 6 TYR HA H 2.734 1.343 -5.557 1.00 . A A . 5 TYR HA 1 1 7 4723 1 1 6 TYR HB2 H 3.031 -0.694 -7.291 1.00 . A A . 5 TYR HB2 1 1 7 4724 1 1 6 TYR HB3 H 1.846 0.589 -7.503 1.00 . A A . 5 TYR HB3 1 1 7 4725 1 1 6 TYR HD1 H 5.160 -0.640 -8.612 1.00 . A A . 5 TYR HD1 1 1 7 4726 1 1 6 TYR HD2 H 1.984 2.106 -9.301 1.00 . A A . 5 TYR HD2 1 1 7 4727 1 1 6 TYR HE1 H 6.122 -0.082 -10.810 1.00 . A A . 5 TYR HE1 1 1 7 4728 1 1 6 TYR HE2 H 2.933 2.669 -11.490 1.00 . A A . 5 TYR HE2 1 1 7 4729 1 1 6 TYR HH H 5.064 2.625 -12.630 1.00 . A A . 5 TYR HH 1 1 7 4730 1 1 6 TYR N N 4.047 2.413 -6.692 1.00 . A A . 5 TYR N 1 1 7 4731 1 1 6 TYR O O 5.753 0.300 -5.986 1.00 . A A . 5 TYR O 1 1 7 4732 1 1 6 TYR OH O 5.114 1.659 -12.510 1.00 . A A . 5 TYR OH 1 1 7 4733 1 1 7 TYR C C 4.745 -2.560 -3.611 1.00 . A A . 6 TYR C 1 1 7 4734 1 1 7 TYR CA C 5.105 -1.081 -3.652 1.00 . A A . 6 TYR CA 1 1 7 4735 1 1 7 TYR CB C 5.031 -0.439 -2.253 1.00 . A A . 6 TYR CB 1 1 7 4736 1 1 7 TYR CD1 C 6.977 -1.373 -0.927 1.00 . A A . 6 TYR CD1 1 1 7 4737 1 1 7 TYR CD2 C 4.764 -1.853 -0.184 1.00 . A A . 6 TYR CD2 1 1 7 4738 1 1 7 TYR CE1 C 7.490 -2.090 0.138 1.00 . A A . 6 TYR CE1 1 1 7 4739 1 1 7 TYR CE2 C 5.266 -2.565 0.886 1.00 . A A . 6 TYR CE2 1 1 7 4740 1 1 7 TYR CG C 5.607 -1.245 -1.108 1.00 . A A . 6 TYR CG 1 1 7 4741 1 1 7 TYR CZ C 6.632 -2.683 1.043 1.00 . A A . 6 TYR CZ 1 1 7 4742 1 1 7 TYR H H 3.221 -0.396 -4.317 1.00 . A A . 6 TYR H 1 1 7 4743 1 1 7 TYR HA H 6.103 -0.968 -4.045 1.00 . A A . 6 TYR HA 1 1 7 4744 1 1 7 TYR HB2 H 5.561 0.500 -2.278 1.00 . A A . 6 TYR HB2 1 1 7 4745 1 1 7 TYR HB3 H 3.993 -0.241 -2.023 1.00 . A A . 6 TYR HB3 1 1 7 4746 1 1 7 TYR HD1 H 7.648 -0.908 -1.636 1.00 . A A . 6 TYR HD1 1 1 7 4747 1 1 7 TYR HD2 H 3.697 -1.761 -0.311 1.00 . A A . 6 TYR HD2 1 1 7 4748 1 1 7 TYR HE1 H 8.559 -2.182 0.261 1.00 . A A . 6 TYR HE1 1 1 7 4749 1 1 7 TYR HE2 H 4.587 -3.028 1.593 1.00 . A A . 6 TYR HE2 1 1 7 4750 1 1 7 TYR HH H 7.702 -2.797 2.640 1.00 . A A . 6 TYR HH 1 1 7 4751 1 1 7 TYR N N 4.186 -0.367 -4.522 1.00 . A A . 6 TYR N 1 1 7 4752 1 1 7 TYR O O 3.571 -2.916 -3.652 1.00 . A A . 6 TYR O 1 1 7 4753 1 1 7 TYR OH O 7.143 -3.384 2.114 1.00 . A A . 6 TYR OH 1 1 7 4754 1 1 8 THR C C 5.485 -5.130 -1.890 1.00 . A A . 7 THR C 1 1 7 4755 1 1 8 THR CA C 5.496 -4.830 -3.369 1.00 . A A . 7 THR CA 1 1 7 4756 1 1 8 THR CB C 6.520 -5.742 -4.064 1.00 . A A . 7 THR CB 1 1 7 4757 1 1 8 THR CG2 C 6.010 -6.169 -5.425 1.00 . A A . 7 THR CG2 1 1 7 4758 1 1 8 THR H H 6.669 -3.101 -3.707 1.00 . A A . 7 THR H 1 1 7 4759 1 1 8 THR HA H 4.518 -5.053 -3.772 1.00 . A A . 7 THR HA 1 1 7 4760 1 1 8 THR HB H 6.643 -6.630 -3.458 1.00 . A A . 7 THR HB 1 1 7 4761 1 1 8 THR HG1 H 7.681 -4.218 -4.570 1.00 . A A . 7 THR HG1 1 1 7 4762 1 1 8 THR HG21 H 5.109 -6.753 -5.296 1.00 . A A . 7 THR HG21 1 1 7 4763 1 1 8 THR HG22 H 6.760 -6.769 -5.920 1.00 . A A . 7 THR HG22 1 1 7 4764 1 1 8 THR HG23 H 5.792 -5.296 -6.020 1.00 . A A . 7 THR HG23 1 1 7 4765 1 1 8 THR N N 5.747 -3.421 -3.586 1.00 . A A . 7 THR N 1 1 7 4766 1 1 8 THR O O 6.468 -4.883 -1.194 1.00 . A A . 7 THR O 1 1 7 4767 1 1 8 THR OG1 O 7.794 -5.095 -4.178 1.00 . A A . 7 THR OG1 1 1 7 4768 1 1 9 VAL C C 5.298 -6.940 0.428 1.00 . A A . 8 VAL C 1 1 7 4769 1 1 9 VAL CA C 4.211 -5.965 -0.012 1.00 . A A . 8 VAL CA 1 1 7 4770 1 1 9 VAL CB C 2.829 -6.572 0.284 1.00 . A A . 8 VAL CB 1 1 7 4771 1 1 9 VAL CG1 C 2.698 -6.880 1.765 1.00 . A A . 8 VAL CG1 1 1 7 4772 1 1 9 VAL CG2 C 1.713 -5.639 -0.178 1.00 . A A . 8 VAL CG2 1 1 7 4773 1 1 9 VAL H H 3.622 -5.823 -2.040 1.00 . A A . 8 VAL H 1 1 7 4774 1 1 9 VAL HA H 4.307 -5.047 0.558 1.00 . A A . 8 VAL HA 1 1 7 4775 1 1 9 VAL HB H 2.742 -7.501 -0.261 1.00 . A A . 8 VAL HB 1 1 7 4776 1 1 9 VAL HG11 H 1.714 -7.277 1.964 1.00 . A A . 8 VAL HG11 1 1 7 4777 1 1 9 VAL HG12 H 2.845 -5.973 2.334 1.00 . A A . 8 VAL HG12 1 1 7 4778 1 1 9 VAL HG13 H 3.445 -7.609 2.049 1.00 . A A . 8 VAL HG13 1 1 7 4779 1 1 9 VAL HG21 H 1.820 -4.680 0.308 1.00 . A A . 8 VAL HG21 1 1 7 4780 1 1 9 VAL HG22 H 0.756 -6.065 0.083 1.00 . A A . 8 VAL HG22 1 1 7 4781 1 1 9 VAL HG23 H 1.765 -5.507 -1.251 1.00 . A A . 8 VAL HG23 1 1 7 4782 1 1 9 VAL N N 4.366 -5.646 -1.417 1.00 . A A . 8 VAL N 1 1 7 4783 1 1 9 VAL O O 5.516 -7.973 -0.207 1.00 . A A . 8 VAL O 1 1 7 4784 1 1 10 LYS C C 6.841 -7.533 3.528 1.00 . A A . 9 LYS C 1 1 7 4785 1 1 10 LYS CA C 7.074 -7.379 2.037 1.00 . A A . 9 LYS CA 1 1 7 4786 1 1 10 LYS CB C 8.429 -6.715 1.769 1.00 . A A . 9 LYS CB 1 1 7 4787 1 1 10 LYS CD C 8.929 -7.830 -0.432 1.00 . A A . 9 LYS CD 1 1 7 4788 1 1 10 LYS CE C 8.885 -7.647 -1.942 1.00 . A A . 9 LYS CE 1 1 7 4789 1 1 10 LYS CG C 8.722 -6.510 0.290 1.00 . A A . 9 LYS CG 1 1 7 4790 1 1 10 LYS H H 5.772 -5.730 1.931 1.00 . A A . 9 LYS H 1 1 7 4791 1 1 10 LYS HA H 7.048 -8.352 1.569 1.00 . A A . 9 LYS HA 1 1 7 4792 1 1 10 LYS HB2 H 8.446 -5.751 2.254 1.00 . A A . 9 LYS HB2 1 1 7 4793 1 1 10 LYS HB3 H 9.208 -7.335 2.186 1.00 . A A . 9 LYS HB3 1 1 7 4794 1 1 10 LYS HD2 H 9.893 -8.231 -0.156 1.00 . A A . 9 LYS HD2 1 1 7 4795 1 1 10 LYS HD3 H 8.150 -8.519 -0.135 1.00 . A A . 9 LYS HD3 1 1 7 4796 1 1 10 LYS HE2 H 7.861 -7.463 -2.240 1.00 . A A . 9 LYS HE2 1 1 7 4797 1 1 10 LYS HE3 H 9.497 -6.798 -2.210 1.00 . A A . 9 LYS HE3 1 1 7 4798 1 1 10 LYS HG2 H 7.890 -5.992 -0.164 1.00 . A A . 9 LYS HG2 1 1 7 4799 1 1 10 LYS HG3 H 9.616 -5.913 0.192 1.00 . A A . 9 LYS HG3 1 1 7 4800 1 1 10 LYS HZ1 H 8.807 -9.685 -2.411 1.00 . A A . 9 LYS HZ1 1 1 7 4801 1 1 10 LYS HZ2 H 10.373 -9.040 -2.379 1.00 . A A . 9 LYS HZ2 1 1 7 4802 1 1 10 LYS HZ3 H 9.350 -8.707 -3.684 1.00 . A A . 9 LYS HZ3 1 1 7 4803 1 1 10 LYS N N 5.995 -6.576 1.487 1.00 . A A . 9 LYS N 1 1 7 4804 1 1 10 LYS NZ N 9.385 -8.852 -2.654 1.00 . A A . 9 LYS NZ 1 1 7 4805 1 1 10 LYS O O 5.815 -7.071 4.022 1.00 . A A . 9 LYS O 1 1 7 4806 1 1 11 SER C C 7.247 -7.049 6.325 1.00 . A A . 10 SER C 1 1 7 4807 1 1 11 SER CA C 7.658 -8.373 5.676 1.00 . A A . 10 SER CA 1 1 7 4808 1 1 11 SER CB C 8.989 -8.868 6.236 1.00 . A A . 10 SER CB 1 1 7 4809 1 1 11 SER H H 8.514 -8.614 3.757 1.00 . A A . 10 SER H 1 1 7 4810 1 1 11 SER HA H 6.894 -9.109 5.877 1.00 . A A . 10 SER HA 1 1 7 4811 1 1 11 SER HB2 H 9.752 -8.123 6.065 1.00 . A A . 10 SER HB2 1 1 7 4812 1 1 11 SER HB3 H 8.888 -9.048 7.296 1.00 . A A . 10 SER HB3 1 1 7 4813 1 1 11 SER HG H 8.601 -10.642 5.481 1.00 . A A . 10 SER HG 1 1 7 4814 1 1 11 SER N N 7.756 -8.213 4.226 1.00 . A A . 10 SER N 1 1 7 4815 1 1 11 SER O O 7.892 -6.011 6.134 1.00 . A A . 10 SER O 1 1 7 4816 1 1 11 SER OG O 9.377 -10.080 5.601 1.00 . A A . 10 SER OG 1 1 7 4817 1 1 12 GLY C C 4.130 -5.958 6.597 1.00 . A A . 11 GLY C 1 1 7 4818 1 1 12 GLY CA C 5.406 -5.928 7.410 1.00 . A A . 11 GLY CA 1 1 7 4819 1 1 12 GLY H H 5.908 -7.981 7.475 1.00 . A A . 11 GLY H 1 1 7 4820 1 1 12 GLY HA2 H 5.168 -5.919 8.466 1.00 . A A . 11 GLY HA2 1 1 7 4821 1 1 12 GLY HA3 H 5.971 -5.047 7.155 1.00 . A A . 11 GLY HA3 1 1 7 4822 1 1 12 GLY N N 6.178 -7.111 7.099 1.00 . A A . 11 GLY N 1 1 7 4823 1 1 12 GLY O O 3.549 -4.929 6.270 1.00 . A A . 11 GLY O 1 1 7 4824 1 1 13 ASP C C 1.273 -6.912 5.713 1.00 . A A . 12 ASP C 1 1 7 4825 1 1 13 ASP CA C 2.630 -7.525 5.381 1.00 . A A . 12 ASP CA 1 1 7 4826 1 1 13 ASP CB C 2.486 -9.043 5.248 1.00 . A A . 12 ASP CB 1 1 7 4827 1 1 13 ASP CG C 2.191 -9.733 6.564 1.00 . A A . 12 ASP CG 1 1 7 4828 1 1 13 ASP H H 4.133 -7.926 6.796 1.00 . A A . 12 ASP H 1 1 7 4829 1 1 13 ASP HA H 2.932 -7.140 4.418 1.00 . A A . 12 ASP HA 1 1 7 4830 1 1 13 ASP HB2 H 1.679 -9.257 4.563 1.00 . A A . 12 ASP HB2 1 1 7 4831 1 1 13 ASP HB3 H 3.405 -9.448 4.849 1.00 . A A . 12 ASP HB3 1 1 7 4832 1 1 13 ASP N N 3.702 -7.187 6.324 1.00 . A A . 12 ASP N 1 1 7 4833 1 1 13 ASP O O 0.302 -7.168 5.018 1.00 . A A . 12 ASP O 1 1 7 4834 1 1 13 ASP OD1 O 1.000 -9.877 6.918 1.00 . A A . 12 ASP OD1 1 1 7 4835 1 1 13 ASP OD2 O 3.149 -10.163 7.241 1.00 . A A . 12 ASP OD2 1 1 7 4836 1 1 14 THR C C -0.223 -4.176 7.033 1.00 . A A . 13 THR C 1 1 7 4837 1 1 14 THR CA C -0.123 -5.684 7.215 1.00 . A A . 13 THR CA 1 1 7 4838 1 1 14 THR CB C -0.375 -6.071 8.684 1.00 . A A . 13 THR CB 1 1 7 4839 1 1 14 THR CG2 C -1.848 -5.928 9.046 1.00 . A A . 13 THR CG2 1 1 7 4840 1 1 14 THR H H 1.986 -5.856 7.240 1.00 . A A . 13 THR H 1 1 7 4841 1 1 14 THR HA H -0.878 -6.154 6.597 1.00 . A A . 13 THR HA 1 1 7 4842 1 1 14 THR HB H 0.207 -5.423 9.323 1.00 . A A . 13 THR HB 1 1 7 4843 1 1 14 THR HG1 H -0.067 -7.920 8.062 1.00 . A A . 13 THR HG1 1 1 7 4844 1 1 14 THR HG21 H -1.997 -6.218 10.076 1.00 . A A . 13 THR HG21 1 1 7 4845 1 1 14 THR HG22 H -2.441 -6.562 8.404 1.00 . A A . 13 THR HG22 1 1 7 4846 1 1 14 THR HG23 H -2.152 -4.900 8.915 1.00 . A A . 13 THR HG23 1 1 7 4847 1 1 14 THR N N 1.174 -6.155 6.778 1.00 . A A . 13 THR N 1 1 7 4848 1 1 14 THR O O 0.755 -3.452 7.211 1.00 . A A . 13 THR O 1 1 7 4849 1 1 14 THR OG1 O 0.035 -7.432 8.890 1.00 . A A . 13 THR OG1 1 1 7 4850 1 1 15 LEU C C -1.120 -1.318 7.149 1.00 . A A . 14 LEU C 1 1 7 4851 1 1 15 LEU CA C -1.668 -2.366 6.205 1.00 . A A . 14 LEU CA 1 1 7 4852 1 1 15 LEU CB C -3.169 -2.117 6.002 1.00 . A A . 14 LEU CB 1 1 7 4853 1 1 15 LEU CD1 C -3.653 -4.330 4.892 1.00 . A A . 14 LEU CD1 1 1 7 4854 1 1 15 LEU CD2 C -5.289 -2.453 4.707 1.00 . A A . 14 LEU CD2 1 1 7 4855 1 1 15 LEU CG C -3.817 -2.821 4.804 1.00 . A A . 14 LEU CG 1 1 7 4856 1 1 15 LEU H H -2.194 -4.334 6.766 1.00 . A A . 14 LEU H 1 1 7 4857 1 1 15 LEU HA H -1.169 -2.269 5.252 1.00 . A A . 14 LEU HA 1 1 7 4858 1 1 15 LEU HB2 H -3.684 -2.432 6.896 1.00 . A A . 14 LEU HB2 1 1 7 4859 1 1 15 LEU HB3 H -3.314 -1.053 5.882 1.00 . A A . 14 LEU HB3 1 1 7 4860 1 1 15 LEU HD11 H -4.234 -4.802 4.113 1.00 . A A . 14 LEU HD11 1 1 7 4861 1 1 15 LEU HD12 H -3.989 -4.677 5.857 1.00 . A A . 14 LEU HD12 1 1 7 4862 1 1 15 LEU HD13 H -2.603 -4.579 4.759 1.00 . A A . 14 LEU HD13 1 1 7 4863 1 1 15 LEU HD21 H -5.386 -1.388 4.549 1.00 . A A . 14 LEU HD21 1 1 7 4864 1 1 15 LEU HD22 H -5.788 -2.727 5.624 1.00 . A A . 14 LEU HD22 1 1 7 4865 1 1 15 LEU HD23 H -5.738 -2.983 3.880 1.00 . A A . 14 LEU HD23 1 1 7 4866 1 1 15 LEU HG H -3.331 -2.488 3.898 1.00 . A A . 14 LEU HG 1 1 7 4867 1 1 15 LEU N N -1.431 -3.724 6.695 1.00 . A A . 14 LEU N 1 1 7 4868 1 1 15 LEU O O -0.447 -0.390 6.719 1.00 . A A . 14 LEU O 1 1 7 4869 1 1 16 ASN C C 0.573 -0.422 9.453 1.00 . A A . 15 ASN C 1 1 7 4870 1 1 16 ASN CA C -0.951 -0.510 9.420 1.00 . A A . 15 ASN CA 1 1 7 4871 1 1 16 ASN CB C -1.494 -0.863 10.812 1.00 . A A . 15 ASN CB 1 1 7 4872 1 1 16 ASN CG C -1.014 -2.212 11.327 1.00 . A A . 15 ASN CG 1 1 7 4873 1 1 16 ASN H H -1.895 -2.267 8.721 1.00 . A A . 15 ASN H 1 1 7 4874 1 1 16 ASN HA H -1.343 0.452 9.129 1.00 . A A . 15 ASN HA 1 1 7 4875 1 1 16 ASN HB2 H -1.181 -0.106 11.513 1.00 . A A . 15 ASN HB2 1 1 7 4876 1 1 16 ASN HB3 H -2.573 -0.880 10.772 1.00 . A A . 15 ASN HB3 1 1 7 4877 1 1 16 ASN HD21 H -1.001 -1.517 13.189 1.00 . A A . 15 ASN HD21 1 1 7 4878 1 1 16 ASN HD22 H -0.505 -3.163 12.989 1.00 . A A . 15 ASN HD22 1 1 7 4879 1 1 16 ASN N N -1.394 -1.477 8.429 1.00 . A A . 15 ASN N 1 1 7 4880 1 1 16 ASN ND2 N -0.824 -2.310 12.630 1.00 . A A . 15 ASN ND2 1 1 7 4881 1 1 16 ASN O O 1.134 0.661 9.626 1.00 . A A . 15 ASN O 1 1 7 4882 1 1 16 ASN OD1 O -0.808 -3.153 10.558 1.00 . A A . 15 ASN OD1 1 1 7 4883 1 1 17 LYS C C 3.333 -0.947 8.145 1.00 . A A . 16 LYS C 1 1 7 4884 1 1 17 LYS CA C 2.689 -1.600 9.360 1.00 . A A . 16 LYS CA 1 1 7 4885 1 1 17 LYS CB C 3.179 -3.039 9.514 1.00 . A A . 16 LYS CB 1 1 7 4886 1 1 17 LYS CD C 3.240 -5.120 10.913 1.00 . A A . 16 LYS CD 1 1 7 4887 1 1 17 LYS CE C 2.723 -5.819 12.162 1.00 . A A . 16 LYS CE 1 1 7 4888 1 1 17 LYS CG C 2.687 -3.713 10.785 1.00 . A A . 16 LYS CG 1 1 7 4889 1 1 17 LYS H H 0.746 -2.374 9.005 1.00 . A A . 16 LYS H 1 1 7 4890 1 1 17 LYS HA H 2.974 -1.041 10.240 1.00 . A A . 16 LYS HA 1 1 7 4891 1 1 17 LYS HB2 H 2.837 -3.618 8.669 1.00 . A A . 16 LYS HB2 1 1 7 4892 1 1 17 LYS HB3 H 4.260 -3.039 9.528 1.00 . A A . 16 LYS HB3 1 1 7 4893 1 1 17 LYS HD2 H 2.942 -5.691 10.046 1.00 . A A . 16 LYS HD2 1 1 7 4894 1 1 17 LYS HD3 H 4.319 -5.068 10.957 1.00 . A A . 16 LYS HD3 1 1 7 4895 1 1 17 LYS HE2 H 1.644 -5.793 12.150 1.00 . A A . 16 LYS HE2 1 1 7 4896 1 1 17 LYS HE3 H 3.057 -6.847 12.148 1.00 . A A . 16 LYS HE3 1 1 7 4897 1 1 17 LYS HG2 H 3.005 -3.132 11.639 1.00 . A A . 16 LYS HG2 1 1 7 4898 1 1 17 LYS HG3 H 1.607 -3.761 10.762 1.00 . A A . 16 LYS HG3 1 1 7 4899 1 1 17 LYS HZ1 H 2.880 -5.712 14.246 1.00 . A A . 16 LYS HZ1 1 1 7 4900 1 1 17 LYS HZ2 H 2.834 -4.197 13.484 1.00 . A A . 16 LYS HZ2 1 1 7 4901 1 1 17 LYS HZ3 H 4.249 -5.137 13.424 1.00 . A A . 16 LYS HZ3 1 1 7 4902 1 1 17 LYS N N 1.240 -1.557 9.263 1.00 . A A . 16 LYS N 1 1 7 4903 1 1 17 LYS NZ N 3.204 -5.172 13.414 1.00 . A A . 16 LYS NZ 1 1 7 4904 1 1 17 LYS O O 4.213 -0.099 8.282 1.00 . A A . 16 LYS O 1 1 7 4905 1 1 18 ILE C C 3.023 0.681 5.511 1.00 . A A . 17 ILE C 1 1 7 4906 1 1 18 ILE CA C 3.418 -0.776 5.726 1.00 . A A . 17 ILE CA 1 1 7 4907 1 1 18 ILE CB C 3.048 -1.621 4.481 1.00 . A A . 17 ILE CB 1 1 7 4908 1 1 18 ILE CD1 C 1.200 -2.965 3.345 1.00 . A A . 17 ILE CD1 1 1 7 4909 1 1 18 ILE CG1 C 1.622 -2.172 4.568 1.00 . A A . 17 ILE CG1 1 1 7 4910 1 1 18 ILE CG2 C 4.049 -2.748 4.298 1.00 . A A . 17 ILE CG2 1 1 7 4911 1 1 18 ILE H H 2.110 -1.949 6.915 1.00 . A A . 17 ILE H 1 1 7 4912 1 1 18 ILE HA H 4.494 -0.812 5.834 1.00 . A A . 17 ILE HA 1 1 7 4913 1 1 18 ILE HB H 3.119 -0.986 3.620 1.00 . A A . 17 ILE HB 1 1 7 4914 1 1 18 ILE HD11 H 0.264 -3.479 3.555 1.00 . A A . 17 ILE HD11 1 1 7 4915 1 1 18 ILE HD12 H 1.969 -3.687 3.096 1.00 . A A . 17 ILE HD12 1 1 7 4916 1 1 18 ILE HD13 H 1.059 -2.292 2.513 1.00 . A A . 17 ILE HD13 1 1 7 4917 1 1 18 ILE HG12 H 1.545 -2.826 5.424 1.00 . A A . 17 ILE HG12 1 1 7 4918 1 1 18 ILE HG13 H 0.931 -1.350 4.685 1.00 . A A . 17 ILE HG13 1 1 7 4919 1 1 18 ILE HG21 H 3.784 -3.324 3.425 1.00 . A A . 17 ILE HG21 1 1 7 4920 1 1 18 ILE HG22 H 4.034 -3.385 5.170 1.00 . A A . 17 ILE HG22 1 1 7 4921 1 1 18 ILE HG23 H 5.038 -2.334 4.171 1.00 . A A . 17 ILE HG23 1 1 7 4922 1 1 18 ILE N N 2.853 -1.307 6.960 1.00 . A A . 17 ILE N 1 1 7 4923 1 1 18 ILE O O 3.867 1.503 5.156 1.00 . A A . 17 ILE O 1 1 7 4924 1 1 19 ALA C C 2.051 3.354 6.433 1.00 . A A . 18 ALA C 1 1 7 4925 1 1 19 ALA CA C 1.268 2.369 5.583 1.00 . A A . 18 ALA CA 1 1 7 4926 1 1 19 ALA CB C -0.202 2.455 5.939 1.00 . A A . 18 ALA CB 1 1 7 4927 1 1 19 ALA H H 1.140 0.312 6.080 1.00 . A A . 18 ALA H 1 1 7 4928 1 1 19 ALA HA H 1.381 2.633 4.539 1.00 . A A . 18 ALA HA 1 1 7 4929 1 1 19 ALA HB1 H -0.322 2.238 6.991 1.00 . A A . 18 ALA HB1 1 1 7 4930 1 1 19 ALA HB2 H -0.759 1.736 5.355 1.00 . A A . 18 ALA HB2 1 1 7 4931 1 1 19 ALA HB3 H -0.565 3.450 5.733 1.00 . A A . 18 ALA HB3 1 1 7 4932 1 1 19 ALA N N 1.760 1.007 5.764 1.00 . A A . 18 ALA N 1 1 7 4933 1 1 19 ALA O O 2.521 4.380 5.944 1.00 . A A . 18 ALA O 1 1 7 4934 1 1 20 ALA C C 4.423 3.847 8.345 1.00 . A A . 19 ALA C 1 1 7 4935 1 1 20 ALA CA C 2.927 3.891 8.625 1.00 . A A . 19 ALA CA 1 1 7 4936 1 1 20 ALA CB C 2.634 3.503 10.064 1.00 . A A . 19 ALA CB 1 1 7 4937 1 1 20 ALA H H 1.829 2.180 8.039 1.00 . A A . 19 ALA H 1 1 7 4938 1 1 20 ALA HA H 2.575 4.901 8.472 1.00 . A A . 19 ALA HA 1 1 7 4939 1 1 20 ALA HB1 H 1.569 3.553 10.240 1.00 . A A . 19 ALA HB1 1 1 7 4940 1 1 20 ALA HB2 H 3.143 4.181 10.731 1.00 . A A . 19 ALA HB2 1 1 7 4941 1 1 20 ALA HB3 H 2.979 2.495 10.241 1.00 . A A . 19 ALA HB3 1 1 7 4942 1 1 20 ALA N N 2.208 3.025 7.708 1.00 . A A . 19 ALA N 1 1 7 4943 1 1 20 ALA O O 5.155 4.778 8.685 1.00 . A A . 19 ALA O 1 1 7 4944 1 1 21 GLN C C 6.774 3.665 6.434 1.00 . A A . 20 GLN C 1 1 7 4945 1 1 21 GLN CA C 6.283 2.594 7.404 1.00 . A A . 20 GLN CA 1 1 7 4946 1 1 21 GLN CB C 6.537 1.201 6.823 1.00 . A A . 20 GLN CB 1 1 7 4947 1 1 21 GLN CD C 8.220 -0.517 6.069 1.00 . A A . 20 GLN CD 1 1 7 4948 1 1 21 GLN CG C 8.008 0.862 6.655 1.00 . A A . 20 GLN CG 1 1 7 4949 1 1 21 GLN H H 4.223 2.074 7.435 1.00 . A A . 20 GLN H 1 1 7 4950 1 1 21 GLN HA H 6.831 2.689 8.329 1.00 . A A . 20 GLN HA 1 1 7 4951 1 1 21 GLN HB2 H 6.094 0.467 7.480 1.00 . A A . 20 GLN HB2 1 1 7 4952 1 1 21 GLN HB3 H 6.061 1.138 5.855 1.00 . A A . 20 GLN HB3 1 1 7 4953 1 1 21 GLN HE21 H 8.256 -1.308 7.895 1.00 . A A . 20 GLN HE21 1 1 7 4954 1 1 21 GLN HE22 H 8.456 -2.420 6.582 1.00 . A A . 20 GLN HE22 1 1 7 4955 1 1 21 GLN HG2 H 8.462 1.590 5.998 1.00 . A A . 20 GLN HG2 1 1 7 4956 1 1 21 GLN HG3 H 8.487 0.904 7.622 1.00 . A A . 20 GLN HG3 1 1 7 4957 1 1 21 GLN N N 4.867 2.770 7.705 1.00 . A A . 20 GLN N 1 1 7 4958 1 1 21 GLN NE2 N 8.322 -1.516 6.933 1.00 . A A . 20 GLN NE2 1 1 7 4959 1 1 21 GLN O O 7.805 4.290 6.670 1.00 . A A . 20 GLN O 1 1 7 4960 1 1 21 GLN OE1 O 8.295 -0.684 4.854 1.00 . A A . 20 GLN OE1 1 1 7 4961 1 1 22 TYR C C 5.644 6.240 4.679 1.00 . A A . 21 TYR C 1 1 7 4962 1 1 22 TYR CA C 6.404 4.945 4.407 1.00 . A A . 21 TYR CA 1 1 7 4963 1 1 22 TYR CB C 6.232 4.498 2.944 1.00 . A A . 21 TYR CB 1 1 7 4964 1 1 22 TYR CD1 C 3.784 3.845 2.913 1.00 . A A . 21 TYR CD1 1 1 7 4965 1 1 22 TYR CD2 C 5.394 2.252 2.174 1.00 . A A . 21 TYR CD2 1 1 7 4966 1 1 22 TYR CE1 C 2.770 2.941 2.654 1.00 . A A . 21 TYR CE1 1 1 7 4967 1 1 22 TYR CE2 C 4.386 1.347 1.908 1.00 . A A . 21 TYR CE2 1 1 7 4968 1 1 22 TYR CG C 5.112 3.514 2.681 1.00 . A A . 21 TYR CG 1 1 7 4969 1 1 22 TYR CZ C 3.075 1.695 2.150 1.00 . A A . 21 TYR CZ 1 1 7 4970 1 1 22 TYR H H 5.228 3.355 5.192 1.00 . A A . 21 TYR H 1 1 7 4971 1 1 22 TYR HA H 7.452 5.146 4.573 1.00 . A A . 21 TYR HA 1 1 7 4972 1 1 22 TYR HB2 H 6.039 5.370 2.339 1.00 . A A . 21 TYR HB2 1 1 7 4973 1 1 22 TYR HB3 H 7.152 4.041 2.613 1.00 . A A . 21 TYR HB3 1 1 7 4974 1 1 22 TYR HD1 H 3.546 4.822 3.308 1.00 . A A . 21 TYR HD1 1 1 7 4975 1 1 22 TYR HD2 H 6.421 1.978 1.988 1.00 . A A . 21 TYR HD2 1 1 7 4976 1 1 22 TYR HE1 H 1.742 3.216 2.844 1.00 . A A . 21 TYR HE1 1 1 7 4977 1 1 22 TYR HE2 H 4.628 0.372 1.513 1.00 . A A . 21 TYR HE2 1 1 7 4978 1 1 22 TYR HH H 1.353 1.242 1.427 1.00 . A A . 21 TYR HH 1 1 7 4979 1 1 22 TYR N N 6.031 3.897 5.355 1.00 . A A . 21 TYR N 1 1 7 4980 1 1 22 TYR O O 5.841 7.240 3.994 1.00 . A A . 21 TYR O 1 1 7 4981 1 1 22 TYR OH O 2.068 0.796 1.885 1.00 . A A . 21 TYR OH 1 1 7 4982 1 1 23 GLY C C 2.984 7.889 5.285 1.00 . A A . 22 GLY C 1 1 7 4983 1 1 23 GLY CA C 4.145 7.439 6.150 1.00 . A A . 22 GLY CA 1 1 7 4984 1 1 23 GLY H H 4.589 5.367 6.134 1.00 . A A . 22 GLY H 1 1 7 4985 1 1 23 GLY HA2 H 3.781 7.278 7.153 1.00 . A A . 22 GLY HA2 1 1 7 4986 1 1 23 GLY HA3 H 4.884 8.227 6.174 1.00 . A A . 22 GLY HA3 1 1 7 4987 1 1 23 GLY N N 4.788 6.219 5.691 1.00 . A A . 22 GLY N 1 1 7 4988 1 1 23 GLY O O 2.903 9.059 4.909 1.00 . A A . 22 GLY O 1 1 7 4989 1 1 24 VAL C C -0.330 6.762 5.074 1.00 . A A . 23 VAL C 1 1 7 4990 1 1 24 VAL CA C 0.851 7.315 4.276 1.00 . A A . 23 VAL CA 1 1 7 4991 1 1 24 VAL CB C 0.830 6.775 2.822 1.00 . A A . 23 VAL CB 1 1 7 4992 1 1 24 VAL CG1 C 0.312 5.344 2.754 1.00 . A A . 23 VAL CG1 1 1 7 4993 1 1 24 VAL CG2 C 0.033 7.694 1.918 1.00 . A A . 23 VAL CG2 1 1 7 4994 1 1 24 VAL H H 2.245 6.033 5.218 1.00 . A A . 23 VAL H 1 1 7 4995 1 1 24 VAL HA H 0.778 8.394 4.244 1.00 . A A . 23 VAL HA 1 1 7 4996 1 1 24 VAL HB H 1.841 6.769 2.459 1.00 . A A . 23 VAL HB 1 1 7 4997 1 1 24 VAL HG11 H 0.954 4.698 3.335 1.00 . A A . 23 VAL HG11 1 1 7 4998 1 1 24 VAL HG12 H 0.304 5.014 1.725 1.00 . A A . 23 VAL HG12 1 1 7 4999 1 1 24 VAL HG13 H -0.693 5.303 3.151 1.00 . A A . 23 VAL HG13 1 1 7 5000 1 1 24 VAL HG21 H -0.985 7.752 2.270 1.00 . A A . 23 VAL HG21 1 1 7 5001 1 1 24 VAL HG22 H 0.045 7.305 0.910 1.00 . A A . 23 VAL HG22 1 1 7 5002 1 1 24 VAL HG23 H 0.473 8.681 1.929 1.00 . A A . 23 VAL HG23 1 1 7 5003 1 1 24 VAL N N 2.084 6.970 4.969 1.00 . A A . 23 VAL N 1 1 7 5004 1 1 24 VAL O O -0.139 5.919 5.954 1.00 . A A . 23 VAL O 1 1 7 5005 1 1 25 SER C C -3.366 5.589 4.984 1.00 . A A . 24 SER C 1 1 7 5006 1 1 25 SER CA C -2.687 6.821 5.584 1.00 . A A . 24 SER CA 1 1 7 5007 1 1 25 SER CB C -3.679 7.976 5.689 1.00 . A A . 24 SER CB 1 1 7 5008 1 1 25 SER H H -1.656 7.843 4.040 1.00 . A A . 24 SER H 1 1 7 5009 1 1 25 SER HA H -2.336 6.573 6.572 1.00 . A A . 24 SER HA 1 1 7 5010 1 1 25 SER HB2 H -4.206 8.080 4.752 1.00 . A A . 24 SER HB2 1 1 7 5011 1 1 25 SER HB3 H -4.383 7.773 6.481 1.00 . A A . 24 SER HB3 1 1 7 5012 1 1 25 SER HG H -2.141 9.003 6.364 1.00 . A A . 24 SER HG 1 1 7 5013 1 1 25 SER N N -1.535 7.228 4.794 1.00 . A A . 24 SER N 1 1 7 5014 1 1 25 SER O O -3.431 5.425 3.761 1.00 . A A . 24 SER O 1 1 7 5015 1 1 25 SER OG O -3.009 9.194 5.970 1.00 . A A . 24 SER OG 1 1 7 5016 1 1 26 VAL C C -5.720 3.803 4.502 1.00 . A A . 25 VAL C 1 1 7 5017 1 1 26 VAL CA C -4.572 3.513 5.464 1.00 . A A . 25 VAL CA 1 1 7 5018 1 1 26 VAL CB C -5.107 2.757 6.701 1.00 . A A . 25 VAL CB 1 1 7 5019 1 1 26 VAL CG1 C -5.704 1.416 6.305 1.00 . A A . 25 VAL CG1 1 1 7 5020 1 1 26 VAL CG2 C -4.005 2.563 7.728 1.00 . A A . 25 VAL CG2 1 1 7 5021 1 1 26 VAL H H -3.784 4.932 6.820 1.00 . A A . 25 VAL H 1 1 7 5022 1 1 26 VAL HA H -3.858 2.875 4.963 1.00 . A A . 25 VAL HA 1 1 7 5023 1 1 26 VAL HB H -5.887 3.353 7.150 1.00 . A A . 25 VAL HB 1 1 7 5024 1 1 26 VAL HG11 H -6.545 1.575 5.647 1.00 . A A . 25 VAL HG11 1 1 7 5025 1 1 26 VAL HG12 H -6.034 0.893 7.191 1.00 . A A . 25 VAL HG12 1 1 7 5026 1 1 26 VAL HG13 H -4.956 0.825 5.797 1.00 . A A . 25 VAL HG13 1 1 7 5027 1 1 26 VAL HG21 H -3.617 3.527 8.027 1.00 . A A . 25 VAL HG21 1 1 7 5028 1 1 26 VAL HG22 H -3.210 1.973 7.295 1.00 . A A . 25 VAL HG22 1 1 7 5029 1 1 26 VAL HG23 H -4.403 2.053 8.593 1.00 . A A . 25 VAL HG23 1 1 7 5030 1 1 26 VAL N N -3.886 4.740 5.863 1.00 . A A . 25 VAL N 1 1 7 5031 1 1 26 VAL O O -5.977 3.030 3.579 1.00 . A A . 25 VAL O 1 1 7 5032 1 1 27 ALA C C -7.157 5.514 2.414 1.00 . A A . 26 ALA C 1 1 7 5033 1 1 27 ALA CA C -7.535 5.293 3.881 1.00 . A A . 26 ALA CA 1 1 7 5034 1 1 27 ALA CB C -8.209 6.535 4.438 1.00 . A A . 26 ALA CB 1 1 7 5035 1 1 27 ALA H H -6.098 5.537 5.414 1.00 . A A . 26 ALA H 1 1 7 5036 1 1 27 ALA HA H -8.243 4.479 3.936 1.00 . A A . 26 ALA HA 1 1 7 5037 1 1 27 ALA HB1 H -9.082 6.764 3.846 1.00 . A A . 26 ALA HB1 1 1 7 5038 1 1 27 ALA HB2 H -7.518 7.365 4.400 1.00 . A A . 26 ALA HB2 1 1 7 5039 1 1 27 ALA HB3 H -8.504 6.358 5.461 1.00 . A A . 26 ALA HB3 1 1 7 5040 1 1 27 ALA N N -6.384 4.935 4.698 1.00 . A A . 26 ALA N 1 1 7 5041 1 1 27 ALA O O -7.799 4.964 1.521 1.00 . A A . 26 ALA O 1 1 7 5042 1 1 28 ASN C C -5.119 5.438 0.050 1.00 . A A . 27 ASN C 1 1 7 5043 1 1 28 ASN CA C -5.712 6.621 0.789 1.00 . A A . 27 ASN CA 1 1 7 5044 1 1 28 ASN CB C -4.760 7.830 0.718 1.00 . A A . 27 ASN CB 1 1 7 5045 1 1 28 ASN CG C -3.901 8.007 1.944 1.00 . A A . 27 ASN CG 1 1 7 5046 1 1 28 ASN H H -5.560 6.625 2.910 1.00 . A A . 27 ASN H 1 1 7 5047 1 1 28 ASN HA H -6.621 6.887 0.272 1.00 . A A . 27 ASN HA 1 1 7 5048 1 1 28 ASN HB2 H -4.095 7.700 -0.124 1.00 . A A . 27 ASN HB2 1 1 7 5049 1 1 28 ASN HB3 H -5.339 8.729 0.573 1.00 . A A . 27 ASN HB3 1 1 7 5050 1 1 28 ASN HD21 H -5.174 9.347 2.670 1.00 . A A . 27 ASN HD21 1 1 7 5051 1 1 28 ASN HD22 H -3.786 9.025 3.647 1.00 . A A . 27 ASN HD22 1 1 7 5052 1 1 28 ASN N N -6.097 6.285 2.163 1.00 . A A . 27 ASN N 1 1 7 5053 1 1 28 ASN ND2 N -4.332 8.876 2.845 1.00 . A A . 27 ASN ND2 1 1 7 5054 1 1 28 ASN O O -5.514 5.169 -1.091 1.00 . A A . 27 ASN O 1 1 7 5055 1 1 28 ASN OD1 O -2.853 7.396 2.072 1.00 . A A . 27 ASN OD1 1 1 7 5056 1 1 29 LEU C C -4.590 2.504 -0.336 1.00 . A A . 28 LEU C 1 1 7 5057 1 1 29 LEU CA C -3.572 3.605 -0.037 1.00 . A A . 28 LEU CA 1 1 7 5058 1 1 29 LEU CB C -2.319 3.068 0.668 1.00 . A A . 28 LEU CB 1 1 7 5059 1 1 29 LEU CD1 C -1.603 0.865 1.557 1.00 . A A . 28 LEU CD1 1 1 7 5060 1 1 29 LEU CD2 C -2.255 2.674 3.126 1.00 . A A . 28 LEU CD2 1 1 7 5061 1 1 29 LEU CG C -2.529 2.047 1.778 1.00 . A A . 28 LEU CG 1 1 7 5062 1 1 29 LEU H H -3.942 4.919 1.598 1.00 . A A . 28 LEU H 1 1 7 5063 1 1 29 LEU HA H -3.262 4.010 -0.989 1.00 . A A . 28 LEU HA 1 1 7 5064 1 1 29 LEU HB2 H -1.688 2.614 -0.081 1.00 . A A . 28 LEU HB2 1 1 7 5065 1 1 29 LEU HB3 H -1.788 3.911 1.088 1.00 . A A . 28 LEU HB3 1 1 7 5066 1 1 29 LEU HD11 H -0.584 1.221 1.473 1.00 . A A . 28 LEU HD11 1 1 7 5067 1 1 29 LEU HD12 H -1.880 0.354 0.646 1.00 . A A . 28 LEU HD12 1 1 7 5068 1 1 29 LEU HD13 H -1.681 0.184 2.390 1.00 . A A . 28 LEU HD13 1 1 7 5069 1 1 29 LEU HD21 H -1.241 3.047 3.146 1.00 . A A . 28 LEU HD21 1 1 7 5070 1 1 29 LEU HD22 H -2.382 1.933 3.900 1.00 . A A . 28 LEU HD22 1 1 7 5071 1 1 29 LEU HD23 H -2.942 3.491 3.290 1.00 . A A . 28 LEU HD23 1 1 7 5072 1 1 29 LEU HG H -3.550 1.694 1.761 1.00 . A A . 28 LEU HG 1 1 7 5073 1 1 29 LEU N N -4.201 4.709 0.673 1.00 . A A . 28 LEU N 1 1 7 5074 1 1 29 LEU O O -4.489 1.818 -1.349 1.00 . A A . 28 LEU O 1 1 7 5075 1 1 30 ARG C C -7.530 1.916 -0.928 1.00 . A A . 29 ARG C 1 1 7 5076 1 1 30 ARG CA C -6.685 1.429 0.255 1.00 . A A . 29 ARG CA 1 1 7 5077 1 1 30 ARG CB C -7.578 1.276 1.487 1.00 . A A . 29 ARG CB 1 1 7 5078 1 1 30 ARG CD C -7.951 0.221 3.734 1.00 . A A . 29 ARG CD 1 1 7 5079 1 1 30 ARG CG C -7.116 0.204 2.462 1.00 . A A . 29 ARG CG 1 1 7 5080 1 1 30 ARG CZ C -10.351 0.038 4.339 1.00 . A A . 29 ARG CZ 1 1 7 5081 1 1 30 ARG H H -5.570 2.848 1.374 1.00 . A A . 29 ARG H 1 1 7 5082 1 1 30 ARG HA H -6.264 0.466 0.007 1.00 . A A . 29 ARG HA 1 1 7 5083 1 1 30 ARG HB2 H -7.607 2.218 2.013 1.00 . A A . 29 ARG HB2 1 1 7 5084 1 1 30 ARG HB3 H -8.578 1.028 1.161 1.00 . A A . 29 ARG HB3 1 1 7 5085 1 1 30 ARG HD2 H -7.735 -0.672 4.305 1.00 . A A . 29 ARG HD2 1 1 7 5086 1 1 30 ARG HD3 H -7.680 1.094 4.312 1.00 . A A . 29 ARG HD3 1 1 7 5087 1 1 30 ARG HE H -9.651 0.515 2.529 1.00 . A A . 29 ARG HE 1 1 7 5088 1 1 30 ARG HG2 H -7.213 -0.763 1.992 1.00 . A A . 29 ARG HG2 1 1 7 5089 1 1 30 ARG HG3 H -6.082 0.382 2.717 1.00 . A A . 29 ARG HG3 1 1 7 5090 1 1 30 ARG HH11 H -9.093 -0.507 5.846 1.00 . A A . 29 ARG HH11 1 1 7 5091 1 1 30 ARG HH12 H -10.786 -0.546 6.231 1.00 . A A . 29 ARG HH12 1 1 7 5092 1 1 30 ARG HH21 H -11.851 0.497 3.056 1.00 . A A . 29 ARG HH21 1 1 7 5093 1 1 30 ARG HH22 H -12.357 0.027 4.656 1.00 . A A . 29 ARG HH22 1 1 7 5094 1 1 30 ARG N N -5.581 2.344 0.531 1.00 . A A . 29 ARG N 1 1 7 5095 1 1 30 ARG NE N -9.388 0.267 3.444 1.00 . A A . 29 ARG NE 1 1 7 5096 1 1 30 ARG NH1 N -10.054 -0.367 5.570 1.00 . A A . 29 ARG NH1 1 1 7 5097 1 1 30 ARG NH2 N -11.619 0.199 3.993 1.00 . A A . 29 ARG NH2 1 1 7 5098 1 1 30 ARG O O -7.956 1.119 -1.766 1.00 . A A . 29 ARG O 1 1 7 5099 1 1 31 SER C C -8.221 3.632 -3.421 1.00 . A A . 30 SER C 1 1 7 5100 1 1 31 SER CA C -8.679 3.798 -1.970 1.00 . A A . 30 SER CA 1 1 7 5101 1 1 31 SER CB C -8.911 5.280 -1.668 1.00 . A A . 30 SER CB 1 1 7 5102 1 1 31 SER H H -7.241 3.829 -0.412 1.00 . A A . 30 SER H 1 1 7 5103 1 1 31 SER HA H -9.616 3.276 -1.849 1.00 . A A . 30 SER HA 1 1 7 5104 1 1 31 SER HB2 H -7.968 5.803 -1.706 1.00 . A A . 30 SER HB2 1 1 7 5105 1 1 31 SER HB3 H -9.583 5.693 -2.405 1.00 . A A . 30 SER HB3 1 1 7 5106 1 1 31 SER HG H -8.831 5.205 0.292 1.00 . A A . 30 SER HG 1 1 7 5107 1 1 31 SER N N -7.737 3.228 -1.008 1.00 . A A . 30 SER N 1 1 7 5108 1 1 31 SER O O -9.012 3.216 -4.270 1.00 . A A . 30 SER O 1 1 7 5109 1 1 31 SER OG O -9.479 5.458 -0.380 1.00 . A A . 30 SER OG 1 1 7 5110 1 1 32 TRP C C -6.156 2.411 -5.527 1.00 . A A . 31 TRP C 1 1 7 5111 1 1 32 TRP CA C -6.490 3.837 -5.104 1.00 . A A . 31 TRP CA 1 1 7 5112 1 1 32 TRP CB C -5.302 4.771 -5.379 1.00 . A A . 31 TRP CB 1 1 7 5113 1 1 32 TRP CD1 C -3.696 3.658 -3.739 1.00 . A A . 31 TRP CD1 1 1 7 5114 1 1 32 TRP CD2 C -3.599 5.889 -3.747 1.00 . A A . 31 TRP CD2 1 1 7 5115 1 1 32 TRP CE2 C -2.681 5.403 -2.802 1.00 . A A . 31 TRP CE2 1 1 7 5116 1 1 32 TRP CE3 C -3.709 7.270 -3.931 1.00 . A A . 31 TRP CE3 1 1 7 5117 1 1 32 TRP CG C -4.247 4.753 -4.325 1.00 . A A . 31 TRP CG 1 1 7 5118 1 1 32 TRP CH2 C -2.007 7.588 -2.245 1.00 . A A . 31 TRP CH2 1 1 7 5119 1 1 32 TRP CZ2 C -1.880 6.244 -2.043 1.00 . A A . 31 TRP CZ2 1 1 7 5120 1 1 32 TRP CZ3 C -2.909 8.104 -3.177 1.00 . A A . 31 TRP CZ3 1 1 7 5121 1 1 32 TRP H H -6.328 4.175 -3.001 1.00 . A A . 31 TRP H 1 1 7 5122 1 1 32 TRP HA H -7.317 4.169 -5.717 1.00 . A A . 31 TRP HA 1 1 7 5123 1 1 32 TRP HB2 H -4.834 4.475 -6.310 1.00 . A A . 31 TRP HB2 1 1 7 5124 1 1 32 TRP HB3 H -5.664 5.783 -5.473 1.00 . A A . 31 TRP HB3 1 1 7 5125 1 1 32 TRP HD1 H -3.976 2.642 -3.969 1.00 . A A . 31 TRP HD1 1 1 7 5126 1 1 32 TRP HE1 H -2.237 3.431 -2.254 1.00 . A A . 31 TRP HE1 1 1 7 5127 1 1 32 TRP HE3 H -4.401 7.685 -4.648 1.00 . A A . 31 TRP HE3 1 1 7 5128 1 1 32 TRP HH2 H -1.401 8.279 -1.677 1.00 . A A . 31 TRP HH2 1 1 7 5129 1 1 32 TRP HZ2 H -1.177 5.864 -1.317 1.00 . A A . 31 TRP HZ2 1 1 7 5130 1 1 32 TRP HZ3 H -2.970 9.172 -3.306 1.00 . A A . 31 TRP HZ3 1 1 7 5131 1 1 32 TRP N N -6.952 3.911 -3.715 1.00 . A A . 31 TRP N 1 1 7 5132 1 1 32 TRP NE1 N -2.762 4.040 -2.815 1.00 . A A . 31 TRP NE1 1 1 7 5133 1 1 32 TRP O O -5.882 2.159 -6.702 1.00 . A A . 31 TRP O 1 1 7 5134 1 1 33 ASN C C -7.363 -0.599 -5.122 1.00 . A A . 32 ASN C 1 1 7 5135 1 1 33 ASN CA C -6.011 0.066 -4.925 1.00 . A A . 32 ASN CA 1 1 7 5136 1 1 33 ASN CB C -5.216 -0.682 -3.850 1.00 . A A . 32 ASN CB 1 1 7 5137 1 1 33 ASN CG C -3.726 -0.491 -3.994 1.00 . A A . 32 ASN CG 1 1 7 5138 1 1 33 ASN H H -6.341 1.733 -3.652 1.00 . A A . 32 ASN H 1 1 7 5139 1 1 33 ASN HA H -5.465 0.022 -5.858 1.00 . A A . 32 ASN HA 1 1 7 5140 1 1 33 ASN HB2 H -5.510 -0.321 -2.875 1.00 . A A . 32 ASN HB2 1 1 7 5141 1 1 33 ASN HB3 H -5.434 -1.738 -3.916 1.00 . A A . 32 ASN HB3 1 1 7 5142 1 1 33 ASN HD21 H -3.752 0.951 -2.628 1.00 . A A . 32 ASN HD21 1 1 7 5143 1 1 33 ASN HD22 H -2.201 0.581 -3.308 1.00 . A A . 32 ASN HD22 1 1 7 5144 1 1 33 ASN N N -6.193 1.474 -4.586 1.00 . A A . 32 ASN N 1 1 7 5145 1 1 33 ASN ND2 N -3.172 0.439 -3.238 1.00 . A A . 32 ASN ND2 1 1 7 5146 1 1 33 ASN O O -7.469 -1.634 -5.781 1.00 . A A . 32 ASN O 1 1 7 5147 1 1 33 ASN OD1 O -3.073 -1.191 -4.762 1.00 . A A . 32 ASN OD1 1 1 7 5148 1 1 34 GLY C C -9.968 -1.863 -4.238 1.00 . A A . 33 GLY C 1 1 7 5149 1 1 34 GLY CA C -9.751 -0.450 -4.733 1.00 . A A . 33 GLY CA 1 1 7 5150 1 1 34 GLY H H -8.224 0.796 -3.981 1.00 . A A . 33 GLY H 1 1 7 5151 1 1 34 GLY HA2 H -10.421 0.210 -4.203 1.00 . A A . 33 GLY HA2 1 1 7 5152 1 1 34 GLY HA3 H -9.990 -0.412 -5.785 1.00 . A A . 33 GLY HA3 1 1 7 5153 1 1 34 GLY N N -8.392 0.015 -4.546 1.00 . A A . 33 GLY N 1 1 7 5154 1 1 34 GLY O O -10.610 -2.670 -4.913 1.00 . A A . 33 GLY O 1 1 7 5155 1 1 35 ILE C C -10.632 -3.417 -1.356 1.00 . A A . 34 ILE C 1 1 7 5156 1 1 35 ILE CA C -9.639 -3.489 -2.491 1.00 . A A . 34 ILE CA 1 1 7 5157 1 1 35 ILE CB C -8.351 -4.157 -1.959 1.00 . A A . 34 ILE CB 1 1 7 5158 1 1 35 ILE CD1 C -6.885 -2.194 -1.261 1.00 . A A . 34 ILE CD1 1 1 7 5159 1 1 35 ILE CG1 C -7.100 -3.323 -2.250 1.00 . A A . 34 ILE CG1 1 1 7 5160 1 1 35 ILE CG2 C -8.221 -5.552 -2.542 1.00 . A A . 34 ILE CG2 1 1 7 5161 1 1 35 ILE H H -8.904 -1.510 -2.586 1.00 . A A . 34 ILE H 1 1 7 5162 1 1 35 ILE HA H -10.049 -4.122 -3.263 1.00 . A A . 34 ILE HA 1 1 7 5163 1 1 35 ILE HB H -8.457 -4.262 -0.888 1.00 . A A . 34 ILE HB 1 1 7 5164 1 1 35 ILE HD11 H -6.766 -2.603 -0.268 1.00 . A A . 34 ILE HD11 1 1 7 5165 1 1 35 ILE HD12 H -7.739 -1.534 -1.279 1.00 . A A . 34 ILE HD12 1 1 7 5166 1 1 35 ILE HD13 H -5.997 -1.641 -1.532 1.00 . A A . 34 ILE HD13 1 1 7 5167 1 1 35 ILE HG12 H -6.233 -3.965 -2.215 1.00 . A A . 34 ILE HG12 1 1 7 5168 1 1 35 ILE HG13 H -7.185 -2.891 -3.238 1.00 . A A . 34 ILE HG13 1 1 7 5169 1 1 35 ILE HG21 H -7.328 -6.021 -2.157 1.00 . A A . 34 ILE HG21 1 1 7 5170 1 1 35 ILE HG22 H -8.162 -5.489 -3.618 1.00 . A A . 34 ILE HG22 1 1 7 5171 1 1 35 ILE HG23 H -9.088 -6.140 -2.260 1.00 . A A . 34 ILE HG23 1 1 7 5172 1 1 35 ILE N N -9.432 -2.175 -3.070 1.00 . A A . 34 ILE N 1 1 7 5173 1 1 35 ILE O O -10.700 -2.421 -0.634 1.00 . A A . 34 ILE O 1 1 7 5174 1 1 36 SER C C -11.803 -5.478 0.965 1.00 . A A . 35 SER C 1 1 7 5175 1 1 36 SER CA C -12.351 -4.581 -0.134 1.00 . A A . 35 SER CA 1 1 7 5176 1 1 36 SER CB C -13.653 -5.142 -0.677 1.00 . A A . 35 SER CB 1 1 7 5177 1 1 36 SER H H -11.319 -5.218 -1.853 1.00 . A A . 35 SER H 1 1 7 5178 1 1 36 SER HA H -12.525 -3.593 0.264 1.00 . A A . 35 SER HA 1 1 7 5179 1 1 36 SER HB2 H -13.465 -6.120 -1.099 1.00 . A A . 35 SER HB2 1 1 7 5180 1 1 36 SER HB3 H -14.375 -5.223 0.123 1.00 . A A . 35 SER HB3 1 1 7 5181 1 1 36 SER HG H -13.449 -3.857 -2.143 1.00 . A A . 35 SER HG 1 1 7 5182 1 1 36 SER N N -11.398 -4.475 -1.211 1.00 . A A . 35 SER N 1 1 7 5183 1 1 36 SER O O -11.691 -6.693 0.791 1.00 . A A . 35 SER O 1 1 7 5184 1 1 36 SER OG O -14.176 -4.301 -1.690 1.00 . A A . 35 SER OG 1 1 7 5185 1 1 37 GLY C C -9.460 -5.231 3.455 1.00 . A A . 36 GLY C 1 1 7 5186 1 1 37 GLY CA C -10.899 -5.615 3.189 1.00 . A A . 36 GLY CA 1 1 7 5187 1 1 37 GLY H H -11.599 -3.901 2.174 1.00 . A A . 36 GLY H 1 1 7 5188 1 1 37 GLY HA2 H -11.484 -5.423 4.076 1.00 . A A . 36 GLY HA2 1 1 7 5189 1 1 37 GLY HA3 H -10.944 -6.669 2.961 1.00 . A A . 36 GLY HA3 1 1 7 5190 1 1 37 GLY N N -11.465 -4.874 2.090 1.00 . A A . 36 GLY N 1 1 7 5191 1 1 37 GLY O O -8.985 -4.196 2.985 1.00 . A A . 36 GLY O 1 1 7 5192 1 1 38 ASP C C -6.463 -6.886 4.017 1.00 . A A . 37 ASP C 1 1 7 5193 1 1 38 ASP CA C -7.382 -5.810 4.585 1.00 . A A . 37 ASP CA 1 1 7 5194 1 1 38 ASP CB C -7.246 -5.738 6.112 1.00 . A A . 37 ASP CB 1 1 7 5195 1 1 38 ASP CG C -7.670 -7.018 6.811 1.00 . A A . 37 ASP CG 1 1 7 5196 1 1 38 ASP H H -9.203 -6.883 4.540 1.00 . A A . 37 ASP H 1 1 7 5197 1 1 38 ASP HA H -7.097 -4.857 4.165 1.00 . A A . 37 ASP HA 1 1 7 5198 1 1 38 ASP HB2 H -6.215 -5.541 6.364 1.00 . A A . 37 ASP HB2 1 1 7 5199 1 1 38 ASP HB3 H -7.861 -4.930 6.480 1.00 . A A . 37 ASP HB3 1 1 7 5200 1 1 38 ASP N N -8.768 -6.066 4.213 1.00 . A A . 37 ASP N 1 1 7 5201 1 1 38 ASP O O -5.441 -7.225 4.613 1.00 . A A . 37 ASP O 1 1 7 5202 1 1 38 ASP OD1 O -8.860 -7.390 6.719 1.00 . A A . 37 ASP OD1 1 1 7 5203 1 1 38 ASP OD2 O -6.821 -7.657 7.461 1.00 . A A . 37 ASP OD2 1 1 7 5204 1 1 39 LEU C C -4.751 -7.903 1.594 1.00 . A A . 38 LEU C 1 1 7 5205 1 1 39 LEU CA C -6.038 -8.457 2.213 1.00 . A A . 38 LEU CA 1 1 7 5206 1 1 39 LEU CB C -6.870 -9.205 1.165 1.00 . A A . 38 LEU CB 1 1 7 5207 1 1 39 LEU CD1 C -7.096 -8.868 -1.309 1.00 . A A . 38 LEU CD1 1 1 7 5208 1 1 39 LEU CD2 C -9.001 -8.307 0.202 1.00 . A A . 38 LEU CD2 1 1 7 5209 1 1 39 LEU CG C -7.489 -8.342 0.063 1.00 . A A . 38 LEU CG 1 1 7 5210 1 1 39 LEU H H -7.621 -7.063 2.401 1.00 . A A . 38 LEU H 1 1 7 5211 1 1 39 LEU HA H -5.760 -9.156 2.990 1.00 . A A . 38 LEU HA 1 1 7 5212 1 1 39 LEU HB2 H -6.234 -9.942 0.696 1.00 . A A . 38 LEU HB2 1 1 7 5213 1 1 39 LEU HB3 H -7.668 -9.720 1.678 1.00 . A A . 38 LEU HB3 1 1 7 5214 1 1 39 LEU HD11 H -7.409 -9.897 -1.404 1.00 . A A . 38 LEU HD11 1 1 7 5215 1 1 39 LEU HD12 H -6.024 -8.804 -1.423 1.00 . A A . 38 LEU HD12 1 1 7 5216 1 1 39 LEU HD13 H -7.574 -8.274 -2.073 1.00 . A A . 38 LEU HD13 1 1 7 5217 1 1 39 LEU HD21 H -9.394 -9.311 0.124 1.00 . A A . 38 LEU HD21 1 1 7 5218 1 1 39 LEU HD22 H -9.421 -7.694 -0.582 1.00 . A A . 38 LEU HD22 1 1 7 5219 1 1 39 LEU HD23 H -9.266 -7.892 1.163 1.00 . A A . 38 LEU HD23 1 1 7 5220 1 1 39 LEU HG H -7.119 -7.331 0.154 1.00 . A A . 38 LEU HG 1 1 7 5221 1 1 39 LEU N N -6.820 -7.403 2.848 1.00 . A A . 38 LEU N 1 1 7 5222 1 1 39 LEU O O -4.757 -7.287 0.526 1.00 . A A . 38 LEU O 1 1 7 5223 1 1 40 ILE C C -1.319 -8.781 2.177 1.00 . A A . 39 ILE C 1 1 7 5224 1 1 40 ILE CA C -2.340 -7.699 1.837 1.00 . A A . 39 ILE CA 1 1 7 5225 1 1 40 ILE CB C -1.925 -6.333 2.450 1.00 . A A . 39 ILE CB 1 1 7 5226 1 1 40 ILE CD1 C -2.025 -3.819 2.038 1.00 . A A . 39 ILE CD1 1 1 7 5227 1 1 40 ILE CG1 C -2.597 -5.180 1.697 1.00 . A A . 39 ILE CG1 1 1 7 5228 1 1 40 ILE CG2 C -0.419 -6.146 2.454 1.00 . A A . 39 ILE CG2 1 1 7 5229 1 1 40 ILE H H -3.725 -8.585 3.159 1.00 . A A . 39 ILE H 1 1 7 5230 1 1 40 ILE HA H -2.387 -7.590 0.762 1.00 . A A . 39 ILE HA 1 1 7 5231 1 1 40 ILE HB H -2.260 -6.315 3.475 1.00 . A A . 39 ILE HB 1 1 7 5232 1 1 40 ILE HD11 H -1.981 -3.708 3.118 1.00 . A A . 39 ILE HD11 1 1 7 5233 1 1 40 ILE HD12 H -2.654 -3.047 1.620 1.00 . A A . 39 ILE HD12 1 1 7 5234 1 1 40 ILE HD13 H -1.030 -3.733 1.629 1.00 . A A . 39 ILE HD13 1 1 7 5235 1 1 40 ILE HG12 H -2.475 -5.334 0.636 1.00 . A A . 39 ILE HG12 1 1 7 5236 1 1 40 ILE HG13 H -3.650 -5.169 1.936 1.00 . A A . 39 ILE HG13 1 1 7 5237 1 1 40 ILE HG21 H -0.173 -5.213 2.950 1.00 . A A . 39 ILE HG21 1 1 7 5238 1 1 40 ILE HG22 H -0.053 -6.124 1.440 1.00 . A A . 39 ILE HG22 1 1 7 5239 1 1 40 ILE HG23 H 0.045 -6.967 2.988 1.00 . A A . 39 ILE HG23 1 1 7 5240 1 1 40 ILE N N -3.653 -8.112 2.296 1.00 . A A . 39 ILE N 1 1 7 5241 1 1 40 ILE O O -1.192 -9.183 3.334 1.00 . A A . 39 ILE O 1 1 7 5242 1 1 41 PHE C C 1.628 -10.074 0.580 1.00 . A A . 40 PHE C 1 1 7 5243 1 1 41 PHE CA C 0.339 -10.356 1.345 1.00 . A A . 40 PHE CA 1 1 7 5244 1 1 41 PHE CB C -0.277 -11.686 0.887 1.00 . A A . 40 PHE CB 1 1 7 5245 1 1 41 PHE CD1 C 0.158 -12.077 -1.559 1.00 . A A . 40 PHE CD1 1 1 7 5246 1 1 41 PHE CD2 C -2.010 -11.332 -0.900 1.00 . A A . 40 PHE CD2 1 1 7 5247 1 1 41 PHE CE1 C -0.244 -12.089 -2.879 1.00 . A A . 40 PHE CE1 1 1 7 5248 1 1 41 PHE CE2 C -2.416 -11.343 -2.219 1.00 . A A . 40 PHE CE2 1 1 7 5249 1 1 41 PHE CG C -0.718 -11.698 -0.553 1.00 . A A . 40 PHE CG 1 1 7 5250 1 1 41 PHE CZ C -1.532 -11.720 -3.209 1.00 . A A . 40 PHE CZ 1 1 7 5251 1 1 41 PHE H H -0.742 -8.892 0.268 1.00 . A A . 40 PHE H 1 1 7 5252 1 1 41 PHE HA H 0.567 -10.420 2.399 1.00 . A A . 40 PHE HA 1 1 7 5253 1 1 41 PHE HB2 H 0.451 -12.472 1.016 1.00 . A A . 40 PHE HB2 1 1 7 5254 1 1 41 PHE HB3 H -1.141 -11.902 1.501 1.00 . A A . 40 PHE HB3 1 1 7 5255 1 1 41 PHE HD1 H 1.168 -12.365 -1.302 1.00 . A A . 40 PHE HD1 1 1 7 5256 1 1 41 PHE HD2 H -2.705 -11.035 -0.126 1.00 . A A . 40 PHE HD2 1 1 7 5257 1 1 41 PHE HE1 H 0.448 -12.385 -3.653 1.00 . A A . 40 PHE HE1 1 1 7 5258 1 1 41 PHE HE2 H -3.424 -11.054 -2.477 1.00 . A A . 40 PHE HE2 1 1 7 5259 1 1 41 PHE HZ H -1.848 -11.730 -4.241 1.00 . A A . 40 PHE HZ 1 1 7 5260 1 1 41 PHE N N -0.617 -9.271 1.162 1.00 . A A . 40 PHE N 1 1 7 5261 1 1 41 PHE O O 1.637 -9.273 -0.356 1.00 . A A . 40 PHE O 1 1 7 5262 1 1 42 VAL C C 4.013 -10.883 -1.109 1.00 . A A . 41 VAL C 1 1 7 5263 1 1 42 VAL CA C 4.018 -10.517 0.375 1.00 . A A . 41 VAL CA 1 1 7 5264 1 1 42 VAL CB C 5.113 -11.331 1.098 1.00 . A A . 41 VAL CB 1 1 7 5265 1 1 42 VAL CG1 C 6.486 -11.046 0.503 1.00 . A A . 41 VAL CG1 1 1 7 5266 1 1 42 VAL CG2 C 5.106 -11.027 2.588 1.00 . A A . 41 VAL CG2 1 1 7 5267 1 1 42 VAL H H 2.614 -11.416 1.687 1.00 . A A . 41 VAL H 1 1 7 5268 1 1 42 VAL HA H 4.255 -9.465 0.474 1.00 . A A . 41 VAL HA 1 1 7 5269 1 1 42 VAL HB H 4.899 -12.383 0.966 1.00 . A A . 41 VAL HB 1 1 7 5270 1 1 42 VAL HG11 H 6.485 -11.302 -0.547 1.00 . A A . 41 VAL HG11 1 1 7 5271 1 1 42 VAL HG12 H 7.230 -11.637 1.016 1.00 . A A . 41 VAL HG12 1 1 7 5272 1 1 42 VAL HG13 H 6.717 -9.998 0.617 1.00 . A A . 41 VAL HG13 1 1 7 5273 1 1 42 VAL HG21 H 5.891 -11.588 3.074 1.00 . A A . 41 VAL HG21 1 1 7 5274 1 1 42 VAL HG22 H 4.151 -11.306 3.008 1.00 . A A . 41 VAL HG22 1 1 7 5275 1 1 42 VAL HG23 H 5.271 -9.970 2.740 1.00 . A A . 41 VAL HG23 1 1 7 5276 1 1 42 VAL N N 2.706 -10.740 0.975 1.00 . A A . 41 VAL N 1 1 7 5277 1 1 42 VAL O O 3.567 -11.966 -1.490 1.00 . A A . 41 VAL O 1 1 7 5278 1 1 43 GLY C C 3.411 -9.423 -4.069 1.00 . A A . 42 GLY C 1 1 7 5279 1 1 43 GLY CA C 4.503 -10.207 -3.373 1.00 . A A . 42 GLY CA 1 1 7 5280 1 1 43 GLY H H 4.863 -9.126 -1.587 1.00 . A A . 42 GLY H 1 1 7 5281 1 1 43 GLY HA2 H 5.461 -9.913 -3.777 1.00 . A A . 42 GLY HA2 1 1 7 5282 1 1 43 GLY HA3 H 4.351 -11.259 -3.558 1.00 . A A . 42 GLY HA3 1 1 7 5283 1 1 43 GLY N N 4.501 -9.971 -1.945 1.00 . A A . 42 GLY N 1 1 7 5284 1 1 43 GLY O O 3.475 -9.187 -5.277 1.00 . A A . 42 GLY O 1 1 7 5285 1 1 44 GLN C C 1.797 -6.805 -4.109 1.00 . A A . 43 GLN C 1 1 7 5286 1 1 44 GLN CA C 1.314 -8.217 -3.818 1.00 . A A . 43 GLN CA 1 1 7 5287 1 1 44 GLN CB C 0.151 -8.185 -2.820 1.00 . A A . 43 GLN CB 1 1 7 5288 1 1 44 GLN CD C -2.187 -7.372 -2.311 1.00 . A A . 43 GLN CD 1 1 7 5289 1 1 44 GLN CG C -0.978 -7.244 -3.215 1.00 . A A . 43 GLN CG 1 1 7 5290 1 1 44 GLN H H 2.408 -9.265 -2.346 1.00 . A A . 43 GLN H 1 1 7 5291 1 1 44 GLN HA H 0.977 -8.669 -4.739 1.00 . A A . 43 GLN HA 1 1 7 5292 1 1 44 GLN HB2 H -0.256 -9.182 -2.729 1.00 . A A . 43 GLN HB2 1 1 7 5293 1 1 44 GLN HB3 H 0.530 -7.874 -1.857 1.00 . A A . 43 GLN HB3 1 1 7 5294 1 1 44 GLN HE21 H -1.485 -5.955 -1.112 1.00 . A A . 43 GLN HE21 1 1 7 5295 1 1 44 GLN HE22 H -3.006 -6.647 -0.654 1.00 . A A . 43 GLN HE22 1 1 7 5296 1 1 44 GLN HG2 H -0.615 -6.226 -3.162 1.00 . A A . 43 GLN HG2 1 1 7 5297 1 1 44 GLN HG3 H -1.277 -7.466 -4.228 1.00 . A A . 43 GLN HG3 1 1 7 5298 1 1 44 GLN N N 2.408 -9.019 -3.298 1.00 . A A . 43 GLN N 1 1 7 5299 1 1 44 GLN NE2 N -2.228 -6.579 -1.253 1.00 . A A . 43 GLN NE2 1 1 7 5300 1 1 44 GLN O O 2.400 -6.157 -3.253 1.00 . A A . 43 GLN O 1 1 7 5301 1 1 44 GLN OE1 O -3.083 -8.173 -2.563 1.00 . A A . 43 GLN OE1 1 1 7 5302 1 1 45 LYS C C 0.782 -4.051 -5.483 1.00 . A A . 44 LYS C 1 1 7 5303 1 1 45 LYS CA C 1.944 -5.004 -5.708 1.00 . A A . 44 LYS CA 1 1 7 5304 1 1 45 LYS CB C 2.368 -4.993 -7.176 1.00 . A A . 44 LYS CB 1 1 7 5305 1 1 45 LYS CD C 3.418 -3.732 -9.083 1.00 . A A . 44 LYS CD 1 1 7 5306 1 1 45 LYS CE C 4.201 -4.972 -9.489 1.00 . A A . 44 LYS CE 1 1 7 5307 1 1 45 LYS CG C 3.097 -3.725 -7.596 1.00 . A A . 44 LYS CG 1 1 7 5308 1 1 45 LYS H H 1.058 -6.907 -5.959 1.00 . A A . 44 LYS H 1 1 7 5309 1 1 45 LYS HA H 2.776 -4.705 -5.089 1.00 . A A . 44 LYS HA 1 1 7 5310 1 1 45 LYS HB2 H 3.021 -5.833 -7.356 1.00 . A A . 44 LYS HB2 1 1 7 5311 1 1 45 LYS HB3 H 1.487 -5.096 -7.792 1.00 . A A . 44 LYS HB3 1 1 7 5312 1 1 45 LYS HD2 H 2.494 -3.706 -9.640 1.00 . A A . 44 LYS HD2 1 1 7 5313 1 1 45 LYS HD3 H 4.005 -2.856 -9.317 1.00 . A A . 44 LYS HD3 1 1 7 5314 1 1 45 LYS HE2 H 5.109 -5.017 -8.905 1.00 . A A . 44 LYS HE2 1 1 7 5315 1 1 45 LYS HE3 H 3.601 -5.847 -9.288 1.00 . A A . 44 LYS HE3 1 1 7 5316 1 1 45 LYS HG2 H 2.472 -2.873 -7.377 1.00 . A A . 44 LYS HG2 1 1 7 5317 1 1 45 LYS HG3 H 4.018 -3.650 -7.039 1.00 . A A . 44 LYS HG3 1 1 7 5318 1 1 45 LYS HZ1 H 4.977 -5.862 -11.215 1.00 . A A . 44 LYS HZ1 1 1 7 5319 1 1 45 LYS HZ2 H 5.250 -4.194 -11.115 1.00 . A A . 44 LYS HZ2 1 1 7 5320 1 1 45 LYS HZ3 H 3.707 -4.772 -11.511 1.00 . A A . 44 LYS HZ3 1 1 7 5321 1 1 45 LYS N N 1.544 -6.340 -5.316 1.00 . A A . 44 LYS N 1 1 7 5322 1 1 45 LYS NZ N 4.557 -4.950 -10.930 1.00 . A A . 44 LYS NZ 1 1 7 5323 1 1 45 LYS O O -0.210 -4.094 -6.208 1.00 . A A . 44 LYS O 1 1 7 5324 1 1 46 LEU C C 0.265 -0.856 -4.331 1.00 . A A . 45 LEU C 1 1 7 5325 1 1 46 LEU CA C -0.186 -2.305 -4.130 1.00 . A A . 45 LEU CA 1 1 7 5326 1 1 46 LEU CB C -0.731 -2.597 -2.693 1.00 . A A . 45 LEU CB 1 1 7 5327 1 1 46 LEU CD1 C 1.518 -2.503 -1.539 1.00 . A A . 45 LEU CD1 1 1 7 5328 1 1 46 LEU CD2 C -0.092 -0.607 -1.255 1.00 . A A . 45 LEU CD2 1 1 7 5329 1 1 46 LEU CG C 0.063 -2.107 -1.464 1.00 . A A . 45 LEU CG 1 1 7 5330 1 1 46 LEU H H 1.732 -3.184 -3.952 1.00 . A A . 45 LEU H 1 1 7 5331 1 1 46 LEU HA H -0.983 -2.496 -4.837 1.00 . A A . 45 LEU HA 1 1 7 5332 1 1 46 LEU HB2 H -1.719 -2.175 -2.623 1.00 . A A . 45 LEU HB2 1 1 7 5333 1 1 46 LEU HB3 H -0.823 -3.675 -2.599 1.00 . A A . 45 LEU HB3 1 1 7 5334 1 1 46 LEU HD11 H 1.591 -3.572 -1.692 1.00 . A A . 45 LEU HD11 1 1 7 5335 1 1 46 LEU HD12 H 2.009 -2.239 -0.616 1.00 . A A . 45 LEU HD12 1 1 7 5336 1 1 46 LEU HD13 H 1.992 -1.989 -2.363 1.00 . A A . 45 LEU HD13 1 1 7 5337 1 1 46 LEU HD21 H 0.300 -0.083 -2.114 1.00 . A A . 45 LEU HD21 1 1 7 5338 1 1 46 LEU HD22 H 0.448 -0.307 -0.370 1.00 . A A . 45 LEU HD22 1 1 7 5339 1 1 46 LEU HD23 H -1.139 -0.366 -1.136 1.00 . A A . 45 LEU HD23 1 1 7 5340 1 1 46 LEU HG H -0.347 -2.593 -0.589 1.00 . A A . 45 LEU HG 1 1 7 5341 1 1 46 LEU N N 0.894 -3.211 -4.470 1.00 . A A . 45 LEU N 1 1 7 5342 1 1 46 LEU O O 1.422 -0.511 -4.069 1.00 . A A . 45 LEU O 1 1 7 5343 1 1 47 ILE C C -0.103 2.129 -3.817 1.00 . A A . 46 ILE C 1 1 7 5344 1 1 47 ILE CA C -0.340 1.374 -5.115 1.00 . A A . 46 ILE CA 1 1 7 5345 1 1 47 ILE CB C -1.488 2.088 -5.874 1.00 . A A . 46 ILE CB 1 1 7 5346 1 1 47 ILE CD1 C -0.651 1.320 -8.166 1.00 . A A . 46 ILE CD1 1 1 7 5347 1 1 47 ILE CG1 C -1.812 1.381 -7.192 1.00 . A A . 46 ILE CG1 1 1 7 5348 1 1 47 ILE CG2 C -1.136 3.552 -6.131 1.00 . A A . 46 ILE CG2 1 1 7 5349 1 1 47 ILE H H -1.533 -0.380 -5.063 1.00 . A A . 46 ILE H 1 1 7 5350 1 1 47 ILE HA H 0.551 1.422 -5.722 1.00 . A A . 46 ILE HA 1 1 7 5351 1 1 47 ILE HB H -2.364 2.067 -5.243 1.00 . A A . 46 ILE HB 1 1 7 5352 1 1 47 ILE HD11 H 0.178 0.797 -7.708 1.00 . A A . 46 ILE HD11 1 1 7 5353 1 1 47 ILE HD12 H -0.346 2.323 -8.423 1.00 . A A . 46 ILE HD12 1 1 7 5354 1 1 47 ILE HD13 H -0.957 0.797 -9.060 1.00 . A A . 46 ILE HD13 1 1 7 5355 1 1 47 ILE HG12 H -2.122 0.370 -6.983 1.00 . A A . 46 ILE HG12 1 1 7 5356 1 1 47 ILE HG13 H -2.624 1.910 -7.677 1.00 . A A . 46 ILE HG13 1 1 7 5357 1 1 47 ILE HG21 H -1.960 4.040 -6.630 1.00 . A A . 46 ILE HG21 1 1 7 5358 1 1 47 ILE HG22 H -0.255 3.606 -6.755 1.00 . A A . 46 ILE HG22 1 1 7 5359 1 1 47 ILE HG23 H -0.939 4.049 -5.187 1.00 . A A . 46 ILE HG23 1 1 7 5360 1 1 47 ILE N N -0.636 -0.030 -4.851 1.00 . A A . 46 ILE N 1 1 7 5361 1 1 47 ILE O O -0.848 1.971 -2.847 1.00 . A A . 46 ILE O 1 1 7 5362 1 1 48 VAL C C 1.831 5.121 -3.191 1.00 . A A . 47 VAL C 1 1 7 5363 1 1 48 VAL CA C 1.189 3.823 -2.694 1.00 . A A . 47 VAL CA 1 1 7 5364 1 1 48 VAL CB C 2.076 3.154 -1.620 1.00 . A A . 47 VAL CB 1 1 7 5365 1 1 48 VAL CG1 C 3.470 2.843 -2.146 1.00 . A A . 47 VAL CG1 1 1 7 5366 1 1 48 VAL CG2 C 2.139 4.026 -0.379 1.00 . A A . 47 VAL CG2 1 1 7 5367 1 1 48 VAL H H 1.530 2.970 -4.581 1.00 . A A . 47 VAL H 1 1 7 5368 1 1 48 VAL HA H 0.237 4.062 -2.236 1.00 . A A . 47 VAL HA 1 1 7 5369 1 1 48 VAL HB H 1.611 2.220 -1.341 1.00 . A A . 47 VAL HB 1 1 7 5370 1 1 48 VAL HG11 H 3.941 3.757 -2.478 1.00 . A A . 47 VAL HG11 1 1 7 5371 1 1 48 VAL HG12 H 3.396 2.155 -2.975 1.00 . A A . 47 VAL HG12 1 1 7 5372 1 1 48 VAL HG13 H 4.061 2.399 -1.359 1.00 . A A . 47 VAL HG13 1 1 7 5373 1 1 48 VAL HG21 H 2.404 5.035 -0.660 1.00 . A A . 47 VAL HG21 1 1 7 5374 1 1 48 VAL HG22 H 2.886 3.634 0.296 1.00 . A A . 47 VAL HG22 1 1 7 5375 1 1 48 VAL HG23 H 1.174 4.026 0.112 1.00 . A A . 47 VAL HG23 1 1 7 5376 1 1 48 VAL N N 0.927 2.946 -3.805 1.00 . A A . 47 VAL N 1 1 7 5377 1 1 48 VAL O O 2.803 5.122 -3.937 1.00 . A A . 47 VAL O 1 1 7 5378 1 1 49 LYS C C 1.615 8.400 -1.855 1.00 . A A . 48 LYS C 1 1 7 5379 1 1 49 LYS CA C 1.803 7.527 -3.085 1.00 . A A . 48 LYS CA 1 1 7 5380 1 1 49 LYS CB C 1.200 8.167 -4.339 1.00 . A A . 48 LYS CB 1 1 7 5381 1 1 49 LYS CD C 3.188 9.630 -4.826 1.00 . A A . 48 LYS CD 1 1 7 5382 1 1 49 LYS CE C 3.665 11.044 -5.114 1.00 . A A . 48 LYS CE 1 1 7 5383 1 1 49 LYS CG C 1.684 9.585 -4.609 1.00 . A A . 48 LYS CG 1 1 7 5384 1 1 49 LYS H H 0.327 6.150 -2.460 1.00 . A A . 48 LYS H 1 1 7 5385 1 1 49 LYS HA H 2.858 7.386 -3.243 1.00 . A A . 48 LYS HA 1 1 7 5386 1 1 49 LYS HB2 H 1.469 7.557 -5.190 1.00 . A A . 48 LYS HB2 1 1 7 5387 1 1 49 LYS HB3 H 0.123 8.185 -4.242 1.00 . A A . 48 LYS HB3 1 1 7 5388 1 1 49 LYS HD2 H 3.679 9.268 -3.935 1.00 . A A . 48 LYS HD2 1 1 7 5389 1 1 49 LYS HD3 H 3.441 8.996 -5.662 1.00 . A A . 48 LYS HD3 1 1 7 5390 1 1 49 LYS HE2 H 3.178 11.398 -6.012 1.00 . A A . 48 LYS HE2 1 1 7 5391 1 1 49 LYS HE3 H 3.390 11.677 -4.284 1.00 . A A . 48 LYS HE3 1 1 7 5392 1 1 49 LYS HG2 H 1.193 9.961 -5.494 1.00 . A A . 48 LYS HG2 1 1 7 5393 1 1 49 LYS HG3 H 1.432 10.209 -3.764 1.00 . A A . 48 LYS HG3 1 1 7 5394 1 1 49 LYS HZ1 H 5.437 10.447 -6.050 1.00 . A A . 48 LYS HZ1 1 1 7 5395 1 1 49 LYS HZ2 H 5.631 10.865 -4.420 1.00 . A A . 48 LYS HZ2 1 1 7 5396 1 1 49 LYS HZ3 H 5.418 12.075 -5.586 1.00 . A A . 48 LYS HZ3 1 1 7 5397 1 1 49 LYS N N 1.217 6.218 -2.850 1.00 . A A . 48 LYS N 1 1 7 5398 1 1 49 LYS NZ N 5.139 11.109 -5.307 1.00 . A A . 48 LYS NZ 1 1 7 5399 1 1 49 LYS O O 0.501 8.574 -1.372 1.00 . A A . 48 LYS O 1 1 7 5400 1 1 50 LYS C C 1.989 11.015 -0.275 1.00 . A A . 49 LYS C 1 1 7 5401 1 1 50 LYS CA C 2.657 9.657 -0.082 1.00 . A A . 49 LYS CA 1 1 7 5402 1 1 50 LYS CB C 4.065 9.824 0.489 1.00 . A A . 49 LYS CB 1 1 7 5403 1 1 50 LYS CD C 5.498 10.079 2.542 1.00 . A A . 49 LYS CD 1 1 7 5404 1 1 50 LYS CE C 6.224 11.377 2.238 1.00 . A A . 49 LYS CE 1 1 7 5405 1 1 50 LYS CG C 4.081 10.073 1.987 1.00 . A A . 49 LYS CG 1 1 7 5406 1 1 50 LYS H H 3.570 8.821 -1.798 1.00 . A A . 49 LYS H 1 1 7 5407 1 1 50 LYS HA H 2.067 9.078 0.612 1.00 . A A . 49 LYS HA 1 1 7 5408 1 1 50 LYS HB2 H 4.631 8.926 0.289 1.00 . A A . 49 LYS HB2 1 1 7 5409 1 1 50 LYS HB3 H 4.545 10.659 0.001 1.00 . A A . 49 LYS HB3 1 1 7 5410 1 1 50 LYS HD2 H 5.453 9.949 3.613 1.00 . A A . 49 LYS HD2 1 1 7 5411 1 1 50 LYS HD3 H 6.049 9.259 2.104 1.00 . A A . 49 LYS HD3 1 1 7 5412 1 1 50 LYS HE2 H 7.232 11.309 2.618 1.00 . A A . 49 LYS HE2 1 1 7 5413 1 1 50 LYS HE3 H 6.251 11.518 1.166 1.00 . A A . 49 LYS HE3 1 1 7 5414 1 1 50 LYS HG2 H 3.623 11.030 2.187 1.00 . A A . 49 LYS HG2 1 1 7 5415 1 1 50 LYS HG3 H 3.515 9.292 2.475 1.00 . A A . 49 LYS HG3 1 1 7 5416 1 1 50 LYS HZ1 H 5.293 12.323 3.852 1.00 . A A . 49 LYS HZ1 1 1 7 5417 1 1 50 LYS HZ2 H 4.675 12.779 2.339 1.00 . A A . 49 LYS HZ2 1 1 7 5418 1 1 50 LYS HZ3 H 6.176 13.373 2.856 1.00 . A A . 49 LYS HZ3 1 1 7 5419 1 1 50 LYS N N 2.707 8.926 -1.332 1.00 . A A . 49 LYS N 1 1 7 5420 1 1 50 LYS NZ N 5.545 12.543 2.864 1.00 . A A . 49 LYS NZ 1 1 7 5421 1 1 50 LYS O O 2.557 11.927 -0.879 1.00 . A A . 49 LYS O 1 1 7 5422 1 1 51 GLY C C -0.230 12.903 1.579 1.00 . A A . 50 GLY C 1 1 7 5423 1 1 51 GLY CA C 0.046 12.378 0.188 1.00 . A A . 50 GLY CA 1 1 7 5424 1 1 51 GLY H H 0.353 10.339 0.645 1.00 . A A . 50 GLY H 1 1 7 5425 1 1 51 GLY HA2 H 0.632 13.104 -0.355 1.00 . A A . 50 GLY HA2 1 1 7 5426 1 1 51 GLY HA3 H -0.892 12.224 -0.323 1.00 . A A . 50 GLY HA3 1 1 7 5427 1 1 51 GLY N N 0.772 11.126 0.236 1.00 . A A . 50 GLY N 1 1 7 5428 1 1 51 GLY O O -1.248 13.557 1.825 1.00 . A A . 50 GLY O 1 1 7 5429 1 1 52 SER C C 1.725 13.906 4.247 1.00 . A A . 51 SER C 1 1 7 5430 1 1 52 SER CA C 0.557 13.001 3.874 1.00 . A A . 51 SER CA 1 1 7 5431 1 1 52 SER CB C 0.530 11.762 4.775 1.00 . A A . 51 SER CB 1 1 7 5432 1 1 52 SER H H 1.472 12.095 2.215 1.00 . A A . 51 SER H 1 1 7 5433 1 1 52 SER HA H -0.367 13.547 3.989 1.00 . A A . 51 SER HA 1 1 7 5434 1 1 52 SER HB2 H 1.479 11.251 4.712 1.00 . A A . 51 SER HB2 1 1 7 5435 1 1 52 SER HB3 H 0.353 12.064 5.796 1.00 . A A . 51 SER HB3 1 1 7 5436 1 1 52 SER HG H -1.350 11.319 4.419 1.00 . A A . 51 SER HG 1 1 7 5437 1 1 52 SER N N 0.680 12.599 2.488 1.00 . A A . 51 SER N 1 1 7 5438 1 1 52 SER O O 1.540 15.139 4.282 1.00 . A A . 51 SER O 1 1 7 5439 1 1 52 SER OG O -0.497 10.865 4.381 1.00 . A A . 51 SER OG 1 1 8 5440 1 1 2 GLY C C 4.362 8.071 -12.257 1.00 . A A . 1 GLY C 1 1 8 5441 1 1 2 GLY CA C 4.760 6.906 -13.138 1.00 . A A . 1 GLY CA 1 1 8 5442 1 1 2 GLY H H 6.787 7.389 -13.166 1.00 . A A . 1 GLY H 1 1 8 5443 1 1 2 GLY HA2 H 3.979 6.733 -13.863 1.00 . A A . 1 GLY HA2 1 1 8 5444 1 1 2 GLY HA3 H 4.875 6.024 -12.525 1.00 . A A . 1 GLY HA3 1 1 8 5445 1 1 2 GLY N N 6.031 7.167 -13.850 1.00 . A A . 1 GLY N 1 1 8 5446 1 1 2 GLY O O 5.214 8.687 -11.616 1.00 . A A . 1 GLY O 1 1 8 5447 1 1 3 THR C C 2.525 9.009 -9.932 1.00 . A A . 2 THR C 1 1 8 5448 1 1 3 THR CA C 2.572 9.459 -11.390 1.00 . A A . 2 THR CA 1 1 8 5449 1 1 3 THR CB C 1.169 9.909 -11.845 1.00 . A A . 2 THR CB 1 1 8 5450 1 1 3 THR CG2 C 0.710 11.136 -11.064 1.00 . A A . 2 THR CG2 1 1 8 5451 1 1 3 THR H H 2.448 7.889 -12.801 1.00 . A A . 2 THR H 1 1 8 5452 1 1 3 THR HA H 3.245 10.298 -11.477 1.00 . A A . 2 THR HA 1 1 8 5453 1 1 3 THR HB H 0.472 9.103 -11.667 1.00 . A A . 2 THR HB 1 1 8 5454 1 1 3 THR HG1 H 0.610 9.599 -13.716 1.00 . A A . 2 THR HG1 1 1 8 5455 1 1 3 THR HG21 H 1.396 11.951 -11.241 1.00 . A A . 2 THR HG21 1 1 8 5456 1 1 3 THR HG22 H 0.692 10.905 -10.009 1.00 . A A . 2 THR HG22 1 1 8 5457 1 1 3 THR HG23 H -0.279 11.421 -11.390 1.00 . A A . 2 THR HG23 1 1 8 5458 1 1 3 THR N N 3.075 8.386 -12.233 1.00 . A A . 2 THR N 1 1 8 5459 1 1 3 THR O O 3.142 9.622 -9.059 1.00 . A A . 2 THR O 1 1 8 5460 1 1 3 THR OG1 O 1.191 10.213 -13.247 1.00 . A A . 2 THR OG1 1 1 8 5461 1 1 4 ASN C C 2.931 6.425 -8.143 1.00 . A A . 3 ASN C 1 1 8 5462 1 1 4 ASN CA C 1.733 7.338 -8.349 1.00 . A A . 3 ASN CA 1 1 8 5463 1 1 4 ASN CB C 0.445 6.520 -8.181 1.00 . A A . 3 ASN CB 1 1 8 5464 1 1 4 ASN CG C -0.813 7.323 -8.439 1.00 . A A . 3 ASN CG 1 1 8 5465 1 1 4 ASN H H 1.315 7.493 -10.420 1.00 . A A . 3 ASN H 1 1 8 5466 1 1 4 ASN HA H 1.755 8.136 -7.619 1.00 . A A . 3 ASN HA 1 1 8 5467 1 1 4 ASN HB2 H 0.461 5.691 -8.872 1.00 . A A . 3 ASN HB2 1 1 8 5468 1 1 4 ASN HB3 H 0.403 6.138 -7.172 1.00 . A A . 3 ASN HB3 1 1 8 5469 1 1 4 ASN HD21 H -1.016 7.692 -6.500 1.00 . A A . 3 ASN HD21 1 1 8 5470 1 1 4 ASN HD22 H -2.240 8.366 -7.526 1.00 . A A . 3 ASN HD22 1 1 8 5471 1 1 4 ASN N N 1.804 7.925 -9.680 1.00 . A A . 3 ASN N 1 1 8 5472 1 1 4 ASN ND2 N -1.411 7.847 -7.381 1.00 . A A . 3 ASN ND2 1 1 8 5473 1 1 4 ASN O O 3.745 6.250 -9.053 1.00 . A A . 3 ASN O 1 1 8 5474 1 1 4 ASN OD1 O -1.259 7.452 -9.579 1.00 . A A . 3 ASN OD1 1 1 8 5475 1 1 5 THR C C 3.323 3.532 -6.431 1.00 . A A . 4 THR C 1 1 8 5476 1 1 5 THR CA C 4.046 4.837 -6.733 1.00 . A A . 4 THR CA 1 1 8 5477 1 1 5 THR CB C 4.954 5.240 -5.551 1.00 . A A . 4 THR CB 1 1 8 5478 1 1 5 THR CG2 C 6.088 4.245 -5.342 1.00 . A A . 4 THR CG2 1 1 8 5479 1 1 5 THR H H 2.458 6.099 -6.214 1.00 . A A . 4 THR H 1 1 8 5480 1 1 5 THR HA H 4.646 4.726 -7.626 1.00 . A A . 4 THR HA 1 1 8 5481 1 1 5 THR HB H 4.347 5.267 -4.656 1.00 . A A . 4 THR HB 1 1 8 5482 1 1 5 THR HG1 H 5.908 6.574 -6.658 1.00 . A A . 4 THR HG1 1 1 8 5483 1 1 5 THR HG21 H 5.677 3.273 -5.113 1.00 . A A . 4 THR HG21 1 1 8 5484 1 1 5 THR HG22 H 6.709 4.574 -4.523 1.00 . A A . 4 THR HG22 1 1 8 5485 1 1 5 THR HG23 H 6.683 4.180 -6.242 1.00 . A A . 4 THR HG23 1 1 8 5486 1 1 5 THR N N 3.052 5.847 -6.963 1.00 . A A . 4 THR N 1 1 8 5487 1 1 5 THR O O 2.167 3.547 -6.012 1.00 . A A . 4 THR O 1 1 8 5488 1 1 5 THR OG1 O 5.497 6.548 -5.776 1.00 . A A . 4 THR OG1 1 1 8 5489 1 1 6 TYR C C 4.498 0.344 -5.590 1.00 . A A . 5 TYR C 1 1 8 5490 1 1 6 TYR CA C 3.404 1.156 -6.252 1.00 . A A . 5 TYR CA 1 1 8 5491 1 1 6 TYR CB C 2.730 0.374 -7.388 1.00 . A A . 5 TYR CB 1 1 8 5492 1 1 6 TYR CD1 C 4.563 -0.387 -8.959 1.00 . A A . 5 TYR CD1 1 1 8 5493 1 1 6 TYR CD2 C 3.020 1.261 -9.728 1.00 . A A . 5 TYR CD2 1 1 8 5494 1 1 6 TYR CE1 C 5.211 -0.350 -10.180 1.00 . A A . 5 TYR CE1 1 1 8 5495 1 1 6 TYR CE2 C 3.664 1.303 -10.947 1.00 . A A . 5 TYR CE2 1 1 8 5496 1 1 6 TYR CG C 3.457 0.419 -8.713 1.00 . A A . 5 TYR CG 1 1 8 5497 1 1 6 TYR CZ C 4.757 0.498 -11.168 1.00 . A A . 5 TYR CZ 1 1 8 5498 1 1 6 TYR H H 4.785 2.431 -7.207 1.00 . A A . 5 TYR H 1 1 8 5499 1 1 6 TYR HA H 2.654 1.397 -5.499 1.00 . A A . 5 TYR HA 1 1 8 5500 1 1 6 TYR HB2 H 2.648 -0.662 -7.096 1.00 . A A . 5 TYR HB2 1 1 8 5501 1 1 6 TYR HB3 H 1.738 0.773 -7.542 1.00 . A A . 5 TYR HB3 1 1 8 5502 1 1 6 TYR HD1 H 4.917 -1.047 -8.181 1.00 . A A . 5 TYR HD1 1 1 8 5503 1 1 6 TYR HD2 H 2.162 1.893 -9.552 1.00 . A A . 5 TYR HD2 1 1 8 5504 1 1 6 TYR HE1 H 6.071 -0.982 -10.354 1.00 . A A . 5 TYR HE1 1 1 8 5505 1 1 6 TYR HE2 H 3.310 1.967 -11.722 1.00 . A A . 5 TYR HE2 1 1 8 5506 1 1 6 TYR HH H 5.623 -0.374 -12.653 1.00 . A A . 5 TYR HH 1 1 8 5507 1 1 6 TYR N N 3.944 2.414 -6.705 1.00 . A A . 5 TYR N 1 1 8 5508 1 1 6 TYR O O 5.675 0.465 -5.938 1.00 . A A . 5 TYR O 1 1 8 5509 1 1 6 TYR OH O 5.393 0.532 -12.387 1.00 . A A . 5 TYR OH 1 1 8 5510 1 1 7 TYR C C 4.595 -2.605 -3.581 1.00 . A A . 6 TYR C 1 1 8 5511 1 1 7 TYR CA C 5.053 -1.173 -3.801 1.00 . A A . 6 TYR CA 1 1 8 5512 1 1 7 TYR CB C 5.186 -0.387 -2.484 1.00 . A A . 6 TYR CB 1 1 8 5513 1 1 7 TYR CD1 C 6.832 -1.453 -0.886 1.00 . A A . 6 TYR CD1 1 1 8 5514 1 1 7 TYR CD2 C 4.506 -1.642 -0.411 1.00 . A A . 6 TYR CD2 1 1 8 5515 1 1 7 TYR CE1 C 7.126 -2.157 0.269 1.00 . A A . 6 TYR CE1 1 1 8 5516 1 1 7 TYR CE2 C 4.788 -2.339 0.746 1.00 . A A . 6 TYR CE2 1 1 8 5517 1 1 7 TYR CG C 5.518 -1.189 -1.245 1.00 . A A . 6 TYR CG 1 1 8 5518 1 1 7 TYR CZ C 6.099 -2.595 1.082 1.00 . A A . 6 TYR CZ 1 1 8 5519 1 1 7 TYR H H 3.143 -0.603 -4.484 1.00 . A A . 6 TYR H 1 1 8 5520 1 1 7 TYR HA H 6.006 -1.181 -4.305 1.00 . A A . 6 TYR HA 1 1 8 5521 1 1 7 TYR HB2 H 5.964 0.349 -2.603 1.00 . A A . 6 TYR HB2 1 1 8 5522 1 1 7 TYR HB3 H 4.251 0.127 -2.298 1.00 . A A . 6 TYR HB3 1 1 8 5523 1 1 7 TYR HD1 H 7.632 -1.108 -1.523 1.00 . A A . 6 TYR HD1 1 1 8 5524 1 1 7 TYR HD2 H 3.480 -1.443 -0.679 1.00 . A A . 6 TYR HD2 1 1 8 5525 1 1 7 TYR HE1 H 8.153 -2.358 0.532 1.00 . A A . 6 TYR HE1 1 1 8 5526 1 1 7 TYR HE2 H 3.981 -2.682 1.380 1.00 . A A . 6 TYR HE2 1 1 8 5527 1 1 7 TYR HH H 7.127 -2.866 2.685 1.00 . A A . 6 TYR HH 1 1 8 5528 1 1 7 TYR N N 4.107 -0.470 -4.638 1.00 . A A . 6 TYR N 1 1 8 5529 1 1 7 TYR O O 3.404 -2.868 -3.449 1.00 . A A . 6 TYR O 1 1 8 5530 1 1 7 TYR OH O 6.385 -3.285 2.237 1.00 . A A . 6 TYR OH 1 1 8 5531 1 1 8 THR C C 5.241 -5.088 -1.771 1.00 . A A . 7 THR C 1 1 8 5532 1 1 8 THR CA C 5.226 -4.910 -3.270 1.00 . A A . 7 THR CA 1 1 8 5533 1 1 8 THR CB C 6.203 -5.909 -3.915 1.00 . A A . 7 THR CB 1 1 8 5534 1 1 8 THR CG2 C 5.658 -6.412 -5.237 1.00 . A A . 7 THR CG2 1 1 8 5535 1 1 8 THR H H 6.454 -3.287 -3.843 1.00 . A A . 7 THR H 1 1 8 5536 1 1 8 THR HA H 4.231 -5.125 -3.635 1.00 . A A . 7 THR HA 1 1 8 5537 1 1 8 THR HB H 6.308 -6.754 -3.248 1.00 . A A . 7 THR HB 1 1 8 5538 1 1 8 THR HG1 H 7.404 -4.513 -4.638 1.00 . A A . 7 THR HG1 1 1 8 5539 1 1 8 THR HG21 H 5.454 -5.572 -5.884 1.00 . A A . 7 THR HG21 1 1 8 5540 1 1 8 THR HG22 H 4.744 -6.962 -5.056 1.00 . A A . 7 THR HG22 1 1 8 5541 1 1 8 THR HG23 H 6.385 -7.061 -5.700 1.00 . A A . 7 THR HG23 1 1 8 5542 1 1 8 THR N N 5.533 -3.534 -3.605 1.00 . A A . 7 THR N 1 1 8 5543 1 1 8 THR O O 6.239 -4.789 -1.119 1.00 . A A . 7 THR O 1 1 8 5544 1 1 8 THR OG1 O 7.493 -5.309 -4.096 1.00 . A A . 7 THR OG1 1 1 8 5545 1 1 9 VAL C C 5.098 -6.621 0.741 1.00 . A A . 8 VAL C 1 1 8 5546 1 1 9 VAL CA C 3.983 -5.734 0.198 1.00 . A A . 8 VAL CA 1 1 8 5547 1 1 9 VAL CB C 2.608 -6.337 0.553 1.00 . A A . 8 VAL CB 1 1 8 5548 1 1 9 VAL CG1 C 2.461 -6.483 2.060 1.00 . A A . 8 VAL CG1 1 1 8 5549 1 1 9 VAL CG2 C 1.478 -5.480 -0.016 1.00 . A A . 8 VAL CG2 1 1 8 5550 1 1 9 VAL H H 3.387 -5.823 -1.829 1.00 . A A . 8 VAL H 1 1 8 5551 1 1 9 VAL HA H 4.052 -4.755 0.660 1.00 . A A . 8 VAL HA 1 1 8 5552 1 1 9 VAL HB H 2.543 -7.320 0.110 1.00 . A A . 8 VAL HB 1 1 8 5553 1 1 9 VAL HG11 H 1.476 -6.863 2.288 1.00 . A A . 8 VAL HG11 1 1 8 5554 1 1 9 VAL HG12 H 2.593 -5.519 2.530 1.00 . A A . 8 VAL HG12 1 1 8 5555 1 1 9 VAL HG13 H 3.207 -7.171 2.428 1.00 . A A . 8 VAL HG13 1 1 8 5556 1 1 9 VAL HG21 H 1.550 -4.478 0.380 1.00 . A A . 8 VAL HG21 1 1 8 5557 1 1 9 VAL HG22 H 0.525 -5.907 0.262 1.00 . A A . 8 VAL HG22 1 1 8 5558 1 1 9 VAL HG23 H 1.552 -5.444 -1.095 1.00 . A A . 8 VAL HG23 1 1 8 5559 1 1 9 VAL N N 4.132 -5.570 -1.236 1.00 . A A . 8 VAL N 1 1 8 5560 1 1 9 VAL O O 5.228 -7.788 0.367 1.00 . A A . 8 VAL O 1 1 8 5561 1 1 10 LYS C C 6.751 -7.078 3.608 1.00 . A A . 9 LYS C 1 1 8 5562 1 1 10 LYS CA C 7.069 -6.695 2.176 1.00 . A A . 9 LYS CA 1 1 8 5563 1 1 10 LYS CB C 8.288 -5.774 2.142 1.00 . A A . 9 LYS CB 1 1 8 5564 1 1 10 LYS CD C 9.105 -6.584 -0.107 1.00 . A A . 9 LYS CD 1 1 8 5565 1 1 10 LYS CE C 8.770 -8.048 -0.356 1.00 . A A . 9 LYS CE 1 1 8 5566 1 1 10 LYS CG C 9.468 -6.321 1.350 1.00 . A A . 9 LYS CG 1 1 8 5567 1 1 10 LYS H H 5.741 -5.097 1.841 1.00 . A A . 9 LYS H 1 1 8 5568 1 1 10 LYS HA H 7.275 -7.586 1.604 1.00 . A A . 9 LYS HA 1 1 8 5569 1 1 10 LYS HB2 H 7.997 -4.831 1.703 1.00 . A A . 9 LYS HB2 1 1 8 5570 1 1 10 LYS HB3 H 8.616 -5.600 3.155 1.00 . A A . 9 LYS HB3 1 1 8 5571 1 1 10 LYS HD2 H 8.246 -5.984 -0.366 1.00 . A A . 9 LYS HD2 1 1 8 5572 1 1 10 LYS HD3 H 9.942 -6.305 -0.729 1.00 . A A . 9 LYS HD3 1 1 8 5573 1 1 10 LYS HE2 H 7.969 -8.340 0.306 1.00 . A A . 9 LYS HE2 1 1 8 5574 1 1 10 LYS HE3 H 8.450 -8.163 -1.381 1.00 . A A . 9 LYS HE3 1 1 8 5575 1 1 10 LYS HG2 H 10.274 -5.605 1.384 1.00 . A A . 9 LYS HG2 1 1 8 5576 1 1 10 LYS HG3 H 9.790 -7.248 1.803 1.00 . A A . 9 LYS HG3 1 1 8 5577 1 1 10 LYS HZ1 H 10.246 -8.861 0.883 1.00 . A A . 9 LYS HZ1 1 1 8 5578 1 1 10 LYS HZ2 H 10.740 -8.639 -0.722 1.00 . A A . 9 LYS HZ2 1 1 8 5579 1 1 10 LYS HZ3 H 9.701 -9.922 -0.326 1.00 . A A . 9 LYS HZ3 1 1 8 5580 1 1 10 LYS N N 5.918 -6.030 1.589 1.00 . A A . 9 LYS N 1 1 8 5581 1 1 10 LYS NZ N 9.944 -8.928 -0.114 1.00 . A A . 9 LYS NZ 1 1 8 5582 1 1 10 LYS O O 5.620 -6.892 4.053 1.00 . A A . 9 LYS O 1 1 8 5583 1 1 11 SER C C 6.973 -6.737 6.432 1.00 . A A . 10 SER C 1 1 8 5584 1 1 11 SER CA C 7.607 -7.936 5.724 1.00 . A A . 10 SER CA 1 1 8 5585 1 1 11 SER CB C 8.984 -8.267 6.304 1.00 . A A . 10 SER CB 1 1 8 5586 1 1 11 SER H H 8.556 -7.915 3.835 1.00 . A A . 10 SER H 1 1 8 5587 1 1 11 SER HA H 6.959 -8.793 5.840 1.00 . A A . 10 SER HA 1 1 8 5588 1 1 11 SER HB2 H 8.932 -8.262 7.382 1.00 . A A . 10 SER HB2 1 1 8 5589 1 1 11 SER HB3 H 9.286 -9.246 5.961 1.00 . A A . 10 SER HB3 1 1 8 5590 1 1 11 SER HG H 9.502 -6.556 5.501 1.00 . A A . 10 SER HG 1 1 8 5591 1 1 11 SER N N 7.732 -7.659 4.300 1.00 . A A . 10 SER N 1 1 8 5592 1 1 11 SER O O 7.557 -5.654 6.513 1.00 . A A . 10 SER O 1 1 8 5593 1 1 11 SER OG O 9.950 -7.322 5.887 1.00 . A A . 10 SER OG 1 1 8 5594 1 1 12 GLY C C 3.586 -5.972 6.552 1.00 . A A . 11 GLY C 1 1 8 5595 1 1 12 GLY CA C 4.895 -5.871 7.312 1.00 . A A . 11 GLY CA 1 1 8 5596 1 1 12 GLY H H 5.459 -7.884 7.022 1.00 . A A . 11 GLY H 1 1 8 5597 1 1 12 GLY HA2 H 4.704 -5.929 8.374 1.00 . A A . 11 GLY HA2 1 1 8 5598 1 1 12 GLY HA3 H 5.368 -4.929 7.081 1.00 . A A . 11 GLY HA3 1 1 8 5599 1 1 12 GLY N N 5.766 -6.955 6.921 1.00 . A A . 11 GLY N 1 1 8 5600 1 1 12 GLY O O 2.952 -4.971 6.248 1.00 . A A . 11 GLY O 1 1 8 5601 1 1 13 ASP C C 0.719 -6.932 5.731 1.00 . A A . 12 ASP C 1 1 8 5602 1 1 13 ASP CA C 2.058 -7.610 5.437 1.00 . A A . 12 ASP CA 1 1 8 5603 1 1 13 ASP CB C 1.839 -9.117 5.508 1.00 . A A . 12 ASP CB 1 1 8 5604 1 1 13 ASP CG C 1.344 -9.561 6.873 1.00 . A A . 12 ASP CG 1 1 8 5605 1 1 13 ASP H H 3.685 -7.942 6.745 1.00 . A A . 12 ASP H 1 1 8 5606 1 1 13 ASP HA H 2.342 -7.366 4.427 1.00 . A A . 12 ASP HA 1 1 8 5607 1 1 13 ASP HB2 H 1.098 -9.392 4.767 1.00 . A A . 12 ASP HB2 1 1 8 5608 1 1 13 ASP HB3 H 2.767 -9.623 5.292 1.00 . A A . 12 ASP HB3 1 1 8 5609 1 1 13 ASP N N 3.185 -7.219 6.312 1.00 . A A . 12 ASP N 1 1 8 5610 1 1 13 ASP O O -0.260 -7.203 5.050 1.00 . A A . 12 ASP O 1 1 8 5611 1 1 13 ASP OD1 O 2.065 -9.347 7.874 1.00 . A A . 12 ASP OD1 1 1 8 5612 1 1 13 ASP OD2 O 0.230 -10.120 6.959 1.00 . A A . 12 ASP OD2 1 1 8 5613 1 1 14 THR C C -0.739 -4.102 6.924 1.00 . A A . 13 THR C 1 1 8 5614 1 1 14 THR CA C -0.662 -5.605 7.162 1.00 . A A . 13 THR CA 1 1 8 5615 1 1 14 THR CB C -0.914 -5.939 8.642 1.00 . A A . 13 THR CB 1 1 8 5616 1 1 14 THR CG2 C -2.398 -5.903 8.970 1.00 . A A . 13 THR CG2 1 1 8 5617 1 1 14 THR H H 1.448 -5.771 7.168 1.00 . A A . 13 THR H 1 1 8 5618 1 1 14 THR HA H -1.420 -6.093 6.564 1.00 . A A . 13 THR HA 1 1 8 5619 1 1 14 THR HB H -0.398 -5.217 9.260 1.00 . A A . 13 THR HB 1 1 8 5620 1 1 14 THR HG1 H -0.199 -7.695 8.084 1.00 . A A . 13 THR HG1 1 1 8 5621 1 1 14 THR HG21 H -2.914 -6.649 8.385 1.00 . A A . 13 THR HG21 1 1 8 5622 1 1 14 THR HG22 H -2.793 -4.926 8.737 1.00 . A A . 13 THR HG22 1 1 8 5623 1 1 14 THR HG23 H -2.540 -6.109 10.020 1.00 . A A . 13 THR HG23 1 1 8 5624 1 1 14 THR N N 0.632 -6.107 6.745 1.00 . A A . 13 THR N 1 1 8 5625 1 1 14 THR O O 0.289 -3.422 6.914 1.00 . A A . 13 THR O 1 1 8 5626 1 1 14 THR OG1 O -0.408 -7.252 8.919 1.00 . A A . 13 THR OG1 1 1 8 5627 1 1 15 LEU C C -1.460 -1.227 7.205 1.00 . A A . 14 LEU C 1 1 8 5628 1 1 15 LEU CA C -2.184 -2.217 6.317 1.00 . A A . 14 LEU CA 1 1 8 5629 1 1 15 LEU CB C -3.676 -1.901 6.362 1.00 . A A . 14 LEU CB 1 1 8 5630 1 1 15 LEU CD1 C -5.998 -2.539 5.703 1.00 . A A . 14 LEU CD1 1 1 8 5631 1 1 15 LEU CD2 C -4.326 -1.900 3.961 1.00 . A A . 14 LEU CD2 1 1 8 5632 1 1 15 LEU CG C -4.531 -2.582 5.302 1.00 . A A . 14 LEU CG 1 1 8 5633 1 1 15 LEU H H -2.736 -4.170 6.910 1.00 . A A . 14 LEU H 1 1 8 5634 1 1 15 LEU HA H -1.829 -2.113 5.304 1.00 . A A . 14 LEU HA 1 1 8 5635 1 1 15 LEU HB2 H -4.051 -2.190 7.332 1.00 . A A . 14 LEU HB2 1 1 8 5636 1 1 15 LEU HB3 H -3.795 -0.835 6.254 1.00 . A A . 14 LEU HB3 1 1 8 5637 1 1 15 LEU HD11 H -6.123 -3.019 6.663 1.00 . A A . 14 LEU HD11 1 1 8 5638 1 1 15 LEU HD12 H -6.589 -3.057 4.962 1.00 . A A . 14 LEU HD12 1 1 8 5639 1 1 15 LEU HD13 H -6.324 -1.512 5.769 1.00 . A A . 14 LEU HD13 1 1 8 5640 1 1 15 LEU HD21 H -3.286 -1.976 3.672 1.00 . A A . 14 LEU HD21 1 1 8 5641 1 1 15 LEU HD22 H -4.601 -0.858 4.041 1.00 . A A . 14 LEU HD22 1 1 8 5642 1 1 15 LEU HD23 H -4.943 -2.379 3.215 1.00 . A A . 14 LEU HD23 1 1 8 5643 1 1 15 LEU HG H -4.232 -3.615 5.207 1.00 . A A . 14 LEU HG 1 1 8 5644 1 1 15 LEU N N -1.959 -3.596 6.747 1.00 . A A . 14 LEU N 1 1 8 5645 1 1 15 LEU O O -0.759 -0.346 6.721 1.00 . A A . 14 LEU O 1 1 8 5646 1 1 16 ASN C C 0.518 -0.539 9.374 1.00 . A A . 15 ASN C 1 1 8 5647 1 1 16 ASN CA C -1.004 -0.508 9.474 1.00 . A A . 15 ASN CA 1 1 8 5648 1 1 16 ASN CB C -1.460 -0.863 10.900 1.00 . A A . 15 ASN CB 1 1 8 5649 1 1 16 ASN CG C -1.086 -2.274 11.335 1.00 . A A . 15 ASN CG 1 1 8 5650 1 1 16 ASN H H -2.162 -2.154 8.825 1.00 . A A . 15 ASN H 1 1 8 5651 1 1 16 ASN HA H -1.337 0.493 9.246 1.00 . A A . 15 ASN HA 1 1 8 5652 1 1 16 ASN HB2 H -1.009 -0.170 11.595 1.00 . A A . 15 ASN HB2 1 1 8 5653 1 1 16 ASN HB3 H -2.535 -0.765 10.957 1.00 . A A . 15 ASN HB3 1 1 8 5654 1 1 16 ASN HD21 H -1.059 -1.697 13.239 1.00 . A A . 15 ASN HD21 1 1 8 5655 1 1 16 ASN HD22 H -0.696 -3.374 12.947 1.00 . A A . 15 ASN HD22 1 1 8 5656 1 1 16 ASN N N -1.613 -1.401 8.505 1.00 . A A . 15 ASN N 1 1 8 5657 1 1 16 ASN ND2 N -0.927 -2.467 12.635 1.00 . A A . 15 ASN ND2 1 1 8 5658 1 1 16 ASN O O 1.172 0.493 9.506 1.00 . A A . 15 ASN O 1 1 8 5659 1 1 16 ASN OD1 O -0.961 -3.186 10.515 1.00 . A A . 15 ASN OD1 1 1 8 5660 1 1 17 LYS C C 3.151 -1.229 7.873 1.00 . A A . 16 LYS C 1 1 8 5661 1 1 17 LYS CA C 2.526 -1.865 9.117 1.00 . A A . 16 LYS CA 1 1 8 5662 1 1 17 LYS CB C 2.914 -3.346 9.247 1.00 . A A . 16 LYS CB 1 1 8 5663 1 1 17 LYS CD C 2.969 -5.401 10.738 1.00 . A A . 16 LYS CD 1 1 8 5664 1 1 17 LYS CE C 2.365 -6.345 9.710 1.00 . A A . 16 LYS CE 1 1 8 5665 1 1 17 LYS CG C 2.466 -3.970 10.566 1.00 . A A . 16 LYS CG 1 1 8 5666 1 1 17 LYS H H 0.507 -2.480 8.851 1.00 . A A . 16 LYS H 1 1 8 5667 1 1 17 LYS HA H 2.896 -1.337 9.983 1.00 . A A . 16 LYS HA 1 1 8 5668 1 1 17 LYS HB2 H 2.459 -3.900 8.438 1.00 . A A . 16 LYS HB2 1 1 8 5669 1 1 17 LYS HB3 H 3.988 -3.435 9.177 1.00 . A A . 16 LYS HB3 1 1 8 5670 1 1 17 LYS HD2 H 4.042 -5.408 10.628 1.00 . A A . 16 LYS HD2 1 1 8 5671 1 1 17 LYS HD3 H 2.707 -5.746 11.728 1.00 . A A . 16 LYS HD3 1 1 8 5672 1 1 17 LYS HE2 H 1.290 -6.267 9.757 1.00 . A A . 16 LYS HE2 1 1 8 5673 1 1 17 LYS HE3 H 2.701 -6.045 8.729 1.00 . A A . 16 LYS HE3 1 1 8 5674 1 1 17 LYS HG2 H 2.846 -3.369 11.378 1.00 . A A . 16 LYS HG2 1 1 8 5675 1 1 17 LYS HG3 H 1.385 -3.972 10.599 1.00 . A A . 16 LYS HG3 1 1 8 5676 1 1 17 LYS HZ1 H 2.486 -8.356 9.118 1.00 . A A . 16 LYS HZ1 1 1 8 5677 1 1 17 LYS HZ2 H 2.263 -8.140 10.783 1.00 . A A . 16 LYS HZ2 1 1 8 5678 1 1 17 LYS HZ3 H 3.784 -7.842 10.091 1.00 . A A . 16 LYS HZ3 1 1 8 5679 1 1 17 LYS N N 1.078 -1.716 9.110 1.00 . A A . 16 LYS N 1 1 8 5680 1 1 17 LYS NZ N 2.753 -7.765 9.941 1.00 . A A . 16 LYS NZ 1 1 8 5681 1 1 17 LYS O O 4.088 -0.429 7.976 1.00 . A A . 16 LYS O 1 1 8 5682 1 1 18 ILE C C 2.869 0.482 5.307 1.00 . A A . 17 ILE C 1 1 8 5683 1 1 18 ILE CA C 3.152 -1.006 5.464 1.00 . A A . 17 ILE CA 1 1 8 5684 1 1 18 ILE CB C 2.666 -1.762 4.204 1.00 . A A . 17 ILE CB 1 1 8 5685 1 1 18 ILE CD1 C 0.642 -2.570 2.901 1.00 . A A . 17 ILE CD1 1 1 8 5686 1 1 18 ILE CG1 C 1.153 -2.001 4.209 1.00 . A A . 17 ILE CG1 1 1 8 5687 1 1 18 ILE CG2 C 3.410 -3.076 4.051 1.00 . A A . 17 ILE CG2 1 1 8 5688 1 1 18 ILE H H 1.798 -2.105 6.675 1.00 . A A . 17 ILE H 1 1 8 5689 1 1 18 ILE HA H 4.225 -1.134 5.525 1.00 . A A . 17 ILE HA 1 1 8 5690 1 1 18 ILE HB H 2.909 -1.157 3.354 1.00 . A A . 17 ILE HB 1 1 8 5691 1 1 18 ILE HD11 H -0.410 -2.805 2.996 1.00 . A A . 17 ILE HD11 1 1 8 5692 1 1 18 ILE HD12 H 1.199 -3.469 2.656 1.00 . A A . 17 ILE HD12 1 1 8 5693 1 1 18 ILE HD13 H 0.780 -1.840 2.117 1.00 . A A . 17 ILE HD13 1 1 8 5694 1 1 18 ILE HG12 H 0.905 -2.702 4.994 1.00 . A A . 17 ILE HG12 1 1 8 5695 1 1 18 ILE HG13 H 0.644 -1.067 4.389 1.00 . A A . 17 ILE HG13 1 1 8 5696 1 1 18 ILE HG21 H 4.470 -2.884 3.991 1.00 . A A . 17 ILE HG21 1 1 8 5697 1 1 18 ILE HG22 H 3.082 -3.572 3.150 1.00 . A A . 17 ILE HG22 1 1 8 5698 1 1 18 ILE HG23 H 3.205 -3.705 4.903 1.00 . A A . 17 ILE HG23 1 1 8 5699 1 1 18 ILE N N 2.593 -1.527 6.704 1.00 . A A . 17 ILE N 1 1 8 5700 1 1 18 ILE O O 3.768 1.251 4.967 1.00 . A A . 17 ILE O 1 1 8 5701 1 1 19 ALA C C 2.071 3.198 6.304 1.00 . A A . 18 ALA C 1 1 8 5702 1 1 19 ALA CA C 1.227 2.279 5.435 1.00 . A A . 18 ALA CA 1 1 8 5703 1 1 19 ALA CB C -0.233 2.437 5.808 1.00 . A A . 18 ALA CB 1 1 8 5704 1 1 19 ALA H H 0.972 0.220 5.877 1.00 . A A . 18 ALA H 1 1 8 5705 1 1 19 ALA HA H 1.345 2.562 4.399 1.00 . A A . 18 ALA HA 1 1 8 5706 1 1 19 ALA HB1 H -0.836 1.790 5.190 1.00 . A A . 18 ALA HB1 1 1 8 5707 1 1 19 ALA HB2 H -0.534 3.463 5.660 1.00 . A A . 18 ALA HB2 1 1 8 5708 1 1 19 ALA HB3 H -0.361 2.169 6.845 1.00 . A A . 18 ALA HB3 1 1 8 5709 1 1 19 ALA N N 1.633 0.883 5.577 1.00 . A A . 18 ALA N 1 1 8 5710 1 1 19 ALA O O 2.617 4.196 5.824 1.00 . A A . 18 ALA O 1 1 8 5711 1 1 20 ALA C C 4.433 3.640 8.192 1.00 . A A . 19 ALA C 1 1 8 5712 1 1 20 ALA CA C 2.947 3.661 8.516 1.00 . A A . 19 ALA CA 1 1 8 5713 1 1 20 ALA CB C 2.697 3.197 9.941 1.00 . A A . 19 ALA CB 1 1 8 5714 1 1 20 ALA H H 1.794 2.002 7.885 1.00 . A A . 19 ALA H 1 1 8 5715 1 1 20 ALA HA H 2.585 4.676 8.426 1.00 . A A . 19 ALA HA 1 1 8 5716 1 1 20 ALA HB1 H 3.084 2.197 10.066 1.00 . A A . 19 ALA HB1 1 1 8 5717 1 1 20 ALA HB2 H 1.634 3.201 10.138 1.00 . A A . 19 ALA HB2 1 1 8 5718 1 1 20 ALA HB3 H 3.193 3.866 10.630 1.00 . A A . 19 ALA HB3 1 1 8 5719 1 1 20 ALA N N 2.205 2.839 7.574 1.00 . A A . 19 ALA N 1 1 8 5720 1 1 20 ALA O O 5.173 4.554 8.562 1.00 . A A . 19 ALA O 1 1 8 5721 1 1 21 GLN C C 6.674 3.631 6.148 1.00 . A A . 20 GLN C 1 1 8 5722 1 1 21 GLN CA C 6.265 2.488 7.079 1.00 . A A . 20 GLN CA 1 1 8 5723 1 1 21 GLN CB C 6.533 1.143 6.401 1.00 . A A . 20 GLN CB 1 1 8 5724 1 1 21 GLN CD C 8.903 0.557 7.130 1.00 . A A . 20 GLN CD 1 1 8 5725 1 1 21 GLN CG C 7.421 0.215 7.218 1.00 . A A . 20 GLN CG 1 1 8 5726 1 1 21 GLN H H 4.232 1.864 7.267 1.00 . A A . 20 GLN H 1 1 8 5727 1 1 21 GLN HA H 6.871 2.548 7.971 1.00 . A A . 20 GLN HA 1 1 8 5728 1 1 21 GLN HB2 H 5.591 0.644 6.229 1.00 . A A . 20 GLN HB2 1 1 8 5729 1 1 21 GLN HB3 H 7.015 1.321 5.451 1.00 . A A . 20 GLN HB3 1 1 8 5730 1 1 21 GLN HE21 H 8.522 2.488 6.824 1.00 . A A . 20 GLN HE21 1 1 8 5731 1 1 21 GLN HE22 H 10.189 2.046 6.845 1.00 . A A . 20 GLN HE22 1 1 8 5732 1 1 21 GLN HG2 H 7.119 0.275 8.254 1.00 . A A . 20 GLN HG2 1 1 8 5733 1 1 21 GLN HG3 H 7.279 -0.796 6.865 1.00 . A A . 20 GLN HG3 1 1 8 5734 1 1 21 GLN N N 4.868 2.594 7.492 1.00 . A A . 20 GLN N 1 1 8 5735 1 1 21 GLN NE2 N 9.236 1.822 6.913 1.00 . A A . 20 GLN NE2 1 1 8 5736 1 1 21 GLN O O 7.718 4.249 6.351 1.00 . A A . 20 GLN O 1 1 8 5737 1 1 21 GLN OE1 O 9.752 -0.323 7.252 1.00 . A A . 20 GLN OE1 1 1 8 5738 1 1 22 TYR C C 5.328 6.235 4.390 1.00 . A A . 21 TYR C 1 1 8 5739 1 1 22 TYR CA C 6.198 4.993 4.199 1.00 . A A . 21 TYR CA 1 1 8 5740 1 1 22 TYR CB C 6.166 4.510 2.741 1.00 . A A . 21 TYR CB 1 1 8 5741 1 1 22 TYR CD1 C 3.833 3.539 2.586 1.00 . A A . 21 TYR CD1 1 1 8 5742 1 1 22 TYR CD2 C 5.677 2.148 2.013 1.00 . A A . 21 TYR CD2 1 1 8 5743 1 1 22 TYR CE1 C 2.963 2.502 2.302 1.00 . A A . 21 TYR CE1 1 1 8 5744 1 1 22 TYR CE2 C 4.814 1.110 1.725 1.00 . A A . 21 TYR CE2 1 1 8 5745 1 1 22 TYR CG C 5.202 3.380 2.448 1.00 . A A . 21 TYR CG 1 1 8 5746 1 1 22 TYR CZ C 3.457 1.293 1.871 1.00 . A A . 21 TYR CZ 1 1 8 5747 1 1 22 TYR H H 5.028 3.418 5.022 1.00 . A A . 21 TYR H 1 1 8 5748 1 1 22 TYR HA H 7.215 5.282 4.424 1.00 . A A . 21 TYR HA 1 1 8 5749 1 1 22 TYR HB2 H 5.891 5.340 2.108 1.00 . A A . 21 TYR HB2 1 1 8 5750 1 1 22 TYR HB3 H 7.156 4.178 2.466 1.00 . A A . 21 TYR HB3 1 1 8 5751 1 1 22 TYR HD1 H 3.445 4.489 2.924 1.00 . A A . 21 TYR HD1 1 1 8 5752 1 1 22 TYR HD2 H 6.742 2.006 1.900 1.00 . A A . 21 TYR HD2 1 1 8 5753 1 1 22 TYR HE1 H 1.899 2.645 2.417 1.00 . A A . 21 TYR HE1 1 1 8 5754 1 1 22 TYR HE2 H 5.204 0.162 1.388 1.00 . A A . 21 TYR HE2 1 1 8 5755 1 1 22 TYR HH H 2.926 -0.554 1.945 1.00 . A A . 21 TYR HH 1 1 8 5756 1 1 22 TYR N N 5.861 3.923 5.139 1.00 . A A . 21 TYR N 1 1 8 5757 1 1 22 TYR O O 5.308 7.124 3.540 1.00 . A A . 21 TYR O 1 1 8 5758 1 1 22 TYR OH O 2.588 0.267 1.580 1.00 . A A . 21 TYR OH 1 1 8 5759 1 1 23 GLY C C 2.663 7.818 5.176 1.00 . A A . 22 GLY C 1 1 8 5760 1 1 23 GLY CA C 3.959 7.524 5.914 1.00 . A A . 22 GLY CA 1 1 8 5761 1 1 23 GLY H H 4.528 5.488 6.061 1.00 . A A . 22 GLY H 1 1 8 5762 1 1 23 GLY HA2 H 3.744 7.466 6.969 1.00 . A A . 22 GLY HA2 1 1 8 5763 1 1 23 GLY HA3 H 4.642 8.344 5.749 1.00 . A A . 22 GLY HA3 1 1 8 5764 1 1 23 GLY N N 4.617 6.292 5.507 1.00 . A A . 22 GLY N 1 1 8 5765 1 1 23 GLY O O 2.307 8.981 4.983 1.00 . A A . 22 GLY O 1 1 8 5766 1 1 24 VAL C C -0.419 6.360 5.089 1.00 . A A . 23 VAL C 1 1 8 5767 1 1 24 VAL CA C 0.637 6.958 4.168 1.00 . A A . 23 VAL CA 1 1 8 5768 1 1 24 VAL CB C 0.560 6.300 2.767 1.00 . A A . 23 VAL CB 1 1 8 5769 1 1 24 VAL CG1 C 0.650 4.792 2.876 1.00 . A A . 23 VAL CG1 1 1 8 5770 1 1 24 VAL CG2 C -0.702 6.707 2.026 1.00 . A A . 23 VAL CG2 1 1 8 5771 1 1 24 VAL H H 2.286 5.873 4.929 1.00 . A A . 23 VAL H 1 1 8 5772 1 1 24 VAL HA H 0.456 8.019 4.064 1.00 . A A . 23 VAL HA 1 1 8 5773 1 1 24 VAL HB H 1.403 6.644 2.191 1.00 . A A . 23 VAL HB 1 1 8 5774 1 1 24 VAL HG11 H 0.587 4.355 1.890 1.00 . A A . 23 VAL HG11 1 1 8 5775 1 1 24 VAL HG12 H -0.164 4.427 3.484 1.00 . A A . 23 VAL HG12 1 1 8 5776 1 1 24 VAL HG13 H 1.591 4.519 3.332 1.00 . A A . 23 VAL HG13 1 1 8 5777 1 1 24 VAL HG21 H -0.719 6.233 1.056 1.00 . A A . 23 VAL HG21 1 1 8 5778 1 1 24 VAL HG22 H -0.719 7.778 1.903 1.00 . A A . 23 VAL HG22 1 1 8 5779 1 1 24 VAL HG23 H -1.567 6.396 2.594 1.00 . A A . 23 VAL HG23 1 1 8 5780 1 1 24 VAL N N 1.945 6.782 4.782 1.00 . A A . 23 VAL N 1 1 8 5781 1 1 24 VAL O O -0.096 5.561 5.967 1.00 . A A . 23 VAL O 1 1 8 5782 1 1 25 SER C C -3.404 5.049 5.041 1.00 . A A . 24 SER C 1 1 8 5783 1 1 25 SER CA C -2.732 6.231 5.739 1.00 . A A . 24 SER CA 1 1 8 5784 1 1 25 SER CB C -3.748 7.329 6.061 1.00 . A A . 24 SER CB 1 1 8 5785 1 1 25 SER H H -1.868 7.440 4.241 1.00 . A A . 24 SER H 1 1 8 5786 1 1 25 SER HA H -2.296 5.879 6.662 1.00 . A A . 24 SER HA 1 1 8 5787 1 1 25 SER HB2 H -4.245 7.637 5.153 1.00 . A A . 24 SER HB2 1 1 8 5788 1 1 25 SER HB3 H -4.477 6.949 6.761 1.00 . A A . 24 SER HB3 1 1 8 5789 1 1 25 SER HG H -2.153 8.289 6.684 1.00 . A A . 24 SER HG 1 1 8 5790 1 1 25 SER N N -1.663 6.766 4.925 1.00 . A A . 24 SER N 1 1 8 5791 1 1 25 SER O O -3.389 4.929 3.803 1.00 . A A . 24 SER O 1 1 8 5792 1 1 25 SER OG O -3.102 8.456 6.636 1.00 . A A . 24 SER OG 1 1 8 5793 1 1 26 VAL C C -5.803 3.421 4.388 1.00 . A A . 25 VAL C 1 1 8 5794 1 1 26 VAL CA C -4.679 3.004 5.337 1.00 . A A . 25 VAL CA 1 1 8 5795 1 1 26 VAL CB C -5.254 2.171 6.504 1.00 . A A . 25 VAL CB 1 1 8 5796 1 1 26 VAL CG1 C -6.013 0.961 5.996 1.00 . A A . 25 VAL CG1 1 1 8 5797 1 1 26 VAL CG2 C -4.146 1.741 7.455 1.00 . A A . 25 VAL CG2 1 1 8 5798 1 1 26 VAL H H -3.907 4.299 6.820 1.00 . A A . 25 VAL H 1 1 8 5799 1 1 26 VAL HA H -3.976 2.390 4.796 1.00 . A A . 25 VAL HA 1 1 8 5800 1 1 26 VAL HB H -5.943 2.793 7.055 1.00 . A A . 25 VAL HB 1 1 8 5801 1 1 26 VAL HG11 H -6.842 1.287 5.385 1.00 . A A . 25 VAL HG11 1 1 8 5802 1 1 26 VAL HG12 H -6.386 0.391 6.834 1.00 . A A . 25 VAL HG12 1 1 8 5803 1 1 26 VAL HG13 H -5.352 0.342 5.405 1.00 . A A . 25 VAL HG13 1 1 8 5804 1 1 26 VAL HG21 H -3.429 1.133 6.923 1.00 . A A . 25 VAL HG21 1 1 8 5805 1 1 26 VAL HG22 H -4.571 1.168 8.267 1.00 . A A . 25 VAL HG22 1 1 8 5806 1 1 26 VAL HG23 H -3.652 2.616 7.853 1.00 . A A . 25 VAL HG23 1 1 8 5807 1 1 26 VAL N N -3.972 4.167 5.844 1.00 . A A . 25 VAL N 1 1 8 5808 1 1 26 VAL O O -6.014 2.796 3.348 1.00 . A A . 25 VAL O 1 1 8 5809 1 1 27 ALA C C -7.306 5.318 2.525 1.00 . A A . 26 ALA C 1 1 8 5810 1 1 27 ALA CA C -7.647 4.958 3.973 1.00 . A A . 26 ALA CA 1 1 8 5811 1 1 27 ALA CB C -8.279 6.150 4.674 1.00 . A A . 26 ALA CB 1 1 8 5812 1 1 27 ALA H H -6.202 5.016 5.514 1.00 . A A . 26 ALA H 1 1 8 5813 1 1 27 ALA HA H -8.369 4.155 3.970 1.00 . A A . 26 ALA HA 1 1 8 5814 1 1 27 ALA HB1 H -8.478 5.895 5.704 1.00 . A A . 26 ALA HB1 1 1 8 5815 1 1 27 ALA HB2 H -9.205 6.409 4.182 1.00 . A A . 26 ALA HB2 1 1 8 5816 1 1 27 ALA HB3 H -7.602 6.993 4.636 1.00 . A A . 26 ALA HB3 1 1 8 5817 1 1 27 ALA N N -6.484 4.506 4.728 1.00 . A A . 26 ALA N 1 1 8 5818 1 1 27 ALA O O -7.969 4.856 1.594 1.00 . A A . 26 ALA O 1 1 8 5819 1 1 28 ASN C C -5.283 5.483 0.137 1.00 . A A . 27 ASN C 1 1 8 5820 1 1 28 ASN CA C -5.924 6.570 0.980 1.00 . A A . 27 ASN CA 1 1 8 5821 1 1 28 ASN CB C -5.094 7.876 0.966 1.00 . A A . 27 ASN CB 1 1 8 5822 1 1 28 ASN CG C -4.032 7.996 2.041 1.00 . A A . 27 ASN CG 1 1 8 5823 1 1 28 ASN H H -5.691 6.376 3.081 1.00 . A A . 27 ASN H 1 1 8 5824 1 1 28 ASN HA H -6.870 6.791 0.508 1.00 . A A . 27 ASN HA 1 1 8 5825 1 1 28 ASN HB2 H -4.591 7.954 0.015 1.00 . A A . 27 ASN HB2 1 1 8 5826 1 1 28 ASN HB3 H -5.768 8.715 1.067 1.00 . A A . 27 ASN HB3 1 1 8 5827 1 1 28 ASN HD21 H -3.049 9.317 0.929 1.00 . A A . 27 ASN HD21 1 1 8 5828 1 1 28 ASN HD22 H -2.341 8.948 2.471 1.00 . A A . 27 ASN HD22 1 1 8 5829 1 1 28 ASN N N -6.255 6.106 2.322 1.00 . A A . 27 ASN N 1 1 8 5830 1 1 28 ASN ND2 N -3.039 8.832 1.787 1.00 . A A . 27 ASN ND2 1 1 8 5831 1 1 28 ASN O O -5.549 5.414 -1.067 1.00 . A A . 27 ASN O 1 1 8 5832 1 1 28 ASN OD1 O -4.122 7.392 3.101 1.00 . A A . 27 ASN OD1 1 1 8 5833 1 1 29 LEU C C -5.005 2.503 -0.463 1.00 . A A . 28 LEU C 1 1 8 5834 1 1 29 LEU CA C -3.929 3.519 -0.083 1.00 . A A . 28 LEU CA 1 1 8 5835 1 1 29 LEU CB C -2.663 2.868 0.511 1.00 . A A . 28 LEU CB 1 1 8 5836 1 1 29 LEU CD1 C -3.500 0.902 1.854 1.00 . A A . 28 LEU CD1 1 1 8 5837 1 1 29 LEU CD2 C -1.329 2.002 2.402 1.00 . A A . 28 LEU CD2 1 1 8 5838 1 1 29 LEU CG C -2.742 2.223 1.896 1.00 . A A . 28 LEU CG 1 1 8 5839 1 1 29 LEU H H -4.273 4.663 1.689 1.00 . A A . 28 LEU H 1 1 8 5840 1 1 29 LEU HA H -3.632 3.997 -1.010 1.00 . A A . 28 LEU HA 1 1 8 5841 1 1 29 LEU HB2 H -2.338 2.105 -0.178 1.00 . A A . 28 LEU HB2 1 1 8 5842 1 1 29 LEU HB3 H -1.897 3.629 0.546 1.00 . A A . 28 LEU HB3 1 1 8 5843 1 1 29 LEU HD11 H -4.509 1.077 1.512 1.00 . A A . 28 LEU HD11 1 1 8 5844 1 1 29 LEU HD12 H -3.524 0.468 2.843 1.00 . A A . 28 LEU HD12 1 1 8 5845 1 1 29 LEU HD13 H -3.002 0.221 1.177 1.00 . A A . 28 LEU HD13 1 1 8 5846 1 1 29 LEU HD21 H -0.834 1.273 1.775 1.00 . A A . 28 LEU HD21 1 1 8 5847 1 1 29 LEU HD22 H -1.356 1.647 3.421 1.00 . A A . 28 LEU HD22 1 1 8 5848 1 1 29 LEU HD23 H -0.782 2.936 2.356 1.00 . A A . 28 LEU HD23 1 1 8 5849 1 1 29 LEU HG H -3.248 2.889 2.579 1.00 . A A . 28 LEU HG 1 1 8 5850 1 1 29 LEU N N -4.485 4.593 0.729 1.00 . A A . 28 LEU N 1 1 8 5851 1 1 29 LEU O O -4.955 1.918 -1.540 1.00 . A A . 28 LEU O 1 1 8 5852 1 1 30 ARG C C -7.930 2.095 -1.088 1.00 . A A . 29 ARG C 1 1 8 5853 1 1 30 ARG CA C -7.138 1.477 0.063 1.00 . A A . 29 ARG CA 1 1 8 5854 1 1 30 ARG CB C -8.055 1.294 1.272 1.00 . A A . 29 ARG CB 1 1 8 5855 1 1 30 ARG CD C -8.306 0.422 3.611 1.00 . A A . 29 ARG CD 1 1 8 5856 1 1 30 ARG CG C -7.502 0.349 2.325 1.00 . A A . 29 ARG CG 1 1 8 5857 1 1 30 ARG CZ C -10.658 0.249 4.332 1.00 . A A . 29 ARG CZ 1 1 8 5858 1 1 30 ARG H H -5.941 2.730 1.292 1.00 . A A . 29 ARG H 1 1 8 5859 1 1 30 ARG HA H -6.767 0.513 -0.247 1.00 . A A . 29 ARG HA 1 1 8 5860 1 1 30 ARG HB2 H -8.220 2.255 1.733 1.00 . A A . 29 ARG HB2 1 1 8 5861 1 1 30 ARG HB3 H -9.003 0.902 0.934 1.00 . A A . 29 ARG HB3 1 1 8 5862 1 1 30 ARG HD2 H -7.887 -0.278 4.321 1.00 . A A . 29 ARG HD2 1 1 8 5863 1 1 30 ARG HD3 H -8.229 1.423 4.008 1.00 . A A . 29 ARG HD3 1 1 8 5864 1 1 30 ARG HE H -9.975 -0.256 2.519 1.00 . A A . 29 ARG HE 1 1 8 5865 1 1 30 ARG HG2 H -7.540 -0.661 1.944 1.00 . A A . 29 ARG HG2 1 1 8 5866 1 1 30 ARG HG3 H -6.478 0.619 2.535 1.00 . A A . 29 ARG HG3 1 1 8 5867 1 1 30 ARG HH11 H -9.417 1.025 5.738 1.00 . A A . 29 ARG HH11 1 1 8 5868 1 1 30 ARG HH12 H -11.077 0.854 6.225 1.00 . A A . 29 ARG HH12 1 1 8 5869 1 1 30 ARG HH21 H -12.146 -0.456 3.151 1.00 . A A . 29 ARG HH21 1 1 8 5870 1 1 30 ARG HH22 H -12.632 0.029 4.750 1.00 . A A . 29 ARG HH22 1 1 8 5871 1 1 30 ARG N N -5.989 2.312 0.404 1.00 . A A . 29 ARG N 1 1 8 5872 1 1 30 ARG NE N -9.715 0.100 3.406 1.00 . A A . 29 ARG NE 1 1 8 5873 1 1 30 ARG NH1 N -10.359 0.750 5.525 1.00 . A A . 29 ARG NH1 1 1 8 5874 1 1 30 ARG NH2 N -11.909 -0.085 4.056 1.00 . A A . 29 ARG NH2 1 1 8 5875 1 1 30 ARG O O -8.455 1.383 -1.944 1.00 . A A . 29 ARG O 1 1 8 5876 1 1 31 SER C C -8.276 4.053 -3.514 1.00 . A A . 30 SER C 1 1 8 5877 1 1 31 SER CA C -8.814 4.137 -2.079 1.00 . A A . 30 SER CA 1 1 8 5878 1 1 31 SER CB C -8.971 5.597 -1.648 1.00 . A A . 30 SER CB 1 1 8 5879 1 1 31 SER H H -7.452 3.936 -0.471 1.00 . A A . 30 SER H 1 1 8 5880 1 1 31 SER HA H -9.789 3.674 -2.062 1.00 . A A . 30 SER HA 1 1 8 5881 1 1 31 SER HB2 H -7.997 6.064 -1.603 1.00 . A A . 30 SER HB2 1 1 8 5882 1 1 31 SER HB3 H -9.588 6.119 -2.365 1.00 . A A . 30 SER HB3 1 1 8 5883 1 1 31 SER HG H -8.943 5.411 0.311 1.00 . A A . 30 SER HG 1 1 8 5884 1 1 31 SER N N -7.982 3.424 -1.118 1.00 . A A . 30 SER N 1 1 8 5885 1 1 31 SER O O -9.042 3.788 -4.439 1.00 . A A . 30 SER O 1 1 8 5886 1 1 31 SER OG O -9.580 5.683 -0.367 1.00 . A A . 30 SER OG 1 1 8 5887 1 1 32 TRP C C -6.125 2.780 -5.541 1.00 . A A . 31 TRP C 1 1 8 5888 1 1 32 TRP CA C -6.436 4.205 -5.086 1.00 . A A . 31 TRP CA 1 1 8 5889 1 1 32 TRP CB C -5.206 5.109 -5.269 1.00 . A A . 31 TRP CB 1 1 8 5890 1 1 32 TRP CD1 C -3.729 3.903 -3.566 1.00 . A A . 31 TRP CD1 1 1 8 5891 1 1 32 TRP CD2 C -3.490 6.125 -3.577 1.00 . A A . 31 TRP CD2 1 1 8 5892 1 1 32 TRP CE2 C -2.632 5.587 -2.604 1.00 . A A . 31 TRP CE2 1 1 8 5893 1 1 32 TRP CE3 C -3.509 7.512 -3.762 1.00 . A A . 31 TRP CE3 1 1 8 5894 1 1 32 TRP CG C -4.191 5.027 -4.174 1.00 . A A . 31 TRP CG 1 1 8 5895 1 1 32 TRP CH2 C -1.836 7.727 -2.023 1.00 . A A . 31 TRP CH2 1 1 8 5896 1 1 32 TRP CZ2 C -1.800 6.379 -1.823 1.00 . A A . 31 TRP CZ2 1 1 8 5897 1 1 32 TRP CZ3 C -2.678 8.298 -2.982 1.00 . A A . 31 TRP CZ3 1 1 8 5898 1 1 32 TRP H H -6.373 4.422 -2.961 1.00 . A A . 31 TRP H 1 1 8 5899 1 1 32 TRP HA H -7.220 4.581 -5.729 1.00 . A A . 31 TRP HA 1 1 8 5900 1 1 32 TRP HB2 H -4.705 4.833 -6.191 1.00 . A A . 31 TRP HB2 1 1 8 5901 1 1 32 TRP HB3 H -5.535 6.135 -5.341 1.00 . A A . 31 TRP HB3 1 1 8 5902 1 1 32 TRP HD1 H -4.061 2.902 -3.803 1.00 . A A . 31 TRP HD1 1 1 8 5903 1 1 32 TRP HE1 H -2.319 3.594 -2.048 1.00 . A A . 31 TRP HE1 1 1 8 5904 1 1 32 TRP HE3 H -4.153 7.970 -4.498 1.00 . A A . 31 TRP HE3 1 1 8 5905 1 1 32 TRP HH2 H -1.206 8.380 -1.436 1.00 . A A . 31 TRP HH2 1 1 8 5906 1 1 32 TRP HZ2 H -1.143 5.954 -1.075 1.00 . A A . 31 TRP HZ2 1 1 8 5907 1 1 32 TRP HZ3 H -2.671 9.369 -3.110 1.00 . A A . 31 TRP HZ3 1 1 8 5908 1 1 32 TRP N N -6.972 4.245 -3.719 1.00 . A A . 31 TRP N 1 1 8 5909 1 1 32 TRP NE1 N -2.792 4.232 -2.623 1.00 . A A . 31 TRP NE1 1 1 8 5910 1 1 32 TRP O O -5.711 2.559 -6.678 1.00 . A A . 31 TRP O 1 1 8 5911 1 1 33 ASN C C -7.535 -0.207 -5.289 1.00 . A A . 32 ASN C 1 1 8 5912 1 1 33 ASN CA C -6.178 0.416 -5.031 1.00 . A A . 32 ASN CA 1 1 8 5913 1 1 33 ASN CB C -5.465 -0.388 -3.940 1.00 . A A . 32 ASN CB 1 1 8 5914 1 1 33 ASN CG C -3.958 -0.294 -4.021 1.00 . A A . 32 ASN CG 1 1 8 5915 1 1 33 ASN H H -6.573 2.044 -3.737 1.00 . A A . 32 ASN H 1 1 8 5916 1 1 33 ASN HA H -5.595 0.374 -5.938 1.00 . A A . 32 ASN HA 1 1 8 5917 1 1 33 ASN HB2 H -5.774 -0.021 -2.974 1.00 . A A . 32 ASN HB2 1 1 8 5918 1 1 33 ASN HB3 H -5.748 -1.428 -4.031 1.00 . A A . 32 ASN HB3 1 1 8 5919 1 1 33 ASN HD21 H -3.948 1.196 -2.704 1.00 . A A . 32 ASN HD21 1 1 8 5920 1 1 33 ASN HD22 H -2.398 0.708 -3.305 1.00 . A A . 32 ASN HD22 1 1 8 5921 1 1 33 ASN N N -6.323 1.814 -4.655 1.00 . A A . 32 ASN N 1 1 8 5922 1 1 33 ASN ND2 N -3.377 0.627 -3.271 1.00 . A A . 32 ASN ND2 1 1 8 5923 1 1 33 ASN O O -7.643 -1.199 -6.015 1.00 . A A . 32 ASN O 1 1 8 5924 1 1 33 ASN OD1 O -3.319 -1.064 -4.733 1.00 . A A . 32 ASN OD1 1 1 8 5925 1 1 34 GLY C C -9.821 -1.565 -3.995 1.00 . A A . 33 GLY C 1 1 8 5926 1 1 34 GLY CA C -9.882 -0.234 -4.713 1.00 . A A . 33 GLY CA 1 1 8 5927 1 1 34 GLY H H -8.455 1.274 -4.302 1.00 . A A . 33 GLY H 1 1 8 5928 1 1 34 GLY HA2 H -10.588 0.413 -4.212 1.00 . A A . 33 GLY HA2 1 1 8 5929 1 1 34 GLY HA3 H -10.206 -0.396 -5.731 1.00 . A A . 33 GLY HA3 1 1 8 5930 1 1 34 GLY N N -8.575 0.395 -4.718 1.00 . A A . 33 GLY N 1 1 8 5931 1 1 34 GLY O O -10.520 -2.514 -4.347 1.00 . A A . 33 GLY O 1 1 8 5932 1 1 35 ILE C C -9.028 -2.848 -0.856 1.00 . A A . 34 ILE C 1 1 8 5933 1 1 35 ILE CA C -8.643 -2.871 -2.321 1.00 . A A . 34 ILE CA 1 1 8 5934 1 1 35 ILE CB C -7.125 -3.172 -2.441 1.00 . A A . 34 ILE CB 1 1 8 5935 1 1 35 ILE CD1 C -7.538 -4.786 -4.347 1.00 . A A . 34 ILE CD1 1 1 8 5936 1 1 35 ILE CG1 C -6.780 -3.571 -3.874 1.00 . A A . 34 ILE CG1 1 1 8 5937 1 1 35 ILE CG2 C -6.691 -4.262 -1.467 1.00 . A A . 34 ILE CG2 1 1 8 5938 1 1 35 ILE H H -8.570 -0.789 -2.649 1.00 . A A . 34 ILE H 1 1 8 5939 1 1 35 ILE HA H -9.184 -3.663 -2.816 1.00 . A A . 34 ILE HA 1 1 8 5940 1 1 35 ILE HB H -6.586 -2.271 -2.191 1.00 . A A . 34 ILE HB 1 1 8 5941 1 1 35 ILE HD11 H -7.255 -5.014 -5.360 1.00 . A A . 34 ILE HD11 1 1 8 5942 1 1 35 ILE HD12 H -8.597 -4.580 -4.304 1.00 . A A . 34 ILE HD12 1 1 8 5943 1 1 35 ILE HD13 H -7.308 -5.624 -3.706 1.00 . A A . 34 ILE HD13 1 1 8 5944 1 1 35 ILE HG12 H -7.014 -2.752 -4.537 1.00 . A A . 34 ILE HG12 1 1 8 5945 1 1 35 ILE HG13 H -5.724 -3.791 -3.935 1.00 . A A . 34 ILE HG13 1 1 8 5946 1 1 35 ILE HG21 H -5.627 -4.427 -1.562 1.00 . A A . 34 ILE HG21 1 1 8 5947 1 1 35 ILE HG22 H -7.220 -5.176 -1.692 1.00 . A A . 34 ILE HG22 1 1 8 5948 1 1 35 ILE HG23 H -6.918 -3.953 -0.457 1.00 . A A . 34 ILE HG23 1 1 8 5949 1 1 35 ILE N N -8.974 -1.622 -2.978 1.00 . A A . 34 ILE N 1 1 8 5950 1 1 35 ILE O O -8.662 -1.930 -0.120 1.00 . A A . 34 ILE O 1 1 8 5951 1 1 36 SER C C -8.699 -4.701 1.514 1.00 . A A . 35 SER C 1 1 8 5952 1 1 36 SER CA C -9.989 -4.106 0.961 1.00 . A A . 35 SER CA 1 1 8 5953 1 1 36 SER CB C -11.165 -5.061 1.157 1.00 . A A . 35 SER CB 1 1 8 5954 1 1 36 SER H H -10.242 -4.411 -1.105 1.00 . A A . 35 SER H 1 1 8 5955 1 1 36 SER HA H -10.194 -3.169 1.457 1.00 . A A . 35 SER HA 1 1 8 5956 1 1 36 SER HB2 H -10.903 -6.035 0.770 1.00 . A A . 35 SER HB2 1 1 8 5957 1 1 36 SER HB3 H -11.392 -5.140 2.210 1.00 . A A . 35 SER HB3 1 1 8 5958 1 1 36 SER HG H -12.942 -4.227 1.112 1.00 . A A . 35 SER HG 1 1 8 5959 1 1 36 SER N N -9.792 -3.844 -0.446 1.00 . A A . 35 SER N 1 1 8 5960 1 1 36 SER O O -8.299 -5.802 1.134 1.00 . A A . 35 SER O 1 1 8 5961 1 1 36 SER OG O -12.316 -4.590 0.472 1.00 . A A . 35 SER OG 1 1 8 5962 1 1 37 GLY C C -6.640 -5.565 3.699 1.00 . A A . 36 GLY C 1 1 8 5963 1 1 37 GLY CA C -6.707 -4.308 2.846 1.00 . A A . 36 GLY CA 1 1 8 5964 1 1 37 GLY H H -8.474 -3.149 2.735 1.00 . A A . 36 GLY H 1 1 8 5965 1 1 37 GLY HA2 H -6.080 -4.452 1.981 1.00 . A A . 36 GLY HA2 1 1 8 5966 1 1 37 GLY HA3 H -6.313 -3.482 3.421 1.00 . A A . 36 GLY HA3 1 1 8 5967 1 1 37 GLY N N -8.045 -3.956 2.391 1.00 . A A . 36 GLY N 1 1 8 5968 1 1 37 GLY O O -5.585 -5.886 4.246 1.00 . A A . 36 GLY O 1 1 8 5969 1 1 38 ASP C C -6.970 -8.585 3.808 1.00 . A A . 37 ASP C 1 1 8 5970 1 1 38 ASP CA C -7.778 -7.528 4.549 1.00 . A A . 37 ASP CA 1 1 8 5971 1 1 38 ASP CB C -9.218 -8.014 4.727 1.00 . A A . 37 ASP CB 1 1 8 5972 1 1 38 ASP CG C -10.073 -7.053 5.530 1.00 . A A . 37 ASP CG 1 1 8 5973 1 1 38 ASP H H -8.574 -5.943 3.402 1.00 . A A . 37 ASP H 1 1 8 5974 1 1 38 ASP HA H -7.335 -7.363 5.521 1.00 . A A . 37 ASP HA 1 1 8 5975 1 1 38 ASP HB2 H -9.670 -8.137 3.754 1.00 . A A . 37 ASP HB2 1 1 8 5976 1 1 38 ASP HB3 H -9.209 -8.968 5.235 1.00 . A A . 37 ASP HB3 1 1 8 5977 1 1 38 ASP N N -7.750 -6.273 3.818 1.00 . A A . 37 ASP N 1 1 8 5978 1 1 38 ASP O O -6.317 -9.430 4.418 1.00 . A A . 37 ASP O 1 1 8 5979 1 1 38 ASP OD1 O -10.508 -6.023 4.969 1.00 . A A . 37 ASP OD1 1 1 8 5980 1 1 38 ASP OD2 O -10.335 -7.333 6.718 1.00 . A A . 37 ASP OD2 1 1 8 5981 1 1 39 LEU C C -4.933 -9.043 1.209 1.00 . A A . 38 LEU C 1 1 8 5982 1 1 39 LEU CA C -6.329 -9.501 1.646 1.00 . A A . 38 LEU CA 1 1 8 5983 1 1 39 LEU CB C -7.208 -9.853 0.432 1.00 . A A . 38 LEU CB 1 1 8 5984 1 1 39 LEU CD1 C -6.873 -7.879 -1.113 1.00 . A A . 38 LEU CD1 1 1 8 5985 1 1 39 LEU CD2 C -9.001 -9.182 -1.186 1.00 . A A . 38 LEU CD2 1 1 8 5986 1 1 39 LEU CG C -7.878 -8.676 -0.294 1.00 . A A . 38 LEU CG 1 1 8 5987 1 1 39 LEU H H -7.473 -7.766 2.054 1.00 . A A . 38 LEU H 1 1 8 5988 1 1 39 LEU HA H -6.214 -10.392 2.247 1.00 . A A . 38 LEU HA 1 1 8 5989 1 1 39 LEU HB2 H -6.592 -10.378 -0.284 1.00 . A A . 38 LEU HB2 1 1 8 5990 1 1 39 LEU HB3 H -7.984 -10.525 0.765 1.00 . A A . 38 LEU HB3 1 1 8 5991 1 1 39 LEU HD11 H -6.425 -8.521 -1.857 1.00 . A A . 38 LEU HD11 1 1 8 5992 1 1 39 LEU HD12 H -6.104 -7.494 -0.460 1.00 . A A . 38 LEU HD12 1 1 8 5993 1 1 39 LEU HD13 H -7.375 -7.057 -1.601 1.00 . A A . 38 LEU HD13 1 1 8 5994 1 1 39 LEU HD21 H -9.478 -8.346 -1.675 1.00 . A A . 38 LEU HD21 1 1 8 5995 1 1 39 LEU HD22 H -9.727 -9.710 -0.585 1.00 . A A . 38 LEU HD22 1 1 8 5996 1 1 39 LEU HD23 H -8.595 -9.852 -1.930 1.00 . A A . 38 LEU HD23 1 1 8 5997 1 1 39 LEU HG H -8.310 -8.012 0.439 1.00 . A A . 38 LEU HG 1 1 8 5998 1 1 39 LEU N N -6.996 -8.510 2.482 1.00 . A A . 38 LEU N 1 1 8 5999 1 1 39 LEU O O -4.491 -9.340 0.097 1.00 . A A . 38 LEU O 1 1 8 6000 1 1 40 ILE C C -1.842 -8.978 2.249 1.00 . A A . 39 ILE C 1 1 8 6001 1 1 40 ILE CA C -2.858 -7.932 1.800 1.00 . A A . 39 ILE CA 1 1 8 6002 1 1 40 ILE CB C -2.527 -6.562 2.456 1.00 . A A . 39 ILE CB 1 1 8 6003 1 1 40 ILE CD1 C -2.740 -4.051 2.039 1.00 . A A . 39 ILE CD1 1 1 8 6004 1 1 40 ILE CG1 C -3.297 -5.433 1.756 1.00 . A A . 39 ILE CG1 1 1 8 6005 1 1 40 ILE CG2 C -1.030 -6.282 2.415 1.00 . A A . 39 ILE CG2 1 1 8 6006 1 1 40 ILE H H -4.596 -8.191 2.988 1.00 . A A . 39 ILE H 1 1 8 6007 1 1 40 ILE HA H -2.784 -7.820 0.726 1.00 . A A . 39 ILE HA 1 1 8 6008 1 1 40 ILE HB H -2.829 -6.601 3.492 1.00 . A A . 39 ILE HB 1 1 8 6009 1 1 40 ILE HD11 H -3.412 -3.300 1.653 1.00 . A A . 39 ILE HD11 1 1 8 6010 1 1 40 ILE HD12 H -1.776 -3.947 1.559 1.00 . A A . 39 ILE HD12 1 1 8 6011 1 1 40 ILE HD13 H -2.624 -3.918 3.109 1.00 . A A . 39 ILE HD13 1 1 8 6012 1 1 40 ILE HG12 H -3.262 -5.589 0.689 1.00 . A A . 39 ILE HG12 1 1 8 6013 1 1 40 ILE HG13 H -4.327 -5.450 2.084 1.00 . A A . 39 ILE HG13 1 1 8 6014 1 1 40 ILE HG21 H -0.708 -6.225 1.383 1.00 . A A . 39 ILE HG21 1 1 8 6015 1 1 40 ILE HG22 H -0.496 -7.081 2.922 1.00 . A A . 39 ILE HG22 1 1 8 6016 1 1 40 ILE HG23 H -0.824 -5.341 2.911 1.00 . A A . 39 ILE HG23 1 1 8 6017 1 1 40 ILE N N -4.212 -8.382 2.106 1.00 . A A . 39 ILE N 1 1 8 6018 1 1 40 ILE O O -1.926 -9.509 3.359 1.00 . A A . 39 ILE O 1 1 8 6019 1 1 41 PHE C C 1.391 -10.002 0.895 1.00 . A A . 40 PHE C 1 1 8 6020 1 1 41 PHE CA C 0.087 -10.326 1.617 1.00 . A A . 40 PHE CA 1 1 8 6021 1 1 41 PHE CB C -0.438 -11.700 1.171 1.00 . A A . 40 PHE CB 1 1 8 6022 1 1 41 PHE CD1 C -1.936 -11.307 -0.812 1.00 . A A . 40 PHE CD1 1 1 8 6023 1 1 41 PHE CD2 C 0.165 -12.374 -1.175 1.00 . A A . 40 PHE CD2 1 1 8 6024 1 1 41 PHE CE1 C -2.218 -11.394 -2.161 1.00 . A A . 40 PHE CE1 1 1 8 6025 1 1 41 PHE CE2 C -0.112 -12.464 -2.526 1.00 . A A . 40 PHE CE2 1 1 8 6026 1 1 41 PHE CG C -0.743 -11.795 -0.301 1.00 . A A . 40 PHE CG 1 1 8 6027 1 1 41 PHE CZ C -1.305 -11.973 -3.020 1.00 . A A . 40 PHE CZ 1 1 8 6028 1 1 41 PHE H H -0.875 -8.802 0.511 1.00 . A A . 40 PHE H 1 1 8 6029 1 1 41 PHE HA H 0.275 -10.349 2.680 1.00 . A A . 40 PHE HA 1 1 8 6030 1 1 41 PHE HB2 H 0.304 -12.451 1.402 1.00 . A A . 40 PHE HB2 1 1 8 6031 1 1 41 PHE HB3 H -1.345 -11.923 1.714 1.00 . A A . 40 PHE HB3 1 1 8 6032 1 1 41 PHE HD1 H -2.652 -10.853 -0.141 1.00 . A A . 40 PHE HD1 1 1 8 6033 1 1 41 PHE HD2 H 1.097 -12.758 -0.789 1.00 . A A . 40 PHE HD2 1 1 8 6034 1 1 41 PHE HE1 H -3.152 -11.009 -2.544 1.00 . A A . 40 PHE HE1 1 1 8 6035 1 1 41 PHE HE2 H 0.605 -12.916 -3.195 1.00 . A A . 40 PHE HE2 1 1 8 6036 1 1 41 PHE HZ H -1.523 -12.042 -4.076 1.00 . A A . 40 PHE HZ 1 1 8 6037 1 1 41 PHE N N -0.907 -9.293 1.362 1.00 . A A . 40 PHE N 1 1 8 6038 1 1 41 PHE O O 1.408 -9.205 -0.045 1.00 . A A . 40 PHE O 1 1 8 6039 1 1 42 VAL C C 3.814 -10.795 -0.734 1.00 . A A . 41 VAL C 1 1 8 6040 1 1 42 VAL CA C 3.791 -10.402 0.744 1.00 . A A . 41 VAL CA 1 1 8 6041 1 1 42 VAL CB C 4.883 -11.186 1.505 1.00 . A A . 41 VAL CB 1 1 8 6042 1 1 42 VAL CG1 C 6.238 -11.023 0.833 1.00 . A A . 41 VAL CG1 1 1 8 6043 1 1 42 VAL CG2 C 4.948 -10.733 2.957 1.00 . A A . 41 VAL CG2 1 1 8 6044 1 1 42 VAL H H 2.390 -11.268 2.075 1.00 . A A . 41 VAL H 1 1 8 6045 1 1 42 VAL HA H 4.014 -9.348 0.826 1.00 . A A . 41 VAL HA 1 1 8 6046 1 1 42 VAL HB H 4.623 -12.234 1.489 1.00 . A A . 41 VAL HB 1 1 8 6047 1 1 42 VAL HG11 H 6.981 -11.580 1.384 1.00 . A A . 41 VAL HG11 1 1 8 6048 1 1 42 VAL HG12 H 6.508 -9.977 0.818 1.00 . A A . 41 VAL HG12 1 1 8 6049 1 1 42 VAL HG13 H 6.185 -11.395 -0.180 1.00 . A A . 41 VAL HG13 1 1 8 6050 1 1 42 VAL HG21 H 5.209 -9.685 2.996 1.00 . A A . 41 VAL HG21 1 1 8 6051 1 1 42 VAL HG22 H 5.695 -11.311 3.482 1.00 . A A . 41 VAL HG22 1 1 8 6052 1 1 42 VAL HG23 H 3.985 -10.882 3.424 1.00 . A A . 41 VAL HG23 1 1 8 6053 1 1 42 VAL N N 2.475 -10.629 1.333 1.00 . A A . 41 VAL N 1 1 8 6054 1 1 42 VAL O O 3.382 -11.886 -1.103 1.00 . A A . 41 VAL O 1 1 8 6055 1 1 43 GLY C C 3.324 -9.388 -3.769 1.00 . A A . 42 GLY C 1 1 8 6056 1 1 43 GLY CA C 4.379 -10.154 -3.002 1.00 . A A . 42 GLY CA 1 1 8 6057 1 1 43 GLY H H 4.635 -9.033 -1.219 1.00 . A A . 42 GLY H 1 1 8 6058 1 1 43 GLY HA2 H 5.354 -9.867 -3.365 1.00 . A A . 42 GLY HA2 1 1 8 6059 1 1 43 GLY HA3 H 4.238 -11.210 -3.172 1.00 . A A . 42 GLY HA3 1 1 8 6060 1 1 43 GLY N N 4.311 -9.892 -1.574 1.00 . A A . 42 GLY N 1 1 8 6061 1 1 43 GLY O O 3.443 -9.172 -4.976 1.00 . A A . 42 GLY O 1 1 8 6062 1 1 44 GLN C C 1.694 -6.780 -3.954 1.00 . A A . 43 GLN C 1 1 8 6063 1 1 44 GLN CA C 1.209 -8.189 -3.628 1.00 . A A . 43 GLN CA 1 1 8 6064 1 1 44 GLN CB C 0.050 -8.135 -2.636 1.00 . A A . 43 GLN CB 1 1 8 6065 1 1 44 GLN CD C -1.866 -6.825 -1.715 1.00 . A A . 43 GLN CD 1 1 8 6066 1 1 44 GLN CG C -0.990 -7.066 -2.921 1.00 . A A . 43 GLN CG 1 1 8 6067 1 1 44 GLN H H 2.246 -9.215 -2.102 1.00 . A A . 43 GLN H 1 1 8 6068 1 1 44 GLN HA H 0.880 -8.672 -4.536 1.00 . A A . 43 GLN HA 1 1 8 6069 1 1 44 GLN HB2 H -0.449 -9.093 -2.639 1.00 . A A . 43 GLN HB2 1 1 8 6070 1 1 44 GLN HB3 H 0.451 -7.960 -1.648 1.00 . A A . 43 GLN HB3 1 1 8 6071 1 1 44 GLN HE21 H -3.396 -6.298 -2.855 1.00 . A A . 43 GLN HE21 1 1 8 6072 1 1 44 GLN HE22 H -3.671 -6.262 -1.149 1.00 . A A . 43 GLN HE22 1 1 8 6073 1 1 44 GLN HG2 H -0.486 -6.143 -3.177 1.00 . A A . 43 GLN HG2 1 1 8 6074 1 1 44 GLN HG3 H -1.608 -7.385 -3.747 1.00 . A A . 43 GLN HG3 1 1 8 6075 1 1 44 GLN N N 2.287 -8.979 -3.055 1.00 . A A . 43 GLN N 1 1 8 6076 1 1 44 GLN NE2 N -3.102 -6.422 -1.931 1.00 . A A . 43 GLN NE2 1 1 8 6077 1 1 44 GLN O O 2.341 -6.136 -3.136 1.00 . A A . 43 GLN O 1 1 8 6078 1 1 44 GLN OE1 O -1.427 -7.005 -0.586 1.00 . A A . 43 GLN OE1 1 1 8 6079 1 1 45 LYS C C 0.593 -4.022 -5.362 1.00 . A A . 44 LYS C 1 1 8 6080 1 1 45 LYS CA C 1.762 -4.978 -5.568 1.00 . A A . 44 LYS CA 1 1 8 6081 1 1 45 LYS CB C 2.167 -5.001 -7.042 1.00 . A A . 44 LYS CB 1 1 8 6082 1 1 45 LYS CD C 2.492 -3.630 -9.127 1.00 . A A . 44 LYS CD 1 1 8 6083 1 1 45 LYS CE C 1.060 -3.536 -9.653 1.00 . A A . 44 LYS CE 1 1 8 6084 1 1 45 LYS CG C 2.543 -3.641 -7.605 1.00 . A A . 44 LYS CG 1 1 8 6085 1 1 45 LYS H H 0.874 -6.883 -5.771 1.00 . A A . 44 LYS H 1 1 8 6086 1 1 45 LYS HA H 2.600 -4.655 -4.969 1.00 . A A . 44 LYS HA 1 1 8 6087 1 1 45 LYS HB2 H 3.014 -5.659 -7.159 1.00 . A A . 44 LYS HB2 1 1 8 6088 1 1 45 LYS HB3 H 1.340 -5.388 -7.621 1.00 . A A . 44 LYS HB3 1 1 8 6089 1 1 45 LYS HD2 H 3.051 -2.780 -9.487 1.00 . A A . 44 LYS HD2 1 1 8 6090 1 1 45 LYS HD3 H 2.942 -4.540 -9.498 1.00 . A A . 44 LYS HD3 1 1 8 6091 1 1 45 LYS HE2 H 0.599 -2.655 -9.234 1.00 . A A . 44 LYS HE2 1 1 8 6092 1 1 45 LYS HE3 H 1.098 -3.439 -10.728 1.00 . A A . 44 LYS HE3 1 1 8 6093 1 1 45 LYS HG2 H 1.852 -2.902 -7.227 1.00 . A A . 44 LYS HG2 1 1 8 6094 1 1 45 LYS HG3 H 3.545 -3.395 -7.285 1.00 . A A . 44 LYS HG3 1 1 8 6095 1 1 45 LYS HZ1 H 0.578 -5.568 -9.799 1.00 . A A . 44 LYS HZ1 1 1 8 6096 1 1 45 LYS HZ2 H -0.767 -4.557 -9.582 1.00 . A A . 44 LYS HZ2 1 1 8 6097 1 1 45 LYS HZ3 H 0.255 -4.893 -8.279 1.00 . A A . 44 LYS HZ3 1 1 8 6098 1 1 45 LYS N N 1.385 -6.315 -5.150 1.00 . A A . 44 LYS N 1 1 8 6099 1 1 45 LYS NZ N 0.225 -4.720 -9.304 1.00 . A A . 44 LYS NZ 1 1 8 6100 1 1 45 LYS O O -0.392 -4.072 -6.103 1.00 . A A . 44 LYS O 1 1 8 6101 1 1 46 LEU C C 0.085 -0.780 -4.286 1.00 . A A . 45 LEU C 1 1 8 6102 1 1 46 LEU CA C -0.384 -2.227 -4.064 1.00 . A A . 45 LEU CA 1 1 8 6103 1 1 46 LEU CB C -0.960 -2.492 -2.634 1.00 . A A . 45 LEU CB 1 1 8 6104 1 1 46 LEU CD1 C 1.268 -2.308 -1.442 1.00 . A A . 45 LEU CD1 1 1 8 6105 1 1 46 LEU CD2 C -0.416 -0.474 -1.200 1.00 . A A . 45 LEU CD2 1 1 8 6106 1 1 46 LEU CG C -0.204 -1.965 -1.396 1.00 . A A . 45 LEU CG 1 1 8 6107 1 1 46 LEU H H 1.515 -3.139 -3.819 1.00 . A A . 45 LEU H 1 1 8 6108 1 1 46 LEU HA H -1.169 -2.425 -4.783 1.00 . A A . 45 LEU HA 1 1 8 6109 1 1 46 LEU HB2 H -1.955 -2.081 -2.597 1.00 . A A . 45 LEU HB2 1 1 8 6110 1 1 46 LEU HB3 H -1.043 -3.569 -2.515 1.00 . A A . 45 LEU HB3 1 1 8 6111 1 1 46 LEU HD11 H 1.385 -3.379 -1.540 1.00 . A A . 45 LEU HD11 1 1 8 6112 1 1 46 LEU HD12 H 1.743 -1.977 -0.532 1.00 . A A . 45 LEU HD12 1 1 8 6113 1 1 46 LEU HD13 H 1.725 -1.818 -2.289 1.00 . A A . 45 LEU HD13 1 1 8 6114 1 1 46 LEU HD21 H -1.473 -0.274 -1.085 1.00 . A A . 45 LEU HD21 1 1 8 6115 1 1 46 LEU HD22 H -0.042 0.057 -2.063 1.00 . A A . 45 LEU HD22 1 1 8 6116 1 1 46 LEU HD23 H 0.110 -0.145 -0.318 1.00 . A A . 45 LEU HD23 1 1 8 6117 1 1 46 LEU HG H -0.611 -2.461 -0.524 1.00 . A A . 45 LEU HG 1 1 8 6118 1 1 46 LEU N N 0.694 -3.158 -4.364 1.00 . A A . 45 LEU N 1 1 8 6119 1 1 46 LEU O O 1.256 -0.459 -4.065 1.00 . A A . 45 LEU O 1 1 8 6120 1 1 47 ILE C C -0.243 2.229 -3.764 1.00 . A A . 46 ILE C 1 1 8 6121 1 1 47 ILE CA C -0.494 1.473 -5.061 1.00 . A A . 46 ILE CA 1 1 8 6122 1 1 47 ILE CB C -1.617 2.230 -5.836 1.00 . A A . 46 ILE CB 1 1 8 6123 1 1 47 ILE CD1 C -2.434 0.345 -7.367 1.00 . A A . 46 ILE CD1 1 1 8 6124 1 1 47 ILE CG1 C -1.803 1.715 -7.268 1.00 . A A . 46 ILE CG1 1 1 8 6125 1 1 47 ILE CG2 C -1.315 3.726 -5.885 1.00 . A A . 46 ILE CG2 1 1 8 6126 1 1 47 ILE H H -1.722 -0.259 -4.978 1.00 . A A . 46 ILE H 1 1 8 6127 1 1 47 ILE HA H 0.405 1.498 -5.659 1.00 . A A . 46 ILE HA 1 1 8 6128 1 1 47 ILE HB H -2.542 2.098 -5.293 1.00 . A A . 46 ILE HB 1 1 8 6129 1 1 47 ILE HD11 H -3.414 0.367 -6.916 1.00 . A A . 46 ILE HD11 1 1 8 6130 1 1 47 ILE HD12 H -1.815 -0.375 -6.854 1.00 . A A . 46 ILE HD12 1 1 8 6131 1 1 47 ILE HD13 H -2.523 0.067 -8.406 1.00 . A A . 46 ILE HD13 1 1 8 6132 1 1 47 ILE HG12 H -2.441 2.408 -7.801 1.00 . A A . 46 ILE HG12 1 1 8 6133 1 1 47 ILE HG13 H -0.838 1.675 -7.755 1.00 . A A . 46 ILE HG13 1 1 8 6134 1 1 47 ILE HG21 H -1.177 4.101 -4.878 1.00 . A A . 46 ILE HG21 1 1 8 6135 1 1 47 ILE HG22 H -2.136 4.245 -6.354 1.00 . A A . 46 ILE HG22 1 1 8 6136 1 1 47 ILE HG23 H -0.413 3.890 -6.455 1.00 . A A . 46 ILE HG23 1 1 8 6137 1 1 47 ILE N N -0.815 0.069 -4.789 1.00 . A A . 46 ILE N 1 1 8 6138 1 1 47 ILE O O -0.988 2.088 -2.795 1.00 . A A . 46 ILE O 1 1 8 6139 1 1 48 VAL C C 1.795 5.173 -3.188 1.00 . A A . 47 VAL C 1 1 8 6140 1 1 48 VAL CA C 1.073 3.929 -2.663 1.00 . A A . 47 VAL CA 1 1 8 6141 1 1 48 VAL CB C 1.910 3.247 -1.555 1.00 . A A . 47 VAL CB 1 1 8 6142 1 1 48 VAL CG1 C 3.249 2.750 -2.087 1.00 . A A . 47 VAL CG1 1 1 8 6143 1 1 48 VAL CG2 C 2.110 4.199 -0.389 1.00 . A A . 47 VAL CG2 1 1 8 6144 1 1 48 VAL H H 1.393 3.055 -4.544 1.00 . A A . 47 VAL H 1 1 8 6145 1 1 48 VAL HA H 0.124 4.228 -2.228 1.00 . A A . 47 VAL HA 1 1 8 6146 1 1 48 VAL HB H 1.355 2.393 -1.194 1.00 . A A . 47 VAL HB 1 1 8 6147 1 1 48 VAL HG11 H 3.806 2.289 -1.284 1.00 . A A . 47 VAL HG11 1 1 8 6148 1 1 48 VAL HG12 H 3.811 3.582 -2.482 1.00 . A A . 47 VAL HG12 1 1 8 6149 1 1 48 VAL HG13 H 3.079 2.026 -2.868 1.00 . A A . 47 VAL HG13 1 1 8 6150 1 1 48 VAL HG21 H 2.777 3.750 0.333 1.00 . A A . 47 VAL HG21 1 1 8 6151 1 1 48 VAL HG22 H 1.156 4.395 0.080 1.00 . A A . 47 VAL HG22 1 1 8 6152 1 1 48 VAL HG23 H 2.535 5.125 -0.746 1.00 . A A . 47 VAL HG23 1 1 8 6153 1 1 48 VAL N N 0.795 3.041 -3.763 1.00 . A A . 47 VAL N 1 1 8 6154 1 1 48 VAL O O 2.723 5.089 -3.977 1.00 . A A . 47 VAL O 1 1 8 6155 1 1 49 LYS C C 1.935 8.527 -1.963 1.00 . A A . 48 LYS C 1 1 8 6156 1 1 49 LYS CA C 2.021 7.559 -3.128 1.00 . A A . 48 LYS CA 1 1 8 6157 1 1 49 LYS CB C 1.486 8.207 -4.405 1.00 . A A . 48 LYS CB 1 1 8 6158 1 1 49 LYS CD C 1.562 10.178 -5.970 1.00 . A A . 48 LYS CD 1 1 8 6159 1 1 49 LYS CE C 2.418 11.308 -6.526 1.00 . A A . 48 LYS CE 1 1 8 6160 1 1 49 LYS CG C 2.251 9.456 -4.823 1.00 . A A . 48 LYS CG 1 1 8 6161 1 1 49 LYS H H 0.440 6.354 -2.396 1.00 . A A . 48 LYS H 1 1 8 6162 1 1 49 LYS HA H 3.056 7.302 -3.280 1.00 . A A . 48 LYS HA 1 1 8 6163 1 1 49 LYS HB2 H 1.560 7.485 -5.207 1.00 . A A . 48 LYS HB2 1 1 8 6164 1 1 49 LYS HB3 H 0.451 8.471 -4.258 1.00 . A A . 48 LYS HB3 1 1 8 6165 1 1 49 LYS HD2 H 1.365 9.469 -6.759 1.00 . A A . 48 LYS HD2 1 1 8 6166 1 1 49 LYS HD3 H 0.629 10.588 -5.613 1.00 . A A . 48 LYS HD3 1 1 8 6167 1 1 49 LYS HE2 H 3.305 10.881 -6.971 1.00 . A A . 48 LYS HE2 1 1 8 6168 1 1 49 LYS HE3 H 1.852 11.826 -7.288 1.00 . A A . 48 LYS HE3 1 1 8 6169 1 1 49 LYS HG2 H 2.316 10.126 -3.979 1.00 . A A . 48 LYS HG2 1 1 8 6170 1 1 49 LYS HG3 H 3.245 9.171 -5.134 1.00 . A A . 48 LYS HG3 1 1 8 6171 1 1 49 LYS HZ1 H 2.029 12.502 -4.847 1.00 . A A . 48 LYS HZ1 1 1 8 6172 1 1 49 LYS HZ2 H 3.143 13.176 -5.930 1.00 . A A . 48 LYS HZ2 1 1 8 6173 1 1 49 LYS HZ3 H 3.619 11.905 -4.915 1.00 . A A . 48 LYS HZ3 1 1 8 6174 1 1 49 LYS N N 1.306 6.325 -2.831 1.00 . A A . 48 LYS N 1 1 8 6175 1 1 49 LYS NZ N 2.829 12.287 -5.481 1.00 . A A . 48 LYS NZ 1 1 8 6176 1 1 49 LYS O O 0.848 8.906 -1.532 1.00 . A A . 48 LYS O 1 1 8 6177 1 1 50 LYS C C 3.043 11.276 -0.893 1.00 . A A . 49 LYS C 1 1 8 6178 1 1 50 LYS CA C 3.148 9.858 -0.348 1.00 . A A . 49 LYS CA 1 1 8 6179 1 1 50 LYS CB C 4.456 9.678 0.427 1.00 . A A . 49 LYS CB 1 1 8 6180 1 1 50 LYS CD C 3.807 11.267 2.282 1.00 . A A . 49 LYS CD 1 1 8 6181 1 1 50 LYS CE C 3.741 11.470 3.786 1.00 . A A . 49 LYS CE 1 1 8 6182 1 1 50 LYS CG C 4.323 9.883 1.932 1.00 . A A . 49 LYS CG 1 1 8 6183 1 1 50 LYS H H 3.926 8.564 -1.827 1.00 . A A . 49 LYS H 1 1 8 6184 1 1 50 LYS HA H 2.311 9.666 0.308 1.00 . A A . 49 LYS HA 1 1 8 6185 1 1 50 LYS HB2 H 4.826 8.677 0.254 1.00 . A A . 49 LYS HB2 1 1 8 6186 1 1 50 LYS HB3 H 5.179 10.386 0.052 1.00 . A A . 49 LYS HB3 1 1 8 6187 1 1 50 LYS HD2 H 4.467 12.008 1.857 1.00 . A A . 49 LYS HD2 1 1 8 6188 1 1 50 LYS HD3 H 2.815 11.384 1.868 1.00 . A A . 49 LYS HD3 1 1 8 6189 1 1 50 LYS HE2 H 3.122 10.695 4.214 1.00 . A A . 49 LYS HE2 1 1 8 6190 1 1 50 LYS HE3 H 4.740 11.397 4.192 1.00 . A A . 49 LYS HE3 1 1 8 6191 1 1 50 LYS HG2 H 3.635 9.150 2.323 1.00 . A A . 49 LYS HG2 1 1 8 6192 1 1 50 LYS HG3 H 5.293 9.744 2.389 1.00 . A A . 49 LYS HG3 1 1 8 6193 1 1 50 LYS HZ1 H 3.144 12.904 5.181 1.00 . A A . 49 LYS HZ1 1 1 8 6194 1 1 50 LYS HZ2 H 2.198 12.875 3.778 1.00 . A A . 49 LYS HZ2 1 1 8 6195 1 1 50 LYS HZ3 H 3.747 13.562 3.737 1.00 . A A . 49 LYS HZ3 1 1 8 6196 1 1 50 LYS N N 3.088 8.915 -1.449 1.00 . A A . 49 LYS N 1 1 8 6197 1 1 50 LYS NZ N 3.170 12.793 4.144 1.00 . A A . 49 LYS NZ 1 1 8 6198 1 1 50 LYS O O 3.962 11.766 -1.549 1.00 . A A . 49 LYS O 1 1 8 6199 1 1 51 GLY C C 0.805 13.281 -2.351 1.00 . A A . 50 GLY C 1 1 8 6200 1 1 51 GLY CA C 1.709 13.258 -1.140 1.00 . A A . 50 GLY CA 1 1 8 6201 1 1 51 GLY H H 1.200 11.467 -0.141 1.00 . A A . 50 GLY H 1 1 8 6202 1 1 51 GLY HA2 H 1.265 13.853 -0.355 1.00 . A A . 50 GLY HA2 1 1 8 6203 1 1 51 GLY HA3 H 2.665 13.684 -1.407 1.00 . A A . 50 GLY HA3 1 1 8 6204 1 1 51 GLY N N 1.914 11.916 -0.650 1.00 . A A . 50 GLY N 1 1 8 6205 1 1 51 GLY O O 1.275 13.268 -3.489 1.00 . A A . 50 GLY O 1 1 8 6206 1 1 52 SER C C -2.646 14.203 -2.744 1.00 . A A . 51 SER C 1 1 8 6207 1 1 52 SER CA C -1.474 13.333 -3.177 1.00 . A A . 51 SER CA 1 1 8 6208 1 1 52 SER CB C -1.951 11.926 -3.545 1.00 . A A . 51 SER CB 1 1 8 6209 1 1 52 SER H H -0.806 13.213 -1.178 1.00 . A A . 51 SER H 1 1 8 6210 1 1 52 SER HA H -1.001 13.786 -4.037 1.00 . A A . 51 SER HA 1 1 8 6211 1 1 52 SER HB2 H -2.504 11.506 -2.717 1.00 . A A . 51 SER HB2 1 1 8 6212 1 1 52 SER HB3 H -2.586 11.978 -4.416 1.00 . A A . 51 SER HB3 1 1 8 6213 1 1 52 SER HG H -0.065 11.432 -3.399 1.00 . A A . 51 SER HG 1 1 8 6214 1 1 52 SER N N -0.494 13.268 -2.109 1.00 . A A . 51 SER N 1 1 8 6215 1 1 52 SER O O -3.542 13.691 -2.043 1.00 . A A . 51 SER O 1 1 8 6216 1 1 52 SER OG O -0.847 11.082 -3.834 1.00 . A A . 51 SER OG 1 1 9 6217 1 1 2 GLY C C -0.243 9.533 -11.387 1.00 . A A . 1 GLY C 1 1 9 6218 1 1 2 GLY CA C -1.393 10.495 -11.224 1.00 . A A . 1 GLY CA 1 1 9 6219 1 1 2 GLY H H -2.841 9.139 -10.581 1.00 . A A . 1 GLY H 1 1 9 6220 1 1 2 GLY HA2 H -1.889 10.613 -12.175 1.00 . A A . 1 GLY HA2 1 1 9 6221 1 1 2 GLY HA3 H -1.011 11.453 -10.901 1.00 . A A . 1 GLY HA3 1 1 9 6222 1 1 2 GLY N N -2.369 10.000 -10.225 1.00 . A A . 1 GLY N 1 1 9 6223 1 1 2 GLY O O -0.454 8.324 -11.498 1.00 . A A . 1 GLY O 1 1 9 6224 1 1 3 THR C C 2.457 8.691 -10.014 1.00 . A A . 2 THR C 1 1 9 6225 1 1 3 THR CA C 2.157 9.212 -11.416 1.00 . A A . 2 THR CA 1 1 9 6226 1 1 3 THR CB C 3.383 9.955 -11.990 1.00 . A A . 2 THR CB 1 1 9 6227 1 1 3 THR CG2 C 3.297 10.045 -13.507 1.00 . A A . 2 THR CG2 1 1 9 6228 1 1 3 THR H H 1.083 11.036 -11.361 1.00 . A A . 2 THR H 1 1 9 6229 1 1 3 THR HA H 1.940 8.369 -12.059 1.00 . A A . 2 THR HA 1 1 9 6230 1 1 3 THR HB H 4.272 9.402 -11.729 1.00 . A A . 2 THR HB 1 1 9 6231 1 1 3 THR HG1 H 3.678 11.215 -10.487 1.00 . A A . 2 THR HG1 1 1 9 6232 1 1 3 THR HG21 H 4.171 10.555 -13.888 1.00 . A A . 2 THR HG21 1 1 9 6233 1 1 3 THR HG22 H 2.411 10.596 -13.786 1.00 . A A . 2 THR HG22 1 1 9 6234 1 1 3 THR HG23 H 3.248 9.050 -13.924 1.00 . A A . 2 THR HG23 1 1 9 6235 1 1 3 THR N N 0.976 10.056 -11.387 1.00 . A A . 2 THR N 1 1 9 6236 1 1 3 THR O O 3.380 9.150 -9.335 1.00 . A A . 2 THR O 1 1 9 6237 1 1 3 THR OG1 O 3.475 11.276 -11.434 1.00 . A A . 2 THR OG1 1 1 9 6238 1 1 4 ASN C C 2.749 6.077 -8.205 1.00 . A A . 3 ASN C 1 1 9 6239 1 1 4 ASN CA C 1.721 7.197 -8.239 1.00 . A A . 3 ASN CA 1 1 9 6240 1 1 4 ASN CB C 0.354 6.667 -7.784 1.00 . A A . 3 ASN CB 1 1 9 6241 1 1 4 ASN CG C -0.699 7.758 -7.628 1.00 . A A . 3 ASN CG 1 1 9 6242 1 1 4 ASN H H 0.932 7.421 -10.185 1.00 . A A . 3 ASN H 1 1 9 6243 1 1 4 ASN HA H 2.037 7.984 -7.572 1.00 . A A . 3 ASN HA 1 1 9 6244 1 1 4 ASN HB2 H -0.005 5.956 -8.511 1.00 . A A . 3 ASN HB2 1 1 9 6245 1 1 4 ASN HB3 H 0.471 6.168 -6.831 1.00 . A A . 3 ASN HB3 1 1 9 6246 1 1 4 ASN HD21 H -1.627 6.703 -6.223 1.00 . A A . 3 ASN HD21 1 1 9 6247 1 1 4 ASN HD22 H -2.337 8.232 -6.608 1.00 . A A . 3 ASN HD22 1 1 9 6248 1 1 4 ASN N N 1.631 7.751 -9.579 1.00 . A A . 3 ASN N 1 1 9 6249 1 1 4 ASN ND2 N -1.648 7.541 -6.730 1.00 . A A . 3 ASN ND2 1 1 9 6250 1 1 4 ASN O O 3.129 5.543 -9.247 1.00 . A A . 3 ASN O 1 1 9 6251 1 1 4 ASN OD1 O -0.672 8.780 -8.315 1.00 . A A . 3 ASN OD1 1 1 9 6252 1 1 5 THR C C 3.426 3.395 -6.469 1.00 . A A . 4 THR C 1 1 9 6253 1 1 5 THR CA C 4.164 4.663 -6.861 1.00 . A A . 4 THR CA 1 1 9 6254 1 1 5 THR CB C 5.199 5.043 -5.779 1.00 . A A . 4 THR CB 1 1 9 6255 1 1 5 THR CG2 C 6.292 3.992 -5.639 1.00 . A A . 4 THR CG2 1 1 9 6256 1 1 5 THR H H 2.831 6.138 -6.207 1.00 . A A . 4 THR H 1 1 9 6257 1 1 5 THR HA H 4.671 4.515 -7.804 1.00 . A A . 4 THR HA 1 1 9 6258 1 1 5 THR HB H 4.685 5.132 -4.832 1.00 . A A . 4 THR HB 1 1 9 6259 1 1 5 THR HG1 H 5.148 6.848 -6.581 1.00 . A A . 4 THR HG1 1 1 9 6260 1 1 5 THR HG21 H 6.810 3.882 -6.581 1.00 . A A . 4 THR HG21 1 1 9 6261 1 1 5 THR HG22 H 5.848 3.047 -5.357 1.00 . A A . 4 THR HG22 1 1 9 6262 1 1 5 THR HG23 H 6.992 4.300 -4.877 1.00 . A A . 4 THR HG23 1 1 9 6263 1 1 5 THR N N 3.194 5.717 -7.015 1.00 . A A . 4 THR N 1 1 9 6264 1 1 5 THR O O 2.311 3.467 -5.966 1.00 . A A . 4 THR O 1 1 9 6265 1 1 5 THR OG1 O 5.791 6.308 -6.107 1.00 . A A . 4 THR OG1 1 1 9 6266 1 1 6 TYR C C 4.488 0.173 -5.581 1.00 . A A . 5 TYR C 1 1 9 6267 1 1 6 TYR CA C 3.421 1.009 -6.264 1.00 . A A . 5 TYR CA 1 1 9 6268 1 1 6 TYR CB C 2.732 0.234 -7.396 1.00 . A A . 5 TYR CB 1 1 9 6269 1 1 6 TYR CD1 C 4.453 -0.250 -9.190 1.00 . A A . 5 TYR CD1 1 1 9 6270 1 1 6 TYR CD2 C 2.764 1.370 -9.640 1.00 . A A . 5 TYR CD2 1 1 9 6271 1 1 6 TYR CE1 C 4.987 -0.046 -10.449 1.00 . A A . 5 TYR CE1 1 1 9 6272 1 1 6 TYR CE2 C 3.290 1.581 -10.896 1.00 . A A . 5 TYR CE2 1 1 9 6273 1 1 6 TYR CG C 3.334 0.455 -8.766 1.00 . A A . 5 TYR CG 1 1 9 6274 1 1 6 TYR CZ C 4.401 0.870 -11.300 1.00 . A A . 5 TYR CZ 1 1 9 6275 1 1 6 TYR H H 4.827 2.223 -7.266 1.00 . A A . 5 TYR H 1 1 9 6276 1 1 6 TYR HA H 2.670 1.284 -5.523 1.00 . A A . 5 TYR HA 1 1 9 6277 1 1 6 TYR HB2 H 2.786 -0.823 -7.181 1.00 . A A . 5 TYR HB2 1 1 9 6278 1 1 6 TYR HB3 H 1.695 0.531 -7.441 1.00 . A A . 5 TYR HB3 1 1 9 6279 1 1 6 TYR HD1 H 4.908 -0.966 -8.522 1.00 . A A . 5 TYR HD1 1 1 9 6280 1 1 6 TYR HD2 H 1.893 1.925 -9.322 1.00 . A A . 5 TYR HD2 1 1 9 6281 1 1 6 TYR HE1 H 5.859 -0.602 -10.761 1.00 . A A . 5 TYR HE1 1 1 9 6282 1 1 6 TYR HE2 H 2.827 2.297 -11.558 1.00 . A A . 5 TYR HE2 1 1 9 6283 1 1 6 TYR HH H 5.057 0.215 -12.993 1.00 . A A . 5 TYR HH 1 1 9 6284 1 1 6 TYR N N 3.997 2.246 -6.741 1.00 . A A . 5 TYR N 1 1 9 6285 1 1 6 TYR O O 5.631 0.107 -6.033 1.00 . A A . 5 TYR O 1 1 9 6286 1 1 6 TYR OH O 4.930 1.074 -12.556 1.00 . A A . 5 TYR OH 1 1 9 6287 1 1 7 TYR C C 4.611 -2.597 -3.462 1.00 . A A . 6 TYR C 1 1 9 6288 1 1 7 TYR CA C 5.044 -1.148 -3.631 1.00 . A A . 6 TYR CA 1 1 9 6289 1 1 7 TYR CB C 5.114 -0.410 -2.284 1.00 . A A . 6 TYR CB 1 1 9 6290 1 1 7 TYR CD1 C 6.902 -1.552 -0.900 1.00 . A A . 6 TYR CD1 1 1 9 6291 1 1 7 TYR CD2 C 4.640 -1.677 -0.159 1.00 . A A . 6 TYR CD2 1 1 9 6292 1 1 7 TYR CE1 C 7.301 -2.292 0.197 1.00 . A A . 6 TYR CE1 1 1 9 6293 1 1 7 TYR CE2 C 5.027 -2.412 0.939 1.00 . A A . 6 TYR CE2 1 1 9 6294 1 1 7 TYR CG C 5.565 -1.234 -1.096 1.00 . A A . 6 TYR CG 1 1 9 6295 1 1 7 TYR CZ C 6.359 -2.720 1.113 1.00 . A A . 6 TYR CZ 1 1 9 6296 1 1 7 TYR H H 3.158 -0.418 -4.225 1.00 . A A . 6 TYR H 1 1 9 6297 1 1 7 TYR HA H 6.015 -1.122 -4.102 1.00 . A A . 6 TYR HA 1 1 9 6298 1 1 7 TYR HB2 H 5.801 0.417 -2.379 1.00 . A A . 6 TYR HB2 1 1 9 6299 1 1 7 TYR HB3 H 4.131 -0.019 -2.056 1.00 . A A . 6 TYR HB3 1 1 9 6300 1 1 7 TYR HD1 H 7.635 -1.214 -1.619 1.00 . A A . 6 TYR HD1 1 1 9 6301 1 1 7 TYR HD2 H 3.597 -1.434 -0.300 1.00 . A A . 6 TYR HD2 1 1 9 6302 1 1 7 TYR HE1 H 8.345 -2.531 0.334 1.00 . A A . 6 TYR HE1 1 1 9 6303 1 1 7 TYR HE2 H 4.286 -2.746 1.657 1.00 . A A . 6 TYR HE2 1 1 9 6304 1 1 7 TYR HH H 7.584 -3.096 2.547 1.00 . A A . 6 TYR HH 1 1 9 6305 1 1 7 TYR N N 4.109 -0.439 -4.482 1.00 . A A . 6 TYR N 1 1 9 6306 1 1 7 TYR O O 3.426 -2.882 -3.321 1.00 . A A . 6 TYR O 1 1 9 6307 1 1 7 TYR OH O 6.754 -3.455 2.206 1.00 . A A . 6 TYR OH 1 1 9 6308 1 1 8 THR C C 5.341 -5.132 -1.733 1.00 . A A . 7 THR C 1 1 9 6309 1 1 8 THR CA C 5.270 -4.902 -3.225 1.00 . A A . 7 THR CA 1 1 9 6310 1 1 8 THR CB C 6.212 -5.890 -3.938 1.00 . A A . 7 THR CB 1 1 9 6311 1 1 8 THR CG2 C 5.604 -6.353 -5.248 1.00 . A A . 7 THR CG2 1 1 9 6312 1 1 8 THR H H 6.473 -3.250 -3.781 1.00 . A A . 7 THR H 1 1 9 6313 1 1 8 THR HA H 4.259 -5.103 -3.554 1.00 . A A . 7 THR HA 1 1 9 6314 1 1 8 THR HB H 6.331 -6.755 -3.302 1.00 . A A . 7 THR HB 1 1 9 6315 1 1 8 THR HG1 H 7.407 -4.423 -4.537 1.00 . A A . 7 THR HG1 1 1 9 6316 1 1 8 THR HG21 H 6.272 -7.047 -5.731 1.00 . A A . 7 THR HG21 1 1 9 6317 1 1 8 THR HG22 H 5.438 -5.501 -5.890 1.00 . A A . 7 THR HG22 1 1 9 6318 1 1 8 THR HG23 H 4.661 -6.843 -5.043 1.00 . A A . 7 THR HG23 1 1 9 6319 1 1 8 THR N N 5.560 -3.515 -3.529 1.00 . A A . 7 THR N 1 1 9 6320 1 1 8 THR O O 6.383 -4.923 -1.117 1.00 . A A . 7 THR O 1 1 9 6321 1 1 8 THR OG1 O 7.507 -5.310 -4.161 1.00 . A A . 7 THR OG1 1 1 9 6322 1 1 9 VAL C C 5.195 -6.729 0.753 1.00 . A A . 8 VAL C 1 1 9 6323 1 1 9 VAL CA C 4.121 -5.758 0.269 1.00 . A A . 8 VAL CA 1 1 9 6324 1 1 9 VAL CB C 2.731 -6.292 0.658 1.00 . A A . 8 VAL CB 1 1 9 6325 1 1 9 VAL CG1 C 2.633 -6.461 2.166 1.00 . A A . 8 VAL CG1 1 1 9 6326 1 1 9 VAL CG2 C 1.629 -5.368 0.139 1.00 . A A . 8 VAL CG2 1 1 9 6327 1 1 9 VAL H H 3.446 -5.745 -1.736 1.00 . A A . 8 VAL H 1 1 9 6328 1 1 9 VAL HA H 4.264 -4.801 0.754 1.00 . A A . 8 VAL HA 1 1 9 6329 1 1 9 VAL HB H 2.602 -7.263 0.202 1.00 . A A . 8 VAL HB 1 1 9 6330 1 1 9 VAL HG11 H 2.805 -5.510 2.647 1.00 . A A . 8 VAL HG11 1 1 9 6331 1 1 9 VAL HG12 H 3.375 -7.172 2.497 1.00 . A A . 8 VAL HG12 1 1 9 6332 1 1 9 VAL HG13 H 1.647 -6.823 2.424 1.00 . A A . 8 VAL HG13 1 1 9 6333 1 1 9 VAL HG21 H 0.667 -5.739 0.461 1.00 . A A . 8 VAL HG21 1 1 9 6334 1 1 9 VAL HG22 H 1.655 -5.334 -0.941 1.00 . A A . 8 VAL HG22 1 1 9 6335 1 1 9 VAL HG23 H 1.778 -4.372 0.531 1.00 . A A . 8 VAL HG23 1 1 9 6336 1 1 9 VAL N N 4.227 -5.559 -1.166 1.00 . A A . 8 VAL N 1 1 9 6337 1 1 9 VAL O O 5.308 -7.847 0.254 1.00 . A A . 8 VAL O 1 1 9 6338 1 1 10 LYS C C 6.850 -7.294 3.729 1.00 . A A . 9 LYS C 1 1 9 6339 1 1 10 LYS CA C 7.095 -7.050 2.252 1.00 . A A . 9 LYS CA 1 1 9 6340 1 1 10 LYS CB C 8.432 -6.344 2.022 1.00 . A A . 9 LYS CB 1 1 9 6341 1 1 10 LYS CD C 8.763 -7.502 -0.178 1.00 . A A . 9 LYS CD 1 1 9 6342 1 1 10 LYS CE C 8.674 -7.321 -1.683 1.00 . A A . 9 LYS CE 1 1 9 6343 1 1 10 LYS CG C 8.758 -6.166 0.550 1.00 . A A . 9 LYS CG 1 1 9 6344 1 1 10 LYS H H 5.851 -5.358 2.039 1.00 . A A . 9 LYS H 1 1 9 6345 1 1 10 LYS HA H 7.109 -8.004 1.745 1.00 . A A . 9 LYS HA 1 1 9 6346 1 1 10 LYS HB2 H 8.397 -5.368 2.484 1.00 . A A . 9 LYS HB2 1 1 9 6347 1 1 10 LYS HB3 H 9.220 -6.924 2.479 1.00 . A A . 9 LYS HB3 1 1 9 6348 1 1 10 LYS HD2 H 9.677 -8.026 0.058 1.00 . A A . 9 LYS HD2 1 1 9 6349 1 1 10 LYS HD3 H 7.917 -8.086 0.157 1.00 . A A . 9 LYS HD3 1 1 9 6350 1 1 10 LYS HE2 H 8.682 -8.296 -2.150 1.00 . A A . 9 LYS HE2 1 1 9 6351 1 1 10 LYS HE3 H 7.743 -6.822 -1.917 1.00 . A A . 9 LYS HE3 1 1 9 6352 1 1 10 LYS HG2 H 8.016 -5.525 0.100 1.00 . A A . 9 LYS HG2 1 1 9 6353 1 1 10 LYS HG3 H 9.734 -5.712 0.459 1.00 . A A . 9 LYS HG3 1 1 9 6354 1 1 10 LYS HZ1 H 9.765 -6.497 -3.258 1.00 . A A . 9 LYS HZ1 1 1 9 6355 1 1 10 LYS HZ2 H 10.715 -6.932 -1.925 1.00 . A A . 9 LYS HZ2 1 1 9 6356 1 1 10 LYS HZ3 H 9.752 -5.537 -1.866 1.00 . A A . 9 LYS HZ3 1 1 9 6357 1 1 10 LYS N N 5.998 -6.269 1.696 1.00 . A A . 9 LYS N 1 1 9 6358 1 1 10 LYS NZ N 9.804 -6.519 -2.222 1.00 . A A . 9 LYS NZ 1 1 9 6359 1 1 10 LYS O O 5.777 -6.951 4.222 1.00 . A A . 9 LYS O 1 1 9 6360 1 1 11 SER C C 7.061 -7.072 6.581 1.00 . A A . 10 SER C 1 1 9 6361 1 1 11 SER CA C 7.687 -8.246 5.832 1.00 . A A . 10 SER CA 1 1 9 6362 1 1 11 SER CB C 9.061 -8.583 6.412 1.00 . A A . 10 SER CB 1 1 9 6363 1 1 11 SER H H 8.633 -8.192 3.939 1.00 . A A . 10 SER H 1 1 9 6364 1 1 11 SER HA H 7.041 -9.107 5.927 1.00 . A A . 10 SER HA 1 1 9 6365 1 1 11 SER HB2 H 9.693 -7.707 6.370 1.00 . A A . 10 SER HB2 1 1 9 6366 1 1 11 SER HB3 H 8.951 -8.900 7.439 1.00 . A A . 10 SER HB3 1 1 9 6367 1 1 11 SER HG H 9.858 -10.380 6.267 1.00 . A A . 10 SER HG 1 1 9 6368 1 1 11 SER N N 7.813 -7.932 4.408 1.00 . A A . 10 SER N 1 1 9 6369 1 1 11 SER O O 7.644 -5.989 6.690 1.00 . A A . 10 SER O 1 1 9 6370 1 1 11 SER OG O 9.678 -9.629 5.672 1.00 . A A . 10 SER OG 1 1 9 6371 1 1 12 GLY C C 3.716 -6.290 6.669 1.00 . A A . 11 GLY C 1 1 9 6372 1 1 12 GLY CA C 4.986 -6.239 7.491 1.00 . A A . 11 GLY CA 1 1 9 6373 1 1 12 GLY H H 5.561 -8.243 7.171 1.00 . A A . 11 GLY H 1 1 9 6374 1 1 12 GLY HA2 H 4.745 -6.354 8.539 1.00 . A A . 11 GLY HA2 1 1 9 6375 1 1 12 GLY HA3 H 5.475 -5.290 7.333 1.00 . A A . 11 GLY HA3 1 1 9 6376 1 1 12 GLY N N 5.862 -7.311 7.080 1.00 . A A . 11 GLY N 1 1 9 6377 1 1 12 GLY O O 3.147 -5.266 6.312 1.00 . A A . 11 GLY O 1 1 9 6378 1 1 13 ASP C C 0.855 -7.160 5.792 1.00 . A A . 12 ASP C 1 1 9 6379 1 1 13 ASP CA C 2.175 -7.873 5.502 1.00 . A A . 12 ASP CA 1 1 9 6380 1 1 13 ASP CB C 1.916 -9.378 5.535 1.00 . A A . 12 ASP CB 1 1 9 6381 1 1 13 ASP CG C 1.486 -9.862 6.908 1.00 . A A . 12 ASP CG 1 1 9 6382 1 1 13 ASP H H 3.745 -8.260 6.859 1.00 . A A . 12 ASP H 1 1 9 6383 1 1 13 ASP HA H 2.485 -7.610 4.505 1.00 . A A . 12 ASP HA 1 1 9 6384 1 1 13 ASP HB2 H 1.131 -9.613 4.827 1.00 . A A . 12 ASP HB2 1 1 9 6385 1 1 13 ASP HB3 H 2.818 -9.901 5.251 1.00 . A A . 12 ASP HB3 1 1 9 6386 1 1 13 ASP N N 3.285 -7.524 6.410 1.00 . A A . 12 ASP N 1 1 9 6387 1 1 13 ASP O O -0.130 -7.398 5.108 1.00 . A A . 12 ASP O 1 1 9 6388 1 1 13 ASP OD1 O 0.280 -9.813 7.217 1.00 . A A . 12 ASP OD1 1 1 9 6389 1 1 13 ASP OD2 O 2.361 -10.291 7.689 1.00 . A A . 12 ASP OD2 1 1 9 6390 1 1 14 THR C C -0.543 -4.330 7.046 1.00 . A A . 13 THR C 1 1 9 6391 1 1 14 THR CA C -0.479 -5.835 7.265 1.00 . A A . 13 THR CA 1 1 9 6392 1 1 14 THR CB C -0.710 -6.184 8.750 1.00 . A A . 13 THR CB 1 1 9 6393 1 1 14 THR CG2 C -2.160 -5.951 9.156 1.00 . A A . 13 THR CG2 1 1 9 6394 1 1 14 THR H H 1.627 -6.016 7.223 1.00 . A A . 13 THR H 1 1 9 6395 1 1 14 THR HA H -1.253 -6.305 6.676 1.00 . A A . 13 THR HA 1 1 9 6396 1 1 14 THR HB H -0.072 -5.559 9.359 1.00 . A A . 13 THR HB 1 1 9 6397 1 1 14 THR HG1 H -0.144 -7.979 8.122 1.00 . A A . 13 THR HG1 1 1 9 6398 1 1 14 THR HG21 H -2.803 -6.599 8.580 1.00 . A A . 13 THR HG21 1 1 9 6399 1 1 14 THR HG22 H -2.425 -4.921 8.969 1.00 . A A . 13 THR HG22 1 1 9 6400 1 1 14 THR HG23 H -2.278 -6.168 10.206 1.00 . A A . 13 THR HG23 1 1 9 6401 1 1 14 THR N N 0.795 -6.346 6.816 1.00 . A A . 13 THR N 1 1 9 6402 1 1 14 THR O O 0.484 -3.651 7.047 1.00 . A A . 13 THR O 1 1 9 6403 1 1 14 THR OG1 O -0.372 -7.566 8.971 1.00 . A A . 13 THR OG1 1 1 9 6404 1 1 15 LEU C C -1.263 -1.463 7.387 1.00 . A A . 14 LEU C 1 1 9 6405 1 1 15 LEU CA C -1.979 -2.435 6.471 1.00 . A A . 14 LEU CA 1 1 9 6406 1 1 15 LEU CB C -3.466 -2.123 6.507 1.00 . A A . 14 LEU CB 1 1 9 6407 1 1 15 LEU CD1 C -5.771 -2.729 5.771 1.00 . A A . 14 LEU CD1 1 1 9 6408 1 1 15 LEU CD2 C -4.064 -2.061 4.085 1.00 . A A . 14 LEU CD2 1 1 9 6409 1 1 15 LEU CG C -4.299 -2.769 5.408 1.00 . A A . 14 LEU CG 1 1 9 6410 1 1 15 LEU H H -2.537 -4.403 6.998 1.00 . A A . 14 LEU H 1 1 9 6411 1 1 15 LEU HA H -1.617 -2.311 5.464 1.00 . A A . 14 LEU HA 1 1 9 6412 1 1 15 LEU HB2 H -3.854 -2.447 7.461 1.00 . A A . 14 LEU HB2 1 1 9 6413 1 1 15 LEU HB3 H -3.586 -1.053 6.436 1.00 . A A . 14 LEU HB3 1 1 9 6414 1 1 15 LEU HD11 H -6.081 -1.703 5.908 1.00 . A A . 14 LEU HD11 1 1 9 6415 1 1 15 LEU HD12 H -5.931 -3.278 6.688 1.00 . A A . 14 LEU HD12 1 1 9 6416 1 1 15 LEU HD13 H -6.350 -3.177 4.978 1.00 . A A . 14 LEU HD13 1 1 9 6417 1 1 15 LEU HD21 H -3.028 -2.173 3.795 1.00 . A A . 14 LEU HD21 1 1 9 6418 1 1 15 LEU HD22 H -4.297 -1.012 4.191 1.00 . A A . 14 LEU HD22 1 1 9 6419 1 1 15 LEU HD23 H -4.699 -2.496 3.327 1.00 . A A . 14 LEU HD23 1 1 9 6420 1 1 15 LEU HG H -4.005 -3.802 5.297 1.00 . A A . 14 LEU HG 1 1 9 6421 1 1 15 LEU N N -1.759 -3.821 6.867 1.00 . A A . 14 LEU N 1 1 9 6422 1 1 15 LEU O O -0.589 -0.551 6.922 1.00 . A A . 14 LEU O 1 1 9 6423 1 1 16 ASN C C 0.732 -0.791 9.522 1.00 . A A . 15 ASN C 1 1 9 6424 1 1 16 ASN CA C -0.787 -0.792 9.660 1.00 . A A . 15 ASN CA 1 1 9 6425 1 1 16 ASN CB C -1.188 -1.190 11.090 1.00 . A A . 15 ASN CB 1 1 9 6426 1 1 16 ASN CG C -0.715 -2.580 11.492 1.00 . A A . 15 ASN CG 1 1 9 6427 1 1 16 ASN H H -1.908 -2.452 8.993 1.00 . A A . 15 ASN H 1 1 9 6428 1 1 16 ASN HA H -1.152 0.205 9.462 1.00 . A A . 15 ASN HA 1 1 9 6429 1 1 16 ASN HB2 H -0.764 -0.478 11.782 1.00 . A A . 15 ASN HB2 1 1 9 6430 1 1 16 ASN HB3 H -2.265 -1.161 11.170 1.00 . A A . 15 ASN HB3 1 1 9 6431 1 1 16 ASN HD21 H -0.496 -1.981 13.377 1.00 . A A . 15 ASN HD21 1 1 9 6432 1 1 16 ASN HD22 H -0.102 -3.638 13.055 1.00 . A A . 15 ASN HD22 1 1 9 6433 1 1 16 ASN N N -1.395 -1.678 8.683 1.00 . A A . 15 ASN N 1 1 9 6434 1 1 16 ASN ND2 N -0.405 -2.753 12.766 1.00 . A A . 15 ASN ND2 1 1 9 6435 1 1 16 ASN O O 1.371 0.247 9.673 1.00 . A A . 15 ASN O 1 1 9 6436 1 1 16 ASN OD1 O -0.624 -3.489 10.663 1.00 . A A . 15 ASN OD1 1 1 9 6437 1 1 17 LYS C C 3.350 -1.397 7.959 1.00 . A A . 16 LYS C 1 1 9 6438 1 1 17 LYS CA C 2.755 -2.073 9.183 1.00 . A A . 16 LYS CA 1 1 9 6439 1 1 17 LYS CB C 3.163 -3.545 9.227 1.00 . A A . 16 LYS CB 1 1 9 6440 1 1 17 LYS CD C 3.751 -3.544 11.662 1.00 . A A . 16 LYS CD 1 1 9 6441 1 1 17 LYS CE C 3.574 -4.235 13.001 1.00 . A A . 16 LYS CE 1 1 9 6442 1 1 17 LYS CG C 2.918 -4.201 10.574 1.00 . A A . 16 LYS CG 1 1 9 6443 1 1 17 LYS H H 0.746 -2.722 8.970 1.00 . A A . 16 LYS H 1 1 9 6444 1 1 17 LYS HA H 3.140 -1.583 10.065 1.00 . A A . 16 LYS HA 1 1 9 6445 1 1 17 LYS HB2 H 2.602 -4.084 8.478 1.00 . A A . 16 LYS HB2 1 1 9 6446 1 1 17 LYS HB3 H 4.216 -3.621 8.999 1.00 . A A . 16 LYS HB3 1 1 9 6447 1 1 17 LYS HD2 H 4.793 -3.588 11.381 1.00 . A A . 16 LYS HD2 1 1 9 6448 1 1 17 LYS HD3 H 3.446 -2.511 11.756 1.00 . A A . 16 LYS HD3 1 1 9 6449 1 1 17 LYS HE2 H 2.528 -4.211 13.268 1.00 . A A . 16 LYS HE2 1 1 9 6450 1 1 17 LYS HE3 H 3.897 -5.261 12.910 1.00 . A A . 16 LYS HE3 1 1 9 6451 1 1 17 LYS HG2 H 1.872 -4.108 10.828 1.00 . A A . 16 LYS HG2 1 1 9 6452 1 1 17 LYS HG3 H 3.185 -5.246 10.511 1.00 . A A . 16 LYS HG3 1 1 9 6453 1 1 17 LYS HZ1 H 4.262 -4.089 14.972 1.00 . A A . 16 LYS HZ1 1 1 9 6454 1 1 17 LYS HZ2 H 4.030 -2.593 14.209 1.00 . A A . 16 LYS HZ2 1 1 9 6455 1 1 17 LYS HZ3 H 5.373 -3.546 13.810 1.00 . A A . 16 LYS HZ3 1 1 9 6456 1 1 17 LYS N N 1.307 -1.948 9.216 1.00 . A A . 16 LYS N 1 1 9 6457 1 1 17 LYS NZ N 4.363 -3.572 14.071 1.00 . A A . 16 LYS NZ 1 1 9 6458 1 1 17 LYS O O 4.271 -0.590 8.077 1.00 . A A . 16 LYS O 1 1 9 6459 1 1 18 ILE C C 3.015 0.327 5.384 1.00 . A A . 17 ILE C 1 1 9 6460 1 1 18 ILE CA C 3.337 -1.152 5.552 1.00 . A A . 17 ILE CA 1 1 9 6461 1 1 18 ILE CB C 2.879 -1.938 4.306 1.00 . A A . 17 ILE CB 1 1 9 6462 1 1 18 ILE CD1 C 0.873 -2.777 3.003 1.00 . A A . 17 ILE CD1 1 1 9 6463 1 1 18 ILE CG1 C 1.370 -2.192 4.307 1.00 . A A . 17 ILE CG1 1 1 9 6464 1 1 18 ILE CG2 C 3.635 -3.248 4.204 1.00 . A A . 17 ILE CG2 1 1 9 6465 1 1 18 ILE H H 2.008 -2.277 6.763 1.00 . A A . 17 ILE H 1 1 9 6466 1 1 18 ILE HA H 4.413 -1.248 5.618 1.00 . A A . 17 ILE HA 1 1 9 6467 1 1 18 ILE HB H 3.126 -1.354 3.444 1.00 . A A . 17 ILE HB 1 1 9 6468 1 1 18 ILE HD11 H 1.420 -3.685 2.786 1.00 . A A . 17 ILE HD11 1 1 9 6469 1 1 18 ILE HD12 H 1.031 -2.065 2.206 1.00 . A A . 17 ILE HD12 1 1 9 6470 1 1 18 ILE HD13 H -0.182 -3.001 3.085 1.00 . A A . 17 ILE HD13 1 1 9 6471 1 1 18 ILE HG12 H 1.127 -2.890 5.096 1.00 . A A . 17 ILE HG12 1 1 9 6472 1 1 18 ILE HG13 H 0.849 -1.262 4.477 1.00 . A A . 17 ILE HG13 1 1 9 6473 1 1 18 ILE HG21 H 4.693 -3.049 4.119 1.00 . A A . 17 ILE HG21 1 1 9 6474 1 1 18 ILE HG22 H 3.298 -3.789 3.333 1.00 . A A . 17 ILE HG22 1 1 9 6475 1 1 18 ILE HG23 H 3.450 -3.837 5.089 1.00 . A A . 17 ILE HG23 1 1 9 6476 1 1 18 ILE N N 2.791 -1.686 6.792 1.00 . A A . 17 ILE N 1 1 9 6477 1 1 18 ILE O O 3.884 1.122 5.024 1.00 . A A . 17 ILE O 1 1 9 6478 1 1 19 ALA C C 2.147 2.994 6.437 1.00 . A A . 18 ALA C 1 1 9 6479 1 1 19 ALA CA C 1.337 2.079 5.532 1.00 . A A . 18 ALA CA 1 1 9 6480 1 1 19 ALA CB C -0.135 2.205 5.864 1.00 . A A . 18 ALA CB 1 1 9 6481 1 1 19 ALA H H 1.126 0.013 5.946 1.00 . A A . 18 ALA H 1 1 9 6482 1 1 19 ALA HA H 1.480 2.386 4.506 1.00 . A A . 18 ALA HA 1 1 9 6483 1 1 19 ALA HB1 H -0.700 1.518 5.256 1.00 . A A . 18 ALA HB1 1 1 9 6484 1 1 19 ALA HB2 H -0.463 3.215 5.669 1.00 . A A . 18 ALA HB2 1 1 9 6485 1 1 19 ALA HB3 H -0.284 1.971 6.907 1.00 . A A . 18 ALA HB3 1 1 9 6486 1 1 19 ALA N N 1.771 0.694 5.659 1.00 . A A . 18 ALA N 1 1 9 6487 1 1 19 ALA O O 2.668 4.017 5.997 1.00 . A A . 18 ALA O 1 1 9 6488 1 1 20 ALA C C 4.511 3.352 8.372 1.00 . A A . 19 ALA C 1 1 9 6489 1 1 20 ALA CA C 3.018 3.403 8.661 1.00 . A A . 19 ALA CA 1 1 9 6490 1 1 20 ALA CB C 2.732 2.944 10.082 1.00 . A A . 19 ALA CB 1 1 9 6491 1 1 20 ALA H H 1.871 1.755 7.986 1.00 . A A . 19 ALA H 1 1 9 6492 1 1 20 ALA HA H 2.681 4.426 8.566 1.00 . A A . 19 ALA HA 1 1 9 6493 1 1 20 ALA HB1 H 3.260 3.580 10.778 1.00 . A A . 19 ALA HB1 1 1 9 6494 1 1 20 ALA HB2 H 3.065 1.922 10.206 1.00 . A A . 19 ALA HB2 1 1 9 6495 1 1 20 ALA HB3 H 1.671 3.003 10.275 1.00 . A A . 19 ALA HB3 1 1 9 6496 1 1 20 ALA N N 2.277 2.605 7.698 1.00 . A A . 19 ALA N 1 1 9 6497 1 1 20 ALA O O 5.258 4.240 8.784 1.00 . A A . 19 ALA O 1 1 9 6498 1 1 21 GLN C C 6.864 3.289 6.458 1.00 . A A . 20 GLN C 1 1 9 6499 1 1 21 GLN CA C 6.354 2.145 7.339 1.00 . A A . 20 GLN CA 1 1 9 6500 1 1 21 GLN CB C 6.602 0.796 6.659 1.00 . A A . 20 GLN CB 1 1 9 6501 1 1 21 GLN CD C 8.347 -0.854 5.842 1.00 . A A . 20 GLN CD 1 1 9 6502 1 1 21 GLN CG C 8.068 0.542 6.358 1.00 . A A . 20 GLN CG 1 1 9 6503 1 1 21 GLN H H 4.288 1.639 7.350 1.00 . A A . 20 GLN H 1 1 9 6504 1 1 21 GLN HA H 6.900 2.167 8.272 1.00 . A A . 20 GLN HA 1 1 9 6505 1 1 21 GLN HB2 H 6.244 0.008 7.304 1.00 . A A . 20 GLN HB2 1 1 9 6506 1 1 21 GLN HB3 H 6.054 0.767 5.729 1.00 . A A . 20 GLN HB3 1 1 9 6507 1 1 21 GLN HE21 H 10.172 -0.787 6.626 1.00 . A A . 20 GLN HE21 1 1 9 6508 1 1 21 GLN HE22 H 9.758 -2.251 5.797 1.00 . A A . 20 GLN HE22 1 1 9 6509 1 1 21 GLN HG2 H 8.394 1.252 5.614 1.00 . A A . 20 GLN HG2 1 1 9 6510 1 1 21 GLN HG3 H 8.634 0.692 7.266 1.00 . A A . 20 GLN HG3 1 1 9 6511 1 1 21 GLN N N 4.941 2.314 7.660 1.00 . A A . 20 GLN N 1 1 9 6512 1 1 21 GLN NE2 N 9.544 -1.348 6.115 1.00 . A A . 20 GLN NE2 1 1 9 6513 1 1 21 GLN O O 7.923 3.856 6.725 1.00 . A A . 20 GLN O 1 1 9 6514 1 1 21 GLN OE1 O 7.507 -1.477 5.193 1.00 . A A . 20 GLN OE1 1 1 9 6515 1 1 22 TYR C C 5.693 6.019 4.937 1.00 . A A . 21 TYR C 1 1 9 6516 1 1 22 TYR CA C 6.494 4.772 4.572 1.00 . A A . 21 TYR CA 1 1 9 6517 1 1 22 TYR CB C 6.372 4.458 3.070 1.00 . A A . 21 TYR CB 1 1 9 6518 1 1 22 TYR CD1 C 3.924 3.808 2.939 1.00 . A A . 21 TYR CD1 1 1 9 6519 1 1 22 TYR CD2 C 5.549 2.312 2.044 1.00 . A A . 21 TYR CD2 1 1 9 6520 1 1 22 TYR CE1 C 2.917 2.935 2.568 1.00 . A A . 21 TYR CE1 1 1 9 6521 1 1 22 TYR CE2 C 4.549 1.439 1.669 1.00 . A A . 21 TYR CE2 1 1 9 6522 1 1 22 TYR CG C 5.257 3.509 2.685 1.00 . A A . 21 TYR CG 1 1 9 6523 1 1 22 TYR CZ C 3.236 1.753 1.932 1.00 . A A . 21 TYR CZ 1 1 9 6524 1 1 22 TYR H H 5.305 3.120 5.201 1.00 . A A . 21 TYR H 1 1 9 6525 1 1 22 TYR HA H 7.532 4.980 4.786 1.00 . A A . 21 TYR HA 1 1 9 6526 1 1 22 TYR HB2 H 6.205 5.380 2.535 1.00 . A A . 21 TYR HB2 1 1 9 6527 1 1 22 TYR HB3 H 7.301 4.023 2.730 1.00 . A A . 21 TYR HB3 1 1 9 6528 1 1 22 TYR HD1 H 3.679 4.735 3.436 1.00 . A A . 21 TYR HD1 1 1 9 6529 1 1 22 TYR HD2 H 6.580 2.065 1.838 1.00 . A A . 21 TYR HD2 1 1 9 6530 1 1 22 TYR HE1 H 1.888 3.182 2.774 1.00 . A A . 21 TYR HE1 1 1 9 6531 1 1 22 TYR HE2 H 4.800 0.515 1.168 1.00 . A A . 21 TYR HE2 1 1 9 6532 1 1 22 TYR HH H 1.557 1.361 1.080 1.00 . A A . 21 TYR HH 1 1 9 6533 1 1 22 TYR N N 6.116 3.635 5.412 1.00 . A A . 21 TYR N 1 1 9 6534 1 1 22 TYR O O 5.782 7.051 4.269 1.00 . A A . 21 TYR O 1 1 9 6535 1 1 22 TYR OH O 2.237 0.884 1.557 1.00 . A A . 21 TYR OH 1 1 9 6536 1 1 23 GLY C C 3.061 7.567 5.766 1.00 . A A . 22 GLY C 1 1 9 6537 1 1 23 GLY CA C 4.249 7.072 6.569 1.00 . A A . 22 GLY CA 1 1 9 6538 1 1 23 GLY H H 4.773 5.030 6.406 1.00 . A A . 22 GLY H 1 1 9 6539 1 1 23 GLY HA2 H 3.910 6.822 7.562 1.00 . A A . 22 GLY HA2 1 1 9 6540 1 1 23 GLY HA3 H 4.971 7.874 6.644 1.00 . A A . 22 GLY HA3 1 1 9 6541 1 1 23 GLY N N 4.907 5.911 6.000 1.00 . A A . 22 GLY N 1 1 9 6542 1 1 23 GLY O O 2.956 8.762 5.491 1.00 . A A . 22 GLY O 1 1 9 6543 1 1 24 VAL C C -0.241 6.346 5.420 1.00 . A A . 23 VAL C 1 1 9 6544 1 1 24 VAL CA C 0.931 7.052 4.735 1.00 . A A . 23 VAL CA 1 1 9 6545 1 1 24 VAL CB C 0.949 6.741 3.217 1.00 . A A . 23 VAL CB 1 1 9 6546 1 1 24 VAL CG1 C 0.439 5.336 2.919 1.00 . A A . 23 VAL CG1 1 1 9 6547 1 1 24 VAL CG2 C 0.173 7.799 2.444 1.00 . A A . 23 VAL CG2 1 1 9 6548 1 1 24 VAL H H 2.348 5.708 5.556 1.00 . A A . 23 VAL H 1 1 9 6549 1 1 24 VAL HA H 0.814 8.119 4.865 1.00 . A A . 23 VAL HA 1 1 9 6550 1 1 24 VAL HB H 1.971 6.788 2.886 1.00 . A A . 23 VAL HB 1 1 9 6551 1 1 24 VAL HG11 H 0.401 5.186 1.849 1.00 . A A . 23 VAL HG11 1 1 9 6552 1 1 24 VAL HG12 H -0.551 5.212 3.337 1.00 . A A . 23 VAL HG12 1 1 9 6553 1 1 24 VAL HG13 H 1.106 4.611 3.359 1.00 . A A . 23 VAL HG13 1 1 9 6554 1 1 24 VAL HG21 H 0.137 7.527 1.398 1.00 . A A . 23 VAL HG21 1 1 9 6555 1 1 24 VAL HG22 H 0.666 8.753 2.549 1.00 . A A . 23 VAL HG22 1 1 9 6556 1 1 24 VAL HG23 H -0.832 7.869 2.833 1.00 . A A . 23 VAL HG23 1 1 9 6557 1 1 24 VAL N N 2.172 6.661 5.387 1.00 . A A . 23 VAL N 1 1 9 6558 1 1 24 VAL O O -0.031 5.441 6.231 1.00 . A A . 23 VAL O 1 1 9 6559 1 1 25 SER C C -3.196 5.004 5.001 1.00 . A A . 24 SER C 1 1 9 6560 1 1 25 SER CA C -2.626 6.197 5.770 1.00 . A A . 24 SER CA 1 1 9 6561 1 1 25 SER CB C -3.706 7.269 5.963 1.00 . A A . 24 SER CB 1 1 9 6562 1 1 25 SER H H -1.580 7.456 4.437 1.00 . A A . 24 SER H 1 1 9 6563 1 1 25 SER HA H -2.312 5.851 6.743 1.00 . A A . 24 SER HA 1 1 9 6564 1 1 25 SER HB2 H -3.314 8.061 6.583 1.00 . A A . 24 SER HB2 1 1 9 6565 1 1 25 SER HB3 H -3.986 7.672 5.000 1.00 . A A . 24 SER HB3 1 1 9 6566 1 1 25 SER HG H -5.004 7.180 7.437 1.00 . A A . 24 SER HG 1 1 9 6567 1 1 25 SER N N -1.460 6.760 5.115 1.00 . A A . 24 SER N 1 1 9 6568 1 1 25 SER O O -3.152 4.929 3.759 1.00 . A A . 24 SER O 1 1 9 6569 1 1 25 SER OG O -4.862 6.733 6.588 1.00 . A A . 24 SER OG 1 1 9 6570 1 1 26 VAL C C -5.596 3.349 4.366 1.00 . A A . 25 VAL C 1 1 9 6571 1 1 26 VAL CA C -4.414 2.914 5.229 1.00 . A A . 25 VAL CA 1 1 9 6572 1 1 26 VAL CB C -4.897 2.000 6.375 1.00 . A A . 25 VAL CB 1 1 9 6573 1 1 26 VAL CG1 C -5.612 0.777 5.840 1.00 . A A . 25 VAL CG1 1 1 9 6574 1 1 26 VAL CG2 C -3.724 1.584 7.254 1.00 . A A . 25 VAL CG2 1 1 9 6575 1 1 26 VAL H H -3.656 4.166 6.744 1.00 . A A . 25 VAL H 1 1 9 6576 1 1 26 VAL HA H -3.721 2.362 4.617 1.00 . A A . 25 VAL HA 1 1 9 6577 1 1 26 VAL HB H -5.591 2.557 6.984 1.00 . A A . 25 VAL HB 1 1 9 6578 1 1 26 VAL HG11 H -6.485 1.084 5.288 1.00 . A A . 25 VAL HG11 1 1 9 6579 1 1 26 VAL HG12 H -5.912 0.144 6.664 1.00 . A A . 25 VAL HG12 1 1 9 6580 1 1 26 VAL HG13 H -4.948 0.229 5.189 1.00 . A A . 25 VAL HG13 1 1 9 6581 1 1 26 VAL HG21 H -4.079 0.950 8.053 1.00 . A A . 25 VAL HG21 1 1 9 6582 1 1 26 VAL HG22 H -3.257 2.463 7.671 1.00 . A A . 25 VAL HG22 1 1 9 6583 1 1 26 VAL HG23 H -3.003 1.042 6.659 1.00 . A A . 25 VAL HG23 1 1 9 6584 1 1 26 VAL N N -3.731 4.072 5.768 1.00 . A A . 25 VAL N 1 1 9 6585 1 1 26 VAL O O -5.913 2.710 3.365 1.00 . A A . 25 VAL O 1 1 9 6586 1 1 27 ALA C C -7.010 5.358 2.582 1.00 . A A . 26 ALA C 1 1 9 6587 1 1 27 ALA CA C -7.365 4.981 4.018 1.00 . A A . 26 ALA CA 1 1 9 6588 1 1 27 ALA CB C -7.953 6.176 4.754 1.00 . A A . 26 ALA CB 1 1 9 6589 1 1 27 ALA H H -5.865 4.968 5.511 1.00 . A A . 26 ALA H 1 1 9 6590 1 1 27 ALA HA H -8.112 4.201 3.997 1.00 . A A . 26 ALA HA 1 1 9 6591 1 1 27 ALA HB1 H -7.228 6.975 4.780 1.00 . A A . 26 ALA HB1 1 1 9 6592 1 1 27 ALA HB2 H -8.207 5.887 5.763 1.00 . A A . 26 ALA HB2 1 1 9 6593 1 1 27 ALA HB3 H -8.842 6.512 4.242 1.00 . A A . 26 ALA HB3 1 1 9 6594 1 1 27 ALA N N -6.206 4.469 4.736 1.00 . A A . 26 ALA N 1 1 9 6595 1 1 27 ALA O O -7.701 4.966 1.639 1.00 . A A . 26 ALA O 1 1 9 6596 1 1 28 ASN C C -5.100 5.389 0.185 1.00 . A A . 27 ASN C 1 1 9 6597 1 1 28 ASN CA C -5.526 6.544 1.074 1.00 . A A . 27 ASN CA 1 1 9 6598 1 1 28 ASN CB C -4.434 7.624 1.110 1.00 . A A . 27 ASN CB 1 1 9 6599 1 1 28 ASN CG C -3.241 7.253 1.949 1.00 . A A . 27 ASN CG 1 1 9 6600 1 1 28 ASN H H -5.352 6.314 3.179 1.00 . A A . 27 ASN H 1 1 9 6601 1 1 28 ASN HA H -6.405 6.975 0.628 1.00 . A A . 27 ASN HA 1 1 9 6602 1 1 28 ASN HB2 H -4.084 7.803 0.105 1.00 . A A . 27 ASN HB2 1 1 9 6603 1 1 28 ASN HB3 H -4.854 8.537 1.503 1.00 . A A . 27 ASN HB3 1 1 9 6604 1 1 28 ASN HD21 H -2.537 6.102 0.501 1.00 . A A . 27 ASN HD21 1 1 9 6605 1 1 28 ASN HD22 H -1.589 6.162 1.940 1.00 . A A . 27 ASN HD22 1 1 9 6606 1 1 28 ASN N N -5.909 6.086 2.406 1.00 . A A . 27 ASN N 1 1 9 6607 1 1 28 ASN ND2 N -2.366 6.425 1.409 1.00 . A A . 27 ASN ND2 1 1 9 6608 1 1 28 ASN O O -5.531 5.317 -0.966 1.00 . A A . 27 ASN O 1 1 9 6609 1 1 28 ASN OD1 O -3.114 7.703 3.080 1.00 . A A . 27 ASN OD1 1 1 9 6610 1 1 29 LEU C C -4.996 2.445 -0.531 1.00 . A A . 28 LEU C 1 1 9 6611 1 1 29 LEU CA C -3.840 3.374 -0.178 1.00 . A A . 28 LEU CA 1 1 9 6612 1 1 29 LEU CB C -2.610 2.624 0.359 1.00 . A A . 28 LEU CB 1 1 9 6613 1 1 29 LEU CD1 C -3.399 0.922 2.037 1.00 . A A . 28 LEU CD1 1 1 9 6614 1 1 29 LEU CD2 C -1.167 2.036 2.291 1.00 . A A . 28 LEU CD2 1 1 9 6615 1 1 29 LEU CG C -2.607 2.208 1.828 1.00 . A A . 28 LEU CG 1 1 9 6616 1 1 29 LEU H H -3.968 4.522 1.621 1.00 . A A . 28 LEU H 1 1 9 6617 1 1 29 LEU HA H -3.543 3.848 -1.105 1.00 . A A . 28 LEU HA 1 1 9 6618 1 1 29 LEU HB2 H -2.488 1.729 -0.231 1.00 . A A . 28 LEU HB2 1 1 9 6619 1 1 29 LEU HB3 H -1.746 3.251 0.194 1.00 . A A . 28 LEU HB3 1 1 9 6620 1 1 29 LEU HD11 H -4.403 1.055 1.662 1.00 . A A . 28 LEU HD11 1 1 9 6621 1 1 29 LEU HD12 H -3.438 0.690 3.091 1.00 . A A . 28 LEU HD12 1 1 9 6622 1 1 29 LEU HD13 H -2.921 0.109 1.507 1.00 . A A . 28 LEU HD13 1 1 9 6623 1 1 29 LEU HD21 H -1.138 1.968 3.368 1.00 . A A . 28 LEU HD21 1 1 9 6624 1 1 29 LEU HD22 H -0.580 2.886 1.960 1.00 . A A . 28 LEU HD22 1 1 9 6625 1 1 29 LEU HD23 H -0.759 1.133 1.861 1.00 . A A . 28 LEU HD23 1 1 9 6626 1 1 29 LEU HG H -3.062 2.987 2.423 1.00 . A A . 28 LEU HG 1 1 9 6627 1 1 29 LEU N N -4.278 4.464 0.686 1.00 . A A . 28 LEU N 1 1 9 6628 1 1 29 LEU O O -5.043 1.902 -1.630 1.00 . A A . 28 LEU O 1 1 9 6629 1 1 30 ARG C C -7.945 2.215 -1.060 1.00 . A A . 29 ARG C 1 1 9 6630 1 1 30 ARG CA C -7.163 1.547 0.074 1.00 . A A . 29 ARG CA 1 1 9 6631 1 1 30 ARG CB C -8.049 1.440 1.316 1.00 . A A . 29 ARG CB 1 1 9 6632 1 1 30 ARG CD C -8.307 0.541 3.640 1.00 . A A . 29 ARG CD 1 1 9 6633 1 1 30 ARG CG C -7.613 0.365 2.300 1.00 . A A . 29 ARG CG 1 1 9 6634 1 1 30 ARG CZ C -9.233 -1.417 4.829 1.00 . A A . 29 ARG CZ 1 1 9 6635 1 1 30 ARG H H -5.827 2.685 1.269 1.00 . A A . 29 ARG H 1 1 9 6636 1 1 30 ARG HA H -6.875 0.554 -0.237 1.00 . A A . 29 ARG HA 1 1 9 6637 1 1 30 ARG HB2 H -8.044 2.391 1.829 1.00 . A A . 29 ARG HB2 1 1 9 6638 1 1 30 ARG HB3 H -9.059 1.219 1.000 1.00 . A A . 29 ARG HB3 1 1 9 6639 1 1 30 ARG HD2 H -7.845 1.375 4.153 1.00 . A A . 29 ARG HD2 1 1 9 6640 1 1 30 ARG HD3 H -9.350 0.755 3.466 1.00 . A A . 29 ARG HD3 1 1 9 6641 1 1 30 ARG HE H -7.304 -0.879 4.822 1.00 . A A . 29 ARG HE 1 1 9 6642 1 1 30 ARG HG2 H -7.867 -0.604 1.898 1.00 . A A . 29 ARG HG2 1 1 9 6643 1 1 30 ARG HG3 H -6.544 0.432 2.445 1.00 . A A . 29 ARG HG3 1 1 9 6644 1 1 30 ARG HH11 H -10.606 -0.343 3.776 1.00 . A A . 29 ARG HH11 1 1 9 6645 1 1 30 ARG HH12 H -11.233 -1.725 4.636 1.00 . A A . 29 ARG HH12 1 1 9 6646 1 1 30 ARG HH21 H -8.139 -2.674 5.988 1.00 . A A . 29 ARG HH21 1 1 9 6647 1 1 30 ARG HH22 H -9.829 -3.049 5.878 1.00 . A A . 29 ARG HH22 1 1 9 6648 1 1 30 ARG N N -5.944 2.291 0.377 1.00 . A A . 29 ARG N 1 1 9 6649 1 1 30 ARG NE N -8.197 -0.650 4.483 1.00 . A A . 29 ARG NE 1 1 9 6650 1 1 30 ARG NH1 N -10.452 -1.139 4.379 1.00 . A A . 29 ARG NH1 1 1 9 6651 1 1 30 ARG NH2 N -9.051 -2.460 5.631 1.00 . A A . 29 ARG NH2 1 1 9 6652 1 1 30 ARG O O -8.555 1.538 -1.889 1.00 . A A . 29 ARG O 1 1 9 6653 1 1 31 SER C C -8.151 4.155 -3.501 1.00 . A A . 30 SER C 1 1 9 6654 1 1 31 SER CA C -8.686 4.304 -2.070 1.00 . A A . 30 SER CA 1 1 9 6655 1 1 31 SER CB C -8.713 5.780 -1.661 1.00 . A A . 30 SER CB 1 1 9 6656 1 1 31 SER H H -7.332 4.027 -0.464 1.00 . A A . 30 SER H 1 1 9 6657 1 1 31 SER HA H -9.694 3.920 -2.043 1.00 . A A . 30 SER HA 1 1 9 6658 1 1 31 SER HB2 H -9.072 5.861 -0.646 1.00 . A A . 30 SER HB2 1 1 9 6659 1 1 31 SER HB3 H -7.713 6.184 -1.721 1.00 . A A . 30 SER HB3 1 1 9 6660 1 1 31 SER HG H -10.398 6.701 -2.058 1.00 . A A . 30 SER HG 1 1 9 6661 1 1 31 SER N N -7.900 3.543 -1.104 1.00 . A A . 30 SER N 1 1 9 6662 1 1 31 SER O O -8.925 3.912 -4.426 1.00 . A A . 30 SER O 1 1 9 6663 1 1 31 SER OG O -9.563 6.539 -2.505 1.00 . A A . 30 SER OG 1 1 9 6664 1 1 32 TRP C C -5.962 2.769 -5.491 1.00 . A A . 31 TRP C 1 1 9 6665 1 1 32 TRP CA C -6.294 4.191 -5.057 1.00 . A A . 31 TRP CA 1 1 9 6666 1 1 32 TRP CB C -5.084 5.110 -5.256 1.00 . A A . 31 TRP CB 1 1 9 6667 1 1 32 TRP CD1 C -3.381 4.026 -3.679 1.00 . A A . 31 TRP CD1 1 1 9 6668 1 1 32 TRP CD2 C -3.633 6.228 -3.385 1.00 . A A . 31 TRP CD2 1 1 9 6669 1 1 32 TRP CE2 C -2.673 5.762 -2.471 1.00 . A A . 31 TRP CE2 1 1 9 6670 1 1 32 TRP CE3 C -3.955 7.589 -3.384 1.00 . A A . 31 TRP CE3 1 1 9 6671 1 1 32 TRP CG C -4.078 5.097 -4.146 1.00 . A A . 31 TRP CG 1 1 9 6672 1 1 32 TRP CH2 C -2.367 7.928 -1.591 1.00 . A A . 31 TRP CH2 1 1 9 6673 1 1 32 TRP CZ2 C -2.033 6.604 -1.570 1.00 . A A . 31 TRP CZ2 1 1 9 6674 1 1 32 TRP CZ3 C -3.319 8.423 -2.487 1.00 . A A . 31 TRP CZ3 1 1 9 6675 1 1 32 TRP H H -6.237 4.400 -2.933 1.00 . A A . 31 TRP H 1 1 9 6676 1 1 32 TRP HA H -7.081 4.544 -5.709 1.00 . A A . 31 TRP HA 1 1 9 6677 1 1 32 TRP HB2 H -4.568 4.800 -6.159 1.00 . A A . 31 TRP HB2 1 1 9 6678 1 1 32 TRP HB3 H -5.434 6.124 -5.381 1.00 . A A . 31 TRP HB3 1 1 9 6679 1 1 32 TRP HD1 H -3.490 3.019 -4.056 1.00 . A A . 31 TRP HD1 1 1 9 6680 1 1 32 TRP HE1 H -1.938 3.823 -2.170 1.00 . A A . 31 TRP HE1 1 1 9 6681 1 1 32 TRP HE3 H -4.686 7.990 -4.064 1.00 . A A . 31 TRP HE3 1 1 9 6682 1 1 32 TRP HH2 H -1.895 8.619 -0.906 1.00 . A A . 31 TRP HH2 1 1 9 6683 1 1 32 TRP HZ2 H -1.293 6.237 -0.871 1.00 . A A . 31 TRP HZ2 1 1 9 6684 1 1 32 TRP HZ3 H -3.556 9.477 -2.472 1.00 . A A . 31 TRP HZ3 1 1 9 6685 1 1 32 TRP N N -6.839 4.260 -3.698 1.00 . A A . 31 TRP N 1 1 9 6686 1 1 32 TRP NE1 N -2.538 4.417 -2.670 1.00 . A A . 31 TRP NE1 1 1 9 6687 1 1 32 TRP O O -5.526 2.548 -6.623 1.00 . A A . 31 TRP O 1 1 9 6688 1 1 33 ASN C C -7.318 -0.195 -5.405 1.00 . A A . 32 ASN C 1 1 9 6689 1 1 33 ASN CA C -5.986 0.414 -5.001 1.00 . A A . 32 ASN CA 1 1 9 6690 1 1 33 ASN CB C -5.336 -0.407 -3.885 1.00 . A A . 32 ASN CB 1 1 9 6691 1 1 33 ASN CG C -3.822 -0.320 -3.914 1.00 . A A . 32 ASN CG 1 1 9 6692 1 1 33 ASN H H -6.426 2.028 -3.695 1.00 . A A . 32 ASN H 1 1 9 6693 1 1 33 ASN HA H -5.334 0.403 -5.864 1.00 . A A . 32 ASN HA 1 1 9 6694 1 1 33 ASN HB2 H -5.678 -0.040 -2.930 1.00 . A A . 32 ASN HB2 1 1 9 6695 1 1 33 ASN HB3 H -5.622 -1.442 -3.992 1.00 . A A . 32 ASN HB3 1 1 9 6696 1 1 33 ASN HD21 H -3.865 1.184 -2.619 1.00 . A A . 32 ASN HD21 1 1 9 6697 1 1 33 ASN HD22 H -2.289 0.692 -3.149 1.00 . A A . 32 ASN HD22 1 1 9 6698 1 1 33 ASN N N -6.161 1.806 -4.613 1.00 . A A . 32 ASN N 1 1 9 6699 1 1 33 ASN ND2 N -3.269 0.610 -3.154 1.00 . A A . 32 ASN ND2 1 1 9 6700 1 1 33 ASN O O -7.363 -1.178 -6.143 1.00 . A A . 32 ASN O 1 1 9 6701 1 1 33 ASN OD1 O -3.158 -1.087 -4.605 1.00 . A A . 32 ASN OD1 1 1 9 6702 1 1 34 GLY C C -10.031 -1.420 -4.677 1.00 . A A . 33 GLY C 1 1 9 6703 1 1 34 GLY CA C -9.737 -0.065 -5.284 1.00 . A A . 33 GLY CA 1 1 9 6704 1 1 34 GLY H H -8.307 1.196 -4.360 1.00 . A A . 33 GLY H 1 1 9 6705 1 1 34 GLY HA2 H -10.468 0.645 -4.926 1.00 . A A . 33 GLY HA2 1 1 9 6706 1 1 34 GLY HA3 H -9.815 -0.139 -6.358 1.00 . A A . 33 GLY HA3 1 1 9 6707 1 1 34 GLY N N -8.407 0.412 -4.940 1.00 . A A . 33 GLY N 1 1 9 6708 1 1 34 GLY O O -10.886 -2.162 -5.163 1.00 . A A . 33 GLY O 1 1 9 6709 1 1 35 ILE C C -9.612 -2.774 -1.453 1.00 . A A . 34 ILE C 1 1 9 6710 1 1 35 ILE CA C -9.471 -3.017 -2.942 1.00 . A A . 34 ILE CA 1 1 9 6711 1 1 35 ILE CB C -8.253 -3.948 -3.154 1.00 . A A . 34 ILE CB 1 1 9 6712 1 1 35 ILE CD1 C -6.516 -4.702 -4.839 1.00 . A A . 34 ILE CD1 1 1 9 6713 1 1 35 ILE CG1 C -7.829 -3.981 -4.620 1.00 . A A . 34 ILE CG1 1 1 9 6714 1 1 35 ILE CG2 C -8.567 -5.359 -2.668 1.00 . A A . 34 ILE CG2 1 1 9 6715 1 1 35 ILE H H -8.644 -1.111 -3.287 1.00 . A A . 34 ILE H 1 1 9 6716 1 1 35 ILE HA H -10.358 -3.503 -3.318 1.00 . A A . 34 ILE HA 1 1 9 6717 1 1 35 ILE HB H -7.435 -3.569 -2.560 1.00 . A A . 34 ILE HB 1 1 9 6718 1 1 35 ILE HD11 H -6.248 -4.660 -5.883 1.00 . A A . 34 ILE HD11 1 1 9 6719 1 1 35 ILE HD12 H -6.619 -5.732 -4.532 1.00 . A A . 34 ILE HD12 1 1 9 6720 1 1 35 ILE HD13 H -5.745 -4.228 -4.248 1.00 . A A . 34 ILE HD13 1 1 9 6721 1 1 35 ILE HG12 H -8.589 -4.487 -5.198 1.00 . A A . 34 ILE HG12 1 1 9 6722 1 1 35 ILE HG13 H -7.719 -2.970 -4.982 1.00 . A A . 34 ILE HG13 1 1 9 6723 1 1 35 ILE HG21 H -9.403 -5.756 -3.225 1.00 . A A . 34 ILE HG21 1 1 9 6724 1 1 35 ILE HG22 H -8.817 -5.332 -1.618 1.00 . A A . 34 ILE HG22 1 1 9 6725 1 1 35 ILE HG23 H -7.703 -5.990 -2.816 1.00 . A A . 34 ILE HG23 1 1 9 6726 1 1 35 ILE N N -9.304 -1.748 -3.626 1.00 . A A . 34 ILE N 1 1 9 6727 1 1 35 ILE O O -9.016 -1.838 -0.914 1.00 . A A . 34 ILE O 1 1 9 6728 1 1 36 SER C C -9.025 -4.208 1.076 1.00 . A A . 35 SER C 1 1 9 6729 1 1 36 SER CA C -10.370 -3.626 0.654 1.00 . A A . 35 SER CA 1 1 9 6730 1 1 36 SER CB C -11.521 -4.476 1.194 1.00 . A A . 35 SER CB 1 1 9 6731 1 1 36 SER H H -11.021 -4.182 -1.275 1.00 . A A . 35 SER H 1 1 9 6732 1 1 36 SER HA H -10.457 -2.615 1.024 1.00 . A A . 35 SER HA 1 1 9 6733 1 1 36 SER HB2 H -11.358 -5.511 0.928 1.00 . A A . 35 SER HB2 1 1 9 6734 1 1 36 SER HB3 H -11.562 -4.381 2.268 1.00 . A A . 35 SER HB3 1 1 9 6735 1 1 36 SER HG H -12.725 -4.112 -0.316 1.00 . A A . 35 SER HG 1 1 9 6736 1 1 36 SER N N -10.402 -3.594 -0.787 1.00 . A A . 35 SER N 1 1 9 6737 1 1 36 SER O O -8.771 -5.397 0.891 1.00 . A A . 35 SER O 1 1 9 6738 1 1 36 SER OG O -12.762 -4.054 0.649 1.00 . A A . 35 SER OG 1 1 9 6739 1 1 37 GLY C C -6.698 -4.753 3.076 1.00 . A A . 36 GLY C 1 1 9 6740 1 1 37 GLY CA C -6.800 -3.760 1.933 1.00 . A A . 36 GLY CA 1 1 9 6741 1 1 37 GLY H H -8.447 -2.440 1.788 1.00 . A A . 36 GLY H 1 1 9 6742 1 1 37 GLY HA2 H -6.362 -4.205 1.052 1.00 . A A . 36 GLY HA2 1 1 9 6743 1 1 37 GLY HA3 H -6.233 -2.877 2.190 1.00 . A A . 36 GLY HA3 1 1 9 6744 1 1 37 GLY N N -8.162 -3.359 1.620 1.00 . A A . 36 GLY N 1 1 9 6745 1 1 37 GLY O O -5.606 -5.022 3.569 1.00 . A A . 36 GLY O 1 1 9 6746 1 1 38 ASP C C -7.050 -7.510 4.179 1.00 . A A . 37 ASP C 1 1 9 6747 1 1 38 ASP CA C -7.857 -6.279 4.569 1.00 . A A . 37 ASP CA 1 1 9 6748 1 1 38 ASP CB C -9.299 -6.669 4.886 1.00 . A A . 37 ASP CB 1 1 9 6749 1 1 38 ASP CG C -10.118 -5.481 5.347 1.00 . A A . 37 ASP CG 1 1 9 6750 1 1 38 ASP H H -8.673 -5.025 3.077 1.00 . A A . 37 ASP H 1 1 9 6751 1 1 38 ASP HA H -7.411 -5.833 5.445 1.00 . A A . 37 ASP HA 1 1 9 6752 1 1 38 ASP HB2 H -9.760 -7.079 3.998 1.00 . A A . 37 ASP HB2 1 1 9 6753 1 1 38 ASP HB3 H -9.304 -7.414 5.667 1.00 . A A . 37 ASP HB3 1 1 9 6754 1 1 38 ASP N N -7.829 -5.294 3.500 1.00 . A A . 37 ASP N 1 1 9 6755 1 1 38 ASP O O -6.375 -8.114 5.012 1.00 . A A . 37 ASP O 1 1 9 6756 1 1 38 ASP OD1 O -10.643 -4.746 4.488 1.00 . A A . 37 ASP OD1 1 1 9 6757 1 1 38 ASP OD2 O -10.220 -5.263 6.572 1.00 . A A . 37 ASP OD2 1 1 9 6758 1 1 39 LEU C C -5.054 -8.471 1.725 1.00 . A A . 38 LEU C 1 1 9 6759 1 1 39 LEU CA C -6.341 -8.976 2.382 1.00 . A A . 38 LEU CA 1 1 9 6760 1 1 39 LEU CB C -7.162 -9.832 1.398 1.00 . A A . 38 LEU CB 1 1 9 6761 1 1 39 LEU CD1 C -8.144 -10.017 -0.902 1.00 . A A . 38 LEU CD1 1 1 9 6762 1 1 39 LEU CD2 C -9.205 -8.502 0.764 1.00 . A A . 38 LEU CD2 1 1 9 6763 1 1 39 LEU CG C -7.886 -9.081 0.269 1.00 . A A . 38 LEU CG 1 1 9 6764 1 1 39 LEU H H -7.707 -7.367 2.300 1.00 . A A . 38 LEU H 1 1 9 6765 1 1 39 LEU HA H -6.063 -9.594 3.224 1.00 . A A . 38 LEU HA 1 1 9 6766 1 1 39 LEU HB2 H -6.496 -10.551 0.947 1.00 . A A . 38 LEU HB2 1 1 9 6767 1 1 39 LEU HB3 H -7.905 -10.371 1.968 1.00 . A A . 38 LEU HB3 1 1 9 6768 1 1 39 LEU HD11 H -8.787 -10.823 -0.584 1.00 . A A . 38 LEU HD11 1 1 9 6769 1 1 39 LEU HD12 H -7.206 -10.421 -1.252 1.00 . A A . 38 LEU HD12 1 1 9 6770 1 1 39 LEU HD13 H -8.621 -9.471 -1.703 1.00 . A A . 38 LEU HD13 1 1 9 6771 1 1 39 LEU HD21 H -9.014 -7.812 1.575 1.00 . A A . 38 LEU HD21 1 1 9 6772 1 1 39 LEU HD22 H -9.841 -9.301 1.116 1.00 . A A . 38 LEU HD22 1 1 9 6773 1 1 39 LEU HD23 H -9.695 -7.980 -0.044 1.00 . A A . 38 LEU HD23 1 1 9 6774 1 1 39 LEU HG H -7.266 -8.268 -0.079 1.00 . A A . 38 LEU HG 1 1 9 6775 1 1 39 LEU N N -7.121 -7.867 2.906 1.00 . A A . 38 LEU N 1 1 9 6776 1 1 39 LEU O O -5.028 -8.137 0.538 1.00 . A A . 38 LEU O 1 1 9 6777 1 1 40 ILE C C -1.661 -9.078 2.336 1.00 . A A . 39 ILE C 1 1 9 6778 1 1 40 ILE CA C -2.687 -7.994 2.015 1.00 . A A . 39 ILE CA 1 1 9 6779 1 1 40 ILE CB C -2.229 -6.629 2.593 1.00 . A A . 39 ILE CB 1 1 9 6780 1 1 40 ILE CD1 C -2.368 -4.113 2.170 1.00 . A A . 39 ILE CD1 1 1 9 6781 1 1 40 ILE CG1 C -2.964 -5.480 1.892 1.00 . A A . 39 ILE CG1 1 1 9 6782 1 1 40 ILE CG2 C -0.724 -6.445 2.471 1.00 . A A . 39 ILE CG2 1 1 9 6783 1 1 40 ILE H H -4.097 -8.588 3.470 1.00 . A A . 39 ILE H 1 1 9 6784 1 1 40 ILE HA H -2.764 -7.897 0.942 1.00 . A A . 39 ILE HA 1 1 9 6785 1 1 40 ILE HB H -2.480 -6.611 3.643 1.00 . A A . 39 ILE HB 1 1 9 6786 1 1 40 ILE HD11 H -2.327 -3.948 3.240 1.00 . A A . 39 ILE HD11 1 1 9 6787 1 1 40 ILE HD12 H -2.979 -3.347 1.710 1.00 . A A . 39 ILE HD12 1 1 9 6788 1 1 40 ILE HD13 H -1.369 -4.067 1.762 1.00 . A A . 39 ILE HD13 1 1 9 6789 1 1 40 ILE HG12 H -2.935 -5.641 0.826 1.00 . A A . 39 ILE HG12 1 1 9 6790 1 1 40 ILE HG13 H -3.993 -5.467 2.221 1.00 . A A . 39 ILE HG13 1 1 9 6791 1 1 40 ILE HG21 H -0.220 -7.278 2.950 1.00 . A A . 39 ILE HG21 1 1 9 6792 1 1 40 ILE HG22 H -0.433 -5.524 2.962 1.00 . A A . 39 ILE HG22 1 1 9 6793 1 1 40 ILE HG23 H -0.446 -6.404 1.430 1.00 . A A . 39 ILE HG23 1 1 9 6794 1 1 40 ILE N N -3.996 -8.383 2.518 1.00 . A A . 39 ILE N 1 1 9 6795 1 1 40 ILE O O -1.632 -9.607 3.448 1.00 . A A . 39 ILE O 1 1 9 6796 1 1 41 PHE C C 1.480 -10.041 0.885 1.00 . A A . 40 PHE C 1 1 9 6797 1 1 41 PHE CA C 0.160 -10.465 1.518 1.00 . A A . 40 PHE CA 1 1 9 6798 1 1 41 PHE CB C -0.326 -11.784 0.901 1.00 . A A . 40 PHE CB 1 1 9 6799 1 1 41 PHE CD1 C -1.892 -11.351 -1.016 1.00 . A A . 40 PHE CD1 1 1 9 6800 1 1 41 PHE CD2 C 0.356 -11.964 -1.511 1.00 . A A . 40 PHE CD2 1 1 9 6801 1 1 41 PHE CE1 C -2.169 -11.270 -2.366 1.00 . A A . 40 PHE CE1 1 1 9 6802 1 1 41 PHE CE2 C 0.083 -11.885 -2.862 1.00 . A A . 40 PHE CE2 1 1 9 6803 1 1 41 PHE CG C -0.628 -11.698 -0.572 1.00 . A A . 40 PHE CG 1 1 9 6804 1 1 41 PHE CZ C -1.180 -11.536 -3.291 1.00 . A A . 40 PHE CZ 1 1 9 6805 1 1 41 PHE H H -0.914 -8.969 0.486 1.00 . A A . 40 PHE H 1 1 9 6806 1 1 41 PHE HA H 0.312 -10.608 2.578 1.00 . A A . 40 PHE HA 1 1 9 6807 1 1 41 PHE HB2 H 0.436 -12.536 1.038 1.00 . A A . 40 PHE HB2 1 1 9 6808 1 1 41 PHE HB3 H -1.228 -12.098 1.407 1.00 . A A . 40 PHE HB3 1 1 9 6809 1 1 41 PHE HD1 H -2.667 -11.140 -0.294 1.00 . A A . 40 PHE HD1 1 1 9 6810 1 1 41 PHE HD2 H 1.346 -12.238 -1.177 1.00 . A A . 40 PHE HD2 1 1 9 6811 1 1 41 PHE HE1 H -3.160 -10.997 -2.700 1.00 . A A . 40 PHE HE1 1 1 9 6812 1 1 41 PHE HE2 H 0.861 -12.094 -3.581 1.00 . A A . 40 PHE HE2 1 1 9 6813 1 1 41 PHE HZ H -1.395 -11.474 -4.348 1.00 . A A . 40 PHE HZ 1 1 9 6814 1 1 41 PHE N N -0.845 -9.426 1.349 1.00 . A A . 40 PHE N 1 1 9 6815 1 1 41 PHE O O 1.512 -9.144 0.039 1.00 . A A . 40 PHE O 1 1 9 6816 1 1 42 VAL C C 3.958 -10.737 -0.720 1.00 . A A . 41 VAL C 1 1 9 6817 1 1 42 VAL CA C 3.885 -10.393 0.765 1.00 . A A . 41 VAL CA 1 1 9 6818 1 1 42 VAL CB C 4.981 -11.170 1.532 1.00 . A A . 41 VAL CB 1 1 9 6819 1 1 42 VAL CG1 C 6.367 -10.858 0.982 1.00 . A A . 41 VAL CG1 1 1 9 6820 1 1 42 VAL CG2 C 4.912 -10.856 3.020 1.00 . A A . 41 VAL CG2 1 1 9 6821 1 1 42 VAL H H 2.464 -11.406 1.962 1.00 . A A . 41 VAL H 1 1 9 6822 1 1 42 VAL HA H 4.065 -9.335 0.892 1.00 . A A . 41 VAL HA 1 1 9 6823 1 1 42 VAL HB H 4.800 -12.227 1.405 1.00 . A A . 41 VAL HB 1 1 9 6824 1 1 42 VAL HG11 H 6.418 -11.158 -0.054 1.00 . A A . 41 VAL HG11 1 1 9 6825 1 1 42 VAL HG12 H 7.110 -11.397 1.549 1.00 . A A . 41 VAL HG12 1 1 9 6826 1 1 42 VAL HG13 H 6.555 -9.797 1.060 1.00 . A A . 41 VAL HG13 1 1 9 6827 1 1 42 VAL HG21 H 5.689 -11.398 3.539 1.00 . A A . 41 VAL HG21 1 1 9 6828 1 1 42 VAL HG22 H 3.947 -11.150 3.406 1.00 . A A . 41 VAL HG22 1 1 9 6829 1 1 42 VAL HG23 H 5.050 -9.796 3.171 1.00 . A A . 41 VAL HG23 1 1 9 6830 1 1 42 VAL N N 2.560 -10.691 1.293 1.00 . A A . 41 VAL N 1 1 9 6831 1 1 42 VAL O O 3.593 -11.842 -1.125 1.00 . A A . 41 VAL O 1 1 9 6832 1 1 43 GLY C C 3.382 -9.281 -3.700 1.00 . A A . 42 GLY C 1 1 9 6833 1 1 43 GLY CA C 4.478 -10.016 -2.958 1.00 . A A . 42 GLY CA 1 1 9 6834 1 1 43 GLY H H 4.733 -8.935 -1.154 1.00 . A A . 42 GLY H 1 1 9 6835 1 1 43 GLY HA2 H 5.436 -9.680 -3.326 1.00 . A A . 42 GLY HA2 1 1 9 6836 1 1 43 GLY HA3 H 4.379 -11.073 -3.151 1.00 . A A . 42 GLY HA3 1 1 9 6837 1 1 43 GLY N N 4.417 -9.792 -1.532 1.00 . A A . 42 GLY N 1 1 9 6838 1 1 43 GLY O O 3.444 -9.132 -4.923 1.00 . A A . 42 GLY O 1 1 9 6839 1 1 44 GLN C C 1.735 -6.645 -3.856 1.00 . A A . 43 GLN C 1 1 9 6840 1 1 44 GLN CA C 1.281 -8.063 -3.553 1.00 . A A . 43 GLN CA 1 1 9 6841 1 1 44 GLN CB C 0.066 -8.036 -2.618 1.00 . A A . 43 GLN CB 1 1 9 6842 1 1 44 GLN CD C -2.309 -7.233 -2.282 1.00 . A A . 43 GLN CD 1 1 9 6843 1 1 44 GLN CG C -1.016 -7.056 -3.049 1.00 . A A . 43 GLN CG 1 1 9 6844 1 1 44 GLN H H 2.366 -9.005 -1.999 1.00 . A A . 43 GLN H 1 1 9 6845 1 1 44 GLN HA H 1.001 -8.542 -4.479 1.00 . A A . 43 GLN HA 1 1 9 6846 1 1 44 GLN HB2 H -0.367 -9.024 -2.583 1.00 . A A . 43 GLN HB2 1 1 9 6847 1 1 44 GLN HB3 H 0.396 -7.762 -1.626 1.00 . A A . 43 GLN HB3 1 1 9 6848 1 1 44 GLN HE21 H -1.713 -5.933 -0.908 1.00 . A A . 43 GLN HE21 1 1 9 6849 1 1 44 GLN HE22 H -3.276 -6.630 -0.657 1.00 . A A . 43 GLN HE22 1 1 9 6850 1 1 44 GLN HG2 H -0.655 -6.047 -2.886 1.00 . A A . 43 GLN HG2 1 1 9 6851 1 1 44 GLN HG3 H -1.215 -7.199 -4.101 1.00 . A A . 43 GLN HG3 1 1 9 6852 1 1 44 GLN N N 2.372 -8.827 -2.965 1.00 . A A . 43 GLN N 1 1 9 6853 1 1 44 GLN NE2 N -2.444 -6.528 -1.172 1.00 . A A . 43 GLN NE2 1 1 9 6854 1 1 44 GLN O O 2.279 -5.962 -2.993 1.00 . A A . 43 GLN O 1 1 9 6855 1 1 44 GLN OE1 O -3.185 -7.994 -2.686 1.00 . A A . 43 GLN OE1 1 1 9 6856 1 1 45 LYS C C 0.692 -3.935 -5.231 1.00 . A A . 44 LYS C 1 1 9 6857 1 1 45 LYS CA C 1.869 -4.867 -5.485 1.00 . A A . 44 LYS CA 1 1 9 6858 1 1 45 LYS CB C 2.235 -4.847 -6.968 1.00 . A A . 44 LYS CB 1 1 9 6859 1 1 45 LYS CD C 2.641 -3.413 -8.979 1.00 . A A . 44 LYS CD 1 1 9 6860 1 1 45 LYS CE C 3.440 -4.513 -9.664 1.00 . A A . 44 LYS CE 1 1 9 6861 1 1 45 LYS CG C 2.734 -3.502 -7.464 1.00 . A A . 44 LYS CG 1 1 9 6862 1 1 45 LYS H H 1.108 -6.820 -5.743 1.00 . A A . 44 LYS H 1 1 9 6863 1 1 45 LYS HA H 2.714 -4.542 -4.899 1.00 . A A . 44 LYS HA 1 1 9 6864 1 1 45 LYS HB2 H 3.010 -5.577 -7.143 1.00 . A A . 44 LYS HB2 1 1 9 6865 1 1 45 LYS HB3 H 1.362 -5.117 -7.544 1.00 . A A . 44 LYS HB3 1 1 9 6866 1 1 45 LYS HD2 H 1.604 -3.501 -9.271 1.00 . A A . 44 LYS HD2 1 1 9 6867 1 1 45 LYS HD3 H 3.025 -2.455 -9.295 1.00 . A A . 44 LYS HD3 1 1 9 6868 1 1 45 LYS HE2 H 4.491 -4.274 -9.594 1.00 . A A . 44 LYS HE2 1 1 9 6869 1 1 45 LYS HE3 H 3.249 -5.451 -9.160 1.00 . A A . 44 LYS HE3 1 1 9 6870 1 1 45 LYS HG2 H 2.132 -2.718 -7.029 1.00 . A A . 44 LYS HG2 1 1 9 6871 1 1 45 LYS HG3 H 3.765 -3.379 -7.167 1.00 . A A . 44 LYS HG3 1 1 9 6872 1 1 45 LYS HZ1 H 3.678 -5.352 -11.566 1.00 . A A . 44 LYS HZ1 1 1 9 6873 1 1 45 LYS HZ2 H 3.174 -3.730 -11.583 1.00 . A A . 44 LYS HZ2 1 1 9 6874 1 1 45 LYS HZ3 H 2.075 -4.959 -11.176 1.00 . A A . 44 LYS HZ3 1 1 9 6875 1 1 45 LYS N N 1.520 -6.215 -5.084 1.00 . A A . 44 LYS N 1 1 9 6876 1 1 45 LYS NZ N 3.069 -4.648 -11.096 1.00 . A A . 44 LYS NZ 1 1 9 6877 1 1 45 LYS O O -0.311 -3.991 -5.943 1.00 . A A . 44 LYS O 1 1 9 6878 1 1 46 LEU C C 0.198 -0.725 -4.115 1.00 . A A . 45 LEU C 1 1 9 6879 1 1 46 LEU CA C -0.270 -2.169 -3.896 1.00 . A A . 45 LEU CA 1 1 9 6880 1 1 46 LEU CB C -0.838 -2.445 -2.466 1.00 . A A . 45 LEU CB 1 1 9 6881 1 1 46 LEU CD1 C 1.378 -2.222 -1.266 1.00 . A A . 45 LEU CD1 1 1 9 6882 1 1 46 LEU CD2 C -0.331 -0.404 -1.051 1.00 . A A . 45 LEU CD2 1 1 9 6883 1 1 46 LEU CG C -0.097 -1.896 -1.228 1.00 . A A . 45 LEU CG 1 1 9 6884 1 1 46 LEU H H 1.631 -3.080 -3.681 1.00 . A A . 45 LEU H 1 1 9 6885 1 1 46 LEU HA H -1.060 -2.362 -4.610 1.00 . A A . 45 LEU HA 1 1 9 6886 1 1 46 LEU HB2 H -1.843 -2.059 -2.433 1.00 . A A . 45 LEU HB2 1 1 9 6887 1 1 46 LEU HB3 H -0.893 -3.523 -2.345 1.00 . A A . 45 LEU HB3 1 1 9 6888 1 1 46 LEU HD11 H 1.838 -1.919 -0.340 1.00 . A A . 45 LEU HD11 1 1 9 6889 1 1 46 LEU HD12 H 1.842 -1.698 -2.089 1.00 . A A . 45 LEU HD12 1 1 9 6890 1 1 46 LEU HD13 H 1.505 -3.288 -1.402 1.00 . A A . 45 LEU HD13 1 1 9 6891 1 1 46 LEU HD21 H 0.156 -0.067 -0.148 1.00 . A A . 45 LEU HD21 1 1 9 6892 1 1 46 LEU HD22 H -1.393 -0.214 -0.981 1.00 . A A . 45 LEU HD22 1 1 9 6893 1 1 46 LEU HD23 H 0.072 0.126 -1.899 1.00 . A A . 45 LEU HD23 1 1 9 6894 1 1 46 LEU HG H -0.500 -2.389 -0.355 1.00 . A A . 45 LEU HG 1 1 9 6895 1 1 46 LEU N N 0.804 -3.092 -4.216 1.00 . A A . 45 LEU N 1 1 9 6896 1 1 46 LEU O O 1.356 -0.389 -3.857 1.00 . A A . 45 LEU O 1 1 9 6897 1 1 47 ILE C C -0.128 2.323 -3.723 1.00 . A A . 46 ILE C 1 1 9 6898 1 1 47 ILE CA C -0.372 1.494 -4.981 1.00 . A A . 46 ILE CA 1 1 9 6899 1 1 47 ILE CB C -1.506 2.176 -5.791 1.00 . A A . 46 ILE CB 1 1 9 6900 1 1 47 ILE CD1 C -0.749 1.142 -8.002 1.00 . A A . 46 ILE CD1 1 1 9 6901 1 1 47 ILE CG1 C -1.890 1.360 -7.028 1.00 . A A . 46 ILE CG1 1 1 9 6902 1 1 47 ILE CG2 C -1.096 3.582 -6.212 1.00 . A A . 46 ILE CG2 1 1 9 6903 1 1 47 ILE H H -1.604 -0.227 -4.826 1.00 . A A . 46 ILE H 1 1 9 6904 1 1 47 ILE HA H 0.524 1.494 -5.585 1.00 . A A . 46 ILE HA 1 1 9 6905 1 1 47 ILE HB H -2.369 2.263 -5.148 1.00 . A A . 46 ILE HB 1 1 9 6906 1 1 47 ILE HD11 H -0.388 2.095 -8.353 1.00 . A A . 46 ILE HD11 1 1 9 6907 1 1 47 ILE HD12 H -1.097 0.557 -8.842 1.00 . A A . 46 ILE HD12 1 1 9 6908 1 1 47 ILE HD13 H 0.052 0.615 -7.505 1.00 . A A . 46 ILE HD13 1 1 9 6909 1 1 47 ILE HG12 H -2.250 0.392 -6.718 1.00 . A A . 46 ILE HG12 1 1 9 6910 1 1 47 ILE HG13 H -2.680 1.884 -7.554 1.00 . A A . 46 ILE HG13 1 1 9 6911 1 1 47 ILE HG21 H -0.873 4.171 -5.334 1.00 . A A . 46 ILE HG21 1 1 9 6912 1 1 47 ILE HG22 H -1.905 4.045 -6.759 1.00 . A A . 46 ILE HG22 1 1 9 6913 1 1 47 ILE HG23 H -0.221 3.527 -6.841 1.00 . A A . 46 ILE HG23 1 1 9 6914 1 1 47 ILE N N -0.696 0.106 -4.648 1.00 . A A . 46 ILE N 1 1 9 6915 1 1 47 ILE O O -0.861 2.208 -2.738 1.00 . A A . 46 ILE O 1 1 9 6916 1 1 48 VAL C C 1.793 5.395 -3.290 1.00 . A A . 47 VAL C 1 1 9 6917 1 1 48 VAL CA C 1.177 4.106 -2.710 1.00 . A A . 47 VAL CA 1 1 9 6918 1 1 48 VAL CB C 2.093 3.505 -1.612 1.00 . A A . 47 VAL CB 1 1 9 6919 1 1 48 VAL CG1 C 3.439 3.062 -2.174 1.00 . A A . 47 VAL CG1 1 1 9 6920 1 1 48 VAL CG2 C 2.269 4.496 -0.469 1.00 . A A . 47 VAL CG2 1 1 9 6921 1 1 48 VAL H H 1.494 3.135 -4.553 1.00 . A A . 47 VAL H 1 1 9 6922 1 1 48 VAL HA H 0.228 4.358 -2.249 1.00 . A A . 47 VAL HA 1 1 9 6923 1 1 48 VAL HB H 1.600 2.630 -1.210 1.00 . A A . 47 VAL HB 1 1 9 6924 1 1 48 VAL HG11 H 4.055 2.677 -1.375 1.00 . A A . 47 VAL HG11 1 1 9 6925 1 1 48 VAL HG12 H 3.933 3.905 -2.635 1.00 . A A . 47 VAL HG12 1 1 9 6926 1 1 48 VAL HG13 H 3.285 2.290 -2.913 1.00 . A A . 47 VAL HG13 1 1 9 6927 1 1 48 VAL HG21 H 2.999 4.115 0.229 1.00 . A A . 47 VAL HG21 1 1 9 6928 1 1 48 VAL HG22 H 1.323 4.627 0.039 1.00 . A A . 47 VAL HG22 1 1 9 6929 1 1 48 VAL HG23 H 2.604 5.446 -0.861 1.00 . A A . 47 VAL HG23 1 1 9 6930 1 1 48 VAL N N 0.900 3.155 -3.769 1.00 . A A . 47 VAL N 1 1 9 6931 1 1 48 VAL O O 2.869 5.383 -3.894 1.00 . A A . 47 VAL O 1 1 9 6932 1 1 49 LYS C C 0.384 8.835 -3.315 1.00 . A A . 48 LYS C 1 1 9 6933 1 1 49 LYS CA C 1.516 7.835 -3.480 1.00 . A A . 48 LYS CA 1 1 9 6934 1 1 49 LYS CB C 2.100 7.955 -4.891 1.00 . A A . 48 LYS CB 1 1 9 6935 1 1 49 LYS CD C 3.699 9.826 -4.378 1.00 . A A . 48 LYS CD 1 1 9 6936 1 1 49 LYS CE C 4.136 11.234 -4.735 1.00 . A A . 48 LYS CE 1 1 9 6937 1 1 49 LYS CG C 2.556 9.359 -5.261 1.00 . A A . 48 LYS CG 1 1 9 6938 1 1 49 LYS H H 0.094 6.352 -2.956 1.00 . A A . 48 LYS H 1 1 9 6939 1 1 49 LYS HA H 2.287 8.065 -2.758 1.00 . A A . 48 LYS HA 1 1 9 6940 1 1 49 LYS HB2 H 2.955 7.302 -4.962 1.00 . A A . 48 LYS HB2 1 1 9 6941 1 1 49 LYS HB3 H 1.354 7.641 -5.606 1.00 . A A . 48 LYS HB3 1 1 9 6942 1 1 49 LYS HD2 H 3.377 9.810 -3.348 1.00 . A A . 48 LYS HD2 1 1 9 6943 1 1 49 LYS HD3 H 4.537 9.156 -4.506 1.00 . A A . 48 LYS HD3 1 1 9 6944 1 1 49 LYS HE2 H 4.476 11.245 -5.759 1.00 . A A . 48 LYS HE2 1 1 9 6945 1 1 49 LYS HE3 H 3.292 11.898 -4.627 1.00 . A A . 48 LYS HE3 1 1 9 6946 1 1 49 LYS HG2 H 2.887 9.360 -6.288 1.00 . A A . 48 LYS HG2 1 1 9 6947 1 1 49 LYS HG3 H 1.724 10.039 -5.148 1.00 . A A . 48 LYS HG3 1 1 9 6948 1 1 49 LYS HZ1 H 4.919 11.720 -2.861 1.00 . A A . 48 LYS HZ1 1 1 9 6949 1 1 49 LYS HZ2 H 5.532 12.660 -4.129 1.00 . A A . 48 LYS HZ2 1 1 9 6950 1 1 49 LYS HZ3 H 6.053 11.058 -3.934 1.00 . A A . 48 LYS HZ3 1 1 9 6951 1 1 49 LYS N N 1.030 6.475 -3.197 1.00 . A A . 48 LYS N 1 1 9 6952 1 1 49 LYS NZ N 5.235 11.701 -3.855 1.00 . A A . 48 LYS NZ 1 1 9 6953 1 1 49 LYS O O -0.619 8.765 -4.022 1.00 . A A . 48 LYS O 1 1 9 6954 1 1 50 LYS C C -0.350 11.957 -2.967 1.00 . A A . 49 LYS C 1 1 9 6955 1 1 50 LYS CA C -0.497 10.725 -2.081 1.00 . A A . 49 LYS CA 1 1 9 6956 1 1 50 LYS CB C -0.423 11.127 -0.602 1.00 . A A . 49 LYS CB 1 1 9 6957 1 1 50 LYS CD C -2.287 12.848 -0.711 1.00 . A A . 49 LYS CD 1 1 9 6958 1 1 50 LYS CE C -3.463 13.455 0.040 1.00 . A A . 49 LYS CE 1 1 9 6959 1 1 50 LYS CG C -1.737 11.621 0.003 1.00 . A A . 49 LYS CG 1 1 9 6960 1 1 50 LYS H H 1.393 9.798 -1.888 1.00 . A A . 49 LYS H 1 1 9 6961 1 1 50 LYS HA H -1.455 10.261 -2.276 1.00 . A A . 49 LYS HA 1 1 9 6962 1 1 50 LYS HB2 H -0.093 10.272 -0.030 1.00 . A A . 49 LYS HB2 1 1 9 6963 1 1 50 LYS HB3 H 0.309 11.914 -0.500 1.00 . A A . 49 LYS HB3 1 1 9 6964 1 1 50 LYS HD2 H -1.505 13.589 -0.790 1.00 . A A . 49 LYS HD2 1 1 9 6965 1 1 50 LYS HD3 H -2.614 12.561 -1.699 1.00 . A A . 49 LYS HD3 1 1 9 6966 1 1 50 LYS HE2 H -3.969 14.151 -0.611 1.00 . A A . 49 LYS HE2 1 1 9 6967 1 1 50 LYS HE3 H -4.142 12.661 0.318 1.00 . A A . 49 LYS HE3 1 1 9 6968 1 1 50 LYS HG2 H -2.468 10.828 -0.063 1.00 . A A . 49 LYS HG2 1 1 9 6969 1 1 50 LYS HG3 H -1.570 11.865 1.040 1.00 . A A . 49 LYS HG3 1 1 9 6970 1 1 50 LYS HZ1 H -2.416 14.980 1.012 1.00 . A A . 49 LYS HZ1 1 1 9 6971 1 1 50 LYS HZ2 H -2.486 13.531 1.891 1.00 . A A . 49 LYS HZ2 1 1 9 6972 1 1 50 LYS HZ3 H -3.855 14.530 1.792 1.00 . A A . 49 LYS HZ3 1 1 9 6973 1 1 50 LYS N N 0.546 9.758 -2.382 1.00 . A A . 49 LYS N 1 1 9 6974 1 1 50 LYS NZ N -3.028 14.171 1.269 1.00 . A A . 49 LYS NZ 1 1 9 6975 1 1 50 LYS O O 0.621 12.704 -2.845 1.00 . A A . 49 LYS O 1 1 9 6976 1 1 51 GLY C C -1.048 13.170 -6.104 1.00 . A A . 50 GLY C 1 1 9 6977 1 1 51 GLY CA C -1.344 13.381 -4.636 1.00 . A A . 50 GLY CA 1 1 9 6978 1 1 51 GLY H H -1.987 11.468 -4.006 1.00 . A A . 50 GLY H 1 1 9 6979 1 1 51 GLY HA2 H -2.326 13.819 -4.543 1.00 . A A . 50 GLY HA2 1 1 9 6980 1 1 51 GLY HA3 H -0.618 14.070 -4.231 1.00 . A A . 50 GLY HA3 1 1 9 6981 1 1 51 GLY N N -1.307 12.159 -3.862 1.00 . A A . 50 GLY N 1 1 9 6982 1 1 51 GLY O O 0.057 12.772 -6.477 1.00 . A A . 50 GLY O 1 1 9 6983 1 1 52 SER C C -1.254 14.737 -8.826 1.00 . A A . 51 SER C 1 1 9 6984 1 1 52 SER CA C -1.860 13.414 -8.376 1.00 . A A . 51 SER CA 1 1 9 6985 1 1 52 SER CB C -3.190 13.166 -9.091 1.00 . A A . 51 SER CB 1 1 9 6986 1 1 52 SER H H -2.928 13.643 -6.570 1.00 . A A . 51 SER H 1 1 9 6987 1 1 52 SER HA H -1.173 12.616 -8.615 1.00 . A A . 51 SER HA 1 1 9 6988 1 1 52 SER HB2 H -3.885 13.956 -8.844 1.00 . A A . 51 SER HB2 1 1 9 6989 1 1 52 SER HB3 H -3.025 13.155 -10.159 1.00 . A A . 51 SER HB3 1 1 9 6990 1 1 52 SER HG H -4.458 12.082 -8.054 1.00 . A A . 51 SER HG 1 1 9 6991 1 1 52 SER N N -2.045 13.431 -6.935 1.00 . A A . 51 SER N 1 1 9 6992 1 1 52 SER O O -1.945 15.771 -8.722 1.00 . A A . 51 SER O 1 1 9 6993 1 1 52 SER OG O -3.757 11.923 -8.704 1.00 . A A . 51 SER OG 1 1 10 6994 1 1 2 GLY C C 2.706 11.993 -9.232 1.00 . A A . 1 GLY C 1 1 10 6995 1 1 2 GLY CA C 2.699 13.342 -8.548 1.00 . A A . 1 GLY CA 1 1 10 6996 1 1 2 GLY H H 1.892 14.334 -10.189 1.00 . A A . 1 GLY H 1 1 10 6997 1 1 2 GLY HA2 H 3.685 13.777 -8.621 1.00 . A A . 1 GLY HA2 1 1 10 6998 1 1 2 GLY HA3 H 2.447 13.209 -7.507 1.00 . A A . 1 GLY HA3 1 1 10 6999 1 1 2 GLY N N 1.723 14.266 -9.163 1.00 . A A . 1 GLY N 1 1 10 7000 1 1 2 GLY O O 1.708 11.589 -9.837 1.00 . A A . 1 GLY O 1 1 10 7001 1 1 3 THR C C 3.364 8.902 -8.905 1.00 . A A . 2 THR C 1 1 10 7002 1 1 3 THR CA C 3.970 9.999 -9.770 1.00 . A A . 2 THR CA 1 1 10 7003 1 1 3 THR CB C 5.456 9.683 -10.044 1.00 . A A . 2 THR CB 1 1 10 7004 1 1 3 THR CG2 C 5.617 8.336 -10.741 1.00 . A A . 2 THR CG2 1 1 10 7005 1 1 3 THR H H 4.571 11.648 -8.596 1.00 . A A . 2 THR H 1 1 10 7006 1 1 3 THR HA H 3.448 10.029 -10.716 1.00 . A A . 2 THR HA 1 1 10 7007 1 1 3 THR HB H 5.979 9.649 -9.099 1.00 . A A . 2 THR HB 1 1 10 7008 1 1 3 THR HG1 H 6.413 11.402 -10.288 1.00 . A A . 2 THR HG1 1 1 10 7009 1 1 3 THR HG21 H 5.089 8.350 -11.683 1.00 . A A . 2 THR HG21 1 1 10 7010 1 1 3 THR HG22 H 5.209 7.557 -10.114 1.00 . A A . 2 THR HG22 1 1 10 7011 1 1 3 THR HG23 H 6.664 8.144 -10.917 1.00 . A A . 2 THR HG23 1 1 10 7012 1 1 3 THR N N 3.823 11.292 -9.133 1.00 . A A . 2 THR N 1 1 10 7013 1 1 3 THR O O 3.872 8.597 -7.820 1.00 . A A . 2 THR O 1 1 10 7014 1 1 3 THR OG1 O 6.031 10.715 -10.859 1.00 . A A . 2 THR OG1 1 1 10 7015 1 1 4 ASN C C 2.609 6.070 -8.533 1.00 . A A . 3 ASN C 1 1 10 7016 1 1 4 ASN CA C 1.621 7.218 -8.682 1.00 . A A . 3 ASN CA 1 1 10 7017 1 1 4 ASN CB C 0.351 6.756 -9.420 1.00 . A A . 3 ASN CB 1 1 10 7018 1 1 4 ASN CG C 0.587 6.389 -10.876 1.00 . A A . 3 ASN CG 1 1 10 7019 1 1 4 ASN H H 1.866 8.664 -10.209 1.00 . A A . 3 ASN H 1 1 10 7020 1 1 4 ASN HA H 1.345 7.563 -7.695 1.00 . A A . 3 ASN HA 1 1 10 7021 1 1 4 ASN HB2 H -0.048 5.887 -8.918 1.00 . A A . 3 ASN HB2 1 1 10 7022 1 1 4 ASN HB3 H -0.383 7.550 -9.384 1.00 . A A . 3 ASN HB3 1 1 10 7023 1 1 4 ASN HD21 H 0.850 4.484 -10.389 1.00 . A A . 3 ASN HD21 1 1 10 7024 1 1 4 ASN HD22 H 1.002 4.856 -12.068 1.00 . A A . 3 ASN HD22 1 1 10 7025 1 1 4 ASN N N 2.257 8.332 -9.375 1.00 . A A . 3 ASN N 1 1 10 7026 1 1 4 ASN ND2 N 0.834 5.114 -11.137 1.00 . A A . 3 ASN ND2 1 1 10 7027 1 1 4 ASN O O 3.128 5.550 -9.517 1.00 . A A . 3 ASN O 1 1 10 7028 1 1 4 ASN OD1 O 0.528 7.244 -11.760 1.00 . A A . 3 ASN OD1 1 1 10 7029 1 1 5 THR C C 3.201 3.412 -6.588 1.00 . A A . 4 THR C 1 1 10 7030 1 1 5 THR CA C 3.885 4.692 -7.049 1.00 . A A . 4 THR CA 1 1 10 7031 1 1 5 THR CB C 4.866 5.220 -5.980 1.00 . A A . 4 THR CB 1 1 10 7032 1 1 5 THR CG2 C 5.991 4.235 -5.698 1.00 . A A . 4 THR CG2 1 1 10 7033 1 1 5 THR H H 2.407 6.078 -6.535 1.00 . A A . 4 THR H 1 1 10 7034 1 1 5 THR HA H 4.429 4.504 -7.962 1.00 . A A . 4 THR HA 1 1 10 7035 1 1 5 THR HB H 4.312 5.389 -5.066 1.00 . A A . 4 THR HB 1 1 10 7036 1 1 5 THR HG1 H 4.801 6.893 -7.033 1.00 . A A . 4 THR HG1 1 1 10 7037 1 1 5 THR HG21 H 6.539 4.042 -6.608 1.00 . A A . 4 THR HG21 1 1 10 7038 1 1 5 THR HG22 H 5.575 3.311 -5.324 1.00 . A A . 4 THR HG22 1 1 10 7039 1 1 5 THR HG23 H 6.658 4.653 -4.958 1.00 . A A . 4 THR HG23 1 1 10 7040 1 1 5 THR N N 2.891 5.692 -7.303 1.00 . A A . 4 THR N 1 1 10 7041 1 1 5 THR O O 2.043 3.439 -6.167 1.00 . A A . 4 THR O 1 1 10 7042 1 1 5 THR OG1 O 5.417 6.472 -6.420 1.00 . A A . 4 THR OG1 1 1 10 7043 1 1 6 TYR C C 4.492 0.379 -5.384 1.00 . A A . 5 TYR C 1 1 10 7044 1 1 6 TYR CA C 3.378 1.066 -6.153 1.00 . A A . 5 TYR CA 1 1 10 7045 1 1 6 TYR CB C 2.775 0.132 -7.213 1.00 . A A . 5 TYR CB 1 1 10 7046 1 1 6 TYR CD1 C 4.790 -0.302 -8.688 1.00 . A A . 5 TYR CD1 1 1 10 7047 1 1 6 TYR CD2 C 2.826 0.603 -9.684 1.00 . A A . 5 TYR CD2 1 1 10 7048 1 1 6 TYR CE1 C 5.423 -0.287 -9.916 1.00 . A A . 5 TYR CE1 1 1 10 7049 1 1 6 TYR CE2 C 3.450 0.619 -10.915 1.00 . A A . 5 TYR CE2 1 1 10 7050 1 1 6 TYR CG C 3.483 0.144 -8.552 1.00 . A A . 5 TYR CG 1 1 10 7051 1 1 6 TYR CZ C 4.749 0.173 -11.027 1.00 . A A . 5 TYR CZ 1 1 10 7052 1 1 6 TYR H H 4.709 2.292 -7.238 1.00 . A A . 5 TYR H 1 1 10 7053 1 1 6 TYR HA H 2.596 1.346 -5.447 1.00 . A A . 5 TYR HA 1 1 10 7054 1 1 6 TYR HB2 H 2.801 -0.881 -6.841 1.00 . A A . 5 TYR HB2 1 1 10 7055 1 1 6 TYR HB3 H 1.748 0.417 -7.382 1.00 . A A . 5 TYR HB3 1 1 10 7056 1 1 6 TYR HD1 H 5.314 -0.665 -7.818 1.00 . A A . 5 TYR HD1 1 1 10 7057 1 1 6 TYR HD2 H 1.809 0.953 -9.592 1.00 . A A . 5 TYR HD2 1 1 10 7058 1 1 6 TYR HE1 H 6.440 -0.636 -10.001 1.00 . A A . 5 TYR HE1 1 1 10 7059 1 1 6 TYR HE2 H 2.917 0.982 -11.783 1.00 . A A . 5 TYR HE2 1 1 10 7060 1 1 6 TYR HH H 5.977 -0.565 -12.313 1.00 . A A . 5 TYR HH 1 1 10 7061 1 1 6 TYR N N 3.867 2.294 -6.735 1.00 . A A . 5 TYR N 1 1 10 7062 1 1 6 TYR O O 5.674 0.513 -5.717 1.00 . A A . 5 TYR O 1 1 10 7063 1 1 6 TYR OH O 5.378 0.191 -12.252 1.00 . A A . 5 TYR OH 1 1 10 7064 1 1 7 TYR C C 4.709 -2.446 -3.304 1.00 . A A . 6 TYR C 1 1 10 7065 1 1 7 TYR CA C 5.061 -0.976 -3.472 1.00 . A A . 6 TYR CA 1 1 10 7066 1 1 7 TYR CB C 5.061 -0.210 -2.136 1.00 . A A . 6 TYR CB 1 1 10 7067 1 1 7 TYR CD1 C 6.711 -1.172 -0.469 1.00 . A A . 6 TYR CD1 1 1 10 7068 1 1 7 TYR CD2 C 4.388 -1.594 -0.151 1.00 . A A . 6 TYR CD2 1 1 10 7069 1 1 7 TYR CE1 C 6.994 -1.884 0.683 1.00 . A A . 6 TYR CE1 1 1 10 7070 1 1 7 TYR CE2 C 4.661 -2.307 0.991 1.00 . A A . 6 TYR CE2 1 1 10 7071 1 1 7 TYR CG C 5.400 -1.012 -0.901 1.00 . A A . 6 TYR CG 1 1 10 7072 1 1 7 TYR CZ C 5.962 -2.454 1.402 1.00 . A A . 6 TYR CZ 1 1 10 7073 1 1 7 TYR H H 3.147 -0.455 -4.182 1.00 . A A . 6 TYR H 1 1 10 7074 1 1 7 TYR HA H 6.041 -0.899 -3.923 1.00 . A A . 6 TYR HA 1 1 10 7075 1 1 7 TYR HB2 H 5.778 0.592 -2.201 1.00 . A A . 6 TYR HB2 1 1 10 7076 1 1 7 TYR HB3 H 4.080 0.216 -1.987 1.00 . A A . 6 TYR HB3 1 1 10 7077 1 1 7 TYR HD1 H 7.513 -0.729 -1.040 1.00 . A A . 6 TYR HD1 1 1 10 7078 1 1 7 TYR HD2 H 3.368 -1.477 -0.477 1.00 . A A . 6 TYR HD2 1 1 10 7079 1 1 7 TYR HE1 H 8.018 -2.002 1.009 1.00 . A A . 6 TYR HE1 1 1 10 7080 1 1 7 TYR HE2 H 3.854 -2.750 1.557 1.00 . A A . 6 TYR HE2 1 1 10 7081 1 1 7 TYR HH H 6.658 -2.587 3.190 1.00 . A A . 6 TYR HH 1 1 10 7082 1 1 7 TYR N N 4.110 -0.342 -4.357 1.00 . A A . 6 TYR N 1 1 10 7083 1 1 7 TYR O O 3.534 -2.808 -3.257 1.00 . A A . 6 TYR O 1 1 10 7084 1 1 7 TYR OH O 6.229 -3.168 2.542 1.00 . A A . 6 TYR OH 1 1 10 7085 1 1 8 THR C C 5.453 -4.925 -1.509 1.00 . A A . 7 THR C 1 1 10 7086 1 1 8 THR CA C 5.515 -4.699 -3.000 1.00 . A A . 7 THR CA 1 1 10 7087 1 1 8 THR CB C 6.621 -5.570 -3.611 1.00 . A A . 7 THR CB 1 1 10 7088 1 1 8 THR CG2 C 6.201 -6.089 -4.971 1.00 . A A . 7 THR CG2 1 1 10 7089 1 1 8 THR H H 6.630 -2.973 -3.455 1.00 . A A . 7 THR H 1 1 10 7090 1 1 8 THR HA H 4.571 -4.992 -3.436 1.00 . A A . 7 THR HA 1 1 10 7091 1 1 8 THR HB H 6.787 -6.415 -2.959 1.00 . A A . 7 THR HB 1 1 10 7092 1 1 8 THR HG1 H 8.523 -5.363 -4.134 1.00 . A A . 7 THR HG1 1 1 10 7093 1 1 8 THR HG21 H 6.020 -5.257 -5.634 1.00 . A A . 7 THR HG21 1 1 10 7094 1 1 8 THR HG22 H 5.296 -6.670 -4.862 1.00 . A A . 7 THR HG22 1 1 10 7095 1 1 8 THR HG23 H 6.984 -6.712 -5.377 1.00 . A A . 7 THR HG23 1 1 10 7096 1 1 8 THR N N 5.720 -3.295 -3.283 1.00 . A A . 7 THR N 1 1 10 7097 1 1 8 THR O O 6.401 -4.611 -0.789 1.00 . A A . 7 THR O 1 1 10 7098 1 1 8 THR OG1 O 7.840 -4.819 -3.708 1.00 . A A . 7 THR OG1 1 1 10 7099 1 1 9 VAL C C 5.239 -6.538 0.945 1.00 . A A . 8 VAL C 1 1 10 7100 1 1 9 VAL CA C 4.114 -5.686 0.362 1.00 . A A . 8 VAL CA 1 1 10 7101 1 1 9 VAL CB C 2.757 -6.367 0.616 1.00 . A A . 8 VAL CB 1 1 10 7102 1 1 9 VAL CG1 C 2.528 -6.545 2.109 1.00 . A A . 8 VAL CG1 1 1 10 7103 1 1 9 VAL CG2 C 1.619 -5.564 -0.019 1.00 . A A . 8 VAL CG2 1 1 10 7104 1 1 9 VAL H H 3.637 -5.725 -1.701 1.00 . A A . 8 VAL H 1 1 10 7105 1 1 9 VAL HA H 4.104 -4.722 0.857 1.00 . A A . 8 VAL HA 1 1 10 7106 1 1 9 VAL HB H 2.776 -7.346 0.158 1.00 . A A . 8 VAL HB 1 1 10 7107 1 1 9 VAL HG11 H 3.321 -7.151 2.525 1.00 . A A . 8 VAL HG11 1 1 10 7108 1 1 9 VAL HG12 H 1.579 -7.034 2.272 1.00 . A A . 8 VAL HG12 1 1 10 7109 1 1 9 VAL HG13 H 2.523 -5.579 2.589 1.00 . A A . 8 VAL HG13 1 1 10 7110 1 1 9 VAL HG21 H 1.806 -5.441 -1.078 1.00 . A A . 8 VAL HG21 1 1 10 7111 1 1 9 VAL HG22 H 1.557 -4.591 0.445 1.00 . A A . 8 VAL HG22 1 1 10 7112 1 1 9 VAL HG23 H 0.684 -6.087 0.121 1.00 . A A . 8 VAL HG23 1 1 10 7113 1 1 9 VAL N N 4.337 -5.466 -1.055 1.00 . A A . 8 VAL N 1 1 10 7114 1 1 9 VAL O O 5.549 -7.616 0.437 1.00 . A A . 8 VAL O 1 1 10 7115 1 1 10 LYS C C 6.483 -7.458 3.829 1.00 . A A . 9 LYS C 1 1 10 7116 1 1 10 LYS CA C 6.987 -6.672 2.638 1.00 . A A . 9 LYS CA 1 1 10 7117 1 1 10 LYS CB C 8.034 -5.651 3.083 1.00 . A A . 9 LYS CB 1 1 10 7118 1 1 10 LYS CD C 9.550 -5.549 1.055 1.00 . A A . 9 LYS CD 1 1 10 7119 1 1 10 LYS CE C 8.852 -6.550 0.145 1.00 . A A . 9 LYS CE 1 1 10 7120 1 1 10 LYS CG C 9.433 -5.910 2.533 1.00 . A A . 9 LYS CG 1 1 10 7121 1 1 10 LYS H H 5.561 -5.154 2.335 1.00 . A A . 9 LYS H 1 1 10 7122 1 1 10 LYS HA H 7.435 -7.355 1.931 1.00 . A A . 9 LYS HA 1 1 10 7123 1 1 10 LYS HB2 H 7.721 -4.670 2.758 1.00 . A A . 9 LYS HB2 1 1 10 7124 1 1 10 LYS HB3 H 8.088 -5.661 4.161 1.00 . A A . 9 LYS HB3 1 1 10 7125 1 1 10 LYS HD2 H 9.107 -4.576 0.901 1.00 . A A . 9 LYS HD2 1 1 10 7126 1 1 10 LYS HD3 H 10.596 -5.510 0.791 1.00 . A A . 9 LYS HD3 1 1 10 7127 1 1 10 LYS HE2 H 9.351 -7.503 0.225 1.00 . A A . 9 LYS HE2 1 1 10 7128 1 1 10 LYS HE3 H 7.821 -6.658 0.459 1.00 . A A . 9 LYS HE3 1 1 10 7129 1 1 10 LYS HG2 H 10.143 -5.319 3.092 1.00 . A A . 9 LYS HG2 1 1 10 7130 1 1 10 LYS HG3 H 9.663 -6.958 2.653 1.00 . A A . 9 LYS HG3 1 1 10 7131 1 1 10 LYS HZ1 H 8.325 -5.236 -1.385 1.00 . A A . 9 LYS HZ1 1 1 10 7132 1 1 10 LYS HZ2 H 8.477 -6.851 -1.884 1.00 . A A . 9 LYS HZ2 1 1 10 7133 1 1 10 LYS HZ3 H 9.862 -5.925 -1.568 1.00 . A A . 9 LYS HZ3 1 1 10 7134 1 1 10 LYS N N 5.869 -6.017 1.981 1.00 . A A . 9 LYS N 1 1 10 7135 1 1 10 LYS NZ N 8.879 -6.111 -1.270 1.00 . A A . 9 LYS NZ 1 1 10 7136 1 1 10 LYS O O 5.272 -7.616 3.985 1.00 . A A . 9 LYS O 1 1 10 7137 1 1 11 SER C C 6.402 -7.658 6.828 1.00 . A A . 10 SER C 1 1 10 7138 1 1 11 SER CA C 7.079 -8.666 5.878 1.00 . A A . 10 SER CA 1 1 10 7139 1 1 11 SER CB C 8.354 -9.230 6.504 1.00 . A A . 10 SER CB 1 1 10 7140 1 1 11 SER H H 8.337 -8.051 4.295 1.00 . A A . 10 SER H 1 1 10 7141 1 1 11 SER HA H 6.394 -9.477 5.684 1.00 . A A . 10 SER HA 1 1 10 7142 1 1 11 SER HB2 H 8.958 -8.419 6.888 1.00 . A A . 10 SER HB2 1 1 10 7143 1 1 11 SER HB3 H 8.093 -9.900 7.310 1.00 . A A . 10 SER HB3 1 1 10 7144 1 1 11 SER HG H 9.390 -10.793 5.908 1.00 . A A . 10 SER HG 1 1 10 7145 1 1 11 SER N N 7.406 -8.037 4.599 1.00 . A A . 10 SER N 1 1 10 7146 1 1 11 SER O O 6.966 -7.237 7.843 1.00 . A A . 10 SER O 1 1 10 7147 1 1 11 SER OG O 9.105 -9.945 5.534 1.00 . A A . 10 SER OG 1 1 10 7148 1 1 12 GLY C C 3.046 -6.249 6.476 1.00 . A A . 11 GLY C 1 1 10 7149 1 1 12 GLY CA C 4.398 -6.303 7.145 1.00 . A A . 11 GLY CA 1 1 10 7150 1 1 12 GLY H H 4.828 -7.685 5.630 1.00 . A A . 11 GLY H 1 1 10 7151 1 1 12 GLY HA2 H 4.288 -6.590 8.184 1.00 . A A . 11 GLY HA2 1 1 10 7152 1 1 12 GLY HA3 H 4.868 -5.335 7.079 1.00 . A A . 11 GLY HA3 1 1 10 7153 1 1 12 GLY N N 5.196 -7.285 6.451 1.00 . A A . 11 GLY N 1 1 10 7154 1 1 12 GLY O O 2.504 -5.185 6.204 1.00 . A A . 11 GLY O 1 1 10 7155 1 1 13 ASP C C 0.079 -6.973 5.799 1.00 . A A . 12 ASP C 1 1 10 7156 1 1 13 ASP CA C 1.345 -7.748 5.420 1.00 . A A . 12 ASP CA 1 1 10 7157 1 1 13 ASP CB C 1.060 -9.244 5.488 1.00 . A A . 12 ASP CB 1 1 10 7158 1 1 13 ASP CG C 0.779 -9.706 6.904 1.00 . A A . 12 ASP CG 1 1 10 7159 1 1 13 ASP H H 2.996 -8.215 6.640 1.00 . A A . 12 ASP H 1 1 10 7160 1 1 13 ASP HA H 1.591 -7.506 4.399 1.00 . A A . 12 ASP HA 1 1 10 7161 1 1 13 ASP HB2 H 0.202 -9.470 4.873 1.00 . A A . 12 ASP HB2 1 1 10 7162 1 1 13 ASP HB3 H 1.921 -9.781 5.113 1.00 . A A . 12 ASP HB3 1 1 10 7163 1 1 13 ASP N N 2.536 -7.449 6.233 1.00 . A A . 12 ASP N 1 1 10 7164 1 1 13 ASP O O -0.975 -7.183 5.204 1.00 . A A . 12 ASP O 1 1 10 7165 1 1 13 ASP OD1 O 1.741 -9.809 7.698 1.00 . A A . 12 ASP OD1 1 1 10 7166 1 1 13 ASP OD2 O -0.397 -9.951 7.236 1.00 . A A . 12 ASP OD2 1 1 10 7167 1 1 14 THR C C -1.037 -4.015 7.019 1.00 . A A . 13 THR C 1 1 10 7168 1 1 14 THR CA C -1.060 -5.510 7.311 1.00 . A A . 13 THR CA 1 1 10 7169 1 1 14 THR CB C -1.198 -5.775 8.824 1.00 . A A . 13 THR CB 1 1 10 7170 1 1 14 THR CG2 C -2.578 -5.380 9.331 1.00 . A A . 13 THR CG2 1 1 10 7171 1 1 14 THR H H 1.020 -5.842 7.138 1.00 . A A . 13 THR H 1 1 10 7172 1 1 14 THR HA H -1.907 -5.953 6.802 1.00 . A A . 13 THR HA 1 1 10 7173 1 1 14 THR HB H -0.453 -5.194 9.350 1.00 . A A . 13 THR HB 1 1 10 7174 1 1 14 THR HG1 H -1.106 -7.671 8.262 1.00 . A A . 13 THR HG1 1 1 10 7175 1 1 14 THR HG21 H -2.645 -5.588 10.387 1.00 . A A . 13 THR HG21 1 1 10 7176 1 1 14 THR HG22 H -3.331 -5.947 8.802 1.00 . A A . 13 THR HG22 1 1 10 7177 1 1 14 THR HG23 H -2.735 -4.326 9.159 1.00 . A A . 13 THR HG23 1 1 10 7178 1 1 14 THR N N 0.142 -6.125 6.797 1.00 . A A . 13 THR N 1 1 10 7179 1 1 14 THR O O 0.028 -3.394 7.004 1.00 . A A . 13 THR O 1 1 10 7180 1 1 14 THR OG1 O -0.982 -7.171 9.083 1.00 . A A . 13 THR OG1 1 1 10 7181 1 1 15 LEU C C -1.595 -1.079 7.089 1.00 . A A . 14 LEU C 1 1 10 7182 1 1 15 LEU CA C -2.360 -2.097 6.263 1.00 . A A . 14 LEU CA 1 1 10 7183 1 1 15 LEU CB C -3.835 -1.709 6.251 1.00 . A A . 14 LEU CB 1 1 10 7184 1 1 15 LEU CD1 C -6.196 -2.319 5.700 1.00 . A A . 14 LEU CD1 1 1 10 7185 1 1 15 LEU CD2 C -4.481 -2.232 3.901 1.00 . A A . 14 LEU CD2 1 1 10 7186 1 1 15 LEU CG C -4.736 -2.558 5.360 1.00 . A A . 14 LEU CG 1 1 10 7187 1 1 15 LEU H H -3.032 -3.963 6.988 1.00 . A A . 14 LEU H 1 1 10 7188 1 1 15 LEU HA H -1.986 -2.088 5.253 1.00 . A A . 14 LEU HA 1 1 10 7189 1 1 15 LEU HB2 H -4.207 -1.769 7.263 1.00 . A A . 14 LEU HB2 1 1 10 7190 1 1 15 LEU HB3 H -3.908 -0.683 5.921 1.00 . A A . 14 LEU HB3 1 1 10 7191 1 1 15 LEU HD11 H -6.820 -2.905 5.040 1.00 . A A . 14 LEU HD11 1 1 10 7192 1 1 15 LEU HD12 H -6.427 -1.270 5.577 1.00 . A A . 14 LEU HD12 1 1 10 7193 1 1 15 LEU HD13 H -6.380 -2.611 6.723 1.00 . A A . 14 LEU HD13 1 1 10 7194 1 1 15 LEU HD21 H -5.088 -2.870 3.277 1.00 . A A . 14 LEU HD21 1 1 10 7195 1 1 15 LEU HD22 H -3.436 -2.392 3.673 1.00 . A A . 14 LEU HD22 1 1 10 7196 1 1 15 LEU HD23 H -4.735 -1.199 3.715 1.00 . A A . 14 LEU HD23 1 1 10 7197 1 1 15 LEU HG H -4.516 -3.603 5.519 1.00 . A A . 14 LEU HG 1 1 10 7198 1 1 15 LEU N N -2.219 -3.451 6.791 1.00 . A A . 14 LEU N 1 1 10 7199 1 1 15 LEU O O -0.857 -0.262 6.545 1.00 . A A . 14 LEU O 1 1 10 7200 1 1 16 ASN C C 0.398 -0.313 9.284 1.00 . A A . 15 ASN C 1 1 10 7201 1 1 16 ASN CA C -1.125 -0.187 9.290 1.00 . A A . 15 ASN CA 1 1 10 7202 1 1 16 ASN CB C -1.680 -0.319 10.720 1.00 . A A . 15 ASN CB 1 1 10 7203 1 1 16 ASN CG C -1.697 -1.745 11.247 1.00 . A A . 15 ASN CG 1 1 10 7204 1 1 16 ASN H H -2.318 -1.862 8.777 1.00 . A A . 15 ASN H 1 1 10 7205 1 1 16 ASN HA H -1.379 0.796 8.920 1.00 . A A . 15 ASN HA 1 1 10 7206 1 1 16 ASN HB2 H -1.073 0.273 11.384 1.00 . A A . 15 ASN HB2 1 1 10 7207 1 1 16 ASN HB3 H -2.692 0.063 10.735 1.00 . A A . 15 ASN HB3 1 1 10 7208 1 1 16 ASN HD21 H -3.321 -1.347 12.323 1.00 . A A . 15 ASN HD21 1 1 10 7209 1 1 16 ASN HD22 H -2.709 -2.961 12.450 1.00 . A A . 15 ASN HD22 1 1 10 7210 1 1 16 ASN N N -1.754 -1.149 8.399 1.00 . A A . 15 ASN N 1 1 10 7211 1 1 16 ASN ND2 N -2.673 -2.049 12.090 1.00 . A A . 15 ASN ND2 1 1 10 7212 1 1 16 ASN O O 1.104 0.676 9.476 1.00 . A A . 15 ASN O 1 1 10 7213 1 1 16 ASN OD1 O -0.855 -2.572 10.894 1.00 . A A . 15 ASN OD1 1 1 10 7214 1 1 17 LYS C C 3.031 -1.149 7.866 1.00 . A A . 16 LYS C 1 1 10 7215 1 1 17 LYS CA C 2.349 -1.736 9.097 1.00 . A A . 16 LYS CA 1 1 10 7216 1 1 17 LYS CB C 2.656 -3.232 9.217 1.00 . A A . 16 LYS CB 1 1 10 7217 1 1 17 LYS CD C 4.890 -2.847 10.350 1.00 . A A . 16 LYS CD 1 1 10 7218 1 1 17 LYS CE C 4.391 -3.252 11.729 1.00 . A A . 16 LYS CE 1 1 10 7219 1 1 17 LYS CG C 4.144 -3.566 9.232 1.00 . A A . 16 LYS CG 1 1 10 7220 1 1 17 LYS H H 0.309 -2.262 8.810 1.00 . A A . 16 LYS H 1 1 10 7221 1 1 17 LYS HA H 2.728 -1.233 9.972 1.00 . A A . 16 LYS HA 1 1 10 7222 1 1 17 LYS HB2 H 2.219 -3.601 10.133 1.00 . A A . 16 LYS HB2 1 1 10 7223 1 1 17 LYS HB3 H 2.204 -3.747 8.383 1.00 . A A . 16 LYS HB3 1 1 10 7224 1 1 17 LYS HD2 H 5.939 -3.089 10.277 1.00 . A A . 16 LYS HD2 1 1 10 7225 1 1 17 LYS HD3 H 4.758 -1.781 10.227 1.00 . A A . 16 LYS HD3 1 1 10 7226 1 1 17 LYS HE2 H 3.346 -2.994 11.812 1.00 . A A . 16 LYS HE2 1 1 10 7227 1 1 17 LYS HE3 H 4.510 -4.319 11.843 1.00 . A A . 16 LYS HE3 1 1 10 7228 1 1 17 LYS HG2 H 4.258 -4.629 9.369 1.00 . A A . 16 LYS HG2 1 1 10 7229 1 1 17 LYS HG3 H 4.573 -3.277 8.284 1.00 . A A . 16 LYS HG3 1 1 10 7230 1 1 17 LYS HZ1 H 6.151 -2.841 12.778 1.00 . A A . 16 LYS HZ1 1 1 10 7231 1 1 17 LYS HZ2 H 4.757 -2.816 13.742 1.00 . A A . 16 LYS HZ2 1 1 10 7232 1 1 17 LYS HZ3 H 5.083 -1.526 12.687 1.00 . A A . 16 LYS HZ3 1 1 10 7233 1 1 17 LYS N N 0.909 -1.517 9.052 1.00 . A A . 16 LYS N 1 1 10 7234 1 1 17 LYS NZ N 5.145 -2.562 12.809 1.00 . A A . 16 LYS NZ 1 1 10 7235 1 1 17 LYS O O 4.017 -0.412 7.975 1.00 . A A . 16 LYS O 1 1 10 7236 1 1 18 ILE C C 2.829 0.500 5.231 1.00 . A A . 17 ILE C 1 1 10 7237 1 1 18 ILE CA C 3.072 -0.987 5.455 1.00 . A A . 17 ILE CA 1 1 10 7238 1 1 18 ILE CB C 2.578 -1.794 4.237 1.00 . A A . 17 ILE CB 1 1 10 7239 1 1 18 ILE CD1 C 0.549 -2.665 2.992 1.00 . A A . 17 ILE CD1 1 1 10 7240 1 1 18 ILE CG1 C 1.063 -1.994 4.248 1.00 . A A . 17 ILE CG1 1 1 10 7241 1 1 18 ILE CG2 C 3.289 -3.133 4.171 1.00 . A A . 17 ILE CG2 1 1 10 7242 1 1 18 ILE H H 1.660 -1.986 6.676 1.00 . A A . 17 ILE H 1 1 10 7243 1 1 18 ILE HA H 4.139 -1.142 5.537 1.00 . A A . 17 ILE HA 1 1 10 7244 1 1 18 ILE HB H 2.841 -1.247 3.360 1.00 . A A . 17 ILE HB 1 1 10 7245 1 1 18 ILE HD11 H -0.504 -2.884 3.101 1.00 . A A . 17 ILE HD11 1 1 10 7246 1 1 18 ILE HD12 H 1.099 -3.584 2.825 1.00 . A A . 17 ILE HD12 1 1 10 7247 1 1 18 ILE HD13 H 0.695 -2.006 2.149 1.00 . A A . 17 ILE HD13 1 1 10 7248 1 1 18 ILE HG12 H 0.788 -2.612 5.093 1.00 . A A . 17 ILE HG12 1 1 10 7249 1 1 18 ILE HG13 H 0.578 -1.032 4.336 1.00 . A A . 17 ILE HG13 1 1 10 7250 1 1 18 ILE HG21 H 2.925 -3.692 3.322 1.00 . A A . 17 ILE HG21 1 1 10 7251 1 1 18 ILE HG22 H 3.094 -3.685 5.077 1.00 . A A . 17 ILE HG22 1 1 10 7252 1 1 18 ILE HG23 H 4.352 -2.971 4.068 1.00 . A A . 17 ILE HG23 1 1 10 7253 1 1 18 ILE N N 2.480 -1.444 6.700 1.00 . A A . 17 ILE N 1 1 10 7254 1 1 18 ILE O O 3.717 1.217 4.780 1.00 . A A . 17 ILE O 1 1 10 7255 1 1 19 ALA C C 2.227 3.238 6.258 1.00 . A A . 18 ALA C 1 1 10 7256 1 1 19 ALA CA C 1.288 2.372 5.432 1.00 . A A . 18 ALA CA 1 1 10 7257 1 1 19 ALA CB C -0.139 2.610 5.876 1.00 . A A . 18 ALA CB 1 1 10 7258 1 1 19 ALA H H 0.947 0.325 5.867 1.00 . A A . 18 ALA H 1 1 10 7259 1 1 19 ALA HA H 1.372 2.653 4.393 1.00 . A A . 18 ALA HA 1 1 10 7260 1 1 19 ALA HB1 H -0.225 2.374 6.926 1.00 . A A . 18 ALA HB1 1 1 10 7261 1 1 19 ALA HB2 H -0.803 1.979 5.307 1.00 . A A . 18 ALA HB2 1 1 10 7262 1 1 19 ALA HB3 H -0.396 3.647 5.718 1.00 . A A . 18 ALA HB3 1 1 10 7263 1 1 19 ALA N N 1.628 0.957 5.555 1.00 . A A . 18 ALA N 1 1 10 7264 1 1 19 ALA O O 2.791 4.213 5.762 1.00 . A A . 18 ALA O 1 1 10 7265 1 1 20 ALA C C 4.735 3.458 8.007 1.00 . A A . 19 ALA C 1 1 10 7266 1 1 20 ALA CA C 3.275 3.612 8.411 1.00 . A A . 19 ALA CA 1 1 10 7267 1 1 20 ALA CB C 3.066 3.170 9.851 1.00 . A A . 19 ALA CB 1 1 10 7268 1 1 20 ALA H H 1.951 2.060 7.852 1.00 . A A . 19 ALA H 1 1 10 7269 1 1 20 ALA HA H 3.003 4.656 8.337 1.00 . A A . 19 ALA HA 1 1 10 7270 1 1 20 ALA HB1 H 2.022 3.279 10.112 1.00 . A A . 19 ALA HB1 1 1 10 7271 1 1 20 ALA HB2 H 3.667 3.781 10.507 1.00 . A A . 19 ALA HB2 1 1 10 7272 1 1 20 ALA HB3 H 3.356 2.136 9.956 1.00 . A A . 19 ALA HB3 1 1 10 7273 1 1 20 ALA N N 2.411 2.861 7.516 1.00 . A A . 19 ALA N 1 1 10 7274 1 1 20 ALA O O 5.566 4.311 8.315 1.00 . A A . 19 ALA O 1 1 10 7275 1 1 21 GLN C C 6.928 3.213 5.942 1.00 . A A . 20 GLN C 1 1 10 7276 1 1 21 GLN CA C 6.399 2.102 6.854 1.00 . A A . 20 GLN CA 1 1 10 7277 1 1 21 GLN CB C 6.470 0.753 6.137 1.00 . A A . 20 GLN CB 1 1 10 7278 1 1 21 GLN CD C 7.906 -0.966 4.967 1.00 . A A . 20 GLN CD 1 1 10 7279 1 1 21 GLN CG C 7.869 0.378 5.667 1.00 . A A . 20 GLN CG 1 1 10 7280 1 1 21 GLN H H 4.315 1.735 7.071 1.00 . A A . 20 GLN H 1 1 10 7281 1 1 21 GLN HA H 7.022 2.059 7.736 1.00 . A A . 20 GLN HA 1 1 10 7282 1 1 21 GLN HB2 H 6.124 -0.015 6.813 1.00 . A A . 20 GLN HB2 1 1 10 7283 1 1 21 GLN HB3 H 5.819 0.783 5.276 1.00 . A A . 20 GLN HB3 1 1 10 7284 1 1 21 GLN HE21 H 9.776 -1.263 5.568 1.00 . A A . 20 GLN HE21 1 1 10 7285 1 1 21 GLN HE22 H 9.070 -2.537 4.638 1.00 . A A . 20 GLN HE22 1 1 10 7286 1 1 21 GLN HG2 H 8.221 1.133 4.980 1.00 . A A . 20 GLN HG2 1 1 10 7287 1 1 21 GLN HG3 H 8.524 0.339 6.525 1.00 . A A . 20 GLN HG3 1 1 10 7288 1 1 21 GLN N N 5.035 2.376 7.295 1.00 . A A . 20 GLN N 1 1 10 7289 1 1 21 GLN NE2 N 9.030 -1.655 5.062 1.00 . A A . 20 GLN NE2 1 1 10 7290 1 1 21 GLN O O 8.084 3.620 6.060 1.00 . A A . 20 GLN O 1 1 10 7291 1 1 21 GLN OE1 O 6.933 -1.380 4.341 1.00 . A A . 20 GLN OE1 1 1 10 7292 1 1 22 TYR C C 5.821 6.108 4.536 1.00 . A A . 21 TYR C 1 1 10 7293 1 1 22 TYR CA C 6.503 4.799 4.155 1.00 . A A . 21 TYR CA 1 1 10 7294 1 1 22 TYR CB C 6.271 4.473 2.670 1.00 . A A . 21 TYR CB 1 1 10 7295 1 1 22 TYR CD1 C 3.800 3.908 2.634 1.00 . A A . 21 TYR CD1 1 1 10 7296 1 1 22 TYR CD2 C 5.352 2.296 1.812 1.00 . A A . 21 TYR CD2 1 1 10 7297 1 1 22 TYR CE1 C 2.756 3.052 2.336 1.00 . A A . 21 TYR CE1 1 1 10 7298 1 1 22 TYR CE2 C 4.313 1.439 1.514 1.00 . A A . 21 TYR CE2 1 1 10 7299 1 1 22 TYR CG C 5.116 3.543 2.376 1.00 . A A . 21 TYR CG 1 1 10 7300 1 1 22 TYR CZ C 3.018 1.819 1.780 1.00 . A A . 21 TYR CZ 1 1 10 7301 1 1 22 TYR H H 5.189 3.324 4.946 1.00 . A A . 21 TYR H 1 1 10 7302 1 1 22 TYR HA H 7.566 4.930 4.306 1.00 . A A . 21 TYR HA 1 1 10 7303 1 1 22 TYR HB2 H 6.085 5.393 2.139 1.00 . A A . 21 TYR HB2 1 1 10 7304 1 1 22 TYR HB3 H 7.168 4.018 2.274 1.00 . A A . 21 TYR HB3 1 1 10 7305 1 1 22 TYR HD1 H 3.597 4.873 3.074 1.00 . A A . 21 TYR HD1 1 1 10 7306 1 1 22 TYR HD2 H 6.368 1.996 1.607 1.00 . A A . 21 TYR HD2 1 1 10 7307 1 1 22 TYR HE1 H 1.736 3.351 2.542 1.00 . A A . 21 TYR HE1 1 1 10 7308 1 1 22 TYR HE2 H 4.519 0.474 1.077 1.00 . A A . 21 TYR HE2 1 1 10 7309 1 1 22 TYR HH H 2.195 0.081 1.781 1.00 . A A . 21 TYR HH 1 1 10 7310 1 1 22 TYR N N 6.093 3.701 5.030 1.00 . A A . 21 TYR N 1 1 10 7311 1 1 22 TYR O O 5.934 7.110 3.828 1.00 . A A . 21 TYR O 1 1 10 7312 1 1 22 TYR OH O 1.979 0.970 1.481 1.00 . A A . 21 TYR OH 1 1 10 7313 1 1 23 GLY C C 3.341 7.814 5.467 1.00 . A A . 22 GLY C 1 1 10 7314 1 1 23 GLY CA C 4.568 7.318 6.207 1.00 . A A . 22 GLY CA 1 1 10 7315 1 1 23 GLY H H 4.982 5.246 6.127 1.00 . A A . 22 GLY H 1 1 10 7316 1 1 23 GLY HA2 H 4.300 7.142 7.238 1.00 . A A . 22 GLY HA2 1 1 10 7317 1 1 23 GLY HA3 H 5.326 8.087 6.175 1.00 . A A . 22 GLY HA3 1 1 10 7318 1 1 23 GLY N N 5.123 6.095 5.662 1.00 . A A . 22 GLY N 1 1 10 7319 1 1 23 GLY O O 3.255 8.993 5.125 1.00 . A A . 22 GLY O 1 1 10 7320 1 1 24 VAL C C -0.025 6.674 5.384 1.00 . A A . 23 VAL C 1 1 10 7321 1 1 24 VAL CA C 1.130 7.306 4.604 1.00 . A A . 23 VAL CA 1 1 10 7322 1 1 24 VAL CB C 1.081 6.894 3.111 1.00 . A A . 23 VAL CB 1 1 10 7323 1 1 24 VAL CG1 C 0.507 5.496 2.922 1.00 . A A . 23 VAL CG1 1 1 10 7324 1 1 24 VAL CG2 C 0.327 7.929 2.290 1.00 . A A . 23 VAL CG2 1 1 10 7325 1 1 24 VAL H H 2.542 5.981 5.459 1.00 . A A . 23 VAL H 1 1 10 7326 1 1 24 VAL HA H 1.043 8.382 4.665 1.00 . A A . 23 VAL HA 1 1 10 7327 1 1 24 VAL HB H 2.095 6.874 2.745 1.00 . A A . 23 VAL HB 1 1 10 7328 1 1 24 VAL HG11 H 1.156 4.773 3.395 1.00 . A A . 23 VAL HG11 1 1 10 7329 1 1 24 VAL HG12 H 0.430 5.275 1.866 1.00 . A A . 23 VAL HG12 1 1 10 7330 1 1 24 VAL HG13 H -0.473 5.444 3.374 1.00 . A A . 23 VAL HG13 1 1 10 7331 1 1 24 VAL HG21 H 0.831 8.882 2.359 1.00 . A A . 23 VAL HG21 1 1 10 7332 1 1 24 VAL HG22 H -0.679 8.027 2.668 1.00 . A A . 23 VAL HG22 1 1 10 7333 1 1 24 VAL HG23 H 0.294 7.613 1.258 1.00 . A A . 23 VAL HG23 1 1 10 7334 1 1 24 VAL N N 2.393 6.924 5.219 1.00 . A A . 23 VAL N 1 1 10 7335 1 1 24 VAL O O 0.209 5.867 6.285 1.00 . A A . 23 VAL O 1 1 10 7336 1 1 25 SER C C -3.050 5.339 5.095 1.00 . A A . 24 SER C 1 1 10 7337 1 1 25 SER CA C -2.404 6.539 5.796 1.00 . A A . 24 SER CA 1 1 10 7338 1 1 25 SER CB C -3.438 7.657 6.001 1.00 . A A . 24 SER CB 1 1 10 7339 1 1 25 SER H H -1.402 7.642 4.301 1.00 . A A . 24 SER H 1 1 10 7340 1 1 25 SER HA H -2.051 6.217 6.762 1.00 . A A . 24 SER HA 1 1 10 7341 1 1 25 SER HB2 H -2.964 8.498 6.487 1.00 . A A . 24 SER HB2 1 1 10 7342 1 1 25 SER HB3 H -3.825 7.967 5.042 1.00 . A A . 24 SER HB3 1 1 10 7343 1 1 25 SER HG H -4.757 7.918 7.438 1.00 . A A . 24 SER HG 1 1 10 7344 1 1 25 SER N N -1.257 7.035 5.057 1.00 . A A . 24 SER N 1 1 10 7345 1 1 25 SER O O -3.063 5.220 3.852 1.00 . A A . 24 SER O 1 1 10 7346 1 1 25 SER OG O -4.521 7.218 6.807 1.00 . A A . 24 SER OG 1 1 10 7347 1 1 26 VAL C C -5.469 3.725 4.543 1.00 . A A . 25 VAL C 1 1 10 7348 1 1 26 VAL CA C -4.310 3.294 5.439 1.00 . A A . 25 VAL CA 1 1 10 7349 1 1 26 VAL CB C -4.853 2.471 6.628 1.00 . A A . 25 VAL CB 1 1 10 7350 1 1 26 VAL CG1 C -5.676 1.289 6.149 1.00 . A A . 25 VAL CG1 1 1 10 7351 1 1 26 VAL CG2 C -3.715 2.004 7.523 1.00 . A A . 25 VAL CG2 1 1 10 7352 1 1 26 VAL H H -3.486 4.584 6.881 1.00 . A A . 25 VAL H 1 1 10 7353 1 1 26 VAL HA H -3.629 2.676 4.871 1.00 . A A . 25 VAL HA 1 1 10 7354 1 1 26 VAL HB H -5.497 3.112 7.211 1.00 . A A . 25 VAL HB 1 1 10 7355 1 1 26 VAL HG11 H -5.074 0.672 5.497 1.00 . A A . 25 VAL HG11 1 1 10 7356 1 1 26 VAL HG12 H -6.540 1.647 5.610 1.00 . A A . 25 VAL HG12 1 1 10 7357 1 1 26 VAL HG13 H -5.998 0.705 6.999 1.00 . A A . 25 VAL HG13 1 1 10 7358 1 1 26 VAL HG21 H -4.121 1.454 8.360 1.00 . A A . 25 VAL HG21 1 1 10 7359 1 1 26 VAL HG22 H -3.168 2.860 7.887 1.00 . A A . 25 VAL HG22 1 1 10 7360 1 1 26 VAL HG23 H -3.050 1.363 6.960 1.00 . A A . 25 VAL HG23 1 1 10 7361 1 1 26 VAL N N -3.584 4.451 5.914 1.00 . A A . 25 VAL N 1 1 10 7362 1 1 26 VAL O O -5.773 3.069 3.549 1.00 . A A . 25 VAL O 1 1 10 7363 1 1 27 ALA C C -6.911 5.724 2.722 1.00 . A A . 26 ALA C 1 1 10 7364 1 1 27 ALA CA C -7.247 5.351 4.168 1.00 . A A . 26 ALA CA 1 1 10 7365 1 1 27 ALA CB C -7.849 6.544 4.897 1.00 . A A . 26 ALA CB 1 1 10 7366 1 1 27 ALA H H -5.756 5.351 5.669 1.00 . A A . 26 ALA H 1 1 10 7367 1 1 27 ALA HA H -7.986 4.557 4.158 1.00 . A A . 26 ALA HA 1 1 10 7368 1 1 27 ALA HB1 H -8.749 6.858 4.390 1.00 . A A . 26 ALA HB1 1 1 10 7369 1 1 27 ALA HB2 H -7.138 7.358 4.906 1.00 . A A . 26 ALA HB2 1 1 10 7370 1 1 27 ALA HB3 H -8.087 6.262 5.912 1.00 . A A . 26 ALA HB3 1 1 10 7371 1 1 27 ALA N N -6.085 4.850 4.890 1.00 . A A . 26 ALA N 1 1 10 7372 1 1 27 ALA O O -7.649 5.370 1.804 1.00 . A A . 26 ALA O 1 1 10 7373 1 1 28 ASN C C -5.115 5.609 0.298 1.00 . A A . 27 ASN C 1 1 10 7374 1 1 28 ASN CA C -5.433 6.828 1.147 1.00 . A A . 27 ASN CA 1 1 10 7375 1 1 28 ASN CB C -4.271 7.838 1.102 1.00 . A A . 27 ASN CB 1 1 10 7376 1 1 28 ASN CG C -3.067 7.414 1.895 1.00 . A A . 27 ASN CG 1 1 10 7377 1 1 28 ASN H H -5.242 6.707 3.265 1.00 . A A . 27 ASN H 1 1 10 7378 1 1 28 ASN HA H -6.299 7.297 0.711 1.00 . A A . 27 ASN HA 1 1 10 7379 1 1 28 ASN HB2 H -3.959 7.968 0.077 1.00 . A A . 27 ASN HB2 1 1 10 7380 1 1 28 ASN HB3 H -4.613 8.786 1.487 1.00 . A A . 27 ASN HB3 1 1 10 7381 1 1 28 ASN HD21 H -2.477 6.236 0.419 1.00 . A A . 27 ASN HD21 1 1 10 7382 1 1 28 ASN HD22 H -1.474 6.243 1.820 1.00 . A A . 27 ASN HD22 1 1 10 7383 1 1 28 ASN N N -5.804 6.437 2.506 1.00 . A A . 27 ASN N 1 1 10 7384 1 1 28 ASN ND2 N -2.255 6.547 1.319 1.00 . A A . 27 ASN ND2 1 1 10 7385 1 1 28 ASN O O -5.605 5.499 -0.831 1.00 . A A . 27 ASN O 1 1 10 7386 1 1 28 ASN OD1 O -2.866 7.861 3.016 1.00 . A A . 27 ASN OD1 1 1 10 7387 1 1 29 LEU C C -5.283 2.613 -0.120 1.00 . A A . 28 LEU C 1 1 10 7388 1 1 29 LEU CA C -4.038 3.477 0.030 1.00 . A A . 28 LEU CA 1 1 10 7389 1 1 29 LEU CB C -2.805 2.693 0.508 1.00 . A A . 28 LEU CB 1 1 10 7390 1 1 29 LEU CD1 C -3.469 1.057 2.292 1.00 . A A . 28 LEU CD1 1 1 10 7391 1 1 29 LEU CD2 C -1.233 2.190 2.346 1.00 . A A . 28 LEU CD2 1 1 10 7392 1 1 29 LEU CG C -2.702 2.338 1.985 1.00 . A A . 28 LEU CG 1 1 10 7393 1 1 29 LEU H H -3.941 4.780 1.722 1.00 . A A . 28 LEU H 1 1 10 7394 1 1 29 LEU HA H -3.812 3.847 -0.964 1.00 . A A . 28 LEU HA 1 1 10 7395 1 1 29 LEU HB2 H -2.770 1.770 -0.047 1.00 . A A . 28 LEU HB2 1 1 10 7396 1 1 29 LEU HB3 H -1.930 3.273 0.245 1.00 . A A . 28 LEU HB3 1 1 10 7397 1 1 29 LEU HD11 H -3.407 0.843 3.348 1.00 . A A . 28 LEU HD11 1 1 10 7398 1 1 29 LEU HD12 H -3.038 0.234 1.733 1.00 . A A . 28 LEU HD12 1 1 10 7399 1 1 29 LEU HD13 H -4.502 1.181 2.009 1.00 . A A . 28 LEU HD13 1 1 10 7400 1 1 29 LEU HD21 H -0.860 1.257 1.950 1.00 . A A . 28 LEU HD21 1 1 10 7401 1 1 29 LEU HD22 H -1.118 2.202 3.418 1.00 . A A . 28 LEU HD22 1 1 10 7402 1 1 29 LEU HD23 H -0.671 3.012 1.909 1.00 . A A . 28 LEU HD23 1 1 10 7403 1 1 29 LEU HG H -3.120 3.135 2.582 1.00 . A A . 28 LEU HG 1 1 10 7404 1 1 29 LEU N N -4.325 4.668 0.820 1.00 . A A . 28 LEU N 1 1 10 7405 1 1 29 LEU O O -5.445 1.913 -1.117 1.00 . A A . 28 LEU O 1 1 10 7406 1 1 30 ARG C C -8.209 2.544 -0.473 1.00 . A A . 29 ARG C 1 1 10 7407 1 1 30 ARG CA C -7.476 2.048 0.772 1.00 . A A . 29 ARG CA 1 1 10 7408 1 1 30 ARG CB C -8.312 2.395 2.008 1.00 . A A . 29 ARG CB 1 1 10 7409 1 1 30 ARG CD C -7.865 0.376 3.442 1.00 . A A . 29 ARG CD 1 1 10 7410 1 1 30 ARG CG C -8.920 1.200 2.718 1.00 . A A . 29 ARG CG 1 1 10 7411 1 1 30 ARG CZ C -7.243 -1.232 1.673 1.00 . A A . 29 ARG CZ 1 1 10 7412 1 1 30 ARG H H -5.919 3.147 1.698 1.00 . A A . 29 ARG H 1 1 10 7413 1 1 30 ARG HA H -7.346 0.980 0.714 1.00 . A A . 29 ARG HA 1 1 10 7414 1 1 30 ARG HB2 H -7.685 2.919 2.714 1.00 . A A . 29 ARG HB2 1 1 10 7415 1 1 30 ARG HB3 H -9.115 3.051 1.704 1.00 . A A . 29 ARG HB3 1 1 10 7416 1 1 30 ARG HD2 H -7.319 1.032 4.103 1.00 . A A . 29 ARG HD2 1 1 10 7417 1 1 30 ARG HD3 H -8.358 -0.389 4.024 1.00 . A A . 29 ARG HD3 1 1 10 7418 1 1 30 ARG HE H -5.994 0.069 2.536 1.00 . A A . 29 ARG HE 1 1 10 7419 1 1 30 ARG HG2 H -9.638 1.553 3.440 1.00 . A A . 29 ARG HG2 1 1 10 7420 1 1 30 ARG HG3 H -9.415 0.574 1.990 1.00 . A A . 29 ARG HG3 1 1 10 7421 1 1 30 ARG HH11 H -9.155 -1.393 2.329 1.00 . A A . 29 ARG HH11 1 1 10 7422 1 1 30 ARG HH12 H -8.725 -2.443 1.013 1.00 . A A . 29 ARG HH12 1 1 10 7423 1 1 30 ARG HH21 H -5.403 -1.350 0.836 1.00 . A A . 29 ARG HH21 1 1 10 7424 1 1 30 ARG HH22 H -6.580 -2.447 0.193 1.00 . A A . 29 ARG HH22 1 1 10 7425 1 1 30 ARG N N -6.161 2.671 0.871 1.00 . A A . 29 ARG N 1 1 10 7426 1 1 30 ARG NE N -6.917 -0.260 2.523 1.00 . A A . 29 ARG NE 1 1 10 7427 1 1 30 ARG NH1 N -8.467 -1.733 1.675 1.00 . A A . 29 ARG NH1 1 1 10 7428 1 1 30 ARG NH2 N -6.335 -1.713 0.834 1.00 . A A . 29 ARG NH2 1 1 10 7429 1 1 30 ARG O O -8.826 1.766 -1.197 1.00 . A A . 29 ARG O 1 1 10 7430 1 1 31 SER C C -8.415 4.209 -3.166 1.00 . A A . 30 SER C 1 1 10 7431 1 1 31 SER CA C -8.895 4.504 -1.742 1.00 . A A . 30 SER CA 1 1 10 7432 1 1 31 SER CB C -8.883 6.010 -1.495 1.00 . A A . 30 SER CB 1 1 10 7433 1 1 31 SER H H -7.443 4.370 -0.215 1.00 . A A . 30 SER H 1 1 10 7434 1 1 31 SER HA H -9.909 4.147 -1.642 1.00 . A A . 30 SER HA 1 1 10 7435 1 1 31 SER HB2 H -7.890 6.391 -1.666 1.00 . A A . 30 SER HB2 1 1 10 7436 1 1 31 SER HB3 H -9.577 6.489 -2.170 1.00 . A A . 30 SER HB3 1 1 10 7437 1 1 31 SER HG H -8.793 5.726 0.451 1.00 . A A . 30 SER HG 1 1 10 7438 1 1 31 SER N N -8.094 3.841 -0.727 1.00 . A A . 30 SER N 1 1 10 7439 1 1 31 SER O O -9.229 3.935 -4.046 1.00 . A A . 30 SER O 1 1 10 7440 1 1 31 SER OG O -9.265 6.310 -0.161 1.00 . A A . 30 SER OG 1 1 10 7441 1 1 32 TRP C C -6.290 2.672 -5.162 1.00 . A A . 31 TRP C 1 1 10 7442 1 1 32 TRP CA C -6.602 4.116 -4.774 1.00 . A A . 31 TRP CA 1 1 10 7443 1 1 32 TRP CB C -5.379 5.007 -5.035 1.00 . A A . 31 TRP CB 1 1 10 7444 1 1 32 TRP CD1 C -3.765 3.832 -3.438 1.00 . A A . 31 TRP CD1 1 1 10 7445 1 1 32 TRP CD2 C -3.657 6.063 -3.368 1.00 . A A . 31 TRP CD2 1 1 10 7446 1 1 32 TRP CE2 C -2.721 5.538 -2.463 1.00 . A A . 31 TRP CE2 1 1 10 7447 1 1 32 TRP CE3 C -3.761 7.450 -3.492 1.00 . A A . 31 TRP CE3 1 1 10 7448 1 1 32 TRP CG C -4.318 4.949 -3.983 1.00 . A A . 31 TRP CG 1 1 10 7449 1 1 32 TRP CH2 C -2.021 7.694 -1.830 1.00 . A A . 31 TRP CH2 1 1 10 7450 1 1 32 TRP CZ2 C -1.899 6.343 -1.689 1.00 . A A . 31 TRP CZ2 1 1 10 7451 1 1 32 TRP CZ3 C -2.941 8.249 -2.720 1.00 . A A . 31 TRP CZ3 1 1 10 7452 1 1 32 TRP H H -6.477 4.375 -2.660 1.00 . A A . 31 TRP H 1 1 10 7453 1 1 32 TRP HA H -7.399 4.457 -5.423 1.00 . A A . 31 TRP HA 1 1 10 7454 1 1 32 TRP HB2 H -4.919 4.697 -5.966 1.00 . A A . 31 TRP HB2 1 1 10 7455 1 1 32 TRP HB3 H -5.702 6.034 -5.126 1.00 . A A . 31 TRP HB3 1 1 10 7456 1 1 32 TRP HD1 H -4.050 2.822 -3.697 1.00 . A A . 31 TRP HD1 1 1 10 7457 1 1 32 TRP HE1 H -2.264 3.552 -2.003 1.00 . A A . 31 TRP HE1 1 1 10 7458 1 1 32 TRP HE3 H -4.465 7.897 -4.174 1.00 . A A . 31 TRP HE3 1 1 10 7459 1 1 32 TRP HH2 H -1.400 8.358 -1.248 1.00 . A A . 31 TRP HH2 1 1 10 7460 1 1 32 TRP HZ2 H -1.181 5.927 -0.997 1.00 . A A . 31 TRP HZ2 1 1 10 7461 1 1 32 TRP HZ3 H -3.000 9.324 -2.805 1.00 . A A . 31 TRP HZ3 1 1 10 7462 1 1 32 TRP N N -7.106 4.250 -3.404 1.00 . A A . 31 TRP N 1 1 10 7463 1 1 32 TRP NE1 N -2.804 4.180 -2.527 1.00 . A A . 31 TRP NE1 1 1 10 7464 1 1 32 TRP O O -5.879 2.415 -6.293 1.00 . A A . 31 TRP O 1 1 10 7465 1 1 33 ASN C C -7.482 -0.386 -5.012 1.00 . A A . 32 ASN C 1 1 10 7466 1 1 33 ASN CA C -6.208 0.328 -4.577 1.00 . A A . 32 ASN CA 1 1 10 7467 1 1 33 ASN CB C -5.576 -0.414 -3.396 1.00 . A A . 32 ASN CB 1 1 10 7468 1 1 33 ASN CG C -4.067 -0.295 -3.376 1.00 . A A . 32 ASN CG 1 1 10 7469 1 1 33 ASN H H -6.782 1.970 -3.349 1.00 . A A . 32 ASN H 1 1 10 7470 1 1 33 ASN HA H -5.511 0.317 -5.403 1.00 . A A . 32 ASN HA 1 1 10 7471 1 1 33 ASN HB2 H -5.960 -0.005 -2.474 1.00 . A A . 32 ASN HB2 1 1 10 7472 1 1 33 ASN HB3 H -5.834 -1.461 -3.456 1.00 . A A . 32 ASN HB3 1 1 10 7473 1 1 33 ASN HD21 H -4.173 1.272 -2.163 1.00 . A A . 32 ASN HD21 1 1 10 7474 1 1 33 ASN HD22 H -2.576 0.784 -2.627 1.00 . A A . 32 ASN HD22 1 1 10 7475 1 1 33 ASN N N -6.470 1.728 -4.245 1.00 . A A . 32 ASN N 1 1 10 7476 1 1 33 ASN ND2 N -3.554 0.683 -2.649 1.00 . A A . 32 ASN ND2 1 1 10 7477 1 1 33 ASN O O -7.427 -1.363 -5.759 1.00 . A A . 32 ASN O 1 1 10 7478 1 1 33 ASN OD1 O -3.366 -1.086 -4.001 1.00 . A A . 32 ASN OD1 1 1 10 7479 1 1 34 GLY C C -10.125 -1.843 -4.467 1.00 . A A . 33 GLY C 1 1 10 7480 1 1 34 GLY CA C -9.905 -0.435 -4.984 1.00 . A A . 33 GLY CA 1 1 10 7481 1 1 34 GLY H H -8.606 0.891 -3.963 1.00 . A A . 33 GLY H 1 1 10 7482 1 1 34 GLY HA2 H -10.698 0.197 -4.615 1.00 . A A . 33 GLY HA2 1 1 10 7483 1 1 34 GLY HA3 H -9.947 -0.452 -6.064 1.00 . A A . 33 GLY HA3 1 1 10 7484 1 1 34 GLY N N -8.627 0.127 -4.575 1.00 . A A . 33 GLY N 1 1 10 7485 1 1 34 GLY O O -10.873 -2.621 -5.061 1.00 . A A . 33 GLY O 1 1 10 7486 1 1 35 ILE C C -9.884 -3.408 -1.287 1.00 . A A . 34 ILE C 1 1 10 7487 1 1 35 ILE CA C -9.602 -3.500 -2.768 1.00 . A A . 34 ILE CA 1 1 10 7488 1 1 35 ILE CB C -8.347 -4.377 -2.922 1.00 . A A . 34 ILE CB 1 1 10 7489 1 1 35 ILE CD1 C -5.818 -4.278 -3.117 1.00 . A A . 34 ILE CD1 1 1 10 7490 1 1 35 ILE CG1 C -7.127 -3.549 -3.321 1.00 . A A . 34 ILE CG1 1 1 10 7491 1 1 35 ILE CG2 C -8.605 -5.506 -3.899 1.00 . A A . 34 ILE CG2 1 1 10 7492 1 1 35 ILE H H -8.868 -1.526 -2.954 1.00 . A A . 34 ILE H 1 1 10 7493 1 1 35 ILE HA H -10.426 -4.002 -3.252 1.00 . A A . 34 ILE HA 1 1 10 7494 1 1 35 ILE HB H -8.152 -4.825 -1.958 1.00 . A A . 34 ILE HB 1 1 10 7495 1 1 35 ILE HD11 H -5.808 -5.173 -3.719 1.00 . A A . 34 ILE HD11 1 1 10 7496 1 1 35 ILE HD12 H -5.716 -4.543 -2.074 1.00 . A A . 34 ILE HD12 1 1 10 7497 1 1 35 ILE HD13 H -4.998 -3.638 -3.409 1.00 . A A . 34 ILE HD13 1 1 10 7498 1 1 35 ILE HG12 H -7.202 -3.284 -4.366 1.00 . A A . 34 ILE HG12 1 1 10 7499 1 1 35 ILE HG13 H -7.102 -2.649 -2.726 1.00 . A A . 34 ILE HG13 1 1 10 7500 1 1 35 ILE HG21 H -7.694 -6.061 -4.056 1.00 . A A . 34 ILE HG21 1 1 10 7501 1 1 35 ILE HG22 H -8.950 -5.099 -4.838 1.00 . A A . 34 ILE HG22 1 1 10 7502 1 1 35 ILE HG23 H -9.361 -6.163 -3.489 1.00 . A A . 34 ILE HG23 1 1 10 7503 1 1 35 ILE N N -9.462 -2.181 -3.371 1.00 . A A . 34 ILE N 1 1 10 7504 1 1 35 ILE O O -9.641 -2.378 -0.658 1.00 . A A . 34 ILE O 1 1 10 7505 1 1 36 SER C C -9.062 -4.807 1.277 1.00 . A A . 35 SER C 1 1 10 7506 1 1 36 SER CA C -10.472 -4.669 0.691 1.00 . A A . 35 SER CA 1 1 10 7507 1 1 36 SER CB C -11.326 -5.894 1.003 1.00 . A A . 35 SER CB 1 1 10 7508 1 1 36 SER H H -10.717 -5.217 -1.325 1.00 . A A . 35 SER H 1 1 10 7509 1 1 36 SER HA H -10.942 -3.790 1.107 1.00 . A A . 35 SER HA 1 1 10 7510 1 1 36 SER HB2 H -10.862 -6.770 0.574 1.00 . A A . 35 SER HB2 1 1 10 7511 1 1 36 SER HB3 H -11.406 -6.012 2.073 1.00 . A A . 35 SER HB3 1 1 10 7512 1 1 36 SER HG H -13.031 -6.631 0.364 1.00 . A A . 35 SER HG 1 1 10 7513 1 1 36 SER N N -10.386 -4.499 -0.742 1.00 . A A . 35 SER N 1 1 10 7514 1 1 36 SER O O -8.092 -5.029 0.549 1.00 . A A . 35 SER O 1 1 10 7515 1 1 36 SER OG O -12.629 -5.755 0.458 1.00 . A A . 35 SER OG 1 1 10 7516 1 1 37 GLY C C -7.220 -5.929 3.822 1.00 . A A . 36 GLY C 1 1 10 7517 1 1 37 GLY CA C -7.635 -4.608 3.210 1.00 . A A . 36 GLY CA 1 1 10 7518 1 1 37 GLY H H -9.753 -4.574 3.127 1.00 . A A . 36 GLY H 1 1 10 7519 1 1 37 GLY HA2 H -6.904 -4.326 2.467 1.00 . A A . 36 GLY HA2 1 1 10 7520 1 1 37 GLY HA3 H -7.647 -3.854 3.984 1.00 . A A . 36 GLY HA3 1 1 10 7521 1 1 37 GLY N N -8.944 -4.649 2.581 1.00 . A A . 36 GLY N 1 1 10 7522 1 1 37 GLY O O -6.159 -6.026 4.440 1.00 . A A . 36 GLY O 1 1 10 7523 1 1 38 ASP C C -6.753 -8.997 3.297 1.00 . A A . 37 ASP C 1 1 10 7524 1 1 38 ASP CA C -7.742 -8.264 4.193 1.00 . A A . 37 ASP CA 1 1 10 7525 1 1 38 ASP CB C -9.018 -9.097 4.350 1.00 . A A . 37 ASP CB 1 1 10 7526 1 1 38 ASP CG C -9.678 -9.400 3.021 1.00 . A A . 37 ASP CG 1 1 10 7527 1 1 38 ASP H H -8.881 -6.814 3.150 1.00 . A A . 37 ASP H 1 1 10 7528 1 1 38 ASP HA H -7.293 -8.124 5.166 1.00 . A A . 37 ASP HA 1 1 10 7529 1 1 38 ASP HB2 H -8.771 -10.033 4.827 1.00 . A A . 37 ASP HB2 1 1 10 7530 1 1 38 ASP HB3 H -9.718 -8.556 4.967 1.00 . A A . 37 ASP HB3 1 1 10 7531 1 1 38 ASP N N -8.045 -6.947 3.650 1.00 . A A . 37 ASP N 1 1 10 7532 1 1 38 ASP O O -5.964 -9.821 3.770 1.00 . A A . 37 ASP O 1 1 10 7533 1 1 38 ASP OD1 O -10.306 -8.486 2.449 1.00 . A A . 37 ASP OD1 1 1 10 7534 1 1 38 ASP OD2 O -9.574 -10.545 2.544 1.00 . A A . 37 ASP OD2 1 1 10 7535 1 1 39 LEU C C -4.660 -8.493 0.782 1.00 . A A . 38 LEU C 1 1 10 7536 1 1 39 LEU CA C -5.902 -9.339 1.049 1.00 . A A . 38 LEU CA 1 1 10 7537 1 1 39 LEU CB C -6.627 -9.674 -0.269 1.00 . A A . 38 LEU CB 1 1 10 7538 1 1 39 LEU CD1 C -7.457 -8.862 -2.492 1.00 . A A . 38 LEU CD1 1 1 10 7539 1 1 39 LEU CD2 C -8.583 -8.088 -0.419 1.00 . A A . 38 LEU CD2 1 1 10 7540 1 1 39 LEU CG C -7.252 -8.495 -1.032 1.00 . A A . 38 LEU CG 1 1 10 7541 1 1 39 LEU H H -7.414 -8.009 1.692 1.00 . A A . 38 LEU H 1 1 10 7542 1 1 39 LEU HA H -5.579 -10.266 1.501 1.00 . A A . 38 LEU HA 1 1 10 7543 1 1 39 LEU HB2 H -5.918 -10.155 -0.926 1.00 . A A . 38 LEU HB2 1 1 10 7544 1 1 39 LEU HB3 H -7.413 -10.382 -0.047 1.00 . A A . 38 LEU HB3 1 1 10 7545 1 1 39 LEU HD11 H -6.506 -9.113 -2.937 1.00 . A A . 38 LEU HD11 1 1 10 7546 1 1 39 LEU HD12 H -7.891 -8.022 -3.017 1.00 . A A . 38 LEU HD12 1 1 10 7547 1 1 39 LEU HD13 H -8.121 -9.710 -2.560 1.00 . A A . 38 LEU HD13 1 1 10 7548 1 1 39 LEU HD21 H -8.997 -7.261 -0.976 1.00 . A A . 38 LEU HD21 1 1 10 7549 1 1 39 LEU HD22 H -8.431 -7.791 0.608 1.00 . A A . 38 LEU HD22 1 1 10 7550 1 1 39 LEU HD23 H -9.265 -8.925 -0.455 1.00 . A A . 38 LEU HD23 1 1 10 7551 1 1 39 LEU HG H -6.586 -7.647 -0.987 1.00 . A A . 38 LEU HG 1 1 10 7552 1 1 39 LEU N N -6.786 -8.689 2.005 1.00 . A A . 38 LEU N 1 1 10 7553 1 1 39 LEU O O -4.558 -7.795 -0.225 1.00 . A A . 38 LEU O 1 1 10 7554 1 1 40 ILE C C -1.374 -8.932 2.026 1.00 . A A . 39 ILE C 1 1 10 7555 1 1 40 ILE CA C -2.422 -7.939 1.545 1.00 . A A . 39 ILE CA 1 1 10 7556 1 1 40 ILE CB C -2.259 -6.586 2.290 1.00 . A A . 39 ILE CB 1 1 10 7557 1 1 40 ILE CD1 C -2.622 -4.076 1.994 1.00 . A A . 39 ILE CD1 1 1 10 7558 1 1 40 ILE CG1 C -3.048 -5.475 1.585 1.00 . A A . 39 ILE CG1 1 1 10 7559 1 1 40 ILE CG2 C -0.792 -6.203 2.402 1.00 . A A . 39 ILE CG2 1 1 10 7560 1 1 40 ILE H H -3.945 -8.971 2.574 1.00 . A A . 39 ILE H 1 1 10 7561 1 1 40 ILE HA H -2.278 -7.769 0.486 1.00 . A A . 39 ILE HA 1 1 10 7562 1 1 40 ILE HB H -2.646 -6.709 3.292 1.00 . A A . 39 ILE HB 1 1 10 7563 1 1 40 ILE HD11 H -1.613 -3.893 1.652 1.00 . A A . 39 ILE HD11 1 1 10 7564 1 1 40 ILE HD12 H -2.655 -3.992 3.074 1.00 . A A . 39 ILE HD12 1 1 10 7565 1 1 40 ILE HD13 H -3.289 -3.343 1.555 1.00 . A A . 39 ILE HD13 1 1 10 7566 1 1 40 ILE HG12 H -2.908 -5.564 0.519 1.00 . A A . 39 ILE HG12 1 1 10 7567 1 1 40 ILE HG13 H -4.098 -5.586 1.817 1.00 . A A . 39 ILE HG13 1 1 10 7568 1 1 40 ILE HG21 H -0.252 -6.997 2.895 1.00 . A A . 39 ILE HG21 1 1 10 7569 1 1 40 ILE HG22 H -0.700 -5.293 2.981 1.00 . A A . 39 ILE HG22 1 1 10 7570 1 1 40 ILE HG23 H -0.383 -6.047 1.416 1.00 . A A . 39 ILE HG23 1 1 10 7571 1 1 40 ILE N N -3.737 -8.527 1.725 1.00 . A A . 39 ILE N 1 1 10 7572 1 1 40 ILE O O -1.408 -9.371 3.173 1.00 . A A . 39 ILE O 1 1 10 7573 1 1 41 PHE C C 1.868 -9.951 0.816 1.00 . A A . 40 PHE C 1 1 10 7574 1 1 41 PHE CA C 0.537 -10.308 1.457 1.00 . A A . 40 PHE CA 1 1 10 7575 1 1 41 PHE CB C 0.082 -11.701 1.005 1.00 . A A . 40 PHE CB 1 1 10 7576 1 1 41 PHE CD1 C 0.656 -12.045 -1.417 1.00 . A A . 40 PHE CD1 1 1 10 7577 1 1 41 PHE CD2 C -1.617 -11.615 -0.840 1.00 . A A . 40 PHE CD2 1 1 10 7578 1 1 41 PHE CE1 C 0.304 -12.128 -2.750 1.00 . A A . 40 PHE CE1 1 1 10 7579 1 1 41 PHE CE2 C -1.974 -11.696 -2.172 1.00 . A A . 40 PHE CE2 1 1 10 7580 1 1 41 PHE CG C -0.299 -11.786 -0.447 1.00 . A A . 40 PHE CG 1 1 10 7581 1 1 41 PHE CZ C -1.013 -11.954 -3.128 1.00 . A A . 40 PHE CZ 1 1 10 7582 1 1 41 PHE H H -0.478 -8.912 0.242 1.00 . A A . 40 PHE H 1 1 10 7583 1 1 41 PHE HA H 0.662 -10.312 2.528 1.00 . A A . 40 PHE HA 1 1 10 7584 1 1 41 PHE HB2 H 0.882 -12.406 1.174 1.00 . A A . 40 PHE HB2 1 1 10 7585 1 1 41 PHE HB3 H -0.777 -11.996 1.590 1.00 . A A . 40 PHE HB3 1 1 10 7586 1 1 41 PHE HD1 H 1.687 -12.180 -1.126 1.00 . A A . 40 PHE HD1 1 1 10 7587 1 1 41 PHE HD2 H -2.371 -11.415 -0.094 1.00 . A A . 40 PHE HD2 1 1 10 7588 1 1 41 PHE HE1 H 1.059 -12.330 -3.496 1.00 . A A . 40 PHE HE1 1 1 10 7589 1 1 41 PHE HE2 H -3.004 -11.560 -2.465 1.00 . A A . 40 PHE HE2 1 1 10 7590 1 1 41 PHE HZ H -1.290 -12.020 -4.170 1.00 . A A . 40 PHE HZ 1 1 10 7591 1 1 41 PHE N N -0.472 -9.313 1.135 1.00 . A A . 40 PHE N 1 1 10 7592 1 1 41 PHE O O 1.915 -9.165 -0.133 1.00 . A A . 40 PHE O 1 1 10 7593 1 1 42 VAL C C 4.381 -10.588 -0.652 1.00 . A A . 41 VAL C 1 1 10 7594 1 1 42 VAL CA C 4.284 -10.279 0.840 1.00 . A A . 41 VAL CA 1 1 10 7595 1 1 42 VAL CB C 5.336 -11.116 1.604 1.00 . A A . 41 VAL CB 1 1 10 7596 1 1 42 VAL CG1 C 6.743 -10.805 1.113 1.00 . A A . 41 VAL CG1 1 1 10 7597 1 1 42 VAL CG2 C 5.229 -10.872 3.100 1.00 . A A . 41 VAL CG2 1 1 10 7598 1 1 42 VAL H H 2.817 -11.165 2.087 1.00 . A A . 41 VAL H 1 1 10 7599 1 1 42 VAL HA H 4.505 -9.234 0.996 1.00 . A A . 41 VAL HA 1 1 10 7600 1 1 42 VAL HB H 5.138 -12.161 1.417 1.00 . A A . 41 VAL HB 1 1 10 7601 1 1 42 VAL HG11 H 6.963 -9.763 1.290 1.00 . A A . 41 VAL HG11 1 1 10 7602 1 1 42 VAL HG12 H 6.809 -11.013 0.055 1.00 . A A . 41 VAL HG12 1 1 10 7603 1 1 42 VAL HG13 H 7.452 -11.419 1.647 1.00 . A A . 41 VAL HG13 1 1 10 7604 1 1 42 VAL HG21 H 4.254 -11.177 3.446 1.00 . A A . 41 VAL HG21 1 1 10 7605 1 1 42 VAL HG22 H 5.372 -9.821 3.306 1.00 . A A . 41 VAL HG22 1 1 10 7606 1 1 42 VAL HG23 H 5.989 -11.446 3.613 1.00 . A A . 41 VAL HG23 1 1 10 7607 1 1 42 VAL N N 2.939 -10.534 1.338 1.00 . A A . 41 VAL N 1 1 10 7608 1 1 42 VAL O O 3.980 -11.663 -1.100 1.00 . A A . 41 VAL O 1 1 10 7609 1 1 43 GLY C C 3.938 -9.169 -3.645 1.00 . A A . 42 GLY C 1 1 10 7610 1 1 43 GLY CA C 5.043 -9.831 -2.845 1.00 . A A . 42 GLY CA 1 1 10 7611 1 1 43 GLY H H 5.206 -8.790 -1.004 1.00 . A A . 42 GLY H 1 1 10 7612 1 1 43 GLY HA2 H 5.991 -9.423 -3.160 1.00 . A A . 42 GLY HA2 1 1 10 7613 1 1 43 GLY HA3 H 5.034 -10.890 -3.050 1.00 . A A . 42 GLY HA3 1 1 10 7614 1 1 43 GLY N N 4.901 -9.633 -1.416 1.00 . A A . 42 GLY N 1 1 10 7615 1 1 43 GLY O O 4.072 -8.984 -4.856 1.00 . A A . 42 GLY O 1 1 10 7616 1 1 44 GLN C C 2.059 -6.704 -3.962 1.00 . A A . 43 GLN C 1 1 10 7617 1 1 44 GLN CA C 1.731 -8.158 -3.649 1.00 . A A . 43 GLN CA 1 1 10 7618 1 1 44 GLN CB C 0.461 -8.241 -2.796 1.00 . A A . 43 GLN CB 1 1 10 7619 1 1 44 GLN CD C -2.015 -7.746 -2.664 1.00 . A A . 43 GLN CD 1 1 10 7620 1 1 44 GLN CG C -0.704 -7.437 -3.356 1.00 . A A . 43 GLN CG 1 1 10 7621 1 1 44 GLN H H 2.794 -8.988 -2.014 1.00 . A A . 43 GLN H 1 1 10 7622 1 1 44 GLN HA H 1.560 -8.680 -4.580 1.00 . A A . 43 GLN HA 1 1 10 7623 1 1 44 GLN HB2 H 0.154 -9.274 -2.724 1.00 . A A . 43 GLN HB2 1 1 10 7624 1 1 44 GLN HB3 H 0.680 -7.871 -1.807 1.00 . A A . 43 GLN HB3 1 1 10 7625 1 1 44 GLN HE21 H -1.715 -6.282 -1.361 1.00 . A A . 43 GLN HE21 1 1 10 7626 1 1 44 GLN HE22 H -3.187 -7.174 -1.164 1.00 . A A . 43 GLN HE22 1 1 10 7627 1 1 44 GLN HG2 H -0.486 -6.383 -3.231 1.00 . A A . 43 GLN HG2 1 1 10 7628 1 1 44 GLN HG3 H -0.805 -7.659 -4.407 1.00 . A A . 43 GLN HG3 1 1 10 7629 1 1 44 GLN N N 2.849 -8.810 -2.979 1.00 . A A . 43 GLN N 1 1 10 7630 1 1 44 GLN NE2 N -2.334 -6.991 -1.625 1.00 . A A . 43 GLN NE2 1 1 10 7631 1 1 44 GLN O O 2.645 -6.000 -3.140 1.00 . A A . 43 GLN O 1 1 10 7632 1 1 44 GLN OE1 O -2.742 -8.650 -3.070 1.00 . A A . 43 GLN OE1 1 1 10 7633 1 1 45 LYS C C 0.695 -4.043 -5.294 1.00 . A A . 44 LYS C 1 1 10 7634 1 1 45 LYS CA C 1.929 -4.898 -5.570 1.00 . A A . 44 LYS CA 1 1 10 7635 1 1 45 LYS CB C 2.246 -4.861 -7.068 1.00 . A A . 44 LYS CB 1 1 10 7636 1 1 45 LYS CD C 4.435 -3.637 -7.237 1.00 . A A . 44 LYS CD 1 1 10 7637 1 1 45 LYS CE C 5.221 -4.212 -8.413 1.00 . A A . 44 LYS CE 1 1 10 7638 1 1 45 LYS CG C 2.940 -3.588 -7.519 1.00 . A A . 44 LYS CG 1 1 10 7639 1 1 45 LYS H H 1.216 -6.879 -5.764 1.00 . A A . 44 LYS H 1 1 10 7640 1 1 45 LYS HA H 2.768 -4.511 -5.012 1.00 . A A . 44 LYS HA 1 1 10 7641 1 1 45 LYS HB2 H 2.884 -5.699 -7.309 1.00 . A A . 44 LYS HB2 1 1 10 7642 1 1 45 LYS HB3 H 1.322 -4.955 -7.619 1.00 . A A . 44 LYS HB3 1 1 10 7643 1 1 45 LYS HD2 H 4.786 -2.634 -7.041 1.00 . A A . 44 LYS HD2 1 1 10 7644 1 1 45 LYS HD3 H 4.604 -4.254 -6.367 1.00 . A A . 44 LYS HD3 1 1 10 7645 1 1 45 LYS HE2 H 5.117 -3.545 -9.255 1.00 . A A . 44 LYS HE2 1 1 10 7646 1 1 45 LYS HE3 H 6.263 -4.270 -8.133 1.00 . A A . 44 LYS HE3 1 1 10 7647 1 1 45 LYS HG2 H 2.790 -3.463 -8.581 1.00 . A A . 44 LYS HG2 1 1 10 7648 1 1 45 LYS HG3 H 2.511 -2.748 -6.992 1.00 . A A . 44 LYS HG3 1 1 10 7649 1 1 45 LYS HZ1 H 5.397 -5.963 -9.540 1.00 . A A . 44 LYS HZ1 1 1 10 7650 1 1 45 LYS HZ2 H 3.796 -5.519 -9.227 1.00 . A A . 44 LYS HZ2 1 1 10 7651 1 1 45 LYS HZ3 H 4.738 -6.214 -8.000 1.00 . A A . 44 LYS HZ3 1 1 10 7652 1 1 45 LYS N N 1.685 -6.265 -5.149 1.00 . A A . 44 LYS N 1 1 10 7653 1 1 45 LYS NZ N 4.757 -5.569 -8.821 1.00 . A A . 44 LYS NZ 1 1 10 7654 1 1 45 LYS O O -0.318 -4.176 -5.983 1.00 . A A . 44 LYS O 1 1 10 7655 1 1 46 LEU C C 0.041 -0.836 -4.196 1.00 . A A . 45 LEU C 1 1 10 7656 1 1 46 LEU CA C -0.361 -2.302 -3.987 1.00 . A A . 45 LEU CA 1 1 10 7657 1 1 46 LEU CB C -0.938 -2.604 -2.567 1.00 . A A . 45 LEU CB 1 1 10 7658 1 1 46 LEU CD1 C 1.271 -2.474 -1.355 1.00 . A A . 45 LEU CD1 1 1 10 7659 1 1 46 LEU CD2 C -0.382 -0.605 -1.107 1.00 . A A . 45 LEU CD2 1 1 10 7660 1 1 46 LEU CG C -0.193 -2.102 -1.316 1.00 . A A . 45 LEU CG 1 1 10 7661 1 1 46 LEU H H 1.597 -3.098 -3.772 1.00 . A A . 45 LEU H 1 1 10 7662 1 1 46 LEU HA H -1.130 -2.528 -4.714 1.00 . A A . 45 LEU HA 1 1 10 7663 1 1 46 LEU HB2 H -1.937 -2.204 -2.526 1.00 . A A . 45 LEU HB2 1 1 10 7664 1 1 46 LEU HB3 H -1.010 -3.684 -2.475 1.00 . A A . 45 LEU HB3 1 1 10 7665 1 1 46 LEU HD11 H 1.362 -3.537 -1.538 1.00 . A A . 45 LEU HD11 1 1 10 7666 1 1 46 LEU HD12 H 1.726 -2.230 -0.407 1.00 . A A . 45 LEU HD12 1 1 10 7667 1 1 46 LEU HD13 H 1.762 -1.929 -2.147 1.00 . A A . 45 LEU HD13 1 1 10 7668 1 1 46 LEU HD21 H 0.056 -0.066 -1.933 1.00 . A A . 45 LEU HD21 1 1 10 7669 1 1 46 LEU HD22 H 0.099 -0.307 -0.186 1.00 . A A . 45 LEU HD22 1 1 10 7670 1 1 46 LEU HD23 H -1.439 -0.381 -1.051 1.00 . A A . 45 LEU HD23 1 1 10 7671 1 1 46 LEU HG H -0.615 -2.601 -0.454 1.00 . A A . 45 LEU HG 1 1 10 7672 1 1 46 LEU N N 0.767 -3.171 -4.297 1.00 . A A . 45 LEU N 1 1 10 7673 1 1 46 LEU O O 1.212 -0.476 -4.025 1.00 . A A . 45 LEU O 1 1 10 7674 1 1 47 ILE C C -0.332 2.216 -3.729 1.00 . A A . 46 ILE C 1 1 10 7675 1 1 47 ILE CA C -0.649 1.386 -4.969 1.00 . A A . 46 ILE CA 1 1 10 7676 1 1 47 ILE CB C -1.839 2.080 -5.706 1.00 . A A . 46 ILE CB 1 1 10 7677 1 1 47 ILE CD1 C -2.739 0.062 -7.018 1.00 . A A . 46 ILE CD1 1 1 10 7678 1 1 47 ILE CG1 C -2.147 1.453 -7.072 1.00 . A A . 46 ILE CG1 1 1 10 7679 1 1 47 ILE CG2 C -1.548 3.567 -5.909 1.00 . A A . 46 ILE CG2 1 1 10 7680 1 1 47 ILE H H -1.838 -0.351 -4.690 1.00 . A A . 46 ILE H 1 1 10 7681 1 1 47 ILE HA H 0.210 1.403 -5.625 1.00 . A A . 46 ILE HA 1 1 10 7682 1 1 47 ILE HB H -2.713 1.998 -5.076 1.00 . A A . 46 ILE HB 1 1 10 7683 1 1 47 ILE HD11 H -2.986 -0.262 -8.019 1.00 . A A . 46 ILE HD11 1 1 10 7684 1 1 47 ILE HD12 H -3.631 0.072 -6.411 1.00 . A A . 46 ILE HD12 1 1 10 7685 1 1 47 ILE HD13 H -2.017 -0.618 -6.589 1.00 . A A . 46 ILE HD13 1 1 10 7686 1 1 47 ILE HG12 H -2.857 2.090 -7.584 1.00 . A A . 46 ILE HG12 1 1 10 7687 1 1 47 ILE HG13 H -1.234 1.407 -7.649 1.00 . A A . 46 ILE HG13 1 1 10 7688 1 1 47 ILE HG21 H -0.682 3.679 -6.546 1.00 . A A . 46 ILE HG21 1 1 10 7689 1 1 47 ILE HG22 H -1.352 4.031 -4.952 1.00 . A A . 46 ILE HG22 1 1 10 7690 1 1 47 ILE HG23 H -2.401 4.041 -6.371 1.00 . A A . 46 ILE HG23 1 1 10 7691 1 1 47 ILE N N -0.918 -0.011 -4.619 1.00 . A A . 46 ILE N 1 1 10 7692 1 1 47 ILE O O -0.988 2.085 -2.693 1.00 . A A . 46 ILE O 1 1 10 7693 1 1 48 VAL C C 1.623 5.278 -3.500 1.00 . A A . 47 VAL C 1 1 10 7694 1 1 48 VAL CA C 0.973 4.059 -2.840 1.00 . A A . 47 VAL CA 1 1 10 7695 1 1 48 VAL CB C 1.883 3.488 -1.726 1.00 . A A . 47 VAL CB 1 1 10 7696 1 1 48 VAL CG1 C 3.214 2.996 -2.276 1.00 . A A . 47 VAL CG1 1 1 10 7697 1 1 48 VAL CG2 C 2.092 4.524 -0.632 1.00 . A A . 47 VAL CG2 1 1 10 7698 1 1 48 VAL H H 1.211 3.055 -4.672 1.00 . A A . 47 VAL H 1 1 10 7699 1 1 48 VAL HA H 0.038 4.367 -2.381 1.00 . A A . 47 VAL HA 1 1 10 7700 1 1 48 VAL HB H 1.376 2.641 -1.283 1.00 . A A . 47 VAL HB 1 1 10 7701 1 1 48 VAL HG11 H 3.726 3.812 -2.762 1.00 . A A . 47 VAL HG11 1 1 10 7702 1 1 48 VAL HG12 H 3.037 2.206 -2.991 1.00 . A A . 47 VAL HG12 1 1 10 7703 1 1 48 VAL HG13 H 3.821 2.619 -1.466 1.00 . A A . 47 VAL HG13 1 1 10 7704 1 1 48 VAL HG21 H 1.148 4.730 -0.147 1.00 . A A . 47 VAL HG21 1 1 10 7705 1 1 48 VAL HG22 H 2.482 5.432 -1.067 1.00 . A A . 47 VAL HG22 1 1 10 7706 1 1 48 VAL HG23 H 2.794 4.143 0.096 1.00 . A A . 47 VAL HG23 1 1 10 7707 1 1 48 VAL N N 0.664 3.074 -3.854 1.00 . A A . 47 VAL N 1 1 10 7708 1 1 48 VAL O O 2.581 5.167 -4.259 1.00 . A A . 47 VAL O 1 1 10 7709 1 1 49 LYS C C 1.527 8.798 -2.775 1.00 . A A . 48 LYS C 1 1 10 7710 1 1 49 LYS CA C 1.648 7.665 -3.784 1.00 . A A . 48 LYS CA 1 1 10 7711 1 1 49 LYS CB C 1.044 8.051 -5.139 1.00 . A A . 48 LYS CB 1 1 10 7712 1 1 49 LYS CD C -1.011 8.476 -6.522 1.00 . A A . 48 LYS CD 1 1 10 7713 1 1 49 LYS CE C -2.510 8.726 -6.502 1.00 . A A . 48 LYS CE 1 1 10 7714 1 1 49 LYS CG C -0.463 8.237 -5.126 1.00 . A A . 48 LYS CG 1 1 10 7715 1 1 49 LYS H H 0.217 6.464 -2.784 1.00 . A A . 48 LYS H 1 1 10 7716 1 1 49 LYS HA H 2.695 7.468 -3.928 1.00 . A A . 48 LYS HA 1 1 10 7717 1 1 49 LYS HB2 H 1.497 8.975 -5.468 1.00 . A A . 48 LYS HB2 1 1 10 7718 1 1 49 LYS HB3 H 1.284 7.274 -5.852 1.00 . A A . 48 LYS HB3 1 1 10 7719 1 1 49 LYS HD2 H -0.520 9.337 -6.950 1.00 . A A . 48 LYS HD2 1 1 10 7720 1 1 49 LYS HD3 H -0.810 7.606 -7.129 1.00 . A A . 48 LYS HD3 1 1 10 7721 1 1 49 LYS HE2 H -2.881 8.694 -7.515 1.00 . A A . 48 LYS HE2 1 1 10 7722 1 1 49 LYS HE3 H -2.984 7.948 -5.921 1.00 . A A . 48 LYS HE3 1 1 10 7723 1 1 49 LYS HG2 H -0.919 7.348 -4.719 1.00 . A A . 48 LYS HG2 1 1 10 7724 1 1 49 LYS HG3 H -0.705 9.086 -4.502 1.00 . A A . 48 LYS HG3 1 1 10 7725 1 1 49 LYS HZ1 H -2.319 10.196 -5.021 1.00 . A A . 48 LYS HZ1 1 1 10 7726 1 1 49 LYS HZ2 H -3.870 10.094 -5.698 1.00 . A A . 48 LYS HZ2 1 1 10 7727 1 1 49 LYS HZ3 H -2.607 10.811 -6.576 1.00 . A A . 48 LYS HZ3 1 1 10 7728 1 1 49 LYS N N 1.054 6.436 -3.277 1.00 . A A . 48 LYS N 1 1 10 7729 1 1 49 LYS NZ N -2.848 10.047 -5.907 1.00 . A A . 48 LYS NZ 1 1 10 7730 1 1 49 LYS O O 0.433 9.184 -2.369 1.00 . A A . 48 LYS O 1 1 10 7731 1 1 50 LYS C C 2.337 11.726 -2.033 1.00 . A A . 49 LYS C 1 1 10 7732 1 1 50 LYS CA C 2.724 10.394 -1.393 1.00 . A A . 49 LYS CA 1 1 10 7733 1 1 50 LYS CB C 4.121 10.471 -0.752 1.00 . A A . 49 LYS CB 1 1 10 7734 1 1 50 LYS CD C 5.476 11.321 -2.726 1.00 . A A . 49 LYS CD 1 1 10 7735 1 1 50 LYS CE C 5.934 12.610 -2.066 1.00 . A A . 49 LYS CE 1 1 10 7736 1 1 50 LYS CG C 5.280 10.200 -1.715 1.00 . A A . 49 LYS CG 1 1 10 7737 1 1 50 LYS H H 3.509 8.956 -2.727 1.00 . A A . 49 LYS H 1 1 10 7738 1 1 50 LYS HA H 2.003 10.168 -0.622 1.00 . A A . 49 LYS HA 1 1 10 7739 1 1 50 LYS HB2 H 4.257 11.459 -0.337 1.00 . A A . 49 LYS HB2 1 1 10 7740 1 1 50 LYS HB3 H 4.175 9.747 0.050 1.00 . A A . 49 LYS HB3 1 1 10 7741 1 1 50 LYS HD2 H 6.220 11.015 -3.445 1.00 . A A . 49 LYS HD2 1 1 10 7742 1 1 50 LYS HD3 H 4.538 11.500 -3.232 1.00 . A A . 49 LYS HD3 1 1 10 7743 1 1 50 LYS HE2 H 5.886 13.405 -2.794 1.00 . A A . 49 LYS HE2 1 1 10 7744 1 1 50 LYS HE3 H 5.268 12.834 -1.245 1.00 . A A . 49 LYS HE3 1 1 10 7745 1 1 50 LYS HG2 H 6.189 10.090 -1.143 1.00 . A A . 49 LYS HG2 1 1 10 7746 1 1 50 LYS HG3 H 5.078 9.282 -2.245 1.00 . A A . 49 LYS HG3 1 1 10 7747 1 1 50 LYS HZ1 H 7.997 12.427 -2.343 1.00 . A A . 49 LYS HZ1 1 1 10 7748 1 1 50 LYS HZ2 H 7.430 11.681 -0.929 1.00 . A A . 49 LYS HZ2 1 1 10 7749 1 1 50 LYS HZ3 H 7.564 13.372 -1.002 1.00 . A A . 49 LYS HZ3 1 1 10 7750 1 1 50 LYS N N 2.671 9.310 -2.363 1.00 . A A . 49 LYS N 1 1 10 7751 1 1 50 LYS NZ N 7.326 12.513 -1.548 1.00 . A A . 49 LYS NZ 1 1 10 7752 1 1 50 LYS O O 2.406 11.881 -3.254 1.00 . A A . 49 LYS O 1 1 10 7753 1 1 51 GLY C C 0.291 13.990 -2.507 1.00 . A A . 50 GLY C 1 1 10 7754 1 1 51 GLY CA C 1.566 13.992 -1.691 1.00 . A A . 50 GLY CA 1 1 10 7755 1 1 51 GLY H H 1.826 12.467 -0.249 1.00 . A A . 50 GLY H 1 1 10 7756 1 1 51 GLY HA2 H 1.438 14.652 -0.846 1.00 . A A . 50 GLY HA2 1 1 10 7757 1 1 51 GLY HA3 H 2.373 14.363 -2.305 1.00 . A A . 50 GLY HA3 1 1 10 7758 1 1 51 GLY N N 1.914 12.671 -1.203 1.00 . A A . 50 GLY N 1 1 10 7759 1 1 51 GLY O O 0.223 14.607 -3.567 1.00 . A A . 50 GLY O 1 1 10 7760 1 1 52 SER C C -3.048 13.966 -1.828 1.00 . A A . 51 SER C 1 1 10 7761 1 1 52 SER CA C -2.008 13.256 -2.686 1.00 . A A . 51 SER CA 1 1 10 7762 1 1 52 SER CB C -2.435 11.813 -2.961 1.00 . A A . 51 SER CB 1 1 10 7763 1 1 52 SER H H -0.599 12.781 -1.185 1.00 . A A . 51 SER H 1 1 10 7764 1 1 52 SER HA H -1.907 13.780 -3.626 1.00 . A A . 51 SER HA 1 1 10 7765 1 1 52 SER HB2 H -2.532 11.285 -2.024 1.00 . A A . 51 SER HB2 1 1 10 7766 1 1 52 SER HB3 H -3.383 11.815 -3.474 1.00 . A A . 51 SER HB3 1 1 10 7767 1 1 52 SER HG H -0.604 11.228 -3.362 1.00 . A A . 51 SER HG 1 1 10 7768 1 1 52 SER N N -0.718 13.284 -2.023 1.00 . A A . 51 SER N 1 1 10 7769 1 1 52 SER O O -3.325 15.153 -2.089 1.00 . A A . 51 SER O 1 1 10 7770 1 1 52 SER OG O -1.477 11.142 -3.768 1.00 . A A . 51 SER OG 1 1 stop_ save_
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