NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
380897 | 1iqs | 5129 | cing | 4-filtered-FRED | STAR | entry | full | 596 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1iqs # This FRED archive file contains, for PDB entry <1iqs>: # # - Coordinates and sequence information from the PDB mmCIF file # - NMR restraints from the PDB MR file # # In this file, the coordinates and NMR restraints share the same atom names, # and in this way can differ from the data deposited at the wwPDB. To achieve # this aim, the NMR restraints were parsed from their original format files, and # the coordinates and NMR restraints information were subsequently harmonized. # # Due to the complexity of this harmonization process and the filtering process # used in creating these files, the NMR restraints information in these files # may differ significantly from that in the originally deposited file. Other # modifications could have occurred to the NMR restraints information, or data # could have been lost because of parsing or conversion errors. The PDB file # remains the authoritative reference for the atomic coordinates and the # originally deposited restraints files remain the primary reference for these # data. # # This file is generated at the BioMagResBank (BMRB) in collaboration with the # PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and # the CMBI/IMM group at the Radboud University of Nijmegen. # # Several software packages were used to produce this file: # # - Wattos (BMRB and CMBI/IMM). # - FormatConverter and NMRStarExport (PDBe). # - CCPN framework (http://www.ccpn.ac.uk/). # # More information about this process can be found in the references below. # Please cite the original reference for this PDB entry. # # JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL # Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED # containing converted and filtered sets of experimental NMR restraints and # coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12. # # WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL # Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy: # development of a software pipeline. Proteins 59, 687-696. # # JF Doreleijers, W Vranken, C Penkett, J Lin, CF Schulte, G Vuister, G Vriend, # JL Markley, EL Ulrich. BioMagResBank database `NMR Restraints Grid` with # curated sets of experimental NMR restraints for over 4,000 protein and nucleic # acid PDB entries. (in preparation) save_Conversion_project_for_entry_Name_1 _Study_list.Sf_category study_list _Study_list.Entry_ID 1 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project for entry 1" NMR . 1 1 stop_ save_ save_originalConstraints_1 _Entry.Sf_category entry_information _Entry.ID 1 _Entry.Title "Data for entry 1" _Entry.NMR_STAR_version 3.1.0.8 _Entry.Experimental_method NMR _Entry.Details . save_ save_assembly_1iqs _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 1iqs _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 9945.29 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 $MTH1880 A . 1 1 stop_ save_ save_MTH1880 _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name MTH1880 _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code LFIATLKGIFTLKDLPEEFRPFVDYKAGLEKKKLSDDDEIAIISIKGTQSNHVLFLSSYNSVDEIRKELEEAGAKINHTTLKILEGHL _Entity.Number_of_monomers 88 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 LEU . 1 1 2 PHE . 1 1 3 ILE . 1 1 4 ALA . 1 1 5 THR . 1 1 6 LEU . 1 1 7 LYS . 1 1 8 GLY . 1 1 9 ILE . 1 1 10 PHE . 1 1 11 THR . 1 1 12 LEU . 1 1 13 LYS . 1 1 14 ASP . 1 1 15 LEU . 1 1 16 PRO . 1 1 17 GLU . 1 1 18 GLU . 1 1 19 PHE . 1 1 20 ARG . 1 1 21 PRO . 1 1 22 PHE . 1 1 23 VAL . 1 1 24 ASP . 1 1 25 TYR . 1 1 26 LYS . 1 1 27 ALA . 1 1 28 GLY . 1 1 29 LEU . 1 1 30 GLU . 1 1 31 LYS . 1 1 32 LYS . 1 1 33 LYS . 1 1 34 LEU . 1 1 35 SER . 1 1 36 ASP . 1 1 37 ASP . 1 1 38 ASP . 1 1 39 GLU . 1 1 40 ILE . 1 1 41 ALA . 1 1 42 ILE . 1 1 43 ILE . 1 1 44 SER . 1 1 45 ILE . 1 1 46 LYS . 1 1 47 GLY . 1 1 48 THR . 1 1 49 GLN . 1 1 50 SER . 1 1 51 ASN . 1 1 52 HIS . 1 1 53 VAL . 1 1 54 LEU . 1 1 55 PHE . 1 1 56 LEU . 1 1 57 SER . 1 1 58 SER . 1 1 59 TYR . 1 1 60 ASN . 1 1 61 SER . 1 1 62 VAL . 1 1 63 ASP . 1 1 64 GLU . 1 1 65 ILE . 1 1 66 ARG . 1 1 67 LYS . 1 1 68 GLU . 1 1 69 LEU . 1 1 70 GLU . 1 1 71 GLU . 1 1 72 ALA . 1 1 73 GLY . 1 1 74 ALA . 1 1 75 LYS . 1 1 76 ILE . 1 1 77 ASN . 1 1 78 HIS . 1 1 79 THR . 1 1 80 THR . 1 1 81 LEU . 1 1 82 LYS . 1 1 83 ILE . 1 1 84 LEU . 1 1 85 GLU . 1 1 86 GLY . 1 1 87 HIS . 1 1 88 LEU . 1 1 stop_ loop_ _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID LEU 1 1 1 1 PHE 2 2 1 1 ILE 3 3 1 1 ALA 4 4 1 1 THR 5 5 1 1 LEU 6 6 1 1 LYS 7 7 1 1 GLY 8 8 1 1 ILE 9 9 1 1 PHE 10 10 1 1 THR 11 11 1 1 LEU 12 12 1 1 LYS 13 13 1 1 ASP 14 14 1 1 LEU 15 15 1 1 PRO 16 16 1 1 GLU 17 17 1 1 GLU 18 18 1 1 PHE 19 19 1 1 ARG 20 20 1 1 PRO 21 21 1 1 PHE 22 22 1 1 VAL 23 23 1 1 ASP 24 24 1 1 TYR 25 25 1 1 LYS 26 26 1 1 ALA 27 27 1 1 GLY 28 28 1 1 LEU 29 29 1 1 GLU 30 30 1 1 LYS 31 31 1 1 LYS 32 32 1 1 LYS 33 33 1 1 LEU 34 34 1 1 SER 35 35 1 1 ASP 36 36 1 1 ASP 37 37 1 1 ASP 38 38 1 1 GLU 39 39 1 1 ILE 40 40 1 1 ALA 41 41 1 1 ILE 42 42 1 1 ILE 43 43 1 1 SER 44 44 1 1 ILE 45 45 1 1 LYS 46 46 1 1 GLY 47 47 1 1 THR 48 48 1 1 GLN 49 49 1 1 SER 50 50 1 1 ASN 51 51 1 1 HIS 52 52 1 1 VAL 53 53 1 1 LEU 54 54 1 1 PHE 55 55 1 1 LEU 56 56 1 1 SER 57 57 1 1 SER 58 58 1 1 TYR 59 59 1 1 ASN 60 60 1 1 SER 61 61 1 1 VAL 62 62 1 1 ASP 63 63 1 1 GLU 64 64 1 1 ILE 65 65 1 1 ARG 66 66 1 1 LYS 67 67 1 1 GLU 68 68 1 1 LEU 69 69 1 1 GLU 70 70 1 1 GLU 71 71 1 1 ALA 72 72 1 1 GLY 73 73 1 1 ALA 74 74 1 1 LYS 75 75 1 1 ILE 76 76 1 1 ASN 77 77 1 1 HIS 78 78 1 1 THR 79 79 1 1 THR 80 80 1 1 LEU 81 81 1 1 LYS 82 82 1 1 ILE 83 83 1 1 LEU 84 84 1 1 GLU 85 85 1 1 GLY 86 86 1 1 HIS 87 87 1 1 LEU 88 88 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 121 1 . . . 1 1 122 1 . . . 1 1 123 1 . . . 1 1 124 1 . . . 1 1 125 1 . . . 1 1 126 1 . . . 1 1 127 1 . . . 1 1 128 1 . . . 1 1 129 1 . . . 1 1 130 1 . . . 1 1 131 1 . . . 1 1 132 1 . . . 1 1 133 1 . . . 1 1 134 1 . . . 1 1 135 1 . . . 1 1 136 1 . . . 1 1 137 1 . . . 1 1 138 1 . . . 1 1 139 1 . . . 1 1 140 1 . . . 1 1 141 1 . . . 1 1 142 1 . . . 1 1 143 1 . . . 1 1 144 1 . . . 1 1 145 1 . . . 1 1 146 1 . . . 1 1 147 1 . . . 1 1 148 1 . . . 1 1 149 1 . . . 1 1 150 1 . . . 1 1 151 1 . . . 1 1 152 1 . . . 1 1 153 1 . . . 1 1 154 1 . . . 1 1 155 1 . . . 1 1 156 1 . . . 1 1 157 1 . . . 1 1 158 1 . . . 1 1 159 1 . . . 1 1 160 1 . . . 1 1 161 1 . . . 1 1 162 1 . . . 1 1 163 1 . . . 1 1 164 1 . . . 1 1 165 1 . . . 1 1 166 1 . . . 1 1 167 1 . . . 1 1 168 1 . . . 1 1 169 1 . . . 1 1 170 1 . . . 1 1 171 1 . . . 1 1 172 1 . . . 1 1 173 1 . . . 1 1 174 1 . . . 1 1 175 1 . . . 1 1 176 1 . . . 1 1 177 1 . . . 1 1 178 1 . . . 1 1 179 1 . . . 1 1 180 1 . . . 1 1 181 1 . . . 1 1 182 1 . . . 1 1 183 1 . . . 1 1 184 1 . . . 1 1 185 1 . . . 1 1 186 1 . . . 1 1 187 1 . . . 1 1 188 1 . . . 1 1 189 1 . . . 1 1 190 1 . . . 1 1 191 1 . . . 1 1 192 1 . . . 1 1 193 1 . . . 1 1 194 1 . . . 1 1 195 1 . . . 1 1 196 1 . . . 1 1 197 1 . . . 1 1 198 1 . . . 1 1 199 1 . . . 1 1 200 1 . . . 1 1 201 1 . . . 1 1 202 1 . . . 1 1 203 1 . . . 1 1 204 1 . . . 1 1 205 1 . . . 1 1 206 1 . . . 1 1 207 1 . . . 1 1 208 1 . . . 1 1 209 1 . . . 1 1 210 1 . . . 1 1 211 1 . . . 1 1 212 1 . . . 1 1 213 1 . . . 1 1 214 1 . . . 1 1 215 1 . . . 1 1 216 1 . . . 1 1 217 1 . . . 1 1 218 1 . . . 1 1 219 1 . . . 1 1 220 1 . . . 1 1 221 1 . . . 1 1 222 1 . . . 1 1 223 1 . . . 1 1 224 1 . . . 1 1 225 1 . . . 1 1 226 1 . . . 1 1 227 1 . . . 1 1 228 1 . . . 1 1 229 1 . . . 1 1 230 1 . . . 1 1 231 1 . . . 1 1 232 1 . . . 1 1 233 1 . . . 1 1 234 1 . . . 1 1 235 1 . . . 1 1 236 1 . . . 1 1 237 1 . . . 1 1 238 1 . . . 1 1 239 1 . . . 1 1 240 1 . . . 1 1 241 1 . . . 1 1 242 1 . . . 1 1 243 1 . . . 1 1 244 1 . . . 1 1 245 1 . . . 1 1 246 1 . . . 1 1 247 1 . . . 1 1 248 1 . . . 1 1 249 1 . . . 1 1 250 1 . . . 1 1 251 1 . . . 1 1 252 1 . . . 1 1 253 1 . . . 1 1 254 1 . . . 1 1 255 1 . . . 1 1 256 1 . . . 1 1 257 1 . . . 1 1 258 1 . . . 1 1 259 1 . . . 1 1 260 1 . . . 1 1 261 1 . . . 1 1 262 1 . . . 1 1 263 1 . . . 1 1 264 1 . . . 1 1 265 1 . . . 1 1 266 1 . . . 1 1 267 1 . . . 1 1 268 1 . . . 1 1 269 1 . . . 1 1 270 1 . . . 1 1 271 1 . . . 1 1 272 1 . . . 1 1 273 1 . . . 1 1 274 1 . . . 1 1 275 1 . . . 1 1 276 1 . . . 1 1 277 1 . . . 1 1 278 1 . . . 1 1 279 1 . . . 1 1 280 1 . . . 1 1 281 1 . . . 1 1 282 1 . . . 1 1 283 1 . . . 1 1 284 1 . . . 1 1 285 1 . . . 1 1 286 1 . . . 1 1 287 1 . . . 1 1 288 1 . . . 1 1 289 1 . . . 1 1 290 1 . . . 1 1 291 1 . . . 1 1 292 1 . . . 1 1 293 1 . . . 1 1 294 1 . . . 1 1 295 1 . . . 1 1 296 1 . . . 1 1 297 1 . . . 1 1 298 1 . . . 1 1 299 1 . . . 1 1 300 1 . . . 1 1 301 1 . . . 1 1 302 1 . . . 1 1 303 1 . . . 1 1 304 1 . . . 1 1 305 1 . . . 1 1 306 1 . . . 1 1 307 1 . . . 1 1 308 1 . . . 1 1 309 1 . . . 1 1 310 1 . . . 1 1 311 1 . . . 1 1 312 1 . . . 1 1 313 1 . . . 1 1 314 1 . . . 1 1 315 1 . . . 1 1 316 1 . . . 1 1 317 1 . . . 1 1 318 1 . . . 1 1 319 1 . . . 1 1 320 1 . . . 1 1 321 1 . . . 1 1 322 1 . . . 1 1 323 1 . . . 1 1 324 1 . . . 1 1 325 1 . . . 1 1 326 1 . . . 1 1 327 1 . . . 1 1 328 1 . . . 1 1 329 1 . . . 1 1 330 1 . . . 1 1 331 1 . . . 1 1 332 1 . . . 1 1 333 1 . . . 1 1 334 1 . . . 1 1 335 1 . . . 1 1 336 1 . . . 1 1 337 1 . . . 1 1 338 1 . . . 1 1 339 1 . . . 1 1 340 1 . . . 1 1 341 1 . . . 1 1 342 1 . . . 1 1 343 1 . . . 1 1 344 1 . . . 1 1 345 1 . . . 1 1 346 1 . . . 1 1 347 1 . . . 1 1 348 1 . . . 1 1 349 1 . . . 1 1 350 1 . . . 1 1 351 1 . . . 1 1 352 1 . . . 1 1 353 1 . . . 1 1 354 1 . . . 1 1 355 1 . . . 1 1 356 1 . . . 1 1 357 1 . . . 1 1 358 1 . . . 1 1 359 1 . . . 1 1 360 1 . . . 1 1 361 1 . . . 1 1 362 1 . . . 1 1 363 1 . . . 1 1 364 1 . . . 1 1 365 1 . . . 1 1 366 1 . . . 1 1 367 1 . . . 1 1 368 1 . . . 1 1 369 1 . . . 1 1 370 1 . . . 1 1 371 1 . . . 1 1 372 1 . . . 1 1 373 1 . . . 1 1 374 1 . . . 1 1 375 1 . . . 1 1 376 1 . . . 1 1 377 1 . . . 1 1 378 1 . . . 1 1 379 1 . . . 1 1 380 1 . . . 1 1 381 1 . . . 1 1 382 1 . . . 1 1 383 1 . . . 1 1 384 1 . . . 1 1 385 1 . . . 1 1 386 1 . . . 1 1 387 1 . . . 1 1 388 1 . . . 1 1 389 1 . . . 1 1 390 1 . . . 1 1 391 1 . . . 1 1 392 1 . . . 1 1 393 1 . . . 1 1 394 1 . . . 1 1 395 1 . . . 1 1 396 1 . . . 1 1 397 1 . . . 1 1 398 1 . . . 1 1 399 1 . . . 1 1 400 1 . . . 1 1 401 1 . . . 1 1 402 1 . . . 1 1 403 1 . . . 1 1 404 1 . . . 1 1 405 1 . . . 1 1 406 1 . . . 1 1 407 1 . . . 1 1 408 1 . . . 1 1 409 1 . . . 1 1 410 1 . . . 1 1 411 1 . . . 1 1 412 1 . . . 1 1 413 1 . . . 1 1 414 1 . . . 1 1 415 1 . . . 1 1 416 1 . . . 1 1 417 1 . . . 1 1 418 1 . . . 1 1 419 1 . . . 1 1 420 1 . . . 1 1 421 1 . . . 1 1 422 1 . . . 1 1 423 1 . . . 1 1 424 1 . . . 1 1 425 1 . . . 1 1 426 1 . . . 1 1 427 1 . . . 1 1 428 1 . . . 1 1 429 1 . . . 1 1 430 1 . . . 1 1 431 1 . . . 1 1 432 1 . . . 1 1 433 1 . . . 1 1 434 1 . . . 1 1 435 1 . . . 1 1 436 1 . . . 1 1 437 1 . . . 1 1 438 1 . . . 1 1 439 1 . . . 1 1 440 1 . . . 1 1 441 1 . . . 1 1 442 1 . . . 1 1 443 1 . . . 1 1 444 1 . . . 1 1 445 1 . . . 1 1 446 1 . . . 1 1 447 1 . . . 1 1 448 1 . . . 1 1 449 1 . . . 1 1 450 1 . . . 1 1 451 1 . . . 1 1 452 1 . . . 1 1 453 1 . . . 1 1 454 1 . . . 1 1 455 1 . . . 1 1 456 1 . . . 1 1 457 1 . . . 1 1 458 1 . . . 1 1 459 1 . . . 1 1 460 1 . . . 1 1 461 1 . . . 1 1 462 1 . . . 1 1 463 1 . . . 1 1 464 1 . . . 1 1 465 1 . . . 1 1 466 1 . . . 1 1 467 1 . . . 1 1 468 1 . . . 1 1 469 1 . . . 1 1 470 1 . . . 1 1 471 1 . . . 1 1 472 1 . . . 1 1 473 1 . . . 1 1 474 1 . . . 1 1 475 1 . . . 1 1 476 1 . . . 1 1 477 1 . . . 1 1 478 1 . . . 1 1 479 1 . . . 1 1 480 1 . . . 1 1 481 1 . . . 1 1 482 1 . . . 1 1 483 1 . . . 1 1 484 1 . . . 1 1 485 1 . . . 1 1 486 1 . . . 1 1 487 1 . . . 1 1 488 1 . . . 1 1 489 1 . . . 1 1 490 1 . . . 1 1 491 1 . . . 1 1 492 1 . . . 1 1 493 1 . . . 1 1 494 1 . . . 1 1 495 1 . . . 1 1 496 1 . . . 1 1 497 1 . . . 1 1 498 1 . . . 1 1 499 1 . . . 1 1 500 1 . . . 1 1 501 1 . . . 1 1 502 1 . . . 1 1 503 1 . . . 1 1 504 1 . . . 1 1 505 1 . . . 1 1 506 1 . . . 1 1 507 1 . . . 1 1 508 1 . . . 1 1 509 1 . . . 1 1 510 1 . . . 1 1 511 1 . . . 1 1 512 1 . . . 1 1 513 1 . . . 1 1 514 1 . . . 1 1 515 1 . . . 1 1 516 1 . . . 1 1 517 1 . . . 1 1 518 1 . . . 1 1 519 1 . . . 1 1 520 1 . . . 1 1 521 1 . . . 1 1 522 1 . . . 1 1 523 1 . . . 1 1 524 1 . . . 1 1 525 1 . . . 1 1 526 1 . . . 1 1 527 1 . . . 1 1 528 1 . . . 1 1 529 1 . . . 1 1 530 1 . . . 1 1 531 1 . . . 1 1 532 1 . . . 1 1 533 1 . . . 1 1 534 1 . . . 1 1 535 1 . . . 1 1 536 1 . . . 1 1 537 1 . . . 1 1 538 1 . . . 1 1 539 1 . . . 1 1 540 1 . . . 1 1 541 1 . . . 1 1 542 1 . . . 1 1 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 1 LEU HA . 1 . HA 1 1 1 1 2 1 1 2 PHE H . 2 . HN 1 1 2 1 1 1 1 1 LEU QB . 1 . HB* 1 1 2 1 2 1 1 2 PHE H . 2 . HN 1 1 3 1 1 1 1 2 PHE QD . 2 . HD* 1 1 3 1 2 1 1 4 ALA H . 4 . HN 1 1 4 1 1 1 1 3 ILE HA . 3 . HA 1 1 4 1 2 1 1 4 ALA H . 4 . HN 1 1 5 1 1 1 1 3 ILE H . 3 . HN 1 1 5 1 2 1 1 4 ALA H . 4 . HN 1 1 6 1 1 1 1 4 ALA H . 4 . HN 1 1 6 1 2 1 1 4 ALA MB . 4 . HB* 1 1 7 1 1 1 1 4 ALA HA . 4 . HA 1 1 7 1 2 1 1 5 THR H . 5 . HN 1 1 8 1 1 1 1 4 ALA MB . 4 . HB* 1 1 8 1 2 1 1 5 THR H . 5 . HN 1 1 9 1 1 1 1 5 THR H . 5 . HN 1 1 9 1 2 1 1 5 THR HB . 5 . HB* 1 1 10 1 1 1 1 5 THR H . 5 . HN 1 1 10 1 2 1 1 5 THR HG1 . 5 . HG* 1 1 10 1 2 1 1 5 THR MG . 5 . HG* 1 1 11 1 1 1 1 5 THR HA . 5 . HA 1 1 11 1 2 1 1 6 LEU H . 6 . HN 1 1 12 1 1 1 1 6 LEU HA . 6 . HA 1 1 12 1 2 1 1 7 LYS H . 7 . HN 1 1 13 1 1 1 1 7 LYS HA . 7 . HA 1 1 13 1 2 1 1 8 GLY H . 8 . HN 1 1 14 1 1 1 1 7 LYS QB . 7 . HB* 1 1 14 1 2 1 1 8 GLY H . 8 . HN 1 1 15 1 1 1 1 7 LYS H . 7 . HN 1 1 15 1 2 1 1 8 GLY H . 8 . HN 1 1 16 1 1 1 1 8 GLY QA . 8 . HA* 1 1 16 1 2 1 1 9 ILE H . 9 . HN 1 1 17 1 1 1 1 8 GLY H . 8 . HN 1 1 17 1 2 1 1 9 ILE H . 9 . HN 1 1 18 1 1 1 1 9 ILE HA . 9 . HA 1 1 18 1 2 1 1 10 PHE H . 10 . HN 1 1 19 1 1 1 1 9 ILE HB . 9 . HB* 1 1 19 1 2 1 1 10 PHE H . 10 . HN 1 1 20 1 1 1 1 10 PHE HA . 10 . HA 1 1 20 1 2 1 1 11 THR H . 11 . HN 1 1 21 1 1 1 1 10 PHE QB . 10 . HB* 1 1 21 1 2 1 1 11 THR H . 11 . HN 1 1 22 1 1 1 1 11 THR H . 11 . HN 1 1 22 1 2 1 1 11 THR HB . 11 . HB* 1 1 23 1 1 1 1 11 THR HA . 11 . HA 1 1 23 1 2 1 1 12 LEU H . 12 . HN 1 1 24 1 1 1 1 11 THR HB . 11 . HB* 1 1 24 1 2 1 1 12 LEU H . 12 . HN 1 1 25 1 1 1 1 12 LEU H . 12 . HN 1 1 25 1 2 1 1 12 LEU QB . 12 . HB* 1 1 26 1 1 1 1 12 LEU H . 12 . HN 1 1 26 1 2 1 1 13 LYS H . 13 . HN 1 1 27 1 1 1 1 12 LEU QB . 12 . HB* 1 1 27 1 2 1 1 13 LYS H . 13 . HN 1 1 28 1 1 1 1 13 LYS H . 13 . HN 1 1 28 1 2 1 1 13 LYS QB . 13 . HB* 1 1 29 1 1 1 1 13 LYS H . 13 . HN 1 1 29 1 2 1 1 13 LYS QG . 13 . HG* 1 1 30 1 1 1 1 11 THR HA . 11 . HA 1 1 30 1 2 1 1 13 LYS H . 13 . HN 1 1 31 1 1 1 1 14 ASP H . 14 . HN 1 1 31 1 2 1 1 14 ASP QB . 14 . HB* 1 1 32 1 1 1 1 13 LYS H . 13 . HN 1 1 32 1 2 1 1 14 ASP H . 14 . HN 1 1 33 1 1 1 1 13 LYS HA . 13 . HA 1 1 33 1 2 1 1 14 ASP H . 14 . HN 1 1 34 1 1 1 1 15 LEU H . 15 . HN 1 1 34 1 2 1 1 15 LEU QB . 15 . HB* 1 1 35 1 1 1 1 14 ASP QB . 14 . HB* 1 1 35 1 2 1 1 15 LEU H . 15 . HN 1 1 36 1 1 1 1 10 PHE QD . 10 . HD* 1 1 36 1 2 1 1 15 LEU H . 15 . HN 1 1 37 1 1 1 1 10 PHE QD . 10 . HD* 1 1 37 1 2 1 1 15 LEU HA . 15 . HA 1 1 38 1 1 1 1 15 LEU H . 15 . HN 1 1 38 1 2 1 1 16 PRO QD . 16 . HD* 1 1 39 1 1 1 1 16 PRO HA . 16 . HA 1 1 39 1 2 1 1 17 GLU H . 17 . HN 1 1 40 1 1 1 1 16 PRO QB . 16 . HB* 1 1 40 1 2 1 1 17 GLU H . 17 . HN 1 1 41 1 1 1 1 17 GLU H . 17 . HN 1 1 41 1 2 1 1 17 GLU QB . 17 . HB* 1 1 42 1 1 1 1 18 GLU H . 18 . HN 1 1 42 1 2 1 1 18 GLU QB . 18 . HB* 1 1 43 1 1 1 1 18 GLU H . 18 . HN 1 1 43 1 2 1 1 18 GLU QG . 18 . HG* 1 1 44 1 1 1 1 17 GLU H . 17 . HN 1 1 44 1 2 1 1 18 GLU H . 18 . HN 1 1 45 1 1 1 1 17 GLU QB . 17 . HB* 1 1 45 1 2 1 1 18 GLU H . 18 . HN 1 1 46 1 1 1 1 17 GLU QG . 17 . HG* 1 1 46 1 2 1 1 18 GLU H . 18 . HN 1 1 47 1 1 1 1 18 GLU H . 18 . HN 1 1 47 1 2 1 1 19 PHE H . 19 . HN 1 1 48 1 1 1 1 18 GLU HA . 18 . HA 1 1 48 1 2 1 1 19 PHE H . 19 . HN 1 1 49 1 1 1 1 18 GLU QB . 18 . HB* 1 1 49 1 2 1 1 19 PHE H . 19 . HN 1 1 50 1 1 1 1 18 GLU QG . 18 . HG* 1 1 50 1 2 1 1 19 PHE H . 19 . HN 1 1 51 1 1 1 1 19 PHE HA . 19 . HA 1 1 51 1 2 1 1 20 ARG H . 20 . HN 1 1 52 1 1 1 1 19 PHE QB . 19 . HB* 1 1 52 1 2 1 1 20 ARG H . 20 . HN 1 1 53 1 1 1 1 19 PHE H . 19 . HN 1 1 53 1 2 1 1 20 ARG H . 20 . HN 1 1 54 1 1 1 1 20 ARG H . 20 . HN 1 1 54 1 2 1 1 21 PRO QD . 21 . HD* 1 1 55 1 1 1 1 22 PHE H . 22 . HN 1 1 55 1 2 1 1 23 VAL H . 23 . HN 1 1 56 1 1 1 1 22 PHE QB . 22 . HB* 1 1 56 1 2 1 1 23 VAL H . 23 . HN 1 1 57 1 1 1 1 23 VAL H . 23 . HN 1 1 57 1 2 1 1 23 VAL HB . 23 . HB 1 1 58 1 1 1 1 23 VAL H . 23 . HN 1 1 58 1 2 1 1 24 ASP H . 24 . HN 1 1 59 1 1 1 1 21 PRO HA . 21 . HA 1 1 59 1 2 1 1 24 ASP H . 24 . HN 1 1 60 1 1 1 1 23 VAL HB . 23 . HB* 1 1 60 1 2 1 1 24 ASP H . 24 . HN 1 1 61 1 1 1 1 24 ASP H . 24 . HN 1 1 61 1 2 1 1 25 TYR H . 25 . HN 1 1 62 1 1 1 1 22 PHE HA . 22 . HA 1 1 62 1 2 1 1 25 TYR H . 25 . HN 1 1 63 1 1 1 1 24 ASP QB . 24 . HB* 1 1 63 1 2 1 1 25 TYR H . 25 . HN 1 1 64 1 1 1 1 25 TYR H . 25 . HN 1 1 64 1 2 1 1 26 LYS H . 26 . HN 1 1 65 1 1 1 1 23 VAL HA . 23 . HA 1 1 65 1 2 1 1 26 LYS H . 26 . HN 1 1 66 1 1 1 1 25 TYR QB . 25 . HB* 1 1 66 1 2 1 1 26 LYS H . 26 . HN 1 1 67 1 1 1 1 26 LYS H . 26 . HN 1 1 67 1 2 1 1 27 ALA H . 27 . HN 1 1 68 1 1 1 1 24 ASP HA . 24 . HA 1 1 68 1 2 1 1 27 ALA H . 27 . HN 1 1 69 1 1 1 1 26 LYS QB . 26 . HB* 1 1 69 1 2 1 1 27 ALA H . 27 . HN 1 1 70 1 1 1 1 27 ALA H . 27 . HN 1 1 70 1 2 1 1 28 GLY H . 28 . HN 1 1 71 1 1 1 1 25 TYR HA . 25 . HA 1 1 71 1 2 1 1 28 GLY H . 28 . HN 1 1 72 1 1 1 1 24 ASP HA . 24 . HA 1 1 72 1 2 1 1 28 GLY H . 28 . HN 1 1 73 1 1 1 1 27 ALA MB . 27 . HB* 1 1 73 1 2 1 1 28 GLY H . 28 . HN 1 1 74 1 1 1 1 28 GLY H . 28 . HN 1 1 74 1 2 1 1 29 LEU H . 29 . HN 1 1 75 1 1 1 1 28 GLY QA . 28 . HA* 1 1 75 1 2 1 1 29 LEU H . 29 . HN 1 1 76 1 1 1 1 26 LYS HA . 26 . HA 1 1 76 1 2 1 1 29 LEU H . 29 . HN 1 1 77 1 1 1 1 29 LEU H . 29 . HN 1 1 77 1 2 1 1 30 GLU H . 30 . HN 1 1 78 1 1 1 1 28 GLY QA . 28 . HA* 1 1 78 1 2 1 1 30 GLU H . 30 . HN 1 1 79 1 1 1 1 29 LEU QB . 29 . HB* 1 1 79 1 2 1 1 30 GLU H . 30 . HN 1 1 80 1 1 1 1 29 LEU HA . 29 . HA 1 1 80 1 2 1 1 30 GLU H . 30 . HN 1 1 81 1 1 1 1 30 GLU H . 30 . HN 1 1 81 1 2 1 1 30 GLU QG . 30 . HG* 1 1 82 1 1 1 1 30 GLU H . 30 . HN 1 1 82 1 2 1 1 31 LYS H . 31 . HN 1 1 83 1 1 1 1 30 GLU HA . 30 . HA 1 1 83 1 2 1 1 31 LYS H . 31 . HN 1 1 84 1 1 1 1 30 GLU QB . 30 . HB* 1 1 84 1 2 1 1 31 LYS H . 31 . HN 1 1 85 1 1 1 1 30 GLU QG . 30 . HG* 1 1 85 1 2 1 1 31 LYS H . 31 . HN 1 1 86 1 1 1 1 31 LYS H . 31 . HN 1 1 86 1 2 1 1 31 LYS QG . 31 . HG* 1 1 87 1 1 1 1 31 LYS H . 31 . HN 1 1 87 1 2 1 1 32 LYS H . 32 . HN 1 1 88 1 1 1 1 31 LYS HA . 31 . HA 1 1 88 1 2 1 1 32 LYS H . 32 . HN 1 1 89 1 1 1 1 31 LYS QB . 31 . HB* 1 1 89 1 2 1 1 32 LYS H . 32 . HN 1 1 90 1 1 1 1 31 LYS QG . 31 . HG* 1 1 90 1 2 1 1 32 LYS H . 32 . HN 1 1 91 1 1 1 1 32 LYS H . 32 . HN 1 1 91 1 2 1 1 32 LYS QG . 32 . HG* 1 1 92 1 1 1 1 32 LYS HA . 32 . HA 1 1 92 1 2 1 1 33 LYS H . 33 . HN 1 1 93 1 1 1 1 32 LYS QB . 32 . HB* 1 1 93 1 2 1 1 33 LYS H . 33 . HN 1 1 94 1 1 1 1 33 LYS H . 33 . HN 1 1 94 1 2 1 1 33 LYS QG . 33 . HG* 1 1 95 1 1 1 1 33 LYS HA . 33 . HA 1 1 95 1 2 1 1 34 LEU H . 34 . HN 1 1 96 1 1 1 1 34 LEU H . 34 . HN 1 1 96 1 2 1 1 34 LEU QB . 34 . HB* 1 1 97 1 1 1 1 34 LEU H . 34 . HN 1 1 97 1 2 1 1 34 LEU HG . 34 . HG 1 1 98 1 1 1 1 34 LEU H . 34 . HN 1 1 98 1 2 1 1 35 SER H . 35 . HN 1 1 99 1 1 1 1 34 LEU HA . 34 . HA 1 1 99 1 2 1 1 35 SER H . 35 . HN 1 1 100 1 1 1 1 35 SER H . 35 . HN 1 1 100 1 2 1 1 35 SER QB . 35 . HB* 1 1 101 1 1 1 1 34 LEU QB . 34 . HB* 1 1 101 1 2 1 1 35 SER H . 35 . HN 1 1 102 1 1 1 1 35 SER HA . 35 . HA 1 1 102 1 2 1 1 36 ASP H . 36 . HN 1 1 103 1 1 1 1 35 SER QB . 35 . HB* 1 1 103 1 2 1 1 37 ASP H . 37 . HN 1 1 104 1 1 1 1 36 ASP HA . 36 . HA 1 1 104 1 2 1 1 37 ASP H . 37 . HN 1 1 105 1 1 1 1 36 ASP QB . 36 . HB* 1 1 105 1 2 1 1 37 ASP H . 37 . HN 1 1 106 1 1 1 1 37 ASP H . 37 . HN 1 1 106 1 2 1 1 37 ASP QB . 37 . HB* 1 1 107 1 1 1 1 37 ASP H . 37 . HN 1 1 107 1 2 1 1 38 ASP H . 38 . HN 1 1 108 1 1 1 1 37 ASP QB . 37 . HB* 1 1 108 1 2 1 1 38 ASP H . 38 . HN 1 1 109 1 1 1 1 35 SER H . 35 . HN 1 1 109 1 2 1 1 38 ASP H . 38 . HN 1 1 110 1 1 1 1 38 ASP H . 38 . HN 1 1 110 1 2 1 1 38 ASP QB . 38 . HB* 1 1 111 1 1 1 1 37 ASP HA . 37 . HA 1 1 111 1 2 1 1 38 ASP H . 38 . HN 1 1 112 1 1 1 1 13 LYS QG . 13 . HG* 1 1 112 1 2 1 1 38 ASP H . 38 . HN 1 1 113 1 1 1 1 12 LEU QD . 12 . HD* 1 1 113 1 2 1 1 38 ASP H . 38 . HN 1 1 114 1 1 1 1 38 ASP HA . 38 . HA 1 1 114 1 2 1 1 39 GLU H . 39 . HN 1 1 115 1 1 1 1 38 ASP QB . 38 . HB* 1 1 115 1 2 1 1 39 GLU H . 39 . HN 1 1 116 1 1 1 1 39 GLU H . 39 . HN 1 1 116 1 2 1 1 39 GLU QB . 39 . HB* 1 1 117 1 1 1 1 39 GLU H . 39 . HN 1 1 117 1 2 1 1 39 GLU QG . 39 . HG* 1 1 118 1 1 1 1 38 ASP H . 38 . HN 1 1 118 1 2 1 1 39 GLU H . 39 . HN 1 1 119 1 1 1 1 39 GLU HA . 39 . HA 1 1 119 1 2 1 1 40 ILE H . 40 . HN 1 1 120 1 1 1 1 39 GLU QB . 39 . HB* 1 1 120 1 2 1 1 40 ILE H . 40 . HN 1 1 121 1 1 1 1 40 ILE HA . 40 . HA 1 1 121 1 2 1 1 41 ALA H . 41 . HN 1 1 122 1 1 1 1 40 ILE HB . 40 . HB 1 1 122 1 2 1 1 41 ALA H . 41 . HN 1 1 123 1 1 1 1 41 ALA H . 41 . HN 1 1 123 1 2 1 1 41 ALA MB . 41 . HB* 1 1 124 1 1 1 1 41 ALA HA . 41 . HA 1 1 124 1 2 1 1 42 ILE H . 42 . HN 1 1 125 1 1 1 1 41 ALA MB . 41 . HB* 1 1 125 1 2 1 1 42 ILE H . 42 . HN 1 1 126 1 1 1 1 42 ILE HA . 42 . HA 1 1 126 1 2 1 1 43 ILE H . 43 . HN 1 1 127 1 1 1 1 42 ILE HB . 42 . HB 1 1 127 1 2 1 1 43 ILE H . 43 . HN 1 1 128 1 1 1 1 43 ILE HA . 43 . HA 1 1 128 1 2 1 1 44 SER H . 44 . HN 1 1 129 1 1 1 1 43 ILE HB . 43 . HB* 1 1 129 1 2 1 1 44 SER H . 44 . HN 1 1 130 1 1 1 1 44 SER H . 44 . HN 1 1 130 1 2 1 1 44 SER QB . 44 . HB* 1 1 131 1 1 1 1 44 SER QB . 44 . HB* 1 1 131 1 2 1 1 45 ILE H . 45 . HN 1 1 132 1 1 1 1 44 SER HA . 44 . HA 1 1 132 1 2 1 1 45 ILE H . 45 . HN 1 1 133 1 1 1 1 45 ILE HA . 45 . HA 1 1 133 1 2 1 1 46 LYS H . 46 . HN 1 1 134 1 1 1 1 46 LYS HA . 46 . HA 1 1 134 1 2 1 1 47 GLY H . 47 . HN 1 1 135 1 1 1 1 47 GLY QA . 47 . HA* 1 1 135 1 2 1 1 48 THR H . 48 . HN 1 1 136 1 1 1 1 48 THR H . 48 . HN 1 1 136 1 2 1 1 48 THR HB . 48 . HB* 1 1 137 1 1 1 1 48 THR H . 48 . HN 1 1 137 1 2 1 1 48 THR HG1 . 48 . HG* 1 1 137 1 2 1 1 48 THR MG . 48 . HG* 1 1 138 1 1 1 1 48 THR HA . 48 . HA 1 1 138 1 2 1 1 49 GLN H . 49 . HN 1 1 139 1 1 1 1 49 GLN HA . 49 . HA 1 1 139 1 2 1 1 50 SER H . 50 . HN 1 1 140 1 1 1 1 50 SER HA . 50 . HA 1 1 140 1 2 1 1 51 ASN H . 51 . HN 1 1 141 1 1 1 1 51 ASN HA . 51 . HA 1 1 141 1 2 1 1 52 HIS H . 52 . HN 1 1 142 1 1 1 1 52 HIS H . 52 . HN 1 1 142 1 2 1 1 52 HIS QB . 52 . HB* 1 1 143 1 1 1 1 52 HIS HA . 52 . HA 1 1 143 1 2 1 1 53 VAL H . 53 . HN 1 1 144 1 1 1 1 52 HIS QB . 52 . HB* 1 1 144 1 2 1 1 53 VAL H . 53 . HN 1 1 145 1 1 1 1 53 VAL HA . 53 . HA 1 1 145 1 2 1 1 54 LEU H . 54 . HN 1 1 146 1 1 1 1 53 VAL HB . 53 . HB* 1 1 146 1 2 1 1 54 LEU H . 54 . HN 1 1 147 1 1 1 1 54 LEU H . 54 . HN 1 1 147 1 2 1 1 54 LEU QB . 54 . HB* 1 1 148 1 1 1 1 54 LEU HA . 54 . HA 1 1 148 1 2 1 1 55 PHE H . 55 . HN 1 1 149 1 1 1 1 54 LEU QB . 54 . HB* 1 1 149 1 2 1 1 55 PHE H . 55 . HN 1 1 150 1 1 1 1 55 PHE H . 55 . HN 1 1 150 1 2 1 1 55 PHE QB . 55 . HB* 1 1 151 1 1 1 1 55 PHE HA . 55 . HA 1 1 151 1 2 1 1 56 LEU H . 56 . HN 1 1 152 1 1 1 1 55 PHE QB . 55 . HB* 1 1 152 1 2 1 1 56 LEU H . 56 . HN 1 1 153 1 1 1 1 56 LEU HA . 56 . HA 1 1 153 1 2 1 1 57 SER H . 57 . HN 1 1 154 1 1 1 1 56 LEU H . 56 . HN 1 1 154 1 2 1 1 57 SER H . 57 . HN 1 1 155 1 1 1 1 56 LEU QB . 56 . HB* 1 1 155 1 2 1 1 57 SER H . 57 . HN 1 1 156 1 1 1 1 57 SER H . 57 . HN 1 1 156 1 2 1 1 57 SER QB . 57 . HB* 1 1 157 1 1 1 1 59 TYR QE . 59 . HE* 1 1 157 1 2 1 1 65 ILE H . 65 . HN 1 1 158 1 1 1 1 59 TYR QE . 59 . HE* 1 1 158 1 2 1 1 65 ILE HA . 65 . HA 1 1 159 1 1 1 1 61 SER H . 61 . HN 1 1 159 1 2 1 1 65 ILE MD . 65 . HD* 1 1 160 1 1 1 1 59 TYR QE . 59 . HE* 1 1 160 1 2 1 1 64 GLU H . 64 . HN 1 1 161 1 1 1 1 59 TYR QE . 59 . HE* 1 1 161 1 2 1 1 66 ARG H . 66 . HN 1 1 162 1 1 1 1 60 ASN H . 60 . HN 1 1 162 1 2 1 1 61 SER H . 61 . HN 1 1 163 1 1 1 1 60 ASN QB . 60 . HB* 1 1 163 1 2 1 1 61 SER H . 61 . HN 1 1 164 1 1 1 1 61 SER H . 61 . HN 1 1 164 1 2 1 1 61 SER QB . 61 . HB* 1 1 165 1 1 1 1 61 SER QB . 61 . HB* 1 1 165 1 2 1 1 62 VAL H . 62 . HN 1 1 166 1 1 1 1 62 VAL H . 62 . HN 1 1 166 1 2 1 1 62 VAL HB . 62 . HB* 1 1 167 1 1 1 1 62 VAL H . 62 . HN 1 1 167 1 2 1 1 62 VAL QG . 62 . HG* 1 1 168 1 1 1 1 61 SER HA . 61 . HA 1 1 168 1 2 1 1 62 VAL HA . 62 . HA 1 1 169 1 1 1 1 62 VAL HB . 62 . HB* 1 1 169 1 2 1 1 63 ASP H . 63 . HN 1 1 170 1 1 1 1 62 VAL HA . 62 . HA 1 1 170 1 2 1 1 63 ASP H . 63 . HN 1 1 171 1 1 1 1 63 ASP H . 63 . HN 1 1 171 1 2 1 1 63 ASP QB . 63 . HB* 1 1 172 1 1 1 1 63 ASP H . 63 . HN 1 1 172 1 2 1 1 64 GLU H . 64 . HN 1 1 173 1 1 1 1 63 ASP QB . 63 . HB* 1 1 173 1 2 1 1 64 GLU H . 64 . HN 1 1 174 1 1 1 1 64 GLU H . 64 . HN 1 1 174 1 2 1 1 64 GLU QB . 64 . HB* 1 1 175 1 1 1 1 64 GLU H . 64 . HN 1 1 175 1 2 1 1 64 GLU QG . 64 . HG* 1 1 176 1 1 1 1 63 ASP HA . 63 . HA 1 1 176 1 2 1 1 64 GLU H . 64 . HN 1 1 177 1 1 1 1 64 GLU H . 64 . HN 1 1 177 1 2 1 1 65 ILE H . 65 . HN 1 1 178 1 1 1 1 62 VAL HA . 62 . HA 1 1 178 1 2 1 1 65 ILE H . 65 . HN 1 1 179 1 1 1 1 64 GLU QB . 64 . HB* 1 1 179 1 2 1 1 65 ILE H . 65 . HN 1 1 180 1 1 1 1 65 ILE H . 65 . HN 1 1 180 1 2 1 1 65 ILE HB . 65 . HB* 1 1 181 1 1 1 1 65 ILE H . 65 . HN 1 1 181 1 2 1 1 65 ILE QG . 65 . HG* 1 1 181 1 2 1 1 65 ILE MG . 65 . HG* 1 1 182 1 1 1 1 65 ILE H . 65 . HN 1 1 182 1 2 1 1 66 ARG H . 66 . HN 1 1 183 1 1 1 1 65 ILE HB . 65 . HB* 1 1 183 1 2 1 1 66 ARG H . 66 . HN 1 1 184 1 1 1 1 66 ARG H . 66 . HN 1 1 184 1 2 1 1 66 ARG QB . 66 . HB* 1 1 185 1 1 1 1 65 ILE QG . 65 . HG* 1 1 185 1 1 1 1 65 ILE MG . 65 . HG* 1 1 185 1 2 1 1 66 ARG H . 66 . HN 1 1 186 1 1 1 1 66 ARG H . 66 . HN 1 1 186 1 2 1 1 67 LYS H . 67 . HN 1 1 187 1 1 1 1 64 GLU HA . 64 . HA 1 1 187 1 2 1 1 67 LYS H . 67 . HN 1 1 188 1 1 1 1 66 ARG QB . 66 . HB* 1 1 188 1 2 1 1 67 LYS H . 67 . HN 1 1 189 1 1 1 1 67 LYS H . 67 . HN 1 1 189 1 2 1 1 67 LYS QB . 67 . HB* 1 1 190 1 1 1 1 67 LYS H . 67 . HN 1 1 190 1 2 1 1 67 LYS QG . 67 . HG* 1 1 191 1 1 1 1 63 ASP HA . 63 . HA 1 1 191 1 2 1 1 67 LYS H . 67 . HN 1 1 192 1 1 1 1 67 LYS H . 67 . HN 1 1 192 1 2 1 1 68 GLU H . 68 . HN 1 1 193 1 1 1 1 64 GLU HA . 64 . HA 1 1 193 1 2 1 1 68 GLU H . 68 . HN 1 1 194 1 1 1 1 65 ILE HA . 65 . HA 1 1 194 1 2 1 1 68 GLU H . 68 . HN 1 1 195 1 1 1 1 67 LYS QB . 67 . HB* 1 1 195 1 2 1 1 68 GLU H . 68 . HN 1 1 196 1 1 1 1 68 GLU H . 68 . HN 1 1 196 1 2 1 1 69 LEU H . 69 . HN 1 1 197 1 1 1 1 66 ARG HA . 66 . HA 1 1 197 1 2 1 1 69 LEU H . 69 . HN 1 1 198 1 1 1 1 68 GLU QB . 68 . HB* 1 1 198 1 2 1 1 69 LEU H . 69 . HN 1 1 199 1 1 1 1 69 LEU H . 69 . HN 1 1 199 1 2 1 1 69 LEU QB . 69 . HB* 1 1 200 1 1 1 1 65 ILE HA . 65 . HA 1 1 200 1 2 1 1 69 LEU H . 69 . HN 1 1 201 1 1 1 1 69 LEU H . 69 . HN 1 1 201 1 2 1 1 70 GLU H . 70 . HN 1 1 202 1 1 1 1 66 ARG HA . 66 . HA 1 1 202 1 2 1 1 70 GLU H . 70 . HN 1 1 203 1 1 1 1 67 LYS HA . 67 . HA 1 1 203 1 2 1 1 70 GLU H . 70 . HN 1 1 204 1 1 1 1 69 LEU QB . 69 . HB* 1 1 204 1 2 1 1 70 GLU H . 70 . HN 1 1 205 1 1 1 1 70 GLU H . 70 . HN 1 1 205 1 2 1 1 70 GLU QB . 70 . HB* 1 1 206 1 1 1 1 70 GLU H . 70 . HN 1 1 206 1 2 1 1 71 GLU H . 71 . HN 1 1 207 1 1 1 1 67 LYS HA . 67 . HA 1 1 207 1 2 1 1 71 GLU H . 71 . HN 1 1 208 1 1 1 1 68 GLU HA . 68 . HA 1 1 208 1 2 1 1 71 GLU H . 71 . HN 1 1 209 1 1 1 1 70 GLU QB . 70 . HB* 1 1 209 1 2 1 1 71 GLU H . 71 . HN 1 1 210 1 1 1 1 71 GLU H . 71 . HN 1 1 210 1 2 1 1 71 GLU QB . 71 . HB* 1 1 211 1 1 1 1 71 GLU H . 71 . HN 1 1 211 1 2 1 1 71 GLU QG . 71 . HG* 1 1 212 1 1 1 1 71 GLU H . 71 . HN 1 1 212 1 2 1 1 72 ALA H . 72 . HN 1 1 213 1 1 1 1 68 GLU HA . 68 . HA 1 1 213 1 2 1 1 72 ALA H . 72 . HN 1 1 214 1 1 1 1 69 LEU HA . 69 . HA 1 1 214 1 2 1 1 72 ALA H . 72 . HN 1 1 215 1 1 1 1 71 GLU QB . 71 . HB* 1 1 215 1 2 1 1 72 ALA H . 72 . HN 1 1 216 1 1 1 1 72 ALA H . 72 . HN 1 1 216 1 2 1 1 72 ALA MB . 72 . HB* 1 1 217 1 1 1 1 72 ALA H . 72 . HN 1 1 217 1 2 1 1 73 GLY H . 73 . HN 1 1 218 1 1 1 1 71 GLU H . 71 . HN 1 1 218 1 2 1 1 73 GLY H . 73 . HN 1 1 219 1 1 1 1 72 ALA MB . 72 . HB* 1 1 219 1 2 1 1 73 GLY H . 73 . HN 1 1 220 1 1 1 1 70 GLU QB . 70 . HB* 1 1 220 1 2 1 1 73 GLY H . 73 . HN 1 1 221 1 1 1 1 73 GLY H . 73 . HN 1 1 221 1 2 1 1 74 ALA H . 74 . HN 1 1 222 1 1 1 1 73 GLY QA . 73 . HA* 1 1 222 1 2 1 1 74 ALA H . 74 . HN 1 1 223 1 1 1 1 74 ALA H . 74 . HN 1 1 223 1 2 1 1 74 ALA MB . 74 . HB* 1 1 224 1 1 1 1 73 GLY QA . 73 . HA* 1 1 224 1 2 1 1 75 LYS H . 75 . HN 1 1 225 1 1 1 1 74 ALA HA . 74 . HA 1 1 225 1 2 1 1 75 LYS H . 75 . HN 1 1 226 1 1 1 1 74 ALA MB . 74 . HB* 1 1 226 1 2 1 1 75 LYS H . 75 . HN 1 1 227 1 1 1 1 75 LYS H . 75 . HN 1 1 227 1 2 1 1 75 LYS QB . 75 . HB* 1 1 228 1 1 1 1 75 LYS H . 75 . HN 1 1 228 1 2 1 1 75 LYS QG . 75 . HG* 1 1 229 1 1 1 1 74 ALA H . 74 . HN 1 1 229 1 2 1 1 75 LYS H . 75 . HN 1 1 230 1 1 1 1 75 LYS HA . 75 . HA 1 1 230 1 2 1 1 76 ILE H . 76 . HN 1 1 231 1 1 1 1 76 ILE H . 76 . HN 1 1 231 1 2 1 1 76 ILE HB . 76 . HB* 1 1 232 1 1 1 1 76 ILE H . 76 . HN 1 1 232 1 2 1 1 76 ILE QG . 76 . HG* 1 1 232 1 2 1 1 76 ILE MG . 76 . HG* 1 1 233 1 1 1 1 75 LYS QB . 75 . HB* 1 1 233 1 2 1 1 76 ILE H . 76 . HN 1 1 234 1 1 1 1 76 ILE HB . 76 . HB* 1 1 234 1 2 1 1 77 ASN H . 77 . HN 1 1 235 1 1 1 1 77 ASN H . 77 . HN 1 1 235 1 2 1 1 77 ASN QB . 77 . HB* 1 1 236 1 1 1 1 76 ILE QG . 76 . HG* 1 1 236 1 1 1 1 76 ILE MG . 76 . HG* 1 1 236 1 2 1 1 77 ASN H . 77 . HN 1 1 237 1 1 1 1 77 ASN HA . 77 . HA 1 1 237 1 2 1 1 78 HIS H . 78 . HN 1 1 238 1 1 1 1 79 THR H . 79 . HN 1 1 238 1 2 1 1 79 THR HB . 79 . HB* 1 1 239 1 1 1 1 78 HIS HA . 78 . HA 1 1 239 1 2 1 1 79 THR H . 79 . HN 1 1 240 1 1 1 1 78 HIS QB . 78 . HB* 1 1 240 1 2 1 1 79 THR H . 79 . HN 1 1 241 1 1 1 1 80 THR H . 80 . HN 1 1 241 1 2 1 1 80 THR HB . 80 . HB* 1 1 242 1 1 1 1 79 THR HA . 79 . HA 1 1 242 1 2 1 1 80 THR H . 80 . HN 1 1 243 1 1 1 1 79 THR HB . 79 . HB* 1 1 243 1 2 1 1 80 THR H . 80 . HN 1 1 244 1 1 1 1 80 THR HA . 80 . HA 1 1 244 1 2 1 1 81 LEU H . 81 . HN 1 1 245 1 1 1 1 80 THR HB . 80 . HB* 1 1 245 1 2 1 1 81 LEU H . 81 . HN 1 1 246 1 1 1 1 81 LEU H . 81 . HN 1 1 246 1 2 1 1 81 LEU QB . 81 . HB* 1 1 247 1 1 1 1 81 LEU H . 81 . HN 1 1 247 1 2 1 1 82 LYS H . 82 . HN 1 1 248 1 1 1 1 82 LYS H . 82 . HN 1 1 248 1 2 1 1 82 LYS QB . 82 . HB* 1 1 249 1 1 1 1 82 LYS H . 82 . HN 1 1 249 1 2 1 1 82 LYS QG . 82 . HG* 1 1 250 1 1 1 1 81 LEU QB . 81 . HB* 1 1 250 1 2 1 1 82 LYS H . 82 . HN 1 1 251 1 1 1 1 82 LYS H . 82 . HN 1 1 251 1 2 1 1 83 ILE H . 83 . HN 1 1 252 1 1 1 1 83 ILE H . 83 . HN 1 1 252 1 2 1 1 83 ILE HB . 83 . HB* 1 1 253 1 1 1 1 83 ILE H . 83 . HN 1 1 253 1 2 1 1 83 ILE QG . 83 . HG* 1 1 253 1 2 1 1 83 ILE MG . 83 . HG* 1 1 254 1 1 1 1 82 LYS QB . 82 . HB* 1 1 254 1 2 1 1 83 ILE H . 83 . HN 1 1 255 1 1 1 1 83 ILE H . 83 . HN 1 1 255 1 2 1 1 84 LEU H . 84 . HN 1 1 256 1 1 1 1 84 LEU H . 84 . HN 1 1 256 1 2 1 1 84 LEU HG . 84 . HG* 1 1 257 1 1 1 1 83 ILE HB . 83 . HB* 1 1 257 1 2 1 1 84 LEU H . 84 . HN 1 1 258 1 1 1 1 84 LEU H . 84 . HN 1 1 258 1 2 1 1 85 GLU H . 85 . HN 1 1 259 1 1 1 1 82 LYS HA . 82 . HA 1 1 259 1 2 1 1 85 GLU H . 85 . HN 1 1 260 1 1 1 1 85 GLU H . 85 . HN 1 1 260 1 2 1 1 85 GLU QB . 85 . HB* 1 1 261 1 1 1 1 82 LYS HA . 82 . HA 1 1 261 1 2 1 1 86 GLY H . 86 . HN 1 1 262 1 1 1 1 83 ILE HA . 83 . HA 1 1 262 1 2 1 1 86 GLY H . 86 . HN 1 1 263 1 1 1 1 85 GLU H . 85 . HN 1 1 263 1 2 1 1 86 GLY H . 86 . HN 1 1 264 1 1 1 1 85 GLU QB . 85 . HB* 1 1 264 1 2 1 1 86 GLY H . 86 . HN 1 1 265 1 1 1 1 86 GLY H . 86 . HN 1 1 265 1 2 1 1 87 HIS H . 87 . HN 1 1 266 1 1 1 1 87 HIS H . 87 . HN 1 1 266 1 2 1 1 87 HIS QB . 87 . HB* 1 1 267 1 1 1 1 86 GLY QA . 86 . HA* 1 1 267 1 2 1 1 87 HIS H . 87 . HN 1 1 268 1 1 1 1 84 LEU HA . 84 . HA 1 1 268 1 2 1 1 87 HIS H . 87 . HN 1 1 269 1 1 1 1 87 HIS H . 87 . HN 1 1 269 1 2 1 1 88 LEU H . 88 . HN 1 1 270 1 1 1 1 88 LEU H . 88 . HN 1 1 270 1 2 1 1 88 LEU QB . 88 . HB* 1 1 271 1 1 1 1 88 LEU H . 88 . HN 1 1 271 1 2 1 1 88 LEU HG . 88 . HG* 1 1 272 1 1 1 1 86 GLY QA . 86 . HA* 1 1 272 1 2 1 1 88 LEU H . 88 . HN 1 1 273 1 1 1 1 41 ALA H . 41 . HN 1 1 273 1 2 1 1 54 LEU H . 54 . HN 1 1 274 1 1 1 1 43 ILE H . 43 . HN 1 1 274 1 2 1 1 52 HIS H . 52 . HN 1 1 275 1 1 1 1 39 GLU H . 39 . HN 1 1 275 1 2 1 1 56 LEU H . 56 . HN 1 1 276 1 1 1 1 43 ILE H . 43 . HN 1 1 276 1 2 1 1 53 VAL HA . 53 . HA 1 1 277 1 1 1 1 44 SER QB . 44 . HB* 1 1 277 1 2 1 1 52 HIS H . 52 . HN 1 1 278 1 1 1 1 44 SER HA . 44 . HA 1 1 278 1 2 1 1 52 HIS H . 52 . HN 1 1 279 1 1 1 1 40 ILE HA . 40 . HA 1 1 279 1 2 1 1 56 LEU H . 56 . HN 1 1 280 1 1 1 1 41 ALA H . 41 . HN 1 1 280 1 2 1 1 55 PHE HA . 55 . HA 1 1 281 1 1 1 1 42 ILE HA . 42 . HA 1 1 281 1 2 1 1 54 LEU H . 54 . HN 1 1 282 1 1 1 1 7 LYS HA . 7 . HA 1 1 282 1 2 1 1 44 SER H . 44 . HN 1 1 283 1 1 1 1 6 LEU H . 6 . HN 1 1 283 1 2 1 1 44 SER H . 44 . HN 1 1 284 1 1 1 1 8 GLY H . 8 . HN 1 1 284 1 2 1 1 43 ILE HA . 43 . HA 1 1 285 1 1 1 1 8 GLY H . 8 . HN 1 1 285 1 2 1 1 42 ILE H . 42 . HN 1 1 286 1 1 1 1 8 GLY QA . 8 . HA* 1 1 286 1 2 1 1 42 ILE H . 42 . HN 1 1 287 1 1 1 1 8 GLY H . 8 . HN 1 1 287 1 2 1 1 42 ILE HB . 42 . HB 1 1 288 1 1 1 1 9 ILE HA . 9 . HA 1 1 288 1 2 1 1 42 ILE H . 42 . HN 1 1 289 1 1 1 1 10 PHE H . 10 . HN 1 1 289 1 2 1 1 41 ALA HA . 41 . HA 1 1 290 1 1 1 1 10 PHE H . 10 . HN 1 1 290 1 2 1 1 40 ILE H . 40 . HN 1 1 291 1 1 1 1 12 LEU H . 12 . HN 1 1 291 1 2 1 1 39 GLU HA . 39 . HA 1 1 292 1 1 1 1 12 LEU H . 12 . HN 1 1 292 1 2 1 1 38 ASP H . 38 . HN 1 1 293 1 1 1 1 12 LEU HA . 12 . HA 1 1 293 1 2 1 1 15 LEU H . 15 . HN 1 1 294 1 1 1 1 65 ILE H . 65 . HN 1 1 294 1 2 1 1 67 LYS H . 67 . HN 1 1 295 1 1 1 1 66 ARG H . 66 . HN 1 1 295 1 2 1 1 68 GLU H . 68 . HN 1 1 296 1 1 1 1 67 LYS H . 67 . HN 1 1 296 1 2 1 1 69 LEU H . 69 . HN 1 1 297 1 1 1 1 68 GLU H . 68 . HN 1 1 297 1 2 1 1 70 GLU H . 70 . HN 1 1 298 1 1 1 1 69 LEU H . 69 . HN 1 1 298 1 2 1 1 71 GLU H . 71 . HN 1 1 299 1 1 1 1 70 GLU H . 70 . HN 1 1 299 1 2 1 1 72 ALA H . 72 . HN 1 1 300 1 1 1 1 80 THR H . 80 . HN 1 1 300 1 2 1 1 82 LYS H . 82 . HN 1 1 301 1 1 1 1 81 LEU H . 81 . HN 1 1 301 1 2 1 1 83 ILE H . 83 . HN 1 1 302 1 1 1 1 82 LYS H . 82 . HN 1 1 302 1 2 1 1 84 LEU H . 84 . HN 1 1 303 1 1 1 1 83 ILE H . 83 . HN 1 1 303 1 2 1 1 85 GLU H . 85 . HN 1 1 304 1 1 1 1 84 LEU H . 84 . HN 1 1 304 1 2 1 1 86 GLY H . 86 . HN 1 1 305 1 1 1 1 86 GLY H . 86 . HN 1 1 305 1 2 1 1 88 LEU H . 88 . HN 1 1 306 1 1 1 1 14 ASP H . 14 . HN 1 1 306 1 2 1 1 15 LEU H . 15 . HN 1 1 307 1 1 1 1 40 ILE HA . 40 . HA 1 1 307 1 2 1 1 55 PHE HA . 55 . HA 1 1 308 1 1 1 1 42 ILE HA . 42 . HA 1 1 308 1 2 1 1 53 VAL HA . 53 . HA 1 1 309 1 1 1 1 7 LYS HA . 7 . HA 1 1 309 1 2 1 1 43 ILE HA . 43 . HA 1 1 310 1 1 1 1 9 ILE HA . 9 . HA 1 1 310 1 2 1 1 41 ALA HA . 41 . HA 1 1 311 1 1 1 1 40 ILE MD . 40 . HD* 1 1 311 1 2 1 1 55 PHE QB . 55 . HB* 1 1 312 1 1 1 1 45 ILE H . 45 . HN 1 1 312 1 2 1 1 50 SER H . 50 . HN 1 1 313 1 1 1 1 44 SER HA . 44 . HA 1 1 313 1 2 1 1 51 ASN HA . 51 . HA 1 1 314 1 1 1 1 45 ILE H . 45 . HN 1 1 314 1 2 1 1 51 ASN HA . 51 . HA 1 1 315 1 1 1 1 46 LYS HA . 46 . HA 1 1 315 1 2 1 1 50 SER H . 50 . HN 1 1 316 1 1 1 1 65 ILE HA . 65 . HA 1 1 316 1 2 1 1 68 GLU QB . 68 . HB* 1 1 317 1 1 1 1 66 ARG HA . 66 . HA 1 1 317 1 2 1 1 69 LEU QB . 69 . HB* 1 1 318 1 1 1 1 67 LYS HA . 67 . HA 1 1 318 1 2 1 1 70 GLU QB . 70 . HB* 1 1 319 1 1 1 1 68 GLU HA . 68 . HA 1 1 319 1 2 1 1 71 GLU QB . 71 . HB* 1 1 320 1 1 1 1 69 LEU HA . 69 . HA 1 1 320 1 2 1 1 72 ALA MB . 72 . HB* 1 1 321 1 1 1 1 21 PRO HA . 21 . HA 1 1 321 1 2 1 1 24 ASP QB . 24 . HB* 1 1 322 1 1 1 1 22 PHE HA . 22 . HA 1 1 322 1 2 1 1 25 TYR QB . 25 . HB* 1 1 323 1 1 1 1 23 VAL HA . 23 . HA 1 1 323 1 2 1 1 26 LYS QB . 26 . HB* 1 1 324 1 1 1 1 24 ASP HA . 24 . HA 1 1 324 1 2 1 1 27 ALA MB . 27 . HB* 1 1 325 1 1 1 1 26 LYS HA . 26 . HA 1 1 325 1 2 1 1 29 LEU QB . 29 . HB* 1 1 326 1 1 1 1 82 LYS HA . 82 . HA 1 1 326 1 2 1 1 85 GLU QB . 85 . HB* 1 1 327 1 1 1 1 83 ILE HA . 83 . HA 1 1 327 1 2 1 1 86 GLY QA . 86 . HA* 1 1 328 1 1 1 1 84 LEU HA . 84 . HA 1 1 328 1 2 1 1 87 HIS QB . 87 . HB* 1 1 329 1 1 1 1 85 GLU HA . 85 . HA 1 1 329 1 2 1 1 88 LEU QB . 88 . HB* 1 1 330 1 1 1 1 43 ILE MD . 43 . HD* 1 1 330 1 2 1 1 69 LEU QD . 69 . HD* 1 1 331 1 1 1 1 43 ILE QG . 43 . HG* 1 1 331 1 1 1 1 43 ILE MG . 43 . HG* 1 1 331 1 2 1 1 69 LEU QD . 69 . HD* 1 1 332 1 1 1 1 43 ILE MD . 43 . HD* 1 1 332 1 2 1 1 69 LEU HG . 69 . HG* 1 1 333 1 1 1 1 45 ILE MD . 45 . HD* 1 1 333 1 2 1 1 74 ALA MB . 74 . HB* 1 1 334 1 1 1 1 45 ILE QG . 45 . HG* 1 1 334 1 1 1 1 45 ILE MG . 45 . HG* 1 1 334 1 2 1 1 74 ALA MB . 74 . HB* 1 1 335 1 1 1 1 7 LYS QE . 7 . HE* 1 1 335 1 2 1 1 70 GLU QG . 70 . HG* 1 1 336 1 1 1 1 11 THR H . 11 . HN 1 1 336 1 2 1 1 15 LEU H . 15 . HN 1 1 337 1 1 1 1 54 LEU QD . 54 . HD* 1 1 337 1 2 1 1 83 ILE MD . 83 . HD* 1 1 338 1 1 1 1 54 LEU QD . 54 . HD* 1 1 338 1 2 1 1 84 LEU QD . 84 . HD* 1 1 339 1 1 1 1 55 PHE QB . 55 . HB* 1 1 339 1 2 1 1 88 LEU QD . 88 . HD* 1 1 340 1 1 1 1 8 GLY QA . 8 . HA* 1 1 340 1 2 1 1 42 ILE HB . 42 . HB* 1 1 341 1 1 1 1 41 ALA MB . 41 . HB* 1 1 341 1 2 1 1 54 LEU H . 54 . HN 1 1 342 1 1 1 1 41 ALA MB . 41 . HB* 1 1 342 1 2 1 1 54 LEU QB . 54 . HB* 1 1 343 1 1 1 1 44 SER HA . 44 . HA 1 1 343 1 2 1 1 51 ASN QB . 51 . HB* 1 1 344 1 1 1 1 44 SER QB . 44 . HB* 1 1 344 1 2 1 1 51 ASN QB . 51 . HB* 1 1 345 1 1 1 1 44 SER QB . 44 . HB* 1 1 345 1 2 1 1 51 ASN HA . 51 . HA 1 1 346 1 1 1 1 3 ILE QG . 3 . HG* 1 1 346 1 1 1 1 3 ILE MG . 3 . HG* 1 1 346 1 2 1 1 74 ALA MB . 74 . HB* 1 1 347 1 1 1 1 3 ILE QG . 3 . HG* 1 1 347 1 1 1 1 3 ILE MG . 3 . HG* 1 1 347 1 2 1 1 5 THR HG1 . 5 . HG* 1 1 347 1 2 1 1 5 THR MG . 5 . HG* 1 1 348 1 1 1 1 3 ILE MD . 3 . HD* 1 1 348 1 2 1 1 46 LYS QE . 46 . HE* 1 1 349 1 1 1 1 5 THR HB . 5 . HB* 1 1 349 1 2 1 1 43 ILE QG . 43 . HG* 1 1 349 1 2 1 1 43 ILE MG . 43 . HG* 1 1 350 1 1 1 1 5 THR HB . 5 . HB* 1 1 350 1 2 1 1 45 ILE QG . 45 . HG* 1 1 350 1 2 1 1 45 ILE MG . 45 . HG* 1 1 351 1 1 1 1 5 THR HB . 5 . HB* 1 1 351 1 2 1 1 74 ALA MB . 74 . HB* 1 1 352 1 1 1 1 5 THR HG1 . 5 . HG* 1 1 352 1 1 1 1 5 THR MG . 5 . HG* 1 1 352 1 2 1 1 45 ILE QG . 45 . HG* 1 1 352 1 2 1 1 45 ILE MG . 45 . HG* 1 1 353 1 1 1 1 5 THR HG1 . 5 . HG* 1 1 353 1 1 1 1 5 THR MG . 5 . HG* 1 1 353 1 2 1 1 74 ALA MB . 74 . HB* 1 1 354 1 1 1 1 6 LEU QB . 6 . HB* 1 1 354 1 2 1 1 44 SER H . 44 . HN 1 1 355 1 1 1 1 7 LYS HA . 7 . HA 1 1 355 1 2 1 1 43 ILE QG . 43 . HG* 1 1 355 1 2 1 1 43 ILE MG . 43 . HG* 1 1 356 1 1 1 1 7 LYS HA . 7 . HA 1 1 356 1 2 1 1 43 ILE MD . 43 . HD* 1 1 357 1 1 1 1 7 LYS QG . 7 . HG* 1 1 357 1 2 1 1 43 ILE QG . 43 . HG* 1 1 357 1 2 1 1 43 ILE MG . 43 . HG* 1 1 358 1 1 1 1 7 LYS QG . 7 . HG* 1 1 358 1 2 1 1 43 ILE MD . 43 . HD* 1 1 359 1 1 1 1 7 LYS QG . 7 . HG* 1 1 359 1 2 1 1 73 GLY QA . 73 . HA* 1 1 360 1 1 1 1 9 ILE QG . 9 . HG* 1 1 360 1 1 1 1 9 ILE MG . 9 . HG* 1 1 360 1 2 1 1 56 LEU QD . 56 . HD* 1 1 361 1 1 1 1 10 PHE HA . 10 . HA 1 1 361 1 2 1 1 16 PRO HA . 16 . HA 1 1 362 1 1 1 1 10 PHE HA . 10 . HA 1 1 362 1 2 1 1 17 GLU H . 17 . HN 1 1 363 1 1 1 1 10 PHE HA . 10 . HA 1 1 363 1 2 1 1 17 GLU QB . 17 . HB* 1 1 364 1 1 1 1 10 PHE QB . 10 . HB* 1 1 364 1 2 1 1 15 LEU QB . 15 . HB* 1 1 365 1 1 1 1 10 PHE QB . 10 . HB* 1 1 365 1 2 1 1 23 VAL QG . 23 . HG* 1 1 366 1 1 1 1 10 PHE QD . 10 . HD* 1 1 366 1 2 1 1 23 VAL QG . 23 . HG* 1 1 367 1 1 1 1 10 PHE QD . 10 . HD* 1 1 367 1 2 1 1 42 ILE QG . 42 . HG* 1 1 367 1 2 1 1 42 ILE MG . 42 . HG* 1 1 368 1 1 1 1 10 PHE QD . 10 . HD* 1 1 368 1 2 1 1 40 ILE QG . 40 . HG* 1 1 368 1 2 1 1 40 ILE MG . 40 . HG* 1 1 369 1 1 1 1 10 PHE QE . 10 . HE* 1 1 369 1 2 1 1 18 GLU QB . 18 . HB* 1 1 370 1 1 1 1 10 PHE QE . 10 . HE* 1 1 370 1 2 1 1 21 PRO HA . 21 . HA 1 1 371 1 1 1 1 10 PHE QE . 10 . HE* 1 1 371 1 2 1 1 22 PHE H . 22 . HN 1 1 372 1 1 1 1 10 PHE QD . 10 . HD* 1 1 372 1 2 1 1 16 PRO QB . 16 . HB* 1 1 373 1 1 1 1 13 LYS QG . 13 . HG* 1 1 373 1 2 1 1 38 ASP QB . 38 . HB* 1 1 374 1 1 1 1 13 LYS QD . 13 . HD* 1 1 374 1 2 1 1 27 ALA MB . 27 . HB* 1 1 375 1 1 1 1 13 LYS QD . 13 . HD* 1 1 375 1 2 1 1 27 ALA HA . 27 . HA 1 1 376 1 1 1 1 13 LYS QE . 13 . HE* 1 1 376 1 2 1 1 27 ALA MB . 27 . HB* 1 1 377 1 1 1 1 13 LYS QE . 13 . HE* 1 1 377 1 2 1 1 34 LEU QB . 34 . HB* 1 1 378 1 1 1 1 13 LYS QE . 13 . HE* 1 1 378 1 2 1 1 34 LEU QD . 34 . HD* 1 1 379 1 1 1 1 14 ASP QB . 14 . HB* 1 1 379 1 2 1 1 36 ASP HA . 36 . HA 1 1 380 1 1 1 1 15 LEU HA . 15 . HA 1 1 380 1 2 1 1 16 PRO QD . 16 . HD* 1 1 381 1 1 1 1 16 PRO HA . 16 . HA 1 1 381 1 2 1 1 21 PRO HA . 21 . HA 1 1 382 1 1 1 1 16 PRO HA . 16 . HA 1 1 382 1 2 1 1 21 PRO QB . 21 . HB* 1 1 383 1 1 1 1 16 PRO HA . 16 . HA 1 1 383 1 2 1 1 22 PHE H . 22 . HN 1 1 384 1 1 1 1 16 PRO HA . 16 . HA 1 1 384 1 2 1 1 23 VAL QG . 23 . HG* 1 1 385 1 1 1 1 16 PRO QB . 16 . HB* 1 1 385 1 2 1 1 20 ARG H . 20 . HN 1 1 386 1 1 1 1 16 PRO QB . 16 . HB* 1 1 386 1 2 1 1 20 ARG HA . 20 . HA 1 1 387 1 1 1 1 16 PRO QB . 16 . HB* 1 1 387 1 2 1 1 20 ARG QB . 20 . HB* 1 1 388 1 1 1 1 16 PRO QB . 16 . HB* 1 1 388 1 2 1 1 21 PRO QD . 21 . HD* 1 1 389 1 1 1 1 23 VAL HB . 23 . HB* 1 1 389 1 2 1 1 40 ILE QG . 40 . HG* 1 1 389 1 2 1 1 40 ILE MG . 40 . HG* 1 1 390 1 1 1 1 23 VAL HB . 23 . HB* 1 1 390 1 2 1 1 40 ILE MD . 40 . HD* 1 1 391 1 1 1 1 23 VAL HB . 23 . HB* 1 1 391 1 2 1 1 42 ILE MD . 42 . HD* 1 1 392 1 1 1 1 23 VAL HB . 23 . HB* 1 1 392 1 2 1 1 53 VAL QG . 53 . HG* 1 1 393 1 1 1 1 23 VAL QG . 23 . HG* 1 1 393 1 2 1 1 42 ILE MD . 42 . HD* 1 1 394 1 1 1 1 23 VAL QG . 23 . HG* 1 1 394 1 2 1 1 40 ILE QG . 40 . HG* 1 1 394 1 2 1 1 40 ILE MG . 40 . HG* 1 1 395 1 1 1 1 23 VAL QG . 23 . HG* 1 1 395 1 2 1 1 40 ILE MD . 40 . HD* 1 1 396 1 1 1 1 23 VAL QG . 23 . HG* 1 1 396 1 2 1 1 42 ILE QG . 42 . HG* 1 1 396 1 2 1 1 42 ILE MG . 42 . HG* 1 1 397 1 1 1 1 23 VAL QG . 23 . HG* 1 1 397 1 2 1 1 53 VAL QG . 53 . HG* 1 1 398 1 1 1 1 26 LYS QB . 26 . HB* 1 1 398 1 2 1 1 40 ILE MD . 40 . HD* 1 1 399 1 1 1 1 26 LYS QB . 26 . HB* 1 1 399 1 2 1 1 40 ILE QG . 40 . HG* 1 1 399 1 2 1 1 40 ILE MG . 40 . HG* 1 1 400 1 1 1 1 26 LYS QB . 26 . HB* 1 1 400 1 2 1 1 53 VAL QG . 53 . HG* 1 1 401 1 1 1 1 26 LYS QD . 26 . HD* 1 1 401 1 2 1 1 40 ILE QG . 40 . HG* 1 1 401 1 2 1 1 40 ILE MG . 40 . HG* 1 1 402 1 1 1 1 26 LYS QD . 26 . HD* 1 1 402 1 2 1 1 40 ILE MD . 40 . HD* 1 1 403 1 1 1 1 26 LYS QD . 26 . HD* 1 1 403 1 2 1 1 53 VAL QG . 53 . HG* 1 1 404 1 1 1 1 26 LYS QD . 26 . HD* 1 1 404 1 2 1 1 55 PHE HA . 55 . HA 1 1 405 1 1 1 1 26 LYS QD . 26 . HD* 1 1 405 1 2 1 1 55 PHE QB . 55 . HB* 1 1 406 1 1 1 1 27 ALA H . 27 . HN 1 1 406 1 2 1 1 40 ILE MD . 40 . HD* 1 1 407 1 1 1 1 27 ALA HA . 27 . HA 1 1 407 1 2 1 1 32 LYS QB . 32 . HB* 1 1 408 1 1 1 1 27 ALA HA . 27 . HA 1 1 408 1 2 1 1 32 LYS QD . 32 . HD* 1 1 409 1 1 1 1 27 ALA HA . 27 . HA 1 1 409 1 2 1 1 40 ILE MD . 40 . HD* 1 1 410 1 1 1 1 27 ALA MB . 27 . HB* 1 1 410 1 2 1 1 34 LEU QB . 34 . HB* 1 1 411 1 1 1 1 27 ALA MB . 27 . HB* 1 1 411 1 2 1 1 34 LEU QD . 34 . HD* 1 1 412 1 1 1 1 27 ALA MB . 27 . HB* 1 1 412 1 2 1 1 40 ILE MD . 40 . HD* 1 1 413 1 1 1 1 28 GLY QA . 28 . HA* 1 1 413 1 2 1 1 34 LEU QD . 34 . HD* 1 1 414 1 1 1 1 39 GLU H . 39 . HN 1 1 414 1 2 1 1 56 LEU QB . 56 . HB* 1 1 415 1 1 1 1 39 GLU QB . 39 . HB* 1 1 415 1 2 1 1 56 LEU QD . 56 . HD* 1 1 416 1 1 1 1 39 GLU QG . 39 . HG* 1 1 416 1 2 1 1 40 ILE H . 40 . HN 1 1 417 1 1 1 1 40 ILE HA . 40 . HA 1 1 417 1 2 1 1 55 PHE QB . 55 . HB* 1 1 418 1 1 1 1 40 ILE HA . 40 . HA 1 1 418 1 2 1 1 56 LEU QB . 56 . HB* 1 1 419 1 1 1 1 40 ILE HA . 40 . HA 1 1 419 1 2 1 1 56 LEU HG . 56 . HG* 1 1 420 1 1 1 1 40 ILE HB . 40 . HB* 1 1 420 1 2 1 1 42 ILE MD . 42 . HD* 1 1 421 1 1 1 1 40 ILE QG . 40 . HG* 1 1 421 1 1 1 1 40 ILE MG . 40 . HG* 1 1 421 1 2 1 1 42 ILE MD . 42 . HD* 1 1 422 1 1 1 1 40 ILE QG . 40 . HG* 1 1 422 1 1 1 1 40 ILE MG . 40 . HG* 1 1 422 1 2 1 1 55 PHE HA . 55 . HA 1 1 423 1 1 1 1 40 ILE QG . 40 . HG* 1 1 423 1 1 1 1 40 ILE MG . 40 . HG* 1 1 423 1 2 1 1 55 PHE QB . 55 . HB* 1 1 424 1 1 1 1 41 ALA MB . 41 . HB* 1 1 424 1 2 1 1 69 LEU QD . 69 . HD* 1 1 425 1 1 1 1 42 ILE QG . 42 . HG* 1 1 425 1 1 1 1 42 ILE MG . 42 . HG* 1 1 425 1 2 1 1 53 VAL QG . 53 . HG* 1 1 426 1 1 1 1 43 ILE MD . 43 . HD* 1 1 426 1 2 1 1 69 LEU QB . 69 . HB* 1 1 427 1 1 1 1 45 ILE MD . 45 . HD* 1 1 427 1 2 1 1 52 HIS QB . 52 . HB* 1 1 428 1 1 1 1 46 LYS QB . 46 . HB* 1 1 428 1 2 1 1 48 THR H . 48 . HN 1 1 429 1 1 1 1 46 LYS QG . 46 . HG* 1 1 429 1 2 1 1 47 GLY H . 47 . HN 1 1 430 1 1 1 1 46 LYS QD . 46 . HD* 1 1 430 1 2 1 1 47 GLY H . 47 . HN 1 1 431 1 1 1 1 46 LYS QD . 46 . HD* 1 1 431 1 2 1 1 48 THR HG1 . 48 . HG* 1 1 431 1 2 1 1 48 THR MG . 48 . HG* 1 1 432 1 1 1 1 47 GLY H . 47 . HN 1 1 432 1 2 1 1 49 GLN H . 49 . HN 1 1 433 1 1 1 1 47 GLY H . 47 . HN 1 1 433 1 2 1 1 50 SER H . 50 . HN 1 1 434 1 1 1 1 47 GLY QA . 47 . HA* 1 1 434 1 2 1 1 50 SER H . 50 . HN 1 1 435 1 1 1 1 47 GLY QA . 47 . HA* 1 1 435 1 2 1 1 51 ASN HA . 51 . HA 1 1 436 1 1 1 1 49 GLN H . 49 . HN 1 1 436 1 2 1 1 50 SER HA . 50 . HA 1 1 437 1 1 1 1 49 GLN HA . 49 . HA 1 1 437 1 2 1 1 50 SER HA . 50 . HA 1 1 438 1 1 1 1 52 HIS QB . 52 . HB* 1 1 438 1 2 1 1 78 HIS HD1 . 78 . HD* 1 1 438 1 2 1 1 78 HIS HD2 . 78 . HD* 1 1 439 1 1 1 1 54 LEU QB . 54 . HB* 1 1 439 1 2 1 1 56 LEU QD . 56 . HD* 1 1 440 1 1 1 1 54 LEU QB . 54 . HB* 1 1 440 1 2 1 1 69 LEU QD . 69 . HD* 1 1 441 1 1 1 1 54 LEU QB . 54 . HB* 1 1 441 1 2 1 1 72 ALA MB . 72 . HB* 1 1 442 1 1 1 1 54 LEU HG . 54 . HG* 1 1 442 1 2 1 1 72 ALA MB . 72 . HB* 1 1 443 1 1 1 1 54 LEU QD . 54 . HD* 1 1 443 1 2 1 1 72 ALA MB . 72 . HB* 1 1 444 1 1 1 1 56 LEU QD . 56 . HD* 1 1 444 1 2 1 1 69 LEU QD . 69 . HD* 1 1 445 1 1 1 1 59 TYR HA . 59 . HA 1 1 445 1 2 1 1 65 ILE QG . 65 . HG* 1 1 445 1 2 1 1 65 ILE MG . 65 . HG* 1 1 446 1 1 1 1 59 TYR QE . 59 . HE* 1 1 446 1 2 1 1 65 ILE QG . 65 . HG* 1 1 446 1 2 1 1 65 ILE MG . 65 . HG* 1 1 447 1 1 1 1 59 TYR QE . 59 . HE* 1 1 447 1 2 1 1 65 ILE MD . 65 . HD* 1 1 448 1 1 1 1 59 TYR QD . 59 . HD* 1 1 448 1 2 1 1 65 ILE QG . 65 . HG* 1 1 448 1 2 1 1 65 ILE MG . 65 . HG* 1 1 449 1 1 1 1 59 TYR QD . 59 . HD* 1 1 449 1 2 1 1 65 ILE MD . 65 . HD* 1 1 450 1 1 1 1 60 ASN H . 60 . HN 1 1 450 1 2 1 1 65 ILE QG . 65 . HG* 1 1 450 1 2 1 1 65 ILE MG . 65 . HG* 1 1 451 1 1 1 1 62 VAL QG . 62 . HG* 1 1 451 1 2 1 1 65 ILE QG . 65 . HG* 1 1 451 1 2 1 1 65 ILE MG . 65 . HG* 1 1 452 1 1 1 1 5 THR HA . 5 . HA 1 1 452 1 2 1 1 5 THR HB . 5 . HB 1 1 453 1 1 1 1 5 THR HA . 5 . HA 1 1 453 1 2 1 1 5 THR HG1 . 5 . HG* 1 1 453 1 2 1 1 5 THR MG . 5 . HG* 1 1 454 1 1 1 1 7 LYS HA . 7 . HA 1 1 454 1 2 1 1 7 LYS QB . 7 . HB* 1 1 455 1 1 1 1 7 LYS HA . 7 . HA 1 1 455 1 2 1 1 7 LYS QG . 7 . HG* 1 1 456 1 1 1 1 7 LYS QB . 7 . HB* 1 1 456 1 2 1 1 7 LYS QD . 7 . HD* 1 1 457 1 1 1 1 7 LYS QE . 7 . HE* 1 1 457 1 2 1 1 7 LYS QG . 7 . HG* 1 1 458 1 1 1 1 9 ILE HA . 9 . HA 1 1 458 1 2 1 1 9 ILE HB . 9 . HB 1 1 459 1 1 1 1 9 ILE HB . 9 . HB 1 1 459 1 2 1 1 9 ILE MD . 9 . HD* 1 1 460 1 1 1 1 10 PHE HA . 10 . HA 1 1 460 1 2 1 1 10 PHE QB . 10 . HB* 1 1 461 1 1 1 1 11 THR HA . 11 . HA 1 1 461 1 2 1 1 11 THR HB . 11 . HB 1 1 462 1 1 1 1 12 LEU HA . 12 . HA 1 1 462 1 2 1 1 12 LEU QB . 12 . HB* 1 1 463 1 1 1 1 13 LYS HA . 13 . HA 1 1 463 1 2 1 1 13 LYS QB . 13 . HB* 1 1 464 1 1 1 1 13 LYS HA . 13 . HA 1 1 464 1 2 1 1 13 LYS QG . 13 . HG* 1 1 465 1 1 1 1 13 LYS QB . 13 . HB* 1 1 465 1 2 1 1 13 LYS QD . 13 . HD* 1 1 466 1 1 1 1 14 ASP HA . 14 . HA 1 1 466 1 2 1 1 14 ASP QB . 14 . HB* 1 1 467 1 1 1 1 20 ARG HA . 20 . HA 1 1 467 1 2 1 1 20 ARG QB . 20 . HB* 1 1 468 1 1 1 1 20 ARG HA . 20 . HA 1 1 468 1 2 1 1 20 ARG QG . 20 . HG* 1 1 469 1 1 1 1 20 ARG QB . 20 . HB* 1 1 469 1 2 1 1 20 ARG QD . 20 . HD* 1 1 470 1 1 1 1 26 LYS HA . 26 . HA 1 1 470 1 2 1 1 26 LYS QG . 26 . HG* 1 1 471 1 1 1 1 29 LEU HA . 29 . HA 1 1 471 1 2 1 1 29 LEU QB . 29 . HB* 1 1 472 1 1 1 1 30 GLU HA . 30 . HA 1 1 472 1 2 1 1 30 GLU QB . 30 . HB* 1 1 473 1 1 1 1 31 LYS HA . 31 . HA 1 1 473 1 2 1 1 31 LYS QB . 31 . HB* 1 1 474 1 1 1 1 31 LYS HA . 31 . HA 1 1 474 1 2 1 1 31 LYS QG . 31 . HG* 1 1 475 1 1 1 1 31 LYS QB . 31 . HB* 1 1 475 1 2 1 1 31 LYS QD . 31 . HD* 1 1 476 1 1 1 1 32 LYS HA . 32 . HA 1 1 476 1 2 1 1 32 LYS QB . 32 . HB* 1 1 477 1 1 1 1 32 LYS HA . 32 . HA 1 1 477 1 2 1 1 32 LYS QG . 32 . HG* 1 1 478 1 1 1 1 33 LYS HA . 33 . HA 1 1 478 1 2 1 1 33 LYS QB . 33 . HB* 1 1 479 1 1 1 1 33 LYS HA . 33 . HA 1 1 479 1 2 1 1 33 LYS QG . 33 . HG* 1 1 480 1 1 1 1 34 LEU HA . 34 . HA 1 1 480 1 2 1 1 34 LEU QB . 34 . HB* 1 1 481 1 1 1 1 35 SER HA . 35 . HA 1 1 481 1 2 1 1 35 SER QB . 35 . HB* 1 1 482 1 1 1 1 36 ASP HA . 36 . HA 1 1 482 1 2 1 1 36 ASP QB . 36 . HB* 1 1 483 1 1 1 1 37 ASP HA . 37 . HA 1 1 483 1 2 1 1 37 ASP QB . 37 . HB* 1 1 484 1 1 1 1 38 ASP HA . 38 . HA 1 1 484 1 2 1 1 38 ASP QB . 38 . HB* 1 1 485 1 1 1 1 39 GLU HA . 39 . HA 1 1 485 1 2 1 1 39 GLU QB . 39 . HB* 1 1 486 1 1 1 1 40 ILE HA . 40 . HA 1 1 486 1 2 1 1 40 ILE HB . 40 . HB 1 1 487 1 1 1 1 40 ILE HB . 40 . HB 1 1 487 1 2 1 1 40 ILE MD . 40 . HD* 1 1 488 1 1 1 1 42 ILE HA . 42 . HA 1 1 488 1 2 1 1 42 ILE HB . 42 . HB 1 1 489 1 1 1 1 42 ILE HB . 42 . HB 1 1 489 1 2 1 1 42 ILE MD . 42 . HD* 1 1 490 1 1 1 1 43 ILE HA . 43 . HA 1 1 490 1 2 1 1 43 ILE HB . 43 . HB 1 1 491 1 1 1 1 43 ILE HB . 43 . HB 1 1 491 1 2 1 1 43 ILE MD . 43 . HD* 1 1 492 1 1 1 1 44 SER HA . 44 . HA 1 1 492 1 2 1 1 44 SER QB . 44 . HB* 1 1 493 1 1 1 1 45 ILE HA . 45 . HA 1 1 493 1 2 1 1 45 ILE HB . 45 . HB 1 1 494 1 1 1 1 45 ILE HB . 45 . HB 1 1 494 1 2 1 1 45 ILE MD . 45 . HD* 1 1 495 1 1 1 1 53 VAL HA . 53 . HA 1 1 495 1 2 1 1 53 VAL HB . 53 . HB 1 1 496 1 1 1 1 54 LEU HA . 54 . HA 1 1 496 1 2 1 1 54 LEU QB . 54 . HB* 1 1 497 1 1 1 1 55 PHE HA . 55 . HA 1 1 497 1 2 1 1 55 PHE QB . 55 . HB* 1 1 498 1 1 1 1 56 LEU HA . 56 . HA 1 1 498 1 2 1 1 56 LEU QB . 56 . HB* 1 1 499 1 1 1 1 57 SER HA . 57 . HA 1 1 499 1 2 1 1 57 SER QB . 57 . HB* 1 1 500 1 1 1 1 58 SER HA . 58 . HA 1 1 500 1 2 1 1 58 SER QB . 58 . HB* 1 1 501 1 1 1 1 59 TYR HA . 59 . HA 1 1 501 1 2 1 1 59 TYR QB . 59 . HB* 1 1 502 1 1 1 1 60 ASN HA . 60 . HA 1 1 502 1 2 1 1 60 ASN QB . 60 . HB* 1 1 503 1 1 1 1 61 SER HA . 61 . HA 1 1 503 1 2 1 1 61 SER QB . 61 . HB* 1 1 504 1 1 1 1 62 VAL HA . 62 . HA 1 1 504 1 2 1 1 62 VAL HB . 62 . HB 1 1 505 1 1 1 1 63 ASP HA . 63 . HA 1 1 505 1 2 1 1 63 ASP QB . 63 . HB* 1 1 506 1 1 1 1 64 GLU HA . 64 . HA 1 1 506 1 2 1 1 64 GLU QB . 64 . HB* 1 1 507 1 1 1 1 65 ILE HA . 65 . HA 1 1 507 1 2 1 1 65 ILE HB . 65 . HB 1 1 508 1 1 1 1 65 ILE HB . 65 . HB 1 1 508 1 2 1 1 65 ILE MD . 65 . HD* 1 1 509 1 1 1 1 66 ARG HA . 66 . HA 1 1 509 1 2 1 1 66 ARG QB . 66 . HB* 1 1 510 1 1 1 1 66 ARG HA . 66 . HA 1 1 510 1 2 1 1 66 ARG QG . 66 . HG* 1 1 511 1 1 1 1 66 ARG QB . 66 . HB* 1 1 511 1 2 1 1 66 ARG QD . 66 . HD* 1 1 512 1 1 1 1 67 LYS HA . 67 . HA 1 1 512 1 2 1 1 67 LYS QB . 67 . HB* 1 1 513 1 1 1 1 67 LYS HA . 67 . HA 1 1 513 1 2 1 1 67 LYS QG . 67 . HG* 1 1 514 1 1 1 1 67 LYS QB . 67 . HB* 1 1 514 1 2 1 1 67 LYS QD . 67 . HD* 1 1 515 1 1 1 1 67 LYS QE . 67 . HE* 1 1 515 1 2 1 1 67 LYS QG . 67 . HG* 1 1 516 1 1 1 1 68 GLU HA . 68 . HA 1 1 516 1 2 1 1 68 GLU QB . 68 . HB* 1 1 517 1 1 1 1 69 LEU HA . 69 . HA 1 1 517 1 2 1 1 69 LEU QB . 69 . HB* 1 1 518 1 1 1 1 69 LEU HA . 69 . HA 1 1 518 1 2 1 1 69 LEU HG . 69 . HG 1 1 519 1 1 1 1 69 LEU QB . 69 . HB* 1 1 519 1 2 1 1 69 LEU HG . 69 . HG 1 1 520 1 1 1 1 70 GLU HA . 70 . HA 1 1 520 1 2 1 1 70 GLU QB . 70 . HB* 1 1 521 1 1 1 1 75 LYS HA . 75 . HA 1 1 521 1 2 1 1 75 LYS QG . 75 . HG* 1 1 522 1 1 1 1 75 LYS QB . 75 . HB* 1 1 522 1 2 1 1 75 LYS QD . 75 . HD* 1 1 523 1 1 1 1 76 ILE HA . 76 . HA 1 1 523 1 2 1 1 76 ILE HB . 76 . HB* 1 1 524 1 1 1 1 76 ILE HB . 76 . HB 1 1 524 1 2 1 1 76 ILE MD . 76 . HD* 1 1 525 1 1 1 1 77 ASN HA . 77 . HA 1 1 525 1 2 1 1 77 ASN QB . 77 . HB* 1 1 526 1 1 1 1 79 THR HA . 79 . HA 1 1 526 1 2 1 1 79 THR HB . 79 . HB 1 1 527 1 1 1 1 80 THR HA . 80 . HA 1 1 527 1 2 1 1 80 THR HB . 80 . HB 1 1 528 1 1 1 1 81 LEU HA . 81 . HA 1 1 528 1 2 1 1 81 LEU QB . 81 . HB* 1 1 529 1 1 1 1 81 LEU HA . 81 . HA 1 1 529 1 2 1 1 81 LEU HG . 81 . HG 1 1 530 1 1 1 1 81 LEU QB . 81 . HB* 1 1 530 1 2 1 1 81 LEU HG . 81 . HG 1 1 531 1 1 1 1 82 LYS HA . 82 . HA 1 1 531 1 2 1 1 82 LYS QB . 82 . HB* 1 1 532 1 1 1 1 82 LYS HA . 82 . HA 1 1 532 1 2 1 1 82 LYS QG . 82 . HG* 1 1 533 1 1 1 1 82 LYS QB . 82 . HB* 1 1 533 1 2 1 1 82 LYS QD . 82 . HD* 1 1 534 1 1 1 1 82 LYS QE . 82 . HE* 1 1 534 1 2 1 1 82 LYS QG . 82 . HG* 1 1 535 1 1 1 1 83 ILE HA . 83 . HA 1 1 535 1 2 1 1 83 ILE HB . 83 . HB* 1 1 536 1 1 1 1 83 ILE HB . 83 . HB 1 1 536 1 2 1 1 83 ILE MD . 83 . HD* 1 1 537 1 1 1 1 84 LEU HA . 84 . HA 1 1 537 1 2 1 1 84 LEU QB . 84 . HB* 1 1 538 1 1 1 1 84 LEU HA . 84 . HA 1 1 538 1 2 1 1 84 LEU HG . 84 . HG 1 1 539 1 1 1 1 84 LEU QB . 84 . HB* 1 1 539 1 2 1 1 84 LEU HG . 84 . HG 1 1 540 1 1 1 1 85 GLU HA . 85 . HA 1 1 540 1 2 1 1 85 GLU QB . 85 . HB* 1 1 541 1 1 1 1 87 HIS HA . 87 . HA 1 1 541 1 2 1 1 87 HIS QB . 87 . HB* 1 1 542 1 1 1 1 88 LEU HA . 88 . HA 1 1 542 1 2 1 1 88 LEU QB . 88 . HB* 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 2.5 1.8 2.7 1 1 2 1 . . . . . 4.0 1.8 6.0 1 1 3 1 . . . . . 4.0 1.8 7.4 1 1 4 1 . . . . . 2.5 1.8 2.7 1 1 5 1 . . . . . 4.0 1.8 5.0 1 1 6 1 . . . . . 3.0 1.8 4.3 1 1 7 1 . . . . . 2.5 1.8 2.7 1 1 8 1 . . . . . 3.0 1.8 4.3 1 1 9 1 . . . . . 4.0 1.8 6.0 1 1 10 1 . . . . . 4.0 1.8 6.0 1 1 11 1 . . . . . 2.5 1.8 2.7 1 1 12 1 . . . . . 2.5 1.8 2.7 1 1 13 1 . . . . . 2.5 1.8 2.7 1 1 14 1 . . . . . 3.0 1.8 4.3 1 1 15 1 . . . . . 4.0 1.8 5.0 1 1 16 1 . . . . . 2.5 1.8 3.7 1 1 17 1 . . . . . 4.0 1.8 5.0 1 1 18 1 . . . . . 2.5 1.8 2.7 1 1 19 1 . . . . . 4.0 1.8 6.0 1 1 20 1 . . . . . 2.5 1.8 2.7 1 1 21 1 . . . . . 4.0 1.8 6.0 1 1 22 1 . . . . . 3.0 1.8 4.3 1 1 23 1 . . . . . 3.0 1.8 3.3 1 1 24 1 . . . . . 3.0 1.8 4.3 1 1 25 1 . . . . . 3.0 1.8 4.3 1 1 26 1 . . . . . 4.0 1.8 5.0 1 1 27 1 . . . . . 4.0 1.8 6.0 1 1 28 1 . . . . . 3.0 1.8 4.3 1 1 29 1 . . . . . 4.0 1.8 6.0 1 1 30 1 . . . . . 4.0 1.8 6.0 1 1 31 1 . . . . . 3.0 1.8 4.3 1 1 32 1 . . . . . 3.0 1.8 3.3 1 1 33 1 . . . . . 4.0 1.8 5.0 1 1 34 1 . . . . . 3.0 1.8 4.3 1 1 35 1 . . . . . 3.0 1.8 4.3 1 1 36 1 . . . . . 4.0 1.8 8.3 1 1 37 1 . . . . . 4.0 1.8 8.3 1 1 38 1 . . . . . 4.0 1.8 6.0 1 1 39 1 . . . . . 2.5 1.8 2.7 1 1 40 1 . . . . . 3.0 1.8 4.3 1 1 41 1 . . . . . 3.0 1.8 4.3 1 1 42 1 . . . . . 3.0 1.8 4.3 1 1 43 1 . . . . . 4.0 1.8 6.0 1 1 44 1 . . . . . 4.0 1.8 5.0 1 1 45 1 . . . . . 3.0 1.8 4.3 1 1 46 1 . . . . . 4.0 1.8 6.0 1 1 47 1 . . . . . 4.0 1.8 5.0 1 1 48 1 . . . . . 3.0 1.8 3.3 1 1 49 1 . . . . . 3.0 1.8 4.3 1 1 50 1 . . . . . 4.0 1.8 6.0 1 1 51 1 . . . . . 4.0 1.8 5.0 1 1 52 1 . . . . . 3.0 1.8 4.3 1 1 53 1 . . . . . 3.0 1.8 3.3 1 1 54 1 . . . . . 4.0 1.8 6.0 1 1 55 1 . . . . . 3.0 1.8 3.3 1 1 56 1 . . . . . 4.0 1.8 6.0 1 1 57 1 . . . . . 4.0 1.8 5.0 1 1 58 1 . . . . . 3.0 1.8 3.3 1 1 59 1 . . . . . 4.0 1.8 5.0 1 1 60 1 . . . . . 4.0 1.8 6.0 1 1 61 1 . . . . . 3.0 1.8 3.3 1 1 62 1 . . . . . 4.0 1.8 5.0 1 1 63 1 . . . . . 4.0 1.8 6.0 1 1 64 1 . . . . . 3.0 1.8 3.3 1 1 65 1 . . . . . 3.0 1.8 3.3 1 1 66 1 . . . . . 4.0 1.8 6.0 1 1 67 1 . . . . . 3.0 1.8 3.3 1 1 68 1 . . . . . 3.0 1.8 3.3 1 1 69 1 . . . . . 4.0 1.8 6.0 1 1 70 1 . . . . . 3.0 1.8 3.3 1 1 71 1 . . . . . 3.0 1.8 3.3 1 1 72 1 . . . . . 4.0 1.8 5.0 1 1 73 1 . . . . . 4.0 1.8 6.0 1 1 74 1 . . . . . 2.5 1.8 2.7 1 1 75 1 . . . . . 4.0 1.8 6.0 1 1 76 1 . . . . . 3.0 1.8 3.3 1 1 77 1 . . . . . 3.0 1.8 3.3 1 1 78 1 . . . . . 4.0 1.8 6.0 1 1 79 1 . . . . . 4.0 1.8 6.0 1 1 80 1 . . . . . 3.0 1.8 3.3 1 1 81 1 . . . . . 4.0 1.8 6.0 1 1 82 1 . . . . . 3.0 1.8 3.3 1 1 83 1 . . . . . 2.5 1.8 2.7 1 1 84 1 . . . . . 4.0 1.8 6.0 1 1 85 1 . . . . . 4.0 1.8 6.0 1 1 86 1 . . . . . 4.0 1.8 6.0 1 1 87 1 . . . . . 2.5 1.8 2.7 1 1 88 1 . . . . . 2.5 1.8 2.7 1 1 89 1 . . . . . 4.0 1.8 6.0 1 1 90 1 . . . . . 4.0 1.8 6.0 1 1 91 1 . . . . . 4.0 1.8 6.0 1 1 92 1 . . . . . 4.0 1.8 5.0 1 1 93 1 . . . . . 4.0 1.8 6.0 1 1 94 1 . . . . . 4.0 1.8 6.0 1 1 95 1 . . . . . 4.0 1.8 5.0 1 1 96 1 . . . . . 3.0 1.8 4.3 1 1 97 1 . . . . . 4.0 1.8 5.0 1 1 98 1 . . . . . 4.0 1.8 5.0 1 1 99 1 . . . . . 2.5 1.8 2.7 1 1 100 1 . . . . . 3.0 1.8 4.3 1 1 101 1 . . . . . 3.0 1.8 4.3 1 1 102 1 . . . . . 4.0 1.8 5.0 1 1 103 1 . . . . . 4.0 1.8 6.0 1 1 104 1 . . . . . 4.0 1.8 5.0 1 1 105 1 . . . . . 4.0 1.8 6.0 1 1 106 1 . . . . . 3.0 1.8 4.3 1 1 107 1 . . . . . 2.5 1.8 2.7 1 1 108 1 . . . . . 4.0 1.8 6.0 1 1 109 1 . . . . . 4.0 1.8 5.0 1 1 110 1 . . . . . 3.0 1.8 4.3 1 1 111 1 . . . . . 4.0 1.8 5.0 1 1 112 1 . . . . . 4.0 1.8 8.3 1 1 113 1 . . . . . 4.0 1.8 8.3 1 1 114 1 . . . . . 2.5 1.8 2.7 1 1 115 1 . . . . . 4.0 1.8 6.0 1 1 116 1 . . . . . 3.0 1.8 4.3 1 1 117 1 . . . . . 4.0 1.8 6.0 1 1 118 1 . . . . . 4.0 1.8 5.0 1 1 119 1 . . . . . 2.5 1.8 2.7 1 1 120 1 . . . . . 4.0 1.8 6.0 1 1 121 1 . . . . . 2.5 1.8 2.7 1 1 122 1 . . . . . 4.0 1.8 5.0 1 1 123 1 . . . . . 3.0 1.8 4.3 1 1 124 1 . . . . . 2.5 1.8 2.7 1 1 125 1 . . . . . 4.0 1.8 6.0 1 1 126 1 . . . . . 2.5 1.8 2.7 1 1 127 1 . . . . . 4.0 1.8 5.0 1 1 128 1 . . . . . 3.0 1.8 3.3 1 1 129 1 . . . . . 4.0 1.8 6.0 1 1 130 1 . . . . . 3.0 1.8 4.3 1 1 131 1 . . . . . 4.0 1.8 6.0 1 1 132 1 . . . . . 3.0 1.8 3.3 1 1 133 1 . . . . . 4.0 1.8 5.0 1 1 134 1 . . . . . 4.0 1.8 5.0 1 1 135 1 . . . . . 4.0 1.8 5.0 1 1 136 1 . . . . . 4.0 1.8 6.0 1 1 137 1 . . . . . 4.0 1.8 6.0 1 1 138 1 . . . . . 4.0 1.8 5.0 1 1 139 1 . . . . . 4.0 1.8 5.0 1 1 140 1 . . . . . 3.0 1.8 3.3 1 1 141 1 . . . . . 3.0 1.8 3.3 1 1 142 1 . . . . . 3.0 1.8 4.3 1 1 143 1 . . . . . 2.5 1.8 2.7 1 1 144 1 . . . . . 4.0 1.8 6.0 1 1 145 1 . . . . . 2.5 1.8 2.7 1 1 146 1 . . . . . 4.0 1.8 6.0 1 1 147 1 . . . . . 3.0 1.8 4.3 1 1 148 1 . . . . . 2.5 1.8 2.7 1 1 149 1 . . . . . 3.0 1.8 4.3 1 1 150 1 . . . . . 3.0 1.8 4.3 1 1 151 1 . . . . . 2.5 1.8 2.7 1 1 152 1 . . . . . 4.0 1.8 6.0 1 1 153 1 . . . . . 3.0 1.8 3.3 1 1 154 1 . . . . . 4.0 1.8 5.0 1 1 155 1 . . . . . 4.0 1.8 6.0 1 1 156 1 . . . . . 3.0 1.8 4.3 1 1 157 1 . . . . . 4.0 1.8 7.4 1 1 158 1 . . . . . 4.0 1.8 7.4 1 1 159 1 . . . . . 4.0 1.8 7.4 1 1 160 1 . . . . . 4.0 1.8 8.3 1 1 161 1 . . . . . 4.0 1.8 8.3 1 1 162 1 . . . . . 4.0 1.8 5.0 1 1 163 1 . . . . . 3.0 1.8 4.3 1 1 164 1 . . . . . 3.0 1.8 4.3 1 1 165 1 . . . . . 3.0 1.8 4.3 1 1 166 1 . . . . . 3.0 1.8 4.3 1 1 167 1 . . . . . 4.0 1.8 6.0 1 1 168 1 . . . . . 4.0 1.8 6.0 1 1 169 1 . . . . . 4.0 1.8 6.0 1 1 170 1 . . . . . 4.0 1.8 5.0 1 1 171 1 . . . . . 3.0 1.8 4.3 1 1 172 1 . . . . . 4.0 1.8 5.0 1 1 173 1 . . . . . 3.0 1.8 4.3 1 1 174 1 . . . . . 3.0 1.8 4.3 1 1 175 1 . . . . . 4.0 1.8 6.0 1 1 176 1 . . . . . 4.0 1.8 5.0 1 1 177 1 . . . . . 3.0 1.8 3.3 1 1 178 1 . . . . . 4.0 1.8 5.0 1 1 179 1 . . . . . 3.0 1.8 4.3 1 1 180 1 . . . . . 3.0 1.8 4.3 1 1 181 1 . . . . . 4.0 1.8 6.0 1 1 182 1 . . . . . 3.0 1.8 3.3 1 1 183 1 . . . . . 3.0 1.8 4.3 1 1 184 1 . . . . . 3.0 1.8 4.3 1 1 185 1 . . . . . 4.0 1.8 6.0 1 1 186 1 . . . . . 3.0 1.8 3.3 1 1 187 1 . . . . . 4.0 1.8 5.0 1 1 188 1 . . . . . 3.0 1.8 4.3 1 1 189 1 . . . . . 3.0 1.8 4.3 1 1 190 1 . . . . . 4.0 1.8 6.0 1 1 191 1 . . . . . 4.0 1.8 5.0 1 1 192 1 . . . . . 3.0 1.8 3.3 1 1 193 1 . . . . . 4.0 1.8 5.0 1 1 194 1 . . . . . 4.0 1.8 5.0 1 1 195 1 . . . . . 4.0 1.8 6.0 1 1 196 1 . . . . . 3.0 1.8 3.3 1 1 197 1 . . . . . 4.0 1.8 5.0 1 1 198 1 . . . . . 4.0 1.8 6.0 1 1 199 1 . . . . . 3.0 1.8 4.3 1 1 200 1 . . . . . 4.0 1.8 5.0 1 1 201 1 . . . . . 3.0 1.8 3.3 1 1 202 1 . . . . . 4.0 1.8 5.0 1 1 203 1 . . . . . 4.0 1.8 5.0 1 1 204 1 . . . . . 4.0 1.8 6.0 1 1 205 1 . . . . . 3.0 1.8 4.3 1 1 206 1 . . . . . 3.0 1.8 3.3 1 1 207 1 . . . . . 4.0 1.8 5.0 1 1 208 1 . . . . . 4.0 1.8 5.0 1 1 209 1 . . . . . 3.0 1.8 4.3 1 1 210 1 . . . . . 3.0 1.8 4.3 1 1 211 1 . . . . . 4.0 1.8 6.0 1 1 212 1 . . . . . 3.0 1.8 3.3 1 1 213 1 . . . . . 4.0 1.8 5.0 1 1 214 1 . . . . . 3.0 1.8 3.3 1 1 215 1 . . . . . 3.0 1.8 4.3 1 1 216 1 . . . . . 2.5 1.8 3.7 1 1 217 1 . . . . . 2.5 1.8 2.7 1 1 218 1 . . . . . 4.0 1.8 5.0 1 1 219 1 . . . . . 3.0 1.8 4.3 1 1 220 1 . . . . . 4.0 1.8 6.0 1 1 221 1 . . . . . 4.0 1.8 5.0 1 1 222 1 . . . . . 4.0 1.8 6.0 1 1 223 1 . . . . . 3.0 1.8 4.3 1 1 224 1 . . . . . 4.0 1.8 6.0 1 1 225 1 . . . . . 3.0 1.8 3.3 1 1 226 1 . . . . . 3.0 1.8 4.3 1 1 227 1 . . . . . 3.0 1.8 4.3 1 1 228 1 . . . . . 4.0 1.8 6.0 1 1 229 1 . . . . . 4.0 1.8 5.0 1 1 230 1 . . . . . 3.0 1.8 3.3 1 1 231 1 . . . . . 3.0 1.8 4.3 1 1 232 1 . . . . . 4.0 1.8 6.0 1 1 233 1 . . . . . 3.0 1.8 4.3 1 1 234 1 . . . . . 3.0 1.8 4.3 1 1 235 1 . . . . . 3.0 1.8 4.3 1 1 236 1 . . . . . 4.0 1.8 6.0 1 1 237 1 . . . . . 4.0 1.8 5.0 1 1 238 1 . . . . . 4.0 1.8 6.0 1 1 239 1 . . . . . 4.0 1.8 5.0 1 1 240 1 . . . . . 4.0 1.8 6.0 1 1 241 1 . . . . . 4.0 1.8 6.0 1 1 242 1 . . . . . 4.0 1.8 5.0 1 1 243 1 . . . . . 4.0 1.8 6.0 1 1 244 1 . . . . . 4.0 1.8 5.0 1 1 245 1 . . . . . 4.0 1.8 5.0 1 1 246 1 . . . . . 3.0 1.8 4.3 1 1 247 1 . . . . . 3.0 1.8 3.3 1 1 248 1 . . . . . 3.0 1.8 4.3 1 1 249 1 . . . . . 4.0 1.8 6.0 1 1 250 1 . . . . . 4.0 1.8 6.0 1 1 251 1 . . . . . 3.0 1.8 3.3 1 1 252 1 . . . . . 3.0 1.8 4.3 1 1 253 1 . . . . . 4.0 1.8 6.0 1 1 254 1 . . . . . 3.0 1.8 4.3 1 1 255 1 . . . . . 3.0 1.8 3.3 1 1 256 1 . . . . . 4.0 1.8 6.0 1 1 257 1 . . . . . 3.0 1.8 4.3 1 1 258 1 . . . . . 3.0 1.8 3.3 1 1 259 1 . . . . . 3.0 1.8 3.3 1 1 260 1 . . . . . 3.0 1.8 4.3 1 1 261 1 . . . . . 4.0 1.8 6.0 1 1 262 1 . . . . . . 1.8 3.3 1 1 263 1 . . . . . 3.0 1.8 3.3 1 1 264 1 . . . . . 3.0 1.8 4.3 1 1 265 1 . . . . . 3.0 1.8 3.3 1 1 266 1 . . . . . 3.0 1.8 4.3 1 1 267 1 . . . . . 3.0 1.8 4.3 1 1 268 1 . . . . . 3.0 1.8 3.3 1 1 269 1 . . . . . 3.0 1.8 3.3 1 1 270 1 . . . . . 3.0 1.8 4.3 1 1 271 1 . . . . . 4.0 1.8 6.0 1 1 272 1 . . . . . 4.0 1.8 6.0 1 1 273 1 . . . . . 4.0 1.8 5.0 1 1 274 1 . . . . . 4.0 1.8 5.0 1 1 275 1 . . . . . 4.0 1.8 5.0 1 1 276 1 . . . . . 4.0 1.8 5.0 1 1 277 1 . . . . . 4.0 1.8 6.0 1 1 278 1 . . . . . 4.0 1.8 5.0 1 1 279 1 . . . . . 4.0 1.8 5.0 1 1 280 1 . . . . . 4.0 1.8 5.0 1 1 281 1 . . . . . 4.0 1.8 5.0 1 1 282 1 . . . . . 4.0 1.8 5.0 1 1 283 1 . . . . . 4.0 1.8 5.0 1 1 284 1 . . . . . 4.0 1.8 5.0 1 1 285 1 . . . . . 4.0 1.8 5.0 1 1 286 1 . . . . . 4.0 1.8 5.0 1 1 287 1 . . . . . 4.0 1.8 5.0 1 1 288 1 . . . . . 4.0 1.8 5.0 1 1 289 1 . . . . . 4.0 1.8 5.0 1 1 290 1 . . . . . 4.0 1.8 5.0 1 1 291 1 . . . . . 4.0 1.8 5.0 1 1 292 1 . . . . . 4.0 1.8 5.0 1 1 293 1 . . . . . 4.0 1.8 5.0 1 1 294 1 . . . . . 4.0 1.8 5.0 1 1 295 1 . . . . . 4.0 1.8 5.0 1 1 296 1 . . . . . 4.0 1.8 5.0 1 1 297 1 . . . . . 4.0 1.8 5.0 1 1 298 1 . . . . . 4.0 1.8 5.0 1 1 299 1 . . . . . 4.0 1.8 5.0 1 1 300 1 . . . . . 4.0 1.8 5.0 1 1 301 1 . . . . . 4.0 1.8 5.0 1 1 302 1 . . . . . 4.0 1.8 5.0 1 1 303 1 . . . . . 4.0 1.8 5.0 1 1 304 1 . . . . . 4.0 1.8 5.0 1 1 305 1 . . . . . 4.0 1.8 5.0 1 1 306 1 . . . . . 4.0 1.8 5.0 1 1 307 1 . . . . . 3.0 1.8 3.3 1 1 308 1 . . . . . 3.0 1.8 3.3 1 1 309 1 . . . . . 3.0 1.8 3.3 1 1 310 1 . . . . . 3.0 1.8 3.3 1 1 311 1 . . . . . 4.0 1.8 8.3 1 1 312 1 . . . . . 4.0 1.8 5.0 1 1 313 1 . . . . . 4.0 1.8 5.0 1 1 314 1 . . . . . 4.0 1.8 5.0 1 1 315 1 . . . . . 4.0 1.8 5.0 1 1 316 1 . . . . . 4.0 1.8 6.0 1 1 317 1 . . . . . 4.0 1.8 6.0 1 1 318 1 . . . . . 4.0 1.8 6.0 1 1 319 1 . . . . . 4.0 1.8 6.0 1 1 320 1 . . . . . 4.0 1.8 6.0 1 1 321 1 . . . . . 4.0 1.8 6.0 1 1 322 1 . . . . . 4.0 1.8 6.0 1 1 323 1 . . . . . 4.0 1.8 6.0 1 1 324 1 . . . . . 4.0 1.8 6.0 1 1 325 1 . . . . . 4.0 1.8 6.0 1 1 326 1 . . . . . 4.0 1.8 6.0 1 1 327 1 . . . . . 4.0 1.8 6.0 1 1 328 1 . . . . . 4.0 1.8 7.0 1 1 329 1 . . . . . 4.0 1.8 6.0 1 1 330 1 . . . . . 4.0 1.8 7.4 1 1 331 1 . . . . . 4.0 1.8 8.3 1 1 332 1 . . . . . 4.0 1.8 8.3 1 1 333 1 . . . . . 4.0 1.8 7.4 1 1 334 1 . . . . . 4.0 1.8 7.4 1 1 335 1 . . . . . 4.0 1.8 8.3 1 1 336 1 . . . . . 4.0 1.8 5.0 1 1 337 1 . . . . . 4.0 1.8 8.3 1 1 338 1 . . . . . 4.0 1.8 8.3 1 1 339 1 . . . . . 4.0 1.8 7.4 1 1 340 1 . . . . . 4.0 1.8 6.0 1 1 341 1 . . . . . 4.0 1.8 6.0 1 1 342 1 . . . . . 4.0 1.8 6.0 1 1 343 1 . . . . . 4.0 1.8 6.0 1 1 344 1 . . . . . 4.0 1.8 6.0 1 1 345 1 . . . . . 4.0 1.8 6.0 1 1 346 1 . . . . . 4.0 1.8 8.3 1 1 347 1 . . . . . 4.0 1.8 6.0 1 1 348 1 . . . . . 4.0 1.8 8.3 1 1 349 1 . . . . . 4.0 1.8 7.4 1 1 350 1 . . . . . 4.0 1.8 7.4 1 1 351 1 . . . . . 4.0 1.8 7.4 1 1 352 1 . . . . . 4.0 1.8 7.4 1 1 353 1 . . . . . 4.0 1.8 7.4 1 1 354 1 . . . . . 4.0 1.8 6.0 1 1 355 1 . . . . . 4.0 1.8 7.4 1 1 356 1 . . . . . 4.0 1.8 6.0 1 1 357 1 . . . . . 4.0 1.8 7.4 1 1 358 1 . . . . . 4.0 1.8 6.0 1 1 359 1 . . . . . 4.0 1.8 7.4 1 1 360 1 . . . . . 4.0 1.8 7.4 1 1 361 1 . . . . . 4.0 1.8 6.0 1 1 362 1 . . . . . 4.0 1.8 5.0 1 1 363 1 . . . . . 4.0 1.8 6.0 1 1 364 1 . . . . . 4.0 1.8 7.4 1 1 365 1 . . . . . 4.0 1.8 7.4 1 1 366 1 . . . . . 4.0 1.8 7.4 1 1 367 1 . . . . . 4.0 1.8 7.4 1 1 368 1 . . . . . 4.0 1.8 7.4 1 1 369 1 . . . . . 4.0 1.8 7.4 1 1 370 1 . . . . . 4.0 1.8 7.4 1 1 371 1 . . . . . 4.0 1.8 7.4 1 1 372 1 . . . . . 4.0 1.8 7.4 1 1 373 1 . . . . . 4.0 1.8 6.0 1 1 374 1 . . . . . 4.0 1.8 6.0 1 1 375 1 . . . . . 4.0 1.8 7.4 1 1 376 1 . . . . . 4.0 1.8 6.0 1 1 377 1 . . . . . 4.0 1.8 6.0 1 1 378 1 . . . . . 4.0 1.8 7.4 1 1 379 1 . . . . . 4.0 1.8 7.4 1 1 380 1 . . . . . 3.0 1.8 4.3 1 1 381 1 . . . . . 4.0 1.8 6.0 1 1 382 1 . . . . . 4.0 1.8 7.4 1 1 383 1 . . . . . 4.0 1.8 7.4 1 1 384 1 . . . . . 4.0 1.8 7.4 1 1 385 1 . . . . . 4.0 1.8 7.4 1 1 386 1 . . . . . 4.0 1.8 6.0 1 1 387 1 . . . . . 4.0 1.8 7.4 1 1 388 1 . . . . . 4.0 1.8 6.0 1 1 389 1 . . . . . 4.0 1.8 7.4 1 1 390 1 . . . . . 4.0 1.8 7.4 1 1 391 1 . . . . . 4.0 1.8 7.4 1 1 392 1 . . . . . 4.0 1.8 7.4 1 1 393 1 . . . . . 4.0 1.8 7.4 1 1 394 1 . . . . . 4.0 1.8 7.4 1 1 395 1 . . . . . 4.0 1.8 7.4 1 1 396 1 . . . . . 4.0 1.8 7.4 1 1 397 1 . . . . . 4.0 1.8 7.4 1 1 398 1 . . . . . 4.0 1.8 7.4 1 1 399 1 . . . . . 4.0 1.8 7.4 1 1 400 1 . . . . . 4.0 1.8 7.4 1 1 401 1 . . . . . 4.0 1.8 7.4 1 1 402 1 . . . . . 4.0 1.8 7.4 1 1 403 1 . . . . . 4.0 1.8 7.4 1 1 404 1 . . . . . 4.0 1.8 7.4 1 1 405 1 . . . . . 4.0 1.8 6.0 1 1 406 1 . . . . . 4.0 1.8 7.4 1 1 407 1 . . . . . 4.0 1.8 6.0 1 1 408 1 . . . . . 4.0 1.8 6.0 1 1 409 1 . . . . . 4.0 1.8 7.4 1 1 410 1 . . . . . 4.0 1.8 7.4 1 1 411 1 . . . . . 4.0 1.8 7.4 1 1 412 1 . . . . . 4.0 1.8 7.4 1 1 413 1 . . . . . 4.0 1.8 7.4 1 1 414 1 . . . . . 4.0 1.8 6.0 1 1 415 1 . . . . . 4.0 1.8 6.0 1 1 416 1 . . . . . 4.0 1.8 6.0 1 1 417 1 . . . . . 4.0 1.8 7.4 1 1 418 1 . . . . . 4.0 1.8 7.4 1 1 419 1 . . . . . 4.0 1.8 7.4 1 1 420 1 . . . . . 4.0 1.8 7.4 1 1 421 1 . . . . . 4.0 1.8 7.4 1 1 422 1 . . . . . 4.0 1.8 7.4 1 1 423 1 . . . . . 4.0 1.8 7.4 1 1 424 1 . . . . . 4.0 1.8 7.4 1 1 425 1 . . . . . 4.0 1.8 7.4 1 1 426 1 . . . . . 4.0 1.8 7.4 1 1 427 1 . . . . . 4.0 1.8 7.4 1 1 428 1 . . . . . 4.0 1.8 6.0 1 1 429 1 . . . . . 4.0 1.8 7.4 1 1 430 1 . . . . . 4.0 1.8 7.4 1 1 431 1 . . . . . 4.0 1.8 7.4 1 1 432 1 . . . . . 4.0 1.8 5.0 1 1 433 1 . . . . . 4.0 1.8 6.0 1 1 434 1 . . . . . 4.0 1.8 6.0 1 1 435 1 . . . . . 4.0 1.8 6.0 1 1 436 1 . . . . . 4.0 1.8 6.0 1 1 437 1 . . . . . 4.0 1.8 6.0 1 1 438 1 . . . . . 4.0 1.8 7.4 1 1 439 1 . . . . . 4.0 1.8 6.0 1 1 440 1 . . . . . 4.0 1.8 7.4 1 1 441 1 . . . . . 4.0 1.8 7.4 1 1 442 1 . . . . . 4.0 1.8 7.4 1 1 443 1 . . . . . 4.0 1.8 7.4 1 1 444 1 . . . . . 4.0 1.8 7.4 1 1 445 1 . . . . . 4.0 1.8 7.4 1 1 446 1 . . . . . 4.0 1.8 7.4 1 1 447 1 . . . . . 4.0 1.8 7.4 1 1 448 1 . . . . . 4.0 1.8 7.4 1 1 449 1 . . . . . 4.0 1.8 7.4 1 1 450 1 . . . . . 4.0 1.8 7.4 1 1 451 1 . . . . . 4.0 1.8 7.4 1 1 452 1 . . . . . 2.5 1.8 2.7 1 1 453 1 . . . . . 3.0 1.8 4.3 1 1 454 1 . . . . . 2.5 1.8 3.7 1 1 455 1 . . . . . 3.0 1.8 4.3 1 1 456 1 . . . . . 3.0 1.8 4.3 1 1 457 1 . . . . . 3.0 1.8 4.3 1 1 458 1 . . . . . 2.5 1.8 3.7 1 1 459 1 . . . . . 3.0 1.8 4.3 1 1 460 1 . . . . . 2.5 1.8 3.7 1 1 461 1 . . . . . 2.5 1.8 2.7 1 1 462 1 . . . . . 2.5 1.8 3.7 1 1 463 1 . . . . . 2.5 1.8 3.7 1 1 464 1 . . . . . 3.0 1.8 4.3 1 1 465 1 . . . . . 3.0 1.8 4.3 1 1 466 1 . . . . . 2.5 1.8 3.7 1 1 467 1 . . . . . 2.5 1.8 3.7 1 1 468 1 . . . . . 3.0 1.8 4.3 1 1 469 1 . . . . . 3.0 1.8 4.3 1 1 470 1 . . . . . 3.0 1.8 4.3 1 1 471 1 . . . . . 2.5 1.8 3.7 1 1 472 1 . . . . . 2.5 1.8 3.7 1 1 473 1 . . . . . 2.5 1.8 3.7 1 1 474 1 . . . . . 3.0 1.8 4.3 1 1 475 1 . . . . . 3.0 1.8 4.3 1 1 476 1 . . . . . 2.5 1.8 3.7 1 1 477 1 . . . . . 3.0 1.8 4.3 1 1 478 1 . . . . . 2.5 1.8 3.7 1 1 479 1 . . . . . 3.0 1.8 4.3 1 1 480 1 . . . . . 2.5 1.8 3.7 1 1 481 1 . . . . . 2.5 1.8 3.7 1 1 482 1 . . . . . 2.5 1.8 3.7 1 1 483 1 . . . . . 2.5 1.8 3.7 1 1 484 1 . . . . . 2.5 1.8 3.7 1 1 485 1 . . . . . 2.5 1.8 3.7 1 1 486 1 . . . . . 2.5 1.8 3.7 1 1 487 1 . . . . . 3.0 1.8 4.3 1 1 488 1 . . . . . 2.5 1.8 3.7 1 1 489 1 . . . . . 3.0 1.8 4.3 1 1 490 1 . . . . . 2.5 1.8 3.7 1 1 491 1 . . . . . 3.0 1.8 4.3 1 1 492 1 . . . . . 2.5 1.8 3.7 1 1 493 1 . . . . . 3.0 1.8 4.3 1 1 494 1 . . . . . 3.0 1.8 4.3 1 1 495 1 . . . . . 3.0 1.8 3.3 1 1 496 1 . . . . . 2.5 1.8 3.7 1 1 497 1 . . . . . 2.5 1.8 3.7 1 1 498 1 . . . . . 2.5 1.8 3.7 1 1 499 1 . . . . . 2.5 1.8 3.7 1 1 500 1 . . . . . 2.5 1.8 3.7 1 1 501 1 . . . . . 2.5 1.8 3.7 1 1 502 1 . . . . . 2.5 1.8 3.7 1 1 503 1 . . . . . 2.5 1.8 3.7 1 1 504 1 . . . . . 2.5 1.8 2.7 1 1 505 1 . . . . . 2.5 1.8 3.7 1 1 506 1 . . . . . 2.5 1.8 3.7 1 1 507 1 . . . . . 2.5 1.8 3.7 1 1 508 1 . . . . . 3.0 1.8 4.3 1 1 509 1 . . . . . 2.5 1.8 3.7 1 1 510 1 . . . . . 3.0 1.8 4.3 1 1 511 1 . . . . . 3.0 1.8 4.3 1 1 512 1 . . . . . 2.5 1.8 3.7 1 1 513 1 . . . . . 3.0 1.8 4.3 1 1 514 1 . . . . . 3.0 1.8 4.3 1 1 515 1 . . . . . 3.0 1.8 4.3 1 1 516 1 . . . . . 2.5 1.8 3.7 1 1 517 1 . . . . . 2.5 1.8 3.7 1 1 518 1 . . . . . 3.0 1.8 3.3 1 1 519 1 . . . . . 2.5 1.8 3.7 1 1 520 1 . . . . . 2.5 1.8 3.7 1 1 521 1 . . . . . 3.0 1.8 4.3 1 1 522 1 . . . . . 3.0 1.8 4.3 1 1 523 1 . . . . . 2.5 1.8 3.7 1 1 524 1 . . . . . 3.0 1.8 4.3 1 1 525 1 . . . . . 2.5 1.8 3.7 1 1 526 1 . . . . . 3.0 1.8 3.3 1 1 527 1 . . . . . 2.5 1.8 2.7 1 1 528 1 . . . . . 2.5 1.8 3.7 1 1 529 1 . . . . . 3.0 1.8 3.3 1 1 530 1 . . . . . 2.5 1.8 3.7 1 1 531 1 . . . . . 2.5 1.8 3.7 1 1 532 1 . . . . . 3.0 1.8 4.3 1 1 533 1 . . . . . 3.0 1.8 4.3 1 1 534 1 . . . . . 3.0 1.8 4.3 1 1 535 1 . . . . . 2.5 1.8 3.7 1 1 536 1 . . . . . 3.0 1.8 4.3 1 1 537 1 . . . . . 2.5 1.8 3.7 1 1 538 1 . . . . . 3.0 1.8 3.3 1 1 539 1 . . . . . 2.5 1.8 3.7 1 1 540 1 . . . . . 2.5 1.8 3.7 1 1 541 1 . . . . . 2.5 1.8 3.7 1 1 542 1 . . . . . 2.5 1.8 3.7 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 33 1 . . . 1 2 34 1 . . . 1 2 35 1 . . . 1 2 36 1 . . . 1 2 37 1 . . . 1 2 38 1 . . . 1 2 39 1 . . . 1 2 40 1 . . . 1 2 41 1 . . . 1 2 42 1 . . . 1 2 43 1 . . . 1 2 44 1 . . . 1 2 45 1 . . . 1 2 46 1 . . . 1 2 47 1 . . . 1 2 48 1 . . . 1 2 49 1 . . . 1 2 50 1 . . . 1 2 51 1 . . . 1 2 52 1 . . . 1 2 53 1 . . . 1 2 54 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 10 PHE H . 10 . HN 1 2 1 1 2 1 1 40 ILE O . 40 . O 1 2 2 1 1 1 1 10 PHE N . 10 . N 1 2 2 1 2 1 1 40 ILE O . 40 . O 1 2 3 1 1 1 1 8 GLY H . 8 . HN 1 2 3 1 2 1 1 42 ILE O . 42 . O 1 2 4 1 1 1 1 8 GLY N . 8 . N 1 2 4 1 2 1 1 42 ILE O . 42 . O 1 2 5 1 1 1 1 12 LEU H . 12 . HN 1 2 5 1 2 1 1 38 ASP O . 38 . O 1 2 6 1 1 1 1 12 LEU N . 12 . N 1 2 6 1 2 1 1 38 ASP O . 38 . O 1 2 7 1 1 1 1 6 LEU H . 6 . HN 1 2 7 1 2 1 1 44 SER O . 44 . O 1 2 8 1 1 1 1 6 LEU N . 6 . N 1 2 8 1 2 1 1 44 SER O . 44 . O 1 2 9 1 1 1 1 11 THR O . 11 . O 1 2 9 1 2 1 1 15 LEU H . 15 . HN 1 2 10 1 1 1 1 11 THR O . 11 . O 1 2 10 1 2 1 1 15 LEU N . 15 . N 1 2 11 1 1 1 1 43 ILE O . 43 . O 1 2 11 1 2 1 1 52 HIS H . 52 . HN 1 2 12 1 1 1 1 43 ILE O . 43 . O 1 2 12 1 2 1 1 52 HIS N . 52 . N 1 2 13 1 1 1 1 10 PHE O . 10 . O 1 2 13 1 2 1 1 40 ILE H . 40 . HN 1 2 14 1 1 1 1 10 PHE O . 10 . O 1 2 14 1 2 1 1 40 ILE N . 40 . N 1 2 15 1 1 1 1 41 ALA H . 41 . HN 1 2 15 1 2 1 1 54 LEU O . 54 . O 1 2 16 1 1 1 1 41 ALA N . 41 . N 1 2 16 1 2 1 1 54 LEU O . 54 . O 1 2 17 1 1 1 1 8 GLY O . 8 . O 1 2 17 1 2 1 1 42 ILE H . 42 . HN 1 2 18 1 1 1 1 8 GLY O . 8 . O 1 2 18 1 2 1 1 42 ILE N . 42 . N 1 2 19 1 1 1 1 43 ILE H . 43 . HN 1 2 19 1 2 1 1 52 HIS O . 52 . O 1 2 20 1 1 1 1 43 ILE N . 43 . N 1 2 20 1 2 1 1 52 HIS O . 52 . O 1 2 21 1 1 1 1 6 LEU O . 6 . O 1 2 21 1 2 1 1 44 SER H . 44 . HN 1 2 22 1 1 1 1 6 LEU O . 6 . O 1 2 22 1 2 1 1 44 SER N . 44 . N 1 2 23 1 1 1 1 41 ALA O . 41 . O 1 2 23 1 2 1 1 54 LEU H . 54 . HN 1 2 24 1 1 1 1 41 ALA O . 41 . O 1 2 24 1 2 1 1 54 LEU N . 54 . N 1 2 25 1 1 1 1 39 GLU O . 39 . O 1 2 25 1 2 1 1 56 LEU H . 56 . HN 1 2 26 1 1 1 1 39 GLU O . 39 . O 1 2 26 1 2 1 1 56 LEU N . 56 . N 1 2 27 1 1 1 1 16 PRO O . 16 . O 1 2 27 1 2 1 1 19 PHE H . 19 . HN 1 2 28 1 1 1 1 16 PRO O . 16 . O 1 2 28 1 2 1 1 19 PHE N . 19 . N 1 2 29 1 1 1 1 65 ILE O . 65 . O 1 2 29 1 2 1 1 69 LEU H . 69 . HN 1 2 30 1 1 1 1 65 ILE O . 65 . O 1 2 30 1 2 1 1 69 LEU N . 69 . N 1 2 31 1 1 1 1 66 ARG O . 66 . O 1 2 31 1 2 1 1 70 GLU H . 70 . HN 1 2 32 1 1 1 1 66 ARG O . 66 . O 1 2 32 1 2 1 1 70 GLU N . 70 . N 1 2 33 1 1 1 1 25 TYR O . 25 . O 1 2 33 1 2 1 1 29 LEU H . 29 . HN 1 2 34 1 1 1 1 25 TYR O . 25 . O 1 2 34 1 2 1 1 29 LEU N . 29 . N 1 2 35 1 1 1 1 63 ASP O . 63 . O 1 2 35 1 2 1 1 67 LYS H . 67 . HN 1 2 36 1 1 1 1 63 ASP O . 63 . O 1 2 36 1 2 1 1 67 LYS N . 67 . N 1 2 37 1 1 1 1 67 LYS O . 67 . O 1 2 37 1 2 1 1 71 GLU H . 71 . HN 1 2 38 1 1 1 1 67 LYS O . 67 . O 1 2 38 1 2 1 1 71 GLU N . 71 . N 1 2 39 1 1 1 1 68 GLU O . 68 . O 1 2 39 1 2 1 1 72 ALA H . 72 . HN 1 2 40 1 1 1 1 68 GLU O . 68 . O 1 2 40 1 2 1 1 72 ALA N . 72 . N 1 2 41 1 1 1 1 69 LEU O . 69 . O 1 2 41 1 2 1 1 73 GLY H . 73 . HN 1 2 42 1 1 1 1 69 LEU O . 69 . O 1 2 42 1 2 1 1 73 GLY N . 73 . N 1 2 43 1 1 1 1 70 GLU O . 70 . O 1 2 43 1 2 1 1 74 ALA H . 74 . HN 1 2 44 1 1 1 1 70 GLU O . 70 . O 1 2 44 1 2 1 1 74 ALA N . 74 . N 1 2 45 1 1 1 1 71 GLU O . 71 . O 1 2 45 1 2 1 1 75 LYS H . 75 . HN 1 2 46 1 1 1 1 71 GLU O . 71 . O 1 2 46 1 2 1 1 75 LYS N . 75 . N 1 2 47 1 1 1 1 84 LEU O . 84 . O 1 2 47 1 2 1 1 88 LEU H . 88 . HN 1 2 48 1 1 1 1 84 LEU O . 84 . O 1 2 48 1 2 1 1 88 LEU N . 88 . N 1 2 49 1 1 1 1 83 ILE O . 83 . O 1 2 49 1 2 1 1 87 HIS H . 87 . HN 1 2 50 1 1 1 1 83 ILE O . 83 . O 1 2 50 1 2 1 1 87 HIS N . 87 . N 1 2 51 1 1 1 1 82 LYS O . 82 . O 1 2 51 1 2 1 1 86 GLY H . 86 . HN 1 2 52 1 1 1 1 82 LYS O . 82 . O 1 2 52 1 2 1 1 86 GLY N . 86 . N 1 2 53 1 1 1 1 81 LEU O . 81 . O 1 2 53 1 2 1 1 85 GLU H . 85 . HN 1 2 54 1 1 1 1 81 LEU O . 81 . O 1 2 54 1 2 1 1 85 GLU N . 85 . N 1 2 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 2.3 1.5 2.5 1 2 2 1 . . . . . 3.3 2.5 3.5 1 2 3 1 . . . . . 2.3 1.5 2.5 1 2 4 1 . . . . . 3.3 2.5 3.5 1 2 5 1 . . . . . 2.3 1.5 2.5 1 2 6 1 . . . . . 3.3 2.5 3.5 1 2 7 1 . . . . . 2.3 1.5 2.5 1 2 8 1 . . . . . 3.3 2.5 3.5 1 2 9 1 . . . . . 2.3 1.5 2.5 1 2 10 1 . . . . . 3.3 2.5 3.5 1 2 11 1 . . . . . 2.3 1.5 2.5 1 2 12 1 . . . . . 3.3 2.5 3.5 1 2 13 1 . . . . . 2.3 1.5 2.5 1 2 14 1 . . . . . 3.3 2.5 3.5 1 2 15 1 . . . . . 2.3 1.5 2.5 1 2 16 1 . . . . . 3.3 2.5 3.5 1 2 17 1 . . . . . 2.3 1.5 2.5 1 2 18 1 . . . . . 3.3 2.5 3.5 1 2 19 1 . . . . . 2.3 1.5 2.5 1 2 20 1 . . . . . 3.3 2.5 3.5 1 2 21 1 . . . . . 2.3 1.5 2.5 1 2 22 1 . . . . . 3.3 2.5 3.5 1 2 23 1 . . . . . 2.3 1.5 2.5 1 2 24 1 . . . . . 3.3 2.5 3.5 1 2 25 1 . . . . . 2.3 1.5 2.5 1 2 26 1 . . . . . 3.3 2.5 3.5 1 2 27 1 . . . . . 2.3 1.5 2.5 1 2 28 1 . . . . . 3.3 2.5 3.5 1 2 29 1 . . . . . 2.3 1.5 2.5 1 2 30 1 . . . . . 3.3 2.5 3.5 1 2 31 1 . . . . . 2.3 1.5 2.5 1 2 32 1 . . . . . 3.3 2.5 3.5 1 2 33 1 . . . . . 2.3 1.5 2.5 1 2 34 1 . . . . . 3.3 2.5 3.5 1 2 35 1 . . . . . 2.3 1.5 2.5 1 2 36 1 . . . . . 3.3 2.5 3.5 1 2 37 1 . . . . . 2.3 1.5 2.5 1 2 38 1 . . . . . 3.3 2.5 3.5 1 2 39 1 . . . . . 2.3 1.5 2.5 1 2 40 1 . . . . . 3.3 2.5 3.5 1 2 41 1 . . . . . 2.3 1.5 2.5 1 2 42 1 . . . . . 3.3 2.5 3.5 1 2 43 1 . . . . . 2.3 1.5 2.5 1 2 44 1 . . . . . 3.3 2.5 3.5 1 2 45 1 . . . . . 2.3 1.5 2.5 1 2 46 1 . . . . . 3.3 2.5 3.5 1 2 47 1 . . . . . 2.3 1.5 2.5 1 2 48 1 . . . . . 3.3 2.5 3.5 1 2 49 1 . . . . . 2.3 1.5 2.5 1 2 50 1 . . . . . 3.3 2.5 3.5 1 2 51 1 . . . . . 2.3 1.5 2.5 1 2 52 1 . . . . . 3.3 2.5 3.5 1 2 53 1 . . . . . 2.3 1.5 2.5 1 2 54 1 . . . . . 3.3 2.5 3.5 1 2 stop_ save_ save_conformer_family_coord_set_1 _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Entry_ID 1 _Conformer_family_coord_set.ID 1 loop_ _Atom_site.Model_ID _Atom_site.ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Occupancy _Atom_site.Uncertainty _Atom_site.PDBX_label_asym_ID _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID 1 1 1 1 1 LEU C C -11.933 20.569 1.529 1.00 . A A . 1 LEU C 1 1 1 2 1 1 1 LEU CA C -11.268 21.910 1.823 1.00 . A A . 1 LEU CA 1 1 1 3 1 1 1 LEU CB C -12.217 23.058 1.473 1.00 . A A . 1 LEU CB 1 1 1 4 1 1 1 LEU CD1 C -12.594 25.080 0.041 1.00 . A A . 1 LEU CD1 1 1 1 5 1 1 1 LEU CD2 C -10.831 25.117 1.813 1.00 . A A . 1 LEU CD2 1 1 1 6 1 1 1 LEU CG C -11.558 24.258 0.791 1.00 . A A . 1 LEU CG 1 1 1 7 1 1 1 LEU H1 H -9.368 21.310 1.311 1.00 . A A . 1 LEU H1 1 1 1 8 1 1 1 LEU H2 H -9.620 23.007 1.265 1.00 . A A . 1 LEU H2 1 1 1 9 1 1 1 LEU H3 H -10.266 22.007 0.029 1.00 . A A . 1 LEU H3 1 1 1 10 1 1 1 LEU HA H -11.022 21.959 2.873 1.00 . A A . 1 LEU HA 1 1 1 11 1 1 1 LEU HB2 H -12.986 22.674 0.818 1.00 . A A . 1 LEU HB2 1 1 1 12 1 1 1 LEU HB3 H -12.683 23.402 2.385 1.00 . A A . 1 LEU HB3 1 1 1 13 1 1 1 LEU HD11 H -13.521 24.528 -0.013 1.00 . A A . 1 LEU HD11 1 1 1 14 1 1 1 LEU HD12 H -12.238 25.284 -0.958 1.00 . A A . 1 LEU HD12 1 1 1 15 1 1 1 LEU HD13 H -12.760 26.012 0.562 1.00 . A A . 1 LEU HD13 1 1 1 16 1 1 1 LEU HD21 H -11.490 25.898 2.162 1.00 . A A . 1 LEU HD21 1 1 1 17 1 1 1 LEU HD22 H -9.959 25.561 1.356 1.00 . A A . 1 LEU HD22 1 1 1 18 1 1 1 LEU HD23 H -10.526 24.504 2.648 1.00 . A A . 1 LEU HD23 1 1 1 19 1 1 1 LEU HG H -10.832 23.902 0.074 1.00 . A A . 1 LEU HG 1 1 1 20 1 1 1 LEU N N -10.018 22.073 1.036 1.00 . A A . 1 LEU N 1 1 1 21 1 1 1 LEU O O -13.126 20.509 1.233 1.00 . A A . 1 LEU O 1 1 1 22 1 1 2 PHE C C -10.784 17.100 2.014 1.00 . A A . 2 PHE C 1 1 1 23 1 1 2 PHE CA C -11.667 18.156 1.357 1.00 . A A . 2 PHE CA 1 1 1 24 1 1 2 PHE CB C -11.754 17.900 -0.148 1.00 . A A . 2 PHE CB 1 1 1 25 1 1 2 PHE CD1 C -14.017 18.848 -0.678 1.00 . A A . 2 PHE CD1 1 1 1 26 1 1 2 PHE CD2 C -12.109 19.803 -1.744 1.00 . A A . 2 PHE CD2 1 1 1 27 1 1 2 PHE CE1 C -14.838 19.739 -1.342 1.00 . A A . 2 PHE CE1 1 1 1 28 1 1 2 PHE CE2 C -12.926 20.697 -2.411 1.00 . A A . 2 PHE CE2 1 1 1 29 1 1 2 PHE CG C -12.645 18.870 -0.871 1.00 . A A . 2 PHE CG 1 1 1 30 1 1 2 PHE CZ C -14.292 20.665 -2.210 1.00 . A A . 2 PHE CZ 1 1 1 31 1 1 2 PHE H H -10.210 19.609 1.854 1.00 . A A . 2 PHE H 1 1 1 32 1 1 2 PHE HA H -12.658 18.094 1.782 1.00 . A A . 2 PHE HA 1 1 1 33 1 1 2 PHE HB2 H -10.766 17.974 -0.577 1.00 . A A . 2 PHE HB2 1 1 1 34 1 1 2 PHE HB3 H -12.140 16.905 -0.315 1.00 . A A . 2 PHE HB3 1 1 1 35 1 1 2 PHE HD1 H -14.445 18.125 0.000 1.00 . A A . 2 PHE HD1 1 1 1 36 1 1 2 PHE HD2 H -11.041 19.829 -1.903 1.00 . A A . 2 PHE HD2 1 1 1 37 1 1 2 PHE HE1 H -15.906 19.712 -1.183 1.00 . A A . 2 PHE HE1 1 1 1 38 1 1 2 PHE HE2 H -12.496 21.420 -3.089 1.00 . A A . 2 PHE HE2 1 1 1 39 1 1 2 PHE HZ H -14.932 21.362 -2.730 1.00 . A A . 2 PHE HZ 1 1 1 40 1 1 2 PHE N N -11.153 19.496 1.614 1.00 . A A . 2 PHE N 1 1 1 41 1 1 2 PHE O O -9.887 17.423 2.793 1.00 . A A . 2 PHE O 1 1 1 42 1 1 3 ILE C C -8.994 14.497 1.454 1.00 . A A . 3 ILE C 1 1 1 43 1 1 3 ILE CA C -10.272 14.732 2.252 1.00 . A A . 3 ILE CA 1 1 1 44 1 1 3 ILE CB C -11.094 13.429 2.279 1.00 . A A . 3 ILE CB 1 1 1 45 1 1 3 ILE CD1 C -13.214 14.707 2.872 1.00 . A A . 3 ILE CD1 1 1 1 46 1 1 3 ILE CG1 C -12.282 13.569 3.231 1.00 . A A . 3 ILE CG1 1 1 1 47 1 1 3 ILE CG2 C -10.215 12.257 2.688 1.00 . A A . 3 ILE CG2 1 1 1 48 1 1 3 ILE H H -11.771 15.642 1.066 1.00 . A A . 3 ILE H 1 1 1 49 1 1 3 ILE HA H -10.009 14.989 3.267 1.00 . A A . 3 ILE HA 1 1 1 50 1 1 3 ILE HB H -11.461 13.241 1.281 1.00 . A A . 3 ILE HB 1 1 1 51 1 1 3 ILE HD11 H -14.155 14.577 3.387 1.00 . A A . 3 ILE HD11 1 1 1 52 1 1 3 ILE HD12 H -13.384 14.709 1.806 1.00 . A A . 3 ILE HD12 1 1 1 53 1 1 3 ILE HD13 H -12.768 15.645 3.168 1.00 . A A . 3 ILE HD13 1 1 1 54 1 1 3 ILE HG12 H -12.856 12.655 3.218 1.00 . A A . 3 ILE HG12 1 1 1 55 1 1 3 ILE HG13 H -11.915 13.744 4.232 1.00 . A A . 3 ILE HG13 1 1 1 56 1 1 3 ILE HG21 H -10.806 11.537 3.234 1.00 . A A . 3 ILE HG21 1 1 1 57 1 1 3 ILE HG22 H -9.410 12.612 3.315 1.00 . A A . 3 ILE HG22 1 1 1 58 1 1 3 ILE HG23 H -9.803 11.790 1.805 1.00 . A A . 3 ILE HG23 1 1 1 59 1 1 3 ILE N N -11.044 15.836 1.693 1.00 . A A . 3 ILE N 1 1 1 60 1 1 3 ILE O O -8.980 13.718 0.501 1.00 . A A . 3 ILE O 1 1 1 61 1 1 4 ALA C C -6.239 13.574 1.040 1.00 . A A . 4 ALA C 1 1 1 62 1 1 4 ALA CA C -6.639 15.040 1.173 1.00 . A A . 4 ALA CA 1 1 1 63 1 1 4 ALA CB C -5.564 15.816 1.919 1.00 . A A . 4 ALA CB 1 1 1 64 1 1 4 ALA H H -7.996 15.781 2.617 1.00 . A A . 4 ALA H 1 1 1 65 1 1 4 ALA HA H -6.737 15.467 0.185 1.00 . A A . 4 ALA HA 1 1 1 66 1 1 4 ALA HB1 H -4.775 15.142 2.218 1.00 . A A . 4 ALA HB1 1 1 1 67 1 1 4 ALA HB2 H -5.996 16.276 2.796 1.00 . A A . 4 ALA HB2 1 1 1 68 1 1 4 ALA HB3 H -5.159 16.581 1.274 1.00 . A A . 4 ALA HB3 1 1 1 69 1 1 4 ALA N N -7.922 15.175 1.851 1.00 . A A . 4 ALA N 1 1 1 70 1 1 4 ALA O O -5.624 13.004 1.941 1.00 . A A . 4 ALA O 1 1 1 71 1 1 5 THR C C -4.930 11.440 -1.054 1.00 . A A . 5 THR C 1 1 1 72 1 1 5 THR CA C -6.271 11.570 -0.340 1.00 . A A . 5 THR CA 1 1 1 73 1 1 5 THR CB C -7.372 10.913 -1.174 1.00 . A A . 5 THR CB 1 1 1 74 1 1 5 THR CG2 C -8.420 10.212 -0.336 1.00 . A A . 5 THR CG2 1 1 1 75 1 1 5 THR H H -7.082 13.477 -0.770 1.00 . A A . 5 THR H 1 1 1 76 1 1 5 THR HA H -6.207 11.069 0.615 1.00 . A A . 5 THR HA 1 1 1 77 1 1 5 THR HB H -6.924 10.177 -1.826 1.00 . A A . 5 THR HB 1 1 1 78 1 1 5 THR HG1 H -8.771 11.459 -2.430 1.00 . A A . 5 THR HG1 1 1 1 79 1 1 5 THR HG21 H -9.271 9.969 -0.954 1.00 . A A . 5 THR HG21 1 1 1 80 1 1 5 THR HG22 H -8.732 10.862 0.468 1.00 . A A . 5 THR HG22 1 1 1 81 1 1 5 THR HG23 H -8.004 9.304 0.076 1.00 . A A . 5 THR HG23 1 1 1 82 1 1 5 THR N N -6.593 12.970 -0.089 1.00 . A A . 5 THR N 1 1 1 83 1 1 5 THR O O -4.780 11.871 -2.197 1.00 . A A . 5 THR O 1 1 1 84 1 1 5 THR OG1 O -8.035 11.874 -1.975 1.00 . A A . 5 THR OG1 1 1 1 85 1 1 6 LEU C C -2.428 9.215 -1.397 1.00 . A A . 6 LEU C 1 1 1 86 1 1 6 LEU CA C -2.628 10.657 -0.942 1.00 . A A . 6 LEU CA 1 1 1 87 1 1 6 LEU CB C -1.554 11.035 0.080 1.00 . A A . 6 LEU CB 1 1 1 88 1 1 6 LEU CD1 C -1.351 13.221 -1.130 1.00 . A A . 6 LEU CD1 1 1 1 89 1 1 6 LEU CD2 C 0.118 12.742 0.836 1.00 . A A . 6 LEU CD2 1 1 1 90 1 1 6 LEU CG C -0.599 12.144 -0.365 1.00 . A A . 6 LEU CG 1 1 1 91 1 1 6 LEU H H -4.138 10.521 0.535 1.00 . A A . 6 LEU H 1 1 1 92 1 1 6 LEU HA H -2.541 11.307 -1.800 1.00 . A A . 6 LEU HA 1 1 1 93 1 1 6 LEU HB2 H -2.048 11.355 0.987 1.00 . A A . 6 LEU HB2 1 1 1 94 1 1 6 LEU HB3 H -0.970 10.155 0.300 1.00 . A A . 6 LEU HB3 1 1 1 95 1 1 6 LEU HD11 H -2.301 13.406 -0.652 1.00 . A A . 6 LEU HD11 1 1 1 96 1 1 6 LEU HD12 H -1.517 12.892 -2.145 1.00 . A A . 6 LEU HD12 1 1 1 97 1 1 6 LEU HD13 H -0.769 14.131 -1.137 1.00 . A A . 6 LEU HD13 1 1 1 98 1 1 6 LEU HD21 H -0.413 13.621 1.171 1.00 . A A . 6 LEU HD21 1 1 1 99 1 1 6 LEU HD22 H 1.125 13.014 0.556 1.00 . A A . 6 LEU HD22 1 1 1 100 1 1 6 LEU HD23 H 0.150 12.015 1.635 1.00 . A A . 6 LEU HD23 1 1 1 101 1 1 6 LEU HG H 0.146 11.724 -1.025 1.00 . A A . 6 LEU HG 1 1 1 102 1 1 6 LEU N N -3.957 10.843 -0.372 1.00 . A A . 6 LEU N 1 1 1 103 1 1 6 LEU O O -2.873 8.277 -0.735 1.00 . A A . 6 LEU O 1 1 1 104 1 1 7 LYS C C -0.080 7.627 -3.636 1.00 . A A . 7 LYS C 1 1 1 105 1 1 7 LYS CA C -1.495 7.717 -3.074 1.00 . A A . 7 LYS CA 1 1 1 106 1 1 7 LYS CB C -2.512 7.382 -4.166 1.00 . A A . 7 LYS CB 1 1 1 107 1 1 7 LYS CD C -4.956 7.253 -4.737 1.00 . A A . 7 LYS CD 1 1 1 108 1 1 7 LYS CE C -5.657 5.927 -4.986 1.00 . A A . 7 LYS CE 1 1 1 109 1 1 7 LYS CG C -3.915 7.133 -3.636 1.00 . A A . 7 LYS CG 1 1 1 110 1 1 7 LYS H H -1.425 9.832 -3.013 1.00 . A A . 7 LYS H 1 1 1 111 1 1 7 LYS HA H -1.596 7.005 -2.269 1.00 . A A . 7 LYS HA 1 1 1 112 1 1 7 LYS HB2 H -2.556 8.204 -4.866 1.00 . A A . 7 LYS HB2 1 1 1 113 1 1 7 LYS HB3 H -2.185 6.495 -4.687 1.00 . A A . 7 LYS HB3 1 1 1 114 1 1 7 LYS HD2 H -5.691 7.988 -4.445 1.00 . A A . 7 LYS HD2 1 1 1 115 1 1 7 LYS HD3 H -4.468 7.569 -5.647 1.00 . A A . 7 LYS HD3 1 1 1 116 1 1 7 LYS HE2 H -5.050 5.333 -5.652 1.00 . A A . 7 LYS HE2 1 1 1 117 1 1 7 LYS HE3 H -5.769 5.411 -4.044 1.00 . A A . 7 LYS HE3 1 1 1 118 1 1 7 LYS HG2 H -3.960 6.138 -3.218 1.00 . A A . 7 LYS HG2 1 1 1 119 1 1 7 LYS HG3 H -4.132 7.859 -2.866 1.00 . A A . 7 LYS HG3 1 1 1 120 1 1 7 LYS HZ1 H -6.910 6.274 -6.622 1.00 . A A . 7 LYS HZ1 1 1 1 121 1 1 7 LYS HZ2 H -7.475 6.940 -5.173 1.00 . A A . 7 LYS HZ2 1 1 1 122 1 1 7 LYS HZ3 H -7.589 5.273 -5.438 1.00 . A A . 7 LYS HZ3 1 1 1 123 1 1 7 LYS N N -1.755 9.045 -2.530 1.00 . A A . 7 LYS N 1 1 1 124 1 1 7 LYS NZ N -7.002 6.117 -5.597 1.00 . A A . 7 LYS NZ 1 1 1 125 1 1 7 LYS O O 0.175 8.032 -4.770 1.00 . A A . 7 LYS O 1 1 1 126 1 1 8 GLY C C 2.513 5.589 -3.839 1.00 . A A . 8 GLY C 1 1 1 127 1 1 8 GLY CA C 2.214 6.962 -3.269 1.00 . A A . 8 GLY CA 1 1 1 128 1 1 8 GLY H H 0.575 6.789 -1.940 1.00 . A A . 8 GLY H 1 1 1 129 1 1 8 GLY HA2 H 2.414 7.705 -4.026 1.00 . A A . 8 GLY HA2 1 1 1 130 1 1 8 GLY HA3 H 2.865 7.138 -2.425 1.00 . A A . 8 GLY HA3 1 1 1 131 1 1 8 GLY N N 0.836 7.095 -2.834 1.00 . A A . 8 GLY N 1 1 1 132 1 1 8 GLY O O 2.260 4.572 -3.193 1.00 . A A . 8 GLY O 1 1 1 133 1 1 9 ILE C C 4.790 3.839 -5.329 1.00 . A A . 9 ILE C 1 1 1 134 1 1 9 ILE CA C 3.388 4.303 -5.711 1.00 . A A . 9 ILE CA 1 1 1 135 1 1 9 ILE CB C 3.303 4.430 -7.243 1.00 . A A . 9 ILE CB 1 1 1 136 1 1 9 ILE CD1 C 1.655 4.646 -9.172 1.00 . A A . 9 ILE CD1 1 1 1 137 1 1 9 ILE CG1 C 1.862 4.712 -7.674 1.00 . A A . 9 ILE CG1 1 1 1 138 1 1 9 ILE CG2 C 3.823 3.165 -7.910 1.00 . A A . 9 ILE CG2 1 1 1 139 1 1 9 ILE H H 3.233 6.405 -5.517 1.00 . A A . 9 ILE H 1 1 1 140 1 1 9 ILE HA H 2.674 3.558 -5.391 1.00 . A A . 9 ILE HA 1 1 1 141 1 1 9 ILE HB H 3.930 5.253 -7.550 1.00 . A A . 9 ILE HB 1 1 1 142 1 1 9 ILE HD11 H 0.643 4.938 -9.408 1.00 . A A . 9 ILE HD11 1 1 1 143 1 1 9 ILE HD12 H 1.828 3.636 -9.514 1.00 . A A . 9 ILE HD12 1 1 1 144 1 1 9 ILE HD13 H 2.347 5.315 -9.661 1.00 . A A . 9 ILE HD13 1 1 1 145 1 1 9 ILE HG12 H 1.207 3.985 -7.217 1.00 . A A . 9 ILE HG12 1 1 1 146 1 1 9 ILE HG13 H 1.582 5.701 -7.343 1.00 . A A . 9 ILE HG13 1 1 1 147 1 1 9 ILE HG21 H 4.901 3.143 -7.848 1.00 . A A . 9 ILE HG21 1 1 1 148 1 1 9 ILE HG22 H 3.521 3.154 -8.947 1.00 . A A . 9 ILE HG22 1 1 1 149 1 1 9 ILE HG23 H 3.416 2.300 -7.407 1.00 . A A . 9 ILE HG23 1 1 1 150 1 1 9 ILE N N 3.054 5.560 -5.053 1.00 . A A . 9 ILE N 1 1 1 151 1 1 9 ILE O O 5.759 4.587 -5.460 1.00 . A A . 9 ILE O 1 1 1 152 1 1 10 PHE C C 6.547 0.850 -5.334 1.00 . A A . 10 PHE C 1 1 1 153 1 1 10 PHE CA C 6.174 2.039 -4.454 1.00 . A A . 10 PHE CA 1 1 1 154 1 1 10 PHE CB C 6.129 1.606 -2.986 1.00 . A A . 10 PHE CB 1 1 1 155 1 1 10 PHE CD1 C 6.722 3.946 -2.293 1.00 . A A . 10 PHE CD1 1 1 1 156 1 1 10 PHE CD2 C 5.356 2.643 -0.836 1.00 . A A . 10 PHE CD2 1 1 1 157 1 1 10 PHE CE1 C 6.667 5.003 -1.405 1.00 . A A . 10 PHE CE1 1 1 1 158 1 1 10 PHE CE2 C 5.298 3.697 0.056 1.00 . A A . 10 PHE CE2 1 1 1 159 1 1 10 PHE CG C 6.068 2.755 -2.019 1.00 . A A . 10 PHE CG 1 1 1 160 1 1 10 PHE CZ C 5.954 4.878 -0.229 1.00 . A A . 10 PHE CZ 1 1 1 161 1 1 10 PHE H H 4.082 2.054 -4.774 1.00 . A A . 10 PHE H 1 1 1 162 1 1 10 PHE HA H 6.924 2.807 -4.571 1.00 . A A . 10 PHE HA 1 1 1 163 1 1 10 PHE HB2 H 5.255 0.992 -2.827 1.00 . A A . 10 PHE HB2 1 1 1 164 1 1 10 PHE HB3 H 7.014 1.028 -2.762 1.00 . A A . 10 PHE HB3 1 1 1 165 1 1 10 PHE HD1 H 7.280 4.045 -3.212 1.00 . A A . 10 PHE HD1 1 1 1 166 1 1 10 PHE HD2 H 4.843 1.720 -0.612 1.00 . A A . 10 PHE HD2 1 1 1 167 1 1 10 PHE HE1 H 7.182 5.925 -1.630 1.00 . A A . 10 PHE HE1 1 1 1 168 1 1 10 PHE HE2 H 4.740 3.597 0.975 1.00 . A A . 10 PHE HE2 1 1 1 169 1 1 10 PHE HZ H 5.910 5.703 0.467 1.00 . A A . 10 PHE HZ 1 1 1 170 1 1 10 PHE N N 4.890 2.602 -4.855 1.00 . A A . 10 PHE N 1 1 1 171 1 1 10 PHE O O 6.018 -0.249 -5.168 1.00 . A A . 10 PHE O 1 1 1 172 1 1 11 THR C C 9.360 -0.331 -6.941 1.00 . A A . 11 THR C 1 1 1 173 1 1 11 THR CA C 7.904 0.025 -7.180 1.00 . A A . 11 THR CA 1 1 1 174 1 1 11 THR CB C 7.700 0.453 -8.634 1.00 . A A . 11 THR CB 1 1 1 175 1 1 11 THR CG2 C 6.456 1.289 -8.843 1.00 . A A . 11 THR CG2 1 1 1 176 1 1 11 THR H H 7.846 1.974 -6.357 1.00 . A A . 11 THR H 1 1 1 177 1 1 11 THR HA H 7.313 -0.852 -6.986 1.00 . A A . 11 THR HA 1 1 1 178 1 1 11 THR HB H 7.611 -0.431 -9.249 1.00 . A A . 11 THR HB 1 1 1 179 1 1 11 THR HG1 H 9.015 0.951 -9.998 1.00 . A A . 11 THR HG1 1 1 1 180 1 1 11 THR HG21 H 6.134 1.206 -9.870 1.00 . A A . 11 THR HG21 1 1 1 181 1 1 11 THR HG22 H 6.675 2.323 -8.616 1.00 . A A . 11 THR HG22 1 1 1 182 1 1 11 THR HG23 H 5.671 0.937 -8.190 1.00 . A A . 11 THR HG23 1 1 1 183 1 1 11 THR N N 7.461 1.078 -6.272 1.00 . A A . 11 THR N 1 1 1 184 1 1 11 THR O O 10.233 0.537 -6.922 1.00 . A A . 11 THR O 1 1 1 185 1 1 11 THR OG1 O 8.807 1.206 -9.096 1.00 . A A . 11 THR OG1 1 1 1 186 1 1 12 LEU C C 11.637 -1.285 -5.433 1.00 . A A . 12 LEU C 1 1 1 187 1 1 12 LEU CA C 10.955 -2.107 -6.526 1.00 . A A . 12 LEU CA 1 1 1 188 1 1 12 LEU CB C 11.760 -2.055 -7.828 1.00 . A A . 12 LEU CB 1 1 1 189 1 1 12 LEU CD1 C 9.825 -3.286 -8.840 1.00 . A A . 12 LEU CD1 1 1 1 190 1 1 12 LEU CD2 C 10.386 -0.979 -9.627 1.00 . A A . 12 LEU CD2 1 1 1 191 1 1 12 LEU CG C 10.946 -2.292 -9.101 1.00 . A A . 12 LEU CG 1 1 1 192 1 1 12 LEU H H 8.868 -2.261 -6.790 1.00 . A A . 12 LEU H 1 1 1 193 1 1 12 LEU HA H 10.885 -3.132 -6.196 1.00 . A A . 12 LEU HA 1 1 1 194 1 1 12 LEU HB2 H 12.226 -1.083 -7.899 1.00 . A A . 12 LEU HB2 1 1 1 195 1 1 12 LEU HB3 H 12.535 -2.804 -7.778 1.00 . A A . 12 LEU HB3 1 1 1 196 1 1 12 LEU HD11 H 8.918 -2.751 -8.601 1.00 . A A . 12 LEU HD11 1 1 1 197 1 1 12 LEU HD12 H 10.096 -3.925 -8.013 1.00 . A A . 12 LEU HD12 1 1 1 198 1 1 12 LEU HD13 H 9.666 -3.888 -9.723 1.00 . A A . 12 LEU HD13 1 1 1 199 1 1 12 LEU HD21 H 10.604 -0.188 -8.924 1.00 . A A . 12 LEU HD21 1 1 1 200 1 1 12 LEU HD22 H 9.316 -1.068 -9.749 1.00 . A A . 12 LEU HD22 1 1 1 201 1 1 12 LEU HD23 H 10.839 -0.750 -10.579 1.00 . A A . 12 LEU HD23 1 1 1 202 1 1 12 LEU HG H 11.592 -2.709 -9.860 1.00 . A A . 12 LEU HG 1 1 1 203 1 1 12 LEU N N 9.610 -1.621 -6.761 1.00 . A A . 12 LEU N 1 1 1 204 1 1 12 LEU O O 10.980 -0.784 -4.521 1.00 . A A . 12 LEU O 1 1 1 205 1 1 13 LYS C C 13.622 1.101 -4.820 1.00 . A A . 13 LYS C 1 1 1 206 1 1 13 LYS CA C 13.722 -0.395 -4.549 1.00 . A A . 13 LYS CA 1 1 1 207 1 1 13 LYS CB C 15.188 -0.833 -4.570 1.00 . A A . 13 LYS CB 1 1 1 208 1 1 13 LYS CD C 14.587 -2.624 -2.912 1.00 . A A . 13 LYS CD 1 1 1 209 1 1 13 LYS CE C 13.320 -3.384 -3.268 1.00 . A A . 13 LYS CE 1 1 1 210 1 1 13 LYS CG C 15.397 -2.279 -4.152 1.00 . A A . 13 LYS CG 1 1 1 211 1 1 13 LYS H H 13.418 -1.575 -6.274 1.00 . A A . 13 LYS H 1 1 1 212 1 1 13 LYS HA H 13.308 -0.601 -3.573 1.00 . A A . 13 LYS HA 1 1 1 213 1 1 13 LYS HB2 H 15.574 -0.710 -5.571 1.00 . A A . 13 LYS HB2 1 1 1 214 1 1 13 LYS HB3 H 15.750 -0.202 -3.897 1.00 . A A . 13 LYS HB3 1 1 1 215 1 1 13 LYS HD2 H 15.190 -3.237 -2.259 1.00 . A A . 13 LYS HD2 1 1 1 216 1 1 13 LYS HD3 H 14.318 -1.709 -2.405 1.00 . A A . 13 LYS HD3 1 1 1 217 1 1 13 LYS HE2 H 12.729 -3.513 -2.374 1.00 . A A . 13 LYS HE2 1 1 1 218 1 1 13 LYS HE3 H 12.759 -2.805 -3.988 1.00 . A A . 13 LYS HE3 1 1 1 219 1 1 13 LYS HG2 H 15.090 -2.925 -4.961 1.00 . A A . 13 LYS HG2 1 1 1 220 1 1 13 LYS HG3 H 16.445 -2.435 -3.942 1.00 . A A . 13 LYS HG3 1 1 1 221 1 1 13 LYS HZ1 H 14.646 -4.849 -3.943 1.00 . A A . 13 LYS HZ1 1 1 1 222 1 1 13 LYS HZ2 H 13.182 -4.810 -4.788 1.00 . A A . 13 LYS HZ2 1 1 1 223 1 1 13 LYS HZ3 H 13.242 -5.471 -3.233 1.00 . A A . 13 LYS HZ3 1 1 1 224 1 1 13 LYS N N 12.953 -1.153 -5.529 1.00 . A A . 13 LYS N 1 1 1 225 1 1 13 LYS NZ N 13.618 -4.722 -3.849 1.00 . A A . 13 LYS NZ 1 1 1 226 1 1 13 LYS O O 13.833 1.920 -3.925 1.00 . A A . 13 LYS O 1 1 1 227 1 1 14 ASP C C 11.814 3.417 -6.006 1.00 . A A . 14 ASP C 1 1 1 228 1 1 14 ASP CA C 13.163 2.851 -6.447 1.00 . A A . 14 ASP CA 1 1 1 229 1 1 14 ASP CB C 13.319 2.998 -7.962 1.00 . A A . 14 ASP CB 1 1 1 230 1 1 14 ASP CG C 14.069 4.258 -8.346 1.00 . A A . 14 ASP CG 1 1 1 231 1 1 14 ASP H H 13.136 0.753 -6.728 1.00 . A A . 14 ASP H 1 1 1 232 1 1 14 ASP HA H 13.949 3.405 -5.959 1.00 . A A . 14 ASP HA 1 1 1 233 1 1 14 ASP HB2 H 13.862 2.147 -8.346 1.00 . A A . 14 ASP HB2 1 1 1 234 1 1 14 ASP HB3 H 12.340 3.030 -8.417 1.00 . A A . 14 ASP HB3 1 1 1 235 1 1 14 ASP N N 13.295 1.452 -6.059 1.00 . A A . 14 ASP N 1 1 1 236 1 1 14 ASP O O 11.471 4.552 -6.337 1.00 . A A . 14 ASP O 1 1 1 237 1 1 14 ASP OD1 O 14.660 4.894 -7.448 1.00 . A A . 14 ASP OD1 1 1 1 238 1 1 14 ASP OD2 O 14.066 4.608 -9.545 1.00 . A A . 14 ASP OD2 1 1 1 239 1 1 15 LEU C C 9.794 4.395 -4.052 1.00 . A A . 15 LEU C 1 1 1 240 1 1 15 LEU CA C 9.743 3.046 -4.780 1.00 . A A . 15 LEU CA 1 1 1 241 1 1 15 LEU CB C 9.124 1.980 -3.867 1.00 . A A . 15 LEU CB 1 1 1 242 1 1 15 LEU CD1 C 10.216 2.299 -1.631 1.00 . A A . 15 LEU CD1 1 1 1 243 1 1 15 LEU CD2 C 9.539 0.011 -2.375 1.00 . A A . 15 LEU CD2 1 1 1 244 1 1 15 LEU CG C 10.062 1.368 -2.824 1.00 . A A . 15 LEU CG 1 1 1 245 1 1 15 LEU H H 11.375 1.724 -5.031 1.00 . A A . 15 LEU H 1 1 1 246 1 1 15 LEU HA H 9.110 3.158 -5.646 1.00 . A A . 15 LEU HA 1 1 1 247 1 1 15 LEU HB2 H 8.292 2.428 -3.347 1.00 . A A . 15 LEU HB2 1 1 1 248 1 1 15 LEU HB3 H 8.748 1.182 -4.489 1.00 . A A . 15 LEU HB3 1 1 1 249 1 1 15 LEU HD11 H 9.546 1.988 -0.843 1.00 . A A . 15 LEU HD11 1 1 1 250 1 1 15 LEU HD12 H 9.976 3.309 -1.929 1.00 . A A . 15 LEU HD12 1 1 1 251 1 1 15 LEU HD13 H 11.234 2.261 -1.273 1.00 . A A . 15 LEU HD13 1 1 1 252 1 1 15 LEU HD21 H 9.159 -0.528 -3.229 1.00 . A A . 15 LEU HD21 1 1 1 253 1 1 15 LEU HD22 H 8.746 0.152 -1.655 1.00 . A A . 15 LEU HD22 1 1 1 254 1 1 15 LEU HD23 H 10.341 -0.552 -1.921 1.00 . A A . 15 LEU HD23 1 1 1 255 1 1 15 LEU HG H 11.037 1.220 -3.263 1.00 . A A . 15 LEU HG 1 1 1 256 1 1 15 LEU N N 11.053 2.620 -5.260 1.00 . A A . 15 LEU N 1 1 1 257 1 1 15 LEU O O 8.828 5.156 -4.103 1.00 . A A . 15 LEU O 1 1 1 258 1 1 16 PRO C C 11.102 7.195 -3.577 1.00 . A A . 16 PRO C 1 1 1 259 1 1 16 PRO CA C 11.019 6.000 -2.635 1.00 . A A . 16 PRO CA 1 1 1 260 1 1 16 PRO CB C 12.321 5.859 -1.836 1.00 . A A . 16 PRO CB 1 1 1 261 1 1 16 PRO CD C 12.124 3.922 -3.211 1.00 . A A . 16 PRO CD 1 1 1 262 1 1 16 PRO CG C 12.677 4.411 -1.908 1.00 . A A . 16 PRO CG 1 1 1 263 1 1 16 PRO HA H 10.191 6.140 -1.955 1.00 . A A . 16 PRO HA 1 1 1 264 1 1 16 PRO HB2 H 13.086 6.475 -2.286 1.00 . A A . 16 PRO HB2 1 1 1 265 1 1 16 PRO HB3 H 12.153 6.172 -0.817 1.00 . A A . 16 PRO HB3 1 1 1 266 1 1 16 PRO HD2 H 12.820 4.119 -4.013 1.00 . A A . 16 PRO HD2 1 1 1 267 1 1 16 PRO HD3 H 11.892 2.872 -3.157 1.00 . A A . 16 PRO HD3 1 1 1 268 1 1 16 PRO HG2 H 13.750 4.294 -1.887 1.00 . A A . 16 PRO HG2 1 1 1 269 1 1 16 PRO HG3 H 12.224 3.879 -1.085 1.00 . A A . 16 PRO HG3 1 1 1 270 1 1 16 PRO N N 10.905 4.728 -3.358 1.00 . A A . 16 PRO N 1 1 1 271 1 1 16 PRO O O 12.049 7.979 -3.521 1.00 . A A . 16 PRO O 1 1 1 272 1 1 17 GLU C C 10.495 9.730 -4.755 1.00 . A A . 17 GLU C 1 1 1 273 1 1 17 GLU CA C 10.053 8.421 -5.400 1.00 . A A . 17 GLU CA 1 1 1 274 1 1 17 GLU CB C 8.638 8.565 -5.964 1.00 . A A . 17 GLU CB 1 1 1 275 1 1 17 GLU CD C 7.502 10.805 -5.691 1.00 . A A . 17 GLU CD 1 1 1 276 1 1 17 GLU CG C 7.723 9.424 -5.106 1.00 . A A . 17 GLU CG 1 1 1 277 1 1 17 GLU H H 9.379 6.667 -4.431 1.00 . A A . 17 GLU H 1 1 1 278 1 1 17 GLU HA H 10.730 8.185 -6.207 1.00 . A A . 17 GLU HA 1 1 1 279 1 1 17 GLU HB2 H 8.698 9.010 -6.946 1.00 . A A . 17 GLU HB2 1 1 1 280 1 1 17 GLU HB3 H 8.196 7.583 -6.050 1.00 . A A . 17 GLU HB3 1 1 1 281 1 1 17 GLU HG2 H 6.767 8.931 -5.016 1.00 . A A . 17 GLU HG2 1 1 1 282 1 1 17 GLU HG3 H 8.166 9.530 -4.126 1.00 . A A . 17 GLU HG3 1 1 1 283 1 1 17 GLU N N 10.103 7.325 -4.440 1.00 . A A . 17 GLU N 1 1 1 284 1 1 17 GLU O O 11.013 10.622 -5.428 1.00 . A A . 17 GLU O 1 1 1 285 1 1 17 GLU OE1 O 8.173 11.140 -6.690 1.00 . A A . 17 GLU OE1 1 1 1 286 1 1 17 GLU OE2 O 6.657 11.550 -5.152 1.00 . A A . 17 GLU OE2 1 1 1 287 1 1 18 GLU C C 12.172 11.114 -2.529 1.00 . A A . 18 GLU C 1 1 1 288 1 1 18 GLU CA C 10.665 11.039 -2.711 1.00 . A A . 18 GLU CA 1 1 1 289 1 1 18 GLU CB C 9.973 11.066 -1.347 1.00 . A A . 18 GLU CB 1 1 1 290 1 1 18 GLU CD C 8.899 12.672 0.280 1.00 . A A . 18 GLU CD 1 1 1 291 1 1 18 GLU CG C 9.027 12.243 -1.168 1.00 . A A . 18 GLU CG 1 1 1 292 1 1 18 GLU H H 9.871 9.094 -2.966 1.00 . A A . 18 GLU H 1 1 1 293 1 1 18 GLU HA H 10.349 11.887 -3.280 1.00 . A A . 18 GLU HA 1 1 1 294 1 1 18 GLU HB2 H 9.405 10.155 -1.226 1.00 . A A . 18 GLU HB2 1 1 1 295 1 1 18 GLU HB3 H 10.726 11.116 -0.575 1.00 . A A . 18 GLU HB3 1 1 1 296 1 1 18 GLU HG2 H 9.400 13.078 -1.743 1.00 . A A . 18 GLU HG2 1 1 1 297 1 1 18 GLU HG3 H 8.050 11.962 -1.534 1.00 . A A . 18 GLU HG3 1 1 1 298 1 1 18 GLU N N 10.288 9.839 -3.447 1.00 . A A . 18 GLU N 1 1 1 299 1 1 18 GLU O O 12.829 12.034 -3.015 1.00 . A A . 18 GLU O 1 1 1 300 1 1 18 GLU OE1 O 8.664 11.797 1.140 1.00 . A A . 18 GLU OE1 1 1 1 301 1 1 18 GLU OE2 O 9.032 13.883 0.555 1.00 . A A . 18 GLU OE2 1 1 1 302 1 1 19 PHE C C 14.510 8.722 -0.939 1.00 . A A . 19 PHE C 1 1 1 303 1 1 19 PHE CA C 14.137 10.063 -1.562 1.00 . A A . 19 PHE CA 1 1 1 304 1 1 19 PHE CB C 14.564 11.204 -0.637 1.00 . A A . 19 PHE CB 1 1 1 305 1 1 19 PHE CD1 C 16.554 12.259 -1.742 1.00 . A A . 19 PHE CD1 1 1 1 306 1 1 19 PHE CD2 C 14.520 13.500 -1.649 1.00 . A A . 19 PHE CD2 1 1 1 307 1 1 19 PHE CE1 C 17.166 13.306 -2.405 1.00 . A A . 19 PHE CE1 1 1 1 308 1 1 19 PHE CE2 C 15.127 14.551 -2.311 1.00 . A A . 19 PHE CE2 1 1 1 309 1 1 19 PHE CG C 15.226 12.344 -1.357 1.00 . A A . 19 PHE CG 1 1 1 310 1 1 19 PHE CZ C 16.451 14.453 -2.690 1.00 . A A . 19 PHE CZ 1 1 1 311 1 1 19 PHE H H 12.115 9.440 -1.475 1.00 . A A . 19 PHE H 1 1 1 312 1 1 19 PHE HA H 14.652 10.164 -2.505 1.00 . A A . 19 PHE HA 1 1 1 313 1 1 19 PHE HB2 H 13.693 11.593 -0.131 1.00 . A A . 19 PHE HB2 1 1 1 314 1 1 19 PHE HB3 H 15.260 10.823 0.096 1.00 . A A . 19 PHE HB3 1 1 1 315 1 1 19 PHE HD1 H 17.114 11.362 -1.521 1.00 . A A . 19 PHE HD1 1 1 1 316 1 1 19 PHE HD2 H 13.484 13.578 -1.353 1.00 . A A . 19 PHE HD2 1 1 1 317 1 1 19 PHE HE1 H 18.202 13.227 -2.700 1.00 . A A . 19 PHE HE1 1 1 1 318 1 1 19 PHE HE2 H 14.566 15.447 -2.532 1.00 . A A . 19 PHE HE2 1 1 1 319 1 1 19 PHE HZ H 16.928 15.273 -3.208 1.00 . A A . 19 PHE HZ 1 1 1 320 1 1 19 PHE N N 12.704 10.134 -1.825 1.00 . A A . 19 PHE N 1 1 1 321 1 1 19 PHE O O 14.815 7.761 -1.646 1.00 . A A . 19 PHE O 1 1 1 322 1 1 20 ARG C C 13.594 6.543 1.255 1.00 . A A . 20 ARG C 1 1 1 323 1 1 20 ARG CA C 14.818 7.441 1.108 1.00 . A A . 20 ARG CA 1 1 1 324 1 1 20 ARG CB C 15.388 7.777 2.488 1.00 . A A . 20 ARG CB 1 1 1 325 1 1 20 ARG CD C 17.864 8.079 2.792 1.00 . A A . 20 ARG CD 1 1 1 326 1 1 20 ARG CG C 16.549 8.757 2.444 1.00 . A A . 20 ARG CG 1 1 1 327 1 1 20 ARG CZ C 18.998 7.217 4.797 1.00 . A A . 20 ARG CZ 1 1 1 328 1 1 20 ARG H H 14.231 9.464 0.897 1.00 . A A . 20 ARG H 1 1 1 329 1 1 20 ARG HA H 15.569 6.916 0.537 1.00 . A A . 20 ARG HA 1 1 1 330 1 1 20 ARG HB2 H 14.604 8.206 3.094 1.00 . A A . 20 ARG HB2 1 1 1 331 1 1 20 ARG HB3 H 15.732 6.865 2.954 1.00 . A A . 20 ARG HB3 1 1 1 332 1 1 20 ARG HD2 H 17.868 7.089 2.363 1.00 . A A . 20 ARG HD2 1 1 1 333 1 1 20 ARG HD3 H 18.674 8.657 2.371 1.00 . A A . 20 ARG HD3 1 1 1 334 1 1 20 ARG HE H 17.459 8.487 4.815 1.00 . A A . 20 ARG HE 1 1 1 335 1 1 20 ARG HG2 H 16.621 9.171 1.450 1.00 . A A . 20 ARG HG2 1 1 1 336 1 1 20 ARG HG3 H 16.363 9.550 3.154 1.00 . A A . 20 ARG HG3 1 1 1 337 1 1 20 ARG HH11 H 19.740 6.542 3.042 1.00 . A A . 20 ARG HH11 1 1 1 338 1 1 20 ARG HH12 H 20.530 5.942 4.462 1.00 . A A . 20 ARG HH12 1 1 1 339 1 1 20 ARG HH21 H 18.492 7.704 6.692 1.00 . A A . 20 ARG HH21 1 1 1 340 1 1 20 ARG HH22 H 19.820 6.603 6.538 1.00 . A A . 20 ARG HH22 1 1 1 341 1 1 20 ARG N N 14.483 8.664 0.389 1.00 . A A . 20 ARG N 1 1 1 342 1 1 20 ARG NE N 18.059 7.971 4.235 1.00 . A A . 20 ARG NE 1 1 1 343 1 1 20 ARG NH1 N 19.824 6.509 4.038 1.00 . A A . 20 ARG NH1 1 1 1 344 1 1 20 ARG NH2 N 19.113 7.171 6.117 1.00 . A A . 20 ARG NH2 1 1 1 345 1 1 20 ARG O O 12.468 7.025 1.381 1.00 . A A . 20 ARG O 1 1 1 346 1 1 21 PRO C C 12.157 4.184 2.788 1.00 . A A . 21 PRO C 1 1 1 347 1 1 21 PRO CA C 12.720 4.242 1.372 1.00 . A A . 21 PRO CA 1 1 1 348 1 1 21 PRO CB C 13.394 2.918 1.010 1.00 . A A . 21 PRO CB 1 1 1 349 1 1 21 PRO CD C 15.121 4.572 1.094 1.00 . A A . 21 PRO CD 1 1 1 350 1 1 21 PRO CG C 14.829 3.119 1.356 1.00 . A A . 21 PRO CG 1 1 1 351 1 1 21 PRO HA H 11.919 4.444 0.676 1.00 . A A . 21 PRO HA 1 1 1 352 1 1 21 PRO HB2 H 12.955 2.118 1.588 1.00 . A A . 21 PRO HB2 1 1 1 353 1 1 21 PRO HB3 H 13.267 2.721 -0.044 1.00 . A A . 21 PRO HB3 1 1 1 354 1 1 21 PRO HD2 H 15.821 4.953 1.822 1.00 . A A . 21 PRO HD2 1 1 1 355 1 1 21 PRO HD3 H 15.505 4.705 0.094 1.00 . A A . 21 PRO HD3 1 1 1 356 1 1 21 PRO HG2 H 14.991 2.887 2.399 1.00 . A A . 21 PRO HG2 1 1 1 357 1 1 21 PRO HG3 H 15.448 2.494 0.731 1.00 . A A . 21 PRO HG3 1 1 1 358 1 1 21 PRO N N 13.805 5.219 1.241 1.00 . A A . 21 PRO N 1 1 1 359 1 1 21 PRO O O 12.907 4.161 3.764 1.00 . A A . 21 PRO O 1 1 1 360 1 1 22 PHE C C 9.723 2.678 4.506 1.00 . A A . 22 PHE C 1 1 1 361 1 1 22 PHE CA C 10.168 4.101 4.188 1.00 . A A . 22 PHE CA 1 1 1 362 1 1 22 PHE CB C 8.962 5.042 4.210 1.00 . A A . 22 PHE CB 1 1 1 363 1 1 22 PHE CD1 C 7.986 4.796 6.508 1.00 . A A . 22 PHE CD1 1 1 1 364 1 1 22 PHE CD2 C 9.007 6.871 5.928 1.00 . A A . 22 PHE CD2 1 1 1 365 1 1 22 PHE CE1 C 7.693 5.288 7.766 1.00 . A A . 22 PHE CE1 1 1 1 366 1 1 22 PHE CE2 C 8.717 7.369 7.184 1.00 . A A . 22 PHE CE2 1 1 1 367 1 1 22 PHE CG C 8.645 5.581 5.576 1.00 . A A . 22 PHE CG 1 1 1 368 1 1 22 PHE CZ C 8.059 6.577 8.104 1.00 . A A . 22 PHE CZ 1 1 1 369 1 1 22 PHE H H 10.289 4.179 2.077 1.00 . A A . 22 PHE H 1 1 1 370 1 1 22 PHE HA H 10.876 4.420 4.938 1.00 . A A . 22 PHE HA 1 1 1 371 1 1 22 PHE HB2 H 9.158 5.882 3.560 1.00 . A A . 22 PHE HB2 1 1 1 372 1 1 22 PHE HB3 H 8.093 4.510 3.851 1.00 . A A . 22 PHE HB3 1 1 1 373 1 1 22 PHE HD1 H 7.699 3.788 6.245 1.00 . A A . 22 PHE HD1 1 1 1 374 1 1 22 PHE HD2 H 9.521 7.492 5.208 1.00 . A A . 22 PHE HD2 1 1 1 375 1 1 22 PHE HE1 H 7.179 4.667 8.484 1.00 . A A . 22 PHE HE1 1 1 1 376 1 1 22 PHE HE2 H 9.005 8.377 7.445 1.00 . A A . 22 PHE HE2 1 1 1 377 1 1 22 PHE HZ H 7.831 6.964 9.086 1.00 . A A . 22 PHE HZ 1 1 1 378 1 1 22 PHE N N 10.833 4.159 2.892 1.00 . A A . 22 PHE N 1 1 1 379 1 1 22 PHE O O 9.573 2.308 5.670 1.00 . A A . 22 PHE O 1 1 1 380 1 1 23 VAL C C 10.274 -0.455 3.528 1.00 . A A . 23 VAL C 1 1 1 381 1 1 23 VAL CA C 9.089 0.499 3.627 1.00 . A A . 23 VAL CA 1 1 1 382 1 1 23 VAL CB C 8.038 0.104 2.573 1.00 . A A . 23 VAL CB 1 1 1 383 1 1 23 VAL CG1 C 6.872 1.080 2.588 1.00 . A A . 23 VAL CG1 1 1 1 384 1 1 23 VAL CG2 C 8.669 0.036 1.190 1.00 . A A . 23 VAL CG2 1 1 1 385 1 1 23 VAL H H 9.653 2.235 2.557 1.00 . A A . 23 VAL H 1 1 1 386 1 1 23 VAL HA H 8.642 0.401 4.605 1.00 . A A . 23 VAL HA 1 1 1 387 1 1 23 VAL HB H 7.660 -0.877 2.821 1.00 . A A . 23 VAL HB 1 1 1 388 1 1 23 VAL HG11 H 6.474 1.181 1.589 1.00 . A A . 23 VAL HG11 1 1 1 389 1 1 23 VAL HG12 H 7.214 2.043 2.937 1.00 . A A . 23 VAL HG12 1 1 1 390 1 1 23 VAL HG13 H 6.101 0.710 3.247 1.00 . A A . 23 VAL HG13 1 1 1 391 1 1 23 VAL HG21 H 9.315 0.889 1.047 1.00 . A A . 23 VAL HG21 1 1 1 392 1 1 23 VAL HG22 H 7.892 0.042 0.439 1.00 . A A . 23 VAL HG22 1 1 1 393 1 1 23 VAL HG23 H 9.247 -0.872 1.102 1.00 . A A . 23 VAL HG23 1 1 1 394 1 1 23 VAL N N 9.515 1.883 3.461 1.00 . A A . 23 VAL N 1 1 1 395 1 1 23 VAL O O 10.226 -1.575 4.038 1.00 . A A . 23 VAL O 1 1 1 396 1 1 24 ASP C C 12.798 -1.650 3.958 1.00 . A A . 24 ASP C 1 1 1 397 1 1 24 ASP CA C 12.535 -0.819 2.707 1.00 . A A . 24 ASP CA 1 1 1 398 1 1 24 ASP CB C 13.745 0.069 2.406 1.00 . A A . 24 ASP CB 1 1 1 399 1 1 24 ASP CG C 15.060 -0.657 2.612 1.00 . A A . 24 ASP CG 1 1 1 400 1 1 24 ASP H H 11.316 0.897 2.487 1.00 . A A . 24 ASP H 1 1 1 401 1 1 24 ASP HA H 12.372 -1.485 1.874 1.00 . A A . 24 ASP HA 1 1 1 402 1 1 24 ASP HB2 H 13.694 0.400 1.380 1.00 . A A . 24 ASP HB2 1 1 1 403 1 1 24 ASP HB3 H 13.723 0.929 3.059 1.00 . A A . 24 ASP HB3 1 1 1 404 1 1 24 ASP N N 11.337 -0.004 2.870 1.00 . A A . 24 ASP N 1 1 1 405 1 1 24 ASP O O 13.336 -2.755 3.880 1.00 . A A . 24 ASP O 1 1 1 406 1 1 24 ASP OD1 O 15.363 -1.021 3.767 1.00 . A A . 24 ASP OD1 1 1 1 407 1 1 24 ASP OD2 O 15.787 -0.861 1.617 1.00 . A A . 24 ASP OD2 1 1 1 408 1 1 25 TYR C C 11.884 -3.146 6.378 1.00 . A A . 25 TYR C 1 1 1 409 1 1 25 TYR CA C 12.606 -1.803 6.379 1.00 . A A . 25 TYR CA 1 1 1 410 1 1 25 TYR CB C 12.103 -0.939 7.537 1.00 . A A . 25 TYR CB 1 1 1 411 1 1 25 TYR CD1 C 9.699 -0.353 7.035 1.00 . A A . 25 TYR CD1 1 1 1 412 1 1 25 TYR CD2 C 10.136 -1.909 8.787 1.00 . A A . 25 TYR CD2 1 1 1 413 1 1 25 TYR CE1 C 8.341 -0.469 7.265 1.00 . A A . 25 TYR CE1 1 1 1 414 1 1 25 TYR CE2 C 8.780 -2.031 9.022 1.00 . A A . 25 TYR CE2 1 1 1 415 1 1 25 TYR CG C 10.618 -1.069 7.791 1.00 . A A . 25 TYR CG 1 1 1 416 1 1 25 TYR CZ C 7.887 -1.309 8.259 1.00 . A A . 25 TYR CZ 1 1 1 417 1 1 25 TYR H H 11.990 -0.227 5.107 1.00 . A A . 25 TYR H 1 1 1 418 1 1 25 TYR HA H 13.664 -1.977 6.504 1.00 . A A . 25 TYR HA 1 1 1 419 1 1 25 TYR HB2 H 12.620 -1.225 8.441 1.00 . A A . 25 TYR HB2 1 1 1 420 1 1 25 TYR HB3 H 12.314 0.098 7.321 1.00 . A A . 25 TYR HB3 1 1 1 421 1 1 25 TYR HD1 H 10.058 0.304 6.257 1.00 . A A . 25 TYR HD1 1 1 1 422 1 1 25 TYR HD2 H 10.838 -2.473 9.384 1.00 . A A . 25 TYR HD2 1 1 1 423 1 1 25 TYR HE1 H 7.643 0.096 6.666 1.00 . A A . 25 TYR HE1 1 1 1 424 1 1 25 TYR HE2 H 8.424 -2.689 9.802 1.00 . A A . 25 TYR HE2 1 1 1 425 1 1 25 TYR HH H 6.054 -0.894 7.854 1.00 . A A . 25 TYR HH 1 1 1 426 1 1 25 TYR N N 12.414 -1.111 5.110 1.00 . A A . 25 TYR N 1 1 1 427 1 1 25 TYR O O 12.418 -4.148 6.852 1.00 . A A . 25 TYR O 1 1 1 428 1 1 25 TYR OH O 6.536 -1.428 8.490 1.00 . A A . 25 TYR OH 1 1 1 429 1 1 26 LYS C C 10.560 -5.420 4.893 1.00 . A A . 26 LYS C 1 1 1 430 1 1 26 LYS CA C 9.877 -4.380 5.775 1.00 . A A . 26 LYS CA 1 1 1 431 1 1 26 LYS CB C 8.476 -4.079 5.240 1.00 . A A . 26 LYS CB 1 1 1 432 1 1 26 LYS CD C 6.366 -4.982 4.218 1.00 . A A . 26 LYS CD 1 1 1 433 1 1 26 LYS CE C 5.203 -5.818 4.729 1.00 . A A . 26 LYS CE 1 1 1 434 1 1 26 LYS CG C 7.658 -5.325 4.941 1.00 . A A . 26 LYS CG 1 1 1 435 1 1 26 LYS H H 10.298 -2.327 5.476 1.00 . A A . 26 LYS H 1 1 1 436 1 1 26 LYS HA H 9.794 -4.775 6.777 1.00 . A A . 26 LYS HA 1 1 1 437 1 1 26 LYS HB2 H 7.942 -3.491 5.972 1.00 . A A . 26 LYS HB2 1 1 1 438 1 1 26 LYS HB3 H 8.567 -3.507 4.328 1.00 . A A . 26 LYS HB3 1 1 1 439 1 1 26 LYS HD2 H 6.142 -3.938 4.376 1.00 . A A . 26 LYS HD2 1 1 1 440 1 1 26 LYS HD3 H 6.495 -5.169 3.162 1.00 . A A . 26 LYS HD3 1 1 1 441 1 1 26 LYS HE2 H 5.293 -6.818 4.331 1.00 . A A . 26 LYS HE2 1 1 1 442 1 1 26 LYS HE3 H 5.251 -5.856 5.808 1.00 . A A . 26 LYS HE3 1 1 1 443 1 1 26 LYS HG2 H 8.242 -5.986 4.319 1.00 . A A . 26 LYS HG2 1 1 1 444 1 1 26 LYS HG3 H 7.420 -5.819 5.871 1.00 . A A . 26 LYS HG3 1 1 1 445 1 1 26 LYS HZ1 H 3.995 -4.693 3.449 1.00 . A A . 26 LYS HZ1 1 1 1 446 1 1 26 LYS HZ2 H 3.518 -4.633 5.071 1.00 . A A . 26 LYS HZ2 1 1 1 447 1 1 26 LYS HZ3 H 3.206 -6.016 4.150 1.00 . A A . 26 LYS HZ3 1 1 1 448 1 1 26 LYS N N 10.669 -3.158 5.840 1.00 . A A . 26 LYS N 1 1 1 449 1 1 26 LYS NZ N 3.889 -5.250 4.321 1.00 . A A . 26 LYS NZ 1 1 1 450 1 1 26 LYS O O 10.410 -6.623 5.104 1.00 . A A . 26 LYS O 1 1 1 451 1 1 27 ALA C C 13.286 -6.383 3.640 1.00 . A A . 27 ALA C 1 1 1 452 1 1 27 ALA CA C 12.021 -5.832 2.992 1.00 . A A . 27 ALA CA 1 1 1 453 1 1 27 ALA CB C 12.362 -5.099 1.703 1.00 . A A . 27 ALA CB 1 1 1 454 1 1 27 ALA H H 11.393 -3.976 3.790 1.00 . A A . 27 ALA H 1 1 1 455 1 1 27 ALA HA H 11.365 -6.655 2.748 1.00 . A A . 27 ALA HA 1 1 1 456 1 1 27 ALA HB1 H 13.431 -4.963 1.638 1.00 . A A . 27 ALA HB1 1 1 1 457 1 1 27 ALA HB2 H 11.875 -4.135 1.697 1.00 . A A . 27 ALA HB2 1 1 1 458 1 1 27 ALA HB3 H 12.021 -5.679 0.858 1.00 . A A . 27 ALA HB3 1 1 1 459 1 1 27 ALA N N 11.312 -4.946 3.905 1.00 . A A . 27 ALA N 1 1 1 460 1 1 27 ALA O O 13.816 -7.411 3.216 1.00 . A A . 27 ALA O 1 1 1 461 1 1 28 GLY C C 14.727 -6.362 6.840 1.00 . A A . 28 GLY C 1 1 1 462 1 1 28 GLY CA C 14.964 -6.128 5.361 1.00 . A A . 28 GLY CA 1 1 1 463 1 1 28 GLY H H 13.300 -4.882 4.963 1.00 . A A . 28 GLY H 1 1 1 464 1 1 28 GLY HA2 H 15.311 -7.048 4.913 1.00 . A A . 28 GLY HA2 1 1 1 465 1 1 28 GLY HA3 H 15.727 -5.374 5.245 1.00 . A A . 28 GLY HA3 1 1 1 466 1 1 28 GLY N N 13.765 -5.693 4.670 1.00 . A A . 28 GLY N 1 1 1 467 1 1 28 GLY O O 15.675 -6.518 7.610 1.00 . A A . 28 GLY O 1 1 1 468 1 1 29 LEU C C 13.425 -8.027 9.075 1.00 . A A . 29 LEU C 1 1 1 469 1 1 29 LEU CA C 13.101 -6.601 8.636 1.00 . A A . 29 LEU CA 1 1 1 470 1 1 29 LEU CB C 11.615 -6.313 8.853 1.00 . A A . 29 LEU CB 1 1 1 471 1 1 29 LEU CD1 C 10.406 -8.210 9.961 1.00 . A A . 29 LEU CD1 1 1 1 472 1 1 29 LEU CD2 C 9.386 -7.063 7.986 1.00 . A A . 29 LEU CD2 1 1 1 473 1 1 29 LEU CG C 10.685 -7.509 8.640 1.00 . A A . 29 LEU CG 1 1 1 474 1 1 29 LEU H H 12.747 -6.254 6.578 1.00 . A A . 29 LEU H 1 1 1 475 1 1 29 LEU HA H 13.681 -5.915 9.234 1.00 . A A . 29 LEU HA 1 1 1 476 1 1 29 LEU HB2 H 11.483 -5.956 9.865 1.00 . A A . 29 LEU HB2 1 1 1 477 1 1 29 LEU HB3 H 11.318 -5.530 8.172 1.00 . A A . 29 LEU HB3 1 1 1 478 1 1 29 LEU HD11 H 10.451 -7.491 10.766 1.00 . A A . 29 LEU HD11 1 1 1 479 1 1 29 LEU HD12 H 11.146 -8.979 10.124 1.00 . A A . 29 LEU HD12 1 1 1 480 1 1 29 LEU HD13 H 9.423 -8.656 9.931 1.00 . A A . 29 LEU HD13 1 1 1 481 1 1 29 LEU HD21 H 9.203 -6.025 8.220 1.00 . A A . 29 LEU HD21 1 1 1 482 1 1 29 LEU HD22 H 8.571 -7.666 8.358 1.00 . A A . 29 LEU HD22 1 1 1 483 1 1 29 LEU HD23 H 9.463 -7.183 6.916 1.00 . A A . 29 LEU HD23 1 1 1 484 1 1 29 LEU HG H 11.167 -8.218 7.982 1.00 . A A . 29 LEU HG 1 1 1 485 1 1 29 LEU N N 13.459 -6.385 7.239 1.00 . A A . 29 LEU N 1 1 1 486 1 1 29 LEU O O 13.299 -8.367 10.251 1.00 . A A . 29 LEU O 1 1 1 487 1 1 30 GLU C C 14.734 -10.945 7.181 1.00 . A A . 30 GLU C 1 1 1 488 1 1 30 GLU CA C 14.182 -10.245 8.419 1.00 . A A . 30 GLU CA 1 1 1 489 1 1 30 GLU CB C 12.954 -10.995 8.938 1.00 . A A . 30 GLU CB 1 1 1 490 1 1 30 GLU CD C 12.045 -13.200 9.771 1.00 . A A . 30 GLU CD 1 1 1 491 1 1 30 GLU CG C 13.280 -12.350 9.545 1.00 . A A . 30 GLU CG 1 1 1 492 1 1 30 GLU H H 13.923 -8.532 7.205 1.00 . A A . 30 GLU H 1 1 1 493 1 1 30 GLU HA H 14.942 -10.244 9.185 1.00 . A A . 30 GLU HA 1 1 1 494 1 1 30 GLU HB2 H 12.471 -10.393 9.694 1.00 . A A . 30 GLU HB2 1 1 1 495 1 1 30 GLU HB3 H 12.267 -11.148 8.119 1.00 . A A . 30 GLU HB3 1 1 1 496 1 1 30 GLU HG2 H 13.944 -12.879 8.878 1.00 . A A . 30 GLU HG2 1 1 1 497 1 1 30 GLU HG3 H 13.772 -12.196 10.495 1.00 . A A . 30 GLU HG3 1 1 1 498 1 1 30 GLU N N 13.842 -8.858 8.125 1.00 . A A . 30 GLU N 1 1 1 499 1 1 30 GLU O O 14.324 -12.056 6.852 1.00 . A A . 30 GLU O 1 1 1 500 1 1 30 GLU OE1 O 11.564 -13.819 8.799 1.00 . A A . 30 GLU OE1 1 1 1 501 1 1 30 GLU OE2 O 11.558 -13.245 10.920 1.00 . A A . 30 GLU OE2 1 1 1 502 1 1 31 LYS C C 15.215 -11.216 4.274 1.00 . A A . 31 LYS C 1 1 1 503 1 1 31 LYS CA C 16.277 -10.825 5.294 1.00 . A A . 31 LYS CA 1 1 1 504 1 1 31 LYS CB C 17.171 -12.024 5.637 1.00 . A A . 31 LYS CB 1 1 1 505 1 1 31 LYS CD C 16.666 -14.125 6.922 1.00 . A A . 31 LYS CD 1 1 1 506 1 1 31 LYS CE C 17.348 -15.463 6.688 1.00 . A A . 31 LYS CE 1 1 1 507 1 1 31 LYS CG C 16.458 -13.370 5.619 1.00 . A A . 31 LYS CG 1 1 1 508 1 1 31 LYS H H 15.939 -9.395 6.815 1.00 . A A . 31 LYS H 1 1 1 509 1 1 31 LYS HA H 16.888 -10.047 4.864 1.00 . A A . 31 LYS HA 1 1 1 510 1 1 31 LYS HB2 H 17.981 -12.065 4.925 1.00 . A A . 31 LYS HB2 1 1 1 511 1 1 31 LYS HB3 H 17.584 -11.875 6.624 1.00 . A A . 31 LYS HB3 1 1 1 512 1 1 31 LYS HD2 H 17.281 -13.529 7.579 1.00 . A A . 31 LYS HD2 1 1 1 513 1 1 31 LYS HD3 H 15.705 -14.297 7.384 1.00 . A A . 31 LYS HD3 1 1 1 514 1 1 31 LYS HE2 H 17.818 -15.779 7.607 1.00 . A A . 31 LYS HE2 1 1 1 515 1 1 31 LYS HE3 H 16.601 -16.188 6.399 1.00 . A A . 31 LYS HE3 1 1 1 516 1 1 31 LYS HG2 H 15.402 -13.212 5.473 1.00 . A A . 31 LYS HG2 1 1 1 517 1 1 31 LYS HG3 H 16.851 -13.962 4.806 1.00 . A A . 31 LYS HG3 1 1 1 518 1 1 31 LYS HZ1 H 19.096 -16.124 5.755 1.00 . A A . 31 LYS HZ1 1 1 1 519 1 1 31 LYS HZ2 H 18.854 -14.454 5.650 1.00 . A A . 31 LYS HZ2 1 1 1 520 1 1 31 LYS HZ3 H 17.942 -15.502 4.685 1.00 . A A . 31 LYS HZ3 1 1 1 521 1 1 31 LYS N N 15.662 -10.280 6.500 1.00 . A A . 31 LYS N 1 1 1 522 1 1 31 LYS NZ N 18.382 -15.380 5.620 1.00 . A A . 31 LYS NZ 1 1 1 523 1 1 31 LYS O O 15.319 -12.245 3.607 1.00 . A A . 31 LYS O 1 1 1 524 1 1 32 LYS C C 13.641 -10.896 1.823 1.00 . A A . 32 LYS C 1 1 1 525 1 1 32 LYS CA C 13.104 -10.617 3.223 1.00 . A A . 32 LYS CA 1 1 1 526 1 1 32 LYS CB C 12.159 -9.414 3.189 1.00 . A A . 32 LYS CB 1 1 1 527 1 1 32 LYS CD C 9.876 -8.994 2.226 1.00 . A A . 32 LYS CD 1 1 1 528 1 1 32 LYS CE C 8.870 -9.869 1.497 1.00 . A A . 32 LYS CE 1 1 1 529 1 1 32 LYS CG C 10.688 -9.796 3.230 1.00 . A A . 32 LYS CG 1 1 1 530 1 1 32 LYS H H 14.179 -9.572 4.721 1.00 . A A . 32 LYS H 1 1 1 531 1 1 32 LYS HA H 12.558 -11.483 3.565 1.00 . A A . 32 LYS HA 1 1 1 532 1 1 32 LYS HB2 H 12.369 -8.782 4.039 1.00 . A A . 32 LYS HB2 1 1 1 533 1 1 32 LYS HB3 H 12.338 -8.856 2.282 1.00 . A A . 32 LYS HB3 1 1 1 534 1 1 32 LYS HD2 H 9.346 -8.212 2.749 1.00 . A A . 32 LYS HD2 1 1 1 535 1 1 32 LYS HD3 H 10.548 -8.554 1.503 1.00 . A A . 32 LYS HD3 1 1 1 536 1 1 32 LYS HE2 H 9.113 -9.877 0.445 1.00 . A A . 32 LYS HE2 1 1 1 537 1 1 32 LYS HE3 H 8.936 -10.874 1.889 1.00 . A A . 32 LYS HE3 1 1 1 538 1 1 32 LYS HG2 H 10.592 -10.846 2.998 1.00 . A A . 32 LYS HG2 1 1 1 539 1 1 32 LYS HG3 H 10.305 -9.608 4.222 1.00 . A A . 32 LYS HG3 1 1 1 540 1 1 32 LYS HZ1 H 7.195 -8.807 0.841 1.00 . A A . 32 LYS HZ1 1 1 1 541 1 1 32 LYS HZ2 H 7.408 -8.781 2.519 1.00 . A A . 32 LYS HZ2 1 1 1 542 1 1 32 LYS HZ3 H 6.820 -10.175 1.764 1.00 . A A . 32 LYS HZ3 1 1 1 543 1 1 32 LYS N N 14.195 -10.376 4.160 1.00 . A A . 32 LYS N 1 1 1 544 1 1 32 LYS NZ N 7.476 -9.373 1.667 1.00 . A A . 32 LYS NZ 1 1 1 545 1 1 32 LYS O O 13.620 -12.035 1.355 1.00 . A A . 32 LYS O 1 1 1 546 1 1 33 LYS C C 14.683 -8.636 -0.903 1.00 . A A . 33 LYS C 1 1 1 547 1 1 33 LYS CA C 14.666 -9.983 -0.188 1.00 . A A . 33 LYS CA 1 1 1 548 1 1 33 LYS CB C 13.844 -10.991 -0.994 1.00 . A A . 33 LYS CB 1 1 1 549 1 1 33 LYS CD C 15.793 -12.176 -2.047 1.00 . A A . 33 LYS CD 1 1 1 550 1 1 33 LYS CE C 15.448 -11.811 -3.482 1.00 . A A . 33 LYS CE 1 1 1 551 1 1 33 LYS CG C 14.544 -12.325 -1.194 1.00 . A A . 33 LYS CG 1 1 1 552 1 1 33 LYS H H 14.113 -8.968 1.586 1.00 . A A . 33 LYS H 1 1 1 553 1 1 33 LYS HA H 15.679 -10.345 -0.102 1.00 . A A . 33 LYS HA 1 1 1 554 1 1 33 LYS HB2 H 12.912 -11.172 -0.479 1.00 . A A . 33 LYS HB2 1 1 1 555 1 1 33 LYS HB3 H 13.633 -10.570 -1.966 1.00 . A A . 33 LYS HB3 1 1 1 556 1 1 33 LYS HD2 H 16.413 -11.398 -1.628 1.00 . A A . 33 LYS HD2 1 1 1 557 1 1 33 LYS HD3 H 16.334 -13.112 -2.043 1.00 . A A . 33 LYS HD3 1 1 1 558 1 1 33 LYS HE2 H 14.654 -12.458 -3.823 1.00 . A A . 33 LYS HE2 1 1 1 559 1 1 33 LYS HE3 H 15.111 -10.785 -3.507 1.00 . A A . 33 LYS HE3 1 1 1 560 1 1 33 LYS HG2 H 14.824 -12.722 -0.230 1.00 . A A . 33 LYS HG2 1 1 1 561 1 1 33 LYS HG3 H 13.864 -13.007 -1.683 1.00 . A A . 33 LYS HG3 1 1 1 562 1 1 33 LYS HZ1 H 16.795 -11.069 -4.895 1.00 . A A . 33 LYS HZ1 1 1 1 563 1 1 33 LYS HZ2 H 16.437 -12.711 -5.087 1.00 . A A . 33 LYS HZ2 1 1 1 564 1 1 33 LYS HZ3 H 17.467 -12.210 -3.842 1.00 . A A . 33 LYS HZ3 1 1 1 565 1 1 33 LYS N N 14.123 -9.850 1.159 1.00 . A A . 33 LYS N 1 1 1 566 1 1 33 LYS NZ N 16.618 -11.961 -4.390 1.00 . A A . 33 LYS NZ 1 1 1 567 1 1 33 LYS O O 13.821 -7.788 -0.672 1.00 . A A . 33 LYS O 1 1 1 568 1 1 34 LEU C C 15.683 -7.456 -4.021 1.00 . A A . 34 LEU C 1 1 1 569 1 1 34 LEU CA C 15.801 -7.202 -2.521 1.00 . A A . 34 LEU CA 1 1 1 570 1 1 34 LEU CB C 17.140 -6.532 -2.210 1.00 . A A . 34 LEU CB 1 1 1 571 1 1 34 LEU CD1 C 16.657 -6.582 0.250 1.00 . A A . 34 LEU CD1 1 1 1 572 1 1 34 LEU CD2 C 18.592 -5.255 -0.615 1.00 . A A . 34 LEU CD2 1 1 1 573 1 1 34 LEU CG C 17.179 -5.738 -0.903 1.00 . A A . 34 LEU CG 1 1 1 574 1 1 34 LEU H H 16.328 -9.160 -1.912 1.00 . A A . 34 LEU H 1 1 1 575 1 1 34 LEU HA H 15.000 -6.546 -2.215 1.00 . A A . 34 LEU HA 1 1 1 576 1 1 34 LEU HB2 H 17.900 -7.299 -2.164 1.00 . A A . 34 LEU HB2 1 1 1 577 1 1 34 LEU HB3 H 17.380 -5.859 -3.020 1.00 . A A . 34 LEU HB3 1 1 1 578 1 1 34 LEU HD11 H 17.065 -6.213 1.179 1.00 . A A . 34 LEU HD11 1 1 1 579 1 1 34 LEU HD12 H 16.957 -7.610 0.108 1.00 . A A . 34 LEU HD12 1 1 1 580 1 1 34 LEU HD13 H 15.579 -6.522 0.281 1.00 . A A . 34 LEU HD13 1 1 1 581 1 1 34 LEU HD21 H 19.301 -6.004 -0.935 1.00 . A A . 34 LEU HD21 1 1 1 582 1 1 34 LEU HD22 H 18.705 -5.081 0.445 1.00 . A A . 34 LEU HD22 1 1 1 583 1 1 34 LEU HD23 H 18.775 -4.335 -1.152 1.00 . A A . 34 LEU HD23 1 1 1 584 1 1 34 LEU HG H 16.541 -4.871 -0.997 1.00 . A A . 34 LEU HG 1 1 1 585 1 1 34 LEU N N 15.671 -8.446 -1.772 1.00 . A A . 34 LEU N 1 1 1 586 1 1 34 LEU O O 16.662 -7.344 -4.758 1.00 . A A . 34 LEU O 1 1 1 587 1 1 35 SER C C 13.693 -6.826 -6.582 1.00 . A A . 35 SER C 1 1 1 588 1 1 35 SER CA C 14.231 -8.067 -5.877 1.00 . A A . 35 SER CA 1 1 1 589 1 1 35 SER CB C 13.244 -9.225 -6.032 1.00 . A A . 35 SER CB 1 1 1 590 1 1 35 SER H H 13.736 -7.870 -3.828 1.00 . A A . 35 SER H 1 1 1 591 1 1 35 SER HA H 15.171 -8.344 -6.330 1.00 . A A . 35 SER HA 1 1 1 592 1 1 35 SER HB2 H 12.653 -9.314 -5.133 1.00 . A A . 35 SER HB2 1 1 1 593 1 1 35 SER HB3 H 12.594 -9.031 -6.872 1.00 . A A . 35 SER HB3 1 1 1 594 1 1 35 SER HG H 14.236 -10.482 -7.160 1.00 . A A . 35 SER HG 1 1 1 595 1 1 35 SER N N 14.478 -7.797 -4.465 1.00 . A A . 35 SER N 1 1 1 596 1 1 35 SER O O 13.185 -5.906 -5.940 1.00 . A A . 35 SER O 1 1 1 597 1 1 35 SER OG O 13.924 -10.449 -6.253 1.00 . A A . 35 SER OG 1 1 1 598 1 1 36 ASP C C 11.855 -5.844 -9.047 1.00 . A A . 36 ASP C 1 1 1 599 1 1 36 ASP CA C 13.331 -5.680 -8.698 1.00 . A A . 36 ASP CA 1 1 1 600 1 1 36 ASP CB C 14.157 -5.545 -9.979 1.00 . A A . 36 ASP CB 1 1 1 601 1 1 36 ASP CG C 15.376 -4.664 -9.790 1.00 . A A . 36 ASP CG 1 1 1 602 1 1 36 ASP H H 14.221 -7.571 -8.360 1.00 . A A . 36 ASP H 1 1 1 603 1 1 36 ASP HA H 13.451 -4.785 -8.107 1.00 . A A . 36 ASP HA 1 1 1 604 1 1 36 ASP HB2 H 14.489 -6.524 -10.291 1.00 . A A . 36 ASP HB2 1 1 1 605 1 1 36 ASP HB3 H 13.540 -5.114 -10.754 1.00 . A A . 36 ASP HB3 1 1 1 606 1 1 36 ASP N N 13.807 -6.808 -7.906 1.00 . A A . 36 ASP N 1 1 1 607 1 1 36 ASP O O 11.335 -5.159 -9.928 1.00 . A A . 36 ASP O 1 1 1 608 1 1 36 ASP OD1 O 15.870 -4.571 -8.646 1.00 . A A . 36 ASP OD1 1 1 1 609 1 1 36 ASP OD2 O 15.838 -4.067 -10.785 1.00 . A A . 36 ASP OD2 1 1 1 610 1 1 37 ASP C C 8.919 -6.436 -7.457 1.00 . A A . 37 ASP C 1 1 1 611 1 1 37 ASP CA C 9.769 -7.010 -8.585 1.00 . A A . 37 ASP CA 1 1 1 612 1 1 37 ASP CB C 9.514 -8.512 -8.718 1.00 . A A . 37 ASP CB 1 1 1 613 1 1 37 ASP CG C 8.911 -8.880 -10.060 1.00 . A A . 37 ASP CG 1 1 1 614 1 1 37 ASP H H 11.655 -7.271 -7.660 1.00 . A A . 37 ASP H 1 1 1 615 1 1 37 ASP HA H 9.495 -6.524 -9.510 1.00 . A A . 37 ASP HA 1 1 1 616 1 1 37 ASP HB2 H 10.449 -9.041 -8.608 1.00 . A A . 37 ASP HB2 1 1 1 617 1 1 37 ASP HB3 H 8.834 -8.826 -7.940 1.00 . A A . 37 ASP HB3 1 1 1 618 1 1 37 ASP N N 11.186 -6.756 -8.350 1.00 . A A . 37 ASP N 1 1 1 619 1 1 37 ASP O O 7.748 -6.110 -7.652 1.00 . A A . 37 ASP O 1 1 1 620 1 1 37 ASP OD1 O 8.441 -7.966 -10.770 1.00 . A A . 37 ASP OD1 1 1 1 621 1 1 37 ASP OD2 O 8.909 -10.081 -10.401 1.00 . A A . 37 ASP OD2 1 1 1 622 1 1 38 ASP C C 7.871 -4.652 -5.523 1.00 . A A . 38 ASP C 1 1 1 623 1 1 38 ASP CA C 8.812 -5.780 -5.115 1.00 . A A . 38 ASP CA 1 1 1 624 1 1 38 ASP CB C 9.813 -5.275 -4.075 1.00 . A A . 38 ASP CB 1 1 1 625 1 1 38 ASP CG C 9.436 -5.682 -2.664 1.00 . A A . 38 ASP CG 1 1 1 626 1 1 38 ASP H H 10.451 -6.592 -6.182 1.00 . A A . 38 ASP H 1 1 1 627 1 1 38 ASP HA H 8.231 -6.580 -4.683 1.00 . A A . 38 ASP HA 1 1 1 628 1 1 38 ASP HB2 H 10.790 -5.679 -4.297 1.00 . A A . 38 ASP HB2 1 1 1 629 1 1 38 ASP HB3 H 9.856 -4.196 -4.120 1.00 . A A . 38 ASP HB3 1 1 1 630 1 1 38 ASP N N 9.515 -6.315 -6.276 1.00 . A A . 38 ASP N 1 1 1 631 1 1 38 ASP O O 8.256 -3.744 -6.260 1.00 . A A . 38 ASP O 1 1 1 632 1 1 38 ASP OD1 O 8.241 -5.957 -2.425 1.00 . A A . 38 ASP OD1 1 1 1 633 1 1 38 ASP OD2 O 10.335 -5.726 -1.798 1.00 . A A . 38 ASP OD2 1 1 1 634 1 1 39 GLU C C 4.779 -3.385 -4.132 1.00 . A A . 39 GLU C 1 1 1 635 1 1 39 GLU CA C 5.637 -3.699 -5.352 1.00 . A A . 39 GLU CA 1 1 1 636 1 1 39 GLU CB C 4.750 -4.165 -6.508 1.00 . A A . 39 GLU CB 1 1 1 637 1 1 39 GLU CD C 4.036 -3.687 -8.884 1.00 . A A . 39 GLU CD 1 1 1 638 1 1 39 GLU CG C 5.142 -3.574 -7.853 1.00 . A A . 39 GLU CG 1 1 1 639 1 1 39 GLU H H 6.387 -5.465 -4.456 1.00 . A A . 39 GLU H 1 1 1 640 1 1 39 GLU HA H 6.160 -2.803 -5.651 1.00 . A A . 39 GLU HA 1 1 1 641 1 1 39 GLU HB2 H 4.810 -5.241 -6.581 1.00 . A A . 39 GLU HB2 1 1 1 642 1 1 39 GLU HB3 H 3.729 -3.883 -6.299 1.00 . A A . 39 GLU HB3 1 1 1 643 1 1 39 GLU HG2 H 5.381 -2.530 -7.717 1.00 . A A . 39 GLU HG2 1 1 1 644 1 1 39 GLU HG3 H 6.013 -4.097 -8.221 1.00 . A A . 39 GLU HG3 1 1 1 645 1 1 39 GLU N N 6.635 -4.716 -5.039 1.00 . A A . 39 GLU N 1 1 1 646 1 1 39 GLU O O 4.141 -4.271 -3.563 1.00 . A A . 39 GLU O 1 1 1 647 1 1 39 GLU OE1 O 3.167 -4.570 -8.728 1.00 . A A . 39 GLU OE1 1 1 1 648 1 1 39 GLU OE2 O 4.039 -2.892 -9.847 1.00 . A A . 39 GLU OE2 1 1 1 649 1 1 40 ILE C C 3.182 -0.429 -2.903 1.00 . A A . 40 ILE C 1 1 1 650 1 1 40 ILE CA C 3.986 -1.684 -2.582 1.00 . A A . 40 ILE CA 1 1 1 651 1 1 40 ILE CB C 4.888 -1.405 -1.365 1.00 . A A . 40 ILE CB 1 1 1 652 1 1 40 ILE CD1 C 6.528 -2.570 0.195 1.00 . A A . 40 ILE CD1 1 1 1 653 1 1 40 ILE CG1 C 5.899 -2.538 -1.181 1.00 . A A . 40 ILE CG1 1 1 1 654 1 1 40 ILE CG2 C 4.045 -1.230 -0.110 1.00 . A A . 40 ILE CG2 1 1 1 655 1 1 40 ILE H H 5.295 -1.455 -4.229 1.00 . A A . 40 ILE H 1 1 1 656 1 1 40 ILE HA H 3.303 -2.481 -2.324 1.00 . A A . 40 ILE HA 1 1 1 657 1 1 40 ILE HB H 5.419 -0.483 -1.543 1.00 . A A . 40 ILE HB 1 1 1 658 1 1 40 ILE HD11 H 6.208 -1.704 0.757 1.00 . A A . 40 ILE HD11 1 1 1 659 1 1 40 ILE HD12 H 7.603 -2.560 0.099 1.00 . A A . 40 ILE HD12 1 1 1 660 1 1 40 ILE HD13 H 6.221 -3.467 0.711 1.00 . A A . 40 ILE HD13 1 1 1 661 1 1 40 ILE HG12 H 5.403 -3.484 -1.340 1.00 . A A . 40 ILE HG12 1 1 1 662 1 1 40 ILE HG13 H 6.691 -2.426 -1.907 1.00 . A A . 40 ILE HG13 1 1 1 663 1 1 40 ILE HG21 H 3.322 -0.444 -0.269 1.00 . A A . 40 ILE HG21 1 1 1 664 1 1 40 ILE HG22 H 4.685 -0.968 0.719 1.00 . A A . 40 ILE HG22 1 1 1 665 1 1 40 ILE HG23 H 3.531 -2.154 0.110 1.00 . A A . 40 ILE HG23 1 1 1 666 1 1 40 ILE N N 4.766 -2.116 -3.735 1.00 . A A . 40 ILE N 1 1 1 667 1 1 40 ILE O O 3.521 0.321 -3.818 1.00 . A A . 40 ILE O 1 1 1 668 1 1 41 ALA C C 0.670 1.443 -1.027 1.00 . A A . 41 ALA C 1 1 1 669 1 1 41 ALA CA C 1.263 0.960 -2.346 1.00 . A A . 41 ALA CA 1 1 1 670 1 1 41 ALA CB C 0.155 0.636 -3.337 1.00 . A A . 41 ALA CB 1 1 1 671 1 1 41 ALA H H 1.896 -0.839 -1.428 1.00 . A A . 41 ALA H 1 1 1 672 1 1 41 ALA HA H 1.871 1.748 -2.766 1.00 . A A . 41 ALA HA 1 1 1 673 1 1 41 ALA HB1 H 0.064 -0.435 -3.438 1.00 . A A . 41 ALA HB1 1 1 1 674 1 1 41 ALA HB2 H 0.394 1.069 -4.297 1.00 . A A . 41 ALA HB2 1 1 1 675 1 1 41 ALA HB3 H -0.778 1.045 -2.980 1.00 . A A . 41 ALA HB3 1 1 1 676 1 1 41 ALA N N 2.115 -0.205 -2.142 1.00 . A A . 41 ALA N 1 1 1 677 1 1 41 ALA O O -0.082 0.721 -0.371 1.00 . A A . 41 ALA O 1 1 1 678 1 1 42 ILE C C -0.452 4.393 0.320 1.00 . A A . 42 ILE C 1 1 1 679 1 1 42 ILE CA C 0.515 3.248 0.598 1.00 . A A . 42 ILE CA 1 1 1 680 1 1 42 ILE CB C 1.667 3.767 1.479 1.00 . A A . 42 ILE CB 1 1 1 681 1 1 42 ILE CD1 C 3.537 2.967 3.008 1.00 . A A . 42 ILE CD1 1 1 1 682 1 1 42 ILE CG1 C 2.587 2.615 1.884 1.00 . A A . 42 ILE CG1 1 1 1 683 1 1 42 ILE CG2 C 1.117 4.472 2.710 1.00 . A A . 42 ILE CG2 1 1 1 684 1 1 42 ILE H H 1.616 3.195 -1.208 1.00 . A A . 42 ILE H 1 1 1 685 1 1 42 ILE HA H -0.006 2.474 1.142 1.00 . A A . 42 ILE HA 1 1 1 686 1 1 42 ILE HB H 2.233 4.486 0.906 1.00 . A A . 42 ILE HB 1 1 1 687 1 1 42 ILE HD11 H 3.196 2.509 3.925 1.00 . A A . 42 ILE HD11 1 1 1 688 1 1 42 ILE HD12 H 3.568 4.039 3.131 1.00 . A A . 42 ILE HD12 1 1 1 689 1 1 42 ILE HD13 H 4.526 2.604 2.771 1.00 . A A . 42 ILE HD13 1 1 1 690 1 1 42 ILE HG12 H 1.986 1.779 2.209 1.00 . A A . 42 ILE HG12 1 1 1 691 1 1 42 ILE HG13 H 3.178 2.317 1.030 1.00 . A A . 42 ILE HG13 1 1 1 692 1 1 42 ILE HG21 H 1.477 5.490 2.733 1.00 . A A . 42 ILE HG21 1 1 1 693 1 1 42 ILE HG22 H 1.446 3.954 3.598 1.00 . A A . 42 ILE HG22 1 1 1 694 1 1 42 ILE HG23 H 0.038 4.473 2.672 1.00 . A A . 42 ILE HG23 1 1 1 695 1 1 42 ILE N N 1.013 2.668 -0.643 1.00 . A A . 42 ILE N 1 1 1 696 1 1 42 ILE O O -0.206 5.229 -0.550 1.00 . A A . 42 ILE O 1 1 1 697 1 1 43 ILE C C -3.018 6.009 2.246 1.00 . A A . 43 ILE C 1 1 1 698 1 1 43 ILE CA C -2.558 5.469 0.897 1.00 . A A . 43 ILE CA 1 1 1 699 1 1 43 ILE CB C -3.783 4.950 0.119 1.00 . A A . 43 ILE CB 1 1 1 700 1 1 43 ILE CD1 C -4.530 3.095 -1.455 1.00 . A A . 43 ILE CD1 1 1 1 701 1 1 43 ILE CG1 C -3.364 3.860 -0.869 1.00 . A A . 43 ILE CG1 1 1 1 702 1 1 43 ILE CG2 C -4.473 6.095 -0.607 1.00 . A A . 43 ILE CG2 1 1 1 703 1 1 43 ILE H H -1.693 3.731 1.741 1.00 . A A . 43 ILE H 1 1 1 704 1 1 43 ILE HA H -2.112 6.273 0.330 1.00 . A A . 43 ILE HA 1 1 1 705 1 1 43 ILE HB H -4.482 4.534 0.829 1.00 . A A . 43 ILE HB 1 1 1 706 1 1 43 ILE HD11 H -4.408 2.041 -1.252 1.00 . A A . 43 ILE HD11 1 1 1 707 1 1 43 ILE HD12 H -4.566 3.255 -2.522 1.00 . A A . 43 ILE HD12 1 1 1 708 1 1 43 ILE HD13 H -5.450 3.443 -1.008 1.00 . A A . 43 ILE HD13 1 1 1 709 1 1 43 ILE HG12 H -2.822 4.313 -1.685 1.00 . A A . 43 ILE HG12 1 1 1 710 1 1 43 ILE HG13 H -2.722 3.153 -0.364 1.00 . A A . 43 ILE HG13 1 1 1 711 1 1 43 ILE HG21 H -4.698 6.884 0.096 1.00 . A A . 43 ILE HG21 1 1 1 712 1 1 43 ILE HG22 H -5.390 5.738 -1.052 1.00 . A A . 43 ILE HG22 1 1 1 713 1 1 43 ILE HG23 H -3.822 6.476 -1.379 1.00 . A A . 43 ILE HG23 1 1 1 714 1 1 43 ILE N N -1.553 4.426 1.063 1.00 . A A . 43 ILE N 1 1 1 715 1 1 43 ILE O O -3.424 5.249 3.125 1.00 . A A . 43 ILE O 1 1 1 716 1 1 44 SER C C -4.654 8.760 3.449 1.00 . A A . 44 SER C 1 1 1 717 1 1 44 SER CA C -3.364 7.970 3.645 1.00 . A A . 44 SER CA 1 1 1 718 1 1 44 SER CB C -2.258 8.896 4.155 1.00 . A A . 44 SER CB 1 1 1 719 1 1 44 SER H H -2.622 7.881 1.665 1.00 . A A . 44 SER H 1 1 1 720 1 1 44 SER HA H -3.538 7.196 4.377 1.00 . A A . 44 SER HA 1 1 1 721 1 1 44 SER HB2 H -2.367 9.032 5.221 1.00 . A A . 44 SER HB2 1 1 1 722 1 1 44 SER HB3 H -1.296 8.453 3.945 1.00 . A A . 44 SER HB3 1 1 1 723 1 1 44 SER HG H -1.681 10.202 2.813 1.00 . A A . 44 SER HG 1 1 1 724 1 1 44 SER N N -2.953 7.327 2.403 1.00 . A A . 44 SER N 1 1 1 725 1 1 44 SER O O -5.045 9.058 2.320 1.00 . A A . 44 SER O 1 1 1 726 1 1 44 SER OG O -2.324 10.164 3.525 1.00 . A A . 44 SER OG 1 1 1 727 1 1 45 ILE C C -6.846 10.526 5.839 1.00 . A A . 45 ILE C 1 1 1 728 1 1 45 ILE CA C -6.556 9.852 4.503 1.00 . A A . 45 ILE CA 1 1 1 729 1 1 45 ILE CB C -7.747 8.949 4.129 1.00 . A A . 45 ILE CB 1 1 1 730 1 1 45 ILE CD1 C -8.685 6.828 5.177 1.00 . A A . 45 ILE CD1 1 1 1 731 1 1 45 ILE CG1 C -7.479 7.507 4.566 1.00 . A A . 45 ILE CG1 1 1 1 732 1 1 45 ILE CG2 C -8.011 9.014 2.632 1.00 . A A . 45 ILE CG2 1 1 1 733 1 1 45 ILE H H -4.948 8.831 5.425 1.00 . A A . 45 ILE H 1 1 1 734 1 1 45 ILE HA H -6.454 10.612 3.742 1.00 . A A . 45 ILE HA 1 1 1 735 1 1 45 ILE HB H -8.623 9.316 4.640 1.00 . A A . 45 ILE HB 1 1 1 736 1 1 45 ILE HD11 H -8.359 6.121 5.926 1.00 . A A . 45 ILE HD11 1 1 1 737 1 1 45 ILE HD12 H -9.234 6.307 4.406 1.00 . A A . 45 ILE HD12 1 1 1 738 1 1 45 ILE HD13 H -9.323 7.569 5.635 1.00 . A A . 45 ILE HD13 1 1 1 739 1 1 45 ILE HG12 H -7.173 6.928 3.708 1.00 . A A . 45 ILE HG12 1 1 1 740 1 1 45 ILE HG13 H -6.687 7.502 5.300 1.00 . A A . 45 ILE HG13 1 1 1 741 1 1 45 ILE HG21 H -7.645 8.113 2.162 1.00 . A A . 45 ILE HG21 1 1 1 742 1 1 45 ILE HG22 H -7.504 9.871 2.214 1.00 . A A . 45 ILE HG22 1 1 1 743 1 1 45 ILE HG23 H -9.074 9.104 2.458 1.00 . A A . 45 ILE HG23 1 1 1 744 1 1 45 ILE N N -5.311 9.097 4.554 1.00 . A A . 45 ILE N 1 1 1 745 1 1 45 ILE O O -7.771 10.139 6.553 1.00 . A A . 45 ILE O 1 1 1 746 1 1 46 LYS C C -6.628 11.322 8.550 1.00 . A A . 46 LYS C 1 1 1 747 1 1 46 LYS CA C -6.220 12.265 7.423 1.00 . A A . 46 LYS CA 1 1 1 748 1 1 46 LYS CB C -7.270 13.365 7.258 1.00 . A A . 46 LYS CB 1 1 1 749 1 1 46 LYS CD C -8.263 14.583 9.219 1.00 . A A . 46 LYS CD 1 1 1 750 1 1 46 LYS CE C -9.230 15.701 8.865 1.00 . A A . 46 LYS CE 1 1 1 751 1 1 46 LYS CG C -7.105 14.516 8.236 1.00 . A A . 46 LYS CG 1 1 1 752 1 1 46 LYS H H -5.329 11.798 5.561 1.00 . A A . 46 LYS H 1 1 1 753 1 1 46 LYS HA H -5.273 12.719 7.675 1.00 . A A . 46 LYS HA 1 1 1 754 1 1 46 LYS HB2 H -7.205 13.761 6.255 1.00 . A A . 46 LYS HB2 1 1 1 755 1 1 46 LYS HB3 H -8.251 12.935 7.403 1.00 . A A . 46 LYS HB3 1 1 1 756 1 1 46 LYS HD2 H -8.794 13.643 9.199 1.00 . A A . 46 LYS HD2 1 1 1 757 1 1 46 LYS HD3 H -7.872 14.757 10.210 1.00 . A A . 46 LYS HD3 1 1 1 758 1 1 46 LYS HE2 H -8.783 16.646 9.139 1.00 . A A . 46 LYS HE2 1 1 1 759 1 1 46 LYS HE3 H -9.407 15.683 7.800 1.00 . A A . 46 LYS HE3 1 1 1 760 1 1 46 LYS HG2 H -6.187 14.379 8.787 1.00 . A A . 46 LYS HG2 1 1 1 761 1 1 46 LYS HG3 H -7.060 15.443 7.682 1.00 . A A . 46 LYS HG3 1 1 1 762 1 1 46 LYS HZ1 H -11.171 16.332 9.309 1.00 . A A . 46 LYS HZ1 1 1 1 763 1 1 46 LYS HZ2 H -10.381 15.585 10.604 1.00 . A A . 46 LYS HZ2 1 1 1 764 1 1 46 LYS HZ3 H -10.976 14.651 9.326 1.00 . A A . 46 LYS HZ3 1 1 1 765 1 1 46 LYS N N -6.049 11.536 6.172 1.00 . A A . 46 LYS N 1 1 1 766 1 1 46 LYS NZ N -10.530 15.557 9.576 1.00 . A A . 46 LYS NZ 1 1 1 767 1 1 46 LYS O O -7.391 11.696 9.441 1.00 . A A . 46 LYS O 1 1 1 768 1 1 47 GLY C C -5.740 9.405 10.843 1.00 . A A . 47 GLY C 1 1 1 769 1 1 47 GLY CA C -6.437 9.119 9.528 1.00 . A A . 47 GLY CA 1 1 1 770 1 1 47 GLY H H -5.512 9.855 7.771 1.00 . A A . 47 GLY H 1 1 1 771 1 1 47 GLY HA2 H -7.505 9.124 9.690 1.00 . A A . 47 GLY HA2 1 1 1 772 1 1 47 GLY HA3 H -6.140 8.141 9.181 1.00 . A A . 47 GLY HA3 1 1 1 773 1 1 47 GLY N N -6.114 10.097 8.505 1.00 . A A . 47 GLY N 1 1 1 774 1 1 47 GLY O O -4.961 8.586 11.331 1.00 . A A . 47 GLY O 1 1 1 775 1 1 48 THR C C -3.967 11.399 12.486 1.00 . A A . 48 THR C 1 1 1 776 1 1 48 THR CA C -5.414 10.961 12.686 1.00 . A A . 48 THR CA 1 1 1 777 1 1 48 THR CB C -5.475 9.803 13.684 1.00 . A A . 48 THR CB 1 1 1 778 1 1 48 THR CG2 C -5.561 10.258 15.124 1.00 . A A . 48 THR CG2 1 1 1 779 1 1 48 THR H H -6.649 11.180 10.981 1.00 . A A . 48 THR H 1 1 1 780 1 1 48 THR HA H -5.979 11.793 13.080 1.00 . A A . 48 THR HA 1 1 1 781 1 1 48 THR HB H -4.582 9.204 13.579 1.00 . A A . 48 THR HB 1 1 1 782 1 1 48 THR HG1 H -6.310 8.066 13.334 1.00 . A A . 48 THR HG1 1 1 1 783 1 1 48 THR HG21 H -5.021 9.566 15.754 1.00 . A A . 48 THR HG21 1 1 1 784 1 1 48 THR HG22 H -6.596 10.291 15.430 1.00 . A A . 48 THR HG22 1 1 1 785 1 1 48 THR HG23 H -5.127 11.243 15.218 1.00 . A A . 48 THR HG23 1 1 1 786 1 1 48 THR N N -6.020 10.569 11.419 1.00 . A A . 48 THR N 1 1 1 787 1 1 48 THR O O -3.588 12.511 12.854 1.00 . A A . 48 THR O 1 1 1 788 1 1 48 THR OG1 O -6.597 8.977 13.426 1.00 . A A . 48 THR OG1 1 1 1 789 1 1 49 GLN C C -1.022 9.577 11.145 1.00 . A A . 49 GLN C 1 1 1 790 1 1 49 GLN CA C -1.758 10.814 11.650 1.00 . A A . 49 GLN CA 1 1 1 791 1 1 49 GLN CB C -1.090 11.334 12.924 1.00 . A A . 49 GLN CB 1 1 1 792 1 1 49 GLN CD C -0.752 13.421 14.306 1.00 . A A . 49 GLN CD 1 1 1 793 1 1 49 GLN CG C -0.839 12.833 12.912 1.00 . A A . 49 GLN CG 1 1 1 794 1 1 49 GLN H H -3.524 9.648 11.628 1.00 . A A . 49 GLN H 1 1 1 795 1 1 49 GLN HA H -1.710 11.581 10.891 1.00 . A A . 49 GLN HA 1 1 1 796 1 1 49 GLN HB2 H -1.723 11.104 13.768 1.00 . A A . 49 GLN HB2 1 1 1 797 1 1 49 GLN HB3 H -0.142 10.833 13.050 1.00 . A A . 49 GLN HB3 1 1 1 798 1 1 49 GLN HE21 H -0.098 11.686 15.024 1.00 . A A . 49 GLN HE21 1 1 1 799 1 1 49 GLN HE22 H -0.262 12.961 16.178 1.00 . A A . 49 GLN HE22 1 1 1 800 1 1 49 GLN HG2 H 0.091 13.025 12.398 1.00 . A A . 49 GLN HG2 1 1 1 801 1 1 49 GLN HG3 H -1.648 13.316 12.383 1.00 . A A . 49 GLN HG3 1 1 1 802 1 1 49 GLN N N -3.164 10.518 11.899 1.00 . A A . 49 GLN N 1 1 1 803 1 1 49 GLN NE2 N -0.328 12.607 15.266 1.00 . A A . 49 GLN NE2 1 1 1 804 1 1 49 GLN O O -0.025 9.154 11.729 1.00 . A A . 49 GLN O 1 1 1 805 1 1 49 GLN OE1 O -1.062 14.593 14.519 1.00 . A A . 49 GLN OE1 1 1 1 806 1 1 50 SER C C -1.612 7.423 8.174 1.00 . A A . 50 SER C 1 1 1 807 1 1 50 SER CA C -0.912 7.812 9.472 1.00 . A A . 50 SER CA 1 1 1 808 1 1 50 SER CB C -0.966 6.647 10.462 1.00 . A A . 50 SER CB 1 1 1 809 1 1 50 SER H H -2.319 9.385 9.635 1.00 . A A . 50 SER H 1 1 1 810 1 1 50 SER HA H 0.121 8.042 9.256 1.00 . A A . 50 SER HA 1 1 1 811 1 1 50 SER HB2 H -1.376 6.993 11.399 1.00 . A A . 50 SER HB2 1 1 1 812 1 1 50 SER HB3 H -1.593 5.865 10.061 1.00 . A A . 50 SER HB3 1 1 1 813 1 1 50 SER HG H 0.989 6.732 10.372 1.00 . A A . 50 SER HG 1 1 1 814 1 1 50 SER N N -1.522 9.001 10.056 1.00 . A A . 50 SER N 1 1 1 815 1 1 50 SER O O -2.291 8.241 7.554 1.00 . A A . 50 SER O 1 1 1 816 1 1 50 SER OG O 0.328 6.119 10.700 1.00 . A A . 50 SER OG 1 1 1 817 1 1 51 ASN C C -2.172 4.151 6.571 1.00 . A A . 51 ASN C 1 1 1 818 1 1 51 ASN CA C -2.056 5.672 6.543 1.00 . A A . 51 ASN CA 1 1 1 819 1 1 51 ASN CB C -1.241 6.110 5.324 1.00 . A A . 51 ASN CB 1 1 1 820 1 1 51 ASN CG C 0.077 5.369 5.213 1.00 . A A . 51 ASN CG 1 1 1 821 1 1 51 ASN H H -0.887 5.564 8.305 1.00 . A A . 51 ASN H 1 1 1 822 1 1 51 ASN HA H -3.046 6.096 6.474 1.00 . A A . 51 ASN HA 1 1 1 823 1 1 51 ASN HB2 H -1.815 5.921 4.429 1.00 . A A . 51 ASN HB2 1 1 1 824 1 1 51 ASN HB3 H -1.034 7.167 5.398 1.00 . A A . 51 ASN HB3 1 1 1 825 1 1 51 ASN HD21 H 1.063 7.091 5.089 1.00 . A A . 51 ASN HD21 1 1 1 826 1 1 51 ASN HD22 H 2.034 5.664 5.023 1.00 . A A . 51 ASN HD22 1 1 1 827 1 1 51 ASN N N -1.440 6.170 7.768 1.00 . A A . 51 ASN N 1 1 1 828 1 1 51 ASN ND2 N 1.168 6.117 5.096 1.00 . A A . 51 ASN ND2 1 1 1 829 1 1 51 ASN O O -2.036 3.528 7.624 1.00 . A A . 51 ASN O 1 1 1 830 1 1 51 ASN OD1 O 0.114 4.139 5.232 1.00 . A A . 51 ASN OD1 1 1 1 831 1 1 52 HIS C C -1.571 1.548 4.286 1.00 . A A . 52 HIS C 1 1 1 832 1 1 52 HIS CA C -2.560 2.112 5.300 1.00 . A A . 52 HIS CA 1 1 1 833 1 1 52 HIS CB C -3.989 1.741 4.897 1.00 . A A . 52 HIS CB 1 1 1 834 1 1 52 HIS CD2 C -5.834 3.485 4.367 1.00 . A A . 52 HIS CD2 1 1 1 835 1 1 52 HIS CE1 C -6.148 4.247 6.398 1.00 . A A . 52 HIS CE1 1 1 1 836 1 1 52 HIS CG C -4.991 2.815 5.187 1.00 . A A . 52 HIS CG 1 1 1 837 1 1 52 HIS H H -2.524 4.111 4.604 1.00 . A A . 52 HIS H 1 1 1 838 1 1 52 HIS HA H -2.347 1.687 6.269 1.00 . A A . 52 HIS HA 1 1 1 839 1 1 52 HIS HB2 H -4.015 1.541 3.837 1.00 . A A . 52 HIS HB2 1 1 1 840 1 1 52 HIS HB3 H -4.287 0.852 5.434 1.00 . A A . 52 HIS HB3 1 1 1 841 1 1 52 HIS HD1 H -4.752 3.031 7.270 1.00 . A A . 52 HIS HD1 1 1 1 842 1 1 52 HIS HD2 H -5.932 3.350 3.298 1.00 . A A . 52 HIS HD2 1 1 1 843 1 1 52 HIS HE1 H -6.526 4.813 7.237 1.00 . A A . 52 HIS HE1 1 1 1 844 1 1 52 HIS HE2 H -7.163 5.049 4.811 1.00 . A A . 52 HIS HE2 1 1 1 845 1 1 52 HIS N N -2.426 3.560 5.408 1.00 . A A . 52 HIS N 1 1 1 846 1 1 52 HIS ND1 N -5.212 3.316 6.453 1.00 . A A . 52 HIS ND1 1 1 1 847 1 1 52 HIS NE2 N -6.541 4.369 5.144 1.00 . A A . 52 HIS NE2 1 1 1 848 1 1 52 HIS O O -1.713 1.757 3.082 1.00 . A A . 52 HIS O 1 1 1 849 1 1 53 VAL C C 0.035 -1.161 3.471 1.00 . A A . 53 VAL C 1 1 1 850 1 1 53 VAL CA C 0.447 0.237 3.920 1.00 . A A . 53 VAL CA 1 1 1 851 1 1 53 VAL CB C 1.811 0.154 4.630 1.00 . A A . 53 VAL CB 1 1 1 852 1 1 53 VAL CG1 C 1.771 -0.879 5.745 1.00 . A A . 53 VAL CG1 1 1 1 853 1 1 53 VAL CG2 C 2.913 -0.170 3.632 1.00 . A A . 53 VAL CG2 1 1 1 854 1 1 53 VAL H H -0.507 0.700 5.752 1.00 . A A . 53 VAL H 1 1 1 855 1 1 53 VAL HA H 0.555 0.867 3.049 1.00 . A A . 53 VAL HA 1 1 1 856 1 1 53 VAL HB H 2.024 1.117 5.069 1.00 . A A . 53 VAL HB 1 1 1 857 1 1 53 VAL HG11 H 1.822 -1.870 5.320 1.00 . A A . 53 VAL HG11 1 1 1 858 1 1 53 VAL HG12 H 0.851 -0.772 6.302 1.00 . A A . 53 VAL HG12 1 1 1 859 1 1 53 VAL HG13 H 2.611 -0.727 6.407 1.00 . A A . 53 VAL HG13 1 1 1 860 1 1 53 VAL HG21 H 3.447 -1.050 3.959 1.00 . A A . 53 VAL HG21 1 1 1 861 1 1 53 VAL HG22 H 3.597 0.663 3.569 1.00 . A A . 53 VAL HG22 1 1 1 862 1 1 53 VAL HG23 H 2.477 -0.352 2.661 1.00 . A A . 53 VAL HG23 1 1 1 863 1 1 53 VAL N N -0.567 0.832 4.782 1.00 . A A . 53 VAL N 1 1 1 864 1 1 53 VAL O O -0.098 -2.072 4.288 1.00 . A A . 53 VAL O 1 1 1 865 1 1 54 LEU C C 0.570 -3.221 0.791 1.00 . A A . 54 LEU C 1 1 1 866 1 1 54 LEU CA C -0.563 -2.610 1.609 1.00 . A A . 54 LEU CA 1 1 1 867 1 1 54 LEU CB C -1.809 -2.449 0.736 1.00 . A A . 54 LEU CB 1 1 1 868 1 1 54 LEU CD1 C -4.304 -2.581 0.528 1.00 . A A . 54 LEU CD1 1 1 1 869 1 1 54 LEU CD2 C -3.163 -3.587 2.512 1.00 . A A . 54 LEU CD2 1 1 1 870 1 1 54 LEU CG C -3.137 -2.456 1.495 1.00 . A A . 54 LEU CG 1 1 1 871 1 1 54 LEU H H -0.045 -0.559 1.566 1.00 . A A . 54 LEU H 1 1 1 872 1 1 54 LEU HA H -0.794 -3.271 2.432 1.00 . A A . 54 LEU HA 1 1 1 873 1 1 54 LEU HB2 H -1.729 -1.515 0.200 1.00 . A A . 54 LEU HB2 1 1 1 874 1 1 54 LEU HB3 H -1.827 -3.256 0.019 1.00 . A A . 54 LEU HB3 1 1 1 875 1 1 54 LEU HD11 H -4.220 -3.507 -0.021 1.00 . A A . 54 LEU HD11 1 1 1 876 1 1 54 LEU HD12 H -4.289 -1.751 -0.163 1.00 . A A . 54 LEU HD12 1 1 1 877 1 1 54 LEU HD13 H -5.232 -2.572 1.080 1.00 . A A . 54 LEU HD13 1 1 1 878 1 1 54 LEU HD21 H -2.885 -3.204 3.483 1.00 . A A . 54 LEU HD21 1 1 1 879 1 1 54 LEU HD22 H -2.463 -4.355 2.215 1.00 . A A . 54 LEU HD22 1 1 1 880 1 1 54 LEU HD23 H -4.157 -4.005 2.561 1.00 . A A . 54 LEU HD23 1 1 1 881 1 1 54 LEU HG H -3.244 -1.523 2.028 1.00 . A A . 54 LEU HG 1 1 1 882 1 1 54 LEU N N -0.166 -1.323 2.167 1.00 . A A . 54 LEU N 1 1 1 883 1 1 54 LEU O O 1.455 -2.513 0.312 1.00 . A A . 54 LEU O 1 1 1 884 1 1 55 PHE C C 1.001 -5.753 -1.451 1.00 . A A . 55 PHE C 1 1 1 885 1 1 55 PHE CA C 1.560 -5.247 -0.125 1.00 . A A . 55 PHE CA 1 1 1 886 1 1 55 PHE CB C 2.112 -6.419 0.689 1.00 . A A . 55 PHE CB 1 1 1 887 1 1 55 PHE CD1 C 4.407 -6.177 -0.296 1.00 . A A . 55 PHE CD1 1 1 1 888 1 1 55 PHE CD2 C 3.529 -8.374 0.005 1.00 . A A . 55 PHE CD2 1 1 1 889 1 1 55 PHE CE1 C 5.570 -6.710 -0.818 1.00 . A A . 55 PHE CE1 1 1 1 890 1 1 55 PHE CE2 C 4.689 -8.913 -0.517 1.00 . A A . 55 PHE CE2 1 1 1 891 1 1 55 PHE CG C 3.375 -7.002 0.121 1.00 . A A . 55 PHE CG 1 1 1 892 1 1 55 PHE CZ C 5.711 -8.080 -0.929 1.00 . A A . 55 PHE CZ 1 1 1 893 1 1 55 PHE H H -0.196 -5.051 1.041 1.00 . A A . 55 PHE H 1 1 1 894 1 1 55 PHE HA H 2.360 -4.552 -0.328 1.00 . A A . 55 PHE HA 1 1 1 895 1 1 55 PHE HB2 H 2.324 -6.082 1.693 1.00 . A A . 55 PHE HB2 1 1 1 896 1 1 55 PHE HB3 H 1.370 -7.203 0.726 1.00 . A A . 55 PHE HB3 1 1 1 897 1 1 55 PHE HD1 H 4.298 -5.106 -0.209 1.00 . A A . 55 PHE HD1 1 1 1 898 1 1 55 PHE HD2 H 2.730 -9.026 0.327 1.00 . A A . 55 PHE HD2 1 1 1 899 1 1 55 PHE HE1 H 6.368 -6.057 -1.140 1.00 . A A . 55 PHE HE1 1 1 1 900 1 1 55 PHE HE2 H 4.797 -9.984 -0.603 1.00 . A A . 55 PHE HE2 1 1 1 901 1 1 55 PHE HZ H 6.619 -8.499 -1.337 1.00 . A A . 55 PHE HZ 1 1 1 902 1 1 55 PHE N N 0.535 -4.541 0.635 1.00 . A A . 55 PHE N 1 1 1 903 1 1 55 PHE O O 0.216 -6.701 -1.484 1.00 . A A . 55 PHE O 1 1 1 904 1 1 56 LEU C C 1.658 -6.765 -4.346 1.00 . A A . 56 LEU C 1 1 1 905 1 1 56 LEU CA C 0.950 -5.500 -3.871 1.00 . A A . 56 LEU CA 1 1 1 906 1 1 56 LEU CB C 1.190 -4.364 -4.867 1.00 . A A . 56 LEU CB 1 1 1 907 1 1 56 LEU CD1 C 0.927 -1.953 -5.502 1.00 . A A . 56 LEU CD1 1 1 1 908 1 1 56 LEU CD2 C -0.906 -3.126 -4.270 1.00 . A A . 56 LEU CD2 1 1 1 909 1 1 56 LEU CG C 0.599 -3.012 -4.462 1.00 . A A . 56 LEU CG 1 1 1 910 1 1 56 LEU H H 2.036 -4.367 -2.452 1.00 . A A . 56 LEU H 1 1 1 911 1 1 56 LEU HA H -0.110 -5.696 -3.811 1.00 . A A . 56 LEU HA 1 1 1 912 1 1 56 LEU HB2 H 2.257 -4.244 -4.993 1.00 . A A . 56 LEU HB2 1 1 1 913 1 1 56 LEU HB3 H 0.762 -4.648 -5.816 1.00 . A A . 56 LEU HB3 1 1 1 914 1 1 56 LEU HD11 H 0.555 -0.995 -5.170 1.00 . A A . 56 LEU HD11 1 1 1 915 1 1 56 LEU HD12 H 0.462 -2.214 -6.441 1.00 . A A . 56 LEU HD12 1 1 1 916 1 1 56 LEU HD13 H 1.998 -1.897 -5.634 1.00 . A A . 56 LEU HD13 1 1 1 917 1 1 56 LEU HD21 H -1.295 -2.185 -3.911 1.00 . A A . 56 LEU HD21 1 1 1 918 1 1 56 LEU HD22 H -1.120 -3.903 -3.551 1.00 . A A . 56 LEU HD22 1 1 1 919 1 1 56 LEU HD23 H -1.371 -3.372 -5.214 1.00 . A A . 56 LEU HD23 1 1 1 920 1 1 56 LEU HG H 1.034 -2.703 -3.522 1.00 . A A . 56 LEU HG 1 1 1 921 1 1 56 LEU N N 1.410 -5.115 -2.542 1.00 . A A . 56 LEU N 1 1 1 922 1 1 56 LEU O O 2.701 -6.698 -4.996 1.00 . A A . 56 LEU O 1 1 1 923 1 1 57 SER C C 1.786 -9.295 -5.928 1.00 . A A . 57 SER C 1 1 1 924 1 1 57 SER CA C 1.658 -9.199 -4.411 1.00 . A A . 57 SER CA 1 1 1 925 1 1 57 SER CB C 0.798 -10.350 -3.887 1.00 . A A . 57 SER CB 1 1 1 926 1 1 57 SER H H 0.251 -7.906 -3.499 1.00 . A A . 57 SER H 1 1 1 927 1 1 57 SER HA H 2.642 -9.268 -3.973 1.00 . A A . 57 SER HA 1 1 1 928 1 1 57 SER HB2 H -0.115 -9.954 -3.469 1.00 . A A . 57 SER HB2 1 1 1 929 1 1 57 SER HB3 H 0.561 -11.019 -4.701 1.00 . A A . 57 SER HB3 1 1 1 930 1 1 57 SER HG H 1.650 -11.972 -3.192 1.00 . A A . 57 SER HG 1 1 1 931 1 1 57 SER N N 1.082 -7.918 -4.018 1.00 . A A . 57 SER N 1 1 1 932 1 1 57 SER O O 2.893 -9.320 -6.467 1.00 . A A . 57 SER O 1 1 1 933 1 1 57 SER OG O 1.480 -11.079 -2.881 1.00 . A A . 57 SER OG 1 1 1 934 1 1 58 SER C C -0.426 -8.517 -8.660 1.00 . A A . 58 SER C 1 1 1 935 1 1 58 SER CA C 0.633 -9.440 -8.066 1.00 . A A . 58 SER CA 1 1 1 936 1 1 58 SER CB C 0.371 -10.883 -8.503 1.00 . A A . 58 SER CB 1 1 1 937 1 1 58 SER H H -0.203 -9.323 -6.125 1.00 . A A . 58 SER H 1 1 1 938 1 1 58 SER HA H 1.603 -9.135 -8.427 1.00 . A A . 58 SER HA 1 1 1 939 1 1 58 SER HB2 H 0.269 -11.509 -7.629 1.00 . A A . 58 SER HB2 1 1 1 940 1 1 58 SER HB3 H -0.540 -10.921 -9.082 1.00 . A A . 58 SER HB3 1 1 1 941 1 1 58 SER HG H 2.023 -11.907 -8.750 1.00 . A A . 58 SER HG 1 1 1 942 1 1 58 SER N N 0.648 -9.347 -6.611 1.00 . A A . 58 SER N 1 1 1 943 1 1 58 SER O O -1.625 -8.745 -8.496 1.00 . A A . 58 SER O 1 1 1 944 1 1 58 SER OG O 1.437 -11.377 -9.296 1.00 . A A . 58 SER OG 1 1 1 945 1 1 59 TYR C C -0.853 -6.638 -11.487 1.00 . A A . 59 TYR C 1 1 1 946 1 1 59 TYR CA C -0.884 -6.515 -9.967 1.00 . A A . 59 TYR CA 1 1 1 947 1 1 59 TYR CB C -0.515 -5.090 -9.551 1.00 . A A . 59 TYR CB 1 1 1 948 1 1 59 TYR CD1 C -2.441 -4.093 -8.259 1.00 . A A . 59 TYR CD1 1 1 1 949 1 1 59 TYR CD2 C -2.094 -3.364 -10.502 1.00 . A A . 59 TYR CD2 1 1 1 950 1 1 59 TYR CE1 C -3.530 -3.249 -8.149 1.00 . A A . 59 TYR CE1 1 1 1 951 1 1 59 TYR CE2 C -3.181 -2.518 -10.400 1.00 . A A . 59 TYR CE2 1 1 1 952 1 1 59 TYR CG C -1.706 -4.165 -9.435 1.00 . A A . 59 TYR CG 1 1 1 953 1 1 59 TYR CZ C -3.896 -2.464 -9.222 1.00 . A A . 59 TYR CZ 1 1 1 954 1 1 59 TYR H H 0.992 -7.346 -9.444 1.00 . A A . 59 TYR H 1 1 1 955 1 1 59 TYR HA H -1.882 -6.735 -9.620 1.00 . A A . 59 TYR HA 1 1 1 956 1 1 59 TYR HB2 H -0.023 -5.119 -8.590 1.00 . A A . 59 TYR HB2 1 1 1 957 1 1 59 TYR HB3 H 0.161 -4.673 -10.284 1.00 . A A . 59 TYR HB3 1 1 1 958 1 1 59 TYR HD1 H -2.152 -4.709 -7.420 1.00 . A A . 59 TYR HD1 1 1 1 959 1 1 59 TYR HD2 H -1.532 -3.409 -11.424 1.00 . A A . 59 TYR HD2 1 1 1 960 1 1 59 TYR HE1 H -4.090 -3.207 -7.226 1.00 . A A . 59 TYR HE1 1 1 1 961 1 1 59 TYR HE2 H -3.467 -1.903 -11.241 1.00 . A A . 59 TYR HE2 1 1 1 962 1 1 59 TYR HH H -5.273 -1.590 -8.203 1.00 . A A . 59 TYR HH 1 1 1 963 1 1 59 TYR N N 0.025 -7.474 -9.349 1.00 . A A . 59 TYR N 1 1 1 964 1 1 59 TYR O O 0.187 -6.438 -12.115 1.00 . A A . 59 TYR O 1 1 1 965 1 1 59 TYR OH O -4.979 -1.622 -9.117 1.00 . A A . 59 TYR OH 1 1 1 966 1 1 60 ASN C C -2.587 -5.824 -14.166 1.00 . A A . 60 ASN C 1 1 1 967 1 1 60 ASN CA C -2.103 -7.118 -13.519 1.00 . A A . 60 ASN CA 1 1 1 968 1 1 60 ASN CB C -3.056 -8.263 -13.867 1.00 . A A . 60 ASN CB 1 1 1 969 1 1 60 ASN CG C -2.483 -9.621 -13.511 1.00 . A A . 60 ASN CG 1 1 1 970 1 1 60 ASN H H -2.794 -7.116 -11.518 1.00 . A A . 60 ASN H 1 1 1 971 1 1 60 ASN HA H -1.120 -7.351 -13.900 1.00 . A A . 60 ASN HA 1 1 1 972 1 1 60 ASN HB2 H -3.981 -8.131 -13.326 1.00 . A A . 60 ASN HB2 1 1 1 973 1 1 60 ASN HB3 H -3.258 -8.245 -14.928 1.00 . A A . 60 ASN HB3 1 1 1 974 1 1 60 ASN HD21 H -3.055 -10.352 -15.269 1.00 . A A . 60 ASN HD21 1 1 1 975 1 1 60 ASN HD22 H -2.246 -11.462 -14.222 1.00 . A A . 60 ASN HD22 1 1 1 976 1 1 60 ASN N N -1.999 -6.969 -12.072 1.00 . A A . 60 ASN N 1 1 1 977 1 1 60 ASN ND2 N -2.607 -10.575 -14.427 1.00 . A A . 60 ASN ND2 1 1 1 978 1 1 60 ASN O O -1.784 -4.979 -14.561 1.00 . A A . 60 ASN O 1 1 1 979 1 1 60 ASN OD1 O -1.934 -9.810 -12.425 1.00 . A A . 60 ASN OD1 1 1 1 980 1 1 61 SER C C -5.986 -4.685 -15.119 1.00 . A A . 61 SER C 1 1 1 981 1 1 61 SER CA C -4.494 -4.487 -14.870 1.00 . A A . 61 SER CA 1 1 1 982 1 1 61 SER CB C -3.787 -4.147 -16.184 1.00 . A A . 61 SER CB 1 1 1 983 1 1 61 SER H H -4.492 -6.387 -13.938 1.00 . A A . 61 SER H 1 1 1 984 1 1 61 SER HA H -4.362 -3.668 -14.179 1.00 . A A . 61 SER HA 1 1 1 985 1 1 61 SER HB2 H -4.524 -3.900 -16.934 1.00 . A A . 61 SER HB2 1 1 1 986 1 1 61 SER HB3 H -3.133 -3.301 -16.030 1.00 . A A . 61 SER HB3 1 1 1 987 1 1 61 SER HG H -3.463 -5.658 -17.387 1.00 . A A . 61 SER HG 1 1 1 988 1 1 61 SER N N -3.903 -5.678 -14.271 1.00 . A A . 61 SER N 1 1 1 989 1 1 61 SER O O -6.453 -4.596 -16.254 1.00 . A A . 61 SER O 1 1 1 990 1 1 61 SER OG O -3.016 -5.242 -16.647 1.00 . A A . 61 SER OG 1 1 1 991 1 1 62 VAL C C -8.903 -4.508 -12.990 1.00 . A A . 62 VAL C 1 1 1 992 1 1 62 VAL CA C -8.166 -5.166 -14.152 1.00 . A A . 62 VAL CA 1 1 1 993 1 1 62 VAL CB C -8.514 -6.666 -14.180 1.00 . A A . 62 VAL CB 1 1 1 994 1 1 62 VAL CG1 C -7.629 -7.402 -15.174 1.00 . A A . 62 VAL CG1 1 1 1 995 1 1 62 VAL CG2 C -8.383 -7.270 -12.790 1.00 . A A . 62 VAL CG2 1 1 1 996 1 1 62 VAL H H -6.297 -5.013 -13.172 1.00 . A A . 62 VAL H 1 1 1 997 1 1 62 VAL HA H -8.504 -4.722 -15.078 1.00 . A A . 62 VAL HA 1 1 1 998 1 1 62 VAL HB H -9.540 -6.772 -14.500 1.00 . A A . 62 VAL HB 1 1 1 999 1 1 62 VAL HG11 H -7.570 -6.835 -16.092 1.00 . A A . 62 VAL HG11 1 1 1 1000 1 1 62 VAL HG12 H -8.049 -8.375 -15.379 1.00 . A A . 62 VAL HG12 1 1 1 1001 1 1 62 VAL HG13 H -6.639 -7.518 -14.759 1.00 . A A . 62 VAL HG13 1 1 1 1002 1 1 62 VAL HG21 H -7.373 -7.137 -12.433 1.00 . A A . 62 VAL HG21 1 1 1 1003 1 1 62 VAL HG22 H -8.614 -8.324 -12.833 1.00 . A A . 62 VAL HG22 1 1 1 1004 1 1 62 VAL HG23 H -9.070 -6.778 -12.118 1.00 . A A . 62 VAL HG23 1 1 1 1005 1 1 62 VAL N N -6.728 -4.955 -14.050 1.00 . A A . 62 VAL N 1 1 1 1006 1 1 62 VAL O O -8.460 -4.576 -11.844 1.00 . A A . 62 VAL O 1 1 1 1007 1 1 63 ASP C C -10.825 -3.994 -10.973 1.00 . A A . 63 ASP C 1 1 1 1008 1 1 63 ASP CA C -10.826 -3.200 -12.275 1.00 . A A . 63 ASP CA 1 1 1 1009 1 1 63 ASP CB C -12.262 -3.007 -12.767 1.00 . A A . 63 ASP CB 1 1 1 1010 1 1 63 ASP CG C -12.455 -1.685 -13.484 1.00 . A A . 63 ASP CG 1 1 1 1011 1 1 63 ASP H H -10.330 -3.851 -14.227 1.00 . A A . 63 ASP H 1 1 1 1012 1 1 63 ASP HA H -10.385 -2.231 -12.093 1.00 . A A . 63 ASP HA 1 1 1 1013 1 1 63 ASP HB2 H -12.513 -3.805 -13.449 1.00 . A A . 63 ASP HB2 1 1 1 1014 1 1 63 ASP HB3 H -12.933 -3.038 -11.921 1.00 . A A . 63 ASP HB3 1 1 1 1015 1 1 63 ASP N N -10.028 -3.871 -13.295 1.00 . A A . 63 ASP N 1 1 1 1016 1 1 63 ASP O O -10.765 -3.421 -9.885 1.00 . A A . 63 ASP O 1 1 1 1017 1 1 63 ASP OD1 O -11.486 -0.901 -13.555 1.00 . A A . 63 ASP OD1 1 1 1 1018 1 1 63 ASP OD2 O -13.576 -1.435 -13.976 1.00 . A A . 63 ASP OD2 1 1 1 1019 1 1 64 GLU C C -9.872 -5.725 -8.893 1.00 . A A . 64 GLU C 1 1 1 1020 1 1 64 GLU CA C -10.897 -6.188 -9.924 1.00 . A A . 64 GLU CA 1 1 1 1021 1 1 64 GLU CB C -10.604 -7.632 -10.338 1.00 . A A . 64 GLU CB 1 1 1 1022 1 1 64 GLU CD C -11.221 -10.035 -9.862 1.00 . A A . 64 GLU CD 1 1 1 1023 1 1 64 GLU CG C -10.978 -8.656 -9.280 1.00 . A A . 64 GLU CG 1 1 1 1024 1 1 64 GLU H H -10.937 -5.714 -11.986 1.00 . A A . 64 GLU H 1 1 1 1025 1 1 64 GLU HA H -11.881 -6.143 -9.481 1.00 . A A . 64 GLU HA 1 1 1 1026 1 1 64 GLU HB2 H -11.159 -7.856 -11.237 1.00 . A A . 64 GLU HB2 1 1 1 1027 1 1 64 GLU HB3 H -9.548 -7.728 -10.545 1.00 . A A . 64 GLU HB3 1 1 1 1028 1 1 64 GLU HG2 H -10.174 -8.723 -8.562 1.00 . A A . 64 GLU HG2 1 1 1 1029 1 1 64 GLU HG3 H -11.878 -8.328 -8.781 1.00 . A A . 64 GLU HG3 1 1 1 1030 1 1 64 GLU N N -10.891 -5.316 -11.092 1.00 . A A . 64 GLU N 1 1 1 1031 1 1 64 GLU O O -10.175 -5.625 -7.704 1.00 . A A . 64 GLU O 1 1 1 1032 1 1 64 GLU OE1 O -12.158 -10.179 -10.675 1.00 . A A . 64 GLU OE1 1 1 1 1033 1 1 64 GLU OE2 O -10.473 -10.970 -9.507 1.00 . A A . 64 GLU OE2 1 1 1 1034 1 1 65 ILE C C -7.720 -3.502 -8.175 1.00 . A A . 65 ILE C 1 1 1 1035 1 1 65 ILE CA C -7.590 -4.991 -8.476 1.00 . A A . 65 ILE CA 1 1 1 1036 1 1 65 ILE CB C -6.203 -5.259 -9.091 1.00 . A A . 65 ILE CB 1 1 1 1037 1 1 65 ILE CD1 C -4.830 -4.803 -11.185 1.00 . A A . 65 ILE CD1 1 1 1 1038 1 1 65 ILE CG1 C -6.214 -4.941 -10.587 1.00 . A A . 65 ILE CG1 1 1 1 1039 1 1 65 ILE CG2 C -5.789 -6.703 -8.853 1.00 . A A . 65 ILE CG2 1 1 1 1040 1 1 65 ILE H H -8.479 -5.543 -10.316 1.00 . A A . 65 ILE H 1 1 1 1041 1 1 65 ILE HA H -7.664 -5.543 -7.551 1.00 . A A . 65 ILE HA 1 1 1 1042 1 1 65 ILE HB H -5.486 -4.619 -8.599 1.00 . A A . 65 ILE HB 1 1 1 1043 1 1 65 ILE HD11 H -4.759 -3.863 -11.713 1.00 . A A . 65 ILE HD11 1 1 1 1044 1 1 65 ILE HD12 H -4.653 -5.616 -11.872 1.00 . A A . 65 ILE HD12 1 1 1 1045 1 1 65 ILE HD13 H -4.093 -4.830 -10.396 1.00 . A A . 65 ILE HD13 1 1 1 1046 1 1 65 ILE HG12 H -6.724 -5.733 -11.114 1.00 . A A . 65 ILE HG12 1 1 1 1047 1 1 65 ILE HG13 H -6.740 -4.011 -10.747 1.00 . A A . 65 ILE HG13 1 1 1 1048 1 1 65 ILE HG21 H -4.830 -6.884 -9.317 1.00 . A A . 65 ILE HG21 1 1 1 1049 1 1 65 ILE HG22 H -6.526 -7.365 -9.283 1.00 . A A . 65 ILE HG22 1 1 1 1050 1 1 65 ILE HG23 H -5.716 -6.887 -7.792 1.00 . A A . 65 ILE HG23 1 1 1 1051 1 1 65 ILE N N -8.659 -5.444 -9.357 1.00 . A A . 65 ILE N 1 1 1 1052 1 1 65 ILE O O -7.416 -3.053 -7.069 1.00 . A A . 65 ILE O 1 1 1 1053 1 1 66 ARG C C -9.384 -0.991 -7.934 1.00 . A A . 66 ARG C 1 1 1 1054 1 1 66 ARG CA C -8.343 -1.301 -9.006 1.00 . A A . 66 ARG CA 1 1 1 1055 1 1 66 ARG CB C -8.758 -0.665 -10.334 1.00 . A A . 66 ARG CB 1 1 1 1056 1 1 66 ARG CD C -8.491 1.322 -11.849 1.00 . A A . 66 ARG CD 1 1 1 1057 1 1 66 ARG CG C -8.465 0.824 -10.413 1.00 . A A . 66 ARG CG 1 1 1 1058 1 1 66 ARG CZ C -10.325 2.956 -11.971 1.00 . A A . 66 ARG CZ 1 1 1 1059 1 1 66 ARG H H -8.399 -3.156 -10.023 1.00 . A A . 66 ARG H 1 1 1 1060 1 1 66 ARG HA H -7.394 -0.887 -8.700 1.00 . A A . 66 ARG HA 1 1 1 1061 1 1 66 ARG HB2 H -8.228 -1.157 -11.136 1.00 . A A . 66 ARG HB2 1 1 1 1062 1 1 66 ARG HB3 H -9.819 -0.809 -10.473 1.00 . A A . 66 ARG HB3 1 1 1 1063 1 1 66 ARG HD2 H -7.484 1.313 -12.238 1.00 . A A . 66 ARG HD2 1 1 1 1064 1 1 66 ARG HD3 H -9.108 0.657 -12.436 1.00 . A A . 66 ARG HD3 1 1 1 1065 1 1 66 ARG HE H -8.384 3.415 -12.004 1.00 . A A . 66 ARG HE 1 1 1 1066 1 1 66 ARG HG2 H -9.212 1.359 -9.845 1.00 . A A . 66 ARG HG2 1 1 1 1067 1 1 66 ARG HG3 H -7.488 1.012 -9.994 1.00 . A A . 66 ARG HG3 1 1 1 1068 1 1 66 ARG HH11 H -10.912 1.027 -11.828 1.00 . A A . 66 ARG HH11 1 1 1 1069 1 1 66 ARG HH12 H -12.194 2.189 -11.915 1.00 . A A . 66 ARG HH12 1 1 1 1070 1 1 66 ARG HH21 H -10.063 4.955 -12.118 1.00 . A A . 66 ARG HH21 1 1 1 1071 1 1 66 ARG HH22 H -11.711 4.422 -12.080 1.00 . A A . 66 ARG HH22 1 1 1 1072 1 1 66 ARG N N -8.173 -2.740 -9.165 1.00 . A A . 66 ARG N 1 1 1 1073 1 1 66 ARG NE N -9.026 2.677 -11.950 1.00 . A A . 66 ARG NE 1 1 1 1074 1 1 66 ARG NH1 N -11.217 1.977 -11.899 1.00 . A A . 66 ARG NH1 1 1 1 1075 1 1 66 ARG NH2 N -10.733 4.214 -12.064 1.00 . A A . 66 ARG NH2 1 1 1 1076 1 1 66 ARG O O -9.180 -0.116 -7.092 1.00 . A A . 66 ARG O 1 1 1 1077 1 1 67 LYS C C -11.098 -1.852 -5.592 1.00 . A A . 67 LYS C 1 1 1 1078 1 1 67 LYS CA C -11.570 -1.517 -7.003 1.00 . A A . 67 LYS CA 1 1 1 1079 1 1 67 LYS CB C -12.779 -2.381 -7.367 1.00 . A A . 67 LYS CB 1 1 1 1080 1 1 67 LYS CD C -15.019 -2.416 -8.505 1.00 . A A . 67 LYS CD 1 1 1 1081 1 1 67 LYS CE C -16.420 -1.831 -8.414 1.00 . A A . 67 LYS CE 1 1 1 1082 1 1 67 LYS CG C -14.014 -1.574 -7.735 1.00 . A A . 67 LYS CG 1 1 1 1083 1 1 67 LYS H H -10.601 -2.397 -8.667 1.00 . A A . 67 LYS H 1 1 1 1084 1 1 67 LYS HA H -11.859 -0.477 -7.036 1.00 . A A . 67 LYS HA 1 1 1 1085 1 1 67 LYS HB2 H -12.520 -3.006 -8.208 1.00 . A A . 67 LYS HB2 1 1 1 1086 1 1 67 LYS HB3 H -13.025 -3.009 -6.524 1.00 . A A . 67 LYS HB3 1 1 1 1087 1 1 67 LYS HD2 H -14.723 -2.454 -9.542 1.00 . A A . 67 LYS HD2 1 1 1 1088 1 1 67 LYS HD3 H -15.028 -3.414 -8.094 1.00 . A A . 67 LYS HD3 1 1 1 1089 1 1 67 LYS HE2 H -16.457 -1.147 -7.580 1.00 . A A . 67 LYS HE2 1 1 1 1090 1 1 67 LYS HE3 H -16.632 -1.296 -9.328 1.00 . A A . 67 LYS HE3 1 1 1 1091 1 1 67 LYS HG2 H -14.480 -1.214 -6.830 1.00 . A A . 67 LYS HG2 1 1 1 1092 1 1 67 LYS HG3 H -13.715 -0.736 -8.347 1.00 . A A . 67 LYS HG3 1 1 1 1093 1 1 67 LYS HZ1 H -18.133 -2.592 -7.493 1.00 . A A . 67 LYS HZ1 1 1 1 1094 1 1 67 LYS HZ2 H -17.002 -3.775 -7.918 1.00 . A A . 67 LYS HZ2 1 1 1 1095 1 1 67 LYS HZ3 H -17.961 -3.057 -9.111 1.00 . A A . 67 LYS HZ3 1 1 1 1096 1 1 67 LYS N N -10.498 -1.714 -7.972 1.00 . A A . 67 LYS N 1 1 1 1097 1 1 67 LYS NZ N -17.451 -2.888 -8.220 1.00 . A A . 67 LYS NZ 1 1 1 1098 1 1 67 LYS O O -11.328 -1.090 -4.653 1.00 . A A . 67 LYS O 1 1 1 1099 1 1 68 GLU C C -9.182 -2.300 -3.454 1.00 . A A . 68 GLU C 1 1 1 1100 1 1 68 GLU CA C -9.930 -3.430 -4.155 1.00 . A A . 68 GLU CA 1 1 1 1101 1 1 68 GLU CB C -9.008 -4.640 -4.323 1.00 . A A . 68 GLU CB 1 1 1 1102 1 1 68 GLU CD C -9.037 -7.022 -3.484 1.00 . A A . 68 GLU CD 1 1 1 1103 1 1 68 GLU CG C -8.976 -5.554 -3.109 1.00 . A A . 68 GLU CG 1 1 1 1104 1 1 68 GLU H H -10.282 -3.559 -6.238 1.00 . A A . 68 GLU H 1 1 1 1105 1 1 68 GLU HA H -10.776 -3.716 -3.548 1.00 . A A . 68 GLU HA 1 1 1 1106 1 1 68 GLU HB2 H -9.341 -5.216 -5.173 1.00 . A A . 68 GLU HB2 1 1 1 1107 1 1 68 GLU HB3 H -8.003 -4.289 -4.509 1.00 . A A . 68 GLU HB3 1 1 1 1108 1 1 68 GLU HG2 H -8.061 -5.376 -2.564 1.00 . A A . 68 GLU HG2 1 1 1 1109 1 1 68 GLU HG3 H -9.821 -5.322 -2.478 1.00 . A A . 68 GLU HG3 1 1 1 1110 1 1 68 GLU N N -10.435 -2.995 -5.451 1.00 . A A . 68 GLU N 1 1 1 1111 1 1 68 GLU O O -9.546 -1.892 -2.351 1.00 . A A . 68 GLU O 1 1 1 1112 1 1 68 GLU OE1 O -7.968 -7.613 -3.746 1.00 . A A . 68 GLU OE1 1 1 1 1113 1 1 68 GLU OE2 O -10.154 -7.580 -3.516 1.00 . A A . 68 GLU OE2 1 1 1 1114 1 1 69 LEU C C -8.221 0.463 -3.144 1.00 . A A . 69 LEU C 1 1 1 1115 1 1 69 LEU CA C -7.337 -0.715 -3.542 1.00 . A A . 69 LEU CA 1 1 1 1116 1 1 69 LEU CB C -6.281 -0.258 -4.550 1.00 . A A . 69 LEU CB 1 1 1 1117 1 1 69 LEU CD1 C -4.328 -1.276 -3.352 1.00 . A A . 69 LEU CD1 1 1 1 1118 1 1 69 LEU CD2 C -3.955 0.542 -5.029 1.00 . A A . 69 LEU CD2 1 1 1 1119 1 1 69 LEU CG C -4.893 -0.002 -3.961 1.00 . A A . 69 LEU CG 1 1 1 1120 1 1 69 LEU H H -7.895 -2.166 -4.979 1.00 . A A . 69 LEU H 1 1 1 1121 1 1 69 LEU HA H -6.841 -1.092 -2.660 1.00 . A A . 69 LEU HA 1 1 1 1122 1 1 69 LEU HB2 H -6.192 -1.016 -5.314 1.00 . A A . 69 LEU HB2 1 1 1 1123 1 1 69 LEU HB3 H -6.625 0.655 -5.011 1.00 . A A . 69 LEU HB3 1 1 1 1124 1 1 69 LEU HD11 H -4.960 -1.595 -2.537 1.00 . A A . 69 LEU HD11 1 1 1 1125 1 1 69 LEU HD12 H -3.331 -1.087 -2.982 1.00 . A A . 69 LEU HD12 1 1 1 1126 1 1 69 LEU HD13 H -4.292 -2.049 -4.105 1.00 . A A . 69 LEU HD13 1 1 1 1127 1 1 69 LEU HD21 H -4.484 1.254 -5.645 1.00 . A A . 69 LEU HD21 1 1 1 1128 1 1 69 LEU HD22 H -3.599 -0.271 -5.644 1.00 . A A . 69 LEU HD22 1 1 1 1129 1 1 69 LEU HD23 H -3.115 1.030 -4.556 1.00 . A A . 69 LEU HD23 1 1 1 1130 1 1 69 LEU HG H -4.972 0.737 -3.177 1.00 . A A . 69 LEU HG 1 1 1 1131 1 1 69 LEU N N -8.136 -1.799 -4.102 1.00 . A A . 69 LEU N 1 1 1 1132 1 1 69 LEU O O -8.428 0.723 -1.959 1.00 . A A . 69 LEU O 1 1 1 1133 1 1 70 GLU C C -10.522 2.067 -2.708 1.00 . A A . 70 GLU C 1 1 1 1134 1 1 70 GLU CA C -9.600 2.321 -3.897 1.00 . A A . 70 GLU CA 1 1 1 1135 1 1 70 GLU CB C -10.431 2.638 -5.142 1.00 . A A . 70 GLU CB 1 1 1 1136 1 1 70 GLU CD C -10.912 4.361 -6.925 1.00 . A A . 70 GLU CD 1 1 1 1137 1 1 70 GLU CG C -10.443 4.114 -5.505 1.00 . A A . 70 GLU CG 1 1 1 1138 1 1 70 GLU H H -8.537 0.914 -5.066 1.00 . A A . 70 GLU H 1 1 1 1139 1 1 70 GLU HA H -8.968 3.167 -3.672 1.00 . A A . 70 GLU HA 1 1 1 1140 1 1 70 GLU HB2 H -10.028 2.087 -5.979 1.00 . A A . 70 GLU HB2 1 1 1 1141 1 1 70 GLU HB3 H -11.449 2.323 -4.971 1.00 . A A . 70 GLU HB3 1 1 1 1142 1 1 70 GLU HG2 H -11.106 4.633 -4.829 1.00 . A A . 70 GLU HG2 1 1 1 1143 1 1 70 GLU HG3 H -9.442 4.506 -5.398 1.00 . A A . 70 GLU HG3 1 1 1 1144 1 1 70 GLU N N -8.739 1.171 -4.142 1.00 . A A . 70 GLU N 1 1 1 1145 1 1 70 GLU O O -10.899 2.995 -1.993 1.00 . A A . 70 GLU O 1 1 1 1146 1 1 70 GLU OE1 O -10.074 4.287 -7.849 1.00 . A A . 70 GLU OE1 1 1 1 1147 1 1 70 GLU OE2 O -12.118 4.629 -7.115 1.00 . A A . 70 GLU OE2 1 1 1 1148 1 1 71 GLU C C -11.055 0.607 -0.061 1.00 . A A . 71 GLU C 1 1 1 1149 1 1 71 GLU CA C -11.759 0.427 -1.402 1.00 . A A . 71 GLU CA 1 1 1 1150 1 1 71 GLU CB C -12.217 -1.024 -1.560 1.00 . A A . 71 GLU CB 1 1 1 1151 1 1 71 GLU CD C -14.063 -2.574 -2.314 1.00 . A A . 71 GLU CD 1 1 1 1152 1 1 71 GLU CG C -13.690 -1.162 -1.906 1.00 . A A . 71 GLU CG 1 1 1 1153 1 1 71 GLU H H -10.548 0.108 -3.109 1.00 . A A . 71 GLU H 1 1 1 1154 1 1 71 GLU HA H -12.623 1.073 -1.431 1.00 . A A . 71 GLU HA 1 1 1 1155 1 1 71 GLU HB2 H -11.640 -1.488 -2.347 1.00 . A A . 71 GLU HB2 1 1 1 1156 1 1 71 GLU HB3 H -12.036 -1.550 -0.635 1.00 . A A . 71 GLU HB3 1 1 1 1157 1 1 71 GLU HG2 H -14.277 -0.887 -1.043 1.00 . A A . 71 GLU HG2 1 1 1 1158 1 1 71 GLU HG3 H -13.919 -0.494 -2.724 1.00 . A A . 71 GLU HG3 1 1 1 1159 1 1 71 GLU N N -10.881 0.804 -2.504 1.00 . A A . 71 GLU N 1 1 1 1160 1 1 71 GLU O O -11.630 1.144 0.886 1.00 . A A . 71 GLU O 1 1 1 1161 1 1 71 GLU OE1 O -14.290 -3.411 -1.416 1.00 . A A . 71 GLU OE1 1 1 1 1162 1 1 71 GLU OE2 O -14.128 -2.843 -3.532 1.00 . A A . 71 GLU OE2 1 1 1 1163 1 1 72 ALA C C -8.293 1.600 1.303 1.00 . A A . 72 ALA C 1 1 1 1164 1 1 72 ALA CA C -9.026 0.264 1.239 1.00 . A A . 72 ALA CA 1 1 1 1165 1 1 72 ALA CB C -8.038 -0.888 1.339 1.00 . A A . 72 ALA CB 1 1 1 1166 1 1 72 ALA H H -9.404 -0.266 -0.775 1.00 . A A . 72 ALA H 1 1 1 1167 1 1 72 ALA HA H -9.707 0.198 2.075 1.00 . A A . 72 ALA HA 1 1 1 1168 1 1 72 ALA HB1 H -8.565 -1.792 1.607 1.00 . A A . 72 ALA HB1 1 1 1 1169 1 1 72 ALA HB2 H -7.300 -0.664 2.095 1.00 . A A . 72 ALA HB2 1 1 1 1170 1 1 72 ALA HB3 H -7.548 -1.026 0.387 1.00 . A A . 72 ALA HB3 1 1 1 1171 1 1 72 ALA N N -9.808 0.153 0.013 1.00 . A A . 72 ALA N 1 1 1 1172 1 1 72 ALA O O -7.423 1.801 2.150 1.00 . A A . 72 ALA O 1 1 1 1173 1 1 73 GLY C C -8.840 4.874 1.083 1.00 . A A . 73 GLY C 1 1 1 1174 1 1 73 GLY CA C -8.018 3.815 0.375 1.00 . A A . 73 GLY CA 1 1 1 1175 1 1 73 GLY H H -9.352 2.293 -0.247 1.00 . A A . 73 GLY H 1 1 1 1176 1 1 73 GLY HA2 H -7.053 3.744 0.854 1.00 . A A . 73 GLY HA2 1 1 1 1177 1 1 73 GLY HA3 H -7.877 4.112 -0.653 1.00 . A A . 73 GLY HA3 1 1 1 1178 1 1 73 GLY N N -8.652 2.510 0.403 1.00 . A A . 73 GLY N 1 1 1 1179 1 1 73 GLY O O -8.351 5.542 1.994 1.00 . A A . 73 GLY O 1 1 1 1180 1 1 74 ALA C C -12.411 5.485 1.341 1.00 . A A . 74 ALA C 1 1 1 1181 1 1 74 ALA CA C -10.983 6.013 1.263 1.00 . A A . 74 ALA CA 1 1 1 1182 1 1 74 ALA CB C -10.941 7.312 0.472 1.00 . A A . 74 ALA CB 1 1 1 1183 1 1 74 ALA H H -10.423 4.464 -0.067 1.00 . A A . 74 ALA H 1 1 1 1184 1 1 74 ALA HA H -10.630 6.216 2.263 1.00 . A A . 74 ALA HA 1 1 1 1185 1 1 74 ALA HB1 H -10.689 8.128 1.133 1.00 . A A . 74 ALA HB1 1 1 1 1186 1 1 74 ALA HB2 H -11.908 7.494 0.027 1.00 . A A . 74 ALA HB2 1 1 1 1187 1 1 74 ALA HB3 H -10.196 7.236 -0.306 1.00 . A A . 74 ALA HB3 1 1 1 1188 1 1 74 ALA N N -10.091 5.027 0.663 1.00 . A A . 74 ALA N 1 1 1 1189 1 1 74 ALA O O -13.350 6.240 1.593 1.00 . A A . 74 ALA O 1 1 1 1190 1 1 75 LYS C C -14.114 2.873 2.514 1.00 . A A . 75 LYS C 1 1 1 1191 1 1 75 LYS CA C -13.883 3.554 1.169 1.00 . A A . 75 LYS CA 1 1 1 1192 1 1 75 LYS CB C -14.023 2.533 0.038 1.00 . A A . 75 LYS CB 1 1 1 1193 1 1 75 LYS CD C -15.983 1.271 -0.898 1.00 . A A . 75 LYS CD 1 1 1 1194 1 1 75 LYS CE C -16.087 0.898 -2.368 1.00 . A A . 75 LYS CE 1 1 1 1195 1 1 75 LYS CG C -15.339 2.636 -0.714 1.00 . A A . 75 LYS CG 1 1 1 1196 1 1 75 LYS H H -11.781 3.633 0.927 1.00 . A A . 75 LYS H 1 1 1 1197 1 1 75 LYS HA H -14.625 4.327 1.038 1.00 . A A . 75 LYS HA 1 1 1 1198 1 1 75 LYS HB2 H -13.218 2.682 -0.667 1.00 . A A . 75 LYS HB2 1 1 1 1199 1 1 75 LYS HB3 H -13.947 1.539 0.453 1.00 . A A . 75 LYS HB3 1 1 1 1200 1 1 75 LYS HD2 H -15.385 0.530 -0.391 1.00 . A A . 75 LYS HD2 1 1 1 1201 1 1 75 LYS HD3 H -16.975 1.291 -0.470 1.00 . A A . 75 LYS HD3 1 1 1 1202 1 1 75 LYS HE2 H -15.322 1.427 -2.916 1.00 . A A . 75 LYS HE2 1 1 1 1203 1 1 75 LYS HE3 H -15.930 -0.166 -2.468 1.00 . A A . 75 LYS HE3 1 1 1 1204 1 1 75 LYS HG2 H -16.014 3.268 -0.156 1.00 . A A . 75 LYS HG2 1 1 1 1205 1 1 75 LYS HG3 H -15.155 3.071 -1.686 1.00 . A A . 75 LYS HG3 1 1 1 1206 1 1 75 LYS HZ1 H -18.175 0.821 -2.366 1.00 . A A . 75 LYS HZ1 1 1 1 1207 1 1 75 LYS HZ2 H -17.494 0.894 -3.912 1.00 . A A . 75 LYS HZ2 1 1 1 1208 1 1 75 LYS HZ3 H -17.543 2.280 -2.945 1.00 . A A . 75 LYS HZ3 1 1 1 1209 1 1 75 LYS N N -12.568 4.183 1.123 1.00 . A A . 75 LYS N 1 1 1 1210 1 1 75 LYS NZ N -17.418 1.248 -2.938 1.00 . A A . 75 LYS NZ 1 1 1 1211 1 1 75 LYS O O -13.527 3.259 3.525 1.00 . A A . 75 LYS O 1 1 1 1212 1 1 76 ILE C C -14.046 0.991 4.627 1.00 . A A . 76 ILE C 1 1 1 1213 1 1 76 ILE CA C -15.280 1.124 3.740 1.00 . A A . 76 ILE CA 1 1 1 1214 1 1 76 ILE CB C -15.827 -0.282 3.428 1.00 . A A . 76 ILE CB 1 1 1 1215 1 1 76 ILE CD1 C -17.746 -1.520 2.304 1.00 . A A . 76 ILE CD1 1 1 1 1216 1 1 76 ILE CG1 C -17.086 -0.183 2.565 1.00 . A A . 76 ILE CG1 1 1 1 1217 1 1 76 ILE CG2 C -16.118 -1.035 4.717 1.00 . A A . 76 ILE CG2 1 1 1 1218 1 1 76 ILE H H -15.408 1.597 1.681 1.00 . A A . 76 ILE H 1 1 1 1219 1 1 76 ILE HA H -16.040 1.673 4.277 1.00 . A A . 76 ILE HA 1 1 1 1220 1 1 76 ILE HB H -15.069 -0.827 2.885 1.00 . A A . 76 ILE HB 1 1 1 1221 1 1 76 ILE HD11 H -17.077 -2.315 2.597 1.00 . A A . 76 ILE HD11 1 1 1 1222 1 1 76 ILE HD12 H -17.974 -1.609 1.252 1.00 . A A . 76 ILE HD12 1 1 1 1223 1 1 76 ILE HD13 H -18.659 -1.589 2.877 1.00 . A A . 76 ILE HD13 1 1 1 1224 1 1 76 ILE HG12 H -17.806 0.450 3.062 1.00 . A A . 76 ILE HG12 1 1 1 1225 1 1 76 ILE HG13 H -16.828 0.252 1.611 1.00 . A A . 76 ILE HG13 1 1 1 1226 1 1 76 ILE HG21 H -15.333 -1.753 4.900 1.00 . A A . 76 ILE HG21 1 1 1 1227 1 1 76 ILE HG22 H -17.063 -1.551 4.627 1.00 . A A . 76 ILE HG22 1 1 1 1228 1 1 76 ILE HG23 H -16.166 -0.337 5.539 1.00 . A A . 76 ILE HG23 1 1 1 1229 1 1 76 ILE N N -14.972 1.858 2.519 1.00 . A A . 76 ILE N 1 1 1 1230 1 1 76 ILE O O -12.939 0.768 4.138 1.00 . A A . 76 ILE O 1 1 1 1231 1 1 77 ASN C C -13.064 -0.386 7.467 1.00 . A A . 77 ASN C 1 1 1 1232 1 1 77 ASN CA C -13.150 1.023 6.890 1.00 . A A . 77 ASN CA 1 1 1 1233 1 1 77 ASN CB C -13.331 2.039 8.019 1.00 . A A . 77 ASN CB 1 1 1 1234 1 1 77 ASN CG C -14.737 2.027 8.587 1.00 . A A . 77 ASN CG 1 1 1 1235 1 1 77 ASN H H -15.152 1.304 6.263 1.00 . A A . 77 ASN H 1 1 1 1236 1 1 77 ASN HA H -12.231 1.241 6.366 1.00 . A A . 77 ASN HA 1 1 1 1237 1 1 77 ASN HB2 H -12.639 1.810 8.816 1.00 . A A . 77 ASN HB2 1 1 1 1238 1 1 77 ASN HB3 H -13.124 3.029 7.641 1.00 . A A . 77 ASN HB3 1 1 1 1239 1 1 77 ASN HD21 H -14.349 3.664 9.646 1.00 . A A . 77 ASN HD21 1 1 1 1240 1 1 77 ASN HD22 H -15.942 3.018 9.820 1.00 . A A . 77 ASN HD22 1 1 1 1241 1 1 77 ASN N N -14.246 1.128 5.934 1.00 . A A . 77 ASN N 1 1 1 1242 1 1 77 ASN ND2 N -15.040 3.001 9.437 1.00 . A A . 77 ASN ND2 1 1 1 1243 1 1 77 ASN O O -14.079 -0.983 7.829 1.00 . A A . 77 ASN O 1 1 1 1244 1 1 77 ASN OD1 O -15.541 1.152 8.267 1.00 . A A . 77 ASN OD1 1 1 1 1245 1 1 78 HIS C C -11.313 -2.200 9.575 1.00 . A A . 78 HIS C 1 1 1 1246 1 1 78 HIS CA C -11.629 -2.253 8.083 1.00 . A A . 78 HIS CA 1 1 1 1247 1 1 78 HIS CB C -10.489 -2.944 7.333 1.00 . A A . 78 HIS CB 1 1 1 1248 1 1 78 HIS CD2 C -10.591 -2.651 4.758 1.00 . A A . 78 HIS CD2 1 1 1 1249 1 1 78 HIS CE1 C -9.280 -0.903 4.582 1.00 . A A . 78 HIS CE1 1 1 1 1250 1 1 78 HIS CG C -10.182 -2.322 6.006 1.00 . A A . 78 HIS CG 1 1 1 1251 1 1 78 HIS H H -11.077 -0.389 7.245 1.00 . A A . 78 HIS H 1 1 1 1252 1 1 78 HIS HA H -12.537 -2.819 7.940 1.00 . A A . 78 HIS HA 1 1 1 1253 1 1 78 HIS HB2 H -9.593 -2.900 7.934 1.00 . A A . 78 HIS HB2 1 1 1 1254 1 1 78 HIS HB3 H -10.753 -3.977 7.164 1.00 . A A . 78 HIS HB3 1 1 1 1255 1 1 78 HIS HD1 H -8.907 -0.748 6.588 1.00 . A A . 78 HIS HD1 1 1 1 1256 1 1 78 HIS HD2 H -11.247 -3.468 4.492 1.00 . A A . 78 HIS HD2 1 1 1 1257 1 1 78 HIS HE1 H -8.707 -0.084 4.170 1.00 . A A . 78 HIS HE1 1 1 1 1258 1 1 78 HIS HE2 H -10.199 -1.692 2.931 1.00 . A A . 78 HIS HE2 1 1 1 1259 1 1 78 HIS N N -11.847 -0.913 7.550 1.00 . A A . 78 HIS N 1 1 1 1260 1 1 78 HIS ND1 N -9.362 -1.223 5.861 1.00 . A A . 78 HIS ND1 1 1 1 1261 1 1 78 HIS NE2 N -10.016 -1.754 3.892 1.00 . A A . 78 HIS NE2 1 1 1 1262 1 1 78 HIS O O -10.532 -1.361 10.024 1.00 . A A . 78 HIS O 1 1 1 1263 1 1 79 THR C C -11.489 -4.593 12.241 1.00 . A A . 79 THR C 1 1 1 1264 1 1 79 THR CA C -11.709 -3.156 11.777 1.00 . A A . 79 THR CA 1 1 1 1265 1 1 79 THR CB C -12.900 -2.546 12.517 1.00 . A A . 79 THR CB 1 1 1 1266 1 1 79 THR CG2 C -14.210 -3.244 12.219 1.00 . A A . 79 THR CG2 1 1 1 1267 1 1 79 THR H H -12.536 -3.743 9.920 1.00 . A A . 79 THR H 1 1 1 1268 1 1 79 THR HA H -10.824 -2.580 12.002 1.00 . A A . 79 THR HA 1 1 1 1269 1 1 79 THR HB H -13.002 -1.512 12.222 1.00 . A A . 79 THR HB 1 1 1 1270 1 1 79 THR HG1 H -13.241 -1.923 14.342 1.00 . A A . 79 THR HG1 1 1 1 1271 1 1 79 THR HG21 H -14.193 -3.627 11.210 1.00 . A A . 79 THR HG21 1 1 1 1272 1 1 79 THR HG22 H -15.024 -2.542 12.324 1.00 . A A . 79 THR HG22 1 1 1 1273 1 1 79 THR HG23 H -14.348 -4.061 12.912 1.00 . A A . 79 THR HG23 1 1 1 1274 1 1 79 THR N N -11.925 -3.101 10.336 1.00 . A A . 79 THR N 1 1 1 1275 1 1 79 THR O O -11.514 -4.880 13.438 1.00 . A A . 79 THR O 1 1 1 1276 1 1 79 THR OG1 O -12.698 -2.592 13.918 1.00 . A A . 79 THR OG1 1 1 1 1277 1 1 80 THR C C -10.003 -7.503 10.668 1.00 . A A . 80 THR C 1 1 1 1278 1 1 80 THR CA C -11.051 -6.899 11.597 1.00 . A A . 80 THR CA 1 1 1 1279 1 1 80 THR CB C -12.360 -7.682 11.484 1.00 . A A . 80 THR CB 1 1 1 1280 1 1 80 THR CG2 C -13.020 -7.553 10.128 1.00 . A A . 80 THR CG2 1 1 1 1281 1 1 80 THR H H -11.267 -5.203 10.349 1.00 . A A . 80 THR H 1 1 1 1282 1 1 80 THR HA H -10.692 -6.960 12.613 1.00 . A A . 80 THR HA 1 1 1 1283 1 1 80 THR HB H -13.054 -7.312 12.226 1.00 . A A . 80 THR HB 1 1 1 1284 1 1 80 THR HG1 H -11.944 -9.504 10.898 1.00 . A A . 80 THR HG1 1 1 1 1285 1 1 80 THR HG21 H -12.971 -8.500 9.612 1.00 . A A . 80 THR HG21 1 1 1 1286 1 1 80 THR HG22 H -12.507 -6.800 9.548 1.00 . A A . 80 THR HG22 1 1 1 1287 1 1 80 THR HG23 H -14.053 -7.266 10.256 1.00 . A A . 80 THR HG23 1 1 1 1288 1 1 80 THR N N -11.275 -5.492 11.285 1.00 . A A . 80 THR N 1 1 1 1289 1 1 80 THR O O -9.830 -8.721 10.619 1.00 . A A . 80 THR O 1 1 1 1290 1 1 80 THR OG1 O -12.142 -9.061 11.726 1.00 . A A . 80 THR OG1 1 1 1 1291 1 1 81 LEU C C -8.689 -8.387 8.313 1.00 . A A . 81 LEU C 1 1 1 1292 1 1 81 LEU CA C -8.272 -7.094 9.006 1.00 . A A . 81 LEU CA 1 1 1 1293 1 1 81 LEU CB C -6.949 -7.301 9.745 1.00 . A A . 81 LEU CB 1 1 1 1294 1 1 81 LEU CD1 C -6.461 -6.050 11.862 1.00 . A A . 81 LEU CD1 1 1 1 1295 1 1 81 LEU CD2 C -4.881 -5.897 9.929 1.00 . A A . 81 LEU CD2 1 1 1 1296 1 1 81 LEU CG C -6.338 -6.034 10.346 1.00 . A A . 81 LEU CG 1 1 1 1297 1 1 81 LEU H H -9.486 -5.685 10.016 1.00 . A A . 81 LEU H 1 1 1 1298 1 1 81 LEU HA H -8.140 -6.326 8.259 1.00 . A A . 81 LEU HA 1 1 1 1299 1 1 81 LEU HB2 H -7.114 -8.011 10.543 1.00 . A A . 81 LEU HB2 1 1 1 1300 1 1 81 LEU HB3 H -6.236 -7.723 9.052 1.00 . A A . 81 LEU HB3 1 1 1 1301 1 1 81 LEU HD11 H -5.561 -6.464 12.292 1.00 . A A . 81 LEU HD11 1 1 1 1302 1 1 81 LEU HD12 H -7.308 -6.656 12.148 1.00 . A A . 81 LEU HD12 1 1 1 1303 1 1 81 LEU HD13 H -6.602 -5.042 12.222 1.00 . A A . 81 LEU HD13 1 1 1 1304 1 1 81 LEU HD21 H -4.441 -6.878 9.828 1.00 . A A . 81 LEU HD21 1 1 1 1305 1 1 81 LEU HD22 H -4.343 -5.337 10.680 1.00 . A A . 81 LEU HD22 1 1 1 1306 1 1 81 LEU HD23 H -4.825 -5.377 8.984 1.00 . A A . 81 LEU HD23 1 1 1 1307 1 1 81 LEU HG H -6.875 -5.173 9.977 1.00 . A A . 81 LEU HG 1 1 1 1308 1 1 81 LEU N N -9.304 -6.644 9.933 1.00 . A A . 81 LEU N 1 1 1 1309 1 1 81 LEU O O -7.847 -9.210 7.954 1.00 . A A . 81 LEU O 1 1 1 1310 1 1 82 LYS C C -9.992 -9.876 6.054 1.00 . A A . 82 LYS C 1 1 1 1311 1 1 82 LYS CA C -10.522 -9.753 7.478 1.00 . A A . 82 LYS CA 1 1 1 1312 1 1 82 LYS CB C -12.052 -9.717 7.464 1.00 . A A . 82 LYS CB 1 1 1 1313 1 1 82 LYS CD C -13.005 -11.972 8.029 1.00 . A A . 82 LYS CD 1 1 1 1314 1 1 82 LYS CE C -14.341 -12.470 8.554 1.00 . A A . 82 LYS CE 1 1 1 1315 1 1 82 LYS CG C -12.690 -10.577 8.543 1.00 . A A . 82 LYS CG 1 1 1 1316 1 1 82 LYS H H -10.616 -7.868 8.436 1.00 . A A . 82 LYS H 1 1 1 1317 1 1 82 LYS HA H -10.196 -10.611 8.046 1.00 . A A . 82 LYS HA 1 1 1 1318 1 1 82 LYS HB2 H -12.378 -8.697 7.607 1.00 . A A . 82 LYS HB2 1 1 1 1319 1 1 82 LYS HB3 H -12.400 -10.066 6.503 1.00 . A A . 82 LYS HB3 1 1 1 1320 1 1 82 LYS HD2 H -13.039 -11.949 6.951 1.00 . A A . 82 LYS HD2 1 1 1 1321 1 1 82 LYS HD3 H -12.226 -12.648 8.353 1.00 . A A . 82 LYS HD3 1 1 1 1322 1 1 82 LYS HE2 H -14.607 -11.896 9.429 1.00 . A A . 82 LYS HE2 1 1 1 1323 1 1 82 LYS HE3 H -15.090 -12.326 7.789 1.00 . A A . 82 LYS HE3 1 1 1 1324 1 1 82 LYS HG2 H -12.008 -10.657 9.377 1.00 . A A . 82 LYS HG2 1 1 1 1325 1 1 82 LYS HG3 H -13.606 -10.107 8.869 1.00 . A A . 82 LYS HG3 1 1 1 1326 1 1 82 LYS HZ1 H -15.227 -14.231 9.248 1.00 . A A . 82 LYS HZ1 1 1 1 1327 1 1 82 LYS HZ2 H -13.600 -14.067 9.678 1.00 . A A . 82 LYS HZ2 1 1 1 1328 1 1 82 LYS HZ3 H -14.016 -14.482 8.092 1.00 . A A . 82 LYS HZ3 1 1 1 1329 1 1 82 LYS N N -9.994 -8.559 8.128 1.00 . A A . 82 LYS N 1 1 1 1330 1 1 82 LYS NZ N -14.293 -13.913 8.919 1.00 . A A . 82 LYS NZ 1 1 1 1331 1 1 82 LYS O O -9.513 -10.935 5.648 1.00 . A A . 82 LYS O 1 1 1 1332 1 1 83 ILE C C -8.210 -9.373 3.814 1.00 . A A . 83 ILE C 1 1 1 1333 1 1 83 ILE CA C -9.607 -8.773 3.920 1.00 . A A . 83 ILE CA 1 1 1 1334 1 1 83 ILE CB C -9.584 -7.343 3.346 1.00 . A A . 83 ILE CB 1 1 1 1335 1 1 83 ILE CD1 C -8.818 -4.969 3.853 1.00 . A A . 83 ILE CD1 1 1 1 1336 1 1 83 ILE CG1 C -8.714 -6.434 4.217 1.00 . A A . 83 ILE CG1 1 1 1 1337 1 1 83 ILE CG2 C -10.997 -6.791 3.241 1.00 . A A . 83 ILE CG2 1 1 1 1338 1 1 83 ILE H H -10.470 -7.971 5.678 1.00 . A A . 83 ILE H 1 1 1 1339 1 1 83 ILE HA H -10.289 -9.366 3.328 1.00 . A A . 83 ILE HA 1 1 1 1340 1 1 83 ILE HB H -9.165 -7.385 2.352 1.00 . A A . 83 ILE HB 1 1 1 1341 1 1 83 ILE HD11 H -8.377 -4.808 2.880 1.00 . A A . 83 ILE HD11 1 1 1 1342 1 1 83 ILE HD12 H -8.293 -4.378 4.589 1.00 . A A . 83 ILE HD12 1 1 1 1343 1 1 83 ILE HD13 H -9.857 -4.677 3.830 1.00 . A A . 83 ILE HD13 1 1 1 1344 1 1 83 ILE HG12 H -9.014 -6.541 5.249 1.00 . A A . 83 ILE HG12 1 1 1 1345 1 1 83 ILE HG13 H -7.680 -6.731 4.114 1.00 . A A . 83 ILE HG13 1 1 1 1346 1 1 83 ILE HG21 H -10.959 -5.715 3.167 1.00 . A A . 83 ILE HG21 1 1 1 1347 1 1 83 ILE HG22 H -11.560 -7.072 4.119 1.00 . A A . 83 ILE HG22 1 1 1 1348 1 1 83 ILE HG23 H -11.477 -7.196 2.362 1.00 . A A . 83 ILE HG23 1 1 1 1349 1 1 83 ILE N N -10.079 -8.786 5.299 1.00 . A A . 83 ILE N 1 1 1 1350 1 1 83 ILE O O -7.946 -10.209 2.950 1.00 . A A . 83 ILE O 1 1 1 1351 1 1 84 LEU C C -5.922 -10.949 4.927 1.00 . A A . 84 LEU C 1 1 1 1352 1 1 84 LEU CA C -5.948 -9.441 4.707 1.00 . A A . 84 LEU CA 1 1 1 1353 1 1 84 LEU CB C -5.133 -8.740 5.797 1.00 . A A . 84 LEU CB 1 1 1 1354 1 1 84 LEU CD1 C -4.974 -6.262 5.452 1.00 . A A . 84 LEU CD1 1 1 1 1355 1 1 84 LEU CD2 C -2.934 -7.571 6.069 1.00 . A A . 84 LEU CD2 1 1 1 1356 1 1 84 LEU CG C -4.250 -7.592 5.307 1.00 . A A . 84 LEU CG 1 1 1 1357 1 1 84 LEU H H -7.588 -8.277 5.366 1.00 . A A . 84 LEU H 1 1 1 1358 1 1 84 LEU HA H -5.511 -9.221 3.745 1.00 . A A . 84 LEU HA 1 1 1 1359 1 1 84 LEU HB2 H -5.819 -8.350 6.535 1.00 . A A . 84 LEU HB2 1 1 1 1360 1 1 84 LEU HB3 H -4.500 -9.474 6.271 1.00 . A A . 84 LEU HB3 1 1 1 1361 1 1 84 LEU HD11 H -5.877 -6.278 4.860 1.00 . A A . 84 LEU HD11 1 1 1 1362 1 1 84 LEU HD12 H -4.333 -5.464 5.110 1.00 . A A . 84 LEU HD12 1 1 1 1363 1 1 84 LEU HD13 H -5.227 -6.102 6.490 1.00 . A A . 84 LEU HD13 1 1 1 1364 1 1 84 LEU HD21 H -2.371 -8.463 5.840 1.00 . A A . 84 LEU HD21 1 1 1 1365 1 1 84 LEU HD22 H -3.133 -7.533 7.130 1.00 . A A . 84 LEU HD22 1 1 1 1366 1 1 84 LEU HD23 H -2.364 -6.700 5.779 1.00 . A A . 84 LEU HD23 1 1 1 1367 1 1 84 LEU HG H -4.029 -7.738 4.259 1.00 . A A . 84 LEU HG 1 1 1 1368 1 1 84 LEU N N -7.318 -8.943 4.701 1.00 . A A . 84 LEU N 1 1 1 1369 1 1 84 LEU O O -5.049 -11.647 4.409 1.00 . A A . 84 LEU O 1 1 1 1370 1 1 85 GLU C C -7.537 -13.632 4.785 1.00 . A A . 85 GLU C 1 1 1 1371 1 1 85 GLU CA C -6.974 -12.873 5.982 1.00 . A A . 85 GLU CA 1 1 1 1372 1 1 85 GLU CB C -7.851 -13.115 7.212 1.00 . A A . 85 GLU CB 1 1 1 1373 1 1 85 GLU CD C -7.027 -13.918 9.461 1.00 . A A . 85 GLU CD 1 1 1 1374 1 1 85 GLU CG C -7.412 -14.307 8.047 1.00 . A A . 85 GLU CG 1 1 1 1375 1 1 85 GLU H H -7.553 -10.840 6.079 1.00 . A A . 85 GLU H 1 1 1 1376 1 1 85 GLU HA H -5.977 -13.234 6.185 1.00 . A A . 85 GLU HA 1 1 1 1377 1 1 85 GLU HB2 H -7.823 -12.235 7.838 1.00 . A A . 85 GLU HB2 1 1 1 1378 1 1 85 GLU HB3 H -8.867 -13.283 6.888 1.00 . A A . 85 GLU HB3 1 1 1 1379 1 1 85 GLU HG2 H -8.225 -15.016 8.094 1.00 . A A . 85 GLU HG2 1 1 1 1380 1 1 85 GLU HG3 H -6.560 -14.769 7.571 1.00 . A A . 85 GLU HG3 1 1 1 1381 1 1 85 GLU N N -6.885 -11.447 5.696 1.00 . A A . 85 GLU N 1 1 1 1382 1 1 85 GLU O O -7.332 -14.838 4.649 1.00 . A A . 85 GLU O 1 1 1 1383 1 1 85 GLU OE1 O -6.278 -12.932 9.623 1.00 . A A . 85 GLU OE1 1 1 1 1384 1 1 85 GLU OE2 O -7.476 -14.600 10.407 1.00 . A A . 85 GLU OE2 1 1 1 1385 1 1 86 GLY C C -7.973 -13.350 1.505 1.00 . A A . 86 GLY C 1 1 1 1386 1 1 86 GLY CA C -8.828 -13.538 2.743 1.00 . A A . 86 GLY CA 1 1 1 1387 1 1 86 GLY H H -8.376 -11.958 4.078 1.00 . A A . 86 GLY H 1 1 1 1388 1 1 86 GLY HA2 H -8.944 -14.596 2.929 1.00 . A A . 86 GLY HA2 1 1 1 1389 1 1 86 GLY HA3 H -9.801 -13.106 2.564 1.00 . A A . 86 GLY HA3 1 1 1 1390 1 1 86 GLY N N -8.247 -12.916 3.918 1.00 . A A . 86 GLY N 1 1 1 1391 1 1 86 GLY O O -8.115 -14.083 0.527 1.00 . A A . 86 GLY O 1 1 1 1392 1 1 87 HIS C C -4.913 -11.414 0.891 1.00 . A A . 87 HIS C 1 1 1 1393 1 1 87 HIS CA C -6.201 -12.081 0.421 1.00 . A A . 87 HIS CA 1 1 1 1394 1 1 87 HIS CB C -6.911 -11.185 -0.596 1.00 . A A . 87 HIS CB 1 1 1 1395 1 1 87 HIS CD2 C -7.710 -9.010 0.571 1.00 . A A . 87 HIS CD2 1 1 1 1396 1 1 87 HIS CE1 C -6.183 -7.646 -0.215 1.00 . A A . 87 HIS CE1 1 1 1 1397 1 1 87 HIS CG C -6.891 -9.733 -0.231 1.00 . A A . 87 HIS CG 1 1 1 1398 1 1 87 HIS H H -7.016 -11.814 2.356 1.00 . A A . 87 HIS H 1 1 1 1399 1 1 87 HIS HA H -5.955 -13.020 -0.051 1.00 . A A . 87 HIS HA 1 1 1 1400 1 1 87 HIS HB2 H -6.430 -11.291 -1.557 1.00 . A A . 87 HIS HB2 1 1 1 1401 1 1 87 HIS HB3 H -7.942 -11.494 -0.680 1.00 . A A . 87 HIS HB3 1 1 1 1402 1 1 87 HIS HD1 H -5.211 -9.071 -1.316 1.00 . A A . 87 HIS HD1 1 1 1 1403 1 1 87 HIS HD2 H -8.566 -9.382 1.115 1.00 . A A . 87 HIS HD2 1 1 1 1404 1 1 87 HIS HE1 H -5.606 -6.756 -0.416 1.00 . A A . 87 HIS HE1 1 1 1 1405 1 1 87 HIS HE2 H -7.590 -6.987 1.120 1.00 . A A . 87 HIS HE2 1 1 1 1406 1 1 87 HIS N N -7.083 -12.364 1.548 1.00 . A A . 87 HIS N 1 1 1 1407 1 1 87 HIS ND1 N -5.947 -8.849 -0.708 1.00 . A A . 87 HIS ND1 1 1 1 1408 1 1 87 HIS NE2 N -7.248 -7.717 0.563 1.00 . A A . 87 HIS NE2 1 1 1 1409 1 1 87 HIS O O -4.420 -10.479 0.261 1.00 . A A . 87 HIS O 1 1 1 1410 1 1 88 LEU C C -2.609 -12.239 3.681 1.00 . A A . 88 LEU C 1 1 1 1411 1 1 88 LEU CA C -3.141 -11.354 2.559 1.00 . A A . 88 LEU CA 1 1 1 1412 1 1 88 LEU CB C -3.380 -9.936 3.082 1.00 . A A . 88 LEU CB 1 1 1 1413 1 1 88 LEU CD1 C -0.887 -9.841 3.324 1.00 . A A . 88 LEU CD1 1 1 1 1414 1 1 88 LEU CD2 C -2.050 -8.270 1.765 1.00 . A A . 88 LEU CD2 1 1 1 1415 1 1 88 LEU CG C -2.149 -9.029 3.079 1.00 . A A . 88 LEU CG 1 1 1 1416 1 1 88 LEU H H -4.812 -12.649 2.461 1.00 . A A . 88 LEU H 1 1 1 1417 1 1 88 LEU HA H -2.408 -11.317 1.767 1.00 . A A . 88 LEU HA 1 1 1 1418 1 1 88 LEU HB2 H -4.144 -9.475 2.473 1.00 . A A . 88 LEU HB2 1 1 1 1419 1 1 88 LEU HB3 H -3.745 -10.006 4.096 1.00 . A A . 88 LEU HB3 1 1 1 1420 1 1 88 LEU HD11 H -0.032 -9.181 3.344 1.00 . A A . 88 LEU HD11 1 1 1 1421 1 1 88 LEU HD12 H -0.764 -10.564 2.531 1.00 . A A . 88 LEU HD12 1 1 1 1422 1 1 88 LEU HD13 H -0.967 -10.355 4.270 1.00 . A A . 88 LEU HD13 1 1 1 1423 1 1 88 LEU HD21 H -1.900 -8.969 0.956 1.00 . A A . 88 LEU HD21 1 1 1 1424 1 1 88 LEU HD22 H -1.218 -7.583 1.807 1.00 . A A . 88 LEU HD22 1 1 1 1425 1 1 88 LEU HD23 H -2.964 -7.718 1.598 1.00 . A A . 88 LEU HD23 1 1 1 1426 1 1 88 LEU HG H -2.240 -8.306 3.878 1.00 . A A . 88 LEU HG 1 1 1 1427 1 1 88 LEU N N -4.372 -11.902 2.003 1.00 . A A . 88 LEU N 1 1 1 1428 1 1 88 LEU O O -2.512 -11.748 4.826 1.00 . A A . 88 LEU O 1 1 1 1429 1 1 88 LEU OXT O -2.294 -13.416 3.406 1.00 . A A . 88 LEU OXT 1 1 stop_ save_
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