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NMR Restraints Grid |
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Result table
(Save to zip file containing files for each block)
image | mrblock_id | pdb_id | cing | stage | program | type | subtype | item_count |
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372774 |
1dfd ![]() ![]() |
cing | 4-filtered-FRED | STAR | entry | full | 568 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1dfd # This FRED archive file contains, for PDB entry <1dfd>: # # - 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_1dfd _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 1dfd _Assembly.Number_of_components 2 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all free" _Assembly.Molecular_mass 7500.37 loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 . 1 $FERREDOXIN_I A . 1 1 2 . 2 $IRON_SULFUR_CLUSTER B . 1 1 stop_ loop_ _PDBX_nonpoly_scheme.Entity_assembly_ID _PDBX_nonpoly_scheme.Entity_ID _PDBX_nonpoly_scheme.Mon_ID _PDBX_nonpoly_scheme.Comp_index_ID _PDBX_nonpoly_scheme.Comp_ID _PDBX_nonpoly_scheme.Entry_ID _PDBX_nonpoly_scheme.Assembly_ID 2 2 SF4 1 SF4 1 1 stop_ save_ save_FERREDOXIN_I _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "FERREDOXIN I" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code ARKFYVDQDECIACESCVEIAPGAFAMDPEIEKAYVKDVEGASQEEVEEAMDTCPVQCIHWEDE _Entity.Number_of_monomers 64 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 ALA . 1 1 2 ARG . 1 1 3 LYS . 1 1 4 PHE . 1 1 5 TYR . 1 1 6 VAL . 1 1 7 ASP . 1 1 8 GLN . 1 1 9 ASP . 1 1 10 GLU . 1 1 11 CYS . 1 1 12 ILE . 1 1 13 ALA . 1 1 14 CYS . 1 1 15 GLU . 1 1 16 SER . 1 1 17 CYS . 1 1 18 VAL . 1 1 19 GLU . 1 1 20 ILE . 1 1 21 ALA . 1 1 22 PRO . 1 1 23 GLY . 1 1 24 ALA . 1 1 25 PHE . 1 1 26 ALA . 1 1 27 MET . 1 1 28 ASP . 1 1 29 PRO . 1 1 30 GLU . 1 1 31 ILE . 1 1 32 GLU . 1 1 33 LYS . 1 1 34 ALA . 1 1 35 TYR . 1 1 36 VAL . 1 1 37 LYS . 1 1 38 ASP . 1 1 39 VAL . 1 1 40 GLU . 1 1 41 GLY . 1 1 42 ALA . 1 1 43 SER . 1 1 44 GLN . 1 1 45 GLU . 1 1 46 GLU . 1 1 47 VAL . 1 1 48 GLU . 1 1 49 GLU . 1 1 50 ALA . 1 1 51 MET . 1 1 52 ASP . 1 1 53 THR . 1 1 54 CYS . 1 1 55 PRO . 1 1 56 VAL . 1 1 57 GLN . 1 1 58 CYS . 1 1 59 ILE . 1 1 60 HIS . 1 1 61 TRP . 1 1 62 GLU . 1 1 63 ASP . 1 1 64 GLU . 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 ALA 1 1 1 1 ARG 2 2 1 1 LYS 3 3 1 1 PHE 4 4 1 1 TYR 5 5 1 1 VAL 6 6 1 1 ASP 7 7 1 1 GLN 8 8 1 1 ASP 9 9 1 1 GLU 10 10 1 1 CYS 11 11 1 1 ILE 12 12 1 1 ALA 13 13 1 1 CYS 14 14 1 1 GLU 15 15 1 1 SER 16 16 1 1 CYS 17 17 1 1 VAL 18 18 1 1 GLU 19 19 1 1 ILE 20 20 1 1 ALA 21 21 1 1 PRO 22 22 1 1 GLY 23 23 1 1 ALA 24 24 1 1 PHE 25 25 1 1 ALA 26 26 1 1 MET 27 27 1 1 ASP 28 28 1 1 PRO 29 29 1 1 GLU 30 30 1 1 ILE 31 31 1 1 GLU 32 32 1 1 LYS 33 33 1 1 ALA 34 34 1 1 TYR 35 35 1 1 VAL 36 36 1 1 LYS 37 37 1 1 ASP 38 38 1 1 VAL 39 39 1 1 GLU 40 40 1 1 GLY 41 41 1 1 ALA 42 42 1 1 SER 43 43 1 1 GLN 44 44 1 1 GLU 45 45 1 1 GLU 46 46 1 1 VAL 47 47 1 1 GLU 48 48 1 1 GLU 49 49 1 1 ALA 50 50 1 1 MET 51 51 1 1 ASP 52 52 1 1 THR 53 53 1 1 CYS 54 54 1 1 PRO 55 55 1 1 VAL 56 56 1 1 GLN 57 57 1 1 CYS 58 58 1 1 ILE 59 59 1 1 HIS 60 60 1 1 TRP 61 61 1 1 GLU 62 62 1 1 ASP 63 63 1 1 GLU 64 64 1 1 stop_ save_ save_IRON_SULFUR_CLUSTER _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 2 _Entity.Name "IRON SULFUR CLUSTER" _Entity.Type non-polymer 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 SF4 $SF4 1 2 stop_ save_ save_SF4 _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID SF4 _Chem_comp.Type non-polymer 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 1 _Distance_constraint_list.Constraint_type "general distance" _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 121 1 . . . 1 1 122 1 . . . 1 1 123 1 . . . 1 1 124 1 . . . 1 1 125 1 . . . 1 1 126 1 . . . 1 1 127 1 . . . 1 1 128 1 . . . 1 1 129 1 . . . 1 1 130 1 . . . 1 1 131 1 . . . 1 1 132 1 . . . 1 1 133 1 . . . 1 1 134 1 . . . 1 1 135 1 . . . 1 1 136 1 . . . 1 1 137 1 . . . 1 1 138 1 . . . 1 1 139 1 . . . 1 1 140 1 . . . 1 1 141 1 . . . 1 1 142 1 . . . 1 1 143 1 . . . 1 1 144 1 . . . 1 1 145 1 . . . 1 1 146 1 . . . 1 1 147 1 . . . 1 1 148 1 . . . 1 1 149 1 . . . 1 1 150 1 . . . 1 1 151 1 . . . 1 1 152 1 . . . 1 1 153 1 . . . 1 1 154 1 . . . 1 1 155 1 . . . 1 1 156 1 . . . 1 1 157 1 . . . 1 1 158 1 . . . 1 1 159 1 . . . 1 1 160 1 . . . 1 1 161 1 . . . 1 1 162 1 . . . 1 1 163 1 . . . 1 1 164 1 . . . 1 1 165 1 . . . 1 1 166 1 . . . 1 1 167 1 . . . 1 1 168 1 . . . 1 1 169 1 . . . 1 1 170 1 . . . 1 1 171 1 . . . 1 1 172 1 . . . 1 1 173 1 . . . 1 1 174 1 . . . 1 1 175 1 . . . 1 1 176 1 . . . 1 1 177 1 . . . 1 1 178 1 . . . 1 1 179 1 . . . 1 1 180 1 . . . 1 1 181 1 . . . 1 1 182 1 . . . 1 1 183 1 . . . 1 1 184 1 . . . 1 1 185 1 . . . 1 1 186 1 . . . 1 1 187 1 . . . 1 1 188 1 . . . 1 1 189 1 . . . 1 1 190 1 . . . 1 1 191 1 . . . 1 1 192 1 . . . 1 1 193 1 . . . 1 1 194 1 . . . 1 1 195 1 . . . 1 1 196 1 . . . 1 1 197 1 . . . 1 1 198 1 . . . 1 1 199 1 . . . 1 1 200 1 . . . 1 1 201 1 . . . 1 1 202 1 . . . 1 1 203 1 . . . 1 1 204 1 . . . 1 1 205 1 . . . 1 1 206 1 . . . 1 1 207 1 . . . 1 1 208 1 . . . 1 1 209 1 . . . 1 1 210 1 . . . 1 1 211 1 . . . 1 1 212 1 . . . 1 1 213 1 . . . 1 1 214 1 . . . 1 1 215 1 . . . 1 1 216 1 . . . 1 1 217 1 . . . 1 1 218 1 . . . 1 1 219 1 . . . 1 1 220 1 . . . 1 1 221 1 . . . 1 1 222 1 . . . 1 1 223 1 . . . 1 1 224 1 . . . 1 1 225 1 . . . 1 1 226 1 . . . 1 1 227 1 . . . 1 1 228 1 . . . 1 1 229 1 . . . 1 1 230 1 . . . 1 1 231 1 . . . 1 1 232 1 . . . 1 1 233 1 . . . 1 1 234 1 . . . 1 1 235 1 . . . 1 1 236 1 . . . 1 1 237 1 . . . 1 1 238 1 . . . 1 1 239 1 . . . 1 1 240 1 . . . 1 1 241 1 . . . 1 1 242 1 . . . 1 1 243 1 . . . 1 1 244 1 . . . 1 1 245 1 . . . 1 1 246 1 . . . 1 1 247 1 . . . 1 1 248 1 . . . 1 1 249 1 . . . 1 1 250 1 . . . 1 1 251 1 . . . 1 1 252 1 . . . 1 1 253 1 . . . 1 1 254 1 . . . 1 1 255 1 . . . 1 1 256 1 . . . 1 1 257 1 . . . 1 1 258 1 . . . 1 1 259 1 . . . 1 1 260 1 . . . 1 1 261 1 . . . 1 1 262 1 . . . 1 1 263 1 . . . 1 1 264 1 . . . 1 1 265 1 . . . 1 1 266 1 . . . 1 1 267 1 . . . 1 1 268 1 . . . 1 1 269 1 . . . 1 1 270 1 . . . 1 1 271 1 . . . 1 1 272 1 . . . 1 1 273 1 . . . 1 1 274 1 . . . 1 1 275 1 . . . 1 1 276 1 . . . 1 1 277 1 . . . 1 1 278 1 . . . 1 1 279 1 . . . 1 1 280 1 . . . 1 1 281 1 . . . 1 1 282 1 . . . 1 1 283 1 . . . 1 1 284 1 . . . 1 1 285 1 . . . 1 1 286 1 . . . 1 1 287 1 . . . 1 1 288 1 . . . 1 1 289 1 . . . 1 1 290 1 . . . 1 1 291 1 . . . 1 1 292 1 . . . 1 1 293 1 . . . 1 1 294 1 . . . 1 1 295 1 . . . 1 1 296 1 . . . 1 1 297 1 . . . 1 1 298 1 . . . 1 1 299 1 . . . 1 1 300 1 . . . 1 1 301 1 . . . 1 1 302 1 . . . 1 1 303 1 . . . 1 1 304 1 . . . 1 1 305 1 . . . 1 1 306 1 . . . 1 1 307 1 . . . 1 1 308 1 . . . 1 1 309 1 . . . 1 1 310 1 . . . 1 1 311 1 . . . 1 1 312 1 . . . 1 1 313 1 . . . 1 1 314 1 . . . 1 1 315 1 . . . 1 1 316 1 . . . 1 1 317 1 . . . 1 1 318 1 . . . 1 1 319 1 . . . 1 1 320 1 . . . 1 1 321 1 . . . 1 1 322 1 . . . 1 1 323 1 . . . 1 1 324 1 . . . 1 1 325 1 . . . 1 1 326 1 . . . 1 1 327 1 . . . 1 1 328 1 . . . 1 1 329 1 . . . 1 1 330 1 . . . 1 1 331 1 . . . 1 1 332 1 . . . 1 1 333 1 . . . 1 1 334 1 . . . 1 1 335 1 . . . 1 1 336 1 . . . 1 1 337 1 . . . 1 1 338 1 . . . 1 1 339 1 . . . 1 1 340 1 . . . 1 1 341 1 . . . 1 1 342 1 . . . 1 1 343 1 . . . 1 1 344 1 . . . 1 1 345 1 . . . 1 1 346 1 . . . 1 1 347 1 . . . 1 1 348 1 . . . 1 1 349 1 . . . 1 1 350 1 . . . 1 1 351 1 . . . 1 1 352 1 . . . 1 1 353 1 . . . 1 1 354 1 . . . 1 1 355 1 . . . 1 1 356 1 . . . 1 1 357 1 . . . 1 1 358 1 . . . 1 1 359 1 . . . 1 1 360 1 . . . 1 1 361 1 . . . 1 1 362 1 . . . 1 1 363 1 . . . 1 1 364 1 . . . 1 1 365 1 . . . 1 1 366 1 . . . 1 1 367 1 . . . 1 1 368 1 . . . 1 1 369 1 . . . 1 1 370 1 . . . 1 1 371 1 . . . 1 1 372 1 . . . 1 1 373 1 . . . 1 1 374 1 . . . 1 1 375 1 . . . 1 1 376 1 . . . 1 1 377 1 . . . 1 1 378 1 . . . 1 1 379 1 . . . 1 1 380 1 . . . 1 1 381 1 . . . 1 1 382 1 . . . 1 1 383 1 . . . 1 1 384 1 . . . 1 1 385 1 . . . 1 1 386 1 . . . 1 1 387 1 . . . 1 1 388 1 . . . 1 1 389 1 . . . 1 1 390 1 . . . 1 1 391 1 . . . 1 1 392 1 . . . 1 1 393 1 . . . 1 1 394 1 . . . 1 1 395 1 . . . 1 1 396 1 . . . 1 1 397 1 . . . 1 1 398 1 . . . 1 1 399 1 . . . 1 1 400 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 1 543 1 . . . 1 1 544 1 . . . 1 1 545 1 . . . 1 1 546 1 . . . 1 1 547 1 . . . 1 1 548 1 . . . 1 1 549 1 . . . 1 1 550 1 . . . 1 1 551 1 . . . 1 1 552 1 . . . 1 1 553 1 . . . 1 1 554 1 . . . 1 1 555 1 . . . 1 1 556 1 . . . 1 1 557 1 . . . 1 1 558 1 . . . 1 1 559 1 . . . 1 1 560 1 . . . 1 1 561 1 . . . 1 1 562 1 . . . 1 1 563 1 . . . 1 1 564 1 . . . 1 1 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 2 ARG HA . 2 . HA 1 1 1 1 2 1 1 3 LYS H . 3 . HN 1 1 2 1 1 1 1 3 LYS H . 3 . HN 1 1 2 1 2 1 1 3 LYS HA . 3 . HA 1 1 3 1 1 1 1 3 LYS H . 3 . HN 1 1 3 1 2 1 1 3 LYS HB2 . 3 . HB2 1 1 4 1 1 1 1 3 LYS H . 3 . HN 1 1 4 1 2 1 1 3 LYS HB3 . 3 . HB1 1 1 5 1 1 1 1 3 LYS H . 3 . HN 1 1 5 1 2 1 1 4 PHE HA . 4 . HA 1 1 6 1 1 1 1 3 LYS H . 3 . HN 1 1 6 1 2 1 1 62 GLU O . 62 . O 1 1 7 1 1 1 1 3 LYS H . 3 . HN 1 1 7 1 2 1 1 63 ASP HA . 63 . HA 1 1 8 1 1 1 1 3 LYS HA . 3 . HA 1 1 8 1 2 1 1 4 PHE H . 4 . HN 1 1 9 1 1 1 1 3 LYS HA . 3 . HA 1 1 9 1 2 1 1 39 VAL MG1 . 39 . HG1# 1 1 10 1 1 1 1 3 LYS HB2 . 3 . HB2 1 1 10 1 2 1 1 4 PHE H . 4 . HN 1 1 11 1 1 1 1 3 LYS HB3 . 3 . HB1 1 1 11 1 2 1 1 4 PHE H . 4 . HN 1 1 12 1 1 1 1 3 LYS N . 3 . N 1 1 12 1 2 1 1 62 GLU O . 62 . O 1 1 13 1 1 1 1 3 LYS O . 3 . O 1 1 13 1 2 1 1 62 GLU H . 62 . HN 1 1 14 1 1 1 1 3 LYS O . 3 . O 1 1 14 1 2 1 1 62 GLU N . 62 . N 1 1 15 1 1 1 1 4 PHE CG . 4 . CG 1 1 15 1 2 1 1 5 TYR H . 5 . HN 1 1 16 1 1 1 1 4 PHE CG . 4 . CG 1 1 16 1 2 1 1 47 VAL MG1 . 47 . HG1# 1 1 17 1 1 1 1 4 PHE CG . 4 . CG 1 1 17 1 2 1 1 59 ILE QG . 59 . HG1# 1 1 18 1 1 1 1 4 PHE CG . 4 . CG 1 1 18 1 2 1 1 62 GLU H . 62 . HN 1 1 19 1 1 1 1 4 PHE CZ . 4 . CZ 1 1 19 1 2 1 1 24 ALA MB . 24 . HB# 1 1 20 1 1 1 1 4 PHE CZ . 4 . CZ 1 1 20 1 2 1 1 36 VAL MG1 . 36 . HG1# 1 1 21 1 1 1 1 4 PHE CZ . 4 . CZ 1 1 21 1 2 1 1 39 VAL HA . 39 . HA 1 1 22 1 1 1 1 4 PHE CZ . 4 . CZ 1 1 22 1 2 1 1 39 VAL MG1 . 39 . HG1# 1 1 23 1 1 1 1 4 PHE CZ . 4 . CZ 1 1 23 1 2 1 1 47 VAL MG1 . 47 . HG1# 1 1 24 1 1 1 1 4 PHE H . 4 . HN 1 1 24 1 2 1 1 5 TYR H . 5 . HN 1 1 25 1 1 1 1 4 PHE H . 4 . HN 1 1 25 1 2 1 1 5 TYR HB3 . 5 . HB1 1 1 26 1 1 1 1 4 PHE H . 4 . HN 1 1 26 1 2 1 1 36 VAL MG1 . 36 . HG1# 1 1 27 1 1 1 1 4 PHE H . 4 . HN 1 1 27 1 2 1 1 39 VAL MG1 . 39 . HG1# 1 1 28 1 1 1 1 4 PHE H . 4 . HN 1 1 28 1 2 1 1 61 TRP HA . 61 . HA 1 1 29 1 1 1 1 4 PHE H . 4 . HN 1 1 29 1 2 1 1 62 GLU HB3 . 62 . HB1 1 1 30 1 1 1 1 4 PHE HA . 4 . HA 1 1 30 1 2 1 1 4 PHE HB2 . 4 . HB2 1 1 31 1 1 1 1 4 PHE HA . 4 . HA 1 1 31 1 2 1 1 4 PHE HB3 . 4 . HB1 1 1 32 1 1 1 1 4 PHE HA . 4 . HA 1 1 32 1 2 1 1 5 TYR CG . 5 . CG 1 1 33 1 1 1 1 4 PHE HA . 4 . HA 1 1 33 1 2 1 1 5 TYR H . 5 . HN 1 1 34 1 1 1 1 4 PHE HA . 4 . HA 1 1 34 1 2 1 1 5 TYR HB3 . 5 . HB1 1 1 35 1 1 1 1 4 PHE HA . 4 . HA 1 1 35 1 2 1 1 51 MET ME . 51 . HE# 1 1 36 1 1 1 1 4 PHE HA . 4 . HA 1 1 36 1 2 1 1 61 TRP HA . 61 . HA 1 1 37 1 1 1 1 4 PHE HA . 4 . HA 1 1 37 1 2 1 1 61 TRP HB3 . 61 . HB1 1 1 38 1 1 1 1 4 PHE HA . 4 . HA 1 1 38 1 2 1 1 61 TRP HE3 . 61 . HE3 1 1 39 1 1 1 1 4 PHE HA . 4 . HA 1 1 39 1 2 1 1 62 GLU H . 62 . HN 1 1 40 1 1 1 1 4 PHE HB2 . 4 . HB2 1 1 40 1 2 1 1 5 TYR H . 5 . HN 1 1 41 1 1 1 1 4 PHE HB2 . 4 . HB2 1 1 41 1 2 1 1 51 MET ME . 51 . HE# 1 1 42 1 1 1 1 4 PHE HB2 . 4 . HB2 1 1 42 1 2 1 1 59 ILE QG . 59 . HG1# 1 1 43 1 1 1 1 4 PHE HB2 . 4 . HB2 1 1 43 1 2 1 1 61 TRP HA . 61 . HA 1 1 44 1 1 1 1 4 PHE HB2 . 4 . HB2 1 1 44 1 2 1 1 61 TRP HE3 . 61 . HE3 1 1 45 1 1 1 1 4 PHE HB3 . 4 . HB1 1 1 45 1 2 1 1 5 TYR H . 5 . HN 1 1 46 1 1 1 1 4 PHE HB3 . 4 . HB1 1 1 46 1 2 1 1 51 MET ME . 51 . HE# 1 1 47 1 1 1 1 4 PHE HB3 . 4 . HB1 1 1 47 1 2 1 1 61 TRP HA . 61 . HA 1 1 48 1 1 1 1 4 PHE HB3 . 4 . HB1 1 1 48 1 2 1 1 61 TRP HE3 . 61 . HE3 1 1 49 1 1 1 1 4 PHE HB3 . 4 . HB1 1 1 49 1 2 1 1 61 TRP HZ3 . 61 . HZ3 1 1 50 1 1 1 1 5 TYR CG . 5 . CG 1 1 50 1 2 1 1 6 VAL H . 6 . HN 1 1 51 1 1 1 1 5 TYR CG . 5 . CG 1 1 51 1 2 1 1 36 VAL MG1 . 36 . HG1# 1 1 52 1 1 1 1 5 TYR CG . 5 . CG 1 1 52 1 2 1 1 62 GLU H . 62 . HN 1 1 53 1 1 1 1 5 TYR CG . 5 . CG 1 1 53 1 2 1 1 62 GLU HA . 62 . HA 1 1 54 1 1 1 1 5 TYR CZ . 5 . CZ 1 1 54 1 2 1 1 6 VAL HA . 6 . HA 1 1 55 1 1 1 1 5 TYR CZ . 5 . CZ 1 1 55 1 2 1 1 7 ASP HA . 7 . HA 1 1 56 1 1 1 1 5 TYR CZ . 5 . CZ 1 1 56 1 2 1 1 7 ASP HB2 . 7 . HB2 1 1 57 1 1 1 1 5 TYR CZ . 5 . CZ 1 1 57 1 2 1 1 60 HIS HB3 . 60 . HB1 1 1 58 1 1 1 1 5 TYR CZ . 5 . CZ 1 1 58 1 2 1 1 62 GLU HA . 62 . HA 1 1 59 1 1 1 1 5 TYR H . 5 . HN 1 1 59 1 2 1 1 6 VAL HA . 6 . HA 1 1 60 1 1 1 1 5 TYR H . 5 . HN 1 1 60 1 2 1 1 6 VAL MG1 . 6 . HG1# 1 1 61 1 1 1 1 5 TYR H . 5 . HN 1 1 61 1 2 1 1 51 MET ME . 51 . HE# 1 1 62 1 1 1 1 5 TYR H . 5 . HN 1 1 62 1 2 1 1 59 ILE QG . 59 . HG1# 1 1 63 1 1 1 1 5 TYR H . 5 . HN 1 1 63 1 2 1 1 60 HIS H . 60 . HN 1 1 64 1 1 1 1 5 TYR H . 5 . HN 1 1 64 1 2 1 1 60 HIS HB2 . 60 . HB2 1 1 65 1 1 1 1 5 TYR H . 5 . HN 1 1 65 1 2 1 1 61 TRP HA . 61 . HA 1 1 66 1 1 1 1 5 TYR HA . 5 . HA 1 1 66 1 2 1 1 5 TYR HB2 . 5 . HB2 1 1 67 1 1 1 1 5 TYR HA . 5 . HA 1 1 67 1 2 1 1 5 TYR HB3 . 5 . HB1 1 1 68 1 1 1 1 5 TYR HA . 5 . HA 1 1 68 1 2 1 1 6 VAL H . 6 . HN 1 1 69 1 1 1 1 5 TYR HA . 5 . HA 1 1 69 1 2 1 1 36 VAL H . 36 . HN 1 1 70 1 1 1 1 5 TYR HA . 5 . HA 1 1 70 1 2 1 1 36 VAL HB . 36 . HB 1 1 71 1 1 1 1 5 TYR HA . 5 . HA 1 1 71 1 2 1 1 36 VAL MG1 . 36 . HG1# 1 1 72 1 1 1 1 5 TYR HB2 . 5 . HB2 1 1 72 1 2 1 1 6 VAL H . 6 . HN 1 1 73 1 1 1 1 5 TYR HB3 . 5 . HB1 1 1 73 1 2 1 1 6 VAL H . 6 . HN 1 1 74 1 1 1 1 5 TYR O . 5 . O 1 1 74 1 2 1 1 60 HIS H . 60 . HN 1 1 75 1 1 1 1 5 TYR O . 5 . O 1 1 75 1 2 1 1 60 HIS N . 60 . N 1 1 76 1 1 1 1 6 VAL H . 6 . HN 1 1 76 1 2 1 1 7 ASP HA . 7 . HA 1 1 77 1 1 1 1 6 VAL H . 6 . HN 1 1 77 1 2 1 1 35 TYR HA . 35 . HA 1 1 78 1 1 1 1 6 VAL H . 6 . HN 1 1 78 1 2 1 1 36 VAL HA . 36 . HA 1 1 79 1 1 1 1 6 VAL H . 6 . HN 1 1 79 1 2 1 1 36 VAL HB . 36 . HB 1 1 80 1 1 1 1 6 VAL H . 6 . HN 1 1 80 1 2 1 1 36 VAL MG1 . 36 . HG1# 1 1 81 1 1 1 1 6 VAL HA . 6 . HA 1 1 81 1 2 1 1 7 ASP H . 7 . HN 1 1 82 1 1 1 1 6 VAL HA . 6 . HA 1 1 82 1 2 1 1 59 ILE HA . 59 . HA 1 1 83 1 1 1 1 6 VAL HB . 6 . HB 1 1 83 1 2 1 1 8 GLN H . 8 . HN 1 1 84 1 1 1 1 6 VAL HB . 6 . HB 1 1 84 1 2 1 1 8 GLN HE22 . 8 . HE22 1 1 85 1 1 1 1 6 VAL HB . 6 . HB 1 1 85 1 2 1 1 35 TYR HA . 35 . HA 1 1 86 1 1 1 1 6 VAL HB . 6 . HB 1 1 86 1 2 1 1 36 VAL H . 36 . HN 1 1 87 1 1 1 1 6 VAL MG1 . 6 . HG1# 1 1 87 1 2 1 1 7 ASP H . 7 . HN 1 1 88 1 1 1 1 6 VAL MG1 . 6 . HG1# 1 1 88 1 2 1 1 7 ASP HA . 7 . HA 1 1 89 1 1 1 1 6 VAL MG1 . 6 . HG1# 1 1 89 1 2 1 1 9 ASP H . 9 . HN 1 1 90 1 1 1 1 6 VAL MG1 . 6 . HG1# 1 1 90 1 2 1 1 36 VAL MG1 . 36 . HG1# 1 1 91 1 1 1 1 7 ASP H . 7 . HN 1 1 91 1 2 1 1 7 ASP HB2 . 7 . HB2 1 1 92 1 1 1 1 7 ASP H . 7 . HN 1 1 92 1 2 1 1 7 ASP HB3 . 7 . HB1 1 1 93 1 1 1 1 7 ASP H . 7 . HN 1 1 93 1 2 1 1 8 GLN HA . 8 . HA 1 1 94 1 1 1 1 7 ASP H . 7 . HN 1 1 94 1 2 1 1 58 CYS HB3 . 58 . HB1 1 1 95 1 1 1 1 7 ASP H . 7 . HN 1 1 95 1 2 1 1 59 ILE HA . 59 . HA 1 1 96 1 1 1 1 7 ASP H . 7 . HN 1 1 96 1 2 1 1 60 HIS HE1 . 60 . HE1 1 1 97 1 1 1 1 7 ASP HA . 7 . HA 1 1 97 1 2 1 1 7 ASP HB2 . 7 . HB2 1 1 98 1 1 1 1 7 ASP HA . 7 . HA 1 1 98 1 2 1 1 8 GLN H . 8 . HN 1 1 99 1 1 1 1 7 ASP HA . 7 . HA 1 1 99 1 2 1 1 8 GLN HA . 8 . HA 1 1 100 1 1 1 1 7 ASP HA . 7 . HA 1 1 100 1 2 1 1 9 ASP H . 9 . HN 1 1 101 1 1 1 1 7 ASP HA . 7 . HA 1 1 101 1 2 1 1 25 PHE CZ . 25 . CZ 1 1 102 1 1 1 1 7 ASP HB2 . 7 . HB2 1 1 102 1 2 1 1 8 GLN H . 8 . HN 1 1 103 1 1 1 1 7 ASP HB2 . 7 . HB2 1 1 103 1 2 1 1 58 CYS HB3 . 58 . HB1 1 1 104 1 1 1 1 7 ASP HB2 . 7 . HB2 1 1 104 1 2 1 1 60 HIS HE1 . 60 . HE1 1 1 105 1 1 1 1 7 ASP HB3 . 7 . HB1 1 1 105 1 2 1 1 10 GLU H . 10 . HN 1 1 106 1 1 1 1 7 ASP HB3 . 7 . HB1 1 1 106 1 2 1 1 58 CYS HA . 58 . HA 1 1 107 1 1 1 1 7 ASP HB3 . 7 . HB1 1 1 107 1 2 1 1 58 CYS HB3 . 58 . HB1 1 1 108 1 1 1 1 7 ASP HB3 . 7 . HB1 1 1 108 1 2 1 1 60 HIS HE1 . 60 . HE1 1 1 109 1 1 1 1 8 GLN H . 8 . HN 1 1 109 1 2 1 1 8 GLN HB3 . 8 . HB1 1 1 110 1 1 1 1 8 GLN H . 8 . HN 1 1 110 1 2 1 1 9 ASP H . 9 . HN 1 1 111 1 1 1 1 8 GLN H . 8 . HN 1 1 111 1 2 1 1 9 ASP HB2 . 9 . HB2 1 1 112 1 1 1 1 8 GLN HA . 8 . HA 1 1 112 1 2 1 1 10 GLU H . 10 . HN 1 1 113 1 1 1 1 8 GLN HA . 8 . HA 1 1 113 1 2 1 1 11 CYS H . 11 . HN 1 1 114 1 1 1 1 8 GLN HA . 8 . HA 1 1 114 1 2 1 1 11 CYS HB2 . 11 . HB1 1 1 115 1 1 1 1 8 GLN HA . 8 . HA 1 1 115 1 2 1 1 11 CYS HB3 . 11 . HB2 1 1 116 1 1 1 1 8 GLN HA . 8 . HA 1 1 116 1 2 1 1 33 LYS HB3 . 33 . HB1 1 1 117 1 1 1 1 8 GLN HB2 . 8 . HB2 1 1 117 1 2 1 1 9 ASP H . 9 . HN 1 1 118 1 1 1 1 8 GLN HB3 . 8 . HB1 1 1 118 1 2 1 1 9 ASP H . 9 . HN 1 1 119 1 1 1 1 8 GLN HB3 . 8 . HB1 1 1 119 1 2 1 1 11 CYS HB2 . 11 . HB1 1 1 120 1 1 1 1 8 GLN HE21 . 8 . HE21 1 1 120 1 2 1 1 35 TYR QB . 35 . HB# 1 1 121 1 1 1 1 8 GLN HE22 . 8 . HE22 1 1 121 1 2 1 1 35 TYR QB . 35 . HB# 1 1 122 1 1 1 1 9 ASP H . 9 . HN 1 1 122 1 2 1 1 9 ASP HB2 . 9 . HB2 1 1 123 1 1 1 1 9 ASP H . 9 . HN 1 1 123 1 2 1 1 9 ASP HB3 . 9 . HB1 1 1 124 1 1 1 1 9 ASP H . 9 . HN 1 1 124 1 2 1 1 10 GLU H . 10 . HN 1 1 125 1 1 1 1 9 ASP H . 9 . HN 1 1 125 1 2 1 1 10 GLU HB3 . 10 . HB1 1 1 126 1 1 1 1 9 ASP HA . 9 . HA 1 1 126 1 2 1 1 9 ASP HB3 . 9 . HB1 1 1 127 1 1 1 1 9 ASP HB2 . 9 . HB2 1 1 127 1 2 1 1 10 GLU H . 10 . HN 1 1 128 1 1 1 1 9 ASP HB3 . 9 . HB1 1 1 128 1 2 1 1 10 GLU H . 10 . HN 1 1 129 1 1 1 1 9 ASP HB3 . 9 . HB1 1 1 129 1 2 1 1 10 GLU HA . 10 . HA 1 1 130 1 1 1 1 10 GLU H . 10 . HN 1 1 130 1 2 1 1 10 GLU HB2 . 10 . HB2 1 1 131 1 1 1 1 10 GLU H . 10 . HN 1 1 131 1 2 1 1 10 GLU HG3 . 10 . HG1 1 1 132 1 1 1 1 10 GLU HA . 10 . HA 1 1 132 1 2 1 1 10 GLU HB2 . 10 . HB2 1 1 133 1 1 1 1 10 GLU HB2 . 10 . HB2 1 1 133 1 2 1 1 58 CYS HA . 58 . HA 1 1 134 1 1 1 1 10 GLU HB2 . 10 . HB2 1 1 134 1 2 1 1 58 CYS HB3 . 58 . HB1 1 1 135 1 1 1 1 11 CYS H . 11 . HN 1 1 135 1 2 1 1 33 LYS QB . 33 . HB# 1 1 136 1 1 1 1 11 CYS HB2 . 11 . HB1 1 1 136 1 2 1 1 33 LYS QB . 33 . HB# 1 1 137 1 1 1 1 11 CYS HB3 . 11 . HB2 1 1 137 1 2 1 1 33 LYS HA . 33 . HA 1 1 138 1 1 1 1 11 CYS HB3 . 11 . HB2 1 1 138 1 2 1 1 33 LYS QB . 33 . HB# 1 1 139 1 1 1 1 11 CYS SG . 11 . SG 1 1 139 1 2 1 1 14 CYS SG . 14 . SG 1 1 140 1 1 1 1 11 CYS SG . 11 . SG 1 1 140 1 2 1 1 17 CYS SG . 17 . SG 1 1 141 1 1 1 1 11 CYS SG . 11 . SG 1 1 141 1 2 1 1 54 CYS SG . 54 . SG 1 1 142 1 1 1 1 12 ILE QG . 12 . HG1# 1 1 142 1 2 1 1 14 CYS HB3 . 14 . HB2 1 1 143 1 1 1 1 14 CYS HA . 14 . HA 1 1 143 1 2 1 1 14 CYS HB2 . 14 . HB1 1 1 144 1 1 1 1 14 CYS HA . 14 . HA 1 1 144 1 2 1 1 14 CYS HB3 . 14 . HB2 1 1 145 1 1 1 1 14 CYS SG . 14 . SG 1 1 145 1 2 1 1 17 CYS SG . 17 . SG 1 1 146 1 1 1 1 14 CYS SG . 14 . SG 1 1 146 1 2 1 1 54 CYS SG . 54 . SG 1 1 147 1 1 1 1 15 GLU O . 15 . O 1 1 147 1 2 1 1 19 GLU H . 19 . HN 1 1 148 1 1 1 1 15 GLU O . 15 . O 1 1 148 1 2 1 1 19 GLU N . 19 . N 1 1 149 1 1 1 1 16 SER O . 16 . O 1 1 149 1 2 1 1 20 ILE H . 20 . HN 1 1 150 1 1 1 1 16 SER O . 16 . O 1 1 150 1 2 1 1 20 ILE N . 20 . N 1 1 151 1 1 1 1 17 CYS HB2 . 17 . HB1 1 1 151 1 2 1 1 25 PHE CG . 25 . CG 1 1 152 1 1 1 1 17 CYS HB2 . 17 . HB1 1 1 152 1 2 1 1 25 PHE CZ . 25 . CZ 1 1 153 1 1 1 1 17 CYS HB2 . 17 . HB1 1 1 153 1 2 1 1 25 PHE HB2 . 25 . HB2 1 1 154 1 1 1 1 17 CYS HB2 . 17 . HB1 1 1 154 1 2 1 1 25 PHE HB3 . 25 . HB1 1 1 155 1 1 1 1 17 CYS HB2 . 17 . HB1 1 1 155 1 2 1 1 50 ALA HA . 50 . HA 1 1 156 1 1 1 1 17 CYS HB2 . 17 . HB1 1 1 156 1 2 1 1 50 ALA MB . 50 . HB# 1 1 157 1 1 1 1 17 CYS O . 17 . O 1 1 157 1 2 1 1 21 ALA H . 21 . HN 1 1 158 1 1 1 1 17 CYS O . 17 . O 1 1 158 1 2 1 1 21 ALA N . 21 . N 1 1 159 1 1 1 1 17 CYS SG . 17 . SG 1 1 159 1 2 1 1 54 CYS SG . 54 . SG 1 1 160 1 1 1 1 18 VAL H . 18 . HN 1 1 160 1 2 1 1 18 VAL HA . 18 . HA 1 1 161 1 1 1 1 18 VAL H . 18 . HN 1 1 161 1 2 1 1 18 VAL HB . 18 . HB 1 1 162 1 1 1 1 18 VAL HA . 18 . HA 1 1 162 1 2 1 1 20 ILE H . 20 . HN 1 1 163 1 1 1 1 18 VAL HA . 18 . HA 1 1 163 1 2 1 1 21 ALA H . 21 . HN 1 1 164 1 1 1 1 18 VAL HA . 18 . HA 1 1 164 1 2 1 1 25 PHE H . 25 . HN 1 1 165 1 1 1 1 18 VAL HA . 18 . HA 1 1 165 1 2 1 1 25 PHE HB2 . 25 . HB2 1 1 166 1 1 1 1 18 VAL HA . 18 . HA 1 1 166 1 2 1 1 25 PHE HB3 . 25 . HB1 1 1 167 1 1 1 1 18 VAL HB . 18 . HB 1 1 167 1 2 1 1 19 GLU H . 19 . HN 1 1 168 1 1 1 1 18 VAL MG1 . 18 . HG1# 1 1 168 1 2 1 1 19 GLU HA . 19 . HA 1 1 169 1 1 1 1 18 VAL MG1 . 18 . HG1# 1 1 169 1 2 1 1 26 ALA HA . 26 . HA 1 1 170 1 1 1 1 18 VAL MG1 . 18 . HG1# 1 1 170 1 2 1 1 27 MET H . 27 . HN 1 1 171 1 1 1 1 19 GLU H . 19 . HN 1 1 171 1 2 1 1 19 GLU HB2 . 19 . HB2 1 1 172 1 1 1 1 19 GLU H . 19 . HN 1 1 172 1 2 1 1 19 GLU HB3 . 19 . HB1 1 1 173 1 1 1 1 19 GLU H . 19 . HN 1 1 173 1 2 1 1 19 GLU HG2 . 19 . HG2 1 1 174 1 1 1 1 19 GLU H . 19 . HN 1 1 174 1 2 1 1 19 GLU HG3 . 19 . HG1 1 1 175 1 1 1 1 19 GLU H . 19 . HN 1 1 175 1 2 1 1 20 ILE H . 20 . HN 1 1 176 1 1 1 1 19 GLU H . 19 . HN 1 1 176 1 2 1 1 21 ALA H . 21 . HN 1 1 177 1 1 1 1 19 GLU HA . 19 . HA 1 1 177 1 2 1 1 19 GLU HB2 . 19 . HB2 1 1 178 1 1 1 1 19 GLU HA . 19 . HA 1 1 178 1 2 1 1 21 ALA H . 21 . HN 1 1 179 1 1 1 1 19 GLU HB2 . 19 . HB2 1 1 179 1 2 1 1 20 ILE H . 20 . HN 1 1 180 1 1 1 1 19 GLU HB3 . 19 . HB1 1 1 180 1 2 1 1 20 ILE H . 20 . HN 1 1 181 1 1 1 1 19 GLU HB3 . 19 . HB1 1 1 181 1 2 1 1 20 ILE HA . 20 . HA 1 1 182 1 1 1 1 20 ILE H . 20 . HN 1 1 182 1 2 1 1 20 ILE HB . 20 . HB 1 1 183 1 1 1 1 20 ILE H . 20 . HN 1 1 183 1 2 1 1 20 ILE HG12 . 20 . HG12 1 1 184 1 1 1 1 20 ILE H . 20 . HN 1 1 184 1 2 1 1 20 ILE HG13 . 20 . HG11 1 1 185 1 1 1 1 20 ILE H . 20 . HN 1 1 185 1 2 1 1 21 ALA H . 21 . HN 1 1 186 1 1 1 1 20 ILE HA . 20 . HA 1 1 186 1 2 1 1 20 ILE HG12 . 20 . HG12 1 1 187 1 1 1 1 20 ILE HA . 20 . HA 1 1 187 1 2 1 1 20 ILE HG13 . 20 . HG11 1 1 188 1 1 1 1 20 ILE HA . 20 . HA 1 1 188 1 2 1 1 21 ALA HA . 21 . HA 1 1 189 1 1 1 1 20 ILE HA . 20 . HA 1 1 189 1 2 1 1 22 PRO HD2 . 22 . HD2 1 1 190 1 1 1 1 20 ILE HB . 20 . HB 1 1 190 1 2 1 1 20 ILE HG12 . 20 . HG12 1 1 191 1 1 1 1 20 ILE HB . 20 . HB 1 1 191 1 2 1 1 20 ILE HG13 . 20 . HG11 1 1 192 1 1 1 1 20 ILE HB . 20 . HB 1 1 192 1 2 1 1 21 ALA H . 21 . HN 1 1 193 1 1 1 1 20 ILE QG . 20 . HG1# 1 1 193 1 2 1 1 21 ALA H . 21 . HN 1 1 194 1 1 1 1 20 ILE QG . 20 . HG1# 1 1 194 1 2 1 1 46 GLU HA . 46 . HA 1 1 195 1 1 1 1 20 ILE QG . 20 . HG1# 1 1 195 1 2 1 1 50 ALA H . 50 . HN 1 1 196 1 1 1 1 20 ILE QG . 20 . HG1# 1 1 196 1 2 1 1 50 ALA HA . 50 . HA 1 1 197 1 1 1 1 20 ILE QG . 20 . HG1# 1 1 197 1 2 1 1 53 THR H . 53 . HN 1 1 198 1 1 1 1 20 ILE QG . 20 . HG1# 1 1 198 1 2 1 1 53 THR HB . 53 . HB 1 1 199 1 1 1 1 20 ILE HG13 . 20 . HG11 1 1 199 1 2 1 1 50 ALA HA . 50 . HA 1 1 200 1 1 1 1 21 ALA H . 21 . HN 1 1 200 1 2 1 1 22 PRO HA . 22 . HA 1 1 201 1 1 1 1 21 ALA H . 21 . HN 1 1 201 1 2 1 1 22 PRO HD2 . 22 . HD2 1 1 202 1 1 1 1 21 ALA H . 21 . HN 1 1 202 1 2 1 1 22 PRO HD3 . 22 . HD1 1 1 203 1 1 1 1 21 ALA H . 21 . HN 1 1 203 1 2 1 1 25 PHE CG . 25 . CG 1 1 204 1 1 1 1 21 ALA H . 21 . HN 1 1 204 1 2 1 1 50 ALA MB . 50 . HB# 1 1 205 1 1 1 1 21 ALA HA . 21 . HA 1 1 205 1 2 1 1 22 PRO HD2 . 22 . HD2 1 1 206 1 1 1 1 21 ALA HA . 21 . HA 1 1 206 1 2 1 1 22 PRO HD3 . 22 . HD1 1 1 207 1 1 1 1 21 ALA HA . 21 . HA 1 1 207 1 2 1 1 24 ALA MB . 24 . HB# 1 1 208 1 1 1 1 21 ALA HA . 21 . HA 1 1 208 1 2 1 1 42 ALA MB . 42 . HB# 1 1 209 1 1 1 1 21 ALA MB . 21 . HB# 1 1 209 1 2 1 1 23 GLY H . 23 . HN 1 1 210 1 1 1 1 21 ALA MB . 21 . HB# 1 1 210 1 2 1 1 24 ALA H . 24 . HN 1 1 211 1 1 1 1 21 ALA MB . 21 . HB# 1 1 211 1 2 1 1 25 PHE CG . 25 . CG 1 1 212 1 1 1 1 21 ALA MB . 21 . HB# 1 1 212 1 2 1 1 25 PHE CZ . 25 . CZ 1 1 213 1 1 1 1 21 ALA MB . 21 . HB# 1 1 213 1 2 1 1 25 PHE H . 25 . HN 1 1 214 1 1 1 1 21 ALA MB . 21 . HB# 1 1 214 1 2 1 1 42 ALA HA . 42 . HA 1 1 215 1 1 1 1 21 ALA MB . 21 . HB# 1 1 215 1 2 1 1 46 GLU HA . 46 . HA 1 1 216 1 1 1 1 21 ALA MB . 21 . HB# 1 1 216 1 2 1 1 47 VAL H . 47 . HN 1 1 217 1 1 1 1 21 ALA MB . 21 . HB# 1 1 217 1 2 1 1 47 VAL HA . 47 . HA 1 1 218 1 1 1 1 21 ALA MB . 21 . HB# 1 1 218 1 2 1 1 50 ALA H . 50 . HN 1 1 219 1 1 1 1 21 ALA O . 21 . O 1 1 219 1 2 1 1 25 PHE H . 25 . HN 1 1 220 1 1 1 1 21 ALA O . 21 . O 1 1 220 1 2 1 1 25 PHE N . 25 . N 1 1 221 1 1 1 1 22 PRO HA . 22 . HA 1 1 221 1 2 1 1 25 PHE H . 25 . HN 1 1 222 1 1 1 1 22 PRO HD3 . 22 . HD1 1 1 222 1 2 1 1 23 GLY H . 23 . HN 1 1 223 1 1 1 1 23 GLY H . 23 . HN 1 1 223 1 2 1 1 24 ALA H . 24 . HN 1 1 224 1 1 1 1 23 GLY H . 23 . HN 1 1 224 1 2 1 1 25 PHE H . 25 . HN 1 1 225 1 1 1 1 23 GLY H . 23 . HN 1 1 225 1 2 1 1 41 GLY HA3 . 41 . HA1 1 1 226 1 1 1 1 23 GLY H . 23 . HN 1 1 226 1 2 1 1 42 ALA MB . 42 . HB# 1 1 227 1 1 1 1 23 GLY HA3 . 23 . HA1 1 1 227 1 2 1 1 25 PHE H . 25 . HN 1 1 228 1 1 1 1 24 ALA H . 24 . HN 1 1 228 1 2 1 1 25 PHE HA . 25 . HA 1 1 229 1 1 1 1 24 ALA H . 24 . HN 1 1 229 1 2 1 1 25 PHE HB2 . 25 . HB2 1 1 230 1 1 1 1 24 ALA H . 24 . HN 1 1 230 1 2 1 1 41 GLY HA2 . 41 . HA2 1 1 231 1 1 1 1 24 ALA H . 24 . HN 1 1 231 1 2 1 1 41 GLY HA3 . 41 . HA1 1 1 232 1 1 1 1 24 ALA H . 24 . HN 1 1 232 1 2 1 1 42 ALA MB . 42 . HB# 1 1 233 1 1 1 1 24 ALA HA . 24 . HA 1 1 233 1 2 1 1 37 LYS QG . 37 . HG# 1 1 234 1 1 1 1 24 ALA HA . 24 . HA 1 1 234 1 2 1 1 38 ASP H . 38 . HN 1 1 235 1 1 1 1 24 ALA HA . 24 . HA 1 1 235 1 2 1 1 41 GLY H . 41 . HN 1 1 236 1 1 1 1 24 ALA HA . 24 . HA 1 1 236 1 2 1 1 41 GLY HA3 . 41 . HA1 1 1 237 1 1 1 1 24 ALA MB . 24 . HB# 1 1 237 1 2 1 1 25 PHE CG . 25 . CG 1 1 238 1 1 1 1 24 ALA MB . 24 . HB# 1 1 238 1 2 1 1 36 VAL MG1 . 36 . HG1# 1 1 239 1 1 1 1 24 ALA MB . 24 . HB# 1 1 239 1 2 1 1 38 ASP H . 38 . HN 1 1 240 1 1 1 1 24 ALA MB . 24 . HB# 1 1 240 1 2 1 1 39 VAL HA . 39 . HA 1 1 241 1 1 1 1 24 ALA MB . 24 . HB# 1 1 241 1 2 1 1 41 GLY H . 41 . HN 1 1 242 1 1 1 1 24 ALA MB . 24 . HB# 1 1 242 1 2 1 1 41 GLY HA3 . 41 . HA1 1 1 243 1 1 1 1 24 ALA MB . 24 . HB# 1 1 243 1 2 1 1 42 ALA H . 42 . HN 1 1 244 1 1 1 1 24 ALA MB . 24 . HB# 1 1 244 1 2 1 1 47 VAL MG1 . 47 . HG1# 1 1 245 1 1 1 1 25 PHE CG . 25 . CG 1 1 245 1 2 1 1 36 VAL HA . 36 . HA 1 1 246 1 1 1 1 25 PHE CG . 25 . CG 1 1 246 1 2 1 1 36 VAL MG1 . 36 . HG1# 1 1 247 1 1 1 1 25 PHE CZ . 25 . CZ 1 1 247 1 2 1 1 47 VAL MG1 . 47 . HG1# 1 1 248 1 1 1 1 25 PHE CZ . 25 . CZ 1 1 248 1 2 1 1 59 ILE QG . 59 . HG1# 1 1 249 1 1 1 1 25 PHE H . 25 . HN 1 1 249 1 2 1 1 25 PHE HB2 . 25 . HB2 1 1 250 1 1 1 1 25 PHE HA . 25 . HA 1 1 250 1 2 1 1 26 ALA H . 26 . HN 1 1 251 1 1 1 1 25 PHE HA . 25 . HA 1 1 251 1 2 1 1 26 ALA HA . 26 . HA 1 1 252 1 1 1 1 25 PHE HA . 25 . HA 1 1 252 1 2 1 1 26 ALA MB . 26 . HB# 1 1 253 1 1 1 1 25 PHE HA . 25 . HA 1 1 253 1 2 1 1 35 TYR H . 35 . HN 1 1 254 1 1 1 1 25 PHE HA . 25 . HA 1 1 254 1 2 1 1 36 VAL HA . 36 . HA 1 1 255 1 1 1 1 25 PHE HA . 25 . HA 1 1 255 1 2 1 1 36 VAL MG1 . 36 . HG1# 1 1 256 1 1 1 1 25 PHE HA . 25 . HA 1 1 256 1 2 1 1 37 LYS H . 37 . HN 1 1 257 1 1 1 1 25 PHE HA . 25 . HA 1 1 257 1 2 1 1 38 ASP H . 38 . HN 1 1 258 1 1 1 1 25 PHE HB2 . 25 . HB2 1 1 258 1 2 1 1 26 ALA H . 26 . HN 1 1 259 1 1 1 1 25 PHE HB3 . 25 . HB1 1 1 259 1 2 1 1 26 ALA H . 26 . HN 1 1 260 1 1 1 1 25 PHE HB3 . 25 . HB1 1 1 260 1 2 1 1 35 TYR H . 35 . HN 1 1 261 1 1 1 1 26 ALA H . 26 . HN 1 1 261 1 2 1 1 27 MET H . 27 . HN 1 1 262 1 1 1 1 26 ALA H . 26 . HN 1 1 262 1 2 1 1 35 TYR H . 35 . HN 1 1 263 1 1 1 1 26 ALA H . 26 . HN 1 1 263 1 2 1 1 35 TYR O . 35 . O 1 1 264 1 1 1 1 26 ALA H . 26 . HN 1 1 264 1 2 1 1 36 VAL HA . 36 . HA 1 1 265 1 1 1 1 26 ALA H . 26 . HN 1 1 265 1 2 1 1 37 LYS HG2 . 37 . HG2 1 1 266 1 1 1 1 26 ALA HA . 26 . HA 1 1 266 1 2 1 1 27 MET H . 27 . HN 1 1 267 1 1 1 1 26 ALA HA . 26 . HA 1 1 267 1 2 1 1 35 TYR H . 35 . HN 1 1 268 1 1 1 1 26 ALA MB . 26 . HB# 1 1 268 1 2 1 1 27 MET HA . 27 . HA 1 1 269 1 1 1 1 26 ALA MB . 26 . HB# 1 1 269 1 2 1 1 35 TYR CZ . 35 . CZ 1 1 270 1 1 1 1 26 ALA MB . 26 . HB# 1 1 270 1 2 1 1 35 TYR H . 35 . HN 1 1 271 1 1 1 1 26 ALA N . 26 . N 1 1 271 1 2 1 1 35 TYR O . 35 . O 1 1 272 1 1 1 1 26 ALA O . 26 . O 1 1 272 1 2 1 1 35 TYR H . 35 . HN 1 1 273 1 1 1 1 26 ALA O . 26 . O 1 1 273 1 2 1 1 35 TYR N . 35 . N 1 1 274 1 1 1 1 27 MET H . 27 . HN 1 1 274 1 2 1 1 35 TYR CZ . 35 . CZ 1 1 275 1 1 1 1 27 MET HA . 27 . HA 1 1 275 1 2 1 1 28 ASP H . 28 . HN 1 1 276 1 1 1 1 27 MET HA . 27 . HA 1 1 276 1 2 1 1 34 ALA HA . 34 . HA 1 1 277 1 1 1 1 27 MET HA . 27 . HA 1 1 277 1 2 1 1 35 TYR CG . 35 . CG 1 1 278 1 1 1 1 27 MET HA . 27 . HA 1 1 278 1 2 1 1 35 TYR H . 35 . HN 1 1 279 1 1 1 1 27 MET QB . 27 . HB# 1 1 279 1 2 1 1 34 ALA HA . 34 . HA 1 1 280 1 1 1 1 27 MET HB2 . 27 . HB2 1 1 280 1 2 1 1 28 ASP H . 28 . HN 1 1 281 1 1 1 1 27 MET HB3 . 27 . HB1 1 1 281 1 2 1 1 28 ASP H . 28 . HN 1 1 282 1 1 1 1 27 MET HB3 . 27 . HB1 1 1 282 1 2 1 1 33 LYS H . 33 . HN 1 1 283 1 1 1 1 28 ASP H . 28 . HN 1 1 283 1 2 1 1 28 ASP HB2 . 28 . HB2 1 1 284 1 1 1 1 28 ASP H . 28 . HN 1 1 284 1 2 1 1 28 ASP HB3 . 28 . HB1 1 1 285 1 1 1 1 28 ASP H . 28 . HN 1 1 285 1 2 1 1 31 ILE H . 31 . HN 1 1 286 1 1 1 1 28 ASP H . 28 . HN 1 1 286 1 2 1 1 31 ILE HA . 31 . HA 1 1 287 1 1 1 1 28 ASP H . 28 . HN 1 1 287 1 2 1 1 31 ILE HG12 . 31 . HG12 1 1 288 1 1 1 1 28 ASP H . 28 . HN 1 1 288 1 2 1 1 32 GLU H . 32 . HN 1 1 289 1 1 1 1 28 ASP H . 28 . HN 1 1 289 1 2 1 1 32 GLU HA . 32 . HA 1 1 290 1 1 1 1 28 ASP H . 28 . HN 1 1 290 1 2 1 1 33 LYS H . 33 . HN 1 1 291 1 1 1 1 28 ASP H . 28 . HN 1 1 291 1 2 1 1 33 LYS O . 33 . O 1 1 292 1 1 1 1 28 ASP H . 28 . HN 1 1 292 1 2 1 1 34 ALA HA . 34 . HA 1 1 293 1 1 1 1 28 ASP H . 28 . HN 1 1 293 1 2 1 1 35 TYR CG . 35 . CG 1 1 294 1 1 1 1 28 ASP H . 28 . HN 1 1 294 1 2 1 1 35 TYR CZ . 35 . CZ 1 1 295 1 1 1 1 28 ASP HA . 28 . HA 1 1 295 1 2 1 1 28 ASP HB2 . 28 . HB2 1 1 296 1 1 1 1 28 ASP HA . 28 . HA 1 1 296 1 2 1 1 29 PRO HA . 29 . HA 1 1 297 1 1 1 1 28 ASP HA . 28 . HA 1 1 297 1 2 1 1 29 PRO HD2 . 29 . HD2 1 1 298 1 1 1 1 28 ASP HA . 28 . HA 1 1 298 1 2 1 1 29 PRO HD3 . 29 . HD1 1 1 299 1 1 1 1 28 ASP HA . 28 . HA 1 1 299 1 2 1 1 30 GLU H . 30 . HN 1 1 300 1 1 1 1 28 ASP HA . 28 . HA 1 1 300 1 2 1 1 31 ILE H . 31 . HN 1 1 301 1 1 1 1 28 ASP HA . 28 . HA 1 1 301 1 2 1 1 35 TYR CG . 35 . CG 1 1 302 1 1 1 1 28 ASP HA . 28 . HA 1 1 302 1 2 1 1 35 TYR CZ . 35 . CZ 1 1 303 1 1 1 1 28 ASP HB2 . 28 . HB2 1 1 303 1 2 1 1 31 ILE H . 31 . HN 1 1 304 1 1 1 1 28 ASP HB2 . 28 . HB2 1 1 304 1 2 1 1 33 LYS H . 33 . HN 1 1 305 1 1 1 1 28 ASP HB2 . 28 . HB2 1 1 305 1 2 1 1 35 TYR CG . 35 . CG 1 1 306 1 1 1 1 28 ASP HB2 . 28 . HB2 1 1 306 1 2 1 1 35 TYR H . 35 . HN 1 1 307 1 1 1 1 28 ASP HB3 . 28 . HB1 1 1 307 1 2 1 1 30 GLU H . 30 . HN 1 1 308 1 1 1 1 28 ASP HB3 . 28 . HB1 1 1 308 1 2 1 1 31 ILE H . 31 . HN 1 1 309 1 1 1 1 28 ASP HB3 . 28 . HB1 1 1 309 1 2 1 1 32 GLU H . 32 . HN 1 1 310 1 1 1 1 28 ASP HB3 . 28 . HB1 1 1 310 1 2 1 1 32 GLU HA . 32 . HA 1 1 311 1 1 1 1 28 ASP HB3 . 28 . HB1 1 1 311 1 2 1 1 33 LYS H . 33 . HN 1 1 312 1 1 1 1 28 ASP N . 28 . N 1 1 312 1 2 1 1 33 LYS O . 33 . O 1 1 313 1 1 1 1 28 ASP O . 28 . O 1 1 313 1 2 1 1 33 LYS H . 33 . HN 1 1 314 1 1 1 1 28 ASP O . 28 . O 1 1 314 1 2 1 1 33 LYS N . 33 . N 1 1 315 1 1 1 1 29 PRO HA . 29 . HA 1 1 315 1 2 1 1 32 GLU H . 32 . HN 1 1 316 1 1 1 1 29 PRO HD2 . 29 . HD2 1 1 316 1 2 1 1 30 GLU H . 30 . HN 1 1 317 1 1 1 1 29 PRO HD3 . 29 . HD1 1 1 317 1 2 1 1 30 GLU H . 30 . HN 1 1 318 1 1 1 1 30 GLU H . 30 . HN 1 1 318 1 2 1 1 30 GLU HB2 . 30 . HB2 1 1 319 1 1 1 1 30 GLU H . 30 . HN 1 1 319 1 2 1 1 31 ILE H . 31 . HN 1 1 320 1 1 1 1 30 GLU H . 30 . HN 1 1 320 1 2 1 1 31 ILE QG . 31 . HG1# 1 1 321 1 1 1 1 30 GLU H . 30 . HN 1 1 321 1 2 1 1 32 GLU H . 32 . HN 1 1 322 1 1 1 1 30 GLU H . 30 . HN 1 1 322 1 2 1 1 32 GLU HA . 32 . HA 1 1 323 1 1 1 1 30 GLU HA . 30 . HA 1 1 323 1 2 1 1 30 GLU HB2 . 30 . HB2 1 1 324 1 1 1 1 30 GLU HA . 30 . HA 1 1 324 1 2 1 1 32 GLU H . 32 . HN 1 1 325 1 1 1 1 30 GLU HA . 30 . HA 1 1 325 1 2 1 1 32 GLU QG . 32 . HG# 1 1 326 1 1 1 1 30 GLU HB2 . 30 . HB2 1 1 326 1 2 1 1 31 ILE H . 31 . HN 1 1 327 1 1 1 1 30 GLU HB3 . 30 . HB1 1 1 327 1 2 1 1 31 ILE H . 31 . HN 1 1 328 1 1 1 1 31 ILE H . 31 . HN 1 1 328 1 2 1 1 31 ILE HG12 . 31 . HG12 1 1 329 1 1 1 1 31 ILE H . 31 . HN 1 1 329 1 2 1 1 31 ILE HG13 . 31 . HG11 1 1 330 1 1 1 1 31 ILE H . 31 . HN 1 1 330 1 2 1 1 32 GLU H . 32 . HN 1 1 331 1 1 1 1 31 ILE H . 31 . HN 1 1 331 1 2 1 1 32 GLU HA . 32 . HA 1 1 332 1 1 1 1 31 ILE HA . 31 . HA 1 1 332 1 2 1 1 32 GLU HB2 . 32 . HB2 1 1 333 1 1 1 1 31 ILE HB . 31 . HB 1 1 333 1 2 1 1 32 GLU H . 32 . HN 1 1 334 1 1 1 1 31 ILE HB . 31 . HB 1 1 334 1 2 1 1 33 LYS H . 33 . HN 1 1 335 1 1 1 1 31 ILE QG . 31 . HG1# 1 1 335 1 2 1 1 32 GLU H . 32 . HN 1 1 336 1 1 1 1 31 ILE QG . 31 . HG1# 1 1 336 1 2 1 1 33 LYS H . 33 . HN 1 1 337 1 1 1 1 31 ILE HG12 . 31 . HG12 1 1 337 1 2 1 1 32 GLU H . 32 . HN 1 1 338 1 1 1 1 31 ILE HG12 . 31 . HG12 1 1 338 1 2 1 1 33 LYS H . 33 . HN 1 1 339 1 1 1 1 31 ILE HG13 . 31 . HG11 1 1 339 1 2 1 1 33 LYS H . 33 . HN 1 1 340 1 1 1 1 32 GLU H . 32 . HN 1 1 340 1 2 1 1 32 GLU HA . 32 . HA 1 1 341 1 1 1 1 32 GLU H . 32 . HN 1 1 341 1 2 1 1 33 LYS H . 33 . HN 1 1 342 1 1 1 1 32 GLU HA . 32 . HA 1 1 342 1 2 1 1 33 LYS H . 33 . HN 1 1 343 1 1 1 1 34 ALA H . 34 . HN 1 1 343 1 2 2 2 1 SF4 FE1 . 65 . FE1 1 1 344 1 1 1 1 35 TYR CG . 35 . CG 1 1 344 1 2 1 1 36 VAL H . 36 . HN 1 1 345 1 1 1 1 35 TYR CG . 35 . CG 1 1 345 1 2 1 1 36 VAL MG1 . 36 . HG1# 1 1 346 1 1 1 1 35 TYR CG . 35 . CG 1 1 346 1 2 1 1 37 LYS HA . 37 . HA 1 1 347 1 1 1 1 35 TYR CZ . 35 . CZ 1 1 347 1 2 1 1 35 TYR H . 35 . HN 1 1 348 1 1 1 1 35 TYR CZ . 35 . CZ 1 1 348 1 2 1 1 36 VAL HA . 36 . HA 1 1 349 1 1 1 1 35 TYR CZ . 35 . CZ 1 1 349 1 2 1 1 37 LYS HA . 37 . HA 1 1 350 1 1 1 1 35 TYR CZ . 35 . CZ 1 1 350 1 2 1 1 38 ASP HB2 . 38 . HB2 1 1 351 1 1 1 1 35 TYR CZ . 35 . CZ 1 1 351 1 2 1 1 38 ASP HB3 . 38 . HB1 1 1 352 1 1 1 1 35 TYR H . 35 . HN 1 1 352 1 2 1 1 36 VAL HA . 36 . HA 1 1 353 1 1 1 1 35 TYR HA . 35 . HA 1 1 353 1 2 1 1 36 VAL H . 36 . HN 1 1 354 1 1 1 1 35 TYR HA . 35 . HA 1 1 354 1 2 1 1 36 VAL HB . 36 . HB 1 1 355 1 1 1 1 36 VAL H . 36 . HN 1 1 355 1 2 1 1 36 VAL HB . 36 . HB 1 1 356 1 1 1 1 36 VAL HA . 36 . HA 1 1 356 1 2 1 1 37 LYS H . 37 . HN 1 1 357 1 1 1 1 36 VAL HA . 36 . HA 1 1 357 1 2 1 1 38 ASP H . 38 . HN 1 1 358 1 1 1 1 36 VAL HB . 36 . HB 1 1 358 1 2 1 1 37 LYS H . 37 . HN 1 1 359 1 1 1 1 36 VAL MG1 . 36 . HG1# 1 1 359 1 2 1 1 37 LYS H . 37 . HN 1 1 360 1 1 1 1 36 VAL MG1 . 36 . HG1# 1 1 360 1 2 1 1 38 ASP H . 38 . HN 1 1 361 1 1 1 1 36 VAL MG1 . 36 . HG1# 1 1 361 1 2 1 1 39 VAL H . 39 . HN 1 1 362 1 1 1 1 36 VAL MG1 . 36 . HG1# 1 1 362 1 2 1 1 39 VAL HA . 39 . HA 1 1 363 1 1 1 1 36 VAL MG1 . 36 . HG1# 1 1 363 1 2 1 1 39 VAL HB . 39 . HB 1 1 364 1 1 1 1 37 LYS H . 37 . HN 1 1 364 1 2 1 1 38 ASP H . 38 . HN 1 1 365 1 1 1 1 37 LYS HA . 37 . HA 1 1 365 1 2 1 1 37 LYS HB2 . 37 . HB2 1 1 366 1 1 1 1 37 LYS HB2 . 37 . HB2 1 1 366 1 2 1 1 38 ASP H . 38 . HN 1 1 367 1 1 1 1 37 LYS HB3 . 37 . HB1 1 1 367 1 2 1 1 38 ASP H . 38 . HN 1 1 368 1 1 1 1 37 LYS QG . 37 . HG# 1 1 368 1 2 1 1 38 ASP H . 38 . HN 1 1 369 1 1 1 1 38 ASP H . 38 . HN 1 1 369 1 2 1 1 39 VAL H . 39 . HN 1 1 370 1 1 1 1 38 ASP H . 38 . HN 1 1 370 1 2 1 1 39 VAL HA . 39 . HA 1 1 371 1 1 1 1 38 ASP H . 38 . HN 1 1 371 1 2 1 1 39 VAL MG1 . 39 . HG1# 1 1 372 1 1 1 1 38 ASP H . 38 . HN 1 1 372 1 2 1 1 41 GLY HA3 . 41 . HA1 1 1 373 1 1 1 1 38 ASP HA . 38 . HA 1 1 373 1 2 1 1 39 VAL H . 39 . HN 1 1 374 1 1 1 1 38 ASP HA . 38 . HA 1 1 374 1 2 1 1 39 VAL HA . 39 . HA 1 1 375 1 1 1 1 38 ASP HA . 38 . HA 1 1 375 1 2 1 1 40 GLU H . 40 . HN 1 1 376 1 1 1 1 38 ASP HB2 . 38 . HB2 1 1 376 1 2 1 1 41 GLY H . 41 . HN 1 1 377 1 1 1 1 38 ASP HB3 . 38 . HB1 1 1 377 1 2 1 1 41 GLY H . 41 . HN 1 1 378 1 1 1 1 38 ASP HB3 . 38 . HB1 1 1 378 1 2 1 1 41 GLY HA3 . 41 . HA1 1 1 379 1 1 1 1 39 VAL H . 39 . HN 1 1 379 1 2 1 1 39 VAL HB . 39 . HB 1 1 380 1 1 1 1 39 VAL H . 39 . HN 1 1 380 1 2 1 1 40 GLU H . 40 . HN 1 1 381 1 1 1 1 39 VAL HA . 39 . HA 1 1 381 1 2 1 1 39 VAL HB . 39 . HB 1 1 382 1 1 1 1 39 VAL HA . 39 . HA 1 1 382 1 2 1 1 40 GLU H . 40 . HN 1 1 383 1 1 1 1 39 VAL HA . 39 . HA 1 1 383 1 2 1 1 41 GLY H . 41 . HN 1 1 384 1 1 1 1 39 VAL HB . 39 . HB 1 1 384 1 2 1 1 40 GLU H . 40 . HN 1 1 385 1 1 1 1 39 VAL MG1 . 39 . HG1# 1 1 385 1 2 1 1 40 GLU H . 40 . HN 1 1 386 1 1 1 1 40 GLU H . 40 . HN 1 1 386 1 2 1 1 40 GLU HG3 . 40 . HG1 1 1 387 1 1 1 1 40 GLU H . 40 . HN 1 1 387 1 2 1 1 41 GLY H . 41 . HN 1 1 388 1 1 1 1 40 GLU H . 40 . HN 1 1 388 1 2 1 1 41 GLY HA3 . 41 . HA1 1 1 389 1 1 1 1 40 GLU H . 40 . HN 1 1 389 1 2 1 1 42 ALA H . 42 . HN 1 1 390 1 1 1 1 40 GLU HA . 40 . HA 1 1 390 1 2 1 1 40 GLU HB3 . 40 . HB1 1 1 391 1 1 1 1 40 GLU HA . 40 . HA 1 1 391 1 2 1 1 40 GLU HG2 . 40 . HG2 1 1 392 1 1 1 1 40 GLU HA . 40 . HA 1 1 392 1 2 1 1 40 GLU HG3 . 40 . HG1 1 1 393 1 1 1 1 40 GLU HA . 40 . HA 1 1 393 1 2 1 1 42 ALA H . 42 . HN 1 1 394 1 1 1 1 40 GLU HB2 . 40 . HB2 1 1 394 1 2 1 1 41 GLY H . 41 . HN 1 1 395 1 1 1 1 41 GLY H . 41 . HN 1 1 395 1 2 1 1 42 ALA H . 42 . HN 1 1 396 1 1 1 1 42 ALA HA . 42 . HA 1 1 396 1 2 1 1 43 SER H . 43 . HN 1 1 397 1 1 1 1 42 ALA MB . 42 . HB# 1 1 397 1 2 1 1 43 SER HA . 43 . HA 1 1 398 1 1 1 1 42 ALA MB . 42 . HB# 1 1 398 1 2 1 1 46 GLU H . 46 . HN 1 1 399 1 1 1 1 42 ALA MB . 42 . HB# 1 1 399 1 2 1 1 47 VAL H . 47 . HN 1 1 400 1 1 1 1 42 ALA MB . 42 . HB# 1 1 400 1 2 1 1 47 VAL HA . 47 . HA 1 1 401 1 1 1 1 42 ALA MB . 42 . HB# 1 1 401 1 2 1 1 47 VAL MG1 . 47 . HG1# 1 1 402 1 1 1 1 43 SER H . 43 . HN 1 1 402 1 2 1 1 43 SER HB3 . 43 . HB1 1 1 403 1 1 1 1 43 SER H . 43 . HN 1 1 403 1 2 1 1 44 GLN H . 44 . HN 1 1 404 1 1 1 1 43 SER H . 43 . HN 1 1 404 1 2 1 1 46 GLU H . 46 . HN 1 1 405 1 1 1 1 43 SER H . 43 . HN 1 1 405 1 2 1 1 46 GLU QB . 46 . HB# 1 1 406 1 1 1 1 43 SER H . 43 . HN 1 1 406 1 2 1 1 46 GLU HG3 . 46 . HG1 1 1 407 1 1 1 1 43 SER HB2 . 43 . HB2 1 1 407 1 2 1 1 44 GLN H . 44 . HN 1 1 408 1 1 1 1 43 SER HB2 . 43 . HB2 1 1 408 1 2 1 1 46 GLU H . 46 . HN 1 1 409 1 1 1 1 43 SER HB3 . 43 . HB1 1 1 409 1 2 1 1 44 GLN H . 44 . HN 1 1 410 1 1 1 1 43 SER HB3 . 43 . HB1 1 1 410 1 2 1 1 45 GLU H . 45 . HN 1 1 411 1 1 1 1 43 SER O . 43 . O 1 1 411 1 2 1 1 47 VAL H . 47 . HN 1 1 412 1 1 1 1 43 SER O . 43 . O 1 1 412 1 2 1 1 47 VAL N . 47 . N 1 1 413 1 1 1 1 44 GLN H . 44 . HN 1 1 413 1 2 1 1 45 GLU H . 45 . HN 1 1 414 1 1 1 1 44 GLN H . 44 . HN 1 1 414 1 2 1 1 45 GLU HG2 . 45 . HG2 1 1 415 1 1 1 1 44 GLN HA . 44 . HA 1 1 415 1 2 1 1 46 GLU H . 46 . HN 1 1 416 1 1 1 1 44 GLN HA . 44 . HA 1 1 416 1 2 1 1 47 VAL H . 47 . HN 1 1 417 1 1 1 1 44 GLN HA . 44 . HA 1 1 417 1 2 1 1 47 VAL HB . 47 . HB 1 1 418 1 1 1 1 44 GLN HA . 44 . HA 1 1 418 1 2 1 1 47 VAL MG1 . 47 . HG1# 1 1 419 1 1 1 1 44 GLN HA . 44 . HA 1 1 419 1 2 1 1 48 GLU H . 48 . HN 1 1 420 1 1 1 1 44 GLN HA . 44 . HA 1 1 420 1 2 1 1 61 TRP HH2 . 61 . HH2 1 1 421 1 1 1 1 44 GLN QG . 44 . HG# 1 1 421 1 2 1 1 61 TRP HH2 . 61 . HH2 1 1 422 1 1 1 1 44 GLN O . 44 . O 1 1 422 1 2 1 1 48 GLU H . 48 . HN 1 1 423 1 1 1 1 44 GLN O . 44 . O 1 1 423 1 2 1 1 48 GLU N . 48 . N 1 1 424 1 1 1 1 45 GLU H . 45 . HN 1 1 424 1 2 1 1 45 GLU HB2 . 45 . HB2 1 1 425 1 1 1 1 45 GLU H . 45 . HN 1 1 425 1 2 1 1 45 GLU HB3 . 45 . HB1 1 1 426 1 1 1 1 45 GLU H . 45 . HN 1 1 426 1 2 1 1 45 GLU HG2 . 45 . HG2 1 1 427 1 1 1 1 45 GLU H . 45 . HN 1 1 427 1 2 1 1 45 GLU HG3 . 45 . HG1 1 1 428 1 1 1 1 45 GLU H . 45 . HN 1 1 428 1 2 1 1 46 GLU H . 46 . HN 1 1 429 1 1 1 1 45 GLU HA . 45 . HA 1 1 429 1 2 1 1 46 GLU H . 46 . HN 1 1 430 1 1 1 1 45 GLU HA . 45 . HA 1 1 430 1 2 1 1 48 GLU H . 48 . HN 1 1 431 1 1 1 1 45 GLU HA . 45 . HA 1 1 431 1 2 1 1 48 GLU HB3 . 48 . HB1 1 1 432 1 1 1 1 45 GLU HA . 45 . HA 1 1 432 1 2 1 1 48 GLU HG3 . 48 . HG1 1 1 433 1 1 1 1 45 GLU HA . 45 . HA 1 1 433 1 2 1 1 49 GLU H . 49 . HN 1 1 434 1 1 1 1 45 GLU HB3 . 45 . HB1 1 1 434 1 2 1 1 46 GLU H . 46 . HN 1 1 435 1 1 1 1 45 GLU HB3 . 45 . HB1 1 1 435 1 2 1 1 49 GLU H . 49 . HN 1 1 436 1 1 1 1 45 GLU O . 45 . O 1 1 436 1 2 1 1 49 GLU H . 49 . HN 1 1 437 1 1 1 1 45 GLU O . 45 . O 1 1 437 1 2 1 1 49 GLU N . 49 . N 1 1 438 1 1 1 1 46 GLU H . 46 . HN 1 1 438 1 2 1 1 46 GLU HG2 . 46 . HG2 1 1 439 1 1 1 1 46 GLU H . 46 . HN 1 1 439 1 2 1 1 46 GLU HG3 . 46 . HG1 1 1 440 1 1 1 1 46 GLU H . 46 . HN 1 1 440 1 2 1 1 47 VAL H . 47 . HN 1 1 441 1 1 1 1 46 GLU H . 46 . HN 1 1 441 1 2 1 1 47 VAL HB . 47 . HB 1 1 442 1 1 1 1 46 GLU H . 46 . HN 1 1 442 1 2 1 1 47 VAL MG1 . 47 . HG1# 1 1 443 1 1 1 1 46 GLU HA . 46 . HA 1 1 443 1 2 1 1 46 GLU HG3 . 46 . HG1 1 1 444 1 1 1 1 46 GLU HB2 . 46 . HB2 1 1 444 1 2 1 1 47 VAL H . 47 . HN 1 1 445 1 1 1 1 46 GLU HB3 . 46 . HB1 1 1 445 1 2 1 1 47 VAL H . 47 . HN 1 1 446 1 1 1 1 46 GLU HG2 . 46 . HG2 1 1 446 1 2 1 1 47 VAL H . 47 . HN 1 1 447 1 1 1 1 46 GLU HG3 . 46 . HG1 1 1 447 1 2 1 1 47 VAL H . 47 . HN 1 1 448 1 1 1 1 46 GLU O . 46 . O 1 1 448 1 2 1 1 50 ALA H . 50 . HN 1 1 449 1 1 1 1 46 GLU O . 46 . O 1 1 449 1 2 1 1 50 ALA N . 50 . N 1 1 450 1 1 1 1 47 VAL H . 47 . HN 1 1 450 1 2 1 1 47 VAL HB . 47 . HB 1 1 451 1 1 1 1 47 VAL H . 47 . HN 1 1 451 1 2 1 1 47 VAL MG1 . 47 . HG1# 1 1 452 1 1 1 1 47 VAL H . 47 . HN 1 1 452 1 2 1 1 48 GLU H . 48 . HN 1 1 453 1 1 1 1 47 VAL HA . 47 . HA 1 1 453 1 2 1 1 50 ALA H . 50 . HN 1 1 454 1 1 1 1 47 VAL HA . 47 . HA 1 1 454 1 2 1 1 50 ALA MB . 50 . HB# 1 1 455 1 1 1 1 47 VAL HB . 47 . HB 1 1 455 1 2 1 1 48 GLU H . 48 . HN 1 1 456 1 1 1 1 47 VAL HB . 47 . HB 1 1 456 1 2 1 1 61 TRP HH2 . 61 . HH2 1 1 457 1 1 1 1 47 VAL HB . 47 . HB 1 1 457 1 2 1 1 61 TRP HZ2 . 61 . HZ2 1 1 458 1 1 1 1 47 VAL MG1 . 47 . HG1# 1 1 458 1 2 1 1 48 GLU H . 48 . HN 1 1 459 1 1 1 1 47 VAL MG1 . 47 . HG1# 1 1 459 1 2 1 1 48 GLU HA . 48 . HA 1 1 460 1 1 1 1 47 VAL MG1 . 47 . HG1# 1 1 460 1 2 1 1 51 MET ME . 51 . HE# 1 1 461 1 1 1 1 47 VAL MG1 . 47 . HG1# 1 1 461 1 2 1 1 51 MET QG . 51 . HG# 1 1 462 1 1 1 1 47 VAL MG1 . 47 . HG1# 1 1 462 1 2 1 1 61 TRP HH2 . 61 . HH2 1 1 463 1 1 1 1 47 VAL MG1 . 47 . HG1# 1 1 463 1 2 1 1 61 TRP HZ2 . 61 . HZ2 1 1 464 1 1 1 1 48 GLU H . 48 . HN 1 1 464 1 2 1 1 48 GLU HB3 . 48 . HB1 1 1 465 1 1 1 1 48 GLU H . 48 . HN 1 1 465 1 2 1 1 48 GLU HG2 . 48 . HG2 1 1 466 1 1 1 1 48 GLU H . 48 . HN 1 1 466 1 2 1 1 48 GLU HG3 . 48 . HG1 1 1 467 1 1 1 1 48 GLU H . 48 . HN 1 1 467 1 2 1 1 49 GLU H . 49 . HN 1 1 468 1 1 1 1 48 GLU H . 48 . HN 1 1 468 1 2 1 1 50 ALA H . 50 . HN 1 1 469 1 1 1 1 48 GLU HA . 48 . HA 1 1 469 1 2 1 1 48 GLU HG2 . 48 . HG2 1 1 470 1 1 1 1 48 GLU HA . 48 . HA 1 1 470 1 2 1 1 48 GLU HG3 . 48 . HG1 1 1 471 1 1 1 1 48 GLU HA . 48 . HA 1 1 471 1 2 1 1 50 ALA H . 50 . HN 1 1 472 1 1 1 1 48 GLU HA . 48 . HA 1 1 472 1 2 1 1 51 MET H . 51 . HN 1 1 473 1 1 1 1 48 GLU HA . 48 . HA 1 1 473 1 2 1 1 51 MET QB . 51 . HB# 1 1 474 1 1 1 1 48 GLU HA . 48 . HA 1 1 474 1 2 1 1 52 ASP H . 52 . HN 1 1 475 1 1 1 1 48 GLU HA . 48 . HA 1 1 475 1 2 1 1 61 TRP HZ2 . 61 . HZ2 1 1 476 1 1 1 1 48 GLU HB2 . 48 . HB2 1 1 476 1 2 1 1 49 GLU H . 49 . HN 1 1 477 1 1 1 1 48 GLU HB3 . 48 . HB1 1 1 477 1 2 1 1 49 GLU H . 49 . HN 1 1 478 1 1 1 1 48 GLU HG2 . 48 . HG2 1 1 478 1 2 1 1 61 TRP HZ2 . 61 . HZ2 1 1 479 1 1 1 1 48 GLU HG3 . 48 . HG1 1 1 479 1 2 1 1 61 TRP HZ2 . 61 . HZ2 1 1 480 1 1 1 1 48 GLU O . 48 . O 1 1 480 1 2 1 1 51 MET H . 51 . HN 1 1 481 1 1 1 1 48 GLU O . 48 . O 1 1 481 1 2 1 1 51 MET N . 51 . N 1 1 482 1 1 1 1 48 GLU O . 48 . O 1 1 482 1 2 1 1 52 ASP H . 52 . HN 1 1 483 1 1 1 1 48 GLU O . 48 . O 1 1 483 1 2 1 1 52 ASP N . 52 . N 1 1 484 1 1 1 1 49 GLU H . 49 . HN 1 1 484 1 2 1 1 50 ALA H . 50 . HN 1 1 485 1 1 1 1 49 GLU H . 49 . HN 1 1 485 1 2 1 1 51 MET H . 51 . HN 1 1 486 1 1 1 1 49 GLU HA . 49 . HA 1 1 486 1 2 1 1 52 ASP H . 52 . HN 1 1 487 1 1 1 1 49 GLU HA . 49 . HA 1 1 487 1 2 1 1 52 ASP HB2 . 52 . HB2 1 1 488 1 1 1 1 49 GLU HA . 49 . HA 1 1 488 1 2 1 1 52 ASP HB3 . 52 . HB1 1 1 489 1 1 1 1 49 GLU O . 49 . O 1 1 489 1 2 1 1 53 THR H . 53 . HN 1 1 490 1 1 1 1 49 GLU O . 49 . O 1 1 490 1 2 1 1 53 THR N . 53 . N 1 1 491 1 1 1 1 50 ALA H . 50 . HN 1 1 491 1 2 1 1 51 MET H . 51 . HN 1 1 492 1 1 1 1 50 ALA H . 50 . HN 1 1 492 1 2 1 1 53 THR H . 53 . HN 1 1 493 1 1 1 1 50 ALA HA . 50 . HA 1 1 493 1 2 1 1 53 THR H . 53 . HN 1 1 494 1 1 1 1 50 ALA HA . 50 . HA 1 1 494 1 2 1 1 53 THR HG1 . 53 . HG1# 1 1 495 1 1 1 1 50 ALA MB . 50 . HB# 1 1 495 1 2 1 1 51 MET HA . 51 . HA 1 1 496 1 1 1 1 51 MET H . 51 . HN 1 1 496 1 2 1 1 51 MET HB2 . 51 . HB2 1 1 497 1 1 1 1 51 MET H . 51 . HN 1 1 497 1 2 1 1 51 MET HB3 . 51 . HB1 1 1 498 1 1 1 1 51 MET H . 51 . HN 1 1 498 1 2 1 1 52 ASP H . 52 . HN 1 1 499 1 1 1 1 51 MET HA . 51 . HA 1 1 499 1 2 1 1 53 THR H . 53 . HN 1 1 500 1 1 1 1 51 MET HA . 51 . HA 1 1 500 1 2 1 1 59 ILE QG . 59 . HG1# 1 1 501 1 1 1 1 51 MET HB2 . 51 . HB2 1 1 501 1 2 1 1 52 ASP H . 52 . HN 1 1 502 1 1 1 1 51 MET HB2 . 51 . HB2 1 1 502 1 2 1 1 59 ILE QG . 59 . HG1# 1 1 503 1 1 1 1 51 MET HB3 . 51 . HB1 1 1 503 1 2 1 1 52 ASP H . 52 . HN 1 1 504 1 1 1 1 51 MET ME . 51 . HE# 1 1 504 1 2 1 1 60 HIS H . 60 . HN 1 1 505 1 1 1 1 51 MET ME . 51 . HE# 1 1 505 1 2 1 1 61 TRP H . 61 . HN 1 1 506 1 1 1 1 51 MET ME . 51 . HE# 1 1 506 1 2 1 1 61 TRP HD1 . 61 . HD1 1 1 507 1 1 1 1 51 MET ME . 51 . HE# 1 1 507 1 2 1 1 61 TRP HE1 . 61 . HE1 1 1 508 1 1 1 1 51 MET ME . 51 . HE# 1 1 508 1 2 1 1 61 TRP HZ2 . 61 . HZ2 1 1 509 1 1 1 1 51 MET QG . 51 . HG# 1 1 509 1 2 1 1 59 ILE QG . 59 . HG1# 1 1 510 1 1 1 1 52 ASP H . 52 . HN 1 1 510 1 2 1 1 52 ASP HB2 . 52 . HB2 1 1 511 1 1 1 1 52 ASP H . 52 . HN 1 1 511 1 2 1 1 52 ASP HB3 . 52 . HB1 1 1 512 1 1 1 1 52 ASP H . 52 . HN 1 1 512 1 2 1 1 53 THR H . 53 . HN 1 1 513 1 1 1 1 52 ASP HB2 . 52 . HB2 1 1 513 1 2 1 1 53 THR H . 53 . HN 1 1 514 1 1 1 1 52 ASP HB3 . 52 . HB1 1 1 514 1 2 1 1 53 THR H . 53 . HN 1 1 515 1 1 1 1 54 CYS HB2 . 54 . HB1 1 1 515 1 2 1 1 57 GLN HA . 57 . HA 1 1 516 1 1 1 1 54 CYS HB2 . 54 . HB1 1 1 516 1 2 1 1 57 GLN QG . 57 . HG# 1 1 517 1 1 1 1 54 CYS HB2 . 54 . HB1 1 1 517 1 2 1 1 59 ILE HB . 59 . HB 1 1 518 1 1 1 1 55 PRO HA . 55 . HA 1 1 518 1 2 1 1 57 GLN H . 57 . HN 1 1 519 1 1 1 1 58 CYS HA . 58 . HA 1 1 519 1 2 1 1 60 HIS HD1 . 60 . HD1 1 1 520 1 1 1 1 59 ILE HA . 59 . HA 1 1 520 1 2 1 1 60 HIS H . 60 . HN 1 1 521 1 1 1 1 59 ILE QG . 59 . HG1# 1 1 521 1 2 1 1 60 HIS H . 60 . HN 1 1 522 1 1 1 1 60 HIS H . 60 . HN 1 1 522 1 2 1 1 60 HIS HD1 . 60 . HD1 1 1 523 1 1 1 1 60 HIS HA . 60 . HA 1 1 523 1 2 1 1 61 TRP H . 61 . HN 1 1 524 1 1 1 1 60 HIS HB2 . 60 . HB2 1 1 524 1 2 1 1 61 TRP H . 61 . HN 1 1 525 1 1 1 1 60 HIS HB3 . 60 . HB1 1 1 525 1 2 1 1 61 TRP H . 61 . HN 1 1 526 1 1 1 1 61 TRP H . 61 . HN 1 1 526 1 2 1 1 61 TRP HD1 . 61 . HD1 1 1 527 1 1 1 1 61 TRP HA . 61 . HA 1 1 527 1 2 1 1 61 TRP HE3 . 61 . HE3 1 1 528 1 1 1 1 61 TRP HA . 61 . HA 1 1 528 1 2 1 1 62 GLU H . 62 . HN 1 1 529 1 1 1 1 61 TRP HB2 . 61 . HB2 1 1 529 1 2 1 1 61 TRP HD1 . 61 . HD1 1 1 530 1 1 1 1 61 TRP HB2 . 61 . HB2 1 1 530 1 2 1 1 61 TRP HE3 . 61 . HE3 1 1 531 1 1 1 1 61 TRP HB2 . 61 . HB2 1 1 531 1 2 1 1 62 GLU H . 62 . HN 1 1 532 1 1 1 1 61 TRP HB3 . 61 . HB1 1 1 532 1 2 1 1 62 GLU H . 62 . HN 1 1 533 1 1 1 1 61 TRP HB3 . 61 . HB1 1 1 533 1 2 1 1 63 ASP H . 63 . HN 1 1 534 1 1 1 1 61 TRP HE3 . 61 . HE3 1 1 534 1 2 1 1 62 GLU H . 62 . HN 1 1 535 1 1 1 1 62 GLU H . 62 . HN 1 1 535 1 2 1 1 62 GLU HB2 . 62 . HB2 1 1 536 1 1 1 1 62 GLU H . 62 . HN 1 1 536 1 2 1 1 62 GLU HB3 . 62 . HB1 1 1 537 1 1 1 1 62 GLU H . 62 . HN 1 1 537 1 2 1 1 62 GLU HG2 . 62 . HG2 1 1 538 1 1 1 1 62 GLU H . 62 . HN 1 1 538 1 2 1 1 62 GLU HG3 . 62 . HG1 1 1 539 1 1 1 1 62 GLU HA . 62 . HA 1 1 539 1 2 1 1 62 GLU HG3 . 62 . HG1 1 1 540 1 1 1 1 62 GLU HA . 62 . HA 1 1 540 1 2 1 1 63 ASP H . 63 . HN 1 1 541 1 1 1 1 62 GLU HB2 . 62 . HB2 1 1 541 1 2 1 1 63 ASP H . 63 . HN 1 1 542 1 1 1 1 62 GLU HB3 . 62 . HB1 1 1 542 1 2 1 1 63 ASP H . 63 . HN 1 1 543 1 1 1 1 63 ASP H . 63 . HN 1 1 543 1 2 1 1 64 GLU H . 64 . HN 1 1 544 1 1 1 1 63 ASP H . 63 . HN 1 1 544 1 2 1 1 64 GLU QB . 64 . HB# 1 1 545 1 1 2 2 1 SF4 FE1 . 65 . FE1 1 1 545 1 2 2 2 1 SF4 FE2 . 65 . FE2 1 1 546 1 1 2 2 1 SF4 FE1 . 65 . FE1 1 1 546 1 2 2 2 1 SF4 FE3 . 65 . FE3 1 1 547 1 1 2 2 1 SF4 FE1 . 65 . FE1 1 1 547 1 2 2 2 1 SF4 FE4 . 65 . FE4 1 1 548 1 1 2 2 1 SF4 FE1 . 65 . FE1 1 1 548 1 2 2 2 1 SF4 S2 . 65 . S2 1 1 549 1 1 2 2 1 SF4 FE1 . 65 . FE1 1 1 549 1 2 2 2 1 SF4 S3 . 65 . S3 1 1 550 1 1 2 2 1 SF4 FE2 . 65 . FE2 1 1 550 1 2 2 2 1 SF4 FE3 . 65 . FE3 1 1 551 1 1 2 2 1 SF4 FE2 . 65 . FE2 1 1 551 1 2 2 2 1 SF4 FE4 . 65 . FE4 1 1 552 1 1 2 2 1 SF4 FE2 . 65 . FE2 1 1 552 1 2 2 2 1 SF4 S3 . 65 . S3 1 1 553 1 1 2 2 1 SF4 FE2 . 65 . FE2 1 1 553 1 2 2 2 1 SF4 S4 . 65 . S4 1 1 554 1 1 2 2 1 SF4 FE3 . 65 . FE3 1 1 554 1 2 2 2 1 SF4 FE4 . 65 . FE4 1 1 555 1 1 2 2 1 SF4 FE3 . 65 . FE3 1 1 555 1 2 2 2 1 SF4 S1 . 65 . S1 1 1 556 1 1 2 2 1 SF4 FE3 . 65 . FE3 1 1 556 1 2 2 2 1 SF4 S4 . 65 . S4 1 1 557 1 1 2 2 1 SF4 FE4 . 65 . FE4 1 1 557 1 2 2 2 1 SF4 S1 . 65 . S1 1 1 558 1 1 2 2 1 SF4 FE4 . 65 . FE4 1 1 558 1 2 2 2 1 SF4 S2 . 65 . S2 1 1 559 1 1 2 2 1 SF4 S1 . 65 . S1 1 1 559 1 2 2 2 1 SF4 S2 . 65 . S2 1 1 560 1 1 2 2 1 SF4 S1 . 65 . S1 1 1 560 1 2 2 2 1 SF4 S3 . 65 . S3 1 1 561 1 1 2 2 1 SF4 S1 . 65 . S1 1 1 561 1 2 2 2 1 SF4 S4 . 65 . S4 1 1 562 1 1 2 2 1 SF4 S2 . 65 . S2 1 1 562 1 2 2 2 1 SF4 S3 . 65 . S3 1 1 563 1 1 2 2 1 SF4 S2 . 65 . S2 1 1 563 1 2 2 2 1 SF4 S4 . 65 . S4 1 1 564 1 1 2 2 1 SF4 S3 . 65 . S3 1 1 564 1 2 2 2 1 SF4 S4 . 65 . S4 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 . . . . . 2.7 1.8 2.9 1 1 2 1 . . . . . 2.8 1.8 3.0 1 1 3 1 . . . . . 3.3 1.8 3.5 1 1 4 1 . . . . . 2.9 1.8 3.1 1 1 5 1 . . . . . 5.0 1.8 5.2 1 1 6 1 . . . . . 2.3 1.8 2.5 1 1 7 1 . . . . . 3.5 1.8 3.7 1 1 8 1 . . . . . 2.7 1.8 2.9 1 1 9 1 . . . . . 6.0 1.8 6.2 1 1 10 1 . . . . . 5.0 1.8 5.2 1 1 11 1 . . . . . 3.4 1.8 3.6 1 1 12 1 . . . . . 3.0 1.8 3.2 1 1 13 1 . . . . . 2.3 1.8 2.5 1 1 14 1 . . . . . 3.0 1.8 3.2 1 1 15 1 . . . . . 7.0 1.8 7.2 1 1 16 1 . . . . . 8.0 1.8 8.2 1 1 17 1 . . . . . 8.0 1.8 8.2 1 1 18 1 . . . . . 7.0 1.8 7.2 1 1 19 1 . . . . . 8.0 1.8 8.2 1 1 20 1 . . . . . 8.0 1.8 8.2 1 1 21 1 . . . . . 5.8 1.8 6.0 1 1 22 1 . . . . . 8.0 1.8 8.2 1 1 23 1 . . . . . 8.0 1.8 8.2 1 1 24 1 . . . . . 5.0 1.8 5.2 1 1 25 1 . . . . . 5.0 1.8 5.2 1 1 26 1 . . . . . 6.0 1.8 6.2 1 1 27 1 . . . . . 6.0 1.8 6.2 1 1 28 1 . . . . . 4.1 1.8 4.3 1 1 29 1 . . . . . 2.3 1.8 2.5 1 1 30 1 . . . . . 2.7 1.8 2.9 1 1 31 1 . . . . . 2.7 1.8 2.9 1 1 32 1 . . . . . 6.7 1.8 6.9 1 1 33 1 . . . . . 2.7 1.8 2.9 1 1 34 1 . . . . . 5.0 1.8 5.2 1 1 35 1 . . . . . 6.0 1.8 6.2 1 1 36 1 . . . . . 2.8 1.8 3.0 1 1 37 1 . . . . . 5.0 1.8 5.2 1 1 38 1 . . . . . 5.0 1.8 5.2 1 1 39 1 . . . . . 3.3 1.8 3.5 1 1 40 1 . . . . . 3.3 1.8 3.5 1 1 41 1 . . . . . 6.0 1.8 6.2 1 1 42 1 . . . . . 6.0 1.8 6.2 1 1 43 1 . . . . . 4.4 1.8 4.6 1 1 44 1 . . . . . 3.9 1.8 4.1 1 1 45 1 . . . . . 3.9 1.8 4.1 1 1 46 1 . . . . . 6.0 1.8 6.2 1 1 47 1 . . . . . 3.4 1.8 3.6 1 1 48 1 . . . . . 3.3 1.8 3.5 1 1 49 1 . . . . . 5.0 1.8 5.2 1 1 50 1 . . . . . 7.0 1.8 7.2 1 1 51 1 . . . . . 8.0 1.8 8.2 1 1 52 1 . . . . . 7.0 1.8 7.2 1 1 53 1 . . . . . 7.0 1.8 7.2 1 1 54 1 . . . . . 7.0 1.8 7.2 1 1 55 1 . . . . . 6.7 1.8 6.9 1 1 56 1 . . . . . 6.2 1.8 6.4 1 1 57 1 . . . . . 6.7 1.8 6.9 1 1 58 1 . . . . . 6.1 1.8 6.3 1 1 59 1 . . . . . 5.0 1.8 5.2 1 1 60 1 . . . . . 6.0 1.8 6.2 1 1 61 1 . . . . . 6.0 1.8 6.2 1 1 62 1 . . . . . 6.0 1.8 6.2 1 1 63 1 . . . . . 3.2 1.8 3.4 1 1 64 1 . . . . . 5.0 1.8 5.2 1 1 65 1 . . . . . 4.9 1.8 5.1 1 1 66 1 . . . . . 2.9 1.8 3.1 1 1 67 1 . . . . . 2.9 1.8 3.1 1 1 68 1 . . . . . 3.1 1.8 3.3 1 1 69 1 . . . . . 4.5 1.8 4.7 1 1 70 1 . . . . . 4.7 1.8 4.9 1 1 71 1 . . . . . 5.5 1.8 5.7 1 1 72 1 . . . . . 5.0 1.8 5.2 1 1 73 1 . . . . . 3.3 1.8 3.5 1 1 74 1 . . . . . 2.3 1.8 2.5 1 1 75 1 . . . . . 3.0 1.8 3.2 1 1 76 1 . . . . . 4.8 1.8 5.0 1 1 77 1 . . . . . 4.5 1.8 4.7 1 1 78 1 . . . . . 5.6 1.8 5.8 1 1 79 1 . . . . . 3.6 1.8 3.8 1 1 80 1 . . . . . 6.0 1.8 6.2 1 1 81 1 . . . . . 3.0 1.8 3.2 1 1 82 1 . . . . . 3.5 1.8 3.7 1 1 83 1 . . . . . 3.5 1.8 3.7 1 1 84 1 . . . . . 4.6 1.8 4.8 1 1 85 1 . . . . . 3.8 1.8 4.0 1 1 86 1 . . . . . 5.0 1.8 5.2 1 1 87 1 . . . . . 6.0 1.8 6.2 1 1 88 1 . . . . . 6.0 1.8 6.2 1 1 89 1 . . . . . 6.0 1.8 6.2 1 1 90 1 . . . . . 7.0 1.8 7.2 1 1 91 1 . . . . . 3.8 1.8 4.0 1 1 92 1 . . . . . 3.9 1.8 4.1 1 1 93 1 . . . . . 4.5 1.8 4.7 1 1 94 1 . . . . . 4.6 1.8 4.8 1 1 95 1 . . . . . 4.0 1.8 4.2 1 1 96 1 . . . . . 4.5 1.8 4.7 1 1 97 1 . . . . . 3.0 1.8 3.2 1 1 98 1 . . . . . 2.7 1.8 2.9 1 1 99 1 . . . . . 4.7 1.8 4.9 1 1 100 1 . . . . . 3.5 1.8 3.7 1 1 101 1 . . . . . 7.0 1.8 7.2 1 1 102 1 . . . . . 4.3 1.8 4.5 1 1 103 1 . . . . . 5.0 1.8 5.2 1 1 104 1 . . . . . 3.4 1.8 3.6 1 1 105 1 . . . . . 4.4 1.8 4.6 1 1 106 1 . . . . . 5.0 1.8 5.2 1 1 107 1 . . . . . 5.0 1.8 5.2 1 1 108 1 . . . . . 4.1 1.8 4.3 1 1 109 1 . . . . . 3.7 1.8 3.9 1 1 110 1 . . . . . 3.5 1.8 3.7 1 1 111 1 . . . . . 5.0 1.8 5.2 1 1 112 1 . . . . . 4.2 1.8 4.4 1 1 113 1 . . . . . 3.4 1.8 3.6 1 1 114 1 . . . . . 3.0 1.8 3.2 1 1 115 1 . . . . . 3.0 1.8 3.2 1 1 116 1 . . . . . 3.7 1.8 3.9 1 1 117 1 . . . . . 5.0 1.8 5.2 1 1 118 1 . . . . . 4.0 1.8 4.2 1 1 119 1 . . . . . 4.0 1.8 4.2 1 1 120 1 . . . . . 5.2 1.8 5.4 1 1 121 1 . . . . . 5.2 1.8 5.4 1 1 122 1 . . . . . 4.0 1.8 4.2 1 1 123 1 . . . . . 3.3 1.8 3.5 1 1 124 1 . . . . . 2.9 1.8 3.1 1 1 125 1 . . . . . 5.0 1.8 5.2 1 1 126 1 . . . . . 2.9 1.8 3.1 1 1 127 1 . . . . . 5.0 1.8 5.2 1 1 128 1 . . . . . 5.0 1.8 5.2 1 1 129 1 . . . . . 4.0 1.8 4.2 1 1 130 1 . . . . . 3.8 1.8 4.0 1 1 131 1 . . . . . 5.0 1.8 5.2 1 1 132 1 . . . . . 2.9 1.8 3.1 1 1 133 1 . . . . . 4.0 1.8 4.2 1 1 134 1 . . . . . 5.0 1.8 5.2 1 1 135 1 . . . . . 6.0 1.8 6.2 1 1 136 1 . . . . . 4.0 1.8 4.2 1 1 137 1 . . . . . 4.0 1.8 4.2 1 1 138 1 . . . . . 3.0 1.8 3.2 1 1 139 1 . . . . . 6.38 1.8 6.58 1 1 140 1 . . . . . 6.38 1.8 6.58 1 1 141 1 . . . . . 6.38 1.8 6.58 1 1 142 1 . . . . . 3.0 1.8 3.2 1 1 143 1 . . . . . 3.0 1.8 3.2 1 1 144 1 . . . . . 3.0 1.8 3.2 1 1 145 1 . . . . . 6.38 1.8 6.58 1 1 146 1 . . . . . 6.38 1.8 6.58 1 1 147 1 . . . . . 2.3 1.8 2.5 1 1 148 1 . . . . . 3.0 1.8 3.2 1 1 149 1 . . . . . 2.3 1.8 2.5 1 1 150 1 . . . . . 3.0 1.8 3.2 1 1 151 1 . . . . . 4.0 1.8 4.2 1 1 152 1 . . . . . 4.5 1.8 4.7 1 1 153 1 . . . . . 4.0 1.8 4.2 1 1 154 1 . . . . . 4.0 1.8 4.2 1 1 155 1 . . . . . 4.5 1.8 4.7 1 1 156 1 . . . . . 3.5 1.8 3.7 1 1 157 1 . . . . . 2.3 1.8 2.5 1 1 158 1 . . . . . 3.0 1.8 3.2 1 1 159 1 . . . . . 6.38 1.8 6.58 1 1 160 1 . . . . . 2.9 1.8 3.1 1 1 161 1 . . . . . 3.0 1.8 3.2 1 1 162 1 . . . . . 4.7 1.8 4.9 1 1 163 1 . . . . . 3.8 1.8 4.0 1 1 164 1 . . . . . 3.9 1.8 4.1 1 1 165 1 . . . . . 3.1 1.8 3.3 1 1 166 1 . . . . . 3.5 1.8 3.7 1 1 167 1 . . . . . 3.8 1.8 4.0 1 1 168 1 . . . . . 6.0 1.8 6.2 1 1 169 1 . . . . . 6.0 1.8 6.2 1 1 170 1 . . . . . 6.0 1.8 6.2 1 1 171 1 . . . . . 4.0 1.8 4.2 1 1 172 1 . . . . . 4.1 1.8 4.3 1 1 173 1 . . . . . 4.1 1.8 4.3 1 1 174 1 . . . . . 4.9 1.8 5.1 1 1 175 1 . . . . . 3.6 1.8 3.8 1 1 176 1 . . . . . 5.0 1.8 5.2 1 1 177 1 . . . . . 3.0 1.8 3.2 1 1 178 1 . . . . . 3.1 1.8 3.3 1 1 179 1 . . . . . 5.0 1.8 5.2 1 1 180 1 . . . . . 4.6 1.8 4.8 1 1 181 1 . . . . . 4.0 1.8 4.2 1 1 182 1 . . . . . 3.4 1.8 3.6 1 1 183 1 . . . . . 4.9 1.8 5.1 1 1 184 1 . . . . . 2.8 1.8 3.0 1 1 185 1 . . . . . 2.9 1.8 3.1 1 1 186 1 . . . . . 3.0 1.8 3.2 1 1 187 1 . . . . . 3.1 1.8 3.3 1 1 188 1 . . . . . 4.8 1.8 5.0 1 1 189 1 . . . . . 4.7 1.8 4.9 1 1 190 1 . . . . . 2.4 1.8 2.6 1 1 191 1 . . . . . 2.5 1.8 2.7 1 1 192 1 . . . . . 5.0 1.8 5.2 1 1 193 1 . . . . . 6.0 1.8 6.2 1 1 194 1 . . . . . 6.0 1.8 6.2 1 1 195 1 . . . . . 6.0 1.8 6.2 1 1 196 1 . . . . . 6.0 1.8 6.2 1 1 197 1 . . . . . 6.0 1.8 6.2 1 1 198 1 . . . . . 6.0 1.8 6.2 1 1 199 1 . . . . . 3.7 1.8 3.9 1 1 200 1 . . . . . 4.2 1.8 4.4 1 1 201 1 . . . . . 4.1 1.8 4.3 1 1 202 1 . . . . . 4.2 1.8 4.4 1 1 203 1 . . . . . 7.0 1.8 7.2 1 1 204 1 . . . . . 6.0 1.8 6.2 1 1 205 1 . . . . . 3.5 1.8 3.7 1 1 206 1 . . . . . 2.8 1.8 3.0 1 1 207 1 . . . . . 6.0 1.8 6.2 1 1 208 1 . . . . . 6.0 1.8 6.2 1 1 209 1 . . . . . 6.0 1.8 6.2 1 1 210 1 . . . . . 6.0 1.8 6.2 1 1 211 1 . . . . . 8.0 1.8 8.2 1 1 212 1 . . . . . 8.0 1.8 8.2 1 1 213 1 . . . . . 6.0 1.8 6.2 1 1 214 1 . . . . . 6.0 1.8 6.2 1 1 215 1 . . . . . 6.0 1.8 6.2 1 1 216 1 . . . . . 6.0 1.8 6.2 1 1 217 1 . . . . . 6.0 1.8 6.2 1 1 218 1 . . . . . 6.0 1.8 6.2 1 1 219 1 . . . . . 2.3 1.8 2.5 1 1 220 1 . . . . . 3.0 1.8 3.2 1 1 221 1 . . . . . 5.0 1.8 5.2 1 1 222 1 . . . . . 5.0 1.8 5.2 1 1 223 1 . . . . . 3.5 1.8 3.7 1 1 224 1 . . . . . 3.7 1.8 3.9 1 1 225 1 . . . . . 5.0 1.8 5.2 1 1 226 1 . . . . . 6.0 1.8 6.2 1 1 227 1 . . . . . 5.0 1.8 5.2 1 1 228 1 . . . . . 5.0 1.8 5.2 1 1 229 1 . . . . . 5.0 1.8 5.2 1 1 230 1 . . . . . 4.5 1.8 4.7 1 1 231 1 . . . . . 3.7 1.8 3.9 1 1 232 1 . . . . . 6.0 1.8 6.2 1 1 233 1 . . . . . 5.8 1.8 6.0 1 1 234 1 . . . . . 3.5 1.8 3.7 1 1 235 1 . . . . . 4.8 1.8 5.0 1 1 236 1 . . . . . 4.5 1.8 4.7 1 1 237 1 . . . . . 8.0 1.8 8.2 1 1 238 1 . . . . . 7.0 1.8 7.2 1 1 239 1 . . . . . 6.0 1.8 6.2 1 1 240 1 . . . . . 6.0 1.8 6.2 1 1 241 1 . . . . . 6.0 1.8 6.2 1 1 242 1 . . . . . 6.0 1.8 6.2 1 1 243 1 . . . . . 6.0 1.8 6.2 1 1 244 1 . . . . . 7.0 1.8 7.2 1 1 245 1 . . . . . 7.0 1.8 7.2 1 1 246 1 . . . . . 8.0 1.8 8.2 1 1 247 1 . . . . . 8.0 1.8 8.2 1 1 248 1 . . . . . 8.0 1.8 8.2 1 1 249 1 . . . . . 3.8 1.8 4.0 1 1 250 1 . . . . . 2.7 1.8 2.9 1 1 251 1 . . . . . 5.0 1.8 5.2 1 1 252 1 . . . . . 6.0 1.8 6.2 1 1 253 1 . . . . . 3.3 1.8 3.5 1 1 254 1 . . . . . 2.9 1.8 3.1 1 1 255 1 . . . . . 6.0 1.8 6.2 1 1 256 1 . . . . . 3.2 1.8 3.4 1 1 257 1 . . . . . 4.5 1.8 4.7 1 1 258 1 . . . . . 5.0 1.8 5.2 1 1 259 1 . . . . . 3.3 1.8 3.5 1 1 260 1 . . . . . 5.0 1.8 5.2 1 1 261 1 . . . . . 4.5 1.8 4.7 1 1 262 1 . . . . . 3.3 1.8 3.5 1 1 263 1 . . . . . 2.3 1.8 2.5 1 1 264 1 . . . . . 4.1 1.8 4.3 1 1 265 1 . . . . . 4.6 1.8 4.8 1 1 266 1 . . . . . 3.1 1.8 3.3 1 1 267 1 . . . . . 5.0 1.8 5.2 1 1 268 1 . . . . . 6.0 1.8 6.2 1 1 269 1 . . . . . 8.0 1.8 8.2 1 1 270 1 . . . . . 6.0 1.8 6.2 1 1 271 1 . . . . . 3.0 1.8 3.2 1 1 272 1 . . . . . 2.3 1.8 2.5 1 1 273 1 . . . . . 3.0 1.8 3.2 1 1 274 1 . . . . . 7.0 1.8 7.2 1 1 275 1 . . . . . 3.0 1.8 3.2 1 1 276 1 . . . . . 3.5 1.8 3.7 1 1 277 1 . . . . . 7.0 1.8 7.2 1 1 278 1 . . . . . 5.0 1.8 5.2 1 1 279 1 . . . . . 6.0 1.8 6.2 1 1 280 1 . . . . . 5.0 1.8 5.2 1 1 281 1 . . . . . 5.0 1.8 5.2 1 1 282 1 . . . . . 5.0 1.8 5.2 1 1 283 1 . . . . . 3.4 1.8 3.6 1 1 284 1 . . . . . 3.3 1.8 3.5 1 1 285 1 . . . . . 4.6 1.8 4.8 1 1 286 1 . . . . . 5.0 1.8 5.2 1 1 287 1 . . . . . 5.0 1.8 5.2 1 1 288 1 . . . . . 4.6 1.8 4.8 1 1 289 1 . . . . . 3.3 1.8 3.5 1 1 290 1 . . . . . 4.0 1.8 4.2 1 1 291 1 . . . . . 2.3 1.8 2.5 1 1 292 1 . . . . . 4.6 1.8 4.8 1 1 293 1 . . . . . 7.0 1.8 7.2 1 1 294 1 . . . . . 7.0 1.8 7.2 1 1 295 1 . . . . . 3.0 1.8 3.2 1 1 296 1 . . . . . 4.5 1.8 4.7 1 1 297 1 . . . . . 3.1 1.8 3.3 1 1 298 1 . . . . . 3.0 1.8 3.2 1 1 299 1 . . . . . 5.0 1.8 5.2 1 1 300 1 . . . . . 5.0 1.8 5.2 1 1 301 1 . . . . . 7.0 1.8 7.2 1 1 302 1 . . . . . 5.8 1.8 6.0 1 1 303 1 . . . . . 4.7 1.8 4.9 1 1 304 1 . . . . . 5.0 1.8 5.2 1 1 305 1 . . . . . 5.9 1.8 6.1 1 1 306 1 . . . . . 5.0 1.8 5.2 1 1 307 1 . . . . . 5.0 1.8 5.2 1 1 308 1 . . . . . 5.0 1.8 5.2 1 1 309 1 . . . . . 4.8 1.8 5.0 1 1 310 1 . . . . . 5.0 1.8 5.2 1 1 311 1 . . . . . 3.6 1.8 3.8 1 1 312 1 . . . . . 3.0 1.8 3.2 1 1 313 1 . . . . . 2.3 1.8 2.5 1 1 314 1 . . . . . 3.0 1.8 3.2 1 1 315 1 . . . . . 4.6 1.8 4.8 1 1 316 1 . . . . . 4.6 1.8 4.8 1 1 317 1 . . . . . 3.1 1.8 3.3 1 1 318 1 . . . . . 2.9 1.8 3.1 1 1 319 1 . . . . . 3.8 1.8 4.0 1 1 320 1 . . . . . 6.0 1.8 6.2 1 1 321 1 . . . . . 4.1 1.8 4.3 1 1 322 1 . . . . . 4.6 1.8 4.8 1 1 323 1 . . . . . 2.6 1.8 2.8 1 1 324 1 . . . . . 4.1 1.8 4.3 1 1 325 1 . . . . . 6.0 1.8 6.2 1 1 326 1 . . . . . 3.3 1.8 3.5 1 1 327 1 . . . . . 4.0 1.8 4.2 1 1 328 1 . . . . . 3.2 1.8 3.4 1 1 329 1 . . . . . 4.3 1.8 4.5 1 1 330 1 . . . . . 2.8 1.8 3.0 1 1 331 1 . . . . . 4.5 1.8 4.7 1 1 332 1 . . . . . 4.6 1.8 4.8 1 1 333 1 . . . . . 4.5 1.8 4.7 1 1 334 1 . . . . . 4.8 1.8 5.0 1 1 335 1 . . . . . 6.0 1.8 6.2 1 1 336 1 . . . . . 6.0 1.8 6.2 1 1 337 1 . . . . . 4.9 1.8 5.1 1 1 338 1 . . . . . 3.8 1.8 4.0 1 1 339 1 . . . . . 3.8 1.8 4.0 1 1 340 1 . . . . . 2.6 1.8 2.8 1 1 341 1 . . . . . 3.1 1.8 3.3 1 1 342 1 . . . . . 2.9 1.8 3.1 1 1 343 1 . . . . . 4.0 1.8 4.2 1 1 344 1 . . . . . 7.0 1.8 7.2 1 1 345 1 . . . . . 8.0 1.8 8.2 1 1 346 1 . . . . . 6.0 1.8 6.2 1 1 347 1 . . . . . 6.0 1.8 6.2 1 1 348 1 . . . . . 7.0 1.8 7.2 1 1 349 1 . . . . . 5.2 1.8 5.4 1 1 350 1 . . . . . 6.6 1.8 6.8 1 1 351 1 . . . . . 7.0 1.8 7.2 1 1 352 1 . . . . . 5.0 1.8 5.2 1 1 353 1 . . . . . 3.2 1.8 3.4 1 1 354 1 . . . . . 5.0 1.8 5.2 1 1 355 1 . . . . . 3.0 1.8 3.2 1 1 356 1 . . . . . 2.6 1.8 2.8 1 1 357 1 . . . . . 4.2 1.8 4.4 1 1 358 1 . . . . . 5.0 1.8 5.2 1 1 359 1 . . . . . 6.0 1.8 6.2 1 1 360 1 . . . . . 6.0 1.8 6.2 1 1 361 1 . . . . . 6.0 1.8 6.2 1 1 362 1 . . . . . 6.0 1.8 6.2 1 1 363 1 . . . . . 6.0 1.8 6.2 1 1 364 1 . . . . . 2.8 1.8 3.0 1 1 365 1 . . . . . 3.0 1.8 3.2 1 1 366 1 . . . . . 4.4 1.8 4.6 1 1 367 1 . . . . . 4.5 1.8 4.7 1 1 368 1 . . . . . 6.0 1.8 6.2 1 1 369 1 . . . . . 5.0 1.8 5.2 1 1 370 1 . . . . . 5.0 1.8 5.2 1 1 371 1 . . . . . 6.0 1.8 6.2 1 1 372 1 . . . . . 5.0 1.8 5.2 1 1 373 1 . . . . . 2.8 1.8 3.0 1 1 374 1 . . . . . 5.0 1.8 5.2 1 1 375 1 . . . . . 4.1 1.8 4.3 1 1 376 1 . . . . . 4.2 1.8 4.4 1 1 377 1 . . . . . 3.6 1.8 3.8 1 1 378 1 . . . . . 3.1 1.8 3.3 1 1 379 1 . . . . . 4.0 1.8 4.2 1 1 380 1 . . . . . 3.0 1.8 3.2 1 1 381 1 . . . . . 3.0 1.8 3.2 1 1 382 1 . . . . . 3.5 1.8 3.7 1 1 383 1 . . . . . 4.7 1.8 4.9 1 1 384 1 . . . . . 4.0 1.8 4.2 1 1 385 1 . . . . . 6.0 1.8 6.2 1 1 386 1 . . . . . 5.0 1.8 5.2 1 1 387 1 . . . . . 3.1 1.8 3.3 1 1 388 1 . . . . . 5.0 1.8 5.2 1 1 389 1 . . . . . 5.0 1.8 5.2 1 1 390 1 . . . . . 2.7 1.8 2.9 1 1 391 1 . . . . . 3.3 1.8 3.5 1 1 392 1 . . . . . 4.0 1.8 4.2 1 1 393 1 . . . . . 3.6 1.8 3.8 1 1 394 1 . . . . . 5.0 1.8 5.2 1 1 395 1 . . . . . 5.0 1.8 5.2 1 1 396 1 . . . . . 3.0 1.8 3.2 1 1 397 1 . . . . . 6.0 1.8 6.2 1 1 398 1 . . . . . 6.0 1.8 6.2 1 1 399 1 . . . . . 6.0 1.8 6.2 1 1 400 1 . . . . . 6.0 1.8 6.2 1 1 401 1 . . . . . 6.4 1.8 6.6 1 1 402 1 . . . . . 3.2 1.8 3.4 1 1 403 1 . . . . . 5.0 1.8 5.2 1 1 404 1 . . . . . 4.4 1.8 4.6 1 1 405 1 . . . . . 4.7 1.8 4.9 1 1 406 1 . . . . . 4.0 1.8 4.2 1 1 407 1 . . . . . 3.2 1.8 3.4 1 1 408 1 . . . . . 3.1 1.8 3.3 1 1 409 1 . . . . . 4.0 1.8 4.2 1 1 410 1 . . . . . 3.8 1.8 4.0 1 1 411 1 . . . . . 2.3 1.8 2.5 1 1 412 1 . . . . . 2.3 1.8 2.5 1 1 413 1 . . . . . 3.3 1.8 3.5 1 1 414 1 . . . . . 4.8 1.8 5.0 1 1 415 1 . . . . . 4.4 1.8 4.6 1 1 416 1 . . . . . 3.9 1.8 4.1 1 1 417 1 . . . . . 3.1 1.8 3.3 1 1 418 1 . . . . . 6.0 1.8 6.2 1 1 419 1 . . . . . 4.6 1.8 4.8 1 1 420 1 . . . . . 4.9 1.8 5.1 1 1 421 1 . . . . . 6.0 1.8 6.2 1 1 422 1 . . . . . 2.3 1.8 2.5 1 1 423 1 . . . . . 3.0 1.8 3.2 1 1 424 1 . . . . . 4.0 1.8 4.2 1 1 425 1 . . . . . 3.8 1.8 4.0 1 1 426 1 . . . . . 4.1 1.8 4.3 1 1 427 1 . . . . . 4.8 1.8 5.0 1 1 428 1 . . . . . 3.4 1.8 3.6 1 1 429 1 . . . . . 3.4 1.8 3.6 1 1 430 1 . . . . . 3.9 1.8 4.1 1 1 431 1 . . . . . 3.4 1.8 3.6 1 1 432 1 . . . . . 5.0 1.8 5.2 1 1 433 1 . . . . . 4.3 1.8 4.5 1 1 434 1 . . . . . 4.1 1.8 4.3 1 1 435 1 . . . . . 4.8 1.8 5.0 1 1 436 1 . . . . . 2.3 1.8 2.5 1 1 437 1 . . . . . 3.0 1.8 3.2 1 1 438 1 . . . . . 4.0 1.8 4.2 1 1 439 1 . . . . . 3.2 1.8 3.4 1 1 440 1 . . . . . 3.1 1.8 3.3 1 1 441 1 . . . . . 4.8 1.8 5.0 1 1 442 1 . . . . . 6.0 1.8 6.2 1 1 443 1 . . . . . 3.3 1.8 3.5 1 1 444 1 . . . . . 4.0 1.8 4.2 1 1 445 1 . . . . . 3.4 1.8 3.6 1 1 446 1 . . . . . 5.0 1.8 5.2 1 1 447 1 . . . . . 3.6 1.8 3.8 1 1 448 1 . . . . . 2.3 1.8 2.5 1 1 449 1 . . . . . 3.0 1.8 3.2 1 1 450 1 . . . . . 2.7 1.8 2.9 1 1 451 1 . . . . . 4.5 1.8 4.7 1 1 452 1 . . . . . 3.4 1.8 3.6 1 1 453 1 . . . . . 4.1 1.8 4.3 1 1 454 1 . . . . . 6.0 1.8 6.2 1 1 455 1 . . . . . 3.1 1.8 3.3 1 1 456 1 . . . . . 4.7 1.8 4.9 1 1 457 1 . . . . . 5.0 1.8 5.2 1 1 458 1 . . . . . 6.0 1.8 6.2 1 1 459 1 . . . . . 6.0 1.8 6.2 1 1 460 1 . . . . . 7.0 1.8 7.2 1 1 461 1 . . . . . 7.0 1.8 7.2 1 1 462 1 . . . . . 5.9 1.8 6.1 1 1 463 1 . . . . . 6.0 1.8 6.2 1 1 464 1 . . . . . 2.8 1.8 3.0 1 1 465 1 . . . . . 3.7 1.8 3.9 1 1 466 1 . . . . . 3.3 1.8 3.5 1 1 467 1 . . . . . 3.3 1.8 3.5 1 1 468 1 . . . . . 4.6 1.8 4.8 1 1 469 1 . . . . . 3.6 1.8 3.8 1 1 470 1 . . . . . 4.0 1.8 4.2 1 1 471 1 . . . . . 5.0 1.8 5.2 1 1 472 1 . . . . . 3.4 1.8 3.6 1 1 473 1 . . . . . 3.9 1.8 4.1 1 1 474 1 . . . . . 4.6 1.8 4.8 1 1 475 1 . . . . . 5.0 1.8 5.2 1 1 476 1 . . . . . 2.9 1.8 3.1 1 1 477 1 . . . . . 4.4 1.8 4.6 1 1 478 1 . . . . . 3.5 1.8 3.7 1 1 479 1 . . . . . 4.2 1.8 4.4 1 1 480 1 . . . . . 2.3 1.8 2.5 1 1 481 1 . . . . . 3.0 1.8 3.2 1 1 482 1 . . . . . 2.3 1.8 2.5 1 1 483 1 . . . . . 3.0 1.8 3.2 1 1 484 1 . . . . . 3.1 1.8 3.3 1 1 485 1 . . . . . 4.7 1.8 4.9 1 1 486 1 . . . . . 3.3 1.8 3.5 1 1 487 1 . . . . . 3.7 1.8 3.9 1 1 488 1 . . . . . 3.8 1.8 4.0 1 1 489 1 . . . . . 2.3 1.8 2.5 1 1 490 1 . . . . . 3.0 1.8 3.2 1 1 491 1 . . . . . 2.7 1.8 2.9 1 1 492 1 . . . . . 4.8 1.8 5.0 1 1 493 1 . . . . . 4.4 1.8 4.6 1 1 494 1 . . . . . 6.0 1.8 6.2 1 1 495 1 . . . . . 6.0 1.8 6.2 1 1 496 1 . . . . . 2.6 1.8 2.8 1 1 497 1 . . . . . 2.8 1.8 3.0 1 1 498 1 . . . . . 3.0 1.8 3.2 1 1 499 1 . . . . . 5.0 1.8 5.2 1 1 500 1 . . . . . 6.0 1.8 6.2 1 1 501 1 . . . . . 5.0 1.8 5.2 1 1 502 1 . . . . . 6.0 1.8 6.2 1 1 503 1 . . . . . 3.1 1.8 3.3 1 1 504 1 . . . . . 6.0 1.8 6.2 1 1 505 1 . . . . . 6.0 1.8 6.2 1 1 506 1 . . . . . 6.0 1.8 6.2 1 1 507 1 . . . . . 6.0 1.8 6.2 1 1 508 1 . . . . . 6.0 1.8 6.2 1 1 509 1 . . . . . 7.0 1.8 7.2 1 1 510 1 . . . . . 4.1 1.8 4.3 1 1 511 1 . . . . . 3.1 1.8 3.3 1 1 512 1 . . . . . 3.6 1.8 3.8 1 1 513 1 . . . . . 5.0 1.8 5.2 1 1 514 1 . . . . . 4.9 1.8 5.1 1 1 515 1 . . . . . 3.0 1.8 3.2 1 1 516 1 . . . . . 4.0 1.8 4.2 1 1 517 1 . . . . . 5.0 1.8 5.2 1 1 518 1 . . . . . 5.0 1.8 5.2 1 1 519 1 . . . . . 5.0 1.8 5.2 1 1 520 1 . . . . . 3.5 1.8 3.7 1 1 521 1 . . . . . 6.0 1.8 6.2 1 1 522 1 . . . . . 5.0 1.8 5.2 1 1 523 1 . . . . . 3.5 1.8 3.7 1 1 524 1 . . . . . 5.0 1.8 5.2 1 1 525 1 . . . . . 3.2 1.8 3.4 1 1 526 1 . . . . . 5.0 1.8 5.2 1 1 527 1 . . . . . 3.4 1.8 3.6 1 1 528 1 . . . . . 3.0 1.8 3.2 1 1 529 1 . . . . . 3.5 1.8 3.7 1 1 530 1 . . . . . 3.7 1.8 3.9 1 1 531 1 . . . . . 5.0 1.8 5.2 1 1 532 1 . . . . . 3.6 1.8 3.8 1 1 533 1 . . . . . 5.0 1.8 5.2 1 1 534 1 . . . . . 5.0 1.8 5.2 1 1 535 1 . . . . . 3.4 1.8 3.6 1 1 536 1 . . . . . 4.2 1.8 4.4 1 1 537 1 . . . . . 5.0 1.8 5.2 1 1 538 1 . . . . . 5.0 1.8 5.2 1 1 539 1 . . . . . 3.5 1.8 3.7 1 1 540 1 . . . . . 3.4 1.8 3.6 1 1 541 1 . . . . . 5.0 1.8 5.2 1 1 542 1 . . . . . 5.0 1.8 5.2 1 1 543 1 . . . . . 5.0 1.8 5.2 1 1 544 1 . . . . . 6.0 1.8 6.2 1 1 545 1 . . . . . 2.66 1.8 2.86 1 1 546 1 . . . . . 2.66 1.8 2.86 1 1 547 1 . . . . . 2.66 1.8 2.86 1 1 548 1 . . . . . 2.32 1.8 2.52 1 1 549 1 . . . . . 2.32 1.8 2.52 1 1 550 1 . . . . . 2.66 1.8 2.86 1 1 551 1 . . . . . 2.66 1.8 2.86 1 1 552 1 . . . . . 2.32 1.8 2.52 1 1 553 1 . . . . . 2.32 1.8 2.52 1 1 554 1 . . . . . 2.66 1.8 2.86 1 1 555 1 . . . . . 2.32 1.8 2.52 1 1 556 1 . . . . . 2.32 1.8 2.52 1 1 557 1 . . . . . 2.32 1.8 2.52 1 1 558 1 . . . . . 2.32 1.8 2.52 1 1 559 1 . . . . . 3.51 1.8 3.71 1 1 560 1 . . . . . 3.51 1.8 3.71 1 1 561 1 . . . . . 3.51 1.8 3.71 1 1 562 1 . . . . . 3.51 1.8 3.71 1 1 563 1 . . . . . 3.51 1.8 3.71 1 1 564 1 . . . . . 3.51 1.8 3.71 1 1 stop_ save_ save_CNS/XPLOR_dihedral_5 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID 1 _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID . _Torsion_angle_constraint_list.Block_ID . loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 . 1 1 11 CYS CA 1 1 11 CYS CB 1 1 11 CYS SG 2 2 1 SF4 FE1 75.0 75.0 . 11 . CA . 11 . CB . 11 . SG . 65 . FE1 1 1 2 . 1 1 14 CYS CA 1 1 14 CYS CB 1 1 14 CYS SG 2 2 1 SF4 FE2 315.0 315.0 . 14 . CA . 14 . CB . 14 . SG . 65 . FE2 1 1 3 . 1 1 17 CYS CA 1 1 17 CYS CB 1 1 17 CYS SG 2 2 1 SF4 FE3 245.0 245.0 . 17 . CA . 17 . CB . 17 . SG . 65 . FE3 1 1 4 . 1 1 54 CYS CA 1 1 54 CYS CB 1 1 54 CYS SG 2 2 1 SF4 FE4 80.0 80.0 . 54 . CA . 54 . CB . 54 . SG . 65 . FE4 1 1 stop_ save_ save_conformer_family_coord_set_1 _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Entry_ID 1 _Conformer_family_coord_set.ID 1 loop_ _Atom_site.Model_ID _Atom_site.ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Occupancy _Atom_site.Uncertainty _Atom_site.PDBX_label_asym_ID _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID 1 1 1 1 1 ALA C C -10.373 9.358 8.567 1.00 . A A . 1 ALA C 1 1 1 2 1 1 1 ALA CA C -11.551 10.263 8.202 1.00 . A A . 1 ALA CA 1 1 1 3 1 1 1 ALA CB C -11.075 11.716 8.135 1.00 . A A . 1 ALA CB 1 1 1 4 1 1 1 ALA HA H -11.948 9.969 7.242 1.00 . A A . 1 ALA HA 1 1 1 5 1 1 1 ALA HB1 H -11.926 12.377 8.201 1.00 . A A . 1 ALA HB1 1 1 1 6 1 1 1 ALA HB2 H -10.402 11.912 8.956 1.00 . A A . 1 ALA HB2 1 1 1 7 1 1 1 ALA HB3 H -10.561 11.882 7.200 1.00 . A A . 1 ALA HB3 1 1 1 8 1 1 1 ALA N N -12.615 10.136 9.239 1.00 . A A . 1 ALA N 1 1 1 9 1 1 1 ALA O O -9.749 9.520 9.596 1.00 . A A . 1 ALA O 1 1 1 10 1 1 2 ARG C C -8.100 7.270 6.761 1.00 . A A . 2 ARG C 1 1 1 11 1 1 2 ARG CA C -8.925 7.490 8.031 1.00 . A A . 2 ARG CA 1 1 1 12 1 1 2 ARG CB C -9.468 6.148 8.533 1.00 . A A . 2 ARG CB 1 1 1 13 1 1 2 ARG CD C -7.510 5.574 9.973 1.00 . A A . 2 ARG CD 1 1 1 14 1 1 2 ARG CG C -8.310 5.170 8.733 1.00 . A A . 2 ARG CG 1 1 1 15 1 1 2 ARG CZ C -6.704 4.499 11.991 1.00 . A A . 2 ARG CZ 1 1 1 16 1 1 2 ARG H H -10.580 8.289 6.906 1.00 . A A . 2 ARG H 1 1 1 17 1 1 2 ARG HA H -8.301 7.932 8.794 1.00 . A A . 2 ARG HA 1 1 1 18 1 1 2 ARG HB2 H -9.980 6.296 9.472 1.00 . A A . 2 ARG HB2 1 1 1 19 1 1 2 ARG HB3 H -10.157 5.744 7.806 1.00 . A A . 2 ARG HB3 1 1 1 20 1 1 2 ARG HD2 H -6.567 6.004 9.670 1.00 . A A . 2 ARG HD2 1 1 1 21 1 1 2 ARG HD3 H -8.071 6.300 10.542 1.00 . A A . 2 ARG HD3 1 1 1 22 1 1 2 ARG HE H -7.512 3.482 10.488 1.00 . A A . 2 ARG HE 1 1 1 23 1 1 2 ARG HG2 H -8.700 4.171 8.865 1.00 . A A . 2 ARG HG2 1 1 1 24 1 1 2 ARG HG3 H -7.664 5.193 7.869 1.00 . A A . 2 ARG HG3 1 1 1 25 1 1 2 ARG HH11 H -6.017 6.345 11.633 1.00 . A A . 2 ARG HH11 1 1 1 26 1 1 2 ARG HH12 H -5.649 5.698 13.197 1.00 . A A . 2 ARG HH12 1 1 1 27 1 1 2 ARG HH21 H -7.258 2.681 12.623 1.00 . A A . 2 ARG HH21 1 1 1 28 1 1 2 ARG HH22 H -6.349 3.624 13.756 1.00 . A A . 2 ARG HH22 1 1 1 29 1 1 2 ARG N N -10.064 8.404 7.731 1.00 . A A . 2 ARG N 1 1 1 30 1 1 2 ARG NE N -7.259 4.370 10.816 1.00 . A A . 2 ARG NE 1 1 1 31 1 1 2 ARG NH1 N -6.074 5.600 12.298 1.00 . A A . 2 ARG NH1 1 1 1 32 1 1 2 ARG NH2 N -6.776 3.526 12.858 1.00 . A A . 2 ARG NH2 1 1 1 33 1 1 2 ARG O O -8.566 6.691 5.799 1.00 . A A . 2 ARG O 1 1 1 34 1 1 3 LYS C C -5.055 6.384 5.763 1.00 . A A . 3 LYS C 1 1 1 35 1 1 3 LYS CA C -6.025 7.546 5.536 1.00 . A A . 3 LYS CA 1 1 1 36 1 1 3 LYS CB C -5.240 8.832 5.266 1.00 . A A . 3 LYS CB 1 1 1 37 1 1 3 LYS CD C -6.468 9.810 3.321 1.00 . A A . 3 LYS CD 1 1 1 38 1 1 3 LYS CE C -6.131 11.235 2.876 1.00 . A A . 3 LYS CE 1 1 1 39 1 1 3 LYS CG C -5.188 9.094 3.759 1.00 . A A . 3 LYS CG 1 1 1 40 1 1 3 LYS H H -6.519 8.195 7.531 1.00 . A A . 3 LYS H 1 1 1 41 1 1 3 LYS HA H -6.654 7.325 4.686 1.00 . A A . 3 LYS HA 1 1 1 42 1 1 3 LYS HB2 H -5.727 9.661 5.760 1.00 . A A . 3 LYS HB2 1 1 1 43 1 1 3 LYS HB3 H -4.235 8.727 5.645 1.00 . A A . 3 LYS HB3 1 1 1 44 1 1 3 LYS HD2 H -6.917 9.272 2.499 1.00 . A A . 3 LYS HD2 1 1 1 45 1 1 3 LYS HD3 H -7.162 9.848 4.148 1.00 . A A . 3 LYS HD3 1 1 1 46 1 1 3 LYS HE2 H -5.590 11.201 1.942 1.00 . A A . 3 LYS HE2 1 1 1 47 1 1 3 LYS HE3 H -7.043 11.796 2.744 1.00 . A A . 3 LYS HE3 1 1 1 48 1 1 3 LYS HG2 H -4.333 9.714 3.531 1.00 . A A . 3 LYS HG2 1 1 1 49 1 1 3 LYS HG3 H -5.105 8.155 3.233 1.00 . A A . 3 LYS HG3 1 1 1 50 1 1 3 LYS HZ1 H -5.506 11.489 4.847 1.00 . A A . 3 LYS HZ1 1 1 1 51 1 1 3 LYS HZ2 H -4.283 11.738 3.694 1.00 . A A . 3 LYS HZ2 1 1 1 52 1 1 3 LYS HZ3 H -5.486 12.914 3.927 1.00 . A A . 3 LYS HZ3 1 1 1 53 1 1 3 LYS N N -6.877 7.728 6.747 1.00 . A A . 3 LYS N 1 1 1 54 1 1 3 LYS NZ N -5.288 11.894 3.914 1.00 . A A . 3 LYS NZ 1 1 1 55 1 1 3 LYS O O -5.303 5.506 6.566 1.00 . A A . 3 LYS O 1 1 1 56 1 1 4 PHE C C -1.799 5.477 4.292 1.00 . A A . 4 PHE C 1 1 1 57 1 1 4 PHE CA C -2.982 5.258 5.233 1.00 . A A . 4 PHE CA 1 1 1 58 1 1 4 PHE CB C -3.667 3.928 4.908 1.00 . A A . 4 PHE CB 1 1 1 59 1 1 4 PHE CD1 C -4.998 4.461 2.838 1.00 . A A . 4 PHE CD1 1 1 1 60 1 1 4 PHE CD2 C -3.005 3.097 2.621 1.00 . A A . 4 PHE CD2 1 1 1 61 1 1 4 PHE CE1 C -5.212 4.368 1.458 1.00 . A A . 4 PHE CE1 1 1 1 62 1 1 4 PHE CE2 C -3.219 3.005 1.241 1.00 . A A . 4 PHE CE2 1 1 1 63 1 1 4 PHE CG C -3.894 3.826 3.420 1.00 . A A . 4 PHE CG 1 1 1 64 1 1 4 PHE CZ C -4.323 3.640 0.659 1.00 . A A . 4 PHE CZ 1 1 1 65 1 1 4 PHE H H -3.772 7.076 4.415 1.00 . A A . 4 PHE H 1 1 1 66 1 1 4 PHE HA H -2.631 5.247 6.253 1.00 . A A . 4 PHE HA 1 1 1 67 1 1 4 PHE HB2 H -3.044 3.111 5.235 1.00 . A A . 4 PHE HB2 1 1 1 68 1 1 4 PHE HB3 H -4.618 3.881 5.419 1.00 . A A . 4 PHE HB3 1 1 1 69 1 1 4 PHE HD1 H -5.684 5.023 3.455 1.00 . A A . 4 PHE HD1 1 1 1 70 1 1 4 PHE HD2 H -2.154 2.607 3.070 1.00 . A A . 4 PHE HD2 1 1 1 71 1 1 4 PHE HE1 H -6.064 4.858 1.009 1.00 . A A . 4 PHE HE1 1 1 1 72 1 1 4 PHE HE2 H -2.533 2.443 0.625 1.00 . A A . 4 PHE HE2 1 1 1 73 1 1 4 PHE HZ H -4.488 3.567 -0.406 1.00 . A A . 4 PHE HZ 1 1 1 74 1 1 4 PHE N N -3.956 6.365 5.059 1.00 . A A . 4 PHE N 1 1 1 75 1 1 4 PHE O O -1.640 6.538 3.722 1.00 . A A . 4 PHE O 1 1 1 76 1 1 5 TYR C C 1.026 3.381 3.376 1.00 . A A . 5 TYR C 1 1 1 77 1 1 5 TYR CA C 0.195 4.632 3.223 1.00 . A A . 5 TYR CA 1 1 1 78 1 1 5 TYR CB C 1.034 5.850 3.616 1.00 . A A . 5 TYR CB 1 1 1 79 1 1 5 TYR CD1 C 0.728 5.966 6.116 1.00 . A A . 5 TYR CD1 1 1 1 80 1 1 5 TYR CD2 C 2.859 5.221 5.232 1.00 . A A . 5 TYR CD2 1 1 1 81 1 1 5 TYR CE1 C 1.211 5.802 7.419 1.00 . A A . 5 TYR CE1 1 1 1 82 1 1 5 TYR CE2 C 3.343 5.057 6.536 1.00 . A A . 5 TYR CE2 1 1 1 83 1 1 5 TYR CG C 1.552 5.675 5.022 1.00 . A A . 5 TYR CG 1 1 1 84 1 1 5 TYR CZ C 2.518 5.347 7.629 1.00 . A A . 5 TYR CZ 1 1 1 85 1 1 5 TYR H H -1.107 3.627 4.583 1.00 . A A . 5 TYR H 1 1 1 86 1 1 5 TYR HA H -0.142 4.727 2.202 1.00 . A A . 5 TYR HA 1 1 1 87 1 1 5 TYR HB2 H 1.867 5.944 2.935 1.00 . A A . 5 TYR HB2 1 1 1 88 1 1 5 TYR HB3 H 0.429 6.737 3.562 1.00 . A A . 5 TYR HB3 1 1 1 89 1 1 5 TYR HD1 H -0.280 6.316 5.955 1.00 . A A . 5 TYR HD1 1 1 1 90 1 1 5 TYR HD2 H 3.496 4.997 4.389 1.00 . A A . 5 TYR HD2 1 1 1 91 1 1 5 TYR HE1 H 0.576 6.027 8.264 1.00 . A A . 5 TYR HE1 1 1 1 92 1 1 5 TYR HE2 H 4.350 4.705 6.697 1.00 . A A . 5 TYR HE2 1 1 1 93 1 1 5 TYR HH H 2.240 5.140 9.506 1.00 . A A . 5 TYR HH 1 1 1 94 1 1 5 TYR N N -0.969 4.486 4.121 1.00 . A A . 5 TYR N 1 1 1 95 1 1 5 TYR O O 0.581 2.399 3.945 1.00 . A A . 5 TYR O 1 1 1 96 1 1 5 TYR OH O 2.995 5.186 8.914 1.00 . A A . 5 TYR OH 1 1 1 97 1 1 6 VAL C C 4.505 2.431 3.092 1.00 . A A . 6 VAL C 1 1 1 98 1 1 6 VAL CA C 3.016 2.148 3.051 1.00 . A A . 6 VAL CA 1 1 1 99 1 1 6 VAL CB C 2.743 1.219 1.889 1.00 . A A . 6 VAL CB 1 1 1 100 1 1 6 VAL CG1 C 3.134 -0.178 2.323 1.00 . A A . 6 VAL CG1 1 1 1 101 1 1 6 VAL CG2 C 1.257 1.258 1.525 1.00 . A A . 6 VAL CG2 1 1 1 102 1 1 6 VAL H H 2.586 4.166 2.435 1.00 . A A . 6 VAL H 1 1 1 103 1 1 6 VAL HA H 2.726 1.655 3.966 1.00 . A A . 6 VAL HA 1 1 1 104 1 1 6 VAL HB H 3.341 1.517 1.038 1.00 . A A . 6 VAL HB 1 1 1 105 1 1 6 VAL HG11 H 3.265 -0.189 3.391 1.00 . A A . 6 VAL HG11 1 1 1 106 1 1 6 VAL HG12 H 2.359 -0.869 2.048 1.00 . A A . 6 VAL HG12 1 1 1 107 1 1 6 VAL HG13 H 4.062 -0.451 1.844 1.00 . A A . 6 VAL HG13 1 1 1 108 1 1 6 VAL HG21 H 0.668 0.964 2.378 1.00 . A A . 6 VAL HG21 1 1 1 109 1 1 6 VAL HG22 H 0.985 2.261 1.228 1.00 . A A . 6 VAL HG22 1 1 1 110 1 1 6 VAL HG23 H 1.069 0.577 0.706 1.00 . A A . 6 VAL HG23 1 1 1 111 1 1 6 VAL N N 2.222 3.378 2.894 1.00 . A A . 6 VAL N 1 1 1 112 1 1 6 VAL O O 4.971 3.498 2.745 1.00 . A A . 6 VAL O 1 1 1 113 1 1 7 ASP C C 7.310 0.793 2.400 1.00 . A A . 7 ASP C 1 1 1 114 1 1 7 ASP CA C 6.715 1.595 3.543 1.00 . A A . 7 ASP CA 1 1 1 115 1 1 7 ASP CB C 7.245 1.082 4.875 1.00 . A A . 7 ASP CB 1 1 1 116 1 1 7 ASP CG C 8.161 2.135 5.502 1.00 . A A . 7 ASP CG 1 1 1 117 1 1 7 ASP H H 4.846 0.594 3.746 1.00 . A A . 7 ASP H 1 1 1 118 1 1 7 ASP HA H 6.967 2.633 3.419 1.00 . A A . 7 ASP HA 1 1 1 119 1 1 7 ASP HB2 H 6.414 0.890 5.529 1.00 . A A . 7 ASP HB2 1 1 1 120 1 1 7 ASP HB3 H 7.800 0.170 4.717 1.00 . A A . 7 ASP HB3 1 1 1 121 1 1 7 ASP N N 5.253 1.446 3.493 1.00 . A A . 7 ASP N 1 1 1 122 1 1 7 ASP O O 7.978 -0.203 2.593 1.00 . A A . 7 ASP O 1 1 1 123 1 1 7 ASP OD1 O 8.700 2.941 4.760 1.00 . A A . 7 ASP OD1 1 1 1 124 1 1 7 ASP OD2 O 8.309 2.118 6.712 1.00 . A A . 7 ASP OD2 1 1 1 125 1 1 8 GLN C C 9.104 0.252 0.218 1.00 . A A . 8 GLN C 1 1 1 126 1 1 8 GLN CA C 7.620 0.552 0.005 1.00 . A A . 8 GLN CA 1 1 1 127 1 1 8 GLN CB C 7.461 1.467 -1.213 1.00 . A A . 8 GLN CB 1 1 1 128 1 1 8 GLN CD C 7.659 3.695 -0.101 1.00 . A A . 8 GLN CD 1 1 1 129 1 1 8 GLN CG C 8.346 2.706 -1.045 1.00 . A A . 8 GLN CG 1 1 1 130 1 1 8 GLN H H 6.538 2.052 1.103 1.00 . A A . 8 GLN H 1 1 1 131 1 1 8 GLN HA H 7.081 -0.369 -0.161 1.00 . A A . 8 GLN HA 1 1 1 132 1 1 8 GLN HB2 H 7.751 0.933 -2.107 1.00 . A A . 8 GLN HB2 1 1 1 133 1 1 8 GLN HB3 H 6.431 1.776 -1.294 1.00 . A A . 8 GLN HB3 1 1 1 134 1 1 8 GLN HE21 H 6.551 4.511 -1.532 1.00 . A A . 8 GLN HE21 1 1 1 135 1 1 8 GLN HE22 H 6.318 5.154 0.020 1.00 . A A . 8 GLN HE22 1 1 1 136 1 1 8 GLN HG2 H 9.300 2.415 -0.631 1.00 . A A . 8 GLN HG2 1 1 1 137 1 1 8 GLN HG3 H 8.497 3.174 -2.006 1.00 . A A . 8 GLN HG3 1 1 1 138 1 1 8 GLN N N 7.075 1.244 1.207 1.00 . A A . 8 GLN N 1 1 1 139 1 1 8 GLN NE2 N 6.770 4.524 -0.577 1.00 . A A . 8 GLN NE2 1 1 1 140 1 1 8 GLN O O 9.693 -0.547 -0.480 1.00 . A A . 8 GLN O 1 1 1 141 1 1 8 GLN OE1 O 7.932 3.712 1.082 1.00 . A A . 8 GLN OE1 1 1 1 142 1 1 9 ASP C C 11.308 -0.813 1.909 1.00 . A A . 9 ASP C 1 1 1 143 1 1 9 ASP CA C 11.153 0.632 1.453 1.00 . A A . 9 ASP CA 1 1 1 144 1 1 9 ASP CB C 11.647 1.575 2.552 1.00 . A A . 9 ASP CB 1 1 1 145 1 1 9 ASP CG C 12.843 2.378 2.036 1.00 . A A . 9 ASP CG 1 1 1 146 1 1 9 ASP H H 9.209 1.513 1.744 1.00 . A A . 9 ASP H 1 1 1 147 1 1 9 ASP HA H 11.723 0.791 0.549 1.00 . A A . 9 ASP HA 1 1 1 148 1 1 9 ASP HB2 H 10.852 2.251 2.831 1.00 . A A . 9 ASP HB2 1 1 1 149 1 1 9 ASP HB3 H 11.949 0.999 3.414 1.00 . A A . 9 ASP HB3 1 1 1 150 1 1 9 ASP N N 9.709 0.883 1.187 1.00 . A A . 9 ASP N 1 1 1 151 1 1 9 ASP O O 12.290 -1.472 1.630 1.00 . A A . 9 ASP O 1 1 1 152 1 1 9 ASP OD1 O 12.877 2.653 0.847 1.00 . A A . 9 ASP OD1 1 1 1 153 1 1 9 ASP OD2 O 13.703 2.705 2.836 1.00 . A A . 9 ASP OD2 1 1 1 154 1 1 10 GLU C C 9.657 -3.596 2.044 1.00 . A A . 10 GLU C 1 1 1 155 1 1 10 GLU CA C 10.363 -2.709 3.076 1.00 . A A . 10 GLU CA 1 1 1 156 1 1 10 GLU CB C 9.621 -2.794 4.410 1.00 . A A . 10 GLU CB 1 1 1 157 1 1 10 GLU CD C 10.448 -5.152 4.570 1.00 . A A . 10 GLU CD 1 1 1 158 1 1 10 GLU CG C 10.290 -3.829 5.319 1.00 . A A . 10 GLU CG 1 1 1 159 1 1 10 GLU H H 9.541 -0.749 2.793 1.00 . A A . 10 GLU H 1 1 1 160 1 1 10 GLU HA H 11.387 -3.029 3.201 1.00 . A A . 10 GLU HA 1 1 1 161 1 1 10 GLU HB2 H 9.632 -1.828 4.894 1.00 . A A . 10 GLU HB2 1 1 1 162 1 1 10 GLU HB3 H 8.604 -3.082 4.224 1.00 . A A . 10 GLU HB3 1 1 1 163 1 1 10 GLU HG2 H 11.264 -3.468 5.620 1.00 . A A . 10 GLU HG2 1 1 1 164 1 1 10 GLU HG3 H 9.681 -3.986 6.196 1.00 . A A . 10 GLU HG3 1 1 1 165 1 1 10 GLU N N 10.323 -1.305 2.598 1.00 . A A . 10 GLU N 1 1 1 166 1 1 10 GLU O O 9.532 -4.793 2.215 1.00 . A A . 10 GLU O 1 1 1 167 1 1 10 GLU OE1 O 9.465 -5.866 4.455 1.00 . A A . 10 GLU OE1 1 1 1 168 1 1 10 GLU OE2 O 11.548 -5.430 4.121 1.00 . A A . 10 GLU OE2 1 1 1 169 1 1 11 CYS C C 9.447 -4.772 -0.746 1.00 . A A . 11 CYS C 1 1 1 170 1 1 11 CYS CA C 8.470 -3.813 -0.062 1.00 . A A . 11 CYS CA 1 1 1 171 1 1 11 CYS CB C 7.852 -2.867 -1.096 1.00 . A A . 11 CYS CB 1 1 1 172 1 1 11 CYS H H 9.281 -2.046 0.856 1.00 . A A . 11 CYS H 1 1 1 173 1 1 11 CYS HA H 7.684 -4.385 0.409 1.00 . A A . 11 CYS HA 1 1 1 174 1 1 11 CYS HB2 H 7.013 -2.348 -0.655 1.00 . A A . 11 CYS HB2 1 1 1 175 1 1 11 CYS HB3 H 8.594 -2.149 -1.411 1.00 . A A . 11 CYS HB3 1 1 1 176 1 1 11 CYS N N 9.180 -3.013 0.974 1.00 . A A . 11 CYS N 1 1 1 177 1 1 11 CYS O O 10.507 -4.382 -1.195 1.00 . A A . 11 CYS O 1 1 1 178 1 1 11 CYS SG S 7.252 -3.703 -2.607 1.00 . A A . 11 CYS SG 1 1 1 179 1 1 12 ILE C C 9.693 -7.089 -2.973 1.00 . A A . 12 ILE C 1 1 1 180 1 1 12 ILE CA C 9.994 -7.023 -1.471 1.00 . A A . 12 ILE CA 1 1 1 181 1 1 12 ILE CB C 9.765 -8.398 -0.835 1.00 . A A . 12 ILE CB 1 1 1 182 1 1 12 ILE CD1 C 8.188 -10.333 -0.718 1.00 . A A . 12 ILE CD1 1 1 1 183 1 1 12 ILE CG1 C 8.337 -8.865 -1.125 1.00 . A A . 12 ILE CG1 1 1 1 184 1 1 12 ILE CG2 C 9.968 -8.303 0.677 1.00 . A A . 12 ILE CG2 1 1 1 185 1 1 12 ILE H H 8.235 -6.316 -0.451 1.00 . A A . 12 ILE H 1 1 1 186 1 1 12 ILE HA H 11.022 -6.726 -1.324 1.00 . A A . 12 ILE HA 1 1 1 187 1 1 12 ILE HB H 10.469 -9.106 -1.247 1.00 . A A . 12 ILE HB 1 1 1 188 1 1 12 ILE HD11 H 9.148 -10.720 -0.414 1.00 . A A . 12 ILE HD11 1 1 1 189 1 1 12 ILE HD12 H 7.491 -10.409 0.105 1.00 . A A . 12 ILE HD12 1 1 1 190 1 1 12 ILE HD13 H 7.819 -10.903 -1.557 1.00 . A A . 12 ILE HD13 1 1 1 191 1 1 12 ILE HG12 H 7.640 -8.262 -0.562 1.00 . A A . 12 ILE HG12 1 1 1 192 1 1 12 ILE HG13 H 8.131 -8.763 -2.180 1.00 . A A . 12 ILE HG13 1 1 1 193 1 1 12 ILE HG21 H 10.094 -7.267 0.958 1.00 . A A . 12 ILE HG21 1 1 1 194 1 1 12 ILE HG22 H 9.105 -8.709 1.181 1.00 . A A . 12 ILE HG22 1 1 1 195 1 1 12 ILE HG23 H 10.847 -8.862 0.959 1.00 . A A . 12 ILE HG23 1 1 1 196 1 1 12 ILE N N 9.094 -6.027 -0.823 1.00 . A A . 12 ILE N 1 1 1 197 1 1 12 ILE O O 9.404 -6.088 -3.599 1.00 . A A . 12 ILE O 1 1 1 198 1 1 13 ALA C C 8.137 -9.058 -5.240 1.00 . A A . 13 ALA C 1 1 1 199 1 1 13 ALA CA C 9.488 -8.373 -5.019 1.00 . A A . 13 ALA CA 1 1 1 200 1 1 13 ALA CB C 10.591 -9.205 -5.677 1.00 . A A . 13 ALA CB 1 1 1 201 1 1 13 ALA H H 10.003 -9.051 -3.044 1.00 . A A . 13 ALA H 1 1 1 202 1 1 13 ALA HA H 9.469 -7.389 -5.463 1.00 . A A . 13 ALA HA 1 1 1 203 1 1 13 ALA HB1 H 10.911 -9.981 -4.997 1.00 . A A . 13 ALA HB1 1 1 1 204 1 1 13 ALA HB2 H 10.210 -9.656 -6.582 1.00 . A A . 13 ALA HB2 1 1 1 205 1 1 13 ALA HB3 H 11.429 -8.567 -5.917 1.00 . A A . 13 ALA HB3 1 1 1 206 1 1 13 ALA N N 9.764 -8.255 -3.560 1.00 . A A . 13 ALA N 1 1 1 207 1 1 13 ALA O O 8.036 -10.027 -5.968 1.00 . A A . 13 ALA O 1 1 1 208 1 1 14 CYS C C 4.708 -8.108 -5.063 1.00 . A A . 14 CYS C 1 1 1 209 1 1 14 CYS CA C 5.758 -9.194 -4.818 1.00 . A A . 14 CYS CA 1 1 1 210 1 1 14 CYS CB C 5.381 -10.005 -3.575 1.00 . A A . 14 CYS CB 1 1 1 211 1 1 14 CYS H H 7.192 -7.781 -4.046 1.00 . A A . 14 CYS H 1 1 1 212 1 1 14 CYS HA H 5.794 -9.852 -5.674 1.00 . A A . 14 CYS HA 1 1 1 213 1 1 14 CYS HB2 H 5.078 -10.997 -3.876 1.00 . A A . 14 CYS HB2 1 1 1 214 1 1 14 CYS HB3 H 6.239 -10.077 -2.925 1.00 . A A . 14 CYS HB3 1 1 1 215 1 1 14 CYS N N 7.095 -8.565 -4.627 1.00 . A A . 14 CYS N 1 1 1 216 1 1 14 CYS O O 4.873 -6.971 -4.669 1.00 . A A . 14 CYS O 1 1 1 217 1 1 14 CYS SG S 4.019 -9.346 -2.541 1.00 . A A . 14 CYS SG 1 1 1 218 1 1 15 GLU C C 1.254 -7.882 -5.376 1.00 . A A . 15 GLU C 1 1 1 219 1 1 15 GLU CA C 2.578 -7.437 -6.001 1.00 . A A . 15 GLU CA 1 1 1 220 1 1 15 GLU CB C 2.403 -7.295 -7.514 1.00 . A A . 15 GLU CB 1 1 1 221 1 1 15 GLU CD C 1.630 -8.747 -9.396 1.00 . A A . 15 GLU CD 1 1 1 222 1 1 15 GLU CG C 2.548 -8.667 -8.175 1.00 . A A . 15 GLU CG 1 1 1 223 1 1 15 GLU H H 3.523 -9.371 -6.035 1.00 . A A . 15 GLU H 1 1 1 224 1 1 15 GLU HA H 2.872 -6.486 -5.583 1.00 . A A . 15 GLU HA 1 1 1 225 1 1 15 GLU HB2 H 1.422 -6.893 -7.727 1.00 . A A . 15 GLU HB2 1 1 1 226 1 1 15 GLU HB3 H 3.157 -6.628 -7.904 1.00 . A A . 15 GLU HB3 1 1 1 227 1 1 15 GLU HG2 H 3.573 -8.810 -8.484 1.00 . A A . 15 GLU HG2 1 1 1 228 1 1 15 GLU HG3 H 2.274 -9.438 -7.470 1.00 . A A . 15 GLU HG3 1 1 1 229 1 1 15 GLU N N 3.633 -8.449 -5.721 1.00 . A A . 15 GLU N 1 1 1 230 1 1 15 GLU O O 0.197 -7.412 -5.746 1.00 . A A . 15 GLU O 1 1 1 231 1 1 15 GLU OE1 O 0.528 -8.229 -9.320 1.00 . A A . 15 GLU OE1 1 1 1 232 1 1 15 GLU OE2 O 2.044 -9.326 -10.386 1.00 . A A . 15 GLU OE2 1 1 1 233 1 1 16 SER C C -0.854 -8.045 -3.490 1.00 . A A . 16 SER C 1 1 1 234 1 1 16 SER CA C 0.038 -9.251 -3.791 1.00 . A A . 16 SER CA 1 1 1 235 1 1 16 SER CB C 0.365 -9.982 -2.489 1.00 . A A . 16 SER CB 1 1 1 236 1 1 16 SER H H 2.162 -9.153 -4.147 1.00 . A A . 16 SER H 1 1 1 237 1 1 16 SER HA H -0.479 -9.923 -4.461 1.00 . A A . 16 SER HA 1 1 1 238 1 1 16 SER HB2 H 0.320 -9.290 -1.664 1.00 . A A . 16 SER HB2 1 1 1 239 1 1 16 SER HB3 H -0.356 -10.774 -2.331 1.00 . A A . 16 SER HB3 1 1 1 240 1 1 16 SER HG H 1.643 -11.293 -3.148 1.00 . A A . 16 SER HG 1 1 1 241 1 1 16 SER N N 1.300 -8.784 -4.432 1.00 . A A . 16 SER N 1 1 1 242 1 1 16 SER O O -2.016 -8.015 -3.845 1.00 . A A . 16 SER O 1 1 1 243 1 1 16 SER OG O 1.676 -10.526 -2.572 1.00 . A A . 16 SER OG 1 1 1 244 1 1 17 CYS C C -1.593 -5.182 -3.820 1.00 . A A . 17 CYS C 1 1 1 245 1 1 17 CYS CA C -1.132 -5.842 -2.520 1.00 . A A . 17 CYS CA 1 1 1 246 1 1 17 CYS CB C -0.282 -4.851 -1.722 1.00 . A A . 17 CYS CB 1 1 1 247 1 1 17 CYS H H 0.622 -7.093 -2.565 1.00 . A A . 17 CYS H 1 1 1 248 1 1 17 CYS HA H -1.993 -6.132 -1.936 1.00 . A A . 17 CYS HA 1 1 1 249 1 1 17 CYS HB2 H -0.924 -4.111 -1.267 1.00 . A A . 17 CYS HB2 1 1 1 250 1 1 17 CYS HB3 H 0.258 -5.381 -0.951 1.00 . A A . 17 CYS HB3 1 1 1 251 1 1 17 CYS N N -0.317 -7.048 -2.840 1.00 . A A . 17 CYS N 1 1 1 252 1 1 17 CYS O O -2.770 -4.964 -4.038 1.00 . A A . 17 CYS O 1 1 1 253 1 1 17 CYS SG S 0.958 -3.948 -2.720 1.00 . A A . 17 CYS SG 1 1 1 254 1 1 18 VAL C C -2.270 -4.930 -6.563 1.00 . A A . 18 VAL C 1 1 1 255 1 1 18 VAL CA C -1.053 -4.216 -5.975 1.00 . A A . 18 VAL CA 1 1 1 256 1 1 18 VAL CB C 0.116 -4.306 -6.955 1.00 . A A . 18 VAL CB 1 1 1 257 1 1 18 VAL CG1 C -0.302 -3.721 -8.305 1.00 . A A . 18 VAL CG1 1 1 1 258 1 1 18 VAL CG2 C 1.304 -3.516 -6.404 1.00 . A A . 18 VAL CG2 1 1 1 259 1 1 18 VAL H H 0.269 -5.046 -4.494 1.00 . A A . 18 VAL H 1 1 1 260 1 1 18 VAL HA H -1.296 -3.177 -5.798 1.00 . A A . 18 VAL HA 1 1 1 261 1 1 18 VAL HB H 0.398 -5.342 -7.084 1.00 . A A . 18 VAL HB 1 1 1 262 1 1 18 VAL HG11 H -1.377 -3.755 -8.395 1.00 . A A . 18 VAL HG11 1 1 1 263 1 1 18 VAL HG12 H 0.033 -2.696 -8.371 1.00 . A A . 18 VAL HG12 1 1 1 264 1 1 18 VAL HG13 H 0.145 -4.297 -9.101 1.00 . A A . 18 VAL HG13 1 1 1 265 1 1 18 VAL HG21 H 0.983 -2.932 -5.553 1.00 . A A . 18 VAL HG21 1 1 1 266 1 1 18 VAL HG22 H 2.081 -4.200 -6.096 1.00 . A A . 18 VAL HG22 1 1 1 267 1 1 18 VAL HG23 H 1.685 -2.857 -7.169 1.00 . A A . 18 VAL HG23 1 1 1 268 1 1 18 VAL N N -0.672 -4.861 -4.688 1.00 . A A . 18 VAL N 1 1 1 269 1 1 18 VAL O O -3.116 -4.321 -7.187 1.00 . A A . 18 VAL O 1 1 1 270 1 1 19 GLU C C -4.772 -6.625 -6.098 1.00 . A A . 19 GLU C 1 1 1 271 1 1 19 GLU CA C -3.539 -6.957 -6.924 1.00 . A A . 19 GLU CA 1 1 1 272 1 1 19 GLU CB C -3.273 -8.463 -6.882 1.00 . A A . 19 GLU CB 1 1 1 273 1 1 19 GLU CD C -4.517 -10.053 -8.356 1.00 . A A . 19 GLU CD 1 1 1 274 1 1 19 GLU CG C -3.370 -9.040 -8.296 1.00 . A A . 19 GLU CG 1 1 1 275 1 1 19 GLU H H -1.681 -6.696 -5.864 1.00 . A A . 19 GLU H 1 1 1 276 1 1 19 GLU HA H -3.707 -6.640 -7.937 1.00 . A A . 19 GLU HA 1 1 1 277 1 1 19 GLU HB2 H -2.284 -8.642 -6.485 1.00 . A A . 19 GLU HB2 1 1 1 278 1 1 19 GLU HB3 H -4.007 -8.939 -6.249 1.00 . A A . 19 GLU HB3 1 1 1 279 1 1 19 GLU HG2 H -3.555 -8.242 -9.000 1.00 . A A . 19 GLU HG2 1 1 1 280 1 1 19 GLU HG3 H -2.443 -9.534 -8.547 1.00 . A A . 19 GLU HG3 1 1 1 281 1 1 19 GLU N N -2.371 -6.218 -6.371 1.00 . A A . 19 GLU N 1 1 1 282 1 1 19 GLU O O -5.861 -6.477 -6.620 1.00 . A A . 19 GLU O 1 1 1 283 1 1 19 GLU OE1 O -4.442 -11.045 -7.650 1.00 . A A . 19 GLU OE1 1 1 1 284 1 1 19 GLU OE2 O -5.449 -9.817 -9.107 1.00 . A A . 19 GLU OE2 1 1 1 285 1 1 20 ILE C C -5.892 -4.583 -3.968 1.00 . A A . 20 ILE C 1 1 1 286 1 1 20 ILE CA C -5.775 -6.107 -3.975 1.00 . A A . 20 ILE CA 1 1 1 287 1 1 20 ILE CB C -5.565 -6.624 -2.554 1.00 . A A . 20 ILE CB 1 1 1 288 1 1 20 ILE CD1 C -5.347 -8.738 -1.244 1.00 . A A . 20 ILE CD1 1 1 1 289 1 1 20 ILE CG1 C -5.178 -8.079 -2.615 1.00 . A A . 20 ILE CG1 1 1 1 290 1 1 20 ILE CG2 C -6.852 -6.460 -1.741 1.00 . A A . 20 ILE CG2 1 1 1 291 1 1 20 ILE H H -3.722 -6.567 -4.417 1.00 . A A . 20 ILE H 1 1 1 292 1 1 20 ILE HA H -6.670 -6.540 -4.391 1.00 . A A . 20 ILE HA 1 1 1 293 1 1 20 ILE HB H -4.781 -6.090 -2.097 1.00 . A A . 20 ILE HB 1 1 1 294 1 1 20 ILE HD11 H -5.454 -7.975 -0.487 1.00 . A A . 20 ILE HD11 1 1 1 295 1 1 20 ILE HD12 H -6.228 -9.364 -1.251 1.00 . A A . 20 ILE HD12 1 1 1 296 1 1 20 ILE HD13 H -4.479 -9.343 -1.025 1.00 . A A . 20 ILE HD13 1 1 1 297 1 1 20 ILE HG12 H -5.804 -8.543 -3.318 1.00 . A A . 20 ILE HG12 1 1 1 298 1 1 20 ILE HG13 H -4.153 -8.164 -2.932 1.00 . A A . 20 ILE HG13 1 1 1 299 1 1 20 ILE HG21 H -7.400 -5.602 -2.100 1.00 . A A . 20 ILE HG21 1 1 1 300 1 1 20 ILE HG22 H -7.459 -7.347 -1.849 1.00 . A A . 20 ILE HG22 1 1 1 301 1 1 20 ILE HG23 H -6.604 -6.319 -0.700 1.00 . A A . 20 ILE HG23 1 1 1 302 1 1 20 ILE N N -4.611 -6.471 -4.818 1.00 . A A . 20 ILE N 1 1 1 303 1 1 20 ILE O O -6.562 -4.002 -3.138 1.00 . A A . 20 ILE O 1 1 1 304 1 1 21 ALA C C -4.571 -1.928 -6.180 1.00 . A A . 21 ALA C 1 1 1 305 1 1 21 ALA CA C -5.304 -2.441 -4.938 1.00 . A A . 21 ALA CA 1 1 1 306 1 1 21 ALA CB C -4.640 -1.864 -3.686 1.00 . A A . 21 ALA CB 1 1 1 307 1 1 21 ALA H H -4.692 -4.416 -5.558 1.00 . A A . 21 ALA H 1 1 1 308 1 1 21 ALA HA H -6.337 -2.129 -4.975 1.00 . A A . 21 ALA HA 1 1 1 309 1 1 21 ALA HB1 H -3.731 -2.408 -3.477 1.00 . A A . 21 ALA HB1 1 1 1 310 1 1 21 ALA HB2 H -4.408 -0.822 -3.849 1.00 . A A . 21 ALA HB2 1 1 1 311 1 1 21 ALA HB3 H -5.314 -1.955 -2.847 1.00 . A A . 21 ALA HB3 1 1 1 312 1 1 21 ALA N N -5.234 -3.928 -4.893 1.00 . A A . 21 ALA N 1 1 1 313 1 1 21 ALA O O -3.583 -1.226 -6.073 1.00 . A A . 21 ALA O 1 1 1 314 1 1 22 PRO C C -4.809 -0.391 -8.885 1.00 . A A . 22 PRO C 1 1 1 315 1 1 22 PRO CA C -4.479 -1.861 -8.608 1.00 . A A . 22 PRO CA 1 1 1 316 1 1 22 PRO CB C -5.136 -2.773 -9.644 1.00 . A A . 22 PRO CB 1 1 1 317 1 1 22 PRO CD C -6.274 -3.132 -7.524 1.00 . A A . 22 PRO CD 1 1 1 318 1 1 22 PRO CG C -6.440 -3.185 -9.028 1.00 . A A . 22 PRO CG 1 1 1 319 1 1 22 PRO HA H -3.413 -2.019 -8.598 1.00 . A A . 22 PRO HA 1 1 1 320 1 1 22 PRO HB2 H -5.275 -2.221 -10.565 1.00 . A A . 22 PRO HB2 1 1 1 321 1 1 22 PRO HB3 H -4.501 -3.624 -9.828 1.00 . A A . 22 PRO HB3 1 1 1 322 1 1 22 PRO HD2 H -7.146 -2.685 -7.066 1.00 . A A . 22 PRO HD2 1 1 1 323 1 1 22 PRO HD3 H -6.105 -4.122 -7.128 1.00 . A A . 22 PRO HD3 1 1 1 324 1 1 22 PRO HG2 H -7.219 -2.504 -9.340 1.00 . A A . 22 PRO HG2 1 1 1 325 1 1 22 PRO HG3 H -6.683 -4.191 -9.332 1.00 . A A . 22 PRO HG3 1 1 1 326 1 1 22 PRO N N -5.088 -2.294 -7.323 1.00 . A A . 22 PRO N 1 1 1 327 1 1 22 PRO O O -5.287 -0.039 -9.945 1.00 . A A . 22 PRO O 1 1 1 328 1 1 23 GLY C C -4.142 2.711 -7.035 1.00 . A A . 23 GLY C 1 1 1 329 1 1 23 GLY CA C -4.847 1.914 -8.132 1.00 . A A . 23 GLY CA 1 1 1 330 1 1 23 GLY H H -4.165 0.161 -7.092 1.00 . A A . 23 GLY H 1 1 1 331 1 1 23 GLY HA2 H -4.486 2.229 -9.102 1.00 . A A . 23 GLY HA2 1 1 1 332 1 1 23 GLY HA3 H -5.911 2.081 -8.069 1.00 . A A . 23 GLY HA3 1 1 1 333 1 1 23 GLY N N -4.554 0.467 -7.937 1.00 . A A . 23 GLY N 1 1 1 334 1 1 23 GLY O O -3.565 3.752 -7.281 1.00 . A A . 23 GLY O 1 1 1 335 1 1 24 ALA C C -2.072 2.392 -4.576 1.00 . A A . 24 ALA C 1 1 1 336 1 1 24 ALA CA C -3.494 2.936 -4.712 1.00 . A A . 24 ALA CA 1 1 1 337 1 1 24 ALA CB C -4.259 2.705 -3.409 1.00 . A A . 24 ALA CB 1 1 1 338 1 1 24 ALA H H -4.635 1.373 -5.654 1.00 . A A . 24 ALA H 1 1 1 339 1 1 24 ALA HA H -3.458 3.993 -4.930 1.00 . A A . 24 ALA HA 1 1 1 340 1 1 24 ALA HB1 H -4.866 1.817 -3.500 1.00 . A A . 24 ALA HB1 1 1 1 341 1 1 24 ALA HB2 H -3.558 2.579 -2.597 1.00 . A A . 24 ALA HB2 1 1 1 342 1 1 24 ALA HB3 H -4.893 3.556 -3.207 1.00 . A A . 24 ALA HB3 1 1 1 343 1 1 24 ALA N N -4.174 2.220 -5.827 1.00 . A A . 24 ALA N 1 1 1 344 1 1 24 ALA O O -1.118 3.138 -4.479 1.00 . A A . 24 ALA O 1 1 1 345 1 1 25 PHE C C 0.020 0.335 -5.874 1.00 . A A . 25 PHE C 1 1 1 346 1 1 25 PHE CA C -0.563 0.502 -4.467 1.00 . A A . 25 PHE CA 1 1 1 347 1 1 25 PHE CB C -0.660 -0.869 -3.794 1.00 . A A . 25 PHE CB 1 1 1 348 1 1 25 PHE CD1 C 1.531 -0.270 -2.699 1.00 . A A . 25 PHE CD1 1 1 1 349 1 1 25 PHE CD2 C -0.004 -1.720 -1.512 1.00 . A A . 25 PHE CD2 1 1 1 350 1 1 25 PHE CE1 C 2.436 -0.357 -1.634 1.00 . A A . 25 PHE CE1 1 1 1 351 1 1 25 PHE CE2 C 0.904 -1.810 -0.448 1.00 . A A . 25 PHE CE2 1 1 1 352 1 1 25 PHE CG C 0.311 -0.951 -2.639 1.00 . A A . 25 PHE CG 1 1 1 353 1 1 25 PHE CZ C 2.125 -1.126 -0.511 1.00 . A A . 25 PHE CZ 1 1 1 354 1 1 25 PHE H H -2.706 0.511 -4.672 1.00 . A A . 25 PHE H 1 1 1 355 1 1 25 PHE HA H 0.071 1.156 -3.882 1.00 . A A . 25 PHE HA 1 1 1 356 1 1 25 PHE HB2 H -1.665 -1.022 -3.431 1.00 . A A . 25 PHE HB2 1 1 1 357 1 1 25 PHE HB3 H -0.419 -1.635 -4.516 1.00 . A A . 25 PHE HB3 1 1 1 358 1 1 25 PHE HD1 H 1.774 0.325 -3.565 1.00 . A A . 25 PHE HD1 1 1 1 359 1 1 25 PHE HD2 H -0.946 -2.247 -1.463 1.00 . A A . 25 PHE HD2 1 1 1 360 1 1 25 PHE HE1 H 3.375 0.168 -1.680 1.00 . A A . 25 PHE HE1 1 1 1 361 1 1 25 PHE HE2 H 0.660 -2.403 0.421 1.00 . A A . 25 PHE HE2 1 1 1 362 1 1 25 PHE HZ H 2.827 -1.199 0.301 1.00 . A A . 25 PHE HZ 1 1 1 363 1 1 25 PHE N N -1.923 1.096 -4.582 1.00 . A A . 25 PHE N 1 1 1 364 1 1 25 PHE O O -0.664 -0.071 -6.792 1.00 . A A . 25 PHE O 1 1 1 365 1 1 26 ALA C C 3.389 0.772 -7.320 1.00 . A A . 26 ALA C 1 1 1 366 1 1 26 ALA CA C 1.887 0.502 -7.407 1.00 . A A . 26 ALA CA 1 1 1 367 1 1 26 ALA CB C 1.245 1.508 -8.363 1.00 . A A . 26 ALA CB 1 1 1 368 1 1 26 ALA H H 1.810 0.971 -5.304 1.00 . A A . 26 ALA H 1 1 1 369 1 1 26 ALA HA H 1.721 -0.499 -7.774 1.00 . A A . 26 ALA HA 1 1 1 370 1 1 26 ALA HB1 H 0.989 2.407 -7.821 1.00 . A A . 26 ALA HB1 1 1 1 371 1 1 26 ALA HB2 H 1.941 1.750 -9.152 1.00 . A A . 26 ALA HB2 1 1 1 372 1 1 26 ALA HB3 H 0.350 1.080 -8.790 1.00 . A A . 26 ALA HB3 1 1 1 373 1 1 26 ALA N N 1.274 0.645 -6.054 1.00 . A A . 26 ALA N 1 1 1 374 1 1 26 ALA O O 3.813 1.793 -6.830 1.00 . A A . 26 ALA O 1 1 1 375 1 1 27 MET C C 6.059 1.271 -8.586 1.00 . A A . 27 MET C 1 1 1 376 1 1 27 MET CA C 5.672 0.072 -7.734 1.00 . A A . 27 MET CA 1 1 1 377 1 1 27 MET CB C 6.386 -1.180 -8.249 1.00 . A A . 27 MET CB 1 1 1 378 1 1 27 MET CE C 6.791 -4.466 -8.981 1.00 . A A . 27 MET CE 1 1 1 379 1 1 27 MET CG C 5.913 -2.399 -7.457 1.00 . A A . 27 MET CG 1 1 1 380 1 1 27 MET H H 3.832 -0.951 -8.184 1.00 . A A . 27 MET H 1 1 1 381 1 1 27 MET HA H 5.962 0.257 -6.723 1.00 . A A . 27 MET HA 1 1 1 382 1 1 27 MET HB2 H 6.158 -1.317 -9.297 1.00 . A A . 27 MET HB2 1 1 1 383 1 1 27 MET HB3 H 7.452 -1.063 -8.125 1.00 . A A . 27 MET HB3 1 1 1 384 1 1 27 MET HE1 H 7.427 -4.465 -8.107 1.00 . A A . 27 MET HE1 1 1 1 385 1 1 27 MET HE2 H 6.588 -5.484 -9.285 1.00 . A A . 27 MET HE2 1 1 1 386 1 1 27 MET HE3 H 7.288 -3.947 -9.785 1.00 . A A . 27 MET HE3 1 1 1 387 1 1 27 MET HG2 H 6.747 -2.826 -6.920 1.00 . A A . 27 MET HG2 1 1 1 388 1 1 27 MET HG3 H 5.150 -2.098 -6.754 1.00 . A A . 27 MET HG3 1 1 1 389 1 1 27 MET N N 4.196 -0.135 -7.792 1.00 . A A . 27 MET N 1 1 1 390 1 1 27 MET O O 5.383 1.602 -9.541 1.00 . A A . 27 MET O 1 1 1 391 1 1 27 MET SD S 5.233 -3.632 -8.592 1.00 . A A . 27 MET SD 1 1 1 392 1 1 28 ASP C C 8.994 2.899 -9.451 1.00 . A A . 28 ASP C 1 1 1 393 1 1 28 ASP CA C 7.540 3.095 -9.091 1.00 . A A . 28 ASP CA 1 1 1 394 1 1 28 ASP CB C 7.376 4.365 -8.265 1.00 . A A . 28 ASP CB 1 1 1 395 1 1 28 ASP CG C 6.769 5.470 -9.129 1.00 . A A . 28 ASP CG 1 1 1 396 1 1 28 ASP H H 7.718 1.669 -7.493 1.00 . A A . 28 ASP H 1 1 1 397 1 1 28 ASP HA H 6.935 3.146 -9.983 1.00 . A A . 28 ASP HA 1 1 1 398 1 1 28 ASP HB2 H 6.726 4.166 -7.425 1.00 . A A . 28 ASP HB2 1 1 1 399 1 1 28 ASP HB3 H 8.342 4.673 -7.907 1.00 . A A . 28 ASP HB3 1 1 1 400 1 1 28 ASP N N 7.145 1.936 -8.270 1.00 . A A . 28 ASP N 1 1 1 401 1 1 28 ASP O O 9.652 2.102 -8.824 1.00 . A A . 28 ASP O 1 1 1 402 1 1 28 ASP OD1 O 6.316 5.162 -10.218 1.00 . A A . 28 ASP OD1 1 1 1 403 1 1 28 ASP OD2 O 6.767 6.608 -8.686 1.00 . A A . 28 ASP OD2 1 1 1 404 1 1 29 PRO C C 11.694 4.415 -9.956 1.00 . A A . 29 PRO C 1 1 1 405 1 1 29 PRO CA C 10.858 3.526 -10.866 1.00 . A A . 29 PRO CA 1 1 1 406 1 1 29 PRO CB C 10.838 4.049 -12.300 1.00 . A A . 29 PRO CB 1 1 1 407 1 1 29 PRO CD C 8.716 4.621 -11.216 1.00 . A A . 29 PRO CD 1 1 1 408 1 1 29 PRO CG C 9.637 4.950 -12.377 1.00 . A A . 29 PRO CG 1 1 1 409 1 1 29 PRO HA H 11.200 2.504 -10.837 1.00 . A A . 29 PRO HA 1 1 1 410 1 1 29 PRO HB2 H 11.760 4.580 -12.497 1.00 . A A . 29 PRO HB2 1 1 1 411 1 1 29 PRO HB3 H 10.751 3.219 -12.983 1.00 . A A . 29 PRO HB3 1 1 1 412 1 1 29 PRO HD2 H 8.531 5.508 -10.630 1.00 . A A . 29 PRO HD2 1 1 1 413 1 1 29 PRO HD3 H 7.793 4.207 -11.571 1.00 . A A . 29 PRO HD3 1 1 1 414 1 1 29 PRO HG2 H 9.956 5.981 -12.315 1.00 . A A . 29 PRO HG2 1 1 1 415 1 1 29 PRO HG3 H 9.120 4.783 -13.309 1.00 . A A . 29 PRO HG3 1 1 1 416 1 1 29 PRO N N 9.451 3.629 -10.435 1.00 . A A . 29 PRO N 1 1 1 417 1 1 29 PRO O O 12.893 4.261 -9.832 1.00 . A A . 29 PRO O 1 1 1 418 1 1 30 GLU C C 11.865 5.465 -7.019 1.00 . A A . 30 GLU C 1 1 1 419 1 1 30 GLU CA C 11.754 6.218 -8.339 1.00 . A A . 30 GLU CA 1 1 1 420 1 1 30 GLU CB C 10.958 7.508 -8.141 1.00 . A A . 30 GLU CB 1 1 1 421 1 1 30 GLU CD C 11.001 9.956 -8.635 1.00 . A A . 30 GLU CD 1 1 1 422 1 1 30 GLU CG C 11.862 8.714 -8.401 1.00 . A A . 30 GLU CG 1 1 1 423 1 1 30 GLU H H 10.067 5.394 -9.393 1.00 . A A . 30 GLU H 1 1 1 424 1 1 30 GLU HA H 12.737 6.446 -8.718 1.00 . A A . 30 GLU HA 1 1 1 425 1 1 30 GLU HB2 H 10.129 7.524 -8.830 1.00 . A A . 30 GLU HB2 1 1 1 426 1 1 30 GLU HB3 H 10.586 7.551 -7.128 1.00 . A A . 30 GLU HB3 1 1 1 427 1 1 30 GLU HG2 H 12.503 8.874 -7.547 1.00 . A A . 30 GLU HG2 1 1 1 428 1 1 30 GLU HG3 H 12.466 8.528 -9.277 1.00 . A A . 30 GLU HG3 1 1 1 429 1 1 30 GLU N N 11.041 5.323 -9.288 1.00 . A A . 30 GLU N 1 1 1 430 1 1 30 GLU O O 12.880 5.491 -6.351 1.00 . A A . 30 GLU O 1 1 1 431 1 1 30 GLU OE1 O 9.796 9.805 -8.756 1.00 . A A . 30 GLU OE1 1 1 1 432 1 1 30 GLU OE2 O 11.561 11.039 -8.687 1.00 . A A . 30 GLU OE2 1 1 1 433 1 1 31 ILE C C 11.097 2.498 -5.794 1.00 . A A . 31 ILE C 1 1 1 434 1 1 31 ILE CA C 10.852 3.951 -5.424 1.00 . A A . 31 ILE CA 1 1 1 435 1 1 31 ILE CB C 9.528 4.082 -4.664 1.00 . A A . 31 ILE CB 1 1 1 436 1 1 31 ILE CD1 C 7.047 3.936 -4.907 1.00 . A A . 31 ILE CD1 1 1 1 437 1 1 31 ILE CG1 C 8.366 4.154 -5.651 1.00 . A A . 31 ILE CG1 1 1 1 438 1 1 31 ILE CG2 C 9.553 5.358 -3.821 1.00 . A A . 31 ILE CG2 1 1 1 439 1 1 31 ILE H H 10.037 4.734 -7.245 1.00 . A A . 31 ILE H 1 1 1 440 1 1 31 ILE HA H 11.644 4.283 -4.808 1.00 . A A . 31 ILE HA 1 1 1 441 1 1 31 ILE HB H 9.400 3.227 -4.016 1.00 . A A . 31 ILE HB 1 1 1 442 1 1 31 ILE HD11 H 7.254 3.658 -3.884 1.00 . A A . 31 ILE HD11 1 1 1 443 1 1 31 ILE HD12 H 6.470 4.849 -4.922 1.00 . A A . 31 ILE HD12 1 1 1 444 1 1 31 ILE HD13 H 6.487 3.148 -5.389 1.00 . A A . 31 ILE HD13 1 1 1 445 1 1 31 ILE HG12 H 8.357 5.125 -6.123 1.00 . A A . 31 ILE HG12 1 1 1 446 1 1 31 ILE HG13 H 8.484 3.388 -6.403 1.00 . A A . 31 ILE HG13 1 1 1 447 1 1 31 ILE HG21 H 9.986 6.162 -4.397 1.00 . A A . 31 ILE HG21 1 1 1 448 1 1 31 ILE HG22 H 8.545 5.621 -3.537 1.00 . A A . 31 ILE HG22 1 1 1 449 1 1 31 ILE HG23 H 10.146 5.192 -2.933 1.00 . A A . 31 ILE HG23 1 1 1 450 1 1 31 ILE N N 10.826 4.757 -6.667 1.00 . A A . 31 ILE N 1 1 1 451 1 1 31 ILE O O 11.194 1.645 -4.934 1.00 . A A . 31 ILE O 1 1 1 452 1 1 32 GLU C C 10.685 -0.121 -6.602 1.00 . A A . 32 GLU C 1 1 1 453 1 1 32 GLU CA C 11.418 0.816 -7.542 1.00 . A A . 32 GLU CA 1 1 1 454 1 1 32 GLU CB C 12.916 0.501 -7.541 1.00 . A A . 32 GLU CB 1 1 1 455 1 1 32 GLU CD C 15.115 1.566 -8.076 1.00 . A A . 32 GLU CD 1 1 1 456 1 1 32 GLU CG C 13.641 1.473 -8.475 1.00 . A A . 32 GLU CG 1 1 1 457 1 1 32 GLU H H 11.107 2.931 -7.737 1.00 . A A . 32 GLU H 1 1 1 458 1 1 32 GLU HA H 11.018 0.707 -8.538 1.00 . A A . 32 GLU HA 1 1 1 459 1 1 32 GLU HB2 H 13.305 0.604 -6.539 1.00 . A A . 32 GLU HB2 1 1 1 460 1 1 32 GLU HB3 H 13.071 -0.510 -7.887 1.00 . A A . 32 GLU HB3 1 1 1 461 1 1 32 GLU HG2 H 13.566 1.117 -9.493 1.00 . A A . 32 GLU HG2 1 1 1 462 1 1 32 GLU HG3 H 13.188 2.450 -8.400 1.00 . A A . 32 GLU HG3 1 1 1 463 1 1 32 GLU N N 11.194 2.215 -7.075 1.00 . A A . 32 GLU N 1 1 1 464 1 1 32 GLU O O 11.136 -1.208 -6.304 1.00 . A A . 32 GLU O 1 1 1 465 1 1 32 GLU OE1 O 15.473 0.985 -7.064 1.00 . A A . 32 GLU OE1 1 1 1 466 1 1 32 GLU OE2 O 15.861 2.219 -8.787 1.00 . A A . 32 GLU OE2 1 1 1 467 1 1 33 LYS C C 7.354 -0.033 -5.024 1.00 . A A . 33 LYS C 1 1 1 468 1 1 33 LYS CA C 8.795 -0.528 -5.143 1.00 . A A . 33 LYS CA 1 1 1 469 1 1 33 LYS CB C 9.454 -0.447 -3.760 1.00 . A A . 33 LYS CB 1 1 1 470 1 1 33 LYS CD C 11.354 -1.274 -2.364 1.00 . A A . 33 LYS CD 1 1 1 471 1 1 33 LYS CE C 12.822 -1.702 -2.406 1.00 . A A . 33 LYS CE 1 1 1 472 1 1 33 LYS CG C 10.827 -1.122 -3.791 1.00 . A A . 33 LYS CG 1 1 1 473 1 1 33 LYS H H 9.229 1.222 -6.376 1.00 . A A . 33 LYS H 1 1 1 474 1 1 33 LYS HA H 8.797 -1.554 -5.481 1.00 . A A . 33 LYS HA 1 1 1 475 1 1 33 LYS HB2 H 9.571 0.589 -3.479 1.00 . A A . 33 LYS HB2 1 1 1 476 1 1 33 LYS HB3 H 8.828 -0.947 -3.036 1.00 . A A . 33 LYS HB3 1 1 1 477 1 1 33 LYS HD2 H 11.270 -0.330 -1.846 1.00 . A A . 33 LYS HD2 1 1 1 478 1 1 33 LYS HD3 H 10.777 -2.024 -1.844 1.00 . A A . 33 LYS HD3 1 1 1 479 1 1 33 LYS HE2 H 12.920 -2.695 -1.992 1.00 . A A . 33 LYS HE2 1 1 1 480 1 1 33 LYS HE3 H 13.166 -1.703 -3.429 1.00 . A A . 33 LYS HE3 1 1 1 481 1 1 33 LYS HG2 H 10.740 -2.096 -4.251 1.00 . A A . 33 LYS HG2 1 1 1 482 1 1 33 LYS HG3 H 11.513 -0.515 -4.362 1.00 . A A . 33 LYS HG3 1 1 1 483 1 1 33 LYS HZ1 H 13.264 -0.691 -0.640 1.00 . A A . 33 LYS HZ1 1 1 1 484 1 1 33 LYS HZ2 H 14.626 -1.080 -1.573 1.00 . A A . 33 LYS HZ2 1 1 1 485 1 1 33 LYS HZ3 H 13.607 0.193 -2.049 1.00 . A A . 33 LYS HZ3 1 1 1 486 1 1 33 LYS N N 9.560 0.321 -6.113 1.00 . A A . 33 LYS N 1 1 1 487 1 1 33 LYS NZ N 13.642 -0.749 -1.606 1.00 . A A . 33 LYS NZ 1 1 1 488 1 1 33 LYS O O 7.072 1.137 -5.190 1.00 . A A . 33 LYS O 1 1 1 489 1 1 34 ALA C C 4.822 0.463 -3.458 1.00 . A A . 34 ALA C 1 1 1 490 1 1 34 ALA CA C 5.003 -0.527 -4.610 1.00 . A A . 34 ALA CA 1 1 1 491 1 1 34 ALA CB C 4.161 -1.776 -4.342 1.00 . A A . 34 ALA CB 1 1 1 492 1 1 34 ALA H H 6.698 -1.860 -4.614 1.00 . A A . 34 ALA H 1 1 1 493 1 1 34 ALA HA H 4.670 -0.069 -5.527 1.00 . A A . 34 ALA HA 1 1 1 494 1 1 34 ALA HB1 H 4.809 -2.603 -4.089 1.00 . A A . 34 ALA HB1 1 1 1 495 1 1 34 ALA HB2 H 3.484 -1.585 -3.521 1.00 . A A . 34 ALA HB2 1 1 1 496 1 1 34 ALA HB3 H 3.591 -2.023 -5.226 1.00 . A A . 34 ALA HB3 1 1 1 497 1 1 34 ALA N N 6.439 -0.923 -4.739 1.00 . A A . 34 ALA N 1 1 1 498 1 1 34 ALA O O 5.463 0.364 -2.432 1.00 . A A . 34 ALA O 1 1 1 499 1 1 35 TYR C C 2.243 2.946 -2.755 1.00 . A A . 35 TYR C 1 1 1 500 1 1 35 TYR CA C 3.665 2.416 -2.555 1.00 . A A . 35 TYR CA 1 1 1 501 1 1 35 TYR CB C 4.670 3.573 -2.664 1.00 . A A . 35 TYR CB 1 1 1 502 1 1 35 TYR CD1 C 4.245 3.839 -5.123 1.00 . A A . 35 TYR CD1 1 1 1 503 1 1 35 TYR CD2 C 4.092 5.797 -3.709 1.00 . A A . 35 TYR CD2 1 1 1 504 1 1 35 TYR CE1 C 3.915 4.614 -6.241 1.00 . A A . 35 TYR CE1 1 1 1 505 1 1 35 TYR CE2 C 3.766 6.577 -4.826 1.00 . A A . 35 TYR CE2 1 1 1 506 1 1 35 TYR CG C 4.332 4.427 -3.862 1.00 . A A . 35 TYR CG 1 1 1 507 1 1 35 TYR CZ C 3.675 5.984 -6.093 1.00 . A A . 35 TYR CZ 1 1 1 508 1 1 35 TYR H H 3.425 1.444 -4.462 1.00 . A A . 35 TYR H 1 1 1 509 1 1 35 TYR HA H 3.745 1.955 -1.581 1.00 . A A . 35 TYR HA 1 1 1 510 1 1 35 TYR HB2 H 4.623 4.175 -1.768 1.00 . A A . 35 TYR HB2 1 1 1 511 1 1 35 TYR HB3 H 5.667 3.174 -2.777 1.00 . A A . 35 TYR HB3 1 1 1 512 1 1 35 TYR HD1 H 4.437 2.789 -5.234 1.00 . A A . 35 TYR HD1 1 1 1 513 1 1 35 TYR HD2 H 4.162 6.253 -2.733 1.00 . A A . 35 TYR HD2 1 1 1 514 1 1 35 TYR HE1 H 3.848 4.156 -7.217 1.00 . A A . 35 TYR HE1 1 1 1 515 1 1 35 TYR HE2 H 3.581 7.634 -4.710 1.00 . A A . 35 TYR HE2 1 1 1 516 1 1 35 TYR HH H 2.938 6.179 -7.844 1.00 . A A . 35 TYR HH 1 1 1 517 1 1 35 TYR N N 3.934 1.406 -3.625 1.00 . A A . 35 TYR N 1 1 1 518 1 1 35 TYR O O 1.697 2.862 -3.836 1.00 . A A . 35 TYR O 1 1 1 519 1 1 35 TYR OH O 3.350 6.752 -7.193 1.00 . A A . 35 TYR OH 1 1 1 520 1 1 36 VAL C C 0.290 5.222 -2.846 1.00 . A A . 36 VAL C 1 1 1 521 1 1 36 VAL CA C 0.246 4.007 -1.915 1.00 . A A . 36 VAL CA 1 1 1 522 1 1 36 VAL CB C -0.345 4.401 -0.558 1.00 . A A . 36 VAL CB 1 1 1 523 1 1 36 VAL CG1 C 0.450 5.561 0.039 1.00 . A A . 36 VAL CG1 1 1 1 524 1 1 36 VAL CG2 C -1.802 4.830 -0.745 1.00 . A A . 36 VAL CG2 1 1 1 525 1 1 36 VAL H H 2.077 3.548 -0.866 1.00 . A A . 36 VAL H 1 1 1 526 1 1 36 VAL HA H -0.366 3.238 -2.363 1.00 . A A . 36 VAL HA 1 1 1 527 1 1 36 VAL HB H -0.301 3.554 0.112 1.00 . A A . 36 VAL HB 1 1 1 528 1 1 36 VAL HG11 H 1.116 5.964 -0.707 1.00 . A A . 36 VAL HG11 1 1 1 529 1 1 36 VAL HG12 H -0.233 6.332 0.366 1.00 . A A . 36 VAL HG12 1 1 1 530 1 1 36 VAL HG13 H 1.024 5.208 0.881 1.00 . A A . 36 VAL HG13 1 1 1 531 1 1 36 VAL HG21 H -2.320 4.095 -1.342 1.00 . A A . 36 VAL HG21 1 1 1 532 1 1 36 VAL HG22 H -2.279 4.912 0.220 1.00 . A A . 36 VAL HG22 1 1 1 533 1 1 36 VAL HG23 H -1.833 5.786 -1.244 1.00 . A A . 36 VAL HG23 1 1 1 534 1 1 36 VAL N N 1.631 3.487 -1.737 1.00 . A A . 36 VAL N 1 1 1 535 1 1 36 VAL O O 0.053 6.343 -2.443 1.00 . A A . 36 VAL O 1 1 1 536 1 1 37 LYS C C -0.586 6.976 -4.991 1.00 . A A . 37 LYS C 1 1 1 537 1 1 37 LYS CA C 0.671 6.120 -5.073 1.00 . A A . 37 LYS CA 1 1 1 538 1 1 37 LYS CB C 0.805 5.550 -6.487 1.00 . A A . 37 LYS CB 1 1 1 539 1 1 37 LYS CD C -1.156 5.662 -8.031 1.00 . A A . 37 LYS CD 1 1 1 540 1 1 37 LYS CE C -0.227 5.664 -9.245 1.00 . A A . 37 LYS CE 1 1 1 541 1 1 37 LYS CG C -0.508 4.875 -6.891 1.00 . A A . 37 LYS CG 1 1 1 542 1 1 37 LYS H H 0.785 4.082 -4.391 1.00 . A A . 37 LYS H 1 1 1 543 1 1 37 LYS HA H 1.524 6.732 -4.852 1.00 . A A . 37 LYS HA 1 1 1 544 1 1 37 LYS HB2 H 1.029 6.351 -7.177 1.00 . A A . 37 LYS HB2 1 1 1 545 1 1 37 LYS HB3 H 1.603 4.823 -6.508 1.00 . A A . 37 LYS HB3 1 1 1 546 1 1 37 LYS HD2 H -2.097 5.200 -8.296 1.00 . A A . 37 LYS HD2 1 1 1 547 1 1 37 LYS HD3 H -1.331 6.679 -7.712 1.00 . A A . 37 LYS HD3 1 1 1 548 1 1 37 LYS HE2 H 0.655 5.082 -9.023 1.00 . A A . 37 LYS HE2 1 1 1 549 1 1 37 LYS HE3 H -0.740 5.231 -10.091 1.00 . A A . 37 LYS HE3 1 1 1 550 1 1 37 LYS HG2 H -0.306 3.864 -7.219 1.00 . A A . 37 LYS HG2 1 1 1 551 1 1 37 LYS HG3 H -1.177 4.853 -6.045 1.00 . A A . 37 LYS HG3 1 1 1 552 1 1 37 LYS HZ1 H -0.243 7.711 -8.865 1.00 . A A . 37 LYS HZ1 1 1 1 553 1 1 37 LYS HZ2 H 1.205 7.146 -9.543 1.00 . A A . 37 LYS HZ2 1 1 1 554 1 1 37 LYS HZ3 H -0.179 7.313 -10.515 1.00 . A A . 37 LYS HZ3 1 1 1 555 1 1 37 LYS N N 0.597 4.998 -4.095 1.00 . A A . 37 LYS N 1 1 1 556 1 1 37 LYS NZ N 0.169 7.064 -9.567 1.00 . A A . 37 LYS NZ 1 1 1 557 1 1 37 LYS O O -0.603 8.106 -5.437 1.00 . A A . 37 LYS O 1 1 1 558 1 1 38 ASP C C -3.851 6.595 -3.381 1.00 . A A . 38 ASP C 1 1 1 559 1 1 38 ASP CA C -2.880 7.261 -4.356 1.00 . A A . 38 ASP CA 1 1 1 560 1 1 38 ASP CB C -3.494 7.342 -5.751 1.00 . A A . 38 ASP CB 1 1 1 561 1 1 38 ASP CG C -4.895 7.949 -5.667 1.00 . A A . 38 ASP CG 1 1 1 562 1 1 38 ASP H H -1.620 5.542 -4.094 1.00 . A A . 38 ASP H 1 1 1 563 1 1 38 ASP HA H -2.643 8.255 -4.007 1.00 . A A . 38 ASP HA 1 1 1 564 1 1 38 ASP HB2 H -2.866 7.960 -6.379 1.00 . A A . 38 ASP HB2 1 1 1 565 1 1 38 ASP HB3 H -3.554 6.351 -6.173 1.00 . A A . 38 ASP HB3 1 1 1 566 1 1 38 ASP N N -1.640 6.457 -4.441 1.00 . A A . 38 ASP N 1 1 1 567 1 1 38 ASP O O -4.532 5.645 -3.713 1.00 . A A . 38 ASP O 1 1 1 568 1 1 38 ASP OD1 O -5.094 8.817 -4.831 1.00 . A A . 38 ASP OD1 1 1 1 569 1 1 38 ASP OD2 O -5.746 7.536 -6.437 1.00 . A A . 38 ASP OD2 1 1 1 570 1 1 39 VAL C C -6.216 6.301 -1.764 1.00 . A A . 39 VAL C 1 1 1 571 1 1 39 VAL CA C -4.822 6.483 -1.159 1.00 . A A . 39 VAL CA 1 1 1 572 1 1 39 VAL CB C -4.908 7.404 0.060 1.00 . A A . 39 VAL CB 1 1 1 573 1 1 39 VAL CG1 C -3.499 7.737 0.553 1.00 . A A . 39 VAL CG1 1 1 1 574 1 1 39 VAL CG2 C -5.630 8.698 -0.325 1.00 . A A . 39 VAL CG2 1 1 1 575 1 1 39 VAL H H -3.342 7.846 -1.926 1.00 . A A . 39 VAL H 1 1 1 576 1 1 39 VAL HA H -4.435 5.521 -0.855 1.00 . A A . 39 VAL HA 1 1 1 577 1 1 39 VAL HB H -5.453 6.906 0.848 1.00 . A A . 39 VAL HB 1 1 1 578 1 1 39 VAL HG11 H -2.786 7.087 0.069 1.00 . A A . 39 VAL HG11 1 1 1 579 1 1 39 VAL HG12 H -3.268 8.765 0.316 1.00 . A A . 39 VAL HG12 1 1 1 580 1 1 39 VAL HG13 H -3.449 7.594 1.622 1.00 . A A . 39 VAL HG13 1 1 1 581 1 1 39 VAL HG21 H -6.512 8.461 -0.902 1.00 . A A . 39 VAL HG21 1 1 1 582 1 1 39 VAL HG22 H -5.917 9.230 0.569 1.00 . A A . 39 VAL HG22 1 1 1 583 1 1 39 VAL HG23 H -4.969 9.316 -0.915 1.00 . A A . 39 VAL HG23 1 1 1 584 1 1 39 VAL N N -3.908 7.084 -2.171 1.00 . A A . 39 VAL N 1 1 1 585 1 1 39 VAL O O -6.951 5.409 -1.392 1.00 . A A . 39 VAL O 1 1 1 586 1 1 40 GLU C C -7.877 5.999 -4.463 1.00 . A A . 40 GLU C 1 1 1 587 1 1 40 GLU CA C -7.934 7.010 -3.314 1.00 . A A . 40 GLU CA 1 1 1 588 1 1 40 GLU CB C -8.384 8.372 -3.849 1.00 . A A . 40 GLU CB 1 1 1 589 1 1 40 GLU CD C -9.553 10.492 -3.220 1.00 . A A . 40 GLU CD 1 1 1 590 1 1 40 GLU CG C -9.338 9.024 -2.847 1.00 . A A . 40 GLU CG 1 1 1 591 1 1 40 GLU H H -5.981 7.855 -2.978 1.00 . A A . 40 GLU H 1 1 1 592 1 1 40 GLU HA H -8.639 6.667 -2.571 1.00 . A A . 40 GLU HA 1 1 1 593 1 1 40 GLU HB2 H -7.520 9.006 -3.992 1.00 . A A . 40 GLU HB2 1 1 1 594 1 1 40 GLU HB3 H -8.892 8.239 -4.793 1.00 . A A . 40 GLU HB3 1 1 1 595 1 1 40 GLU HG2 H -10.286 8.505 -2.864 1.00 . A A . 40 GLU HG2 1 1 1 596 1 1 40 GLU HG3 H -8.914 8.965 -1.856 1.00 . A A . 40 GLU HG3 1 1 1 597 1 1 40 GLU N N -6.587 7.140 -2.692 1.00 . A A . 40 GLU N 1 1 1 598 1 1 40 GLU O O -8.881 5.662 -5.056 1.00 . A A . 40 GLU O 1 1 1 599 1 1 40 GLU OE1 O -9.379 10.819 -4.382 1.00 . A A . 40 GLU OE1 1 1 1 600 1 1 40 GLU OE2 O -9.889 11.263 -2.336 1.00 . A A . 40 GLU OE2 1 1 1 601 1 1 41 GLY C C -7.285 3.215 -5.483 1.00 . A A . 41 GLY C 1 1 1 602 1 1 41 GLY CA C -6.589 4.517 -5.885 1.00 . A A . 41 GLY CA 1 1 1 603 1 1 41 GLY H H -5.909 5.791 -4.286 1.00 . A A . 41 GLY H 1 1 1 604 1 1 41 GLY HA2 H -7.054 4.915 -6.777 1.00 . A A . 41 GLY HA2 1 1 1 605 1 1 41 GLY HA3 H -5.547 4.318 -6.080 1.00 . A A . 41 GLY HA3 1 1 1 606 1 1 41 GLY N N -6.708 5.509 -4.778 1.00 . A A . 41 GLY N 1 1 1 607 1 1 41 GLY O O -7.831 2.510 -6.308 1.00 . A A . 41 GLY O 1 1 1 608 1 1 42 ALA C C -8.889 1.958 -2.615 1.00 . A A . 42 ALA C 1 1 1 609 1 1 42 ALA CA C -7.936 1.637 -3.766 1.00 . A A . 42 ALA CA 1 1 1 610 1 1 42 ALA CB C -6.877 0.642 -3.286 1.00 . A A . 42 ALA CB 1 1 1 611 1 1 42 ALA H H -6.829 3.474 -3.569 1.00 . A A . 42 ALA H 1 1 1 612 1 1 42 ALA HA H -8.491 1.206 -4.585 1.00 . A A . 42 ALA HA 1 1 1 613 1 1 42 ALA HB1 H -6.127 0.516 -4.053 1.00 . A A . 42 ALA HB1 1 1 1 614 1 1 42 ALA HB2 H -6.413 1.017 -2.387 1.00 . A A . 42 ALA HB2 1 1 1 615 1 1 42 ALA HB3 H -7.344 -0.310 -3.080 1.00 . A A . 42 ALA HB3 1 1 1 616 1 1 42 ALA N N -7.272 2.891 -4.219 1.00 . A A . 42 ALA N 1 1 1 617 1 1 42 ALA O O -8.807 3.003 -2.002 1.00 . A A . 42 ALA O 1 1 1 618 1 1 43 SER C C -10.159 0.807 0.105 1.00 . A A . 43 SER C 1 1 1 619 1 1 43 SER CA C -10.751 1.327 -1.206 1.00 . A A . 43 SER CA 1 1 1 620 1 1 43 SER CB C -12.072 0.611 -1.489 1.00 . A A . 43 SER CB 1 1 1 621 1 1 43 SER H H -9.845 0.231 -2.824 1.00 . A A . 43 SER H 1 1 1 622 1 1 43 SER HA H -10.927 2.389 -1.124 1.00 . A A . 43 SER HA 1 1 1 623 1 1 43 SER HB2 H -12.348 0.009 -0.639 1.00 . A A . 43 SER HB2 1 1 1 624 1 1 43 SER HB3 H -12.845 1.346 -1.674 1.00 . A A . 43 SER HB3 1 1 1 625 1 1 43 SER HG H -12.585 -0.915 -2.580 1.00 . A A . 43 SER HG 1 1 1 626 1 1 43 SER N N -9.795 1.068 -2.318 1.00 . A A . 43 SER N 1 1 1 627 1 1 43 SER O O -9.137 0.145 0.120 1.00 . A A . 43 SER O 1 1 1 628 1 1 43 SER OG O -11.917 -0.227 -2.625 1.00 . A A . 43 SER OG 1 1 1 629 1 1 44 GLN C C -10.410 -0.889 2.601 1.00 . A A . 44 GLN C 1 1 1 630 1 1 44 GLN CA C -10.265 0.629 2.517 1.00 . A A . 44 GLN CA 1 1 1 631 1 1 44 GLN CB C -11.053 1.285 3.653 1.00 . A A . 44 GLN CB 1 1 1 632 1 1 44 GLN CD C -13.353 1.840 4.450 1.00 . A A . 44 GLN CD 1 1 1 633 1 1 44 GLN CG C -12.538 0.949 3.510 1.00 . A A . 44 GLN CG 1 1 1 634 1 1 44 GLN H H -11.611 1.640 1.174 1.00 . A A . 44 GLN H 1 1 1 635 1 1 44 GLN HA H -9.222 0.895 2.602 1.00 . A A . 44 GLN HA 1 1 1 636 1 1 44 GLN HB2 H -10.689 0.917 4.601 1.00 . A A . 44 GLN HB2 1 1 1 637 1 1 44 GLN HB3 H -10.923 2.357 3.609 1.00 . A A . 44 GLN HB3 1 1 1 638 1 1 44 GLN HE21 H -13.463 0.470 5.885 1.00 . A A . 44 GLN HE21 1 1 1 639 1 1 44 GLN HE22 H -14.237 1.942 6.225 1.00 . A A . 44 GLN HE22 1 1 1 640 1 1 44 GLN HG2 H -12.850 1.119 2.490 1.00 . A A . 44 GLN HG2 1 1 1 641 1 1 44 GLN HG3 H -12.700 -0.087 3.769 1.00 . A A . 44 GLN HG3 1 1 1 642 1 1 44 GLN N N -10.791 1.104 1.207 1.00 . A A . 44 GLN N 1 1 1 643 1 1 44 GLN NE2 N -13.714 1.379 5.617 1.00 . A A . 44 GLN NE2 1 1 1 644 1 1 44 GLN O O -9.584 -1.566 3.178 1.00 . A A . 44 GLN O 1 1 1 645 1 1 44 GLN OE1 O -13.662 2.967 4.121 1.00 . A A . 44 GLN OE1 1 1 1 646 1 1 45 GLU C C -10.634 -3.583 1.148 1.00 . A A . 45 GLU C 1 1 1 647 1 1 45 GLU CA C -11.647 -2.911 2.075 1.00 . A A . 45 GLU CA 1 1 1 648 1 1 45 GLU CB C -13.063 -3.256 1.612 1.00 . A A . 45 GLU CB 1 1 1 649 1 1 45 GLU CD C -14.565 -3.541 3.586 1.00 . A A . 45 GLU CD 1 1 1 650 1 1 45 GLU CG C -14.082 -2.562 2.516 1.00 . A A . 45 GLU CG 1 1 1 651 1 1 45 GLU H H -12.107 -0.866 1.566 1.00 . A A . 45 GLU H 1 1 1 652 1 1 45 GLU HA H -11.500 -3.262 3.086 1.00 . A A . 45 GLU HA 1 1 1 653 1 1 45 GLU HB2 H -13.200 -2.923 0.594 1.00 . A A . 45 GLU HB2 1 1 1 654 1 1 45 GLU HB3 H -13.208 -4.324 1.664 1.00 . A A . 45 GLU HB3 1 1 1 655 1 1 45 GLU HG2 H -13.619 -1.707 2.990 1.00 . A A . 45 GLU HG2 1 1 1 656 1 1 45 GLU HG3 H -14.923 -2.234 1.925 1.00 . A A . 45 GLU HG3 1 1 1 657 1 1 45 GLU N N -11.453 -1.431 2.029 1.00 . A A . 45 GLU N 1 1 1 658 1 1 45 GLU O O -10.261 -4.728 1.336 1.00 . A A . 45 GLU O 1 1 1 659 1 1 45 GLU OE1 O -13.814 -4.444 3.917 1.00 . A A . 45 GLU OE1 1 1 1 660 1 1 45 GLU OE2 O -15.679 -3.372 4.055 1.00 . A A . 45 GLU OE2 1 1 1 661 1 1 46 GLU C C -7.809 -3.179 -0.099 1.00 . A A . 46 GLU C 1 1 1 662 1 1 46 GLU CA C -9.141 -3.441 -0.747 1.00 . A A . 46 GLU CA 1 1 1 663 1 1 46 GLU CB C -9.194 -2.726 -2.095 1.00 . A A . 46 GLU CB 1 1 1 664 1 1 46 GLU CD C -10.605 -2.330 -4.114 1.00 . A A . 46 GLU CD 1 1 1 665 1 1 46 GLU CG C -10.609 -2.809 -2.662 1.00 . A A . 46 GLU CG 1 1 1 666 1 1 46 GLU H H -10.431 -1.930 0.067 1.00 . A A . 46 GLU H 1 1 1 667 1 1 46 GLU HA H -9.299 -4.503 -0.871 1.00 . A A . 46 GLU HA 1 1 1 668 1 1 46 GLU HB2 H -8.919 -1.690 -1.962 1.00 . A A . 46 GLU HB2 1 1 1 669 1 1 46 GLU HB3 H -8.504 -3.195 -2.776 1.00 . A A . 46 GLU HB3 1 1 1 670 1 1 46 GLU HG2 H -10.954 -3.832 -2.619 1.00 . A A . 46 GLU HG2 1 1 1 671 1 1 46 GLU HG3 H -11.263 -2.181 -2.076 1.00 . A A . 46 GLU HG3 1 1 1 672 1 1 46 GLU N N -10.153 -2.865 0.171 1.00 . A A . 46 GLU N 1 1 1 673 1 1 46 GLU O O -6.929 -4.015 -0.046 1.00 . A A . 46 GLU O 1 1 1 674 1 1 46 GLU OE1 O -9.712 -2.725 -4.845 1.00 . A A . 46 GLU OE1 1 1 1 675 1 1 46 GLU OE2 O -11.494 -1.575 -4.471 1.00 . A A . 46 GLU OE2 1 1 1 676 1 1 47 VAL C C -6.331 -2.567 2.355 1.00 . A A . 47 VAL C 1 1 1 677 1 1 47 VAL CA C -6.462 -1.635 1.150 1.00 . A A . 47 VAL CA 1 1 1 678 1 1 47 VAL CB C -6.586 -0.190 1.621 1.00 . A A . 47 VAL CB 1 1 1 679 1 1 47 VAL CG1 C -5.497 0.093 2.640 1.00 . A A . 47 VAL CG1 1 1 1 680 1 1 47 VAL CG2 C -6.433 0.758 0.428 1.00 . A A . 47 VAL CG2 1 1 1 681 1 1 47 VAL H H -8.443 -1.393 0.392 1.00 . A A . 47 VAL H 1 1 1 682 1 1 47 VAL HA H -5.608 -1.744 0.499 1.00 . A A . 47 VAL HA 1 1 1 683 1 1 47 VAL HB H -7.553 -0.043 2.079 1.00 . A A . 47 VAL HB 1 1 1 684 1 1 47 VAL HG11 H -4.550 -0.252 2.254 1.00 . A A . 47 VAL HG11 1 1 1 685 1 1 47 VAL HG12 H -5.449 1.153 2.827 1.00 . A A . 47 VAL HG12 1 1 1 686 1 1 47 VAL HG13 H -5.725 -0.428 3.557 1.00 . A A . 47 VAL HG13 1 1 1 687 1 1 47 VAL HG21 H -6.287 0.181 -0.474 1.00 . A A . 47 VAL HG21 1 1 1 688 1 1 47 VAL HG22 H -7.325 1.359 0.330 1.00 . A A . 47 VAL HG22 1 1 1 689 1 1 47 VAL HG23 H -5.581 1.401 0.586 1.00 . A A . 47 VAL HG23 1 1 1 690 1 1 47 VAL N N -7.694 -2.010 0.436 1.00 . A A . 47 VAL N 1 1 1 691 1 1 47 VAL O O -5.246 -2.881 2.801 1.00 . A A . 47 VAL O 1 1 1 692 1 1 48 GLU C C -6.883 -5.286 3.575 1.00 . A A . 48 GLU C 1 1 1 693 1 1 48 GLU CA C -7.435 -3.934 4.018 1.00 . A A . 48 GLU CA 1 1 1 694 1 1 48 GLU CB C -8.879 -4.091 4.464 1.00 . A A . 48 GLU CB 1 1 1 695 1 1 48 GLU CD C -9.960 -4.477 6.681 1.00 . A A . 48 GLU CD 1 1 1 696 1 1 48 GLU CG C -9.040 -3.553 5.880 1.00 . A A . 48 GLU CG 1 1 1 697 1 1 48 GLU H H -8.307 -2.766 2.495 1.00 . A A . 48 GLU H 1 1 1 698 1 1 48 GLU HA H -6.841 -3.527 4.821 1.00 . A A . 48 GLU HA 1 1 1 699 1 1 48 GLU HB2 H -9.519 -3.536 3.795 1.00 . A A . 48 GLU HB2 1 1 1 700 1 1 48 GLU HB3 H -9.147 -5.121 4.429 1.00 . A A . 48 GLU HB3 1 1 1 701 1 1 48 GLU HG2 H -8.072 -3.502 6.353 1.00 . A A . 48 GLU HG2 1 1 1 702 1 1 48 GLU HG3 H -9.472 -2.566 5.835 1.00 . A A . 48 GLU HG3 1 1 1 703 1 1 48 GLU N N -7.445 -3.021 2.871 1.00 . A A . 48 GLU N 1 1 1 704 1 1 48 GLU O O -5.834 -5.714 4.013 1.00 . A A . 48 GLU O 1 1 1 705 1 1 48 GLU OE1 O -11.160 -4.267 6.639 1.00 . A A . 48 GLU OE1 1 1 1 706 1 1 48 GLU OE2 O -9.446 -5.381 7.320 1.00 . A A . 48 GLU OE2 1 1 1 707 1 1 49 GLU C C -5.634 -7.115 1.744 1.00 . A A . 49 GLU C 1 1 1 708 1 1 49 GLU CA C -7.077 -7.279 2.221 1.00 . A A . 49 GLU CA 1 1 1 709 1 1 49 GLU CB C -7.948 -7.779 1.067 1.00 . A A . 49 GLU CB 1 1 1 710 1 1 49 GLU CD C -9.869 -9.301 0.577 1.00 . A A . 49 GLU CD 1 1 1 711 1 1 49 GLU CG C -9.238 -8.383 1.625 1.00 . A A . 49 GLU CG 1 1 1 712 1 1 49 GLU H H -8.419 -5.596 2.346 1.00 . A A . 49 GLU H 1 1 1 713 1 1 49 GLU HA H -7.108 -7.991 3.032 1.00 . A A . 49 GLU HA 1 1 1 714 1 1 49 GLU HB2 H -8.189 -6.953 0.414 1.00 . A A . 49 GLU HB2 1 1 1 715 1 1 49 GLU HB3 H -7.412 -8.534 0.511 1.00 . A A . 49 GLU HB3 1 1 1 716 1 1 49 GLU HG2 H -9.013 -8.953 2.516 1.00 . A A . 49 GLU HG2 1 1 1 717 1 1 49 GLU HG3 H -9.929 -7.590 1.870 1.00 . A A . 49 GLU HG3 1 1 1 718 1 1 49 GLU N N -7.578 -5.960 2.695 1.00 . A A . 49 GLU N 1 1 1 719 1 1 49 GLU O O -4.789 -7.954 1.985 1.00 . A A . 49 GLU O 1 1 1 720 1 1 49 GLU OE1 O -9.265 -9.478 -0.468 1.00 . A A . 49 GLU OE1 1 1 1 721 1 1 49 GLU OE2 O -10.948 -9.810 0.836 1.00 . A A . 49 GLU OE2 1 1 1 722 1 1 50 ALA C C -3.028 -5.705 1.811 1.00 . A A . 50 ALA C 1 1 1 723 1 1 50 ALA CA C -3.953 -5.803 0.599 1.00 . A A . 50 ALA CA 1 1 1 724 1 1 50 ALA CB C -3.889 -4.501 -0.203 1.00 . A A . 50 ALA CB 1 1 1 725 1 1 50 ALA H H -6.037 -5.360 0.903 1.00 . A A . 50 ALA H 1 1 1 726 1 1 50 ALA HA H -3.645 -6.630 -0.025 1.00 . A A . 50 ALA HA 1 1 1 727 1 1 50 ALA HB1 H -4.701 -4.478 -0.915 1.00 . A A . 50 ALA HB1 1 1 1 728 1 1 50 ALA HB2 H -3.977 -3.661 0.470 1.00 . A A . 50 ALA HB2 1 1 1 729 1 1 50 ALA HB3 H -2.947 -4.446 -0.727 1.00 . A A . 50 ALA HB3 1 1 1 730 1 1 50 ALA N N -5.343 -6.029 1.078 1.00 . A A . 50 ALA N 1 1 1 731 1 1 50 ALA O O -1.855 -6.016 1.739 1.00 . A A . 50 ALA O 1 1 1 732 1 1 51 MET C C -2.427 -6.583 4.674 1.00 . A A . 51 MET C 1 1 1 733 1 1 51 MET CA C -2.715 -5.175 4.153 1.00 . A A . 51 MET CA 1 1 1 734 1 1 51 MET CB C -3.468 -4.376 5.217 1.00 . A A . 51 MET CB 1 1 1 735 1 1 51 MET CE C -3.259 -0.872 6.144 1.00 . A A . 51 MET CE 1 1 1 736 1 1 51 MET CG C -2.489 -3.466 5.958 1.00 . A A . 51 MET CG 1 1 1 737 1 1 51 MET H H -4.503 -5.046 2.965 1.00 . A A . 51 MET H 1 1 1 738 1 1 51 MET HA H -1.786 -4.680 3.915 1.00 . A A . 51 MET HA 1 1 1 739 1 1 51 MET HB2 H -4.231 -3.776 4.743 1.00 . A A . 51 MET HB2 1 1 1 740 1 1 51 MET HB3 H -3.928 -5.055 5.918 1.00 . A A . 51 MET HB3 1 1 1 741 1 1 51 MET HE1 H -3.185 -1.108 5.094 1.00 . A A . 51 MET HE1 1 1 1 742 1 1 51 MET HE2 H -4.134 -0.261 6.313 1.00 . A A . 51 MET HE2 1 1 1 743 1 1 51 MET HE3 H -2.373 -0.336 6.453 1.00 . A A . 51 MET HE3 1 1 1 744 1 1 51 MET HG2 H -1.783 -4.068 6.510 1.00 . A A . 51 MET HG2 1 1 1 745 1 1 51 MET HG3 H -1.959 -2.854 5.243 1.00 . A A . 51 MET HG3 1 1 1 746 1 1 51 MET N N -3.553 -5.283 2.929 1.00 . A A . 51 MET N 1 1 1 747 1 1 51 MET O O -1.316 -6.906 5.044 1.00 . A A . 51 MET O 1 1 1 748 1 1 51 MET SD S -3.400 -2.401 7.101 1.00 . A A . 51 MET SD 1 1 1 749 1 1 52 ASP C C -2.079 -9.455 4.367 1.00 . A A . 52 ASP C 1 1 1 750 1 1 52 ASP CA C -3.211 -8.820 5.175 1.00 . A A . 52 ASP CA 1 1 1 751 1 1 52 ASP CB C -4.497 -9.626 4.978 1.00 . A A . 52 ASP CB 1 1 1 752 1 1 52 ASP CG C -4.395 -10.949 5.740 1.00 . A A . 52 ASP CG 1 1 1 753 1 1 52 ASP H H -4.309 -7.147 4.382 1.00 . A A . 52 ASP H 1 1 1 754 1 1 52 ASP HA H -2.948 -8.805 6.222 1.00 . A A . 52 ASP HA 1 1 1 755 1 1 52 ASP HB2 H -5.338 -9.060 5.349 1.00 . A A . 52 ASP HB2 1 1 1 756 1 1 52 ASP HB3 H -4.636 -9.829 3.926 1.00 . A A . 52 ASP HB3 1 1 1 757 1 1 52 ASP N N -3.423 -7.427 4.693 1.00 . A A . 52 ASP N 1 1 1 758 1 1 52 ASP O O -1.219 -10.123 4.903 1.00 . A A . 52 ASP O 1 1 1 759 1 1 52 ASP OD1 O -3.292 -11.309 6.116 1.00 . A A . 52 ASP OD1 1 1 1 760 1 1 52 ASP OD2 O -5.421 -11.579 5.933 1.00 . A A . 52 ASP OD2 1 1 1 761 1 1 53 THR C C 0.357 -9.299 2.699 1.00 . A A . 53 THR C 1 1 1 762 1 1 53 THR CA C -0.998 -9.831 2.230 1.00 . A A . 53 THR CA 1 1 1 763 1 1 53 THR CB C -1.226 -9.429 0.771 1.00 . A A . 53 THR CB 1 1 1 764 1 1 53 THR CG2 C -1.282 -10.682 -0.105 1.00 . A A . 53 THR CG2 1 1 1 765 1 1 53 THR H H -2.777 -8.701 2.667 1.00 . A A . 53 THR H 1 1 1 766 1 1 53 THR HA H -1.013 -10.907 2.317 1.00 . A A . 53 THR HA 1 1 1 767 1 1 53 THR HB H -0.413 -8.800 0.439 1.00 . A A . 53 THR HB 1 1 1 768 1 1 53 THR HG1 H -2.254 -7.779 0.724 1.00 . A A . 53 THR HG1 1 1 1 769 1 1 53 THR HG21 H -1.797 -11.469 0.425 1.00 . A A . 53 THR HG21 1 1 1 770 1 1 53 THR HG22 H -1.812 -10.457 -1.019 1.00 . A A . 53 THR HG22 1 1 1 771 1 1 53 THR HG23 H -0.279 -11.003 -0.340 1.00 . A A . 53 THR HG23 1 1 1 772 1 1 53 THR N N -2.074 -9.246 3.078 1.00 . A A . 53 THR N 1 1 1 773 1 1 53 THR O O 0.497 -8.823 3.808 1.00 . A A . 53 THR O 1 1 1 774 1 1 53 THR OG1 O -2.451 -8.717 0.663 1.00 . A A . 53 THR OG1 1 1 1 775 1 1 54 CYS C C 3.253 -9.745 3.394 1.00 . A A . 54 CYS C 1 1 1 776 1 1 54 CYS CA C 2.697 -8.866 2.271 1.00 . A A . 54 CYS CA 1 1 1 777 1 1 54 CYS CB C 2.565 -7.424 2.771 1.00 . A A . 54 CYS CB 1 1 1 778 1 1 54 CYS H H 1.226 -9.757 0.974 1.00 . A A . 54 CYS H 1 1 1 779 1 1 54 CYS HA H 3.367 -8.895 1.424 1.00 . A A . 54 CYS HA 1 1 1 780 1 1 54 CYS HB2 H 1.712 -6.945 2.309 1.00 . A A . 54 CYS HB2 1 1 1 781 1 1 54 CYS HB3 H 2.425 -7.439 3.837 1.00 . A A . 54 CYS HB3 1 1 1 782 1 1 54 CYS N N 1.357 -9.372 1.865 1.00 . A A . 54 CYS N 1 1 1 783 1 1 54 CYS O O 2.514 -10.216 4.235 1.00 . A A . 54 CYS O 1 1 1 784 1 1 54 CYS SG S 4.043 -6.388 2.470 1.00 . A A . 54 CYS SG 1 1 1 785 1 1 55 PRO C C 5.261 -9.998 5.734 1.00 . A A . 55 PRO C 1 1 1 786 1 1 55 PRO CA C 5.211 -10.761 4.407 1.00 . A A . 55 PRO CA 1 1 1 787 1 1 55 PRO CB C 6.615 -10.989 3.845 1.00 . A A . 55 PRO CB 1 1 1 788 1 1 55 PRO CD C 5.497 -9.394 2.392 1.00 . A A . 55 PRO CD 1 1 1 789 1 1 55 PRO CG C 6.849 -9.842 2.909 1.00 . A A . 55 PRO CG 1 1 1 790 1 1 55 PRO HA H 4.702 -11.704 4.528 1.00 . A A . 55 PRO HA 1 1 1 791 1 1 55 PRO HB2 H 7.326 -11.005 4.661 1.00 . A A . 55 PRO HB2 1 1 1 792 1 1 55 PRO HB3 H 6.645 -11.934 3.326 1.00 . A A . 55 PRO HB3 1 1 1 793 1 1 55 PRO HD2 H 5.447 -8.314 2.359 1.00 . A A . 55 PRO HD2 1 1 1 794 1 1 55 PRO HD3 H 5.309 -9.812 1.416 1.00 . A A . 55 PRO HD3 1 1 1 795 1 1 55 PRO HG2 H 7.332 -9.033 3.440 1.00 . A A . 55 PRO HG2 1 1 1 796 1 1 55 PRO HG3 H 7.465 -10.164 2.084 1.00 . A A . 55 PRO HG3 1 1 1 797 1 1 55 PRO N N 4.546 -9.932 3.371 1.00 . A A . 55 PRO N 1 1 1 798 1 1 55 PRO O O 4.700 -10.421 6.725 1.00 . A A . 55 PRO O 1 1 1 799 1 1 56 VAL C C 5.014 -6.898 6.901 1.00 . A A . 56 VAL C 1 1 1 800 1 1 56 VAL CA C 5.987 -8.073 7.009 1.00 . A A . 56 VAL CA 1 1 1 801 1 1 56 VAL CB C 7.410 -7.545 7.202 1.00 . A A . 56 VAL CB 1 1 1 802 1 1 56 VAL CG1 C 7.558 -6.976 8.613 1.00 . A A . 56 VAL CG1 1 1 1 803 1 1 56 VAL CG2 C 8.407 -8.689 7.008 1.00 . A A . 56 VAL CG2 1 1 1 804 1 1 56 VAL H H 6.352 -8.543 4.941 1.00 . A A . 56 VAL H 1 1 1 805 1 1 56 VAL HA H 5.714 -8.695 7.849 1.00 . A A . 56 VAL HA 1 1 1 806 1 1 56 VAL HB H 7.606 -6.766 6.477 1.00 . A A . 56 VAL HB 1 1 1 807 1 1 56 VAL HG11 H 6.797 -7.396 9.253 1.00 . A A . 56 VAL HG11 1 1 1 808 1 1 56 VAL HG12 H 8.534 -7.228 9.003 1.00 . A A . 56 VAL HG12 1 1 1 809 1 1 56 VAL HG13 H 7.450 -5.902 8.583 1.00 . A A . 56 VAL HG13 1 1 1 810 1 1 56 VAL HG21 H 8.076 -9.323 6.199 1.00 . A A . 56 VAL HG21 1 1 1 811 1 1 56 VAL HG22 H 9.379 -8.283 6.772 1.00 . A A . 56 VAL HG22 1 1 1 812 1 1 56 VAL HG23 H 8.469 -9.268 7.917 1.00 . A A . 56 VAL HG23 1 1 1 813 1 1 56 VAL N N 5.916 -8.871 5.754 1.00 . A A . 56 VAL N 1 1 1 814 1 1 56 VAL O O 5.069 -5.956 7.668 1.00 . A A . 56 VAL O 1 1 1 815 1 1 57 GLN C C 3.867 -4.563 5.379 1.00 . A A . 57 GLN C 1 1 1 816 1 1 57 GLN CA C 3.139 -5.844 5.775 1.00 . A A . 57 GLN CA 1 1 1 817 1 1 57 GLN CB C 2.368 -5.627 7.074 1.00 . A A . 57 GLN CB 1 1 1 818 1 1 57 GLN CD C 0.323 -6.545 8.181 1.00 . A A . 57 GLN CD 1 1 1 819 1 1 57 GLN CG C 0.917 -6.058 6.857 1.00 . A A . 57 GLN CG 1 1 1 820 1 1 57 GLN H H 4.098 -7.719 5.344 1.00 . A A . 57 GLN H 1 1 1 821 1 1 57 GLN HA H 2.444 -6.104 4.995 1.00 . A A . 57 GLN HA 1 1 1 822 1 1 57 GLN HB2 H 2.810 -6.220 7.861 1.00 . A A . 57 GLN HB2 1 1 1 823 1 1 57 GLN HB3 H 2.396 -4.584 7.344 1.00 . A A . 57 GLN HB3 1 1 1 824 1 1 57 GLN HE21 H -0.765 -4.908 8.461 1.00 . A A . 57 GLN HE21 1 1 1 825 1 1 57 GLN HE22 H -0.901 -6.088 9.674 1.00 . A A . 57 GLN HE22 1 1 1 826 1 1 57 GLN HG2 H 0.343 -5.220 6.487 1.00 . A A . 57 GLN HG2 1 1 1 827 1 1 57 GLN HG3 H 0.886 -6.860 6.133 1.00 . A A . 57 GLN HG3 1 1 1 828 1 1 57 GLN N N 4.121 -6.949 5.949 1.00 . A A . 57 GLN N 1 1 1 829 1 1 57 GLN NE2 N -0.518 -5.784 8.825 1.00 . A A . 57 GLN NE2 1 1 1 830 1 1 57 GLN O O 3.801 -4.133 4.245 1.00 . A A . 57 GLN O 1 1 1 831 1 1 57 GLN OE1 O 0.630 -7.631 8.632 1.00 . A A . 57 GLN OE1 1 1 1 832 1 1 58 CYS C C 4.240 -1.631 5.537 1.00 . A A . 58 CYS C 1 1 1 833 1 1 58 CYS CA C 5.276 -2.689 5.929 1.00 . A A . 58 CYS CA 1 1 1 834 1 1 58 CYS CB C 6.199 -2.955 4.735 1.00 . A A . 58 CYS CB 1 1 1 835 1 1 58 CYS H H 4.606 -4.294 7.206 1.00 . A A . 58 CYS H 1 1 1 836 1 1 58 CYS HA H 5.861 -2.340 6.767 1.00 . A A . 58 CYS HA 1 1 1 837 1 1 58 CYS HB2 H 5.658 -2.779 3.817 1.00 . A A . 58 CYS HB2 1 1 1 838 1 1 58 CYS HB3 H 7.045 -2.287 4.784 1.00 . A A . 58 CYS HB3 1 1 1 839 1 1 58 CYS HG H 7.718 -4.666 4.983 1.00 . A A . 58 CYS HG 1 1 1 840 1 1 58 CYS N N 4.559 -3.942 6.292 1.00 . A A . 58 CYS N 1 1 1 841 1 1 58 CYS O O 4.565 -0.606 4.971 1.00 . A A . 58 CYS O 1 1 1 842 1 1 58 CYS SG S 6.782 -4.674 4.769 1.00 . A A . 58 CYS SG 1 1 1 843 1 1 59 ILE C C 1.214 -0.438 6.740 1.00 . A A . 59 ILE C 1 1 1 844 1 1 59 ILE CA C 1.920 -0.912 5.468 1.00 . A A . 59 ILE CA 1 1 1 845 1 1 59 ILE CB C 0.912 -1.605 4.547 1.00 . A A . 59 ILE CB 1 1 1 846 1 1 59 ILE CD1 C -1.010 -1.150 3.015 1.00 . A A . 59 ILE CD1 1 1 1 847 1 1 59 ILE CG1 C -0.244 -0.650 4.242 1.00 . A A . 59 ILE CG1 1 1 1 848 1 1 59 ILE CG2 C 0.369 -2.856 5.239 1.00 . A A . 59 ILE CG2 1 1 1 849 1 1 59 ILE H H 2.753 -2.720 6.278 1.00 . A A . 59 ILE H 1 1 1 850 1 1 59 ILE HA H 2.352 -0.065 4.960 1.00 . A A . 59 ILE HA 1 1 1 851 1 1 59 ILE HB H 1.401 -1.892 3.625 1.00 . A A . 59 ILE HB 1 1 1 852 1 1 59 ILE HD11 H -1.189 -2.211 3.112 1.00 . A A . 59 ILE HD11 1 1 1 853 1 1 59 ILE HD12 H -1.953 -0.630 2.944 1.00 . A A . 59 ILE HD12 1 1 1 854 1 1 59 ILE HD13 H -0.427 -0.963 2.125 1.00 . A A . 59 ILE HD13 1 1 1 855 1 1 59 ILE HG12 H -0.911 -0.609 5.091 1.00 . A A . 59 ILE HG12 1 1 1 856 1 1 59 ILE HG13 H 0.147 0.337 4.043 1.00 . A A . 59 ILE HG13 1 1 1 857 1 1 59 ILE HG21 H 1.193 -3.478 5.558 1.00 . A A . 59 ILE HG21 1 1 1 858 1 1 59 ILE HG22 H -0.219 -2.567 6.098 1.00 . A A . 59 ILE HG22 1 1 1 859 1 1 59 ILE HG23 H -0.251 -3.409 4.548 1.00 . A A . 59 ILE HG23 1 1 1 860 1 1 59 ILE N N 2.990 -1.883 5.827 1.00 . A A . 59 ILE N 1 1 1 861 1 1 59 ILE O O 1.161 -1.142 7.727 1.00 . A A . 59 ILE O 1 1 1 862 1 1 60 HIS C C -1.046 2.322 7.568 1.00 . A A . 60 HIS C 1 1 1 863 1 1 60 HIS CA C -0.022 1.252 7.950 1.00 . A A . 60 HIS CA 1 1 1 864 1 1 60 HIS CB C 1.007 1.854 8.910 1.00 . A A . 60 HIS CB 1 1 1 865 1 1 60 HIS CD2 C 2.479 -0.152 9.757 1.00 . A A . 60 HIS CD2 1 1 1 866 1 1 60 HIS CE1 C 4.213 0.176 8.500 1.00 . A A . 60 HIS CE1 1 1 1 867 1 1 60 HIS CG C 2.208 0.951 8.987 1.00 . A A . 60 HIS CG 1 1 1 868 1 1 60 HIS H H 0.724 1.311 5.926 1.00 . A A . 60 HIS H 1 1 1 869 1 1 60 HIS HA H -0.528 0.431 8.437 1.00 . A A . 60 HIS HA 1 1 1 870 1 1 60 HIS HB2 H 1.309 2.827 8.551 1.00 . A A . 60 HIS HB2 1 1 1 871 1 1 60 HIS HB3 H 0.569 1.952 9.893 1.00 . A A . 60 HIS HB3 1 1 1 872 1 1 60 HIS HD1 H 3.454 1.853 7.528 1.00 . A A . 60 HIS HD1 1 1 1 873 1 1 60 HIS HD2 H 1.811 -0.576 10.492 1.00 . A A . 60 HIS HD2 1 1 1 874 1 1 60 HIS HE1 H 5.183 0.071 8.036 1.00 . A A . 60 HIS HE1 1 1 1 875 1 1 60 HIS N N 0.672 0.751 6.729 1.00 . A A . 60 HIS N 1 1 1 876 1 1 60 HIS ND1 N 3.329 1.142 8.192 1.00 . A A . 60 HIS ND1 1 1 1 877 1 1 60 HIS NE2 N 3.745 -0.640 9.448 1.00 . A A . 60 HIS NE2 1 1 1 878 1 1 60 HIS O O -1.089 2.783 6.445 1.00 . A A . 60 HIS O 1 1 1 879 1 1 61 TRP C C -2.351 5.139 8.571 1.00 . A A . 61 TRP C 1 1 1 880 1 1 61 TRP CA C -2.894 3.761 8.192 1.00 . A A . 61 TRP CA 1 1 1 881 1 1 61 TRP CB C -4.169 3.480 8.988 1.00 . A A . 61 TRP CB 1 1 1 882 1 1 61 TRP CD1 C -4.224 0.947 8.998 1.00 . A A . 61 TRP CD1 1 1 1 883 1 1 61 TRP CD2 C -5.859 1.861 7.761 1.00 . A A . 61 TRP CD2 1 1 1 884 1 1 61 TRP CE2 C -6.026 0.461 7.672 1.00 . A A . 61 TRP CE2 1 1 1 885 1 1 61 TRP CE3 C -6.755 2.685 7.073 1.00 . A A . 61 TRP CE3 1 1 1 886 1 1 61 TRP CG C -4.717 2.145 8.605 1.00 . A A . 61 TRP CG 1 1 1 887 1 1 61 TRP CH2 C -7.944 0.734 6.234 1.00 . A A . 61 TRP CH2 1 1 1 888 1 1 61 TRP CZ2 C -7.056 -0.103 6.919 1.00 . A A . 61 TRP CZ2 1 1 1 889 1 1 61 TRP CZ3 C -7.795 2.127 6.312 1.00 . A A . 61 TRP CZ3 1 1 1 890 1 1 61 TRP H H -1.820 2.336 9.397 1.00 . A A . 61 TRP H 1 1 1 891 1 1 61 TRP HA H -3.120 3.744 7.137 1.00 . A A . 61 TRP HA 1 1 1 892 1 1 61 TRP HB2 H -3.953 3.491 10.039 1.00 . A A . 61 TRP HB2 1 1 1 893 1 1 61 TRP HB3 H -4.902 4.242 8.766 1.00 . A A . 61 TRP HB3 1 1 1 894 1 1 61 TRP HD1 H -3.368 0.797 9.639 1.00 . A A . 61 TRP HD1 1 1 1 895 1 1 61 TRP HE1 H -4.867 -1.016 8.577 1.00 . A A . 61 TRP HE1 1 1 1 896 1 1 61 TRP HE3 H -6.640 3.757 7.133 1.00 . A A . 61 TRP HE3 1 1 1 897 1 1 61 TRP HH2 H -8.745 0.308 5.648 1.00 . A A . 61 TRP HH2 1 1 1 898 1 1 61 TRP HZ2 H -7.165 -1.176 6.862 1.00 . A A . 61 TRP HZ2 1 1 1 899 1 1 61 TRP HZ3 H -8.481 2.771 5.784 1.00 . A A . 61 TRP HZ3 1 1 1 900 1 1 61 TRP N N -1.872 2.720 8.498 1.00 . A A . 61 TRP N 1 1 1 901 1 1 61 TRP NE1 N -5.005 -0.056 8.446 1.00 . A A . 61 TRP NE1 1 1 1 902 1 1 61 TRP O O -1.274 5.264 9.120 1.00 . A A . 61 TRP O 1 1 1 903 1 1 62 GLU C C -3.780 8.353 9.194 1.00 . A A . 62 GLU C 1 1 1 904 1 1 62 GLU CA C -2.616 7.545 8.612 1.00 . A A . 62 GLU CA 1 1 1 905 1 1 62 GLU CB C -2.090 8.221 7.339 1.00 . A A . 62 GLU CB 1 1 1 906 1 1 62 GLU CD C -0.834 10.299 6.743 1.00 . A A . 62 GLU CD 1 1 1 907 1 1 62 GLU CG C -2.008 9.736 7.547 1.00 . A A . 62 GLU CG 1 1 1 908 1 1 62 GLU H H -3.951 6.049 7.829 1.00 . A A . 62 GLU H 1 1 1 909 1 1 62 GLU HA H -1.821 7.484 9.342 1.00 . A A . 62 GLU HA 1 1 1 910 1 1 62 GLU HB2 H -1.106 7.838 7.110 1.00 . A A . 62 GLU HB2 1 1 1 911 1 1 62 GLU HB3 H -2.757 8.008 6.516 1.00 . A A . 62 GLU HB3 1 1 1 912 1 1 62 GLU HG2 H -2.928 10.195 7.213 1.00 . A A . 62 GLU HG2 1 1 1 913 1 1 62 GLU HG3 H -1.858 9.948 8.594 1.00 . A A . 62 GLU HG3 1 1 1 914 1 1 62 GLU N N -3.087 6.174 8.275 1.00 . A A . 62 GLU N 1 1 1 915 1 1 62 GLU O O -4.507 9.017 8.483 1.00 . A A . 62 GLU O 1 1 1 916 1 1 62 GLU OE1 O -0.427 9.650 5.793 1.00 . A A . 62 GLU OE1 1 1 1 917 1 1 62 GLU OE2 O -0.363 11.370 7.090 1.00 . A A . 62 GLU OE2 1 1 1 918 1 1 63 ASP C C -4.974 10.535 10.739 1.00 . A A . 63 ASP C 1 1 1 919 1 1 63 ASP CA C -5.075 9.057 11.122 1.00 . A A . 63 ASP CA 1 1 1 920 1 1 63 ASP CB C -4.983 8.918 12.643 1.00 . A A . 63 ASP CB 1 1 1 921 1 1 63 ASP CG C -3.659 9.509 13.130 1.00 . A A . 63 ASP CG 1 1 1 922 1 1 63 ASP H H -3.362 7.754 11.040 1.00 . A A . 63 ASP H 1 1 1 923 1 1 63 ASP HA H -6.021 8.660 10.782 1.00 . A A . 63 ASP HA 1 1 1 924 1 1 63 ASP HB2 H -5.805 9.448 13.102 1.00 . A A . 63 ASP HB2 1 1 1 925 1 1 63 ASP HB3 H -5.030 7.874 12.913 1.00 . A A . 63 ASP HB3 1 1 1 926 1 1 63 ASP N N -3.961 8.297 10.487 1.00 . A A . 63 ASP N 1 1 1 927 1 1 63 ASP O O -3.914 11.032 10.420 1.00 . A A . 63 ASP O 1 1 1 928 1 1 63 ASP OD1 O -2.677 9.381 12.417 1.00 . A A . 63 ASP OD1 1 1 1 929 1 1 63 ASP OD2 O -3.648 10.080 14.208 1.00 . A A . 63 ASP OD2 1 1 1 930 1 1 64 GLU C C -5.185 12.888 9.165 1.00 . A A . 64 GLU C 1 1 1 931 1 1 64 GLU CA C -6.044 12.686 10.415 1.00 . A A . 64 GLU CA 1 1 1 932 1 1 64 GLU CB C -5.451 13.488 11.576 1.00 . A A . 64 GLU CB 1 1 1 933 1 1 64 GLU CD C -5.988 15.652 10.448 1.00 . A A . 64 GLU CD 1 1 1 934 1 1 64 GLU CG C -6.197 14.817 11.713 1.00 . A A . 64 GLU CG 1 1 1 935 1 1 64 GLU H H -6.917 10.818 11.037 1.00 . A A . 64 GLU H 1 1 1 936 1 1 64 GLU HA H -7.049 13.027 10.219 1.00 . A A . 64 GLU HA 1 1 1 937 1 1 64 GLU HB2 H -5.551 12.923 12.491 1.00 . A A . 64 GLU HB2 1 1 1 938 1 1 64 GLU HB3 H -4.406 13.683 11.385 1.00 . A A . 64 GLU HB3 1 1 1 939 1 1 64 GLU HG2 H -7.252 14.626 11.849 1.00 . A A . 64 GLU HG2 1 1 1 940 1 1 64 GLU HG3 H -5.815 15.359 12.565 1.00 . A A . 64 GLU HG3 1 1 1 941 1 1 64 GLU N N -6.072 11.240 10.773 1.00 . A A . 64 GLU N 1 1 1 942 1 1 64 GLU OE1 O -6.624 15.352 9.451 1.00 . A A . 64 GLU OE1 1 1 1 943 1 1 64 GLU OE2 O -5.195 16.578 10.496 1.00 . A A . 64 GLU OE2 1 1 1 944 2 2 1 SF4 FE1 FE 5.475 -4.717 -1.861 1.00 . B A . 65 SF4 FE1 1 1 1 945 2 2 1 SF4 FE2 FE 3.992 -5.863 0.353 1.00 . B A . 65 SF4 FE2 1 1 1 946 2 2 1 SF4 FE3 FE 2.883 -4.612 -1.943 1.00 . B A . 65 SF4 FE3 1 1 1 947 2 2 1 SF4 FE4 FE 4.316 -7.215 -2.184 1.00 . B A . 65 SF4 FE4 1 1 1 948 2 2 1 SF4 S1 S 2.277 -6.706 -0.770 1.00 . B A . 65 SF4 S1 1 1 1 949 2 2 1 SF4 S2 S 4.371 -5.122 -3.491 1.00 . B A . 65 SF4 S2 1 1 1 950 2 2 1 SF4 S3 S 5.952 -6.849 -0.732 1.00 . B A . 65 SF4 S3 1 1 1 951 2 2 1 SF4 S4 S 4.181 -3.520 -0.527 1.00 . B A . 65 SF4 S4 1 1 2 952 1 1 1 ALA C C -8.495 10.208 9.276 1.00 . A A . 1 ALA C 1 1 2 953 1 1 1 ALA CA C -7.994 11.548 9.815 1.00 . A A . 1 ALA CA 1 1 2 954 1 1 1 ALA CB C -9.177 12.499 10.001 1.00 . A A . 1 ALA CB 1 1 2 955 1 1 1 ALA HA H -7.505 11.392 10.766 1.00 . A A . 1 ALA HA 1 1 2 956 1 1 1 ALA HB1 H -8.874 13.506 9.756 1.00 . A A . 1 ALA HB1 1 1 2 957 1 1 1 ALA HB2 H -9.985 12.199 9.352 1.00 . A A . 1 ALA HB2 1 1 2 958 1 1 1 ALA HB3 H -9.509 12.464 11.029 1.00 . A A . 1 ALA HB3 1 1 2 959 1 1 1 ALA N N -7.026 12.144 8.852 1.00 . A A . 1 ALA N 1 1 2 960 1 1 1 ALA O O -9.428 10.151 8.499 1.00 . A A . 1 ALA O 1 1 2 961 1 1 2 ARG C C -7.767 7.536 7.798 1.00 . A A . 2 ARG C 1 1 2 962 1 1 2 ARG CA C -8.318 7.785 9.204 1.00 . A A . 2 ARG CA 1 1 2 963 1 1 2 ARG CB C -9.848 7.721 9.176 1.00 . A A . 2 ARG CB 1 1 2 964 1 1 2 ARG CD C -10.116 5.843 10.808 1.00 . A A . 2 ARG CD 1 1 2 965 1 1 2 ARG CG C -10.302 6.269 9.350 1.00 . A A . 2 ARG CG 1 1 2 966 1 1 2 ARG CZ C -12.218 6.580 11.766 1.00 . A A . 2 ARG CZ 1 1 2 967 1 1 2 ARG H H -7.133 9.202 10.312 1.00 . A A . 2 ARG H 1 1 2 968 1 1 2 ARG HA H -7.941 7.028 9.874 1.00 . A A . 2 ARG HA 1 1 2 969 1 1 2 ARG HB2 H -10.248 8.322 9.979 1.00 . A A . 2 ARG HB2 1 1 2 970 1 1 2 ARG HB3 H -10.206 8.097 8.230 1.00 . A A . 2 ARG HB3 1 1 2 971 1 1 2 ARG HD2 H -10.441 4.820 10.929 1.00 . A A . 2 ARG HD2 1 1 2 972 1 1 2 ARG HD3 H -9.071 5.921 11.074 1.00 . A A . 2 ARG HD3 1 1 2 973 1 1 2 ARG HE H -10.480 7.423 12.226 1.00 . A A . 2 ARG HE 1 1 2 974 1 1 2 ARG HG2 H -11.345 6.184 9.079 1.00 . A A . 2 ARG HG2 1 1 2 975 1 1 2 ARG HG3 H -9.712 5.629 8.712 1.00 . A A . 2 ARG HG3 1 1 2 976 1 1 2 ARG HH11 H -12.563 7.398 9.970 1.00 . A A . 2 ARG HH11 1 1 2 977 1 1 2 ARG HH12 H -13.967 6.867 10.836 1.00 . A A . 2 ARG HH12 1 1 2 978 1 1 2 ARG HH21 H -12.177 5.726 13.576 1.00 . A A . 2 ARG HH21 1 1 2 979 1 1 2 ARG HH22 H -13.748 5.917 12.874 1.00 . A A . 2 ARG HH22 1 1 2 980 1 1 2 ARG N N -7.882 9.128 9.685 1.00 . A A . 2 ARG N 1 1 2 981 1 1 2 ARG NE N -10.923 6.729 11.695 1.00 . A A . 2 ARG NE 1 1 2 982 1 1 2 ARG NH1 N -12.975 6.979 10.780 1.00 . A A . 2 ARG NH1 1 1 2 983 1 1 2 ARG NH2 N -12.756 6.032 12.820 1.00 . A A . 2 ARG NH2 1 1 2 984 1 1 2 ARG O O -8.426 6.954 6.959 1.00 . A A . 2 ARG O 1 1 2 985 1 1 3 LYS C C -5.037 6.540 6.229 1.00 . A A . 3 LYS C 1 1 2 986 1 1 3 LYS CA C -5.973 7.749 6.182 1.00 . A A . 3 LYS CA 1 1 2 987 1 1 3 LYS CB C -5.193 8.994 5.757 1.00 . A A . 3 LYS CB 1 1 2 988 1 1 3 LYS CD C -7.013 9.875 4.293 1.00 . A A . 3 LYS CD 1 1 2 989 1 1 3 LYS CE C -7.333 10.420 2.900 1.00 . A A . 3 LYS CE 1 1 2 990 1 1 3 LYS CG C -5.572 9.367 4.324 1.00 . A A . 3 LYS CG 1 1 2 991 1 1 3 LYS H H -6.046 8.432 8.225 1.00 . A A . 3 LYS H 1 1 2 992 1 1 3 LYS HA H -6.762 7.559 5.470 1.00 . A A . 3 LYS HA 1 1 2 993 1 1 3 LYS HB2 H -5.433 9.812 6.420 1.00 . A A . 3 LYS HB2 1 1 2 994 1 1 3 LYS HB3 H -4.136 8.791 5.805 1.00 . A A . 3 LYS HB3 1 1 2 995 1 1 3 LYS HD2 H -7.685 9.063 4.529 1.00 . A A . 3 LYS HD2 1 1 2 996 1 1 3 LYS HD3 H -7.132 10.663 5.021 1.00 . A A . 3 LYS HD3 1 1 2 997 1 1 3 LYS HE2 H -6.547 11.090 2.588 1.00 . A A . 3 LYS HE2 1 1 2 998 1 1 3 LYS HE3 H -7.406 9.600 2.201 1.00 . A A . 3 LYS HE3 1 1 2 999 1 1 3 LYS HG2 H -4.908 10.141 3.966 1.00 . A A . 3 LYS HG2 1 1 2 1000 1 1 3 LYS HG3 H -5.485 8.497 3.690 1.00 . A A . 3 LYS HG3 1 1 2 1001 1 1 3 LYS HZ1 H -8.718 11.645 3.854 1.00 . A A . 3 LYS HZ1 1 1 2 1002 1 1 3 LYS HZ2 H -8.654 11.851 2.168 1.00 . A A . 3 LYS HZ2 1 1 2 1003 1 1 3 LYS HZ3 H -9.412 10.483 2.831 1.00 . A A . 3 LYS HZ3 1 1 2 1004 1 1 3 LYS N N -6.563 7.968 7.534 1.00 . A A . 3 LYS N 1 1 2 1005 1 1 3 LYS NZ N -8.627 11.156 2.942 1.00 . A A . 3 LYS NZ 1 1 2 1006 1 1 3 LYS O O -5.187 5.661 7.055 1.00 . A A . 3 LYS O 1 1 2 1007 1 1 4 PHE C C -2.166 5.487 4.174 1.00 . A A . 4 PHE C 1 1 2 1008 1 1 4 PHE CA C -3.131 5.336 5.348 1.00 . A A . 4 PHE CA 1 1 2 1009 1 1 4 PHE CB C -3.919 4.031 5.207 1.00 . A A . 4 PHE CB 1 1 2 1010 1 1 4 PHE CD1 C -5.945 4.645 3.841 1.00 . A A . 4 PHE CD1 1 1 2 1011 1 1 4 PHE CD2 C -4.133 3.447 2.764 1.00 . A A . 4 PHE CD2 1 1 2 1012 1 1 4 PHE CE1 C -6.655 4.655 2.635 1.00 . A A . 4 PHE CE1 1 1 2 1013 1 1 4 PHE CE2 C -4.844 3.457 1.557 1.00 . A A . 4 PHE CE2 1 1 2 1014 1 1 4 PHE CG C -4.684 4.041 3.905 1.00 . A A . 4 PHE CG 1 1 2 1015 1 1 4 PHE CZ C -6.105 4.060 1.493 1.00 . A A . 4 PHE CZ 1 1 2 1016 1 1 4 PHE H H -3.962 7.200 4.698 1.00 . A A . 4 PHE H 1 1 2 1017 1 1 4 PHE HA H -2.572 5.326 6.271 1.00 . A A . 4 PHE HA 1 1 2 1018 1 1 4 PHE HB2 H -3.238 3.194 5.220 1.00 . A A . 4 PHE HB2 1 1 2 1019 1 1 4 PHE HB3 H -4.614 3.938 6.029 1.00 . A A . 4 PHE HB3 1 1 2 1020 1 1 4 PHE HD1 H -6.370 5.103 4.721 1.00 . A A . 4 PHE HD1 1 1 2 1021 1 1 4 PHE HD2 H -3.160 2.980 2.814 1.00 . A A . 4 PHE HD2 1 1 2 1022 1 1 4 PHE HE1 H -7.628 5.122 2.585 1.00 . A A . 4 PHE HE1 1 1 2 1023 1 1 4 PHE HE2 H -4.419 2.998 0.676 1.00 . A A . 4 PHE HE2 1 1 2 1024 1 1 4 PHE HZ H -6.653 4.069 0.563 1.00 . A A . 4 PHE HZ 1 1 2 1025 1 1 4 PHE N N -4.070 6.486 5.354 1.00 . A A . 4 PHE N 1 1 2 1026 1 1 4 PHE O O -2.276 6.402 3.381 1.00 . A A . 4 PHE O 1 1 2 1027 1 1 5 TYR C C 0.780 3.587 3.144 1.00 . A A . 5 TYR C 1 1 2 1028 1 1 5 TYR CA C -0.246 4.689 2.942 1.00 . A A . 5 TYR CA 1 1 2 1029 1 1 5 TYR CB C 0.450 6.054 2.967 1.00 . A A . 5 TYR CB 1 1 2 1030 1 1 5 TYR CD1 C 0.546 6.464 5.452 1.00 . A A . 5 TYR CD1 1 1 2 1031 1 1 5 TYR CD2 C 2.615 6.073 4.250 1.00 . A A . 5 TYR CD2 1 1 2 1032 1 1 5 TYR CE1 C 1.265 6.599 6.646 1.00 . A A . 5 TYR CE1 1 1 2 1033 1 1 5 TYR CE2 C 3.333 6.208 5.444 1.00 . A A . 5 TYR CE2 1 1 2 1034 1 1 5 TYR CG C 1.222 6.201 4.254 1.00 . A A . 5 TYR CG 1 1 2 1035 1 1 5 TYR CZ C 2.659 6.470 6.642 1.00 . A A . 5 TYR CZ 1 1 2 1036 1 1 5 TYR H H -1.144 3.868 4.705 1.00 . A A . 5 TYR H 1 1 2 1037 1 1 5 TYR HA H -0.756 4.549 2.002 1.00 . A A . 5 TYR HA 1 1 2 1038 1 1 5 TYR HB2 H 1.130 6.129 2.130 1.00 . A A . 5 TYR HB2 1 1 2 1039 1 1 5 TYR HB3 H -0.290 6.837 2.900 1.00 . A A . 5 TYR HB3 1 1 2 1040 1 1 5 TYR HD1 H -0.529 6.564 5.454 1.00 . A A . 5 TYR HD1 1 1 2 1041 1 1 5 TYR HD2 H 3.136 5.870 3.326 1.00 . A A . 5 TYR HD2 1 1 2 1042 1 1 5 TYR HE1 H 0.744 6.802 7.570 1.00 . A A . 5 TYR HE1 1 1 2 1043 1 1 5 TYR HE2 H 4.409 6.110 5.440 1.00 . A A . 5 TYR HE2 1 1 2 1044 1 1 5 TYR HH H 3.409 5.740 8.237 1.00 . A A . 5 TYR HH 1 1 2 1045 1 1 5 TYR N N -1.220 4.600 4.055 1.00 . A A . 5 TYR N 1 1 2 1046 1 1 5 TYR O O 0.509 2.602 3.804 1.00 . A A . 5 TYR O 1 1 2 1047 1 1 5 TYR OH O 3.367 6.602 7.819 1.00 . A A . 5 TYR OH 1 1 2 1048 1 1 6 VAL C C 4.340 3.187 2.892 1.00 . A A . 6 VAL C 1 1 2 1049 1 1 6 VAL CA C 2.939 2.635 2.803 1.00 . A A . 6 VAL CA 1 1 2 1050 1 1 6 VAL CB C 2.928 1.652 1.641 1.00 . A A . 6 VAL CB 1 1 2 1051 1 1 6 VAL CG1 C 3.096 0.253 2.217 1.00 . A A . 6 VAL CG1 1 1 2 1052 1 1 6 VAL CG2 C 1.613 1.736 0.847 1.00 . A A . 6 VAL CG2 1 1 2 1053 1 1 6 VAL H H 2.174 4.503 2.058 1.00 . A A . 6 VAL H 1 1 2 1054 1 1 6 VAL HA H 2.704 2.106 3.714 1.00 . A A . 6 VAL HA 1 1 2 1055 1 1 6 VAL HB H 3.770 1.872 0.985 1.00 . A A . 6 VAL HB 1 1 2 1056 1 1 6 VAL HG11 H 3.447 0.326 3.236 1.00 . A A . 6 VAL HG11 1 1 2 1057 1 1 6 VAL HG12 H 2.148 -0.256 2.197 1.00 . A A . 6 VAL HG12 1 1 2 1058 1 1 6 VAL HG13 H 3.815 -0.295 1.628 1.00 . A A . 6 VAL HG13 1 1 2 1059 1 1 6 VAL HG21 H 1.137 2.687 1.012 1.00 . A A . 6 VAL HG21 1 1 2 1060 1 1 6 VAL HG22 H 1.826 1.623 -0.205 1.00 . A A . 6 VAL HG22 1 1 2 1061 1 1 6 VAL HG23 H 0.951 0.945 1.164 1.00 . A A . 6 VAL HG23 1 1 2 1062 1 1 6 VAL N N 1.951 3.716 2.597 1.00 . A A . 6 VAL N 1 1 2 1063 1 1 6 VAL O O 4.573 4.378 2.936 1.00 . A A . 6 VAL O 1 1 2 1064 1 1 7 ASP C C 7.472 1.673 2.128 1.00 . A A . 7 ASP C 1 1 2 1065 1 1 7 ASP CA C 6.688 2.686 2.919 1.00 . A A . 7 ASP CA 1 1 2 1066 1 1 7 ASP CB C 7.189 2.737 4.355 1.00 . A A . 7 ASP CB 1 1 2 1067 1 1 7 ASP CG C 7.974 4.029 4.580 1.00 . A A . 7 ASP CG 1 1 2 1068 1 1 7 ASP H H 5.042 1.346 2.817 1.00 . A A . 7 ASP H 1 1 2 1069 1 1 7 ASP HA H 6.797 3.641 2.455 1.00 . A A . 7 ASP HA 1 1 2 1070 1 1 7 ASP HB2 H 6.346 2.706 5.018 1.00 . A A . 7 ASP HB2 1 1 2 1071 1 1 7 ASP HB3 H 7.830 1.888 4.544 1.00 . A A . 7 ASP HB3 1 1 2 1072 1 1 7 ASP N N 5.277 2.294 2.880 1.00 . A A . 7 ASP N 1 1 2 1073 1 1 7 ASP O O 7.837 0.621 2.615 1.00 . A A . 7 ASP O 1 1 2 1074 1 1 7 ASP OD1 O 9.068 4.136 4.049 1.00 . A A . 7 ASP OD1 1 1 2 1075 1 1 7 ASP OD2 O 7.469 4.892 5.279 1.00 . A A . 7 ASP OD2 1 1 2 1076 1 1 8 GLN C C 9.922 0.874 0.528 1.00 . A A . 8 GLN C 1 1 2 1077 1 1 8 GLN CA C 8.492 1.057 0.022 1.00 . A A . 8 GLN CA 1 1 2 1078 1 1 8 GLN CB C 8.566 1.628 -1.377 1.00 . A A . 8 GLN CB 1 1 2 1079 1 1 8 GLN CD C 6.183 2.354 -1.362 1.00 . A A . 8 GLN CD 1 1 2 1080 1 1 8 GLN CG C 7.216 1.473 -2.067 1.00 . A A . 8 GLN CG 1 1 2 1081 1 1 8 GLN H H 7.398 2.839 0.556 1.00 . A A . 8 GLN H 1 1 2 1082 1 1 8 GLN HA H 7.995 0.099 -0.010 1.00 . A A . 8 GLN HA 1 1 2 1083 1 1 8 GLN HB2 H 8.833 2.674 -1.328 1.00 . A A . 8 GLN HB2 1 1 2 1084 1 1 8 GLN HB3 H 9.316 1.088 -1.921 1.00 . A A . 8 GLN HB3 1 1 2 1085 1 1 8 GLN HE21 H 7.135 4.046 -1.780 1.00 . A A . 8 GLN HE21 1 1 2 1086 1 1 8 GLN HE22 H 5.696 4.222 -0.898 1.00 . A A . 8 GLN HE22 1 1 2 1087 1 1 8 GLN HG2 H 7.304 1.774 -3.101 1.00 . A A . 8 GLN HG2 1 1 2 1088 1 1 8 GLN HG3 H 6.905 0.443 -2.015 1.00 . A A . 8 GLN HG3 1 1 2 1089 1 1 8 GLN N N 7.726 1.986 0.902 1.00 . A A . 8 GLN N 1 1 2 1090 1 1 8 GLN NE2 N 6.352 3.648 -1.345 1.00 . A A . 8 GLN NE2 1 1 2 1091 1 1 8 GLN O O 10.858 0.805 -0.243 1.00 . A A . 8 GLN O 1 1 2 1092 1 1 8 GLN OE1 O 5.215 1.862 -0.818 1.00 . A A . 8 GLN OE1 1 1 2 1093 1 1 9 ASP C C 11.643 -0.908 2.661 1.00 . A A . 9 ASP C 1 1 2 1094 1 1 9 ASP CA C 11.463 0.575 2.357 1.00 . A A . 9 ASP CA 1 1 2 1095 1 1 9 ASP CB C 11.620 1.376 3.650 1.00 . A A . 9 ASP CB 1 1 2 1096 1 1 9 ASP CG C 12.928 2.169 3.607 1.00 . A A . 9 ASP CG 1 1 2 1097 1 1 9 ASP H H 9.332 0.817 2.397 1.00 . A A . 9 ASP H 1 1 2 1098 1 1 9 ASP HA H 12.202 0.893 1.636 1.00 . A A . 9 ASP HA 1 1 2 1099 1 1 9 ASP HB2 H 10.787 2.056 3.757 1.00 . A A . 9 ASP HB2 1 1 2 1100 1 1 9 ASP HB3 H 11.641 0.696 4.489 1.00 . A A . 9 ASP HB3 1 1 2 1101 1 1 9 ASP N N 10.098 0.776 1.803 1.00 . A A . 9 ASP N 1 1 2 1102 1 1 9 ASP O O 12.745 -1.396 2.817 1.00 . A A . 9 ASP O 1 1 2 1103 1 1 9 ASP OD1 O 12.993 3.125 2.853 1.00 . A A . 9 ASP OD1 1 1 2 1104 1 1 9 ASP OD2 O 13.842 1.808 4.331 1.00 . A A . 9 ASP OD2 1 1 2 1105 1 1 10 GLU C C 10.103 -3.878 1.864 1.00 . A A . 10 GLU C 1 1 2 1106 1 1 10 GLU CA C 10.644 -3.076 3.049 1.00 . A A . 10 GLU CA 1 1 2 1107 1 1 10 GLU CB C 9.807 -3.382 4.293 1.00 . A A . 10 GLU CB 1 1 2 1108 1 1 10 GLU CD C 9.908 -4.835 6.323 1.00 . A A . 10 GLU CD 1 1 2 1109 1 1 10 GLU CG C 10.715 -3.924 5.397 1.00 . A A . 10 GLU CG 1 1 2 1110 1 1 10 GLU H H 9.682 -1.206 2.624 1.00 . A A . 10 GLU H 1 1 2 1111 1 1 10 GLU HA H 11.673 -3.343 3.233 1.00 . A A . 10 GLU HA 1 1 2 1112 1 1 10 GLU HB2 H 9.323 -2.477 4.635 1.00 . A A . 10 GLU HB2 1 1 2 1113 1 1 10 GLU HB3 H 9.059 -4.120 4.050 1.00 . A A . 10 GLU HB3 1 1 2 1114 1 1 10 GLU HG2 H 11.525 -4.487 4.953 1.00 . A A . 10 GLU HG2 1 1 2 1115 1 1 10 GLU HG3 H 11.119 -3.101 5.968 1.00 . A A . 10 GLU HG3 1 1 2 1116 1 1 10 GLU N N 10.557 -1.625 2.750 1.00 . A A . 10 GLU N 1 1 2 1117 1 1 10 GLU O O 10.222 -5.087 1.816 1.00 . A A . 10 GLU O 1 1 2 1118 1 1 10 GLU OE1 O 8.769 -4.501 6.604 1.00 . A A . 10 GLU OE1 1 1 2 1119 1 1 10 GLU OE2 O 10.443 -5.852 6.735 1.00 . A A . 10 GLU OE2 1 1 2 1120 1 1 11 CYS C C 10.077 -4.688 -0.990 1.00 . A A . 11 CYS C 1 1 2 1121 1 1 11 CYS CA C 8.950 -3.955 -0.262 1.00 . A A . 11 CYS CA 1 1 2 1122 1 1 11 CYS CB C 8.269 -2.979 -1.229 1.00 . A A . 11 CYS CB 1 1 2 1123 1 1 11 CYS H H 9.409 -2.244 0.966 1.00 . A A . 11 CYS H 1 1 2 1124 1 1 11 CYS HA H 8.224 -4.677 0.084 1.00 . A A . 11 CYS HA 1 1 2 1125 1 1 11 CYS HB2 H 7.438 -2.499 -0.735 1.00 . A A . 11 CYS HB2 1 1 2 1126 1 1 11 CYS HB3 H 8.977 -2.231 -1.553 1.00 . A A . 11 CYS HB3 1 1 2 1127 1 1 11 CYS N N 9.502 -3.218 0.909 1.00 . A A . 11 CYS N 1 1 2 1128 1 1 11 CYS O O 11.096 -4.115 -1.316 1.00 . A A . 11 CYS O 1 1 2 1129 1 1 11 CYS SG S 7.644 -3.817 -2.730 1.00 . A A . 11 CYS SG 1 1 2 1130 1 1 12 ILE C C 10.688 -6.674 -3.466 1.00 . A A . 12 ILE C 1 1 2 1131 1 1 12 ILE CA C 10.951 -6.728 -1.960 1.00 . A A . 12 ILE CA 1 1 2 1132 1 1 12 ILE CB C 10.927 -8.182 -1.486 1.00 . A A . 12 ILE CB 1 1 2 1133 1 1 12 ILE CD1 C 9.562 -10.274 -1.403 1.00 . A A . 12 ILE CD1 1 1 2 1134 1 1 12 ILE CG1 C 9.643 -8.858 -1.975 1.00 . A A . 12 ILE CG1 1 1 2 1135 1 1 12 ILE CG2 C 10.975 -8.218 0.042 1.00 . A A . 12 ILE CG2 1 1 2 1136 1 1 12 ILE H H 9.064 -6.396 -0.979 1.00 . A A . 12 ILE H 1 1 2 1137 1 1 12 ILE HA H 11.918 -6.296 -1.748 1.00 . A A . 12 ILE HA 1 1 2 1138 1 1 12 ILE HB H 11.785 -8.704 -1.885 1.00 . A A . 12 ILE HB 1 1 2 1139 1 1 12 ILE HD11 H 10.502 -10.782 -1.566 1.00 . A A . 12 ILE HD11 1 1 2 1140 1 1 12 ILE HD12 H 9.360 -10.225 -0.345 1.00 . A A . 12 ILE HD12 1 1 2 1141 1 1 12 ILE HD13 H 8.770 -10.816 -1.897 1.00 . A A . 12 ILE HD13 1 1 2 1142 1 1 12 ILE HG12 H 8.787 -8.286 -1.645 1.00 . A A . 12 ILE HG12 1 1 2 1143 1 1 12 ILE HG13 H 9.650 -8.906 -3.053 1.00 . A A . 12 ILE HG13 1 1 2 1144 1 1 12 ILE HG21 H 11.757 -7.562 0.393 1.00 . A A . 12 ILE HG21 1 1 2 1145 1 1 12 ILE HG22 H 10.026 -7.892 0.439 1.00 . A A . 12 ILE HG22 1 1 2 1146 1 1 12 ILE HG23 H 11.175 -9.226 0.373 1.00 . A A . 12 ILE HG23 1 1 2 1147 1 1 12 ILE N N 9.896 -5.955 -1.249 1.00 . A A . 12 ILE N 1 1 2 1148 1 1 12 ILE O O 11.585 -6.448 -4.252 1.00 . A A . 12 ILE O 1 1 2 1149 1 1 13 ALA C C 7.784 -7.460 -5.596 1.00 . A A . 13 ALA C 1 1 2 1150 1 1 13 ALA CA C 9.152 -6.827 -5.331 1.00 . A A . 13 ALA CA 1 1 2 1151 1 1 13 ALA CB C 10.224 -7.599 -6.104 1.00 . A A . 13 ALA CB 1 1 2 1152 1 1 13 ALA H H 8.751 -7.051 -3.225 1.00 . A A . 13 ALA H 1 1 2 1153 1 1 13 ALA HA H 9.143 -5.800 -5.662 1.00 . A A . 13 ALA HA 1 1 2 1154 1 1 13 ALA HB1 H 10.887 -8.089 -5.408 1.00 . A A . 13 ALA HB1 1 1 2 1155 1 1 13 ALA HB2 H 9.751 -8.338 -6.733 1.00 . A A . 13 ALA HB2 1 1 2 1156 1 1 13 ALA HB3 H 10.789 -6.912 -6.717 1.00 . A A . 13 ALA HB3 1 1 2 1157 1 1 13 ALA N N 9.463 -6.875 -3.874 1.00 . A A . 13 ALA N 1 1 2 1158 1 1 13 ALA O O 7.095 -7.093 -6.527 1.00 . A A . 13 ALA O 1 1 2 1159 1 1 14 CYS C C 4.991 -7.976 -5.210 1.00 . A A . 14 CYS C 1 1 2 1160 1 1 14 CYS CA C 6.057 -9.057 -5.028 1.00 . A A . 14 CYS CA 1 1 2 1161 1 1 14 CYS CB C 5.691 -9.959 -3.842 1.00 . A A . 14 CYS CB 1 1 2 1162 1 1 14 CYS H H 7.948 -8.703 -4.051 1.00 . A A . 14 CYS H 1 1 2 1163 1 1 14 CYS HA H 6.110 -9.655 -5.927 1.00 . A A . 14 CYS HA 1 1 2 1164 1 1 14 CYS HB2 H 5.413 -10.935 -4.210 1.00 . A A . 14 CYS HB2 1 1 2 1165 1 1 14 CYS HB3 H 6.548 -10.054 -3.191 1.00 . A A . 14 CYS HB3 1 1 2 1166 1 1 14 CYS N N 7.381 -8.412 -4.796 1.00 . A A . 14 CYS N 1 1 2 1167 1 1 14 CYS O O 5.132 -6.864 -4.740 1.00 . A A . 14 CYS O 1 1 2 1168 1 1 14 CYS SG S 4.308 -9.414 -2.774 1.00 . A A . 14 CYS SG 1 1 2 1169 1 1 15 GLU C C 1.568 -7.754 -5.443 1.00 . A A . 15 GLU C 1 1 2 1170 1 1 15 GLU CA C 2.857 -7.277 -6.112 1.00 . A A . 15 GLU CA 1 1 2 1171 1 1 15 GLU CB C 2.611 -7.095 -7.614 1.00 . A A . 15 GLU CB 1 1 2 1172 1 1 15 GLU CD C 4.364 -5.585 -8.562 1.00 . A A . 15 GLU CD 1 1 2 1173 1 1 15 GLU CG C 3.946 -7.043 -8.364 1.00 . A A . 15 GLU CG 1 1 2 1174 1 1 15 GLU H H 3.833 -9.190 -6.274 1.00 . A A . 15 GLU H 1 1 2 1175 1 1 15 GLU HA H 3.161 -6.336 -5.680 1.00 . A A . 15 GLU HA 1 1 2 1176 1 1 15 GLU HB2 H 2.024 -7.924 -7.984 1.00 . A A . 15 GLU HB2 1 1 2 1177 1 1 15 GLU HB3 H 2.073 -6.173 -7.780 1.00 . A A . 15 GLU HB3 1 1 2 1178 1 1 15 GLU HG2 H 4.704 -7.561 -7.794 1.00 . A A . 15 GLU HG2 1 1 2 1179 1 1 15 GLU HG3 H 3.835 -7.517 -9.328 1.00 . A A . 15 GLU HG3 1 1 2 1180 1 1 15 GLU N N 3.927 -8.290 -5.896 1.00 . A A . 15 GLU N 1 1 2 1181 1 1 15 GLU O O 0.488 -7.293 -5.756 1.00 . A A . 15 GLU O 1 1 2 1182 1 1 15 GLU OE1 O 3.490 -4.734 -8.560 1.00 . A A . 15 GLU OE1 1 1 2 1183 1 1 15 GLU OE2 O 5.550 -5.344 -8.716 1.00 . A A . 15 GLU OE2 1 1 2 1184 1 1 16 SER C C -0.452 -7.995 -3.471 1.00 . A A . 16 SER C 1 1 2 1185 1 1 16 SER CA C 0.449 -9.178 -3.833 1.00 . A A . 16 SER CA 1 1 2 1186 1 1 16 SER CB C 0.852 -9.921 -2.559 1.00 . A A . 16 SER CB 1 1 2 1187 1 1 16 SER H H 2.551 -9.032 -4.284 1.00 . A A . 16 SER H 1 1 2 1188 1 1 16 SER HA H -0.083 -9.849 -4.490 1.00 . A A . 16 SER HA 1 1 2 1189 1 1 16 SER HB2 H 1.894 -9.745 -2.351 1.00 . A A . 16 SER HB2 1 1 2 1190 1 1 16 SER HB3 H 0.257 -9.562 -1.730 1.00 . A A . 16 SER HB3 1 1 2 1191 1 1 16 SER HG H 0.158 -11.645 -1.982 1.00 . A A . 16 SER HG 1 1 2 1192 1 1 16 SER N N 1.671 -8.673 -4.522 1.00 . A A . 16 SER N 1 1 2 1193 1 1 16 SER O O -1.645 -8.020 -3.695 1.00 . A A . 16 SER O 1 1 2 1194 1 1 16 SER OG O 0.642 -11.315 -2.743 1.00 . A A . 16 SER OG 1 1 2 1195 1 1 17 CYS C C -1.247 -5.115 -3.815 1.00 . A A . 17 CYS C 1 1 2 1196 1 1 17 CYS CA C -0.707 -5.771 -2.546 1.00 . A A . 17 CYS CA 1 1 2 1197 1 1 17 CYS CB C 0.162 -4.766 -1.789 1.00 . A A . 17 CYS CB 1 1 2 1198 1 1 17 CYS H H 1.079 -6.956 -2.749 1.00 . A A . 17 CYS H 1 1 2 1199 1 1 17 CYS HA H -1.530 -6.081 -1.919 1.00 . A A . 17 CYS HA 1 1 2 1200 1 1 17 CYS HB2 H -0.464 -3.999 -1.359 1.00 . A A . 17 CYS HB2 1 1 2 1201 1 1 17 CYS HB3 H 0.699 -5.275 -1.001 1.00 . A A . 17 CYS HB3 1 1 2 1202 1 1 17 CYS N N 0.114 -6.958 -2.917 1.00 . A A . 17 CYS N 1 1 2 1203 1 1 17 CYS O O -2.417 -4.801 -3.916 1.00 . A A . 17 CYS O 1 1 2 1204 1 1 17 CYS SG S 1.401 -3.926 -2.843 1.00 . A A . 17 CYS SG 1 1 2 1205 1 1 18 VAL C C -2.109 -5.005 -6.561 1.00 . A A . 18 VAL C 1 1 2 1206 1 1 18 VAL CA C -0.868 -4.269 -6.051 1.00 . A A . 18 VAL CA 1 1 2 1207 1 1 18 VAL CB C 0.239 -4.347 -7.103 1.00 . A A . 18 VAL CB 1 1 2 1208 1 1 18 VAL CG1 C -0.171 -3.541 -8.336 1.00 . A A . 18 VAL CG1 1 1 2 1209 1 1 18 VAL CG2 C 1.532 -3.768 -6.524 1.00 . A A . 18 VAL CG2 1 1 2 1210 1 1 18 VAL H H 0.535 -5.167 -4.688 1.00 . A A . 18 VAL H 1 1 2 1211 1 1 18 VAL HA H -1.116 -3.234 -5.863 1.00 . A A . 18 VAL HA 1 1 2 1212 1 1 18 VAL HB H 0.398 -5.379 -7.384 1.00 . A A . 18 VAL HB 1 1 2 1213 1 1 18 VAL HG11 H -0.768 -2.694 -8.031 1.00 . A A . 18 VAL HG11 1 1 2 1214 1 1 18 VAL HG12 H 0.714 -3.192 -8.848 1.00 . A A . 18 VAL HG12 1 1 2 1215 1 1 18 VAL HG13 H -0.748 -4.168 -9.001 1.00 . A A . 18 VAL HG13 1 1 2 1216 1 1 18 VAL HG21 H 1.319 -3.280 -5.584 1.00 . A A . 18 VAL HG21 1 1 2 1217 1 1 18 VAL HG22 H 2.243 -4.565 -6.362 1.00 . A A . 18 VAL HG22 1 1 2 1218 1 1 18 VAL HG23 H 1.946 -3.050 -7.217 1.00 . A A . 18 VAL HG23 1 1 2 1219 1 1 18 VAL N N -0.403 -4.905 -4.788 1.00 . A A . 18 VAL N 1 1 2 1220 1 1 18 VAL O O -3.037 -4.399 -7.059 1.00 . A A . 18 VAL O 1 1 2 1221 1 1 19 GLU C C -4.502 -6.775 -6.001 1.00 . A A . 19 GLU C 1 1 2 1222 1 1 19 GLU CA C -3.325 -7.063 -6.920 1.00 . A A . 19 GLU CA 1 1 2 1223 1 1 19 GLU CB C -3.019 -8.564 -6.925 1.00 . A A . 19 GLU CB 1 1 2 1224 1 1 19 GLU CD C -3.835 -8.762 -9.279 1.00 . A A . 19 GLU CD 1 1 2 1225 1 1 19 GLU CG C -2.650 -9.005 -8.343 1.00 . A A . 19 GLU CG 1 1 2 1226 1 1 19 GLU H H -1.380 -6.778 -6.036 1.00 . A A . 19 GLU H 1 1 2 1227 1 1 19 GLU HA H -3.575 -6.736 -7.914 1.00 . A A . 19 GLU HA 1 1 2 1228 1 1 19 GLU HB2 H -2.193 -8.765 -6.258 1.00 . A A . 19 GLU HB2 1 1 2 1229 1 1 19 GLU HB3 H -3.890 -9.111 -6.595 1.00 . A A . 19 GLU HB3 1 1 2 1230 1 1 19 GLU HG2 H -1.796 -8.437 -8.686 1.00 . A A . 19 GLU HG2 1 1 2 1231 1 1 19 GLU HG3 H -2.405 -10.057 -8.341 1.00 . A A . 19 GLU HG3 1 1 2 1232 1 1 19 GLU N N -2.136 -6.305 -6.441 1.00 . A A . 19 GLU N 1 1 2 1233 1 1 19 GLU O O -5.627 -6.640 -6.439 1.00 . A A . 19 GLU O 1 1 2 1234 1 1 19 GLU OE1 O -4.862 -9.388 -9.076 1.00 . A A . 19 GLU OE1 1 1 2 1235 1 1 19 GLU OE2 O -3.695 -7.953 -10.182 1.00 . A A . 19 GLU OE2 1 1 2 1236 1 1 20 ILE C C -5.676 -4.840 -3.897 1.00 . A A . 20 ILE C 1 1 2 1237 1 1 20 ILE CA C -5.355 -6.334 -3.794 1.00 . A A . 20 ILE CA 1 1 2 1238 1 1 20 ILE CB C -4.919 -6.692 -2.381 1.00 . A A . 20 ILE CB 1 1 2 1239 1 1 20 ILE CD1 C -5.918 -8.656 -1.119 1.00 . A A . 20 ILE CD1 1 1 2 1240 1 1 20 ILE CG1 C -4.989 -8.208 -2.257 1.00 . A A . 20 ILE CG1 1 1 2 1241 1 1 20 ILE CG2 C -5.811 -5.992 -1.346 1.00 . A A . 20 ILE CG2 1 1 2 1242 1 1 20 ILE H H -3.335 -6.742 -4.396 1.00 . A A . 20 ILE H 1 1 2 1243 1 1 20 ILE HA H -6.221 -6.918 -4.054 1.00 . A A . 20 ILE HA 1 1 2 1244 1 1 20 ILE HB H -3.906 -6.391 -2.247 1.00 . A A . 20 ILE HB 1 1 2 1245 1 1 20 ILE HD11 H -6.858 -8.131 -1.193 1.00 . A A . 20 ILE HD11 1 1 2 1246 1 1 20 ILE HD12 H -6.092 -9.719 -1.195 1.00 . A A . 20 ILE HD12 1 1 2 1247 1 1 20 ILE HD13 H -5.454 -8.434 -0.168 1.00 . A A . 20 ILE HD13 1 1 2 1248 1 1 20 ILE HG12 H -5.345 -8.594 -3.183 1.00 . A A . 20 ILE HG12 1 1 2 1249 1 1 20 ILE HG13 H -4.002 -8.584 -2.085 1.00 . A A . 20 ILE HG13 1 1 2 1250 1 1 20 ILE HG21 H -6.848 -6.113 -1.623 1.00 . A A . 20 ILE HG21 1 1 2 1251 1 1 20 ILE HG22 H -5.645 -6.431 -0.374 1.00 . A A . 20 ILE HG22 1 1 2 1252 1 1 20 ILE HG23 H -5.568 -4.941 -1.313 1.00 . A A . 20 ILE HG23 1 1 2 1253 1 1 20 ILE N N -4.251 -6.648 -4.730 1.00 . A A . 20 ILE N 1 1 2 1254 1 1 20 ILE O O -6.479 -4.311 -3.154 1.00 . A A . 20 ILE O 1 1 2 1255 1 1 21 ALA C C -4.481 -2.142 -6.126 1.00 . A A . 21 ALA C 1 1 2 1256 1 1 21 ALA CA C -5.321 -2.695 -4.973 1.00 . A A . 21 ALA CA 1 1 2 1257 1 1 21 ALA CB C -4.951 -1.969 -3.678 1.00 . A A . 21 ALA CB 1 1 2 1258 1 1 21 ALA H H -4.406 -4.592 -5.420 1.00 . A A . 21 ALA H 1 1 2 1259 1 1 21 ALA HA H -6.369 -2.541 -5.186 1.00 . A A . 21 ALA HA 1 1 2 1260 1 1 21 ALA HB1 H -4.203 -2.540 -3.147 1.00 . A A . 21 ALA HB1 1 1 2 1261 1 1 21 ALA HB2 H -4.557 -0.991 -3.913 1.00 . A A . 21 ALA HB2 1 1 2 1262 1 1 21 ALA HB3 H -5.830 -1.865 -3.060 1.00 . A A . 21 ALA HB3 1 1 2 1263 1 1 21 ALA N N -5.051 -4.150 -4.822 1.00 . A A . 21 ALA N 1 1 2 1264 1 1 21 ALA O O -3.578 -1.357 -5.919 1.00 . A A . 21 ALA O 1 1 2 1265 1 1 22 PRO C C -4.412 -0.655 -8.826 1.00 . A A . 22 PRO C 1 1 2 1266 1 1 22 PRO CA C -4.086 -2.119 -8.525 1.00 . A A . 22 PRO CA 1 1 2 1267 1 1 22 PRO CB C -4.615 -3.038 -9.628 1.00 . A A . 22 PRO CB 1 1 2 1268 1 1 22 PRO CD C -5.890 -3.521 -7.631 1.00 . A A . 22 PRO CD 1 1 2 1269 1 1 22 PRO CG C -5.958 -3.485 -9.141 1.00 . A A . 22 PRO CG 1 1 2 1270 1 1 22 PRO HA H -3.023 -2.259 -8.406 1.00 . A A . 22 PRO HA 1 1 2 1271 1 1 22 PRO HB2 H -4.678 -2.481 -10.554 1.00 . A A . 22 PRO HB2 1 1 2 1272 1 1 22 PRO HB3 H -3.943 -3.871 -9.755 1.00 . A A . 22 PRO HB3 1 1 2 1273 1 1 22 PRO HD2 H -6.831 -3.201 -7.202 1.00 . A A . 22 PRO HD2 1 1 2 1274 1 1 22 PRO HD3 H -5.634 -4.510 -7.288 1.00 . A A . 22 PRO HD3 1 1 2 1275 1 1 22 PRO HG2 H -6.715 -2.785 -9.464 1.00 . A A . 22 PRO HG2 1 1 2 1276 1 1 22 PRO HG3 H -6.176 -4.472 -9.519 1.00 . A A . 22 PRO HG3 1 1 2 1277 1 1 22 PRO N N -4.815 -2.576 -7.311 1.00 . A A . 22 PRO N 1 1 2 1278 1 1 22 PRO O O -3.879 -0.066 -9.745 1.00 . A A . 22 PRO O 1 1 2 1279 1 1 23 GLY C C -4.938 2.245 -7.261 1.00 . A A . 23 GLY C 1 1 2 1280 1 1 23 GLY CA C -5.637 1.365 -8.299 1.00 . A A . 23 GLY CA 1 1 2 1281 1 1 23 GLY H H -5.701 -0.551 -7.319 1.00 . A A . 23 GLY H 1 1 2 1282 1 1 23 GLY HA2 H -5.319 1.652 -9.292 1.00 . A A . 23 GLY HA2 1 1 2 1283 1 1 23 GLY HA3 H -6.705 1.491 -8.213 1.00 . A A . 23 GLY HA3 1 1 2 1284 1 1 23 GLY N N -5.283 -0.061 -8.057 1.00 . A A . 23 GLY N 1 1 2 1285 1 1 23 GLY O O -4.550 3.362 -7.539 1.00 . A A . 23 GLY O 1 1 2 1286 1 1 24 ALA C C -2.623 2.163 -4.925 1.00 . A A . 24 ALA C 1 1 2 1287 1 1 24 ALA CA C -4.102 2.552 -5.007 1.00 . A A . 24 ALA CA 1 1 2 1288 1 1 24 ALA CB C -4.774 2.280 -3.659 1.00 . A A . 24 ALA CB 1 1 2 1289 1 1 24 ALA H H -5.096 0.845 -5.863 1.00 . A A . 24 ALA H 1 1 2 1290 1 1 24 ALA HA H -4.186 3.602 -5.244 1.00 . A A . 24 ALA HA 1 1 2 1291 1 1 24 ALA HB1 H -5.089 1.247 -3.616 1.00 . A A . 24 ALA HB1 1 1 2 1292 1 1 24 ALA HB2 H -4.074 2.476 -2.859 1.00 . A A . 24 ALA HB2 1 1 2 1293 1 1 24 ALA HB3 H -5.636 2.923 -3.549 1.00 . A A . 24 ALA HB3 1 1 2 1294 1 1 24 ALA N N -4.774 1.747 -6.065 1.00 . A A . 24 ALA N 1 1 2 1295 1 1 24 ALA O O -1.748 3.004 -4.956 1.00 . A A . 24 ALA O 1 1 2 1296 1 1 25 PHE C C -0.344 0.293 -6.146 1.00 . A A . 25 PHE C 1 1 2 1297 1 1 25 PHE CA C -0.922 0.447 -4.733 1.00 . A A . 25 PHE CA 1 1 2 1298 1 1 25 PHE CB C -0.872 -0.903 -4.015 1.00 . A A . 25 PHE CB 1 1 2 1299 1 1 25 PHE CD1 C 1.401 -0.719 -2.960 1.00 . A A . 25 PHE CD1 1 1 2 1300 1 1 25 PHE CD2 C -0.536 -0.830 -1.512 1.00 . A A . 25 PHE CD2 1 1 2 1301 1 1 25 PHE CE1 C 2.236 -0.650 -1.839 1.00 . A A . 25 PHE CE1 1 1 2 1302 1 1 25 PHE CE2 C 0.301 -0.757 -0.389 1.00 . A A . 25 PHE CE2 1 1 2 1303 1 1 25 PHE CG C 0.018 -0.809 -2.798 1.00 . A A . 25 PHE CG 1 1 2 1304 1 1 25 PHE CZ C 1.689 -0.667 -0.556 1.00 . A A . 25 PHE CZ 1 1 2 1305 1 1 25 PHE H H -3.063 0.232 -4.797 1.00 . A A . 25 PHE H 1 1 2 1306 1 1 25 PHE HA H -0.344 1.174 -4.180 1.00 . A A . 25 PHE HA 1 1 2 1307 1 1 25 PHE HB2 H -1.869 -1.184 -3.710 1.00 . A A . 25 PHE HB2 1 1 2 1308 1 1 25 PHE HB3 H -0.478 -1.649 -4.688 1.00 . A A . 25 PHE HB3 1 1 2 1309 1 1 25 PHE HD1 H 1.823 -0.699 -3.951 1.00 . A A . 25 PHE HD1 1 1 2 1310 1 1 25 PHE HD2 H -1.607 -0.899 -1.384 1.00 . A A . 25 PHE HD2 1 1 2 1311 1 1 25 PHE HE1 H 3.303 -0.585 -1.964 1.00 . A A . 25 PHE HE1 1 1 2 1312 1 1 25 PHE HE2 H -0.124 -0.770 0.604 1.00 . A A . 25 PHE HE2 1 1 2 1313 1 1 25 PHE HZ H 2.332 -0.620 0.301 1.00 . A A . 25 PHE HZ 1 1 2 1314 1 1 25 PHE N N -2.340 0.894 -4.820 1.00 . A A . 25 PHE N 1 1 2 1315 1 1 25 PHE O O -0.980 -0.246 -7.030 1.00 . A A . 25 PHE O 1 1 2 1316 1 1 26 ALA C C 2.981 0.879 -7.639 1.00 . A A . 26 ALA C 1 1 2 1317 1 1 26 ALA CA C 1.469 0.640 -7.726 1.00 . A A . 26 ALA CA 1 1 2 1318 1 1 26 ALA CB C 0.848 1.678 -8.661 1.00 . A A . 26 ALA CB 1 1 2 1319 1 1 26 ALA H H 1.354 1.194 -5.641 1.00 . A A . 26 ALA H 1 1 2 1320 1 1 26 ALA HA H 1.284 -0.350 -8.116 1.00 . A A . 26 ALA HA 1 1 2 1321 1 1 26 ALA HB1 H -0.086 2.025 -8.244 1.00 . A A . 26 ALA HB1 1 1 2 1322 1 1 26 ALA HB2 H 1.525 2.513 -8.772 1.00 . A A . 26 ALA HB2 1 1 2 1323 1 1 26 ALA HB3 H 0.666 1.230 -9.628 1.00 . A A . 26 ALA HB3 1 1 2 1324 1 1 26 ALA N N 0.857 0.762 -6.367 1.00 . A A . 26 ALA N 1 1 2 1325 1 1 26 ALA O O 3.430 1.858 -7.093 1.00 . A A . 26 ALA O 1 1 2 1326 1 1 27 MET C C 5.658 1.429 -8.880 1.00 . A A . 27 MET C 1 1 2 1327 1 1 27 MET CA C 5.252 0.154 -8.138 1.00 . A A . 27 MET CA 1 1 2 1328 1 1 27 MET CB C 5.903 -1.049 -8.826 1.00 . A A . 27 MET CB 1 1 2 1329 1 1 27 MET CE C 8.983 -3.366 -7.424 1.00 . A A . 27 MET CE 1 1 2 1330 1 1 27 MET CG C 6.812 -1.781 -7.841 1.00 . A A . 27 MET CG 1 1 2 1331 1 1 27 MET H H 3.376 -0.791 -8.622 1.00 . A A . 27 MET H 1 1 2 1332 1 1 27 MET HA H 5.579 0.206 -7.118 1.00 . A A . 27 MET HA 1 1 2 1333 1 1 27 MET HB2 H 5.133 -1.722 -9.175 1.00 . A A . 27 MET HB2 1 1 2 1334 1 1 27 MET HB3 H 6.488 -0.706 -9.667 1.00 . A A . 27 MET HB3 1 1 2 1335 1 1 27 MET HE1 H 8.498 -3.316 -6.459 1.00 . A A . 27 MET HE1 1 1 2 1336 1 1 27 MET HE2 H 9.402 -4.350 -7.560 1.00 . A A . 27 MET HE2 1 1 2 1337 1 1 27 MET HE3 H 9.772 -2.630 -7.476 1.00 . A A . 27 MET HE3 1 1 2 1338 1 1 27 MET HG2 H 7.486 -1.074 -7.383 1.00 . A A . 27 MET HG2 1 1 2 1339 1 1 27 MET HG3 H 6.212 -2.253 -7.079 1.00 . A A . 27 MET HG3 1 1 2 1340 1 1 27 MET N N 3.765 -0.011 -8.182 1.00 . A A . 27 MET N 1 1 2 1341 1 1 27 MET O O 5.023 1.810 -9.843 1.00 . A A . 27 MET O 1 1 2 1342 1 1 27 MET SD S 7.768 -3.040 -8.725 1.00 . A A . 27 MET SD 1 1 2 1343 1 1 28 ASP C C 8.588 3.144 -9.572 1.00 . A A . 28 ASP C 1 1 2 1344 1 1 28 ASP CA C 7.121 3.309 -9.214 1.00 . A A . 28 ASP CA 1 1 2 1345 1 1 28 ASP CB C 6.914 4.536 -8.328 1.00 . A A . 28 ASP CB 1 1 2 1346 1 1 28 ASP CG C 6.405 5.700 -9.176 1.00 . A A . 28 ASP CG 1 1 2 1347 1 1 28 ASP H H 7.271 1.790 -7.698 1.00 . A A . 28 ASP H 1 1 2 1348 1 1 28 ASP HA H 6.531 3.399 -10.115 1.00 . A A . 28 ASP HA 1 1 2 1349 1 1 28 ASP HB2 H 6.189 4.304 -7.562 1.00 . A A . 28 ASP HB2 1 1 2 1350 1 1 28 ASP HB3 H 7.848 4.809 -7.866 1.00 . A A . 28 ASP HB3 1 1 2 1351 1 1 28 ASP N N 6.719 2.094 -8.474 1.00 . A A . 28 ASP N 1 1 2 1352 1 1 28 ASP O O 9.255 2.335 -8.964 1.00 . A A . 28 ASP O 1 1 2 1353 1 1 28 ASP OD1 O 5.460 5.495 -9.920 1.00 . A A . 28 ASP OD1 1 1 2 1354 1 1 28 ASP OD2 O 6.967 6.777 -9.069 1.00 . A A . 28 ASP OD2 1 1 2 1355 1 1 29 PRO C C 11.294 4.695 -10.085 1.00 . A A . 29 PRO C 1 1 2 1356 1 1 29 PRO CA C 10.447 3.807 -10.984 1.00 . A A . 29 PRO CA 1 1 2 1357 1 1 29 PRO CB C 10.408 4.331 -12.418 1.00 . A A . 29 PRO CB 1 1 2 1358 1 1 29 PRO CD C 8.298 4.899 -11.307 1.00 . A A . 29 PRO CD 1 1 2 1359 1 1 29 PRO CG C 9.196 5.216 -12.491 1.00 . A A . 29 PRO CG 1 1 2 1360 1 1 29 PRO HA H 10.795 2.788 -10.963 1.00 . A A . 29 PRO HA 1 1 2 1361 1 1 29 PRO HB2 H 11.323 4.874 -12.621 1.00 . A A . 29 PRO HB2 1 1 2 1362 1 1 29 PRO HB3 H 10.329 3.499 -13.098 1.00 . A A . 29 PRO HB3 1 1 2 1363 1 1 29 PRO HD2 H 8.140 5.790 -10.715 1.00 . A A . 29 PRO HD2 1 1 2 1364 1 1 29 PRO HD3 H 7.360 4.499 -11.640 1.00 . A A . 29 PRO HD3 1 1 2 1365 1 1 29 PRO HG2 H 9.505 6.252 -12.452 1.00 . A A . 29 PRO HG2 1 1 2 1366 1 1 29 PRO HG3 H 8.664 5.026 -13.410 1.00 . A A . 29 PRO HG3 1 1 2 1367 1 1 29 PRO N N 9.039 3.896 -10.545 1.00 . A A . 29 PRO N 1 1 2 1368 1 1 29 PRO O O 12.492 4.530 -9.961 1.00 . A A . 29 PRO O 1 1 2 1369 1 1 30 GLU C C 11.381 5.796 -7.133 1.00 . A A . 30 GLU C 1 1 2 1370 1 1 30 GLU CA C 11.385 6.500 -8.480 1.00 . A A . 30 GLU CA 1 1 2 1371 1 1 30 GLU CB C 10.672 7.849 -8.366 1.00 . A A . 30 GLU CB 1 1 2 1372 1 1 30 GLU CD C 11.085 10.315 -8.453 1.00 . A A . 30 GLU CD 1 1 2 1373 1 1 30 GLU CG C 11.710 8.952 -8.149 1.00 . A A . 30 GLU CG 1 1 2 1374 1 1 30 GLU H H 9.681 5.689 -9.519 1.00 . A A . 30 GLU H 1 1 2 1375 1 1 30 GLU HA H 12.401 6.642 -8.819 1.00 . A A . 30 GLU HA 1 1 2 1376 1 1 30 GLU HB2 H 10.120 8.042 -9.273 1.00 . A A . 30 GLU HB2 1 1 2 1377 1 1 30 GLU HB3 H 9.991 7.827 -7.527 1.00 . A A . 30 GLU HB3 1 1 2 1378 1 1 30 GLU HG2 H 12.047 8.931 -7.121 1.00 . A A . 30 GLU HG2 1 1 2 1379 1 1 30 GLU HG3 H 12.551 8.789 -8.806 1.00 . A A . 30 GLU HG3 1 1 2 1380 1 1 30 GLU N N 10.655 5.612 -9.421 1.00 . A A . 30 GLU N 1 1 2 1381 1 1 30 GLU O O 12.326 5.852 -6.372 1.00 . A A . 30 GLU O 1 1 2 1382 1 1 30 GLU OE1 O 10.290 10.387 -9.373 1.00 . A A . 30 GLU OE1 1 1 2 1383 1 1 30 GLU OE2 O 11.415 11.263 -7.758 1.00 . A A . 30 GLU OE2 1 1 2 1384 1 1 31 ILE C C 10.501 2.858 -5.903 1.00 . A A . 31 ILE C 1 1 2 1385 1 1 31 ILE CA C 10.221 4.326 -5.601 1.00 . A A . 31 ILE CA 1 1 2 1386 1 1 31 ILE CB C 8.835 4.520 -4.966 1.00 . A A . 31 ILE CB 1 1 2 1387 1 1 31 ILE CD1 C 6.425 3.868 -5.080 1.00 . A A . 31 ILE CD1 1 1 2 1388 1 1 31 ILE CG1 C 7.848 3.467 -5.479 1.00 . A A . 31 ILE CG1 1 1 2 1389 1 1 31 ILE CG2 C 8.312 5.916 -5.311 1.00 . A A . 31 ILE CG2 1 1 2 1390 1 1 31 ILE H H 9.593 5.049 -7.517 1.00 . A A . 31 ILE H 1 1 2 1391 1 1 31 ILE HA H 10.960 4.671 -4.929 1.00 . A A . 31 ILE HA 1 1 2 1392 1 1 31 ILE HB H 8.924 4.433 -3.892 1.00 . A A . 31 ILE HB 1 1 2 1393 1 1 31 ILE HD11 H 6.428 4.236 -4.064 1.00 . A A . 31 ILE HD11 1 1 2 1394 1 1 31 ILE HD12 H 6.070 4.643 -5.741 1.00 . A A . 31 ILE HD12 1 1 2 1395 1 1 31 ILE HD13 H 5.775 3.011 -5.148 1.00 . A A . 31 ILE HD13 1 1 2 1396 1 1 31 ILE HG12 H 7.918 3.398 -6.555 1.00 . A A . 31 ILE HG12 1 1 2 1397 1 1 31 ILE HG13 H 8.088 2.512 -5.038 1.00 . A A . 31 ILE HG13 1 1 2 1398 1 1 31 ILE HG21 H 9.138 6.611 -5.344 1.00 . A A . 31 ILE HG21 1 1 2 1399 1 1 31 ILE HG22 H 7.824 5.890 -6.273 1.00 . A A . 31 ILE HG22 1 1 2 1400 1 1 31 ILE HG23 H 7.606 6.232 -4.557 1.00 . A A . 31 ILE HG23 1 1 2 1401 1 1 31 ILE N N 10.318 5.093 -6.863 1.00 . A A . 31 ILE N 1 1 2 1402 1 1 31 ILE O O 10.497 2.029 -5.019 1.00 . A A . 31 ILE O 1 1 2 1403 1 1 32 GLU C C 10.356 0.176 -6.639 1.00 . A A . 32 GLU C 1 1 2 1404 1 1 32 GLU CA C 11.045 1.149 -7.582 1.00 . A A . 32 GLU CA 1 1 2 1405 1 1 32 GLU CB C 12.555 0.904 -7.570 1.00 . A A . 32 GLU CB 1 1 2 1406 1 1 32 GLU CD C 14.656 1.191 -8.891 1.00 . A A . 32 GLU CD 1 1 2 1407 1 1 32 GLU CG C 13.128 1.198 -8.957 1.00 . A A . 32 GLU CG 1 1 2 1408 1 1 32 GLU H H 10.756 3.257 -7.835 1.00 . A A . 32 GLU H 1 1 2 1409 1 1 32 GLU HA H 10.662 1.004 -8.580 1.00 . A A . 32 GLU HA 1 1 2 1410 1 1 32 GLU HB2 H 13.020 1.553 -6.840 1.00 . A A . 32 GLU HB2 1 1 2 1411 1 1 32 GLU HB3 H 12.751 -0.126 -7.311 1.00 . A A . 32 GLU HB3 1 1 2 1412 1 1 32 GLU HG2 H 12.792 0.441 -9.652 1.00 . A A . 32 GLU HG2 1 1 2 1413 1 1 32 GLU HG3 H 12.789 2.167 -9.288 1.00 . A A . 32 GLU HG3 1 1 2 1414 1 1 32 GLU N N 10.755 2.551 -7.157 1.00 . A A . 32 GLU N 1 1 2 1415 1 1 32 GLU O O 10.919 -0.815 -6.225 1.00 . A A . 32 GLU O 1 1 2 1416 1 1 32 GLU OE1 O 15.196 0.355 -8.184 1.00 . A A . 32 GLU OE1 1 1 2 1417 1 1 32 GLU OE2 O 15.261 2.021 -9.550 1.00 . A A . 32 GLU OE2 1 1 2 1418 1 1 33 LYS C C 6.934 0.048 -5.287 1.00 . A A . 33 LYS C 1 1 2 1419 1 1 33 LYS CA C 8.389 -0.412 -5.350 1.00 . A A . 33 LYS CA 1 1 2 1420 1 1 33 LYS CB C 9.015 -0.344 -3.955 1.00 . A A . 33 LYS CB 1 1 2 1421 1 1 33 LYS CD C 10.959 -1.303 -2.707 1.00 . A A . 33 LYS CD 1 1 2 1422 1 1 33 LYS CE C 12.301 -1.759 -3.280 1.00 . A A . 33 LYS CE 1 1 2 1423 1 1 33 LYS CG C 9.845 -1.607 -3.711 1.00 . A A . 33 LYS CG 1 1 2 1424 1 1 33 LYS H H 8.722 1.295 -6.644 1.00 . A A . 33 LYS H 1 1 2 1425 1 1 33 LYS HA H 8.427 -1.432 -5.703 1.00 . A A . 33 LYS HA 1 1 2 1426 1 1 33 LYS HB2 H 9.650 0.525 -3.884 1.00 . A A . 33 LYS HB2 1 1 2 1427 1 1 33 LYS HB3 H 8.235 -0.282 -3.212 1.00 . A A . 33 LYS HB3 1 1 2 1428 1 1 33 LYS HD2 H 10.990 -0.239 -2.517 1.00 . A A . 33 LYS HD2 1 1 2 1429 1 1 33 LYS HD3 H 10.768 -1.827 -1.783 1.00 . A A . 33 LYS HD3 1 1 2 1430 1 1 33 LYS HE2 H 13.065 -1.670 -2.522 1.00 . A A . 33 LYS HE2 1 1 2 1431 1 1 33 LYS HE3 H 12.225 -2.790 -3.596 1.00 . A A . 33 LYS HE3 1 1 2 1432 1 1 33 LYS HG2 H 9.208 -2.387 -3.323 1.00 . A A . 33 LYS HG2 1 1 2 1433 1 1 33 LYS HG3 H 10.283 -1.938 -4.638 1.00 . A A . 33 LYS HG3 1 1 2 1434 1 1 33 LYS HZ1 H 12.402 0.082 -4.247 1.00 . A A . 33 LYS HZ1 1 1 2 1435 1 1 33 LYS HZ2 H 13.679 -0.969 -4.625 1.00 . A A . 33 LYS HZ2 1 1 2 1436 1 1 33 LYS HZ3 H 12.137 -1.235 -5.287 1.00 . A A . 33 LYS HZ3 1 1 2 1437 1 1 33 LYS N N 9.141 0.475 -6.290 1.00 . A A . 33 LYS N 1 1 2 1438 1 1 33 LYS NZ N 12.656 -0.906 -4.448 1.00 . A A . 33 LYS NZ 1 1 2 1439 1 1 33 LYS O O 6.617 1.174 -5.605 1.00 . A A . 33 LYS O 1 1 2 1440 1 1 34 ALA C C 4.345 0.550 -3.700 1.00 . A A . 34 ALA C 1 1 2 1441 1 1 34 ALA CA C 4.601 -0.439 -4.846 1.00 . A A . 34 ALA CA 1 1 2 1442 1 1 34 ALA CB C 3.767 -1.702 -4.629 1.00 . A A . 34 ALA CB 1 1 2 1443 1 1 34 ALA H H 6.316 -1.729 -4.668 1.00 . A A . 34 ALA H 1 1 2 1444 1 1 34 ALA HA H 4.313 0.019 -5.780 1.00 . A A . 34 ALA HA 1 1 2 1445 1 1 34 ALA HB1 H 4.357 -2.570 -4.885 1.00 . A A . 34 ALA HB1 1 1 2 1446 1 1 34 ALA HB2 H 3.467 -1.762 -3.593 1.00 . A A . 34 ALA HB2 1 1 2 1447 1 1 34 ALA HB3 H 2.889 -1.667 -5.257 1.00 . A A . 34 ALA HB3 1 1 2 1448 1 1 34 ALA N N 6.042 -0.819 -4.903 1.00 . A A . 34 ALA N 1 1 2 1449 1 1 34 ALA O O 4.939 0.459 -2.647 1.00 . A A . 34 ALA O 1 1 2 1450 1 1 35 TYR C C 1.669 2.917 -2.989 1.00 . A A . 35 TYR C 1 1 2 1451 1 1 35 TYR CA C 3.130 2.482 -2.827 1.00 . A A . 35 TYR CA 1 1 2 1452 1 1 35 TYR CB C 4.052 3.702 -2.961 1.00 . A A . 35 TYR CB 1 1 2 1453 1 1 35 TYR CD1 C 3.638 3.975 -5.416 1.00 . A A . 35 TYR CD1 1 1 2 1454 1 1 35 TYR CD2 C 3.198 5.855 -3.959 1.00 . A A . 35 TYR CD2 1 1 2 1455 1 1 35 TYR CE1 C 3.231 4.731 -6.523 1.00 . A A . 35 TYR CE1 1 1 2 1456 1 1 35 TYR CE2 C 2.790 6.614 -5.062 1.00 . A A . 35 TYR CE2 1 1 2 1457 1 1 35 TYR CG C 3.620 4.534 -4.141 1.00 . A A . 35 TYR CG 1 1 2 1458 1 1 35 TYR CZ C 2.804 6.051 -6.345 1.00 . A A . 35 TYR CZ 1 1 2 1459 1 1 35 TYR H H 2.980 1.529 -4.758 1.00 . A A . 35 TYR H 1 1 2 1460 1 1 35 TYR HA H 3.264 2.030 -1.851 1.00 . A A . 35 TYR HA 1 1 2 1461 1 1 35 TYR HB2 H 3.998 4.296 -2.061 1.00 . A A . 35 TYR HB2 1 1 2 1462 1 1 35 TYR HB3 H 5.067 3.369 -3.113 1.00 . A A . 35 TYR HB3 1 1 2 1463 1 1 35 TYR HD1 H 3.970 2.960 -5.546 1.00 . A A . 35 TYR HD1 1 1 2 1464 1 1 35 TYR HD2 H 3.183 6.287 -2.970 1.00 . A A . 35 TYR HD2 1 1 2 1465 1 1 35 TYR HE1 H 3.244 4.294 -7.510 1.00 . A A . 35 TYR HE1 1 1 2 1466 1 1 35 TYR HE2 H 2.462 7.633 -4.924 1.00 . A A . 35 TYR HE2 1 1 2 1467 1 1 35 TYR HH H 2.829 7.658 -7.374 1.00 . A A . 35 TYR HH 1 1 2 1468 1 1 35 TYR N N 3.451 1.486 -3.899 1.00 . A A . 35 TYR N 1 1 2 1469 1 1 35 TYR O O 1.089 2.778 -4.048 1.00 . A A . 35 TYR O 1 1 2 1470 1 1 35 TYR OH O 2.403 6.799 -7.432 1.00 . A A . 35 TYR OH 1 1 2 1471 1 1 36 VAL C C -0.444 5.072 -3.025 1.00 . A A . 36 VAL C 1 1 2 1472 1 1 36 VAL CA C -0.362 3.868 -2.081 1.00 . A A . 36 VAL CA 1 1 2 1473 1 1 36 VAL CB C -0.922 4.234 -0.699 1.00 . A A . 36 VAL CB 1 1 2 1474 1 1 36 VAL CG1 C -0.288 5.531 -0.194 1.00 . A A . 36 VAL CG1 1 1 2 1475 1 1 36 VAL CG2 C -2.437 4.421 -0.799 1.00 . A A . 36 VAL CG2 1 1 2 1476 1 1 36 VAL H H 1.536 3.544 -1.106 1.00 . A A . 36 VAL H 1 1 2 1477 1 1 36 VAL HA H -0.940 3.054 -2.497 1.00 . A A . 36 VAL HA 1 1 2 1478 1 1 36 VAL HB H -0.705 3.436 -0.004 1.00 . A A . 36 VAL HB 1 1 2 1479 1 1 36 VAL HG11 H 0.398 5.911 -0.932 1.00 . A A . 36 VAL HG11 1 1 2 1480 1 1 36 VAL HG12 H -1.063 6.262 -0.010 1.00 . A A . 36 VAL HG12 1 1 2 1481 1 1 36 VAL HG13 H 0.246 5.336 0.722 1.00 . A A . 36 VAL HG13 1 1 2 1482 1 1 36 VAL HG21 H -2.672 4.986 -1.690 1.00 . A A . 36 VAL HG21 1 1 2 1483 1 1 36 VAL HG22 H -2.917 3.455 -0.848 1.00 . A A . 36 VAL HG22 1 1 2 1484 1 1 36 VAL HG23 H -2.792 4.956 0.070 1.00 . A A . 36 VAL HG23 1 1 2 1485 1 1 36 VAL N N 1.061 3.438 -1.956 1.00 . A A . 36 VAL N 1 1 2 1486 1 1 36 VAL O O -0.748 6.179 -2.628 1.00 . A A . 36 VAL O 1 1 2 1487 1 1 37 LYS C C -1.580 6.647 -5.255 1.00 . A A . 37 LYS C 1 1 2 1488 1 1 37 LYS CA C -0.213 5.970 -5.270 1.00 . A A . 37 LYS CA 1 1 2 1489 1 1 37 LYS CB C 0.076 5.416 -6.671 1.00 . A A . 37 LYS CB 1 1 2 1490 1 1 37 LYS CD C -1.391 5.079 -8.666 1.00 . A A . 37 LYS CD 1 1 2 1491 1 1 37 LYS CE C -2.000 6.482 -8.700 1.00 . A A . 37 LYS CE 1 1 2 1492 1 1 37 LYS CG C -1.145 4.661 -7.215 1.00 . A A . 37 LYS CG 1 1 2 1493 1 1 37 LYS H H 0.076 3.954 -4.578 1.00 . A A . 37 LYS H 1 1 2 1494 1 1 37 LYS HA H 0.535 6.700 -5.016 1.00 . A A . 37 LYS HA 1 1 2 1495 1 1 37 LYS HB2 H 0.319 6.229 -7.337 1.00 . A A . 37 LYS HB2 1 1 2 1496 1 1 37 LYS HB3 H 0.912 4.736 -6.617 1.00 . A A . 37 LYS HB3 1 1 2 1497 1 1 37 LYS HD2 H -0.453 5.080 -9.203 1.00 . A A . 37 LYS HD2 1 1 2 1498 1 1 37 LYS HD3 H -2.072 4.381 -9.130 1.00 . A A . 37 LYS HD3 1 1 2 1499 1 1 37 LYS HE2 H -2.151 6.834 -7.690 1.00 . A A . 37 LYS HE2 1 1 2 1500 1 1 37 LYS HE3 H -1.330 7.151 -9.218 1.00 . A A . 37 LYS HE3 1 1 2 1501 1 1 37 LYS HG2 H -0.954 3.599 -7.174 1.00 . A A . 37 LYS HG2 1 1 2 1502 1 1 37 LYS HG3 H -2.015 4.891 -6.624 1.00 . A A . 37 LYS HG3 1 1 2 1503 1 1 37 LYS HZ1 H -3.740 5.500 -9.289 1.00 . A A . 37 LYS HZ1 1 1 2 1504 1 1 37 LYS HZ2 H -3.942 7.163 -9.022 1.00 . A A . 37 LYS HZ2 1 1 2 1505 1 1 37 LYS HZ3 H -3.157 6.618 -10.426 1.00 . A A . 37 LYS HZ3 1 1 2 1506 1 1 37 LYS N N -0.169 4.856 -4.282 1.00 . A A . 37 LYS N 1 1 2 1507 1 1 37 LYS NZ N -3.308 6.437 -9.413 1.00 . A A . 37 LYS NZ 1 1 2 1508 1 1 37 LYS O O -1.752 7.724 -5.791 1.00 . A A . 37 LYS O 1 1 2 1509 1 1 38 ASP C C -4.796 5.951 -3.634 1.00 . A A . 38 ASP C 1 1 2 1510 1 1 38 ASP CA C -3.900 6.658 -4.652 1.00 . A A . 38 ASP CA 1 1 2 1511 1 1 38 ASP CB C -4.494 6.540 -6.052 1.00 . A A . 38 ASP CB 1 1 2 1512 1 1 38 ASP CG C -5.964 6.963 -6.027 1.00 . A A . 38 ASP CG 1 1 2 1513 1 1 38 ASP H H -2.416 5.157 -4.246 1.00 . A A . 38 ASP H 1 1 2 1514 1 1 38 ASP HA H -3.808 7.701 -4.387 1.00 . A A . 38 ASP HA 1 1 2 1515 1 1 38 ASP HB2 H -3.939 7.181 -6.727 1.00 . A A . 38 ASP HB2 1 1 2 1516 1 1 38 ASP HB3 H -4.415 5.518 -6.386 1.00 . A A . 38 ASP HB3 1 1 2 1517 1 1 38 ASP N N -2.558 6.030 -4.665 1.00 . A A . 38 ASP N 1 1 2 1518 1 1 38 ASP O O -5.450 4.973 -3.936 1.00 . A A . 38 ASP O 1 1 2 1519 1 1 38 ASP OD1 O -6.393 7.486 -5.011 1.00 . A A . 38 ASP OD1 1 1 2 1520 1 1 38 ASP OD2 O -6.635 6.756 -7.024 1.00 . A A . 38 ASP OD2 1 1 2 1521 1 1 39 VAL C C -7.092 5.605 -1.915 1.00 . A A . 39 VAL C 1 1 2 1522 1 1 39 VAL CA C -5.674 5.812 -1.377 1.00 . A A . 39 VAL CA 1 1 2 1523 1 1 39 VAL CB C -5.722 6.724 -0.150 1.00 . A A . 39 VAL CB 1 1 2 1524 1 1 39 VAL CG1 C -4.300 6.977 0.355 1.00 . A A . 39 VAL CG1 1 1 2 1525 1 1 39 VAL CG2 C -6.370 8.058 -0.534 1.00 . A A . 39 VAL CG2 1 1 2 1526 1 1 39 VAL H H -4.290 7.234 -2.208 1.00 . A A . 39 VAL H 1 1 2 1527 1 1 39 VAL HA H -5.252 4.857 -1.099 1.00 . A A . 39 VAL HA 1 1 2 1528 1 1 39 VAL HB H -6.300 6.251 0.628 1.00 . A A . 39 VAL HB 1 1 2 1529 1 1 39 VAL HG11 H -3.593 6.739 -0.426 1.00 . A A . 39 VAL HG11 1 1 2 1530 1 1 39 VAL HG12 H -4.196 8.014 0.632 1.00 . A A . 39 VAL HG12 1 1 2 1531 1 1 39 VAL HG13 H -4.109 6.353 1.216 1.00 . A A . 39 VAL HG13 1 1 2 1532 1 1 39 VAL HG21 H -6.068 8.330 -1.534 1.00 . A A . 39 VAL HG21 1 1 2 1533 1 1 39 VAL HG22 H -7.445 7.960 -0.496 1.00 . A A . 39 VAL HG22 1 1 2 1534 1 1 39 VAL HG23 H -6.054 8.824 0.158 1.00 . A A . 39 VAL HG23 1 1 2 1535 1 1 39 VAL N N -4.827 6.443 -2.425 1.00 . A A . 39 VAL N 1 1 2 1536 1 1 39 VAL O O -7.811 4.731 -1.474 1.00 . A A . 39 VAL O 1 1 2 1537 1 1 40 GLU C C -8.890 5.084 -4.418 1.00 . A A . 40 GLU C 1 1 2 1538 1 1 40 GLU CA C -8.870 6.249 -3.427 1.00 . A A . 40 GLU CA 1 1 2 1539 1 1 40 GLU CB C -9.276 7.538 -4.144 1.00 . A A . 40 GLU CB 1 1 2 1540 1 1 40 GLU CD C -9.417 10.019 -3.895 1.00 . A A . 40 GLU CD 1 1 2 1541 1 1 40 GLU CG C -8.771 8.745 -3.350 1.00 . A A . 40 GLU CG 1 1 2 1542 1 1 40 GLU H H -6.905 7.102 -3.206 1.00 . A A . 40 GLU H 1 1 2 1543 1 1 40 GLU HA H -9.567 6.051 -2.625 1.00 . A A . 40 GLU HA 1 1 2 1544 1 1 40 GLU HB2 H -8.844 7.551 -5.135 1.00 . A A . 40 GLU HB2 1 1 2 1545 1 1 40 GLU HB3 H -10.352 7.586 -4.219 1.00 . A A . 40 GLU HB3 1 1 2 1546 1 1 40 GLU HG2 H -9.030 8.625 -2.308 1.00 . A A . 40 GLU HG2 1 1 2 1547 1 1 40 GLU HG3 H -7.697 8.817 -3.449 1.00 . A A . 40 GLU HG3 1 1 2 1548 1 1 40 GLU N N -7.499 6.403 -2.864 1.00 . A A . 40 GLU N 1 1 2 1549 1 1 40 GLU O O -9.934 4.655 -4.866 1.00 . A A . 40 GLU O 1 1 2 1550 1 1 40 GLU OE1 O -9.652 10.075 -5.091 1.00 . A A . 40 GLU OE1 1 1 2 1551 1 1 40 GLU OE2 O -9.666 10.917 -3.107 1.00 . A A . 40 GLU OE2 1 1 2 1552 1 1 41 GLY C C -8.039 2.127 -4.990 1.00 . A A . 41 GLY C 1 1 2 1553 1 1 41 GLY CA C -7.698 3.425 -5.724 1.00 . A A . 41 GLY CA 1 1 2 1554 1 1 41 GLY H H -6.910 4.923 -4.391 1.00 . A A . 41 GLY H 1 1 2 1555 1 1 41 GLY HA2 H -8.415 3.593 -6.515 1.00 . A A . 41 GLY HA2 1 1 2 1556 1 1 41 GLY HA3 H -6.708 3.346 -6.146 1.00 . A A . 41 GLY HA3 1 1 2 1557 1 1 41 GLY N N -7.742 4.565 -4.764 1.00 . A A . 41 GLY N 1 1 2 1558 1 1 41 GLY O O -8.408 1.138 -5.592 1.00 . A A . 41 GLY O 1 1 2 1559 1 1 42 ALA C C -9.234 1.232 -1.805 1.00 . A A . 42 ALA C 1 1 2 1560 1 1 42 ALA CA C -8.239 0.891 -2.914 1.00 . A A . 42 ALA CA 1 1 2 1561 1 1 42 ALA CB C -6.955 0.333 -2.295 1.00 . A A . 42 ALA CB 1 1 2 1562 1 1 42 ALA H H -7.621 2.931 -3.223 1.00 . A A . 42 ALA H 1 1 2 1563 1 1 42 ALA HA H -8.671 0.152 -3.573 1.00 . A A . 42 ALA HA 1 1 2 1564 1 1 42 ALA HB1 H -6.437 1.121 -1.769 1.00 . A A . 42 ALA HB1 1 1 2 1565 1 1 42 ALA HB2 H -7.203 -0.459 -1.605 1.00 . A A . 42 ALA HB2 1 1 2 1566 1 1 42 ALA HB3 H -6.318 -0.057 -3.077 1.00 . A A . 42 ALA HB3 1 1 2 1567 1 1 42 ALA N N -7.920 2.122 -3.690 1.00 . A A . 42 ALA N 1 1 2 1568 1 1 42 ALA O O -9.302 2.353 -1.342 1.00 . A A . 42 ALA O 1 1 2 1569 1 1 43 SER C C -10.433 0.131 1.051 1.00 . A A . 43 SER C 1 1 2 1570 1 1 43 SER CA C -11.004 0.546 -0.305 1.00 . A A . 43 SER CA 1 1 2 1571 1 1 43 SER CB C -12.268 -0.262 -0.579 1.00 . A A . 43 SER CB 1 1 2 1572 1 1 43 SER H H -9.949 -0.620 -1.764 1.00 . A A . 43 SER H 1 1 2 1573 1 1 43 SER HA H -11.245 1.599 -0.291 1.00 . A A . 43 SER HA 1 1 2 1574 1 1 43 SER HB2 H -12.028 -1.102 -1.205 1.00 . A A . 43 SER HB2 1 1 2 1575 1 1 43 SER HB3 H -12.669 -0.620 0.355 1.00 . A A . 43 SER HB3 1 1 2 1576 1 1 43 SER HG H -13.930 -0.005 -1.558 1.00 . A A . 43 SER HG 1 1 2 1577 1 1 43 SER N N -10.012 0.276 -1.377 1.00 . A A . 43 SER N 1 1 2 1578 1 1 43 SER O O -9.255 -0.154 1.189 1.00 . A A . 43 SER O 1 1 2 1579 1 1 43 SER OG O -13.222 0.560 -1.239 1.00 . A A . 43 SER OG 1 1 2 1580 1 1 44 GLN C C -10.555 -1.823 3.428 1.00 . A A . 44 GLN C 1 1 2 1581 1 1 44 GLN CA C -10.804 -0.315 3.407 1.00 . A A . 44 GLN CA 1 1 2 1582 1 1 44 GLN CB C -11.878 0.037 4.439 1.00 . A A . 44 GLN CB 1 1 2 1583 1 1 44 GLN CD C -11.801 0.494 6.892 1.00 . A A . 44 GLN CD 1 1 2 1584 1 1 44 GLN CG C -11.273 0.930 5.523 1.00 . A A . 44 GLN CG 1 1 2 1585 1 1 44 GLN H H -12.212 0.312 1.907 1.00 . A A . 44 GLN H 1 1 2 1586 1 1 44 GLN HA H -9.889 0.206 3.644 1.00 . A A . 44 GLN HA 1 1 2 1587 1 1 44 GLN HB2 H -12.687 0.559 3.953 1.00 . A A . 44 GLN HB2 1 1 2 1588 1 1 44 GLN HB3 H -12.254 -0.869 4.891 1.00 . A A . 44 GLN HB3 1 1 2 1589 1 1 44 GLN HE21 H -10.101 0.899 7.834 1.00 . A A . 44 GLN HE21 1 1 2 1590 1 1 44 GLN HE22 H -11.346 0.289 8.814 1.00 . A A . 44 GLN HE22 1 1 2 1591 1 1 44 GLN HG2 H -10.196 0.840 5.505 1.00 . A A . 44 GLN HG2 1 1 2 1592 1 1 44 GLN HG3 H -11.553 1.956 5.343 1.00 . A A . 44 GLN HG3 1 1 2 1593 1 1 44 GLN N N -11.270 0.085 2.052 1.00 . A A . 44 GLN N 1 1 2 1594 1 1 44 GLN NE2 N -11.018 0.567 7.933 1.00 . A A . 44 GLN NE2 1 1 2 1595 1 1 44 GLN O O -9.469 -2.274 3.716 1.00 . A A . 44 GLN O 1 1 2 1596 1 1 44 GLN OE1 O -12.937 0.082 7.015 1.00 . A A . 44 GLN OE1 1 1 2 1597 1 1 45 GLU C C -10.335 -4.478 2.078 1.00 . A A . 45 GLU C 1 1 2 1598 1 1 45 GLU CA C -11.377 -4.082 3.126 1.00 . A A . 45 GLU CA 1 1 2 1599 1 1 45 GLU CB C -12.710 -4.756 2.791 1.00 . A A . 45 GLU CB 1 1 2 1600 1 1 45 GLU CD C -13.626 -4.958 5.104 1.00 . A A . 45 GLU CD 1 1 2 1601 1 1 45 GLU CG C -13.788 -4.260 3.753 1.00 . A A . 45 GLU CG 1 1 2 1602 1 1 45 GLU H H -12.426 -2.216 2.892 1.00 . A A . 45 GLU H 1 1 2 1603 1 1 45 GLU HA H -11.048 -4.404 4.103 1.00 . A A . 45 GLU HA 1 1 2 1604 1 1 45 GLU HB2 H -12.990 -4.511 1.777 1.00 . A A . 45 GLU HB2 1 1 2 1605 1 1 45 GLU HB3 H -12.607 -5.826 2.889 1.00 . A A . 45 GLU HB3 1 1 2 1606 1 1 45 GLU HG2 H -13.688 -3.191 3.884 1.00 . A A . 45 GLU HG2 1 1 2 1607 1 1 45 GLU HG3 H -14.763 -4.484 3.348 1.00 . A A . 45 GLU HG3 1 1 2 1608 1 1 45 GLU N N -11.555 -2.603 3.123 1.00 . A A . 45 GLU N 1 1 2 1609 1 1 45 GLU O O -9.820 -5.581 2.086 1.00 . A A . 45 GLU O 1 1 2 1610 1 1 45 GLU OE1 O -12.754 -5.804 5.210 1.00 . A A . 45 GLU OE1 1 1 2 1611 1 1 45 GLU OE2 O -14.377 -4.635 6.008 1.00 . A A . 45 GLU OE2 1 1 2 1612 1 1 46 GLU C C -7.649 -3.407 0.671 1.00 . A A . 46 GLU C 1 1 2 1613 1 1 46 GLU CA C -8.982 -3.909 0.158 1.00 . A A . 46 GLU CA 1 1 2 1614 1 1 46 GLU CB C -9.324 -3.201 -1.150 1.00 . A A . 46 GLU CB 1 1 2 1615 1 1 46 GLU CD C -10.996 -3.185 -3.007 1.00 . A A . 46 GLU CD 1 1 2 1616 1 1 46 GLU CG C -10.778 -3.493 -1.524 1.00 . A A . 46 GLU CG 1 1 2 1617 1 1 46 GLU H H -10.404 -2.687 1.215 1.00 . A A . 46 GLU H 1 1 2 1618 1 1 46 GLU HA H -8.940 -4.977 0.003 1.00 . A A . 46 GLU HA 1 1 2 1619 1 1 46 GLU HB2 H -9.191 -2.137 -1.025 1.00 . A A . 46 GLU HB2 1 1 2 1620 1 1 46 GLU HB3 H -8.673 -3.555 -1.932 1.00 . A A . 46 GLU HB3 1 1 2 1621 1 1 46 GLU HG2 H -10.996 -4.534 -1.334 1.00 . A A . 46 GLU HG2 1 1 2 1622 1 1 46 GLU HG3 H -11.431 -2.873 -0.930 1.00 . A A . 46 GLU HG3 1 1 2 1623 1 1 46 GLU N N -10.001 -3.583 1.190 1.00 . A A . 46 GLU N 1 1 2 1624 1 1 46 GLU O O -6.650 -4.098 0.657 1.00 . A A . 46 GLU O 1 1 2 1625 1 1 46 GLU OE1 O -10.581 -3.987 -3.825 1.00 . A A . 46 GLU OE1 1 1 2 1626 1 1 46 GLU OE2 O -11.577 -2.152 -3.298 1.00 . A A . 46 GLU OE2 1 1 2 1627 1 1 47 VAL C C -5.942 -2.550 2.864 1.00 . A A . 47 VAL C 1 1 2 1628 1 1 47 VAL CA C -6.401 -1.641 1.718 1.00 . A A . 47 VAL CA 1 1 2 1629 1 1 47 VAL CB C -6.692 -0.231 2.239 1.00 . A A . 47 VAL CB 1 1 2 1630 1 1 47 VAL CG1 C -5.637 0.168 3.261 1.00 . A A . 47 VAL CG1 1 1 2 1631 1 1 47 VAL CG2 C -6.670 0.757 1.071 1.00 . A A . 47 VAL CG2 1 1 2 1632 1 1 47 VAL H H -8.473 -1.694 1.174 1.00 . A A . 47 VAL H 1 1 2 1633 1 1 47 VAL HA H -5.640 -1.600 0.953 1.00 . A A . 47 VAL HA 1 1 2 1634 1 1 47 VAL HB H -7.667 -0.217 2.707 1.00 . A A . 47 VAL HB 1 1 2 1635 1 1 47 VAL HG11 H -4.656 -0.033 2.859 1.00 . A A . 47 VAL HG11 1 1 2 1636 1 1 47 VAL HG12 H -5.733 1.220 3.480 1.00 . A A . 47 VAL HG12 1 1 2 1637 1 1 47 VAL HG13 H -5.782 -0.405 4.165 1.00 . A A . 47 VAL HG13 1 1 2 1638 1 1 47 VAL HG21 H -6.841 0.225 0.146 1.00 . A A . 47 VAL HG21 1 1 2 1639 1 1 47 VAL HG22 H -7.444 1.497 1.210 1.00 . A A . 47 VAL HG22 1 1 2 1640 1 1 47 VAL HG23 H -5.708 1.246 1.031 1.00 . A A . 47 VAL HG23 1 1 2 1641 1 1 47 VAL N N -7.646 -2.207 1.158 1.00 . A A . 47 VAL N 1 1 2 1642 1 1 47 VAL O O -4.765 -2.779 3.059 1.00 . A A . 47 VAL O 1 1 2 1643 1 1 48 GLU C C -6.091 -5.315 4.218 1.00 . A A . 48 GLU C 1 1 2 1644 1 1 48 GLU CA C -6.545 -3.952 4.746 1.00 . A A . 48 GLU CA 1 1 2 1645 1 1 48 GLU CB C -7.816 -4.116 5.558 1.00 . A A . 48 GLU CB 1 1 2 1646 1 1 48 GLU CD C -8.242 -4.441 7.996 1.00 . A A . 48 GLU CD 1 1 2 1647 1 1 48 GLU CG C -7.616 -3.523 6.945 1.00 . A A . 48 GLU CG 1 1 2 1648 1 1 48 GLU H H -7.813 -2.872 3.454 1.00 . A A . 48 GLU H 1 1 2 1649 1 1 48 GLU HA H -5.773 -3.511 5.356 1.00 . A A . 48 GLU HA 1 1 2 1650 1 1 48 GLU HB2 H -8.623 -3.599 5.063 1.00 . A A . 48 GLU HB2 1 1 2 1651 1 1 48 GLU HB3 H -8.057 -5.151 5.631 1.00 . A A . 48 GLU HB3 1 1 2 1652 1 1 48 GLU HG2 H -6.560 -3.415 7.137 1.00 . A A . 48 GLU HG2 1 1 2 1653 1 1 48 GLU HG3 H -8.089 -2.555 6.984 1.00 . A A . 48 GLU HG3 1 1 2 1654 1 1 48 GLU N N -6.875 -3.067 3.621 1.00 . A A . 48 GLU N 1 1 2 1655 1 1 48 GLU O O -5.017 -5.784 4.537 1.00 . A A . 48 GLU O 1 1 2 1656 1 1 48 GLU OE1 O -7.840 -5.590 8.066 1.00 . A A . 48 GLU OE1 1 1 2 1657 1 1 48 GLU OE2 O -9.114 -3.979 8.714 1.00 . A A . 48 GLU OE2 1 1 2 1658 1 1 49 GLU C C -5.044 -7.213 2.406 1.00 . A A . 49 GLU C 1 1 2 1659 1 1 49 GLU CA C -6.497 -7.289 2.877 1.00 . A A . 49 GLU CA 1 1 2 1660 1 1 49 GLU CB C -7.403 -7.678 1.706 1.00 . A A . 49 GLU CB 1 1 2 1661 1 1 49 GLU CD C -8.576 -9.599 0.611 1.00 . A A . 49 GLU CD 1 1 2 1662 1 1 49 GLU CG C -7.853 -9.132 1.876 1.00 . A A . 49 GLU CG 1 1 2 1663 1 1 49 GLU H H -7.764 -5.568 3.166 1.00 . A A . 49 GLU H 1 1 2 1664 1 1 49 GLU HA H -6.580 -8.029 3.659 1.00 . A A . 49 GLU HA 1 1 2 1665 1 1 49 GLU HB2 H -8.269 -7.030 1.690 1.00 . A A . 49 GLU HB2 1 1 2 1666 1 1 49 GLU HB3 H -6.859 -7.576 0.779 1.00 . A A . 49 GLU HB3 1 1 2 1667 1 1 49 GLU HG2 H -6.989 -9.757 2.048 1.00 . A A . 49 GLU HG2 1 1 2 1668 1 1 49 GLU HG3 H -8.524 -9.205 2.719 1.00 . A A . 49 GLU HG3 1 1 2 1669 1 1 49 GLU N N -6.900 -5.958 3.413 1.00 . A A . 49 GLU N 1 1 2 1670 1 1 49 GLU O O -4.222 -8.028 2.773 1.00 . A A . 49 GLU O 1 1 2 1671 1 1 49 GLU OE1 O -8.884 -8.758 -0.217 1.00 . A A . 49 GLU OE1 1 1 2 1672 1 1 49 GLU OE2 O -8.809 -10.791 0.493 1.00 . A A . 49 GLU OE2 1 1 2 1673 1 1 50 ALA C C -2.407 -5.894 2.351 1.00 . A A . 50 ALA C 1 1 2 1674 1 1 50 ALA CA C -3.311 -6.107 1.137 1.00 . A A . 50 ALA CA 1 1 2 1675 1 1 50 ALA CB C -3.194 -4.910 0.190 1.00 . A A . 50 ALA CB 1 1 2 1676 1 1 50 ALA H H -5.390 -5.579 1.330 1.00 . A A . 50 ALA H 1 1 2 1677 1 1 50 ALA HA H -3.018 -7.010 0.619 1.00 . A A . 50 ALA HA 1 1 2 1678 1 1 50 ALA HB1 H -4.157 -4.431 0.096 1.00 . A A . 50 ALA HB1 1 1 2 1679 1 1 50 ALA HB2 H -2.477 -4.207 0.586 1.00 . A A . 50 ALA HB2 1 1 2 1680 1 1 50 ALA HB3 H -2.865 -5.251 -0.781 1.00 . A A . 50 ALA HB3 1 1 2 1681 1 1 50 ALA N N -4.716 -6.234 1.608 1.00 . A A . 50 ALA N 1 1 2 1682 1 1 50 ALA O O -1.248 -6.261 2.351 1.00 . A A . 50 ALA O 1 1 2 1683 1 1 51 MET C C -1.728 -6.422 5.222 1.00 . A A . 51 MET C 1 1 2 1684 1 1 51 MET CA C -2.121 -5.075 4.617 1.00 . A A . 51 MET CA 1 1 2 1685 1 1 51 MET CB C -2.941 -4.279 5.635 1.00 . A A . 51 MET CB 1 1 2 1686 1 1 51 MET CE C -2.632 -1.163 6.888 1.00 . A A . 51 MET CE 1 1 2 1687 1 1 51 MET CG C -2.031 -3.811 6.771 1.00 . A A . 51 MET CG 1 1 2 1688 1 1 51 MET H H -3.875 -5.027 3.371 1.00 . A A . 51 MET H 1 1 2 1689 1 1 51 MET HA H -1.231 -4.525 4.361 1.00 . A A . 51 MET HA 1 1 2 1690 1 1 51 MET HB2 H -3.382 -3.420 5.150 1.00 . A A . 51 MET HB2 1 1 2 1691 1 1 51 MET HB3 H -3.723 -4.905 6.037 1.00 . A A . 51 MET HB3 1 1 2 1692 1 1 51 MET HE1 H -2.742 -1.375 5.834 1.00 . A A . 51 MET HE1 1 1 2 1693 1 1 51 MET HE2 H -3.340 -0.402 7.176 1.00 . A A . 51 MET HE2 1 1 2 1694 1 1 51 MET HE3 H -1.629 -0.814 7.089 1.00 . A A . 51 MET HE3 1 1 2 1695 1 1 51 MET HG2 H -1.708 -4.665 7.349 1.00 . A A . 51 MET HG2 1 1 2 1696 1 1 51 MET HG3 H -1.169 -3.308 6.359 1.00 . A A . 51 MET HG3 1 1 2 1697 1 1 51 MET N N -2.937 -5.308 3.393 1.00 . A A . 51 MET N 1 1 2 1698 1 1 51 MET O O -0.789 -6.522 5.986 1.00 . A A . 51 MET O 1 1 2 1699 1 1 51 MET SD S -2.943 -2.671 7.842 1.00 . A A . 51 MET SD 1 1 2 1700 1 1 52 ASP C C -1.475 -9.661 4.336 1.00 . A A . 52 ASP C 1 1 2 1701 1 1 52 ASP CA C -2.110 -8.802 5.433 1.00 . A A . 52 ASP CA 1 1 2 1702 1 1 52 ASP CB C -3.390 -9.476 5.930 1.00 . A A . 52 ASP CB 1 1 2 1703 1 1 52 ASP CG C -3.065 -10.368 7.130 1.00 . A A . 52 ASP CG 1 1 2 1704 1 1 52 ASP H H -3.193 -7.357 4.263 1.00 . A A . 52 ASP H 1 1 2 1705 1 1 52 ASP HA H -1.417 -8.694 6.254 1.00 . A A . 52 ASP HA 1 1 2 1706 1 1 52 ASP HB2 H -4.103 -8.721 6.224 1.00 . A A . 52 ASP HB2 1 1 2 1707 1 1 52 ASP HB3 H -3.809 -10.080 5.139 1.00 . A A . 52 ASP HB3 1 1 2 1708 1 1 52 ASP N N -2.440 -7.460 4.882 1.00 . A A . 52 ASP N 1 1 2 1709 1 1 52 ASP O O -0.963 -10.732 4.593 1.00 . A A . 52 ASP O 1 1 2 1710 1 1 52 ASP OD1 O -2.776 -9.826 8.184 1.00 . A A . 52 ASP OD1 1 1 2 1711 1 1 52 ASP OD2 O -3.113 -11.577 6.974 1.00 . A A . 52 ASP OD2 1 1 2 1712 1 1 53 THR C C 0.504 -9.496 1.704 1.00 . A A . 53 THR C 1 1 2 1713 1 1 53 THR CA C -0.913 -9.994 2.002 1.00 . A A . 53 THR CA 1 1 2 1714 1 1 53 THR CB C -1.782 -9.842 0.750 1.00 . A A . 53 THR CB 1 1 2 1715 1 1 53 THR CG2 C -3.251 -10.060 1.117 1.00 . A A . 53 THR CG2 1 1 2 1716 1 1 53 THR H H -1.930 -8.336 2.928 1.00 . A A . 53 THR H 1 1 2 1717 1 1 53 THR HA H -0.875 -11.035 2.285 1.00 . A A . 53 THR HA 1 1 2 1718 1 1 53 THR HB H -1.488 -10.574 0.014 1.00 . A A . 53 THR HB 1 1 2 1719 1 1 53 THR HG1 H -2.189 -8.453 -0.550 1.00 . A A . 53 THR HG1 1 1 2 1720 1 1 53 THR HG21 H -3.369 -9.989 2.189 1.00 . A A . 53 THR HG21 1 1 2 1721 1 1 53 THR HG22 H -3.859 -9.304 0.639 1.00 . A A . 53 THR HG22 1 1 2 1722 1 1 53 THR HG23 H -3.565 -11.038 0.784 1.00 . A A . 53 THR HG23 1 1 2 1723 1 1 53 THR N N -1.509 -9.201 3.114 1.00 . A A . 53 THR N 1 1 2 1724 1 1 53 THR O O 0.936 -9.473 0.569 1.00 . A A . 53 THR O 1 1 2 1725 1 1 53 THR OG1 O -1.615 -8.537 0.215 1.00 . A A . 53 THR OG1 1 1 2 1726 1 1 54 CYS C C 3.598 -9.386 3.367 1.00 . A A . 54 CYS C 1 1 2 1727 1 1 54 CYS CA C 2.625 -8.617 2.472 1.00 . A A . 54 CYS CA 1 1 2 1728 1 1 54 CYS CB C 2.713 -7.122 2.793 1.00 . A A . 54 CYS CB 1 1 2 1729 1 1 54 CYS H H 0.875 -9.133 3.622 1.00 . A A . 54 CYS H 1 1 2 1730 1 1 54 CYS HA H 2.886 -8.778 1.436 1.00 . A A . 54 CYS HA 1 1 2 1731 1 1 54 CYS HB2 H 1.945 -6.589 2.257 1.00 . A A . 54 CYS HB2 1 1 2 1732 1 1 54 CYS HB3 H 2.577 -6.977 3.854 1.00 . A A . 54 CYS HB3 1 1 2 1733 1 1 54 CYS N N 1.236 -9.103 2.711 1.00 . A A . 54 CYS N 1 1 2 1734 1 1 54 CYS O O 3.363 -9.538 4.551 1.00 . A A . 54 CYS O 1 1 2 1735 1 1 54 CYS SG S 4.319 -6.350 2.370 1.00 . A A . 54 CYS SG 1 1 2 1736 1 1 55 PRO C C 6.479 -9.640 4.431 1.00 . A A . 55 PRO C 1 1 2 1737 1 1 55 PRO CA C 5.696 -10.598 3.534 1.00 . A A . 55 PRO CA 1 1 2 1738 1 1 55 PRO CB C 6.591 -11.194 2.447 1.00 . A A . 55 PRO CB 1 1 2 1739 1 1 55 PRO CD C 5.023 -9.697 1.357 1.00 . A A . 55 PRO CD 1 1 2 1740 1 1 55 PRO CG C 6.413 -10.290 1.266 1.00 . A A . 55 PRO CG 1 1 2 1741 1 1 55 PRO HA H 5.241 -11.384 4.116 1.00 . A A . 55 PRO HA 1 1 2 1742 1 1 55 PRO HB2 H 7.615 -11.213 2.801 1.00 . A A . 55 PRO HB2 1 1 2 1743 1 1 55 PRO HB3 H 6.268 -12.199 2.228 1.00 . A A . 55 PRO HB3 1 1 2 1744 1 1 55 PRO HD2 H 5.040 -8.656 1.068 1.00 . A A . 55 PRO HD2 1 1 2 1745 1 1 55 PRO HD3 H 4.333 -10.252 0.739 1.00 . A A . 55 PRO HD3 1 1 2 1746 1 1 55 PRO HG2 H 7.156 -9.505 1.295 1.00 . A A . 55 PRO HG2 1 1 2 1747 1 1 55 PRO HG3 H 6.509 -10.859 0.354 1.00 . A A . 55 PRO HG3 1 1 2 1748 1 1 55 PRO N N 4.669 -9.843 2.773 1.00 . A A . 55 PRO N 1 1 2 1749 1 1 55 PRO O O 6.901 -9.987 5.515 1.00 . A A . 55 PRO O 1 1 2 1750 1 1 56 VAL C C 6.379 -6.544 5.527 1.00 . A A . 56 VAL C 1 1 2 1751 1 1 56 VAL CA C 7.398 -7.431 4.808 1.00 . A A . 56 VAL CA 1 1 2 1752 1 1 56 VAL CB C 8.281 -6.570 3.902 1.00 . A A . 56 VAL CB 1 1 2 1753 1 1 56 VAL CG1 C 9.121 -7.474 3.000 1.00 . A A . 56 VAL CG1 1 1 2 1754 1 1 56 VAL CG2 C 7.395 -5.669 3.039 1.00 . A A . 56 VAL CG2 1 1 2 1755 1 1 56 VAL H H 6.301 -8.168 3.112 1.00 . A A . 56 VAL H 1 1 2 1756 1 1 56 VAL HA H 8.011 -7.943 5.536 1.00 . A A . 56 VAL HA 1 1 2 1757 1 1 56 VAL HB H 8.934 -5.960 4.511 1.00 . A A . 56 VAL HB 1 1 2 1758 1 1 56 VAL HG11 H 9.313 -8.409 3.507 1.00 . A A . 56 VAL HG11 1 1 2 1759 1 1 56 VAL HG12 H 8.585 -7.667 2.082 1.00 . A A . 56 VAL HG12 1 1 2 1760 1 1 56 VAL HG13 H 10.058 -6.988 2.775 1.00 . A A . 56 VAL HG13 1 1 2 1761 1 1 56 VAL HG21 H 6.401 -6.088 2.980 1.00 . A A . 56 VAL HG21 1 1 2 1762 1 1 56 VAL HG22 H 7.344 -4.683 3.479 1.00 . A A . 56 VAL HG22 1 1 2 1763 1 1 56 VAL HG23 H 7.813 -5.597 2.046 1.00 . A A . 56 VAL HG23 1 1 2 1764 1 1 56 VAL N N 6.661 -8.427 3.986 1.00 . A A . 56 VAL N 1 1 2 1765 1 1 56 VAL O O 6.698 -5.850 6.472 1.00 . A A . 56 VAL O 1 1 2 1766 1 1 57 GLN C C 4.658 -4.346 6.036 1.00 . A A . 57 GLN C 1 1 2 1767 1 1 57 GLN CA C 4.099 -5.737 5.725 1.00 . A A . 57 GLN CA 1 1 2 1768 1 1 57 GLN CB C 3.648 -6.405 7.025 1.00 . A A . 57 GLN CB 1 1 2 1769 1 1 57 GLN CD C 1.756 -7.685 8.033 1.00 . A A . 57 GLN CD 1 1 2 1770 1 1 57 GLN CG C 2.502 -7.376 6.734 1.00 . A A . 57 GLN CG 1 1 2 1771 1 1 57 GLN H H 4.921 -7.138 4.318 1.00 . A A . 57 GLN H 1 1 2 1772 1 1 57 GLN HA H 3.253 -5.646 5.055 1.00 . A A . 57 GLN HA 1 1 2 1773 1 1 57 GLN HB2 H 4.479 -6.947 7.456 1.00 . A A . 57 GLN HB2 1 1 2 1774 1 1 57 GLN HB3 H 3.311 -5.653 7.720 1.00 . A A . 57 GLN HB3 1 1 2 1775 1 1 57 GLN HE21 H 1.608 -5.777 8.567 1.00 . A A . 57 GLN HE21 1 1 2 1776 1 1 57 GLN HE22 H 0.920 -6.890 9.649 1.00 . A A . 57 GLN HE22 1 1 2 1777 1 1 57 GLN HG2 H 1.823 -6.927 6.024 1.00 . A A . 57 GLN HG2 1 1 2 1778 1 1 57 GLN HG3 H 2.900 -8.292 6.324 1.00 . A A . 57 GLN HG3 1 1 2 1779 1 1 57 GLN N N 5.152 -6.568 5.080 1.00 . A A . 57 GLN N 1 1 2 1780 1 1 57 GLN NE2 N 1.397 -6.702 8.814 1.00 . A A . 57 GLN NE2 1 1 2 1781 1 1 57 GLN O O 5.138 -4.088 7.122 1.00 . A A . 57 GLN O 1 1 2 1782 1 1 57 GLN OE1 O 1.497 -8.831 8.341 1.00 . A A . 57 GLN OE1 1 1 2 1783 1 1 58 CYS C C 3.974 -1.066 5.152 1.00 . A A . 58 CYS C 1 1 2 1784 1 1 58 CYS CA C 5.111 -2.073 5.335 1.00 . A A . 58 CYS CA 1 1 2 1785 1 1 58 CYS CB C 6.228 -1.767 4.337 1.00 . A A . 58 CYS CB 1 1 2 1786 1 1 58 CYS H H 4.196 -3.676 4.227 1.00 . A A . 58 CYS H 1 1 2 1787 1 1 58 CYS HA H 5.499 -2.004 6.342 1.00 . A A . 58 CYS HA 1 1 2 1788 1 1 58 CYS HB2 H 6.496 -0.723 4.405 1.00 . A A . 58 CYS HB2 1 1 2 1789 1 1 58 CYS HB3 H 7.091 -2.377 4.563 1.00 . A A . 58 CYS HB3 1 1 2 1790 1 1 58 CYS HG H 5.689 -3.086 2.537 1.00 . A A . 58 CYS HG 1 1 2 1791 1 1 58 CYS N N 4.592 -3.448 5.094 1.00 . A A . 58 CYS N 1 1 2 1792 1 1 58 CYS O O 4.182 0.131 5.183 1.00 . A A . 58 CYS O 1 1 2 1793 1 1 58 CYS SG S 5.655 -2.134 2.660 1.00 . A A . 58 CYS SG 1 1 2 1794 1 1 59 ILE C C 0.903 -0.387 6.093 1.00 . A A . 59 ILE C 1 1 2 1795 1 1 59 ILE CA C 1.621 -0.613 4.761 1.00 . A A . 59 ILE CA 1 1 2 1796 1 1 59 ILE CB C 0.646 -1.221 3.746 1.00 . A A . 59 ILE CB 1 1 2 1797 1 1 59 ILE CD1 C -1.211 0.339 4.378 1.00 . A A . 59 ILE CD1 1 1 2 1798 1 1 59 ILE CG1 C -0.312 -0.138 3.237 1.00 . A A . 59 ILE CG1 1 1 2 1799 1 1 59 ILE CG2 C -0.157 -2.343 4.403 1.00 . A A . 59 ILE CG2 1 1 2 1800 1 1 59 ILE H H 2.625 -2.510 4.930 1.00 . A A . 59 ILE H 1 1 2 1801 1 1 59 ILE HA H 1.984 0.333 4.386 1.00 . A A . 59 ILE HA 1 1 2 1802 1 1 59 ILE HB H 1.203 -1.628 2.915 1.00 . A A . 59 ILE HB 1 1 2 1803 1 1 59 ILE HD11 H -1.236 -0.408 5.156 1.00 . A A . 59 ILE HD11 1 1 2 1804 1 1 59 ILE HD12 H -0.821 1.262 4.778 1.00 . A A . 59 ILE HD12 1 1 2 1805 1 1 59 ILE HD13 H -2.210 0.503 4.004 1.00 . A A . 59 ILE HD13 1 1 2 1806 1 1 59 ILE HG12 H 0.260 0.696 2.858 1.00 . A A . 59 ILE HG12 1 1 2 1807 1 1 59 ILE HG13 H -0.924 -0.544 2.445 1.00 . A A . 59 ILE HG13 1 1 2 1808 1 1 59 ILE HG21 H 0.467 -2.865 5.113 1.00 . A A . 59 ILE HG21 1 1 2 1809 1 1 59 ILE HG22 H -1.013 -1.926 4.912 1.00 . A A . 59 ILE HG22 1 1 2 1810 1 1 59 ILE HG23 H -0.490 -3.032 3.642 1.00 . A A . 59 ILE HG23 1 1 2 1811 1 1 59 ILE N N 2.772 -1.541 4.955 1.00 . A A . 59 ILE N 1 1 2 1812 1 1 59 ILE O O 0.514 -1.321 6.766 1.00 . A A . 59 ILE O 1 1 2 1813 1 1 60 HIS C C -1.057 2.201 7.503 1.00 . A A . 60 HIS C 1 1 2 1814 1 1 60 HIS CA C 0.013 1.139 7.753 1.00 . A A . 60 HIS CA 1 1 2 1815 1 1 60 HIS CB C 1.014 1.656 8.791 1.00 . A A . 60 HIS CB 1 1 2 1816 1 1 60 HIS CD2 C 2.930 -0.133 8.990 1.00 . A A . 60 HIS CD2 1 1 2 1817 1 1 60 HIS CE1 C 4.396 0.834 7.721 1.00 . A A . 60 HIS CE1 1 1 2 1818 1 1 60 HIS CG C 2.362 1.036 8.546 1.00 . A A . 60 HIS CG 1 1 2 1819 1 1 60 HIS H H 1.032 1.585 5.908 1.00 . A A . 60 HIS H 1 1 2 1820 1 1 60 HIS HA H -0.454 0.237 8.120 1.00 . A A . 60 HIS HA 1 1 2 1821 1 1 60 HIS HB2 H 1.091 2.730 8.710 1.00 . A A . 60 HIS HB2 1 1 2 1822 1 1 60 HIS HB3 H 0.672 1.394 9.781 1.00 . A A . 60 HIS HB3 1 1 2 1823 1 1 60 HIS HD1 H 3.220 2.491 7.269 1.00 . A A . 60 HIS HD1 1 1 2 1824 1 1 60 HIS HD2 H 2.452 -0.846 9.645 1.00 . A A . 60 HIS HD2 1 1 2 1825 1 1 60 HIS HE1 H 5.299 1.048 7.169 1.00 . A A . 60 HIS HE1 1 1 2 1826 1 1 60 HIS N N 0.717 0.847 6.472 1.00 . A A . 60 HIS N 1 1 2 1827 1 1 60 HIS ND1 N 3.316 1.636 7.740 1.00 . A A . 60 HIS ND1 1 1 2 1828 1 1 60 HIS NE2 N 4.214 -0.258 8.467 1.00 . A A . 60 HIS NE2 1 1 2 1829 1 1 60 HIS O O -1.469 2.428 6.383 1.00 . A A . 60 HIS O 1 1 2 1830 1 1 61 TRP C C -1.942 5.280 8.615 1.00 . A A . 61 TRP C 1 1 2 1831 1 1 61 TRP CA C -2.549 3.907 8.334 1.00 . A A . 61 TRP CA 1 1 2 1832 1 1 61 TRP CB C -3.719 3.656 9.283 1.00 . A A . 61 TRP CB 1 1 2 1833 1 1 61 TRP CD1 C -3.690 1.127 9.408 1.00 . A A . 61 TRP CD1 1 1 2 1834 1 1 61 TRP CD2 C -5.502 1.937 8.360 1.00 . A A . 61 TRP CD2 1 1 2 1835 1 1 61 TRP CE2 C -5.628 0.530 8.347 1.00 . A A . 61 TRP CE2 1 1 2 1836 1 1 61 TRP CE3 C -6.510 2.701 7.763 1.00 . A A . 61 TRP CE3 1 1 2 1837 1 1 61 TRP CG C -4.270 2.291 9.034 1.00 . A A . 61 TRP CG 1 1 2 1838 1 1 61 TRP CH2 C -7.726 0.679 7.167 1.00 . A A . 61 TRP CH2 1 1 2 1839 1 1 61 TRP CZ2 C -6.726 -0.098 7.758 1.00 . A A . 61 TRP CZ2 1 1 2 1840 1 1 61 TRP CZ3 C -7.619 2.078 7.169 1.00 . A A . 61 TRP CZ3 1 1 2 1841 1 1 61 TRP H H -1.166 2.670 9.428 1.00 . A A . 61 TRP H 1 1 2 1842 1 1 61 TRP HA H -2.904 3.878 7.311 1.00 . A A . 61 TRP HA 1 1 2 1843 1 1 61 TRP HB2 H -3.386 3.729 10.301 1.00 . A A . 61 TRP HB2 1 1 2 1844 1 1 61 TRP HB3 H -4.490 4.389 9.104 1.00 . A A . 61 TRP HB3 1 1 2 1845 1 1 61 TRP HD1 H -2.754 1.032 9.937 1.00 . A A . 61 TRP HD1 1 1 2 1846 1 1 61 TRP HE1 H -4.306 -0.872 9.144 1.00 . A A . 61 TRP HE1 1 1 2 1847 1 1 61 TRP HE3 H -6.427 3.778 7.764 1.00 . A A . 61 TRP HE3 1 1 2 1848 1 1 61 TRP HH2 H -8.582 0.202 6.710 1.00 . A A . 61 TRP HH2 1 1 2 1849 1 1 61 TRP HZ2 H -6.801 -1.175 7.758 1.00 . A A . 61 TRP HZ2 1 1 2 1850 1 1 61 TRP HZ3 H -8.393 2.677 6.714 1.00 . A A . 61 TRP HZ3 1 1 2 1851 1 1 61 TRP N N -1.510 2.860 8.529 1.00 . A A . 61 TRP N 1 1 2 1852 1 1 61 TRP NE1 N -4.496 0.079 8.999 1.00 . A A . 61 TRP NE1 1 1 2 1853 1 1 61 TRP O O -0.809 5.395 9.038 1.00 . A A . 61 TRP O 1 1 2 1854 1 1 62 GLU C C -3.231 8.527 9.314 1.00 . A A . 62 GLU C 1 1 2 1855 1 1 62 GLU CA C -2.156 7.687 8.618 1.00 . A A . 62 GLU CA 1 1 2 1856 1 1 62 GLU CB C -1.780 8.317 7.273 1.00 . A A . 62 GLU CB 1 1 2 1857 1 1 62 GLU CD C -2.098 10.606 6.319 1.00 . A A . 62 GLU CD 1 1 2 1858 1 1 62 GLU CG C -1.463 9.804 7.457 1.00 . A A . 62 GLU CG 1 1 2 1859 1 1 62 GLU H H -3.595 6.201 8.031 1.00 . A A . 62 GLU H 1 1 2 1860 1 1 62 GLU HA H -1.282 7.628 9.248 1.00 . A A . 62 GLU HA 1 1 2 1861 1 1 62 GLU HB2 H -0.910 7.812 6.877 1.00 . A A . 62 GLU HB2 1 1 2 1862 1 1 62 GLU HB3 H -2.602 8.206 6.582 1.00 . A A . 62 GLU HB3 1 1 2 1863 1 1 62 GLU HG2 H -1.856 10.146 8.403 1.00 . A A . 62 GLU HG2 1 1 2 1864 1 1 62 GLU HG3 H -0.393 9.948 7.439 1.00 . A A . 62 GLU HG3 1 1 2 1865 1 1 62 GLU N N -2.687 6.319 8.376 1.00 . A A . 62 GLU N 1 1 2 1866 1 1 62 GLU O O -3.905 9.327 8.698 1.00 . A A . 62 GLU O 1 1 2 1867 1 1 62 GLU OE1 O -1.709 10.393 5.183 1.00 . A A . 62 GLU OE1 1 1 2 1868 1 1 62 GLU OE2 O -2.962 11.418 6.604 1.00 . A A . 62 GLU OE2 1 1 2 1869 1 1 63 ASP C C -3.784 10.392 11.913 1.00 . A A . 63 ASP C 1 1 2 1870 1 1 63 ASP CA C -4.422 9.124 11.341 1.00 . A A . 63 ASP CA 1 1 2 1871 1 1 63 ASP CB C -4.977 8.271 12.482 1.00 . A A . 63 ASP CB 1 1 2 1872 1 1 63 ASP CG C -6.030 7.305 11.936 1.00 . A A . 63 ASP CG 1 1 2 1873 1 1 63 ASP H H -2.840 7.689 11.071 1.00 . A A . 63 ASP H 1 1 2 1874 1 1 63 ASP HA H -5.224 9.395 10.670 1.00 . A A . 63 ASP HA 1 1 2 1875 1 1 63 ASP HB2 H -4.171 7.709 12.934 1.00 . A A . 63 ASP HB2 1 1 2 1876 1 1 63 ASP HB3 H -5.429 8.911 13.224 1.00 . A A . 63 ASP HB3 1 1 2 1877 1 1 63 ASP N N -3.394 8.344 10.597 1.00 . A A . 63 ASP N 1 1 2 1878 1 1 63 ASP O O -4.463 11.339 12.255 1.00 . A A . 63 ASP O 1 1 2 1879 1 1 63 ASP OD1 O -5.650 6.385 11.228 1.00 . A A . 63 ASP OD1 1 1 2 1880 1 1 63 ASP OD2 O -7.196 7.501 12.234 1.00 . A A . 63 ASP OD2 1 1 2 1881 1 1 64 GLU C C -2.385 12.878 11.916 1.00 . A A . 64 GLU C 1 1 2 1882 1 1 64 GLU CA C -1.802 11.623 12.568 1.00 . A A . 64 GLU CA 1 1 2 1883 1 1 64 GLU CB C -0.302 11.543 12.270 1.00 . A A . 64 GLU CB 1 1 2 1884 1 1 64 GLU CD C 1.896 11.210 13.409 1.00 . A A . 64 GLU CD 1 1 2 1885 1 1 64 GLU CG C 0.412 10.841 13.426 1.00 . A A . 64 GLU CG 1 1 2 1886 1 1 64 GLU H H -1.954 9.642 11.736 1.00 . A A . 64 GLU H 1 1 2 1887 1 1 64 GLU HA H -1.955 11.668 13.636 1.00 . A A . 64 GLU HA 1 1 2 1888 1 1 64 GLU HB2 H -0.147 10.986 11.358 1.00 . A A . 64 GLU HB2 1 1 2 1889 1 1 64 GLU HB3 H 0.095 12.540 12.156 1.00 . A A . 64 GLU HB3 1 1 2 1890 1 1 64 GLU HG2 H -0.027 11.154 14.363 1.00 . A A . 64 GLU HG2 1 1 2 1891 1 1 64 GLU HG3 H 0.306 9.772 13.320 1.00 . A A . 64 GLU HG3 1 1 2 1892 1 1 64 GLU N N -2.483 10.417 12.019 1.00 . A A . 64 GLU N 1 1 2 1893 1 1 64 GLU OE1 O 2.192 12.391 13.353 1.00 . A A . 64 GLU OE1 1 1 2 1894 1 1 64 GLU OE2 O 2.711 10.303 13.454 1.00 . A A . 64 GLU OE2 1 1 2 1895 2 2 1 SF4 FE1 FE 5.897 -4.887 -1.996 1.00 . B A . 65 SF4 FE1 1 1 2 1896 2 2 1 SF4 FE2 FE 4.347 -5.962 0.223 1.00 . B A . 65 SF4 FE2 1 1 2 1897 2 2 1 SF4 FE3 FE 3.304 -4.645 -2.066 1.00 . B A . 65 SF4 FE3 1 1 2 1898 2 2 1 SF4 FE4 FE 4.623 -7.305 -2.328 1.00 . B A . 65 SF4 FE4 1 1 2 1899 2 2 1 SF4 S1 S 2.602 -6.722 -0.913 1.00 . B A . 65 SF4 S1 1 1 2 1900 2 2 1 SF4 S2 S 4.765 -5.211 -3.624 1.00 . B A . 65 SF4 S2 1 1 2 1901 2 2 1 SF4 S3 S 6.263 -7.038 -0.860 1.00 . B A . 65 SF4 S3 1 1 2 1902 2 2 1 SF4 S4 S 4.668 -3.631 -0.655 1.00 . B A . 65 SF4 S4 1 1 3 1903 1 1 1 ALA C C -7.580 10.150 10.222 1.00 . A A . 1 ALA C 1 1 3 1904 1 1 1 ALA CA C -8.472 11.391 10.161 1.00 . A A . 1 ALA CA 1 1 3 1905 1 1 1 ALA CB C -7.603 12.650 10.197 1.00 . A A . 1 ALA CB 1 1 3 1906 1 1 1 ALA HA H -9.048 11.377 9.248 1.00 . A A . 1 ALA HA 1 1 3 1907 1 1 1 ALA HB1 H -7.593 13.053 11.199 1.00 . A A . 1 ALA HB1 1 1 3 1908 1 1 1 ALA HB2 H -6.596 12.400 9.899 1.00 . A A . 1 ALA HB2 1 1 3 1909 1 1 1 ALA HB3 H -8.007 13.387 9.518 1.00 . A A . 1 ALA HB3 1 1 3 1910 1 1 1 ALA N N -9.398 11.393 11.330 1.00 . A A . 1 ALA N 1 1 3 1911 1 1 1 ALA O O -6.406 10.230 10.524 1.00 . A A . 1 ALA O 1 1 3 1912 1 1 2 ARG C C -6.629 7.552 8.626 1.00 . A A . 2 ARG C 1 1 3 1913 1 1 2 ARG CA C -7.319 7.753 9.976 1.00 . A A . 2 ARG CA 1 1 3 1914 1 1 2 ARG CB C -8.235 6.562 10.267 1.00 . A A . 2 ARG CB 1 1 3 1915 1 1 2 ARG CD C -10.689 6.965 10.008 1.00 . A A . 2 ARG CD 1 1 3 1916 1 1 2 ARG CG C -9.404 6.567 9.279 1.00 . A A . 2 ARG CG 1 1 3 1917 1 1 2 ARG CZ C -12.262 6.584 8.204 1.00 . A A . 2 ARG CZ 1 1 3 1918 1 1 2 ARG H H -9.080 8.960 9.695 1.00 . A A . 2 ARG H 1 1 3 1919 1 1 2 ARG HA H -6.572 7.832 10.754 1.00 . A A . 2 ARG HA 1 1 3 1920 1 1 2 ARG HB2 H -7.676 5.643 10.162 1.00 . A A . 2 ARG HB2 1 1 3 1921 1 1 2 ARG HB3 H -8.617 6.639 11.274 1.00 . A A . 2 ARG HB3 1 1 3 1922 1 1 2 ARG HD2 H -11.080 6.112 10.543 1.00 . A A . 2 ARG HD2 1 1 3 1923 1 1 2 ARG HD3 H -10.474 7.760 10.707 1.00 . A A . 2 ARG HD3 1 1 3 1924 1 1 2 ARG HE H -11.937 8.384 8.975 1.00 . A A . 2 ARG HE 1 1 3 1925 1 1 2 ARG HG2 H -9.203 7.275 8.488 1.00 . A A . 2 ARG HG2 1 1 3 1926 1 1 2 ARG HG3 H -9.523 5.580 8.857 1.00 . A A . 2 ARG HG3 1 1 3 1927 1 1 2 ARG HH11 H -13.280 5.643 9.649 1.00 . A A . 2 ARG HH11 1 1 3 1928 1 1 2 ARG HH12 H -13.515 5.031 8.046 1.00 . A A . 2 ARG HH12 1 1 3 1929 1 1 2 ARG HH21 H -11.380 7.326 6.568 1.00 . A A . 2 ARG HH21 1 1 3 1930 1 1 2 ARG HH22 H -12.441 5.983 6.303 1.00 . A A . 2 ARG HH22 1 1 3 1931 1 1 2 ARG N N -8.131 9.002 9.936 1.00 . A A . 2 ARG N 1 1 3 1932 1 1 2 ARG NE N -11.698 7.435 9.017 1.00 . A A . 2 ARG NE 1 1 3 1933 1 1 2 ARG NH1 N -13.082 5.682 8.669 1.00 . A A . 2 ARG NH1 1 1 3 1934 1 1 2 ARG NH2 N -12.008 6.635 6.926 1.00 . A A . 2 ARG NH2 1 1 3 1935 1 1 2 ARG O O -7.234 7.113 7.668 1.00 . A A . 2 ARG O 1 1 3 1936 1 1 3 LYS C C -3.883 6.376 7.249 1.00 . A A . 3 LYS C 1 1 3 1937 1 1 3 LYS CA C -4.643 7.705 7.248 1.00 . A A . 3 LYS CA 1 1 3 1938 1 1 3 LYS CB C -3.653 8.857 7.069 1.00 . A A . 3 LYS CB 1 1 3 1939 1 1 3 LYS CD C -2.505 10.179 5.282 1.00 . A A . 3 LYS CD 1 1 3 1940 1 1 3 LYS CE C -2.862 11.547 4.697 1.00 . A A . 3 LYS CE 1 1 3 1941 1 1 3 LYS CG C -3.786 9.431 5.655 1.00 . A A . 3 LYS CG 1 1 3 1942 1 1 3 LYS H H -4.898 8.229 9.323 1.00 . A A . 3 LYS H 1 1 3 1943 1 1 3 LYS HA H -5.352 7.711 6.434 1.00 . A A . 3 LYS HA 1 1 3 1944 1 1 3 LYS HB2 H -3.865 9.630 7.793 1.00 . A A . 3 LYS HB2 1 1 3 1945 1 1 3 LYS HB3 H -2.648 8.494 7.213 1.00 . A A . 3 LYS HB3 1 1 3 1946 1 1 3 LYS HD2 H -1.896 10.313 6.165 1.00 . A A . 3 LYS HD2 1 1 3 1947 1 1 3 LYS HD3 H -1.955 9.609 4.549 1.00 . A A . 3 LYS HD3 1 1 3 1948 1 1 3 LYS HE2 H -3.423 12.115 5.425 1.00 . A A . 3 LYS HE2 1 1 3 1949 1 1 3 LYS HE3 H -1.956 12.078 4.444 1.00 . A A . 3 LYS HE3 1 1 3 1950 1 1 3 LYS HG2 H -3.950 8.625 4.955 1.00 . A A . 3 LYS HG2 1 1 3 1951 1 1 3 LYS HG3 H -4.622 10.114 5.621 1.00 . A A . 3 LYS HG3 1 1 3 1952 1 1 3 LYS HZ1 H -3.453 10.450 3.027 1.00 . A A . 3 LYS HZ1 1 1 3 1953 1 1 3 LYS HZ2 H -4.697 11.373 3.724 1.00 . A A . 3 LYS HZ2 1 1 3 1954 1 1 3 LYS HZ3 H -3.490 12.130 2.798 1.00 . A A . 3 LYS HZ3 1 1 3 1955 1 1 3 LYS N N -5.368 7.873 8.539 1.00 . A A . 3 LYS N 1 1 3 1956 1 1 3 LYS NZ N -3.688 11.361 3.469 1.00 . A A . 3 LYS NZ 1 1 3 1957 1 1 3 LYS O O -4.253 5.435 7.921 1.00 . A A . 3 LYS O 1 1 3 1958 1 1 4 PHE C C -1.034 5.182 5.268 1.00 . A A . 4 PHE C 1 1 3 1959 1 1 4 PHE CA C -2.019 5.057 6.428 1.00 . A A . 4 PHE CA 1 1 3 1960 1 1 4 PHE CB C -2.934 3.849 6.201 1.00 . A A . 4 PHE CB 1 1 3 1961 1 1 4 PHE CD1 C -3.381 4.171 3.739 1.00 . A A . 4 PHE CD1 1 1 3 1962 1 1 4 PHE CD2 C -5.235 4.329 5.294 1.00 . A A . 4 PHE CD2 1 1 3 1963 1 1 4 PHE CE1 C -4.253 4.424 2.674 1.00 . A A . 4 PHE CE1 1 1 3 1964 1 1 4 PHE CE2 C -6.107 4.581 4.229 1.00 . A A . 4 PHE CE2 1 1 3 1965 1 1 4 PHE CG C -3.872 4.125 5.050 1.00 . A A . 4 PHE CG 1 1 3 1966 1 1 4 PHE CZ C -5.617 4.628 2.919 1.00 . A A . 4 PHE CZ 1 1 3 1967 1 1 4 PHE H H -2.548 7.074 5.969 1.00 . A A . 4 PHE H 1 1 3 1968 1 1 4 PHE HA H -1.472 4.934 7.349 1.00 . A A . 4 PHE HA 1 1 3 1969 1 1 4 PHE HB2 H -2.331 2.982 5.973 1.00 . A A . 4 PHE HB2 1 1 3 1970 1 1 4 PHE HB3 H -3.509 3.661 7.095 1.00 . A A . 4 PHE HB3 1 1 3 1971 1 1 4 PHE HD1 H -2.329 4.014 3.550 1.00 . A A . 4 PHE HD1 1 1 3 1972 1 1 4 PHE HD2 H -5.614 4.293 6.305 1.00 . A A . 4 PHE HD2 1 1 3 1973 1 1 4 PHE HE1 H -3.876 4.459 1.662 1.00 . A A . 4 PHE HE1 1 1 3 1974 1 1 4 PHE HE2 H -7.158 4.740 4.418 1.00 . A A . 4 PHE HE2 1 1 3 1975 1 1 4 PHE HZ H -6.291 4.823 2.097 1.00 . A A . 4 PHE HZ 1 1 3 1976 1 1 4 PHE N N -2.823 6.302 6.495 1.00 . A A . 4 PHE N 1 1 3 1977 1 1 4 PHE O O -1.041 6.155 4.542 1.00 . A A . 4 PHE O 1 1 3 1978 1 1 5 TYR C C 1.621 3.034 4.054 1.00 . A A . 5 TYR C 1 1 3 1979 1 1 5 TYR CA C 0.779 4.277 3.973 1.00 . A A . 5 TYR CA 1 1 3 1980 1 1 5 TYR CB C 1.682 5.502 4.107 1.00 . A A . 5 TYR CB 1 1 3 1981 1 1 5 TYR CD1 C 1.736 5.748 6.619 1.00 . A A . 5 TYR CD1 1 1 3 1982 1 1 5 TYR CD2 C 3.769 5.111 5.462 1.00 . A A . 5 TYR CD2 1 1 3 1983 1 1 5 TYR CE1 C 2.418 5.700 7.841 1.00 . A A . 5 TYR CE1 1 1 3 1984 1 1 5 TYR CE2 C 4.450 5.064 6.683 1.00 . A A . 5 TYR CE2 1 1 3 1985 1 1 5 TYR CG C 2.412 5.454 5.429 1.00 . A A . 5 TYR CG 1 1 3 1986 1 1 5 TYR CZ C 3.774 5.358 7.873 1.00 . A A . 5 TYR CZ 1 1 3 1987 1 1 5 TYR H H -0.196 3.420 5.668 1.00 . A A . 5 TYR H 1 1 3 1988 1 1 5 TYR HA H 0.254 4.304 3.033 1.00 . A A . 5 TYR HA 1 1 3 1989 1 1 5 TYR HB2 H 2.400 5.504 3.300 1.00 . A A . 5 TYR HB2 1 1 3 1990 1 1 5 TYR HB3 H 1.087 6.393 4.054 1.00 . A A . 5 TYR HB3 1 1 3 1991 1 1 5 TYR HD1 H 0.690 6.013 6.595 1.00 . A A . 5 TYR HD1 1 1 3 1992 1 1 5 TYR HD2 H 4.291 4.884 4.544 1.00 . A A . 5 TYR HD2 1 1 3 1993 1 1 5 TYR HE1 H 1.896 5.927 8.759 1.00 . A A . 5 TYR HE1 1 1 3 1994 1 1 5 TYR HE2 H 5.497 4.799 6.709 1.00 . A A . 5 TYR HE2 1 1 3 1995 1 1 5 TYR HH H 5.073 6.036 9.096 1.00 . A A . 5 TYR HH 1 1 3 1996 1 1 5 TYR N N -0.192 4.211 5.082 1.00 . A A . 5 TYR N 1 1 3 1997 1 1 5 TYR O O 1.358 2.156 4.850 1.00 . A A . 5 TYR O 1 1 3 1998 1 1 5 TYR OH O 4.445 5.311 9.077 1.00 . A A . 5 TYR OH 1 1 3 1999 1 1 6 VAL C C 4.906 2.003 3.364 1.00 . A A . 6 VAL C 1 1 3 2000 1 1 6 VAL CA C 3.428 1.690 3.333 1.00 . A A . 6 VAL CA 1 1 3 2001 1 1 6 VAL CB C 3.153 0.802 2.135 1.00 . A A . 6 VAL CB 1 1 3 2002 1 1 6 VAL CG1 C 3.255 -0.645 2.596 1.00 . A A . 6 VAL CG1 1 1 3 2003 1 1 6 VAL CG2 C 1.743 1.061 1.584 1.00 . A A . 6 VAL CG2 1 1 3 2004 1 1 6 VAL H H 2.828 3.629 2.598 1.00 . A A . 6 VAL H 1 1 3 2005 1 1 6 VAL HA H 3.163 1.155 4.232 1.00 . A A . 6 VAL HA 1 1 3 2006 1 1 6 VAL HB H 3.899 0.996 1.369 1.00 . A A . 6 VAL HB 1 1 3 2007 1 1 6 VAL HG11 H 3.631 -0.665 3.609 1.00 . A A . 6 VAL HG11 1 1 3 2008 1 1 6 VAL HG12 H 2.279 -1.100 2.566 1.00 . A A . 6 VAL HG12 1 1 3 2009 1 1 6 VAL HG13 H 3.930 -1.180 1.950 1.00 . A A . 6 VAL HG13 1 1 3 2010 1 1 6 VAL HG21 H 1.176 1.649 2.286 1.00 . A A . 6 VAL HG21 1 1 3 2011 1 1 6 VAL HG22 H 1.813 1.591 0.646 1.00 . A A . 6 VAL HG22 1 1 3 2012 1 1 6 VAL HG23 H 1.241 0.118 1.427 1.00 . A A . 6 VAL HG23 1 1 3 2013 1 1 6 VAL N N 2.620 2.922 3.250 1.00 . A A . 6 VAL N 1 1 3 2014 1 1 6 VAL O O 5.339 3.107 3.102 1.00 . A A . 6 VAL O 1 1 3 2015 1 1 7 ASP C C 7.773 0.338 2.637 1.00 . A A . 7 ASP C 1 1 3 2016 1 1 7 ASP CA C 7.144 1.203 3.705 1.00 . A A . 7 ASP CA 1 1 3 2017 1 1 7 ASP CB C 7.689 0.815 5.079 1.00 . A A . 7 ASP CB 1 1 3 2018 1 1 7 ASP CG C 9.218 0.796 5.035 1.00 . A A . 7 ASP CG 1 1 3 2019 1 1 7 ASP H H 5.302 0.131 3.860 1.00 . A A . 7 ASP H 1 1 3 2020 1 1 7 ASP HA H 7.376 2.225 3.495 1.00 . A A . 7 ASP HA 1 1 3 2021 1 1 7 ASP HB2 H 7.359 1.536 5.811 1.00 . A A . 7 ASP HB2 1 1 3 2022 1 1 7 ASP HB3 H 7.327 -0.165 5.349 1.00 . A A . 7 ASP HB3 1 1 3 2023 1 1 7 ASP N N 5.685 1.012 3.669 1.00 . A A . 7 ASP N 1 1 3 2024 1 1 7 ASP O O 8.122 -0.800 2.871 1.00 . A A . 7 ASP O 1 1 3 2025 1 1 7 ASP OD1 O 9.783 1.635 4.353 1.00 . A A . 7 ASP OD1 1 1 3 2026 1 1 7 ASP OD2 O 9.800 -0.059 5.683 1.00 . A A . 7 ASP OD2 1 1 3 2027 1 1 8 GLN C C 9.992 -0.253 0.661 1.00 . A A . 8 GLN C 1 1 3 2028 1 1 8 GLN CA C 8.538 0.105 0.343 1.00 . A A . 8 GLN CA 1 1 3 2029 1 1 8 GLN CB C 8.540 0.965 -0.905 1.00 . A A . 8 GLN CB 1 1 3 2030 1 1 8 GLN CD C 6.062 0.889 -0.471 1.00 . A A . 8 GLN CD 1 1 3 2031 1 1 8 GLN CG C 7.150 0.988 -1.547 1.00 . A A . 8 GLN CG 1 1 3 2032 1 1 8 GLN H H 7.609 1.792 1.311 1.00 . A A . 8 GLN H 1 1 3 2033 1 1 8 GLN HA H 7.972 -0.795 0.159 1.00 . A A . 8 GLN HA 1 1 3 2034 1 1 8 GLN HB2 H 8.834 1.973 -0.648 1.00 . A A . 8 GLN HB2 1 1 3 2035 1 1 8 GLN HB3 H 9.249 0.551 -1.597 1.00 . A A . 8 GLN HB3 1 1 3 2036 1 1 8 GLN HE21 H 5.452 -0.903 -1.071 1.00 . A A . 8 GLN HE21 1 1 3 2037 1 1 8 GLN HE22 H 4.616 -0.259 0.255 1.00 . A A . 8 GLN HE22 1 1 3 2038 1 1 8 GLN HG2 H 7.027 1.910 -2.097 1.00 . A A . 8 GLN HG2 1 1 3 2039 1 1 8 GLN HG3 H 7.058 0.153 -2.225 1.00 . A A . 8 GLN HG3 1 1 3 2040 1 1 8 GLN N N 7.919 0.874 1.463 1.00 . A A . 8 GLN N 1 1 3 2041 1 1 8 GLN NE2 N 5.314 -0.180 -0.424 1.00 . A A . 8 GLN NE2 1 1 3 2042 1 1 8 GLN O O 10.858 -0.171 -0.187 1.00 . A A . 8 GLN O 1 1 3 2043 1 1 8 GLN OE1 O 5.894 1.788 0.329 1.00 . A A . 8 GLN OE1 1 1 3 2044 1 1 9 ASP C C 11.750 -2.558 2.189 1.00 . A A . 9 ASP C 1 1 3 2045 1 1 9 ASP CA C 11.656 -1.040 2.215 1.00 . A A . 9 ASP CA 1 1 3 2046 1 1 9 ASP CB C 11.981 -0.543 3.624 1.00 . A A . 9 ASP CB 1 1 3 2047 1 1 9 ASP CG C 13.351 0.138 3.624 1.00 . A A . 9 ASP CG 1 1 3 2048 1 1 9 ASP H H 9.550 -0.734 2.512 1.00 . A A . 9 ASP H 1 1 3 2049 1 1 9 ASP HA H 12.349 -0.615 1.504 1.00 . A A . 9 ASP HA 1 1 3 2050 1 1 9 ASP HB2 H 11.226 0.159 3.943 1.00 . A A . 9 ASP HB2 1 1 3 2051 1 1 9 ASP HB3 H 12.001 -1.386 4.301 1.00 . A A . 9 ASP HB3 1 1 3 2052 1 1 9 ASP N N 10.264 -0.661 1.855 1.00 . A A . 9 ASP N 1 1 3 2053 1 1 9 ASP O O 12.793 -3.131 1.943 1.00 . A A . 9 ASP O 1 1 3 2054 1 1 9 ASP OD1 O 14.341 -0.566 3.733 1.00 . A A . 9 ASP OD1 1 1 3 2055 1 1 9 ASP OD2 O 13.386 1.353 3.515 1.00 . A A . 9 ASP OD2 1 1 3 2056 1 1 10 GLU C C 9.664 -5.191 1.384 1.00 . A A . 10 GLU C 1 1 3 2057 1 1 10 GLU CA C 10.648 -4.692 2.446 1.00 . A A . 10 GLU CA 1 1 3 2058 1 1 10 GLU CB C 10.206 -5.190 3.822 1.00 . A A . 10 GLU CB 1 1 3 2059 1 1 10 GLU CD C 11.517 -5.562 5.916 1.00 . A A . 10 GLU CD 1 1 3 2060 1 1 10 GLU CG C 11.338 -5.998 4.460 1.00 . A A . 10 GLU CG 1 1 3 2061 1 1 10 GLU H H 9.829 -2.719 2.642 1.00 . A A . 10 GLU H 1 1 3 2062 1 1 10 GLU HA H 11.639 -5.057 2.228 1.00 . A A . 10 GLU HA 1 1 3 2063 1 1 10 GLU HB2 H 9.967 -4.343 4.452 1.00 . A A . 10 GLU HB2 1 1 3 2064 1 1 10 GLU HB3 H 9.334 -5.813 3.715 1.00 . A A . 10 GLU HB3 1 1 3 2065 1 1 10 GLU HG2 H 11.093 -7.049 4.425 1.00 . A A . 10 GLU HG2 1 1 3 2066 1 1 10 GLU HG3 H 12.255 -5.822 3.918 1.00 . A A . 10 GLU HG3 1 1 3 2067 1 1 10 GLU N N 10.654 -3.210 2.446 1.00 . A A . 10 GLU N 1 1 3 2068 1 1 10 GLU O O 9.183 -6.305 1.447 1.00 . A A . 10 GLU O 1 1 3 2069 1 1 10 GLU OE1 O 12.138 -4.533 6.133 1.00 . A A . 10 GLU OE1 1 1 3 2070 1 1 10 GLU OE2 O 11.033 -6.263 6.788 1.00 . A A . 10 GLU OE2 1 1 3 2071 1 1 11 CYS C C 9.081 -5.751 -1.625 1.00 . A A . 11 CYS C 1 1 3 2072 1 1 11 CYS CA C 8.391 -4.806 -0.642 1.00 . A A . 11 CYS CA 1 1 3 2073 1 1 11 CYS CB C 7.853 -3.585 -1.397 1.00 . A A . 11 CYS CB 1 1 3 2074 1 1 11 CYS H H 9.746 -3.476 0.380 1.00 . A A . 11 CYS H 1 1 3 2075 1 1 11 CYS HA H 7.566 -5.324 -0.175 1.00 . A A . 11 CYS HA 1 1 3 2076 1 1 11 CYS HB2 H 7.184 -3.025 -0.759 1.00 . A A . 11 CYS HB2 1 1 3 2077 1 1 11 CYS HB3 H 8.675 -2.954 -1.702 1.00 . A A . 11 CYS HB3 1 1 3 2078 1 1 11 CYS N N 9.353 -4.373 0.412 1.00 . A A . 11 CYS N 1 1 3 2079 1 1 11 CYS O O 10.072 -5.412 -2.240 1.00 . A A . 11 CYS O 1 1 3 2080 1 1 11 CYS SG S 6.966 -4.023 -2.936 1.00 . A A . 11 CYS SG 1 1 3 2081 1 1 12 ILE C C 8.870 -7.483 -4.163 1.00 . A A . 12 ILE C 1 1 3 2082 1 1 12 ILE CA C 9.170 -7.912 -2.725 1.00 . A A . 12 ILE CA 1 1 3 2083 1 1 12 ILE CB C 8.580 -9.300 -2.476 1.00 . A A . 12 ILE CB 1 1 3 2084 1 1 12 ILE CD1 C 6.493 -10.657 -2.673 1.00 . A A . 12 ILE CD1 1 1 3 2085 1 1 12 ILE CG1 C 7.058 -9.237 -2.617 1.00 . A A . 12 ILE CG1 1 1 3 2086 1 1 12 ILE CG2 C 8.939 -9.764 -1.062 1.00 . A A . 12 ILE CG2 1 1 3 2087 1 1 12 ILE H H 7.755 -7.185 -1.274 1.00 . A A . 12 ILE H 1 1 3 2088 1 1 12 ILE HA H 10.238 -7.941 -2.571 1.00 . A A . 12 ILE HA 1 1 3 2089 1 1 12 ILE HB H 8.982 -9.997 -3.196 1.00 . A A . 12 ILE HB 1 1 3 2090 1 1 12 ILE HD11 H 7.070 -11.247 -3.372 1.00 . A A . 12 ILE HD11 1 1 3 2091 1 1 12 ILE HD12 H 6.548 -11.106 -1.692 1.00 . A A . 12 ILE HD12 1 1 3 2092 1 1 12 ILE HD13 H 5.463 -10.622 -2.995 1.00 . A A . 12 ILE HD13 1 1 3 2093 1 1 12 ILE HG12 H 6.640 -8.714 -1.769 1.00 . A A . 12 ILE HG12 1 1 3 2094 1 1 12 ILE HG13 H 6.803 -8.714 -3.526 1.00 . A A . 12 ILE HG13 1 1 3 2095 1 1 12 ILE HG21 H 9.729 -9.141 -0.668 1.00 . A A . 12 ILE HG21 1 1 3 2096 1 1 12 ILE HG22 H 8.070 -9.687 -0.426 1.00 . A A . 12 ILE HG22 1 1 3 2097 1 1 12 ILE HG23 H 9.272 -10.790 -1.094 1.00 . A A . 12 ILE HG23 1 1 3 2098 1 1 12 ILE N N 8.557 -6.938 -1.779 1.00 . A A . 12 ILE N 1 1 3 2099 1 1 12 ILE O O 9.360 -8.066 -5.108 1.00 . A A . 12 ILE O 1 1 3 2100 1 1 13 ALA C C 6.656 -6.871 -6.326 1.00 . A A . 13 ALA C 1 1 3 2101 1 1 13 ALA CA C 7.737 -5.981 -5.703 1.00 . A A . 13 ALA CA 1 1 3 2102 1 1 13 ALA CB C 8.993 -6.014 -6.577 1.00 . A A . 13 ALA CB 1 1 3 2103 1 1 13 ALA H H 7.689 -6.007 -3.552 1.00 . A A . 13 ALA H 1 1 3 2104 1 1 13 ALA HA H 7.372 -4.967 -5.645 1.00 . A A . 13 ALA HA 1 1 3 2105 1 1 13 ALA HB1 H 9.861 -5.811 -5.967 1.00 . A A . 13 ALA HB1 1 1 3 2106 1 1 13 ALA HB2 H 9.091 -6.988 -7.029 1.00 . A A . 13 ALA HB2 1 1 3 2107 1 1 13 ALA HB3 H 8.914 -5.264 -7.350 1.00 . A A . 13 ALA HB3 1 1 3 2108 1 1 13 ALA N N 8.070 -6.462 -4.331 1.00 . A A . 13 ALA N 1 1 3 2109 1 1 13 ALA O O 6.626 -7.076 -7.523 1.00 . A A . 13 ALA O 1 1 3 2110 1 1 14 CYS C C 3.431 -7.407 -6.326 1.00 . A A . 14 CYS C 1 1 3 2111 1 1 14 CYS CA C 4.683 -8.256 -6.094 1.00 . A A . 14 CYS CA 1 1 3 2112 1 1 14 CYS CB C 4.368 -9.403 -5.127 1.00 . A A . 14 CYS CB 1 1 3 2113 1 1 14 CYS H H 5.794 -7.213 -4.567 1.00 . A A . 14 CYS H 1 1 3 2114 1 1 14 CYS HA H 5.015 -8.665 -7.038 1.00 . A A . 14 CYS HA 1 1 3 2115 1 1 14 CYS HB2 H 4.000 -10.249 -5.689 1.00 . A A . 14 CYS HB2 1 1 3 2116 1 1 14 CYS HB3 H 5.271 -9.687 -4.607 1.00 . A A . 14 CYS HB3 1 1 3 2117 1 1 14 CYS N N 5.762 -7.394 -5.529 1.00 . A A . 14 CYS N 1 1 3 2118 1 1 14 CYS O O 3.210 -6.414 -5.662 1.00 . A A . 14 CYS O 1 1 3 2119 1 1 14 CYS SG S 3.119 -9.071 -3.831 1.00 . A A . 14 CYS SG 1 1 3 2120 1 1 15 GLU C C 0.269 -7.359 -6.596 1.00 . A A . 15 GLU C 1 1 3 2121 1 1 15 GLU CA C 1.390 -6.984 -7.569 1.00 . A A . 15 GLU CA 1 1 3 2122 1 1 15 GLU CB C 0.933 -7.267 -9.002 1.00 . A A . 15 GLU CB 1 1 3 2123 1 1 15 GLU CD C 1.163 -9.242 -10.515 1.00 . A A . 15 GLU CD 1 1 3 2124 1 1 15 GLU CG C 0.645 -8.762 -9.159 1.00 . A A . 15 GLU CG 1 1 3 2125 1 1 15 GLU H H 2.822 -8.576 -7.810 1.00 . A A . 15 GLU H 1 1 3 2126 1 1 15 GLU HA H 1.612 -5.932 -7.469 1.00 . A A . 15 GLU HA 1 1 3 2127 1 1 15 GLU HB2 H 0.036 -6.704 -9.212 1.00 . A A . 15 GLU HB2 1 1 3 2128 1 1 15 GLU HB3 H 1.711 -6.979 -9.691 1.00 . A A . 15 GLU HB3 1 1 3 2129 1 1 15 GLU HG2 H 1.140 -9.309 -8.369 1.00 . A A . 15 GLU HG2 1 1 3 2130 1 1 15 GLU HG3 H -0.420 -8.931 -9.102 1.00 . A A . 15 GLU HG3 1 1 3 2131 1 1 15 GLU N N 2.618 -7.779 -7.277 1.00 . A A . 15 GLU N 1 1 3 2132 1 1 15 GLU O O -0.849 -6.902 -6.728 1.00 . A A . 15 GLU O 1 1 3 2133 1 1 15 GLU OE1 O 1.093 -8.473 -11.461 1.00 . A A . 15 GLU OE1 1 1 3 2134 1 1 15 GLU OE2 O 1.620 -10.371 -10.587 1.00 . A A . 15 GLU OE2 1 1 3 2135 1 1 16 SER C C -1.313 -7.332 -4.245 1.00 . A A . 16 SER C 1 1 3 2136 1 1 16 SER CA C -0.511 -8.573 -4.652 1.00 . A A . 16 SER CA 1 1 3 2137 1 1 16 SER CB C 0.136 -9.190 -3.412 1.00 . A A . 16 SER CB 1 1 3 2138 1 1 16 SER H H 1.459 -8.540 -5.530 1.00 . A A . 16 SER H 1 1 3 2139 1 1 16 SER HA H -1.171 -9.293 -5.112 1.00 . A A . 16 SER HA 1 1 3 2140 1 1 16 SER HB2 H 1.065 -8.689 -3.201 1.00 . A A . 16 SER HB2 1 1 3 2141 1 1 16 SER HB3 H -0.531 -9.080 -2.567 1.00 . A A . 16 SER HB3 1 1 3 2142 1 1 16 SER HG H 1.256 -10.777 -3.291 1.00 . A A . 16 SER HG 1 1 3 2143 1 1 16 SER N N 0.551 -8.181 -5.623 1.00 . A A . 16 SER N 1 1 3 2144 1 1 16 SER O O -2.371 -7.062 -4.780 1.00 . A A . 16 SER O 1 1 3 2145 1 1 16 SER OG O 0.392 -10.568 -3.654 1.00 . A A . 16 SER OG 1 1 3 2146 1 1 17 CYS C C -1.991 -4.550 -4.090 1.00 . A A . 17 CYS C 1 1 3 2147 1 1 17 CYS CA C -1.548 -5.352 -2.865 1.00 . A A . 17 CYS CA 1 1 3 2148 1 1 17 CYS CB C -0.616 -4.494 -2.008 1.00 . A A . 17 CYS CB 1 1 3 2149 1 1 17 CYS H H 0.038 -6.811 -2.888 1.00 . A A . 17 CYS H 1 1 3 2150 1 1 17 CYS HA H -2.414 -5.636 -2.284 1.00 . A A . 17 CYS HA 1 1 3 2151 1 1 17 CYS HB2 H -1.202 -3.782 -1.444 1.00 . A A . 17 CYS HB2 1 1 3 2152 1 1 17 CYS HB3 H -0.069 -5.129 -1.327 1.00 . A A . 17 CYS HB3 1 1 3 2153 1 1 17 CYS N N -0.818 -6.576 -3.305 1.00 . A A . 17 CYS N 1 1 3 2154 1 1 17 CYS O O -3.160 -4.263 -4.271 1.00 . A A . 17 CYS O 1 1 3 2155 1 1 17 CYS SG S 0.625 -3.538 -2.958 1.00 . A A . 17 CYS SG 1 1 3 2156 1 1 18 VAL C C -2.617 -4.019 -6.851 1.00 . A A . 18 VAL C 1 1 3 2157 1 1 18 VAL CA C -1.417 -3.388 -6.138 1.00 . A A . 18 VAL CA 1 1 3 2158 1 1 18 VAL CB C -0.219 -3.360 -7.090 1.00 . A A . 18 VAL CB 1 1 3 2159 1 1 18 VAL CG1 C -0.625 -2.700 -8.408 1.00 . A A . 18 VAL CG1 1 1 3 2160 1 1 18 VAL CG2 C 0.922 -2.563 -6.451 1.00 . A A . 18 VAL CG2 1 1 3 2161 1 1 18 VAL H H -0.129 -4.419 -4.757 1.00 . A A . 18 VAL H 1 1 3 2162 1 1 18 VAL HA H -1.665 -2.377 -5.846 1.00 . A A . 18 VAL HA 1 1 3 2163 1 1 18 VAL HB H 0.110 -4.372 -7.281 1.00 . A A . 18 VAL HB 1 1 3 2164 1 1 18 VAL HG11 H -1.664 -2.410 -8.360 1.00 . A A . 18 VAL HG11 1 1 3 2165 1 1 18 VAL HG12 H -0.014 -1.827 -8.577 1.00 . A A . 18 VAL HG12 1 1 3 2166 1 1 18 VAL HG13 H -0.485 -3.400 -9.218 1.00 . A A . 18 VAL HG13 1 1 3 2167 1 1 18 VAL HG21 H 1.105 -2.933 -5.453 1.00 . A A . 18 VAL HG21 1 1 3 2168 1 1 18 VAL HG22 H 1.816 -2.674 -7.046 1.00 . A A . 18 VAL HG22 1 1 3 2169 1 1 18 VAL HG23 H 0.648 -1.519 -6.403 1.00 . A A . 18 VAL HG23 1 1 3 2170 1 1 18 VAL N N -1.064 -4.180 -4.927 1.00 . A A . 18 VAL N 1 1 3 2171 1 1 18 VAL O O -3.366 -3.345 -7.530 1.00 . A A . 18 VAL O 1 1 3 2172 1 1 19 GLU C C -5.230 -5.736 -6.587 1.00 . A A . 19 GLU C 1 1 3 2173 1 1 19 GLU CA C -3.964 -5.953 -7.400 1.00 . A A . 19 GLU CA 1 1 3 2174 1 1 19 GLU CB C -3.701 -7.451 -7.564 1.00 . A A . 19 GLU CB 1 1 3 2175 1 1 19 GLU CD C -4.457 -9.129 -9.255 1.00 . A A . 19 GLU CD 1 1 3 2176 1 1 19 GLU CG C -3.706 -7.812 -9.050 1.00 . A A . 19 GLU CG 1 1 3 2177 1 1 19 GLU H H -2.194 -5.839 -6.168 1.00 . A A . 19 GLU H 1 1 3 2178 1 1 19 GLU HA H -4.096 -5.497 -8.364 1.00 . A A . 19 GLU HA 1 1 3 2179 1 1 19 GLU HB2 H -2.741 -7.697 -7.135 1.00 . A A . 19 GLU HB2 1 1 3 2180 1 1 19 GLU HB3 H -4.475 -8.009 -7.057 1.00 . A A . 19 GLU HB3 1 1 3 2181 1 1 19 GLU HG2 H -4.195 -7.026 -9.609 1.00 . A A . 19 GLU HG2 1 1 3 2182 1 1 19 GLU HG3 H -2.690 -7.921 -9.398 1.00 . A A . 19 GLU HG3 1 1 3 2183 1 1 19 GLU N N -2.808 -5.304 -6.713 1.00 . A A . 19 GLU N 1 1 3 2184 1 1 19 GLU O O -6.283 -5.459 -7.125 1.00 . A A . 19 GLU O 1 1 3 2185 1 1 19 GLU OE1 O -3.955 -10.149 -8.812 1.00 . A A . 19 GLU OE1 1 1 3 2186 1 1 19 GLU OE2 O -5.521 -9.095 -9.851 1.00 . A A . 19 GLU OE2 1 1 3 2187 1 1 20 ILE C C -6.477 -4.078 -4.243 1.00 . A A . 20 ILE C 1 1 3 2188 1 1 20 ILE CA C -6.343 -5.587 -4.464 1.00 . A A . 20 ILE CA 1 1 3 2189 1 1 20 ILE CB C -6.198 -6.301 -3.122 1.00 . A A . 20 ILE CB 1 1 3 2190 1 1 20 ILE CD1 C -4.513 -8.076 -2.700 1.00 . A A . 20 ILE CD1 1 1 3 2191 1 1 20 ILE CG1 C -5.857 -7.750 -3.354 1.00 . A A . 20 ILE CG1 1 1 3 2192 1 1 20 ILE CG2 C -7.505 -6.207 -2.336 1.00 . A A . 20 ILE CG2 1 1 3 2193 1 1 20 ILE H H -4.278 -6.029 -4.871 1.00 . A A . 20 ILE H 1 1 3 2194 1 1 20 ILE HA H -7.218 -5.957 -4.980 1.00 . A A . 20 ILE HA 1 1 3 2195 1 1 20 ILE HB H -5.417 -5.863 -2.564 1.00 . A A . 20 ILE HB 1 1 3 2196 1 1 20 ILE HD11 H -3.865 -7.215 -2.760 1.00 . A A . 20 ILE HD11 1 1 3 2197 1 1 20 ILE HD12 H -4.671 -8.337 -1.664 1.00 . A A . 20 ILE HD12 1 1 3 2198 1 1 20 ILE HD13 H -4.055 -8.909 -3.214 1.00 . A A . 20 ILE HD13 1 1 3 2199 1 1 20 ILE HG12 H -6.621 -8.349 -2.919 1.00 . A A . 20 ILE HG12 1 1 3 2200 1 1 20 ILE HG13 H -5.794 -7.932 -4.404 1.00 . A A . 20 ILE HG13 1 1 3 2201 1 1 20 ILE HG21 H -8.132 -5.442 -2.770 1.00 . A A . 20 ILE HG21 1 1 3 2202 1 1 20 ILE HG22 H -8.017 -7.157 -2.374 1.00 . A A . 20 ILE HG22 1 1 3 2203 1 1 20 ILE HG23 H -7.289 -5.956 -1.308 1.00 . A A . 20 ILE HG23 1 1 3 2204 1 1 20 ILE N N -5.139 -5.827 -5.295 1.00 . A A . 20 ILE N 1 1 3 2205 1 1 20 ILE O O -7.227 -3.626 -3.400 1.00 . A A . 20 ILE O 1 1 3 2206 1 1 21 ALA C C -4.847 -1.142 -5.801 1.00 . A A . 21 ALA C 1 1 3 2207 1 1 21 ALA CA C -5.830 -1.813 -4.839 1.00 . A A . 21 ALA CA 1 1 3 2208 1 1 21 ALA CB C -5.468 -1.436 -3.401 1.00 . A A . 21 ALA CB 1 1 3 2209 1 1 21 ALA H H -5.147 -3.676 -5.682 1.00 . A A . 21 ALA H 1 1 3 2210 1 1 21 ALA HA H -6.834 -1.479 -5.058 1.00 . A A . 21 ALA HA 1 1 3 2211 1 1 21 ALA HB1 H -5.613 -2.290 -2.758 1.00 . A A . 21 ALA HB1 1 1 3 2212 1 1 21 ALA HB2 H -4.433 -1.126 -3.361 1.00 . A A . 21 ALA HB2 1 1 3 2213 1 1 21 ALA HB3 H -6.099 -0.624 -3.072 1.00 . A A . 21 ALA HB3 1 1 3 2214 1 1 21 ALA N N -5.748 -3.292 -5.002 1.00 . A A . 21 ALA N 1 1 3 2215 1 1 21 ALA O O -3.887 -0.527 -5.381 1.00 . A A . 21 ALA O 1 1 3 2216 1 1 22 PRO C C -4.450 0.820 -8.191 1.00 . A A . 22 PRO C 1 1 3 2217 1 1 22 PRO CA C -4.249 -0.698 -8.113 1.00 . A A . 22 PRO CA 1 1 3 2218 1 1 22 PRO CB C -4.720 -1.376 -9.399 1.00 . A A . 22 PRO CB 1 1 3 2219 1 1 22 PRO CD C -6.260 -2.020 -7.635 1.00 . A A . 22 PRO CD 1 1 3 2220 1 1 22 PRO CG C -6.135 -1.789 -9.125 1.00 . A A . 22 PRO CG 1 1 3 2221 1 1 22 PRO HA H -3.214 -0.936 -7.927 1.00 . A A . 22 PRO HA 1 1 3 2222 1 1 22 PRO HB2 H -4.649 -0.671 -10.218 1.00 . A A . 22 PRO HB2 1 1 3 2223 1 1 22 PRO HB3 H -4.093 -2.228 -9.606 1.00 . A A . 22 PRO HB3 1 1 3 2224 1 1 22 PRO HD2 H -7.197 -1.620 -7.271 1.00 . A A . 22 PRO HD2 1 1 3 2225 1 1 22 PRO HD3 H -6.183 -3.071 -7.408 1.00 . A A . 22 PRO HD3 1 1 3 2226 1 1 22 PRO HG2 H -6.809 -1.003 -9.438 1.00 . A A . 22 PRO HG2 1 1 3 2227 1 1 22 PRO HG3 H -6.357 -2.701 -9.655 1.00 . A A . 22 PRO HG3 1 1 3 2228 1 1 22 PRO N N -5.122 -1.291 -7.066 1.00 . A A . 22 PRO N 1 1 3 2229 1 1 22 PRO O O -3.849 1.492 -9.006 1.00 . A A . 22 PRO O 1 1 3 2230 1 1 23 GLY C C -4.665 3.514 -6.314 1.00 . A A . 23 GLY C 1 1 3 2231 1 1 23 GLY CA C -5.519 2.837 -7.387 1.00 . A A . 23 GLY CA 1 1 3 2232 1 1 23 GLY H H -5.763 0.810 -6.702 1.00 . A A . 23 GLY H 1 1 3 2233 1 1 23 GLY HA2 H -5.248 3.222 -8.360 1.00 . A A . 23 GLY HA2 1 1 3 2234 1 1 23 GLY HA3 H -6.560 3.044 -7.194 1.00 . A A . 23 GLY HA3 1 1 3 2235 1 1 23 GLY N N -5.288 1.366 -7.353 1.00 . A A . 23 GLY N 1 1 3 2236 1 1 23 GLY O O -4.028 4.521 -6.556 1.00 . A A . 23 GLY O 1 1 3 2237 1 1 24 ALA C C -2.405 3.029 -4.094 1.00 . A A . 24 ALA C 1 1 3 2238 1 1 24 ALA CA C -3.831 3.582 -4.042 1.00 . A A . 24 ALA CA 1 1 3 2239 1 1 24 ALA CB C -4.458 3.248 -2.687 1.00 . A A . 24 ALA CB 1 1 3 2240 1 1 24 ALA H H -5.164 2.157 -4.954 1.00 . A A . 24 ALA H 1 1 3 2241 1 1 24 ALA HA H -3.805 4.653 -4.172 1.00 . A A . 24 ALA HA 1 1 3 2242 1 1 24 ALA HB1 H -5.473 3.616 -2.660 1.00 . A A . 24 ALA HB1 1 1 3 2243 1 1 24 ALA HB2 H -4.459 2.178 -2.543 1.00 . A A . 24 ALA HB2 1 1 3 2244 1 1 24 ALA HB3 H -3.884 3.717 -1.900 1.00 . A A . 24 ALA HB3 1 1 3 2245 1 1 24 ALA N N -4.644 2.968 -5.129 1.00 . A A . 24 ALA N 1 1 3 2246 1 1 24 ALA O O -1.442 3.767 -4.033 1.00 . A A . 24 ALA O 1 1 3 2247 1 1 25 PHE C C -0.471 1.011 -5.734 1.00 . A A . 25 PHE C 1 1 3 2248 1 1 25 PHE CA C -0.898 1.142 -4.270 1.00 . A A . 25 PHE CA 1 1 3 2249 1 1 25 PHE CB C -0.925 -0.254 -3.641 1.00 . A A . 25 PHE CB 1 1 3 2250 1 1 25 PHE CD1 C 1.312 0.359 -2.628 1.00 . A A . 25 PHE CD1 1 1 3 2251 1 1 25 PHE CD2 C -0.080 -1.270 -1.495 1.00 . A A . 25 PHE CD2 1 1 3 2252 1 1 25 PHE CE1 C 2.283 0.217 -1.626 1.00 . A A . 25 PHE CE1 1 1 3 2253 1 1 25 PHE CE2 C 0.894 -1.411 -0.499 1.00 . A A . 25 PHE CE2 1 1 3 2254 1 1 25 PHE CG C 0.128 -0.385 -2.562 1.00 . A A . 25 PHE CG 1 1 3 2255 1 1 25 PHE CZ C 2.075 -0.666 -0.565 1.00 . A A . 25 PHE CZ 1 1 3 2256 1 1 25 PHE H H -3.051 1.158 -4.262 1.00 . A A . 25 PHE H 1 1 3 2257 1 1 25 PHE HA H -0.200 1.777 -3.737 1.00 . A A . 25 PHE HA 1 1 3 2258 1 1 25 PHE HB2 H -1.899 -0.434 -3.211 1.00 . A A . 25 PHE HB2 1 1 3 2259 1 1 25 PHE HB3 H -0.734 -0.986 -4.411 1.00 . A A . 25 PHE HB3 1 1 3 2260 1 1 25 PHE HD1 H 1.476 1.042 -3.448 1.00 . A A . 25 PHE HD1 1 1 3 2261 1 1 25 PHE HD2 H -0.992 -1.846 -1.442 1.00 . A A . 25 PHE HD2 1 1 3 2262 1 1 25 PHE HE1 H 3.192 0.787 -1.672 1.00 . A A . 25 PHE HE1 1 1 3 2263 1 1 25 PHE HE2 H 0.731 -2.094 0.322 1.00 . A A . 25 PHE HE2 1 1 3 2264 1 1 25 PHE HZ H 2.826 -0.775 0.203 1.00 . A A . 25 PHE HZ 1 1 3 2265 1 1 25 PHE N N -2.262 1.738 -4.211 1.00 . A A . 25 PHE N 1 1 3 2266 1 1 25 PHE O O -1.225 0.563 -6.574 1.00 . A A . 25 PHE O 1 1 3 2267 1 1 26 ALA C C 2.758 1.252 -7.451 1.00 . A A . 26 ALA C 1 1 3 2268 1 1 26 ALA CA C 1.226 1.281 -7.444 1.00 . A A . 26 ALA CA 1 1 3 2269 1 1 26 ALA CB C 0.736 2.486 -8.250 1.00 . A A . 26 ALA CB 1 1 3 2270 1 1 26 ALA H H 1.317 1.738 -5.343 1.00 . A A . 26 ALA H 1 1 3 2271 1 1 26 ALA HA H 0.847 0.373 -7.888 1.00 . A A . 26 ALA HA 1 1 3 2272 1 1 26 ALA HB1 H 0.024 3.047 -7.663 1.00 . A A . 26 ALA HB1 1 1 3 2273 1 1 26 ALA HB2 H 1.575 3.118 -8.500 1.00 . A A . 26 ALA HB2 1 1 3 2274 1 1 26 ALA HB3 H 0.261 2.143 -9.157 1.00 . A A . 26 ALA HB3 1 1 3 2275 1 1 26 ALA N N 0.734 1.389 -6.039 1.00 . A A . 26 ALA N 1 1 3 2276 1 1 26 ALA O O 3.407 2.184 -7.025 1.00 . A A . 26 ALA O 1 1 3 2277 1 1 27 MET C C 5.385 1.259 -8.802 1.00 . A A . 27 MET C 1 1 3 2278 1 1 27 MET CA C 4.833 0.104 -7.972 1.00 . A A . 27 MET CA 1 1 3 2279 1 1 27 MET CB C 5.256 -1.225 -8.608 1.00 . A A . 27 MET CB 1 1 3 2280 1 1 27 MET CE C 4.661 -3.871 -9.589 1.00 . A A . 27 MET CE 1 1 3 2281 1 1 27 MET CG C 5.434 -2.285 -7.521 1.00 . A A . 27 MET CG 1 1 3 2282 1 1 27 MET H H 2.801 -0.555 -8.278 1.00 . A A . 27 MET H 1 1 3 2283 1 1 27 MET HA H 5.218 0.166 -6.975 1.00 . A A . 27 MET HA 1 1 3 2284 1 1 27 MET HB2 H 4.496 -1.547 -9.304 1.00 . A A . 27 MET HB2 1 1 3 2285 1 1 27 MET HB3 H 6.190 -1.091 -9.133 1.00 . A A . 27 MET HB3 1 1 3 2286 1 1 27 MET HE1 H 3.717 -3.532 -9.185 1.00 . A A . 27 MET HE1 1 1 3 2287 1 1 27 MET HE2 H 4.965 -3.213 -10.388 1.00 . A A . 27 MET HE2 1 1 3 2288 1 1 27 MET HE3 H 4.554 -4.876 -9.974 1.00 . A A . 27 MET HE3 1 1 3 2289 1 1 27 MET HG2 H 6.205 -1.972 -6.834 1.00 . A A . 27 MET HG2 1 1 3 2290 1 1 27 MET HG3 H 4.505 -2.413 -6.986 1.00 . A A . 27 MET HG3 1 1 3 2291 1 1 27 MET N N 3.342 0.188 -7.936 1.00 . A A . 27 MET N 1 1 3 2292 1 1 27 MET O O 4.748 1.709 -9.734 1.00 . A A . 27 MET O 1 1 3 2293 1 1 27 MET SD S 5.913 -3.856 -8.282 1.00 . A A . 27 MET SD 1 1 3 2294 1 1 28 ASP C C 8.476 2.421 -9.790 1.00 . A A . 28 ASP C 1 1 3 2295 1 1 28 ASP CA C 7.103 2.847 -9.325 1.00 . A A . 28 ASP CA 1 1 3 2296 1 1 28 ASP CB C 7.213 4.106 -8.472 1.00 . A A . 28 ASP CB 1 1 3 2297 1 1 28 ASP CG C 6.720 5.319 -9.263 1.00 . A A . 28 ASP CG 1 1 3 2298 1 1 28 ASP H H 7.118 1.378 -7.754 1.00 . A A . 28 ASP H 1 1 3 2299 1 1 28 ASP HA H 6.460 3.027 -10.175 1.00 . A A . 28 ASP HA 1 1 3 2300 1 1 28 ASP HB2 H 6.615 3.989 -7.580 1.00 . A A . 28 ASP HB2 1 1 3 2301 1 1 28 ASP HB3 H 8.243 4.250 -8.197 1.00 . A A . 28 ASP HB3 1 1 3 2302 1 1 28 ASP N N 6.567 1.745 -8.504 1.00 . A A . 28 ASP N 1 1 3 2303 1 1 28 ASP O O 9.034 1.509 -9.220 1.00 . A A . 28 ASP O 1 1 3 2304 1 1 28 ASP OD1 O 6.032 5.118 -10.250 1.00 . A A . 28 ASP OD1 1 1 3 2305 1 1 28 ASP OD2 O 7.040 6.428 -8.868 1.00 . A A . 28 ASP OD2 1 1 3 2306 1 1 29 PRO C C 11.348 3.502 -10.486 1.00 . A A . 29 PRO C 1 1 3 2307 1 1 29 PRO CA C 10.312 2.780 -11.336 1.00 . A A . 29 PRO CA 1 1 3 2308 1 1 29 PRO CB C 10.264 3.338 -12.757 1.00 . A A . 29 PRO CB 1 1 3 2309 1 1 29 PRO CD C 8.353 4.212 -11.499 1.00 . A A . 29 PRO CD 1 1 3 2310 1 1 29 PRO CG C 9.218 4.415 -12.729 1.00 . A A . 29 PRO CG 1 1 3 2311 1 1 29 PRO HA H 10.488 1.716 -11.348 1.00 . A A . 29 PRO HA 1 1 3 2312 1 1 29 PRO HB2 H 11.241 3.724 -13.018 1.00 . A A . 29 PRO HB2 1 1 3 2313 1 1 29 PRO HB3 H 9.998 2.548 -13.441 1.00 . A A . 29 PRO HB3 1 1 3 2314 1 1 29 PRO HD2 H 8.364 5.102 -10.888 1.00 . A A . 29 PRO HD2 1 1 3 2315 1 1 29 PRO HD3 H 7.348 3.963 -11.778 1.00 . A A . 29 PRO HD3 1 1 3 2316 1 1 29 PRO HG2 H 9.697 5.383 -12.686 1.00 . A A . 29 PRO HG2 1 1 3 2317 1 1 29 PRO HG3 H 8.607 4.347 -13.616 1.00 . A A . 29 PRO HG3 1 1 3 2318 1 1 29 PRO N N 8.975 3.094 -10.794 1.00 . A A . 29 PRO N 1 1 3 2319 1 1 29 PRO O O 12.518 3.176 -10.482 1.00 . A A . 29 PRO O 1 1 3 2320 1 1 30 GLU C C 11.888 4.420 -7.531 1.00 . A A . 30 GLU C 1 1 3 2321 1 1 30 GLU CA C 11.814 5.210 -8.831 1.00 . A A . 30 GLU CA 1 1 3 2322 1 1 30 GLU CB C 11.254 6.610 -8.558 1.00 . A A . 30 GLU CB 1 1 3 2323 1 1 30 GLU CD C 12.590 8.486 -9.531 1.00 . A A . 30 GLU CD 1 1 3 2324 1 1 30 GLU CG C 12.409 7.584 -8.309 1.00 . A A . 30 GLU CG 1 1 3 2325 1 1 30 GLU H H 9.938 4.677 -9.742 1.00 . A A . 30 GLU H 1 1 3 2326 1 1 30 GLU HA H 12.795 5.280 -9.278 1.00 . A A . 30 GLU HA 1 1 3 2327 1 1 30 GLU HB2 H 10.680 6.940 -9.410 1.00 . A A . 30 GLU HB2 1 1 3 2328 1 1 30 GLU HB3 H 10.619 6.579 -7.685 1.00 . A A . 30 GLU HB3 1 1 3 2329 1 1 30 GLU HG2 H 12.186 8.191 -7.443 1.00 . A A . 30 GLU HG2 1 1 3 2330 1 1 30 GLU HG3 H 13.318 7.029 -8.136 1.00 . A A . 30 GLU HG3 1 1 3 2331 1 1 30 GLU N N 10.896 4.466 -9.734 1.00 . A A . 30 GLU N 1 1 3 2332 1 1 30 GLU O O 12.934 4.268 -6.931 1.00 . A A . 30 GLU O 1 1 3 2333 1 1 30 GLU OE1 O 12.453 7.988 -10.636 1.00 . A A . 30 GLU OE1 1 1 3 2334 1 1 30 GLU OE2 O 12.862 9.660 -9.341 1.00 . A A . 30 GLU OE2 1 1 3 2335 1 1 31 ILE C C 10.708 1.592 -6.276 1.00 . A A . 31 ILE C 1 1 3 2336 1 1 31 ILE CA C 10.745 3.060 -5.886 1.00 . A A . 31 ILE CA 1 1 3 2337 1 1 31 ILE CB C 9.517 3.397 -5.036 1.00 . A A . 31 ILE CB 1 1 3 2338 1 1 31 ILE CD1 C 7.051 3.765 -5.124 1.00 . A A . 31 ILE CD1 1 1 3 2339 1 1 31 ILE CG1 C 8.337 3.716 -5.949 1.00 . A A . 31 ILE CG1 1 1 3 2340 1 1 31 ILE CG2 C 9.821 4.610 -4.155 1.00 . A A . 31 ILE CG2 1 1 3 2341 1 1 31 ILE H H 9.956 4.003 -7.641 1.00 . A A . 31 ILE H 1 1 3 2342 1 1 31 ILE HA H 11.619 3.239 -5.324 1.00 . A A . 31 ILE HA 1 1 3 2343 1 1 31 ILE HB H 9.271 2.551 -4.410 1.00 . A A . 31 ILE HB 1 1 3 2344 1 1 31 ILE HD11 H 7.189 3.208 -4.209 1.00 . A A . 31 ILE HD11 1 1 3 2345 1 1 31 ILE HD12 H 6.814 4.792 -4.888 1.00 . A A . 31 ILE HD12 1 1 3 2346 1 1 31 ILE HD13 H 6.243 3.330 -5.692 1.00 . A A . 31 ILE HD13 1 1 3 2347 1 1 31 ILE HG12 H 8.499 4.672 -6.421 1.00 . A A . 31 ILE HG12 1 1 3 2348 1 1 31 ILE HG13 H 8.249 2.950 -6.704 1.00 . A A . 31 ILE HG13 1 1 3 2349 1 1 31 ILE HG21 H 10.886 4.789 -4.143 1.00 . A A . 31 ILE HG21 1 1 3 2350 1 1 31 ILE HG22 H 9.314 5.479 -4.549 1.00 . A A . 31 ILE HG22 1 1 3 2351 1 1 31 ILE HG23 H 9.477 4.419 -3.149 1.00 . A A . 31 ILE HG23 1 1 3 2352 1 1 31 ILE N N 10.773 3.883 -7.118 1.00 . A A . 31 ILE N 1 1 3 2353 1 1 31 ILE O O 10.711 0.725 -5.425 1.00 . A A . 31 ILE O 1 1 3 2354 1 1 32 GLU C C 9.786 -0.894 -7.037 1.00 . A A . 32 GLU C 1 1 3 2355 1 1 32 GLU CA C 10.600 -0.100 -8.040 1.00 . A A . 32 GLU CA 1 1 3 2356 1 1 32 GLU CB C 12.012 -0.681 -8.144 1.00 . A A . 32 GLU CB 1 1 3 2357 1 1 32 GLU CD C 12.097 -1.228 -10.582 1.00 . A A . 32 GLU CD 1 1 3 2358 1 1 32 GLU CG C 12.627 -0.294 -9.491 1.00 . A A . 32 GLU CG 1 1 3 2359 1 1 32 GLU H H 10.654 2.041 -8.217 1.00 . A A . 32 GLU H 1 1 3 2360 1 1 32 GLU HA H 10.115 -0.131 -9.003 1.00 . A A . 32 GLU HA 1 1 3 2361 1 1 32 GLU HB2 H 12.622 -0.289 -7.343 1.00 . A A . 32 GLU HB2 1 1 3 2362 1 1 32 GLU HB3 H 11.965 -1.757 -8.067 1.00 . A A . 32 GLU HB3 1 1 3 2363 1 1 32 GLU HG2 H 12.360 0.726 -9.729 1.00 . A A . 32 GLU HG2 1 1 3 2364 1 1 32 GLU HG3 H 13.701 -0.382 -9.436 1.00 . A A . 32 GLU HG3 1 1 3 2365 1 1 32 GLU N N 10.662 1.314 -7.563 1.00 . A A . 32 GLU N 1 1 3 2366 1 1 32 GLU O O 10.081 -2.031 -6.726 1.00 . A A . 32 GLU O 1 1 3 2367 1 1 32 GLU OE1 O 10.913 -1.160 -10.868 1.00 . A A . 32 GLU OE1 1 1 3 2368 1 1 32 GLU OE2 O 12.884 -1.994 -11.113 1.00 . A A . 32 GLU OE2 1 1 3 2369 1 1 33 LYS C C 6.606 -0.269 -5.288 1.00 . A A . 33 LYS C 1 1 3 2370 1 1 33 LYS CA C 7.957 -0.961 -5.451 1.00 . A A . 33 LYS CA 1 1 3 2371 1 1 33 LYS CB C 8.700 -0.916 -4.113 1.00 . A A . 33 LYS CB 1 1 3 2372 1 1 33 LYS CD C 10.537 -1.958 -2.778 1.00 . A A . 33 LYS CD 1 1 3 2373 1 1 33 LYS CE C 12.007 -1.537 -2.799 1.00 . A A . 33 LYS CE 1 1 3 2374 1 1 33 LYS CG C 9.942 -1.807 -4.180 1.00 . A A . 33 LYS CG 1 1 3 2375 1 1 33 LYS H H 8.586 0.674 -6.760 1.00 . A A . 33 LYS H 1 1 3 2376 1 1 33 LYS HA H 7.804 -1.991 -5.736 1.00 . A A . 33 LYS HA 1 1 3 2377 1 1 33 LYS HB2 H 8.997 0.101 -3.901 1.00 . A A . 33 LYS HB2 1 1 3 2378 1 1 33 LYS HB3 H 8.048 -1.272 -3.330 1.00 . A A . 33 LYS HB3 1 1 3 2379 1 1 33 LYS HD2 H 9.993 -1.333 -2.087 1.00 . A A . 33 LYS HD2 1 1 3 2380 1 1 33 LYS HD3 H 10.465 -2.989 -2.466 1.00 . A A . 33 LYS HD3 1 1 3 2381 1 1 33 LYS HE2 H 12.196 -0.927 -3.671 1.00 . A A . 33 LYS HE2 1 1 3 2382 1 1 33 LYS HE3 H 12.231 -0.968 -1.908 1.00 . A A . 33 LYS HE3 1 1 3 2383 1 1 33 LYS HG2 H 9.668 -2.779 -4.563 1.00 . A A . 33 LYS HG2 1 1 3 2384 1 1 33 LYS HG3 H 10.675 -1.355 -4.832 1.00 . A A . 33 LYS HG3 1 1 3 2385 1 1 33 LYS HZ1 H 12.276 -3.601 -2.874 1.00 . A A . 33 LYS HZ1 1 1 3 2386 1 1 33 LYS HZ2 H 13.471 -2.715 -3.694 1.00 . A A . 33 LYS HZ2 1 1 3 2387 1 1 33 LYS HZ3 H 13.474 -2.780 -1.997 1.00 . A A . 33 LYS HZ3 1 1 3 2388 1 1 33 LYS N N 8.780 -0.267 -6.495 1.00 . A A . 33 LYS N 1 1 3 2389 1 1 33 LYS NZ N 12.872 -2.750 -2.845 1.00 . A A . 33 LYS NZ 1 1 3 2390 1 1 33 LYS O O 6.480 0.926 -5.466 1.00 . A A . 33 LYS O 1 1 3 2391 1 1 34 ALA C C 4.278 0.663 -3.702 1.00 . A A . 34 ALA C 1 1 3 2392 1 1 34 ALA CA C 4.234 -0.424 -4.776 1.00 . A A . 34 ALA CA 1 1 3 2393 1 1 34 ALA CB C 3.251 -1.517 -4.350 1.00 . A A . 34 ALA CB 1 1 3 2394 1 1 34 ALA H H 5.720 -1.981 -4.817 1.00 . A A . 34 ALA H 1 1 3 2395 1 1 34 ALA HA H 3.904 0.008 -5.708 1.00 . A A . 34 ALA HA 1 1 3 2396 1 1 34 ALA HB1 H 3.548 -2.458 -4.790 1.00 . A A . 34 ALA HB1 1 1 3 2397 1 1 34 ALA HB2 H 3.254 -1.606 -3.273 1.00 . A A . 34 ALA HB2 1 1 3 2398 1 1 34 ALA HB3 H 2.258 -1.260 -4.687 1.00 . A A . 34 ALA HB3 1 1 3 2399 1 1 34 ALA N N 5.590 -1.020 -4.951 1.00 . A A . 34 ALA N 1 1 3 2400 1 1 34 ALA O O 4.975 0.548 -2.725 1.00 . A A . 34 ALA O 1 1 3 2401 1 1 35 TYR C C 2.067 3.368 -2.737 1.00 . A A . 35 TYR C 1 1 3 2402 1 1 35 TYR CA C 3.492 2.818 -2.875 1.00 . A A . 35 TYR CA 1 1 3 2403 1 1 35 TYR CB C 4.469 3.939 -3.284 1.00 . A A . 35 TYR CB 1 1 3 2404 1 1 35 TYR CD1 C 3.085 4.160 -5.425 1.00 . A A . 35 TYR CD1 1 1 3 2405 1 1 35 TYR CD2 C 4.555 5.972 -4.778 1.00 . A A . 35 TYR CD2 1 1 3 2406 1 1 35 TYR CE1 C 2.700 4.880 -6.562 1.00 . A A . 35 TYR CE1 1 1 3 2407 1 1 35 TYR CE2 C 4.170 6.690 -5.918 1.00 . A A . 35 TYR CE2 1 1 3 2408 1 1 35 TYR CG C 4.014 4.702 -4.524 1.00 . A A . 35 TYR CG 1 1 3 2409 1 1 35 TYR CZ C 3.242 6.143 -6.811 1.00 . A A . 35 TYR CZ 1 1 3 2410 1 1 35 TYR H H 2.968 1.753 -4.673 1.00 . A A . 35 TYR H 1 1 3 2411 1 1 35 TYR HA H 3.800 2.433 -1.910 1.00 . A A . 35 TYR HA 1 1 3 2412 1 1 35 TYR HB2 H 4.562 4.635 -2.465 1.00 . A A . 35 TYR HB2 1 1 3 2413 1 1 35 TYR HB3 H 5.437 3.500 -3.477 1.00 . A A . 35 TYR HB3 1 1 3 2414 1 1 35 TYR HD1 H 2.660 3.195 -5.246 1.00 . A A . 35 TYR HD1 1 1 3 2415 1 1 35 TYR HD2 H 5.270 6.399 -4.090 1.00 . A A . 35 TYR HD2 1 1 3 2416 1 1 35 TYR HE1 H 1.984 4.456 -7.251 1.00 . A A . 35 TYR HE1 1 1 3 2417 1 1 35 TYR HE2 H 4.588 7.668 -6.108 1.00 . A A . 35 TYR HE2 1 1 3 2418 1 1 35 TYR HH H 2.853 6.242 -8.677 1.00 . A A . 35 TYR HH 1 1 3 2419 1 1 35 TYR N N 3.523 1.707 -3.882 1.00 . A A . 35 TYR N 1 1 3 2420 1 1 35 TYR O O 1.340 3.510 -3.699 1.00 . A A . 35 TYR O 1 1 3 2421 1 1 35 TYR OH O 2.862 6.850 -7.933 1.00 . A A . 35 TYR OH 1 1 3 2422 1 1 36 VAL C C 0.249 5.655 -1.792 1.00 . A A . 36 VAL C 1 1 3 2423 1 1 36 VAL CA C 0.286 4.203 -1.319 1.00 . A A . 36 VAL CA 1 1 3 2424 1 1 36 VAL CB C -0.064 4.135 0.168 1.00 . A A . 36 VAL CB 1 1 3 2425 1 1 36 VAL CG1 C 0.791 5.138 0.947 1.00 . A A . 36 VAL CG1 1 1 3 2426 1 1 36 VAL CG2 C -1.543 4.471 0.358 1.00 . A A . 36 VAL CG2 1 1 3 2427 1 1 36 VAL H H 2.257 3.537 -0.767 1.00 . A A . 36 VAL H 1 1 3 2428 1 1 36 VAL HA H -0.423 3.617 -1.887 1.00 . A A . 36 VAL HA 1 1 3 2429 1 1 36 VAL HB H 0.130 3.137 0.536 1.00 . A A . 36 VAL HB 1 1 3 2430 1 1 36 VAL HG11 H 1.400 5.706 0.260 1.00 . A A . 36 VAL HG11 1 1 3 2431 1 1 36 VAL HG12 H 0.147 5.810 1.497 1.00 . A A . 36 VAL HG12 1 1 3 2432 1 1 36 VAL HG13 H 1.431 4.608 1.637 1.00 . A A . 36 VAL HG13 1 1 3 2433 1 1 36 VAL HG21 H -2.119 4.035 -0.446 1.00 . A A . 36 VAL HG21 1 1 3 2434 1 1 36 VAL HG22 H -1.885 4.074 1.302 1.00 . A A . 36 VAL HG22 1 1 3 2435 1 1 36 VAL HG23 H -1.671 5.542 0.351 1.00 . A A . 36 VAL HG23 1 1 3 2436 1 1 36 VAL N N 1.659 3.667 -1.532 1.00 . A A . 36 VAL N 1 1 3 2437 1 1 36 VAL O O 0.011 6.569 -1.027 1.00 . A A . 36 VAL O 1 1 3 2438 1 1 37 LYS C C -0.919 7.827 -3.629 1.00 . A A . 37 LYS C 1 1 3 2439 1 1 37 LYS CA C 0.503 7.270 -3.574 1.00 . A A . 37 LYS CA 1 1 3 2440 1 1 37 LYS CB C 1.102 7.275 -4.977 1.00 . A A . 37 LYS CB 1 1 3 2441 1 1 37 LYS CD C -0.679 7.696 -6.677 1.00 . A A . 37 LYS CD 1 1 3 2442 1 1 37 LYS CE C -1.595 7.045 -7.713 1.00 . A A . 37 LYS CE 1 1 3 2443 1 1 37 LYS CG C 0.125 6.616 -5.954 1.00 . A A . 37 LYS CG 1 1 3 2444 1 1 37 LYS H H 0.698 5.118 -3.648 1.00 . A A . 37 LYS H 1 1 3 2445 1 1 37 LYS HA H 1.105 7.892 -2.929 1.00 . A A . 37 LYS HA 1 1 3 2446 1 1 37 LYS HB2 H 1.291 8.294 -5.286 1.00 . A A . 37 LYS HB2 1 1 3 2447 1 1 37 LYS HB3 H 2.028 6.724 -4.967 1.00 . A A . 37 LYS HB3 1 1 3 2448 1 1 37 LYS HD2 H -1.276 8.240 -5.958 1.00 . A A . 37 LYS HD2 1 1 3 2449 1 1 37 LYS HD3 H -0.004 8.377 -7.173 1.00 . A A . 37 LYS HD3 1 1 3 2450 1 1 37 LYS HE2 H -0.996 6.552 -8.465 1.00 . A A . 37 LYS HE2 1 1 3 2451 1 1 37 LYS HE3 H -2.230 6.320 -7.228 1.00 . A A . 37 LYS HE3 1 1 3 2452 1 1 37 LYS HG2 H 0.677 6.032 -6.676 1.00 . A A . 37 LYS HG2 1 1 3 2453 1 1 37 LYS HG3 H -0.549 5.972 -5.409 1.00 . A A . 37 LYS HG3 1 1 3 2454 1 1 37 LYS HZ1 H -2.884 8.677 -7.624 1.00 . A A . 37 LYS HZ1 1 1 3 2455 1 1 37 LYS HZ2 H -1.843 8.692 -8.963 1.00 . A A . 37 LYS HZ2 1 1 3 2456 1 1 37 LYS HZ3 H -3.175 7.637 -8.934 1.00 . A A . 37 LYS HZ3 1 1 3 2457 1 1 37 LYS N N 0.500 5.874 -3.049 1.00 . A A . 37 LYS N 1 1 3 2458 1 1 37 LYS NZ N -2.438 8.092 -8.357 1.00 . A A . 37 LYS NZ 1 1 3 2459 1 1 37 LYS O O -1.122 9.021 -3.712 1.00 . A A . 37 LYS O 1 1 3 2460 1 1 38 ASP C C -4.155 6.760 -2.605 1.00 . A A . 38 ASP C 1 1 3 2461 1 1 38 ASP CA C -3.305 7.479 -3.652 1.00 . A A . 38 ASP CA 1 1 3 2462 1 1 38 ASP CB C -3.870 7.216 -5.048 1.00 . A A . 38 ASP CB 1 1 3 2463 1 1 38 ASP CG C -5.334 7.656 -5.098 1.00 . A A . 38 ASP CG 1 1 3 2464 1 1 38 ASP H H -1.728 6.017 -3.530 1.00 . A A . 38 ASP H 1 1 3 2465 1 1 38 ASP HA H -3.316 8.540 -3.455 1.00 . A A . 38 ASP HA 1 1 3 2466 1 1 38 ASP HB2 H -3.297 7.775 -5.776 1.00 . A A . 38 ASP HB2 1 1 3 2467 1 1 38 ASP HB3 H -3.802 6.163 -5.271 1.00 . A A . 38 ASP HB3 1 1 3 2468 1 1 38 ASP N N -1.906 6.979 -3.592 1.00 . A A . 38 ASP N 1 1 3 2469 1 1 38 ASP O O -4.943 5.890 -2.920 1.00 . A A . 38 ASP O 1 1 3 2470 1 1 38 ASP OD1 O -5.824 8.131 -4.087 1.00 . A A . 38 ASP OD1 1 1 3 2471 1 1 38 ASP OD2 O -5.942 7.508 -6.146 1.00 . A A . 38 ASP OD2 1 1 3 2472 1 1 39 VAL C C -6.287 6.508 -0.685 1.00 . A A . 39 VAL C 1 1 3 2473 1 1 39 VAL CA C -4.809 6.461 -0.295 1.00 . A A . 39 VAL CA 1 1 3 2474 1 1 39 VAL CB C -4.603 7.193 1.031 1.00 . A A . 39 VAL CB 1 1 3 2475 1 1 39 VAL CG1 C -3.106 7.363 1.299 1.00 . A A . 39 VAL CG1 1 1 3 2476 1 1 39 VAL CG2 C -5.268 8.570 0.961 1.00 . A A . 39 VAL CG2 1 1 3 2477 1 1 39 VAL H H -3.369 7.828 -1.130 1.00 . A A . 39 VAL H 1 1 3 2478 1 1 39 VAL HA H -4.496 5.432 -0.194 1.00 . A A . 39 VAL HA 1 1 3 2479 1 1 39 VAL HB H -5.047 6.619 1.832 1.00 . A A . 39 VAL HB 1 1 3 2480 1 1 39 VAL HG11 H -2.554 7.170 0.393 1.00 . A A . 39 VAL HG11 1 1 3 2481 1 1 39 VAL HG12 H -2.913 8.372 1.630 1.00 . A A . 39 VAL HG12 1 1 3 2482 1 1 39 VAL HG13 H -2.795 6.667 2.064 1.00 . A A . 39 VAL HG13 1 1 3 2483 1 1 39 VAL HG21 H -5.497 8.805 -0.067 1.00 . A A . 39 VAL HG21 1 1 3 2484 1 1 39 VAL HG22 H -6.179 8.560 1.541 1.00 . A A . 39 VAL HG22 1 1 3 2485 1 1 39 VAL HG23 H -4.595 9.314 1.360 1.00 . A A . 39 VAL HG23 1 1 3 2486 1 1 39 VAL N N -4.007 7.121 -1.361 1.00 . A A . 39 VAL N 1 1 3 2487 1 1 39 VAL O O -7.081 5.695 -0.254 1.00 . A A . 39 VAL O 1 1 3 2488 1 1 40 GLU C C -8.293 6.721 -3.202 1.00 . A A . 40 GLU C 1 1 3 2489 1 1 40 GLU CA C -8.084 7.551 -1.931 1.00 . A A . 40 GLU CA 1 1 3 2490 1 1 40 GLU CB C -8.431 9.015 -2.218 1.00 . A A . 40 GLU CB 1 1 3 2491 1 1 40 GLU CD C -7.349 11.103 -1.377 1.00 . A A . 40 GLU CD 1 1 3 2492 1 1 40 GLU CG C -8.146 9.862 -0.976 1.00 . A A . 40 GLU CG 1 1 3 2493 1 1 40 GLU H H -6.003 8.095 -1.844 1.00 . A A . 40 GLU H 1 1 3 2494 1 1 40 GLU HA H -8.723 7.176 -1.146 1.00 . A A . 40 GLU HA 1 1 3 2495 1 1 40 GLU HB2 H -7.831 9.371 -3.043 1.00 . A A . 40 GLU HB2 1 1 3 2496 1 1 40 GLU HB3 H -9.477 9.093 -2.472 1.00 . A A . 40 GLU HB3 1 1 3 2497 1 1 40 GLU HG2 H -9.080 10.162 -0.524 1.00 . A A . 40 GLU HG2 1 1 3 2498 1 1 40 GLU HG3 H -7.574 9.282 -0.267 1.00 . A A . 40 GLU HG3 1 1 3 2499 1 1 40 GLU N N -6.660 7.452 -1.505 1.00 . A A . 40 GLU N 1 1 3 2500 1 1 40 GLU O O -9.374 6.679 -3.755 1.00 . A A . 40 GLU O 1 1 3 2501 1 1 40 GLU OE1 O -6.171 10.961 -1.660 1.00 . A A . 40 GLU OE1 1 1 3 2502 1 1 40 GLU OE2 O -7.931 12.176 -1.395 1.00 . A A . 40 GLU OE2 1 1 3 2503 1 1 41 GLY C C -7.676 3.785 -4.517 1.00 . A A . 41 GLY C 1 1 3 2504 1 1 41 GLY CA C -7.410 5.239 -4.903 1.00 . A A . 41 GLY CA 1 1 3 2505 1 1 41 GLY H H -6.402 6.110 -3.210 1.00 . A A . 41 GLY H 1 1 3 2506 1 1 41 GLY HA2 H -8.236 5.615 -5.492 1.00 . A A . 41 GLY HA2 1 1 3 2507 1 1 41 GLY HA3 H -6.499 5.295 -5.480 1.00 . A A . 41 GLY HA3 1 1 3 2508 1 1 41 GLY N N -7.267 6.063 -3.669 1.00 . A A . 41 GLY N 1 1 3 2509 1 1 41 GLY O O -7.237 2.866 -5.180 1.00 . A A . 41 GLY O 1 1 3 2510 1 1 42 ALA C C -9.543 2.188 -1.753 1.00 . A A . 42 ALA C 1 1 3 2511 1 1 42 ALA CA C -8.685 2.169 -3.021 1.00 . A A . 42 ALA CA 1 1 3 2512 1 1 42 ALA CB C -7.373 1.439 -2.734 1.00 . A A . 42 ALA CB 1 1 3 2513 1 1 42 ALA H H -8.738 4.321 -2.927 1.00 . A A . 42 ALA H 1 1 3 2514 1 1 42 ALA HA H -9.218 1.656 -3.808 1.00 . A A . 42 ALA HA 1 1 3 2515 1 1 42 ALA HB1 H -6.721 1.518 -3.591 1.00 . A A . 42 ALA HB1 1 1 3 2516 1 1 42 ALA HB2 H -6.893 1.885 -1.875 1.00 . A A . 42 ALA HB2 1 1 3 2517 1 1 42 ALA HB3 H -7.577 0.397 -2.531 1.00 . A A . 42 ALA HB3 1 1 3 2518 1 1 42 ALA N N -8.392 3.567 -3.448 1.00 . A A . 42 ALA N 1 1 3 2519 1 1 42 ALA O O -9.197 2.811 -0.768 1.00 . A A . 42 ALA O 1 1 3 2520 1 1 43 SER C C -10.751 0.914 0.624 1.00 . A A . 43 SER C 1 1 3 2521 1 1 43 SER CA C -11.531 1.482 -0.564 1.00 . A A . 43 SER CA 1 1 3 2522 1 1 43 SER CB C -12.751 0.600 -0.840 1.00 . A A . 43 SER CB 1 1 3 2523 1 1 43 SER H H -10.914 1.011 -2.571 1.00 . A A . 43 SER H 1 1 3 2524 1 1 43 SER HA H -11.857 2.485 -0.335 1.00 . A A . 43 SER HA 1 1 3 2525 1 1 43 SER HB2 H -12.680 -0.307 -0.262 1.00 . A A . 43 SER HB2 1 1 3 2526 1 1 43 SER HB3 H -13.650 1.133 -0.560 1.00 . A A . 43 SER HB3 1 1 3 2527 1 1 43 SER HG H -13.702 0.333 -2.516 1.00 . A A . 43 SER HG 1 1 3 2528 1 1 43 SER N N -10.656 1.507 -1.768 1.00 . A A . 43 SER N 1 1 3 2529 1 1 43 SER O O -9.696 0.326 0.470 1.00 . A A . 43 SER O 1 1 3 2530 1 1 43 SER OG O -12.790 0.272 -2.223 1.00 . A A . 43 SER OG 1 1 3 2531 1 1 44 GLN C C -10.666 -0.964 3.037 1.00 . A A . 44 GLN C 1 1 3 2532 1 1 44 GLN CA C -10.561 0.560 3.012 1.00 . A A . 44 GLN CA 1 1 3 2533 1 1 44 GLN CB C -11.202 1.141 4.274 1.00 . A A . 44 GLN CB 1 1 3 2534 1 1 44 GLN CD C -10.365 2.345 6.302 1.00 . A A . 44 GLN CD 1 1 3 2535 1 1 44 GLN CG C -10.366 2.323 4.772 1.00 . A A . 44 GLN CG 1 1 3 2536 1 1 44 GLN H H -12.116 1.563 1.911 1.00 . A A . 44 GLN H 1 1 3 2537 1 1 44 GLN HA H -9.521 0.848 2.972 1.00 . A A . 44 GLN HA 1 1 3 2538 1 1 44 GLN HB2 H -12.203 1.476 4.048 1.00 . A A . 44 GLN HB2 1 1 3 2539 1 1 44 GLN HB3 H -11.240 0.382 5.042 1.00 . A A . 44 GLN HB3 1 1 3 2540 1 1 44 GLN HE21 H -9.927 0.415 6.472 1.00 . A A . 44 GLN HE21 1 1 3 2541 1 1 44 GLN HE22 H -10.109 1.250 7.939 1.00 . A A . 44 GLN HE22 1 1 3 2542 1 1 44 GLN HG2 H -9.352 2.222 4.412 1.00 . A A . 44 GLN HG2 1 1 3 2543 1 1 44 GLN HG3 H -10.789 3.244 4.401 1.00 . A A . 44 GLN HG3 1 1 3 2544 1 1 44 GLN N N -11.265 1.086 1.811 1.00 . A A . 44 GLN N 1 1 3 2545 1 1 44 GLN NE2 N -10.113 1.245 6.958 1.00 . A A . 44 GLN NE2 1 1 3 2546 1 1 44 GLN O O -9.739 -1.648 3.413 1.00 . A A . 44 GLN O 1 1 3 2547 1 1 44 GLN OE1 O -10.596 3.372 6.906 1.00 . A A . 44 GLN OE1 1 1 3 2548 1 1 45 GLU C C -11.082 -3.586 1.520 1.00 . A A . 45 GLU C 1 1 3 2549 1 1 45 GLU CA C -11.935 -2.990 2.640 1.00 . A A . 45 GLU CA 1 1 3 2550 1 1 45 GLU CB C -13.402 -3.359 2.413 1.00 . A A . 45 GLU CB 1 1 3 2551 1 1 45 GLU CD C -14.099 -4.235 4.648 1.00 . A A . 45 GLU CD 1 1 3 2552 1 1 45 GLU CG C -14.208 -3.056 3.679 1.00 . A A . 45 GLU CG 1 1 3 2553 1 1 45 GLU H H -12.524 -0.938 2.333 1.00 . A A . 45 GLU H 1 1 3 2554 1 1 45 GLU HA H -11.604 -3.386 3.591 1.00 . A A . 45 GLU HA 1 1 3 2555 1 1 45 GLU HB2 H -13.795 -2.782 1.589 1.00 . A A . 45 GLU HB2 1 1 3 2556 1 1 45 GLU HB3 H -13.478 -4.411 2.185 1.00 . A A . 45 GLU HB3 1 1 3 2557 1 1 45 GLU HG2 H -13.818 -2.164 4.148 1.00 . A A . 45 GLU HG2 1 1 3 2558 1 1 45 GLU HG3 H -15.243 -2.902 3.417 1.00 . A A . 45 GLU HG3 1 1 3 2559 1 1 45 GLU N N -11.785 -1.506 2.637 1.00 . A A . 45 GLU N 1 1 3 2560 1 1 45 GLU O O -10.723 -4.747 1.549 1.00 . A A . 45 GLU O 1 1 3 2561 1 1 45 GLU OE1 O -12.997 -4.721 4.838 1.00 . A A . 45 GLU OE1 1 1 3 2562 1 1 45 GLU OE2 O -15.121 -4.632 5.182 1.00 . A A . 45 GLU OE2 1 1 3 2563 1 1 46 GLU C C -8.449 -2.963 -0.191 1.00 . A A . 46 GLU C 1 1 3 2564 1 1 46 GLU CA C -9.878 -3.308 -0.554 1.00 . A A . 46 GLU CA 1 1 3 2565 1 1 46 GLU CB C -10.289 -2.651 -1.880 1.00 . A A . 46 GLU CB 1 1 3 2566 1 1 46 GLU CD C -9.784 -0.804 -3.483 1.00 . A A . 46 GLU CD 1 1 3 2567 1 1 46 GLU CG C -9.628 -1.280 -2.037 1.00 . A A . 46 GLU CG 1 1 3 2568 1 1 46 GLU H H -10.997 -1.850 0.557 1.00 . A A . 46 GLU H 1 1 3 2569 1 1 46 GLU HA H -9.984 -4.379 -0.627 1.00 . A A . 46 GLU HA 1 1 3 2570 1 1 46 GLU HB2 H -9.994 -3.286 -2.702 1.00 . A A . 46 GLU HB2 1 1 3 2571 1 1 46 GLU HB3 H -11.360 -2.528 -1.892 1.00 . A A . 46 GLU HB3 1 1 3 2572 1 1 46 GLU HG2 H -10.103 -0.574 -1.371 1.00 . A A . 46 GLU HG2 1 1 3 2573 1 1 46 GLU HG3 H -8.581 -1.354 -1.797 1.00 . A A . 46 GLU HG3 1 1 3 2574 1 1 46 GLU N N -10.729 -2.793 0.547 1.00 . A A . 46 GLU N 1 1 3 2575 1 1 46 GLU O O -7.519 -3.703 -0.445 1.00 . A A . 46 GLU O 1 1 3 2576 1 1 46 GLU OE1 O -9.066 -1.306 -4.331 1.00 . A A . 46 GLU OE1 1 1 3 2577 1 1 46 GLU OE2 O -10.618 0.054 -3.716 1.00 . A A . 46 GLU OE2 1 1 3 2578 1 1 47 VAL C C -6.465 -2.456 1.922 1.00 . A A . 47 VAL C 1 1 3 2579 1 1 47 VAL CA C -6.945 -1.430 0.894 1.00 . A A . 47 VAL CA 1 1 3 2580 1 1 47 VAL CB C -7.035 -0.047 1.535 1.00 . A A . 47 VAL CB 1 1 3 2581 1 1 47 VAL CG1 C -5.769 0.222 2.335 1.00 . A A . 47 VAL CG1 1 1 3 2582 1 1 47 VAL CG2 C -7.185 1.012 0.440 1.00 . A A . 47 VAL CG2 1 1 3 2583 1 1 47 VAL H H -9.071 -1.297 0.660 1.00 . A A . 47 VAL H 1 1 3 2584 1 1 47 VAL HA H -6.268 -1.406 0.052 1.00 . A A . 47 VAL HA 1 1 3 2585 1 1 47 VAL HB H -7.891 -0.012 2.193 1.00 . A A . 47 VAL HB 1 1 3 2586 1 1 47 VAL HG11 H -4.982 -0.431 1.988 1.00 . A A . 47 VAL HG11 1 1 3 2587 1 1 47 VAL HG12 H -5.472 1.250 2.201 1.00 . A A . 47 VAL HG12 1 1 3 2588 1 1 47 VAL HG13 H -5.960 0.034 3.380 1.00 . A A . 47 VAL HG13 1 1 3 2589 1 1 47 VAL HG21 H -7.498 0.539 -0.479 1.00 . A A . 47 VAL HG21 1 1 3 2590 1 1 47 VAL HG22 H -7.926 1.739 0.741 1.00 . A A . 47 VAL HG22 1 1 3 2591 1 1 47 VAL HG23 H -6.237 1.508 0.285 1.00 . A A . 47 VAL HG23 1 1 3 2592 1 1 47 VAL N N -8.291 -1.845 0.449 1.00 . A A . 47 VAL N 1 1 3 2593 1 1 47 VAL O O -5.360 -2.954 1.855 1.00 . A A . 47 VAL O 1 1 3 2594 1 1 48 GLU C C -6.759 -5.138 3.181 1.00 . A A . 48 GLU C 1 1 3 2595 1 1 48 GLU CA C -6.960 -3.791 3.874 1.00 . A A . 48 GLU CA 1 1 3 2596 1 1 48 GLU CB C -8.129 -3.862 4.841 1.00 . A A . 48 GLU CB 1 1 3 2597 1 1 48 GLU CD C -8.317 -4.392 7.272 1.00 . A A . 48 GLU CD 1 1 3 2598 1 1 48 GLU CG C -7.655 -3.483 6.236 1.00 . A A . 48 GLU CG 1 1 3 2599 1 1 48 GLU H H -8.202 -2.401 2.893 1.00 . A A . 48 GLU H 1 1 3 2600 1 1 48 GLU HA H -6.063 -3.497 4.395 1.00 . A A . 48 GLU HA 1 1 3 2601 1 1 48 GLU HB2 H -8.892 -3.168 4.524 1.00 . A A . 48 GLU HB2 1 1 3 2602 1 1 48 GLU HB3 H -8.532 -4.849 4.842 1.00 . A A . 48 GLU HB3 1 1 3 2603 1 1 48 GLU HG2 H -6.583 -3.589 6.287 1.00 . A A . 48 GLU HG2 1 1 3 2604 1 1 48 GLU HG3 H -7.925 -2.456 6.430 1.00 . A A . 48 GLU HG3 1 1 3 2605 1 1 48 GLU N N -7.313 -2.794 2.860 1.00 . A A . 48 GLU N 1 1 3 2606 1 1 48 GLU O O -5.746 -5.789 3.348 1.00 . A A . 48 GLU O 1 1 3 2607 1 1 48 GLU OE1 O -9.426 -4.835 7.019 1.00 . A A . 48 GLU OE1 1 1 3 2608 1 1 48 GLU OE2 O -7.708 -4.627 8.302 1.00 . A A . 48 GLU OE2 1 1 3 2609 1 1 49 GLU C C -6.213 -6.835 0.941 1.00 . A A . 49 GLU C 1 1 3 2610 1 1 49 GLU CA C -7.560 -6.846 1.664 1.00 . A A . 49 GLU CA 1 1 3 2611 1 1 49 GLU CB C -8.691 -7.002 0.644 1.00 . A A . 49 GLU CB 1 1 3 2612 1 1 49 GLU CD C -11.093 -7.661 0.414 1.00 . A A . 49 GLU CD 1 1 3 2613 1 1 49 GLU CG C -9.832 -7.811 1.266 1.00 . A A . 49 GLU CG 1 1 3 2614 1 1 49 GLU H H -8.514 -5.007 2.252 1.00 . A A . 49 GLU H 1 1 3 2615 1 1 49 GLU HA H -7.588 -7.664 2.370 1.00 . A A . 49 GLU HA 1 1 3 2616 1 1 49 GLU HB2 H -9.055 -6.025 0.359 1.00 . A A . 49 GLU HB2 1 1 3 2617 1 1 49 GLU HB3 H -8.322 -7.518 -0.228 1.00 . A A . 49 GLU HB3 1 1 3 2618 1 1 49 GLU HG2 H -9.550 -8.853 1.312 1.00 . A A . 49 GLU HG2 1 1 3 2619 1 1 49 GLU HG3 H -10.029 -7.447 2.264 1.00 . A A . 49 GLU HG3 1 1 3 2620 1 1 49 GLU N N -7.711 -5.553 2.385 1.00 . A A . 49 GLU N 1 1 3 2621 1 1 49 GLU O O -5.496 -7.816 0.918 1.00 . A A . 49 GLU O 1 1 3 2622 1 1 49 GLU OE1 O -11.120 -8.218 -0.671 1.00 . A A . 49 GLU OE1 1 1 3 2623 1 1 49 GLU OE2 O -12.010 -6.992 0.860 1.00 . A A . 49 GLU OE2 1 1 3 2624 1 1 50 ALA C C -3.433 -5.585 0.694 1.00 . A A . 50 ALA C 1 1 3 2625 1 1 50 ALA CA C -4.555 -5.616 -0.345 1.00 . A A . 50 ALA CA 1 1 3 2626 1 1 50 ALA CB C -4.516 -4.315 -1.153 1.00 . A A . 50 ALA CB 1 1 3 2627 1 1 50 ALA H H -6.452 -4.938 0.409 1.00 . A A . 50 ALA H 1 1 3 2628 1 1 50 ALA HA H -4.428 -6.463 -1.009 1.00 . A A . 50 ALA HA 1 1 3 2629 1 1 50 ALA HB1 H -5.509 -4.084 -1.510 1.00 . A A . 50 ALA HB1 1 1 3 2630 1 1 50 ALA HB2 H -4.164 -3.512 -0.523 1.00 . A A . 50 ALA HB2 1 1 3 2631 1 1 50 ALA HB3 H -3.849 -4.433 -1.994 1.00 . A A . 50 ALA HB3 1 1 3 2632 1 1 50 ALA N N -5.860 -5.718 0.364 1.00 . A A . 50 ALA N 1 1 3 2633 1 1 50 ALA O O -2.339 -6.062 0.465 1.00 . A A . 50 ALA O 1 1 3 2634 1 1 51 MET C C -2.476 -6.280 3.569 1.00 . A A . 51 MET C 1 1 3 2635 1 1 51 MET CA C -2.671 -4.914 2.904 1.00 . A A . 51 MET CA 1 1 3 2636 1 1 51 MET CB C -3.135 -3.897 3.953 1.00 . A A . 51 MET CB 1 1 3 2637 1 1 51 MET CE C -2.813 -1.273 5.921 1.00 . A A . 51 MET CE 1 1 3 2638 1 1 51 MET CG C -2.058 -3.730 5.025 1.00 . A A . 51 MET CG 1 1 3 2639 1 1 51 MET H H -4.593 -4.625 1.983 1.00 . A A . 51 MET H 1 1 3 2640 1 1 51 MET HA H -1.736 -4.586 2.475 1.00 . A A . 51 MET HA 1 1 3 2641 1 1 51 MET HB2 H -3.316 -2.947 3.473 1.00 . A A . 51 MET HB2 1 1 3 2642 1 1 51 MET HB3 H -4.046 -4.247 4.413 1.00 . A A . 51 MET HB3 1 1 3 2643 1 1 51 MET HE1 H -2.988 -1.256 4.857 1.00 . A A . 51 MET HE1 1 1 3 2644 1 1 51 MET HE2 H -3.602 -0.731 6.423 1.00 . A A . 51 MET HE2 1 1 3 2645 1 1 51 MET HE3 H -1.859 -0.810 6.133 1.00 . A A . 51 MET HE3 1 1 3 2646 1 1 51 MET HG2 H -1.643 -4.695 5.274 1.00 . A A . 51 MET HG2 1 1 3 2647 1 1 51 MET HG3 H -1.275 -3.087 4.652 1.00 . A A . 51 MET HG3 1 1 3 2648 1 1 51 MET N N -3.704 -5.008 1.834 1.00 . A A . 51 MET N 1 1 3 2649 1 1 51 MET O O -1.434 -6.565 4.125 1.00 . A A . 51 MET O 1 1 3 2650 1 1 51 MET SD S -2.792 -2.987 6.505 1.00 . A A . 51 MET SD 1 1 3 2651 1 1 52 ASP C C -2.682 -9.449 3.182 1.00 . A A . 52 ASP C 1 1 3 2652 1 1 52 ASP CA C -3.330 -8.468 4.163 1.00 . A A . 52 ASP CA 1 1 3 2653 1 1 52 ASP CB C -4.712 -8.988 4.563 1.00 . A A . 52 ASP CB 1 1 3 2654 1 1 52 ASP CG C -4.566 -10.341 5.263 1.00 . A A . 52 ASP CG 1 1 3 2655 1 1 52 ASP H H -4.304 -6.881 3.074 1.00 . A A . 52 ASP H 1 1 3 2656 1 1 52 ASP HA H -2.711 -8.382 5.043 1.00 . A A . 52 ASP HA 1 1 3 2657 1 1 52 ASP HB2 H -5.181 -8.283 5.235 1.00 . A A . 52 ASP HB2 1 1 3 2658 1 1 52 ASP HB3 H -5.323 -9.107 3.681 1.00 . A A . 52 ASP HB3 1 1 3 2659 1 1 52 ASP N N -3.468 -7.127 3.523 1.00 . A A . 52 ASP N 1 1 3 2660 1 1 52 ASP O O -2.054 -10.411 3.578 1.00 . A A . 52 ASP O 1 1 3 2661 1 1 52 ASP OD1 O -4.363 -11.325 4.572 1.00 . A A . 52 ASP OD1 1 1 3 2662 1 1 52 ASP OD2 O -4.660 -10.371 6.479 1.00 . A A . 52 ASP OD2 1 1 3 2663 1 1 53 THR C C -0.710 -9.951 0.870 1.00 . A A . 53 THR C 1 1 3 2664 1 1 53 THR CA C -2.228 -10.146 0.906 1.00 . A A . 53 THR CA 1 1 3 2665 1 1 53 THR CB C -2.812 -9.848 -0.477 1.00 . A A . 53 THR CB 1 1 3 2666 1 1 53 THR CG2 C -2.365 -8.458 -0.939 1.00 . A A . 53 THR CG2 1 1 3 2667 1 1 53 THR H H -3.345 -8.441 1.605 1.00 . A A . 53 THR H 1 1 3 2668 1 1 53 THR HA H -2.453 -11.166 1.179 1.00 . A A . 53 THR HA 1 1 3 2669 1 1 53 THR HB H -3.889 -9.876 -0.426 1.00 . A A . 53 THR HB 1 1 3 2670 1 1 53 THR HG1 H -2.534 -11.693 -1.030 1.00 . A A . 53 THR HG1 1 1 3 2671 1 1 53 THR HG21 H -1.415 -8.213 -0.488 1.00 . A A . 53 THR HG21 1 1 3 2672 1 1 53 THR HG22 H -2.265 -8.452 -2.014 1.00 . A A . 53 THR HG22 1 1 3 2673 1 1 53 THR HG23 H -3.103 -7.728 -0.644 1.00 . A A . 53 THR HG23 1 1 3 2674 1 1 53 THR N N -2.832 -9.220 1.907 1.00 . A A . 53 THR N 1 1 3 2675 1 1 53 THR O O 0.002 -10.672 0.199 1.00 . A A . 53 THR O 1 1 3 2676 1 1 53 THR OG1 O -2.356 -10.825 -1.402 1.00 . A A . 53 THR OG1 1 1 3 2677 1 1 54 CYS C C 1.954 -9.746 2.500 1.00 . A A . 54 CYS C 1 1 3 2678 1 1 54 CYS CA C 1.263 -8.740 1.577 1.00 . A A . 54 CYS CA 1 1 3 2679 1 1 54 CYS CB C 1.551 -7.321 2.072 1.00 . A A . 54 CYS CB 1 1 3 2680 1 1 54 CYS H H -0.798 -8.406 2.114 1.00 . A A . 54 CYS H 1 1 3 2681 1 1 54 CYS HA H 1.642 -8.854 0.573 1.00 . A A . 54 CYS HA 1 1 3 2682 1 1 54 CYS HB2 H 0.906 -6.623 1.562 1.00 . A A . 54 CYS HB2 1 1 3 2683 1 1 54 CYS HB3 H 1.369 -7.268 3.135 1.00 . A A . 54 CYS HB3 1 1 3 2684 1 1 54 CYS N N -0.208 -8.980 1.582 1.00 . A A . 54 CYS N 1 1 3 2685 1 1 54 CYS O O 1.440 -10.085 3.548 1.00 . A A . 54 CYS O 1 1 3 2686 1 1 54 CYS SG S 3.275 -6.767 1.802 1.00 . A A . 54 CYS SG 1 1 3 2687 1 1 55 PRO C C 4.568 -10.439 4.052 1.00 . A A . 55 PRO C 1 1 3 2688 1 1 55 PRO CA C 3.894 -11.154 2.877 1.00 . A A . 55 PRO CA 1 1 3 2689 1 1 55 PRO CB C 4.924 -11.690 1.885 1.00 . A A . 55 PRO CB 1 1 3 2690 1 1 55 PRO CD C 3.782 -9.815 0.827 1.00 . A A . 55 PRO CD 1 1 3 2691 1 1 55 PRO CG C 5.066 -10.620 0.842 1.00 . A A . 55 PRO CG 1 1 3 2692 1 1 55 PRO HA H 3.264 -11.955 3.229 1.00 . A A . 55 PRO HA 1 1 3 2693 1 1 55 PRO HB2 H 5.854 -11.878 2.406 1.00 . A A . 55 PRO HB2 1 1 3 2694 1 1 55 PRO HB3 H 4.562 -12.612 1.456 1.00 . A A . 55 PRO HB3 1 1 3 2695 1 1 55 PRO HD2 H 4.004 -8.757 0.807 1.00 . A A . 55 PRO HD2 1 1 3 2696 1 1 55 PRO HD3 H 3.175 -10.090 -0.021 1.00 . A A . 55 PRO HD3 1 1 3 2697 1 1 55 PRO HG2 H 5.902 -9.982 1.086 1.00 . A A . 55 PRO HG2 1 1 3 2698 1 1 55 PRO HG3 H 5.220 -11.074 -0.124 1.00 . A A . 55 PRO HG3 1 1 3 2699 1 1 55 PRO N N 3.109 -10.183 2.077 1.00 . A A . 55 PRO N 1 1 3 2700 1 1 55 PRO O O 4.170 -10.584 5.191 1.00 . A A . 55 PRO O 1 1 3 2701 1 1 56 VAL C C 5.368 -7.767 5.338 1.00 . A A . 56 VAL C 1 1 3 2702 1 1 56 VAL CA C 6.262 -8.923 4.886 1.00 . A A . 56 VAL CA 1 1 3 2703 1 1 56 VAL CB C 7.597 -8.374 4.383 1.00 . A A . 56 VAL CB 1 1 3 2704 1 1 56 VAL CG1 C 8.513 -8.095 5.576 1.00 . A A . 56 VAL CG1 1 1 3 2705 1 1 56 VAL CG2 C 8.259 -9.404 3.464 1.00 . A A . 56 VAL CG2 1 1 3 2706 1 1 56 VAL H H 5.879 -9.541 2.862 1.00 . A A . 56 VAL H 1 1 3 2707 1 1 56 VAL HA H 6.434 -9.593 5.716 1.00 . A A . 56 VAL HA 1 1 3 2708 1 1 56 VAL HB H 7.427 -7.458 3.838 1.00 . A A . 56 VAL HB 1 1 3 2709 1 1 56 VAL HG11 H 7.975 -8.281 6.494 1.00 . A A . 56 VAL HG11 1 1 3 2710 1 1 56 VAL HG12 H 9.377 -8.742 5.527 1.00 . A A . 56 VAL HG12 1 1 3 2711 1 1 56 VAL HG13 H 8.835 -7.064 5.550 1.00 . A A . 56 VAL HG13 1 1 3 2712 1 1 56 VAL HG21 H 7.943 -10.396 3.749 1.00 . A A . 56 VAL HG21 1 1 3 2713 1 1 56 VAL HG22 H 7.969 -9.213 2.442 1.00 . A A . 56 VAL HG22 1 1 3 2714 1 1 56 VAL HG23 H 9.333 -9.329 3.555 1.00 . A A . 56 VAL HG23 1 1 3 2715 1 1 56 VAL N N 5.578 -9.655 3.785 1.00 . A A . 56 VAL N 1 1 3 2716 1 1 56 VAL O O 5.525 -7.227 6.415 1.00 . A A . 56 VAL O 1 1 3 2717 1 1 57 GLN C C 4.245 -4.941 4.833 1.00 . A A . 57 GLN C 1 1 3 2718 1 1 57 GLN CA C 3.503 -6.278 4.886 1.00 . A A . 57 GLN CA 1 1 3 2719 1 1 57 GLN CB C 2.964 -6.505 6.299 1.00 . A A . 57 GLN CB 1 1 3 2720 1 1 57 GLN CD C 0.961 -7.366 7.519 1.00 . A A . 57 GLN CD 1 1 3 2721 1 1 57 GLN CG C 1.446 -6.679 6.241 1.00 . A A . 57 GLN CG 1 1 3 2722 1 1 57 GLN H H 4.316 -7.847 3.657 1.00 . A A . 57 GLN H 1 1 3 2723 1 1 57 GLN HA H 2.677 -6.254 4.191 1.00 . A A . 57 GLN HA 1 1 3 2724 1 1 57 GLN HB2 H 3.415 -7.393 6.717 1.00 . A A . 57 GLN HB2 1 1 3 2725 1 1 57 GLN HB3 H 3.204 -5.654 6.918 1.00 . A A . 57 GLN HB3 1 1 3 2726 1 1 57 GLN HE21 H 2.357 -8.777 7.453 1.00 . A A . 57 GLN HE21 1 1 3 2727 1 1 57 GLN HE22 H 1.285 -8.877 8.766 1.00 . A A . 57 GLN HE22 1 1 3 2728 1 1 57 GLN HG2 H 0.976 -5.709 6.151 1.00 . A A . 57 GLN HG2 1 1 3 2729 1 1 57 GLN HG3 H 1.185 -7.287 5.387 1.00 . A A . 57 GLN HG3 1 1 3 2730 1 1 57 GLN N N 4.423 -7.390 4.518 1.00 . A A . 57 GLN N 1 1 3 2731 1 1 57 GLN NE2 N 1.586 -8.429 7.948 1.00 . A A . 57 GLN NE2 1 1 3 2732 1 1 57 GLN O O 3.928 -4.081 4.037 1.00 . A A . 57 GLN O 1 1 3 2733 1 1 57 GLN OE1 O 0.008 -6.932 8.132 1.00 . A A . 57 GLN OE1 1 1 3 2734 1 1 58 CYS C C 4.985 -2.312 5.527 1.00 . A A . 58 CYS C 1 1 3 2735 1 1 58 CYS CA C 5.980 -3.464 5.684 1.00 . A A . 58 CYS CA 1 1 3 2736 1 1 58 CYS CB C 7.007 -3.409 4.534 1.00 . A A . 58 CYS CB 1 1 3 2737 1 1 58 CYS H H 5.462 -5.461 6.319 1.00 . A A . 58 CYS H 1 1 3 2738 1 1 58 CYS HA H 6.497 -3.360 6.628 1.00 . A A . 58 CYS HA 1 1 3 2739 1 1 58 CYS HB2 H 6.842 -2.514 3.955 1.00 . A A . 58 CYS HB2 1 1 3 2740 1 1 58 CYS HB3 H 8.004 -3.381 4.952 1.00 . A A . 58 CYS HB3 1 1 3 2741 1 1 58 CYS HG H 7.268 -5.600 3.885 1.00 . A A . 58 CYS HG 1 1 3 2742 1 1 58 CYS N N 5.226 -4.756 5.681 1.00 . A A . 58 CYS N 1 1 3 2743 1 1 58 CYS O O 5.247 -1.338 4.848 1.00 . A A . 58 CYS O 1 1 3 2744 1 1 58 CYS SG S 6.856 -4.854 3.445 1.00 . A A . 58 CYS SG 1 1 3 2745 1 1 59 ILE C C 2.462 -0.796 7.400 1.00 . A A . 59 ILE C 1 1 3 2746 1 1 59 ILE CA C 2.815 -1.346 6.017 1.00 . A A . 59 ILE CA 1 1 3 2747 1 1 59 ILE CB C 1.558 -1.921 5.363 1.00 . A A . 59 ILE CB 1 1 3 2748 1 1 59 ILE CD1 C -0.232 -1.181 3.782 1.00 . A A . 59 ILE CD1 1 1 3 2749 1 1 59 ILE CG1 C 0.610 -0.779 4.994 1.00 . A A . 59 ILE CG1 1 1 3 2750 1 1 59 ILE CG2 C 0.861 -2.866 6.345 1.00 . A A . 59 ILE CG2 1 1 3 2751 1 1 59 ILE H H 3.643 -3.222 6.673 1.00 . A A . 59 ILE H 1 1 3 2752 1 1 59 ILE HA H 3.205 -0.548 5.403 1.00 . A A . 59 ILE HA 1 1 3 2753 1 1 59 ILE HB H 1.832 -2.467 4.473 1.00 . A A . 59 ILE HB 1 1 3 2754 1 1 59 ILE HD11 H 0.051 -2.171 3.459 1.00 . A A . 59 ILE HD11 1 1 3 2755 1 1 59 ILE HD12 H -1.278 -1.175 4.052 1.00 . A A . 59 ILE HD12 1 1 3 2756 1 1 59 ILE HD13 H -0.065 -0.478 2.980 1.00 . A A . 59 ILE HD13 1 1 3 2757 1 1 59 ILE HG12 H -0.038 -0.566 5.831 1.00 . A A . 59 ILE HG12 1 1 3 2758 1 1 59 ILE HG13 H 1.187 0.099 4.753 1.00 . A A . 59 ILE HG13 1 1 3 2759 1 1 59 ILE HG21 H 1.594 -3.512 6.804 1.00 . A A . 59 ILE HG21 1 1 3 2760 1 1 59 ILE HG22 H 0.362 -2.287 7.109 1.00 . A A . 59 ILE HG22 1 1 3 2761 1 1 59 ILE HG23 H 0.135 -3.465 5.815 1.00 . A A . 59 ILE HG23 1 1 3 2762 1 1 59 ILE N N 3.837 -2.423 6.140 1.00 . A A . 59 ILE N 1 1 3 2763 1 1 59 ILE O O 2.646 -1.452 8.406 1.00 . A A . 59 ILE O 1 1 3 2764 1 1 60 HIS C C 0.579 2.134 8.560 1.00 . A A . 60 HIS C 1 1 3 2765 1 1 60 HIS CA C 1.586 1.002 8.772 1.00 . A A . 60 HIS CA 1 1 3 2766 1 1 60 HIS CB C 2.841 1.562 9.446 1.00 . A A . 60 HIS CB 1 1 3 2767 1 1 60 HIS CD2 C 4.396 -0.357 10.341 1.00 . A A . 60 HIS CD2 1 1 3 2768 1 1 60 HIS CE1 C 5.602 -0.640 8.564 1.00 . A A . 60 HIS CE1 1 1 3 2769 1 1 60 HIS CG C 3.938 0.534 9.403 1.00 . A A . 60 HIS CG 1 1 3 2770 1 1 60 HIS H H 1.813 0.917 6.631 1.00 . A A . 60 HIS H 1 1 3 2771 1 1 60 HIS HA H 1.149 0.243 9.401 1.00 . A A . 60 HIS HA 1 1 3 2772 1 1 60 HIS HB2 H 3.160 2.453 8.926 1.00 . A A . 60 HIS HB2 1 1 3 2773 1 1 60 HIS HB3 H 2.617 1.807 10.474 1.00 . A A . 60 HIS HB3 1 1 3 2774 1 1 60 HIS HD1 H 4.647 0.818 7.427 1.00 . A A . 60 HIS HD1 1 1 3 2775 1 1 60 HIS HD2 H 4.001 -0.466 11.340 1.00 . A A . 60 HIS HD2 1 1 3 2776 1 1 60 HIS HE1 H 6.345 -1.008 7.872 1.00 . A A . 60 HIS HE1 1 1 3 2777 1 1 60 HIS N N 1.955 0.406 7.456 1.00 . A A . 60 HIS N 1 1 3 2778 1 1 60 HIS ND1 N 4.721 0.336 8.277 1.00 . A A . 60 HIS ND1 1 1 3 2779 1 1 60 HIS NE2 N 5.447 -1.097 9.809 1.00 . A A . 60 HIS NE2 1 1 3 2780 1 1 60 HIS O O 0.762 2.993 7.720 1.00 . A A . 60 HIS O 1 1 3 2781 1 1 61 TRP C C -0.915 4.541 9.702 1.00 . A A . 61 TRP C 1 1 3 2782 1 1 61 TRP CA C -1.497 3.230 9.174 1.00 . A A . 61 TRP CA 1 1 3 2783 1 1 61 TRP CB C -2.750 2.866 9.969 1.00 . A A . 61 TRP CB 1 1 3 2784 1 1 61 TRP CD1 C -2.993 0.421 9.361 1.00 . A A . 61 TRP CD1 1 1 3 2785 1 1 61 TRP CD2 C -4.646 1.700 8.544 1.00 . A A . 61 TRP CD2 1 1 3 2786 1 1 61 TRP CE2 C -4.918 0.379 8.123 1.00 . A A . 61 TRP CE2 1 1 3 2787 1 1 61 TRP CE3 C -5.532 2.715 8.169 1.00 . A A . 61 TRP CE3 1 1 3 2788 1 1 61 TRP CG C -3.425 1.703 9.323 1.00 . A A . 61 TRP CG 1 1 3 2789 1 1 61 TRP CH2 C -6.916 1.102 6.982 1.00 . A A . 61 TRP CH2 1 1 3 2790 1 1 61 TRP CZ2 C -6.039 0.077 7.350 1.00 . A A . 61 TRP CZ2 1 1 3 2791 1 1 61 TRP CZ3 C -6.664 2.420 7.391 1.00 . A A . 61 TRP CZ3 1 1 3 2792 1 1 61 TRP H H -0.606 1.450 9.999 1.00 . A A . 61 TRP H 1 1 3 2793 1 1 61 TRP HA H -1.756 3.347 8.130 1.00 . A A . 61 TRP HA 1 1 3 2794 1 1 61 TRP HB2 H -2.480 2.610 10.978 1.00 . A A . 61 TRP HB2 1 1 3 2795 1 1 61 TRP HB3 H -3.423 3.709 9.981 1.00 . A A . 61 TRP HB3 1 1 3 2796 1 1 61 TRP HD1 H -2.104 0.071 9.863 1.00 . A A . 61 TRP HD1 1 1 3 2797 1 1 61 TRP HE1 H -3.800 -1.335 8.517 1.00 . A A . 61 TRP HE1 1 1 3 2798 1 1 61 TRP HE3 H -5.338 3.730 8.484 1.00 . A A . 61 TRP HE3 1 1 3 2799 1 1 61 TRP HH2 H -7.788 0.879 6.384 1.00 . A A . 61 TRP HH2 1 1 3 2800 1 1 61 TRP HZ2 H -6.229 -0.940 7.037 1.00 . A A . 61 TRP HZ2 1 1 3 2801 1 1 61 TRP HZ3 H -7.341 3.211 7.106 1.00 . A A . 61 TRP HZ3 1 1 3 2802 1 1 61 TRP N N -0.480 2.148 9.323 1.00 . A A . 61 TRP N 1 1 3 2803 1 1 61 TRP NE1 N -3.880 -0.367 8.647 1.00 . A A . 61 TRP NE1 1 1 3 2804 1 1 61 TRP O O 0.125 4.561 10.331 1.00 . A A . 61 TRP O 1 1 3 2805 1 1 62 GLU C C -2.189 7.762 10.540 1.00 . A A . 62 GLU C 1 1 3 2806 1 1 62 GLU CA C -1.048 6.943 9.935 1.00 . A A . 62 GLU CA 1 1 3 2807 1 1 62 GLU CB C -0.430 7.709 8.764 1.00 . A A . 62 GLU CB 1 1 3 2808 1 1 62 GLU CD C 1.332 9.475 8.898 1.00 . A A . 62 GLU CD 1 1 3 2809 1 1 62 GLU CG C -0.133 9.146 9.194 1.00 . A A . 62 GLU CG 1 1 3 2810 1 1 62 GLU H H -2.407 5.604 8.937 1.00 . A A . 62 GLU H 1 1 3 2811 1 1 62 GLU HA H -0.293 6.769 10.688 1.00 . A A . 62 GLU HA 1 1 3 2812 1 1 62 GLU HB2 H 0.489 7.225 8.464 1.00 . A A . 62 GLU HB2 1 1 3 2813 1 1 62 GLU HB3 H -1.120 7.717 7.933 1.00 . A A . 62 GLU HB3 1 1 3 2814 1 1 62 GLU HG2 H -0.773 9.825 8.649 1.00 . A A . 62 GLU HG2 1 1 3 2815 1 1 62 GLU HG3 H -0.315 9.250 10.252 1.00 . A A . 62 GLU HG3 1 1 3 2816 1 1 62 GLU N N -1.572 5.638 9.449 1.00 . A A . 62 GLU N 1 1 3 2817 1 1 62 GLU O O -3.090 8.194 9.848 1.00 . A A . 62 GLU O 1 1 3 2818 1 1 62 GLU OE1 O 1.680 9.539 7.731 1.00 . A A . 62 GLU OE1 1 1 3 2819 1 1 62 GLU OE2 O 2.081 9.657 9.844 1.00 . A A . 62 GLU OE2 1 1 3 2820 1 1 63 ASP C C -2.703 10.156 12.837 1.00 . A A . 63 ASP C 1 1 3 2821 1 1 63 ASP CA C -3.238 8.770 12.475 1.00 . A A . 63 ASP CA 1 1 3 2822 1 1 63 ASP CB C -3.698 8.052 13.746 1.00 . A A . 63 ASP CB 1 1 3 2823 1 1 63 ASP CG C -5.151 8.426 14.047 1.00 . A A . 63 ASP CG 1 1 3 2824 1 1 63 ASP H H -1.421 7.621 12.364 1.00 . A A . 63 ASP H 1 1 3 2825 1 1 63 ASP HA H -4.071 8.869 11.795 1.00 . A A . 63 ASP HA 1 1 3 2826 1 1 63 ASP HB2 H -3.622 6.983 13.603 1.00 . A A . 63 ASP HB2 1 1 3 2827 1 1 63 ASP HB3 H -3.074 8.350 14.574 1.00 . A A . 63 ASP HB3 1 1 3 2828 1 1 63 ASP N N -2.158 7.978 11.825 1.00 . A A . 63 ASP N 1 1 3 2829 1 1 63 ASP O O -3.051 10.721 13.855 1.00 . A A . 63 ASP O 1 1 3 2830 1 1 63 ASP OD1 O -5.675 9.288 13.362 1.00 . A A . 63 ASP OD1 1 1 3 2831 1 1 63 ASP OD2 O -5.715 7.842 14.958 1.00 . A A . 63 ASP OD2 1 1 3 2832 1 1 64 GLU C C -0.497 12.007 13.605 1.00 . A A . 64 GLU C 1 1 3 2833 1 1 64 GLU CA C -1.301 12.061 12.305 1.00 . A A . 64 GLU CA 1 1 3 2834 1 1 64 GLU CB C -2.446 13.065 12.453 1.00 . A A . 64 GLU CB 1 1 3 2835 1 1 64 GLU CD C -2.666 13.439 9.992 1.00 . A A . 64 GLU CD 1 1 3 2836 1 1 64 GLU CG C -2.360 14.106 11.334 1.00 . A A . 64 GLU CG 1 1 3 2837 1 1 64 GLU H H -1.592 10.240 11.194 1.00 . A A . 64 GLU H 1 1 3 2838 1 1 64 GLU HA H -0.655 12.368 11.494 1.00 . A A . 64 GLU HA 1 1 3 2839 1 1 64 GLU HB2 H -3.390 12.545 12.391 1.00 . A A . 64 GLU HB2 1 1 3 2840 1 1 64 GLU HB3 H -2.368 13.560 13.409 1.00 . A A . 64 GLU HB3 1 1 3 2841 1 1 64 GLU HG2 H -3.080 14.891 11.519 1.00 . A A . 64 GLU HG2 1 1 3 2842 1 1 64 GLU HG3 H -1.367 14.526 11.308 1.00 . A A . 64 GLU HG3 1 1 3 2843 1 1 64 GLU N N -1.859 10.711 12.010 1.00 . A A . 64 GLU N 1 1 3 2844 1 1 64 GLU OE1 O -3.700 12.802 9.891 1.00 . A A . 64 GLU OE1 1 1 3 2845 1 1 64 GLU OE2 O -1.858 13.576 9.088 1.00 . A A . 64 GLU OE2 1 1 3 2846 2 2 1 SF4 FE1 FE 5.077 -4.896 -2.295 1.00 . B A . 65 SF4 FE1 1 1 3 2847 2 2 1 SF4 FE2 FE 3.408 -6.147 -0.283 1.00 . B A . 65 SF4 FE2 1 1 3 2848 2 2 1 SF4 FE3 FE 2.510 -4.439 -2.340 1.00 . B A . 65 SF4 FE3 1 1 3 2849 2 2 1 SF4 FE4 FE 3.625 -7.122 -3.000 1.00 . B A . 65 SF4 FE4 1 1 3 2850 2 2 1 SF4 S1 S 1.633 -6.604 -1.523 1.00 . B A . 65 SF4 S1 1 1 3 2851 2 2 1 SF4 S2 S 3.949 -4.873 -3.958 1.00 . B A . 65 SF4 S2 1 1 3 2852 2 2 1 SF4 S3 S 5.249 -7.214 -1.493 1.00 . B A . 65 SF4 S3 1 1 3 2853 2 2 1 SF4 S4 S 3.928 -3.746 -0.796 1.00 . B A . 65 SF4 S4 1 1 4 2854 1 1 1 ALA C C -11.101 6.612 10.004 1.00 . A A . 1 ALA C 1 1 4 2855 1 1 1 ALA CA C -12.559 6.666 9.543 1.00 . A A . 1 ALA CA 1 1 4 2856 1 1 1 ALA CB C -12.683 7.595 8.333 1.00 . A A . 1 ALA CB 1 1 4 2857 1 1 1 ALA HA H -12.885 5.673 9.269 1.00 . A A . 1 ALA HA 1 1 4 2858 1 1 1 ALA HB1 H -13.638 8.097 8.361 1.00 . A A . 1 ALA HB1 1 1 4 2859 1 1 1 ALA HB2 H -11.890 8.328 8.359 1.00 . A A . 1 ALA HB2 1 1 4 2860 1 1 1 ALA HB3 H -12.607 7.015 7.425 1.00 . A A . 1 ALA HB3 1 1 4 2861 1 1 1 ALA N N -13.413 7.180 10.652 1.00 . A A . 1 ALA N 1 1 4 2862 1 1 1 ALA O O -10.776 6.993 11.112 1.00 . A A . 1 ALA O 1 1 4 2863 1 1 2 ARG C C -7.899 6.195 8.322 1.00 . A A . 2 ARG C 1 1 4 2864 1 1 2 ARG CA C -8.784 6.058 9.564 1.00 . A A . 2 ARG CA 1 1 4 2865 1 1 2 ARG CB C -8.521 4.709 10.236 1.00 . A A . 2 ARG CB 1 1 4 2866 1 1 2 ARG CD C -9.100 3.277 12.203 1.00 . A A . 2 ARG CD 1 1 4 2867 1 1 2 ARG CG C -9.478 4.534 11.417 1.00 . A A . 2 ARG CG 1 1 4 2868 1 1 2 ARG CZ C -9.389 0.936 11.653 1.00 . A A . 2 ARG CZ 1 1 4 2869 1 1 2 ARG H H -10.500 5.833 8.279 1.00 . A A . 2 ARG H 1 1 4 2870 1 1 2 ARG HA H -8.557 6.856 10.257 1.00 . A A . 2 ARG HA 1 1 4 2871 1 1 2 ARG HB2 H -8.680 3.915 9.521 1.00 . A A . 2 ARG HB2 1 1 4 2872 1 1 2 ARG HB3 H -7.502 4.676 10.592 1.00 . A A . 2 ARG HB3 1 1 4 2873 1 1 2 ARG HD2 H -8.052 3.061 12.055 1.00 . A A . 2 ARG HD2 1 1 4 2874 1 1 2 ARG HD3 H -9.288 3.440 13.254 1.00 . A A . 2 ARG HD3 1 1 4 2875 1 1 2 ARG HE H -10.851 2.264 11.462 1.00 . A A . 2 ARG HE 1 1 4 2876 1 1 2 ARG HG2 H -9.411 5.397 12.064 1.00 . A A . 2 ARG HG2 1 1 4 2877 1 1 2 ARG HG3 H -10.488 4.436 11.050 1.00 . A A . 2 ARG HG3 1 1 4 2878 1 1 2 ARG HH11 H -8.193 1.388 10.113 1.00 . A A . 2 ARG HH11 1 1 4 2879 1 1 2 ARG HH12 H -8.077 -0.238 10.698 1.00 . A A . 2 ARG HH12 1 1 4 2880 1 1 2 ARG HH21 H -10.463 0.203 13.177 1.00 . A A . 2 ARG HH21 1 1 4 2881 1 1 2 ARG HH22 H -9.363 -0.909 12.432 1.00 . A A . 2 ARG HH22 1 1 4 2882 1 1 2 ARG N N -10.219 6.138 9.167 1.00 . A A . 2 ARG N 1 1 4 2883 1 1 2 ARG NE N -9.917 2.126 11.723 1.00 . A A . 2 ARG NE 1 1 4 2884 1 1 2 ARG NH1 N -8.483 0.675 10.751 1.00 . A A . 2 ARG NH1 1 1 4 2885 1 1 2 ARG NH2 N -9.768 0.004 12.485 1.00 . A A . 2 ARG NH2 1 1 4 2886 1 1 2 ARG O O -8.305 5.877 7.222 1.00 . A A . 2 ARG O 1 1 4 2887 1 1 3 LYS C C -4.780 5.669 7.280 1.00 . A A . 3 LYS C 1 1 4 2888 1 1 3 LYS CA C -5.787 6.823 7.314 1.00 . A A . 3 LYS CA 1 1 4 2889 1 1 3 LYS CB C -5.039 8.154 7.420 1.00 . A A . 3 LYS CB 1 1 4 2890 1 1 3 LYS CD C -4.158 10.087 6.100 1.00 . A A . 3 LYS CD 1 1 4 2891 1 1 3 LYS CE C -3.265 10.067 4.859 1.00 . A A . 3 LYS CE 1 1 4 2892 1 1 3 LYS CG C -5.095 8.877 6.072 1.00 . A A . 3 LYS CG 1 1 4 2893 1 1 3 LYS H H -6.383 6.919 9.383 1.00 . A A . 3 LYS H 1 1 4 2894 1 1 3 LYS HA H -6.373 6.813 6.407 1.00 . A A . 3 LYS HA 1 1 4 2895 1 1 3 LYS HB2 H -5.501 8.767 8.179 1.00 . A A . 3 LYS HB2 1 1 4 2896 1 1 3 LYS HB3 H -4.009 7.967 7.683 1.00 . A A . 3 LYS HB3 1 1 4 2897 1 1 3 LYS HD2 H -4.744 10.995 6.109 1.00 . A A . 3 LYS HD2 1 1 4 2898 1 1 3 LYS HD3 H -3.543 10.046 6.986 1.00 . A A . 3 LYS HD3 1 1 4 2899 1 1 3 LYS HE2 H -2.227 10.059 5.162 1.00 . A A . 3 LYS HE2 1 1 4 2900 1 1 3 LYS HE3 H -3.476 9.182 4.277 1.00 . A A . 3 LYS HE3 1 1 4 2901 1 1 3 LYS HG2 H -4.787 8.200 5.288 1.00 . A A . 3 LYS HG2 1 1 4 2902 1 1 3 LYS HG3 H -6.104 9.210 5.884 1.00 . A A . 3 LYS HG3 1 1 4 2903 1 1 3 LYS HZ1 H -3.612 12.110 4.655 1.00 . A A . 3 LYS HZ1 1 1 4 2904 1 1 3 LYS HZ2 H -2.753 11.423 3.363 1.00 . A A . 3 LYS HZ2 1 1 4 2905 1 1 3 LYS HZ3 H -4.425 11.151 3.512 1.00 . A A . 3 LYS HZ3 1 1 4 2906 1 1 3 LYS N N -6.693 6.667 8.488 1.00 . A A . 3 LYS N 1 1 4 2907 1 1 3 LYS NZ N -3.534 11.279 4.035 1.00 . A A . 3 LYS NZ 1 1 4 2908 1 1 3 LYS O O -4.961 4.656 7.923 1.00 . A A . 3 LYS O 1 1 4 2909 1 1 4 PHE C C -1.731 5.032 5.299 1.00 . A A . 4 PHE C 1 1 4 2910 1 1 4 PHE CA C -2.699 4.738 6.448 1.00 . A A . 4 PHE CA 1 1 4 2911 1 1 4 PHE CB C -3.391 3.395 6.200 1.00 . A A . 4 PHE CB 1 1 4 2912 1 1 4 PHE CD1 C -4.028 3.553 3.764 1.00 . A A . 4 PHE CD1 1 1 4 2913 1 1 4 PHE CD2 C -5.779 3.682 5.436 1.00 . A A . 4 PHE CD2 1 1 4 2914 1 1 4 PHE CE1 C -4.984 3.692 2.752 1.00 . A A . 4 PHE CE1 1 1 4 2915 1 1 4 PHE CE2 C -6.735 3.822 4.425 1.00 . A A . 4 PHE CE2 1 1 4 2916 1 1 4 PHE CG C -4.424 3.548 5.107 1.00 . A A . 4 PHE CG 1 1 4 2917 1 1 4 PHE CZ C -6.339 3.827 3.083 1.00 . A A . 4 PHE CZ 1 1 4 2918 1 1 4 PHE H H -3.589 6.641 6.029 1.00 . A A . 4 PHE H 1 1 4 2919 1 1 4 PHE HA H -2.148 4.697 7.372 1.00 . A A . 4 PHE HA 1 1 4 2920 1 1 4 PHE HB2 H -2.656 2.663 5.898 1.00 . A A . 4 PHE HB2 1 1 4 2921 1 1 4 PHE HB3 H -3.875 3.064 7.106 1.00 . A A . 4 PHE HB3 1 1 4 2922 1 1 4 PHE HD1 H -2.983 3.450 3.510 1.00 . A A . 4 PHE HD1 1 1 4 2923 1 1 4 PHE HD2 H -6.087 3.677 6.471 1.00 . A A . 4 PHE HD2 1 1 4 2924 1 1 4 PHE HE1 H -4.679 3.696 1.717 1.00 . A A . 4 PHE HE1 1 1 4 2925 1 1 4 PHE HE2 H -7.779 3.927 4.680 1.00 . A A . 4 PHE HE2 1 1 4 2926 1 1 4 PHE HZ H -7.077 3.934 2.302 1.00 . A A . 4 PHE HZ 1 1 4 2927 1 1 4 PHE N N -3.717 5.818 6.533 1.00 . A A . 4 PHE N 1 1 4 2928 1 1 4 PHE O O -1.787 6.072 4.673 1.00 . A A . 4 PHE O 1 1 4 2929 1 1 5 TYR C C 1.063 3.132 3.926 1.00 . A A . 5 TYR C 1 1 4 2930 1 1 5 TYR CA C 0.131 4.319 3.920 1.00 . A A . 5 TYR CA 1 1 4 2931 1 1 5 TYR CB C 0.957 5.583 4.149 1.00 . A A . 5 TYR CB 1 1 4 2932 1 1 5 TYR CD1 C 1.167 5.296 6.647 1.00 . A A . 5 TYR CD1 1 1 4 2933 1 1 5 TYR CD2 C 3.187 5.379 5.306 1.00 . A A . 5 TYR CD2 1 1 4 2934 1 1 5 TYR CE1 C 1.942 5.139 7.803 1.00 . A A . 5 TYR CE1 1 1 4 2935 1 1 5 TYR CE2 C 3.960 5.220 6.461 1.00 . A A . 5 TYR CE2 1 1 4 2936 1 1 5 TYR CG C 1.790 5.417 5.399 1.00 . A A . 5 TYR CG 1 1 4 2937 1 1 5 TYR CZ C 3.339 5.100 7.709 1.00 . A A . 5 TYR CZ 1 1 4 2938 1 1 5 TYR H H -0.815 3.282 5.536 1.00 . A A . 5 TYR H 1 1 4 2939 1 1 5 TYR HA H -0.384 4.379 2.973 1.00 . A A . 5 TYR HA 1 1 4 2940 1 1 5 TYR HB2 H 1.609 5.742 3.301 1.00 . A A . 5 TYR HB2 1 1 4 2941 1 1 5 TYR HB3 H 0.304 6.424 4.256 1.00 . A A . 5 TYR HB3 1 1 4 2942 1 1 5 TYR HD1 H 0.092 5.327 6.720 1.00 . A A . 5 TYR HD1 1 1 4 2943 1 1 5 TYR HD2 H 3.666 5.472 4.342 1.00 . A A . 5 TYR HD2 1 1 4 2944 1 1 5 TYR HE1 H 1.463 5.047 8.766 1.00 . A A . 5 TYR HE1 1 1 4 2945 1 1 5 TYR HE2 H 5.038 5.191 6.389 1.00 . A A . 5 TYR HE2 1 1 4 2946 1 1 5 TYR HH H 4.582 5.760 9.000 1.00 . A A . 5 TYR HH 1 1 4 2947 1 1 5 TYR N N -0.843 4.117 5.020 1.00 . A A . 5 TYR N 1 1 4 2948 1 1 5 TYR O O 0.860 2.182 4.655 1.00 . A A . 5 TYR O 1 1 4 2949 1 1 5 TYR OH O 4.103 4.943 8.848 1.00 . A A . 5 TYR OH 1 1 4 2950 1 1 6 VAL C C 4.453 2.449 3.166 1.00 . A A . 6 VAL C 1 1 4 2951 1 1 6 VAL CA C 3.007 2.000 3.152 1.00 . A A . 6 VAL CA 1 1 4 2952 1 1 6 VAL CB C 2.804 1.130 1.919 1.00 . A A . 6 VAL CB 1 1 4 2953 1 1 6 VAL CG1 C 2.950 -0.322 2.342 1.00 . A A . 6 VAL CG1 1 1 4 2954 1 1 6 VAL CG2 C 1.410 1.346 1.322 1.00 . A A . 6 VAL CG2 1 1 4 2955 1 1 6 VAL H H 2.254 3.937 2.560 1.00 . A A . 6 VAL H 1 1 4 2956 1 1 6 VAL HA H 2.814 1.407 4.033 1.00 . A A . 6 VAL HA 1 1 4 2957 1 1 6 VAL HB H 3.566 1.373 1.183 1.00 . A A . 6 VAL HB 1 1 4 2958 1 1 6 VAL HG11 H 2.775 -0.400 3.403 1.00 . A A . 6 VAL HG11 1 1 4 2959 1 1 6 VAL HG12 H 2.229 -0.924 1.815 1.00 . A A . 6 VAL HG12 1 1 4 2960 1 1 6 VAL HG13 H 3.947 -0.663 2.116 1.00 . A A . 6 VAL HG13 1 1 4 2961 1 1 6 VAL HG21 H 0.773 1.829 2.045 1.00 . A A . 6 VAL HG21 1 1 4 2962 1 1 6 VAL HG22 H 1.488 1.963 0.440 1.00 . A A . 6 VAL HG22 1 1 4 2963 1 1 6 VAL HG23 H 0.983 0.392 1.055 1.00 . A A . 6 VAL HG23 1 1 4 2964 1 1 6 VAL N N 2.089 3.161 3.141 1.00 . A A . 6 VAL N 1 1 4 2965 1 1 6 VAL O O 4.783 3.579 2.867 1.00 . A A . 6 VAL O 1 1 4 2966 1 1 7 ASP C C 7.394 1.142 2.320 1.00 . A A . 7 ASP C 1 1 4 2967 1 1 7 ASP CA C 6.758 1.850 3.486 1.00 . A A . 7 ASP CA 1 1 4 2968 1 1 7 ASP CB C 7.397 1.379 4.789 1.00 . A A . 7 ASP CB 1 1 4 2969 1 1 7 ASP CG C 7.316 2.493 5.834 1.00 . A A . 7 ASP CG 1 1 4 2970 1 1 7 ASP H H 5.017 0.628 3.689 1.00 . A A . 7 ASP H 1 1 4 2971 1 1 7 ASP HA H 6.905 2.900 3.364 1.00 . A A . 7 ASP HA 1 1 4 2972 1 1 7 ASP HB2 H 6.871 0.509 5.143 1.00 . A A . 7 ASP HB2 1 1 4 2973 1 1 7 ASP HB3 H 8.432 1.127 4.613 1.00 . A A . 7 ASP HB3 1 1 4 2974 1 1 7 ASP N N 5.320 1.537 3.481 1.00 . A A . 7 ASP N 1 1 4 2975 1 1 7 ASP O O 7.822 0.009 2.424 1.00 . A A . 7 ASP O 1 1 4 2976 1 1 7 ASP OD1 O 7.582 3.630 5.481 1.00 . A A . 7 ASP OD1 1 1 4 2977 1 1 7 ASP OD2 O 6.992 2.191 6.971 1.00 . A A . 7 ASP OD2 1 1 4 2978 1 1 8 GLN C C 9.567 0.960 0.234 1.00 . A A . 8 GLN C 1 1 4 2979 1 1 8 GLN CA C 8.076 1.175 0.001 1.00 . A A . 8 GLN CA 1 1 4 2980 1 1 8 GLN CB C 7.912 2.082 -1.193 1.00 . A A . 8 GLN CB 1 1 4 2981 1 1 8 GLN CD C 6.531 4.091 -0.654 1.00 . A A . 8 GLN CD 1 1 4 2982 1 1 8 GLN CG C 6.501 2.668 -1.216 1.00 . A A . 8 GLN CG 1 1 4 2983 1 1 8 GLN H H 7.091 2.703 1.155 1.00 . A A . 8 GLN H 1 1 4 2984 1 1 8 GLN HA H 7.600 0.227 -0.199 1.00 . A A . 8 GLN HA 1 1 4 2985 1 1 8 GLN HB2 H 8.637 2.883 -1.141 1.00 . A A . 8 GLN HB2 1 1 4 2986 1 1 8 GLN HB3 H 8.081 1.500 -2.071 1.00 . A A . 8 GLN HB3 1 1 4 2987 1 1 8 GLN HE21 H 4.798 3.904 0.297 1.00 . A A . 8 GLN HE21 1 1 4 2988 1 1 8 GLN HE22 H 5.557 5.414 0.460 1.00 . A A . 8 GLN HE22 1 1 4 2989 1 1 8 GLN HG2 H 6.141 2.690 -2.232 1.00 . A A . 8 GLN HG2 1 1 4 2990 1 1 8 GLN HG3 H 5.846 2.058 -0.613 1.00 . A A . 8 GLN HG3 1 1 4 2991 1 1 8 GLN N N 7.458 1.798 1.202 1.00 . A A . 8 GLN N 1 1 4 2992 1 1 8 GLN NE2 N 5.547 4.503 0.097 1.00 . A A . 8 GLN NE2 1 1 4 2993 1 1 8 GLN O O 10.399 1.289 -0.588 1.00 . A A . 8 GLN O 1 1 4 2994 1 1 8 GLN OE1 O 7.460 4.833 -0.902 1.00 . A A . 8 GLN OE1 1 1 4 2995 1 1 9 ASP C C 11.549 -1.378 1.639 1.00 . A A . 9 ASP C 1 1 4 2996 1 1 9 ASP CA C 11.321 0.133 1.673 1.00 . A A . 9 ASP CA 1 1 4 2997 1 1 9 ASP CB C 11.636 0.667 3.072 1.00 . A A . 9 ASP CB 1 1 4 2998 1 1 9 ASP CG C 13.101 1.103 3.135 1.00 . A A . 9 ASP CG 1 1 4 2999 1 1 9 ASP H H 9.189 0.150 1.963 1.00 . A A . 9 ASP H 1 1 4 3000 1 1 9 ASP HA H 11.960 0.613 0.947 1.00 . A A . 9 ASP HA 1 1 4 3001 1 1 9 ASP HB2 H 10.998 1.513 3.285 1.00 . A A . 9 ASP HB2 1 1 4 3002 1 1 9 ASP HB3 H 11.463 -0.108 3.803 1.00 . A A . 9 ASP HB3 1 1 4 3003 1 1 9 ASP N N 9.895 0.402 1.344 1.00 . A A . 9 ASP N 1 1 4 3004 1 1 9 ASP O O 12.557 -1.858 1.158 1.00 . A A . 9 ASP O 1 1 4 3005 1 1 9 ASP OD1 O 13.728 1.154 2.090 1.00 . A A . 9 ASP OD1 1 1 4 3006 1 1 9 ASP OD2 O 13.572 1.379 4.225 1.00 . A A . 9 ASP OD2 1 1 4 3007 1 1 10 GLU C C 9.905 -4.174 0.979 1.00 . A A . 10 GLU C 1 1 4 3008 1 1 10 GLU CA C 10.742 -3.610 2.128 1.00 . A A . 10 GLU CA 1 1 4 3009 1 1 10 GLU CB C 10.232 -4.179 3.455 1.00 . A A . 10 GLU CB 1 1 4 3010 1 1 10 GLU CD C 12.489 -3.889 4.491 1.00 . A A . 10 GLU CD 1 1 4 3011 1 1 10 GLU CG C 11.378 -4.893 4.177 1.00 . A A . 10 GLU CG 1 1 4 3012 1 1 10 GLU H H 9.799 -1.714 2.509 1.00 . A A . 10 GLU H 1 1 4 3013 1 1 10 GLU HA H 11.778 -3.880 1.989 1.00 . A A . 10 GLU HA 1 1 4 3014 1 1 10 GLU HB2 H 9.859 -3.374 4.074 1.00 . A A . 10 GLU HB2 1 1 4 3015 1 1 10 GLU HB3 H 9.437 -4.883 3.263 1.00 . A A . 10 GLU HB3 1 1 4 3016 1 1 10 GLU HG2 H 11.010 -5.323 5.097 1.00 . A A . 10 GLU HG2 1 1 4 3017 1 1 10 GLU HG3 H 11.770 -5.675 3.545 1.00 . A A . 10 GLU HG3 1 1 4 3018 1 1 10 GLU N N 10.606 -2.128 2.136 1.00 . A A . 10 GLU N 1 1 4 3019 1 1 10 GLU O O 9.540 -5.333 0.972 1.00 . A A . 10 GLU O 1 1 4 3020 1 1 10 GLU OE1 O 12.352 -2.741 4.099 1.00 . A A . 10 GLU OE1 1 1 4 3021 1 1 10 GLU OE2 O 13.458 -4.285 5.117 1.00 . A A . 10 GLU OE2 1 1 4 3022 1 1 11 CYS C C 9.668 -4.463 -2.202 1.00 . A A . 11 CYS C 1 1 4 3023 1 1 11 CYS CA C 8.768 -3.840 -1.135 1.00 . A A . 11 CYS CA 1 1 4 3024 1 1 11 CYS CB C 8.006 -2.663 -1.751 1.00 . A A . 11 CYS CB 1 1 4 3025 1 1 11 CYS H H 9.890 -2.425 0.039 1.00 . A A . 11 CYS H 1 1 4 3026 1 1 11 CYS HA H 8.062 -4.577 -0.785 1.00 . A A . 11 CYS HA 1 1 4 3027 1 1 11 CYS HB2 H 7.216 -2.354 -1.083 1.00 . A A . 11 CYS HB2 1 1 4 3028 1 1 11 CYS HB3 H 8.683 -1.839 -1.911 1.00 . A A . 11 CYS HB3 1 1 4 3029 1 1 11 CYS N N 9.590 -3.357 0.009 1.00 . A A . 11 CYS N 1 1 4 3030 1 1 11 CYS O O 10.689 -3.916 -2.569 1.00 . A A . 11 CYS O 1 1 4 3031 1 1 11 CYS SG S 7.235 -3.068 -3.361 1.00 . A A . 11 CYS SG 1 1 4 3032 1 1 12 ILE C C 9.398 -6.065 -5.123 1.00 . A A . 12 ILE C 1 1 4 3033 1 1 12 ILE CA C 10.099 -6.253 -3.775 1.00 . A A . 12 ILE CA 1 1 4 3034 1 1 12 ILE CB C 10.237 -7.747 -3.468 1.00 . A A . 12 ILE CB 1 1 4 3035 1 1 12 ILE CD1 C 9.064 -9.948 -3.616 1.00 . A A . 12 ILE CD1 1 1 4 3036 1 1 12 ILE CG1 C 8.877 -8.430 -3.628 1.00 . A A . 12 ILE CG1 1 1 4 3037 1 1 12 ILE CG2 C 10.732 -7.929 -2.033 1.00 . A A . 12 ILE CG2 1 1 4 3038 1 1 12 ILE H H 8.449 -6.015 -2.414 1.00 . A A . 12 ILE H 1 1 4 3039 1 1 12 ILE HA H 11.077 -5.798 -3.810 1.00 . A A . 12 ILE HA 1 1 4 3040 1 1 12 ILE HB H 10.947 -8.189 -4.152 1.00 . A A . 12 ILE HB 1 1 4 3041 1 1 12 ILE HD11 H 9.796 -10.215 -2.868 1.00 . A A . 12 ILE HD11 1 1 4 3042 1 1 12 ILE HD12 H 8.122 -10.425 -3.385 1.00 . A A . 12 ILE HD12 1 1 4 3043 1 1 12 ILE HD13 H 9.405 -10.276 -4.587 1.00 . A A . 12 ILE HD13 1 1 4 3044 1 1 12 ILE HG12 H 8.231 -8.140 -2.811 1.00 . A A . 12 ILE HG12 1 1 4 3045 1 1 12 ILE HG13 H 8.431 -8.131 -4.564 1.00 . A A . 12 ILE HG13 1 1 4 3046 1 1 12 ILE HG21 H 11.090 -6.983 -1.653 1.00 . A A . 12 ILE HG21 1 1 4 3047 1 1 12 ILE HG22 H 9.921 -8.283 -1.415 1.00 . A A . 12 ILE HG22 1 1 4 3048 1 1 12 ILE HG23 H 11.538 -8.649 -2.018 1.00 . A A . 12 ILE HG23 1 1 4 3049 1 1 12 ILE N N 9.284 -5.599 -2.716 1.00 . A A . 12 ILE N 1 1 4 3050 1 1 12 ILE O O 9.921 -6.411 -6.162 1.00 . A A . 12 ILE O 1 1 4 3051 1 1 13 ALA C C 6.883 -6.621 -6.862 1.00 . A A . 13 ALA C 1 1 4 3052 1 1 13 ALA CA C 7.470 -5.294 -6.381 1.00 . A A . 13 ALA CA 1 1 4 3053 1 1 13 ALA CB C 8.425 -4.745 -7.443 1.00 . A A . 13 ALA CB 1 1 4 3054 1 1 13 ALA H H 7.808 -5.238 -4.260 1.00 . A A . 13 ALA H 1 1 4 3055 1 1 13 ALA HA H 6.671 -4.587 -6.216 1.00 . A A . 13 ALA HA 1 1 4 3056 1 1 13 ALA HB1 H 9.144 -4.089 -6.976 1.00 . A A . 13 ALA HB1 1 1 4 3057 1 1 13 ALA HB2 H 8.941 -5.563 -7.922 1.00 . A A . 13 ALA HB2 1 1 4 3058 1 1 13 ALA HB3 H 7.861 -4.193 -8.182 1.00 . A A . 13 ALA HB3 1 1 4 3059 1 1 13 ALA N N 8.211 -5.512 -5.109 1.00 . A A . 13 ALA N 1 1 4 3060 1 1 13 ALA O O 7.328 -7.187 -7.841 1.00 . A A . 13 ALA O 1 1 4 3061 1 1 14 CYS C C 3.949 -8.150 -7.320 1.00 . A A . 14 CYS C 1 1 4 3062 1 1 14 CYS CA C 5.284 -8.414 -6.620 1.00 . A A . 14 CYS CA 1 1 4 3063 1 1 14 CYS CB C 5.060 -9.325 -5.411 1.00 . A A . 14 CYS CB 1 1 4 3064 1 1 14 CYS H H 5.537 -6.657 -5.399 1.00 . A A . 14 CYS H 1 1 4 3065 1 1 14 CYS HA H 5.954 -8.902 -7.312 1.00 . A A . 14 CYS HA 1 1 4 3066 1 1 14 CYS HB2 H 4.632 -10.258 -5.747 1.00 . A A . 14 CYS HB2 1 1 4 3067 1 1 14 CYS HB3 H 6.010 -9.521 -4.937 1.00 . A A . 14 CYS HB3 1 1 4 3068 1 1 14 CYS N N 5.886 -7.125 -6.186 1.00 . A A . 14 CYS N 1 1 4 3069 1 1 14 CYS O O 3.383 -9.025 -7.944 1.00 . A A . 14 CYS O 1 1 4 3070 1 1 14 CYS SG S 3.960 -8.740 -4.068 1.00 . A A . 14 CYS SG 1 1 4 3071 1 1 15 GLU C C 0.982 -7.215 -7.106 1.00 . A A . 15 GLU C 1 1 4 3072 1 1 15 GLU CA C 2.153 -6.631 -7.903 1.00 . A A . 15 GLU CA 1 1 4 3073 1 1 15 GLU CB C 2.157 -7.228 -9.311 1.00 . A A . 15 GLU CB 1 1 4 3074 1 1 15 GLU CD C 1.912 -6.433 -11.667 1.00 . A A . 15 GLU CD 1 1 4 3075 1 1 15 GLU CG C 1.342 -6.338 -10.250 1.00 . A A . 15 GLU CG 1 1 4 3076 1 1 15 GLU H H 3.921 -6.255 -6.729 1.00 . A A . 15 GLU H 1 1 4 3077 1 1 15 GLU HA H 2.041 -5.559 -7.971 1.00 . A A . 15 GLU HA 1 1 4 3078 1 1 15 GLU HB2 H 3.174 -7.295 -9.670 1.00 . A A . 15 GLU HB2 1 1 4 3079 1 1 15 GLU HB3 H 1.721 -8.215 -9.284 1.00 . A A . 15 GLU HB3 1 1 4 3080 1 1 15 GLU HG2 H 0.311 -6.666 -10.253 1.00 . A A . 15 GLU HG2 1 1 4 3081 1 1 15 GLU HG3 H 1.393 -5.314 -9.911 1.00 . A A . 15 GLU HG3 1 1 4 3082 1 1 15 GLU N N 3.445 -6.949 -7.230 1.00 . A A . 15 GLU N 1 1 4 3083 1 1 15 GLU O O -0.164 -7.045 -7.465 1.00 . A A . 15 GLU O 1 1 4 3084 1 1 15 GLU OE1 O 2.900 -7.128 -11.840 1.00 . A A . 15 GLU OE1 1 1 4 3085 1 1 15 GLU OE2 O 1.351 -5.811 -12.553 1.00 . A A . 15 GLU OE2 1 1 4 3086 1 1 16 SER C C -0.747 -7.355 -4.697 1.00 . A A . 16 SER C 1 1 4 3087 1 1 16 SER CA C 0.141 -8.484 -5.224 1.00 . A A . 16 SER CA 1 1 4 3088 1 1 16 SER CB C 0.711 -9.275 -4.045 1.00 . A A . 16 SER CB 1 1 4 3089 1 1 16 SER H H 2.184 -8.031 -5.748 1.00 . A A . 16 SER H 1 1 4 3090 1 1 16 SER HA H -0.446 -9.142 -5.847 1.00 . A A . 16 SER HA 1 1 4 3091 1 1 16 SER HB2 H 0.076 -9.149 -3.185 1.00 . A A . 16 SER HB2 1 1 4 3092 1 1 16 SER HB3 H 0.758 -10.325 -4.306 1.00 . A A . 16 SER HB3 1 1 4 3093 1 1 16 SER HG H 2.513 -9.512 -3.353 1.00 . A A . 16 SER HG 1 1 4 3094 1 1 16 SER N N 1.254 -7.901 -6.029 1.00 . A A . 16 SER N 1 1 4 3095 1 1 16 SER O O -1.890 -7.217 -5.089 1.00 . A A . 16 SER O 1 1 4 3096 1 1 16 SER OG O 2.010 -8.790 -3.740 1.00 . A A . 16 SER OG 1 1 4 3097 1 1 17 CYS C C -1.584 -4.585 -4.430 1.00 . A A . 17 CYS C 1 1 4 3098 1 1 17 CYS CA C -1.050 -5.424 -3.270 1.00 . A A . 17 CYS CA 1 1 4 3099 1 1 17 CYS CB C -0.183 -4.547 -2.365 1.00 . A A . 17 CYS CB 1 1 4 3100 1 1 17 CYS H H 0.692 -6.669 -3.512 1.00 . A A . 17 CYS H 1 1 4 3101 1 1 17 CYS HA H -1.877 -5.823 -2.702 1.00 . A A . 17 CYS HA 1 1 4 3102 1 1 17 CYS HB2 H -0.818 -3.916 -1.760 1.00 . A A . 17 CYS HB2 1 1 4 3103 1 1 17 CYS HB3 H 0.414 -5.177 -1.722 1.00 . A A . 17 CYS HB3 1 1 4 3104 1 1 17 CYS N N -0.232 -6.543 -3.814 1.00 . A A . 17 CYS N 1 1 4 3105 1 1 17 CYS O O -2.739 -4.209 -4.460 1.00 . A A . 17 CYS O 1 1 4 3106 1 1 17 CYS SG S 0.978 -3.441 -3.251 1.00 . A A . 17 CYS SG 1 1 4 3107 1 1 18 VAL C C -2.442 -4.147 -7.171 1.00 . A A . 18 VAL C 1 1 4 3108 1 1 18 VAL CA C -1.209 -3.486 -6.553 1.00 . A A . 18 VAL CA 1 1 4 3109 1 1 18 VAL CB C -0.091 -3.414 -7.594 1.00 . A A . 18 VAL CB 1 1 4 3110 1 1 18 VAL CG1 C -0.473 -2.417 -8.690 1.00 . A A . 18 VAL CG1 1 1 4 3111 1 1 18 VAL CG2 C 1.202 -2.956 -6.915 1.00 . A A . 18 VAL CG2 1 1 4 3112 1 1 18 VAL H H 0.174 -4.612 -5.349 1.00 . A A . 18 VAL H 1 1 4 3113 1 1 18 VAL HA H -1.461 -2.487 -6.222 1.00 . A A . 18 VAL HA 1 1 4 3114 1 1 18 VAL HB H 0.057 -4.391 -8.031 1.00 . A A . 18 VAL HB 1 1 4 3115 1 1 18 VAL HG11 H -1.525 -2.184 -8.612 1.00 . A A . 18 VAL HG11 1 1 4 3116 1 1 18 VAL HG12 H 0.106 -1.514 -8.573 1.00 . A A . 18 VAL HG12 1 1 4 3117 1 1 18 VAL HG13 H -0.271 -2.852 -9.658 1.00 . A A . 18 VAL HG13 1 1 4 3118 1 1 18 VAL HG21 H 0.970 -2.232 -6.148 1.00 . A A . 18 VAL HG21 1 1 4 3119 1 1 18 VAL HG22 H 1.694 -3.807 -6.468 1.00 . A A . 18 VAL HG22 1 1 4 3120 1 1 18 VAL HG23 H 1.855 -2.506 -7.649 1.00 . A A . 18 VAL HG23 1 1 4 3121 1 1 18 VAL N N -0.752 -4.295 -5.391 1.00 . A A . 18 VAL N 1 1 4 3122 1 1 18 VAL O O -3.203 -3.519 -7.881 1.00 . A A . 18 VAL O 1 1 4 3123 1 1 19 GLU C C -5.033 -5.871 -6.562 1.00 . A A . 19 GLU C 1 1 4 3124 1 1 19 GLU CA C -3.843 -6.093 -7.478 1.00 . A A . 19 GLU CA 1 1 4 3125 1 1 19 GLU CB C -3.574 -7.592 -7.624 1.00 . A A . 19 GLU CB 1 1 4 3126 1 1 19 GLU CD C -5.655 -8.670 -8.488 1.00 . A A . 19 GLU CD 1 1 4 3127 1 1 19 GLU CG C -4.283 -8.115 -8.874 1.00 . A A . 19 GLU CG 1 1 4 3128 1 1 19 GLU H H -2.030 -5.901 -6.327 1.00 . A A . 19 GLU H 1 1 4 3129 1 1 19 GLU HA H -4.065 -5.665 -8.438 1.00 . A A . 19 GLU HA 1 1 4 3130 1 1 19 GLU HB2 H -2.510 -7.760 -7.714 1.00 . A A . 19 GLU HB2 1 1 4 3131 1 1 19 GLU HB3 H -3.949 -8.111 -6.755 1.00 . A A . 19 GLU HB3 1 1 4 3132 1 1 19 GLU HG2 H -4.405 -7.307 -9.581 1.00 . A A . 19 GLU HG2 1 1 4 3133 1 1 19 GLU HG3 H -3.692 -8.898 -9.322 1.00 . A A . 19 GLU HG3 1 1 4 3134 1 1 19 GLU N N -2.652 -5.409 -6.904 1.00 . A A . 19 GLU N 1 1 4 3135 1 1 19 GLU O O -6.127 -5.587 -7.007 1.00 . A A . 19 GLU O 1 1 4 3136 1 1 19 GLU OE1 O -6.393 -7.962 -7.824 1.00 . A A . 19 GLU OE1 1 1 4 3137 1 1 19 GLU OE2 O -5.943 -9.795 -8.862 1.00 . A A . 19 GLU OE2 1 1 4 3138 1 1 20 ILE C C -6.020 -4.190 -4.102 1.00 . A A . 20 ILE C 1 1 4 3139 1 1 20 ILE CA C -5.953 -5.698 -4.350 1.00 . A A . 20 ILE CA 1 1 4 3140 1 1 20 ILE CB C -5.727 -6.439 -3.033 1.00 . A A . 20 ILE CB 1 1 4 3141 1 1 20 ILE CD1 C -3.992 -8.180 -2.679 1.00 . A A . 20 ILE CD1 1 1 4 3142 1 1 20 ILE CG1 C -5.346 -7.869 -3.315 1.00 . A A . 20 ILE CG1 1 1 4 3143 1 1 20 ILE CG2 C -7.005 -6.411 -2.196 1.00 . A A . 20 ILE CG2 1 1 4 3144 1 1 20 ILE H H -3.935 -6.155 -4.933 1.00 . A A . 20 ILE H 1 1 4 3145 1 1 20 ILE HA H -6.878 -6.032 -4.801 1.00 . A A . 20 ILE HA 1 1 4 3146 1 1 20 ILE HB H -4.940 -5.986 -2.493 1.00 . A A . 20 ILE HB 1 1 4 3147 1 1 20 ILE HD11 H -3.334 -7.334 -2.806 1.00 . A A . 20 ILE HD11 1 1 4 3148 1 1 20 ILE HD12 H -4.127 -8.376 -1.625 1.00 . A A . 20 ILE HD12 1 1 4 3149 1 1 20 ILE HD13 H -3.561 -9.049 -3.155 1.00 . A A . 20 ILE HD13 1 1 4 3150 1 1 20 ILE HG12 H -6.091 -8.502 -2.899 1.00 . A A . 20 ILE HG12 1 1 4 3151 1 1 20 ILE HG13 H -5.283 -8.013 -4.371 1.00 . A A . 20 ILE HG13 1 1 4 3152 1 1 20 ILE HG21 H -7.730 -5.764 -2.668 1.00 . A A . 20 ILE HG21 1 1 4 3153 1 1 20 ILE HG22 H -7.408 -7.410 -2.122 1.00 . A A . 20 ILE HG22 1 1 4 3154 1 1 20 ILE HG23 H -6.779 -6.040 -1.207 1.00 . A A . 20 ILE HG23 1 1 4 3155 1 1 20 ILE N N -4.829 -5.955 -5.280 1.00 . A A . 20 ILE N 1 1 4 3156 1 1 20 ILE O O -6.646 -3.728 -3.169 1.00 . A A . 20 ILE O 1 1 4 3157 1 1 21 ALA C C -4.605 -1.290 -5.911 1.00 . A A . 21 ALA C 1 1 4 3158 1 1 21 ALA CA C -5.386 -1.937 -4.766 1.00 . A A . 21 ALA CA 1 1 4 3159 1 1 21 ALA CB C -4.733 -1.571 -3.431 1.00 . A A . 21 ALA CB 1 1 4 3160 1 1 21 ALA H H -4.869 -3.811 -5.693 1.00 . A A . 21 ALA H 1 1 4 3161 1 1 21 ALA HA H -6.407 -1.583 -4.778 1.00 . A A . 21 ALA HA 1 1 4 3162 1 1 21 ALA HB1 H -5.107 -2.224 -2.655 1.00 . A A . 21 ALA HB1 1 1 4 3163 1 1 21 ALA HB2 H -3.662 -1.684 -3.510 1.00 . A A . 21 ALA HB2 1 1 4 3164 1 1 21 ALA HB3 H -4.969 -0.547 -3.184 1.00 . A A . 21 ALA HB3 1 1 4 3165 1 1 21 ALA N N -5.370 -3.416 -4.941 1.00 . A A . 21 ALA N 1 1 4 3166 1 1 21 ALA O O -3.626 -0.607 -5.690 1.00 . A A . 21 ALA O 1 1 4 3167 1 1 22 PRO C C -4.710 0.518 -8.444 1.00 . A A . 22 PRO C 1 1 4 3168 1 1 22 PRO CA C -4.412 -0.978 -8.316 1.00 . A A . 22 PRO CA 1 1 4 3169 1 1 22 PRO CB C -5.045 -1.763 -9.465 1.00 . A A . 22 PRO CB 1 1 4 3170 1 1 22 PRO CD C -6.246 -2.348 -7.437 1.00 . A A . 22 PRO CD 1 1 4 3171 1 1 22 PRO CG C -6.372 -2.219 -8.939 1.00 . A A . 22 PRO CG 1 1 4 3172 1 1 22 PRO HA H -3.349 -1.155 -8.288 1.00 . A A . 22 PRO HA 1 1 4 3173 1 1 22 PRO HB2 H -5.145 -1.113 -10.325 1.00 . A A . 22 PRO HB2 1 1 4 3174 1 1 22 PRO HB3 H -4.413 -2.598 -9.719 1.00 . A A . 22 PRO HB3 1 1 4 3175 1 1 22 PRO HD2 H -7.131 -1.960 -6.951 1.00 . A A . 22 PRO HD2 1 1 4 3176 1 1 22 PRO HD3 H -6.082 -3.377 -7.159 1.00 . A A . 22 PRO HD3 1 1 4 3177 1 1 22 PRO HG2 H -7.130 -1.489 -9.188 1.00 . A A . 22 PRO HG2 1 1 4 3178 1 1 22 PRO HG3 H -6.624 -3.175 -9.367 1.00 . A A . 22 PRO HG3 1 1 4 3179 1 1 22 PRO N N -5.071 -1.536 -7.106 1.00 . A A . 22 PRO N 1 1 4 3180 1 1 22 PRO O O -4.260 1.175 -9.364 1.00 . A A . 22 PRO O 1 1 4 3181 1 1 23 GLY C C -5.081 3.240 -6.443 1.00 . A A . 23 GLY C 1 1 4 3182 1 1 23 GLY CA C -5.780 2.515 -7.593 1.00 . A A . 23 GLY CA 1 1 4 3183 1 1 23 GLY H H -5.808 0.516 -6.792 1.00 . A A . 23 GLY H 1 1 4 3184 1 1 23 GLY HA2 H -5.439 2.918 -8.537 1.00 . A A . 23 GLY HA2 1 1 4 3185 1 1 23 GLY HA3 H -6.847 2.654 -7.505 1.00 . A A . 23 GLY HA3 1 1 4 3186 1 1 23 GLY N N -5.459 1.062 -7.528 1.00 . A A . 23 GLY N 1 1 4 3187 1 1 23 GLY O O -4.776 4.411 -6.528 1.00 . A A . 23 GLY O 1 1 4 3188 1 1 24 ALA C C -2.659 2.819 -4.212 1.00 . A A . 24 ALA C 1 1 4 3189 1 1 24 ALA CA C -4.144 3.188 -4.205 1.00 . A A . 24 ALA CA 1 1 4 3190 1 1 24 ALA CB C -4.784 2.694 -2.906 1.00 . A A . 24 ALA CB 1 1 4 3191 1 1 24 ALA H H -5.080 1.602 -5.321 1.00 . A A . 24 ALA H 1 1 4 3192 1 1 24 ALA HA H -4.249 4.259 -4.271 1.00 . A A . 24 ALA HA 1 1 4 3193 1 1 24 ALA HB1 H -4.772 1.614 -2.886 1.00 . A A . 24 ALA HB1 1 1 4 3194 1 1 24 ALA HB2 H -4.229 3.076 -2.063 1.00 . A A . 24 ALA HB2 1 1 4 3195 1 1 24 ALA HB3 H -5.805 3.042 -2.852 1.00 . A A . 24 ALA HB3 1 1 4 3196 1 1 24 ALA N N -4.824 2.547 -5.366 1.00 . A A . 24 ALA N 1 1 4 3197 1 1 24 ALA O O -1.799 3.663 -4.056 1.00 . A A . 24 ALA O 1 1 4 3198 1 1 25 PHE C C -0.406 1.191 -5.847 1.00 . A A . 25 PHE C 1 1 4 3199 1 1 25 PHE CA C -0.928 1.135 -4.407 1.00 . A A . 25 PHE CA 1 1 4 3200 1 1 25 PHE CB C -0.841 -0.307 -3.895 1.00 . A A . 25 PHE CB 1 1 4 3201 1 1 25 PHE CD1 C 1.345 0.347 -2.802 1.00 . A A . 25 PHE CD1 1 1 4 3202 1 1 25 PHE CD2 C -0.057 -1.308 -1.719 1.00 . A A . 25 PHE CD2 1 1 4 3203 1 1 25 PHE CE1 C 2.283 0.223 -1.767 1.00 . A A . 25 PHE CE1 1 1 4 3204 1 1 25 PHE CE2 C 0.885 -1.432 -0.688 1.00 . A A . 25 PHE CE2 1 1 4 3205 1 1 25 PHE CG C 0.174 -0.419 -2.777 1.00 . A A . 25 PHE CG 1 1 4 3206 1 1 25 PHE CZ C 2.055 -0.664 -0.714 1.00 . A A . 25 PHE CZ 1 1 4 3207 1 1 25 PHE H H -3.065 0.900 -4.513 1.00 . A A . 25 PHE H 1 1 4 3208 1 1 25 PHE HA H -0.342 1.792 -3.775 1.00 . A A . 25 PHE HA 1 1 4 3209 1 1 25 PHE HB2 H -1.809 -0.614 -3.527 1.00 . A A . 25 PHE HB2 1 1 4 3210 1 1 25 PHE HB3 H -0.548 -0.956 -4.707 1.00 . A A . 25 PHE HB3 1 1 4 3211 1 1 25 PHE HD1 H 1.525 1.033 -3.616 1.00 . A A . 25 PHE HD1 1 1 4 3212 1 1 25 PHE HD2 H -0.959 -1.900 -1.698 1.00 . A A . 25 PHE HD2 1 1 4 3213 1 1 25 PHE HE1 H 3.183 0.810 -1.783 1.00 . A A . 25 PHE HE1 1 1 4 3214 1 1 25 PHE HE2 H 0.706 -2.118 0.127 1.00 . A A . 25 PHE HE2 1 1 4 3215 1 1 25 PHE HZ H 2.783 -0.760 0.075 1.00 . A A . 25 PHE HZ 1 1 4 3216 1 1 25 PHE N N -2.354 1.564 -4.390 1.00 . A A . 25 PHE N 1 1 4 3217 1 1 25 PHE O O -1.100 0.837 -6.780 1.00 . A A . 25 PHE O 1 1 4 3218 1 1 26 ALA C C 2.885 1.861 -7.366 1.00 . A A . 26 ALA C 1 1 4 3219 1 1 26 ALA CA C 1.363 1.697 -7.421 1.00 . A A . 26 ALA CA 1 1 4 3220 1 1 26 ALA CB C 0.751 2.891 -8.156 1.00 . A A . 26 ALA CB 1 1 4 3221 1 1 26 ALA H H 1.355 1.907 -5.276 1.00 . A A . 26 ALA H 1 1 4 3222 1 1 26 ALA HA H 1.119 0.788 -7.951 1.00 . A A . 26 ALA HA 1 1 4 3223 1 1 26 ALA HB1 H -0.055 3.302 -7.567 1.00 . A A . 26 ALA HB1 1 1 4 3224 1 1 26 ALA HB2 H 1.508 3.647 -8.306 1.00 . A A . 26 ALA HB2 1 1 4 3225 1 1 26 ALA HB3 H 0.370 2.568 -9.113 1.00 . A A . 26 ALA HB3 1 1 4 3226 1 1 26 ALA N N 0.808 1.628 -6.037 1.00 . A A . 26 ALA N 1 1 4 3227 1 1 26 ALA O O 3.397 2.823 -6.833 1.00 . A A . 26 ALA O 1 1 4 3228 1 1 27 MET C C 5.515 2.319 -8.630 1.00 . A A . 27 MET C 1 1 4 3229 1 1 27 MET CA C 5.101 1.041 -7.907 1.00 . A A . 27 MET CA 1 1 4 3230 1 1 27 MET CB C 5.706 -0.173 -8.618 1.00 . A A . 27 MET CB 1 1 4 3231 1 1 27 MET CE C 7.346 -2.309 -10.101 1.00 . A A . 27 MET CE 1 1 4 3232 1 1 27 MET CG C 7.220 -0.195 -8.407 1.00 . A A . 27 MET CG 1 1 4 3233 1 1 27 MET H H 3.183 0.163 -8.354 1.00 . A A . 27 MET H 1 1 4 3234 1 1 27 MET HA H 5.447 1.077 -6.895 1.00 . A A . 27 MET HA 1 1 4 3235 1 1 27 MET HB2 H 5.273 -1.077 -8.216 1.00 . A A . 27 MET HB2 1 1 4 3236 1 1 27 MET HB3 H 5.493 -0.112 -9.676 1.00 . A A . 27 MET HB3 1 1 4 3237 1 1 27 MET HE1 H 6.535 -2.424 -9.395 1.00 . A A . 27 MET HE1 1 1 4 3238 1 1 27 MET HE2 H 6.973 -2.461 -11.101 1.00 . A A . 27 MET HE2 1 1 4 3239 1 1 27 MET HE3 H 8.118 -3.037 -9.893 1.00 . A A . 27 MET HE3 1 1 4 3240 1 1 27 MET HG2 H 7.556 0.780 -8.093 1.00 . A A . 27 MET HG2 1 1 4 3241 1 1 27 MET HG3 H 7.466 -0.923 -7.646 1.00 . A A . 27 MET HG3 1 1 4 3242 1 1 27 MET N N 3.614 0.930 -7.922 1.00 . A A . 27 MET N 1 1 4 3243 1 1 27 MET O O 4.822 2.784 -9.513 1.00 . A A . 27 MET O 1 1 4 3244 1 1 27 MET SD S 8.038 -0.643 -9.957 1.00 . A A . 27 MET SD 1 1 4 3245 1 1 28 ASP C C 8.457 3.877 -9.509 1.00 . A A . 28 ASP C 1 1 4 3246 1 1 28 ASP CA C 7.053 4.126 -8.989 1.00 . A A . 28 ASP CA 1 1 4 3247 1 1 28 ASP CB C 7.035 5.297 -8.005 1.00 . A A . 28 ASP CB 1 1 4 3248 1 1 28 ASP CG C 6.559 6.564 -8.717 1.00 . A A . 28 ASP CG 1 1 4 3249 1 1 28 ASP H H 7.226 2.523 -7.575 1.00 . A A . 28 ASP H 1 1 4 3250 1 1 28 ASP HA H 6.382 4.324 -9.812 1.00 . A A . 28 ASP HA 1 1 4 3251 1 1 28 ASP HB2 H 6.358 5.066 -7.193 1.00 . A A . 28 ASP HB2 1 1 4 3252 1 1 28 ASP HB3 H 8.026 5.453 -7.612 1.00 . A A . 28 ASP HB3 1 1 4 3253 1 1 28 ASP N N 6.640 2.899 -8.286 1.00 . A A . 28 ASP N 1 1 4 3254 1 1 28 ASP O O 9.120 2.987 -9.016 1.00 . A A . 28 ASP O 1 1 4 3255 1 1 28 ASP OD1 O 5.745 6.442 -9.617 1.00 . A A . 28 ASP OD1 1 1 4 3256 1 1 28 ASP OD2 O 7.017 7.633 -8.351 1.00 . A A . 28 ASP OD2 1 1 4 3257 1 1 29 PRO C C 11.201 5.279 -10.235 1.00 . A A . 29 PRO C 1 1 4 3258 1 1 29 PRO CA C 10.204 4.497 -11.079 1.00 . A A . 29 PRO CA 1 1 4 3259 1 1 29 PRO CB C 10.051 5.101 -12.473 1.00 . A A . 29 PRO CB 1 1 4 3260 1 1 29 PRO CD C 8.118 5.746 -11.108 1.00 . A A . 29 PRO CD 1 1 4 3261 1 1 29 PRO CG C 8.901 6.065 -12.369 1.00 . A A . 29 PRO CG 1 1 4 3262 1 1 29 PRO HA H 10.481 3.457 -11.145 1.00 . A A . 29 PRO HA 1 1 4 3263 1 1 29 PRO HB2 H 10.974 5.596 -12.745 1.00 . A A . 29 PRO HB2 1 1 4 3264 1 1 29 PRO HB3 H 9.844 4.316 -13.182 1.00 . A A . 29 PRO HB3 1 1 4 3265 1 1 29 PRO HD2 H 8.096 6.610 -10.460 1.00 . A A . 29 PRO HD2 1 1 4 3266 1 1 29 PRO HD3 H 7.121 5.433 -11.349 1.00 . A A . 29 PRO HD3 1 1 4 3267 1 1 29 PRO HG2 H 9.281 7.075 -12.321 1.00 . A A . 29 PRO HG2 1 1 4 3268 1 1 29 PRO HG3 H 8.259 5.955 -13.230 1.00 . A A . 29 PRO HG3 1 1 4 3269 1 1 29 PRO N N 8.859 4.652 -10.484 1.00 . A A . 29 PRO N 1 1 4 3270 1 1 29 PRO O O 12.397 5.069 -10.293 1.00 . A A . 29 PRO O 1 1 4 3271 1 1 30 GLU C C 11.644 6.174 -7.199 1.00 . A A . 30 GLU C 1 1 4 3272 1 1 30 GLU CA C 11.571 6.939 -8.511 1.00 . A A . 30 GLU CA 1 1 4 3273 1 1 30 GLU CB C 10.988 8.324 -8.276 1.00 . A A . 30 GLU CB 1 1 4 3274 1 1 30 GLU CD C 11.088 8.827 -10.721 1.00 . A A . 30 GLU CD 1 1 4 3275 1 1 30 GLU CG C 10.175 8.766 -9.495 1.00 . A A . 30 GLU CG 1 1 4 3276 1 1 30 GLU H H 9.718 6.266 -9.374 1.00 . A A . 30 GLU H 1 1 4 3277 1 1 30 GLU HA H 12.549 7.029 -8.933 1.00 . A A . 30 GLU HA 1 1 4 3278 1 1 30 GLU HB2 H 10.359 8.286 -7.414 1.00 . A A . 30 GLU HB2 1 1 4 3279 1 1 30 GLU HB3 H 11.788 9.028 -8.106 1.00 . A A . 30 GLU HB3 1 1 4 3280 1 1 30 GLU HG2 H 9.376 8.060 -9.674 1.00 . A A . 30 GLU HG2 1 1 4 3281 1 1 30 GLU HG3 H 9.756 9.743 -9.313 1.00 . A A . 30 GLU HG3 1 1 4 3282 1 1 30 GLU N N 10.693 6.154 -9.416 1.00 . A A . 30 GLU N 1 1 4 3283 1 1 30 GLU O O 12.624 6.214 -6.481 1.00 . A A . 30 GLU O 1 1 4 3284 1 1 30 GLU OE1 O 11.396 7.776 -11.259 1.00 . A A . 30 GLU OE1 1 1 4 3285 1 1 30 GLU OE2 O 11.465 9.923 -11.101 1.00 . A A . 30 GLU OE2 1 1 4 3286 1 1 31 ILE C C 10.704 3.145 -6.096 1.00 . A A . 31 ILE C 1 1 4 3287 1 1 31 ILE CA C 10.578 4.607 -5.686 1.00 . A A . 31 ILE CA 1 1 4 3288 1 1 31 ILE CB C 9.272 4.852 -4.916 1.00 . A A . 31 ILE CB 1 1 4 3289 1 1 31 ILE CD1 C 6.805 4.427 -4.933 1.00 . A A . 31 ILE CD1 1 1 4 3290 1 1 31 ILE CG1 C 8.162 3.934 -5.441 1.00 . A A . 31 ILE CG1 1 1 4 3291 1 1 31 ILE CG2 C 8.852 6.313 -5.091 1.00 . A A . 31 ILE CG2 1 1 4 3292 1 1 31 ILE H H 9.852 5.405 -7.534 1.00 . A A . 31 ILE H 1 1 4 3293 1 1 31 ILE HA H 11.402 4.860 -5.069 1.00 . A A . 31 ILE HA 1 1 4 3294 1 1 31 ILE HB H 9.437 4.654 -3.866 1.00 . A A . 31 ILE HB 1 1 4 3295 1 1 31 ILE HD11 H 6.850 4.553 -3.862 1.00 . A A . 31 ILE HD11 1 1 4 3296 1 1 31 ILE HD12 H 6.571 5.375 -5.394 1.00 . A A . 31 ILE HD12 1 1 4 3297 1 1 31 ILE HD13 H 6.042 3.706 -5.182 1.00 . A A . 31 ILE HD13 1 1 4 3298 1 1 31 ILE HG12 H 8.171 3.938 -6.519 1.00 . A A . 31 ILE HG12 1 1 4 3299 1 1 31 ILE HG13 H 8.332 2.930 -5.085 1.00 . A A . 31 ILE HG13 1 1 4 3300 1 1 31 ILE HG21 H 9.665 6.959 -4.796 1.00 . A A . 31 ILE HG21 1 1 4 3301 1 1 31 ILE HG22 H 8.606 6.495 -6.127 1.00 . A A . 31 ILE HG22 1 1 4 3302 1 1 31 ILE HG23 H 7.989 6.516 -4.475 1.00 . A A . 31 ILE HG23 1 1 4 3303 1 1 31 ILE N N 10.607 5.436 -6.914 1.00 . A A . 31 ILE N 1 1 4 3304 1 1 31 ILE O O 10.719 2.260 -5.264 1.00 . A A . 31 ILE O 1 1 4 3305 1 1 32 GLU C C 10.226 0.547 -6.969 1.00 . A A . 32 GLU C 1 1 4 3306 1 1 32 GLU CA C 10.909 1.517 -7.917 1.00 . A A . 32 GLU CA 1 1 4 3307 1 1 32 GLU CB C 12.385 1.145 -8.067 1.00 . A A . 32 GLU CB 1 1 4 3308 1 1 32 GLU CD C 14.588 2.143 -8.701 1.00 . A A . 32 GLU CD 1 1 4 3309 1 1 32 GLU CG C 13.081 2.176 -8.958 1.00 . A A . 32 GLU CG 1 1 4 3310 1 1 32 GLU H H 10.773 3.649 -8.016 1.00 . A A . 32 GLU H 1 1 4 3311 1 1 32 GLU HA H 10.420 1.474 -8.878 1.00 . A A . 32 GLU HA 1 1 4 3312 1 1 32 GLU HB2 H 12.854 1.134 -7.093 1.00 . A A . 32 GLU HB2 1 1 4 3313 1 1 32 GLU HB3 H 12.467 0.167 -8.519 1.00 . A A . 32 GLU HB3 1 1 4 3314 1 1 32 GLU HG2 H 12.888 1.943 -9.996 1.00 . A A . 32 GLU HG2 1 1 4 3315 1 1 32 GLU HG3 H 12.701 3.161 -8.733 1.00 . A A . 32 GLU HG3 1 1 4 3316 1 1 32 GLU N N 10.792 2.904 -7.384 1.00 . A A . 32 GLU N 1 1 4 3317 1 1 32 GLU O O 10.734 -0.514 -6.670 1.00 . A A . 32 GLU O 1 1 4 3318 1 1 32 GLU OE1 O 15.010 2.685 -7.692 1.00 . A A . 32 GLU OE1 1 1 4 3319 1 1 32 GLU OE2 O 15.297 1.579 -9.518 1.00 . A A . 32 GLU OE2 1 1 4 3320 1 1 33 LYS C C 6.938 0.519 -5.291 1.00 . A A . 33 LYS C 1 1 4 3321 1 1 33 LYS CA C 8.362 0.017 -5.526 1.00 . A A . 33 LYS CA 1 1 4 3322 1 1 33 LYS CB C 9.110 -0.015 -4.189 1.00 . A A . 33 LYS CB 1 1 4 3323 1 1 33 LYS CD C 11.514 -0.669 -3.960 1.00 . A A . 33 LYS CD 1 1 4 3324 1 1 33 LYS CE C 12.417 -1.823 -3.519 1.00 . A A . 33 LYS CE 1 1 4 3325 1 1 33 LYS CG C 10.091 -1.190 -4.177 1.00 . A A . 33 LYS CG 1 1 4 3326 1 1 33 LYS H H 8.695 1.792 -6.740 1.00 . A A . 33 LYS H 1 1 4 3327 1 1 33 LYS HA H 8.325 -0.981 -5.936 1.00 . A A . 33 LYS HA 1 1 4 3328 1 1 33 LYS HB2 H 9.651 0.910 -4.056 1.00 . A A . 33 LYS HB2 1 1 4 3329 1 1 33 LYS HB3 H 8.401 -0.136 -3.384 1.00 . A A . 33 LYS HB3 1 1 4 3330 1 1 33 LYS HD2 H 11.889 -0.250 -4.883 1.00 . A A . 33 LYS HD2 1 1 4 3331 1 1 33 LYS HD3 H 11.507 0.093 -3.195 1.00 . A A . 33 LYS HD3 1 1 4 3332 1 1 33 LYS HE2 H 12.488 -1.833 -2.442 1.00 . A A . 33 LYS HE2 1 1 4 3333 1 1 33 LYS HE3 H 11.999 -2.758 -3.862 1.00 . A A . 33 LYS HE3 1 1 4 3334 1 1 33 LYS HG2 H 9.830 -1.866 -3.376 1.00 . A A . 33 LYS HG2 1 1 4 3335 1 1 33 LYS HG3 H 10.040 -1.713 -5.119 1.00 . A A . 33 LYS HG3 1 1 4 3336 1 1 33 LYS HZ1 H 14.144 -0.706 -3.844 1.00 . A A . 33 LYS HZ1 1 1 4 3337 1 1 33 LYS HZ2 H 14.412 -2.381 -3.737 1.00 . A A . 33 LYS HZ2 1 1 4 3338 1 1 33 LYS HZ3 H 13.722 -1.721 -5.139 1.00 . A A . 33 LYS HZ3 1 1 4 3339 1 1 33 LYS N N 9.078 0.917 -6.483 1.00 . A A . 33 LYS N 1 1 4 3340 1 1 33 LYS NZ N 13.776 -1.644 -4.104 1.00 . A A . 33 LYS NZ 1 1 4 3341 1 1 33 LYS O O 6.668 1.703 -5.333 1.00 . A A . 33 LYS O 1 1 4 3342 1 1 34 ALA C C 4.501 1.006 -3.653 1.00 . A A . 34 ALA C 1 1 4 3343 1 1 34 ALA CA C 4.603 0.021 -4.822 1.00 . A A . 34 ALA CA 1 1 4 3344 1 1 34 ALA CB C 3.774 -1.224 -4.505 1.00 . A A . 34 ALA CB 1 1 4 3345 1 1 34 ALA H H 6.268 -1.329 -5.029 1.00 . A A . 34 ALA H 1 1 4 3346 1 1 34 ALA HA H 4.213 0.487 -5.712 1.00 . A A . 34 ALA HA 1 1 4 3347 1 1 34 ALA HB1 H 4.430 -2.075 -4.396 1.00 . A A . 34 ALA HB1 1 1 4 3348 1 1 34 ALA HB2 H 3.228 -1.070 -3.586 1.00 . A A . 34 ALA HB2 1 1 4 3349 1 1 34 ALA HB3 H 3.079 -1.408 -5.310 1.00 . A A . 34 ALA HB3 1 1 4 3350 1 1 34 ALA N N 6.023 -0.380 -5.051 1.00 . A A . 34 ALA N 1 1 4 3351 1 1 34 ALA O O 5.203 0.896 -2.668 1.00 . A A . 34 ALA O 1 1 4 3352 1 1 35 TYR C C 1.925 3.314 -2.549 1.00 . A A . 35 TYR C 1 1 4 3353 1 1 35 TYR CA C 3.413 2.956 -2.662 1.00 . A A . 35 TYR CA 1 1 4 3354 1 1 35 TYR CB C 4.262 4.213 -2.934 1.00 . A A . 35 TYR CB 1 1 4 3355 1 1 35 TYR CD1 C 2.835 4.609 -5.006 1.00 . A A . 35 TYR CD1 1 1 4 3356 1 1 35 TYR CD2 C 3.902 6.499 -3.933 1.00 . A A . 35 TYR CD2 1 1 4 3357 1 1 35 TYR CE1 C 2.292 5.464 -5.971 1.00 . A A . 35 TYR CE1 1 1 4 3358 1 1 35 TYR CE2 C 3.356 7.355 -4.898 1.00 . A A . 35 TYR CE2 1 1 4 3359 1 1 35 TYR CG C 3.640 5.123 -3.982 1.00 . A A . 35 TYR CG 1 1 4 3360 1 1 35 TYR CZ C 2.550 6.836 -5.917 1.00 . A A . 35 TYR CZ 1 1 4 3361 1 1 35 TYR H H 3.050 1.995 -4.558 1.00 . A A . 35 TYR H 1 1 4 3362 1 1 35 TYR HA H 3.731 2.521 -1.723 1.00 . A A . 35 TYR HA 1 1 4 3363 1 1 35 TYR HB2 H 4.372 4.767 -2.015 1.00 . A A . 35 TYR HB2 1 1 4 3364 1 1 35 TYR HB3 H 5.238 3.905 -3.274 1.00 . A A . 35 TYR HB3 1 1 4 3365 1 1 35 TYR HD1 H 2.627 3.558 -5.050 1.00 . A A . 35 TYR HD1 1 1 4 3366 1 1 35 TYR HD2 H 4.523 6.902 -3.147 1.00 . A A . 35 TYR HD2 1 1 4 3367 1 1 35 TYR HE1 H 1.671 5.062 -6.759 1.00 . A A . 35 TYR HE1 1 1 4 3368 1 1 35 TYR HE2 H 3.556 8.415 -4.856 1.00 . A A . 35 TYR HE2 1 1 4 3369 1 1 35 TYR HH H 2.703 8.284 -7.151 1.00 . A A . 35 TYR HH 1 1 4 3370 1 1 35 TYR N N 3.607 1.954 -3.758 1.00 . A A . 35 TYR N 1 1 4 3371 1 1 35 TYR O O 1.211 3.393 -3.528 1.00 . A A . 35 TYR O 1 1 4 3372 1 1 35 TYR OH O 2.014 7.676 -6.870 1.00 . A A . 35 TYR OH 1 1 4 3373 1 1 36 VAL C C -0.141 5.378 -1.331 1.00 . A A . 36 VAL C 1 1 4 3374 1 1 36 VAL CA C 0.007 3.863 -1.181 1.00 . A A . 36 VAL CA 1 1 4 3375 1 1 36 VAL CB C -0.462 3.393 0.208 1.00 . A A . 36 VAL CB 1 1 4 3376 1 1 36 VAL CG1 C -1.560 4.309 0.753 1.00 . A A . 36 VAL CG1 1 1 4 3377 1 1 36 VAL CG2 C -1.017 1.971 0.092 1.00 . A A . 36 VAL CG2 1 1 4 3378 1 1 36 VAL H H 2.029 3.440 -0.570 1.00 . A A . 36 VAL H 1 1 4 3379 1 1 36 VAL HA H -0.574 3.369 -1.946 1.00 . A A . 36 VAL HA 1 1 4 3380 1 1 36 VAL HB H 0.375 3.396 0.888 1.00 . A A . 36 VAL HB 1 1 4 3381 1 1 36 VAL HG11 H -2.095 4.758 -0.070 1.00 . A A . 36 VAL HG11 1 1 4 3382 1 1 36 VAL HG12 H -2.243 3.731 1.356 1.00 . A A . 36 VAL HG12 1 1 4 3383 1 1 36 VAL HG13 H -1.113 5.084 1.358 1.00 . A A . 36 VAL HG13 1 1 4 3384 1 1 36 VAL HG21 H -0.323 1.359 -0.467 1.00 . A A . 36 VAL HG21 1 1 4 3385 1 1 36 VAL HG22 H -1.148 1.555 1.080 1.00 . A A . 36 VAL HG22 1 1 4 3386 1 1 36 VAL HG23 H -1.967 1.996 -0.418 1.00 . A A . 36 VAL HG23 1 1 4 3387 1 1 36 VAL N N 1.445 3.518 -1.354 1.00 . A A . 36 VAL N 1 1 4 3388 1 1 36 VAL O O -0.003 6.125 -0.384 1.00 . A A . 36 VAL O 1 1 4 3389 1 1 37 LYS C C -2.000 7.700 -2.900 1.00 . A A . 37 LYS C 1 1 4 3390 1 1 37 LYS CA C -0.530 7.307 -2.742 1.00 . A A . 37 LYS CA 1 1 4 3391 1 1 37 LYS CB C 0.237 7.702 -4.004 1.00 . A A . 37 LYS CB 1 1 4 3392 1 1 37 LYS CD C -0.807 8.370 -6.174 1.00 . A A . 37 LYS CD 1 1 4 3393 1 1 37 LYS CE C -1.665 7.889 -7.345 1.00 . A A . 37 LYS CE 1 1 4 3394 1 1 37 LYS CG C -0.506 7.194 -5.242 1.00 . A A . 37 LYS CG 1 1 4 3395 1 1 37 LYS H H -0.491 5.211 -3.280 1.00 . A A . 37 LYS H 1 1 4 3396 1 1 37 LYS HA H -0.112 7.829 -1.895 1.00 . A A . 37 LYS HA 1 1 4 3397 1 1 37 LYS HB2 H 0.321 8.779 -4.051 1.00 . A A . 37 LYS HB2 1 1 4 3398 1 1 37 LYS HB3 H 1.223 7.266 -3.975 1.00 . A A . 37 LYS HB3 1 1 4 3399 1 1 37 LYS HD2 H -1.339 9.135 -5.627 1.00 . A A . 37 LYS HD2 1 1 4 3400 1 1 37 LYS HD3 H 0.119 8.776 -6.552 1.00 . A A . 37 LYS HD3 1 1 4 3401 1 1 37 LYS HE2 H -2.307 7.085 -7.017 1.00 . A A . 37 LYS HE2 1 1 4 3402 1 1 37 LYS HE3 H -2.271 8.707 -7.707 1.00 . A A . 37 LYS HE3 1 1 4 3403 1 1 37 LYS HG2 H 0.109 6.473 -5.759 1.00 . A A . 37 LYS HG2 1 1 4 3404 1 1 37 LYS HG3 H -1.433 6.729 -4.942 1.00 . A A . 37 LYS HG3 1 1 4 3405 1 1 37 LYS HZ1 H -0.046 6.784 -8.048 1.00 . A A . 37 LYS HZ1 1 1 4 3406 1 1 37 LYS HZ2 H -1.350 6.870 -9.134 1.00 . A A . 37 LYS HZ2 1 1 4 3407 1 1 37 LYS HZ3 H -0.334 8.214 -8.913 1.00 . A A . 37 LYS HZ3 1 1 4 3408 1 1 37 LYS N N -0.400 5.836 -2.524 1.00 . A A . 37 LYS N 1 1 4 3409 1 1 37 LYS NZ N -0.782 7.402 -8.443 1.00 . A A . 37 LYS NZ 1 1 4 3410 1 1 37 LYS O O -2.350 8.859 -2.803 1.00 . A A . 37 LYS O 1 1 4 3411 1 1 38 ASP C C -5.159 6.201 -2.436 1.00 . A A . 38 ASP C 1 1 4 3412 1 1 38 ASP CA C -4.300 7.107 -3.321 1.00 . A A . 38 ASP CA 1 1 4 3413 1 1 38 ASP CB C -4.692 6.920 -4.787 1.00 . A A . 38 ASP CB 1 1 4 3414 1 1 38 ASP CG C -6.160 7.301 -4.980 1.00 . A A . 38 ASP CG 1 1 4 3415 1 1 38 ASP H H -2.567 5.827 -3.234 1.00 . A A . 38 ASP H 1 1 4 3416 1 1 38 ASP HA H -4.455 8.137 -3.038 1.00 . A A . 38 ASP HA 1 1 4 3417 1 1 38 ASP HB2 H -4.073 7.552 -5.407 1.00 . A A . 38 ASP HB2 1 1 4 3418 1 1 38 ASP HB3 H -4.549 5.890 -5.071 1.00 . A A . 38 ASP HB3 1 1 4 3419 1 1 38 ASP N N -2.863 6.758 -3.151 1.00 . A A . 38 ASP N 1 1 4 3420 1 1 38 ASP O O -5.576 5.135 -2.841 1.00 . A A . 38 ASP O 1 1 4 3421 1 1 38 ASP OD1 O -6.481 8.461 -4.779 1.00 . A A . 38 ASP OD1 1 1 4 3422 1 1 38 ASP OD2 O -6.937 6.428 -5.329 1.00 . A A . 38 ASP OD2 1 1 4 3423 1 1 39 VAL C C -7.621 5.519 -0.962 1.00 . A A . 39 VAL C 1 1 4 3424 1 1 39 VAL CA C -6.260 5.782 -0.317 1.00 . A A . 39 VAL CA 1 1 4 3425 1 1 39 VAL CB C -6.457 6.515 1.010 1.00 . A A . 39 VAL CB 1 1 4 3426 1 1 39 VAL CG1 C -5.095 6.804 1.641 1.00 . A A . 39 VAL CG1 1 1 4 3427 1 1 39 VAL CG2 C -7.192 7.834 0.762 1.00 . A A . 39 VAL CG2 1 1 4 3428 1 1 39 VAL H H -5.083 7.484 -0.921 1.00 . A A . 39 VAL H 1 1 4 3429 1 1 39 VAL HA H -5.760 4.842 -0.138 1.00 . A A . 39 VAL HA 1 1 4 3430 1 1 39 VAL HB H -7.039 5.896 1.679 1.00 . A A . 39 VAL HB 1 1 4 3431 1 1 39 VAL HG11 H -4.425 7.190 0.887 1.00 . A A . 39 VAL HG11 1 1 4 3432 1 1 39 VAL HG12 H -5.209 7.535 2.428 1.00 . A A . 39 VAL HG12 1 1 4 3433 1 1 39 VAL HG13 H -4.687 5.893 2.052 1.00 . A A . 39 VAL HG13 1 1 4 3434 1 1 39 VAL HG21 H -6.931 8.213 -0.215 1.00 . A A . 39 VAL HG21 1 1 4 3435 1 1 39 VAL HG22 H -8.257 7.668 0.812 1.00 . A A . 39 VAL HG22 1 1 4 3436 1 1 39 VAL HG23 H -6.904 8.553 1.515 1.00 . A A . 39 VAL HG23 1 1 4 3437 1 1 39 VAL N N -5.429 6.619 -1.228 1.00 . A A . 39 VAL N 1 1 4 3438 1 1 39 VAL O O -8.160 4.433 -0.874 1.00 . A A . 39 VAL O 1 1 4 3439 1 1 40 GLU C C -9.371 5.266 -3.376 1.00 . A A . 40 GLU C 1 1 4 3440 1 1 40 GLU CA C -9.507 6.303 -2.258 1.00 . A A . 40 GLU CA 1 1 4 3441 1 1 40 GLU CB C -9.990 7.631 -2.843 1.00 . A A . 40 GLU CB 1 1 4 3442 1 1 40 GLU CD C -8.602 9.699 -3.055 1.00 . A A . 40 GLU CD 1 1 4 3443 1 1 40 GLU CG C -8.846 8.294 -3.612 1.00 . A A . 40 GLU CG 1 1 4 3444 1 1 40 GLU H H -7.732 7.369 -1.670 1.00 . A A . 40 GLU H 1 1 4 3445 1 1 40 GLU HA H -10.218 5.952 -1.525 1.00 . A A . 40 GLU HA 1 1 4 3446 1 1 40 GLU HB2 H -10.818 7.450 -3.512 1.00 . A A . 40 GLU HB2 1 1 4 3447 1 1 40 GLU HB3 H -10.309 8.282 -2.042 1.00 . A A . 40 GLU HB3 1 1 4 3448 1 1 40 GLU HG2 H -7.950 7.701 -3.502 1.00 . A A . 40 GLU HG2 1 1 4 3449 1 1 40 GLU HG3 H -9.107 8.363 -4.657 1.00 . A A . 40 GLU HG3 1 1 4 3450 1 1 40 GLU N N -8.182 6.502 -1.609 1.00 . A A . 40 GLU N 1 1 4 3451 1 1 40 GLU O O -10.345 4.718 -3.850 1.00 . A A . 40 GLU O 1 1 4 3452 1 1 40 GLU OE1 O -8.522 9.829 -1.845 1.00 . A A . 40 GLU OE1 1 1 4 3453 1 1 40 GLU OE2 O -8.501 10.620 -3.849 1.00 . A A . 40 GLU OE2 1 1 4 3454 1 1 41 GLY C C -8.117 2.579 -4.322 1.00 . A A . 41 GLY C 1 1 4 3455 1 1 41 GLY CA C -7.963 3.995 -4.887 1.00 . A A . 41 GLY CA 1 1 4 3456 1 1 41 GLY H H -7.392 5.450 -3.404 1.00 . A A . 41 GLY H 1 1 4 3457 1 1 41 GLY HA2 H -8.699 4.155 -5.663 1.00 . A A . 41 GLY HA2 1 1 4 3458 1 1 41 GLY HA3 H -6.973 4.108 -5.300 1.00 . A A . 41 GLY HA3 1 1 4 3459 1 1 41 GLY N N -8.165 4.995 -3.799 1.00 . A A . 41 GLY N 1 1 4 3460 1 1 41 GLY O O -7.980 1.602 -5.031 1.00 . A A . 41 GLY O 1 1 4 3461 1 1 42 ALA C C -9.354 1.216 -1.145 1.00 . A A . 42 ALA C 1 1 4 3462 1 1 42 ALA CA C -8.562 1.104 -2.450 1.00 . A A . 42 ALA CA 1 1 4 3463 1 1 42 ALA CB C -7.183 0.505 -2.159 1.00 . A A . 42 ALA CB 1 1 4 3464 1 1 42 ALA H H -8.507 3.259 -2.496 1.00 . A A . 42 ALA H 1 1 4 3465 1 1 42 ALA HA H -9.093 0.465 -3.140 1.00 . A A . 42 ALA HA 1 1 4 3466 1 1 42 ALA HB1 H -6.641 1.157 -1.489 1.00 . A A . 42 ALA HB1 1 1 4 3467 1 1 42 ALA HB2 H -7.303 -0.465 -1.699 1.00 . A A . 42 ALA HB2 1 1 4 3468 1 1 42 ALA HB3 H -6.634 0.400 -3.083 1.00 . A A . 42 ALA HB3 1 1 4 3469 1 1 42 ALA N N -8.401 2.459 -3.053 1.00 . A A . 42 ALA N 1 1 4 3470 1 1 42 ALA O O -8.837 1.637 -0.129 1.00 . A A . 42 ALA O 1 1 4 3471 1 1 43 SER C C -10.689 0.268 1.236 1.00 . A A . 43 SER C 1 1 4 3472 1 1 43 SER CA C -11.431 0.933 0.074 1.00 . A A . 43 SER CA 1 1 4 3473 1 1 43 SER CB C -12.767 0.224 -0.150 1.00 . A A . 43 SER CB 1 1 4 3474 1 1 43 SER H H -11.004 0.509 -1.995 1.00 . A A . 43 SER H 1 1 4 3475 1 1 43 SER HA H -11.611 1.971 0.311 1.00 . A A . 43 SER HA 1 1 4 3476 1 1 43 SER HB2 H -12.776 -0.710 0.387 1.00 . A A . 43 SER HB2 1 1 4 3477 1 1 43 SER HB3 H -13.571 0.852 0.212 1.00 . A A . 43 SER HB3 1 1 4 3478 1 1 43 SER HG H -13.877 -0.008 -1.730 1.00 . A A . 43 SER HG 1 1 4 3479 1 1 43 SER N N -10.606 0.845 -1.165 1.00 . A A . 43 SER N 1 1 4 3480 1 1 43 SER O O -9.761 -0.495 1.042 1.00 . A A . 43 SER O 1 1 4 3481 1 1 43 SER OG O -12.937 -0.032 -1.538 1.00 . A A . 43 SER OG 1 1 4 3482 1 1 44 GLN C C -10.295 -1.565 3.414 1.00 . A A . 44 GLN C 1 1 4 3483 1 1 44 GLN CA C -10.420 -0.056 3.624 1.00 . A A . 44 GLN CA 1 1 4 3484 1 1 44 GLN CB C -11.243 0.220 4.886 1.00 . A A . 44 GLN CB 1 1 4 3485 1 1 44 GLN CD C -13.577 0.356 5.773 1.00 . A A . 44 GLN CD 1 1 4 3486 1 1 44 GLN CG C -12.694 -0.211 4.659 1.00 . A A . 44 GLN CG 1 1 4 3487 1 1 44 GLN H H -11.845 1.169 2.576 1.00 . A A . 44 GLN H 1 1 4 3488 1 1 44 GLN HA H -9.435 0.372 3.736 1.00 . A A . 44 GLN HA 1 1 4 3489 1 1 44 GLN HB2 H -10.828 -0.335 5.715 1.00 . A A . 44 GLN HB2 1 1 4 3490 1 1 44 GLN HB3 H -11.215 1.276 5.109 1.00 . A A . 44 GLN HB3 1 1 4 3491 1 1 44 GLN HE21 H -14.685 1.446 4.536 1.00 . A A . 44 GLN HE21 1 1 4 3492 1 1 44 GLN HE22 H -15.108 1.555 6.177 1.00 . A A . 44 GLN HE22 1 1 4 3493 1 1 44 GLN HG2 H -13.034 0.161 3.703 1.00 . A A . 44 GLN HG2 1 1 4 3494 1 1 44 GLN HG3 H -12.755 -1.289 4.669 1.00 . A A . 44 GLN HG3 1 1 4 3495 1 1 44 GLN N N -11.095 0.554 2.445 1.00 . A A . 44 GLN N 1 1 4 3496 1 1 44 GLN NE2 N -14.536 1.188 5.470 1.00 . A A . 44 GLN NE2 1 1 4 3497 1 1 44 GLN O O -9.233 -2.134 3.564 1.00 . A A . 44 GLN O 1 1 4 3498 1 1 44 GLN OE1 O -13.393 0.036 6.931 1.00 . A A . 44 GLN OE1 1 1 4 3499 1 1 45 GLU C C -10.370 -3.984 1.670 1.00 . A A . 45 GLU C 1 1 4 3500 1 1 45 GLU CA C -11.308 -3.688 2.840 1.00 . A A . 45 GLU CA 1 1 4 3501 1 1 45 GLU CB C -12.709 -4.214 2.524 1.00 . A A . 45 GLU CB 1 1 4 3502 1 1 45 GLU CD C -13.337 -5.403 4.628 1.00 . A A . 45 GLU CD 1 1 4 3503 1 1 45 GLU CG C -13.572 -4.148 3.785 1.00 . A A . 45 GLU CG 1 1 4 3504 1 1 45 GLU H H -12.216 -1.738 2.942 1.00 . A A . 45 GLU H 1 1 4 3505 1 1 45 GLU HA H -10.934 -4.172 3.732 1.00 . A A . 45 GLU HA 1 1 4 3506 1 1 45 GLU HB2 H -13.155 -3.608 1.748 1.00 . A A . 45 GLU HB2 1 1 4 3507 1 1 45 GLU HB3 H -12.643 -5.238 2.188 1.00 . A A . 45 GLU HB3 1 1 4 3508 1 1 45 GLU HG2 H -13.303 -3.272 4.359 1.00 . A A . 45 GLU HG2 1 1 4 3509 1 1 45 GLU HG3 H -14.613 -4.093 3.508 1.00 . A A . 45 GLU HG3 1 1 4 3510 1 1 45 GLU N N -11.370 -2.217 3.063 1.00 . A A . 45 GLU N 1 1 4 3511 1 1 45 GLU O O -9.954 -5.107 1.459 1.00 . A A . 45 GLU O 1 1 4 3512 1 1 45 GLU OE1 O -12.414 -6.138 4.317 1.00 . A A . 45 GLU OE1 1 1 4 3513 1 1 45 GLU OE2 O -14.084 -5.608 5.570 1.00 . A A . 45 GLU OE2 1 1 4 3514 1 1 46 GLU C C -7.680 -2.932 0.288 1.00 . A A . 46 GLU C 1 1 4 3515 1 1 46 GLU CA C -9.083 -3.196 -0.218 1.00 . A A . 46 GLU CA 1 1 4 3516 1 1 46 GLU CB C -9.412 -2.228 -1.354 1.00 . A A . 46 GLU CB 1 1 4 3517 1 1 46 GLU CD C -11.151 -1.923 -3.119 1.00 . A A . 46 GLU CD 1 1 4 3518 1 1 46 GLU CG C -10.909 -2.285 -1.653 1.00 . A A . 46 GLU CG 1 1 4 3519 1 1 46 GLU H H -10.329 -2.072 1.125 1.00 . A A . 46 GLU H 1 1 4 3520 1 1 46 GLU HA H -9.163 -4.216 -0.565 1.00 . A A . 46 GLU HA 1 1 4 3521 1 1 46 GLU HB2 H -9.140 -1.225 -1.060 1.00 . A A . 46 GLU HB2 1 1 4 3522 1 1 46 GLU HB3 H -8.859 -2.509 -2.237 1.00 . A A . 46 GLU HB3 1 1 4 3523 1 1 46 GLU HG2 H -11.275 -3.284 -1.462 1.00 . A A . 46 GLU HG2 1 1 4 3524 1 1 46 GLU HG3 H -11.428 -1.583 -1.018 1.00 . A A . 46 GLU HG3 1 1 4 3525 1 1 46 GLU N N -10.011 -2.977 0.922 1.00 . A A . 46 GLU N 1 1 4 3526 1 1 46 GLU O O -6.795 -3.753 0.172 1.00 . A A . 46 GLU O 1 1 4 3527 1 1 46 GLU OE1 O -10.423 -2.426 -3.961 1.00 . A A . 46 GLU OE1 1 1 4 3528 1 1 46 GLU OE2 O -12.057 -1.148 -3.377 1.00 . A A . 46 GLU OE2 1 1 4 3529 1 1 47 VAL C C -5.741 -2.624 2.368 1.00 . A A . 47 VAL C 1 1 4 3530 1 1 47 VAL CA C -6.147 -1.477 1.436 1.00 . A A . 47 VAL CA 1 1 4 3531 1 1 47 VAL CB C -6.241 -0.155 2.207 1.00 . A A . 47 VAL CB 1 1 4 3532 1 1 47 VAL CG1 C -5.180 -0.107 3.304 1.00 . A A . 47 VAL CG1 1 1 4 3533 1 1 47 VAL CG2 C -6.021 1.009 1.241 1.00 . A A . 47 VAL CG2 1 1 4 3534 1 1 47 VAL H H -8.209 -1.161 0.981 1.00 . A A . 47 VAL H 1 1 4 3535 1 1 47 VAL HA H -5.430 -1.385 0.634 1.00 . A A . 47 VAL HA 1 1 4 3536 1 1 47 VAL HB H -7.221 -0.071 2.654 1.00 . A A . 47 VAL HB 1 1 4 3537 1 1 47 VAL HG11 H -4.223 -0.379 2.887 1.00 . A A . 47 VAL HG11 1 1 4 3538 1 1 47 VAL HG12 H -5.130 0.891 3.709 1.00 . A A . 47 VAL HG12 1 1 4 3539 1 1 47 VAL HG13 H -5.446 -0.804 4.085 1.00 . A A . 47 VAL HG13 1 1 4 3540 1 1 47 VAL HG21 H -5.954 0.631 0.232 1.00 . A A . 47 VAL HG21 1 1 4 3541 1 1 47 VAL HG22 H -6.849 1.699 1.312 1.00 . A A . 47 VAL HG22 1 1 4 3542 1 1 47 VAL HG23 H -5.104 1.520 1.495 1.00 . A A . 47 VAL HG23 1 1 4 3543 1 1 47 VAL N N -7.481 -1.794 0.882 1.00 . A A . 47 VAL N 1 1 4 3544 1 1 47 VAL O O -4.598 -3.030 2.413 1.00 . A A . 47 VAL O 1 1 4 3545 1 1 48 GLU C C -6.077 -5.525 3.235 1.00 . A A . 48 GLU C 1 1 4 3546 1 1 48 GLU CA C -6.396 -4.256 4.032 1.00 . A A . 48 GLU CA 1 1 4 3547 1 1 48 GLU CB C -7.650 -4.468 4.859 1.00 . A A . 48 GLU CB 1 1 4 3548 1 1 48 GLU CD C -8.022 -5.266 7.193 1.00 . A A . 48 GLU CD 1 1 4 3549 1 1 48 GLU CG C -7.344 -4.203 6.326 1.00 . A A . 48 GLU CG 1 1 4 3550 1 1 48 GLU H H -7.598 -2.814 3.064 1.00 . A A . 48 GLU H 1 1 4 3551 1 1 48 GLU HA H -5.570 -4.001 4.676 1.00 . A A . 48 GLU HA 1 1 4 3552 1 1 48 GLU HB2 H -8.414 -3.782 4.525 1.00 . A A . 48 GLU HB2 1 1 4 3553 1 1 48 GLU HB3 H -7.993 -5.468 4.728 1.00 . A A . 48 GLU HB3 1 1 4 3554 1 1 48 GLU HG2 H -6.276 -4.232 6.479 1.00 . A A . 48 GLU HG2 1 1 4 3555 1 1 48 GLU HG3 H -7.720 -3.227 6.592 1.00 . A A . 48 GLU HG3 1 1 4 3556 1 1 48 GLU N N -6.683 -3.149 3.110 1.00 . A A . 48 GLU N 1 1 4 3557 1 1 48 GLU O O -5.036 -6.128 3.408 1.00 . A A . 48 GLU O 1 1 4 3558 1 1 48 GLU OE1 O -9.058 -5.763 6.784 1.00 . A A . 48 GLU OE1 1 1 4 3559 1 1 48 GLU OE2 O -7.491 -5.566 8.250 1.00 . A A . 48 GLU OE2 1 1 4 3560 1 1 49 GLU C C -5.329 -7.020 0.880 1.00 . A A . 49 GLU C 1 1 4 3561 1 1 49 GLU CA C -6.690 -7.168 1.565 1.00 . A A . 49 GLU CA 1 1 4 3562 1 1 49 GLU CB C -7.785 -7.348 0.511 1.00 . A A . 49 GLU CB 1 1 4 3563 1 1 49 GLU CD C -8.578 -9.455 1.594 1.00 . A A . 49 GLU CD 1 1 4 3564 1 1 49 GLU CG C -8.987 -8.052 1.142 1.00 . A A . 49 GLU CG 1 1 4 3565 1 1 49 GLU H H -7.797 -5.442 2.237 1.00 . A A . 49 GLU H 1 1 4 3566 1 1 49 GLU HA H -6.672 -8.028 2.221 1.00 . A A . 49 GLU HA 1 1 4 3567 1 1 49 GLU HB2 H -8.086 -6.381 0.136 1.00 . A A . 49 GLU HB2 1 1 4 3568 1 1 49 GLU HB3 H -7.406 -7.948 -0.304 1.00 . A A . 49 GLU HB3 1 1 4 3569 1 1 49 GLU HG2 H -9.331 -7.484 1.994 1.00 . A A . 49 GLU HG2 1 1 4 3570 1 1 49 GLU HG3 H -9.783 -8.128 0.415 1.00 . A A . 49 GLU HG3 1 1 4 3571 1 1 49 GLU N N -6.961 -5.938 2.365 1.00 . A A . 49 GLU N 1 1 4 3572 1 1 49 GLU O O -4.485 -7.889 0.957 1.00 . A A . 49 GLU O 1 1 4 3573 1 1 49 GLU OE1 O -8.541 -10.339 0.754 1.00 . A A . 49 GLU OE1 1 1 4 3574 1 1 49 GLU OE2 O -8.306 -9.621 2.771 1.00 . A A . 49 GLU OE2 1 1 4 3575 1 1 50 ALA C C -2.704 -5.593 0.607 1.00 . A A . 50 ALA C 1 1 4 3576 1 1 50 ALA CA C -3.803 -5.693 -0.455 1.00 . A A . 50 ALA CA 1 1 4 3577 1 1 50 ALA CB C -3.857 -4.382 -1.242 1.00 . A A . 50 ALA CB 1 1 4 3578 1 1 50 ALA H H -5.801 -5.228 0.184 1.00 . A A . 50 ALA H 1 1 4 3579 1 1 50 ALA HA H -3.595 -6.513 -1.129 1.00 . A A . 50 ALA HA 1 1 4 3580 1 1 50 ALA HB1 H -4.865 -3.990 -1.221 1.00 . A A . 50 ALA HB1 1 1 4 3581 1 1 50 ALA HB2 H -3.183 -3.666 -0.797 1.00 . A A . 50 ALA HB2 1 1 4 3582 1 1 50 ALA HB3 H -3.565 -4.563 -2.266 1.00 . A A . 50 ALA HB3 1 1 4 3583 1 1 50 ALA N N -5.110 -5.916 0.222 1.00 . A A . 50 ALA N 1 1 4 3584 1 1 50 ALA O O -1.527 -5.597 0.304 1.00 . A A . 50 ALA O 1 1 4 3585 1 1 51 MET C C -1.600 -6.763 3.354 1.00 . A A . 51 MET C 1 1 4 3586 1 1 51 MET CA C -2.089 -5.372 2.944 1.00 . A A . 51 MET CA 1 1 4 3587 1 1 51 MET CB C -2.765 -4.704 4.140 1.00 . A A . 51 MET CB 1 1 4 3588 1 1 51 MET CE C -2.767 -1.521 6.213 1.00 . A A . 51 MET CE 1 1 4 3589 1 1 51 MET CG C -1.878 -3.584 4.682 1.00 . A A . 51 MET CG 1 1 4 3590 1 1 51 MET H H -4.040 -5.476 2.070 1.00 . A A . 51 MET H 1 1 4 3591 1 1 51 MET HA H -1.255 -4.771 2.618 1.00 . A A . 51 MET HA 1 1 4 3592 1 1 51 MET HB2 H -3.713 -4.292 3.829 1.00 . A A . 51 MET HB2 1 1 4 3593 1 1 51 MET HB3 H -2.932 -5.438 4.910 1.00 . A A . 51 MET HB3 1 1 4 3594 1 1 51 MET HE1 H -1.790 -1.656 6.648 1.00 . A A . 51 MET HE1 1 1 4 3595 1 1 51 MET HE2 H -3.055 -0.482 6.294 1.00 . A A . 51 MET HE2 1 1 4 3596 1 1 51 MET HE3 H -3.482 -2.140 6.737 1.00 . A A . 51 MET HE3 1 1 4 3597 1 1 51 MET HG2 H -1.684 -3.751 5.730 1.00 . A A . 51 MET HG2 1 1 4 3598 1 1 51 MET HG3 H -0.944 -3.569 4.139 1.00 . A A . 51 MET HG3 1 1 4 3599 1 1 51 MET N N -3.087 -5.488 1.851 1.00 . A A . 51 MET N 1 1 4 3600 1 1 51 MET O O -0.424 -6.982 3.564 1.00 . A A . 51 MET O 1 1 4 3601 1 1 51 MET SD S -2.725 -1.998 4.469 1.00 . A A . 51 MET SD 1 1 4 3602 1 1 52 ASP C C -1.451 -9.811 2.716 1.00 . A A . 52 ASP C 1 1 4 3603 1 1 52 ASP CA C -2.091 -9.073 3.895 1.00 . A A . 52 ASP CA 1 1 4 3604 1 1 52 ASP CB C -3.324 -9.844 4.369 1.00 . A A . 52 ASP CB 1 1 4 3605 1 1 52 ASP CG C -2.926 -10.802 5.493 1.00 . A A . 52 ASP CG 1 1 4 3606 1 1 52 ASP H H -3.443 -7.498 3.319 1.00 . A A . 52 ASP H 1 1 4 3607 1 1 52 ASP HA H -1.380 -9.007 4.704 1.00 . A A . 52 ASP HA 1 1 4 3608 1 1 52 ASP HB2 H -4.065 -9.146 4.735 1.00 . A A . 52 ASP HB2 1 1 4 3609 1 1 52 ASP HB3 H -3.736 -10.408 3.546 1.00 . A A . 52 ASP HB3 1 1 4 3610 1 1 52 ASP N N -2.498 -7.700 3.483 1.00 . A A . 52 ASP N 1 1 4 3611 1 1 52 ASP O O -0.707 -10.754 2.898 1.00 . A A . 52 ASP O 1 1 4 3612 1 1 52 ASP OD1 O -1.745 -10.878 5.790 1.00 . A A . 52 ASP OD1 1 1 4 3613 1 1 52 ASP OD2 O -3.809 -11.443 6.039 1.00 . A A . 52 ASP OD2 1 1 4 3614 1 1 53 THR C C 0.364 -9.803 0.270 1.00 . A A . 53 THR C 1 1 4 3615 1 1 53 THR CA C -1.137 -10.097 0.335 1.00 . A A . 53 THR CA 1 1 4 3616 1 1 53 THR CB C -1.813 -9.605 -0.950 1.00 . A A . 53 THR CB 1 1 4 3617 1 1 53 THR CG2 C -1.336 -8.187 -1.277 1.00 . A A . 53 THR CG2 1 1 4 3618 1 1 53 THR H H -2.342 -8.641 1.378 1.00 . A A . 53 THR H 1 1 4 3619 1 1 53 THR HA H -1.290 -11.161 0.433 1.00 . A A . 53 THR HA 1 1 4 3620 1 1 53 THR HB H -2.882 -9.597 -0.813 1.00 . A A . 53 THR HB 1 1 4 3621 1 1 53 THR HG1 H -0.659 -10.924 -1.797 1.00 . A A . 53 THR HG1 1 1 4 3622 1 1 53 THR HG21 H -0.258 -8.145 -1.227 1.00 . A A . 53 THR HG21 1 1 4 3623 1 1 53 THR HG22 H -1.660 -7.920 -2.271 1.00 . A A . 53 THR HG22 1 1 4 3624 1 1 53 THR HG23 H -1.756 -7.494 -0.564 1.00 . A A . 53 THR HG23 1 1 4 3625 1 1 53 THR N N -1.735 -9.401 1.511 1.00 . A A . 53 THR N 1 1 4 3626 1 1 53 THR O O 1.077 -10.352 -0.548 1.00 . A A . 53 THR O 1 1 4 3627 1 1 53 THR OG1 O -1.478 -10.476 -2.022 1.00 . A A . 53 THR OG1 1 1 4 3628 1 1 54 CYS C C 3.072 -9.630 1.945 1.00 . A A . 54 CYS C 1 1 4 3629 1 1 54 CYS CA C 2.305 -8.614 1.096 1.00 . A A . 54 CYS CA 1 1 4 3630 1 1 54 CYS CB C 2.521 -7.210 1.663 1.00 . A A . 54 CYS CB 1 1 4 3631 1 1 54 CYS H H 0.260 -8.505 1.769 1.00 . A A . 54 CYS H 1 1 4 3632 1 1 54 CYS HA H 2.665 -8.651 0.078 1.00 . A A . 54 CYS HA 1 1 4 3633 1 1 54 CYS HB2 H 1.812 -6.529 1.217 1.00 . A A . 54 CYS HB2 1 1 4 3634 1 1 54 CYS HB3 H 2.371 -7.232 2.733 1.00 . A A . 54 CYS HB3 1 1 4 3635 1 1 54 CYS N N 0.851 -8.941 1.119 1.00 . A A . 54 CYS N 1 1 4 3636 1 1 54 CYS O O 2.620 -10.024 3.002 1.00 . A A . 54 CYS O 1 1 4 3637 1 1 54 CYS SG S 4.188 -6.511 1.370 1.00 . A A . 54 CYS SG 1 1 4 3638 1 1 55 PRO C C 5.738 -10.326 3.373 1.00 . A A . 55 PRO C 1 1 4 3639 1 1 55 PRO CA C 5.064 -10.997 2.173 1.00 . A A . 55 PRO CA 1 1 4 3640 1 1 55 PRO CB C 6.098 -11.419 1.130 1.00 . A A . 55 PRO CB 1 1 4 3641 1 1 55 PRO CD C 4.819 -9.583 0.187 1.00 . A A . 55 PRO CD 1 1 4 3642 1 1 55 PRO CG C 6.165 -10.273 0.167 1.00 . A A . 55 PRO CG 1 1 4 3643 1 1 55 PRO HA H 4.484 -11.850 2.487 1.00 . A A . 55 PRO HA 1 1 4 3644 1 1 55 PRO HB2 H 7.046 -11.599 1.621 1.00 . A A . 55 PRO HB2 1 1 4 3645 1 1 55 PRO HB3 H 5.769 -12.324 0.644 1.00 . A A . 55 PRO HB3 1 1 4 3646 1 1 55 PRO HD2 H 4.948 -8.508 0.170 1.00 . A A . 55 PRO HD2 1 1 4 3647 1 1 55 PRO HD3 H 4.216 -9.905 -0.647 1.00 . A A . 55 PRO HD3 1 1 4 3648 1 1 55 PRO HG2 H 6.941 -9.585 0.475 1.00 . A A . 55 PRO HG2 1 1 4 3649 1 1 55 PRO HG3 H 6.370 -10.643 -0.826 1.00 . A A . 55 PRO HG3 1 1 4 3650 1 1 55 PRO N N 4.214 -10.017 1.450 1.00 . A A . 55 PRO N 1 1 4 3651 1 1 55 PRO O O 5.696 -10.823 4.480 1.00 . A A . 55 PRO O 1 1 4 3652 1 1 56 VAL C C 6.077 -7.402 4.826 1.00 . A A . 56 VAL C 1 1 4 3653 1 1 56 VAL CA C 7.018 -8.483 4.289 1.00 . A A . 56 VAL CA 1 1 4 3654 1 1 56 VAL CB C 8.316 -7.841 3.795 1.00 . A A . 56 VAL CB 1 1 4 3655 1 1 56 VAL CG1 C 9.170 -7.428 4.995 1.00 . A A . 56 VAL CG1 1 1 4 3656 1 1 56 VAL CG2 C 9.090 -8.850 2.945 1.00 . A A . 56 VAL CG2 1 1 4 3657 1 1 56 VAL H H 6.368 -8.806 2.261 1.00 . A A . 56 VAL H 1 1 4 3658 1 1 56 VAL HA H 7.242 -9.189 5.076 1.00 . A A . 56 VAL HA 1 1 4 3659 1 1 56 VAL HB H 8.084 -6.969 3.201 1.00 . A A . 56 VAL HB 1 1 4 3660 1 1 56 VAL HG11 H 8.638 -7.646 5.909 1.00 . A A . 56 VAL HG11 1 1 4 3661 1 1 56 VAL HG12 H 10.100 -7.978 4.980 1.00 . A A . 56 VAL HG12 1 1 4 3662 1 1 56 VAL HG13 H 9.377 -6.369 4.941 1.00 . A A . 56 VAL HG13 1 1 4 3663 1 1 56 VAL HG21 H 8.548 -9.783 2.910 1.00 . A A . 56 VAL HG21 1 1 4 3664 1 1 56 VAL HG22 H 9.207 -8.464 1.943 1.00 . A A . 56 VAL HG22 1 1 4 3665 1 1 56 VAL HG23 H 10.065 -9.017 3.382 1.00 . A A . 56 VAL HG23 1 1 4 3666 1 1 56 VAL N N 6.351 -9.193 3.161 1.00 . A A . 56 VAL N 1 1 4 3667 1 1 56 VAL O O 6.302 -6.834 5.876 1.00 . A A . 56 VAL O 1 1 4 3668 1 1 57 GLN C C 4.722 -4.707 4.578 1.00 . A A . 57 GLN C 1 1 4 3669 1 1 57 GLN CA C 4.052 -6.082 4.568 1.00 . A A . 57 GLN CA 1 1 4 3670 1 1 57 GLN CB C 3.558 -6.427 5.975 1.00 . A A . 57 GLN CB 1 1 4 3671 1 1 57 GLN CD C 1.950 -7.885 7.218 1.00 . A A . 57 GLN CD 1 1 4 3672 1 1 57 GLN CG C 2.265 -7.238 5.869 1.00 . A A . 57 GLN CG 1 1 4 3673 1 1 57 GLN H H 4.861 -7.595 3.269 1.00 . A A . 57 GLN H 1 1 4 3674 1 1 57 GLN HA H 3.210 -6.060 3.894 1.00 . A A . 57 GLN HA 1 1 4 3675 1 1 57 GLN HB2 H 4.308 -7.008 6.491 1.00 . A A . 57 GLN HB2 1 1 4 3676 1 1 57 GLN HB3 H 3.366 -5.516 6.524 1.00 . A A . 57 GLN HB3 1 1 4 3677 1 1 57 GLN HE21 H 1.790 -6.151 8.172 1.00 . A A . 57 GLN HE21 1 1 4 3678 1 1 57 GLN HE22 H 1.539 -7.531 9.128 1.00 . A A . 57 GLN HE22 1 1 4 3679 1 1 57 GLN HG2 H 1.453 -6.584 5.583 1.00 . A A . 57 GLN HG2 1 1 4 3680 1 1 57 GLN HG3 H 2.386 -8.008 5.121 1.00 . A A . 57 GLN HG3 1 1 4 3681 1 1 57 GLN N N 5.021 -7.119 4.110 1.00 . A A . 57 GLN N 1 1 4 3682 1 1 57 GLN NE2 N 1.743 -7.126 8.259 1.00 . A A . 57 GLN NE2 1 1 4 3683 1 1 57 GLN O O 4.617 -3.953 3.631 1.00 . A A . 57 GLN O 1 1 4 3684 1 1 57 GLN OE1 O 1.891 -9.093 7.326 1.00 . A A . 57 GLN OE1 1 1 4 3685 1 1 58 CYS C C 4.990 -1.948 5.525 1.00 . A A . 58 CYS C 1 1 4 3686 1 1 58 CYS CA C 6.057 -3.031 5.694 1.00 . A A . 58 CYS CA 1 1 4 3687 1 1 58 CYS CB C 7.081 -2.918 4.562 1.00 . A A . 58 CYS CB 1 1 4 3688 1 1 58 CYS H H 5.469 -4.982 6.399 1.00 . A A . 58 CYS H 1 1 4 3689 1 1 58 CYS HA H 6.553 -2.909 6.645 1.00 . A A . 58 CYS HA 1 1 4 3690 1 1 58 CYS HB2 H 7.615 -3.853 4.466 1.00 . A A . 58 CYS HB2 1 1 4 3691 1 1 58 CYS HB3 H 6.572 -2.698 3.635 1.00 . A A . 58 CYS HB3 1 1 4 3692 1 1 58 CYS HG H 9.041 -1.986 5.310 1.00 . A A . 58 CYS HG 1 1 4 3693 1 1 58 CYS N N 5.400 -4.365 5.639 1.00 . A A . 58 CYS N 1 1 4 3694 1 1 58 CYS O O 5.238 -0.896 4.970 1.00 . A A . 58 CYS O 1 1 4 3695 1 1 58 CYS SG S 8.251 -1.589 4.939 1.00 . A A . 58 CYS SG 1 1 4 3696 1 1 59 ILE C C 2.351 -0.632 7.231 1.00 . A A . 59 ILE C 1 1 4 3697 1 1 59 ILE CA C 2.704 -1.202 5.856 1.00 . A A . 59 ILE CA 1 1 4 3698 1 1 59 ILE CB C 1.474 -1.887 5.254 1.00 . A A . 59 ILE CB 1 1 4 3699 1 1 59 ILE CD1 C -0.038 -1.052 3.447 1.00 . A A . 59 ILE CD1 1 1 4 3700 1 1 59 ILE CG1 C 0.430 -0.831 4.886 1.00 . A A . 59 ILE CG1 1 1 4 3701 1 1 59 ILE CG2 C 0.876 -2.856 6.276 1.00 . A A . 59 ILE CG2 1 1 4 3702 1 1 59 ILE H H 3.620 -3.064 6.431 1.00 . A A . 59 ILE H 1 1 4 3703 1 1 59 ILE HA H 3.026 -0.403 5.208 1.00 . A A . 59 ILE HA 1 1 4 3704 1 1 59 ILE HB H 1.764 -2.434 4.368 1.00 . A A . 59 ILE HB 1 1 4 3705 1 1 59 ILE HD11 H -0.107 -2.111 3.248 1.00 . A A . 59 ILE HD11 1 1 4 3706 1 1 59 ILE HD12 H -1.007 -0.595 3.310 1.00 . A A . 59 ILE HD12 1 1 4 3707 1 1 59 ILE HD13 H 0.668 -0.603 2.766 1.00 . A A . 59 ILE HD13 1 1 4 3708 1 1 59 ILE HG12 H -0.413 -0.910 5.558 1.00 . A A . 59 ILE HG12 1 1 4 3709 1 1 59 ILE HG13 H 0.869 0.147 4.973 1.00 . A A . 59 ILE HG13 1 1 4 3710 1 1 59 ILE HG21 H 1.602 -3.055 7.051 1.00 . A A . 59 ILE HG21 1 1 4 3711 1 1 59 ILE HG22 H -0.006 -2.416 6.715 1.00 . A A . 59 ILE HG22 1 1 4 3712 1 1 59 ILE HG23 H 0.612 -3.781 5.784 1.00 . A A . 59 ILE HG23 1 1 4 3713 1 1 59 ILE N N 3.798 -2.205 5.993 1.00 . A A . 59 ILE N 1 1 4 3714 1 1 59 ILE O O 2.592 -1.250 8.248 1.00 . A A . 59 ILE O 1 1 4 3715 1 1 60 HIS C C 0.255 2.121 8.412 1.00 . A A . 60 HIS C 1 1 4 3716 1 1 60 HIS CA C 1.418 1.142 8.590 1.00 . A A . 60 HIS CA 1 1 4 3717 1 1 60 HIS CB C 2.626 1.885 9.166 1.00 . A A . 60 HIS CB 1 1 4 3718 1 1 60 HIS CD2 C 4.523 0.185 9.820 1.00 . A A . 60 HIS CD2 1 1 4 3719 1 1 60 HIS CE1 C 5.641 0.233 7.965 1.00 . A A . 60 HIS CE1 1 1 4 3720 1 1 60 HIS CG C 3.868 1.053 8.982 1.00 . A A . 60 HIS CG 1 1 4 3721 1 1 60 HIS H H 1.593 1.034 6.443 1.00 . A A . 60 HIS H 1 1 4 3722 1 1 60 HIS HA H 1.125 0.356 9.269 1.00 . A A . 60 HIS HA 1 1 4 3723 1 1 60 HIS HB2 H 2.747 2.827 8.653 1.00 . A A . 60 HIS HB2 1 1 4 3724 1 1 60 HIS HB3 H 2.469 2.065 10.218 1.00 . A A . 60 HIS HB3 1 1 4 3725 1 1 60 HIS HD1 H 4.392 1.589 7.000 1.00 . A A . 60 HIS HD1 1 1 4 3726 1 1 60 HIS HD2 H 4.216 -0.060 10.825 1.00 . A A . 60 HIS HD2 1 1 4 3727 1 1 60 HIS HE1 H 6.388 0.043 7.206 1.00 . A A . 60 HIS HE1 1 1 4 3728 1 1 60 HIS N N 1.781 0.545 7.274 1.00 . A A . 60 HIS N 1 1 4 3729 1 1 60 HIS ND1 N 4.598 1.067 7.804 1.00 . A A . 60 HIS ND1 1 1 4 3730 1 1 60 HIS NE2 N 5.644 -0.331 9.175 1.00 . A A . 60 HIS NE2 1 1 4 3731 1 1 60 HIS O O 0.231 2.911 7.489 1.00 . A A . 60 HIS O 1 1 4 3732 1 1 61 TRP C C -1.474 4.385 9.711 1.00 . A A . 61 TRP C 1 1 4 3733 1 1 61 TRP CA C -1.871 3.003 9.186 1.00 . A A . 61 TRP CA 1 1 4 3734 1 1 61 TRP CB C -3.033 2.456 10.015 1.00 . A A . 61 TRP CB 1 1 4 3735 1 1 61 TRP CD1 C -2.852 -0.011 9.480 1.00 . A A . 61 TRP CD1 1 1 4 3736 1 1 61 TRP CD2 C -4.721 0.931 8.673 1.00 . A A . 61 TRP CD2 1 1 4 3737 1 1 61 TRP CE2 C -4.765 -0.429 8.297 1.00 . A A . 61 TRP CE2 1 1 4 3738 1 1 61 TRP CE3 C -5.781 1.763 8.292 1.00 . A A . 61 TRP CE3 1 1 4 3739 1 1 61 TRP CG C -3.504 1.173 9.420 1.00 . A A . 61 TRP CG 1 1 4 3740 1 1 61 TRP CH2 C -6.885 -0.107 7.191 1.00 . A A . 61 TRP CH2 1 1 4 3741 1 1 61 TRP CZ2 C -5.832 -0.949 7.564 1.00 . A A . 61 TRP CZ2 1 1 4 3742 1 1 61 TRP CZ3 C -6.859 1.248 7.554 1.00 . A A . 61 TRP CZ3 1 1 4 3743 1 1 61 TRP H H -0.664 1.431 10.030 1.00 . A A . 61 TRP H 1 1 4 3744 1 1 61 TRP HA H -2.178 3.086 8.153 1.00 . A A . 61 TRP HA 1 1 4 3745 1 1 61 TRP HB2 H -2.709 2.286 11.027 1.00 . A A . 61 TRP HB2 1 1 4 3746 1 1 61 TRP HB3 H -3.842 3.171 10.014 1.00 . A A . 61 TRP HB3 1 1 4 3747 1 1 61 TRP HD1 H -1.904 -0.183 9.969 1.00 . A A . 61 TRP HD1 1 1 4 3748 1 1 61 TRP HE1 H -3.354 -1.907 8.709 1.00 . A A . 61 TRP HE1 1 1 4 3749 1 1 61 TRP HE3 H -5.762 2.807 8.571 1.00 . A A . 61 TRP HE3 1 1 4 3750 1 1 61 TRP HH2 H -7.715 -0.500 6.623 1.00 . A A . 61 TRP HH2 1 1 4 3751 1 1 61 TRP HZ2 H -5.845 -1.992 7.286 1.00 . A A . 61 TRP HZ2 1 1 4 3752 1 1 61 TRP HZ3 H -7.673 1.898 7.266 1.00 . A A . 61 TRP HZ3 1 1 4 3753 1 1 61 TRP N N -0.707 2.076 9.294 1.00 . A A . 61 TRP N 1 1 4 3754 1 1 61 TRP NE1 N -3.601 -0.965 8.813 1.00 . A A . 61 TRP NE1 1 1 4 3755 1 1 61 TRP O O -0.451 4.548 10.345 1.00 . A A . 61 TRP O 1 1 4 3756 1 1 62 GLU C C -3.188 7.365 10.593 1.00 . A A . 62 GLU C 1 1 4 3757 1 1 62 GLU CA C -1.950 6.750 9.935 1.00 . A A . 62 GLU CA 1 1 4 3758 1 1 62 GLU CB C -1.511 7.618 8.753 1.00 . A A . 62 GLU CB 1 1 4 3759 1 1 62 GLU CD C -1.261 9.980 7.966 1.00 . A A . 62 GLU CD 1 1 4 3760 1 1 62 GLU CG C -1.432 9.082 9.193 1.00 . A A . 62 GLU CG 1 1 4 3761 1 1 62 GLU H H -3.098 5.225 8.939 1.00 . A A . 62 GLU H 1 1 4 3762 1 1 62 GLU HA H -1.149 6.695 10.658 1.00 . A A . 62 GLU HA 1 1 4 3763 1 1 62 GLU HB2 H -0.540 7.292 8.409 1.00 . A A . 62 GLU HB2 1 1 4 3764 1 1 62 GLU HB3 H -2.227 7.522 7.949 1.00 . A A . 62 GLU HB3 1 1 4 3765 1 1 62 GLU HG2 H -2.338 9.353 9.712 1.00 . A A . 62 GLU HG2 1 1 4 3766 1 1 62 GLU HG3 H -0.587 9.214 9.852 1.00 . A A . 62 GLU HG3 1 1 4 3767 1 1 62 GLU N N -2.278 5.380 9.452 1.00 . A A . 62 GLU N 1 1 4 3768 1 1 62 GLU O O -4.200 7.575 9.954 1.00 . A A . 62 GLU O 1 1 4 3769 1 1 62 GLU OE1 O -0.856 9.469 6.933 1.00 . A A . 62 GLU OE1 1 1 4 3770 1 1 62 GLU OE2 O -1.537 11.162 8.079 1.00 . A A . 62 GLU OE2 1 1 4 3771 1 1 63 ASP C C -4.029 9.736 12.827 1.00 . A A . 63 ASP C 1 1 4 3772 1 1 63 ASP CA C -4.293 8.253 12.558 1.00 . A A . 63 ASP CA 1 1 4 3773 1 1 63 ASP CB C -4.528 7.529 13.886 1.00 . A A . 63 ASP CB 1 1 4 3774 1 1 63 ASP CG C -5.652 6.505 13.716 1.00 . A A . 63 ASP CG 1 1 4 3775 1 1 63 ASP H H -2.292 7.475 12.362 1.00 . A A . 63 ASP H 1 1 4 3776 1 1 63 ASP HA H -5.169 8.151 11.935 1.00 . A A . 63 ASP HA 1 1 4 3777 1 1 63 ASP HB2 H -3.621 7.024 14.187 1.00 . A A . 63 ASP HB2 1 1 4 3778 1 1 63 ASP HB3 H -4.809 8.246 14.642 1.00 . A A . 63 ASP HB3 1 1 4 3779 1 1 63 ASP N N -3.117 7.653 11.865 1.00 . A A . 63 ASP N 1 1 4 3780 1 1 63 ASP O O -4.908 10.566 12.703 1.00 . A A . 63 ASP O 1 1 4 3781 1 1 63 ASP OD1 O -6.465 6.690 12.825 1.00 . A A . 63 ASP OD1 1 1 4 3782 1 1 63 ASP OD2 O -5.681 5.554 14.479 1.00 . A A . 63 ASP OD2 1 1 4 3783 1 1 64 GLU C C -0.989 11.704 13.448 1.00 . A A . 64 GLU C 1 1 4 3784 1 1 64 GLU CA C -2.505 11.506 13.469 1.00 . A A . 64 GLU CA 1 1 4 3785 1 1 64 GLU CB C -3.051 11.895 14.844 1.00 . A A . 64 GLU CB 1 1 4 3786 1 1 64 GLU CD C -3.533 13.826 16.353 1.00 . A A . 64 GLU CD 1 1 4 3787 1 1 64 GLU CG C -2.778 13.379 15.101 1.00 . A A . 64 GLU CG 1 1 4 3788 1 1 64 GLU H H -2.129 9.393 13.288 1.00 . A A . 64 GLU H 1 1 4 3789 1 1 64 GLU HA H -2.960 12.129 12.712 1.00 . A A . 64 GLU HA 1 1 4 3790 1 1 64 GLU HB2 H -4.115 11.713 14.873 1.00 . A A . 64 GLU HB2 1 1 4 3791 1 1 64 GLU HB3 H -2.564 11.306 15.605 1.00 . A A . 64 GLU HB3 1 1 4 3792 1 1 64 GLU HG2 H -1.719 13.529 15.244 1.00 . A A . 64 GLU HG2 1 1 4 3793 1 1 64 GLU HG3 H -3.114 13.959 14.254 1.00 . A A . 64 GLU HG3 1 1 4 3794 1 1 64 GLU N N -2.824 10.077 13.193 1.00 . A A . 64 GLU N 1 1 4 3795 1 1 64 GLU OE1 O -3.208 13.337 17.422 1.00 . A A . 64 GLU OE1 1 1 4 3796 1 1 64 GLU OE2 O -4.424 14.648 16.223 1.00 . A A . 64 GLU OE2 1 1 4 3797 2 2 1 SF4 FE1 FE 5.543 -4.300 -2.766 1.00 . B A . 65 SF4 FE1 1 1 4 3798 2 2 1 SF4 FE2 FE 4.166 -5.778 -0.681 1.00 . B A . 65 SF4 FE2 1 1 4 3799 2 2 1 SF4 FE3 FE 2.950 -4.174 -2.684 1.00 . B A . 65 SF4 FE3 1 1 4 3800 2 2 1 SF4 FE4 FE 4.351 -6.690 -3.429 1.00 . B A . 65 SF4 FE4 1 1 4 3801 2 2 1 SF4 S1 S 2.394 -6.435 -1.840 1.00 . B A . 65 SF4 S1 1 1 4 3802 2 2 1 SF4 S2 S 4.347 -4.414 -4.375 1.00 . B A . 65 SF4 S2 1 1 4 3803 2 2 1 SF4 S3 S 6.055 -6.585 -2.015 1.00 . B A . 65 SF4 S3 1 1 4 3804 2 2 1 SF4 S4 S 4.339 -3.325 -1.189 1.00 . B A . 65 SF4 S4 1 1 5 3805 1 1 1 ALA C C -7.486 8.950 10.190 1.00 . A A . 1 ALA C 1 1 5 3806 1 1 1 ALA CA C -7.297 10.453 10.395 1.00 . A A . 1 ALA CA 1 1 5 3807 1 1 1 ALA CB C -8.025 10.890 11.667 1.00 . A A . 1 ALA CB 1 1 5 3808 1 1 1 ALA HA H -6.245 10.674 10.487 1.00 . A A . 1 ALA HA 1 1 5 3809 1 1 1 ALA HB1 H -9.079 11.003 11.459 1.00 . A A . 1 ALA HB1 1 1 5 3810 1 1 1 ALA HB2 H -7.888 10.143 12.435 1.00 . A A . 1 ALA HB2 1 1 5 3811 1 1 1 ALA HB3 H -7.622 11.833 12.008 1.00 . A A . 1 ALA HB3 1 1 5 3812 1 1 1 ALA N N -7.858 11.187 9.224 1.00 . A A . 1 ALA N 1 1 5 3813 1 1 1 ALA O O -8.117 8.518 9.245 1.00 . A A . 1 ALA O 1 1 5 3814 1 1 2 ARG C C -6.859 6.292 9.454 1.00 . A A . 2 ARG C 1 1 5 3815 1 1 2 ARG CA C -7.090 6.673 10.916 1.00 . A A . 2 ARG CA 1 1 5 3816 1 1 2 ARG CB C -8.499 6.250 11.338 1.00 . A A . 2 ARG CB 1 1 5 3817 1 1 2 ARG CD C -9.837 5.921 13.421 1.00 . A A . 2 ARG CD 1 1 5 3818 1 1 2 ARG CG C -8.467 5.720 12.773 1.00 . A A . 2 ARG CG 1 1 5 3819 1 1 2 ARG CZ C -11.280 7.787 13.968 1.00 . A A . 2 ARG CZ 1 1 5 3820 1 1 2 ARG H H -6.436 8.516 11.819 1.00 . A A . 2 ARG H 1 1 5 3821 1 1 2 ARG HA H -6.361 6.174 11.534 1.00 . A A . 2 ARG HA 1 1 5 3822 1 1 2 ARG HB2 H -9.161 7.102 11.284 1.00 . A A . 2 ARG HB2 1 1 5 3823 1 1 2 ARG HB3 H -8.856 5.474 10.678 1.00 . A A . 2 ARG HB3 1 1 5 3824 1 1 2 ARG HD2 H -10.597 5.470 12.801 1.00 . A A . 2 ARG HD2 1 1 5 3825 1 1 2 ARG HD3 H -9.846 5.456 14.396 1.00 . A A . 2 ARG HD3 1 1 5 3826 1 1 2 ARG HE H -9.409 8.030 13.351 1.00 . A A . 2 ARG HE 1 1 5 3827 1 1 2 ARG HG2 H -8.222 4.667 12.763 1.00 . A A . 2 ARG HG2 1 1 5 3828 1 1 2 ARG HG3 H -7.720 6.257 13.339 1.00 . A A . 2 ARG HG3 1 1 5 3829 1 1 2 ARG HH11 H -12.220 7.262 12.281 1.00 . A A . 2 ARG HH11 1 1 5 3830 1 1 2 ARG HH12 H -13.216 7.979 13.502 1.00 . A A . 2 ARG HH12 1 1 5 3831 1 1 2 ARG HH21 H -10.613 8.410 15.750 1.00 . A A . 2 ARG HH21 1 1 5 3832 1 1 2 ARG HH22 H -12.307 8.630 15.465 1.00 . A A . 2 ARG HH22 1 1 5 3833 1 1 2 ARG N N -6.943 8.148 11.066 1.00 . A A . 2 ARG N 1 1 5 3834 1 1 2 ARG NE N -10.109 7.378 13.562 1.00 . A A . 2 ARG NE 1 1 5 3835 1 1 2 ARG NH1 N -12.320 7.667 13.190 1.00 . A A . 2 ARG NH1 1 1 5 3836 1 1 2 ARG NH2 N -11.410 8.317 15.154 1.00 . A A . 2 ARG NH2 1 1 5 3837 1 1 2 ARG O O -7.452 5.366 8.939 1.00 . A A . 2 ARG O 1 1 5 3838 1 1 3 LYS C C -4.718 5.551 7.270 1.00 . A A . 3 LYS C 1 1 5 3839 1 1 3 LYS CA C -5.719 6.707 7.363 1.00 . A A . 3 LYS CA 1 1 5 3840 1 1 3 LYS CB C -5.168 7.977 6.707 1.00 . A A . 3 LYS CB 1 1 5 3841 1 1 3 LYS CD C -4.264 9.806 8.145 1.00 . A A . 3 LYS CD 1 1 5 3842 1 1 3 LYS CE C -3.397 10.907 7.531 1.00 . A A . 3 LYS CE 1 1 5 3843 1 1 3 LYS CG C -3.944 8.467 7.475 1.00 . A A . 3 LYS CG 1 1 5 3844 1 1 3 LYS H H -5.535 7.748 9.219 1.00 . A A . 3 LYS H 1 1 5 3845 1 1 3 LYS HA H -6.624 6.419 6.864 1.00 . A A . 3 LYS HA 1 1 5 3846 1 1 3 LYS HB2 H -4.899 7.770 5.693 1.00 . A A . 3 LYS HB2 1 1 5 3847 1 1 3 LYS HB3 H -5.927 8.744 6.725 1.00 . A A . 3 LYS HB3 1 1 5 3848 1 1 3 LYS HD2 H -5.307 10.042 7.996 1.00 . A A . 3 LYS HD2 1 1 5 3849 1 1 3 LYS HD3 H -4.059 9.737 9.202 1.00 . A A . 3 LYS HD3 1 1 5 3850 1 1 3 LYS HE2 H -2.454 10.955 8.052 1.00 . A A . 3 LYS HE2 1 1 5 3851 1 1 3 LYS HE3 H -3.222 10.688 6.487 1.00 . A A . 3 LYS HE3 1 1 5 3852 1 1 3 LYS HG2 H -3.684 7.743 8.228 1.00 . A A . 3 LYS HG2 1 1 5 3853 1 1 3 LYS HG3 H -3.117 8.595 6.794 1.00 . A A . 3 LYS HG3 1 1 5 3854 1 1 3 LYS HZ1 H -4.530 12.293 8.594 1.00 . A A . 3 LYS HZ1 1 1 5 3855 1 1 3 LYS HZ2 H -3.415 12.989 7.517 1.00 . A A . 3 LYS HZ2 1 1 5 3856 1 1 3 LYS HZ3 H -4.842 12.280 6.927 1.00 . A A . 3 LYS HZ3 1 1 5 3857 1 1 3 LYS N N -5.999 7.006 8.785 1.00 . A A . 3 LYS N 1 1 5 3858 1 1 3 LYS NZ N -4.099 12.217 7.651 1.00 . A A . 3 LYS NZ 1 1 5 3859 1 1 3 LYS O O -4.742 4.632 8.065 1.00 . A A . 3 LYS O 1 1 5 3860 1 1 4 PHE C C -1.880 4.846 5.026 1.00 . A A . 4 PHE C 1 1 5 3861 1 1 4 PHE CA C -2.869 4.481 6.137 1.00 . A A . 4 PHE CA 1 1 5 3862 1 1 4 PHE CB C -3.609 3.191 5.766 1.00 . A A . 4 PHE CB 1 1 5 3863 1 1 4 PHE CD1 C -5.277 3.982 4.050 1.00 . A A . 4 PHE CD1 1 1 5 3864 1 1 4 PHE CD2 C -3.389 2.652 3.311 1.00 . A A . 4 PHE CD2 1 1 5 3865 1 1 4 PHE CE1 C -5.738 4.062 2.731 1.00 . A A . 4 PHE CE1 1 1 5 3866 1 1 4 PHE CE2 C -3.849 2.733 1.991 1.00 . A A . 4 PHE CE2 1 1 5 3867 1 1 4 PHE CG C -4.103 3.277 4.340 1.00 . A A . 4 PHE CG 1 1 5 3868 1 1 4 PHE CZ C -5.024 3.438 1.701 1.00 . A A . 4 PHE CZ 1 1 5 3869 1 1 4 PHE H H -3.864 6.314 5.680 1.00 . A A . 4 PHE H 1 1 5 3870 1 1 4 PHE HA H -2.333 4.337 7.060 1.00 . A A . 4 PHE HA 1 1 5 3871 1 1 4 PHE HB2 H -2.939 2.350 5.865 1.00 . A A . 4 PHE HB2 1 1 5 3872 1 1 4 PHE HB3 H -4.451 3.057 6.429 1.00 . A A . 4 PHE HB3 1 1 5 3873 1 1 4 PHE HD1 H -5.828 4.463 4.845 1.00 . A A . 4 PHE HD1 1 1 5 3874 1 1 4 PHE HD2 H -2.482 2.109 3.534 1.00 . A A . 4 PHE HD2 1 1 5 3875 1 1 4 PHE HE1 H -6.642 4.607 2.508 1.00 . A A . 4 PHE HE1 1 1 5 3876 1 1 4 PHE HE2 H -3.299 2.251 1.195 1.00 . A A . 4 PHE HE2 1 1 5 3877 1 1 4 PHE HZ H -5.379 3.500 0.683 1.00 . A A . 4 PHE HZ 1 1 5 3878 1 1 4 PHE N N -3.857 5.579 6.302 1.00 . A A . 4 PHE N 1 1 5 3879 1 1 4 PHE O O -1.938 5.915 4.453 1.00 . A A . 4 PHE O 1 1 5 3880 1 1 5 TYR C C 0.988 3.065 3.654 1.00 . A A . 5 TYR C 1 1 5 3881 1 1 5 TYR CA C 0.028 4.230 3.660 1.00 . A A . 5 TYR CA 1 1 5 3882 1 1 5 TYR CB C 0.812 5.505 3.966 1.00 . A A . 5 TYR CB 1 1 5 3883 1 1 5 TYR CD1 C 0.868 5.338 6.483 1.00 . A A . 5 TYR CD1 1 1 5 3884 1 1 5 TYR CD2 C 2.952 5.171 5.257 1.00 . A A . 5 TYR CD2 1 1 5 3885 1 1 5 TYR CE1 C 1.563 5.177 7.688 1.00 . A A . 5 TYR CE1 1 1 5 3886 1 1 5 TYR CE2 C 3.648 5.009 6.461 1.00 . A A . 5 TYR CE2 1 1 5 3887 1 1 5 TYR CG C 1.562 5.336 5.268 1.00 . A A . 5 TYR CG 1 1 5 3888 1 1 5 TYR CZ C 2.953 5.012 7.677 1.00 . A A . 5 TYR CZ 1 1 5 3889 1 1 5 TYR H H -0.943 3.100 5.198 1.00 . A A . 5 TYR H 1 1 5 3890 1 1 5 TYR HA H -0.462 4.314 2.702 1.00 . A A . 5 TYR HA 1 1 5 3891 1 1 5 TYR HB2 H 1.517 5.690 3.168 1.00 . A A . 5 TYR HB2 1 1 5 3892 1 1 5 TYR HB3 H 0.137 6.333 4.042 1.00 . A A . 5 TYR HB3 1 1 5 3893 1 1 5 TYR HD1 H -0.203 5.465 6.494 1.00 . A A . 5 TYR HD1 1 1 5 3894 1 1 5 TYR HD2 H 3.488 5.169 4.320 1.00 . A A . 5 TYR HD2 1 1 5 3895 1 1 5 TYR HE1 H 1.027 5.179 8.625 1.00 . A A . 5 TYR HE1 1 1 5 3896 1 1 5 TYR HE2 H 4.720 4.882 6.453 1.00 . A A . 5 TYR HE2 1 1 5 3897 1 1 5 TYR HH H 3.501 5.639 9.394 1.00 . A A . 5 TYR HH 1 1 5 3898 1 1 5 TYR N N -0.972 3.961 4.722 1.00 . A A . 5 TYR N 1 1 5 3899 1 1 5 TYR O O 0.778 2.080 4.335 1.00 . A A . 5 TYR O 1 1 5 3900 1 1 5 TYR OH O 3.638 4.851 8.865 1.00 . A A . 5 TYR OH 1 1 5 3901 1 1 6 VAL C C 4.409 2.469 3.056 1.00 . A A . 6 VAL C 1 1 5 3902 1 1 6 VAL CA C 2.977 2.003 2.927 1.00 . A A . 6 VAL CA 1 1 5 3903 1 1 6 VAL CB C 2.863 1.180 1.657 1.00 . A A . 6 VAL CB 1 1 5 3904 1 1 6 VAL CG1 C 3.066 -0.274 2.042 1.00 . A A . 6 VAL CG1 1 1 5 3905 1 1 6 VAL CG2 C 1.482 1.347 1.011 1.00 . A A . 6 VAL CG2 1 1 5 3906 1 1 6 VAL H H 2.220 3.944 2.364 1.00 . A A . 6 VAL H 1 1 5 3907 1 1 6 VAL HA H 2.740 1.372 3.770 1.00 . A A . 6 VAL HA 1 1 5 3908 1 1 6 VAL HB H 3.641 1.484 0.961 1.00 . A A . 6 VAL HB 1 1 5 3909 1 1 6 VAL HG11 H 3.410 -0.323 3.063 1.00 . A A . 6 VAL HG11 1 1 5 3910 1 1 6 VAL HG12 H 2.130 -0.802 1.950 1.00 . A A . 6 VAL HG12 1 1 5 3911 1 1 6 VAL HG13 H 3.801 -0.717 1.393 1.00 . A A . 6 VAL HG13 1 1 5 3912 1 1 6 VAL HG21 H 0.852 1.954 1.638 1.00 . A A . 6 VAL HG21 1 1 5 3913 1 1 6 VAL HG22 H 1.590 1.817 0.045 1.00 . A A . 6 VAL HG22 1 1 5 3914 1 1 6 VAL HG23 H 1.026 0.377 0.888 1.00 . A A . 6 VAL HG23 1 1 5 3915 1 1 6 VAL N N 2.044 3.146 2.914 1.00 . A A . 6 VAL N 1 1 5 3916 1 1 6 VAL O O 4.718 3.641 2.978 1.00 . A A . 6 VAL O 1 1 5 3917 1 1 7 ASP C C 7.472 1.128 2.275 1.00 . A A . 7 ASP C 1 1 5 3918 1 1 7 ASP CA C 6.715 1.867 3.347 1.00 . A A . 7 ASP CA 1 1 5 3919 1 1 7 ASP CB C 7.242 1.470 4.728 1.00 . A A . 7 ASP CB 1 1 5 3920 1 1 7 ASP CG C 8.769 1.561 4.737 1.00 . A A . 7 ASP CG 1 1 5 3921 1 1 7 ASP H H 5.003 0.597 3.274 1.00 . A A . 7 ASP H 1 1 5 3922 1 1 7 ASP HA H 6.852 2.912 3.192 1.00 . A A . 7 ASP HA 1 1 5 3923 1 1 7 ASP HB2 H 6.834 2.137 5.472 1.00 . A A . 7 ASP HB2 1 1 5 3924 1 1 7 ASP HB3 H 6.943 0.456 4.950 1.00 . A A . 7 ASP HB3 1 1 5 3925 1 1 7 ASP N N 5.289 1.533 3.232 1.00 . A A . 7 ASP N 1 1 5 3926 1 1 7 ASP O O 7.926 0.019 2.473 1.00 . A A . 7 ASP O 1 1 5 3927 1 1 7 ASP OD1 O 9.277 2.667 4.652 1.00 . A A . 7 ASP OD1 1 1 5 3928 1 1 7 ASP OD2 O 9.404 0.524 4.830 1.00 . A A . 7 ASP OD2 1 1 5 3929 1 1 8 GLN C C 9.837 0.938 0.417 1.00 . A A . 8 GLN C 1 1 5 3930 1 1 8 GLN CA C 8.368 1.079 0.032 1.00 . A A . 8 GLN CA 1 1 5 3931 1 1 8 GLN CB C 8.295 1.917 -1.221 1.00 . A A . 8 GLN CB 1 1 5 3932 1 1 8 GLN CD C 6.622 3.749 -0.941 1.00 . A A . 8 GLN CD 1 1 5 3933 1 1 8 GLN CG C 6.853 2.341 -1.492 1.00 . A A . 8 GLN CG 1 1 5 3934 1 1 8 GLN H H 7.235 2.628 1.006 1.00 . A A . 8 GLN H 1 1 5 3935 1 1 8 GLN HA H 7.950 0.103 -0.160 1.00 . A A . 8 GLN HA 1 1 5 3936 1 1 8 GLN HB2 H 8.917 2.795 -1.107 1.00 . A A . 8 GLN HB2 1 1 5 3937 1 1 8 GLN HB3 H 8.657 1.323 -2.030 1.00 . A A . 8 GLN HB3 1 1 5 3938 1 1 8 GLN HE21 H 4.864 3.296 -0.137 1.00 . A A . 8 GLN HE21 1 1 5 3939 1 1 8 GLN HE22 H 5.369 4.903 0.079 1.00 . A A . 8 GLN HE22 1 1 5 3940 1 1 8 GLN HG2 H 6.672 2.337 -2.557 1.00 . A A . 8 GLN HG2 1 1 5 3941 1 1 8 GLN HG3 H 6.176 1.652 -1.007 1.00 . A A . 8 GLN HG3 1 1 5 3942 1 1 8 GLN N N 7.619 1.736 1.135 1.00 . A A . 8 GLN N 1 1 5 3943 1 1 8 GLN NE2 N 5.528 4.005 -0.278 1.00 . A A . 8 GLN NE2 1 1 5 3944 1 1 8 GLN O O 10.731 1.274 -0.336 1.00 . A A . 8 GLN O 1 1 5 3945 1 1 8 GLN OE1 O 7.445 4.626 -1.117 1.00 . A A . 8 GLN OE1 1 1 5 3946 1 1 9 ASP C C 11.754 -1.244 2.177 1.00 . A A . 9 ASP C 1 1 5 3947 1 1 9 ASP CA C 11.485 0.252 2.041 1.00 . A A . 9 ASP CA 1 1 5 3948 1 1 9 ASP CB C 11.675 0.931 3.399 1.00 . A A . 9 ASP CB 1 1 5 3949 1 1 9 ASP CG C 12.950 1.774 3.375 1.00 . A A . 9 ASP CG 1 1 5 3950 1 1 9 ASP H H 9.337 0.176 2.142 1.00 . A A . 9 ASP H 1 1 5 3951 1 1 9 ASP HA H 12.168 0.679 1.321 1.00 . A A . 9 ASP HA 1 1 5 3952 1 1 9 ASP HB2 H 10.825 1.567 3.606 1.00 . A A . 9 ASP HB2 1 1 5 3953 1 1 9 ASP HB3 H 11.757 0.179 4.169 1.00 . A A . 9 ASP HB3 1 1 5 3954 1 1 9 ASP N N 10.084 0.439 1.576 1.00 . A A . 9 ASP N 1 1 5 3955 1 1 9 ASP O O 12.876 -1.701 2.080 1.00 . A A . 9 ASP O 1 1 5 3956 1 1 9 ASP OD1 O 13.175 2.444 2.379 1.00 . A A . 9 ASP OD1 1 1 5 3957 1 1 9 ASP OD2 O 13.682 1.736 4.350 1.00 . A A . 9 ASP OD2 1 1 5 3958 1 1 10 GLU C C 10.275 -4.158 1.306 1.00 . A A . 10 GLU C 1 1 5 3959 1 1 10 GLU CA C 10.888 -3.475 2.532 1.00 . A A . 10 GLU CA 1 1 5 3960 1 1 10 GLU CB C 10.168 -3.944 3.797 1.00 . A A . 10 GLU CB 1 1 5 3961 1 1 10 GLU CD C 11.961 -5.514 4.552 1.00 . A A . 10 GLU CD 1 1 5 3962 1 1 10 GLU CG C 11.193 -4.237 4.896 1.00 . A A . 10 GLU CG 1 1 5 3963 1 1 10 GLU H H 9.828 -1.609 2.462 1.00 . A A . 10 GLU H 1 1 5 3964 1 1 10 GLU HA H 11.938 -3.717 2.598 1.00 . A A . 10 GLU HA 1 1 5 3965 1 1 10 GLU HB2 H 9.492 -3.171 4.132 1.00 . A A . 10 GLU HB2 1 1 5 3966 1 1 10 GLU HB3 H 9.610 -4.840 3.580 1.00 . A A . 10 GLU HB3 1 1 5 3967 1 1 10 GLU HG2 H 11.884 -3.410 4.974 1.00 . A A . 10 GLU HG2 1 1 5 3968 1 1 10 GLU HG3 H 10.682 -4.369 5.838 1.00 . A A . 10 GLU HG3 1 1 5 3969 1 1 10 GLU N N 10.722 -2.006 2.394 1.00 . A A . 10 GLU N 1 1 5 3970 1 1 10 GLU O O 10.579 -5.292 0.993 1.00 . A A . 10 GLU O 1 1 5 3971 1 1 10 GLU OE1 O 12.449 -5.606 3.439 1.00 . A A . 10 GLU OE1 1 1 5 3972 1 1 10 GLU OE2 O 12.049 -6.377 5.409 1.00 . A A . 10 GLU OE2 1 1 5 3973 1 1 11 CYS C C 9.842 -4.721 -1.473 1.00 . A A . 11 CYS C 1 1 5 3974 1 1 11 CYS CA C 8.772 -4.056 -0.603 1.00 . A A . 11 CYS CA 1 1 5 3975 1 1 11 CYS CB C 8.084 -2.941 -1.399 1.00 . A A . 11 CYS CB 1 1 5 3976 1 1 11 CYS H H 9.187 -2.553 0.881 1.00 . A A . 11 CYS H 1 1 5 3977 1 1 11 CYS HA H 8.040 -4.792 -0.305 1.00 . A A . 11 CYS HA 1 1 5 3978 1 1 11 CYS HB2 H 7.323 -2.477 -0.788 1.00 . A A . 11 CYS HB2 1 1 5 3979 1 1 11 CYS HB3 H 8.817 -2.197 -1.677 1.00 . A A . 11 CYS HB3 1 1 5 3980 1 1 11 CYS N N 9.412 -3.466 0.608 1.00 . A A . 11 CYS N 1 1 5 3981 1 1 11 CYS O O 10.943 -4.224 -1.602 1.00 . A A . 11 CYS O 1 1 5 3982 1 1 11 CYS SG S 7.280 -3.450 -2.962 1.00 . A A . 11 CYS SG 1 1 5 3983 1 1 12 ILE C C 10.276 -6.194 -4.399 1.00 . A A . 12 ILE C 1 1 5 3984 1 1 12 ILE CA C 10.546 -6.521 -2.925 1.00 . A A . 12 ILE CA 1 1 5 3985 1 1 12 ILE CB C 10.488 -8.035 -2.696 1.00 . A A . 12 ILE CB 1 1 5 3986 1 1 12 ILE CD1 C 8.976 -10.038 -2.679 1.00 . A A . 12 ILE CD1 1 1 5 3987 1 1 12 ILE CG1 C 9.105 -8.568 -3.089 1.00 . A A . 12 ILE CG1 1 1 5 3988 1 1 12 ILE CG2 C 10.754 -8.328 -1.216 1.00 . A A . 12 ILE CG2 1 1 5 3989 1 1 12 ILE H H 8.642 -6.231 -1.956 1.00 . A A . 12 ILE H 1 1 5 3990 1 1 12 ILE HA H 11.529 -6.160 -2.660 1.00 . A A . 12 ILE HA 1 1 5 3991 1 1 12 ILE HB H 11.246 -8.517 -3.298 1.00 . A A . 12 ILE HB 1 1 5 3992 1 1 12 ILE HD11 H 9.784 -10.297 -2.011 1.00 . A A . 12 ILE HD11 1 1 5 3993 1 1 12 ILE HD12 H 8.032 -10.189 -2.177 1.00 . A A . 12 ILE HD12 1 1 5 3994 1 1 12 ILE HD13 H 9.022 -10.663 -3.558 1.00 . A A . 12 ILE HD13 1 1 5 3995 1 1 12 ILE HG12 H 8.341 -7.988 -2.594 1.00 . A A . 12 ILE HG12 1 1 5 3996 1 1 12 ILE HG13 H 8.981 -8.486 -4.158 1.00 . A A . 12 ILE HG13 1 1 5 3997 1 1 12 ILE HG21 H 10.375 -7.514 -0.616 1.00 . A A . 12 ILE HG21 1 1 5 3998 1 1 12 ILE HG22 H 10.260 -9.244 -0.931 1.00 . A A . 12 ILE HG22 1 1 5 3999 1 1 12 ILE HG23 H 11.817 -8.428 -1.056 1.00 . A A . 12 ILE HG23 1 1 5 4000 1 1 12 ILE N N 9.534 -5.840 -2.070 1.00 . A A . 12 ILE N 1 1 5 4001 1 1 12 ILE O O 11.161 -5.748 -5.103 1.00 . A A . 12 ILE O 1 1 5 4002 1 1 13 ALA C C 7.545 -6.920 -6.761 1.00 . A A . 13 ALA C 1 1 5 4003 1 1 13 ALA CA C 8.734 -6.076 -6.290 1.00 . A A . 13 ALA CA 1 1 5 4004 1 1 13 ALA CB C 9.935 -6.381 -7.187 1.00 . A A . 13 ALA CB 1 1 5 4005 1 1 13 ALA H H 8.364 -6.734 -4.270 1.00 . A A . 13 ALA H 1 1 5 4006 1 1 13 ALA HA H 8.483 -5.030 -6.374 1.00 . A A . 13 ALA HA 1 1 5 4007 1 1 13 ALA HB1 H 10.563 -7.121 -6.712 1.00 . A A . 13 ALA HB1 1 1 5 4008 1 1 13 ALA HB2 H 9.589 -6.761 -8.137 1.00 . A A . 13 ALA HB2 1 1 5 4009 1 1 13 ALA HB3 H 10.504 -5.477 -7.347 1.00 . A A . 13 ALA HB3 1 1 5 4010 1 1 13 ALA N N 9.062 -6.392 -4.863 1.00 . A A . 13 ALA N 1 1 5 4011 1 1 13 ALA O O 7.487 -7.327 -7.905 1.00 . A A . 13 ALA O 1 1 5 4012 1 1 14 CYS C C 4.205 -7.094 -6.548 1.00 . A A . 14 CYS C 1 1 5 4013 1 1 14 CYS CA C 5.422 -8.001 -6.358 1.00 . A A . 14 CYS CA 1 1 5 4014 1 1 14 CYS CB C 5.097 -9.089 -5.331 1.00 . A A . 14 CYS CB 1 1 5 4015 1 1 14 CYS H H 6.638 -6.853 -4.989 1.00 . A A . 14 CYS H 1 1 5 4016 1 1 14 CYS HA H 5.663 -8.467 -7.303 1.00 . A A . 14 CYS HA 1 1 5 4017 1 1 14 CYS HB2 H 4.783 -9.984 -5.850 1.00 . A A . 14 CYS HB2 1 1 5 4018 1 1 14 CYS HB3 H 5.981 -9.307 -4.751 1.00 . A A . 14 CYS HB3 1 1 5 4019 1 1 14 CYS N N 6.591 -7.188 -5.909 1.00 . A A . 14 CYS N 1 1 5 4020 1 1 14 CYS O O 4.132 -6.010 -6.005 1.00 . A A . 14 CYS O 1 1 5 4021 1 1 14 CYS SG S 3.777 -8.710 -4.118 1.00 . A A . 14 CYS SG 1 1 5 4022 1 1 15 GLU C C 0.897 -7.168 -6.660 1.00 . A A . 15 GLU C 1 1 5 4023 1 1 15 GLU CA C 2.039 -6.695 -7.562 1.00 . A A . 15 GLU CA 1 1 5 4024 1 1 15 GLU CB C 1.615 -6.824 -9.027 1.00 . A A . 15 GLU CB 1 1 5 4025 1 1 15 GLU CD C 1.784 -5.437 -11.098 1.00 . A A . 15 GLU CD 1 1 5 4026 1 1 15 GLU CG C 2.559 -6.002 -9.906 1.00 . A A . 15 GLU CG 1 1 5 4027 1 1 15 GLU H H 3.332 -8.406 -7.757 1.00 . A A . 15 GLU H 1 1 5 4028 1 1 15 GLU HA H 2.266 -5.663 -7.344 1.00 . A A . 15 GLU HA 1 1 5 4029 1 1 15 GLU HB2 H 1.659 -7.862 -9.323 1.00 . A A . 15 GLU HB2 1 1 5 4030 1 1 15 GLU HB3 H 0.607 -6.458 -9.144 1.00 . A A . 15 GLU HB3 1 1 5 4031 1 1 15 GLU HG2 H 2.975 -5.190 -9.327 1.00 . A A . 15 GLU HG2 1 1 5 4032 1 1 15 GLU HG3 H 3.358 -6.634 -10.265 1.00 . A A . 15 GLU HG3 1 1 5 4033 1 1 15 GLU N N 3.249 -7.530 -7.325 1.00 . A A . 15 GLU N 1 1 5 4034 1 1 15 GLU O O -0.244 -6.790 -6.840 1.00 . A A . 15 GLU O 1 1 5 4035 1 1 15 GLU OE1 O 0.570 -5.361 -11.007 1.00 . A A . 15 GLU OE1 1 1 5 4036 1 1 15 GLU OE2 O 2.417 -5.090 -12.082 1.00 . A A . 15 GLU OE2 1 1 5 4037 1 1 16 SER C C -0.769 -7.290 -4.374 1.00 . A A . 16 SER C 1 1 5 4038 1 1 16 SER CA C 0.114 -8.473 -4.779 1.00 . A A . 16 SER CA 1 1 5 4039 1 1 16 SER CB C 0.743 -9.094 -3.530 1.00 . A A . 16 SER CB 1 1 5 4040 1 1 16 SER H H 2.116 -8.280 -5.554 1.00 . A A . 16 SER H 1 1 5 4041 1 1 16 SER HA H -0.483 -9.213 -5.288 1.00 . A A . 16 SER HA 1 1 5 4042 1 1 16 SER HB2 H 1.626 -8.540 -3.257 1.00 . A A . 16 SER HB2 1 1 5 4043 1 1 16 SER HB3 H 0.033 -9.058 -2.715 1.00 . A A . 16 SER HB3 1 1 5 4044 1 1 16 SER HG H 1.769 -10.707 -3.167 1.00 . A A . 16 SER HG 1 1 5 4045 1 1 16 SER N N 1.190 -7.988 -5.687 1.00 . A A . 16 SER N 1 1 5 4046 1 1 16 SER O O -1.862 -7.120 -4.876 1.00 . A A . 16 SER O 1 1 5 4047 1 1 16 SER OG O 1.103 -10.441 -3.806 1.00 . A A . 16 SER OG 1 1 5 4048 1 1 17 CYS C C -1.532 -4.499 -4.284 1.00 . A A . 17 CYS C 1 1 5 4049 1 1 17 CYS CA C -1.101 -5.288 -3.049 1.00 . A A . 17 CYS CA 1 1 5 4050 1 1 17 CYS CB C -0.243 -4.402 -2.147 1.00 . A A . 17 CYS CB 1 1 5 4051 1 1 17 CYS H H 0.590 -6.620 -3.093 1.00 . A A . 17 CYS H 1 1 5 4052 1 1 17 CYS HA H -1.974 -5.621 -2.507 1.00 . A A . 17 CYS HA 1 1 5 4053 1 1 17 CYS HB2 H -0.882 -3.746 -1.576 1.00 . A A . 17 CYS HB2 1 1 5 4054 1 1 17 CYS HB3 H 0.330 -5.022 -1.474 1.00 . A A . 17 CYS HB3 1 1 5 4055 1 1 17 CYS N N -0.298 -6.468 -3.479 1.00 . A A . 17 CYS N 1 1 5 4056 1 1 17 CYS O O -2.687 -4.160 -4.448 1.00 . A A . 17 CYS O 1 1 5 4057 1 1 17 CYS SG S 0.946 -3.341 -3.050 1.00 . A A . 17 CYS SG 1 1 5 4058 1 1 18 VAL C C -2.140 -4.135 -7.085 1.00 . A A . 18 VAL C 1 1 5 4059 1 1 18 VAL CA C -0.963 -3.449 -6.389 1.00 . A A . 18 VAL CA 1 1 5 4060 1 1 18 VAL CB C 0.241 -3.413 -7.330 1.00 . A A . 18 VAL CB 1 1 5 4061 1 1 18 VAL CG1 C -0.112 -2.605 -8.579 1.00 . A A . 18 VAL CG1 1 1 5 4062 1 1 18 VAL CG2 C 1.424 -2.755 -6.616 1.00 . A A . 18 VAL CG2 1 1 5 4063 1 1 18 VAL H H 0.315 -4.498 -5.011 1.00 . A A . 18 VAL H 1 1 5 4064 1 1 18 VAL HA H -1.241 -2.441 -6.121 1.00 . A A . 18 VAL HA 1 1 5 4065 1 1 18 VAL HB H 0.505 -4.421 -7.617 1.00 . A A . 18 VAL HB 1 1 5 4066 1 1 18 VAL HG11 H -0.446 -1.620 -8.289 1.00 . A A . 18 VAL HG11 1 1 5 4067 1 1 18 VAL HG12 H 0.761 -2.517 -9.210 1.00 . A A . 18 VAL HG12 1 1 5 4068 1 1 18 VAL HG13 H -0.899 -3.106 -9.122 1.00 . A A . 18 VAL HG13 1 1 5 4069 1 1 18 VAL HG21 H 1.062 -1.966 -5.974 1.00 . A A . 18 VAL HG21 1 1 5 4070 1 1 18 VAL HG22 H 1.942 -3.493 -6.022 1.00 . A A . 18 VAL HG22 1 1 5 4071 1 1 18 VAL HG23 H 2.102 -2.341 -7.347 1.00 . A A . 18 VAL HG23 1 1 5 4072 1 1 18 VAL N N -0.609 -4.210 -5.161 1.00 . A A . 18 VAL N 1 1 5 4073 1 1 18 VAL O O -2.889 -3.514 -7.813 1.00 . A A . 18 VAL O 1 1 5 4074 1 1 19 GLU C C -4.708 -5.921 -6.683 1.00 . A A . 19 GLU C 1 1 5 4075 1 1 19 GLU CA C -3.448 -6.125 -7.513 1.00 . A A . 19 GLU CA 1 1 5 4076 1 1 19 GLU CB C -3.132 -7.618 -7.621 1.00 . A A . 19 GLU CB 1 1 5 4077 1 1 19 GLU CD C -4.648 -9.033 -9.014 1.00 . A A . 19 GLU CD 1 1 5 4078 1 1 19 GLU CG C -3.434 -8.103 -9.040 1.00 . A A . 19 GLU CG 1 1 5 4079 1 1 19 GLU H H -1.703 -5.896 -6.270 1.00 . A A . 19 GLU H 1 1 5 4080 1 1 19 GLU HA H -3.610 -5.711 -8.492 1.00 . A A . 19 GLU HA 1 1 5 4081 1 1 19 GLU HB2 H -2.088 -7.781 -7.398 1.00 . A A . 19 GLU HB2 1 1 5 4082 1 1 19 GLU HB3 H -3.741 -8.165 -6.918 1.00 . A A . 19 GLU HB3 1 1 5 4083 1 1 19 GLU HG2 H -3.643 -7.254 -9.674 1.00 . A A . 19 GLU HG2 1 1 5 4084 1 1 19 GLU HG3 H -2.579 -8.639 -9.426 1.00 . A A . 19 GLU HG3 1 1 5 4085 1 1 19 GLU N N -2.314 -5.411 -6.864 1.00 . A A . 19 GLU N 1 1 5 4086 1 1 19 GLU O O -5.792 -5.771 -7.210 1.00 . A A . 19 GLU O 1 1 5 4087 1 1 19 GLU OE1 O -5.365 -9.012 -8.028 1.00 . A A . 19 GLU OE1 1 1 5 4088 1 1 19 GLU OE2 O -4.841 -9.751 -9.981 1.00 . A A . 19 GLU OE2 1 1 5 4089 1 1 20 ILE C C -6.011 -4.138 -4.468 1.00 . A A . 20 ILE C 1 1 5 4090 1 1 20 ILE CA C -5.765 -5.645 -4.538 1.00 . A A . 20 ILE CA 1 1 5 4091 1 1 20 ILE CB C -5.511 -6.184 -3.135 1.00 . A A . 20 ILE CB 1 1 5 4092 1 1 20 ILE CD1 C -3.776 -7.916 -2.752 1.00 . A A . 20 ILE CD1 1 1 5 4093 1 1 20 ILE CG1 C -5.214 -7.657 -3.206 1.00 . A A . 20 ILE CG1 1 1 5 4094 1 1 20 ILE CG2 C -6.739 -5.952 -2.257 1.00 . A A . 20 ILE CG2 1 1 5 4095 1 1 20 ILE H H -3.688 -5.979 -4.983 1.00 . A A . 20 ILE H 1 1 5 4096 1 1 20 ILE HA H -6.625 -6.137 -4.967 1.00 . A A . 20 ILE HA 1 1 5 4097 1 1 20 ILE HB H -4.673 -5.697 -2.713 1.00 . A A . 20 ILE HB 1 1 5 4098 1 1 20 ILE HD11 H -3.240 -6.981 -2.707 1.00 . A A . 20 ILE HD11 1 1 5 4099 1 1 20 ILE HD12 H -3.784 -8.375 -1.774 1.00 . A A . 20 ILE HD12 1 1 5 4100 1 1 20 ILE HD13 H -3.291 -8.577 -3.455 1.00 . A A . 20 ILE HD13 1 1 5 4101 1 1 20 ILE HG12 H -5.893 -8.170 -2.566 1.00 . A A . 20 ILE HG12 1 1 5 4102 1 1 20 ILE HG13 H -5.334 -7.988 -4.212 1.00 . A A . 20 ILE HG13 1 1 5 4103 1 1 20 ILE HG21 H -7.633 -6.170 -2.823 1.00 . A A . 20 ILE HG21 1 1 5 4104 1 1 20 ILE HG22 H -6.694 -6.600 -1.395 1.00 . A A . 20 ILE HG22 1 1 5 4105 1 1 20 ILE HG23 H -6.761 -4.922 -1.933 1.00 . A A . 20 ILE HG23 1 1 5 4106 1 1 20 ILE N N -4.573 -5.881 -5.390 1.00 . A A . 20 ILE N 1 1 5 4107 1 1 20 ILE O O -6.807 -3.663 -3.682 1.00 . A A . 20 ILE O 1 1 5 4108 1 1 21 ALA C C -4.559 -1.273 -6.285 1.00 . A A . 21 ALA C 1 1 5 4109 1 1 21 ALA CA C -5.511 -1.903 -5.269 1.00 . A A . 21 ALA CA 1 1 5 4110 1 1 21 ALA CB C -5.201 -1.363 -3.872 1.00 . A A . 21 ALA CB 1 1 5 4111 1 1 21 ALA H H -4.683 -3.783 -5.916 1.00 . A A . 21 ALA H 1 1 5 4112 1 1 21 ALA HA H -6.531 -1.664 -5.533 1.00 . A A . 21 ALA HA 1 1 5 4113 1 1 21 ALA HB1 H -4.234 -1.724 -3.552 1.00 . A A . 21 ALA HB1 1 1 5 4114 1 1 21 ALA HB2 H -5.191 -0.284 -3.898 1.00 . A A . 21 ALA HB2 1 1 5 4115 1 1 21 ALA HB3 H -5.959 -1.700 -3.180 1.00 . A A . 21 ALA HB3 1 1 5 4116 1 1 21 ALA N N -5.326 -3.380 -5.287 1.00 . A A . 21 ALA N 1 1 5 4117 1 1 21 ALA O O -3.617 -0.597 -5.921 1.00 . A A . 21 ALA O 1 1 5 4118 1 1 22 PRO C C -4.176 0.540 -8.754 1.00 . A A . 22 PRO C 1 1 5 4119 1 1 22 PRO CA C -4.002 -0.977 -8.635 1.00 . A A . 22 PRO CA 1 1 5 4120 1 1 22 PRO CB C -4.538 -1.692 -9.877 1.00 . A A . 22 PRO CB 1 1 5 4121 1 1 22 PRO CD C -5.961 -2.328 -8.032 1.00 . A A . 22 PRO CD 1 1 5 4122 1 1 22 PRO CG C -5.940 -2.078 -9.522 1.00 . A A . 22 PRO CG 1 1 5 4123 1 1 22 PRO HA H -2.966 -1.231 -8.483 1.00 . A A . 22 PRO HA 1 1 5 4124 1 1 22 PRO HB2 H -4.499 -1.015 -10.721 1.00 . A A . 22 PRO HB2 1 1 5 4125 1 1 22 PRO HB3 H -3.930 -2.558 -10.085 1.00 . A A . 22 PRO HB3 1 1 5 4126 1 1 22 PRO HD2 H -6.899 -1.997 -7.605 1.00 . A A . 22 PRO HD2 1 1 5 4127 1 1 22 PRO HD3 H -5.796 -3.373 -7.821 1.00 . A A . 22 PRO HD3 1 1 5 4128 1 1 22 PRO HG2 H -6.616 -1.273 -9.777 1.00 . A A . 22 PRO HG2 1 1 5 4129 1 1 22 PRO HG3 H -6.217 -2.979 -10.048 1.00 . A A . 22 PRO HG3 1 1 5 4130 1 1 22 PRO N N -4.842 -1.523 -7.533 1.00 . A A . 22 PRO N 1 1 5 4131 1 1 22 PRO O O -3.555 1.180 -9.581 1.00 . A A . 22 PRO O 1 1 5 4132 1 1 23 GLY C C -4.504 3.266 -6.826 1.00 . A A . 23 GLY C 1 1 5 4133 1 1 23 GLY CA C -5.212 2.597 -8.007 1.00 . A A . 23 GLY CA 1 1 5 4134 1 1 23 GLY H H -5.502 0.594 -7.276 1.00 . A A . 23 GLY H 1 1 5 4135 1 1 23 GLY HA2 H -4.803 2.973 -8.934 1.00 . A A . 23 GLY HA2 1 1 5 4136 1 1 23 GLY HA3 H -6.267 2.819 -7.962 1.00 . A A . 23 GLY HA3 1 1 5 4137 1 1 23 GLY N N -5.010 1.123 -7.937 1.00 . A A . 23 GLY N 1 1 5 4138 1 1 23 GLY O O -3.839 4.271 -6.979 1.00 . A A . 23 GLY O 1 1 5 4139 1 1 24 ALA C C -2.534 2.847 -4.368 1.00 . A A . 24 ALA C 1 1 5 4140 1 1 24 ALA CA C -3.987 3.321 -4.455 1.00 . A A . 24 ALA CA 1 1 5 4141 1 1 24 ALA CB C -4.735 2.889 -3.192 1.00 . A A . 24 ALA CB 1 1 5 4142 1 1 24 ALA H H -5.189 1.908 -5.551 1.00 . A A . 24 ALA H 1 1 5 4143 1 1 24 ALA HA H -4.010 4.396 -4.535 1.00 . A A . 24 ALA HA 1 1 5 4144 1 1 24 ALA HB1 H -5.795 3.052 -3.329 1.00 . A A . 24 ALA HB1 1 1 5 4145 1 1 24 ALA HB2 H -4.554 1.841 -3.007 1.00 . A A . 24 ALA HB2 1 1 5 4146 1 1 24 ALA HB3 H -4.387 3.469 -2.350 1.00 . A A . 24 ALA HB3 1 1 5 4147 1 1 24 ALA N N -4.646 2.717 -5.649 1.00 . A A . 24 ALA N 1 1 5 4148 1 1 24 ALA O O -1.653 3.585 -3.974 1.00 . A A . 24 ALA O 1 1 5 4149 1 1 25 PHE C C -0.316 0.997 -6.078 1.00 . A A . 25 PHE C 1 1 5 4150 1 1 25 PHE CA C -0.888 1.094 -4.659 1.00 . A A . 25 PHE CA 1 1 5 4151 1 1 25 PHE CB C -0.922 -0.304 -4.032 1.00 . A A . 25 PHE CB 1 1 5 4152 1 1 25 PHE CD1 C 1.277 0.335 -2.958 1.00 . A A . 25 PHE CD1 1 1 5 4153 1 1 25 PHE CD2 C -0.114 -1.331 -1.882 1.00 . A A . 25 PHE CD2 1 1 5 4154 1 1 25 PHE CE1 C 2.227 0.193 -1.936 1.00 . A A . 25 PHE CE1 1 1 5 4155 1 1 25 PHE CE2 C 0.839 -1.474 -0.866 1.00 . A A . 25 PHE CE2 1 1 5 4156 1 1 25 PHE CG C 0.105 -0.428 -2.929 1.00 . A A . 25 PHE CG 1 1 5 4157 1 1 25 PHE CZ C 2.010 -0.708 -0.896 1.00 . A A . 25 PHE CZ 1 1 5 4158 1 1 25 PHE H H -3.008 1.043 -5.036 1.00 . A A . 25 PHE H 1 1 5 4159 1 1 25 PHE HA H -0.277 1.755 -4.058 1.00 . A A . 25 PHE HA 1 1 5 4160 1 1 25 PHE HB2 H -1.905 -0.487 -3.625 1.00 . A A . 25 PHE HB2 1 1 5 4161 1 1 25 PHE HB3 H -0.711 -1.039 -4.795 1.00 . A A . 25 PHE HB3 1 1 5 4162 1 1 25 PHE HD1 H 1.447 1.034 -3.759 1.00 . A A . 25 PHE HD1 1 1 5 4163 1 1 25 PHE HD2 H -1.020 -1.918 -1.857 1.00 . A A . 25 PHE HD2 1 1 5 4164 1 1 25 PHE HE1 H 3.127 0.778 -1.952 1.00 . A A . 25 PHE HE1 1 1 5 4165 1 1 25 PHE HE2 H 0.669 -2.170 -0.059 1.00 . A A . 25 PHE HE2 1 1 5 4166 1 1 25 PHE HZ H 2.747 -0.822 -0.122 1.00 . A A . 25 PHE HZ 1 1 5 4167 1 1 25 PHE N N -2.281 1.622 -4.726 1.00 . A A . 25 PHE N 1 1 5 4168 1 1 25 PHE O O -1.004 0.626 -7.009 1.00 . A A . 25 PHE O 1 1 5 4169 1 1 26 ALA C C 3.058 1.474 -7.503 1.00 . A A . 26 ALA C 1 1 5 4170 1 1 26 ALA CA C 1.546 1.249 -7.610 1.00 . A A . 26 ALA CA 1 1 5 4171 1 1 26 ALA CB C 0.932 2.323 -8.509 1.00 . A A . 26 ALA CB 1 1 5 4172 1 1 26 ALA H H 1.472 1.621 -5.491 1.00 . A A . 26 ALA H 1 1 5 4173 1 1 26 ALA HA H 1.357 0.272 -8.035 1.00 . A A . 26 ALA HA 1 1 5 4174 1 1 26 ALA HB1 H 0.787 3.230 -7.940 1.00 . A A . 26 ALA HB1 1 1 5 4175 1 1 26 ALA HB2 H 1.595 2.521 -9.338 1.00 . A A . 26 ALA HB2 1 1 5 4176 1 1 26 ALA HB3 H -0.020 1.977 -8.885 1.00 . A A . 26 ALA HB3 1 1 5 4177 1 1 26 ALA N N 0.935 1.326 -6.252 1.00 . A A . 26 ALA N 1 1 5 4178 1 1 26 ALA O O 3.511 2.502 -7.045 1.00 . A A . 26 ALA O 1 1 5 4179 1 1 27 MET C C 5.731 1.924 -8.630 1.00 . A A . 27 MET C 1 1 5 4180 1 1 27 MET CA C 5.321 0.687 -7.840 1.00 . A A . 27 MET CA 1 1 5 4181 1 1 27 MET CB C 6.010 -0.551 -8.416 1.00 . A A . 27 MET CB 1 1 5 4182 1 1 27 MET CE C 7.090 -3.394 -9.207 1.00 . A A . 27 MET CE 1 1 5 4183 1 1 27 MET CG C 5.465 -1.804 -7.724 1.00 . A A . 27 MET CG 1 1 5 4184 1 1 27 MET H H 3.462 -0.302 -8.288 1.00 . A A . 27 MET H 1 1 5 4185 1 1 27 MET HA H 5.606 0.815 -6.818 1.00 . A A . 27 MET HA 1 1 5 4186 1 1 27 MET HB2 H 5.815 -0.611 -9.478 1.00 . A A . 27 MET HB2 1 1 5 4187 1 1 27 MET HB3 H 7.074 -0.484 -8.248 1.00 . A A . 27 MET HB3 1 1 5 4188 1 1 27 MET HE1 H 7.558 -2.441 -9.413 1.00 . A A . 27 MET HE1 1 1 5 4189 1 1 27 MET HE2 H 7.534 -3.837 -8.326 1.00 . A A . 27 MET HE2 1 1 5 4190 1 1 27 MET HE3 H 7.235 -4.053 -10.049 1.00 . A A . 27 MET HE3 1 1 5 4191 1 1 27 MET HG2 H 6.138 -2.099 -6.933 1.00 . A A . 27 MET HG2 1 1 5 4192 1 1 27 MET HG3 H 4.492 -1.589 -7.306 1.00 . A A . 27 MET HG3 1 1 5 4193 1 1 27 MET N N 3.843 0.520 -7.922 1.00 . A A . 27 MET N 1 1 5 4194 1 1 27 MET O O 5.049 2.323 -9.553 1.00 . A A . 27 MET O 1 1 5 4195 1 1 27 MET SD S 5.320 -3.147 -8.929 1.00 . A A . 27 MET SD 1 1 5 4196 1 1 28 ASP C C 8.691 3.613 -9.395 1.00 . A A . 28 ASP C 1 1 5 4197 1 1 28 ASP CA C 7.223 3.751 -9.059 1.00 . A A . 28 ASP CA 1 1 5 4198 1 1 28 ASP CB C 7.014 4.978 -8.181 1.00 . A A . 28 ASP CB 1 1 5 4199 1 1 28 ASP CG C 6.433 6.124 -9.010 1.00 . A A . 28 ASP CG 1 1 5 4200 1 1 28 ASP H H 7.411 2.243 -7.536 1.00 . A A . 28 ASP H 1 1 5 4201 1 1 28 ASP HA H 6.636 3.830 -9.960 1.00 . A A . 28 ASP HA 1 1 5 4202 1 1 28 ASP HB2 H 6.331 4.732 -7.379 1.00 . A A . 28 ASP HB2 1 1 5 4203 1 1 28 ASP HB3 H 7.964 5.271 -7.767 1.00 . A A . 28 ASP HB3 1 1 5 4204 1 1 28 ASP N N 6.832 2.552 -8.293 1.00 . A A . 28 ASP N 1 1 5 4205 1 1 28 ASP O O 9.358 2.800 -8.795 1.00 . A A . 28 ASP O 1 1 5 4206 1 1 28 ASP OD1 O 5.613 5.850 -9.872 1.00 . A A . 28 ASP OD1 1 1 5 4207 1 1 28 ASP OD2 O 6.818 7.257 -8.771 1.00 . A A . 28 ASP OD2 1 1 5 4208 1 1 29 PRO C C 11.333 5.264 -9.723 1.00 . A A . 29 PRO C 1 1 5 4209 1 1 29 PRO CA C 10.571 4.383 -10.705 1.00 . A A . 29 PRO CA 1 1 5 4210 1 1 29 PRO CB C 10.577 4.965 -12.117 1.00 . A A . 29 PRO CB 1 1 5 4211 1 1 29 PRO CD C 8.411 5.429 -11.069 1.00 . A A . 29 PRO CD 1 1 5 4212 1 1 29 PRO CG C 9.344 5.820 -12.202 1.00 . A A . 29 PRO CG 1 1 5 4213 1 1 29 PRO HA H 10.952 3.375 -10.704 1.00 . A A . 29 PRO HA 1 1 5 4214 1 1 29 PRO HB2 H 11.484 5.539 -12.260 1.00 . A A . 29 PRO HB2 1 1 5 4215 1 1 29 PRO HB3 H 10.547 4.161 -12.833 1.00 . A A . 29 PRO HB3 1 1 5 4216 1 1 29 PRO HD2 H 8.208 6.290 -10.450 1.00 . A A . 29 PRO HD2 1 1 5 4217 1 1 29 PRO HD3 H 7.497 5.017 -11.454 1.00 . A A . 29 PRO HD3 1 1 5 4218 1 1 29 PRO HG2 H 9.622 6.861 -12.108 1.00 . A A . 29 PRO HG2 1 1 5 4219 1 1 29 PRO HG3 H 8.854 5.655 -13.148 1.00 . A A . 29 PRO HG3 1 1 5 4220 1 1 29 PRO N N 9.151 4.416 -10.318 1.00 . A A . 29 PRO N 1 1 5 4221 1 1 29 PRO O O 12.540 5.192 -9.597 1.00 . A A . 29 PRO O 1 1 5 4222 1 1 30 GLU C C 11.408 6.092 -6.717 1.00 . A A . 30 GLU C 1 1 5 4223 1 1 30 GLU CA C 11.239 6.939 -7.971 1.00 . A A . 30 GLU CA 1 1 5 4224 1 1 30 GLU CB C 10.328 8.134 -7.672 1.00 . A A . 30 GLU CB 1 1 5 4225 1 1 30 GLU CD C 10.352 10.309 -6.441 1.00 . A A . 30 GLU CD 1 1 5 4226 1 1 30 GLU CG C 11.179 9.350 -7.300 1.00 . A A . 30 GLU CG 1 1 5 4227 1 1 30 GLU H H 9.633 6.075 -9.102 1.00 . A A . 30 GLU H 1 1 5 4228 1 1 30 GLU HA H 12.203 7.281 -8.320 1.00 . A A . 30 GLU HA 1 1 5 4229 1 1 30 GLU HB2 H 9.737 8.362 -8.545 1.00 . A A . 30 GLU HB2 1 1 5 4230 1 1 30 GLU HB3 H 9.675 7.889 -6.848 1.00 . A A . 30 GLU HB3 1 1 5 4231 1 1 30 GLU HG2 H 12.048 9.026 -6.745 1.00 . A A . 30 GLU HG2 1 1 5 4232 1 1 30 GLU HG3 H 11.495 9.857 -8.199 1.00 . A A . 30 GLU HG3 1 1 5 4233 1 1 30 GLU N N 10.607 6.070 -8.994 1.00 . A A . 30 GLU N 1 1 5 4234 1 1 30 GLU O O 12.413 6.149 -6.036 1.00 . A A . 30 GLU O 1 1 5 4235 1 1 30 GLU OE1 O 9.145 10.339 -6.615 1.00 . A A . 30 GLU OE1 1 1 5 4236 1 1 30 GLU OE2 O 10.941 10.998 -5.623 1.00 . A A . 30 GLU OE2 1 1 5 4237 1 1 31 ILE C C 10.774 2.959 -5.733 1.00 . A A . 31 ILE C 1 1 5 4238 1 1 31 ILE CA C 10.521 4.378 -5.255 1.00 . A A . 31 ILE CA 1 1 5 4239 1 1 31 ILE CB C 9.232 4.425 -4.424 1.00 . A A . 31 ILE CB 1 1 5 4240 1 1 31 ILE CD1 C 8.088 6.364 -5.534 1.00 . A A . 31 ILE CD1 1 1 5 4241 1 1 31 ILE CG1 C 8.054 4.847 -5.303 1.00 . A A . 31 ILE CG1 1 1 5 4242 1 1 31 ILE CG2 C 9.405 5.421 -3.273 1.00 . A A . 31 ILE CG2 1 1 5 4243 1 1 31 ILE H H 9.646 5.232 -7.017 1.00 . A A . 31 ILE H 1 1 5 4244 1 1 31 ILE HA H 11.334 4.679 -4.653 1.00 . A A . 31 ILE HA 1 1 5 4245 1 1 31 ILE HB H 9.041 3.443 -4.015 1.00 . A A . 31 ILE HB 1 1 5 4246 1 1 31 ILE HD11 H 9.107 6.715 -5.474 1.00 . A A . 31 ILE HD11 1 1 5 4247 1 1 31 ILE HD12 H 7.684 6.591 -6.509 1.00 . A A . 31 ILE HD12 1 1 5 4248 1 1 31 ILE HD13 H 7.496 6.855 -4.776 1.00 . A A . 31 ILE HD13 1 1 5 4249 1 1 31 ILE HG12 H 8.119 4.334 -6.247 1.00 . A A . 31 ILE HG12 1 1 5 4250 1 1 31 ILE HG13 H 7.129 4.582 -4.814 1.00 . A A . 31 ILE HG13 1 1 5 4251 1 1 31 ILE HG21 H 10.136 6.166 -3.550 1.00 . A A . 31 ILE HG21 1 1 5 4252 1 1 31 ILE HG22 H 8.461 5.901 -3.069 1.00 . A A . 31 ILE HG22 1 1 5 4253 1 1 31 ILE HG23 H 9.742 4.897 -2.391 1.00 . A A . 31 ILE HG23 1 1 5 4254 1 1 31 ILE N N 10.429 5.274 -6.433 1.00 . A A . 31 ILE N 1 1 5 4255 1 1 31 ILE O O 10.859 2.043 -4.940 1.00 . A A . 31 ILE O 1 1 5 4256 1 1 32 GLU C C 10.395 0.411 -6.733 1.00 . A A . 32 GLU C 1 1 5 4257 1 1 32 GLU CA C 11.122 1.414 -7.601 1.00 . A A . 32 GLU CA 1 1 5 4258 1 1 32 GLU CB C 12.619 1.102 -7.615 1.00 . A A . 32 GLU CB 1 1 5 4259 1 1 32 GLU CD C 14.888 2.084 -7.975 1.00 . A A . 32 GLU CD 1 1 5 4260 1 1 32 GLU CG C 13.385 2.307 -8.160 1.00 . A A . 32 GLU CG 1 1 5 4261 1 1 32 GLU H H 10.811 3.540 -7.639 1.00 . A A . 32 GLU H 1 1 5 4262 1 1 32 GLU HA H 10.726 1.375 -8.604 1.00 . A A . 32 GLU HA 1 1 5 4263 1 1 32 GLU HB2 H 12.950 0.887 -6.609 1.00 . A A . 32 GLU HB2 1 1 5 4264 1 1 32 GLU HB3 H 12.803 0.245 -8.246 1.00 . A A . 32 GLU HB3 1 1 5 4265 1 1 32 GLU HG2 H 13.165 2.429 -9.210 1.00 . A A . 32 GLU HG2 1 1 5 4266 1 1 32 GLU HG3 H 13.087 3.195 -7.623 1.00 . A A . 32 GLU HG3 1 1 5 4267 1 1 32 GLU N N 10.889 2.776 -7.032 1.00 . A A . 32 GLU N 1 1 5 4268 1 1 32 GLU O O 10.871 -0.678 -6.479 1.00 . A A . 32 GLU O 1 1 5 4269 1 1 32 GLU OE1 O 15.324 2.035 -6.836 1.00 . A A . 32 GLU OE1 1 1 5 4270 1 1 32 GLU OE2 O 15.576 1.966 -8.975 1.00 . A A . 32 GLU OE2 1 1 5 4271 1 1 33 LYS C C 7.051 0.341 -5.186 1.00 . A A . 33 LYS C 1 1 5 4272 1 1 33 LYS CA C 8.497 -0.122 -5.337 1.00 . A A . 33 LYS CA 1 1 5 4273 1 1 33 LYS CB C 9.156 -0.111 -3.953 1.00 . A A . 33 LYS CB 1 1 5 4274 1 1 33 LYS CD C 10.873 -1.244 -2.541 1.00 . A A . 33 LYS CD 1 1 5 4275 1 1 33 LYS CE C 12.379 -1.028 -2.387 1.00 . A A . 33 LYS CE 1 1 5 4276 1 1 33 LYS CG C 10.454 -0.917 -3.976 1.00 . A A . 33 LYS CG 1 1 5 4277 1 1 33 LYS H H 8.901 1.706 -6.463 1.00 . A A . 33 LYS H 1 1 5 4278 1 1 33 LYS HA H 8.520 -1.125 -5.735 1.00 . A A . 33 LYS HA 1 1 5 4279 1 1 33 LYS HB2 H 9.375 0.909 -3.674 1.00 . A A . 33 LYS HB2 1 1 5 4280 1 1 33 LYS HB3 H 8.479 -0.543 -3.231 1.00 . A A . 33 LYS HB3 1 1 5 4281 1 1 33 LYS HD2 H 10.344 -0.597 -1.856 1.00 . A A . 33 LYS HD2 1 1 5 4282 1 1 33 LYS HD3 H 10.635 -2.273 -2.321 1.00 . A A . 33 LYS HD3 1 1 5 4283 1 1 33 LYS HE2 H 12.660 -0.094 -2.852 1.00 . A A . 33 LYS HE2 1 1 5 4284 1 1 33 LYS HE3 H 12.634 -0.998 -1.338 1.00 . A A . 33 LYS HE3 1 1 5 4285 1 1 33 LYS HG2 H 10.302 -1.834 -4.527 1.00 . A A . 33 LYS HG2 1 1 5 4286 1 1 33 LYS HG3 H 11.231 -0.337 -4.450 1.00 . A A . 33 LYS HG3 1 1 5 4287 1 1 33 LYS HZ1 H 12.481 -2.970 -3.131 1.00 . A A . 33 LYS HZ1 1 1 5 4288 1 1 33 LYS HZ2 H 13.422 -1.852 -3.990 1.00 . A A . 33 LYS HZ2 1 1 5 4289 1 1 33 LYS HZ3 H 13.939 -2.404 -2.469 1.00 . A A . 33 LYS HZ3 1 1 5 4290 1 1 33 LYS N N 9.251 0.797 -6.246 1.00 . A A . 33 LYS N 1 1 5 4291 1 1 33 LYS NZ N 13.111 -2.148 -3.044 1.00 . A A . 33 LYS NZ 1 1 5 4292 1 1 33 LYS O O 6.754 1.518 -5.252 1.00 . A A . 33 LYS O 1 1 5 4293 1 1 34 ALA C C 4.578 0.852 -3.720 1.00 . A A . 34 ALA C 1 1 5 4294 1 1 34 ALA CA C 4.712 -0.214 -4.808 1.00 . A A . 34 ALA CA 1 1 5 4295 1 1 34 ALA CB C 3.917 -1.456 -4.399 1.00 . A A . 34 ALA CB 1 1 5 4296 1 1 34 ALA H H 6.419 -1.524 -4.921 1.00 . A A . 34 ALA H 1 1 5 4297 1 1 34 ALA HA H 4.322 0.168 -5.737 1.00 . A A . 34 ALA HA 1 1 5 4298 1 1 34 ALA HB1 H 4.594 -2.210 -4.024 1.00 . A A . 34 ALA HB1 1 1 5 4299 1 1 34 ALA HB2 H 3.210 -1.191 -3.627 1.00 . A A . 34 ALA HB2 1 1 5 4300 1 1 34 ALA HB3 H 3.387 -1.842 -5.256 1.00 . A A . 34 ALA HB3 1 1 5 4301 1 1 34 ALA N N 6.148 -0.583 -4.975 1.00 . A A . 34 ALA N 1 1 5 4302 1 1 34 ALA O O 5.251 0.807 -2.714 1.00 . A A . 34 ALA O 1 1 5 4303 1 1 35 TYR C C 2.029 3.268 -2.811 1.00 . A A . 35 TYR C 1 1 5 4304 1 1 35 TYR CA C 3.504 2.866 -2.875 1.00 . A A . 35 TYR CA 1 1 5 4305 1 1 35 TYR CB C 4.401 4.078 -3.191 1.00 . A A . 35 TYR CB 1 1 5 4306 1 1 35 TYR CD1 C 3.034 4.415 -5.308 1.00 . A A . 35 TYR CD1 1 1 5 4307 1 1 35 TYR CD2 C 4.093 6.332 -4.275 1.00 . A A . 35 TYR CD2 1 1 5 4308 1 1 35 TYR CE1 C 2.525 5.241 -6.318 1.00 . A A . 35 TYR CE1 1 1 5 4309 1 1 35 TYR CE2 C 3.581 7.156 -5.282 1.00 . A A . 35 TYR CE2 1 1 5 4310 1 1 35 TYR CG C 3.818 4.958 -4.284 1.00 . A A . 35 TYR CG 1 1 5 4311 1 1 35 TYR CZ C 2.799 6.611 -6.304 1.00 . A A . 35 TYR CZ 1 1 5 4312 1 1 35 TYR H H 3.154 1.796 -4.719 1.00 . A A . 35 TYR H 1 1 5 4313 1 1 35 TYR HA H 3.786 2.474 -1.902 1.00 . A A . 35 TYR HA 1 1 5 4314 1 1 35 TYR HB2 H 4.519 4.669 -2.296 1.00 . A A . 35 TYR HB2 1 1 5 4315 1 1 35 TYR HB3 H 5.371 3.722 -3.506 1.00 . A A . 35 TYR HB3 1 1 5 4316 1 1 35 TYR HD1 H 2.814 3.365 -5.317 1.00 . A A . 35 TYR HD1 1 1 5 4317 1 1 35 TYR HD2 H 4.698 6.755 -3.487 1.00 . A A . 35 TYR HD2 1 1 5 4318 1 1 35 TYR HE1 H 1.921 4.818 -7.107 1.00 . A A . 35 TYR HE1 1 1 5 4319 1 1 35 TYR HE2 H 3.792 8.216 -5.271 1.00 . A A . 35 TYR HE2 1 1 5 4320 1 1 35 TYR HH H 1.895 6.864 -7.966 1.00 . A A . 35 TYR HH 1 1 5 4321 1 1 35 TYR N N 3.697 1.799 -3.907 1.00 . A A . 35 TYR N 1 1 5 4322 1 1 35 TYR O O 1.339 3.347 -3.807 1.00 . A A . 35 TYR O 1 1 5 4323 1 1 35 TYR OH O 2.299 7.424 -7.300 1.00 . A A . 35 TYR OH 1 1 5 4324 1 1 36 VAL C C -0.005 5.396 -1.681 1.00 . A A . 36 VAL C 1 1 5 4325 1 1 36 VAL CA C 0.113 3.884 -1.471 1.00 . A A . 36 VAL CA 1 1 5 4326 1 1 36 VAL CB C -0.342 3.475 -0.061 1.00 . A A . 36 VAL CB 1 1 5 4327 1 1 36 VAL CG1 C -1.364 4.463 0.500 1.00 . A A . 36 VAL CG1 1 1 5 4328 1 1 36 VAL CG2 C -0.972 2.081 -0.125 1.00 . A A . 36 VAL CG2 1 1 5 4329 1 1 36 VAL H H 2.110 3.414 -0.839 1.00 . A A . 36 VAL H 1 1 5 4330 1 1 36 VAL HA H -0.486 3.369 -2.208 1.00 . A A . 36 VAL HA 1 1 5 4331 1 1 36 VAL HB H 0.518 3.446 0.592 1.00 . A A . 36 VAL HB 1 1 5 4332 1 1 36 VAL HG11 H -1.920 4.903 -0.313 1.00 . A A . 36 VAL HG11 1 1 5 4333 1 1 36 VAL HG12 H -2.039 3.943 1.163 1.00 . A A . 36 VAL HG12 1 1 5 4334 1 1 36 VAL HG13 H -0.849 5.238 1.047 1.00 . A A . 36 VAL HG13 1 1 5 4335 1 1 36 VAL HG21 H -0.260 1.382 -0.538 1.00 . A A . 36 VAL HG21 1 1 5 4336 1 1 36 VAL HG22 H -1.251 1.766 0.870 1.00 . A A . 36 VAL HG22 1 1 5 4337 1 1 36 VAL HG23 H -1.850 2.112 -0.753 1.00 . A A . 36 VAL HG23 1 1 5 4338 1 1 36 VAL N N 1.538 3.501 -1.630 1.00 . A A . 36 VAL N 1 1 5 4339 1 1 36 VAL O O 0.252 6.179 -0.789 1.00 . A A . 36 VAL O 1 1 5 4340 1 1 37 LYS C C -1.912 7.687 -3.446 1.00 . A A . 37 LYS C 1 1 5 4341 1 1 37 LYS CA C -0.468 7.278 -3.132 1.00 . A A . 37 LYS CA 1 1 5 4342 1 1 37 LYS CB C 0.432 7.635 -4.320 1.00 . A A . 37 LYS CB 1 1 5 4343 1 1 37 LYS CD C -0.100 8.116 -6.713 1.00 . A A . 37 LYS CD 1 1 5 4344 1 1 37 LYS CE C -1.447 8.836 -6.796 1.00 . A A . 37 LYS CE 1 1 5 4345 1 1 37 LYS CG C -0.155 7.057 -5.611 1.00 . A A . 37 LYS CG 1 1 5 4346 1 1 37 LYS H H -0.552 5.162 -3.580 1.00 . A A . 37 LYS H 1 1 5 4347 1 1 37 LYS HA H -0.129 7.818 -2.261 1.00 . A A . 37 LYS HA 1 1 5 4348 1 1 37 LYS HB2 H 0.500 8.710 -4.407 1.00 . A A . 37 LYS HB2 1 1 5 4349 1 1 37 LYS HB3 H 1.417 7.224 -4.160 1.00 . A A . 37 LYS HB3 1 1 5 4350 1 1 37 LYS HD2 H 0.678 8.830 -6.486 1.00 . A A . 37 LYS HD2 1 1 5 4351 1 1 37 LYS HD3 H 0.111 7.641 -7.660 1.00 . A A . 37 LYS HD3 1 1 5 4352 1 1 37 LYS HE2 H -2.161 8.335 -6.159 1.00 . A A . 37 LYS HE2 1 1 5 4353 1 1 37 LYS HE3 H -1.329 9.859 -6.471 1.00 . A A . 37 LYS HE3 1 1 5 4354 1 1 37 LYS HG2 H 0.419 6.192 -5.911 1.00 . A A . 37 LYS HG2 1 1 5 4355 1 1 37 LYS HG3 H -1.182 6.766 -5.446 1.00 . A A . 37 LYS HG3 1 1 5 4356 1 1 37 LYS HZ1 H -1.200 8.417 -8.820 1.00 . A A . 37 LYS HZ1 1 1 5 4357 1 1 37 LYS HZ2 H -2.791 8.230 -8.265 1.00 . A A . 37 LYS HZ2 1 1 5 4358 1 1 37 LYS HZ3 H -2.156 9.786 -8.508 1.00 . A A . 37 LYS HZ3 1 1 5 4359 1 1 37 LYS N N -0.368 5.812 -2.865 1.00 . A A . 37 LYS N 1 1 5 4360 1 1 37 LYS NZ N -1.936 8.815 -8.203 1.00 . A A . 37 LYS NZ 1 1 5 4361 1 1 37 LYS O O -2.225 8.860 -3.508 1.00 . A A . 37 LYS O 1 1 5 4362 1 1 38 ASP C C -5.171 6.305 -3.116 1.00 . A A . 38 ASP C 1 1 5 4363 1 1 38 ASP CA C -4.202 7.128 -3.968 1.00 . A A . 38 ASP CA 1 1 5 4364 1 1 38 ASP CB C -4.481 6.872 -5.449 1.00 . A A . 38 ASP CB 1 1 5 4365 1 1 38 ASP CG C -5.930 7.246 -5.769 1.00 . A A . 38 ASP CG 1 1 5 4366 1 1 38 ASP H H -2.533 5.807 -3.606 1.00 . A A . 38 ASP H 1 1 5 4367 1 1 38 ASP HA H -4.345 8.178 -3.754 1.00 . A A . 38 ASP HA 1 1 5 4368 1 1 38 ASP HB2 H -3.813 7.473 -6.050 1.00 . A A . 38 ASP HB2 1 1 5 4369 1 1 38 ASP HB3 H -4.324 5.829 -5.670 1.00 . A A . 38 ASP HB3 1 1 5 4370 1 1 38 ASP N N -2.793 6.750 -3.652 1.00 . A A . 38 ASP N 1 1 5 4371 1 1 38 ASP O O -5.635 5.260 -3.522 1.00 . A A . 38 ASP O 1 1 5 4372 1 1 38 ASP OD1 O -6.484 8.060 -5.048 1.00 . A A . 38 ASP OD1 1 1 5 4373 1 1 38 ASP OD2 O -6.461 6.712 -6.729 1.00 . A A . 38 ASP OD2 1 1 5 4374 1 1 39 VAL C C -7.725 5.750 -1.832 1.00 . A A . 39 VAL C 1 1 5 4375 1 1 39 VAL CA C -6.429 6.025 -1.064 1.00 . A A . 39 VAL CA 1 1 5 4376 1 1 39 VAL CB C -6.739 6.862 0.178 1.00 . A A . 39 VAL CB 1 1 5 4377 1 1 39 VAL CG1 C -5.437 7.191 0.911 1.00 . A A . 39 VAL CG1 1 1 5 4378 1 1 39 VAL CG2 C -7.426 8.163 -0.242 1.00 . A A . 39 VAL CG2 1 1 5 4379 1 1 39 VAL H H -5.106 7.624 -1.634 1.00 . A A . 39 VAL H 1 1 5 4380 1 1 39 VAL HA H -5.980 5.089 -0.766 1.00 . A A . 39 VAL HA 1 1 5 4381 1 1 39 VAL HB H -7.391 6.305 0.835 1.00 . A A . 39 VAL HB 1 1 5 4382 1 1 39 VAL HG11 H -4.705 6.425 0.703 1.00 . A A . 39 VAL HG11 1 1 5 4383 1 1 39 VAL HG12 H -5.065 8.147 0.571 1.00 . A A . 39 VAL HG12 1 1 5 4384 1 1 39 VAL HG13 H -5.623 7.234 1.974 1.00 . A A . 39 VAL HG13 1 1 5 4385 1 1 39 VAL HG21 H -7.021 8.493 -1.188 1.00 . A A . 39 VAL HG21 1 1 5 4386 1 1 39 VAL HG22 H -8.487 7.993 -0.345 1.00 . A A . 39 VAL HG22 1 1 5 4387 1 1 39 VAL HG23 H -7.253 8.921 0.507 1.00 . A A . 39 VAL HG23 1 1 5 4388 1 1 39 VAL N N -5.486 6.774 -1.940 1.00 . A A . 39 VAL N 1 1 5 4389 1 1 39 VAL O O -8.352 4.723 -1.662 1.00 . A A . 39 VAL O 1 1 5 4390 1 1 40 GLU C C -9.175 5.344 -4.481 1.00 . A A . 40 GLU C 1 1 5 4391 1 1 40 GLU CA C -9.384 6.458 -3.452 1.00 . A A . 40 GLU CA 1 1 5 4392 1 1 40 GLU CB C -9.752 7.754 -4.175 1.00 . A A . 40 GLU CB 1 1 5 4393 1 1 40 GLU CD C -10.577 10.091 -3.881 1.00 . A A . 40 GLU CD 1 1 5 4394 1 1 40 GLU CG C -10.149 8.818 -3.150 1.00 . A A . 40 GLU CG 1 1 5 4395 1 1 40 GLU H H -7.608 7.482 -2.793 1.00 . A A . 40 GLU H 1 1 5 4396 1 1 40 GLU HA H -10.184 6.180 -2.781 1.00 . A A . 40 GLU HA 1 1 5 4397 1 1 40 GLU HB2 H -8.902 8.102 -4.745 1.00 . A A . 40 GLU HB2 1 1 5 4398 1 1 40 GLU HB3 H -10.581 7.572 -4.841 1.00 . A A . 40 GLU HB3 1 1 5 4399 1 1 40 GLU HG2 H -10.970 8.453 -2.551 1.00 . A A . 40 GLU HG2 1 1 5 4400 1 1 40 GLU HG3 H -9.306 9.038 -2.512 1.00 . A A . 40 GLU HG3 1 1 5 4401 1 1 40 GLU N N -8.129 6.662 -2.674 1.00 . A A . 40 GLU N 1 1 5 4402 1 1 40 GLU O O -10.115 4.832 -5.055 1.00 . A A . 40 GLU O 1 1 5 4403 1 1 40 GLU OE1 O -10.961 9.987 -5.034 1.00 . A A . 40 GLU OE1 1 1 5 4404 1 1 40 GLU OE2 O -10.511 11.150 -3.277 1.00 . A A . 40 GLU OE2 1 1 5 4405 1 1 41 GLY C C -8.023 2.526 -5.101 1.00 . A A . 41 GLY C 1 1 5 4406 1 1 41 GLY CA C -7.686 3.887 -5.716 1.00 . A A . 41 GLY CA 1 1 5 4407 1 1 41 GLY H H -7.202 5.391 -4.250 1.00 . A A . 41 GLY H 1 1 5 4408 1 1 41 GLY HA2 H -8.298 4.050 -6.592 1.00 . A A . 41 GLY HA2 1 1 5 4409 1 1 41 GLY HA3 H -6.644 3.903 -5.996 1.00 . A A . 41 GLY HA3 1 1 5 4410 1 1 41 GLY N N -7.949 4.966 -4.722 1.00 . A A . 41 GLY N 1 1 5 4411 1 1 41 GLY O O -7.922 1.501 -5.747 1.00 . A A . 41 GLY O 1 1 5 4412 1 1 42 ALA C C -9.601 1.475 -1.954 1.00 . A A . 42 ALA C 1 1 5 4413 1 1 42 ALA CA C -8.767 1.210 -3.209 1.00 . A A . 42 ALA CA 1 1 5 4414 1 1 42 ALA CB C -7.481 0.477 -2.822 1.00 . A A . 42 ALA CB 1 1 5 4415 1 1 42 ALA H H -8.501 3.341 -3.355 1.00 . A A . 42 ALA H 1 1 5 4416 1 1 42 ALA HA H -9.336 0.601 -3.897 1.00 . A A . 42 ALA HA 1 1 5 4417 1 1 42 ALA HB1 H -6.676 1.190 -2.722 1.00 . A A . 42 ALA HB1 1 1 5 4418 1 1 42 ALA HB2 H -7.626 -0.037 -1.884 1.00 . A A . 42 ALA HB2 1 1 5 4419 1 1 42 ALA HB3 H -7.232 -0.241 -3.590 1.00 . A A . 42 ALA HB3 1 1 5 4420 1 1 42 ALA N N -8.424 2.506 -3.860 1.00 . A A . 42 ALA N 1 1 5 4421 1 1 42 ALA O O -9.301 2.356 -1.173 1.00 . A A . 42 ALA O 1 1 5 4422 1 1 43 SER C C -10.831 0.333 0.675 1.00 . A A . 43 SER C 1 1 5 4423 1 1 43 SER CA C -11.508 0.933 -0.559 1.00 . A A . 43 SER CA 1 1 5 4424 1 1 43 SER CB C -12.859 0.254 -0.782 1.00 . A A . 43 SER CB 1 1 5 4425 1 1 43 SER H H -10.877 0.022 -2.402 1.00 . A A . 43 SER H 1 1 5 4426 1 1 43 SER HA H -11.659 1.992 -0.406 1.00 . A A . 43 SER HA 1 1 5 4427 1 1 43 SER HB2 H -12.983 -0.547 -0.073 1.00 . A A . 43 SER HB2 1 1 5 4428 1 1 43 SER HB3 H -13.649 0.978 -0.646 1.00 . A A . 43 SER HB3 1 1 5 4429 1 1 43 SER HG H -13.815 -0.500 -2.298 1.00 . A A . 43 SER HG 1 1 5 4430 1 1 43 SER N N -10.650 0.724 -1.758 1.00 . A A . 43 SER N 1 1 5 4431 1 1 43 SER O O -9.881 -0.421 0.575 1.00 . A A . 43 SER O 1 1 5 4432 1 1 43 SER OG O -12.904 -0.276 -2.100 1.00 . A A . 43 SER OG 1 1 5 4433 1 1 44 GLN C C -10.684 -1.404 3.028 1.00 . A A . 44 GLN C 1 1 5 4434 1 1 44 GLN CA C -10.711 0.125 3.091 1.00 . A A . 44 GLN CA 1 1 5 4435 1 1 44 GLN CB C -11.537 0.576 4.298 1.00 . A A . 44 GLN CB 1 1 5 4436 1 1 44 GLN CD C -13.838 0.719 5.263 1.00 . A A . 44 GLN CD 1 1 5 4437 1 1 44 GLN CG C -13.018 0.279 4.049 1.00 . A A . 44 GLN CG 1 1 5 4438 1 1 44 GLN H H -12.081 1.277 1.895 1.00 . A A . 44 GLN H 1 1 5 4439 1 1 44 GLN HA H -9.701 0.497 3.188 1.00 . A A . 44 GLN HA 1 1 5 4440 1 1 44 GLN HB2 H -11.207 0.045 5.179 1.00 . A A . 44 GLN HB2 1 1 5 4441 1 1 44 GLN HB3 H -11.406 1.636 4.446 1.00 . A A . 44 GLN HB3 1 1 5 4442 1 1 44 GLN HE21 H -13.543 2.655 4.938 1.00 . A A . 44 GLN HE21 1 1 5 4443 1 1 44 GLN HE22 H -14.495 2.284 6.293 1.00 . A A . 44 GLN HE22 1 1 5 4444 1 1 44 GLN HG2 H -13.352 0.820 3.175 1.00 . A A . 44 GLN HG2 1 1 5 4445 1 1 44 GLN HG3 H -13.153 -0.780 3.891 1.00 . A A . 44 GLN HG3 1 1 5 4446 1 1 44 GLN N N -11.317 0.667 1.842 1.00 . A A . 44 GLN N 1 1 5 4447 1 1 44 GLN NE2 N -13.969 1.991 5.520 1.00 . A A . 44 GLN NE2 1 1 5 4448 1 1 44 GLN O O -9.706 -2.028 3.382 1.00 . A A . 44 GLN O 1 1 5 4449 1 1 44 GLN OE1 O -14.364 -0.104 5.987 1.00 . A A . 44 GLN OE1 1 1 5 4450 1 1 45 GLU C C -10.806 -3.956 1.396 1.00 . A A . 45 GLU C 1 1 5 4451 1 1 45 GLU CA C -11.772 -3.499 2.492 1.00 . A A . 45 GLU CA 1 1 5 4452 1 1 45 GLU CB C -13.190 -3.968 2.159 1.00 . A A . 45 GLU CB 1 1 5 4453 1 1 45 GLU CD C -13.931 -5.007 4.305 1.00 . A A . 45 GLU CD 1 1 5 4454 1 1 45 GLU CG C -14.084 -3.793 3.387 1.00 . A A . 45 GLU CG 1 1 5 4455 1 1 45 GLU H H -12.527 -1.491 2.291 1.00 . A A . 45 GLU H 1 1 5 4456 1 1 45 GLU HA H -11.466 -3.919 3.439 1.00 . A A . 45 GLU HA 1 1 5 4457 1 1 45 GLU HB2 H -13.581 -3.381 1.341 1.00 . A A . 45 GLU HB2 1 1 5 4458 1 1 45 GLU HB3 H -13.168 -5.011 1.877 1.00 . A A . 45 GLU HB3 1 1 5 4459 1 1 45 GLU HG2 H -13.794 -2.898 3.918 1.00 . A A . 45 GLU HG2 1 1 5 4460 1 1 45 GLU HG3 H -15.114 -3.708 3.073 1.00 . A A . 45 GLU HG3 1 1 5 4461 1 1 45 GLU N N -11.747 -2.011 2.577 1.00 . A A . 45 GLU N 1 1 5 4462 1 1 45 GLU O O -10.474 -5.123 1.288 1.00 . A A . 45 GLU O 1 1 5 4463 1 1 45 GLU OE1 O -13.155 -5.886 3.968 1.00 . A A . 45 GLU OE1 1 1 5 4464 1 1 45 GLU OE2 O -14.594 -5.038 5.328 1.00 . A A . 45 GLU OE2 1 1 5 4465 1 1 46 GLU C C -7.986 -3.179 0.116 1.00 . A A . 46 GLU C 1 1 5 4466 1 1 46 GLU CA C -9.359 -3.403 -0.462 1.00 . A A . 46 GLU CA 1 1 5 4467 1 1 46 GLU CB C -9.558 -2.493 -1.673 1.00 . A A . 46 GLU CB 1 1 5 4468 1 1 46 GLU CD C -11.152 -2.164 -3.568 1.00 . A A . 46 GLU CD 1 1 5 4469 1 1 46 GLU CG C -11.029 -2.508 -2.082 1.00 . A A . 46 GLU CG 1 1 5 4470 1 1 46 GLU H H -10.565 -2.095 0.737 1.00 . A A . 46 GLU H 1 1 5 4471 1 1 46 GLU HA H -9.484 -4.439 -0.743 1.00 . A A . 46 GLU HA 1 1 5 4472 1 1 46 GLU HB2 H -9.265 -1.485 -1.416 1.00 . A A . 46 GLU HB2 1 1 5 4473 1 1 46 GLU HB3 H -8.952 -2.845 -2.490 1.00 . A A . 46 GLU HB3 1 1 5 4474 1 1 46 GLU HG2 H -11.443 -3.490 -1.903 1.00 . A A . 46 GLU HG2 1 1 5 4475 1 1 46 GLU HG3 H -11.569 -1.778 -1.499 1.00 . A A . 46 GLU HG3 1 1 5 4476 1 1 46 GLU N N -10.323 -3.037 0.604 1.00 . A A . 46 GLU N 1 1 5 4477 1 1 46 GLU O O -7.096 -4.000 0.015 1.00 . A A . 46 GLU O 1 1 5 4478 1 1 46 GLU OE1 O -10.551 -1.188 -3.983 1.00 . A A . 46 GLU OE1 1 1 5 4479 1 1 46 GLU OE2 O -11.849 -2.884 -4.266 1.00 . A A . 46 GLU OE2 1 1 5 4480 1 1 47 VAL C C -6.293 -2.855 2.456 1.00 . A A . 47 VAL C 1 1 5 4481 1 1 47 VAL CA C -6.556 -1.762 1.421 1.00 . A A . 47 VAL CA 1 1 5 4482 1 1 47 VAL CB C -6.675 -0.407 2.106 1.00 . A A . 47 VAL CB 1 1 5 4483 1 1 47 VAL CG1 C -5.421 -0.150 2.924 1.00 . A A . 47 VAL CG1 1 1 5 4484 1 1 47 VAL CG2 C -6.832 0.688 1.048 1.00 . A A . 47 VAL CG2 1 1 5 4485 1 1 47 VAL H H -8.584 -1.462 0.852 1.00 . A A . 47 VAL H 1 1 5 4486 1 1 47 VAL HA H -5.761 -1.743 0.690 1.00 . A A . 47 VAL HA 1 1 5 4487 1 1 47 VAL HB H -7.536 -0.407 2.760 1.00 . A A . 47 VAL HB 1 1 5 4488 1 1 47 VAL HG11 H -4.821 -1.047 2.946 1.00 . A A . 47 VAL HG11 1 1 5 4489 1 1 47 VAL HG12 H -4.860 0.653 2.474 1.00 . A A . 47 VAL HG12 1 1 5 4490 1 1 47 VAL HG13 H -5.703 0.122 3.929 1.00 . A A . 47 VAL HG13 1 1 5 4491 1 1 47 VAL HG21 H -6.895 0.237 0.070 1.00 . A A . 47 VAL HG21 1 1 5 4492 1 1 47 VAL HG22 H -7.732 1.250 1.244 1.00 . A A . 47 VAL HG22 1 1 5 4493 1 1 47 VAL HG23 H -5.978 1.350 1.085 1.00 . A A . 47 VAL HG23 1 1 5 4494 1 1 47 VAL N N -7.838 -2.073 0.768 1.00 . A A . 47 VAL N 1 1 5 4495 1 1 47 VAL O O -5.176 -3.294 2.652 1.00 . A A . 47 VAL O 1 1 5 4496 1 1 48 GLU C C -6.809 -5.679 3.415 1.00 . A A . 48 GLU C 1 1 5 4497 1 1 48 GLU CA C -7.196 -4.374 4.112 1.00 . A A . 48 GLU CA 1 1 5 4498 1 1 48 GLU CB C -8.554 -4.528 4.770 1.00 . A A . 48 GLU CB 1 1 5 4499 1 1 48 GLU CD C -9.270 -5.221 7.055 1.00 . A A . 48 GLU CD 1 1 5 4500 1 1 48 GLU CG C -8.438 -4.219 6.255 1.00 . A A . 48 GLU CG 1 1 5 4501 1 1 48 GLU H H -8.224 -2.956 2.935 1.00 . A A . 48 GLU H 1 1 5 4502 1 1 48 GLU HA H -6.456 -4.104 4.847 1.00 . A A . 48 GLU HA 1 1 5 4503 1 1 48 GLU HB2 H -9.249 -3.838 4.316 1.00 . A A . 48 GLU HB2 1 1 5 4504 1 1 48 GLU HB3 H -8.904 -5.525 4.628 1.00 . A A . 48 GLU HB3 1 1 5 4505 1 1 48 GLU HG2 H -7.404 -4.282 6.552 1.00 . A A . 48 GLU HG2 1 1 5 4506 1 1 48 GLU HG3 H -8.806 -3.221 6.433 1.00 . A A . 48 GLU HG3 1 1 5 4507 1 1 48 GLU N N -7.332 -3.311 3.110 1.00 . A A . 48 GLU N 1 1 5 4508 1 1 48 GLU O O -5.777 -6.256 3.689 1.00 . A A . 48 GLU O 1 1 5 4509 1 1 48 GLU OE1 O -10.390 -5.491 6.651 1.00 . A A . 48 GLU OE1 1 1 5 4510 1 1 48 GLU OE2 O -8.773 -5.706 8.060 1.00 . A A . 48 GLU OE2 1 1 5 4511 1 1 49 GLU C C -5.877 -7.310 1.236 1.00 . A A . 49 GLU C 1 1 5 4512 1 1 49 GLU CA C -7.294 -7.415 1.802 1.00 . A A . 49 GLU CA 1 1 5 4513 1 1 49 GLU CB C -8.286 -7.648 0.660 1.00 . A A . 49 GLU CB 1 1 5 4514 1 1 49 GLU CD C -8.198 -8.727 -1.594 1.00 . A A . 49 GLU CD 1 1 5 4515 1 1 49 GLU CG C -7.891 -8.912 -0.106 1.00 . A A . 49 GLU CG 1 1 5 4516 1 1 49 GLU H H -8.458 -5.669 2.298 1.00 . A A . 49 GLU H 1 1 5 4517 1 1 49 GLU HA H -7.344 -8.241 2.497 1.00 . A A . 49 GLU HA 1 1 5 4518 1 1 49 GLU HB2 H -9.280 -7.767 1.066 1.00 . A A . 49 GLU HB2 1 1 5 4519 1 1 49 GLU HB3 H -8.269 -6.803 -0.011 1.00 . A A . 49 GLU HB3 1 1 5 4520 1 1 49 GLU HG2 H -6.835 -9.096 0.024 1.00 . A A . 49 GLU HG2 1 1 5 4521 1 1 49 GLU HG3 H -8.453 -9.753 0.273 1.00 . A A . 49 GLU HG3 1 1 5 4522 1 1 49 GLU N N -7.631 -6.149 2.510 1.00 . A A . 49 GLU N 1 1 5 4523 1 1 49 GLU O O -5.062 -8.198 1.397 1.00 . A A . 49 GLU O 1 1 5 4524 1 1 49 GLU OE1 O -8.825 -7.737 -1.931 1.00 . A A . 49 GLU OE1 1 1 5 4525 1 1 49 GLU OE2 O -7.801 -9.581 -2.370 1.00 . A A . 49 GLU OE2 1 1 5 4526 1 1 50 ALA C C -3.183 -6.059 1.147 1.00 . A A . 50 ALA C 1 1 5 4527 1 1 50 ALA CA C -4.210 -6.047 0.011 1.00 . A A . 50 ALA CA 1 1 5 4528 1 1 50 ALA CB C -4.136 -4.701 -0.714 1.00 . A A . 50 ALA CB 1 1 5 4529 1 1 50 ALA H H -6.245 -5.515 0.471 1.00 . A A . 50 ALA H 1 1 5 4530 1 1 50 ALA HA H -4.000 -6.846 -0.686 1.00 . A A . 50 ALA HA 1 1 5 4531 1 1 50 ALA HB1 H -5.052 -4.536 -1.260 1.00 . A A . 50 ALA HB1 1 1 5 4532 1 1 50 ALA HB2 H -4.001 -3.909 0.008 1.00 . A A . 50 ALA HB2 1 1 5 4533 1 1 50 ALA HB3 H -3.304 -4.706 -1.401 1.00 . A A . 50 ALA HB3 1 1 5 4534 1 1 50 ALA N N -5.574 -6.222 0.582 1.00 . A A . 50 ALA N 1 1 5 4535 1 1 50 ALA O O -2.034 -6.408 0.959 1.00 . A A . 50 ALA O 1 1 5 4536 1 1 51 MET C C -2.310 -7.048 3.933 1.00 . A A . 51 MET C 1 1 5 4537 1 1 51 MET CA C -2.655 -5.627 3.480 1.00 . A A . 51 MET CA 1 1 5 4538 1 1 51 MET CB C -3.322 -4.876 4.636 1.00 . A A . 51 MET CB 1 1 5 4539 1 1 51 MET CE C -2.145 -2.053 7.208 1.00 . A A . 51 MET CE 1 1 5 4540 1 1 51 MET CG C -2.267 -4.084 5.410 1.00 . A A . 51 MET CG 1 1 5 4541 1 1 51 MET H H -4.522 -5.376 2.440 1.00 . A A . 51 MET H 1 1 5 4542 1 1 51 MET HA H -1.750 -5.112 3.194 1.00 . A A . 51 MET HA 1 1 5 4543 1 1 51 MET HB2 H -4.064 -4.197 4.241 1.00 . A A . 51 MET HB2 1 1 5 4544 1 1 51 MET HB3 H -3.796 -5.584 5.299 1.00 . A A . 51 MET HB3 1 1 5 4545 1 1 51 MET HE1 H -1.233 -2.023 6.626 1.00 . A A . 51 MET HE1 1 1 5 4546 1 1 51 MET HE2 H -2.829 -1.307 6.838 1.00 . A A . 51 MET HE2 1 1 5 4547 1 1 51 MET HE3 H -1.923 -1.852 8.247 1.00 . A A . 51 MET HE3 1 1 5 4548 1 1 51 MET HG2 H -1.368 -4.674 5.499 1.00 . A A . 51 MET HG2 1 1 5 4549 1 1 51 MET HG3 H -2.047 -3.167 4.883 1.00 . A A . 51 MET HG3 1 1 5 4550 1 1 51 MET N N -3.593 -5.664 2.321 1.00 . A A . 51 MET N 1 1 5 4551 1 1 51 MET O O -1.260 -7.289 4.495 1.00 . A A . 51 MET O 1 1 5 4552 1 1 51 MET SD S -2.898 -3.692 7.060 1.00 . A A . 51 MET SD 1 1 5 4553 1 1 52 ASP C C -2.275 -10.183 2.991 1.00 . A A . 52 ASP C 1 1 5 4554 1 1 52 ASP CA C -2.891 -9.387 4.145 1.00 . A A . 52 ASP CA 1 1 5 4555 1 1 52 ASP CB C -4.189 -10.062 4.592 1.00 . A A . 52 ASP CB 1 1 5 4556 1 1 52 ASP CG C -3.893 -11.025 5.744 1.00 . A A . 52 ASP CG 1 1 5 4557 1 1 52 ASP H H -4.028 -7.783 3.262 1.00 . A A . 52 ASP H 1 1 5 4558 1 1 52 ASP HA H -2.197 -9.365 4.974 1.00 . A A . 52 ASP HA 1 1 5 4559 1 1 52 ASP HB2 H -4.890 -9.309 4.922 1.00 . A A . 52 ASP HB2 1 1 5 4560 1 1 52 ASP HB3 H -4.613 -10.612 3.766 1.00 . A A . 52 ASP HB3 1 1 5 4561 1 1 52 ASP N N -3.182 -7.992 3.708 1.00 . A A . 52 ASP N 1 1 5 4562 1 1 52 ASP O O -1.825 -11.297 3.167 1.00 . A A . 52 ASP O 1 1 5 4563 1 1 52 ASP OD1 O -2.781 -11.521 5.805 1.00 . A A . 52 ASP OD1 1 1 5 4564 1 1 52 ASP OD2 O -4.786 -11.250 6.545 1.00 . A A . 52 ASP OD2 1 1 5 4565 1 1 53 THR C C -0.163 -10.095 0.567 1.00 . A A . 53 THR C 1 1 5 4566 1 1 53 THR CA C -1.669 -10.365 0.655 1.00 . A A . 53 THR CA 1 1 5 4567 1 1 53 THR CB C -2.344 -9.904 -0.638 1.00 . A A . 53 THR CB 1 1 5 4568 1 1 53 THR CG2 C -1.785 -10.701 -1.818 1.00 . A A . 53 THR CG2 1 1 5 4569 1 1 53 THR H H -2.625 -8.729 1.683 1.00 . A A . 53 THR H 1 1 5 4570 1 1 53 THR HA H -1.835 -11.424 0.786 1.00 . A A . 53 THR HA 1 1 5 4571 1 1 53 THR HB H -2.146 -8.855 -0.793 1.00 . A A . 53 THR HB 1 1 5 4572 1 1 53 THR HG1 H -3.950 -10.954 -0.961 1.00 . A A . 53 THR HG1 1 1 5 4573 1 1 53 THR HG21 H -0.709 -10.754 -1.739 1.00 . A A . 53 THR HG21 1 1 5 4574 1 1 53 THR HG22 H -2.197 -11.699 -1.805 1.00 . A A . 53 THR HG22 1 1 5 4575 1 1 53 THR HG23 H -2.054 -10.212 -2.742 1.00 . A A . 53 THR HG23 1 1 5 4576 1 1 53 THR N N -2.254 -9.627 1.811 1.00 . A A . 53 THR N 1 1 5 4577 1 1 53 THR O O 0.569 -10.819 -0.078 1.00 . A A . 53 THR O 1 1 5 4578 1 1 53 THR OG1 O -3.746 -10.115 -0.541 1.00 . A A . 53 THR OG1 1 1 5 4579 1 1 54 CYS C C 2.551 -9.807 1.924 1.00 . A A . 54 CYS C 1 1 5 4580 1 1 54 CYS CA C 1.768 -8.751 1.145 1.00 . A A . 54 CYS CA 1 1 5 4581 1 1 54 CYS CB C 2.033 -7.376 1.764 1.00 . A A . 54 CYS CB 1 1 5 4582 1 1 54 CYS H H -0.294 -8.481 1.719 1.00 . A A . 54 CYS H 1 1 5 4583 1 1 54 CYS HA H 2.093 -8.749 0.115 1.00 . A A . 54 CYS HA 1 1 5 4584 1 1 54 CYS HB2 H 1.368 -6.647 1.328 1.00 . A A . 54 CYS HB2 1 1 5 4585 1 1 54 CYS HB3 H 1.864 -7.422 2.829 1.00 . A A . 54 CYS HB3 1 1 5 4586 1 1 54 CYS N N 0.308 -9.058 1.205 1.00 . A A . 54 CYS N 1 1 5 4587 1 1 54 CYS O O 2.079 -10.326 2.916 1.00 . A A . 54 CYS O 1 1 5 4588 1 1 54 CYS SG S 3.747 -6.776 1.525 1.00 . A A . 54 CYS SG 1 1 5 4589 1 1 55 PRO C C 5.257 -10.456 3.351 1.00 . A A . 55 PRO C 1 1 5 4590 1 1 55 PRO CA C 4.609 -11.078 2.112 1.00 . A A . 55 PRO CA 1 1 5 4591 1 1 55 PRO CB C 5.657 -11.404 1.049 1.00 . A A . 55 PRO CB 1 1 5 4592 1 1 55 PRO CD C 4.363 -9.493 0.260 1.00 . A A . 55 PRO CD 1 1 5 4593 1 1 55 PRO CG C 5.698 -10.201 0.153 1.00 . A A . 55 PRO CG 1 1 5 4594 1 1 55 PRO HA H 4.053 -11.964 2.373 1.00 . A A . 55 PRO HA 1 1 5 4595 1 1 55 PRO HB2 H 6.607 -11.587 1.533 1.00 . A A . 55 PRO HB2 1 1 5 4596 1 1 55 PRO HB3 H 5.356 -12.287 0.509 1.00 . A A . 55 PRO HB3 1 1 5 4597 1 1 55 PRO HD2 H 4.513 -8.430 0.392 1.00 . A A . 55 PRO HD2 1 1 5 4598 1 1 55 PRO HD3 H 3.763 -9.684 -0.615 1.00 . A A . 55 PRO HD3 1 1 5 4599 1 1 55 PRO HG2 H 6.494 -9.542 0.467 1.00 . A A . 55 PRO HG2 1 1 5 4600 1 1 55 PRO HG3 H 5.861 -10.515 -0.867 1.00 . A A . 55 PRO HG3 1 1 5 4601 1 1 55 PRO N N 3.735 -10.080 1.448 1.00 . A A . 55 PRO N 1 1 5 4602 1 1 55 PRO O O 5.020 -10.876 4.466 1.00 . A A . 55 PRO O 1 1 5 4603 1 1 56 VAL C C 5.725 -7.813 4.969 1.00 . A A . 56 VAL C 1 1 5 4604 1 1 56 VAL CA C 6.716 -8.788 4.326 1.00 . A A . 56 VAL CA 1 1 5 4605 1 1 56 VAL CB C 7.954 -8.023 3.851 1.00 . A A . 56 VAL CB 1 1 5 4606 1 1 56 VAL CG1 C 8.523 -7.201 5.008 1.00 . A A . 56 VAL CG1 1 1 5 4607 1 1 56 VAL CG2 C 9.010 -9.019 3.364 1.00 . A A . 56 VAL CG2 1 1 5 4608 1 1 56 VAL H H 6.233 -9.119 2.256 1.00 . A A . 56 VAL H 1 1 5 4609 1 1 56 VAL HA H 7.007 -9.535 5.050 1.00 . A A . 56 VAL HA 1 1 5 4610 1 1 56 VAL HB H 7.679 -7.363 3.041 1.00 . A A . 56 VAL HB 1 1 5 4611 1 1 56 VAL HG11 H 8.573 -7.814 5.895 1.00 . A A . 56 VAL HG11 1 1 5 4612 1 1 56 VAL HG12 H 9.515 -6.857 4.750 1.00 . A A . 56 VAL HG12 1 1 5 4613 1 1 56 VAL HG13 H 7.885 -6.351 5.193 1.00 . A A . 56 VAL HG13 1 1 5 4614 1 1 56 VAL HG21 H 8.522 -9.878 2.930 1.00 . A A . 56 VAL HG21 1 1 5 4615 1 1 56 VAL HG22 H 9.636 -8.545 2.622 1.00 . A A . 56 VAL HG22 1 1 5 4616 1 1 56 VAL HG23 H 9.619 -9.334 4.199 1.00 . A A . 56 VAL HG23 1 1 5 4617 1 1 56 VAL N N 6.064 -9.448 3.164 1.00 . A A . 56 VAL N 1 1 5 4618 1 1 56 VAL O O 5.991 -7.234 6.004 1.00 . A A . 56 VAL O 1 1 5 4619 1 1 57 GLN C C 4.256 -5.395 5.357 1.00 . A A . 57 GLN C 1 1 5 4620 1 1 57 GLN CA C 3.571 -6.697 4.935 1.00 . A A . 57 GLN CA 1 1 5 4621 1 1 57 GLN CB C 2.913 -7.350 6.152 1.00 . A A . 57 GLN CB 1 1 5 4622 1 1 57 GLN CD C 1.597 -9.357 6.851 1.00 . A A . 57 GLN CD 1 1 5 4623 1 1 57 GLN CG C 1.930 -8.425 5.684 1.00 . A A . 57 GLN CG 1 1 5 4624 1 1 57 GLN H H 4.387 -8.108 3.529 1.00 . A A . 57 GLN H 1 1 5 4625 1 1 57 GLN HA H 2.819 -6.482 4.190 1.00 . A A . 57 GLN HA 1 1 5 4626 1 1 57 GLN HB2 H 3.673 -7.801 6.774 1.00 . A A . 57 GLN HB2 1 1 5 4627 1 1 57 GLN HB3 H 2.381 -6.601 6.720 1.00 . A A . 57 GLN HB3 1 1 5 4628 1 1 57 GLN HE21 H 2.485 -10.934 6.033 1.00 . A A . 57 GLN HE21 1 1 5 4629 1 1 57 GLN HE22 H 1.781 -11.205 7.554 1.00 . A A . 57 GLN HE22 1 1 5 4630 1 1 57 GLN HG2 H 1.024 -7.954 5.328 1.00 . A A . 57 GLN HG2 1 1 5 4631 1 1 57 GLN HG3 H 2.376 -8.998 4.885 1.00 . A A . 57 GLN HG3 1 1 5 4632 1 1 57 GLN N N 4.582 -7.629 4.362 1.00 . A A . 57 GLN N 1 1 5 4633 1 1 57 GLN NE2 N 1.986 -10.602 6.810 1.00 . A A . 57 GLN NE2 1 1 5 4634 1 1 57 GLN O O 4.410 -5.113 6.529 1.00 . A A . 57 GLN O 1 1 5 4635 1 1 57 GLN OE1 O 0.977 -8.949 7.813 1.00 . A A . 57 GLN OE1 1 1 5 4636 1 1 58 CYS C C 4.303 -2.190 4.760 1.00 . A A . 58 CYS C 1 1 5 4637 1 1 58 CYS CA C 5.342 -3.313 4.749 1.00 . A A . 58 CYS CA 1 1 5 4638 1 1 58 CYS CB C 6.416 -2.999 3.701 1.00 . A A . 58 CYS CB 1 1 5 4639 1 1 58 CYS H H 4.533 -4.845 3.470 1.00 . A A . 58 CYS H 1 1 5 4640 1 1 58 CYS HA H 5.800 -3.391 5.724 1.00 . A A . 58 CYS HA 1 1 5 4641 1 1 58 CYS HB2 H 5.963 -2.481 2.868 1.00 . A A . 58 CYS HB2 1 1 5 4642 1 1 58 CYS HB3 H 7.176 -2.372 4.143 1.00 . A A . 58 CYS HB3 1 1 5 4643 1 1 58 CYS HG H 7.157 -5.169 3.836 1.00 . A A . 58 CYS HG 1 1 5 4644 1 1 58 CYS N N 4.668 -4.599 4.409 1.00 . A A . 58 CYS N 1 1 5 4645 1 1 58 CYS O O 4.629 -1.027 4.626 1.00 . A A . 58 CYS O 1 1 5 4646 1 1 58 CYS SG S 7.169 -4.537 3.113 1.00 . A A . 58 CYS SG 1 1 5 4647 1 1 59 ILE C C 1.490 -1.277 6.349 1.00 . A A . 59 ILE C 1 1 5 4648 1 1 59 ILE CA C 1.989 -1.494 4.921 1.00 . A A . 59 ILE CA 1 1 5 4649 1 1 59 ILE CB C 0.830 -1.956 4.038 1.00 . A A . 59 ILE CB 1 1 5 4650 1 1 59 ILE CD1 C -0.856 -0.749 2.646 1.00 . A A . 59 ILE CD1 1 1 5 4651 1 1 59 ILE CG1 C -0.276 -0.898 4.054 1.00 . A A . 59 ILE CG1 1 1 5 4652 1 1 59 ILE CG2 C 0.281 -3.277 4.576 1.00 . A A . 59 ILE CG2 1 1 5 4653 1 1 59 ILE H H 2.817 -3.478 5.011 1.00 . A A . 59 ILE H 1 1 5 4654 1 1 59 ILE HA H 2.384 -0.567 4.538 1.00 . A A . 59 ILE HA 1 1 5 4655 1 1 59 ILE HB H 1.182 -2.098 3.027 1.00 . A A . 59 ILE HB 1 1 5 4656 1 1 59 ILE HD11 H -0.076 -0.906 1.917 1.00 . A A . 59 ILE HD11 1 1 5 4657 1 1 59 ILE HD12 H -1.638 -1.481 2.500 1.00 . A A . 59 ILE HD12 1 1 5 4658 1 1 59 ILE HD13 H -1.265 0.243 2.528 1.00 . A A . 59 ILE HD13 1 1 5 4659 1 1 59 ILE HG12 H -1.057 -1.204 4.736 1.00 . A A . 59 ILE HG12 1 1 5 4660 1 1 59 ILE HG13 H 0.133 0.047 4.374 1.00 . A A . 59 ILE HG13 1 1 5 4661 1 1 59 ILE HG21 H 1.073 -4.010 4.608 1.00 . A A . 59 ILE HG21 1 1 5 4662 1 1 59 ILE HG22 H -0.111 -3.126 5.572 1.00 . A A . 59 ILE HG22 1 1 5 4663 1 1 59 ILE HG23 H -0.509 -3.629 3.928 1.00 . A A . 59 ILE HG23 1 1 5 4664 1 1 59 ILE N N 3.056 -2.533 4.911 1.00 . A A . 59 ILE N 1 1 5 4665 1 1 59 ILE O O 1.372 -2.205 7.125 1.00 . A A . 59 ILE O 1 1 5 4666 1 1 60 HIS C C -0.239 1.437 8.029 1.00 . A A . 60 HIS C 1 1 5 4667 1 1 60 HIS CA C 0.698 0.230 8.074 1.00 . A A . 60 HIS CA 1 1 5 4668 1 1 60 HIS CB C 1.885 0.537 8.991 1.00 . A A . 60 HIS CB 1 1 5 4669 1 1 60 HIS CD2 C 3.424 -1.595 8.996 1.00 . A A . 60 HIS CD2 1 1 5 4670 1 1 60 HIS CE1 C 4.916 -0.906 7.584 1.00 . A A . 60 HIS CE1 1 1 5 4671 1 1 60 HIS CG C 3.052 -0.330 8.609 1.00 . A A . 60 HIS CG 1 1 5 4672 1 1 60 HIS H H 1.295 0.677 6.055 1.00 . A A . 60 HIS H 1 1 5 4673 1 1 60 HIS HA H 0.164 -0.630 8.451 1.00 . A A . 60 HIS HA 1 1 5 4674 1 1 60 HIS HB2 H 2.159 1.577 8.887 1.00 . A A . 60 HIS HB2 1 1 5 4675 1 1 60 HIS HB3 H 1.608 0.338 10.015 1.00 . A A . 60 HIS HB3 1 1 5 4676 1 1 60 HIS HD1 H 4.045 0.954 7.246 1.00 . A A . 60 HIS HD1 1 1 5 4677 1 1 60 HIS HD2 H 2.885 -2.214 9.698 1.00 . A A . 60 HIS HD2 1 1 5 4678 1 1 60 HIS HE1 H 5.787 -0.860 6.947 1.00 . A A . 60 HIS HE1 1 1 5 4679 1 1 60 HIS N N 1.193 -0.055 6.698 1.00 . A A . 60 HIS N 1 1 5 4680 1 1 60 HIS ND1 N 4.019 0.090 7.708 1.00 . A A . 60 HIS ND1 1 1 5 4681 1 1 60 HIS NE2 N 4.602 -1.955 8.348 1.00 . A A . 60 HIS NE2 1 1 5 4682 1 1 60 HIS O O -0.018 2.378 7.293 1.00 . A A . 60 HIS O 1 1 5 4683 1 1 61 TRP C C -1.501 3.845 9.195 1.00 . A A . 61 TRP C 1 1 5 4684 1 1 61 TRP CA C -2.236 2.566 8.802 1.00 . A A . 61 TRP CA 1 1 5 4685 1 1 61 TRP CB C -3.367 2.297 9.795 1.00 . A A . 61 TRP CB 1 1 5 4686 1 1 61 TRP CD1 C -3.692 -0.205 9.561 1.00 . A A . 61 TRP CD1 1 1 5 4687 1 1 61 TRP CD2 C -5.399 0.991 8.731 1.00 . A A . 61 TRP CD2 1 1 5 4688 1 1 61 TRP CE2 C -5.728 -0.367 8.526 1.00 . A A . 61 TRP CE2 1 1 5 4689 1 1 61 TRP CE3 C -6.304 1.968 8.302 1.00 . A A . 61 TRP CE3 1 1 5 4690 1 1 61 TRP CG C -4.111 1.070 9.385 1.00 . A A . 61 TRP CG 1 1 5 4691 1 1 61 TRP CH2 C -7.817 0.243 7.487 1.00 . A A . 61 TRP CH2 1 1 5 4692 1 1 61 TRP CZ2 C -6.921 -0.744 7.910 1.00 . A A . 61 TRP CZ2 1 1 5 4693 1 1 61 TRP CZ3 C -7.509 1.599 7.683 1.00 . A A . 61 TRP CZ3 1 1 5 4694 1 1 61 TRP H H -1.449 0.649 9.391 1.00 . A A . 61 TRP H 1 1 5 4695 1 1 61 TRP HA H -2.653 2.690 7.811 1.00 . A A . 61 TRP HA 1 1 5 4696 1 1 61 TRP HB2 H -2.963 2.158 10.780 1.00 . A A . 61 TRP HB2 1 1 5 4697 1 1 61 TRP HB3 H -4.044 3.138 9.803 1.00 . A A . 61 TRP HB3 1 1 5 4698 1 1 61 TRP HD1 H -2.764 -0.506 10.022 1.00 . A A . 61 TRP HD1 1 1 5 4699 1 1 61 TRP HE1 H -4.598 -2.040 9.048 1.00 . A A . 61 TRP HE1 1 1 5 4700 1 1 61 TRP HE3 H -6.066 3.011 8.453 1.00 . A A . 61 TRP HE3 1 1 5 4701 1 1 61 TRP HH2 H -8.746 -0.037 7.012 1.00 . A A . 61 TRP HH2 1 1 5 4702 1 1 61 TRP HZ2 H -7.152 -1.788 7.763 1.00 . A A . 61 TRP HZ2 1 1 5 4703 1 1 61 TRP HZ3 H -8.202 2.361 7.357 1.00 . A A . 61 TRP HZ3 1 1 5 4704 1 1 61 TRP N N -1.286 1.418 8.806 1.00 . A A . 61 TRP N 1 1 5 4705 1 1 61 TRP NE1 N -4.654 -1.061 9.049 1.00 . A A . 61 TRP NE1 1 1 5 4706 1 1 61 TRP O O -0.332 3.827 9.528 1.00 . A A . 61 TRP O 1 1 5 4707 1 1 62 GLU C C -2.383 6.966 10.552 1.00 . A A . 62 GLU C 1 1 5 4708 1 1 62 GLU CA C -1.527 6.244 9.502 1.00 . A A . 62 GLU CA 1 1 5 4709 1 1 62 GLU CB C -1.388 7.093 8.224 1.00 . A A . 62 GLU CB 1 1 5 4710 1 1 62 GLU CD C -0.169 8.872 9.489 1.00 . A A . 62 GLU CD 1 1 5 4711 1 1 62 GLU CG C -1.360 8.586 8.571 1.00 . A A . 62 GLU CG 1 1 5 4712 1 1 62 GLU H H -3.116 4.946 8.867 1.00 . A A . 62 GLU H 1 1 5 4713 1 1 62 GLU HA H -0.547 6.050 9.911 1.00 . A A . 62 GLU HA 1 1 5 4714 1 1 62 GLU HB2 H -0.467 6.829 7.725 1.00 . A A . 62 GLU HB2 1 1 5 4715 1 1 62 GLU HB3 H -2.222 6.890 7.561 1.00 . A A . 62 GLU HB3 1 1 5 4716 1 1 62 GLU HG2 H -1.263 9.164 7.663 1.00 . A A . 62 GLU HG2 1 1 5 4717 1 1 62 GLU HG3 H -2.274 8.856 9.075 1.00 . A A . 62 GLU HG3 1 1 5 4718 1 1 62 GLU N N -2.177 4.957 9.146 1.00 . A A . 62 GLU N 1 1 5 4719 1 1 62 GLU O O -3.412 7.535 10.250 1.00 . A A . 62 GLU O 1 1 5 4720 1 1 62 GLU OE1 O -0.054 8.202 10.503 1.00 . A A . 62 GLU OE1 1 1 5 4721 1 1 62 GLU OE2 O 0.607 9.754 9.162 1.00 . A A . 62 GLU OE2 1 1 5 4722 1 1 63 ASP C C -2.022 8.880 13.311 1.00 . A A . 63 ASP C 1 1 5 4723 1 1 63 ASP CA C -2.760 7.621 12.850 1.00 . A A . 63 ASP CA 1 1 5 4724 1 1 63 ASP CB C -2.943 6.673 14.038 1.00 . A A . 63 ASP CB 1 1 5 4725 1 1 63 ASP CG C -4.405 6.697 14.491 1.00 . A A . 63 ASP CG 1 1 5 4726 1 1 63 ASP H H -1.136 6.476 12.017 1.00 . A A . 63 ASP H 1 1 5 4727 1 1 63 ASP HA H -3.728 7.895 12.455 1.00 . A A . 63 ASP HA 1 1 5 4728 1 1 63 ASP HB2 H -2.672 5.669 13.742 1.00 . A A . 63 ASP HB2 1 1 5 4729 1 1 63 ASP HB3 H -2.311 6.990 14.853 1.00 . A A . 63 ASP HB3 1 1 5 4730 1 1 63 ASP N N -1.967 6.941 11.788 1.00 . A A . 63 ASP N 1 1 5 4731 1 1 63 ASP O O -1.054 8.811 14.041 1.00 . A A . 63 ASP O 1 1 5 4732 1 1 63 ASP OD1 O -5.258 6.953 13.658 1.00 . A A . 63 ASP OD1 1 1 5 4733 1 1 63 ASP OD2 O -4.646 6.456 15.662 1.00 . A A . 63 ASP OD2 1 1 5 4734 1 1 64 GLU C C -2.840 12.397 13.471 1.00 . A A . 64 GLU C 1 1 5 4735 1 1 64 GLU CA C -1.798 11.290 13.308 1.00 . A A . 64 GLU CA 1 1 5 4736 1 1 64 GLU CB C -0.778 11.701 12.243 1.00 . A A . 64 GLU CB 1 1 5 4737 1 1 64 GLU CD C -2.008 13.046 10.532 1.00 . A A . 64 GLU CD 1 1 5 4738 1 1 64 GLU CG C -1.434 11.667 10.861 1.00 . A A . 64 GLU CG 1 1 5 4739 1 1 64 GLU H H -3.256 10.065 12.303 1.00 . A A . 64 GLU H 1 1 5 4740 1 1 64 GLU HA H -1.291 11.132 14.249 1.00 . A A . 64 GLU HA 1 1 5 4741 1 1 64 GLU HB2 H -0.425 12.701 12.450 1.00 . A A . 64 GLU HB2 1 1 5 4742 1 1 64 GLU HB3 H 0.056 11.015 12.261 1.00 . A A . 64 GLU HB3 1 1 5 4743 1 1 64 GLU HG2 H -0.695 11.398 10.119 1.00 . A A . 64 GLU HG2 1 1 5 4744 1 1 64 GLU HG3 H -2.230 10.936 10.858 1.00 . A A . 64 GLU HG3 1 1 5 4745 1 1 64 GLU N N -2.473 10.030 12.891 1.00 . A A . 64 GLU N 1 1 5 4746 1 1 64 GLU OE1 O -1.234 13.986 10.460 1.00 . A A . 64 GLU OE1 1 1 5 4747 1 1 64 GLU OE2 O -3.212 13.138 10.359 1.00 . A A . 64 GLU OE2 1 1 5 4748 2 2 1 SF4 FE1 FE 5.451 -4.494 -2.410 1.00 . B A . 65 SF4 FE1 1 1 5 4749 2 2 1 SF4 FE2 FE 3.854 -5.981 -0.501 1.00 . B A . 65 SF4 FE2 1 1 5 4750 2 2 1 SF4 FE3 FE 2.860 -4.178 -2.438 1.00 . B A . 65 SF4 FE3 1 1 5 4751 2 2 1 SF4 FE4 FE 4.136 -6.730 -3.283 1.00 . B A . 65 SF4 FE4 1 1 5 4752 2 2 1 SF4 S1 S 2.111 -6.447 -1.787 1.00 . B A . 65 SF4 S1 1 1 5 4753 2 2 1 SF4 S2 S 4.326 -4.401 -4.072 1.00 . B A . 65 SF4 S2 1 1 5 4754 2 2 1 SF4 S3 S 5.755 -6.849 -1.773 1.00 . B A . 65 SF4 S3 1 1 5 4755 2 2 1 SF4 S4 S 4.235 -3.524 -0.839 1.00 . B A . 65 SF4 S4 1 1 6 4756 1 1 1 ALA C C -8.576 9.801 8.635 1.00 . A A . 1 ALA C 1 1 6 4757 1 1 1 ALA CA C -9.624 10.903 8.472 1.00 . A A . 1 ALA CA 1 1 6 4758 1 1 1 ALA CB C -8.936 12.269 8.507 1.00 . A A . 1 ALA CB 1 1 6 4759 1 1 1 ALA HA H -10.130 10.779 7.526 1.00 . A A . 1 ALA HA 1 1 6 4760 1 1 1 ALA HB1 H -9.197 12.779 9.423 1.00 . A A . 1 ALA HB1 1 1 6 4761 1 1 1 ALA HB2 H -7.866 12.134 8.463 1.00 . A A . 1 ALA HB2 1 1 6 4762 1 1 1 ALA HB3 H -9.261 12.857 7.661 1.00 . A A . 1 ALA HB3 1 1 6 4763 1 1 1 ALA N N -10.615 10.817 9.581 1.00 . A A . 1 ALA N 1 1 6 4764 1 1 1 ALA O O -7.428 10.063 8.939 1.00 . A A . 1 ALA O 1 1 6 4765 1 1 2 ARG C C -7.034 7.451 7.377 1.00 . A A . 2 ARG C 1 1 6 4766 1 1 2 ARG CA C -7.981 7.454 8.578 1.00 . A A . 2 ARG CA 1 1 6 4767 1 1 2 ARG CB C -8.732 6.123 8.640 1.00 . A A . 2 ARG CB 1 1 6 4768 1 1 2 ARG CD C -11.087 5.630 7.964 1.00 . A A . 2 ARG CD 1 1 6 4769 1 1 2 ARG CG C -9.698 6.023 7.457 1.00 . A A . 2 ARG CG 1 1 6 4770 1 1 2 ARG CZ C -12.780 6.317 6.373 1.00 . A A . 2 ARG CZ 1 1 6 4771 1 1 2 ARG H H -9.887 8.379 8.189 1.00 . A A . 2 ARG H 1 1 6 4772 1 1 2 ARG HA H -7.411 7.589 9.486 1.00 . A A . 2 ARG HA 1 1 6 4773 1 1 2 ARG HB2 H -8.024 5.308 8.597 1.00 . A A . 2 ARG HB2 1 1 6 4774 1 1 2 ARG HB3 H -9.290 6.066 9.563 1.00 . A A . 2 ARG HB3 1 1 6 4775 1 1 2 ARG HD2 H -11.012 4.736 8.564 1.00 . A A . 2 ARG HD2 1 1 6 4776 1 1 2 ARG HD3 H -11.493 6.434 8.562 1.00 . A A . 2 ARG HD3 1 1 6 4777 1 1 2 ARG HE H -11.979 4.501 6.360 1.00 . A A . 2 ARG HE 1 1 6 4778 1 1 2 ARG HG2 H -9.753 6.978 6.955 1.00 . A A . 2 ARG HG2 1 1 6 4779 1 1 2 ARG HG3 H -9.344 5.273 6.766 1.00 . A A . 2 ARG HG3 1 1 6 4780 1 1 2 ARG HH11 H -11.372 7.211 5.265 1.00 . A A . 2 ARG HH11 1 1 6 4781 1 1 2 ARG HH12 H -12.937 7.953 5.228 1.00 . A A . 2 ARG HH12 1 1 6 4782 1 1 2 ARG HH21 H -14.373 5.647 7.384 1.00 . A A . 2 ARG HH21 1 1 6 4783 1 1 2 ARG HH22 H -14.636 7.068 6.429 1.00 . A A . 2 ARG HH22 1 1 6 4784 1 1 2 ARG N N -8.957 8.570 8.435 1.00 . A A . 2 ARG N 1 1 6 4785 1 1 2 ARG NE N -11.986 5.376 6.802 1.00 . A A . 2 ARG NE 1 1 6 4786 1 1 2 ARG NH1 N -12.327 7.232 5.558 1.00 . A A . 2 ARG NH1 1 1 6 4787 1 1 2 ARG NH2 N -14.027 6.347 6.758 1.00 . A A . 2 ARG NH2 1 1 6 4788 1 1 2 ARG O O -7.439 7.214 6.256 1.00 . A A . 2 ARG O 1 1 6 4789 1 1 3 LYS C C -3.840 6.552 6.604 1.00 . A A . 3 LYS C 1 1 6 4790 1 1 3 LYS CA C -4.807 7.730 6.469 1.00 . A A . 3 LYS CA 1 1 6 4791 1 1 3 LYS CB C -4.021 9.042 6.487 1.00 . A A . 3 LYS CB 1 1 6 4792 1 1 3 LYS CD C -2.286 9.894 4.904 1.00 . A A . 3 LYS CD 1 1 6 4793 1 1 3 LYS CE C -2.151 10.973 3.826 1.00 . A A . 3 LYS CE 1 1 6 4794 1 1 3 LYS CG C -3.756 9.497 5.050 1.00 . A A . 3 LYS CG 1 1 6 4795 1 1 3 LYS H H -5.469 7.907 8.512 1.00 . A A . 3 LYS H 1 1 6 4796 1 1 3 LYS HA H -5.345 7.647 5.536 1.00 . A A . 3 LYS HA 1 1 6 4797 1 1 3 LYS HB2 H -4.593 9.798 7.005 1.00 . A A . 3 LYS HB2 1 1 6 4798 1 1 3 LYS HB3 H -3.080 8.892 6.994 1.00 . A A . 3 LYS HB3 1 1 6 4799 1 1 3 LYS HD2 H -1.922 10.278 5.846 1.00 . A A . 3 LYS HD2 1 1 6 4800 1 1 3 LYS HD3 H -1.706 9.031 4.618 1.00 . A A . 3 LYS HD3 1 1 6 4801 1 1 3 LYS HE2 H -2.975 11.667 3.906 1.00 . A A . 3 LYS HE2 1 1 6 4802 1 1 3 LYS HE3 H -1.220 11.503 3.964 1.00 . A A . 3 LYS HE3 1 1 6 4803 1 1 3 LYS HG2 H -3.981 8.688 4.370 1.00 . A A . 3 LYS HG2 1 1 6 4804 1 1 3 LYS HG3 H -4.381 10.345 4.820 1.00 . A A . 3 LYS HG3 1 1 6 4805 1 1 3 LYS HZ1 H -1.954 9.324 2.571 1.00 . A A . 3 LYS HZ1 1 1 6 4806 1 1 3 LYS HZ2 H -3.108 10.457 2.051 1.00 . A A . 3 LYS HZ2 1 1 6 4807 1 1 3 LYS HZ3 H -1.451 10.787 1.875 1.00 . A A . 3 LYS HZ3 1 1 6 4808 1 1 3 LYS N N -5.776 7.716 7.601 1.00 . A A . 3 LYS N 1 1 6 4809 1 1 3 LYS NZ N -2.167 10.338 2.479 1.00 . A A . 3 LYS NZ 1 1 6 4810 1 1 3 LYS O O -4.045 5.654 7.396 1.00 . A A . 3 LYS O 1 1 6 4811 1 1 4 PHE C C -0.711 5.671 4.844 1.00 . A A . 4 PHE C 1 1 6 4812 1 1 4 PHE CA C -1.797 5.444 5.902 1.00 . A A . 4 PHE CA 1 1 6 4813 1 1 4 PHE CB C -2.511 4.112 5.637 1.00 . A A . 4 PHE CB 1 1 6 4814 1 1 4 PHE CD1 C -3.857 4.787 3.615 1.00 . A A . 4 PHE CD1 1 1 6 4815 1 1 4 PHE CD2 C -2.138 3.097 3.362 1.00 . A A . 4 PHE CD2 1 1 6 4816 1 1 4 PHE CE1 C -4.165 4.679 2.254 1.00 . A A . 4 PHE CE1 1 1 6 4817 1 1 4 PHE CE2 C -2.445 2.989 2.000 1.00 . A A . 4 PHE CE2 1 1 6 4818 1 1 4 PHE CG C -2.843 3.995 4.169 1.00 . A A . 4 PHE CG 1 1 6 4819 1 1 4 PHE CZ C -3.460 3.779 1.446 1.00 . A A . 4 PHE CZ 1 1 6 4820 1 1 4 PHE H H -2.642 7.288 5.209 1.00 . A A . 4 PHE H 1 1 6 4821 1 1 4 PHE HA H -1.346 5.426 6.878 1.00 . A A . 4 PHE HA 1 1 6 4822 1 1 4 PHE HB2 H -1.870 3.295 5.930 1.00 . A A . 4 PHE HB2 1 1 6 4823 1 1 4 PHE HB3 H -3.423 4.072 6.213 1.00 . A A . 4 PHE HB3 1 1 6 4824 1 1 4 PHE HD1 H -4.402 5.481 4.239 1.00 . A A . 4 PHE HD1 1 1 6 4825 1 1 4 PHE HD2 H -1.356 2.487 3.789 1.00 . A A . 4 PHE HD2 1 1 6 4826 1 1 4 PHE HE1 H -4.947 5.288 1.827 1.00 . A A . 4 PHE HE1 1 1 6 4827 1 1 4 PHE HE2 H -1.900 2.295 1.377 1.00 . A A . 4 PHE HE2 1 1 6 4828 1 1 4 PHE HZ H -3.696 3.695 0.395 1.00 . A A . 4 PHE HZ 1 1 6 4829 1 1 4 PHE N N -2.785 6.554 5.834 1.00 . A A . 4 PHE N 1 1 6 4830 1 1 4 PHE O O -0.569 6.752 4.310 1.00 . A A . 4 PHE O 1 1 6 4831 1 1 5 TYR C C 1.914 3.534 3.574 1.00 . A A . 5 TYR C 1 1 6 4832 1 1 5 TYR CA C 1.116 4.802 3.518 1.00 . A A . 5 TYR CA 1 1 6 4833 1 1 5 TYR CB C 2.046 5.969 3.836 1.00 . A A . 5 TYR CB 1 1 6 4834 1 1 5 TYR CD1 C 3.880 5.026 5.285 1.00 . A A . 5 TYR CD1 1 1 6 4835 1 1 5 TYR CD2 C 2.085 6.272 6.338 1.00 . A A . 5 TYR CD2 1 1 6 4836 1 1 5 TYR CE1 C 4.473 4.823 6.537 1.00 . A A . 5 TYR CE1 1 1 6 4837 1 1 5 TYR CE2 C 2.679 6.068 7.589 1.00 . A A . 5 TYR CE2 1 1 6 4838 1 1 5 TYR CG C 2.685 5.752 5.186 1.00 . A A . 5 TYR CG 1 1 6 4839 1 1 5 TYR CZ C 3.873 5.343 7.688 1.00 . A A . 5 TYR CZ 1 1 6 4840 1 1 5 TYR H H -0.070 3.781 4.965 1.00 . A A . 5 TYR H 1 1 6 4841 1 1 5 TYR HA H 0.676 4.931 2.541 1.00 . A A . 5 TYR HA 1 1 6 4842 1 1 5 TYR HB2 H 2.817 6.025 3.080 1.00 . A A . 5 TYR HB2 1 1 6 4843 1 1 5 TYR HB3 H 1.489 6.879 3.838 1.00 . A A . 5 TYR HB3 1 1 6 4844 1 1 5 TYR HD1 H 4.342 4.625 4.397 1.00 . A A . 5 TYR HD1 1 1 6 4845 1 1 5 TYR HD2 H 1.165 6.831 6.262 1.00 . A A . 5 TYR HD2 1 1 6 4846 1 1 5 TYR HE1 H 5.395 4.264 6.613 1.00 . A A . 5 TYR HE1 1 1 6 4847 1 1 5 TYR HE2 H 2.216 6.469 8.478 1.00 . A A . 5 TYR HE2 1 1 6 4848 1 1 5 TYR HH H 5.317 5.569 8.918 1.00 . A A . 5 TYR HH 1 1 6 4849 1 1 5 TYR N N 0.054 4.659 4.533 1.00 . A A . 5 TYR N 1 1 6 4850 1 1 5 TYR O O 1.615 2.647 4.347 1.00 . A A . 5 TYR O 1 1 6 4851 1 1 5 TYR OH O 4.457 5.141 8.923 1.00 . A A . 5 TYR OH 1 1 6 4852 1 1 6 VAL C C 5.186 2.434 2.699 1.00 . A A . 6 VAL C 1 1 6 4853 1 1 6 VAL CA C 3.705 2.175 2.886 1.00 . A A . 6 VAL CA 1 1 6 4854 1 1 6 VAL CB C 3.244 1.192 1.831 1.00 . A A . 6 VAL CB 1 1 6 4855 1 1 6 VAL CG1 C 3.778 -0.163 2.233 1.00 . A A . 6 VAL CG1 1 1 6 4856 1 1 6 VAL CG2 C 1.714 1.131 1.776 1.00 . A A . 6 VAL CG2 1 1 6 4857 1 1 6 VAL H H 3.184 4.145 2.187 1.00 . A A . 6 VAL H 1 1 6 4858 1 1 6 VAL HA H 3.550 1.737 3.860 1.00 . A A . 6 VAL HA 1 1 6 4859 1 1 6 VAL HB H 3.642 1.474 0.867 1.00 . A A . 6 VAL HB 1 1 6 4860 1 1 6 VAL HG11 H 4.072 -0.128 3.272 1.00 . A A . 6 VAL HG11 1 1 6 4861 1 1 6 VAL HG12 H 3.008 -0.901 2.098 1.00 . A A . 6 VAL HG12 1 1 6 4862 1 1 6 VAL HG13 H 4.631 -0.402 1.622 1.00 . A A . 6 VAL HG13 1 1 6 4863 1 1 6 VAL HG21 H 1.303 1.451 2.718 1.00 . A A . 6 VAL HG21 1 1 6 4864 1 1 6 VAL HG22 H 1.355 1.775 0.990 1.00 . A A . 6 VAL HG22 1 1 6 4865 1 1 6 VAL HG23 H 1.403 0.117 1.576 1.00 . A A . 6 VAL HG23 1 1 6 4866 1 1 6 VAL N N 2.930 3.421 2.800 1.00 . A A . 6 VAL N 1 1 6 4867 1 1 6 VAL O O 5.601 3.393 2.077 1.00 . A A . 6 VAL O 1 1 6 4868 1 1 7 ASP C C 7.903 0.735 1.997 1.00 . A A . 7 ASP C 1 1 6 4869 1 1 7 ASP CA C 7.445 1.699 3.078 1.00 . A A . 7 ASP CA 1 1 6 4870 1 1 7 ASP CB C 8.127 1.358 4.398 1.00 . A A . 7 ASP CB 1 1 6 4871 1 1 7 ASP CG C 8.516 2.647 5.125 1.00 . A A . 7 ASP CG 1 1 6 4872 1 1 7 ASP H H 5.619 0.786 3.702 1.00 . A A . 7 ASP H 1 1 6 4873 1 1 7 ASP HA H 7.681 2.709 2.787 1.00 . A A . 7 ASP HA 1 1 6 4874 1 1 7 ASP HB2 H 7.445 0.791 5.008 1.00 . A A . 7 ASP HB2 1 1 6 4875 1 1 7 ASP HB3 H 9.013 0.772 4.209 1.00 . A A . 7 ASP HB3 1 1 6 4876 1 1 7 ASP N N 5.985 1.556 3.223 1.00 . A A . 7 ASP N 1 1 6 4877 1 1 7 ASP O O 8.487 -0.295 2.267 1.00 . A A . 7 ASP O 1 1 6 4878 1 1 7 ASP OD1 O 7.619 3.358 5.551 1.00 . A A . 7 ASP OD1 1 1 6 4879 1 1 7 ASP OD2 O 9.703 2.903 5.244 1.00 . A A . 7 ASP OD2 1 1 6 4880 1 1 8 GLN C C 9.443 -0.347 -0.106 1.00 . A A . 8 GLN C 1 1 6 4881 1 1 8 GLN CA C 8.042 0.201 -0.365 1.00 . A A . 8 GLN CA 1 1 6 4882 1 1 8 GLN CB C 8.054 1.026 -1.653 1.00 . A A . 8 GLN CB 1 1 6 4883 1 1 8 GLN CD C 7.917 3.506 -1.399 1.00 . A A . 8 GLN CD 1 1 6 4884 1 1 8 GLN CG C 8.864 2.305 -1.429 1.00 . A A . 8 GLN CG 1 1 6 4885 1 1 8 GLN H H 7.161 1.911 0.597 1.00 . A A . 8 GLN H 1 1 6 4886 1 1 8 GLN HA H 7.342 -0.615 -0.462 1.00 . A A . 8 GLN HA 1 1 6 4887 1 1 8 GLN HB2 H 8.502 0.448 -2.448 1.00 . A A . 8 GLN HB2 1 1 6 4888 1 1 8 GLN HB3 H 7.044 1.289 -1.921 1.00 . A A . 8 GLN HB3 1 1 6 4889 1 1 8 GLN HE21 H 7.921 3.642 0.581 1.00 . A A . 8 GLN HE21 1 1 6 4890 1 1 8 GLN HE22 H 6.959 4.786 -0.223 1.00 . A A . 8 GLN HE22 1 1 6 4891 1 1 8 GLN HG2 H 9.391 2.236 -0.488 1.00 . A A . 8 GLN HG2 1 1 6 4892 1 1 8 GLN HG3 H 9.573 2.428 -2.232 1.00 . A A . 8 GLN HG3 1 1 6 4893 1 1 8 GLN N N 7.635 1.073 0.771 1.00 . A A . 8 GLN N 1 1 6 4894 1 1 8 GLN NE2 N 7.572 4.023 -0.251 1.00 . A A . 8 GLN NE2 1 1 6 4895 1 1 8 GLN O O 9.824 -1.384 -0.614 1.00 . A A . 8 GLN O 1 1 6 4896 1 1 8 GLN OE1 O 7.487 3.981 -2.432 1.00 . A A . 8 GLN OE1 1 1 6 4897 1 1 9 ASP C C 11.522 -1.567 1.516 1.00 . A A . 9 ASP C 1 1 6 4898 1 1 9 ASP CA C 11.591 -0.133 0.991 1.00 . A A . 9 ASP CA 1 1 6 4899 1 1 9 ASP CB C 12.223 0.771 2.054 1.00 . A A . 9 ASP CB 1 1 6 4900 1 1 9 ASP CG C 13.444 1.477 1.463 1.00 . A A . 9 ASP CG 1 1 6 4901 1 1 9 ASP H H 9.878 1.172 1.088 1.00 . A A . 9 ASP H 1 1 6 4902 1 1 9 ASP HA H 12.188 -0.105 0.092 1.00 . A A . 9 ASP HA 1 1 6 4903 1 1 9 ASP HB2 H 11.501 1.508 2.375 1.00 . A A . 9 ASP HB2 1 1 6 4904 1 1 9 ASP HB3 H 12.529 0.174 2.899 1.00 . A A . 9 ASP HB3 1 1 6 4905 1 1 9 ASP N N 10.212 0.343 0.689 1.00 . A A . 9 ASP N 1 1 6 4906 1 1 9 ASP O O 12.420 -2.359 1.312 1.00 . A A . 9 ASP O 1 1 6 4907 1 1 9 ASP OD1 O 14.355 0.787 1.036 1.00 . A A . 9 ASP OD1 1 1 6 4908 1 1 9 ASP OD2 O 13.448 2.698 1.449 1.00 . A A . 9 ASP OD2 1 1 6 4909 1 1 10 GLU C C 9.401 -4.094 1.805 1.00 . A A . 10 GLU C 1 1 6 4910 1 1 10 GLU CA C 10.320 -3.288 2.724 1.00 . A A . 10 GLU CA 1 1 6 4911 1 1 10 GLU CB C 9.709 -3.237 4.127 1.00 . A A . 10 GLU CB 1 1 6 4912 1 1 10 GLU CD C 10.838 -4.626 5.873 1.00 . A A . 10 GLU CD 1 1 6 4913 1 1 10 GLU CG C 9.782 -4.626 4.765 1.00 . A A . 10 GLU CG 1 1 6 4914 1 1 10 GLU H H 9.743 -1.251 2.337 1.00 . A A . 10 GLU H 1 1 6 4915 1 1 10 GLU HA H 11.291 -3.759 2.768 1.00 . A A . 10 GLU HA 1 1 6 4916 1 1 10 GLU HB2 H 10.255 -2.531 4.734 1.00 . A A . 10 GLU HB2 1 1 6 4917 1 1 10 GLU HB3 H 8.677 -2.929 4.058 1.00 . A A . 10 GLU HB3 1 1 6 4918 1 1 10 GLU HG2 H 8.819 -4.879 5.185 1.00 . A A . 10 GLU HG2 1 1 6 4919 1 1 10 GLU HG3 H 10.051 -5.353 4.015 1.00 . A A . 10 GLU HG3 1 1 6 4920 1 1 10 GLU N N 10.457 -1.907 2.188 1.00 . A A . 10 GLU N 1 1 6 4921 1 1 10 GLU O O 8.969 -5.179 2.141 1.00 . A A . 10 GLU O 1 1 6 4922 1 1 10 GLU OE1 O 11.717 -3.782 5.828 1.00 . A A . 10 GLU OE1 1 1 6 4923 1 1 10 GLU OE2 O 10.750 -5.473 6.747 1.00 . A A . 10 GLU OE2 1 1 6 4924 1 1 11 CYS C C 8.965 -5.431 -0.971 1.00 . A A . 11 CYS C 1 1 6 4925 1 1 11 CYS CA C 8.191 -4.308 -0.279 1.00 . A A . 11 CYS CA 1 1 6 4926 1 1 11 CYS CB C 7.624 -3.347 -1.328 1.00 . A A . 11 CYS CB 1 1 6 4927 1 1 11 CYS H H 9.443 -2.692 0.399 1.00 . A A . 11 CYS H 1 1 6 4928 1 1 11 CYS HA H 7.375 -4.737 0.285 1.00 . A A . 11 CYS HA 1 1 6 4929 1 1 11 CYS HB2 H 6.880 -2.709 -0.874 1.00 . A A . 11 CYS HB2 1 1 6 4930 1 1 11 CYS HB3 H 8.421 -2.742 -1.741 1.00 . A A . 11 CYS HB3 1 1 6 4931 1 1 11 CYS N N 9.091 -3.570 0.651 1.00 . A A . 11 CYS N 1 1 6 4932 1 1 11 CYS O O 9.957 -5.201 -1.632 1.00 . A A . 11 CYS O 1 1 6 4933 1 1 11 CYS SG S 6.856 -4.213 -2.739 1.00 . A A . 11 CYS SG 1 1 6 4934 1 1 12 ILE C C 8.992 -7.732 -2.983 1.00 . A A . 12 ILE C 1 1 6 4935 1 1 12 ILE CA C 9.213 -7.791 -1.469 1.00 . A A . 12 ILE CA 1 1 6 4936 1 1 12 ILE CB C 8.654 -9.105 -0.917 1.00 . A A . 12 ILE CB 1 1 6 4937 1 1 12 ILE CD1 C 6.780 -10.723 -1.270 1.00 . A A . 12 ILE CD1 1 1 6 4938 1 1 12 ILE CG1 C 7.187 -9.250 -1.334 1.00 . A A . 12 ILE CG1 1 1 6 4939 1 1 12 ILE CG2 C 8.750 -9.100 0.610 1.00 . A A . 12 ILE CG2 1 1 6 4940 1 1 12 ILE H H 7.708 -6.807 -0.285 1.00 . A A . 12 ILE H 1 1 6 4941 1 1 12 ILE HA H 10.271 -7.733 -1.257 1.00 . A A . 12 ILE HA 1 1 6 4942 1 1 12 ILE HB H 9.226 -9.933 -1.310 1.00 . A A . 12 ILE HB 1 1 6 4943 1 1 12 ILE HD11 H 7.417 -11.301 -1.923 1.00 . A A . 12 ILE HD11 1 1 6 4944 1 1 12 ILE HD12 H 6.885 -11.081 -0.257 1.00 . A A . 12 ILE HD12 1 1 6 4945 1 1 12 ILE HD13 H 5.752 -10.826 -1.585 1.00 . A A . 12 ILE HD13 1 1 6 4946 1 1 12 ILE HG12 H 6.565 -8.674 -0.665 1.00 . A A . 12 ILE HG12 1 1 6 4947 1 1 12 ILE HG13 H 7.062 -8.887 -2.343 1.00 . A A . 12 ILE HG13 1 1 6 4948 1 1 12 ILE HG21 H 9.058 -8.121 0.948 1.00 . A A . 12 ILE HG21 1 1 6 4949 1 1 12 ILE HG22 H 7.785 -9.339 1.032 1.00 . A A . 12 ILE HG22 1 1 6 4950 1 1 12 ILE HG23 H 9.474 -9.835 0.928 1.00 . A A . 12 ILE HG23 1 1 6 4951 1 1 12 ILE N N 8.513 -6.648 -0.822 1.00 . A A . 12 ILE N 1 1 6 4952 1 1 12 ILE O O 8.921 -6.668 -3.566 1.00 . A A . 12 ILE O 1 1 6 4953 1 1 13 ALA C C 7.261 -9.374 -5.415 1.00 . A A . 13 ALA C 1 1 6 4954 1 1 13 ALA CA C 8.667 -8.859 -5.102 1.00 . A A . 13 ALA CA 1 1 6 4955 1 1 13 ALA CB C 9.701 -9.765 -5.771 1.00 . A A . 13 ALA CB 1 1 6 4956 1 1 13 ALA H H 8.943 -9.712 -3.145 1.00 . A A . 13 ALA H 1 1 6 4957 1 1 13 ALA HA H 8.774 -7.853 -5.478 1.00 . A A . 13 ALA HA 1 1 6 4958 1 1 13 ALA HB1 H 10.620 -9.744 -5.203 1.00 . A A . 13 ALA HB1 1 1 6 4959 1 1 13 ALA HB2 H 9.324 -10.776 -5.807 1.00 . A A . 13 ALA HB2 1 1 6 4960 1 1 13 ALA HB3 H 9.892 -9.415 -6.775 1.00 . A A . 13 ALA HB3 1 1 6 4961 1 1 13 ALA N N 8.883 -8.862 -3.628 1.00 . A A . 13 ALA N 1 1 6 4962 1 1 13 ALA O O 7.088 -10.314 -6.165 1.00 . A A . 13 ALA O 1 1 6 4963 1 1 14 CYS C C 3.942 -8.015 -5.291 1.00 . A A . 14 CYS C 1 1 6 4964 1 1 14 CYS CA C 4.862 -9.225 -5.126 1.00 . A A . 14 CYS CA 1 1 6 4965 1 1 14 CYS CB C 4.368 -10.098 -3.969 1.00 . A A . 14 CYS CB 1 1 6 4966 1 1 14 CYS H H 6.409 -8.007 -4.252 1.00 . A A . 14 CYS H 1 1 6 4967 1 1 14 CYS HA H 4.853 -9.805 -6.038 1.00 . A A . 14 CYS HA 1 1 6 4968 1 1 14 CYS HB2 H 3.966 -11.019 -4.365 1.00 . A A . 14 CYS HB2 1 1 6 4969 1 1 14 CYS HB3 H 5.196 -10.322 -3.314 1.00 . A A . 14 CYS HB3 1 1 6 4970 1 1 14 CYS N N 6.252 -8.765 -4.852 1.00 . A A . 14 CYS N 1 1 6 4971 1 1 14 CYS O O 4.214 -6.942 -4.790 1.00 . A A . 14 CYS O 1 1 6 4972 1 1 14 CYS SG S 3.057 -9.386 -2.906 1.00 . A A . 14 CYS SG 1 1 6 4973 1 1 15 GLU C C 0.556 -7.382 -5.595 1.00 . A A . 15 GLU C 1 1 6 4974 1 1 15 GLU CA C 1.919 -7.040 -6.201 1.00 . A A . 15 GLU CA 1 1 6 4975 1 1 15 GLU CB C 1.756 -6.778 -7.699 1.00 . A A . 15 GLU CB 1 1 6 4976 1 1 15 GLU CD C 1.169 -7.923 -9.842 1.00 . A A . 15 GLU CD 1 1 6 4977 1 1 15 GLU CG C 0.937 -7.907 -8.329 1.00 . A A . 15 GLU CG 1 1 6 4978 1 1 15 GLU H H 2.658 -9.053 -6.394 1.00 . A A . 15 GLU H 1 1 6 4979 1 1 15 GLU HA H 2.315 -6.157 -5.721 1.00 . A A . 15 GLU HA 1 1 6 4980 1 1 15 GLU HB2 H 1.246 -5.837 -7.846 1.00 . A A . 15 GLU HB2 1 1 6 4981 1 1 15 GLU HB3 H 2.728 -6.738 -8.165 1.00 . A A . 15 GLU HB3 1 1 6 4982 1 1 15 GLU HG2 H 1.244 -8.853 -7.907 1.00 . A A . 15 GLU HG2 1 1 6 4983 1 1 15 GLU HG3 H -0.111 -7.746 -8.130 1.00 . A A . 15 GLU HG3 1 1 6 4984 1 1 15 GLU N N 2.856 -8.180 -5.995 1.00 . A A . 15 GLU N 1 1 6 4985 1 1 15 GLU O O -0.449 -6.796 -5.941 1.00 . A A . 15 GLU O 1 1 6 4986 1 1 15 GLU OE1 O 1.517 -6.886 -10.379 1.00 . A A . 15 GLU OE1 1 1 6 4987 1 1 15 GLU OE2 O 0.995 -8.975 -10.437 1.00 . A A . 15 GLU OE2 1 1 6 4988 1 1 16 SER C C -1.560 -7.430 -3.718 1.00 . A A . 16 SER C 1 1 6 4989 1 1 16 SER CA C -0.782 -8.700 -4.066 1.00 . A A . 16 SER CA 1 1 6 4990 1 1 16 SER CB C -0.519 -9.501 -2.790 1.00 . A A . 16 SER CB 1 1 6 4991 1 1 16 SER H H 1.340 -8.785 -4.428 1.00 . A A . 16 SER H 1 1 6 4992 1 1 16 SER HA H -1.358 -9.299 -4.755 1.00 . A A . 16 SER HA 1 1 6 4993 1 1 16 SER HB2 H 0.492 -9.875 -2.799 1.00 . A A . 16 SER HB2 1 1 6 4994 1 1 16 SER HB3 H -0.654 -8.858 -1.928 1.00 . A A . 16 SER HB3 1 1 6 4995 1 1 16 SER HG H -0.990 -11.359 -3.116 1.00 . A A . 16 SER HG 1 1 6 4996 1 1 16 SER N N 0.516 -8.325 -4.693 1.00 . A A . 16 SER N 1 1 6 4997 1 1 16 SER O O -2.645 -7.199 -4.212 1.00 . A A . 16 SER O 1 1 6 4998 1 1 16 SER OG O -1.423 -10.596 -2.727 1.00 . A A . 16 SER OG 1 1 6 4999 1 1 17 CYS C C -2.175 -4.628 -3.765 1.00 . A A . 17 CYS C 1 1 6 5000 1 1 17 CYS CA C -1.708 -5.344 -2.498 1.00 . A A . 17 CYS CA 1 1 6 5001 1 1 17 CYS CB C -0.739 -4.441 -1.733 1.00 . A A . 17 CYS CB 1 1 6 5002 1 1 17 CYS H H -0.130 -6.807 -2.492 1.00 . A A . 17 CYS H 1 1 6 5003 1 1 17 CYS HA H -2.558 -5.573 -1.875 1.00 . A A . 17 CYS HA 1 1 6 5004 1 1 17 CYS HB2 H -1.282 -3.615 -1.298 1.00 . A A . 17 CYS HB2 1 1 6 5005 1 1 17 CYS HB3 H -0.259 -5.010 -0.950 1.00 . A A . 17 CYS HB3 1 1 6 5006 1 1 17 CYS N N -1.008 -6.603 -2.874 1.00 . A A . 17 CYS N 1 1 6 5007 1 1 17 CYS O O -3.312 -4.212 -3.876 1.00 . A A . 17 CYS O 1 1 6 5008 1 1 17 CYS SG S 0.588 -3.732 -2.775 1.00 . A A . 17 CYS SG 1 1 6 5009 1 1 18 VAL C C -2.993 -4.385 -6.514 1.00 . A A . 18 VAL C 1 1 6 5010 1 1 18 VAL CA C -1.688 -3.790 -5.983 1.00 . A A . 18 VAL CA 1 1 6 5011 1 1 18 VAL CB C -0.582 -3.971 -7.021 1.00 . A A . 18 VAL CB 1 1 6 5012 1 1 18 VAL CG1 C -0.793 -2.980 -8.166 1.00 . A A . 18 VAL CG1 1 1 6 5013 1 1 18 VAL CG2 C 0.778 -3.711 -6.366 1.00 . A A . 18 VAL CG2 1 1 6 5014 1 1 18 VAL H H -0.391 -4.822 -4.611 1.00 . A A . 18 VAL H 1 1 6 5015 1 1 18 VAL HA H -1.828 -2.737 -5.787 1.00 . A A . 18 VAL HA 1 1 6 5016 1 1 18 VAL HB H -0.611 -4.979 -7.408 1.00 . A A . 18 VAL HB 1 1 6 5017 1 1 18 VAL HG11 H -1.415 -2.164 -7.825 1.00 . A A . 18 VAL HG11 1 1 6 5018 1 1 18 VAL HG12 H 0.162 -2.593 -8.489 1.00 . A A . 18 VAL HG12 1 1 6 5019 1 1 18 VAL HG13 H -1.277 -3.480 -8.991 1.00 . A A . 18 VAL HG13 1 1 6 5020 1 1 18 VAL HG21 H 0.628 -3.325 -5.369 1.00 . A A . 18 VAL HG21 1 1 6 5021 1 1 18 VAL HG22 H 1.335 -4.634 -6.315 1.00 . A A . 18 VAL HG22 1 1 6 5022 1 1 18 VAL HG23 H 1.328 -2.989 -6.953 1.00 . A A . 18 VAL HG23 1 1 6 5023 1 1 18 VAL N N -1.302 -4.480 -4.722 1.00 . A A . 18 VAL N 1 1 6 5024 1 1 18 VAL O O -3.827 -3.686 -7.055 1.00 . A A . 18 VAL O 1 1 6 5025 1 1 19 GLU C C -5.592 -5.911 -5.951 1.00 . A A . 19 GLU C 1 1 6 5026 1 1 19 GLU CA C -4.440 -6.289 -6.871 1.00 . A A . 19 GLU CA 1 1 6 5027 1 1 19 GLU CB C -4.289 -7.810 -6.920 1.00 . A A . 19 GLU CB 1 1 6 5028 1 1 19 GLU CD C -2.511 -7.921 -8.672 1.00 . A A . 19 GLU CD 1 1 6 5029 1 1 19 GLU CG C -3.971 -8.247 -8.351 1.00 . A A . 19 GLU CG 1 1 6 5030 1 1 19 GLU H H -2.502 -6.222 -5.930 1.00 . A A . 19 GLU H 1 1 6 5031 1 1 19 GLU HA H -4.648 -5.911 -7.855 1.00 . A A . 19 GLU HA 1 1 6 5032 1 1 19 GLU HB2 H -3.485 -8.114 -6.264 1.00 . A A . 19 GLU HB2 1 1 6 5033 1 1 19 GLU HB3 H -5.209 -8.275 -6.601 1.00 . A A . 19 GLU HB3 1 1 6 5034 1 1 19 GLU HG2 H -4.132 -9.310 -8.446 1.00 . A A . 19 GLU HG2 1 1 6 5035 1 1 19 GLU HG3 H -4.614 -7.721 -9.040 1.00 . A A . 19 GLU HG3 1 1 6 5036 1 1 19 GLU N N -3.183 -5.669 -6.367 1.00 . A A . 19 GLU N 1 1 6 5037 1 1 19 GLU O O -6.698 -5.673 -6.394 1.00 . A A . 19 GLU O 1 1 6 5038 1 1 19 GLU OE1 O -2.063 -6.855 -8.284 1.00 . A A . 19 GLU OE1 1 1 6 5039 1 1 19 GLU OE2 O -1.864 -8.745 -9.298 1.00 . A A . 19 GLU OE2 1 1 6 5040 1 1 20 ILE C C -6.492 -3.885 -3.731 1.00 . A A . 20 ILE C 1 1 6 5041 1 1 20 ILE CA C -6.427 -5.413 -3.754 1.00 . A A . 20 ILE CA 1 1 6 5042 1 1 20 ILE CB C -6.139 -5.935 -2.351 1.00 . A A . 20 ILE CB 1 1 6 5043 1 1 20 ILE CD1 C -4.494 -7.758 -1.988 1.00 . A A . 20 ILE CD1 1 1 6 5044 1 1 20 ILE CG1 C -5.926 -7.423 -2.406 1.00 . A A . 20 ILE CG1 1 1 6 5045 1 1 20 ILE CG2 C -7.319 -5.623 -1.432 1.00 . A A . 20 ILE CG2 1 1 6 5046 1 1 20 ILE H H -4.439 -5.987 -4.338 1.00 . A A . 20 ILE H 1 1 6 5047 1 1 20 ILE HA H -7.368 -5.813 -4.101 1.00 . A A . 20 ILE HA 1 1 6 5048 1 1 20 ILE HB H -5.260 -5.485 -1.972 1.00 . A A . 20 ILE HB 1 1 6 5049 1 1 20 ILE HD11 H -3.853 -6.912 -2.189 1.00 . A A . 20 ILE HD11 1 1 6 5050 1 1 20 ILE HD12 H -4.470 -7.986 -0.934 1.00 . A A . 20 ILE HD12 1 1 6 5051 1 1 20 ILE HD13 H -4.148 -8.614 -2.550 1.00 . A A . 20 ILE HD13 1 1 6 5052 1 1 20 ILE HG12 H -6.614 -7.886 -1.738 1.00 . A A . 20 ILE HG12 1 1 6 5053 1 1 20 ILE HG13 H -6.094 -7.762 -3.402 1.00 . A A . 20 ILE HG13 1 1 6 5054 1 1 20 ILE HG21 H -8.125 -5.200 -2.013 1.00 . A A . 20 ILE HG21 1 1 6 5055 1 1 20 ILE HG22 H -7.656 -6.532 -0.956 1.00 . A A . 20 ILE HG22 1 1 6 5056 1 1 20 ILE HG23 H -7.010 -4.915 -0.679 1.00 . A A . 20 ILE HG23 1 1 6 5057 1 1 20 ILE N N -5.342 -5.817 -4.679 1.00 . A A . 20 ILE N 1 1 6 5058 1 1 20 ILE O O -7.137 -3.292 -2.888 1.00 . A A . 20 ILE O 1 1 6 5059 1 1 21 ALA C C -5.168 -1.264 -5.967 1.00 . A A . 21 ALA C 1 1 6 5060 1 1 21 ALA CA C -5.841 -1.753 -4.684 1.00 . A A . 21 ALA CA 1 1 6 5061 1 1 21 ALA CB C -5.082 -1.208 -3.472 1.00 . A A . 21 ALA CB 1 1 6 5062 1 1 21 ALA H H -5.303 -3.737 -5.329 1.00 . A A . 21 ALA H 1 1 6 5063 1 1 21 ALA HA H -6.862 -1.404 -4.657 1.00 . A A . 21 ALA HA 1 1 6 5064 1 1 21 ALA HB1 H -4.109 -1.675 -3.417 1.00 . A A . 21 ALA HB1 1 1 6 5065 1 1 21 ALA HB2 H -4.963 -0.139 -3.572 1.00 . A A . 21 ALA HB2 1 1 6 5066 1 1 21 ALA HB3 H -5.638 -1.426 -2.573 1.00 . A A . 21 ALA HB3 1 1 6 5067 1 1 21 ALA N N -5.821 -3.241 -4.654 1.00 . A A . 21 ALA N 1 1 6 5068 1 1 21 ALA O O -4.122 -0.646 -5.924 1.00 . A A . 21 ALA O 1 1 6 5069 1 1 22 PRO C C -5.427 0.373 -8.570 1.00 . A A . 22 PRO C 1 1 6 5070 1 1 22 PRO CA C -5.258 -1.138 -8.388 1.00 . A A . 22 PRO CA 1 1 6 5071 1 1 22 PRO CB C -6.110 -1.914 -9.392 1.00 . A A . 22 PRO CB 1 1 6 5072 1 1 22 PRO CD C -7.061 -2.293 -7.194 1.00 . A A . 22 PRO CD 1 1 6 5073 1 1 22 PRO CG C -7.391 -2.200 -8.667 1.00 . A A . 22 PRO CG 1 1 6 5074 1 1 22 PRO HA H -4.222 -1.421 -8.483 1.00 . A A . 22 PRO HA 1 1 6 5075 1 1 22 PRO HB2 H -6.265 -1.305 -10.274 1.00 . A A . 22 PRO HB2 1 1 6 5076 1 1 22 PRO HB3 H -5.602 -2.823 -9.668 1.00 . A A . 22 PRO HB3 1 1 6 5077 1 1 22 PRO HD2 H -7.840 -1.828 -6.604 1.00 . A A . 22 PRO HD2 1 1 6 5078 1 1 22 PRO HD3 H -6.925 -3.321 -6.900 1.00 . A A . 22 PRO HD3 1 1 6 5079 1 1 22 PRO HG2 H -8.094 -1.398 -8.843 1.00 . A A . 22 PRO HG2 1 1 6 5080 1 1 22 PRO HG3 H -7.802 -3.137 -9.008 1.00 . A A . 22 PRO HG3 1 1 6 5081 1 1 22 PRO N N -5.799 -1.556 -7.069 1.00 . A A . 22 PRO N 1 1 6 5082 1 1 22 PRO O O -6.030 0.833 -9.519 1.00 . A A . 22 PRO O 1 1 6 5083 1 1 23 GLY C C -4.319 3.279 -6.579 1.00 . A A . 23 GLY C 1 1 6 5084 1 1 23 GLY CA C -5.026 2.625 -7.767 1.00 . A A . 23 GLY CA 1 1 6 5085 1 1 23 GLY H H -4.421 0.749 -6.902 1.00 . A A . 23 GLY H 1 1 6 5086 1 1 23 GLY HA2 H -4.572 2.960 -8.689 1.00 . A A . 23 GLY HA2 1 1 6 5087 1 1 23 GLY HA3 H -6.069 2.901 -7.756 1.00 . A A . 23 GLY HA3 1 1 6 5088 1 1 23 GLY N N -4.900 1.145 -7.660 1.00 . A A . 23 GLY N 1 1 6 5089 1 1 23 GLY O O -3.739 4.341 -6.694 1.00 . A A . 23 GLY O 1 1 6 5090 1 1 24 ALA C C -2.283 2.635 -4.110 1.00 . A A . 24 ALA C 1 1 6 5091 1 1 24 ALA CA C -3.687 3.229 -4.239 1.00 . A A . 24 ALA CA 1 1 6 5092 1 1 24 ALA CB C -4.501 2.896 -2.986 1.00 . A A . 24 ALA CB 1 1 6 5093 1 1 24 ALA H H -4.831 1.792 -5.365 1.00 . A A . 24 ALA H 1 1 6 5094 1 1 24 ALA HA H -3.617 4.301 -4.349 1.00 . A A . 24 ALA HA 1 1 6 5095 1 1 24 ALA HB1 H -4.603 1.824 -2.898 1.00 . A A . 24 ALA HB1 1 1 6 5096 1 1 24 ALA HB2 H -3.994 3.282 -2.114 1.00 . A A . 24 ALA HB2 1 1 6 5097 1 1 24 ALA HB3 H -5.481 3.345 -3.062 1.00 . A A . 24 ALA HB3 1 1 6 5098 1 1 24 ALA N N -4.359 2.649 -5.435 1.00 . A A . 24 ALA N 1 1 6 5099 1 1 24 ALA O O -1.393 3.234 -3.539 1.00 . A A . 24 ALA O 1 1 6 5100 1 1 25 PHE C C -0.243 0.492 -5.964 1.00 . A A . 25 PHE C 1 1 6 5101 1 1 25 PHE CA C -0.733 0.822 -4.557 1.00 . A A . 25 PHE CA 1 1 6 5102 1 1 25 PHE CB C -0.828 -0.472 -3.750 1.00 . A A . 25 PHE CB 1 1 6 5103 1 1 25 PHE CD1 C 1.456 0.116 -2.859 1.00 . A A . 25 PHE CD1 1 1 6 5104 1 1 25 PHE CD2 C -0.101 -1.039 -1.405 1.00 . A A . 25 PHE CD2 1 1 6 5105 1 1 25 PHE CE1 C 2.408 0.119 -1.833 1.00 . A A . 25 PHE CE1 1 1 6 5106 1 1 25 PHE CE2 C 0.854 -1.037 -0.382 1.00 . A A . 25 PHE CE2 1 1 6 5107 1 1 25 PHE CG C 0.200 -0.463 -2.645 1.00 . A A . 25 PHE CG 1 1 6 5108 1 1 25 PHE CZ C 2.109 -0.457 -0.597 1.00 . A A . 25 PHE CZ 1 1 6 5109 1 1 25 PHE H H -2.810 0.997 -5.098 1.00 . A A . 25 PHE H 1 1 6 5110 1 1 25 PHE HA H -0.033 1.496 -4.081 1.00 . A A . 25 PHE HA 1 1 6 5111 1 1 25 PHE HB2 H -1.817 -0.560 -3.324 1.00 . A A . 25 PHE HB2 1 1 6 5112 1 1 25 PHE HB3 H -0.641 -1.310 -4.404 1.00 . A A . 25 PHE HB3 1 1 6 5113 1 1 25 PHE HD1 H 1.690 0.561 -3.814 1.00 . A A . 25 PHE HD1 1 1 6 5114 1 1 25 PHE HD2 H -1.070 -1.487 -1.240 1.00 . A A . 25 PHE HD2 1 1 6 5115 1 1 25 PHE HE1 H 3.375 0.565 -1.996 1.00 . A A . 25 PHE HE1 1 1 6 5116 1 1 25 PHE HE2 H 0.621 -1.482 0.574 1.00 . A A . 25 PHE HE2 1 1 6 5117 1 1 25 PHE HZ H 2.843 -0.455 0.186 1.00 . A A . 25 PHE HZ 1 1 6 5118 1 1 25 PHE N N -2.078 1.461 -4.641 1.00 . A A . 25 PHE N 1 1 6 5119 1 1 25 PHE O O -0.970 -0.026 -6.787 1.00 . A A . 25 PHE O 1 1 6 5120 1 1 26 ALA C C 3.076 0.537 -7.510 1.00 . A A . 26 ALA C 1 1 6 5121 1 1 26 ALA CA C 1.552 0.492 -7.589 1.00 . A A . 26 ALA CA 1 1 6 5122 1 1 26 ALA CB C 1.061 1.542 -8.588 1.00 . A A . 26 ALA CB 1 1 6 5123 1 1 26 ALA H H 1.556 1.201 -5.553 1.00 . A A . 26 ALA H 1 1 6 5124 1 1 26 ALA HA H 1.234 -0.490 -7.907 1.00 . A A . 26 ALA HA 1 1 6 5125 1 1 26 ALA HB1 H 1.152 2.526 -8.153 1.00 . A A . 26 ALA HB1 1 1 6 5126 1 1 26 ALA HB2 H 1.657 1.489 -9.488 1.00 . A A . 26 ALA HB2 1 1 6 5127 1 1 26 ALA HB3 H 0.026 1.351 -8.830 1.00 . A A . 26 ALA HB3 1 1 6 5128 1 1 26 ALA N N 0.992 0.787 -6.240 1.00 . A A . 26 ALA N 1 1 6 5129 1 1 26 ALA O O 3.638 1.318 -6.778 1.00 . A A . 26 ALA O 1 1 6 5130 1 1 27 MET C C 5.763 0.898 -9.022 1.00 . A A . 27 MET C 1 1 6 5131 1 1 27 MET CA C 5.245 -0.283 -8.206 1.00 . A A . 27 MET CA 1 1 6 5132 1 1 27 MET CB C 5.780 -1.592 -8.793 1.00 . A A . 27 MET CB 1 1 6 5133 1 1 27 MET CE C 7.833 -4.246 -9.230 1.00 . A A . 27 MET CE 1 1 6 5134 1 1 27 MET CG C 7.298 -1.653 -8.617 1.00 . A A . 27 MET CG 1 1 6 5135 1 1 27 MET H H 3.286 -0.920 -8.840 1.00 . A A . 27 MET H 1 1 6 5136 1 1 27 MET HA H 5.568 -0.184 -7.187 1.00 . A A . 27 MET HA 1 1 6 5137 1 1 27 MET HB2 H 5.323 -2.427 -8.283 1.00 . A A . 27 MET HB2 1 1 6 5138 1 1 27 MET HB3 H 5.539 -1.638 -9.845 1.00 . A A . 27 MET HB3 1 1 6 5139 1 1 27 MET HE1 H 7.677 -4.140 -8.165 1.00 . A A . 27 MET HE1 1 1 6 5140 1 1 27 MET HE2 H 6.985 -4.747 -9.675 1.00 . A A . 27 MET HE2 1 1 6 5141 1 1 27 MET HE3 H 8.724 -4.827 -9.404 1.00 . A A . 27 MET HE3 1 1 6 5142 1 1 27 MET HG2 H 7.702 -0.653 -8.624 1.00 . A A . 27 MET HG2 1 1 6 5143 1 1 27 MET HG3 H 7.532 -2.130 -7.677 1.00 . A A . 27 MET HG3 1 1 6 5144 1 1 27 MET N N 3.754 -0.293 -8.253 1.00 . A A . 27 MET N 1 1 6 5145 1 1 27 MET O O 5.118 1.329 -9.959 1.00 . A A . 27 MET O 1 1 6 5146 1 1 27 MET SD S 8.023 -2.607 -9.975 1.00 . A A . 27 MET SD 1 1 6 5147 1 1 28 ASP C C 8.777 2.154 -10.044 1.00 . A A . 28 ASP C 1 1 6 5148 1 1 28 ASP CA C 7.417 2.559 -9.526 1.00 . A A . 28 ASP CA 1 1 6 5149 1 1 28 ASP CB C 7.547 3.805 -8.658 1.00 . A A . 28 ASP CB 1 1 6 5150 1 1 28 ASP CG C 7.000 5.019 -9.414 1.00 . A A . 28 ASP CG 1 1 6 5151 1 1 28 ASP H H 7.484 1.083 -7.961 1.00 . A A . 28 ASP H 1 1 6 5152 1 1 28 ASP HA H 6.742 2.747 -10.349 1.00 . A A . 28 ASP HA 1 1 6 5153 1 1 28 ASP HB2 H 6.989 3.668 -7.743 1.00 . A A . 28 ASP HB2 1 1 6 5154 1 1 28 ASP HB3 H 8.586 3.963 -8.428 1.00 . A A . 28 ASP HB3 1 1 6 5155 1 1 28 ASP N N 6.922 1.431 -8.713 1.00 . A A . 28 ASP N 1 1 6 5156 1 1 28 ASP O O 9.363 1.243 -9.502 1.00 . A A . 28 ASP O 1 1 6 5157 1 1 28 ASP OD1 O 6.174 4.824 -10.289 1.00 . A A . 28 ASP OD1 1 1 6 5158 1 1 28 ASP OD2 O 7.416 6.123 -9.102 1.00 . A A . 28 ASP OD2 1 1 6 5159 1 1 29 PRO C C 11.609 3.281 -10.841 1.00 . A A . 29 PRO C 1 1 6 5160 1 1 29 PRO CA C 10.551 2.546 -11.653 1.00 . A A . 29 PRO CA 1 1 6 5161 1 1 29 PRO CB C 10.443 3.109 -13.068 1.00 . A A . 29 PRO CB 1 1 6 5162 1 1 29 PRO CD C 8.571 3.957 -11.734 1.00 . A A . 29 PRO CD 1 1 6 5163 1 1 29 PRO CG C 9.389 4.177 -12.994 1.00 . A A . 29 PRO CG 1 1 6 5164 1 1 29 PRO HA H 10.741 1.485 -11.676 1.00 . A A . 29 PRO HA 1 1 6 5165 1 1 29 PRO HB2 H 11.407 3.504 -13.366 1.00 . A A . 29 PRO HB2 1 1 6 5166 1 1 29 PRO HB3 H 10.157 2.319 -13.745 1.00 . A A . 29 PRO HB3 1 1 6 5167 1 1 29 PRO HD2 H 8.594 4.844 -11.116 1.00 . A A . 29 PRO HD2 1 1 6 5168 1 1 29 PRO HD3 H 7.560 3.700 -11.979 1.00 . A A . 29 PRO HD3 1 1 6 5169 1 1 29 PRO HG2 H 9.863 5.148 -12.960 1.00 . A A . 29 PRO HG2 1 1 6 5170 1 1 29 PRO HG3 H 8.747 4.112 -13.859 1.00 . A A . 29 PRO HG3 1 1 6 5171 1 1 29 PRO N N 9.231 2.840 -11.060 1.00 . A A . 29 PRO N 1 1 6 5172 1 1 29 PRO O O 12.789 2.994 -10.907 1.00 . A A . 29 PRO O 1 1 6 5173 1 1 30 GLU C C 12.242 4.188 -7.881 1.00 . A A . 30 GLU C 1 1 6 5174 1 1 30 GLU CA C 12.108 4.971 -9.179 1.00 . A A . 30 GLU CA 1 1 6 5175 1 1 30 GLU CB C 11.539 6.363 -8.893 1.00 . A A . 30 GLU CB 1 1 6 5176 1 1 30 GLU CD C 12.192 8.680 -8.233 1.00 . A A . 30 GLU CD 1 1 6 5177 1 1 30 GLU CG C 12.673 7.390 -8.897 1.00 . A A . 30 GLU CG 1 1 6 5178 1 1 30 GLU H H 10.205 4.395 -10.000 1.00 . A A . 30 GLU H 1 1 6 5179 1 1 30 GLU HA H 13.071 5.054 -9.661 1.00 . A A . 30 GLU HA 1 1 6 5180 1 1 30 GLU HB2 H 10.818 6.619 -9.656 1.00 . A A . 30 GLU HB2 1 1 6 5181 1 1 30 GLU HB3 H 11.058 6.365 -7.927 1.00 . A A . 30 GLU HB3 1 1 6 5182 1 1 30 GLU HG2 H 13.517 6.995 -8.351 1.00 . A A . 30 GLU HG2 1 1 6 5183 1 1 30 GLU HG3 H 12.967 7.599 -9.915 1.00 . A A . 30 GLU HG3 1 1 6 5184 1 1 30 GLU N N 11.169 4.213 -10.046 1.00 . A A . 30 GLU N 1 1 6 5185 1 1 30 GLU O O 13.296 4.118 -7.279 1.00 . A A . 30 GLU O 1 1 6 5186 1 1 30 GLU OE1 O 11.628 8.593 -7.155 1.00 . A A . 30 GLU OE1 1 1 6 5187 1 1 30 GLU OE2 O 12.395 9.734 -8.814 1.00 . A A . 30 GLU OE2 1 1 6 5188 1 1 31 ILE C C 11.152 1.272 -6.641 1.00 . A A . 31 ILE C 1 1 6 5189 1 1 31 ILE CA C 11.207 2.736 -6.246 1.00 . A A . 31 ILE CA 1 1 6 5190 1 1 31 ILE CB C 10.024 3.069 -5.338 1.00 . A A . 31 ILE CB 1 1 6 5191 1 1 31 ILE CD1 C 7.599 3.629 -5.295 1.00 . A A . 31 ILE CD1 1 1 6 5192 1 1 31 ILE CG1 C 8.824 3.462 -6.190 1.00 . A A . 31 ILE CG1 1 1 6 5193 1 1 31 ILE CG2 C 10.396 4.233 -4.418 1.00 . A A . 31 ILE CG2 1 1 6 5194 1 1 31 ILE H H 10.349 3.617 -7.999 1.00 . A A . 31 ILE H 1 1 6 5195 1 1 31 ILE HA H 12.108 2.913 -5.728 1.00 . A A . 31 ILE HA 1 1 6 5196 1 1 31 ILE HB H 9.776 2.204 -4.740 1.00 . A A . 31 ILE HB 1 1 6 5197 1 1 31 ILE HD11 H 7.845 4.281 -4.471 1.00 . A A . 31 ILE HD11 1 1 6 5198 1 1 31 ILE HD12 H 6.791 4.061 -5.868 1.00 . A A . 31 ILE HD12 1 1 6 5199 1 1 31 ILE HD13 H 7.297 2.665 -4.915 1.00 . A A . 31 ILE HD13 1 1 6 5200 1 1 31 ILE HG12 H 9.032 4.392 -6.695 1.00 . A A . 31 ILE HG12 1 1 6 5201 1 1 31 ILE HG13 H 8.631 2.690 -6.920 1.00 . A A . 31 ILE HG13 1 1 6 5202 1 1 31 ILE HG21 H 10.840 5.026 -5.001 1.00 . A A . 31 ILE HG21 1 1 6 5203 1 1 31 ILE HG22 H 9.508 4.602 -3.927 1.00 . A A . 31 ILE HG22 1 1 6 5204 1 1 31 ILE HG23 H 11.103 3.893 -3.676 1.00 . A A . 31 ILE HG23 1 1 6 5205 1 1 31 ILE N N 11.172 3.562 -7.474 1.00 . A A . 31 ILE N 1 1 6 5206 1 1 31 ILE O O 11.201 0.399 -5.797 1.00 . A A . 31 ILE O 1 1 6 5207 1 1 32 GLU C C 10.167 -1.199 -7.371 1.00 . A A . 32 GLU C 1 1 6 5208 1 1 32 GLU CA C 10.946 -0.408 -8.403 1.00 . A A . 32 GLU CA 1 1 6 5209 1 1 32 GLU CB C 12.349 -0.996 -8.566 1.00 . A A . 32 GLU CB 1 1 6 5210 1 1 32 GLU CD C 13.143 -2.621 -10.286 1.00 . A A . 32 GLU CD 1 1 6 5211 1 1 32 GLU CG C 12.648 -1.193 -10.052 1.00 . A A . 32 GLU CG 1 1 6 5212 1 1 32 GLU H H 10.991 1.732 -8.572 1.00 . A A . 32 GLU H 1 1 6 5213 1 1 32 GLU HA H 10.421 -0.428 -9.346 1.00 . A A . 32 GLU HA 1 1 6 5214 1 1 32 GLU HB2 H 13.074 -0.320 -8.137 1.00 . A A . 32 GLU HB2 1 1 6 5215 1 1 32 GLU HB3 H 12.400 -1.948 -8.061 1.00 . A A . 32 GLU HB3 1 1 6 5216 1 1 32 GLU HG2 H 11.749 -1.023 -10.627 1.00 . A A . 32 GLU HG2 1 1 6 5217 1 1 32 GLU HG3 H 13.411 -0.494 -10.362 1.00 . A A . 32 GLU HG3 1 1 6 5218 1 1 32 GLU N N 11.036 1.001 -7.922 1.00 . A A . 32 GLU N 1 1 6 5219 1 1 32 GLU O O 10.448 -2.348 -7.093 1.00 . A A . 32 GLU O 1 1 6 5220 1 1 32 GLU OE1 O 12.537 -3.532 -9.746 1.00 . A A . 32 GLU OE1 1 1 6 5221 1 1 32 GLU OE2 O 14.119 -2.779 -11.001 1.00 . A A . 32 GLU OE2 1 1 6 5222 1 1 33 LYS C C 7.059 -0.578 -5.519 1.00 . A A . 33 LYS C 1 1 6 5223 1 1 33 LYS CA C 8.418 -1.245 -5.697 1.00 . A A . 33 LYS CA 1 1 6 5224 1 1 33 LYS CB C 9.183 -1.162 -4.370 1.00 . A A . 33 LYS CB 1 1 6 5225 1 1 33 LYS CD C 10.015 -3.517 -4.629 1.00 . A A . 33 LYS CD 1 1 6 5226 1 1 33 LYS CE C 11.266 -4.387 -4.765 1.00 . A A . 33 LYS CE 1 1 6 5227 1 1 33 LYS CG C 10.428 -2.057 -4.415 1.00 . A A . 33 LYS CG 1 1 6 5228 1 1 33 LYS H H 9.020 0.391 -7.015 1.00 . A A . 33 LYS H 1 1 6 5229 1 1 33 LYS HA H 8.273 -2.280 -5.958 1.00 . A A . 33 LYS HA 1 1 6 5230 1 1 33 LYS HB2 H 9.484 -0.140 -4.195 1.00 . A A . 33 LYS HB2 1 1 6 5231 1 1 33 LYS HB3 H 8.539 -1.488 -3.566 1.00 . A A . 33 LYS HB3 1 1 6 5232 1 1 33 LYS HD2 H 9.432 -3.853 -3.785 1.00 . A A . 33 LYS HD2 1 1 6 5233 1 1 33 LYS HD3 H 9.427 -3.599 -5.528 1.00 . A A . 33 LYS HD3 1 1 6 5234 1 1 33 LYS HE2 H 11.009 -5.418 -4.568 1.00 . A A . 33 LYS HE2 1 1 6 5235 1 1 33 LYS HE3 H 11.656 -4.301 -5.768 1.00 . A A . 33 LYS HE3 1 1 6 5236 1 1 33 LYS HG2 H 11.071 -1.739 -5.221 1.00 . A A . 33 LYS HG2 1 1 6 5237 1 1 33 LYS HG3 H 10.961 -1.972 -3.480 1.00 . A A . 33 LYS HG3 1 1 6 5238 1 1 33 LYS HZ1 H 11.845 -3.748 -2.871 1.00 . A A . 33 LYS HZ1 1 1 6 5239 1 1 33 LYS HZ2 H 13.016 -4.679 -3.677 1.00 . A A . 33 LYS HZ2 1 1 6 5240 1 1 33 LYS HZ3 H 12.750 -3.069 -4.139 1.00 . A A . 33 LYS HZ3 1 1 6 5241 1 1 33 LYS N N 9.205 -0.557 -6.772 1.00 . A A . 33 LYS N 1 1 6 5242 1 1 33 LYS NZ N 12.297 -3.937 -3.789 1.00 . A A . 33 LYS NZ 1 1 6 5243 1 1 33 LYS O O 6.887 0.595 -5.785 1.00 . A A . 33 LYS O 1 1 6 5244 1 1 34 ALA C C 4.785 0.367 -3.824 1.00 . A A . 34 ALA C 1 1 6 5245 1 1 34 ALA CA C 4.732 -0.756 -4.859 1.00 . A A . 34 ALA CA 1 1 6 5246 1 1 34 ALA CB C 3.787 -1.856 -4.370 1.00 . A A . 34 ALA CB 1 1 6 5247 1 1 34 ALA H H 6.259 -2.268 -4.854 1.00 . A A . 34 ALA H 1 1 6 5248 1 1 34 ALA HA H 4.366 -0.364 -5.794 1.00 . A A . 34 ALA HA 1 1 6 5249 1 1 34 ALA HB1 H 4.290 -2.811 -4.421 1.00 . A A . 34 ALA HB1 1 1 6 5250 1 1 34 ALA HB2 H 3.500 -1.655 -3.349 1.00 . A A . 34 ALA HB2 1 1 6 5251 1 1 34 ALA HB3 H 2.907 -1.878 -4.995 1.00 . A A . 34 ALA HB3 1 1 6 5252 1 1 34 ALA N N 6.090 -1.326 -5.063 1.00 . A A . 34 ALA N 1 1 6 5253 1 1 34 ALA O O 5.495 0.292 -2.844 1.00 . A A . 34 ALA O 1 1 6 5254 1 1 35 TYR C C 2.553 3.044 -3.010 1.00 . A A . 35 TYR C 1 1 6 5255 1 1 35 TYR CA C 3.976 2.536 -3.065 1.00 . A A . 35 TYR CA 1 1 6 5256 1 1 35 TYR CB C 4.937 3.651 -3.507 1.00 . A A . 35 TYR CB 1 1 6 5257 1 1 35 TYR CD1 C 4.241 3.927 -5.913 1.00 . A A . 35 TYR CD1 1 1 6 5258 1 1 35 TYR CD2 C 3.854 5.756 -4.375 1.00 . A A . 35 TYR CD2 1 1 6 5259 1 1 35 TYR CE1 C 3.674 4.678 -6.951 1.00 . A A . 35 TYR CE1 1 1 6 5260 1 1 35 TYR CE2 C 3.290 6.510 -5.412 1.00 . A A . 35 TYR CE2 1 1 6 5261 1 1 35 TYR CG C 4.329 4.464 -4.627 1.00 . A A . 35 TYR CG 1 1 6 5262 1 1 35 TYR CZ C 3.197 5.971 -6.701 1.00 . A A . 35 TYR CZ 1 1 6 5263 1 1 35 TYR H H 3.432 1.420 -4.820 1.00 . A A . 35 TYR H 1 1 6 5264 1 1 35 TYR HA H 4.251 2.199 -2.069 1.00 . A A . 35 TYR HA 1 1 6 5265 1 1 35 TYR HB2 H 5.142 4.298 -2.668 1.00 . A A . 35 TYR HB2 1 1 6 5266 1 1 35 TYR HB3 H 5.859 3.207 -3.846 1.00 . A A . 35 TYR HB3 1 1 6 5267 1 1 35 TYR HD1 H 4.615 2.937 -6.106 1.00 . A A . 35 TYR HD1 1 1 6 5268 1 1 35 TYR HD2 H 3.925 6.173 -3.381 1.00 . A A . 35 TYR HD2 1 1 6 5269 1 1 35 TYR HE1 H 3.606 4.261 -7.945 1.00 . A A . 35 TYR HE1 1 1 6 5270 1 1 35 TYR HE2 H 2.927 7.507 -5.218 1.00 . A A . 35 TYR HE2 1 1 6 5271 1 1 35 TYR HH H 3.084 6.473 -8.538 1.00 . A A . 35 TYR HH 1 1 6 5272 1 1 35 TYR N N 4.013 1.399 -4.029 1.00 . A A . 35 TYR N 1 1 6 5273 1 1 35 TYR O O 1.707 2.662 -3.793 1.00 . A A . 35 TYR O 1 1 6 5274 1 1 35 TYR OH O 2.639 6.712 -7.721 1.00 . A A . 35 TYR OH 1 1 6 5275 1 1 36 VAL C C 0.710 5.587 -2.840 1.00 . A A . 36 VAL C 1 1 6 5276 1 1 36 VAL CA C 0.897 4.381 -1.920 1.00 . A A . 36 VAL CA 1 1 6 5277 1 1 36 VAL CB C 0.671 4.763 -0.453 1.00 . A A . 36 VAL CB 1 1 6 5278 1 1 36 VAL CG1 C -0.749 4.389 -0.035 1.00 . A A . 36 VAL CG1 1 1 6 5279 1 1 36 VAL CG2 C 1.658 4.007 0.438 1.00 . A A . 36 VAL CG2 1 1 6 5280 1 1 36 VAL H H 2.973 4.143 -1.436 1.00 . A A . 36 VAL H 1 1 6 5281 1 1 36 VAL HA H 0.200 3.603 -2.204 1.00 . A A . 36 VAL HA 1 1 6 5282 1 1 36 VAL HB H 0.825 5.819 -0.333 1.00 . A A . 36 VAL HB 1 1 6 5283 1 1 36 VAL HG11 H -0.989 3.409 -0.422 1.00 . A A . 36 VAL HG11 1 1 6 5284 1 1 36 VAL HG12 H -0.812 4.373 1.044 1.00 . A A . 36 VAL HG12 1 1 6 5285 1 1 36 VAL HG13 H -1.443 5.113 -0.428 1.00 . A A . 36 VAL HG13 1 1 6 5286 1 1 36 VAL HG21 H 2.014 3.129 -0.078 1.00 . A A . 36 VAL HG21 1 1 6 5287 1 1 36 VAL HG22 H 2.491 4.652 0.665 1.00 . A A . 36 VAL HG22 1 1 6 5288 1 1 36 VAL HG23 H 1.170 3.710 1.352 1.00 . A A . 36 VAL HG23 1 1 6 5289 1 1 36 VAL N N 2.276 3.871 -2.068 1.00 . A A . 36 VAL N 1 1 6 5290 1 1 36 VAL O O 0.756 6.727 -2.419 1.00 . A A . 36 VAL O 1 1 6 5291 1 1 37 LYS C C -0.984 7.146 -4.864 1.00 . A A . 37 LYS C 1 1 6 5292 1 1 37 LYS CA C 0.339 6.427 -5.093 1.00 . A A . 37 LYS CA 1 1 6 5293 1 1 37 LYS CB C 0.361 5.833 -6.508 1.00 . A A . 37 LYS CB 1 1 6 5294 1 1 37 LYS CD C -0.879 4.338 -8.084 1.00 . A A . 37 LYS CD 1 1 6 5295 1 1 37 LYS CE C -1.647 4.959 -9.254 1.00 . A A . 37 LYS CE 1 1 6 5296 1 1 37 LYS CG C -1.008 5.237 -6.853 1.00 . A A . 37 LYS CG 1 1 6 5297 1 1 37 LYS H H 0.496 4.397 -4.409 1.00 . A A . 37 LYS H 1 1 6 5298 1 1 37 LYS HA H 1.142 7.135 -4.990 1.00 . A A . 37 LYS HA 1 1 6 5299 1 1 37 LYS HB2 H 0.605 6.607 -7.220 1.00 . A A . 37 LYS HB2 1 1 6 5300 1 1 37 LYS HB3 H 1.105 5.053 -6.556 1.00 . A A . 37 LYS HB3 1 1 6 5301 1 1 37 LYS HD2 H 0.164 4.239 -8.351 1.00 . A A . 37 LYS HD2 1 1 6 5302 1 1 37 LYS HD3 H -1.288 3.364 -7.864 1.00 . A A . 37 LYS HD3 1 1 6 5303 1 1 37 LYS HE2 H -2.146 4.180 -9.811 1.00 . A A . 37 LYS HE2 1 1 6 5304 1 1 37 LYS HE3 H -2.380 5.656 -8.874 1.00 . A A . 37 LYS HE3 1 1 6 5305 1 1 37 LYS HG2 H -1.366 4.653 -6.017 1.00 . A A . 37 LYS HG2 1 1 6 5306 1 1 37 LYS HG3 H -1.706 6.033 -7.062 1.00 . A A . 37 LYS HG3 1 1 6 5307 1 1 37 LYS HZ1 H 0.275 5.543 -9.804 1.00 . A A . 37 LYS HZ1 1 1 6 5308 1 1 37 LYS HZ2 H -0.774 5.297 -11.114 1.00 . A A . 37 LYS HZ2 1 1 6 5309 1 1 37 LYS HZ3 H -0.926 6.691 -10.155 1.00 . A A . 37 LYS HZ3 1 1 6 5310 1 1 37 LYS N N 0.514 5.327 -4.104 1.00 . A A . 37 LYS N 1 1 6 5311 1 1 37 LYS NZ N -0.696 5.677 -10.149 1.00 . A A . 37 LYS NZ 1 1 6 5312 1 1 37 LYS O O -1.292 8.111 -5.536 1.00 . A A . 37 LYS O 1 1 6 5313 1 1 38 ASP C C -3.851 6.664 -2.608 1.00 . A A . 38 ASP C 1 1 6 5314 1 1 38 ASP CA C -3.079 7.363 -3.728 1.00 . A A . 38 ASP CA 1 1 6 5315 1 1 38 ASP CB C -3.860 7.290 -5.037 1.00 . A A . 38 ASP CB 1 1 6 5316 1 1 38 ASP CG C -5.268 7.850 -4.835 1.00 . A A . 38 ASP CG 1 1 6 5317 1 1 38 ASP H H -1.532 5.902 -3.416 1.00 . A A . 38 ASP H 1 1 6 5318 1 1 38 ASP HA H -2.914 8.398 -3.465 1.00 . A A . 38 ASP HA 1 1 6 5319 1 1 38 ASP HB2 H -3.341 7.864 -5.793 1.00 . A A . 38 ASP HB2 1 1 6 5320 1 1 38 ASP HB3 H -3.921 6.260 -5.356 1.00 . A A . 38 ASP HB3 1 1 6 5321 1 1 38 ASP N N -1.779 6.689 -3.944 1.00 . A A . 38 ASP N 1 1 6 5322 1 1 38 ASP O O -4.028 5.461 -2.617 1.00 . A A . 38 ASP O 1 1 6 5323 1 1 38 ASP OD1 O -5.497 8.467 -3.807 1.00 . A A . 38 ASP OD1 1 1 6 5324 1 1 38 ASP OD2 O -6.095 7.653 -5.710 1.00 . A A . 38 ASP OD2 1 1 6 5325 1 1 39 VAL C C -6.512 6.524 -0.950 1.00 . A A . 39 VAL C 1 1 6 5326 1 1 39 VAL CA C -5.069 6.791 -0.515 1.00 . A A . 39 VAL CA 1 1 6 5327 1 1 39 VAL CB C -5.063 7.740 0.686 1.00 . A A . 39 VAL CB 1 1 6 5328 1 1 39 VAL CG1 C -3.653 7.806 1.277 1.00 . A A . 39 VAL CG1 1 1 6 5329 1 1 39 VAL CG2 C -5.489 9.140 0.237 1.00 . A A . 39 VAL CG2 1 1 6 5330 1 1 39 VAL H H -4.156 8.376 -1.650 1.00 . A A . 39 VAL H 1 1 6 5331 1 1 39 VAL HA H -4.600 5.858 -0.237 1.00 . A A . 39 VAL HA 1 1 6 5332 1 1 39 VAL HB H -5.750 7.375 1.436 1.00 . A A . 39 VAL HB 1 1 6 5333 1 1 39 VAL HG11 H -3.272 6.803 1.413 1.00 . A A . 39 VAL HG11 1 1 6 5334 1 1 39 VAL HG12 H -3.005 8.347 0.603 1.00 . A A . 39 VAL HG12 1 1 6 5335 1 1 39 VAL HG13 H -3.684 8.311 2.231 1.00 . A A . 39 VAL HG13 1 1 6 5336 1 1 39 VAL HG21 H -5.986 9.077 -0.719 1.00 . A A . 39 VAL HG21 1 1 6 5337 1 1 39 VAL HG22 H -6.164 9.563 0.967 1.00 . A A . 39 VAL HG22 1 1 6 5338 1 1 39 VAL HG23 H -4.617 9.770 0.147 1.00 . A A . 39 VAL HG23 1 1 6 5339 1 1 39 VAL N N -4.312 7.409 -1.639 1.00 . A A . 39 VAL N 1 1 6 5340 1 1 39 VAL O O -7.145 5.593 -0.494 1.00 . A A . 39 VAL O 1 1 6 5341 1 1 40 GLU C C -8.445 6.082 -3.419 1.00 . A A . 40 GLU C 1 1 6 5342 1 1 40 GLU CA C -8.437 7.118 -2.293 1.00 . A A . 40 GLU CA 1 1 6 5343 1 1 40 GLU CB C -9.013 8.435 -2.815 1.00 . A A . 40 GLU CB 1 1 6 5344 1 1 40 GLU CD C -10.534 10.305 -2.163 1.00 . A A . 40 GLU CD 1 1 6 5345 1 1 40 GLU CG C -9.546 9.260 -1.642 1.00 . A A . 40 GLU CG 1 1 6 5346 1 1 40 GLU H H -6.511 8.075 -2.190 1.00 . A A . 40 GLU H 1 1 6 5347 1 1 40 GLU HA H -9.038 6.762 -1.471 1.00 . A A . 40 GLU HA 1 1 6 5348 1 1 40 GLU HB2 H -8.237 8.991 -3.323 1.00 . A A . 40 GLU HB2 1 1 6 5349 1 1 40 GLU HB3 H -9.818 8.230 -3.503 1.00 . A A . 40 GLU HB3 1 1 6 5350 1 1 40 GLU HG2 H -10.047 8.607 -0.942 1.00 . A A . 40 GLU HG2 1 1 6 5351 1 1 40 GLU HG3 H -8.725 9.757 -1.149 1.00 . A A . 40 GLU HG3 1 1 6 5352 1 1 40 GLU N N -7.037 7.331 -1.831 1.00 . A A . 40 GLU N 1 1 6 5353 1 1 40 GLU O O -9.485 5.614 -3.839 1.00 . A A . 40 GLU O 1 1 6 5354 1 1 40 GLU OE1 O -10.626 10.456 -3.370 1.00 . A A . 40 GLU OE1 1 1 6 5355 1 1 40 GLU OE2 O -11.181 10.939 -1.346 1.00 . A A . 40 GLU OE2 1 1 6 5356 1 1 41 GLY C C -7.807 3.387 -4.529 1.00 . A A . 41 GLY C 1 1 6 5357 1 1 41 GLY CA C -7.227 4.720 -5.010 1.00 . A A . 41 GLY CA 1 1 6 5358 1 1 41 GLY H H -6.466 6.114 -3.558 1.00 . A A . 41 GLY H 1 1 6 5359 1 1 41 GLY HA2 H -7.798 5.078 -5.856 1.00 . A A . 41 GLY HA2 1 1 6 5360 1 1 41 GLY HA3 H -6.199 4.576 -5.305 1.00 . A A . 41 GLY HA3 1 1 6 5361 1 1 41 GLY N N -7.291 5.722 -3.911 1.00 . A A . 41 GLY N 1 1 6 5362 1 1 41 GLY O O -8.217 2.560 -5.318 1.00 . A A . 41 GLY O 1 1 6 5363 1 1 42 ALA C C -9.307 2.166 -1.524 1.00 . A A . 42 ALA C 1 1 6 5364 1 1 42 ALA CA C -8.395 1.888 -2.721 1.00 . A A . 42 ALA CA 1 1 6 5365 1 1 42 ALA CB C -7.246 0.977 -2.284 1.00 . A A . 42 ALA CB 1 1 6 5366 1 1 42 ALA H H -7.505 3.849 -2.620 1.00 . A A . 42 ALA H 1 1 6 5367 1 1 42 ALA HA H -8.964 1.399 -3.499 1.00 . A A . 42 ALA HA 1 1 6 5368 1 1 42 ALA HB1 H -6.337 1.554 -2.210 1.00 . A A . 42 ALA HB1 1 1 6 5369 1 1 42 ALA HB2 H -7.477 0.541 -1.323 1.00 . A A . 42 ALA HB2 1 1 6 5370 1 1 42 ALA HB3 H -7.114 0.189 -3.013 1.00 . A A . 42 ALA HB3 1 1 6 5371 1 1 42 ALA N N -7.843 3.171 -3.242 1.00 . A A . 42 ALA N 1 1 6 5372 1 1 42 ALA O O -9.007 2.986 -0.678 1.00 . A A . 42 ALA O 1 1 6 5373 1 1 43 SER C C -10.758 1.124 0.970 1.00 . A A . 43 SER C 1 1 6 5374 1 1 43 SER CA C -11.357 1.711 -0.309 1.00 . A A . 43 SER CA 1 1 6 5375 1 1 43 SER CB C -12.689 1.023 -0.605 1.00 . A A . 43 SER CB 1 1 6 5376 1 1 43 SER H H -10.645 0.835 -2.141 1.00 . A A . 43 SER H 1 1 6 5377 1 1 43 SER HA H -11.521 2.771 -0.177 1.00 . A A . 43 SER HA 1 1 6 5378 1 1 43 SER HB2 H -12.841 0.215 0.090 1.00 . A A . 43 SER HB2 1 1 6 5379 1 1 43 SER HB3 H -13.493 1.738 -0.503 1.00 . A A . 43 SER HB3 1 1 6 5380 1 1 43 SER HG H -13.523 0.663 -2.326 1.00 . A A . 43 SER HG 1 1 6 5381 1 1 43 SER N N -10.422 1.490 -1.447 1.00 . A A . 43 SER N 1 1 6 5382 1 1 43 SER O O -9.905 0.260 0.926 1.00 . A A . 43 SER O 1 1 6 5383 1 1 43 SER OG O -12.663 0.503 -1.928 1.00 . A A . 43 SER OG 1 1 6 5384 1 1 44 GLN C C -10.648 -0.473 3.348 1.00 . A A . 44 GLN C 1 1 6 5385 1 1 44 GLN CA C -10.664 1.057 3.392 1.00 . A A . 44 GLN CA 1 1 6 5386 1 1 44 GLN CB C -11.552 1.525 4.546 1.00 . A A . 44 GLN CB 1 1 6 5387 1 1 44 GLN CD C -11.472 0.992 6.986 1.00 . A A . 44 GLN CD 1 1 6 5388 1 1 44 GLN CG C -10.715 1.636 5.822 1.00 . A A . 44 GLN CG 1 1 6 5389 1 1 44 GLN H H -11.892 2.282 2.117 1.00 . A A . 44 GLN H 1 1 6 5390 1 1 44 GLN HA H -9.658 1.423 3.541 1.00 . A A . 44 GLN HA 1 1 6 5391 1 1 44 GLN HB2 H -11.975 2.490 4.305 1.00 . A A . 44 GLN HB2 1 1 6 5392 1 1 44 GLN HB3 H -12.348 0.812 4.701 1.00 . A A . 44 GLN HB3 1 1 6 5393 1 1 44 GLN HE21 H -9.831 0.657 8.053 1.00 . A A . 44 GLN HE21 1 1 6 5394 1 1 44 GLN HE22 H -11.282 0.152 8.775 1.00 . A A . 44 GLN HE22 1 1 6 5395 1 1 44 GLN HG2 H -9.771 1.128 5.678 1.00 . A A . 44 GLN HG2 1 1 6 5396 1 1 44 GLN HG3 H -10.535 2.677 6.046 1.00 . A A . 44 GLN HG3 1 1 6 5397 1 1 44 GLN N N -11.202 1.586 2.108 1.00 . A A . 44 GLN N 1 1 6 5398 1 1 44 GLN NE2 N -10.806 0.564 8.024 1.00 . A A . 44 GLN NE2 1 1 6 5399 1 1 44 GLN O O -9.671 -1.103 3.700 1.00 . A A . 44 GLN O 1 1 6 5400 1 1 44 GLN OE1 O -12.681 0.874 6.949 1.00 . A A . 44 GLN OE1 1 1 6 5401 1 1 45 GLU C C -10.781 -3.053 1.783 1.00 . A A . 45 GLU C 1 1 6 5402 1 1 45 GLU CA C -11.767 -2.562 2.846 1.00 . A A . 45 GLU CA 1 1 6 5403 1 1 45 GLU CB C -13.182 -3.009 2.476 1.00 . A A . 45 GLU CB 1 1 6 5404 1 1 45 GLU CD C -14.030 -3.214 4.817 1.00 . A A . 45 GLU CD 1 1 6 5405 1 1 45 GLU CG C -14.173 -2.451 3.499 1.00 . A A . 45 GLU CG 1 1 6 5406 1 1 45 GLU H H -12.499 -0.546 2.634 1.00 . A A . 45 GLU H 1 1 6 5407 1 1 45 GLU HA H -11.497 -2.975 3.806 1.00 . A A . 45 GLU HA 1 1 6 5408 1 1 45 GLU HB2 H -13.430 -2.638 1.492 1.00 . A A . 45 GLU HB2 1 1 6 5409 1 1 45 GLU HB3 H -13.232 -4.087 2.479 1.00 . A A . 45 GLU HB3 1 1 6 5410 1 1 45 GLU HG2 H -13.968 -1.403 3.664 1.00 . A A . 45 GLU HG2 1 1 6 5411 1 1 45 GLU HG3 H -15.179 -2.567 3.125 1.00 . A A . 45 GLU HG3 1 1 6 5412 1 1 45 GLU N N -11.722 -1.074 2.915 1.00 . A A . 45 GLU N 1 1 6 5413 1 1 45 GLU O O -10.495 -4.231 1.681 1.00 . A A . 45 GLU O 1 1 6 5414 1 1 45 GLU OE1 O -14.459 -4.355 4.867 1.00 . A A . 45 GLU OE1 1 1 6 5415 1 1 45 GLU OE2 O -13.494 -2.644 5.753 1.00 . A A . 45 GLU OE2 1 1 6 5416 1 1 46 GLU C C -7.885 -2.315 0.559 1.00 . A A . 46 GLU C 1 1 6 5417 1 1 46 GLU CA C -9.255 -2.555 -0.028 1.00 . A A . 46 GLU CA 1 1 6 5418 1 1 46 GLU CB C -9.439 -1.680 -1.264 1.00 . A A . 46 GLU CB 1 1 6 5419 1 1 46 GLU CD C -11.009 -1.324 -3.175 1.00 . A A . 46 GLU CD 1 1 6 5420 1 1 46 GLU CG C -10.901 -1.730 -1.704 1.00 . A A . 46 GLU CG 1 1 6 5421 1 1 46 GLU H H -10.452 -1.202 1.131 1.00 . A A . 46 GLU H 1 1 6 5422 1 1 46 GLU HA H -9.379 -3.597 -0.282 1.00 . A A . 46 GLU HA 1 1 6 5423 1 1 46 GLU HB2 H -9.169 -0.661 -1.026 1.00 . A A . 46 GLU HB2 1 1 6 5424 1 1 46 GLU HB3 H -8.809 -2.041 -2.056 1.00 . A A . 46 GLU HB3 1 1 6 5425 1 1 46 GLU HG2 H -11.281 -2.732 -1.577 1.00 . A A . 46 GLU HG2 1 1 6 5426 1 1 46 GLU HG3 H -11.478 -1.046 -1.100 1.00 . A A . 46 GLU HG3 1 1 6 5427 1 1 46 GLU N N -10.237 -2.153 1.010 1.00 . A A . 46 GLU N 1 1 6 5428 1 1 46 GLU O O -6.978 -3.114 0.447 1.00 . A A . 46 GLU O 1 1 6 5429 1 1 46 GLU OE1 O -10.343 -0.376 -3.558 1.00 . A A . 46 GLU OE1 1 1 6 5430 1 1 46 GLU OE2 O -11.755 -1.968 -3.894 1.00 . A A . 46 GLU OE2 1 1 6 5431 1 1 47 VAL C C -6.209 -1.941 2.937 1.00 . A A . 47 VAL C 1 1 6 5432 1 1 47 VAL CA C -6.491 -0.871 1.884 1.00 . A A . 47 VAL CA 1 1 6 5433 1 1 47 VAL CB C -6.635 0.490 2.560 1.00 . A A . 47 VAL CB 1 1 6 5434 1 1 47 VAL CG1 C -5.262 1.113 2.731 1.00 . A A . 47 VAL CG1 1 1 6 5435 1 1 47 VAL CG2 C -7.498 1.410 1.694 1.00 . A A . 47 VAL CG2 1 1 6 5436 1 1 47 VAL H H -8.526 -0.622 1.302 1.00 . A A . 47 VAL H 1 1 6 5437 1 1 47 VAL HA H -5.690 -0.843 1.159 1.00 . A A . 47 VAL HA 1 1 6 5438 1 1 47 VAL HB H -7.098 0.365 3.529 1.00 . A A . 47 VAL HB 1 1 6 5439 1 1 47 VAL HG11 H -4.580 0.370 3.112 1.00 . A A . 47 VAL HG11 1 1 6 5440 1 1 47 VAL HG12 H -4.913 1.468 1.773 1.00 . A A . 47 VAL HG12 1 1 6 5441 1 1 47 VAL HG13 H -5.328 1.937 3.422 1.00 . A A . 47 VAL HG13 1 1 6 5442 1 1 47 VAL HG21 H -7.498 1.051 0.676 1.00 . A A . 47 VAL HG21 1 1 6 5443 1 1 47 VAL HG22 H -8.509 1.418 2.073 1.00 . A A . 47 VAL HG22 1 1 6 5444 1 1 47 VAL HG23 H -7.095 2.413 1.722 1.00 . A A . 47 VAL HG23 1 1 6 5445 1 1 47 VAL N N -7.764 -1.213 1.222 1.00 . A A . 47 VAL N 1 1 6 5446 1 1 47 VAL O O -5.093 -2.386 3.111 1.00 . A A . 47 VAL O 1 1 6 5447 1 1 48 GLU C C -6.864 -4.753 4.007 1.00 . A A . 48 GLU C 1 1 6 5448 1 1 48 GLU CA C -7.081 -3.390 4.669 1.00 . A A . 48 GLU CA 1 1 6 5449 1 1 48 GLU CB C -8.375 -3.399 5.460 1.00 . A A . 48 GLU CB 1 1 6 5450 1 1 48 GLU CD C -8.892 -3.872 7.854 1.00 . A A . 48 GLU CD 1 1 6 5451 1 1 48 GLU CG C -8.092 -2.987 6.896 1.00 . A A . 48 GLU CG 1 1 6 5452 1 1 48 GLU H H -8.121 -1.991 3.484 1.00 . A A . 48 GLU H 1 1 6 5453 1 1 48 GLU HA H -6.254 -3.152 5.319 1.00 . A A . 48 GLU HA 1 1 6 5454 1 1 48 GLU HB2 H -9.066 -2.695 5.014 1.00 . A A . 48 GLU HB2 1 1 6 5455 1 1 48 GLU HB3 H -8.800 -4.376 5.431 1.00 . A A . 48 GLU HB3 1 1 6 5456 1 1 48 GLU HG2 H -7.037 -3.094 7.096 1.00 . A A . 48 GLU HG2 1 1 6 5457 1 1 48 GLU HG3 H -8.382 -1.957 7.029 1.00 . A A . 48 GLU HG3 1 1 6 5458 1 1 48 GLU N N -7.232 -2.359 3.637 1.00 . A A . 48 GLU N 1 1 6 5459 1 1 48 GLU O O -5.885 -5.427 4.260 1.00 . A A . 48 GLU O 1 1 6 5460 1 1 48 GLU OE1 O -8.516 -5.021 8.024 1.00 . A A . 48 GLU OE1 1 1 6 5461 1 1 48 GLU OE2 O -9.867 -3.386 8.404 1.00 . A A . 48 GLU OE2 1 1 6 5462 1 1 49 GLU C C -6.213 -6.527 1.830 1.00 . A A . 49 GLU C 1 1 6 5463 1 1 49 GLU CA C -7.596 -6.482 2.482 1.00 . A A . 49 GLU CA 1 1 6 5464 1 1 49 GLU CB C -8.677 -6.658 1.412 1.00 . A A . 49 GLU CB 1 1 6 5465 1 1 49 GLU CD C -9.596 -8.213 -0.316 1.00 . A A . 49 GLU CD 1 1 6 5466 1 1 49 GLU CG C -8.590 -8.070 0.828 1.00 . A A . 49 GLU CG 1 1 6 5467 1 1 49 GLU H H -8.550 -4.608 2.959 1.00 . A A . 49 GLU H 1 1 6 5468 1 1 49 GLU HA H -7.676 -7.274 3.212 1.00 . A A . 49 GLU HA 1 1 6 5469 1 1 49 GLU HB2 H -9.650 -6.509 1.856 1.00 . A A . 49 GLU HB2 1 1 6 5470 1 1 49 GLU HB3 H -8.525 -5.935 0.624 1.00 . A A . 49 GLU HB3 1 1 6 5471 1 1 49 GLU HG2 H -7.591 -8.244 0.454 1.00 . A A . 49 GLU HG2 1 1 6 5472 1 1 49 GLU HG3 H -8.818 -8.791 1.598 1.00 . A A . 49 GLU HG3 1 1 6 5473 1 1 49 GLU N N -7.767 -5.164 3.155 1.00 . A A . 49 GLU N 1 1 6 5474 1 1 49 GLU O O -5.483 -7.493 1.951 1.00 . A A . 49 GLU O 1 1 6 5475 1 1 49 GLU OE1 O -10.784 -8.220 -0.036 1.00 . A A . 49 GLU OE1 1 1 6 5476 1 1 49 GLU OE2 O -9.162 -8.314 -1.452 1.00 . A A . 49 GLU OE2 1 1 6 5477 1 1 50 ALA C C -3.425 -5.480 1.579 1.00 . A A . 50 ALA C 1 1 6 5478 1 1 50 ALA CA C -4.505 -5.439 0.497 1.00 . A A . 50 ALA CA 1 1 6 5479 1 1 50 ALA CB C -4.369 -4.141 -0.301 1.00 . A A . 50 ALA CB 1 1 6 5480 1 1 50 ALA H H -6.443 -4.707 1.076 1.00 . A A . 50 ALA H 1 1 6 5481 1 1 50 ALA HA H -4.399 -6.287 -0.168 1.00 . A A . 50 ALA HA 1 1 6 5482 1 1 50 ALA HB1 H -5.315 -3.901 -0.764 1.00 . A A . 50 ALA HB1 1 1 6 5483 1 1 50 ALA HB2 H -4.079 -3.340 0.363 1.00 . A A . 50 ALA HB2 1 1 6 5484 1 1 50 ALA HB3 H -3.616 -4.265 -1.065 1.00 . A A . 50 ALA HB3 1 1 6 5485 1 1 50 ALA N N -5.842 -5.477 1.148 1.00 . A A . 50 ALA N 1 1 6 5486 1 1 50 ALA O O -2.276 -5.774 1.319 1.00 . A A . 50 ALA O 1 1 6 5487 1 1 51 MET C C -2.597 -6.618 4.396 1.00 . A A . 51 MET C 1 1 6 5488 1 1 51 MET CA C -2.809 -5.185 3.907 1.00 . A A . 51 MET CA 1 1 6 5489 1 1 51 MET CB C -3.354 -4.333 5.055 1.00 . A A . 51 MET CB 1 1 6 5490 1 1 51 MET CE C -2.812 -0.904 6.370 1.00 . A A . 51 MET CE 1 1 6 5491 1 1 51 MET CG C -2.239 -3.457 5.626 1.00 . A A . 51 MET CG 1 1 6 5492 1 1 51 MET H H -4.728 -4.941 2.976 1.00 . A A . 51 MET H 1 1 6 5493 1 1 51 MET HA H -1.870 -4.774 3.566 1.00 . A A . 51 MET HA 1 1 6 5494 1 1 51 MET HB2 H -4.151 -3.703 4.685 1.00 . A A . 51 MET HB2 1 1 6 5495 1 1 51 MET HB3 H -3.737 -4.978 5.829 1.00 . A A . 51 MET HB3 1 1 6 5496 1 1 51 MET HE1 H -2.439 -0.954 5.357 1.00 . A A . 51 MET HE1 1 1 6 5497 1 1 51 MET HE2 H -3.811 -0.488 6.372 1.00 . A A . 51 MET HE2 1 1 6 5498 1 1 51 MET HE3 H -2.164 -0.276 6.960 1.00 . A A . 51 MET HE3 1 1 6 5499 1 1 51 MET HG2 H -1.402 -4.079 5.911 1.00 . A A . 51 MET HG2 1 1 6 5500 1 1 51 MET HG3 H -1.921 -2.747 4.878 1.00 . A A . 51 MET HG3 1 1 6 5501 1 1 51 MET N N -3.795 -5.179 2.794 1.00 . A A . 51 MET N 1 1 6 5502 1 1 51 MET O O -1.490 -7.034 4.676 1.00 . A A . 51 MET O 1 1 6 5503 1 1 51 MET SD S -2.854 -2.569 7.079 1.00 . A A . 51 MET SD 1 1 6 5504 1 1 52 ASP C C -2.798 -9.618 3.922 1.00 . A A . 52 ASP C 1 1 6 5505 1 1 52 ASP CA C -3.520 -8.780 4.981 1.00 . A A . 52 ASP CA 1 1 6 5506 1 1 52 ASP CB C -4.911 -9.367 5.230 1.00 . A A . 52 ASP CB 1 1 6 5507 1 1 52 ASP CG C -4.839 -10.395 6.361 1.00 . A A . 52 ASP CG 1 1 6 5508 1 1 52 ASP H H -4.537 -7.019 4.277 1.00 . A A . 52 ASP H 1 1 6 5509 1 1 52 ASP HA H -2.953 -8.797 5.900 1.00 . A A . 52 ASP HA 1 1 6 5510 1 1 52 ASP HB2 H -5.591 -8.574 5.506 1.00 . A A . 52 ASP HB2 1 1 6 5511 1 1 52 ASP HB3 H -5.265 -9.849 4.332 1.00 . A A . 52 ASP HB3 1 1 6 5512 1 1 52 ASP N N -3.653 -7.376 4.505 1.00 . A A . 52 ASP N 1 1 6 5513 1 1 52 ASP O O -2.198 -10.630 4.223 1.00 . A A . 52 ASP O 1 1 6 5514 1 1 52 ASP OD1 O -3.985 -10.244 7.219 1.00 . A A . 52 ASP OD1 1 1 6 5515 1 1 52 ASP OD2 O -5.641 -11.315 6.349 1.00 . A A . 52 ASP OD2 1 1 6 5516 1 1 53 THR C C -0.656 -9.822 1.721 1.00 . A A . 53 THR C 1 1 6 5517 1 1 53 THR CA C -2.174 -9.997 1.612 1.00 . A A . 53 THR CA 1 1 6 5518 1 1 53 THR CB C -2.649 -9.513 0.241 1.00 . A A . 53 THR CB 1 1 6 5519 1 1 53 THR CG2 C -4.025 -10.109 -0.064 1.00 . A A . 53 THR CG2 1 1 6 5520 1 1 53 THR H H -3.348 -8.395 2.455 1.00 . A A . 53 THR H 1 1 6 5521 1 1 53 THR HA H -2.422 -11.042 1.726 1.00 . A A . 53 THR HA 1 1 6 5522 1 1 53 THR HB H -1.949 -9.832 -0.516 1.00 . A A . 53 THR HB 1 1 6 5523 1 1 53 THR HG1 H -2.106 -7.761 0.890 1.00 . A A . 53 THR HG1 1 1 6 5524 1 1 53 THR HG21 H -4.010 -11.171 0.132 1.00 . A A . 53 THR HG21 1 1 6 5525 1 1 53 THR HG22 H -4.768 -9.637 0.562 1.00 . A A . 53 THR HG22 1 1 6 5526 1 1 53 THR HG23 H -4.269 -9.939 -1.102 1.00 . A A . 53 THR HG23 1 1 6 5527 1 1 53 THR N N -2.856 -9.211 2.682 1.00 . A A . 53 THR N 1 1 6 5528 1 1 53 THR O O 0.102 -10.724 1.421 1.00 . A A . 53 THR O 1 1 6 5529 1 1 53 THR OG1 O -2.733 -8.094 0.243 1.00 . A A . 53 THR OG1 1 1 6 5530 1 1 54 CYS C C 1.850 -9.373 3.329 1.00 . A A . 54 CYS C 1 1 6 5531 1 1 54 CYS CA C 1.269 -8.452 2.254 1.00 . A A . 54 CYS CA 1 1 6 5532 1 1 54 CYS CB C 1.544 -6.997 2.642 1.00 . A A . 54 CYS CB 1 1 6 5533 1 1 54 CYS H H -0.826 -7.954 2.373 1.00 . A A . 54 CYS H 1 1 6 5534 1 1 54 CYS HA H 1.739 -8.665 1.306 1.00 . A A . 54 CYS HA 1 1 6 5535 1 1 54 CYS HB2 H 0.910 -6.341 2.064 1.00 . A A . 54 CYS HB2 1 1 6 5536 1 1 54 CYS HB3 H 1.342 -6.859 3.693 1.00 . A A . 54 CYS HB3 1 1 6 5537 1 1 54 CYS N N -0.202 -8.672 2.139 1.00 . A A . 54 CYS N 1 1 6 5538 1 1 54 CYS O O 1.205 -9.664 4.316 1.00 . A A . 54 CYS O 1 1 6 5539 1 1 54 CYS SG S 3.278 -6.486 2.353 1.00 . A A . 54 CYS SG 1 1 6 5540 1 1 55 PRO C C 4.303 -9.869 5.233 1.00 . A A . 55 PRO C 1 1 6 5541 1 1 55 PRO CA C 3.755 -10.686 4.060 1.00 . A A . 55 PRO CA 1 1 6 5542 1 1 55 PRO CB C 4.886 -11.298 3.234 1.00 . A A . 55 PRO CB 1 1 6 5543 1 1 55 PRO CD C 3.896 -9.485 1.931 1.00 . A A . 55 PRO CD 1 1 6 5544 1 1 55 PRO CG C 5.147 -10.317 2.127 1.00 . A A . 55 PRO CG 1 1 6 5545 1 1 55 PRO HA H 3.089 -11.460 4.409 1.00 . A A . 55 PRO HA 1 1 6 5546 1 1 55 PRO HB2 H 5.752 -11.438 3.870 1.00 . A A . 55 PRO HB2 1 1 6 5547 1 1 55 PRO HB3 H 4.570 -12.253 2.848 1.00 . A A . 55 PRO HB3 1 1 6 5548 1 1 55 PRO HD2 H 4.147 -8.433 1.907 1.00 . A A . 55 PRO HD2 1 1 6 5549 1 1 55 PRO HD3 H 3.390 -9.773 1.023 1.00 . A A . 55 PRO HD3 1 1 6 5550 1 1 55 PRO HG2 H 5.978 -9.681 2.396 1.00 . A A . 55 PRO HG2 1 1 6 5551 1 1 55 PRO HG3 H 5.373 -10.852 1.217 1.00 . A A . 55 PRO HG3 1 1 6 5552 1 1 55 PRO N N 3.064 -9.795 3.097 1.00 . A A . 55 PRO N 1 1 6 5553 1 1 55 PRO O O 3.818 -9.958 6.343 1.00 . A A . 55 PRO O 1 1 6 5554 1 1 56 VAL C C 4.915 -7.074 6.380 1.00 . A A . 56 VAL C 1 1 6 5555 1 1 56 VAL CA C 5.871 -8.234 6.094 1.00 . A A . 56 VAL CA 1 1 6 5556 1 1 56 VAL CB C 7.235 -7.685 5.672 1.00 . A A . 56 VAL CB 1 1 6 5557 1 1 56 VAL CG1 C 7.053 -6.671 4.542 1.00 . A A . 56 VAL CG1 1 1 6 5558 1 1 56 VAL CG2 C 7.899 -7.000 6.868 1.00 . A A . 56 VAL CG2 1 1 6 5559 1 1 56 VAL H H 5.676 -8.999 4.091 1.00 . A A . 56 VAL H 1 1 6 5560 1 1 56 VAL HA H 5.982 -8.838 6.982 1.00 . A A . 56 VAL HA 1 1 6 5561 1 1 56 VAL HB H 7.859 -8.498 5.329 1.00 . A A . 56 VAL HB 1 1 6 5562 1 1 56 VAL HG11 H 6.174 -6.925 3.968 1.00 . A A . 56 VAL HG11 1 1 6 5563 1 1 56 VAL HG12 H 6.935 -5.682 4.961 1.00 . A A . 56 VAL HG12 1 1 6 5564 1 1 56 VAL HG13 H 7.921 -6.688 3.900 1.00 . A A . 56 VAL HG13 1 1 6 5565 1 1 56 VAL HG21 H 7.626 -7.517 7.777 1.00 . A A . 56 VAL HG21 1 1 6 5566 1 1 56 VAL HG22 H 8.972 -7.026 6.748 1.00 . A A . 56 VAL HG22 1 1 6 5567 1 1 56 VAL HG23 H 7.567 -5.974 6.925 1.00 . A A . 56 VAL HG23 1 1 6 5568 1 1 56 VAL N N 5.304 -9.063 4.994 1.00 . A A . 56 VAL N 1 1 6 5569 1 1 56 VAL O O 4.987 -6.432 7.409 1.00 . A A . 56 VAL O 1 1 6 5570 1 1 57 GLN C C 3.789 -4.361 5.745 1.00 . A A . 57 GLN C 1 1 6 5571 1 1 57 GLN CA C 3.045 -5.696 5.679 1.00 . A A . 57 GLN CA 1 1 6 5572 1 1 57 GLN CB C 2.283 -5.922 6.986 1.00 . A A . 57 GLN CB 1 1 6 5573 1 1 57 GLN CD C -0.108 -5.481 7.565 1.00 . A A . 57 GLN CD 1 1 6 5574 1 1 57 GLN CG C 0.833 -6.291 6.669 1.00 . A A . 57 GLN CG 1 1 6 5575 1 1 57 GLN H H 3.977 -7.341 4.651 1.00 . A A . 57 GLN H 1 1 6 5576 1 1 57 GLN HA H 2.345 -5.675 4.856 1.00 . A A . 57 GLN HA 1 1 6 5577 1 1 57 GLN HB2 H 2.748 -6.726 7.539 1.00 . A A . 57 GLN HB2 1 1 6 5578 1 1 57 GLN HB3 H 2.302 -5.019 7.577 1.00 . A A . 57 GLN HB3 1 1 6 5579 1 1 57 GLN HE21 H -1.055 -7.084 8.260 1.00 . A A . 57 GLN HE21 1 1 6 5580 1 1 57 GLN HE22 H -1.603 -5.595 8.867 1.00 . A A . 57 GLN HE22 1 1 6 5581 1 1 57 GLN HG2 H 0.624 -6.068 5.633 1.00 . A A . 57 GLN HG2 1 1 6 5582 1 1 57 GLN HG3 H 0.680 -7.345 6.849 1.00 . A A . 57 GLN HG3 1 1 6 5583 1 1 57 GLN N N 4.016 -6.806 5.471 1.00 . A A . 57 GLN N 1 1 6 5584 1 1 57 GLN NE2 N -0.995 -6.106 8.291 1.00 . A A . 57 GLN NE2 1 1 6 5585 1 1 57 GLN O O 3.558 -3.553 6.623 1.00 . A A . 57 GLN O 1 1 6 5586 1 1 57 GLN OE1 O -0.035 -4.271 7.604 1.00 . A A . 57 GLN OE1 1 1 6 5587 1 1 58 CYS C C 4.440 -1.671 4.992 1.00 . A A . 58 CYS C 1 1 6 5588 1 1 58 CYS CA C 5.428 -2.831 4.822 1.00 . A A . 58 CYS CA 1 1 6 5589 1 1 58 CYS CB C 6.171 -2.673 3.493 1.00 . A A . 58 CYS CB 1 1 6 5590 1 1 58 CYS H H 4.843 -4.781 4.115 1.00 . A A . 58 CYS H 1 1 6 5591 1 1 58 CYS HA H 6.140 -2.827 5.635 1.00 . A A . 58 CYS HA 1 1 6 5592 1 1 58 CYS HB2 H 6.602 -1.684 3.437 1.00 . A A . 58 CYS HB2 1 1 6 5593 1 1 58 CYS HB3 H 6.955 -3.412 3.428 1.00 . A A . 58 CYS HB3 1 1 6 5594 1 1 58 CYS HG H 4.150 -3.110 2.495 1.00 . A A . 58 CYS HG 1 1 6 5595 1 1 58 CYS N N 4.677 -4.118 4.817 1.00 . A A . 58 CYS N 1 1 6 5596 1 1 58 CYS O O 4.797 -0.598 5.438 1.00 . A A . 58 CYS O 1 1 6 5597 1 1 58 CYS SG S 5.010 -2.902 2.123 1.00 . A A . 58 CYS SG 1 1 6 5598 1 1 59 ILE C C 1.891 -0.532 6.240 1.00 . A A . 59 ILE C 1 1 6 5599 1 1 59 ILE CA C 2.183 -0.804 4.763 1.00 . A A . 59 ILE CA 1 1 6 5600 1 1 59 ILE CB C 0.897 -1.245 4.063 1.00 . A A . 59 ILE CB 1 1 6 5601 1 1 59 ILE CD1 C -1.144 -0.234 3.038 1.00 . A A . 59 ILE CD1 1 1 6 5602 1 1 59 ILE CG1 C -0.167 -0.157 4.212 1.00 . A A . 59 ILE CG1 1 1 6 5603 1 1 59 ILE CG2 C 0.393 -2.541 4.699 1.00 . A A . 59 ILE CG2 1 1 6 5604 1 1 59 ILE H H 2.942 -2.757 4.274 1.00 . A A . 59 ILE H 1 1 6 5605 1 1 59 ILE HA H 2.552 0.097 4.298 1.00 . A A . 59 ILE HA 1 1 6 5606 1 1 59 ILE HB H 1.098 -1.415 3.014 1.00 . A A . 59 ILE HB 1 1 6 5607 1 1 59 ILE HD11 H -1.027 -1.183 2.534 1.00 . A A . 59 ILE HD11 1 1 6 5608 1 1 59 ILE HD12 H -2.156 -0.144 3.404 1.00 . A A . 59 ILE HD12 1 1 6 5609 1 1 59 ILE HD13 H -0.939 0.569 2.345 1.00 . A A . 59 ILE HD13 1 1 6 5610 1 1 59 ILE HG12 H -0.703 -0.303 5.138 1.00 . A A . 59 ILE HG12 1 1 6 5611 1 1 59 ILE HG13 H 0.307 0.813 4.219 1.00 . A A . 59 ILE HG13 1 1 6 5612 1 1 59 ILE HG21 H 1.236 -3.153 4.986 1.00 . A A . 59 ILE HG21 1 1 6 5613 1 1 59 ILE HG22 H -0.196 -2.307 5.573 1.00 . A A . 59 ILE HG22 1 1 6 5614 1 1 59 ILE HG23 H -0.216 -3.078 3.988 1.00 . A A . 59 ILE HG23 1 1 6 5615 1 1 59 ILE N N 3.203 -1.885 4.634 1.00 . A A . 59 ILE N 1 1 6 5616 1 1 59 ILE O O 2.134 -1.358 7.097 1.00 . A A . 59 ILE O 1 1 6 5617 1 1 60 HIS C C -0.156 1.918 7.975 1.00 . A A . 60 HIS C 1 1 6 5618 1 1 60 HIS CA C 1.047 0.966 7.952 1.00 . A A . 60 HIS CA 1 1 6 5619 1 1 60 HIS CB C 2.263 1.634 8.598 1.00 . A A . 60 HIS CB 1 1 6 5620 1 1 60 HIS CD2 C 3.683 -0.488 9.223 1.00 . A A . 60 HIS CD2 1 1 6 5621 1 1 60 HIS CE1 C 5.402 -0.098 7.962 1.00 . A A . 60 HIS CE1 1 1 6 5622 1 1 60 HIS CG C 3.433 0.690 8.562 1.00 . A A . 60 HIS CG 1 1 6 5623 1 1 60 HIS H H 1.176 1.272 5.826 1.00 . A A . 60 HIS H 1 1 6 5624 1 1 60 HIS HA H 0.801 0.063 8.493 1.00 . A A . 60 HIS HA 1 1 6 5625 1 1 60 HIS HB2 H 2.510 2.535 8.054 1.00 . A A . 60 HIS HB2 1 1 6 5626 1 1 60 HIS HB3 H 2.034 1.885 9.624 1.00 . A A . 60 HIS HB3 1 1 6 5627 1 1 60 HIS HD1 H 4.677 1.680 7.163 1.00 . A A . 60 HIS HD1 1 1 6 5628 1 1 60 HIS HD2 H 3.015 -0.958 9.930 1.00 . A A . 60 HIS HD2 1 1 6 5629 1 1 60 HIS HE1 H 6.360 -0.186 7.471 1.00 . A A . 60 HIS HE1 1 1 6 5630 1 1 60 HIS N N 1.365 0.625 6.538 1.00 . A A . 60 HIS N 1 1 6 5631 1 1 60 HIS ND1 N 4.543 0.919 7.764 1.00 . A A . 60 HIS ND1 1 1 6 5632 1 1 60 HIS NE2 N 4.927 -0.983 8.844 1.00 . A A . 60 HIS NE2 1 1 6 5633 1 1 60 HIS O O -1.137 1.697 7.294 1.00 . A A . 60 HIS O 1 1 6 5634 1 1 61 TRP C C -0.761 5.329 9.125 1.00 . A A . 61 TRP C 1 1 6 5635 1 1 61 TRP CA C -1.250 3.920 8.786 1.00 . A A . 61 TRP CA 1 1 6 5636 1 1 61 TRP CB C -2.249 3.464 9.848 1.00 . A A . 61 TRP CB 1 1 6 5637 1 1 61 TRP CD1 C -2.176 0.938 9.688 1.00 . A A . 61 TRP CD1 1 1 6 5638 1 1 61 TRP CD2 C -4.063 1.826 8.867 1.00 . A A . 61 TRP CD2 1 1 6 5639 1 1 61 TRP CE2 C -4.181 0.429 8.707 1.00 . A A . 61 TRP CE2 1 1 6 5640 1 1 61 TRP CE3 C -5.112 2.639 8.435 1.00 . A A . 61 TRP CE3 1 1 6 5641 1 1 61 TRP CG C -2.793 2.124 9.487 1.00 . A A . 61 TRP CG 1 1 6 5642 1 1 61 TRP CH2 C -6.360 0.681 7.704 1.00 . A A . 61 TRP CH2 1 1 6 5643 1 1 61 TRP CZ2 C -5.315 -0.145 8.132 1.00 . A A . 61 TRP CZ2 1 1 6 5644 1 1 61 TRP CZ3 C -6.259 2.072 7.854 1.00 . A A . 61 TRP CZ3 1 1 6 5645 1 1 61 TRP H H 0.695 3.149 9.291 1.00 . A A . 61 TRP H 1 1 6 5646 1 1 61 TRP HA H -1.737 3.934 7.822 1.00 . A A . 61 TRP HA 1 1 6 5647 1 1 61 TRP HB2 H -1.764 3.409 10.803 1.00 . A A . 61 TRP HB2 1 1 6 5648 1 1 61 TRP HB3 H -3.061 4.175 9.902 1.00 . A A . 61 TRP HB3 1 1 6 5649 1 1 61 TRP HD1 H -1.203 0.800 10.135 1.00 . A A . 61 TRP HD1 1 1 6 5650 1 1 61 TRP HE1 H -2.794 -1.032 9.249 1.00 . A A . 61 TRP HE1 1 1 6 5651 1 1 61 TRP HE3 H -5.031 3.710 8.551 1.00 . A A . 61 TRP HE3 1 1 6 5652 1 1 61 TRP HH2 H -7.243 0.248 7.258 1.00 . A A . 61 TRP HH2 1 1 6 5653 1 1 61 TRP HZ2 H -5.386 -1.216 8.020 1.00 . A A . 61 TRP HZ2 1 1 6 5654 1 1 61 TRP HZ3 H -7.065 2.709 7.524 1.00 . A A . 61 TRP HZ3 1 1 6 5655 1 1 61 TRP N N -0.098 2.975 8.745 1.00 . A A . 61 TRP N 1 1 6 5656 1 1 61 TRP NE1 N -3.001 -0.074 9.224 1.00 . A A . 61 TRP NE1 1 1 6 5657 1 1 61 TRP O O 0.373 5.531 9.513 1.00 . A A . 61 TRP O 1 1 6 5658 1 1 62 GLU C C -2.426 8.480 9.808 1.00 . A A . 62 GLU C 1 1 6 5659 1 1 62 GLU CA C -1.213 7.707 9.284 1.00 . A A . 62 GLU CA 1 1 6 5660 1 1 62 GLU CB C -0.692 8.375 8.007 1.00 . A A . 62 GLU CB 1 1 6 5661 1 1 62 GLU CD C 0.703 10.415 7.625 1.00 . A A . 62 GLU CD 1 1 6 5662 1 1 62 GLU CG C -0.607 9.889 8.216 1.00 . A A . 62 GLU CG 1 1 6 5663 1 1 62 GLU H H -2.522 6.117 8.661 1.00 . A A . 62 GLU H 1 1 6 5664 1 1 62 GLU HA H -0.434 7.703 10.032 1.00 . A A . 62 GLU HA 1 1 6 5665 1 1 62 GLU HB2 H 0.289 7.987 7.774 1.00 . A A . 62 GLU HB2 1 1 6 5666 1 1 62 GLU HB3 H -1.367 8.163 7.189 1.00 . A A . 62 GLU HB3 1 1 6 5667 1 1 62 GLU HG2 H -1.442 10.368 7.724 1.00 . A A . 62 GLU HG2 1 1 6 5668 1 1 62 GLU HG3 H -0.637 10.109 9.272 1.00 . A A . 62 GLU HG3 1 1 6 5669 1 1 62 GLU N N -1.614 6.306 8.977 1.00 . A A . 62 GLU N 1 1 6 5670 1 1 62 GLU O O -3.385 8.704 9.096 1.00 . A A . 62 GLU O 1 1 6 5671 1 1 62 GLU OE1 O 1.461 9.611 7.109 1.00 . A A . 62 GLU OE1 1 1 6 5672 1 1 62 GLU OE2 O 0.924 11.612 7.698 1.00 . A A . 62 GLU OE2 1 1 6 5673 1 1 63 ASP C C -3.020 10.820 12.448 1.00 . A A . 63 ASP C 1 1 6 5674 1 1 63 ASP CA C -3.543 9.653 11.608 1.00 . A A . 63 ASP CA 1 1 6 5675 1 1 63 ASP CB C -4.386 8.729 12.488 1.00 . A A . 63 ASP CB 1 1 6 5676 1 1 63 ASP CG C -5.573 8.199 11.682 1.00 . A A . 63 ASP CG 1 1 6 5677 1 1 63 ASP H H -1.608 8.705 11.604 1.00 . A A . 63 ASP H 1 1 6 5678 1 1 63 ASP HA H -4.150 10.034 10.801 1.00 . A A . 63 ASP HA 1 1 6 5679 1 1 63 ASP HB2 H -3.780 7.901 12.826 1.00 . A A . 63 ASP HB2 1 1 6 5680 1 1 63 ASP HB3 H -4.751 9.279 13.343 1.00 . A A . 63 ASP HB3 1 1 6 5681 1 1 63 ASP N N -2.391 8.893 11.045 1.00 . A A . 63 ASP N 1 1 6 5682 1 1 63 ASP O O -3.194 11.973 12.105 1.00 . A A . 63 ASP O 1 1 6 5683 1 1 63 ASP OD1 O -6.413 9.001 11.306 1.00 . A A . 63 ASP OD1 1 1 6 5684 1 1 63 ASP OD2 O -5.622 7.003 11.453 1.00 . A A . 63 ASP OD2 1 1 6 5685 1 1 64 GLU C C -0.321 11.548 14.438 1.00 . A A . 64 GLU C 1 1 6 5686 1 1 64 GLU CA C -1.849 11.622 14.410 1.00 . A A . 64 GLU CA 1 1 6 5687 1 1 64 GLU CB C -2.394 11.461 15.831 1.00 . A A . 64 GLU CB 1 1 6 5688 1 1 64 GLU CD C -3.505 13.671 16.194 1.00 . A A . 64 GLU CD 1 1 6 5689 1 1 64 GLU CG C -2.304 12.800 16.567 1.00 . A A . 64 GLU CG 1 1 6 5690 1 1 64 GLU H H -2.253 9.594 13.808 1.00 . A A . 64 GLU H 1 1 6 5691 1 1 64 GLU HA H -2.156 12.578 14.012 1.00 . A A . 64 GLU HA 1 1 6 5692 1 1 64 GLU HB2 H -3.426 11.143 15.786 1.00 . A A . 64 GLU HB2 1 1 6 5693 1 1 64 GLU HB3 H -1.811 10.722 16.359 1.00 . A A . 64 GLU HB3 1 1 6 5694 1 1 64 GLU HG2 H -2.303 12.624 17.633 1.00 . A A . 64 GLU HG2 1 1 6 5695 1 1 64 GLU HG3 H -1.393 13.305 16.284 1.00 . A A . 64 GLU HG3 1 1 6 5696 1 1 64 GLU N N -2.382 10.530 13.549 1.00 . A A . 64 GLU N 1 1 6 5697 1 1 64 GLU OE1 O -4.606 13.329 16.589 1.00 . A A . 64 GLU OE1 1 1 6 5698 1 1 64 GLU OE2 O -3.302 14.667 15.518 1.00 . A A . 64 GLU OE2 1 1 6 5699 2 2 1 SF4 FE1 FE 5.004 -5.024 -1.938 1.00 . B A . 65 SF4 FE1 1 1 6 5700 2 2 1 SF4 FE2 FE 3.377 -6.084 0.218 1.00 . B A . 65 SF4 FE2 1 1 6 5701 2 2 1 SF4 FE3 FE 2.422 -4.624 -2.007 1.00 . B A . 65 SF4 FE3 1 1 6 5702 2 2 1 SF4 FE4 FE 3.588 -7.335 -2.389 1.00 . B A . 65 SF4 FE4 1 1 6 5703 2 2 1 SF4 S1 S 1.601 -6.706 -0.950 1.00 . B A . 65 SF4 S1 1 1 6 5704 2 2 1 SF4 S2 S 3.859 -5.195 -3.582 1.00 . B A . 65 SF4 S2 1 1 6 5705 2 2 1 SF4 S3 S 5.224 -7.241 -0.896 1.00 . B A . 65 SF4 S3 1 1 6 5706 2 2 1 SF4 S4 S 3.841 -3.744 -0.561 1.00 . B A . 65 SF4 S4 1 1 7 5707 1 1 1 ALA C C -9.661 9.231 9.008 1.00 . A A . 1 ALA C 1 1 7 5708 1 1 1 ALA CA C -10.058 10.673 9.333 1.00 . A A . 1 ALA CA 1 1 7 5709 1 1 1 ALA CB C -8.847 11.590 9.151 1.00 . A A . 1 ALA CB 1 1 7 5710 1 1 1 ALA HA H -10.849 10.986 8.667 1.00 . A A . 1 ALA HA 1 1 7 5711 1 1 1 ALA HB1 H -8.086 11.327 9.871 1.00 . A A . 1 ALA HB1 1 1 7 5712 1 1 1 ALA HB2 H -8.452 11.474 8.152 1.00 . A A . 1 ALA HB2 1 1 7 5713 1 1 1 ALA HB3 H -9.147 12.617 9.302 1.00 . A A . 1 ALA HB3 1 1 7 5714 1 1 1 ALA N N -10.534 10.752 10.742 1.00 . A A . 1 ALA N 1 1 7 5715 1 1 1 ALA O O -10.115 8.655 8.039 1.00 . A A . 1 ALA O 1 1 7 5716 1 1 2 ARG C C -7.744 7.154 8.164 1.00 . A A . 2 ARG C 1 1 7 5717 1 1 2 ARG CA C -8.395 7.236 9.545 1.00 . A A . 2 ARG CA 1 1 7 5718 1 1 2 ARG CB C -9.621 6.322 9.586 1.00 . A A . 2 ARG CB 1 1 7 5719 1 1 2 ARG CD C -9.659 6.438 12.081 1.00 . A A . 2 ARG CD 1 1 7 5720 1 1 2 ARG CG C -10.475 6.668 10.808 1.00 . A A . 2 ARG CG 1 1 7 5721 1 1 2 ARG CZ C -10.774 4.351 12.596 1.00 . A A . 2 ARG CZ 1 1 7 5722 1 1 2 ARG H H -8.461 9.121 10.587 1.00 . A A . 2 ARG H 1 1 7 5723 1 1 2 ARG HA H -7.687 6.924 10.297 1.00 . A A . 2 ARG HA 1 1 7 5724 1 1 2 ARG HB2 H -10.204 6.461 8.687 1.00 . A A . 2 ARG HB2 1 1 7 5725 1 1 2 ARG HB3 H -9.301 5.293 9.652 1.00 . A A . 2 ARG HB3 1 1 7 5726 1 1 2 ARG HD2 H -8.645 6.778 11.924 1.00 . A A . 2 ARG HD2 1 1 7 5727 1 1 2 ARG HD3 H -10.102 6.988 12.897 1.00 . A A . 2 ARG HD3 1 1 7 5728 1 1 2 ARG HE H -8.798 4.505 12.486 1.00 . A A . 2 ARG HE 1 1 7 5729 1 1 2 ARG HG2 H -10.776 7.705 10.753 1.00 . A A . 2 ARG HG2 1 1 7 5730 1 1 2 ARG HG3 H -11.352 6.038 10.825 1.00 . A A . 2 ARG HG3 1 1 7 5731 1 1 2 ARG HH11 H -11.175 5.264 14.332 1.00 . A A . 2 ARG HH11 1 1 7 5732 1 1 2 ARG HH12 H -12.352 4.108 13.804 1.00 . A A . 2 ARG HH12 1 1 7 5733 1 1 2 ARG HH21 H -10.636 3.291 10.903 1.00 . A A . 2 ARG HH21 1 1 7 5734 1 1 2 ARG HH22 H -12.046 2.990 11.863 1.00 . A A . 2 ARG HH22 1 1 7 5735 1 1 2 ARG N N -8.817 8.641 9.811 1.00 . A A . 2 ARG N 1 1 7 5736 1 1 2 ARG NE N -9.649 4.984 12.409 1.00 . A A . 2 ARG NE 1 1 7 5737 1 1 2 ARG NH1 N -11.489 4.593 13.660 1.00 . A A . 2 ARG NH1 1 1 7 5738 1 1 2 ARG NH2 N -11.184 3.476 11.719 1.00 . A A . 2 ARG NH2 1 1 7 5739 1 1 2 ARG O O -8.404 6.938 7.167 1.00 . A A . 2 ARG O 1 1 7 5740 1 1 3 LYS C C -4.899 5.995 6.710 1.00 . A A . 3 LYS C 1 1 7 5741 1 1 3 LYS CA C -5.763 7.260 6.775 1.00 . A A . 3 LYS CA 1 1 7 5742 1 1 3 LYS CB C -4.886 8.503 6.600 1.00 . A A . 3 LYS CB 1 1 7 5743 1 1 3 LYS CD C -5.428 10.210 4.857 1.00 . A A . 3 LYS CD 1 1 7 5744 1 1 3 LYS CE C -4.377 11.315 4.986 1.00 . A A . 3 LYS CE 1 1 7 5745 1 1 3 LYS CG C -4.777 8.850 5.114 1.00 . A A . 3 LYS CG 1 1 7 5746 1 1 3 LYS H H -5.937 7.502 8.908 1.00 . A A . 3 LYS H 1 1 7 5747 1 1 3 LYS HA H -6.501 7.230 5.987 1.00 . A A . 3 LYS HA 1 1 7 5748 1 1 3 LYS HB2 H -5.330 9.333 7.132 1.00 . A A . 3 LYS HB2 1 1 7 5749 1 1 3 LYS HB3 H -3.903 8.309 6.995 1.00 . A A . 3 LYS HB3 1 1 7 5750 1 1 3 LYS HD2 H -5.845 10.226 3.860 1.00 . A A . 3 LYS HD2 1 1 7 5751 1 1 3 LYS HD3 H -6.212 10.377 5.579 1.00 . A A . 3 LYS HD3 1 1 7 5752 1 1 3 LYS HE2 H -3.390 10.877 4.959 1.00 . A A . 3 LYS HE2 1 1 7 5753 1 1 3 LYS HE3 H -4.484 12.011 4.168 1.00 . A A . 3 LYS HE3 1 1 7 5754 1 1 3 LYS HG2 H -3.734 8.888 4.829 1.00 . A A . 3 LYS HG2 1 1 7 5755 1 1 3 LYS HG3 H -5.282 8.096 4.530 1.00 . A A . 3 LYS HG3 1 1 7 5756 1 1 3 LYS HZ1 H -5.580 12.055 6.517 1.00 . A A . 3 LYS HZ1 1 1 7 5757 1 1 3 LYS HZ2 H -4.044 11.538 7.028 1.00 . A A . 3 LYS HZ2 1 1 7 5758 1 1 3 LYS HZ3 H -4.214 13.006 6.189 1.00 . A A . 3 LYS HZ3 1 1 7 5759 1 1 3 LYS N N -6.453 7.327 8.094 1.00 . A A . 3 LYS N 1 1 7 5760 1 1 3 LYS NZ N -4.568 12.033 6.277 1.00 . A A . 3 LYS NZ 1 1 7 5761 1 1 3 LYS O O -5.124 5.044 7.428 1.00 . A A . 3 LYS O 1 1 7 5762 1 1 4 PHE C C -2.005 5.037 4.643 1.00 . A A . 4 PHE C 1 1 7 5763 1 1 4 PHE CA C -3.046 4.777 5.735 1.00 . A A . 4 PHE CA 1 1 7 5764 1 1 4 PHE CB C -3.900 3.558 5.368 1.00 . A A . 4 PHE CB 1 1 7 5765 1 1 4 PHE CD1 C -4.232 3.764 2.879 1.00 . A A . 4 PHE CD1 1 1 7 5766 1 1 4 PHE CD2 C -6.094 4.261 4.352 1.00 . A A . 4 PHE CD2 1 1 7 5767 1 1 4 PHE CE1 C -5.038 4.045 1.769 1.00 . A A . 4 PHE CE1 1 1 7 5768 1 1 4 PHE CE2 C -6.898 4.542 3.243 1.00 . A A . 4 PHE CE2 1 1 7 5769 1 1 4 PHE CG C -4.762 3.872 4.170 1.00 . A A . 4 PHE CG 1 1 7 5770 1 1 4 PHE CZ C -6.370 4.434 1.951 1.00 . A A . 4 PHE CZ 1 1 7 5771 1 1 4 PHE H H -3.748 6.751 5.283 1.00 . A A . 4 PHE H 1 1 7 5772 1 1 4 PHE HA H -2.546 4.599 6.676 1.00 . A A . 4 PHE HA 1 1 7 5773 1 1 4 PHE HB2 H -3.257 2.722 5.141 1.00 . A A . 4 PHE HB2 1 1 7 5774 1 1 4 PHE HB3 H -4.534 3.302 6.205 1.00 . A A . 4 PHE HB3 1 1 7 5775 1 1 4 PHE HD1 H -3.205 3.463 2.739 1.00 . A A . 4 PHE HD1 1 1 7 5776 1 1 4 PHE HD2 H -6.501 4.344 5.349 1.00 . A A . 4 PHE HD2 1 1 7 5777 1 1 4 PHE HE1 H -4.631 3.963 0.772 1.00 . A A . 4 PHE HE1 1 1 7 5778 1 1 4 PHE HE2 H -7.925 4.842 3.383 1.00 . A A . 4 PHE HE2 1 1 7 5779 1 1 4 PHE HZ H -6.991 4.651 1.094 1.00 . A A . 4 PHE HZ 1 1 7 5780 1 1 4 PHE N N -3.916 5.977 5.853 1.00 . A A . 4 PHE N 1 1 7 5781 1 1 4 PHE O O -2.052 6.038 3.959 1.00 . A A . 4 PHE O 1 1 7 5782 1 1 5 TYR C C 0.930 3.175 3.526 1.00 . A A . 5 TYR C 1 1 7 5783 1 1 5 TYR CA C -0.026 4.347 3.439 1.00 . A A . 5 TYR CA 1 1 7 5784 1 1 5 TYR CB C 0.736 5.651 3.693 1.00 . A A . 5 TYR CB 1 1 7 5785 1 1 5 TYR CD1 C 0.742 5.529 6.214 1.00 . A A . 5 TYR CD1 1 1 7 5786 1 1 5 TYR CD2 C 2.865 5.540 5.041 1.00 . A A . 5 TYR CD2 1 1 7 5787 1 1 5 TYR CE1 C 1.419 5.459 7.437 1.00 . A A . 5 TYR CE1 1 1 7 5788 1 1 5 TYR CE2 C 3.541 5.469 6.265 1.00 . A A . 5 TYR CE2 1 1 7 5789 1 1 5 TYR CG C 1.464 5.570 5.015 1.00 . A A . 5 TYR CG 1 1 7 5790 1 1 5 TYR CZ C 2.818 5.429 7.464 1.00 . A A . 5 TYR CZ 1 1 7 5791 1 1 5 TYR H H -1.040 3.345 5.039 1.00 . A A . 5 TYR H 1 1 7 5792 1 1 5 TYR HA H -0.486 4.373 2.463 1.00 . A A . 5 TYR HA 1 1 7 5793 1 1 5 TYR HB2 H 1.451 5.808 2.898 1.00 . A A . 5 TYR HB2 1 1 7 5794 1 1 5 TYR HB3 H 0.042 6.474 3.717 1.00 . A A . 5 TYR HB3 1 1 7 5795 1 1 5 TYR HD1 H -0.337 5.552 6.194 1.00 . A A . 5 TYR HD1 1 1 7 5796 1 1 5 TYR HD2 H 3.422 5.571 4.117 1.00 . A A . 5 TYR HD2 1 1 7 5797 1 1 5 TYR HE1 H 0.861 5.429 8.362 1.00 . A A . 5 TYR HE1 1 1 7 5798 1 1 5 TYR HE2 H 4.621 5.445 6.285 1.00 . A A . 5 TYR HE2 1 1 7 5799 1 1 5 TYR HH H 3.958 4.530 8.704 1.00 . A A . 5 TYR HH 1 1 7 5800 1 1 5 TYR N N -1.066 4.150 4.478 1.00 . A A . 5 TYR N 1 1 7 5801 1 1 5 TYR O O 0.602 2.149 4.090 1.00 . A A . 5 TYR O 1 1 7 5802 1 1 5 TYR OH O 3.484 5.363 8.670 1.00 . A A . 5 TYR OH 1 1 7 5803 1 1 6 VAL C C 4.439 2.548 3.369 1.00 . A A . 6 VAL C 1 1 7 5804 1 1 6 VAL CA C 3.015 2.128 3.082 1.00 . A A . 6 VAL CA 1 1 7 5805 1 1 6 VAL CB C 3.040 1.331 1.788 1.00 . A A . 6 VAL CB 1 1 7 5806 1 1 6 VAL CG1 C 3.082 -0.141 2.166 1.00 . A A . 6 VAL CG1 1 1 7 5807 1 1 6 VAL CG2 C 1.795 1.610 0.928 1.00 . A A . 6 VAL CG2 1 1 7 5808 1 1 6 VAL H H 2.369 4.109 2.520 1.00 . A A . 6 VAL H 1 1 7 5809 1 1 6 VAL HA H 2.674 1.481 3.877 1.00 . A A . 6 VAL HA 1 1 7 5810 1 1 6 VAL HB H 3.942 1.585 1.232 1.00 . A A . 6 VAL HB 1 1 7 5811 1 1 6 VAL HG11 H 3.219 -0.228 3.233 1.00 . A A . 6 VAL HG11 1 1 7 5812 1 1 6 VAL HG12 H 2.155 -0.608 1.881 1.00 . A A . 6 VAL HG12 1 1 7 5813 1 1 6 VAL HG13 H 3.903 -0.617 1.656 1.00 . A A . 6 VAL HG13 1 1 7 5814 1 1 6 VAL HG21 H 1.306 2.510 1.257 1.00 . A A . 6 VAL HG21 1 1 7 5815 1 1 6 VAL HG22 H 2.094 1.727 -0.101 1.00 . A A . 6 VAL HG22 1 1 7 5816 1 1 6 VAL HG23 H 1.111 0.779 1.008 1.00 . A A . 6 VAL HG23 1 1 7 5817 1 1 6 VAL N N 2.102 3.288 2.985 1.00 . A A . 6 VAL N 1 1 7 5818 1 1 6 VAL O O 4.762 3.710 3.515 1.00 . A A . 6 VAL O 1 1 7 5819 1 1 7 ASP C C 7.517 0.847 2.832 1.00 . A A . 7 ASP C 1 1 7 5820 1 1 7 ASP CA C 6.722 1.824 3.661 1.00 . A A . 7 ASP CA 1 1 7 5821 1 1 7 ASP CB C 7.050 1.631 5.136 1.00 . A A . 7 ASP CB 1 1 7 5822 1 1 7 ASP CG C 7.105 2.992 5.833 1.00 . A A . 7 ASP CG 1 1 7 5823 1 1 7 ASP H H 4.984 0.652 3.275 1.00 . A A . 7 ASP H 1 1 7 5824 1 1 7 ASP HA H 6.968 2.815 3.352 1.00 . A A . 7 ASP HA 1 1 7 5825 1 1 7 ASP HB2 H 6.286 1.025 5.586 1.00 . A A . 7 ASP HB2 1 1 7 5826 1 1 7 ASP HB3 H 8.004 1.137 5.234 1.00 . A A . 7 ASP HB3 1 1 7 5827 1 1 7 ASP N N 5.293 1.571 3.419 1.00 . A A . 7 ASP N 1 1 7 5828 1 1 7 ASP O O 7.765 -0.272 3.233 1.00 . A A . 7 ASP O 1 1 7 5829 1 1 7 ASP OD1 O 7.017 3.994 5.143 1.00 . A A . 7 ASP OD1 1 1 7 5830 1 1 7 ASP OD2 O 7.238 3.008 7.046 1.00 . A A . 7 ASP OD2 1 1 7 5831 1 1 8 GLN C C 10.062 0.036 1.389 1.00 . A A . 8 GLN C 1 1 7 5832 1 1 8 GLN CA C 8.701 0.366 0.781 1.00 . A A . 8 GLN CA 1 1 7 5833 1 1 8 GLN CB C 8.932 1.051 -0.551 1.00 . A A . 8 GLN CB 1 1 7 5834 1 1 8 GLN CD C 6.655 0.076 -1.000 1.00 . A A . 8 GLN CD 1 1 7 5835 1 1 8 GLN CG C 7.608 1.235 -1.304 1.00 . A A . 8 GLN CG 1 1 7 5836 1 1 8 GLN H H 7.674 2.163 1.384 1.00 . A A . 8 GLN H 1 1 7 5837 1 1 8 GLN HA H 8.155 -0.551 0.621 1.00 . A A . 8 GLN HA 1 1 7 5838 1 1 8 GLN HB2 H 9.389 2.016 -0.383 1.00 . A A . 8 GLN HB2 1 1 7 5839 1 1 8 GLN HB3 H 9.593 0.440 -1.127 1.00 . A A . 8 GLN HB3 1 1 7 5840 1 1 8 GLN HE21 H 5.405 1.206 0.049 1.00 . A A . 8 GLN HE21 1 1 7 5841 1 1 8 GLN HE22 H 4.962 -0.425 -0.093 1.00 . A A . 8 GLN HE22 1 1 7 5842 1 1 8 GLN HG2 H 7.150 2.164 -0.997 1.00 . A A . 8 GLN HG2 1 1 7 5843 1 1 8 GLN HG3 H 7.803 1.267 -2.365 1.00 . A A . 8 GLN HG3 1 1 7 5844 1 1 8 GLN N N 7.912 1.260 1.674 1.00 . A A . 8 GLN N 1 1 7 5845 1 1 8 GLN NE2 N 5.586 0.304 -0.286 1.00 . A A . 8 GLN NE2 1 1 7 5846 1 1 8 GLN O O 11.069 0.006 0.710 1.00 . A A . 8 GLN O 1 1 7 5847 1 1 8 GLN OE1 O 6.880 -1.039 -1.421 1.00 . A A . 8 GLN OE1 1 1 7 5848 1 1 9 ASP C C 11.498 -2.119 3.301 1.00 . A A . 9 ASP C 1 1 7 5849 1 1 9 ASP CA C 11.372 -0.601 3.308 1.00 . A A . 9 ASP CA 1 1 7 5850 1 1 9 ASP CB C 11.356 -0.126 4.758 1.00 . A A . 9 ASP CB 1 1 7 5851 1 1 9 ASP CG C 12.632 0.661 5.058 1.00 . A A . 9 ASP CG 1 1 7 5852 1 1 9 ASP H H 9.267 -0.227 3.155 1.00 . A A . 9 ASP H 1 1 7 5853 1 1 9 ASP HA H 12.202 -0.156 2.780 1.00 . A A . 9 ASP HA 1 1 7 5854 1 1 9 ASP HB2 H 10.493 0.504 4.922 1.00 . A A . 9 ASP HB2 1 1 7 5855 1 1 9 ASP HB3 H 11.304 -0.990 5.407 1.00 . A A . 9 ASP HB3 1 1 7 5856 1 1 9 ASP N N 10.092 -0.238 2.647 1.00 . A A . 9 ASP N 1 1 7 5857 1 1 9 ASP O O 12.560 -2.669 3.516 1.00 . A A . 9 ASP O 1 1 7 5858 1 1 9 ASP OD1 O 13.619 0.038 5.414 1.00 . A A . 9 ASP OD1 1 1 7 5859 1 1 9 ASP OD2 O 12.600 1.874 4.929 1.00 . A A . 9 ASP OD2 1 1 7 5860 1 1 10 GLU C C 9.852 -4.842 1.778 1.00 . A A . 10 GLU C 1 1 7 5861 1 1 10 GLU CA C 10.454 -4.285 3.075 1.00 . A A . 10 GLU CA 1 1 7 5862 1 1 10 GLU CB C 9.649 -4.806 4.267 1.00 . A A . 10 GLU CB 1 1 7 5863 1 1 10 GLU CD C 11.676 -4.917 5.728 1.00 . A A . 10 GLU CD 1 1 7 5864 1 1 10 GLU CG C 10.529 -5.726 5.116 1.00 . A A . 10 GLU CG 1 1 7 5865 1 1 10 GLU H H 9.560 -2.338 2.916 1.00 . A A . 10 GLU H 1 1 7 5866 1 1 10 GLU HA H 11.479 -4.606 3.171 1.00 . A A . 10 GLU HA 1 1 7 5867 1 1 10 GLU HB2 H 9.310 -3.973 4.867 1.00 . A A . 10 GLU HB2 1 1 7 5868 1 1 10 GLU HB3 H 8.796 -5.360 3.908 1.00 . A A . 10 GLU HB3 1 1 7 5869 1 1 10 GLU HG2 H 9.935 -6.164 5.904 1.00 . A A . 10 GLU HG2 1 1 7 5870 1 1 10 GLU HG3 H 10.937 -6.509 4.493 1.00 . A A . 10 GLU HG3 1 1 7 5871 1 1 10 GLU N N 10.409 -2.803 3.073 1.00 . A A . 10 GLU N 1 1 7 5872 1 1 10 GLU O O 9.805 -6.039 1.579 1.00 . A A . 10 GLU O 1 1 7 5873 1 1 10 GLU OE1 O 11.460 -4.314 6.767 1.00 . A A . 10 GLU OE1 1 1 7 5874 1 1 10 GLU OE2 O 12.749 -4.916 5.149 1.00 . A A . 10 GLU OE2 1 1 7 5875 1 1 11 CYS C C 9.844 -5.239 -1.191 1.00 . A A . 11 CYS C 1 1 7 5876 1 1 11 CYS CA C 8.777 -4.517 -0.371 1.00 . A A . 11 CYS CA 1 1 7 5877 1 1 11 CYS CB C 8.182 -3.368 -1.195 1.00 . A A . 11 CYS CB 1 1 7 5878 1 1 11 CYS H H 9.413 -3.032 1.066 1.00 . A A . 11 CYS H 1 1 7 5879 1 1 11 CYS HA H 7.993 -5.218 -0.123 1.00 . A A . 11 CYS HA 1 1 7 5880 1 1 11 CYS HB2 H 7.413 -2.876 -0.620 1.00 . A A . 11 CYS HB2 1 1 7 5881 1 1 11 CYS HB3 H 8.957 -2.658 -1.451 1.00 . A A . 11 CYS HB3 1 1 7 5882 1 1 11 CYS N N 9.380 -3.997 0.895 1.00 . A A . 11 CYS N 1 1 7 5883 1 1 11 CYS O O 10.835 -4.661 -1.592 1.00 . A A . 11 CYS O 1 1 7 5884 1 1 11 CYS SG S 7.431 -3.904 -2.778 1.00 . A A . 11 CYS SG 1 1 7 5885 1 1 12 ILE C C 10.387 -7.050 -3.728 1.00 . A A . 12 ILE C 1 1 7 5886 1 1 12 ILE CA C 10.644 -7.270 -2.236 1.00 . A A . 12 ILE CA 1 1 7 5887 1 1 12 ILE CB C 10.521 -8.759 -1.906 1.00 . A A . 12 ILE CB 1 1 7 5888 1 1 12 ILE CD1 C 9.066 -10.779 -2.111 1.00 . A A . 12 ILE CD1 1 1 7 5889 1 1 12 ILE CG1 C 9.234 -9.315 -2.522 1.00 . A A . 12 ILE CG1 1 1 7 5890 1 1 12 ILE CG2 C 10.473 -8.941 -0.388 1.00 . A A . 12 ILE CG2 1 1 7 5891 1 1 12 ILE H H 8.840 -6.950 -1.109 1.00 . A A . 12 ILE H 1 1 7 5892 1 1 12 ILE HA H 11.639 -6.929 -1.989 1.00 . A A . 12 ILE HA 1 1 7 5893 1 1 12 ILE HB H 11.373 -9.289 -2.306 1.00 . A A . 12 ILE HB 1 1 7 5894 1 1 12 ILE HD11 H 9.981 -11.318 -2.311 1.00 . A A . 12 ILE HD11 1 1 7 5895 1 1 12 ILE HD12 H 8.842 -10.833 -1.055 1.00 . A A . 12 ILE HD12 1 1 7 5896 1 1 12 ILE HD13 H 8.258 -11.221 -2.674 1.00 . A A . 12 ILE HD13 1 1 7 5897 1 1 12 ILE HG12 H 8.390 -8.741 -2.167 1.00 . A A . 12 ILE HG12 1 1 7 5898 1 1 12 ILE HG13 H 9.290 -9.248 -3.598 1.00 . A A . 12 ILE HG13 1 1 7 5899 1 1 12 ILE HG21 H 10.909 -8.076 0.093 1.00 . A A . 12 ILE HG21 1 1 7 5900 1 1 12 ILE HG22 H 9.446 -9.049 -0.071 1.00 . A A . 12 ILE HG22 1 1 7 5901 1 1 12 ILE HG23 H 11.031 -9.824 -0.113 1.00 . A A . 12 ILE HG23 1 1 7 5902 1 1 12 ILE N N 9.647 -6.504 -1.443 1.00 . A A . 12 ILE N 1 1 7 5903 1 1 12 ILE O O 11.301 -6.813 -4.494 1.00 . A A . 12 ILE O 1 1 7 5904 1 1 13 ALA C C 7.442 -7.425 -5.917 1.00 . A A . 13 ALA C 1 1 7 5905 1 1 13 ALA CA C 8.849 -6.910 -5.595 1.00 . A A . 13 ALA CA 1 1 7 5906 1 1 13 ALA CB C 9.870 -7.669 -6.444 1.00 . A A . 13 ALA CB 1 1 7 5907 1 1 13 ALA H H 8.426 -7.309 -3.519 1.00 . A A . 13 ALA H 1 1 7 5908 1 1 13 ALA HA H 8.906 -5.856 -5.823 1.00 . A A . 13 ALA HA 1 1 7 5909 1 1 13 ALA HB1 H 10.131 -8.594 -5.951 1.00 . A A . 13 ALA HB1 1 1 7 5910 1 1 13 ALA HB2 H 9.444 -7.885 -7.412 1.00 . A A . 13 ALA HB2 1 1 7 5911 1 1 13 ALA HB3 H 10.756 -7.065 -6.568 1.00 . A A . 13 ALA HB3 1 1 7 5912 1 1 13 ALA N N 9.152 -7.121 -4.150 1.00 . A A . 13 ALA N 1 1 7 5913 1 1 13 ALA O O 6.796 -6.953 -6.832 1.00 . A A . 13 ALA O 1 1 7 5914 1 1 14 CYS C C 4.604 -7.793 -5.626 1.00 . A A . 14 CYS C 1 1 7 5915 1 1 14 CYS CA C 5.605 -8.939 -5.475 1.00 . A A . 14 CYS CA 1 1 7 5916 1 1 14 CYS CB C 5.158 -9.862 -4.337 1.00 . A A . 14 CYS CB 1 1 7 5917 1 1 14 CYS H H 7.501 -8.773 -4.459 1.00 . A A . 14 CYS H 1 1 7 5918 1 1 14 CYS HA H 5.639 -9.503 -6.396 1.00 . A A . 14 CYS HA 1 1 7 5919 1 1 14 CYS HB2 H 4.831 -10.804 -4.752 1.00 . A A . 14 CYS HB2 1 1 7 5920 1 1 14 CYS HB3 H 5.991 -10.036 -3.672 1.00 . A A . 14 CYS HB3 1 1 7 5921 1 1 14 CYS N N 6.964 -8.396 -5.187 1.00 . A A . 14 CYS N 1 1 7 5922 1 1 14 CYS O O 4.785 -6.717 -5.093 1.00 . A A . 14 CYS O 1 1 7 5923 1 1 14 CYS SG S 3.784 -9.272 -3.276 1.00 . A A . 14 CYS SG 1 1 7 5924 1 1 15 GLU C C 1.222 -7.377 -5.863 1.00 . A A . 15 GLU C 1 1 7 5925 1 1 15 GLU CA C 2.523 -6.956 -6.547 1.00 . A A . 15 GLU CA 1 1 7 5926 1 1 15 GLU CB C 2.268 -6.753 -8.041 1.00 . A A . 15 GLU CB 1 1 7 5927 1 1 15 GLU CD C 3.432 -5.676 -9.972 1.00 . A A . 15 GLU CD 1 1 7 5928 1 1 15 GLU CG C 3.603 -6.611 -8.773 1.00 . A A . 15 GLU CG 1 1 7 5929 1 1 15 GLU H H 3.420 -8.898 -6.774 1.00 . A A . 15 GLU H 1 1 7 5930 1 1 15 GLU HA H 2.876 -6.033 -6.112 1.00 . A A . 15 GLU HA 1 1 7 5931 1 1 15 GLU HB2 H 1.731 -7.605 -8.433 1.00 . A A . 15 GLU HB2 1 1 7 5932 1 1 15 GLU HB3 H 1.682 -5.859 -8.190 1.00 . A A . 15 GLU HB3 1 1 7 5933 1 1 15 GLU HG2 H 4.341 -6.201 -8.098 1.00 . A A . 15 GLU HG2 1 1 7 5934 1 1 15 GLU HG3 H 3.930 -7.580 -9.119 1.00 . A A . 15 GLU HG3 1 1 7 5935 1 1 15 GLU N N 3.544 -8.022 -6.355 1.00 . A A . 15 GLU N 1 1 7 5936 1 1 15 GLU O O 0.162 -6.856 -6.147 1.00 . A A . 15 GLU O 1 1 7 5937 1 1 15 GLU OE1 O 2.512 -4.874 -9.947 1.00 . A A . 15 GLU OE1 1 1 7 5938 1 1 15 GLU OE2 O 4.223 -5.777 -10.895 1.00 . A A . 15 GLU OE2 1 1 7 5939 1 1 16 SER C C -0.787 -7.578 -3.877 1.00 . A A . 16 SER C 1 1 7 5940 1 1 16 SER CA C 0.068 -8.787 -4.260 1.00 . A A . 16 SER CA 1 1 7 5941 1 1 16 SER CB C 0.469 -9.549 -2.997 1.00 . A A . 16 SER CB 1 1 7 5942 1 1 16 SER H H 2.164 -8.730 -4.755 1.00 . A A . 16 SER H 1 1 7 5943 1 1 16 SER HA H -0.497 -9.436 -4.911 1.00 . A A . 16 SER HA 1 1 7 5944 1 1 16 SER HB2 H 1.409 -9.173 -2.631 1.00 . A A . 16 SER HB2 1 1 7 5945 1 1 16 SER HB3 H -0.292 -9.414 -2.240 1.00 . A A . 16 SER HB3 1 1 7 5946 1 1 16 SER HG H 0.858 -11.390 -2.505 1.00 . A A . 16 SER HG 1 1 7 5947 1 1 16 SER N N 1.297 -8.324 -4.965 1.00 . A A . 16 SER N 1 1 7 5948 1 1 16 SER O O -1.920 -7.448 -4.297 1.00 . A A . 16 SER O 1 1 7 5949 1 1 16 SER OG O 0.606 -10.930 -3.308 1.00 . A A . 16 SER OG 1 1 7 5950 1 1 17 CYS C C -1.602 -4.813 -3.926 1.00 . A A . 17 CYS C 1 1 7 5951 1 1 17 CYS CA C -1.029 -5.489 -2.679 1.00 . A A . 17 CYS CA 1 1 7 5952 1 1 17 CYS CB C -0.103 -4.519 -1.945 1.00 . A A . 17 CYS CB 1 1 7 5953 1 1 17 CYS H H 0.665 -6.815 -2.762 1.00 . A A . 17 CYS H 1 1 7 5954 1 1 17 CYS HA H -1.835 -5.785 -2.024 1.00 . A A . 17 CYS HA 1 1 7 5955 1 1 17 CYS HB2 H -0.694 -3.752 -1.469 1.00 . A A . 17 CYS HB2 1 1 7 5956 1 1 17 CYS HB3 H 0.459 -5.056 -1.197 1.00 . A A . 17 CYS HB3 1 1 7 5957 1 1 17 CYS N N -0.252 -6.692 -3.086 1.00 . A A . 17 CYS N 1 1 7 5958 1 1 17 CYS O O -2.791 -4.577 -4.027 1.00 . A A . 17 CYS O 1 1 7 5959 1 1 17 CYS SG S 1.120 -3.682 -3.019 1.00 . A A . 17 CYS SG 1 1 7 5960 1 1 18 VAL C C -2.506 -4.584 -6.613 1.00 . A A . 18 VAL C 1 1 7 5961 1 1 18 VAL CA C -1.261 -3.849 -6.119 1.00 . A A . 18 VAL CA 1 1 7 5962 1 1 18 VAL CB C -0.175 -3.903 -7.196 1.00 . A A . 18 VAL CB 1 1 7 5963 1 1 18 VAL CG1 C -0.750 -3.426 -8.530 1.00 . A A . 18 VAL CG1 1 1 7 5964 1 1 18 VAL CG2 C 0.987 -2.995 -6.789 1.00 . A A . 18 VAL CG2 1 1 7 5965 1 1 18 VAL H H 0.189 -4.707 -4.778 1.00 . A A . 18 VAL H 1 1 7 5966 1 1 18 VAL HA H -1.511 -2.819 -5.909 1.00 . A A . 18 VAL HA 1 1 7 5967 1 1 18 VAL HB H 0.179 -4.919 -7.299 1.00 . A A . 18 VAL HB 1 1 7 5968 1 1 18 VAL HG11 H -1.348 -2.541 -8.368 1.00 . A A . 18 VAL HG11 1 1 7 5969 1 1 18 VAL HG12 H 0.059 -3.194 -9.208 1.00 . A A . 18 VAL HG12 1 1 7 5970 1 1 18 VAL HG13 H -1.366 -4.203 -8.957 1.00 . A A . 18 VAL HG13 1 1 7 5971 1 1 18 VAL HG21 H 1.053 -2.955 -5.712 1.00 . A A . 18 VAL HG21 1 1 7 5972 1 1 18 VAL HG22 H 1.910 -3.388 -7.191 1.00 . A A . 18 VAL HG22 1 1 7 5973 1 1 18 VAL HG23 H 0.820 -2.001 -7.175 1.00 . A A . 18 VAL HG23 1 1 7 5974 1 1 18 VAL N N -0.766 -4.504 -4.878 1.00 . A A . 18 VAL N 1 1 7 5975 1 1 18 VAL O O -3.443 -3.982 -7.099 1.00 . A A . 18 VAL O 1 1 7 5976 1 1 19 GLU C C -4.868 -6.423 -5.981 1.00 . A A . 19 GLU C 1 1 7 5977 1 1 19 GLU CA C -3.719 -6.648 -6.953 1.00 . A A . 19 GLU CA 1 1 7 5978 1 1 19 GLU CB C -3.383 -8.138 -7.030 1.00 . A A . 19 GLU CB 1 1 7 5979 1 1 19 GLU CD C -5.100 -9.601 -8.100 1.00 . A A . 19 GLU CD 1 1 7 5980 1 1 19 GLU CG C -3.888 -8.706 -8.357 1.00 . A A . 19 GLU CG 1 1 7 5981 1 1 19 GLU H H -1.765 -6.354 -6.095 1.00 . A A . 19 GLU H 1 1 7 5982 1 1 19 GLU HA H -4.011 -6.290 -7.927 1.00 . A A . 19 GLU HA 1 1 7 5983 1 1 19 GLU HB2 H -2.312 -8.268 -6.964 1.00 . A A . 19 GLU HB2 1 1 7 5984 1 1 19 GLU HB3 H -3.860 -8.657 -6.213 1.00 . A A . 19 GLU HB3 1 1 7 5985 1 1 19 GLU HG2 H -4.171 -7.893 -9.011 1.00 . A A . 19 GLU HG2 1 1 7 5986 1 1 19 GLU HG3 H -3.105 -9.286 -8.823 1.00 . A A . 19 GLU HG3 1 1 7 5987 1 1 19 GLU N N -2.529 -5.883 -6.492 1.00 . A A . 19 GLU N 1 1 7 5988 1 1 19 GLU O O -6.018 -6.370 -6.366 1.00 . A A . 19 GLU O 1 1 7 5989 1 1 19 GLU OE1 O -5.713 -9.450 -7.056 1.00 . A A . 19 GLU OE1 1 1 7 5990 1 1 19 GLU OE2 O -5.397 -10.423 -8.953 1.00 . A A . 19 GLU OE2 1 1 7 5991 1 1 20 ILE C C -5.943 -4.493 -3.747 1.00 . A A . 20 ILE C 1 1 7 5992 1 1 20 ILE CA C -5.652 -5.995 -3.747 1.00 . A A . 20 ILE CA 1 1 7 5993 1 1 20 ILE CB C -5.216 -6.434 -2.351 1.00 . A A . 20 ILE CB 1 1 7 5994 1 1 20 ILE CD1 C -3.589 -8.296 -2.150 1.00 . A A . 20 ILE CD1 1 1 7 5995 1 1 20 ILE CG1 C -5.064 -7.930 -2.320 1.00 . A A . 20 ILE CG1 1 1 7 5996 1 1 20 ILE CG2 C -6.261 -6.010 -1.322 1.00 . A A . 20 ILE CG2 1 1 7 5997 1 1 20 ILE H H -3.632 -6.276 -4.434 1.00 . A A . 20 ILE H 1 1 7 5998 1 1 20 ILE HA H -6.540 -6.538 -4.035 1.00 . A A . 20 ILE HA 1 1 7 5999 1 1 20 ILE HB H -4.280 -6.000 -2.113 1.00 . A A . 20 ILE HB 1 1 7 6000 1 1 20 ILE HD11 H -3.028 -7.415 -1.877 1.00 . A A . 20 ILE HD11 1 1 7 6001 1 1 20 ILE HD12 H -3.489 -9.041 -1.374 1.00 . A A . 20 ILE HD12 1 1 7 6002 1 1 20 ILE HD13 H -3.206 -8.692 -3.079 1.00 . A A . 20 ILE HD13 1 1 7 6003 1 1 20 ILE HG12 H -5.628 -8.311 -1.497 1.00 . A A . 20 ILE HG12 1 1 7 6004 1 1 20 ILE HG13 H -5.428 -8.333 -3.236 1.00 . A A . 20 ILE HG13 1 1 7 6005 1 1 20 ILE HG21 H -7.201 -5.820 -1.820 1.00 . A A . 20 ILE HG21 1 1 7 6006 1 1 20 ILE HG22 H -6.392 -6.798 -0.596 1.00 . A A . 20 ILE HG22 1 1 7 6007 1 1 20 ILE HG23 H -5.932 -5.112 -0.825 1.00 . A A . 20 ILE HG23 1 1 7 6008 1 1 20 ILE N N -4.568 -6.256 -4.725 1.00 . A A . 20 ILE N 1 1 7 6009 1 1 20 ILE O O -6.631 -3.983 -2.885 1.00 . A A . 20 ILE O 1 1 7 6010 1 1 21 ALA C C -4.914 -1.720 -5.974 1.00 . A A . 21 ALA C 1 1 7 6011 1 1 21 ALA CA C -5.655 -2.310 -4.772 1.00 . A A . 21 ALA CA 1 1 7 6012 1 1 21 ALA CB C -5.142 -1.659 -3.486 1.00 . A A . 21 ALA CB 1 1 7 6013 1 1 21 ALA H H -4.859 -4.211 -5.402 1.00 . A A . 21 ALA H 1 1 7 6014 1 1 21 ALA HA H -6.714 -2.122 -4.873 1.00 . A A . 21 ALA HA 1 1 7 6015 1 1 21 ALA HB1 H -4.476 -2.341 -2.978 1.00 . A A . 21 ALA HB1 1 1 7 6016 1 1 21 ALA HB2 H -4.610 -0.751 -3.729 1.00 . A A . 21 ALA HB2 1 1 7 6017 1 1 21 ALA HB3 H -5.977 -1.425 -2.843 1.00 . A A . 21 ALA HB3 1 1 7 6018 1 1 21 ALA N N -5.416 -3.779 -4.713 1.00 . A A . 21 ALA N 1 1 7 6019 1 1 21 ALA O O -4.026 -0.899 -5.819 1.00 . A A . 21 ALA O 1 1 7 6020 1 1 22 PRO C C -5.135 -0.244 -8.695 1.00 . A A . 22 PRO C 1 1 7 6021 1 1 22 PRO CA C -4.683 -1.675 -8.396 1.00 . A A . 22 PRO CA 1 1 7 6022 1 1 22 PRO CB C -5.198 -2.647 -9.457 1.00 . A A . 22 PRO CB 1 1 7 6023 1 1 22 PRO CD C -6.372 -3.141 -7.391 1.00 . A A . 22 PRO CD 1 1 7 6024 1 1 22 PRO CG C -6.481 -3.185 -8.900 1.00 . A A . 22 PRO CG 1 1 7 6025 1 1 22 PRO HA H -3.608 -1.731 -8.332 1.00 . A A . 22 PRO HA 1 1 7 6026 1 1 22 PRO HB2 H -5.346 -2.112 -10.386 1.00 . A A . 22 PRO HB2 1 1 7 6027 1 1 22 PRO HB3 H -4.474 -3.431 -9.607 1.00 . A A . 22 PRO HB3 1 1 7 6028 1 1 22 PRO HD2 H -7.309 -2.817 -6.957 1.00 . A A . 22 PRO HD2 1 1 7 6029 1 1 22 PRO HD3 H -6.090 -4.108 -7.005 1.00 . A A . 22 PRO HD3 1 1 7 6030 1 1 22 PRO HG2 H -7.307 -2.572 -9.232 1.00 . A A . 22 PRO HG2 1 1 7 6031 1 1 22 PRO HG3 H -6.620 -4.204 -9.226 1.00 . A A . 22 PRO HG3 1 1 7 6032 1 1 22 PRO N N -5.310 -2.161 -7.139 1.00 . A A . 22 PRO N 1 1 7 6033 1 1 22 PRO O O -5.643 0.051 -9.759 1.00 . A A . 22 PRO O 1 1 7 6034 1 1 23 GLY C C -4.639 2.941 -6.956 1.00 . A A . 23 GLY C 1 1 7 6035 1 1 23 GLY CA C -5.362 2.060 -7.974 1.00 . A A . 23 GLY CA 1 1 7 6036 1 1 23 GLY H H -4.538 0.381 -6.913 1.00 . A A . 23 GLY H 1 1 7 6037 1 1 23 GLY HA2 H -5.097 2.365 -8.977 1.00 . A A . 23 GLY HA2 1 1 7 6038 1 1 23 GLY HA3 H -6.428 2.152 -7.835 1.00 . A A . 23 GLY HA3 1 1 7 6039 1 1 23 GLY N N -4.951 0.645 -7.760 1.00 . A A . 23 GLY N 1 1 7 6040 1 1 23 GLY O O -4.177 4.020 -7.268 1.00 . A A . 23 GLY O 1 1 7 6041 1 1 24 ALA C C -2.379 2.796 -4.596 1.00 . A A . 24 ALA C 1 1 7 6042 1 1 24 ALA CA C -3.827 3.279 -4.699 1.00 . A A . 24 ALA CA 1 1 7 6043 1 1 24 ALA CB C -4.528 3.094 -3.352 1.00 . A A . 24 ALA CB 1 1 7 6044 1 1 24 ALA H H -4.904 1.603 -5.513 1.00 . A A . 24 ALA H 1 1 7 6045 1 1 24 ALA HA H -3.841 4.323 -4.975 1.00 . A A . 24 ALA HA 1 1 7 6046 1 1 24 ALA HB1 H -4.655 2.039 -3.155 1.00 . A A . 24 ALA HB1 1 1 7 6047 1 1 24 ALA HB2 H -3.927 3.537 -2.570 1.00 . A A . 24 ALA HB2 1 1 7 6048 1 1 24 ALA HB3 H -5.494 3.573 -3.381 1.00 . A A . 24 ALA HB3 1 1 7 6049 1 1 24 ALA N N -4.529 2.480 -5.740 1.00 . A A . 24 ALA N 1 1 7 6050 1 1 24 ALA O O -1.467 3.574 -4.394 1.00 . A A . 24 ALA O 1 1 7 6051 1 1 25 PHE C C -0.201 0.872 -6.075 1.00 . A A . 25 PHE C 1 1 7 6052 1 1 25 PHE CA C -0.771 0.983 -4.659 1.00 . A A . 25 PHE CA 1 1 7 6053 1 1 25 PHE CB C -0.795 -0.406 -4.020 1.00 . A A . 25 PHE CB 1 1 7 6054 1 1 25 PHE CD1 C 1.353 0.306 -2.891 1.00 . A A . 25 PHE CD1 1 1 7 6055 1 1 25 PHE CD2 C -0.041 -1.356 -1.812 1.00 . A A . 25 PHE CD2 1 1 7 6056 1 1 25 PHE CE1 C 2.271 0.214 -1.836 1.00 . A A . 25 PHE CE1 1 1 7 6057 1 1 25 PHE CE2 C 0.878 -1.443 -0.758 1.00 . A A . 25 PHE CE2 1 1 7 6058 1 1 25 PHE CG C 0.196 -0.482 -2.879 1.00 . A A . 25 PHE CG 1 1 7 6059 1 1 25 PHE CZ C 2.036 -0.657 -0.773 1.00 . A A . 25 PHE CZ 1 1 7 6060 1 1 25 PHE H H -2.910 0.907 -4.909 1.00 . A A . 25 PHE H 1 1 7 6061 1 1 25 PHE HA H -0.159 1.650 -4.067 1.00 . A A . 25 PHE HA 1 1 7 6062 1 1 25 PHE HB2 H -1.788 -0.610 -3.645 1.00 . A A . 25 PHE HB2 1 1 7 6063 1 1 25 PHE HB3 H -0.537 -1.142 -4.765 1.00 . A A . 25 PHE HB3 1 1 7 6064 1 1 25 PHE HD1 H 1.540 0.981 -3.712 1.00 . A A . 25 PHE HD1 1 1 7 6065 1 1 25 PHE HD2 H -0.935 -1.961 -1.800 1.00 . A A . 25 PHE HD2 1 1 7 6066 1 1 25 PHE HE1 H 3.156 0.820 -1.838 1.00 . A A . 25 PHE HE1 1 1 7 6067 1 1 25 PHE HE2 H 0.694 -2.119 0.065 1.00 . A A . 25 PHE HE2 1 1 7 6068 1 1 25 PHE HZ H 2.747 -0.729 0.028 1.00 . A A . 25 PHE HZ 1 1 7 6069 1 1 25 PHE N N -2.160 1.516 -4.740 1.00 . A A . 25 PHE N 1 1 7 6070 1 1 25 PHE O O -0.877 0.447 -6.990 1.00 . A A . 25 PHE O 1 1 7 6071 1 1 26 ALA C C 3.160 1.221 -7.555 1.00 . A A . 26 ALA C 1 1 7 6072 1 1 26 ALA CA C 1.630 1.147 -7.637 1.00 . A A . 26 ALA CA 1 1 7 6073 1 1 26 ALA CB C 1.112 2.299 -8.499 1.00 . A A . 26 ALA CB 1 1 7 6074 1 1 26 ALA H H 1.564 1.581 -5.520 1.00 . A A . 26 ALA H 1 1 7 6075 1 1 26 ALA HA H 1.342 0.208 -8.086 1.00 . A A . 26 ALA HA 1 1 7 6076 1 1 26 ALA HB1 H 0.265 2.761 -8.012 1.00 . A A . 26 ALA HB1 1 1 7 6077 1 1 26 ALA HB2 H 1.895 3.031 -8.629 1.00 . A A . 26 ALA HB2 1 1 7 6078 1 1 26 ALA HB3 H 0.810 1.919 -9.464 1.00 . A A . 26 ALA HB3 1 1 7 6079 1 1 26 ALA N N 1.034 1.244 -6.268 1.00 . A A . 26 ALA N 1 1 7 6080 1 1 26 ALA O O 3.715 2.178 -7.061 1.00 . A A . 26 ALA O 1 1 7 6081 1 1 27 MET C C 5.869 1.404 -8.810 1.00 . A A . 27 MET C 1 1 7 6082 1 1 27 MET CA C 5.342 0.227 -7.993 1.00 . A A . 27 MET CA 1 1 7 6083 1 1 27 MET CB C 5.875 -1.082 -8.582 1.00 . A A . 27 MET CB 1 1 7 6084 1 1 27 MET CE C 7.674 -2.558 -10.785 1.00 . A A . 27 MET CE 1 1 7 6085 1 1 27 MET CG C 7.403 -1.089 -8.519 1.00 . A A . 27 MET CG 1 1 7 6086 1 1 27 MET H H 3.376 -0.548 -8.437 1.00 . A A . 27 MET H 1 1 7 6087 1 1 27 MET HA H 5.670 0.324 -6.981 1.00 . A A . 27 MET HA 1 1 7 6088 1 1 27 MET HB2 H 5.487 -1.916 -8.014 1.00 . A A . 27 MET HB2 1 1 7 6089 1 1 27 MET HB3 H 5.559 -1.170 -9.610 1.00 . A A . 27 MET HB3 1 1 7 6090 1 1 27 MET HE1 H 7.155 -3.104 -10.015 1.00 . A A . 27 MET HE1 1 1 7 6091 1 1 27 MET HE2 H 7.042 -2.483 -11.660 1.00 . A A . 27 MET HE2 1 1 7 6092 1 1 27 MET HE3 H 8.588 -3.077 -11.039 1.00 . A A . 27 MET HE3 1 1 7 6093 1 1 27 MET HG2 H 7.742 -0.273 -7.897 1.00 . A A . 27 MET HG2 1 1 7 6094 1 1 27 MET HG3 H 7.742 -2.025 -8.100 1.00 . A A . 27 MET HG3 1 1 7 6095 1 1 27 MET N N 3.845 0.216 -8.040 1.00 . A A . 27 MET N 1 1 7 6096 1 1 27 MET O O 5.276 1.782 -9.801 1.00 . A A . 27 MET O 1 1 7 6097 1 1 27 MET SD S 8.074 -0.896 -10.189 1.00 . A A . 27 MET SD 1 1 7 6098 1 1 28 ASP C C 8.918 2.773 -9.617 1.00 . A A . 28 ASP C 1 1 7 6099 1 1 28 ASP CA C 7.492 3.114 -9.245 1.00 . A A . 28 ASP CA 1 1 7 6100 1 1 28 ASP CB C 7.459 4.398 -8.422 1.00 . A A . 28 ASP CB 1 1 7 6101 1 1 28 ASP CG C 6.928 5.547 -9.282 1.00 . A A . 28 ASP CG 1 1 7 6102 1 1 28 ASP H H 7.504 1.688 -7.634 1.00 . A A . 28 ASP H 1 1 7 6103 1 1 28 ASP HA H 6.892 3.229 -10.136 1.00 . A A . 28 ASP HA 1 1 7 6104 1 1 28 ASP HB2 H 6.815 4.260 -7.566 1.00 . A A . 28 ASP HB2 1 1 7 6105 1 1 28 ASP HB3 H 8.456 4.629 -8.088 1.00 . A A . 28 ASP HB3 1 1 7 6106 1 1 28 ASP N N 6.984 1.992 -8.435 1.00 . A A . 28 ASP N 1 1 7 6107 1 1 28 ASP O O 9.506 1.925 -8.980 1.00 . A A . 28 ASP O 1 1 7 6108 1 1 28 ASP OD1 O 5.978 5.323 -10.012 1.00 . A A . 28 ASP OD1 1 1 7 6109 1 1 28 ASP OD2 O 7.480 6.631 -9.194 1.00 . A A . 28 ASP OD2 1 1 7 6110 1 1 29 PRO C C 11.738 4.028 -10.202 1.00 . A A . 29 PRO C 1 1 7 6111 1 1 29 PRO CA C 10.807 3.200 -11.075 1.00 . A A . 29 PRO CA 1 1 7 6112 1 1 29 PRO CB C 10.805 3.700 -12.518 1.00 . A A . 29 PRO CB 1 1 7 6113 1 1 29 PRO CD C 8.766 4.481 -11.408 1.00 . A A . 29 PRO CD 1 1 7 6114 1 1 29 PRO CG C 9.693 4.707 -12.589 1.00 . A A . 29 PRO CG 1 1 7 6115 1 1 29 PRO HA H 11.058 2.152 -11.032 1.00 . A A . 29 PRO HA 1 1 7 6116 1 1 29 PRO HB2 H 11.769 4.138 -12.741 1.00 . A A . 29 PRO HB2 1 1 7 6117 1 1 29 PRO HB3 H 10.627 2.869 -13.182 1.00 . A A . 29 PRO HB3 1 1 7 6118 1 1 29 PRO HD2 H 8.670 5.390 -10.832 1.00 . A A . 29 PRO HD2 1 1 7 6119 1 1 29 PRO HD3 H 7.804 4.145 -11.740 1.00 . A A . 29 PRO HD3 1 1 7 6120 1 1 29 PRO HG2 H 10.108 5.704 -12.546 1.00 . A A . 29 PRO HG2 1 1 7 6121 1 1 29 PRO HG3 H 9.145 4.575 -13.509 1.00 . A A . 29 PRO HG3 1 1 7 6122 1 1 29 PRO N N 9.423 3.440 -10.620 1.00 . A A . 29 PRO N 1 1 7 6123 1 1 29 PRO O O 12.930 3.803 -10.132 1.00 . A A . 29 PRO O 1 1 7 6124 1 1 30 GLU C C 12.030 5.098 -7.252 1.00 . A A . 30 GLU C 1 1 7 6125 1 1 30 GLU CA C 11.975 5.820 -8.590 1.00 . A A . 30 GLU CA 1 1 7 6126 1 1 30 GLU CB C 11.299 7.183 -8.420 1.00 . A A . 30 GLU CB 1 1 7 6127 1 1 30 GLU CD C 12.111 9.385 -7.562 1.00 . A A . 30 GLU CD 1 1 7 6128 1 1 30 GLU CG C 12.333 8.295 -8.612 1.00 . A A . 30 GLU CG 1 1 7 6129 1 1 30 GLU H H 10.200 5.102 -9.570 1.00 . A A . 30 GLU H 1 1 7 6130 1 1 30 GLU HA H 12.972 5.947 -8.984 1.00 . A A . 30 GLU HA 1 1 7 6131 1 1 30 GLU HB2 H 10.515 7.289 -9.156 1.00 . A A . 30 GLU HB2 1 1 7 6132 1 1 30 GLU HB3 H 10.876 7.254 -7.429 1.00 . A A . 30 GLU HB3 1 1 7 6133 1 1 30 GLU HG2 H 13.326 7.884 -8.502 1.00 . A A . 30 GLU HG2 1 1 7 6134 1 1 30 GLU HG3 H 12.226 8.720 -9.598 1.00 . A A . 30 GLU HG3 1 1 7 6135 1 1 30 GLU N N 11.171 4.972 -9.506 1.00 . A A . 30 GLU N 1 1 7 6136 1 1 30 GLU O O 13.032 5.096 -6.565 1.00 . A A . 30 GLU O 1 1 7 6137 1 1 30 GLU OE1 O 11.037 9.412 -6.984 1.00 . A A . 30 GLU OE1 1 1 7 6138 1 1 30 GLU OE2 O 13.017 10.175 -7.355 1.00 . A A . 30 GLU OE2 1 1 7 6139 1 1 31 ILE C C 11.005 2.193 -5.966 1.00 . A A . 31 ILE C 1 1 7 6140 1 1 31 ILE CA C 10.920 3.673 -5.638 1.00 . A A . 31 ILE CA 1 1 7 6141 1 1 31 ILE CB C 9.632 3.955 -4.858 1.00 . A A . 31 ILE CB 1 1 7 6142 1 1 31 ILE CD1 C 7.149 4.043 -5.062 1.00 . A A . 31 ILE CD1 1 1 7 6143 1 1 31 ILE CG1 C 8.469 4.144 -5.827 1.00 . A A . 31 ILE CG1 1 1 7 6144 1 1 31 ILE CG2 C 9.804 5.223 -4.020 1.00 . A A . 31 ILE CG2 1 1 7 6145 1 1 31 ILE H H 10.175 4.444 -7.493 1.00 . A A . 31 ILE H 1 1 7 6146 1 1 31 ILE HA H 11.751 3.935 -5.045 1.00 . A A . 31 ILE HA 1 1 7 6147 1 1 31 ILE HB H 9.423 3.120 -4.204 1.00 . A A . 31 ILE HB 1 1 7 6148 1 1 31 ILE HD11 H 7.159 3.159 -4.441 1.00 . A A . 31 ILE HD11 1 1 7 6149 1 1 31 ILE HD12 H 7.026 4.918 -4.441 1.00 . A A . 31 ILE HD12 1 1 7 6150 1 1 31 ILE HD13 H 6.332 3.981 -5.763 1.00 . A A . 31 ILE HD13 1 1 7 6151 1 1 31 ILE HG12 H 8.544 5.116 -6.293 1.00 . A A . 31 ILE HG12 1 1 7 6152 1 1 31 ILE HG13 H 8.503 3.376 -6.585 1.00 . A A . 31 ILE HG13 1 1 7 6153 1 1 31 ILE HG21 H 10.852 5.479 -3.965 1.00 . A A . 31 ILE HG21 1 1 7 6154 1 1 31 ILE HG22 H 9.260 6.035 -4.479 1.00 . A A . 31 ILE HG22 1 1 7 6155 1 1 31 ILE HG23 H 9.422 5.050 -3.025 1.00 . A A . 31 ILE HG23 1 1 7 6156 1 1 31 ILE N N 10.953 4.446 -6.903 1.00 . A A . 31 ILE N 1 1 7 6157 1 1 31 ILE O O 11.014 1.364 -5.081 1.00 . A A . 31 ILE O 1 1 7 6158 1 1 32 GLU C C 10.272 -0.374 -6.678 1.00 . A A . 32 GLU C 1 1 7 6159 1 1 32 GLU CA C 11.099 0.430 -7.662 1.00 . A A . 32 GLU CA 1 1 7 6160 1 1 32 GLU CB C 12.544 -0.075 -7.664 1.00 . A A . 32 GLU CB 1 1 7 6161 1 1 32 GLU CD C 14.674 1.150 -8.102 1.00 . A A . 32 GLU CD 1 1 7 6162 1 1 32 GLU CG C 13.353 0.686 -8.715 1.00 . A A . 32 GLU CG 1 1 7 6163 1 1 32 GLU H H 11.026 2.561 -7.924 1.00 . A A . 32 GLU H 1 1 7 6164 1 1 32 GLU HA H 10.671 0.340 -8.649 1.00 . A A . 32 GLU HA 1 1 7 6165 1 1 32 GLU HB2 H 12.982 0.083 -6.689 1.00 . A A . 32 GLU HB2 1 1 7 6166 1 1 32 GLU HB3 H 12.556 -1.129 -7.897 1.00 . A A . 32 GLU HB3 1 1 7 6167 1 1 32 GLU HG2 H 13.552 0.036 -9.556 1.00 . A A . 32 GLU HG2 1 1 7 6168 1 1 32 GLU HG3 H 12.791 1.545 -9.049 1.00 . A A . 32 GLU HG3 1 1 7 6169 1 1 32 GLU N N 11.048 1.862 -7.240 1.00 . A A . 32 GLU N 1 1 7 6170 1 1 32 GLU O O 10.594 -1.492 -6.326 1.00 . A A . 32 GLU O 1 1 7 6171 1 1 32 GLU OE1 O 14.634 1.998 -7.227 1.00 . A A . 32 GLU OE1 1 1 7 6172 1 1 32 GLU OE2 O 15.706 0.646 -8.516 1.00 . A A . 32 GLU OE2 1 1 7 6173 1 1 33 LYS C C 6.981 0.207 -5.182 1.00 . A A . 33 LYS C 1 1 7 6174 1 1 33 LYS CA C 8.354 -0.458 -5.200 1.00 . A A . 33 LYS CA 1 1 7 6175 1 1 33 LYS CB C 8.989 -0.342 -3.804 1.00 . A A . 33 LYS CB 1 1 7 6176 1 1 33 LYS CD C 10.947 -0.968 -2.379 1.00 . A A . 33 LYS CD 1 1 7 6177 1 1 33 LYS CE C 12.237 -1.786 -2.319 1.00 . A A . 33 LYS CE 1 1 7 6178 1 1 33 LYS CG C 10.333 -1.079 -3.776 1.00 . A A . 33 LYS CG 1 1 7 6179 1 1 33 LYS H H 9.003 1.146 -6.519 1.00 . A A . 33 LYS H 1 1 7 6180 1 1 33 LYS HA H 8.248 -1.502 -5.458 1.00 . A A . 33 LYS HA 1 1 7 6181 1 1 33 LYS HB2 H 9.145 0.700 -3.566 1.00 . A A . 33 LYS HB2 1 1 7 6182 1 1 33 LYS HB3 H 8.327 -0.782 -3.073 1.00 . A A . 33 LYS HB3 1 1 7 6183 1 1 33 LYS HD2 H 11.167 0.068 -2.165 1.00 . A A . 33 LYS HD2 1 1 7 6184 1 1 33 LYS HD3 H 10.250 -1.345 -1.647 1.00 . A A . 33 LYS HD3 1 1 7 6185 1 1 33 LYS HE2 H 12.319 -2.258 -1.351 1.00 . A A . 33 LYS HE2 1 1 7 6186 1 1 33 LYS HE3 H 12.220 -2.543 -3.089 1.00 . A A . 33 LYS HE3 1 1 7 6187 1 1 33 LYS HG2 H 10.180 -2.119 -4.020 1.00 . A A . 33 LYS HG2 1 1 7 6188 1 1 33 LYS HG3 H 11.005 -0.635 -4.491 1.00 . A A . 33 LYS HG3 1 1 7 6189 1 1 33 LYS HZ1 H 13.109 -0.059 -3.089 1.00 . A A . 33 LYS HZ1 1 1 7 6190 1 1 33 LYS HZ2 H 13.772 -0.570 -1.610 1.00 . A A . 33 LYS HZ2 1 1 7 6191 1 1 33 LYS HZ3 H 14.149 -1.397 -3.046 1.00 . A A . 33 LYS HZ3 1 1 7 6192 1 1 33 LYS N N 9.218 0.225 -6.210 1.00 . A A . 33 LYS N 1 1 7 6193 1 1 33 LYS NZ N 13.405 -0.885 -2.532 1.00 . A A . 33 LYS NZ 1 1 7 6194 1 1 33 LYS O O 6.840 1.372 -5.496 1.00 . A A . 33 LYS O 1 1 7 6195 1 1 34 ALA C C 4.447 1.057 -3.680 1.00 . A A . 34 ALA C 1 1 7 6196 1 1 34 ALA CA C 4.591 0.055 -4.819 1.00 . A A . 34 ALA CA 1 1 7 6197 1 1 34 ALA CB C 3.569 -1.069 -4.637 1.00 . A A . 34 ALA CB 1 1 7 6198 1 1 34 ALA H H 6.096 -1.470 -4.600 1.00 . A A . 34 ALA H 1 1 7 6199 1 1 34 ALA HA H 4.401 0.554 -5.749 1.00 . A A . 34 ALA HA 1 1 7 6200 1 1 34 ALA HB1 H 4.027 -2.015 -4.880 1.00 . A A . 34 ALA HB1 1 1 7 6201 1 1 34 ALA HB2 H 3.231 -1.086 -3.611 1.00 . A A . 34 ALA HB2 1 1 7 6202 1 1 34 ALA HB3 H 2.726 -0.898 -5.290 1.00 . A A . 34 ALA HB3 1 1 7 6203 1 1 34 ALA N N 5.962 -0.528 -4.836 1.00 . A A . 34 ALA N 1 1 7 6204 1 1 34 ALA O O 5.069 0.943 -2.655 1.00 . A A . 34 ALA O 1 1 7 6205 1 1 35 TYR C C 1.922 3.490 -2.873 1.00 . A A . 35 TYR C 1 1 7 6206 1 1 35 TYR CA C 3.374 3.037 -2.777 1.00 . A A . 35 TYR CA 1 1 7 6207 1 1 35 TYR CB C 4.313 4.234 -2.969 1.00 . A A . 35 TYR CB 1 1 7 6208 1 1 35 TYR CD1 C 4.049 4.375 -5.470 1.00 . A A . 35 TYR CD1 1 1 7 6209 1 1 35 TYR CD2 C 3.474 6.311 -4.134 1.00 . A A . 35 TYR CD2 1 1 7 6210 1 1 35 TYR CE1 C 3.702 5.075 -6.634 1.00 . A A . 35 TYR CE1 1 1 7 6211 1 1 35 TYR CE2 C 3.128 7.012 -5.297 1.00 . A A . 35 TYR CE2 1 1 7 6212 1 1 35 TYR CG C 3.935 4.992 -4.222 1.00 . A A . 35 TYR CG 1 1 7 6213 1 1 35 TYR CZ C 3.241 6.395 -6.548 1.00 . A A . 35 TYR CZ 1 1 7 6214 1 1 35 TYR H H 3.099 2.090 -4.686 1.00 . A A . 35 TYR H 1 1 7 6215 1 1 35 TYR HA H 3.550 2.592 -1.807 1.00 . A A . 35 TYR HA 1 1 7 6216 1 1 35 TYR HB2 H 4.235 4.890 -2.115 1.00 . A A . 35 TYR HB2 1 1 7 6217 1 1 35 TYR HB3 H 5.329 3.880 -3.057 1.00 . A A . 35 TYR HB3 1 1 7 6218 1 1 35 TYR HD1 H 4.407 3.360 -5.535 1.00 . A A . 35 TYR HD1 1 1 7 6219 1 1 35 TYR HD2 H 3.386 6.789 -3.170 1.00 . A A . 35 TYR HD2 1 1 7 6220 1 1 35 TYR HE1 H 3.791 4.596 -7.599 1.00 . A A . 35 TYR HE1 1 1 7 6221 1 1 35 TYR HE2 H 2.774 8.030 -5.228 1.00 . A A . 35 TYR HE2 1 1 7 6222 1 1 35 TYR HH H 2.621 7.967 -7.434 1.00 . A A . 35 TYR HH 1 1 7 6223 1 1 35 TYR N N 3.603 2.030 -3.851 1.00 . A A . 35 TYR N 1 1 7 6224 1 1 35 TYR O O 1.340 3.481 -3.943 1.00 . A A . 35 TYR O 1 1 7 6225 1 1 35 TYR OH O 2.900 7.086 -7.693 1.00 . A A . 35 TYR OH 1 1 7 6226 1 1 36 VAL C C -0.147 5.649 -2.603 1.00 . A A . 36 VAL C 1 1 7 6227 1 1 36 VAL CA C -0.100 4.315 -1.856 1.00 . A A . 36 VAL CA 1 1 7 6228 1 1 36 VAL CB C -0.690 4.455 -0.447 1.00 . A A . 36 VAL CB 1 1 7 6229 1 1 36 VAL CG1 C -0.022 5.610 0.296 1.00 . A A . 36 VAL CG1 1 1 7 6230 1 1 36 VAL CG2 C -2.193 4.721 -0.556 1.00 . A A . 36 VAL CG2 1 1 7 6231 1 1 36 VAL H H 1.793 3.869 -0.923 1.00 . A A . 36 VAL H 1 1 7 6232 1 1 36 VAL HA H -0.665 3.580 -2.411 1.00 . A A . 36 VAL HA 1 1 7 6233 1 1 36 VAL HB H -0.526 3.539 0.102 1.00 . A A . 36 VAL HB 1 1 7 6234 1 1 36 VAL HG11 H 0.661 6.117 -0.366 1.00 . A A . 36 VAL HG11 1 1 7 6235 1 1 36 VAL HG12 H -0.779 6.302 0.635 1.00 . A A . 36 VAL HG12 1 1 7 6236 1 1 36 VAL HG13 H 0.518 5.222 1.148 1.00 . A A . 36 VAL HG13 1 1 7 6237 1 1 36 VAL HG21 H -2.364 5.555 -1.220 1.00 . A A . 36 VAL HG21 1 1 7 6238 1 1 36 VAL HG22 H -2.687 3.843 -0.946 1.00 . A A . 36 VAL HG22 1 1 7 6239 1 1 36 VAL HG23 H -2.590 4.952 0.421 1.00 . A A . 36 VAL HG23 1 1 7 6240 1 1 36 VAL N N 1.319 3.874 -1.781 1.00 . A A . 36 VAL N 1 1 7 6241 1 1 36 VAL O O -0.515 6.675 -2.065 1.00 . A A . 36 VAL O 1 1 7 6242 1 1 37 LYS C C -1.050 7.612 -4.549 1.00 . A A . 37 LYS C 1 1 7 6243 1 1 37 LYS CA C 0.266 6.859 -4.681 1.00 . A A . 37 LYS CA 1 1 7 6244 1 1 37 LYS CB C 0.482 6.457 -6.148 1.00 . A A . 37 LYS CB 1 1 7 6245 1 1 37 LYS CD C -0.609 5.663 -8.257 1.00 . A A . 37 LYS CD 1 1 7 6246 1 1 37 LYS CE C -1.933 5.672 -9.026 1.00 . A A . 37 LYS CE 1 1 7 6247 1 1 37 LYS CG C -0.855 6.103 -6.813 1.00 . A A . 37 LYS CG 1 1 7 6248 1 1 37 LYS H H 0.545 4.779 -4.240 1.00 . A A . 37 LYS H 1 1 7 6249 1 1 37 LYS HA H 1.075 7.495 -4.361 1.00 . A A . 37 LYS HA 1 1 7 6250 1 1 37 LYS HB2 H 0.942 7.277 -6.681 1.00 . A A . 37 LYS HB2 1 1 7 6251 1 1 37 LYS HB3 H 1.130 5.595 -6.186 1.00 . A A . 37 LYS HB3 1 1 7 6252 1 1 37 LYS HD2 H 0.086 6.344 -8.728 1.00 . A A . 37 LYS HD2 1 1 7 6253 1 1 37 LYS HD3 H -0.198 4.665 -8.265 1.00 . A A . 37 LYS HD3 1 1 7 6254 1 1 37 LYS HE2 H -1.780 5.257 -10.011 1.00 . A A . 37 LYS HE2 1 1 7 6255 1 1 37 LYS HE3 H -2.662 5.078 -8.495 1.00 . A A . 37 LYS HE3 1 1 7 6256 1 1 37 LYS HG2 H -1.327 5.300 -6.267 1.00 . A A . 37 LYS HG2 1 1 7 6257 1 1 37 LYS HG3 H -1.500 6.969 -6.808 1.00 . A A . 37 LYS HG3 1 1 7 6258 1 1 37 LYS HZ1 H -1.619 7.723 -9.202 1.00 . A A . 37 LYS HZ1 1 1 7 6259 1 1 37 LYS HZ2 H -3.003 7.162 -10.011 1.00 . A A . 37 LYS HZ2 1 1 7 6260 1 1 37 LYS HZ3 H -3.006 7.310 -8.319 1.00 . A A . 37 LYS HZ3 1 1 7 6261 1 1 37 LYS N N 0.246 5.625 -3.848 1.00 . A A . 37 LYS N 1 1 7 6262 1 1 37 LYS NZ N -2.427 7.073 -9.148 1.00 . A A . 37 LYS NZ 1 1 7 6263 1 1 37 LYS O O -1.112 8.811 -4.736 1.00 . A A . 37 LYS O 1 1 7 6264 1 1 38 ASP C C -4.364 6.771 -3.310 1.00 . A A . 38 ASP C 1 1 7 6265 1 1 38 ASP CA C -3.412 7.600 -4.168 1.00 . A A . 38 ASP CA 1 1 7 6266 1 1 38 ASP CB C -3.959 7.751 -5.585 1.00 . A A . 38 ASP CB 1 1 7 6267 1 1 38 ASP CG C -5.371 8.337 -5.538 1.00 . A A . 38 ASP CG 1 1 7 6268 1 1 38 ASP H H -2.042 5.948 -4.144 1.00 . A A . 38 ASP H 1 1 7 6269 1 1 38 ASP HA H -3.280 8.577 -3.726 1.00 . A A . 38 ASP HA 1 1 7 6270 1 1 38 ASP HB2 H -3.307 8.409 -6.148 1.00 . A A . 38 ASP HB2 1 1 7 6271 1 1 38 ASP HB3 H -3.983 6.784 -6.062 1.00 . A A . 38 ASP HB3 1 1 7 6272 1 1 38 ASP N N -2.105 6.918 -4.265 1.00 . A A . 38 ASP N 1 1 7 6273 1 1 38 ASP O O -5.053 5.894 -3.792 1.00 . A A . 38 ASP O 1 1 7 6274 1 1 38 ASP OD1 O -5.755 8.826 -4.488 1.00 . A A . 38 ASP OD1 1 1 7 6275 1 1 38 ASP OD2 O -6.046 8.288 -6.553 1.00 . A A . 38 ASP OD2 1 1 7 6276 1 1 39 VAL C C -6.711 6.222 -1.724 1.00 . A A . 39 VAL C 1 1 7 6277 1 1 39 VAL CA C -5.302 6.278 -1.129 1.00 . A A . 39 VAL CA 1 1 7 6278 1 1 39 VAL CB C -5.345 6.971 0.234 1.00 . A A . 39 VAL CB 1 1 7 6279 1 1 39 VAL CG1 C -3.954 6.940 0.868 1.00 . A A . 39 VAL CG1 1 1 7 6280 1 1 39 VAL CG2 C -5.790 8.424 0.053 1.00 . A A . 39 VAL CG2 1 1 7 6281 1 1 39 VAL H H -3.834 7.755 -1.672 1.00 . A A . 39 VAL H 1 1 7 6282 1 1 39 VAL HA H -4.921 5.274 -1.009 1.00 . A A . 39 VAL HA 1 1 7 6283 1 1 39 VAL HB H -6.042 6.458 0.876 1.00 . A A . 39 VAL HB 1 1 7 6284 1 1 39 VAL HG11 H -3.212 6.782 0.100 1.00 . A A . 39 VAL HG11 1 1 7 6285 1 1 39 VAL HG12 H -3.765 7.880 1.365 1.00 . A A . 39 VAL HG12 1 1 7 6286 1 1 39 VAL HG13 H -3.904 6.137 1.588 1.00 . A A . 39 VAL HG13 1 1 7 6287 1 1 39 VAL HG21 H -5.273 8.858 -0.790 1.00 . A A . 39 VAL HG21 1 1 7 6288 1 1 39 VAL HG22 H -6.856 8.454 -0.123 1.00 . A A . 39 VAL HG22 1 1 7 6289 1 1 39 VAL HG23 H -5.557 8.985 0.946 1.00 . A A . 39 VAL HG23 1 1 7 6290 1 1 39 VAL N N -4.403 7.043 -2.035 1.00 . A A . 39 VAL N 1 1 7 6291 1 1 39 VAL O O -7.498 5.356 -1.398 1.00 . A A . 39 VAL O 1 1 7 6292 1 1 40 GLU C C -8.454 6.068 -4.308 1.00 . A A . 40 GLU C 1 1 7 6293 1 1 40 GLU CA C -8.396 7.130 -3.208 1.00 . A A . 40 GLU CA 1 1 7 6294 1 1 40 GLU CB C -8.684 8.503 -3.814 1.00 . A A . 40 GLU CB 1 1 7 6295 1 1 40 GLU CD C -10.960 9.240 -4.532 1.00 . A A . 40 GLU CD 1 1 7 6296 1 1 40 GLU CG C -10.047 8.998 -3.330 1.00 . A A . 40 GLU CG 1 1 7 6297 1 1 40 GLU H H -6.390 7.828 -2.847 1.00 . A A . 40 GLU H 1 1 7 6298 1 1 40 GLU HA H -9.131 6.908 -2.452 1.00 . A A . 40 GLU HA 1 1 7 6299 1 1 40 GLU HB2 H -7.918 9.200 -3.509 1.00 . A A . 40 GLU HB2 1 1 7 6300 1 1 40 GLU HB3 H -8.694 8.426 -4.891 1.00 . A A . 40 GLU HB3 1 1 7 6301 1 1 40 GLU HG2 H -10.490 8.253 -2.683 1.00 . A A . 40 GLU HG2 1 1 7 6302 1 1 40 GLU HG3 H -9.922 9.920 -2.784 1.00 . A A . 40 GLU HG3 1 1 7 6303 1 1 40 GLU N N -7.037 7.137 -2.595 1.00 . A A . 40 GLU N 1 1 7 6304 1 1 40 GLU O O -9.515 5.668 -4.744 1.00 . A A . 40 GLU O 1 1 7 6305 1 1 40 GLU OE1 O -10.757 8.589 -5.545 1.00 . A A . 40 GLU OE1 1 1 7 6306 1 1 40 GLU OE2 O -11.845 10.071 -4.421 1.00 . A A . 40 GLU OE2 1 1 7 6307 1 1 41 GLY C C -7.636 3.206 -5.248 1.00 . A A . 41 GLY C 1 1 7 6308 1 1 41 GLY CA C -7.309 4.578 -5.839 1.00 . A A . 41 GLY CA 1 1 7 6309 1 1 41 GLY H H -6.474 5.949 -4.401 1.00 . A A . 41 GLY H 1 1 7 6310 1 1 41 GLY HA2 H -8.045 4.833 -6.587 1.00 . A A . 41 GLY HA2 1 1 7 6311 1 1 41 GLY HA3 H -6.331 4.546 -6.295 1.00 . A A . 41 GLY HA3 1 1 7 6312 1 1 41 GLY N N -7.319 5.610 -4.764 1.00 . A A . 41 GLY N 1 1 7 6313 1 1 41 GLY O O -7.656 2.211 -5.946 1.00 . A A . 41 GLY O 1 1 7 6314 1 1 42 ALA C C -9.000 2.038 -2.054 1.00 . A A . 42 ALA C 1 1 7 6315 1 1 42 ALA CA C -8.212 1.822 -3.349 1.00 . A A . 42 ALA CA 1 1 7 6316 1 1 42 ALA CB C -6.914 1.075 -3.036 1.00 . A A . 42 ALA CB 1 1 7 6317 1 1 42 ALA H H -7.870 3.949 -3.420 1.00 . A A . 42 ALA H 1 1 7 6318 1 1 42 ALA HA H -8.806 1.237 -4.035 1.00 . A A . 42 ALA HA 1 1 7 6319 1 1 42 ALA HB1 H -6.350 0.938 -3.947 1.00 . A A . 42 ALA HB1 1 1 7 6320 1 1 42 ALA HB2 H -6.329 1.649 -2.333 1.00 . A A . 42 ALA HB2 1 1 7 6321 1 1 42 ALA HB3 H -7.148 0.112 -2.608 1.00 . A A . 42 ALA HB3 1 1 7 6322 1 1 42 ALA N N -7.891 3.139 -3.970 1.00 . A A . 42 ALA N 1 1 7 6323 1 1 42 ALA O O -8.561 2.727 -1.156 1.00 . A A . 42 ALA O 1 1 7 6324 1 1 43 SER C C -10.146 1.227 0.508 1.00 . A A . 43 SER C 1 1 7 6325 1 1 43 SER CA C -10.979 1.608 -0.719 1.00 . A A . 43 SER CA 1 1 7 6326 1 1 43 SER CB C -12.205 0.698 -0.799 1.00 . A A . 43 SER CB 1 1 7 6327 1 1 43 SER H H -10.492 0.894 -2.690 1.00 . A A . 43 SER H 1 1 7 6328 1 1 43 SER HA H -11.300 2.636 -0.631 1.00 . A A . 43 SER HA 1 1 7 6329 1 1 43 SER HB2 H -12.091 -0.124 -0.114 1.00 . A A . 43 SER HB2 1 1 7 6330 1 1 43 SER HB3 H -13.090 1.263 -0.535 1.00 . A A . 43 SER HB3 1 1 7 6331 1 1 43 SER HG H -13.262 0.144 -2.335 1.00 . A A . 43 SER HG 1 1 7 6332 1 1 43 SER N N -10.160 1.448 -1.953 1.00 . A A . 43 SER N 1 1 7 6333 1 1 43 SER O O -9.119 0.580 0.404 1.00 . A A . 43 SER O 1 1 7 6334 1 1 43 SER OG O -12.328 0.191 -2.121 1.00 . A A . 43 SER OG 1 1 7 6335 1 1 44 GLN C C -9.887 -0.209 3.175 1.00 . A A . 44 GLN C 1 1 7 6336 1 1 44 GLN CA C -9.825 1.299 2.910 1.00 . A A . 44 GLN CA 1 1 7 6337 1 1 44 GLN CB C -10.437 2.052 4.095 1.00 . A A . 44 GLN CB 1 1 7 6338 1 1 44 GLN CD C -12.531 2.339 5.427 1.00 . A A . 44 GLN CD 1 1 7 6339 1 1 44 GLN CG C -11.772 1.410 4.477 1.00 . A A . 44 GLN CG 1 1 7 6340 1 1 44 GLN H H -11.411 2.146 1.730 1.00 . A A . 44 GLN H 1 1 7 6341 1 1 44 GLN HA H -8.794 1.598 2.790 1.00 . A A . 44 GLN HA 1 1 7 6342 1 1 44 GLN HB2 H -9.760 2.008 4.937 1.00 . A A . 44 GLN HB2 1 1 7 6343 1 1 44 GLN HB3 H -10.600 3.082 3.819 1.00 . A A . 44 GLN HB3 1 1 7 6344 1 1 44 GLN HE21 H -13.728 0.904 6.099 1.00 . A A . 44 GLN HE21 1 1 7 6345 1 1 44 GLN HE22 H -13.988 2.441 6.772 1.00 . A A . 44 GLN HE22 1 1 7 6346 1 1 44 GLN HG2 H -12.360 1.246 3.587 1.00 . A A . 44 GLN HG2 1 1 7 6347 1 1 44 GLN HG3 H -11.590 0.466 4.968 1.00 . A A . 44 GLN HG3 1 1 7 6348 1 1 44 GLN N N -10.582 1.626 1.671 1.00 . A A . 44 GLN N 1 1 7 6349 1 1 44 GLN NE2 N -13.495 1.854 6.160 1.00 . A A . 44 GLN NE2 1 1 7 6350 1 1 44 GLN O O -8.912 -0.815 3.576 1.00 . A A . 44 GLN O 1 1 7 6351 1 1 44 GLN OE1 O -12.243 3.516 5.503 1.00 . A A . 44 GLN OE1 1 1 7 6352 1 1 45 GLU C C -10.366 -3.048 2.130 1.00 . A A . 45 GLU C 1 1 7 6353 1 1 45 GLU CA C -11.125 -2.287 3.215 1.00 . A A . 45 GLU CA 1 1 7 6354 1 1 45 GLU CB C -12.591 -2.715 3.212 1.00 . A A . 45 GLU CB 1 1 7 6355 1 1 45 GLU CD C -14.006 -2.553 5.263 1.00 . A A . 45 GLU CD 1 1 7 6356 1 1 45 GLU CG C -13.400 -1.769 4.099 1.00 . A A . 45 GLU CG 1 1 7 6357 1 1 45 GLU H H -11.799 -0.320 2.643 1.00 . A A . 45 GLU H 1 1 7 6358 1 1 45 GLU HA H -10.682 -2.509 4.178 1.00 . A A . 45 GLU HA 1 1 7 6359 1 1 45 GLU HB2 H -12.974 -2.681 2.202 1.00 . A A . 45 GLU HB2 1 1 7 6360 1 1 45 GLU HB3 H -12.670 -3.721 3.594 1.00 . A A . 45 GLU HB3 1 1 7 6361 1 1 45 GLU HG2 H -12.752 -0.994 4.485 1.00 . A A . 45 GLU HG2 1 1 7 6362 1 1 45 GLU HG3 H -14.193 -1.321 3.519 1.00 . A A . 45 GLU HG3 1 1 7 6363 1 1 45 GLU N N -11.020 -0.821 2.962 1.00 . A A . 45 GLU N 1 1 7 6364 1 1 45 GLU O O -9.869 -4.134 2.355 1.00 . A A . 45 GLU O 1 1 7 6365 1 1 45 GLU OE1 O -14.411 -3.683 5.044 1.00 . A A . 45 GLU OE1 1 1 7 6366 1 1 45 GLU OE2 O -14.057 -2.011 6.355 1.00 . A A . 45 GLU OE2 1 1 7 6367 1 1 46 GLU C C -8.003 -2.786 0.166 1.00 . A A . 46 GLU C 1 1 7 6368 1 1 46 GLU CA C -9.450 -3.157 -0.091 1.00 . A A . 46 GLU CA 1 1 7 6369 1 1 46 GLU CB C -9.918 -2.675 -1.472 1.00 . A A . 46 GLU CB 1 1 7 6370 1 1 46 GLU CD C -9.446 -1.082 -3.335 1.00 . A A . 46 GLU CD 1 1 7 6371 1 1 46 GLU CG C -9.249 -1.350 -1.841 1.00 . A A . 46 GLU CG 1 1 7 6372 1 1 46 GLU H H -10.595 -1.581 0.813 1.00 . A A . 46 GLU H 1 1 7 6373 1 1 46 GLU HA H -9.572 -4.227 -0.010 1.00 . A A . 46 GLU HA 1 1 7 6374 1 1 46 GLU HB2 H -9.673 -3.420 -2.214 1.00 . A A . 46 GLU HB2 1 1 7 6375 1 1 46 GLU HB3 H -10.985 -2.533 -1.445 1.00 . A A . 46 GLU HB3 1 1 7 6376 1 1 46 GLU HG2 H -9.694 -0.554 -1.267 1.00 . A A . 46 GLU HG2 1 1 7 6377 1 1 46 GLU HG3 H -8.197 -1.405 -1.624 1.00 . A A . 46 GLU HG3 1 1 7 6378 1 1 46 GLU N N -10.227 -2.476 0.970 1.00 . A A . 46 GLU N 1 1 7 6379 1 1 46 GLU O O -7.085 -3.547 -0.066 1.00 . A A . 46 GLU O 1 1 7 6380 1 1 46 GLU OE1 O -10.580 -0.885 -3.736 1.00 . A A . 46 GLU OE1 1 1 7 6381 1 1 46 GLU OE2 O -8.457 -1.077 -4.051 1.00 . A A . 46 GLU OE2 1 1 7 6382 1 1 47 VAL C C -5.913 -2.043 2.149 1.00 . A A . 47 VAL C 1 1 7 6383 1 1 47 VAL CA C -6.457 -1.144 1.031 1.00 . A A . 47 VAL CA 1 1 7 6384 1 1 47 VAL CB C -6.539 0.315 1.504 1.00 . A A . 47 VAL CB 1 1 7 6385 1 1 47 VAL CG1 C -5.381 0.632 2.451 1.00 . A A . 47 VAL CG1 1 1 7 6386 1 1 47 VAL CG2 C -6.466 1.245 0.290 1.00 . A A . 47 VAL CG2 1 1 7 6387 1 1 47 VAL H H -8.593 -1.044 0.885 1.00 . A A . 47 VAL H 1 1 7 6388 1 1 47 VAL HA H -5.818 -1.213 0.163 1.00 . A A . 47 VAL HA 1 1 7 6389 1 1 47 VAL HB H -7.474 0.472 2.021 1.00 . A A . 47 VAL HB 1 1 7 6390 1 1 47 VAL HG11 H -4.468 0.215 2.055 1.00 . A A . 47 VAL HG11 1 1 7 6391 1 1 47 VAL HG12 H -5.280 1.702 2.546 1.00 . A A . 47 VAL HG12 1 1 7 6392 1 1 47 VAL HG13 H -5.584 0.201 3.420 1.00 . A A . 47 VAL HG13 1 1 7 6393 1 1 47 VAL HG21 H -7.228 0.966 -0.423 1.00 . A A . 47 VAL HG21 1 1 7 6394 1 1 47 VAL HG22 H -6.626 2.264 0.607 1.00 . A A . 47 VAL HG22 1 1 7 6395 1 1 47 VAL HG23 H -5.493 1.159 -0.170 1.00 . A A . 47 VAL HG23 1 1 7 6396 1 1 47 VAL N N -7.819 -1.610 0.691 1.00 . A A . 47 VAL N 1 1 7 6397 1 1 47 VAL O O -4.735 -2.337 2.203 1.00 . A A . 47 VAL O 1 1 7 6398 1 1 48 GLU C C -6.002 -4.765 3.585 1.00 . A A . 48 GLU C 1 1 7 6399 1 1 48 GLU CA C -6.282 -3.374 4.140 1.00 . A A . 48 GLU CA 1 1 7 6400 1 1 48 GLU CB C -7.315 -3.475 5.272 1.00 . A A . 48 GLU CB 1 1 7 6401 1 1 48 GLU CD C -9.709 -3.643 5.903 1.00 . A A . 48 GLU CD 1 1 7 6402 1 1 48 GLU CG C -8.707 -3.805 4.755 1.00 . A A . 48 GLU CG 1 1 7 6403 1 1 48 GLU H H -7.711 -2.247 2.979 1.00 . A A . 48 GLU H 1 1 7 6404 1 1 48 GLU HA H -5.363 -2.965 4.536 1.00 . A A . 48 GLU HA 1 1 7 6405 1 1 48 GLU HB2 H -7.011 -4.255 5.942 1.00 . A A . 48 GLU HB2 1 1 7 6406 1 1 48 GLU HB3 H -7.357 -2.541 5.798 1.00 . A A . 48 GLU HB3 1 1 7 6407 1 1 48 GLU HG2 H -8.963 -3.138 3.953 1.00 . A A . 48 GLU HG2 1 1 7 6408 1 1 48 GLU HG3 H -8.733 -4.820 4.412 1.00 . A A . 48 GLU HG3 1 1 7 6409 1 1 48 GLU N N -6.765 -2.489 3.040 1.00 . A A . 48 GLU N 1 1 7 6410 1 1 48 GLU O O -4.907 -5.279 3.699 1.00 . A A . 48 GLU O 1 1 7 6411 1 1 48 GLU OE1 O -9.942 -2.515 6.303 1.00 . A A . 48 GLU OE1 1 1 7 6412 1 1 48 GLU OE2 O -10.222 -4.650 6.362 1.00 . A A . 48 GLU OE2 1 1 7 6413 1 1 49 GLU C C -5.416 -6.790 1.723 1.00 . A A . 49 GLU C 1 1 7 6414 1 1 49 GLU CA C -6.783 -6.734 2.409 1.00 . A A . 49 GLU CA 1 1 7 6415 1 1 49 GLU CB C -7.884 -7.025 1.387 1.00 . A A . 49 GLU CB 1 1 7 6416 1 1 49 GLU CD C -8.513 -8.555 -0.484 1.00 . A A . 49 GLU CD 1 1 7 6417 1 1 49 GLU CG C -7.670 -8.415 0.785 1.00 . A A . 49 GLU CG 1 1 7 6418 1 1 49 GLU H H -7.849 -4.932 2.912 1.00 . A A . 49 GLU H 1 1 7 6419 1 1 49 GLU HA H -6.818 -7.469 3.200 1.00 . A A . 49 GLU HA 1 1 7 6420 1 1 49 GLU HB2 H -8.846 -6.987 1.875 1.00 . A A . 49 GLU HB2 1 1 7 6421 1 1 49 GLU HB3 H -7.849 -6.285 0.601 1.00 . A A . 49 GLU HB3 1 1 7 6422 1 1 49 GLU HG2 H -6.626 -8.545 0.542 1.00 . A A . 49 GLU HG2 1 1 7 6423 1 1 49 GLU HG3 H -7.971 -9.167 1.499 1.00 . A A . 49 GLU HG3 1 1 7 6424 1 1 49 GLU N N -6.982 -5.374 2.984 1.00 . A A . 49 GLU N 1 1 7 6425 1 1 49 GLU O O -4.709 -7.776 1.799 1.00 . A A . 49 GLU O 1 1 7 6426 1 1 49 GLU OE1 O -9.251 -7.631 -0.788 1.00 . A A . 49 GLU OE1 1 1 7 6427 1 1 49 GLU OE2 O -8.406 -9.583 -1.132 1.00 . A A . 49 GLU OE2 1 1 7 6428 1 1 50 ALA C C -2.615 -5.716 1.468 1.00 . A A . 50 ALA C 1 1 7 6429 1 1 50 ALA CA C -3.703 -5.703 0.395 1.00 . A A . 50 ALA CA 1 1 7 6430 1 1 50 ALA CB C -3.573 -4.423 -0.437 1.00 . A A . 50 ALA CB 1 1 7 6431 1 1 50 ALA H H -5.612 -4.939 1.033 1.00 . A A . 50 ALA H 1 1 7 6432 1 1 50 ALA HA H -3.602 -6.569 -0.247 1.00 . A A . 50 ALA HA 1 1 7 6433 1 1 50 ALA HB1 H -4.536 -3.940 -0.511 1.00 . A A . 50 ALA HB1 1 1 7 6434 1 1 50 ALA HB2 H -2.874 -3.754 0.044 1.00 . A A . 50 ALA HB2 1 1 7 6435 1 1 50 ALA HB3 H -3.213 -4.668 -1.425 1.00 . A A . 50 ALA HB3 1 1 7 6436 1 1 50 ALA N N -5.031 -5.727 1.069 1.00 . A A . 50 ALA N 1 1 7 6437 1 1 50 ALA O O -1.614 -6.397 1.352 1.00 . A A . 50 ALA O 1 1 7 6438 1 1 51 MET C C -1.690 -6.302 4.251 1.00 . A A . 51 MET C 1 1 7 6439 1 1 51 MET CA C -1.812 -4.915 3.617 1.00 . A A . 51 MET CA 1 1 7 6440 1 1 51 MET CB C -2.275 -3.902 4.668 1.00 . A A . 51 MET CB 1 1 7 6441 1 1 51 MET CE C -2.304 -1.926 7.432 1.00 . A A . 51 MET CE 1 1 7 6442 1 1 51 MET CG C -1.363 -3.962 5.896 1.00 . A A . 51 MET CG 1 1 7 6443 1 1 51 MET H H -3.633 -4.429 2.581 1.00 . A A . 51 MET H 1 1 7 6444 1 1 51 MET HA H -0.854 -4.613 3.219 1.00 . A A . 51 MET HA 1 1 7 6445 1 1 51 MET HB2 H -2.242 -2.908 4.247 1.00 . A A . 51 MET HB2 1 1 7 6446 1 1 51 MET HB3 H -3.287 -4.132 4.965 1.00 . A A . 51 MET HB3 1 1 7 6447 1 1 51 MET HE1 H -1.286 -1.591 7.323 1.00 . A A . 51 MET HE1 1 1 7 6448 1 1 51 MET HE2 H -2.900 -1.532 6.618 1.00 . A A . 51 MET HE2 1 1 7 6449 1 1 51 MET HE3 H -2.698 -1.576 8.375 1.00 . A A . 51 MET HE3 1 1 7 6450 1 1 51 MET HG2 H -0.868 -4.920 5.933 1.00 . A A . 51 MET HG2 1 1 7 6451 1 1 51 MET HG3 H -0.624 -3.178 5.834 1.00 . A A . 51 MET HG3 1 1 7 6452 1 1 51 MET N N -2.815 -4.964 2.516 1.00 . A A . 51 MET N 1 1 7 6453 1 1 51 MET O O -0.604 -6.807 4.458 1.00 . A A . 51 MET O 1 1 7 6454 1 1 51 MET SD S -2.355 -3.736 7.393 1.00 . A A . 51 MET SD 1 1 7 6455 1 1 52 ASP C C -2.043 -9.246 4.219 1.00 . A A . 52 ASP C 1 1 7 6456 1 1 52 ASP CA C -2.738 -8.278 5.180 1.00 . A A . 52 ASP CA 1 1 7 6457 1 1 52 ASP CB C -4.159 -8.769 5.465 1.00 . A A . 52 ASP CB 1 1 7 6458 1 1 52 ASP CG C -4.292 -9.113 6.950 1.00 . A A . 52 ASP CG 1 1 7 6459 1 1 52 ASP H H -3.662 -6.502 4.384 1.00 . A A . 52 ASP H 1 1 7 6460 1 1 52 ASP HA H -2.182 -8.228 6.105 1.00 . A A . 52 ASP HA 1 1 7 6461 1 1 52 ASP HB2 H -4.865 -7.992 5.210 1.00 . A A . 52 ASP HB2 1 1 7 6462 1 1 52 ASP HB3 H -4.362 -9.649 4.873 1.00 . A A . 52 ASP HB3 1 1 7 6463 1 1 52 ASP N N -2.795 -6.925 4.561 1.00 . A A . 52 ASP N 1 1 7 6464 1 1 52 ASP O O -1.378 -10.175 4.632 1.00 . A A . 52 ASP O 1 1 7 6465 1 1 52 ASP OD1 O -3.627 -10.038 7.384 1.00 . A A . 52 ASP OD1 1 1 7 6466 1 1 52 ASP OD2 O -5.056 -8.444 7.626 1.00 . A A . 52 ASP OD2 1 1 7 6467 1 1 53 THR C C -0.230 -9.295 1.470 1.00 . A A . 53 THR C 1 1 7 6468 1 1 53 THR CA C -1.533 -9.937 1.952 1.00 . A A . 53 THR CA 1 1 7 6469 1 1 53 THR CB C -2.469 -10.156 0.761 1.00 . A A . 53 THR CB 1 1 7 6470 1 1 53 THR CG2 C -1.765 -11.014 -0.292 1.00 . A A . 53 THR CG2 1 1 7 6471 1 1 53 THR H H -2.727 -8.274 2.627 1.00 . A A . 53 THR H 1 1 7 6472 1 1 53 THR HA H -1.316 -10.885 2.420 1.00 . A A . 53 THR HA 1 1 7 6473 1 1 53 THR HB H -2.729 -9.204 0.325 1.00 . A A . 53 THR HB 1 1 7 6474 1 1 53 THR HG1 H -3.431 -11.309 1.995 1.00 . A A . 53 THR HG1 1 1 7 6475 1 1 53 THR HG21 H -0.725 -10.730 -0.352 1.00 . A A . 53 THR HG21 1 1 7 6476 1 1 53 THR HG22 H -1.838 -12.056 -0.015 1.00 . A A . 53 THR HG22 1 1 7 6477 1 1 53 THR HG23 H -2.236 -10.865 -1.253 1.00 . A A . 53 THR HG23 1 1 7 6478 1 1 53 THR N N -2.189 -9.032 2.939 1.00 . A A . 53 THR N 1 1 7 6479 1 1 53 THR O O -0.204 -8.584 0.484 1.00 . A A . 53 THR O 1 1 7 6480 1 1 53 THR OG1 O -3.647 -10.815 1.201 1.00 . A A . 53 THR OG1 1 1 7 6481 1 1 54 CYS C C 3.301 -9.709 2.394 1.00 . A A . 54 CYS C 1 1 7 6482 1 1 54 CYS CA C 2.152 -8.931 1.746 1.00 . A A . 54 CYS CA 1 1 7 6483 1 1 54 CYS CB C 2.197 -7.473 2.215 1.00 . A A . 54 CYS CB 1 1 7 6484 1 1 54 CYS H H 0.809 -10.105 2.954 1.00 . A A . 54 CYS H 1 1 7 6485 1 1 54 CYS HA H 2.246 -8.969 0.671 1.00 . A A . 54 CYS HA 1 1 7 6486 1 1 54 CYS HB2 H 1.474 -6.894 1.665 1.00 . A A . 54 CYS HB2 1 1 7 6487 1 1 54 CYS HB3 H 1.951 -7.436 3.264 1.00 . A A . 54 CYS HB3 1 1 7 6488 1 1 54 CYS N N 0.852 -9.534 2.160 1.00 . A A . 54 CYS N 1 1 7 6489 1 1 54 CYS O O 3.179 -10.177 3.508 1.00 . A A . 54 CYS O 1 1 7 6490 1 1 54 CYS SG S 3.804 -6.615 2.018 1.00 . A A . 54 CYS SG 1 1 7 6491 1 1 55 PRO C C 6.223 -9.702 3.317 1.00 . A A . 55 PRO C 1 1 7 6492 1 1 55 PRO CA C 5.581 -10.528 2.202 1.00 . A A . 55 PRO CA 1 1 7 6493 1 1 55 PRO CB C 6.505 -10.637 0.987 1.00 . A A . 55 PRO CB 1 1 7 6494 1 1 55 PRO CD C 4.616 -9.268 0.333 1.00 . A A . 55 PRO CD 1 1 7 6495 1 1 55 PRO CG C 6.091 -9.508 0.094 1.00 . A A . 55 PRO CG 1 1 7 6496 1 1 55 PRO HA H 5.311 -11.510 2.556 1.00 . A A . 55 PRO HA 1 1 7 6497 1 1 55 PRO HB2 H 7.533 -10.547 1.313 1.00 . A A . 55 PRO HB2 1 1 7 6498 1 1 55 PRO HB3 H 6.361 -11.592 0.510 1.00 . A A . 55 PRO HB3 1 1 7 6499 1 1 55 PRO HD2 H 4.397 -8.211 0.300 1.00 . A A . 55 PRO HD2 1 1 7 6500 1 1 55 PRO HD3 H 4.023 -9.803 -0.392 1.00 . A A . 55 PRO HD3 1 1 7 6501 1 1 55 PRO HG2 H 6.659 -8.621 0.342 1.00 . A A . 55 PRO HG2 1 1 7 6502 1 1 55 PRO HG3 H 6.254 -9.779 -0.937 1.00 . A A . 55 PRO HG3 1 1 7 6503 1 1 55 PRO N N 4.390 -9.809 1.677 1.00 . A A . 55 PRO N 1 1 7 6504 1 1 55 PRO O O 6.910 -8.732 3.066 1.00 . A A . 55 PRO O 1 1 7 6505 1 1 56 VAL C C 5.634 -8.080 5.962 1.00 . A A . 56 VAL C 1 1 7 6506 1 1 56 VAL CA C 6.540 -9.295 5.694 1.00 . A A . 56 VAL CA 1 1 7 6507 1 1 56 VAL CB C 7.986 -8.858 5.373 1.00 . A A . 56 VAL CB 1 1 7 6508 1 1 56 VAL CG1 C 8.037 -7.388 4.938 1.00 . A A . 56 VAL CG1 1 1 7 6509 1 1 56 VAL CG2 C 8.856 -9.043 6.619 1.00 . A A . 56 VAL CG2 1 1 7 6510 1 1 56 VAL H H 5.401 -10.840 4.719 1.00 . A A . 56 VAL H 1 1 7 6511 1 1 56 VAL HA H 6.546 -9.927 6.572 1.00 . A A . 56 VAL HA 1 1 7 6512 1 1 56 VAL HB H 8.372 -9.476 4.575 1.00 . A A . 56 VAL HB 1 1 7 6513 1 1 56 VAL HG11 H 7.122 -7.132 4.424 1.00 . A A . 56 VAL HG11 1 1 7 6514 1 1 56 VAL HG12 H 8.149 -6.759 5.809 1.00 . A A . 56 VAL HG12 1 1 7 6515 1 1 56 VAL HG13 H 8.876 -7.237 4.275 1.00 . A A . 56 VAL HG13 1 1 7 6516 1 1 56 VAL HG21 H 8.537 -9.926 7.154 1.00 . A A . 56 VAL HG21 1 1 7 6517 1 1 56 VAL HG22 H 9.889 -9.155 6.324 1.00 . A A . 56 VAL HG22 1 1 7 6518 1 1 56 VAL HG23 H 8.756 -8.179 7.260 1.00 . A A . 56 VAL HG23 1 1 7 6519 1 1 56 VAL N N 5.977 -10.066 4.547 1.00 . A A . 56 VAL N 1 1 7 6520 1 1 56 VAL O O 5.776 -7.392 6.952 1.00 . A A . 56 VAL O 1 1 7 6521 1 1 57 GLN C C 4.533 -5.356 5.255 1.00 . A A . 57 GLN C 1 1 7 6522 1 1 57 GLN CA C 3.766 -6.679 5.273 1.00 . A A . 57 GLN CA 1 1 7 6523 1 1 57 GLN CB C 3.033 -6.829 6.603 1.00 . A A . 57 GLN CB 1 1 7 6524 1 1 57 GLN CD C 0.966 -6.000 7.735 1.00 . A A . 57 GLN CD 1 1 7 6525 1 1 57 GLN CG C 1.560 -6.468 6.406 1.00 . A A . 57 GLN CG 1 1 7 6526 1 1 57 GLN H H 4.595 -8.402 4.300 1.00 . A A . 57 GLN H 1 1 7 6527 1 1 57 GLN HA H 3.044 -6.675 4.472 1.00 . A A . 57 GLN HA 1 1 7 6528 1 1 57 GLN HB2 H 3.114 -7.853 6.944 1.00 . A A . 57 GLN HB2 1 1 7 6529 1 1 57 GLN HB3 H 3.472 -6.169 7.335 1.00 . A A . 57 GLN HB3 1 1 7 6530 1 1 57 GLN HE21 H 1.138 -4.071 7.294 1.00 . A A . 57 GLN HE21 1 1 7 6531 1 1 57 GLN HE22 H 0.467 -4.411 8.815 1.00 . A A . 57 GLN HE22 1 1 7 6532 1 1 57 GLN HG2 H 1.481 -5.675 5.675 1.00 . A A . 57 GLN HG2 1 1 7 6533 1 1 57 GLN HG3 H 1.020 -7.335 6.056 1.00 . A A . 57 GLN HG3 1 1 7 6534 1 1 57 GLN N N 4.696 -7.828 5.084 1.00 . A A . 57 GLN N 1 1 7 6535 1 1 57 GLN NE2 N 0.847 -4.721 7.967 1.00 . A A . 57 GLN NE2 1 1 7 6536 1 1 57 GLN O O 5.674 -5.274 5.664 1.00 . A A . 57 GLN O 1 1 7 6537 1 1 57 GLN OE1 O 0.606 -6.804 8.570 1.00 . A A . 57 GLN OE1 1 1 7 6538 1 1 58 CYS C C 3.496 -1.884 4.895 1.00 . A A . 58 CYS C 1 1 7 6539 1 1 58 CYS CA C 4.555 -2.981 4.724 1.00 . A A . 58 CYS CA 1 1 7 6540 1 1 58 CYS CB C 5.256 -2.810 3.377 1.00 . A A . 58 CYS CB 1 1 7 6541 1 1 58 CYS H H 2.978 -4.422 4.462 1.00 . A A . 58 CYS H 1 1 7 6542 1 1 58 CYS HA H 5.284 -2.906 5.520 1.00 . A A . 58 CYS HA 1 1 7 6543 1 1 58 CYS HB2 H 5.468 -1.763 3.212 1.00 . A A . 58 CYS HB2 1 1 7 6544 1 1 58 CYS HB3 H 6.180 -3.368 3.379 1.00 . A A . 58 CYS HB3 1 1 7 6545 1 1 58 CYS HG H 3.485 -2.776 1.918 1.00 . A A . 58 CYS HG 1 1 7 6546 1 1 58 CYS N N 3.897 -4.318 4.781 1.00 . A A . 58 CYS N 1 1 7 6547 1 1 58 CYS O O 3.750 -0.853 5.483 1.00 . A A . 58 CYS O 1 1 7 6548 1 1 58 CYS SG S 4.182 -3.421 2.055 1.00 . A A . 58 CYS SG 1 1 7 6549 1 1 59 ILE C C 0.997 -0.776 6.007 1.00 . A A . 59 ILE C 1 1 7 6550 1 1 59 ILE CA C 1.240 -1.062 4.522 1.00 . A A . 59 ILE CA 1 1 7 6551 1 1 59 ILE CB C -0.059 -1.573 3.879 1.00 . A A . 59 ILE CB 1 1 7 6552 1 1 59 ILE CD1 C -1.261 -1.932 1.718 1.00 . A A . 59 ILE CD1 1 1 7 6553 1 1 59 ILE CG1 C 0.021 -1.402 2.362 1.00 . A A . 59 ILE CG1 1 1 7 6554 1 1 59 ILE CG2 C -1.255 -0.774 4.407 1.00 . A A . 59 ILE CG2 1 1 7 6555 1 1 59 ILE H H 2.119 -2.930 3.911 1.00 . A A . 59 ILE H 1 1 7 6556 1 1 59 ILE HA H 1.551 -0.153 4.030 1.00 . A A . 59 ILE HA 1 1 7 6557 1 1 59 ILE HB H -0.191 -2.619 4.118 1.00 . A A . 59 ILE HB 1 1 7 6558 1 1 59 ILE HD11 H -1.557 -2.849 2.206 1.00 . A A . 59 ILE HD11 1 1 7 6559 1 1 59 ILE HD12 H -2.046 -1.198 1.824 1.00 . A A . 59 ILE HD12 1 1 7 6560 1 1 59 ILE HD13 H -1.085 -2.122 0.669 1.00 . A A . 59 ILE HD13 1 1 7 6561 1 1 59 ILE HG12 H 0.137 -0.355 2.125 1.00 . A A . 59 ILE HG12 1 1 7 6562 1 1 59 ILE HG13 H 0.866 -1.955 1.982 1.00 . A A . 59 ILE HG13 1 1 7 6563 1 1 59 ILE HG21 H -1.022 0.281 4.384 1.00 . A A . 59 ILE HG21 1 1 7 6564 1 1 59 ILE HG22 H -2.119 -0.966 3.789 1.00 . A A . 59 ILE HG22 1 1 7 6565 1 1 59 ILE HG23 H -1.467 -1.072 5.423 1.00 . A A . 59 ILE HG23 1 1 7 6566 1 1 59 ILE N N 2.308 -2.095 4.384 1.00 . A A . 59 ILE N 1 1 7 6567 1 1 59 ILE O O 1.220 -1.613 6.860 1.00 . A A . 59 ILE O 1 1 7 6568 1 1 60 HIS C C -0.738 1.918 7.761 1.00 . A A . 60 HIS C 1 1 7 6569 1 1 60 HIS CA C 0.251 0.754 7.732 1.00 . A A . 60 HIS CA 1 1 7 6570 1 1 60 HIS CB C 1.545 1.178 8.429 1.00 . A A . 60 HIS CB 1 1 7 6571 1 1 60 HIS CD2 C 2.498 -1.185 9.076 1.00 . A A . 60 HIS CD2 1 1 7 6572 1 1 60 HIS CE1 C 4.352 -1.090 7.956 1.00 . A A . 60 HIS CE1 1 1 7 6573 1 1 60 HIS CG C 2.518 0.032 8.441 1.00 . A A . 60 HIS CG 1 1 7 6574 1 1 60 HIS H H 0.350 1.052 5.605 1.00 . A A . 60 HIS H 1 1 7 6575 1 1 60 HIS HA H -0.175 -0.097 8.241 1.00 . A A . 60 HIS HA 1 1 7 6576 1 1 60 HIS HB2 H 1.980 2.015 7.902 1.00 . A A . 60 HIS HB2 1 1 7 6577 1 1 60 HIS HB3 H 1.322 1.471 9.444 1.00 . A A . 60 HIS HB3 1 1 7 6578 1 1 60 HIS HD1 H 4.026 0.808 7.171 1.00 . A A . 60 HIS HD1 1 1 7 6579 1 1 60 HIS HD2 H 1.703 -1.538 9.716 1.00 . A A . 60 HIS HD2 1 1 7 6580 1 1 60 HIS HE1 H 5.312 -1.343 7.526 1.00 . A A . 60 HIS HE1 1 1 7 6581 1 1 60 HIS N N 0.529 0.400 6.314 1.00 . A A . 60 HIS N 1 1 7 6582 1 1 60 HIS ND1 N 3.709 0.070 7.733 1.00 . A A . 60 HIS ND1 1 1 7 6583 1 1 60 HIS NE2 N 3.657 -1.892 8.769 1.00 . A A . 60 HIS NE2 1 1 7 6584 1 1 60 HIS O O -0.507 2.952 7.168 1.00 . A A . 60 HIS O 1 1 7 6585 1 1 61 TRP C C -2.130 4.140 9.000 1.00 . A A . 61 TRP C 1 1 7 6586 1 1 61 TRP CA C -2.825 2.876 8.499 1.00 . A A . 61 TRP CA 1 1 7 6587 1 1 61 TRP CB C -3.970 2.516 9.449 1.00 . A A . 61 TRP CB 1 1 7 6588 1 1 61 TRP CD1 C -4.434 0.038 9.145 1.00 . A A . 61 TRP CD1 1 1 7 6589 1 1 61 TRP CD2 C -5.926 1.357 8.117 1.00 . A A . 61 TRP CD2 1 1 7 6590 1 1 61 TRP CE2 C -6.331 0.029 7.862 1.00 . A A . 61 TRP CE2 1 1 7 6591 1 1 61 TRP CE3 C -6.684 2.400 7.589 1.00 . A A . 61 TRP CE3 1 1 7 6592 1 1 61 TRP CG C -4.732 1.341 8.928 1.00 . A A . 61 TRP CG 1 1 7 6593 1 1 61 TRP CH2 C -8.220 0.807 6.575 1.00 . A A . 61 TRP CH2 1 1 7 6594 1 1 61 TRP CZ2 C -7.467 -0.250 7.098 1.00 . A A . 61 TRP CZ2 1 1 7 6595 1 1 61 TRP CZ3 C -7.828 2.133 6.819 1.00 . A A . 61 TRP CZ3 1 1 7 6596 1 1 61 TRP H H -2.008 0.926 8.921 1.00 . A A . 61 TRP H 1 1 7 6597 1 1 61 TRP HA H -3.219 3.058 7.511 1.00 . A A . 61 TRP HA 1 1 7 6598 1 1 61 TRP HB2 H -3.578 2.283 10.415 1.00 . A A . 61 TRP HB2 1 1 7 6599 1 1 61 TRP HB3 H -4.638 3.361 9.532 1.00 . A A . 61 TRP HB3 1 1 7 6600 1 1 61 TRP HD1 H -3.595 -0.330 9.716 1.00 . A A . 61 TRP HD1 1 1 7 6601 1 1 61 TRP HE1 H -5.408 -1.724 8.511 1.00 . A A . 61 TRP HE1 1 1 7 6602 1 1 61 TRP HE3 H -6.375 3.416 7.778 1.00 . A A . 61 TRP HE3 1 1 7 6603 1 1 61 TRP HH2 H -9.100 0.604 5.983 1.00 . A A . 61 TRP HH2 1 1 7 6604 1 1 61 TRP HZ2 H -7.767 -1.272 6.916 1.00 . A A . 61 TRP HZ2 1 1 7 6605 1 1 61 TRP HZ3 H -8.408 2.949 6.416 1.00 . A A . 61 TRP HZ3 1 1 7 6606 1 1 61 TRP N N -1.836 1.765 8.445 1.00 . A A . 61 TRP N 1 1 7 6607 1 1 61 TRP NE1 N -5.389 -0.745 8.510 1.00 . A A . 61 TRP NE1 1 1 7 6608 1 1 61 TRP O O -0.994 4.107 9.432 1.00 . A A . 61 TRP O 1 1 7 6609 1 1 62 GLU C C -3.187 7.307 10.249 1.00 . A A . 62 GLU C 1 1 7 6610 1 1 62 GLU CA C -2.173 6.522 9.411 1.00 . A A . 62 GLU CA 1 1 7 6611 1 1 62 GLU CB C -1.736 7.343 8.188 1.00 . A A . 62 GLU CB 1 1 7 6612 1 1 62 GLU CD C -0.288 9.369 7.969 1.00 . A A . 62 GLU CD 1 1 7 6613 1 1 62 GLU CG C -1.583 8.818 8.570 1.00 . A A . 62 GLU CG 1 1 7 6614 1 1 62 GLU H H -3.712 5.262 8.588 1.00 . A A . 62 GLU H 1 1 7 6615 1 1 62 GLU HA H -1.309 6.292 10.017 1.00 . A A . 62 GLU HA 1 1 7 6616 1 1 62 GLU HB2 H -0.789 6.966 7.828 1.00 . A A . 62 GLU HB2 1 1 7 6617 1 1 62 GLU HB3 H -2.477 7.248 7.407 1.00 . A A . 62 GLU HB3 1 1 7 6618 1 1 62 GLU HG2 H -2.424 9.377 8.187 1.00 . A A . 62 GLU HG2 1 1 7 6619 1 1 62 GLU HG3 H -1.546 8.910 9.644 1.00 . A A . 62 GLU HG3 1 1 7 6620 1 1 62 GLU N N -2.799 5.256 8.943 1.00 . A A . 62 GLU N 1 1 7 6621 1 1 62 GLU O O -3.982 8.065 9.732 1.00 . A A . 62 GLU O 1 1 7 6622 1 1 62 GLU OE1 O 0.235 8.743 7.062 1.00 . A A . 62 GLU OE1 1 1 7 6623 1 1 62 GLU OE2 O 0.158 10.408 8.428 1.00 . A A . 62 GLU OE2 1 1 7 6624 1 1 63 ASP C C -3.503 9.194 12.850 1.00 . A A . 63 ASP C 1 1 7 6625 1 1 63 ASP CA C -4.124 7.865 12.417 1.00 . A A . 63 ASP CA 1 1 7 6626 1 1 63 ASP CB C -4.436 7.023 13.656 1.00 . A A . 63 ASP CB 1 1 7 6627 1 1 63 ASP CG C -4.411 5.538 13.291 1.00 . A A . 63 ASP CG 1 1 7 6628 1 1 63 ASP H H -2.514 6.513 11.943 1.00 . A A . 63 ASP H 1 1 7 6629 1 1 63 ASP HA H -5.036 8.053 11.870 1.00 . A A . 63 ASP HA 1 1 7 6630 1 1 63 ASP HB2 H -3.696 7.219 14.419 1.00 . A A . 63 ASP HB2 1 1 7 6631 1 1 63 ASP HB3 H -5.415 7.283 14.030 1.00 . A A . 63 ASP HB3 1 1 7 6632 1 1 63 ASP N N -3.164 7.130 11.545 1.00 . A A . 63 ASP N 1 1 7 6633 1 1 63 ASP O O -2.352 9.257 13.234 1.00 . A A . 63 ASP O 1 1 7 6634 1 1 63 ASP OD1 O -3.329 4.977 13.245 1.00 . A A . 63 ASP OD1 1 1 7 6635 1 1 63 ASP OD2 O -5.476 4.986 13.064 1.00 . A A . 63 ASP OD2 1 1 7 6636 1 1 64 GLU C C -4.848 12.594 13.315 1.00 . A A . 64 GLU C 1 1 7 6637 1 1 64 GLU CA C -3.707 11.581 13.202 1.00 . A A . 64 GLU CA 1 1 7 6638 1 1 64 GLU CB C -2.699 12.063 12.156 1.00 . A A . 64 GLU CB 1 1 7 6639 1 1 64 GLU CD C -3.630 13.882 10.717 1.00 . A A . 64 GLU CD 1 1 7 6640 1 1 64 GLU CG C -3.432 12.370 10.848 1.00 . A A . 64 GLU CG 1 1 7 6641 1 1 64 GLU H H -5.183 10.187 12.481 1.00 . A A . 64 GLU H 1 1 7 6642 1 1 64 GLU HA H -3.214 11.487 14.159 1.00 . A A . 64 GLU HA 1 1 7 6643 1 1 64 GLU HB2 H -2.207 12.955 12.514 1.00 . A A . 64 GLU HB2 1 1 7 6644 1 1 64 GLU HB3 H -1.964 11.291 11.982 1.00 . A A . 64 GLU HB3 1 1 7 6645 1 1 64 GLU HG2 H -2.847 12.009 10.014 1.00 . A A . 64 GLU HG2 1 1 7 6646 1 1 64 GLU HG3 H -4.394 11.882 10.852 1.00 . A A . 64 GLU HG3 1 1 7 6647 1 1 64 GLU N N -4.256 10.258 12.792 1.00 . A A . 64 GLU N 1 1 7 6648 1 1 64 GLU OE1 O -3.658 14.546 11.740 1.00 . A A . 64 GLU OE1 1 1 7 6649 1 1 64 GLU OE2 O -3.752 14.348 9.596 1.00 . A A . 64 GLU OE2 1 1 7 6650 2 2 1 SF4 FE1 FE 5.574 -4.872 -2.183 1.00 . B A . 65 SF4 FE1 1 1 7 6651 2 2 1 SF4 FE2 FE 3.934 -6.018 -0.075 1.00 . B A . 65 SF4 FE2 1 1 7 6652 2 2 1 SF4 FE3 FE 2.999 -4.502 -2.283 1.00 . B A . 65 SF4 FE3 1 1 7 6653 2 2 1 SF4 FE4 FE 4.179 -7.206 -2.703 1.00 . B A . 65 SF4 FE4 1 1 7 6654 2 2 1 SF4 S1 S 2.169 -6.609 -1.281 1.00 . B A . 65 SF4 S1 1 1 7 6655 2 2 1 SF4 S2 S 4.462 -5.037 -3.847 1.00 . B A . 65 SF4 S2 1 1 7 6656 2 2 1 SF4 S3 S 5.809 -7.116 -1.204 1.00 . B A . 65 SF4 S3 1 1 7 6657 2 2 1 SF4 S4 S 4.378 -3.650 -0.780 1.00 . B A . 65 SF4 S4 1 1 8 6658 1 1 1 ALA C C -9.783 9.485 9.078 1.00 . A A . 1 ALA C 1 1 8 6659 1 1 1 ALA CA C -11.239 9.899 8.852 1.00 . A A . 1 ALA CA 1 1 8 6660 1 1 1 ALA CB C -11.899 8.925 7.874 1.00 . A A . 1 ALA CB 1 1 8 6661 1 1 1 ALA HA H -11.770 9.880 9.793 1.00 . A A . 1 ALA HA 1 1 8 6662 1 1 1 ALA HB1 H -11.633 9.196 6.863 1.00 . A A . 1 ALA HB1 1 1 8 6663 1 1 1 ALA HB2 H -11.559 7.923 8.081 1.00 . A A . 1 ALA HB2 1 1 8 6664 1 1 1 ALA HB3 H -12.973 8.973 7.988 1.00 . A A . 1 ALA HB3 1 1 8 6665 1 1 1 ALA N N -11.283 11.277 8.285 1.00 . A A . 1 ALA N 1 1 8 6666 1 1 1 ALA O O -8.870 10.263 8.890 1.00 . A A . 1 ALA O 1 1 8 6667 1 1 2 ARG C C -7.389 7.830 8.398 1.00 . A A . 2 ARG C 1 1 8 6668 1 1 2 ARG CA C -8.163 7.799 9.717 1.00 . A A . 2 ARG CA 1 1 8 6669 1 1 2 ARG CB C -8.183 6.370 10.266 1.00 . A A . 2 ARG CB 1 1 8 6670 1 1 2 ARG CD C -7.485 5.122 12.315 1.00 . A A . 2 ARG CD 1 1 8 6671 1 1 2 ARG CG C -8.138 6.405 11.795 1.00 . A A . 2 ARG CG 1 1 8 6672 1 1 2 ARG CZ C -6.914 4.193 14.478 1.00 . A A . 2 ARG CZ 1 1 8 6673 1 1 2 ARG H H -10.310 7.650 9.628 1.00 . A A . 2 ARG H 1 1 8 6674 1 1 2 ARG HA H -7.683 8.452 10.431 1.00 . A A . 2 ARG HA 1 1 8 6675 1 1 2 ARG HB2 H -9.086 5.873 9.943 1.00 . A A . 2 ARG HB2 1 1 8 6676 1 1 2 ARG HB3 H -7.323 5.831 9.895 1.00 . A A . 2 ARG HB3 1 1 8 6677 1 1 2 ARG HD2 H -8.147 4.286 12.142 1.00 . A A . 2 ARG HD2 1 1 8 6678 1 1 2 ARG HD3 H -6.554 4.955 11.794 1.00 . A A . 2 ARG HD3 1 1 8 6679 1 1 2 ARG HE H -7.275 6.127 14.209 1.00 . A A . 2 ARG HE 1 1 8 6680 1 1 2 ARG HG2 H -7.562 7.260 12.119 1.00 . A A . 2 ARG HG2 1 1 8 6681 1 1 2 ARG HG3 H -9.142 6.478 12.183 1.00 . A A . 2 ARG HG3 1 1 8 6682 1 1 2 ARG HH11 H -8.454 3.108 13.800 1.00 . A A . 2 ARG HH11 1 1 8 6683 1 1 2 ARG HH12 H -7.418 2.309 14.934 1.00 . A A . 2 ARG HH12 1 1 8 6684 1 1 2 ARG HH21 H -5.302 5.029 15.319 1.00 . A A . 2 ARG HH21 1 1 8 6685 1 1 2 ARG HH22 H -5.633 3.397 15.796 1.00 . A A . 2 ARG HH22 1 1 8 6686 1 1 2 ARG N N -9.560 8.263 9.481 1.00 . A A . 2 ARG N 1 1 8 6687 1 1 2 ARG NE N -7.221 5.250 13.776 1.00 . A A . 2 ARG NE 1 1 8 6688 1 1 2 ARG NH1 N -7.653 3.120 14.398 1.00 . A A . 2 ARG NH1 1 1 8 6689 1 1 2 ARG NH2 N -5.868 4.208 15.258 1.00 . A A . 2 ARG NH2 1 1 8 6690 1 1 2 ARG O O -7.950 8.053 7.343 1.00 . A A . 2 ARG O 1 1 8 6691 1 1 3 LYS C C -4.398 6.390 7.140 1.00 . A A . 3 LYS C 1 1 8 6692 1 1 3 LYS CA C -5.299 7.626 7.191 1.00 . A A . 3 LYS CA 1 1 8 6693 1 1 3 LYS CB C -4.440 8.892 7.159 1.00 . A A . 3 LYS CB 1 1 8 6694 1 1 3 LYS CD C -5.476 10.409 5.466 1.00 . A A . 3 LYS CD 1 1 8 6695 1 1 3 LYS CE C -4.894 11.692 4.871 1.00 . A A . 3 LYS CE 1 1 8 6696 1 1 3 LYS CG C -4.348 9.407 5.721 1.00 . A A . 3 LYS CG 1 1 8 6697 1 1 3 LYS H H -5.667 7.430 9.305 1.00 . A A . 3 LYS H 1 1 8 6698 1 1 3 LYS HA H -5.962 7.621 6.340 1.00 . A A . 3 LYS HA 1 1 8 6699 1 1 3 LYS HB2 H -4.890 9.648 7.784 1.00 . A A . 3 LYS HB2 1 1 8 6700 1 1 3 LYS HB3 H -3.449 8.665 7.521 1.00 . A A . 3 LYS HB3 1 1 8 6701 1 1 3 LYS HD2 H -6.188 9.982 4.775 1.00 . A A . 3 LYS HD2 1 1 8 6702 1 1 3 LYS HD3 H -5.971 10.640 6.398 1.00 . A A . 3 LYS HD3 1 1 8 6703 1 1 3 LYS HE2 H -4.888 12.468 5.622 1.00 . A A . 3 LYS HE2 1 1 8 6704 1 1 3 LYS HE3 H -3.884 11.507 4.535 1.00 . A A . 3 LYS HE3 1 1 8 6705 1 1 3 LYS HG2 H -3.393 9.892 5.572 1.00 . A A . 3 LYS HG2 1 1 8 6706 1 1 3 LYS HG3 H -4.443 8.579 5.035 1.00 . A A . 3 LYS HG3 1 1 8 6707 1 1 3 LYS HZ1 H -6.422 11.386 3.489 1.00 . A A . 3 LYS HZ1 1 1 8 6708 1 1 3 LYS HZ2 H -6.228 13.007 3.960 1.00 . A A . 3 LYS HZ2 1 1 8 6709 1 1 3 LYS HZ3 H -5.120 12.291 2.889 1.00 . A A . 3 LYS HZ3 1 1 8 6710 1 1 3 LYS N N -6.103 7.607 8.445 1.00 . A A . 3 LYS N 1 1 8 6711 1 1 3 LYS NZ N -5.729 12.127 3.714 1.00 . A A . 3 LYS NZ 1 1 8 6712 1 1 3 LYS O O -4.592 5.438 7.869 1.00 . A A . 3 LYS O 1 1 8 6713 1 1 4 PHE C C -1.484 5.487 5.056 1.00 . A A . 4 PHE C 1 1 8 6714 1 1 4 PHE CA C -2.497 5.232 6.175 1.00 . A A . 4 PHE CA 1 1 8 6715 1 1 4 PHE CB C -3.313 3.977 5.858 1.00 . A A . 4 PHE CB 1 1 8 6716 1 1 4 PHE CD1 C -4.887 5.074 4.224 1.00 . A A . 4 PHE CD1 1 1 8 6717 1 1 4 PHE CD2 C -3.492 3.247 3.452 1.00 . A A . 4 PHE CD2 1 1 8 6718 1 1 4 PHE CE1 C -5.442 5.191 2.945 1.00 . A A . 4 PHE CE1 1 1 8 6719 1 1 4 PHE CE2 C -4.048 3.364 2.173 1.00 . A A . 4 PHE CE2 1 1 8 6720 1 1 4 PHE CG C -3.911 4.102 4.478 1.00 . A A . 4 PHE CG 1 1 8 6721 1 1 4 PHE CZ C -5.023 4.336 1.919 1.00 . A A . 4 PHE CZ 1 1 8 6722 1 1 4 PHE H H -3.274 7.174 5.710 1.00 . A A . 4 PHE H 1 1 8 6723 1 1 4 PHE HA H -1.973 5.102 7.109 1.00 . A A . 4 PHE HA 1 1 8 6724 1 1 4 PHE HB2 H -2.671 3.110 5.897 1.00 . A A . 4 PHE HB2 1 1 8 6725 1 1 4 PHE HB3 H -4.104 3.868 6.582 1.00 . A A . 4 PHE HB3 1 1 8 6726 1 1 4 PHE HD1 H -5.210 5.733 5.016 1.00 . A A . 4 PHE HD1 1 1 8 6727 1 1 4 PHE HD2 H -2.739 2.498 3.648 1.00 . A A . 4 PHE HD2 1 1 8 6728 1 1 4 PHE HE1 H -6.194 5.941 2.749 1.00 . A A . 4 PHE HE1 1 1 8 6729 1 1 4 PHE HE2 H -3.724 2.704 1.382 1.00 . A A . 4 PHE HE2 1 1 8 6730 1 1 4 PHE HZ H -5.451 4.426 0.932 1.00 . A A . 4 PHE HZ 1 1 8 6731 1 1 4 PHE N N -3.413 6.399 6.283 1.00 . A A . 4 PHE N 1 1 8 6732 1 1 4 PHE O O -1.414 6.569 4.509 1.00 . A A . 4 PHE O 1 1 8 6733 1 1 5 TYR C C 1.187 3.464 3.702 1.00 . A A . 5 TYR C 1 1 8 6734 1 1 5 TYR CA C 0.306 4.675 3.643 1.00 . A A . 5 TYR CA 1 1 8 6735 1 1 5 TYR CB C 1.168 5.909 3.886 1.00 . A A . 5 TYR CB 1 1 8 6736 1 1 5 TYR CD1 C 1.165 6.230 6.386 1.00 . A A . 5 TYR CD1 1 1 8 6737 1 1 5 TYR CD2 C 3.111 5.235 5.337 1.00 . A A . 5 TYR CD2 1 1 8 6738 1 1 5 TYR CE1 C 1.782 6.112 7.638 1.00 . A A . 5 TYR CE1 1 1 8 6739 1 1 5 TYR CE2 C 3.726 5.116 6.588 1.00 . A A . 5 TYR CE2 1 1 8 6740 1 1 5 TYR CG C 1.830 5.792 5.236 1.00 . A A . 5 TYR CG 1 1 8 6741 1 1 5 TYR CZ C 3.063 5.555 7.739 1.00 . A A . 5 TYR CZ 1 1 8 6742 1 1 5 TYR H H -0.760 3.625 5.161 1.00 . A A . 5 TYR H 1 1 8 6743 1 1 5 TYR HA H -0.179 4.739 2.684 1.00 . A A . 5 TYR HA 1 1 8 6744 1 1 5 TYR HB2 H 1.926 5.971 3.119 1.00 . A A . 5 TYR HB2 1 1 8 6745 1 1 5 TYR HB3 H 0.558 6.786 3.854 1.00 . A A . 5 TYR HB3 1 1 8 6746 1 1 5 TYR HD1 H 0.177 6.660 6.310 1.00 . A A . 5 TYR HD1 1 1 8 6747 1 1 5 TYR HD2 H 3.624 4.898 4.449 1.00 . A A . 5 TYR HD2 1 1 8 6748 1 1 5 TYR HE1 H 1.270 6.449 8.527 1.00 . A A . 5 TYR HE1 1 1 8 6749 1 1 5 TYR HE2 H 4.715 4.687 6.665 1.00 . A A . 5 TYR HE2 1 1 8 6750 1 1 5 TYR HH H 3.027 5.068 9.584 1.00 . A A . 5 TYR HH 1 1 8 6751 1 1 5 TYR N N -0.698 4.502 4.712 1.00 . A A . 5 TYR N 1 1 8 6752 1 1 5 TYR O O 0.972 2.578 4.506 1.00 . A A . 5 TYR O 1 1 8 6753 1 1 5 TYR OH O 3.669 5.436 8.972 1.00 . A A . 5 TYR OH 1 1 8 6754 1 1 6 VAL C C 4.493 2.548 2.847 1.00 . A A . 6 VAL C 1 1 8 6755 1 1 6 VAL CA C 3.029 2.196 2.991 1.00 . A A . 6 VAL CA 1 1 8 6756 1 1 6 VAL CB C 2.670 1.186 1.921 1.00 . A A . 6 VAL CB 1 1 8 6757 1 1 6 VAL CG1 C 3.255 -0.133 2.362 1.00 . A A . 6 VAL CG1 1 1 8 6758 1 1 6 VAL CG2 C 1.153 1.038 1.783 1.00 . A A . 6 VAL CG2 1 1 8 6759 1 1 6 VAL H H 2.363 4.107 2.246 1.00 . A A . 6 VAL H 1 1 8 6760 1 1 6 VAL HA H 2.875 1.740 3.958 1.00 . A A . 6 VAL HA 1 1 8 6761 1 1 6 VAL HB H 3.106 1.484 0.976 1.00 . A A . 6 VAL HB 1 1 8 6762 1 1 6 VAL HG11 H 3.444 -0.089 3.425 1.00 . A A . 6 VAL HG11 1 1 8 6763 1 1 6 VAL HG12 H 2.555 -0.921 2.153 1.00 . A A . 6 VAL HG12 1 1 8 6764 1 1 6 VAL HG13 H 4.178 -0.305 1.836 1.00 . A A . 6 VAL HG13 1 1 8 6765 1 1 6 VAL HG21 H 0.657 1.582 2.567 1.00 . A A . 6 VAL HG21 1 1 8 6766 1 1 6 VAL HG22 H 0.845 1.422 0.825 1.00 . A A . 6 VAL HG22 1 1 8 6767 1 1 6 VAL HG23 H 0.889 -0.006 1.850 1.00 . A A . 6 VAL HG23 1 1 8 6768 1 1 6 VAL N N 2.178 3.390 2.894 1.00 . A A . 6 VAL N 1 1 8 6769 1 1 6 VAL O O 4.859 3.573 2.306 1.00 . A A . 6 VAL O 1 1 8 6770 1 1 7 ASP C C 7.335 0.981 2.139 1.00 . A A . 7 ASP C 1 1 8 6771 1 1 7 ASP CA C 6.783 1.916 3.201 1.00 . A A . 7 ASP CA 1 1 8 6772 1 1 7 ASP CB C 7.459 1.636 4.540 1.00 . A A . 7 ASP CB 1 1 8 6773 1 1 7 ASP CG C 7.751 2.956 5.257 1.00 . A A . 7 ASP CG 1 1 8 6774 1 1 7 ASP H H 5.008 0.854 3.732 1.00 . A A . 7 ASP H 1 1 8 6775 1 1 7 ASP HA H 6.954 2.938 2.907 1.00 . A A . 7 ASP HA 1 1 8 6776 1 1 7 ASP HB2 H 6.800 1.035 5.145 1.00 . A A . 7 ASP HB2 1 1 8 6777 1 1 7 ASP HB3 H 8.384 1.104 4.375 1.00 . A A . 7 ASP HB3 1 1 8 6778 1 1 7 ASP N N 5.335 1.678 3.316 1.00 . A A . 7 ASP N 1 1 8 6779 1 1 7 ASP O O 8.024 0.022 2.427 1.00 . A A . 7 ASP O 1 1 8 6780 1 1 7 ASP OD1 O 7.007 3.899 5.046 1.00 . A A . 7 ASP OD1 1 1 8 6781 1 1 7 ASP OD2 O 8.714 3.000 6.004 1.00 . A A . 7 ASP OD2 1 1 8 6782 1 1 8 GLN C C 8.994 0.049 0.059 1.00 . A A . 8 GLN C 1 1 8 6783 1 1 8 GLN CA C 7.537 0.419 -0.212 1.00 . A A . 8 GLN CA 1 1 8 6784 1 1 8 GLN CB C 7.442 1.207 -1.519 1.00 . A A . 8 GLN CB 1 1 8 6785 1 1 8 GLN CD C 8.006 3.409 -0.484 1.00 . A A . 8 GLN CD 1 1 8 6786 1 1 8 GLN CG C 8.455 2.353 -1.497 1.00 . A A . 8 GLN CG 1 1 8 6787 1 1 8 GLN H H 6.482 2.049 0.715 1.00 . A A . 8 GLN H 1 1 8 6788 1 1 8 GLN HA H 6.940 -0.478 -0.284 1.00 . A A . 8 GLN HA 1 1 8 6789 1 1 8 GLN HB2 H 7.653 0.552 -2.351 1.00 . A A . 8 GLN HB2 1 1 8 6790 1 1 8 GLN HB3 H 6.449 1.612 -1.621 1.00 . A A . 8 GLN HB3 1 1 8 6791 1 1 8 GLN HE21 H 6.291 3.779 -1.413 1.00 . A A . 8 GLN HE21 1 1 8 6792 1 1 8 GLN HE22 H 6.559 4.681 -0.001 1.00 . A A . 8 GLN HE22 1 1 8 6793 1 1 8 GLN HG2 H 9.425 1.973 -1.216 1.00 . A A . 8 GLN HG2 1 1 8 6794 1 1 8 GLN HG3 H 8.513 2.801 -2.478 1.00 . A A . 8 GLN HG3 1 1 8 6795 1 1 8 GLN N N 7.036 1.266 0.905 1.00 . A A . 8 GLN N 1 1 8 6796 1 1 8 GLN NE2 N 6.857 4.007 -0.646 1.00 . A A . 8 GLN NE2 1 1 8 6797 1 1 8 GLN O O 9.499 -0.943 -0.426 1.00 . A A . 8 GLN O 1 1 8 6798 1 1 8 GLN OE1 O 8.709 3.692 0.467 1.00 . A A . 8 GLN OE1 1 1 8 6799 1 1 9 ASP C C 11.189 -0.917 1.631 1.00 . A A . 9 ASP C 1 1 8 6800 1 1 9 ASP CA C 11.092 0.534 1.157 1.00 . A A . 9 ASP CA 1 1 8 6801 1 1 9 ASP CB C 11.584 1.473 2.262 1.00 . A A . 9 ASP CB 1 1 8 6802 1 1 9 ASP CG C 13.102 1.632 2.159 1.00 . A A . 9 ASP CG 1 1 8 6803 1 1 9 ASP H H 9.238 1.630 1.227 1.00 . A A . 9 ASP H 1 1 8 6804 1 1 9 ASP HA H 11.696 0.667 0.271 1.00 . A A . 9 ASP HA 1 1 8 6805 1 1 9 ASP HB2 H 11.112 2.440 2.148 1.00 . A A . 9 ASP HB2 1 1 8 6806 1 1 9 ASP HB3 H 11.330 1.060 3.226 1.00 . A A . 9 ASP HB3 1 1 8 6807 1 1 9 ASP N N 9.669 0.840 0.841 1.00 . A A . 9 ASP N 1 1 8 6808 1 1 9 ASP O O 12.117 -1.629 1.303 1.00 . A A . 9 ASP O 1 1 8 6809 1 1 9 ASP OD1 O 13.660 1.185 1.170 1.00 . A A . 9 ASP OD1 1 1 8 6810 1 1 9 ASP OD2 O 13.680 2.198 3.073 1.00 . A A . 9 ASP OD2 1 1 8 6811 1 1 10 GLU C C 9.699 -3.684 1.777 1.00 . A A . 10 GLU C 1 1 8 6812 1 1 10 GLU CA C 10.246 -2.772 2.876 1.00 . A A . 10 GLU CA 1 1 8 6813 1 1 10 GLU CB C 9.363 -2.895 4.122 1.00 . A A . 10 GLU CB 1 1 8 6814 1 1 10 GLU CD C 9.161 -4.295 6.183 1.00 . A A . 10 GLU CD 1 1 8 6815 1 1 10 GLU CG C 9.460 -4.316 4.683 1.00 . A A . 10 GLU CG 1 1 8 6816 1 1 10 GLU H H 9.481 -0.774 2.634 1.00 . A A . 10 GLU H 1 1 8 6817 1 1 10 GLU HA H 11.259 -3.059 3.118 1.00 . A A . 10 GLU HA 1 1 8 6818 1 1 10 GLU HB2 H 9.691 -2.189 4.871 1.00 . A A . 10 GLU HB2 1 1 8 6819 1 1 10 GLU HB3 H 8.341 -2.687 3.857 1.00 . A A . 10 GLU HB3 1 1 8 6820 1 1 10 GLU HG2 H 8.745 -4.951 4.181 1.00 . A A . 10 GLU HG2 1 1 8 6821 1 1 10 GLU HG3 H 10.457 -4.700 4.522 1.00 . A A . 10 GLU HG3 1 1 8 6822 1 1 10 GLU N N 10.226 -1.363 2.390 1.00 . A A . 10 GLU N 1 1 8 6823 1 1 10 GLU O O 9.929 -4.877 1.772 1.00 . A A . 10 GLU O 1 1 8 6824 1 1 10 GLU OE1 O 8.309 -3.521 6.585 1.00 . A A . 10 GLU OE1 1 1 8 6825 1 1 10 GLU OE2 O 9.790 -5.053 6.904 1.00 . A A . 10 GLU OE2 1 1 8 6826 1 1 11 CYS C C 9.496 -4.791 -0.900 1.00 . A A . 11 CYS C 1 1 8 6827 1 1 11 CYS CA C 8.395 -3.948 -0.255 1.00 . A A . 11 CYS CA 1 1 8 6828 1 1 11 CYS CB C 7.765 -3.026 -1.304 1.00 . A A . 11 CYS CB 1 1 8 6829 1 1 11 CYS H H 8.797 -2.162 0.877 1.00 . A A . 11 CYS H 1 1 8 6830 1 1 11 CYS HA H 7.636 -4.602 0.147 1.00 . A A . 11 CYS HA 1 1 8 6831 1 1 11 CYS HB2 H 6.926 -2.502 -0.868 1.00 . A A . 11 CYS HB2 1 1 8 6832 1 1 11 CYS HB3 H 8.499 -2.310 -1.640 1.00 . A A . 11 CYS HB3 1 1 8 6833 1 1 11 CYS N N 8.969 -3.126 0.848 1.00 . A A . 11 CYS N 1 1 8 6834 1 1 11 CYS O O 10.501 -4.278 -1.354 1.00 . A A . 11 CYS O 1 1 8 6835 1 1 11 CYS SG S 7.158 -3.884 -2.801 1.00 . A A . 11 CYS SG 1 1 8 6836 1 1 12 ILE C C 10.283 -6.848 -3.075 1.00 . A A . 12 ILE C 1 1 8 6837 1 1 12 ILE CA C 10.348 -6.964 -1.551 1.00 . A A . 12 ILE CA 1 1 8 6838 1 1 12 ILE CB C 10.098 -8.414 -1.133 1.00 . A A . 12 ILE CB 1 1 8 6839 1 1 12 ILE CD1 C 8.373 -10.222 -1.015 1.00 . A A . 12 ILE CD1 1 1 8 6840 1 1 12 ILE CG1 C 8.720 -8.862 -1.626 1.00 . A A . 12 ILE CG1 1 1 8 6841 1 1 12 ILE CG2 C 10.148 -8.518 0.393 1.00 . A A . 12 ILE CG2 1 1 8 6842 1 1 12 ILE H H 8.498 -6.474 -0.565 1.00 . A A . 12 ILE H 1 1 8 6843 1 1 12 ILE HA H 11.326 -6.656 -1.211 1.00 . A A . 12 ILE HA 1 1 8 6844 1 1 12 ILE HB H 10.861 -9.048 -1.562 1.00 . A A . 12 ILE HB 1 1 8 6845 1 1 12 ILE HD11 H 8.449 -10.163 0.060 1.00 . A A . 12 ILE HD11 1 1 8 6846 1 1 12 ILE HD12 H 7.366 -10.494 -1.292 1.00 . A A . 12 ILE HD12 1 1 8 6847 1 1 12 ILE HD13 H 9.062 -10.968 -1.385 1.00 . A A . 12 ILE HD13 1 1 8 6848 1 1 12 ILE HG12 H 7.978 -8.135 -1.330 1.00 . A A . 12 ILE HG12 1 1 8 6849 1 1 12 ILE HG13 H 8.732 -8.947 -2.702 1.00 . A A . 12 ILE HG13 1 1 8 6850 1 1 12 ILE HG21 H 11.083 -8.114 0.751 1.00 . A A . 12 ILE HG21 1 1 8 6851 1 1 12 ILE HG22 H 9.328 -7.960 0.818 1.00 . A A . 12 ILE HG22 1 1 8 6852 1 1 12 ILE HG23 H 10.069 -9.555 0.685 1.00 . A A . 12 ILE HG23 1 1 8 6853 1 1 12 ILE N N 9.315 -6.083 -0.940 1.00 . A A . 12 ILE N 1 1 8 6854 1 1 12 ILE O O 11.287 -6.662 -3.734 1.00 . A A . 12 ILE O 1 1 8 6855 1 1 13 ALA C C 7.627 -7.339 -5.590 1.00 . A A . 13 ALA C 1 1 8 6856 1 1 13 ALA CA C 9.002 -6.847 -5.127 1.00 . A A . 13 ALA CA 1 1 8 6857 1 1 13 ALA CB C 10.090 -7.700 -5.781 1.00 . A A . 13 ALA CB 1 1 8 6858 1 1 13 ALA H H 8.312 -7.102 -3.101 1.00 . A A . 13 ALA H 1 1 8 6859 1 1 13 ALA HA H 9.131 -5.816 -5.422 1.00 . A A . 13 ALA HA 1 1 8 6860 1 1 13 ALA HB1 H 10.211 -8.617 -5.223 1.00 . A A . 13 ALA HB1 1 1 8 6861 1 1 13 ALA HB2 H 9.805 -7.931 -6.796 1.00 . A A . 13 ALA HB2 1 1 8 6862 1 1 13 ALA HB3 H 11.022 -7.155 -5.784 1.00 . A A . 13 ALA HB3 1 1 8 6863 1 1 13 ALA N N 9.113 -6.955 -3.646 1.00 . A A . 13 ALA N 1 1 8 6864 1 1 13 ALA O O 7.080 -6.848 -6.558 1.00 . A A . 13 ALA O 1 1 8 6865 1 1 14 CYS C C 4.750 -7.656 -5.473 1.00 . A A . 14 CYS C 1 1 8 6866 1 1 14 CYS CA C 5.730 -8.823 -5.339 1.00 . A A . 14 CYS CA 1 1 8 6867 1 1 14 CYS CB C 5.208 -9.824 -4.304 1.00 . A A . 14 CYS CB 1 1 8 6868 1 1 14 CYS H H 7.521 -8.697 -4.143 1.00 . A A . 14 CYS H 1 1 8 6869 1 1 14 CYS HA H 5.827 -9.317 -6.295 1.00 . A A . 14 CYS HA 1 1 8 6870 1 1 14 CYS HB2 H 4.946 -10.746 -4.799 1.00 . A A . 14 CYS HB2 1 1 8 6871 1 1 14 CYS HB3 H 5.982 -10.018 -3.575 1.00 . A A . 14 CYS HB3 1 1 8 6872 1 1 14 CYS N N 7.065 -8.307 -4.917 1.00 . A A . 14 CYS N 1 1 8 6873 1 1 14 CYS O O 4.958 -6.592 -4.924 1.00 . A A . 14 CYS O 1 1 8 6874 1 1 14 CYS SG S 3.727 -9.315 -3.355 1.00 . A A . 14 CYS SG 1 1 8 6875 1 1 15 GLU C C 1.314 -7.229 -5.936 1.00 . A A . 15 GLU C 1 1 8 6876 1 1 15 GLU CA C 2.697 -6.746 -6.378 1.00 . A A . 15 GLU CA 1 1 8 6877 1 1 15 GLU CB C 2.644 -6.329 -7.849 1.00 . A A . 15 GLU CB 1 1 8 6878 1 1 15 GLU CD C 1.738 -6.986 -10.081 1.00 . A A . 15 GLU CD 1 1 8 6879 1 1 15 GLU CG C 2.143 -7.499 -8.698 1.00 . A A . 15 GLU CG 1 1 8 6880 1 1 15 GLU H H 3.541 -8.709 -6.643 1.00 . A A . 15 GLU H 1 1 8 6881 1 1 15 GLU HA H 2.990 -5.900 -5.775 1.00 . A A . 15 GLU HA 1 1 8 6882 1 1 15 GLU HB2 H 1.974 -5.489 -7.961 1.00 . A A . 15 GLU HB2 1 1 8 6883 1 1 15 GLU HB3 H 3.633 -6.046 -8.178 1.00 . A A . 15 GLU HB3 1 1 8 6884 1 1 15 GLU HG2 H 2.930 -8.233 -8.800 1.00 . A A . 15 GLU HG2 1 1 8 6885 1 1 15 GLU HG3 H 1.288 -7.952 -8.219 1.00 . A A . 15 GLU HG3 1 1 8 6886 1 1 15 GLU N N 3.686 -7.845 -6.205 1.00 . A A . 15 GLU N 1 1 8 6887 1 1 15 GLU O O 0.302 -6.685 -6.329 1.00 . A A . 15 GLU O 1 1 8 6888 1 1 15 GLU OE1 O 2.408 -6.097 -10.581 1.00 . A A . 15 GLU OE1 1 1 8 6889 1 1 15 GLU OE2 O 0.766 -7.492 -10.617 1.00 . A A . 15 GLU OE2 1 1 8 6890 1 1 16 SER C C -0.942 -7.570 -4.263 1.00 . A A . 16 SER C 1 1 8 6891 1 1 16 SER CA C -0.058 -8.756 -4.651 1.00 . A A . 16 SER CA 1 1 8 6892 1 1 16 SER CB C 0.147 -9.661 -3.435 1.00 . A A . 16 SER CB 1 1 8 6893 1 1 16 SER H H 2.089 -8.671 -4.810 1.00 . A A . 16 SER H 1 1 8 6894 1 1 16 SER HA H -0.531 -9.317 -5.445 1.00 . A A . 16 SER HA 1 1 8 6895 1 1 16 SER HB2 H 1.155 -9.554 -3.071 1.00 . A A . 16 SER HB2 1 1 8 6896 1 1 16 SER HB3 H -0.547 -9.376 -2.655 1.00 . A A . 16 SER HB3 1 1 8 6897 1 1 16 SER HG H 0.411 -11.574 -3.202 1.00 . A A . 16 SER HG 1 1 8 6898 1 1 16 SER N N 1.261 -8.246 -5.118 1.00 . A A . 16 SER N 1 1 8 6899 1 1 16 SER O O -2.012 -7.374 -4.804 1.00 . A A . 16 SER O 1 1 8 6900 1 1 16 SER OG O -0.074 -11.013 -3.813 1.00 . A A . 16 SER OG 1 1 8 6901 1 1 17 CYS C C -1.723 -4.804 -4.146 1.00 . A A . 17 CYS C 1 1 8 6902 1 1 17 CYS CA C -1.294 -5.591 -2.908 1.00 . A A . 17 CYS CA 1 1 8 6903 1 1 17 CYS CB C -0.432 -4.704 -2.008 1.00 . A A . 17 CYS CB 1 1 8 6904 1 1 17 CYS H H 0.375 -6.949 -2.917 1.00 . A A . 17 CYS H 1 1 8 6905 1 1 17 CYS HA H -2.167 -5.919 -2.365 1.00 . A A . 17 CYS HA 1 1 8 6906 1 1 17 CYS HB2 H -1.055 -3.960 -1.535 1.00 . A A . 17 CYS HB2 1 1 8 6907 1 1 17 CYS HB3 H 0.042 -5.310 -1.252 1.00 . A A . 17 CYS HB3 1 1 8 6908 1 1 17 CYS N N -0.494 -6.773 -3.333 1.00 . A A . 17 CYS N 1 1 8 6909 1 1 17 CYS O O -2.897 -4.612 -4.395 1.00 . A A . 17 CYS O 1 1 8 6910 1 1 17 CYS SG S 0.887 -3.814 -2.910 1.00 . A A . 17 CYS SG 1 1 8 6911 1 1 18 VAL C C -2.277 -4.302 -6.879 1.00 . A A . 18 VAL C 1 1 8 6912 1 1 18 VAL CA C -1.142 -3.581 -6.153 1.00 . A A . 18 VAL CA 1 1 8 6913 1 1 18 VAL CB C 0.074 -3.483 -7.075 1.00 . A A . 18 VAL CB 1 1 8 6914 1 1 18 VAL CG1 C -0.296 -2.673 -8.318 1.00 . A A . 18 VAL CG1 1 1 8 6915 1 1 18 VAL CG2 C 1.221 -2.788 -6.339 1.00 . A A . 18 VAL CG2 1 1 8 6916 1 1 18 VAL H H 0.159 -4.518 -4.714 1.00 . A A . 18 VAL H 1 1 8 6917 1 1 18 VAL HA H -1.466 -2.587 -5.873 1.00 . A A . 18 VAL HA 1 1 8 6918 1 1 18 VAL HB H 0.381 -4.476 -7.372 1.00 . A A . 18 VAL HB 1 1 8 6919 1 1 18 VAL HG11 H -1.302 -2.918 -8.622 1.00 . A A . 18 VAL HG11 1 1 8 6920 1 1 18 VAL HG12 H -0.236 -1.618 -8.091 1.00 . A A . 18 VAL HG12 1 1 8 6921 1 1 18 VAL HG13 H 0.390 -2.908 -9.118 1.00 . A A . 18 VAL HG13 1 1 8 6922 1 1 18 VAL HG21 H 1.183 -3.045 -5.290 1.00 . A A . 18 VAL HG21 1 1 8 6923 1 1 18 VAL HG22 H 2.163 -3.111 -6.756 1.00 . A A . 18 VAL HG22 1 1 8 6924 1 1 18 VAL HG23 H 1.125 -1.717 -6.451 1.00 . A A . 18 VAL HG23 1 1 8 6925 1 1 18 VAL N N -0.782 -4.350 -4.929 1.00 . A A . 18 VAL N 1 1 8 6926 1 1 18 VAL O O -3.139 -3.684 -7.472 1.00 . A A . 18 VAL O 1 1 8 6927 1 1 19 GLU C C -4.670 -6.169 -6.752 1.00 . A A . 19 GLU C 1 1 8 6928 1 1 19 GLU CA C -3.375 -6.360 -7.524 1.00 . A A . 19 GLU CA 1 1 8 6929 1 1 19 GLU CB C -3.022 -7.847 -7.593 1.00 . A A . 19 GLU CB 1 1 8 6930 1 1 19 GLU CD C -4.143 -9.136 -9.417 1.00 . A A . 19 GLU CD 1 1 8 6931 1 1 19 GLU CG C -2.925 -8.283 -9.056 1.00 . A A . 19 GLU CG 1 1 8 6932 1 1 19 GLU H H -1.587 -6.092 -6.351 1.00 . A A . 19 GLU H 1 1 8 6933 1 1 19 GLU HA H -3.503 -5.965 -8.515 1.00 . A A . 19 GLU HA 1 1 8 6934 1 1 19 GLU HB2 H -2.075 -8.015 -7.103 1.00 . A A . 19 GLU HB2 1 1 8 6935 1 1 19 GLU HB3 H -3.790 -8.423 -7.098 1.00 . A A . 19 GLU HB3 1 1 8 6936 1 1 19 GLU HG2 H -2.896 -7.408 -9.689 1.00 . A A . 19 GLU HG2 1 1 8 6937 1 1 19 GLU HG3 H -2.027 -8.862 -9.199 1.00 . A A . 19 GLU HG3 1 1 8 6938 1 1 19 GLU N N -2.289 -5.609 -6.837 1.00 . A A . 19 GLU N 1 1 8 6939 1 1 19 GLU O O -5.724 -5.979 -7.324 1.00 . A A . 19 GLU O 1 1 8 6940 1 1 19 GLU OE1 O -5.143 -9.026 -8.728 1.00 . A A . 19 GLU OE1 1 1 8 6941 1 1 19 GLU OE2 O -4.052 -9.884 -10.375 1.00 . A A . 19 GLU OE2 1 1 8 6942 1 1 20 ILE C C -5.985 -4.433 -4.472 1.00 . A A . 20 ILE C 1 1 8 6943 1 1 20 ILE CA C -5.824 -5.944 -4.652 1.00 . A A . 20 ILE CA 1 1 8 6944 1 1 20 ILE CB C -5.692 -6.618 -3.287 1.00 . A A . 20 ILE CB 1 1 8 6945 1 1 20 ILE CD1 C -3.902 -8.216 -2.649 1.00 . A A . 20 ILE CD1 1 1 8 6946 1 1 20 ILE CG1 C -5.182 -8.023 -3.462 1.00 . A A . 20 ILE CG1 1 1 8 6947 1 1 20 ILE CG2 C -7.050 -6.655 -2.589 1.00 . A A . 20 ILE CG2 1 1 8 6948 1 1 20 ILE H H -3.733 -6.296 -5.007 1.00 . A A . 20 ILE H 1 1 8 6949 1 1 20 ILE HA H -6.680 -6.343 -5.176 1.00 . A A . 20 ILE HA 1 1 8 6950 1 1 20 ILE HB H -5.002 -6.089 -2.689 1.00 . A A . 20 ILE HB 1 1 8 6951 1 1 20 ILE HD11 H -3.263 -7.355 -2.779 1.00 . A A . 20 ILE HD11 1 1 8 6952 1 1 20 ILE HD12 H -4.151 -8.327 -1.605 1.00 . A A . 20 ILE HD12 1 1 8 6953 1 1 20 ILE HD13 H -3.388 -9.101 -2.993 1.00 . A A . 20 ILE HD13 1 1 8 6954 1 1 20 ILE HG12 H -5.929 -8.696 -3.116 1.00 . A A . 20 ILE HG12 1 1 8 6955 1 1 20 ILE HG13 H -4.977 -8.197 -4.495 1.00 . A A . 20 ILE HG13 1 1 8 6956 1 1 20 ILE HG21 H -7.746 -6.025 -3.123 1.00 . A A . 20 ILE HG21 1 1 8 6957 1 1 20 ILE HG22 H -7.420 -7.668 -2.574 1.00 . A A . 20 ILE HG22 1 1 8 6958 1 1 20 ILE HG23 H -6.944 -6.295 -1.576 1.00 . A A . 20 ILE HG23 1 1 8 6959 1 1 20 ILE N N -4.598 -6.174 -5.453 1.00 . A A . 20 ILE N 1 1 8 6960 1 1 20 ILE O O -6.698 -3.970 -3.605 1.00 . A A . 20 ILE O 1 1 8 6961 1 1 21 ALA C C -4.382 -1.539 -6.116 1.00 . A A . 21 ALA C 1 1 8 6962 1 1 21 ALA CA C -5.406 -2.178 -5.175 1.00 . A A . 21 ALA CA 1 1 8 6963 1 1 21 ALA CB C -5.106 -1.761 -3.733 1.00 . A A . 21 ALA CB 1 1 8 6964 1 1 21 ALA H H -4.734 -4.056 -5.984 1.00 . A A . 21 ALA H 1 1 8 6965 1 1 21 ALA HA H -6.400 -1.856 -5.446 1.00 . A A . 21 ALA HA 1 1 8 6966 1 1 21 ALA HB1 H -4.313 -2.380 -3.338 1.00 . A A . 21 ALA HB1 1 1 8 6967 1 1 21 ALA HB2 H -4.798 -0.726 -3.714 1.00 . A A . 21 ALA HB2 1 1 8 6968 1 1 21 ALA HB3 H -5.993 -1.885 -3.130 1.00 . A A . 21 ALA HB3 1 1 8 6969 1 1 21 ALA N N -5.311 -3.659 -5.292 1.00 . A A . 21 ALA N 1 1 8 6970 1 1 21 ALA O O -3.444 -0.903 -5.677 1.00 . A A . 21 ALA O 1 1 8 6971 1 1 22 PRO C C -3.845 0.333 -8.525 1.00 . A A . 22 PRO C 1 1 8 6972 1 1 22 PRO CA C -3.679 -1.184 -8.416 1.00 . A A . 22 PRO CA 1 1 8 6973 1 1 22 PRO CB C -4.122 -1.877 -9.705 1.00 . A A . 22 PRO CB 1 1 8 6974 1 1 22 PRO CD C -5.709 -2.491 -7.981 1.00 . A A . 22 PRO CD 1 1 8 6975 1 1 22 PRO CG C -5.550 -2.259 -9.467 1.00 . A A . 22 PRO CG 1 1 8 6976 1 1 22 PRO HA H -2.656 -1.441 -8.192 1.00 . A A . 22 PRO HA 1 1 8 6977 1 1 22 PRO HB2 H -4.013 -1.189 -10.535 1.00 . A A . 22 PRO HB2 1 1 8 6978 1 1 22 PRO HB3 H -3.504 -2.745 -9.876 1.00 . A A . 22 PRO HB3 1 1 8 6979 1 1 22 PRO HD2 H -6.662 -2.106 -7.641 1.00 . A A . 22 PRO HD2 1 1 8 6980 1 1 22 PRO HD3 H -5.619 -3.540 -7.750 1.00 . A A . 22 PRO HD3 1 1 8 6981 1 1 22 PRO HG2 H -6.199 -1.458 -9.791 1.00 . A A . 22 PRO HG2 1 1 8 6982 1 1 22 PRO HG3 H -5.781 -3.165 -10.004 1.00 . A A . 22 PRO HG3 1 1 8 6983 1 1 22 PRO N N -4.599 -1.740 -7.387 1.00 . A A . 22 PRO N 1 1 8 6984 1 1 22 PRO O O -3.156 0.991 -9.279 1.00 . A A . 22 PRO O 1 1 8 6985 1 1 23 GLY C C -4.091 3.048 -6.769 1.00 . A A . 23 GLY C 1 1 8 6986 1 1 23 GLY CA C -4.956 2.369 -7.832 1.00 . A A . 23 GLY CA 1 1 8 6987 1 1 23 GLY H H -5.295 0.347 -7.170 1.00 . A A . 23 GLY H 1 1 8 6988 1 1 23 GLY HA2 H -4.679 2.731 -8.812 1.00 . A A . 23 GLY HA2 1 1 8 6989 1 1 23 GLY HA3 H -5.995 2.595 -7.645 1.00 . A A . 23 GLY HA3 1 1 8 6990 1 1 23 GLY N N -4.751 0.894 -7.774 1.00 . A A . 23 GLY N 1 1 8 6991 1 1 23 GLY O O -3.105 3.687 -7.073 1.00 . A A . 23 GLY O 1 1 8 6992 1 1 24 ALA C C -2.290 2.881 -4.356 1.00 . A A . 24 ALA C 1 1 8 6993 1 1 24 ALA CA C -3.657 3.540 -4.432 1.00 . A A . 24 ALA CA 1 1 8 6994 1 1 24 ALA CB C -4.380 3.349 -3.096 1.00 . A A . 24 ALA CB 1 1 8 6995 1 1 24 ALA H H -5.245 2.380 -5.301 1.00 . A A . 24 ALA H 1 1 8 6996 1 1 24 ALA HA H -3.532 4.595 -4.632 1.00 . A A . 24 ALA HA 1 1 8 6997 1 1 24 ALA HB1 H -5.370 2.954 -3.276 1.00 . A A . 24 ALA HB1 1 1 8 6998 1 1 24 ALA HB2 H -3.824 2.659 -2.481 1.00 . A A . 24 ALA HB2 1 1 8 6999 1 1 24 ALA HB3 H -4.459 4.299 -2.590 1.00 . A A . 24 ALA HB3 1 1 8 7000 1 1 24 ALA N N -4.451 2.906 -5.521 1.00 . A A . 24 ALA N 1 1 8 7001 1 1 24 ALA O O -1.315 3.501 -3.979 1.00 . A A . 24 ALA O 1 1 8 7002 1 1 25 PHE C C -0.312 0.789 -6.037 1.00 . A A . 25 PHE C 1 1 8 7003 1 1 25 PHE CA C -0.881 0.966 -4.632 1.00 . A A . 25 PHE CA 1 1 8 7004 1 1 25 PHE CB C -1.016 -0.397 -3.955 1.00 . A A . 25 PHE CB 1 1 8 7005 1 1 25 PHE CD1 C 1.226 -0.068 -2.855 1.00 . A A . 25 PHE CD1 1 1 8 7006 1 1 25 PHE CD2 C -0.628 -0.856 -1.506 1.00 . A A . 25 PHE CD2 1 1 8 7007 1 1 25 PHE CE1 C 2.060 -0.110 -1.732 1.00 . A A . 25 PHE CE1 1 1 8 7008 1 1 25 PHE CE2 C 0.208 -0.897 -0.383 1.00 . A A . 25 PHE CE2 1 1 8 7009 1 1 25 PHE CG C -0.119 -0.442 -2.742 1.00 . A A . 25 PHE CG 1 1 8 7010 1 1 25 PHE CZ C 1.552 -0.523 -0.498 1.00 . A A . 25 PHE CZ 1 1 8 7011 1 1 25 PHE H H -2.991 1.136 -5.003 1.00 . A A . 25 PHE H 1 1 8 7012 1 1 25 PHE HA H -0.220 1.588 -4.056 1.00 . A A . 25 PHE HA 1 1 8 7013 1 1 25 PHE HB2 H -2.042 -0.551 -3.653 1.00 . A A . 25 PHE HB2 1 1 8 7014 1 1 25 PHE HB3 H -0.722 -1.171 -4.647 1.00 . A A . 25 PHE HB3 1 1 8 7015 1 1 25 PHE HD1 H 1.619 0.251 -3.809 1.00 . A A . 25 PHE HD1 1 1 8 7016 1 1 25 PHE HD2 H -1.666 -1.144 -1.419 1.00 . A A . 25 PHE HD2 1 1 8 7017 1 1 25 PHE HE1 H 3.095 0.178 -1.816 1.00 . A A . 25 PHE HE1 1 1 8 7018 1 1 25 PHE HE2 H -0.186 -1.216 0.571 1.00 . A A . 25 PHE HE2 1 1 8 7019 1 1 25 PHE HZ H 2.196 -0.557 0.364 1.00 . A A . 25 PHE HZ 1 1 8 7020 1 1 25 PHE N N -2.199 1.631 -4.703 1.00 . A A . 25 PHE N 1 1 8 7021 1 1 25 PHE O O -0.991 0.358 -6.947 1.00 . A A . 25 PHE O 1 1 8 7022 1 1 26 ALA C C 3.080 1.093 -7.418 1.00 . A A . 26 ALA C 1 1 8 7023 1 1 26 ALA CA C 1.562 0.972 -7.557 1.00 . A A . 26 ALA CA 1 1 8 7024 1 1 26 ALA CB C 1.044 2.073 -8.486 1.00 . A A . 26 ALA CB 1 1 8 7025 1 1 26 ALA H H 1.462 1.464 -5.465 1.00 . A A . 26 ALA H 1 1 8 7026 1 1 26 ALA HA H 1.314 0.005 -7.969 1.00 . A A . 26 ALA HA 1 1 8 7027 1 1 26 ALA HB1 H 0.470 2.786 -7.913 1.00 . A A . 26 ALA HB1 1 1 8 7028 1 1 26 ALA HB2 H 1.881 2.575 -8.951 1.00 . A A . 26 ALA HB2 1 1 8 7029 1 1 26 ALA HB3 H 0.417 1.635 -9.248 1.00 . A A . 26 ALA HB3 1 1 8 7030 1 1 26 ALA N N 0.936 1.118 -6.216 1.00 . A A . 26 ALA N 1 1 8 7031 1 1 26 ALA O O 3.589 2.069 -6.904 1.00 . A A . 26 ALA O 1 1 8 7032 1 1 27 MET C C 5.797 1.366 -8.563 1.00 . A A . 27 MET C 1 1 8 7033 1 1 27 MET CA C 5.292 0.178 -7.756 1.00 . A A . 27 MET CA 1 1 8 7034 1 1 27 MET CB C 5.912 -1.114 -8.290 1.00 . A A . 27 MET CB 1 1 8 7035 1 1 27 MET CE C 5.667 -3.864 -10.626 1.00 . A A . 27 MET CE 1 1 8 7036 1 1 27 MET CG C 5.525 -1.296 -9.759 1.00 . A A . 27 MET CG 1 1 8 7037 1 1 27 MET H H 3.382 -0.673 -8.277 1.00 . A A . 27 MET H 1 1 8 7038 1 1 27 MET HA H 5.563 0.311 -6.728 1.00 . A A . 27 MET HA 1 1 8 7039 1 1 27 MET HB2 H 6.988 -1.061 -8.202 1.00 . A A . 27 MET HB2 1 1 8 7040 1 1 27 MET HB3 H 5.545 -1.953 -7.718 1.00 . A A . 27 MET HB3 1 1 8 7041 1 1 27 MET HE1 H 6.629 -3.681 -10.166 1.00 . A A . 27 MET HE1 1 1 8 7042 1 1 27 MET HE2 H 5.370 -4.884 -10.439 1.00 . A A . 27 MET HE2 1 1 8 7043 1 1 27 MET HE3 H 5.736 -3.701 -11.693 1.00 . A A . 27 MET HE3 1 1 8 7044 1 1 27 MET HG2 H 5.009 -0.414 -10.107 1.00 . A A . 27 MET HG2 1 1 8 7045 1 1 27 MET HG3 H 6.417 -1.448 -10.349 1.00 . A A . 27 MET HG3 1 1 8 7046 1 1 27 MET N N 3.809 0.109 -7.867 1.00 . A A . 27 MET N 1 1 8 7047 1 1 27 MET O O 5.149 1.806 -9.492 1.00 . A A . 27 MET O 1 1 8 7048 1 1 27 MET SD S 4.441 -2.735 -9.922 1.00 . A A . 27 MET SD 1 1 8 7049 1 1 28 ASP C C 8.863 2.710 -9.444 1.00 . A A . 28 ASP C 1 1 8 7050 1 1 28 ASP CA C 7.446 3.049 -9.016 1.00 . A A . 28 ASP CA 1 1 8 7051 1 1 28 ASP CB C 7.424 4.291 -8.125 1.00 . A A . 28 ASP CB 1 1 8 7052 1 1 28 ASP CG C 7.039 5.519 -8.952 1.00 . A A . 28 ASP CG 1 1 8 7053 1 1 28 ASP H H 7.493 1.547 -7.484 1.00 . A A . 28 ASP H 1 1 8 7054 1 1 28 ASP HA H 6.825 3.205 -9.886 1.00 . A A . 28 ASP HA 1 1 8 7055 1 1 28 ASP HB2 H 6.695 4.146 -7.335 1.00 . A A . 28 ASP HB2 1 1 8 7056 1 1 28 ASP HB3 H 8.399 4.436 -7.690 1.00 . A A . 28 ASP HB3 1 1 8 7057 1 1 28 ASP N N 6.947 1.900 -8.237 1.00 . A A . 28 ASP N 1 1 8 7058 1 1 28 ASP O O 9.456 1.822 -8.872 1.00 . A A . 28 ASP O 1 1 8 7059 1 1 28 ASP OD1 O 6.410 5.340 -9.983 1.00 . A A . 28 ASP OD1 1 1 8 7060 1 1 28 ASP OD2 O 7.376 6.616 -8.539 1.00 . A A . 28 ASP OD2 1 1 8 7061 1 1 29 PRO C C 11.709 3.933 -10.075 1.00 . A A . 29 PRO C 1 1 8 7062 1 1 29 PRO CA C 10.721 3.156 -10.935 1.00 . A A . 29 PRO CA 1 1 8 7063 1 1 29 PRO CB C 10.677 3.685 -12.367 1.00 . A A . 29 PRO CB 1 1 8 7064 1 1 29 PRO CD C 8.709 4.505 -11.156 1.00 . A A . 29 PRO CD 1 1 8 7065 1 1 29 PRO CG C 9.576 4.709 -12.386 1.00 . A A . 29 PRO CG 1 1 8 7066 1 1 29 PRO HA H 10.945 2.102 -10.928 1.00 . A A . 29 PRO HA 1 1 8 7067 1 1 29 PRO HB2 H 11.639 4.115 -12.615 1.00 . A A . 29 PRO HB2 1 1 8 7068 1 1 29 PRO HB3 H 10.466 2.870 -13.040 1.00 . A A . 29 PRO HB3 1 1 8 7069 1 1 29 PRO HD2 H 8.697 5.405 -10.559 1.00 . A A . 29 PRO HD2 1 1 8 7070 1 1 29 PRO HD3 H 7.711 4.228 -11.437 1.00 . A A . 29 PRO HD3 1 1 8 7071 1 1 29 PRO HG2 H 10.007 5.702 -12.372 1.00 . A A . 29 PRO HG2 1 1 8 7072 1 1 29 PRO HG3 H 8.979 4.581 -13.275 1.00 . A A . 29 PRO HG3 1 1 8 7073 1 1 29 PRO N N 9.356 3.412 -10.431 1.00 . A A . 29 PRO N 1 1 8 7074 1 1 29 PRO O O 12.886 3.638 -10.023 1.00 . A A . 29 PRO O 1 1 8 7075 1 1 30 GLU C C 12.064 4.981 -7.115 1.00 . A A . 30 GLU C 1 1 8 7076 1 1 30 GLU CA C 12.078 5.695 -8.458 1.00 . A A . 30 GLU CA 1 1 8 7077 1 1 30 GLU CB C 11.519 7.109 -8.297 1.00 . A A . 30 GLU CB 1 1 8 7078 1 1 30 GLU CD C 12.196 9.338 -7.391 1.00 . A A . 30 GLU CD 1 1 8 7079 1 1 30 GLU CG C 12.675 8.100 -8.152 1.00 . A A . 30 GLU CG 1 1 8 7080 1 1 30 GLU H H 10.246 5.087 -9.410 1.00 . A A . 30 GLU H 1 1 8 7081 1 1 30 GLU HA H 13.085 5.732 -8.847 1.00 . A A . 30 GLU HA 1 1 8 7082 1 1 30 GLU HB2 H 10.929 7.364 -9.166 1.00 . A A . 30 GLU HB2 1 1 8 7083 1 1 30 GLU HB3 H 10.897 7.153 -7.415 1.00 . A A . 30 GLU HB3 1 1 8 7084 1 1 30 GLU HG2 H 13.483 7.633 -7.607 1.00 . A A . 30 GLU HG2 1 1 8 7085 1 1 30 GLU HG3 H 13.023 8.394 -9.130 1.00 . A A . 30 GLU HG3 1 1 8 7086 1 1 30 GLU N N 11.209 4.903 -9.367 1.00 . A A . 30 GLU N 1 1 8 7087 1 1 30 GLU O O 13.040 4.947 -6.391 1.00 . A A . 30 GLU O 1 1 8 7088 1 1 30 GLU OE1 O 11.010 9.421 -7.120 1.00 . A A . 30 GLU OE1 1 1 8 7089 1 1 30 GLU OE2 O 13.024 10.183 -7.092 1.00 . A A . 30 GLU OE2 1 1 8 7090 1 1 31 ILE C C 10.891 2.121 -5.876 1.00 . A A . 31 ILE C 1 1 8 7091 1 1 31 ILE CA C 10.832 3.609 -5.545 1.00 . A A . 31 ILE CA 1 1 8 7092 1 1 31 ILE CB C 9.516 3.967 -4.838 1.00 . A A . 31 ILE CB 1 1 8 7093 1 1 31 ILE CD1 C 7.029 3.710 -4.966 1.00 . A A . 31 ILE CD1 1 1 8 7094 1 1 31 ILE CG1 C 8.371 3.100 -5.376 1.00 . A A . 31 ILE CG1 1 1 8 7095 1 1 31 ILE CG2 C 9.200 5.445 -5.078 1.00 . A A . 31 ILE CG2 1 1 8 7096 1 1 31 ILE H H 10.200 4.403 -7.432 1.00 . A A . 31 ILE H 1 1 8 7097 1 1 31 ILE HA H 11.647 3.847 -4.911 1.00 . A A . 31 ILE HA 1 1 8 7098 1 1 31 ILE HB H 9.629 3.796 -3.776 1.00 . A A . 31 ILE HB 1 1 8 7099 1 1 31 ILE HD11 H 7.054 3.960 -3.916 1.00 . A A . 31 ILE HD11 1 1 8 7100 1 1 31 ILE HD12 H 6.849 4.606 -5.543 1.00 . A A . 31 ILE HD12 1 1 8 7101 1 1 31 ILE HD13 H 6.237 2.998 -5.151 1.00 . A A . 31 ILE HD13 1 1 8 7102 1 1 31 ILE HG12 H 8.434 3.048 -6.451 1.00 . A A . 31 ILE HG12 1 1 8 7103 1 1 31 ILE HG13 H 8.453 2.108 -4.962 1.00 . A A . 31 ILE HG13 1 1 8 7104 1 1 31 ILE HG21 H 10.058 6.044 -4.814 1.00 . A A . 31 ILE HG21 1 1 8 7105 1 1 31 ILE HG22 H 8.960 5.598 -6.120 1.00 . A A . 31 ILE HG22 1 1 8 7106 1 1 31 ILE HG23 H 8.357 5.735 -4.468 1.00 . A A . 31 ILE HG23 1 1 8 7107 1 1 31 ILE N N 10.953 4.375 -6.808 1.00 . A A . 31 ILE N 1 1 8 7108 1 1 31 ILE O O 10.777 1.283 -5.006 1.00 . A A . 31 ILE O 1 1 8 7109 1 1 32 GLU C C 10.370 -0.511 -6.647 1.00 . A A . 32 GLU C 1 1 8 7110 1 1 32 GLU CA C 11.145 0.386 -7.599 1.00 . A A . 32 GLU CA 1 1 8 7111 1 1 32 GLU CB C 12.607 -0.064 -7.668 1.00 . A A . 32 GLU CB 1 1 8 7112 1 1 32 GLU CD C 14.733 0.898 -8.561 1.00 . A A . 32 GLU CD 1 1 8 7113 1 1 32 GLU CG C 13.278 0.564 -8.891 1.00 . A A . 32 GLU CG 1 1 8 7114 1 1 32 GLU H H 11.165 2.519 -7.806 1.00 . A A . 32 GLU H 1 1 8 7115 1 1 32 GLU HA H 10.702 0.319 -8.580 1.00 . A A . 32 GLU HA 1 1 8 7116 1 1 32 GLU HB2 H 13.122 0.251 -6.771 1.00 . A A . 32 GLU HB2 1 1 8 7117 1 1 32 GLU HB3 H 12.649 -1.140 -7.749 1.00 . A A . 32 GLU HB3 1 1 8 7118 1 1 32 GLU HG2 H 13.246 -0.133 -9.716 1.00 . A A . 32 GLU HG2 1 1 8 7119 1 1 32 GLU HG3 H 12.757 1.469 -9.164 1.00 . A A . 32 GLU HG3 1 1 8 7120 1 1 32 GLU N N 11.075 1.806 -7.142 1.00 . A A . 32 GLU N 1 1 8 7121 1 1 32 GLU O O 10.819 -1.575 -6.270 1.00 . A A . 32 GLU O 1 1 8 7122 1 1 32 GLU OE1 O 15.405 0.046 -8.003 1.00 . A A . 32 GLU OE1 1 1 8 7123 1 1 32 GLU OE2 O 15.153 2.001 -8.872 1.00 . A A . 32 GLU OE2 1 1 8 7124 1 1 33 LYS C C 7.009 -0.334 -5.118 1.00 . A A . 33 LYS C 1 1 8 7125 1 1 33 LYS CA C 8.408 -0.919 -5.304 1.00 . A A . 33 LYS CA 1 1 8 7126 1 1 33 LYS CB C 9.114 -0.986 -3.949 1.00 . A A . 33 LYS CB 1 1 8 7127 1 1 33 LYS CD C 11.357 -1.980 -3.470 1.00 . A A . 33 LYS CD 1 1 8 7128 1 1 33 LYS CE C 12.228 -3.209 -3.738 1.00 . A A . 33 LYS CE 1 1 8 7129 1 1 33 LYS CG C 9.910 -2.289 -3.856 1.00 . A A . 33 LYS CG 1 1 8 7130 1 1 33 LYS H H 8.869 0.790 -6.568 1.00 . A A . 33 LYS H 1 1 8 7131 1 1 33 LYS HA H 8.321 -1.919 -5.705 1.00 . A A . 33 LYS HA 1 1 8 7132 1 1 33 LYS HB2 H 9.782 -0.145 -3.847 1.00 . A A . 33 LYS HB2 1 1 8 7133 1 1 33 LYS HB3 H 8.379 -0.961 -3.158 1.00 . A A . 33 LYS HB3 1 1 8 7134 1 1 33 LYS HD2 H 11.716 -1.146 -4.057 1.00 . A A . 33 LYS HD2 1 1 8 7135 1 1 33 LYS HD3 H 11.405 -1.729 -2.422 1.00 . A A . 33 LYS HD3 1 1 8 7136 1 1 33 LYS HE2 H 11.912 -4.020 -3.097 1.00 . A A . 33 LYS HE2 1 1 8 7137 1 1 33 LYS HE3 H 12.124 -3.505 -4.771 1.00 . A A . 33 LYS HE3 1 1 8 7138 1 1 33 LYS HG2 H 9.465 -2.929 -3.109 1.00 . A A . 33 LYS HG2 1 1 8 7139 1 1 33 LYS HG3 H 9.894 -2.788 -4.813 1.00 . A A . 33 LYS HG3 1 1 8 7140 1 1 33 LYS HZ1 H 13.702 -2.220 -2.651 1.00 . A A . 33 LYS HZ1 1 1 8 7141 1 1 33 LYS HZ2 H 14.171 -3.749 -3.224 1.00 . A A . 33 LYS HZ2 1 1 8 7142 1 1 33 LYS HZ3 H 14.079 -2.437 -4.294 1.00 . A A . 33 LYS HZ3 1 1 8 7143 1 1 33 LYS N N 9.208 -0.082 -6.249 1.00 . A A . 33 LYS N 1 1 8 7144 1 1 33 LYS NZ N 13.653 -2.880 -3.455 1.00 . A A . 33 LYS NZ 1 1 8 7145 1 1 33 LYS O O 6.806 0.863 -5.190 1.00 . A A . 33 LYS O 1 1 8 7146 1 1 34 ALA C C 4.559 0.339 -3.596 1.00 . A A . 34 ALA C 1 1 8 7147 1 1 34 ALA CA C 4.636 -0.714 -4.704 1.00 . A A . 34 ALA CA 1 1 8 7148 1 1 34 ALA CB C 3.757 -1.907 -4.324 1.00 . A A . 34 ALA CB 1 1 8 7149 1 1 34 ALA H H 6.240 -2.140 -4.845 1.00 . A A . 34 ALA H 1 1 8 7150 1 1 34 ALA HA H 4.272 -0.288 -5.626 1.00 . A A . 34 ALA HA 1 1 8 7151 1 1 34 ALA HB1 H 4.374 -2.691 -3.910 1.00 . A A . 34 ALA HB1 1 1 8 7152 1 1 34 ALA HB2 H 3.028 -1.598 -3.589 1.00 . A A . 34 ALA HB2 1 1 8 7153 1 1 34 ALA HB3 H 3.248 -2.274 -5.203 1.00 . A A . 34 ALA HB3 1 1 8 7154 1 1 34 ALA N N 6.041 -1.182 -4.888 1.00 . A A . 34 ALA N 1 1 8 7155 1 1 34 ALA O O 5.226 0.245 -2.587 1.00 . A A . 34 ALA O 1 1 8 7156 1 1 35 TYR C C 2.106 2.861 -2.677 1.00 . A A . 35 TYR C 1 1 8 7157 1 1 35 TYR CA C 3.572 2.400 -2.740 1.00 . A A . 35 TYR CA 1 1 8 7158 1 1 35 TYR CB C 4.516 3.575 -3.057 1.00 . A A . 35 TYR CB 1 1 8 7159 1 1 35 TYR CD1 C 3.091 3.910 -5.145 1.00 . A A . 35 TYR CD1 1 1 8 7160 1 1 35 TYR CD2 C 4.528 5.709 -4.393 1.00 . A A . 35 TYR CD2 1 1 8 7161 1 1 35 TYR CE1 C 2.653 4.703 -6.211 1.00 . A A . 35 TYR CE1 1 1 8 7162 1 1 35 TYR CE2 C 4.092 6.501 -5.461 1.00 . A A . 35 TYR CE2 1 1 8 7163 1 1 35 TYR CG C 4.027 4.412 -4.228 1.00 . A A . 35 TYR CG 1 1 8 7164 1 1 35 TYR CZ C 3.149 5.999 -6.368 1.00 . A A . 35 TYR CZ 1 1 8 7165 1 1 35 TYR H H 3.198 1.365 -4.599 1.00 . A A . 35 TYR H 1 1 8 7166 1 1 35 TYR HA H 3.838 1.993 -1.770 1.00 . A A . 35 TYR HA 1 1 8 7167 1 1 35 TYR HB2 H 4.590 4.208 -2.185 1.00 . A A . 35 TYR HB2 1 1 8 7168 1 1 35 TYR HB3 H 5.494 3.182 -3.287 1.00 . A A . 35 TYR HB3 1 1 8 7169 1 1 35 TYR HD1 H 2.713 2.917 -5.039 1.00 . A A . 35 TYR HD1 1 1 8 7170 1 1 35 TYR HD2 H 5.250 6.102 -3.691 1.00 . A A . 35 TYR HD2 1 1 8 7171 1 1 35 TYR HE1 H 1.927 4.316 -6.910 1.00 . A A . 35 TYR HE1 1 1 8 7172 1 1 35 TYR HE2 H 4.481 7.501 -5.585 1.00 . A A . 35 TYR HE2 1 1 8 7173 1 1 35 TYR HH H 2.803 6.266 -8.227 1.00 . A A . 35 TYR HH 1 1 8 7174 1 1 35 TYR N N 3.728 1.332 -3.780 1.00 . A A . 35 TYR N 1 1 8 7175 1 1 35 TYR O O 1.373 2.788 -3.638 1.00 . A A . 35 TYR O 1 1 8 7176 1 1 35 TYR OH O 2.720 6.781 -7.421 1.00 . A A . 35 TYR OH 1 1 8 7177 1 1 36 VAL C C 0.122 5.235 -1.733 1.00 . A A . 36 VAL C 1 1 8 7178 1 1 36 VAL CA C 0.234 3.737 -1.420 1.00 . A A . 36 VAL CA 1 1 8 7179 1 1 36 VAL CB C -0.268 3.421 0.004 1.00 . A A . 36 VAL CB 1 1 8 7180 1 1 36 VAL CG1 C -1.073 4.585 0.583 1.00 . A A . 36 VAL CG1 1 1 8 7181 1 1 36 VAL CG2 C -1.161 2.180 -0.043 1.00 . A A . 36 VAL CG2 1 1 8 7182 1 1 36 VAL H H 2.249 3.340 -0.756 1.00 . A A . 36 VAL H 1 1 8 7183 1 1 36 VAL HA H -0.360 3.186 -2.134 1.00 . A A . 36 VAL HA 1 1 8 7184 1 1 36 VAL HB H 0.580 3.227 0.643 1.00 . A A . 36 VAL HB 1 1 8 7185 1 1 36 VAL HG11 H -1.726 4.984 -0.178 1.00 . A A . 36 VAL HG11 1 1 8 7186 1 1 36 VAL HG12 H -1.662 4.232 1.417 1.00 . A A . 36 VAL HG12 1 1 8 7187 1 1 36 VAL HG13 H -0.396 5.356 0.921 1.00 . A A . 36 VAL HG13 1 1 8 7188 1 1 36 VAL HG21 H -0.712 1.436 -0.684 1.00 . A A . 36 VAL HG21 1 1 8 7189 1 1 36 VAL HG22 H -1.272 1.778 0.953 1.00 . A A . 36 VAL HG22 1 1 8 7190 1 1 36 VAL HG23 H -2.133 2.450 -0.430 1.00 . A A . 36 VAL HG23 1 1 8 7191 1 1 36 VAL N N 1.658 3.307 -1.538 1.00 . A A . 36 VAL N 1 1 8 7192 1 1 36 VAL O O 0.552 6.072 -0.964 1.00 . A A . 36 VAL O 1 1 8 7193 1 1 37 LYS C C -2.053 7.347 -3.519 1.00 . A A . 37 LYS C 1 1 8 7194 1 1 37 LYS CA C -0.597 7.013 -3.219 1.00 . A A . 37 LYS CA 1 1 8 7195 1 1 37 LYS CB C 0.194 7.303 -4.487 1.00 . A A . 37 LYS CB 1 1 8 7196 1 1 37 LYS CD C 2.066 7.773 -2.886 1.00 . A A . 37 LYS CD 1 1 8 7197 1 1 37 LYS CE C 3.516 8.257 -2.952 1.00 . A A . 37 LYS CE 1 1 8 7198 1 1 37 LYS CG C 1.684 7.146 -4.230 1.00 . A A . 37 LYS CG 1 1 8 7199 1 1 37 LYS H H -0.800 4.881 -3.458 1.00 . A A . 37 LYS H 1 1 8 7200 1 1 37 LYS HA H -0.230 7.633 -2.419 1.00 . A A . 37 LYS HA 1 1 8 7201 1 1 37 LYS HB2 H -0.107 6.613 -5.261 1.00 . A A . 37 LYS HB2 1 1 8 7202 1 1 37 LYS HB3 H -0.007 8.313 -4.812 1.00 . A A . 37 LYS HB3 1 1 8 7203 1 1 37 LYS HD2 H 1.414 8.607 -2.677 1.00 . A A . 37 LYS HD2 1 1 8 7204 1 1 37 LYS HD3 H 1.972 7.036 -2.106 1.00 . A A . 37 LYS HD3 1 1 8 7205 1 1 37 LYS HE2 H 4.181 7.425 -2.771 1.00 . A A . 37 LYS HE2 1 1 8 7206 1 1 37 LYS HE3 H 3.713 8.670 -3.930 1.00 . A A . 37 LYS HE3 1 1 8 7207 1 1 37 LYS HG2 H 1.938 6.095 -4.229 1.00 . A A . 37 LYS HG2 1 1 8 7208 1 1 37 LYS HG3 H 2.216 7.648 -5.017 1.00 . A A . 37 LYS HG3 1 1 8 7209 1 1 37 LYS HZ1 H 3.439 8.945 -0.987 1.00 . A A . 37 LYS HZ1 1 1 8 7210 1 1 37 LYS HZ2 H 4.750 9.545 -1.880 1.00 . A A . 37 LYS HZ2 1 1 8 7211 1 1 37 LYS HZ3 H 3.188 10.152 -2.156 1.00 . A A . 37 LYS HZ3 1 1 8 7212 1 1 37 LYS N N -0.457 5.574 -2.856 1.00 . A A . 37 LYS N 1 1 8 7213 1 1 37 LYS NZ N 3.739 9.303 -1.915 1.00 . A A . 37 LYS NZ 1 1 8 7214 1 1 37 LYS O O -2.614 8.286 -2.992 1.00 . A A . 37 LYS O 1 1 8 7215 1 1 38 ASP C C -5.030 6.191 -3.838 1.00 . A A . 38 ASP C 1 1 8 7216 1 1 38 ASP CA C -4.057 6.890 -4.790 1.00 . A A . 38 ASP CA 1 1 8 7217 1 1 38 ASP CB C -4.273 6.391 -6.218 1.00 . A A . 38 ASP CB 1 1 8 7218 1 1 38 ASP CG C -5.722 6.636 -6.638 1.00 . A A . 38 ASP CG 1 1 8 7219 1 1 38 ASP H H -2.163 5.864 -4.833 1.00 . A A . 38 ASP H 1 1 8 7220 1 1 38 ASP HA H -4.226 7.955 -4.757 1.00 . A A . 38 ASP HA 1 1 8 7221 1 1 38 ASP HB2 H -3.605 6.920 -6.887 1.00 . A A . 38 ASP HB2 1 1 8 7222 1 1 38 ASP HB3 H -4.057 5.336 -6.263 1.00 . A A . 38 ASP HB3 1 1 8 7223 1 1 38 ASP N N -2.653 6.602 -4.401 1.00 . A A . 38 ASP N 1 1 8 7224 1 1 38 ASP O O -5.687 5.238 -4.200 1.00 . A A . 38 ASP O 1 1 8 7225 1 1 38 ASP OD1 O -6.490 7.094 -5.807 1.00 . A A . 38 ASP OD1 1 1 8 7226 1 1 38 ASP OD2 O -6.041 6.361 -7.782 1.00 . A A . 38 ASP OD2 1 1 8 7227 1 1 39 VAL C C -7.422 5.805 -2.341 1.00 . A A . 39 VAL C 1 1 8 7228 1 1 39 VAL CA C -6.073 6.035 -1.658 1.00 . A A . 39 VAL CA 1 1 8 7229 1 1 39 VAL CB C -6.265 6.961 -0.457 1.00 . A A . 39 VAL CB 1 1 8 7230 1 1 39 VAL CG1 C -4.908 7.247 0.192 1.00 . A A . 39 VAL CG1 1 1 8 7231 1 1 39 VAL CG2 C -6.893 8.276 -0.927 1.00 . A A . 39 VAL CG2 1 1 8 7232 1 1 39 VAL H H -4.601 7.443 -2.358 1.00 . A A . 39 VAL H 1 1 8 7233 1 1 39 VAL HA H -5.670 5.090 -1.326 1.00 . A A . 39 VAL HA 1 1 8 7234 1 1 39 VAL HB H -6.915 6.487 0.264 1.00 . A A . 39 VAL HB 1 1 8 7235 1 1 39 VAL HG11 H -4.121 7.043 -0.518 1.00 . A A . 39 VAL HG11 1 1 8 7236 1 1 39 VAL HG12 H -4.863 8.285 0.491 1.00 . A A . 39 VAL HG12 1 1 8 7237 1 1 39 VAL HG13 H -4.783 6.617 1.060 1.00 . A A . 39 VAL HG13 1 1 8 7238 1 1 39 VAL HG21 H -6.323 8.670 -1.755 1.00 . A A . 39 VAL HG21 1 1 8 7239 1 1 39 VAL HG22 H -7.909 8.096 -1.243 1.00 . A A . 39 VAL HG22 1 1 8 7240 1 1 39 VAL HG23 H -6.889 8.989 -0.115 1.00 . A A . 39 VAL HG23 1 1 8 7241 1 1 39 VAL N N -5.135 6.667 -2.627 1.00 . A A . 39 VAL N 1 1 8 7242 1 1 39 VAL O O -8.057 4.786 -2.156 1.00 . A A . 39 VAL O 1 1 8 7243 1 1 40 GLU C C -9.074 5.446 -4.840 1.00 . A A . 40 GLU C 1 1 8 7244 1 1 40 GLU CA C -9.172 6.587 -3.826 1.00 . A A . 40 GLU CA 1 1 8 7245 1 1 40 GLU CB C -9.522 7.886 -4.553 1.00 . A A . 40 GLU CB 1 1 8 7246 1 1 40 GLU CD C -11.740 8.497 -3.584 1.00 . A A . 40 GLU CD 1 1 8 7247 1 1 40 GLU CG C -10.247 8.829 -3.592 1.00 . A A . 40 GLU CG 1 1 8 7248 1 1 40 GLU H H -7.334 7.560 -3.264 1.00 . A A . 40 GLU H 1 1 8 7249 1 1 40 GLU HA H -9.941 6.362 -3.102 1.00 . A A . 40 GLU HA 1 1 8 7250 1 1 40 GLU HB2 H -8.615 8.358 -4.905 1.00 . A A . 40 GLU HB2 1 1 8 7251 1 1 40 GLU HB3 H -10.163 7.668 -5.393 1.00 . A A . 40 GLU HB3 1 1 8 7252 1 1 40 GLU HG2 H -9.845 8.708 -2.597 1.00 . A A . 40 GLU HG2 1 1 8 7253 1 1 40 GLU HG3 H -10.109 9.850 -3.915 1.00 . A A . 40 GLU HG3 1 1 8 7254 1 1 40 GLU N N -7.864 6.747 -3.129 1.00 . A A . 40 GLU N 1 1 8 7255 1 1 40 GLU O O -10.068 4.919 -5.294 1.00 . A A . 40 GLU O 1 1 8 7256 1 1 40 GLU OE1 O -12.108 7.493 -4.171 1.00 . A A . 40 GLU OE1 1 1 8 7257 1 1 40 GLU OE2 O -12.493 9.253 -2.991 1.00 . A A . 40 GLU OE2 1 1 8 7258 1 1 41 GLY C C -8.078 2.624 -5.513 1.00 . A A . 41 GLY C 1 1 8 7259 1 1 41 GLY CA C -7.716 3.952 -6.179 1.00 . A A . 41 GLY CA 1 1 8 7260 1 1 41 GLY H H -7.089 5.499 -4.818 1.00 . A A . 41 GLY H 1 1 8 7261 1 1 41 GLY HA2 H -8.367 4.124 -7.025 1.00 . A A . 41 GLY HA2 1 1 8 7262 1 1 41 GLY HA3 H -6.690 3.917 -6.513 1.00 . A A . 41 GLY HA3 1 1 8 7263 1 1 41 GLY N N -7.880 5.061 -5.197 1.00 . A A . 41 GLY N 1 1 8 7264 1 1 41 GLY O O -8.390 1.652 -6.172 1.00 . A A . 41 GLY O 1 1 8 7265 1 1 42 ALA C C -9.366 1.618 -2.368 1.00 . A A . 42 ALA C 1 1 8 7266 1 1 42 ALA CA C -8.383 1.311 -3.499 1.00 . A A . 42 ALA CA 1 1 8 7267 1 1 42 ALA CB C -7.110 0.691 -2.918 1.00 . A A . 42 ALA CB 1 1 8 7268 1 1 42 ALA H H -7.788 3.372 -3.697 1.00 . A A . 42 ALA H 1 1 8 7269 1 1 42 ALA HA H -8.836 0.619 -4.194 1.00 . A A . 42 ALA HA 1 1 8 7270 1 1 42 ALA HB1 H -6.443 1.476 -2.593 1.00 . A A . 42 ALA HB1 1 1 8 7271 1 1 42 ALA HB2 H -7.367 0.066 -2.075 1.00 . A A . 42 ALA HB2 1 1 8 7272 1 1 42 ALA HB3 H -6.622 0.094 -3.674 1.00 . A A . 42 ALA HB3 1 1 8 7273 1 1 42 ALA N N -8.040 2.575 -4.210 1.00 . A A . 42 ALA N 1 1 8 7274 1 1 42 ALA O O -9.191 2.562 -1.622 1.00 . A A . 42 ALA O 1 1 8 7275 1 1 43 SER C C -10.852 0.559 0.175 1.00 . A A . 43 SER C 1 1 8 7276 1 1 43 SER CA C -11.390 1.087 -1.156 1.00 . A A . 43 SER CA 1 1 8 7277 1 1 43 SER CB C -12.695 0.371 -1.493 1.00 . A A . 43 SER CB 1 1 8 7278 1 1 43 SER H H -10.527 0.080 -2.845 1.00 . A A . 43 SER H 1 1 8 7279 1 1 43 SER HA H -11.572 2.148 -1.075 1.00 . A A . 43 SER HA 1 1 8 7280 1 1 43 SER HB2 H -12.502 -0.420 -2.194 1.00 . A A . 43 SER HB2 1 1 8 7281 1 1 43 SER HB3 H -13.115 -0.048 -0.593 1.00 . A A . 43 SER HB3 1 1 8 7282 1 1 43 SER HG H -14.233 1.560 -1.394 1.00 . A A . 43 SER HG 1 1 8 7283 1 1 43 SER N N -10.399 0.834 -2.235 1.00 . A A . 43 SER N 1 1 8 7284 1 1 43 SER O O -9.685 0.237 0.307 1.00 . A A . 43 SER O 1 1 8 7285 1 1 43 SER OG O -13.606 1.298 -2.071 1.00 . A A . 43 SER OG 1 1 8 7286 1 1 44 GLN C C -10.989 -1.536 2.406 1.00 . A A . 44 GLN C 1 1 8 7287 1 1 44 GLN CA C -11.261 -0.034 2.491 1.00 . A A . 44 GLN CA 1 1 8 7288 1 1 44 GLN CB C -12.355 0.232 3.525 1.00 . A A . 44 GLN CB 1 1 8 7289 1 1 44 GLN CD C -13.135 1.937 5.178 1.00 . A A . 44 GLN CD 1 1 8 7290 1 1 44 GLN CG C -11.916 1.370 4.450 1.00 . A A . 44 GLN CG 1 1 8 7291 1 1 44 GLN H H -12.635 0.734 1.024 1.00 . A A . 44 GLN H 1 1 8 7292 1 1 44 GLN HA H -10.357 0.479 2.785 1.00 . A A . 44 GLN HA 1 1 8 7293 1 1 44 GLN HB2 H -13.269 0.510 3.020 1.00 . A A . 44 GLN HB2 1 1 8 7294 1 1 44 GLN HB3 H -12.523 -0.660 4.111 1.00 . A A . 44 GLN HB3 1 1 8 7295 1 1 44 GLN HE21 H -14.189 0.263 5.012 1.00 . A A . 44 GLN HE21 1 1 8 7296 1 1 44 GLN HE22 H -14.972 1.537 5.815 1.00 . A A . 44 GLN HE22 1 1 8 7297 1 1 44 GLN HG2 H -11.206 0.994 5.171 1.00 . A A . 44 GLN HG2 1 1 8 7298 1 1 44 GLN HG3 H -11.454 2.151 3.863 1.00 . A A . 44 GLN HG3 1 1 8 7299 1 1 44 GLN N N -11.703 0.469 1.160 1.00 . A A . 44 GLN N 1 1 8 7300 1 1 44 GLN NE2 N -14.186 1.183 5.350 1.00 . A A . 44 GLN NE2 1 1 8 7301 1 1 44 GLN O O -9.955 -2.007 2.825 1.00 . A A . 44 GLN O 1 1 8 7302 1 1 44 GLN OE1 O -13.132 3.078 5.595 1.00 . A A . 44 GLN OE1 1 1 8 7303 1 1 45 GLU C C -10.640 -4.033 0.671 1.00 . A A . 45 GLU C 1 1 8 7304 1 1 45 GLU CA C -11.677 -3.763 1.754 1.00 . A A . 45 GLU CA 1 1 8 7305 1 1 45 GLU CB C -12.974 -4.477 1.391 1.00 . A A . 45 GLU CB 1 1 8 7306 1 1 45 GLU CD C -14.861 -2.843 1.287 1.00 . A A . 45 GLU CD 1 1 8 7307 1 1 45 GLU CG C -13.818 -3.601 0.464 1.00 . A A . 45 GLU CG 1 1 8 7308 1 1 45 GLU H H -12.733 -1.890 1.529 1.00 . A A . 45 GLU H 1 1 8 7309 1 1 45 GLU HA H -11.313 -4.140 2.698 1.00 . A A . 45 GLU HA 1 1 8 7310 1 1 45 GLU HB2 H -12.744 -5.410 0.894 1.00 . A A . 45 GLU HB2 1 1 8 7311 1 1 45 GLU HB3 H -13.518 -4.678 2.290 1.00 . A A . 45 GLU HB3 1 1 8 7312 1 1 45 GLU HG2 H -13.177 -2.893 -0.044 1.00 . A A . 45 GLU HG2 1 1 8 7313 1 1 45 GLU HG3 H -14.318 -4.220 -0.265 1.00 . A A . 45 GLU HG3 1 1 8 7314 1 1 45 GLU N N -11.904 -2.291 1.864 1.00 . A A . 45 GLU N 1 1 8 7315 1 1 45 GLU O O -10.099 -5.114 0.567 1.00 . A A . 45 GLU O 1 1 8 7316 1 1 45 GLU OE1 O -14.467 -1.993 2.068 1.00 . A A . 45 GLU OE1 1 1 8 7317 1 1 45 GLU OE2 O -16.036 -3.126 1.123 1.00 . A A . 45 GLU OE2 1 1 8 7318 1 1 46 GLU C C -7.996 -2.828 -0.549 1.00 . A A . 46 GLU C 1 1 8 7319 1 1 46 GLU CA C -9.314 -3.221 -1.173 1.00 . A A . 46 GLU CA 1 1 8 7320 1 1 46 GLU CB C -9.616 -2.291 -2.345 1.00 . A A . 46 GLU CB 1 1 8 7321 1 1 46 GLU CD C -11.234 -1.879 -4.201 1.00 . A A . 46 GLU CD 1 1 8 7322 1 1 46 GLU CG C -11.039 -2.542 -2.836 1.00 . A A . 46 GLU CG 1 1 8 7323 1 1 46 GLU H H -10.769 -2.173 0.013 1.00 . A A . 46 GLU H 1 1 8 7324 1 1 46 GLU HA H -9.284 -4.249 -1.502 1.00 . A A . 46 GLU HA 1 1 8 7325 1 1 46 GLU HB2 H -9.522 -1.264 -2.021 1.00 . A A . 46 GLU HB2 1 1 8 7326 1 1 46 GLU HB3 H -8.920 -2.481 -3.142 1.00 . A A . 46 GLU HB3 1 1 8 7327 1 1 46 GLU HG2 H -11.208 -3.606 -2.922 1.00 . A A . 46 GLU HG2 1 1 8 7328 1 1 46 GLU HG3 H -11.737 -2.121 -2.128 1.00 . A A . 46 GLU HG3 1 1 8 7329 1 1 46 GLU N N -10.340 -3.045 -0.115 1.00 . A A . 46 GLU N 1 1 8 7330 1 1 46 GLU O O -6.981 -3.476 -0.703 1.00 . A A . 46 GLU O 1 1 8 7331 1 1 46 GLU OE1 O -11.387 -0.669 -4.233 1.00 . A A . 46 GLU OE1 1 1 8 7332 1 1 46 GLU OE2 O -11.223 -2.592 -5.191 1.00 . A A . 46 GLU OE2 1 1 8 7333 1 1 47 VAL C C -6.424 -2.370 1.915 1.00 . A A . 47 VAL C 1 1 8 7334 1 1 47 VAL CA C -6.834 -1.297 0.902 1.00 . A A . 47 VAL CA 1 1 8 7335 1 1 47 VAL CB C -7.174 0.003 1.630 1.00 . A A . 47 VAL CB 1 1 8 7336 1 1 47 VAL CG1 C -6.106 0.295 2.674 1.00 . A A . 47 VAL CG1 1 1 8 7337 1 1 47 VAL CG2 C -7.234 1.151 0.622 1.00 . A A . 47 VAL CG2 1 1 8 7338 1 1 47 VAL H H -8.890 -1.304 0.306 1.00 . A A . 47 VAL H 1 1 8 7339 1 1 47 VAL HA H -6.033 -1.127 0.197 1.00 . A A . 47 VAL HA 1 1 8 7340 1 1 47 VAL HB H -8.133 -0.100 2.117 1.00 . A A . 47 VAL HB 1 1 8 7341 1 1 47 VAL HG11 H -5.148 0.390 2.189 1.00 . A A . 47 VAL HG11 1 1 8 7342 1 1 47 VAL HG12 H -6.348 1.214 3.185 1.00 . A A . 47 VAL HG12 1 1 8 7343 1 1 47 VAL HG13 H -6.072 -0.517 3.385 1.00 . A A . 47 VAL HG13 1 1 8 7344 1 1 47 VAL HG21 H -7.609 0.783 -0.322 1.00 . A A . 47 VAL HG21 1 1 8 7345 1 1 47 VAL HG22 H -7.893 1.922 0.994 1.00 . A A . 47 VAL HG22 1 1 8 7346 1 1 47 VAL HG23 H -6.244 1.560 0.481 1.00 . A A . 47 VAL HG23 1 1 8 7347 1 1 47 VAL N N -8.042 -1.771 0.195 1.00 . A A . 47 VAL N 1 1 8 7348 1 1 47 VAL O O -5.276 -2.756 2.001 1.00 . A A . 47 VAL O 1 1 8 7349 1 1 48 GLU C C -6.711 -5.197 2.963 1.00 . A A . 48 GLU C 1 1 8 7350 1 1 48 GLU CA C -7.083 -3.895 3.672 1.00 . A A . 48 GLU CA 1 1 8 7351 1 1 48 GLU CB C -8.349 -4.086 4.484 1.00 . A A . 48 GLU CB 1 1 8 7352 1 1 48 GLU CD C -8.759 -4.751 6.854 1.00 . A A . 48 GLU CD 1 1 8 7353 1 1 48 GLU CG C -8.073 -3.737 5.938 1.00 . A A . 48 GLU CG 1 1 8 7354 1 1 48 GLU H H -8.284 -2.542 2.593 1.00 . A A . 48 GLU H 1 1 8 7355 1 1 48 GLU HA H -6.277 -3.580 4.318 1.00 . A A . 48 GLU HA 1 1 8 7356 1 1 48 GLU HB2 H -9.118 -3.432 4.099 1.00 . A A . 48 GLU HB2 1 1 8 7357 1 1 48 GLU HB3 H -8.674 -5.098 4.401 1.00 . A A . 48 GLU HB3 1 1 8 7358 1 1 48 GLU HG2 H -7.007 -3.751 6.109 1.00 . A A . 48 GLU HG2 1 1 8 7359 1 1 48 GLU HG3 H -8.456 -2.750 6.139 1.00 . A A . 48 GLU HG3 1 1 8 7360 1 1 48 GLU N N -7.369 -2.857 2.676 1.00 . A A . 48 GLU N 1 1 8 7361 1 1 48 GLU O O -5.613 -5.694 3.109 1.00 . A A . 48 GLU O 1 1 8 7362 1 1 48 GLU OE1 O -8.300 -5.882 6.902 1.00 . A A . 48 GLU OE1 1 1 8 7363 1 1 48 GLU OE2 O -9.730 -4.381 7.492 1.00 . A A . 48 GLU OE2 1 1 8 7364 1 1 49 GLU C C -5.878 -6.911 0.890 1.00 . A A . 49 GLU C 1 1 8 7365 1 1 49 GLU CA C -7.288 -7.022 1.477 1.00 . A A . 49 GLU CA 1 1 8 7366 1 1 49 GLU CB C -8.293 -7.249 0.347 1.00 . A A . 49 GLU CB 1 1 8 7367 1 1 49 GLU CD C -10.492 -8.281 -0.235 1.00 . A A . 49 GLU CD 1 1 8 7368 1 1 49 GLU CG C -9.571 -7.870 0.915 1.00 . A A . 49 GLU CG 1 1 8 7369 1 1 49 GLU H H -8.503 -5.339 2.087 1.00 . A A . 49 GLU H 1 1 8 7370 1 1 49 GLU HA H -7.326 -7.850 2.170 1.00 . A A . 49 GLU HA 1 1 8 7371 1 1 49 GLU HB2 H -8.527 -6.305 -0.121 1.00 . A A . 49 GLU HB2 1 1 8 7372 1 1 49 GLU HB3 H -7.865 -7.918 -0.386 1.00 . A A . 49 GLU HB3 1 1 8 7373 1 1 49 GLU HG2 H -9.317 -8.741 1.503 1.00 . A A . 49 GLU HG2 1 1 8 7374 1 1 49 GLU HG3 H -10.076 -7.148 1.538 1.00 . A A . 49 GLU HG3 1 1 8 7375 1 1 49 GLU N N -7.615 -5.754 2.194 1.00 . A A . 49 GLU N 1 1 8 7376 1 1 49 GLU O O -5.034 -7.757 1.110 1.00 . A A . 49 GLU O 1 1 8 7377 1 1 49 GLU OE1 O -10.773 -7.439 -1.072 1.00 . A A . 49 GLU OE1 1 1 8 7378 1 1 49 GLU OE2 O -10.902 -9.430 -0.259 1.00 . A A . 49 GLU OE2 1 1 8 7379 1 1 50 ALA C C -3.254 -5.476 0.704 1.00 . A A . 50 ALA C 1 1 8 7380 1 1 50 ALA CA C -4.260 -5.679 -0.431 1.00 . A A . 50 ALA CA 1 1 8 7381 1 1 50 ALA CB C -4.255 -4.433 -1.320 1.00 . A A . 50 ALA CB 1 1 8 7382 1 1 50 ALA H H -6.310 -5.188 0.005 1.00 . A A . 50 ALA H 1 1 8 7383 1 1 50 ALA HA H -3.993 -6.551 -1.020 1.00 . A A . 50 ALA HA 1 1 8 7384 1 1 50 ALA HB1 H -5.186 -4.376 -1.863 1.00 . A A . 50 ALA HB1 1 1 8 7385 1 1 50 ALA HB2 H -4.140 -3.552 -0.705 1.00 . A A . 50 ALA HB2 1 1 8 7386 1 1 50 ALA HB3 H -3.433 -4.494 -2.019 1.00 . A A . 50 ALA HB3 1 1 8 7387 1 1 50 ALA N N -5.616 -5.862 0.158 1.00 . A A . 50 ALA N 1 1 8 7388 1 1 50 ALA O O -2.084 -5.777 0.580 1.00 . A A . 50 ALA O 1 1 8 7389 1 1 51 MET C C -2.509 -5.998 3.704 1.00 . A A . 51 MET C 1 1 8 7390 1 1 51 MET CA C -2.807 -4.692 2.963 1.00 . A A . 51 MET CA 1 1 8 7391 1 1 51 MET CB C -3.491 -3.711 3.918 1.00 . A A . 51 MET CB 1 1 8 7392 1 1 51 MET CE C -3.598 -1.083 6.041 1.00 . A A . 51 MET CE 1 1 8 7393 1 1 51 MET CG C -2.568 -3.409 5.095 1.00 . A A . 51 MET CG 1 1 8 7394 1 1 51 MET H H -4.660 -4.704 1.872 1.00 . A A . 51 MET H 1 1 8 7395 1 1 51 MET HA H -1.883 -4.260 2.609 1.00 . A A . 51 MET HA 1 1 8 7396 1 1 51 MET HB2 H -3.715 -2.794 3.392 1.00 . A A . 51 MET HB2 1 1 8 7397 1 1 51 MET HB3 H -4.408 -4.147 4.285 1.00 . A A . 51 MET HB3 1 1 8 7398 1 1 51 MET HE1 H -3.316 -0.977 5.003 1.00 . A A . 51 MET HE1 1 1 8 7399 1 1 51 MET HE2 H -4.598 -0.698 6.190 1.00 . A A . 51 MET HE2 1 1 8 7400 1 1 51 MET HE3 H -2.906 -0.530 6.657 1.00 . A A . 51 MET HE3 1 1 8 7401 1 1 51 MET HG2 H -2.030 -4.303 5.372 1.00 . A A . 51 MET HG2 1 1 8 7402 1 1 51 MET HG3 H -1.868 -2.641 4.808 1.00 . A A . 51 MET HG3 1 1 8 7403 1 1 51 MET N N -3.712 -4.947 1.807 1.00 . A A . 51 MET N 1 1 8 7404 1 1 51 MET O O -1.527 -6.108 4.410 1.00 . A A . 51 MET O 1 1 8 7405 1 1 51 MET SD S -3.553 -2.832 6.501 1.00 . A A . 51 MET SD 1 1 8 7406 1 1 52 ASP C C -2.313 -9.222 3.351 1.00 . A A . 52 ASP C 1 1 8 7407 1 1 52 ASP CA C -3.098 -8.277 4.261 1.00 . A A . 52 ASP CA 1 1 8 7408 1 1 52 ASP CB C -4.436 -8.920 4.633 1.00 . A A . 52 ASP CB 1 1 8 7409 1 1 52 ASP CG C -4.487 -9.152 6.143 1.00 . A A . 52 ASP CG 1 1 8 7410 1 1 52 ASP H H -4.135 -6.883 2.985 1.00 . A A . 52 ASP H 1 1 8 7411 1 1 52 ASP HA H -2.529 -8.091 5.161 1.00 . A A . 52 ASP HA 1 1 8 7412 1 1 52 ASP HB2 H -5.243 -8.265 4.339 1.00 . A A . 52 ASP HB2 1 1 8 7413 1 1 52 ASP HB3 H -4.535 -9.865 4.121 1.00 . A A . 52 ASP HB3 1 1 8 7414 1 1 52 ASP N N -3.346 -6.988 3.555 1.00 . A A . 52 ASP N 1 1 8 7415 1 1 52 ASP O O -1.755 -10.206 3.796 1.00 . A A . 52 ASP O 1 1 8 7416 1 1 52 ASP OD1 O -3.717 -8.519 6.846 1.00 . A A . 52 ASP OD1 1 1 8 7417 1 1 52 ASP OD2 O -5.297 -9.957 6.571 1.00 . A A . 52 ASP OD2 1 1 8 7418 1 1 53 THR C C -0.075 -9.317 1.011 1.00 . A A . 53 THR C 1 1 8 7419 1 1 53 THR CA C -1.515 -9.820 1.146 1.00 . A A . 53 THR CA 1 1 8 7420 1 1 53 THR CB C -2.193 -9.803 -0.225 1.00 . A A . 53 THR CB 1 1 8 7421 1 1 53 THR CG2 C -3.620 -10.338 -0.098 1.00 . A A . 53 THR CG2 1 1 8 7422 1 1 53 THR H H -2.722 -8.137 1.740 1.00 . A A . 53 THR H 1 1 8 7423 1 1 53 THR HA H -1.509 -10.829 1.532 1.00 . A A . 53 THR HA 1 1 8 7424 1 1 53 THR HB H -1.638 -10.425 -0.911 1.00 . A A . 53 THR HB 1 1 8 7425 1 1 53 THR HG1 H -1.724 -8.441 -1.532 1.00 . A A . 53 THR HG1 1 1 8 7426 1 1 53 THR HG21 H -3.634 -11.163 0.598 1.00 . A A . 53 THR HG21 1 1 8 7427 1 1 53 THR HG22 H -4.268 -9.553 0.261 1.00 . A A . 53 THR HG22 1 1 8 7428 1 1 53 THR HG23 H -3.964 -10.676 -1.064 1.00 . A A . 53 THR HG23 1 1 8 7429 1 1 53 THR N N -2.264 -8.935 2.081 1.00 . A A . 53 THR N 1 1 8 7430 1 1 53 THR O O 0.301 -8.752 0.002 1.00 . A A . 53 THR O 1 1 8 7431 1 1 53 THR OG1 O -2.227 -8.470 -0.715 1.00 . A A . 53 THR OG1 1 1 8 7432 1 1 54 CYS C C 3.037 -9.942 2.807 1.00 . A A . 54 CYS C 1 1 8 7433 1 1 54 CYS CA C 2.147 -9.048 1.937 1.00 . A A . 54 CYS CA 1 1 8 7434 1 1 54 CYS CB C 2.237 -7.603 2.437 1.00 . A A . 54 CYS CB 1 1 8 7435 1 1 54 CYS H H 0.413 -9.975 2.821 1.00 . A A . 54 CYS H 1 1 8 7436 1 1 54 CYS HA H 2.482 -9.094 0.911 1.00 . A A . 54 CYS HA 1 1 8 7437 1 1 54 CYS HB2 H 1.458 -7.011 1.985 1.00 . A A . 54 CYS HB2 1 1 8 7438 1 1 54 CYS HB3 H 2.120 -7.589 3.510 1.00 . A A . 54 CYS HB3 1 1 8 7439 1 1 54 CYS N N 0.734 -9.517 2.016 1.00 . A A . 54 CYS N 1 1 8 7440 1 1 54 CYS O O 2.750 -10.155 3.969 1.00 . A A . 54 CYS O 1 1 8 7441 1 1 54 CYS SG S 3.836 -6.790 2.078 1.00 . A A . 54 CYS SG 1 1 8 7442 1 1 55 PRO C C 5.905 -10.461 3.901 1.00 . A A . 55 PRO C 1 1 8 7443 1 1 55 PRO CA C 5.044 -11.306 2.959 1.00 . A A . 55 PRO CA 1 1 8 7444 1 1 55 PRO CB C 5.895 -11.932 1.856 1.00 . A A . 55 PRO CB 1 1 8 7445 1 1 55 PRO CD C 4.508 -10.223 0.825 1.00 . A A . 55 PRO CD 1 1 8 7446 1 1 55 PRO CG C 5.821 -10.968 0.711 1.00 . A A . 55 PRO CG 1 1 8 7447 1 1 55 PRO HA H 4.515 -12.071 3.503 1.00 . A A . 55 PRO HA 1 1 8 7448 1 1 55 PRO HB2 H 6.907 -12.062 2.220 1.00 . A A . 55 PRO HB2 1 1 8 7449 1 1 55 PRO HB3 H 5.487 -12.894 1.591 1.00 . A A . 55 PRO HB3 1 1 8 7450 1 1 55 PRO HD2 H 4.655 -9.171 0.621 1.00 . A A . 55 PRO HD2 1 1 8 7451 1 1 55 PRO HD3 H 3.777 -10.641 0.151 1.00 . A A . 55 PRO HD3 1 1 8 7452 1 1 55 PRO HG2 H 6.649 -10.274 0.768 1.00 . A A . 55 PRO HG2 1 1 8 7453 1 1 55 PRO HG3 H 5.854 -11.507 -0.222 1.00 . A A . 55 PRO HG3 1 1 8 7454 1 1 55 PRO N N 4.096 -10.431 2.217 1.00 . A A . 55 PRO N 1 1 8 7455 1 1 55 PRO O O 7.117 -10.515 3.866 1.00 . A A . 55 PRO O 1 1 8 7456 1 1 56 VAL C C 5.097 -7.693 6.156 1.00 . A A . 56 VAL C 1 1 8 7457 1 1 56 VAL CA C 6.030 -8.810 5.685 1.00 . A A . 56 VAL CA 1 1 8 7458 1 1 56 VAL CB C 7.249 -8.202 4.980 1.00 . A A . 56 VAL CB 1 1 8 7459 1 1 56 VAL CG1 C 6.842 -7.718 3.589 1.00 . A A . 56 VAL CG1 1 1 8 7460 1 1 56 VAL CG2 C 7.780 -7.019 5.795 1.00 . A A . 56 VAL CG2 1 1 8 7461 1 1 56 VAL H H 4.299 -9.655 4.734 1.00 . A A . 56 VAL H 1 1 8 7462 1 1 56 VAL HA H 6.354 -9.396 6.534 1.00 . A A . 56 VAL HA 1 1 8 7463 1 1 56 VAL HB H 8.022 -8.951 4.889 1.00 . A A . 56 VAL HB 1 1 8 7464 1 1 56 VAL HG11 H 5.766 -7.733 3.502 1.00 . A A . 56 VAL HG11 1 1 8 7465 1 1 56 VAL HG12 H 7.201 -6.711 3.438 1.00 . A A . 56 VAL HG12 1 1 8 7466 1 1 56 VAL HG13 H 7.272 -8.369 2.840 1.00 . A A . 56 VAL HG13 1 1 8 7467 1 1 56 VAL HG21 H 7.551 -7.168 6.840 1.00 . A A . 56 VAL HG21 1 1 8 7468 1 1 56 VAL HG22 H 8.850 -6.945 5.667 1.00 . A A . 56 VAL HG22 1 1 8 7469 1 1 56 VAL HG23 H 7.312 -6.107 5.451 1.00 . A A . 56 VAL HG23 1 1 8 7470 1 1 56 VAL N N 5.277 -9.677 4.735 1.00 . A A . 56 VAL N 1 1 8 7471 1 1 56 VAL O O 5.243 -7.158 7.237 1.00 . A A . 56 VAL O 1 1 8 7472 1 1 57 GLN C C 3.927 -4.960 5.969 1.00 . A A . 57 GLN C 1 1 8 7473 1 1 57 GLN CA C 3.174 -6.275 5.733 1.00 . A A . 57 GLN CA 1 1 8 7474 1 1 57 GLN CB C 2.450 -6.685 7.018 1.00 . A A . 57 GLN CB 1 1 8 7475 1 1 57 GLN CD C 0.207 -7.179 8.004 1.00 . A A . 57 GLN CD 1 1 8 7476 1 1 57 GLN CG C 0.996 -7.041 6.699 1.00 . A A . 57 GLN CG 1 1 8 7477 1 1 57 GLN H H 4.035 -7.800 4.483 1.00 . A A . 57 GLN H 1 1 8 7478 1 1 57 GLN HA H 2.450 -6.140 4.939 1.00 . A A . 57 GLN HA 1 1 8 7479 1 1 57 GLN HB2 H 2.944 -7.544 7.450 1.00 . A A . 57 GLN HB2 1 1 8 7480 1 1 57 GLN HB3 H 2.471 -5.866 7.721 1.00 . A A . 57 GLN HB3 1 1 8 7481 1 1 57 GLN HE21 H 1.300 -8.699 8.672 1.00 . A A . 57 GLN HE21 1 1 8 7482 1 1 57 GLN HE22 H 0.047 -8.197 9.702 1.00 . A A . 57 GLN HE22 1 1 8 7483 1 1 57 GLN HG2 H 0.559 -6.261 6.093 1.00 . A A . 57 GLN HG2 1 1 8 7484 1 1 57 GLN HG3 H 0.964 -7.976 6.161 1.00 . A A . 57 GLN HG3 1 1 8 7485 1 1 57 GLN N N 4.133 -7.347 5.347 1.00 . A A . 57 GLN N 1 1 8 7486 1 1 57 GLN NE2 N 0.546 -8.102 8.864 1.00 . A A . 57 GLN NE2 1 1 8 7487 1 1 57 GLN O O 4.084 -4.516 7.089 1.00 . A A . 57 GLN O 1 1 8 7488 1 1 57 GLN OE1 O -0.726 -6.440 8.244 1.00 . A A . 57 GLN OE1 1 1 8 7489 1 1 58 CYS C C 4.104 -1.891 5.162 1.00 . A A . 58 CYS C 1 1 8 7490 1 1 58 CYS CA C 5.117 -3.037 5.084 1.00 . A A . 58 CYS CA 1 1 8 7491 1 1 58 CYS CB C 6.027 -2.815 3.876 1.00 . A A . 58 CYS CB 1 1 8 7492 1 1 58 CYS H H 4.242 -4.700 4.026 1.00 . A A . 58 CYS H 1 1 8 7493 1 1 58 CYS HA H 5.712 -3.062 5.985 1.00 . A A . 58 CYS HA 1 1 8 7494 1 1 58 CYS HB2 H 6.590 -1.904 4.013 1.00 . A A . 58 CYS HB2 1 1 8 7495 1 1 58 CYS HB3 H 6.707 -3.647 3.779 1.00 . A A . 58 CYS HB3 1 1 8 7496 1 1 58 CYS HG H 5.609 -2.684 1.622 1.00 . A A . 58 CYS HG 1 1 8 7497 1 1 58 CYS N N 4.386 -4.328 4.922 1.00 . A A . 58 CYS N 1 1 8 7498 1 1 58 CYS O O 4.461 -0.730 5.139 1.00 . A A . 58 CYS O 1 1 8 7499 1 1 58 CYS SG S 5.018 -2.682 2.379 1.00 . A A . 58 CYS SG 1 1 8 7500 1 1 59 ILE C C 1.752 -0.521 6.697 1.00 . A A . 59 ILE C 1 1 8 7501 1 1 59 ILE CA C 1.794 -1.152 5.303 1.00 . A A . 59 ILE CA 1 1 8 7502 1 1 59 ILE CB C 0.434 -1.779 4.993 1.00 . A A . 59 ILE CB 1 1 8 7503 1 1 59 ILE CD1 C -1.256 -0.904 3.377 1.00 . A A . 59 ILE CD1 1 1 8 7504 1 1 59 ILE CG1 C -0.594 -0.676 4.737 1.00 . A A . 59 ILE CG1 1 1 8 7505 1 1 59 ILE CG2 C -0.014 -2.630 6.184 1.00 . A A . 59 ILE CG2 1 1 8 7506 1 1 59 ILE H H 2.576 -3.155 5.249 1.00 . A A . 59 ILE H 1 1 8 7507 1 1 59 ILE HA H 2.010 -0.390 4.570 1.00 . A A . 59 ILE HA 1 1 8 7508 1 1 59 ILE HB H 0.519 -2.405 4.116 1.00 . A A . 59 ILE HB 1 1 8 7509 1 1 59 ILE HD11 H -1.149 -1.940 3.095 1.00 . A A . 59 ILE HD11 1 1 8 7510 1 1 59 ILE HD12 H -2.305 -0.654 3.441 1.00 . A A . 59 ILE HD12 1 1 8 7511 1 1 59 ILE HD13 H -0.781 -0.278 2.636 1.00 . A A . 59 ILE HD13 1 1 8 7512 1 1 59 ILE HG12 H -1.346 -0.696 5.513 1.00 . A A . 59 ILE HG12 1 1 8 7513 1 1 59 ILE HG13 H -0.101 0.284 4.738 1.00 . A A . 59 ILE HG13 1 1 8 7514 1 1 59 ILE HG21 H 0.775 -2.663 6.920 1.00 . A A . 59 ILE HG21 1 1 8 7515 1 1 59 ILE HG22 H -0.899 -2.194 6.624 1.00 . A A . 59 ILE HG22 1 1 8 7516 1 1 59 ILE HG23 H -0.237 -3.632 5.847 1.00 . A A . 59 ILE HG23 1 1 8 7517 1 1 59 ILE N N 2.840 -2.212 5.241 1.00 . A A . 59 ILE N 1 1 8 7518 1 1 59 ILE O O 2.133 -1.127 7.679 1.00 . A A . 59 ILE O 1 1 8 7519 1 1 60 HIS C C 0.093 2.442 8.037 1.00 . A A . 60 HIS C 1 1 8 7520 1 1 60 HIS CA C 1.184 1.374 8.107 1.00 . A A . 60 HIS CA 1 1 8 7521 1 1 60 HIS CB C 2.520 2.034 8.445 1.00 . A A . 60 HIS CB 1 1 8 7522 1 1 60 HIS CD2 C 3.949 -0.053 9.156 1.00 . A A . 60 HIS CD2 1 1 8 7523 1 1 60 HIS CE1 C 5.398 -0.007 7.545 1.00 . A A . 60 HIS CE1 1 1 8 7524 1 1 60 HIS CG C 3.621 1.014 8.357 1.00 . A A . 60 HIS CG 1 1 8 7525 1 1 60 HIS H H 0.967 1.153 5.979 1.00 . A A . 60 HIS H 1 1 8 7526 1 1 60 HIS HA H 0.933 0.651 8.870 1.00 . A A . 60 HIS HA 1 1 8 7527 1 1 60 HIS HB2 H 2.713 2.835 7.747 1.00 . A A . 60 HIS HB2 1 1 8 7528 1 1 60 HIS HB3 H 2.477 2.433 9.448 1.00 . A A . 60 HIS HB3 1 1 8 7529 1 1 60 HIS HD1 H 4.601 1.664 6.594 1.00 . A A . 60 HIS HD1 1 1 8 7530 1 1 60 HIS HD2 H 3.418 -0.349 10.050 1.00 . A A . 60 HIS HD2 1 1 8 7531 1 1 60 HIS HE1 H 6.232 -0.249 6.904 1.00 . A A . 60 HIS HE1 1 1 8 7532 1 1 60 HIS N N 1.276 0.692 6.786 1.00 . A A . 60 HIS N 1 1 8 7533 1 1 60 HIS ND1 N 4.558 1.024 7.336 1.00 . A A . 60 HIS ND1 1 1 8 7534 1 1 60 HIS NE2 N 5.071 -0.697 8.642 1.00 . A A . 60 HIS NE2 1 1 8 7535 1 1 60 HIS O O 0.109 3.301 7.178 1.00 . A A . 60 HIS O 1 1 8 7536 1 1 61 TRP C C -1.408 4.759 9.383 1.00 . A A . 61 TRP C 1 1 8 7537 1 1 61 TRP CA C -1.947 3.411 8.899 1.00 . A A . 61 TRP CA 1 1 8 7538 1 1 61 TRP CB C -3.097 2.962 9.804 1.00 . A A . 61 TRP CB 1 1 8 7539 1 1 61 TRP CD1 C -3.355 0.521 9.172 1.00 . A A . 61 TRP CD1 1 1 8 7540 1 1 61 TRP CD2 C -5.073 1.795 8.494 1.00 . A A . 61 TRP CD2 1 1 8 7541 1 1 61 TRP CE2 C -5.364 0.478 8.075 1.00 . A A . 61 TRP CE2 1 1 8 7542 1 1 61 TRP CE3 C -5.990 2.807 8.198 1.00 . A A . 61 TRP CE3 1 1 8 7543 1 1 61 TRP CG C -3.801 1.800 9.186 1.00 . A A . 61 TRP CG 1 1 8 7544 1 1 61 TRP CH2 C -7.446 1.199 7.090 1.00 . A A . 61 TRP CH2 1 1 8 7545 1 1 61 TRP CZ2 C -6.536 0.177 7.379 1.00 . A A . 61 TRP CZ2 1 1 8 7546 1 1 61 TRP CZ3 C -7.174 2.514 7.499 1.00 . A A . 61 TRP CZ3 1 1 8 7547 1 1 61 TRP H H -0.855 1.695 9.612 1.00 . A A . 61 TRP H 1 1 8 7548 1 1 61 TRP HA H -2.312 3.519 7.888 1.00 . A A . 61 TRP HA 1 1 8 7549 1 1 61 TRP HB2 H -2.713 2.678 10.764 1.00 . A A . 61 TRP HB2 1 1 8 7550 1 1 61 TRP HB3 H -3.794 3.777 9.925 1.00 . A A . 61 TRP HB3 1 1 8 7551 1 1 61 TRP HD1 H -2.430 0.172 9.604 1.00 . A A . 61 TRP HD1 1 1 8 7552 1 1 61 TRP HE1 H -4.206 -1.232 8.364 1.00 . A A . 61 TRP HE1 1 1 8 7553 1 1 61 TRP HE3 H -5.780 3.819 8.512 1.00 . A A . 61 TRP HE3 1 1 8 7554 1 1 61 TRP HH2 H -8.356 0.977 6.553 1.00 . A A . 61 TRP HH2 1 1 8 7555 1 1 61 TRP HZ2 H -6.740 -0.839 7.068 1.00 . A A . 61 TRP HZ2 1 1 8 7556 1 1 61 TRP HZ3 H -7.877 3.303 7.276 1.00 . A A . 61 TRP HZ3 1 1 8 7557 1 1 61 TRP N N -0.857 2.396 8.928 1.00 . A A . 61 TRP N 1 1 8 7558 1 1 61 TRP NE1 N -4.285 -0.267 8.512 1.00 . A A . 61 TRP NE1 1 1 8 7559 1 1 61 TRP O O -0.280 4.867 9.821 1.00 . A A . 61 TRP O 1 1 8 7560 1 1 62 GLU C C -2.919 7.891 10.372 1.00 . A A . 62 GLU C 1 1 8 7561 1 1 62 GLU CA C -1.744 7.132 9.749 1.00 . A A . 62 GLU CA 1 1 8 7562 1 1 62 GLU CB C -1.202 7.906 8.539 1.00 . A A . 62 GLU CB 1 1 8 7563 1 1 62 GLU CD C -0.210 9.661 10.021 1.00 . A A . 62 GLU CD 1 1 8 7564 1 1 62 GLU CG C -1.158 9.406 8.848 1.00 . A A . 62 GLU CG 1 1 8 7565 1 1 62 GLU H H -3.110 5.676 8.944 1.00 . A A . 62 GLU H 1 1 8 7566 1 1 62 GLU HA H -0.959 7.017 10.483 1.00 . A A . 62 GLU HA 1 1 8 7567 1 1 62 GLU HB2 H -0.206 7.559 8.310 1.00 . A A . 62 GLU HB2 1 1 8 7568 1 1 62 GLU HB3 H -1.844 7.734 7.688 1.00 . A A . 62 GLU HB3 1 1 8 7569 1 1 62 GLU HG2 H -0.808 9.941 7.977 1.00 . A A . 62 GLU HG2 1 1 8 7570 1 1 62 GLU HG3 H -2.148 9.748 9.108 1.00 . A A . 62 GLU HG3 1 1 8 7571 1 1 62 GLU N N -2.206 5.788 9.303 1.00 . A A . 62 GLU N 1 1 8 7572 1 1 62 GLU O O -3.806 8.355 9.684 1.00 . A A . 62 GLU O 1 1 8 7573 1 1 62 GLU OE1 O 0.942 9.274 9.920 1.00 . A A . 62 GLU OE1 1 1 8 7574 1 1 62 GLU OE2 O -0.653 10.239 10.999 1.00 . A A . 62 GLU OE2 1 1 8 7575 1 1 63 ASP C C -3.477 9.964 13.082 1.00 . A A . 63 ASP C 1 1 8 7576 1 1 63 ASP CA C -4.041 8.752 12.338 1.00 . A A . 63 ASP CA 1 1 8 7577 1 1 63 ASP CB C -4.737 7.822 13.333 1.00 . A A . 63 ASP CB 1 1 8 7578 1 1 63 ASP CG C -5.758 8.618 14.146 1.00 . A A . 63 ASP CG 1 1 8 7579 1 1 63 ASP H H -2.201 7.641 12.205 1.00 . A A . 63 ASP H 1 1 8 7580 1 1 63 ASP HA H -4.752 9.082 11.596 1.00 . A A . 63 ASP HA 1 1 8 7581 1 1 63 ASP HB2 H -5.241 7.031 12.796 1.00 . A A . 63 ASP HB2 1 1 8 7582 1 1 63 ASP HB3 H -4.003 7.394 13.999 1.00 . A A . 63 ASP HB3 1 1 8 7583 1 1 63 ASP N N -2.927 8.022 11.670 1.00 . A A . 63 ASP N 1 1 8 7584 1 1 63 ASP O O -2.963 9.848 14.176 1.00 . A A . 63 ASP O 1 1 8 7585 1 1 63 ASP OD1 O -6.208 9.640 13.656 1.00 . A A . 63 ASP OD1 1 1 8 7586 1 1 63 ASP OD2 O -6.070 8.193 15.246 1.00 . A A . 63 ASP OD2 1 1 8 7587 1 1 64 GLU C C -4.169 13.034 13.933 1.00 . A A . 64 GLU C 1 1 8 7588 1 1 64 GLU CA C -3.038 12.342 13.170 1.00 . A A . 64 GLU CA 1 1 8 7589 1 1 64 GLU CB C -2.467 13.299 12.121 1.00 . A A . 64 GLU CB 1 1 8 7590 1 1 64 GLU CD C -0.445 14.635 11.516 1.00 . A A . 64 GLU CD 1 1 8 7591 1 1 64 GLU CG C -0.961 13.452 12.337 1.00 . A A . 64 GLU CG 1 1 8 7592 1 1 64 GLU H H -3.987 11.197 11.613 1.00 . A A . 64 GLU H 1 1 8 7593 1 1 64 GLU HA H -2.258 12.058 13.861 1.00 . A A . 64 GLU HA 1 1 8 7594 1 1 64 GLU HB2 H -2.653 12.902 11.134 1.00 . A A . 64 GLU HB2 1 1 8 7595 1 1 64 GLU HB3 H -2.943 14.263 12.217 1.00 . A A . 64 GLU HB3 1 1 8 7596 1 1 64 GLU HG2 H -0.764 13.628 13.385 1.00 . A A . 64 GLU HG2 1 1 8 7597 1 1 64 GLU HG3 H -0.458 12.551 12.023 1.00 . A A . 64 GLU HG3 1 1 8 7598 1 1 64 GLU N N -3.569 11.125 12.496 1.00 . A A . 64 GLU N 1 1 8 7599 1 1 64 GLU OE1 O -0.509 14.560 10.300 1.00 . A A . 64 GLU OE1 1 1 8 7600 1 1 64 GLU OE2 O 0.009 15.595 12.117 1.00 . A A . 64 GLU OE2 1 1 8 7601 2 2 1 SF4 FE1 FE 5.358 -4.904 -2.119 1.00 . B A . 65 SF4 FE1 1 1 8 7602 2 2 1 SF4 FE2 FE 3.816 -6.178 -0.017 1.00 . B A . 65 SF4 FE2 1 1 8 7603 2 2 1 SF4 FE3 FE 2.753 -4.654 -2.161 1.00 . B A . 65 SF4 FE3 1 1 8 7604 2 2 1 SF4 FE4 FE 4.066 -7.267 -2.689 1.00 . B A . 65 SF4 FE4 1 1 8 7605 2 2 1 SF4 S1 S 2.061 -6.830 -1.204 1.00 . B A . 65 SF4 S1 1 1 8 7606 2 2 1 SF4 S2 S 4.216 -5.052 -3.765 1.00 . B A . 65 SF4 S2 1 1 8 7607 2 2 1 SF4 S3 S 5.715 -7.161 -1.211 1.00 . B A . 65 SF4 S3 1 1 8 7608 2 2 1 SF4 S4 S 4.127 -3.775 -0.669 1.00 . B A . 65 SF4 S4 1 1 9 7609 1 1 1 ALA C C -7.961 10.559 9.799 1.00 . A A . 1 ALA C 1 1 9 7610 1 1 1 ALA CA C -8.919 11.751 9.786 1.00 . A A . 1 ALA CA 1 1 9 7611 1 1 1 ALA CB C -9.856 11.660 10.992 1.00 . A A . 1 ALA CB 1 1 9 7612 1 1 1 ALA HA H -8.354 12.669 9.837 1.00 . A A . 1 ALA HA 1 1 9 7613 1 1 1 ALA HB1 H -10.627 12.413 10.907 1.00 . A A . 1 ALA HB1 1 1 9 7614 1 1 1 ALA HB2 H -10.310 10.681 11.022 1.00 . A A . 1 ALA HB2 1 1 9 7615 1 1 1 ALA HB3 H -9.293 11.824 11.898 1.00 . A A . 1 ALA HB3 1 1 9 7616 1 1 1 ALA N N -9.721 11.729 8.531 1.00 . A A . 1 ALA N 1 1 9 7617 1 1 1 ALA O O -6.790 10.694 10.092 1.00 . A A . 1 ALA O 1 1 9 7618 1 1 2 ARG C C -7.027 7.964 8.066 1.00 . A A . 2 ARG C 1 1 9 7619 1 1 2 ARG CA C -7.567 8.192 9.479 1.00 . A A . 2 ARG CA 1 1 9 7620 1 1 2 ARG CB C -8.370 6.966 9.922 1.00 . A A . 2 ARG CB 1 1 9 7621 1 1 2 ARG CD C -10.162 5.547 8.917 1.00 . A A . 2 ARG CD 1 1 9 7622 1 1 2 ARG CG C -9.740 6.982 9.243 1.00 . A A . 2 ARG CG 1 1 9 7623 1 1 2 ARG CZ C -10.095 3.609 10.368 1.00 . A A . 2 ARG CZ 1 1 9 7624 1 1 2 ARG H H -9.398 9.303 9.251 1.00 . A A . 2 ARG H 1 1 9 7625 1 1 2 ARG HA H -6.742 8.348 10.159 1.00 . A A . 2 ARG HA 1 1 9 7626 1 1 2 ARG HB2 H -7.838 6.068 9.644 1.00 . A A . 2 ARG HB2 1 1 9 7627 1 1 2 ARG HB3 H -8.501 6.991 10.994 1.00 . A A . 2 ARG HB3 1 1 9 7628 1 1 2 ARG HD2 H -11.022 5.566 8.264 1.00 . A A . 2 ARG HD2 1 1 9 7629 1 1 2 ARG HD3 H -9.348 5.036 8.425 1.00 . A A . 2 ARG HD3 1 1 9 7630 1 1 2 ARG HE H -11.046 5.281 10.863 1.00 . A A . 2 ARG HE 1 1 9 7631 1 1 2 ARG HG2 H -10.466 7.430 9.907 1.00 . A A . 2 ARG HG2 1 1 9 7632 1 1 2 ARG HG3 H -9.684 7.555 8.330 1.00 . A A . 2 ARG HG3 1 1 9 7633 1 1 2 ARG HH11 H -10.132 3.131 8.424 1.00 . A A . 2 ARG HH11 1 1 9 7634 1 1 2 ARG HH12 H -9.621 1.871 9.497 1.00 . A A . 2 ARG HH12 1 1 9 7635 1 1 2 ARG HH21 H -9.959 3.805 12.356 1.00 . A A . 2 ARG HH21 1 1 9 7636 1 1 2 ARG HH22 H -9.524 2.252 11.724 1.00 . A A . 2 ARG HH22 1 1 9 7637 1 1 2 ARG N N -8.449 9.391 9.484 1.00 . A A . 2 ARG N 1 1 9 7638 1 1 2 ARG NE N -10.508 4.832 10.177 1.00 . A A . 2 ARG NE 1 1 9 7639 1 1 2 ARG NH1 N -9.937 2.808 9.351 1.00 . A A . 2 ARG NH1 1 1 9 7640 1 1 2 ARG NH2 N -9.839 3.189 11.577 1.00 . A A . 2 ARG NH2 1 1 9 7641 1 1 2 ARG O O -7.716 7.462 7.200 1.00 . A A . 2 ARG O 1 1 9 7642 1 1 3 LYS C C -4.303 6.906 6.477 1.00 . A A . 3 LYS C 1 1 9 7643 1 1 3 LYS CA C -5.214 8.134 6.467 1.00 . A A . 3 LYS CA 1 1 9 7644 1 1 3 LYS CB C -4.399 9.368 6.077 1.00 . A A . 3 LYS CB 1 1 9 7645 1 1 3 LYS CD C -4.909 11.096 4.345 1.00 . A A . 3 LYS CD 1 1 9 7646 1 1 3 LYS CE C -5.095 11.348 2.847 1.00 . A A . 3 LYS CE 1 1 9 7647 1 1 3 LYS CG C -4.550 9.627 4.576 1.00 . A A . 3 LYS CG 1 1 9 7648 1 1 3 LYS H H -5.258 8.733 8.536 1.00 . A A . 3 LYS H 1 1 9 7649 1 1 3 LYS HA H -6.008 7.985 5.750 1.00 . A A . 3 LYS HA 1 1 9 7650 1 1 3 LYS HB2 H -4.758 10.224 6.629 1.00 . A A . 3 LYS HB2 1 1 9 7651 1 1 3 LYS HB3 H -3.358 9.200 6.308 1.00 . A A . 3 LYS HB3 1 1 9 7652 1 1 3 LYS HD2 H -5.826 11.329 4.866 1.00 . A A . 3 LYS HD2 1 1 9 7653 1 1 3 LYS HD3 H -4.113 11.724 4.716 1.00 . A A . 3 LYS HD3 1 1 9 7654 1 1 3 LYS HE2 H -5.162 10.404 2.328 1.00 . A A . 3 LYS HE2 1 1 9 7655 1 1 3 LYS HE3 H -6.002 11.913 2.687 1.00 . A A . 3 LYS HE3 1 1 9 7656 1 1 3 LYS HG2 H -3.620 9.398 4.076 1.00 . A A . 3 LYS HG2 1 1 9 7657 1 1 3 LYS HG3 H -5.336 9.000 4.180 1.00 . A A . 3 LYS HG3 1 1 9 7658 1 1 3 LYS HZ1 H -3.404 12.531 3.122 1.00 . A A . 3 LYS HZ1 1 1 9 7659 1 1 3 LYS HZ2 H -3.307 11.485 1.791 1.00 . A A . 3 LYS HZ2 1 1 9 7660 1 1 3 LYS HZ3 H -4.271 12.880 1.703 1.00 . A A . 3 LYS HZ3 1 1 9 7661 1 1 3 LYS N N -5.797 8.330 7.824 1.00 . A A . 3 LYS N 1 1 9 7662 1 1 3 LYS NZ N -3.931 12.120 2.327 1.00 . A A . 3 LYS NZ 1 1 9 7663 1 1 3 LYS O O -4.461 6.013 7.287 1.00 . A A . 3 LYS O 1 1 9 7664 1 1 4 PHE C C -1.434 5.846 4.393 1.00 . A A . 4 PHE C 1 1 9 7665 1 1 4 PHE CA C -2.424 5.689 5.549 1.00 . A A . 4 PHE CA 1 1 9 7666 1 1 4 PHE CB C -3.230 4.399 5.359 1.00 . A A . 4 PHE CB 1 1 9 7667 1 1 4 PHE CD1 C -4.594 5.304 3.441 1.00 . A A . 4 PHE CD1 1 1 9 7668 1 1 4 PHE CD2 C -3.357 3.243 3.125 1.00 . A A . 4 PHE CD2 1 1 9 7669 1 1 4 PHE CE1 C -5.069 5.221 2.126 1.00 . A A . 4 PHE CE1 1 1 9 7670 1 1 4 PHE CE2 C -3.831 3.160 1.810 1.00 . A A . 4 PHE CE2 1 1 9 7671 1 1 4 PHE CG C -3.738 4.315 3.940 1.00 . A A . 4 PHE CG 1 1 9 7672 1 1 4 PHE CZ C -4.687 4.149 1.311 1.00 . A A . 4 PHE CZ 1 1 9 7673 1 1 4 PHE H H -3.236 7.585 4.953 1.00 . A A . 4 PHE H 1 1 9 7674 1 1 4 PHE HA H -1.878 5.638 6.478 1.00 . A A . 4 PHE HA 1 1 9 7675 1 1 4 PHE HB2 H -2.595 3.548 5.564 1.00 . A A . 4 PHE HB2 1 1 9 7676 1 1 4 PHE HB3 H -4.066 4.393 6.040 1.00 . A A . 4 PHE HB3 1 1 9 7677 1 1 4 PHE HD1 H -4.888 6.132 4.070 1.00 . A A . 4 PHE HD1 1 1 9 7678 1 1 4 PHE HD2 H -2.696 2.480 3.510 1.00 . A A . 4 PHE HD2 1 1 9 7679 1 1 4 PHE HE1 H -5.727 5.984 1.740 1.00 . A A . 4 PHE HE1 1 1 9 7680 1 1 4 PHE HE2 H -3.536 2.332 1.182 1.00 . A A . 4 PHE HE2 1 1 9 7681 1 1 4 PHE HZ H -5.052 4.084 0.297 1.00 . A A . 4 PHE HZ 1 1 9 7682 1 1 4 PHE N N -3.348 6.855 5.590 1.00 . A A . 4 PHE N 1 1 9 7683 1 1 4 PHE O O -1.448 6.823 3.671 1.00 . A A . 4 PHE O 1 1 9 7684 1 1 5 TYR C C 1.346 3.740 3.281 1.00 . A A . 5 TYR C 1 1 9 7685 1 1 5 TYR CA C 0.427 4.938 3.124 1.00 . A A . 5 TYR CA 1 1 9 7686 1 1 5 TYR CB C 1.256 6.219 3.226 1.00 . A A . 5 TYR CB 1 1 9 7687 1 1 5 TYR CD1 C 1.360 6.468 5.734 1.00 . A A . 5 TYR CD1 1 1 9 7688 1 1 5 TYR CD2 C 3.404 5.983 4.524 1.00 . A A . 5 TYR CD2 1 1 9 7689 1 1 5 TYR CE1 C 2.074 6.470 6.939 1.00 . A A . 5 TYR CE1 1 1 9 7690 1 1 5 TYR CE2 C 4.118 5.986 5.728 1.00 . A A . 5 TYR CE2 1 1 9 7691 1 1 5 TYR CG C 2.025 6.223 4.526 1.00 . A A . 5 TYR CG 1 1 9 7692 1 1 5 TYR CZ C 3.453 6.230 6.936 1.00 . A A . 5 TYR CZ 1 1 9 7693 1 1 5 TYR H H -0.588 4.101 4.816 1.00 . A A . 5 TYR H 1 1 9 7694 1 1 5 TYR HA H -0.072 4.895 2.166 1.00 . A A . 5 TYR HA 1 1 9 7695 1 1 5 TYR HB2 H 1.949 6.263 2.399 1.00 . A A . 5 TYR HB2 1 1 9 7696 1 1 5 TYR HB3 H 0.603 7.072 3.189 1.00 . A A . 5 TYR HB3 1 1 9 7697 1 1 5 TYR HD1 H 0.297 6.653 5.738 1.00 . A A . 5 TYR HD1 1 1 9 7698 1 1 5 TYR HD2 H 3.917 5.794 3.592 1.00 . A A . 5 TYR HD2 1 1 9 7699 1 1 5 TYR HE1 H 1.561 6.659 7.870 1.00 . A A . 5 TYR HE1 1 1 9 7700 1 1 5 TYR HE2 H 5.182 5.800 5.725 1.00 . A A . 5 TYR HE2 1 1 9 7701 1 1 5 TYR HH H 3.823 6.950 8.664 1.00 . A A . 5 TYR HH 1 1 9 7702 1 1 5 TYR N N -0.575 4.880 4.219 1.00 . A A . 5 TYR N 1 1 9 7703 1 1 5 TYR O O 1.059 2.831 4.032 1.00 . A A . 5 TYR O 1 1 9 7704 1 1 5 TYR OH O 4.157 6.232 8.123 1.00 . A A . 5 TYR OH 1 1 9 7705 1 1 6 VAL C C 4.784 2.983 2.856 1.00 . A A . 6 VAL C 1 1 9 7706 1 1 6 VAL CA C 3.349 2.548 2.757 1.00 . A A . 6 VAL CA 1 1 9 7707 1 1 6 VAL CB C 3.282 1.613 1.557 1.00 . A A . 6 VAL CB 1 1 9 7708 1 1 6 VAL CG1 C 3.200 0.188 2.077 1.00 . A A . 6 VAL CG1 1 1 9 7709 1 1 6 VAL CG2 C 2.069 1.916 0.680 1.00 . A A . 6 VAL CG2 1 1 9 7710 1 1 6 VAL H H 2.679 4.453 1.991 1.00 . A A . 6 VAL H 1 1 9 7711 1 1 6 VAL HA H 3.076 2.001 3.646 1.00 . A A . 6 VAL HA 1 1 9 7712 1 1 6 VAL HB H 4.193 1.726 0.972 1.00 . A A . 6 VAL HB 1 1 9 7713 1 1 6 VAL HG11 H 3.671 0.137 3.048 1.00 . A A . 6 VAL HG11 1 1 9 7714 1 1 6 VAL HG12 H 2.165 -0.102 2.160 1.00 . A A . 6 VAL HG12 1 1 9 7715 1 1 6 VAL HG13 H 3.710 -0.473 1.394 1.00 . A A . 6 VAL HG13 1 1 9 7716 1 1 6 VAL HG21 H 1.795 2.949 0.783 1.00 . A A . 6 VAL HG21 1 1 9 7717 1 1 6 VAL HG22 H 2.317 1.716 -0.351 1.00 . A A . 6 VAL HG22 1 1 9 7718 1 1 6 VAL HG23 H 1.241 1.291 0.980 1.00 . A A . 6 VAL HG23 1 1 9 7719 1 1 6 VAL N N 2.448 3.715 2.599 1.00 . A A . 6 VAL N 1 1 9 7720 1 1 6 VAL O O 5.111 4.143 3.010 1.00 . A A . 6 VAL O 1 1 9 7721 1 1 7 ASP C C 7.764 1.264 1.908 1.00 . A A . 7 ASP C 1 1 9 7722 1 1 7 ASP CA C 7.075 2.305 2.741 1.00 . A A . 7 ASP CA 1 1 9 7723 1 1 7 ASP CB C 7.607 2.278 4.169 1.00 . A A . 7 ASP CB 1 1 9 7724 1 1 7 ASP CG C 8.125 3.665 4.553 1.00 . A A . 7 ASP CG 1 1 9 7725 1 1 7 ASP H H 5.328 1.113 2.562 1.00 . A A . 7 ASP H 1 1 9 7726 1 1 7 ASP HA H 7.250 3.257 2.299 1.00 . A A . 7 ASP HA 1 1 9 7727 1 1 7 ASP HB2 H 6.812 1.991 4.832 1.00 . A A . 7 ASP HB2 1 1 9 7728 1 1 7 ASP HB3 H 8.412 1.562 4.241 1.00 . A A . 7 ASP HB3 1 1 9 7729 1 1 7 ASP N N 5.642 2.028 2.717 1.00 . A A . 7 ASP N 1 1 9 7730 1 1 7 ASP O O 8.014 0.158 2.344 1.00 . A A . 7 ASP O 1 1 9 7731 1 1 7 ASP OD1 O 7.924 4.587 3.779 1.00 . A A . 7 ASP OD1 1 1 9 7732 1 1 7 ASP OD2 O 8.715 3.783 5.615 1.00 . A A . 7 ASP OD2 1 1 9 7733 1 1 8 GLN C C 10.155 0.342 0.312 1.00 . A A . 8 GLN C 1 1 9 7734 1 1 8 GLN CA C 8.758 0.668 -0.211 1.00 . A A . 8 GLN CA 1 1 9 7735 1 1 8 GLN CB C 8.902 1.302 -1.576 1.00 . A A . 8 GLN CB 1 1 9 7736 1 1 8 GLN CD C 6.805 2.643 -1.750 1.00 . A A . 8 GLN CD 1 1 9 7737 1 1 8 GLN CG C 7.534 1.391 -2.240 1.00 . A A . 8 GLN CG 1 1 9 7738 1 1 8 GLN H H 7.836 2.514 0.400 1.00 . A A . 8 GLN H 1 1 9 7739 1 1 8 GLN HA H 8.181 -0.241 -0.295 1.00 . A A . 8 GLN HA 1 1 9 7740 1 1 8 GLN HB2 H 9.325 2.292 -1.474 1.00 . A A . 8 GLN HB2 1 1 9 7741 1 1 8 GLN HB3 H 9.554 0.688 -2.163 1.00 . A A . 8 GLN HB3 1 1 9 7742 1 1 8 GLN HE21 H 8.290 3.870 -2.234 1.00 . A A . 8 GLN HE21 1 1 9 7743 1 1 8 GLN HE22 H 6.933 4.613 -1.536 1.00 . A A . 8 GLN HE22 1 1 9 7744 1 1 8 GLN HG2 H 7.656 1.438 -3.313 1.00 . A A . 8 GLN HG2 1 1 9 7745 1 1 8 GLN HG3 H 6.960 0.516 -1.981 1.00 . A A . 8 GLN HG3 1 1 9 7746 1 1 8 GLN N N 8.070 1.615 0.705 1.00 . A A . 8 GLN N 1 1 9 7747 1 1 8 GLN NE2 N 7.392 3.805 -1.849 1.00 . A A . 8 GLN NE2 1 1 9 7748 1 1 8 GLN O O 11.114 0.290 -0.434 1.00 . A A . 8 GLN O 1 1 9 7749 1 1 8 GLN OE1 O 5.691 2.564 -1.273 1.00 . A A . 8 GLN OE1 1 1 9 7750 1 1 9 ASP C C 11.669 -1.741 2.330 1.00 . A A . 9 ASP C 1 1 9 7751 1 1 9 ASP CA C 11.599 -0.230 2.159 1.00 . A A . 9 ASP CA 1 1 9 7752 1 1 9 ASP CB C 11.751 0.437 3.526 1.00 . A A . 9 ASP CB 1 1 9 7753 1 1 9 ASP CG C 13.102 1.151 3.600 1.00 . A A . 9 ASP CG 1 1 9 7754 1 1 9 ASP H H 9.478 0.147 2.142 1.00 . A A . 9 ASP H 1 1 9 7755 1 1 9 ASP HA H 12.386 0.101 1.498 1.00 . A A . 9 ASP HA 1 1 9 7756 1 1 9 ASP HB2 H 10.954 1.153 3.668 1.00 . A A . 9 ASP HB2 1 1 9 7757 1 1 9 ASP HB3 H 11.702 -0.317 4.298 1.00 . A A . 9 ASP HB3 1 1 9 7758 1 1 9 ASP N N 10.272 0.111 1.576 1.00 . A A . 9 ASP N 1 1 9 7759 1 1 9 ASP O O 12.723 -2.344 2.268 1.00 . A A . 9 ASP O 1 1 9 7760 1 1 9 ASP OD1 O 13.474 1.775 2.619 1.00 . A A . 9 ASP OD1 1 1 9 7761 1 1 9 ASP OD2 O 13.740 1.064 4.635 1.00 . A A . 9 ASP OD2 1 1 9 7762 1 1 10 GLU C C 9.657 -4.438 1.609 1.00 . A A . 10 GLU C 1 1 9 7763 1 1 10 GLU CA C 10.510 -3.824 2.722 1.00 . A A . 10 GLU CA 1 1 9 7764 1 1 10 GLU CB C 9.885 -4.150 4.080 1.00 . A A . 10 GLU CB 1 1 9 7765 1 1 10 GLU CD C 11.255 -4.146 6.168 1.00 . A A . 10 GLU CD 1 1 9 7766 1 1 10 GLU CG C 10.878 -4.952 4.924 1.00 . A A . 10 GLU CG 1 1 9 7767 1 1 10 GLU H H 9.709 -1.839 2.590 1.00 . A A . 10 GLU H 1 1 9 7768 1 1 10 GLU HA H 11.514 -4.216 2.678 1.00 . A A . 10 GLU HA 1 1 9 7769 1 1 10 GLU HB2 H 9.637 -3.231 4.591 1.00 . A A . 10 GLU HB2 1 1 9 7770 1 1 10 GLU HB3 H 8.989 -4.731 3.931 1.00 . A A . 10 GLU HB3 1 1 9 7771 1 1 10 GLU HG2 H 10.424 -5.886 5.223 1.00 . A A . 10 GLU HG2 1 1 9 7772 1 1 10 GLU HG3 H 11.766 -5.152 4.343 1.00 . A A . 10 GLU HG3 1 1 9 7773 1 1 10 GLU N N 10.542 -2.353 2.546 1.00 . A A . 10 GLU N 1 1 9 7774 1 1 10 GLU O O 9.090 -5.501 1.765 1.00 . A A . 10 GLU O 1 1 9 7775 1 1 10 GLU OE1 O 11.312 -2.931 6.067 1.00 . A A . 10 GLU OE1 1 1 9 7776 1 1 10 GLU OE2 O 11.478 -4.755 7.200 1.00 . A A . 10 GLU OE2 1 1 9 7777 1 1 11 CYS C C 9.567 -5.198 -1.536 1.00 . A A . 11 CYS C 1 1 9 7778 1 1 11 CYS CA C 8.720 -4.319 -0.619 1.00 . A A . 11 CYS CA 1 1 9 7779 1 1 11 CYS CB C 8.102 -3.178 -1.435 1.00 . A A . 11 CYS CB 1 1 9 7780 1 1 11 CYS H H 10.006 -2.909 0.383 1.00 . A A . 11 CYS H 1 1 9 7781 1 1 11 CYS HA H 7.926 -4.919 -0.198 1.00 . A A . 11 CYS HA 1 1 9 7782 1 1 11 CYS HB2 H 7.357 -2.666 -0.844 1.00 . A A . 11 CYS HB2 1 1 9 7783 1 1 11 CYS HB3 H 8.872 -2.481 -1.729 1.00 . A A . 11 CYS HB3 1 1 9 7784 1 1 11 CYS N N 9.551 -3.771 0.489 1.00 . A A . 11 CYS N 1 1 9 7785 1 1 11 CYS O O 10.515 -4.748 -2.150 1.00 . A A . 11 CYS O 1 1 9 7786 1 1 11 CYS SG S 7.324 -3.786 -2.975 1.00 . A A . 11 CYS SG 1 1 9 7787 1 1 12 ILE C C 9.384 -7.311 -3.939 1.00 . A A . 12 ILE C 1 1 9 7788 1 1 12 ILE CA C 9.981 -7.369 -2.529 1.00 . A A . 12 ILE CA 1 1 9 7789 1 1 12 ILE CB C 9.876 -8.795 -1.989 1.00 . A A . 12 ILE CB 1 1 9 7790 1 1 12 ILE CD1 C 8.243 -10.610 -1.444 1.00 . A A . 12 ILE CD1 1 1 9 7791 1 1 12 ILE CG1 C 8.414 -9.104 -1.650 1.00 . A A . 12 ILE CG1 1 1 9 7792 1 1 12 ILE CG2 C 10.731 -8.926 -0.727 1.00 . A A . 12 ILE CG2 1 1 9 7793 1 1 12 ILE H H 8.443 -6.782 -1.146 1.00 . A A . 12 ILE H 1 1 9 7794 1 1 12 ILE HA H 11.017 -7.067 -2.561 1.00 . A A . 12 ILE HA 1 1 9 7795 1 1 12 ILE HB H 10.229 -9.490 -2.737 1.00 . A A . 12 ILE HB 1 1 9 7796 1 1 12 ILE HD11 H 8.808 -11.142 -2.194 1.00 . A A . 12 ILE HD11 1 1 9 7797 1 1 12 ILE HD12 H 8.602 -10.882 -0.462 1.00 . A A . 12 ILE HD12 1 1 9 7798 1 1 12 ILE HD13 H 7.198 -10.868 -1.529 1.00 . A A . 12 ILE HD13 1 1 9 7799 1 1 12 ILE HG12 H 8.137 -8.581 -0.746 1.00 . A A . 12 ILE HG12 1 1 9 7800 1 1 12 ILE HG13 H 7.781 -8.779 -2.462 1.00 . A A . 12 ILE HG13 1 1 9 7801 1 1 12 ILE HG21 H 10.735 -7.986 -0.196 1.00 . A A . 12 ILE HG21 1 1 9 7802 1 1 12 ILE HG22 H 10.318 -9.696 -0.091 1.00 . A A . 12 ILE HG22 1 1 9 7803 1 1 12 ILE HG23 H 11.741 -9.190 -1.002 1.00 . A A . 12 ILE HG23 1 1 9 7804 1 1 12 ILE N N 9.217 -6.449 -1.643 1.00 . A A . 12 ILE N 1 1 9 7805 1 1 12 ILE O O 9.781 -8.044 -4.822 1.00 . A A . 12 ILE O 1 1 9 7806 1 1 13 ALA C C 7.133 -7.659 -5.863 1.00 . A A . 13 ALA C 1 1 9 7807 1 1 13 ALA CA C 7.806 -6.334 -5.500 1.00 . A A . 13 ALA CA 1 1 9 7808 1 1 13 ALA CB C 8.884 -6.011 -6.537 1.00 . A A . 13 ALA CB 1 1 9 7809 1 1 13 ALA H H 8.126 -5.861 -3.427 1.00 . A A . 13 ALA H 1 1 9 7810 1 1 13 ALA HA H 7.068 -5.546 -5.492 1.00 . A A . 13 ALA HA 1 1 9 7811 1 1 13 ALA HB1 H 9.854 -6.278 -6.144 1.00 . A A . 13 ALA HB1 1 1 9 7812 1 1 13 ALA HB2 H 8.694 -6.574 -7.440 1.00 . A A . 13 ALA HB2 1 1 9 7813 1 1 13 ALA HB3 H 8.863 -4.955 -6.760 1.00 . A A . 13 ALA HB3 1 1 9 7814 1 1 13 ALA N N 8.431 -6.442 -4.153 1.00 . A A . 13 ALA N 1 1 9 7815 1 1 13 ALA O O 7.532 -8.332 -6.792 1.00 . A A . 13 ALA O 1 1 9 7816 1 1 14 CYS C C 4.123 -9.033 -6.218 1.00 . A A . 14 CYS C 1 1 9 7817 1 1 14 CYS CA C 5.425 -9.322 -5.467 1.00 . A A . 14 CYS CA 1 1 9 7818 1 1 14 CYS CB C 5.116 -10.097 -4.183 1.00 . A A . 14 CYS CB 1 1 9 7819 1 1 14 CYS H H 5.797 -7.486 -4.399 1.00 . A A . 14 CYS H 1 1 9 7820 1 1 14 CYS HA H 6.070 -9.918 -6.095 1.00 . A A . 14 CYS HA 1 1 9 7821 1 1 14 CYS HB2 H 4.709 -11.063 -4.442 1.00 . A A . 14 CYS HB2 1 1 9 7822 1 1 14 CYS HB3 H 6.031 -10.236 -3.627 1.00 . A A . 14 CYS HB3 1 1 9 7823 1 1 14 CYS N N 6.112 -8.041 -5.143 1.00 . A A . 14 CYS N 1 1 9 7824 1 1 14 CYS O O 3.490 -9.926 -6.744 1.00 . A A . 14 CYS O 1 1 9 7825 1 1 14 CYS SG S 3.933 -9.372 -2.986 1.00 . A A . 14 CYS SG 1 1 9 7826 1 1 15 GLU C C 1.256 -7.963 -6.220 1.00 . A A . 15 GLU C 1 1 9 7827 1 1 15 GLU CA C 2.466 -7.450 -7.005 1.00 . A A . 15 GLU CA 1 1 9 7828 1 1 15 GLU CB C 2.486 -8.102 -8.389 1.00 . A A . 15 GLU CB 1 1 9 7829 1 1 15 GLU CD C 0.767 -7.707 -10.160 1.00 . A A . 15 GLU CD 1 1 9 7830 1 1 15 GLU CG C 1.970 -7.106 -9.431 1.00 . A A . 15 GLU CG 1 1 9 7831 1 1 15 GLU H H 4.250 -7.086 -5.852 1.00 . A A . 15 GLU H 1 1 9 7832 1 1 15 GLU HA H 2.395 -6.378 -7.114 1.00 . A A . 15 GLU HA 1 1 9 7833 1 1 15 GLU HB2 H 3.497 -8.391 -8.636 1.00 . A A . 15 GLU HB2 1 1 9 7834 1 1 15 GLU HB3 H 1.851 -8.975 -8.384 1.00 . A A . 15 GLU HB3 1 1 9 7835 1 1 15 GLU HG2 H 1.674 -6.191 -8.939 1.00 . A A . 15 GLU HG2 1 1 9 7836 1 1 15 GLU HG3 H 2.752 -6.895 -10.145 1.00 . A A . 15 GLU HG3 1 1 9 7837 1 1 15 GLU N N 3.722 -7.792 -6.279 1.00 . A A . 15 GLU N 1 1 9 7838 1 1 15 GLU O O 0.130 -7.863 -6.665 1.00 . A A . 15 GLU O 1 1 9 7839 1 1 15 GLU OE1 O 0.184 -8.641 -9.632 1.00 . A A . 15 GLU OE1 1 1 9 7840 1 1 15 GLU OE2 O 0.449 -7.224 -11.234 1.00 . A A . 15 GLU OE2 1 1 9 7841 1 1 16 SER C C -0.606 -7.866 -3.904 1.00 . A A . 16 SER C 1 1 9 7842 1 1 16 SER CA C 0.330 -9.026 -4.253 1.00 . A A . 16 SER CA 1 1 9 7843 1 1 16 SER CB C 0.858 -9.662 -2.967 1.00 . A A . 16 SER CB 1 1 9 7844 1 1 16 SER H H 2.389 -8.585 -4.713 1.00 . A A . 16 SER H 1 1 9 7845 1 1 16 SER HA H -0.210 -9.766 -4.826 1.00 . A A . 16 SER HA 1 1 9 7846 1 1 16 SER HB2 H 0.033 -9.905 -2.318 1.00 . A A . 16 SER HB2 1 1 9 7847 1 1 16 SER HB3 H 1.400 -10.567 -3.210 1.00 . A A . 16 SER HB3 1 1 9 7848 1 1 16 SER HG H 2.222 -9.227 -1.649 1.00 . A A . 16 SER HG 1 1 9 7849 1 1 16 SER N N 1.474 -8.512 -5.056 1.00 . A A . 16 SER N 1 1 9 7850 1 1 16 SER O O -1.709 -7.773 -4.407 1.00 . A A . 16 SER O 1 1 9 7851 1 1 16 SER OG O 1.718 -8.743 -2.307 1.00 . A A . 16 SER OG 1 1 9 7852 1 1 17 CYS C C -1.576 -5.157 -3.935 1.00 . A A . 17 CYS C 1 1 9 7853 1 1 17 CYS CA C -1.030 -5.823 -2.670 1.00 . A A . 17 CYS CA 1 1 9 7854 1 1 17 CYS CB C -0.188 -4.819 -1.883 1.00 . A A . 17 CYS CB 1 1 9 7855 1 1 17 CYS H H 0.721 -7.075 -2.661 1.00 . A A . 17 CYS H 1 1 9 7856 1 1 17 CYS HA H -1.850 -6.166 -2.058 1.00 . A A . 17 CYS HA 1 1 9 7857 1 1 17 CYS HB2 H -0.833 -4.071 -1.447 1.00 . A A . 17 CYS HB2 1 1 9 7858 1 1 17 CYS HB3 H 0.349 -5.333 -1.100 1.00 . A A . 17 CYS HB3 1 1 9 7859 1 1 17 CYS N N -0.173 -6.980 -3.051 1.00 . A A . 17 CYS N 1 1 9 7860 1 1 17 CYS O O -2.772 -5.014 -4.107 1.00 . A A . 17 CYS O 1 1 9 7861 1 1 17 CYS SG S 1.043 -3.947 -2.917 1.00 . A A . 17 CYS SG 1 1 9 7862 1 1 18 VAL C C -2.340 -4.926 -6.657 1.00 . A A . 18 VAL C 1 1 9 7863 1 1 18 VAL CA C -1.191 -4.104 -6.078 1.00 . A A . 18 VAL CA 1 1 9 7864 1 1 18 VAL CB C -0.053 -4.038 -7.096 1.00 . A A . 18 VAL CB 1 1 9 7865 1 1 18 VAL CG1 C -0.550 -3.347 -8.368 1.00 . A A . 18 VAL CG1 1 1 9 7866 1 1 18 VAL CG2 C 1.113 -3.241 -6.507 1.00 . A A . 18 VAL CG2 1 1 9 7867 1 1 18 VAL H H 0.247 -4.879 -4.674 1.00 . A A . 18 VAL H 1 1 9 7868 1 1 18 VAL HA H -1.537 -3.104 -5.855 1.00 . A A . 18 VAL HA 1 1 9 7869 1 1 18 VAL HB H 0.275 -5.039 -7.335 1.00 . A A . 18 VAL HB 1 1 9 7870 1 1 18 VAL HG11 H -1.463 -3.818 -8.699 1.00 . A A . 18 VAL HG11 1 1 9 7871 1 1 18 VAL HG12 H -0.738 -2.303 -8.161 1.00 . A A . 18 VAL HG12 1 1 9 7872 1 1 18 VAL HG13 H 0.201 -3.430 -9.140 1.00 . A A . 18 VAL HG13 1 1 9 7873 1 1 18 VAL HG21 H 0.730 -2.383 -5.974 1.00 . A A . 18 VAL HG21 1 1 9 7874 1 1 18 VAL HG22 H 1.670 -3.868 -5.827 1.00 . A A . 18 VAL HG22 1 1 9 7875 1 1 18 VAL HG23 H 1.762 -2.909 -7.304 1.00 . A A . 18 VAL HG23 1 1 9 7876 1 1 18 VAL N N -0.712 -4.754 -4.826 1.00 . A A . 18 VAL N 1 1 9 7877 1 1 18 VAL O O -3.256 -4.395 -7.249 1.00 . A A . 18 VAL O 1 1 9 7878 1 1 19 GLU C C -4.662 -6.808 -6.203 1.00 . A A . 19 GLU C 1 1 9 7879 1 1 19 GLU CA C -3.413 -7.055 -7.034 1.00 . A A . 19 GLU CA 1 1 9 7880 1 1 19 GLU CB C -3.028 -8.536 -6.975 1.00 . A A . 19 GLU CB 1 1 9 7881 1 1 19 GLU CD C -2.501 -10.542 -8.366 1.00 . A A . 19 GLU CD 1 1 9 7882 1 1 19 GLU CG C -2.650 -9.020 -8.375 1.00 . A A . 19 GLU CG 1 1 9 7883 1 1 19 GLU H H -1.565 -6.637 -6.008 1.00 . A A . 19 GLU H 1 1 9 7884 1 1 19 GLU HA H -3.610 -6.765 -8.050 1.00 . A A . 19 GLU HA 1 1 9 7885 1 1 19 GLU HB2 H -2.186 -8.662 -6.309 1.00 . A A . 19 GLU HB2 1 1 9 7886 1 1 19 GLU HB3 H -3.866 -9.111 -6.611 1.00 . A A . 19 GLU HB3 1 1 9 7887 1 1 19 GLU HG2 H -3.424 -8.736 -9.075 1.00 . A A . 19 GLU HG2 1 1 9 7888 1 1 19 GLU HG3 H -1.714 -8.570 -8.671 1.00 . A A . 19 GLU HG3 1 1 9 7889 1 1 19 GLU N N -2.308 -6.219 -6.490 1.00 . A A . 19 GLU N 1 1 9 7890 1 1 19 GLU O O -5.766 -6.784 -6.709 1.00 . A A . 19 GLU O 1 1 9 7891 1 1 19 GLU OE1 O -3.318 -11.193 -7.736 1.00 . A A . 19 GLU OE1 1 1 9 7892 1 1 19 GLU OE2 O -1.572 -11.030 -8.989 1.00 . A A . 19 GLU OE2 1 1 9 7893 1 1 20 ILE C C -6.031 -4.823 -4.237 1.00 . A A . 20 ILE C 1 1 9 7894 1 1 20 ILE CA C -5.668 -6.302 -4.074 1.00 . A A . 20 ILE CA 1 1 9 7895 1 1 20 ILE CB C -5.307 -6.607 -2.623 1.00 . A A . 20 ILE CB 1 1 9 7896 1 1 20 ILE CD1 C -6.185 -8.550 -1.246 1.00 . A A . 20 ILE CD1 1 1 9 7897 1 1 20 ILE CG1 C -5.328 -8.119 -2.445 1.00 . A A . 20 ILE CG1 1 1 9 7898 1 1 20 ILE CG2 C -6.287 -5.908 -1.670 1.00 . A A . 20 ILE CG2 1 1 9 7899 1 1 20 ILE H H -3.593 -6.588 -4.547 1.00 . A A . 20 ILE H 1 1 9 7900 1 1 20 ILE HA H -6.496 -6.921 -4.376 1.00 . A A . 20 ILE HA 1 1 9 7901 1 1 20 ILE HB H -4.319 -6.262 -2.437 1.00 . A A . 20 ILE HB 1 1 9 7902 1 1 20 ILE HD11 H -7.187 -8.166 -1.362 1.00 . A A . 20 ILE HD11 1 1 9 7903 1 1 20 ILE HD12 H -6.215 -9.628 -1.194 1.00 . A A . 20 ILE HD12 1 1 9 7904 1 1 20 ILE HD13 H -5.752 -8.158 -0.338 1.00 . A A . 20 ILE HD13 1 1 9 7905 1 1 20 ILE HG12 H -5.718 -8.543 -3.337 1.00 . A A . 20 ILE HG12 1 1 9 7906 1 1 20 ILE HG13 H -4.321 -8.464 -2.309 1.00 . A A . 20 ILE HG13 1 1 9 7907 1 1 20 ILE HG21 H -7.300 -6.111 -1.984 1.00 . A A . 20 ILE HG21 1 1 9 7908 1 1 20 ILE HG22 H -6.139 -6.281 -0.667 1.00 . A A . 20 ILE HG22 1 1 9 7909 1 1 20 ILE HG23 H -6.111 -4.844 -1.688 1.00 . A A . 20 ILE HG23 1 1 9 7910 1 1 20 ILE N N -4.496 -6.588 -4.932 1.00 . A A . 20 ILE N 1 1 9 7911 1 1 20 ILE O O -6.896 -4.302 -3.560 1.00 . A A . 20 ILE O 1 1 9 7912 1 1 21 ALA C C -4.710 -2.138 -6.404 1.00 . A A . 21 ALA C 1 1 9 7913 1 1 21 ALA CA C -5.672 -2.698 -5.356 1.00 . A A . 21 ALA CA 1 1 9 7914 1 1 21 ALA CB C -5.493 -1.937 -4.041 1.00 . A A . 21 ALA CB 1 1 9 7915 1 1 21 ALA H H -4.677 -4.580 -5.686 1.00 . A A . 21 ALA H 1 1 9 7916 1 1 21 ALA HA H -6.689 -2.588 -5.704 1.00 . A A . 21 ALA HA 1 1 9 7917 1 1 21 ALA HB1 H -4.501 -2.116 -3.655 1.00 . A A . 21 ALA HB1 1 1 9 7918 1 1 21 ALA HB2 H -5.628 -0.880 -4.215 1.00 . A A . 21 ALA HB2 1 1 9 7919 1 1 21 ALA HB3 H -6.225 -2.281 -3.325 1.00 . A A . 21 ALA HB3 1 1 9 7920 1 1 21 ALA N N -5.371 -4.140 -5.143 1.00 . A A . 21 ALA N 1 1 9 7921 1 1 21 ALA O O -3.888 -1.294 -6.109 1.00 . A A . 21 ALA O 1 1 9 7922 1 1 22 PRO C C -4.343 -0.770 -9.162 1.00 . A A . 22 PRO C 1 1 9 7923 1 1 22 PRO CA C -3.976 -2.189 -8.723 1.00 . A A . 22 PRO CA 1 1 9 7924 1 1 22 PRO CB C -4.281 -3.194 -9.835 1.00 . A A . 22 PRO CB 1 1 9 7925 1 1 22 PRO CD C -5.816 -3.655 -8.021 1.00 . A A . 22 PRO CD 1 1 9 7926 1 1 22 PRO CG C -5.654 -3.702 -9.525 1.00 . A A . 22 PRO CG 1 1 9 7927 1 1 22 PRO HA H -2.936 -2.250 -8.445 1.00 . A A . 22 PRO HA 1 1 9 7928 1 1 22 PRO HB2 H -4.236 -2.690 -10.791 1.00 . A A . 22 PRO HB2 1 1 9 7929 1 1 22 PRO HB3 H -3.552 -3.988 -9.813 1.00 . A A . 22 PRO HB3 1 1 9 7930 1 1 22 PRO HD2 H -6.824 -3.366 -7.757 1.00 . A A . 22 PRO HD2 1 1 9 7931 1 1 22 PRO HD3 H -5.569 -4.609 -7.585 1.00 . A A . 22 PRO HD3 1 1 9 7932 1 1 22 PRO HG2 H -6.392 -3.070 -9.999 1.00 . A A . 22 PRO HG2 1 1 9 7933 1 1 22 PRO HG3 H -5.757 -4.718 -9.871 1.00 . A A . 22 PRO HG3 1 1 9 7934 1 1 22 PRO N N -4.847 -2.637 -7.602 1.00 . A A . 22 PRO N 1 1 9 7935 1 1 22 PRO O O -3.751 -0.219 -10.069 1.00 . A A . 22 PRO O 1 1 9 7936 1 1 23 GLY C C -5.026 2.218 -8.004 1.00 . A A . 23 GLY C 1 1 9 7937 1 1 23 GLY CA C -5.715 1.207 -8.918 1.00 . A A . 23 GLY CA 1 1 9 7938 1 1 23 GLY H H -5.781 -0.631 -7.802 1.00 . A A . 23 GLY H 1 1 9 7939 1 1 23 GLY HA2 H -5.429 1.391 -9.943 1.00 . A A . 23 GLY HA2 1 1 9 7940 1 1 23 GLY HA3 H -6.783 1.311 -8.816 1.00 . A A . 23 GLY HA3 1 1 9 7941 1 1 23 GLY N N -5.314 -0.173 -8.530 1.00 . A A . 23 GLY N 1 1 9 7942 1 1 23 GLY O O -4.722 3.324 -8.404 1.00 . A A . 23 GLY O 1 1 9 7943 1 1 24 ALA C C -2.706 2.333 -5.547 1.00 . A A . 24 ALA C 1 1 9 7944 1 1 24 ALA CA C -4.123 2.797 -5.840 1.00 . A A . 24 ALA CA 1 1 9 7945 1 1 24 ALA CB C -4.914 2.853 -4.533 1.00 . A A . 24 ALA CB 1 1 9 7946 1 1 24 ALA H H -5.043 0.956 -6.473 1.00 . A A . 24 ALA H 1 1 9 7947 1 1 24 ALA HA H -4.082 3.778 -6.284 1.00 . A A . 24 ALA HA 1 1 9 7948 1 1 24 ALA HB1 H -5.167 1.849 -4.224 1.00 . A A . 24 ALA HB1 1 1 9 7949 1 1 24 ALA HB2 H -4.311 3.321 -3.771 1.00 . A A . 24 ALA HB2 1 1 9 7950 1 1 24 ALA HB3 H -5.818 3.423 -4.681 1.00 . A A . 24 ALA HB3 1 1 9 7951 1 1 24 ALA N N -4.784 1.851 -6.778 1.00 . A A . 24 ALA N 1 1 9 7952 1 1 24 ALA O O -1.759 3.077 -5.710 1.00 . A A . 24 ALA O 1 1 9 7953 1 1 25 PHE C C -0.474 0.393 -6.175 1.00 . A A . 25 PHE C 1 1 9 7954 1 1 25 PHE CA C -1.158 0.654 -4.839 1.00 . A A . 25 PHE CA 1 1 9 7955 1 1 25 PHE CB C -1.186 -0.635 -4.006 1.00 . A A . 25 PHE CB 1 1 9 7956 1 1 25 PHE CD1 C 1.189 -0.494 -3.138 1.00 . A A . 25 PHE CD1 1 1 9 7957 1 1 25 PHE CD2 C -0.629 -0.579 -1.537 1.00 . A A . 25 PHE CD2 1 1 9 7958 1 1 25 PHE CE1 C 2.113 -0.442 -2.082 1.00 . A A . 25 PHE CE1 1 1 9 7959 1 1 25 PHE CE2 C 0.299 -0.524 -0.484 1.00 . A A . 25 PHE CE2 1 1 9 7960 1 1 25 PHE CG C -0.184 -0.561 -2.866 1.00 . A A . 25 PHE CG 1 1 9 7961 1 1 25 PHE CZ C 1.671 -0.455 -0.758 1.00 . A A . 25 PHE CZ 1 1 9 7962 1 1 25 PHE H H -3.303 0.517 -5.000 1.00 . A A . 25 PHE H 1 1 9 7963 1 1 25 PHE HA H -0.628 1.436 -4.310 1.00 . A A . 25 PHE HA 1 1 9 7964 1 1 25 PHE HB2 H -2.177 -0.779 -3.602 1.00 . A A . 25 PHE HB2 1 1 9 7965 1 1 25 PHE HB3 H -0.936 -1.469 -4.643 1.00 . A A . 25 PHE HB3 1 1 9 7966 1 1 25 PHE HD1 H 1.533 -0.478 -4.160 1.00 . A A . 25 PHE HD1 1 1 9 7967 1 1 25 PHE HD2 H -1.686 -0.632 -1.322 1.00 . A A . 25 PHE HD2 1 1 9 7968 1 1 25 PHE HE1 H 3.166 -0.393 -2.289 1.00 . A A . 25 PHE HE1 1 1 9 7969 1 1 25 PHE HE2 H -0.047 -0.535 0.539 1.00 . A A . 25 PHE HE2 1 1 9 7970 1 1 25 PHE HZ H 2.382 -0.416 0.046 1.00 . A A . 25 PHE HZ 1 1 9 7971 1 1 25 PHE N N -2.536 1.119 -5.122 1.00 . A A . 25 PHE N 1 1 9 7972 1 1 25 PHE O O -1.070 -0.125 -7.098 1.00 . A A . 25 PHE O 1 1 9 7973 1 1 26 ALA C C 2.953 0.868 -7.418 1.00 . A A . 26 ALA C 1 1 9 7974 1 1 26 ALA CA C 1.473 0.541 -7.587 1.00 . A A . 26 ALA CA 1 1 9 7975 1 1 26 ALA CB C 0.868 1.453 -8.656 1.00 . A A . 26 ALA CB 1 1 9 7976 1 1 26 ALA H H 1.219 1.177 -5.544 1.00 . A A . 26 ALA H 1 1 9 7977 1 1 26 ALA HA H 1.363 -0.489 -7.889 1.00 . A A . 26 ALA HA 1 1 9 7978 1 1 26 ALA HB1 H -0.081 1.836 -8.309 1.00 . A A . 26 ALA HB1 1 1 9 7979 1 1 26 ALA HB2 H 1.539 2.278 -8.848 1.00 . A A . 26 ALA HB2 1 1 9 7980 1 1 26 ALA HB3 H 0.718 0.892 -9.566 1.00 . A A . 26 ALA HB3 1 1 9 7981 1 1 26 ALA N N 0.763 0.758 -6.294 1.00 . A A . 26 ALA N 1 1 9 7982 1 1 26 ALA O O 3.318 1.804 -6.735 1.00 . A A . 26 ALA O 1 1 9 7983 1 1 27 MET C C 5.649 1.613 -8.659 1.00 . A A . 27 MET C 1 1 9 7984 1 1 27 MET CA C 5.270 0.357 -7.885 1.00 . A A . 27 MET CA 1 1 9 7985 1 1 27 MET CB C 6.059 -0.837 -8.426 1.00 . A A . 27 MET CB 1 1 9 7986 1 1 27 MET CE C 7.029 -3.460 -9.536 1.00 . A A . 27 MET CE 1 1 9 7987 1 1 27 MET CG C 5.771 -2.070 -7.570 1.00 . A A . 27 MET CG 1 1 9 7988 1 1 27 MET H H 3.497 -0.659 -8.562 1.00 . A A . 27 MET H 1 1 9 7989 1 1 27 MET HA H 5.503 0.502 -6.852 1.00 . A A . 27 MET HA 1 1 9 7990 1 1 27 MET HB2 H 5.764 -1.030 -9.448 1.00 . A A . 27 MET HB2 1 1 9 7991 1 1 27 MET HB3 H 7.115 -0.617 -8.392 1.00 . A A . 27 MET HB3 1 1 9 7992 1 1 27 MET HE1 H 7.317 -2.434 -9.720 1.00 . A A . 27 MET HE1 1 1 9 7993 1 1 27 MET HE2 H 7.786 -3.952 -8.941 1.00 . A A . 27 MET HE2 1 1 9 7994 1 1 27 MET HE3 H 6.923 -3.976 -10.477 1.00 . A A . 27 MET HE3 1 1 9 7995 1 1 27 MET HG2 H 6.623 -2.279 -6.940 1.00 . A A . 27 MET HG2 1 1 9 7996 1 1 27 MET HG3 H 4.904 -1.885 -6.953 1.00 . A A . 27 MET HG3 1 1 9 7997 1 1 27 MET N N 3.812 0.096 -8.024 1.00 . A A . 27 MET N 1 1 9 7998 1 1 27 MET O O 4.959 2.017 -9.573 1.00 . A A . 27 MET O 1 1 9 7999 1 1 27 MET SD S 5.452 -3.491 -8.647 1.00 . A A . 27 MET SD 1 1 9 8000 1 1 28 ASP C C 8.576 3.206 -9.528 1.00 . A A . 28 ASP C 1 1 9 8001 1 1 28 ASP CA C 7.153 3.445 -9.059 1.00 . A A . 28 ASP CA 1 1 9 8002 1 1 28 ASP CB C 7.083 4.647 -8.117 1.00 . A A . 28 ASP CB 1 1 9 8003 1 1 28 ASP CG C 6.613 5.883 -8.888 1.00 . A A . 28 ASP CG 1 1 9 8004 1 1 28 ASP H H 7.330 1.901 -7.582 1.00 . A A . 28 ASP H 1 1 9 8005 1 1 28 ASP HA H 6.502 3.596 -9.908 1.00 . A A . 28 ASP HA 1 1 9 8006 1 1 28 ASP HB2 H 6.381 4.433 -7.319 1.00 . A A . 28 ASP HB2 1 1 9 8007 1 1 28 ASP HB3 H 8.059 4.833 -7.697 1.00 . A A . 28 ASP HB3 1 1 9 8008 1 1 28 ASP N N 6.750 2.235 -8.319 1.00 . A A . 28 ASP N 1 1 9 8009 1 1 28 ASP O O 9.233 2.334 -8.996 1.00 . A A . 28 ASP O 1 1 9 8010 1 1 28 ASP OD1 O 5.911 5.712 -9.871 1.00 . A A . 28 ASP OD1 1 1 9 8011 1 1 28 ASP OD2 O 6.966 6.978 -8.484 1.00 . A A . 28 ASP OD2 1 1 9 8012 1 1 29 PRO C C 11.324 4.635 -10.190 1.00 . A A . 29 PRO C 1 1 9 8013 1 1 29 PRO CA C 10.366 3.819 -11.048 1.00 . A A . 29 PRO CA 1 1 9 8014 1 1 29 PRO CB C 10.249 4.385 -12.462 1.00 . A A . 29 PRO CB 1 1 9 8015 1 1 29 PRO CD C 8.269 5.042 -11.175 1.00 . A A . 29 PRO CD 1 1 9 8016 1 1 29 PRO CG C 9.084 5.334 -12.422 1.00 . A A . 29 PRO CG 1 1 9 8017 1 1 29 PRO HA H 10.659 2.781 -11.078 1.00 . A A . 29 PRO HA 1 1 9 8018 1 1 29 PRO HB2 H 11.175 4.885 -12.719 1.00 . A A . 29 PRO HB2 1 1 9 8019 1 1 29 PRO HB3 H 10.076 3.578 -13.156 1.00 . A A . 29 PRO HB3 1 1 9 8020 1 1 29 PRO HD2 H 8.224 5.922 -10.550 1.00 . A A . 29 PRO HD2 1 1 9 8021 1 1 29 PRO HD3 H 7.281 4.716 -11.434 1.00 . A A . 29 PRO HD3 1 1 9 8022 1 1 29 PRO HG2 H 9.449 6.351 -12.394 1.00 . A A . 29 PRO HG2 1 1 9 8023 1 1 29 PRO HG3 H 8.469 5.189 -13.298 1.00 . A A . 29 PRO HG3 1 1 9 8024 1 1 29 PRO N N 9.001 3.969 -10.504 1.00 . A A . 29 PRO N 1 1 9 8025 1 1 29 PRO O O 12.524 4.444 -10.207 1.00 . A A . 29 PRO O 1 1 9 8026 1 1 30 GLU C C 11.687 5.597 -7.177 1.00 . A A . 30 GLU C 1 1 9 8027 1 1 30 GLU CA C 11.618 6.343 -8.499 1.00 . A A . 30 GLU CA 1 1 9 8028 1 1 30 GLU CB C 10.973 7.714 -8.290 1.00 . A A . 30 GLU CB 1 1 9 8029 1 1 30 GLU CD C 12.674 8.990 -6.980 1.00 . A A . 30 GLU CD 1 1 9 8030 1 1 30 GLU CG C 12.048 8.799 -8.364 1.00 . A A . 30 GLU CG 1 1 9 8031 1 1 30 GLU H H 9.802 5.622 -9.401 1.00 . A A . 30 GLU H 1 1 9 8032 1 1 30 GLU HA H 12.611 6.456 -8.913 1.00 . A A . 30 GLU HA 1 1 9 8033 1 1 30 GLU HB2 H 10.233 7.885 -9.059 1.00 . A A . 30 GLU HB2 1 1 9 8034 1 1 30 GLU HB3 H 10.500 7.745 -7.321 1.00 . A A . 30 GLU HB3 1 1 9 8035 1 1 30 GLU HG2 H 12.813 8.501 -9.067 1.00 . A A . 30 GLU HG2 1 1 9 8036 1 1 30 GLU HG3 H 11.602 9.727 -8.686 1.00 . A A . 30 GLU HG3 1 1 9 8037 1 1 30 GLU N N 10.778 5.522 -9.410 1.00 . A A . 30 GLU N 1 1 9 8038 1 1 30 GLU O O 12.660 5.656 -6.450 1.00 . A A . 30 GLU O 1 1 9 8039 1 1 30 GLU OE1 O 12.044 9.626 -6.151 1.00 . A A . 30 GLU OE1 1 1 9 8040 1 1 30 GLU OE2 O 13.770 8.496 -6.773 1.00 . A A . 30 GLU OE2 1 1 9 8041 1 1 31 ILE C C 10.797 2.589 -6.025 1.00 . A A . 31 ILE C 1 1 9 8042 1 1 31 ILE CA C 10.609 4.056 -5.648 1.00 . A A . 31 ILE CA 1 1 9 8043 1 1 31 ILE CB C 9.265 4.264 -4.943 1.00 . A A . 31 ILE CB 1 1 9 8044 1 1 31 ILE CD1 C 6.817 3.779 -5.119 1.00 . A A . 31 ILE CD1 1 1 9 8045 1 1 31 ILE CG1 C 8.213 3.324 -5.539 1.00 . A A . 31 ILE CG1 1 1 9 8046 1 1 31 ILE CG2 C 8.819 5.716 -5.127 1.00 . A A . 31 ILE CG2 1 1 9 8047 1 1 31 ILE H H 9.899 4.825 -7.515 1.00 . A A . 31 ILE H 1 1 9 8048 1 1 31 ILE HA H 11.396 4.352 -5.003 1.00 . A A . 31 ILE HA 1 1 9 8049 1 1 31 ILE HB H 9.379 4.057 -3.887 1.00 . A A . 31 ILE HB 1 1 9 8050 1 1 31 ILE HD11 H 6.659 4.797 -5.442 1.00 . A A . 31 ILE HD11 1 1 9 8051 1 1 31 ILE HD12 H 6.077 3.139 -5.576 1.00 . A A . 31 ILE HD12 1 1 9 8052 1 1 31 ILE HD13 H 6.729 3.723 -4.045 1.00 . A A . 31 ILE HD13 1 1 9 8053 1 1 31 ILE HG12 H 8.290 3.335 -6.615 1.00 . A A . 31 ILE HG12 1 1 9 8054 1 1 31 ILE HG13 H 8.389 2.322 -5.177 1.00 . A A . 31 ILE HG13 1 1 9 8055 1 1 31 ILE HG21 H 9.678 6.332 -5.349 1.00 . A A . 31 ILE HG21 1 1 9 8056 1 1 31 ILE HG22 H 8.114 5.776 -5.944 1.00 . A A . 31 ILE HG22 1 1 9 8057 1 1 31 ILE HG23 H 8.349 6.066 -4.220 1.00 . A A . 31 ILE HG23 1 1 9 8058 1 1 31 ILE N N 10.651 4.864 -6.889 1.00 . A A . 31 ILE N 1 1 9 8059 1 1 31 ILE O O 10.884 1.727 -5.174 1.00 . A A . 31 ILE O 1 1 9 8060 1 1 32 GLU C C 10.295 -0.030 -6.847 1.00 . A A . 32 GLU C 1 1 9 8061 1 1 32 GLU CA C 11.004 0.923 -7.798 1.00 . A A . 32 GLU CA 1 1 9 8062 1 1 32 GLU CB C 12.489 0.565 -7.882 1.00 . A A . 32 GLU CB 1 1 9 8063 1 1 32 GLU CD C 13.380 0.988 -10.177 1.00 . A A . 32 GLU CD 1 1 9 8064 1 1 32 GLU CG C 13.209 1.577 -8.775 1.00 . A A . 32 GLU CG 1 1 9 8065 1 1 32 GLU H H 10.762 3.043 -7.958 1.00 . A A . 32 GLU H 1 1 9 8066 1 1 32 GLU HA H 10.554 0.849 -8.776 1.00 . A A . 32 GLU HA 1 1 9 8067 1 1 32 GLU HB2 H 12.921 0.588 -6.890 1.00 . A A . 32 GLU HB2 1 1 9 8068 1 1 32 GLU HB3 H 12.599 -0.424 -8.300 1.00 . A A . 32 GLU HB3 1 1 9 8069 1 1 32 GLU HG2 H 12.626 2.485 -8.834 1.00 . A A . 32 GLU HG2 1 1 9 8070 1 1 32 GLU HG3 H 14.181 1.798 -8.360 1.00 . A A . 32 GLU HG3 1 1 9 8071 1 1 32 GLU N N 10.845 2.317 -7.306 1.00 . A A . 32 GLU N 1 1 9 8072 1 1 32 GLU O O 10.796 -1.084 -6.518 1.00 . A A . 32 GLU O 1 1 9 8073 1 1 32 GLU OE1 O 12.541 0.194 -10.570 1.00 . A A . 32 GLU OE1 1 1 9 8074 1 1 32 GLU OE2 O 14.347 1.340 -10.832 1.00 . A A . 32 GLU OE2 1 1 9 8075 1 1 33 LYS C C 6.955 -0.021 -5.245 1.00 . A A . 33 LYS C 1 1 9 8076 1 1 33 LYS CA C 8.386 -0.535 -5.439 1.00 . A A . 33 LYS CA 1 1 9 8077 1 1 33 LYS CB C 9.107 -0.557 -4.090 1.00 . A A . 33 LYS CB 1 1 9 8078 1 1 33 LYS CD C 11.024 -1.695 -2.960 1.00 . A A . 33 LYS CD 1 1 9 8079 1 1 33 LYS CE C 12.296 -2.283 -3.573 1.00 . A A . 33 LYS CE 1 1 9 8080 1 1 33 LYS CG C 9.855 -1.884 -3.929 1.00 . A A . 33 LYS CG 1 1 9 8081 1 1 33 LYS H H 8.757 1.214 -6.681 1.00 . A A . 33 LYS H 1 1 9 8082 1 1 33 LYS HA H 8.351 -1.541 -5.832 1.00 . A A . 33 LYS HA 1 1 9 8083 1 1 33 LYS HB2 H 9.808 0.263 -4.041 1.00 . A A . 33 LYS HB2 1 1 9 8084 1 1 33 LYS HB3 H 8.383 -0.462 -3.298 1.00 . A A . 33 LYS HB3 1 1 9 8085 1 1 33 LYS HD2 H 11.168 -0.642 -2.769 1.00 . A A . 33 LYS HD2 1 1 9 8086 1 1 33 LYS HD3 H 10.806 -2.203 -2.032 1.00 . A A . 33 LYS HD3 1 1 9 8087 1 1 33 LYS HE2 H 12.845 -2.821 -2.814 1.00 . A A . 33 LYS HE2 1 1 9 8088 1 1 33 LYS HE3 H 12.030 -2.959 -4.373 1.00 . A A . 33 LYS HE3 1 1 9 8089 1 1 33 LYS HG2 H 9.180 -2.632 -3.542 1.00 . A A . 33 LYS HG2 1 1 9 8090 1 1 33 LYS HG3 H 10.233 -2.204 -4.886 1.00 . A A . 33 LYS HG3 1 1 9 8091 1 1 33 LYS HZ1 H 12.556 -0.537 -4.679 1.00 . A A . 33 LYS HZ1 1 1 9 8092 1 1 33 LYS HZ2 H 13.577 -0.658 -3.326 1.00 . A A . 33 LYS HZ2 1 1 9 8093 1 1 33 LYS HZ3 H 13.893 -1.584 -4.712 1.00 . A A . 33 LYS HZ3 1 1 9 8094 1 1 33 LYS N N 9.133 0.348 -6.396 1.00 . A A . 33 LYS N 1 1 9 8095 1 1 33 LYS NZ N 13.144 -1.183 -4.114 1.00 . A A . 33 LYS NZ 1 1 9 8096 1 1 33 LYS O O 6.694 1.163 -5.294 1.00 . A A . 33 LYS O 1 1 9 8097 1 1 34 ALA C C 4.436 0.628 -3.862 1.00 . A A . 34 ALA C 1 1 9 8098 1 1 34 ALA CA C 4.588 -0.520 -4.878 1.00 . A A . 34 ALA CA 1 1 9 8099 1 1 34 ALA CB C 3.801 -1.742 -4.396 1.00 . A A . 34 ALA CB 1 1 9 8100 1 1 34 ALA H H 6.265 -1.866 -5.032 1.00 . A A . 34 ALA H 1 1 9 8101 1 1 34 ALA HA H 4.192 -0.206 -5.825 1.00 . A A . 34 ALA HA 1 1 9 8102 1 1 34 ALA HB1 H 4.266 -2.639 -4.777 1.00 . A A . 34 ALA HB1 1 1 9 8103 1 1 34 ALA HB2 H 3.800 -1.770 -3.318 1.00 . A A . 34 ALA HB2 1 1 9 8104 1 1 34 ALA HB3 H 2.787 -1.684 -4.759 1.00 . A A . 34 ALA HB3 1 1 9 8105 1 1 34 ALA N N 6.023 -0.917 -5.050 1.00 . A A . 34 ALA N 1 1 9 8106 1 1 34 ALA O O 5.159 0.712 -2.897 1.00 . A A . 34 ALA O 1 1 9 8107 1 1 35 TYR C C 1.766 2.798 -2.811 1.00 . A A . 35 TYR C 1 1 9 8108 1 1 35 TYR CA C 3.260 2.633 -3.103 1.00 . A A . 35 TYR CA 1 1 9 8109 1 1 35 TYR CB C 3.822 3.940 -3.694 1.00 . A A . 35 TYR CB 1 1 9 8110 1 1 35 TYR CD1 C 2.012 3.631 -5.482 1.00 . A A . 35 TYR CD1 1 1 9 8111 1 1 35 TYR CD2 C 3.543 5.496 -5.665 1.00 . A A . 35 TYR CD2 1 1 9 8112 1 1 35 TYR CE1 C 1.361 4.047 -6.648 1.00 . A A . 35 TYR CE1 1 1 9 8113 1 1 35 TYR CE2 C 2.895 5.908 -6.838 1.00 . A A . 35 TYR CE2 1 1 9 8114 1 1 35 TYR CG C 3.106 4.354 -4.980 1.00 . A A . 35 TYR CG 1 1 9 8115 1 1 35 TYR CZ C 1.798 5.183 -7.326 1.00 . A A . 35 TYR CZ 1 1 9 8116 1 1 35 TYR H H 2.889 1.409 -4.845 1.00 . A A . 35 TYR H 1 1 9 8117 1 1 35 TYR HA H 3.774 2.419 -2.172 1.00 . A A . 35 TYR HA 1 1 9 8118 1 1 35 TYR HB2 H 3.711 4.729 -2.966 1.00 . A A . 35 TYR HB2 1 1 9 8119 1 1 35 TYR HB3 H 4.870 3.804 -3.902 1.00 . A A . 35 TYR HB3 1 1 9 8120 1 1 35 TYR HD1 H 1.670 2.758 -4.981 1.00 . A A . 35 TYR HD1 1 1 9 8121 1 1 35 TYR HD2 H 4.387 6.057 -5.292 1.00 . A A . 35 TYR HD2 1 1 9 8122 1 1 35 TYR HE1 H 0.520 3.484 -7.026 1.00 . A A . 35 TYR HE1 1 1 9 8123 1 1 35 TYR HE2 H 3.236 6.788 -7.362 1.00 . A A . 35 TYR HE2 1 1 9 8124 1 1 35 TYR HH H 0.978 4.813 -9.010 1.00 . A A . 35 TYR HH 1 1 9 8125 1 1 35 TYR N N 3.475 1.503 -4.066 1.00 . A A . 35 TYR N 1 1 9 8126 1 1 35 TYR O O 0.951 2.022 -3.263 1.00 . A A . 35 TYR O 1 1 9 8127 1 1 35 TYR OH O 1.156 5.592 -8.478 1.00 . A A . 35 TYR OH 1 1 9 8128 1 1 36 VAL C C -0.385 5.468 -2.197 1.00 . A A . 36 VAL C 1 1 9 8129 1 1 36 VAL CA C -0.042 4.040 -1.779 1.00 . A A . 36 VAL CA 1 1 9 8130 1 1 36 VAL CB C -0.295 3.832 -0.279 1.00 . A A . 36 VAL CB 1 1 9 8131 1 1 36 VAL CG1 C -1.496 4.647 0.190 1.00 . A A . 36 VAL CG1 1 1 9 8132 1 1 36 VAL CG2 C -0.580 2.354 -0.028 1.00 . A A . 36 VAL CG2 1 1 9 8133 1 1 36 VAL H H 2.076 4.435 -1.737 1.00 . A A . 36 VAL H 1 1 9 8134 1 1 36 VAL HA H -0.641 3.345 -2.350 1.00 . A A . 36 VAL HA 1 1 9 8135 1 1 36 VAL HB H 0.577 4.133 0.277 1.00 . A A . 36 VAL HB 1 1 9 8136 1 1 36 VAL HG11 H -2.271 4.606 -0.557 1.00 . A A . 36 VAL HG11 1 1 9 8137 1 1 36 VAL HG12 H -1.866 4.233 1.117 1.00 . A A . 36 VAL HG12 1 1 9 8138 1 1 36 VAL HG13 H -1.194 5.670 0.347 1.00 . A A . 36 VAL HG13 1 1 9 8139 1 1 36 VAL HG21 H 0.089 1.758 -0.627 1.00 . A A . 36 VAL HG21 1 1 9 8140 1 1 36 VAL HG22 H -0.428 2.129 1.017 1.00 . A A . 36 VAL HG22 1 1 9 8141 1 1 36 VAL HG23 H -1.601 2.133 -0.300 1.00 . A A . 36 VAL HG23 1 1 9 8142 1 1 36 VAL N N 1.401 3.812 -2.079 1.00 . A A . 36 VAL N 1 1 9 8143 1 1 36 VAL O O -0.207 6.407 -1.445 1.00 . A A . 36 VAL O 1 1 9 8144 1 1 37 LYS C C -2.664 7.272 -3.882 1.00 . A A . 37 LYS C 1 1 9 8145 1 1 37 LYS CA C -1.163 7.022 -3.877 1.00 . A A . 37 LYS CA 1 1 9 8146 1 1 37 LYS CB C -0.649 7.201 -5.303 1.00 . A A . 37 LYS CB 1 1 9 8147 1 1 37 LYS CD C 1.493 7.836 -4.181 1.00 . A A . 37 LYS CD 1 1 9 8148 1 1 37 LYS CE C 2.805 8.468 -4.648 1.00 . A A . 37 LYS CE 1 1 9 8149 1 1 37 LYS CG C 0.865 7.040 -5.329 1.00 . A A . 37 LYS CG 1 1 9 8150 1 1 37 LYS H H -0.958 4.870 -4.005 1.00 . A A . 37 LYS H 1 1 9 8151 1 1 37 LYS HA H -0.681 7.740 -3.235 1.00 . A A . 37 LYS HA 1 1 9 8152 1 1 37 LYS HB2 H -1.102 6.458 -5.942 1.00 . A A . 37 LYS HB2 1 1 9 8153 1 1 37 LYS HB3 H -0.909 8.188 -5.656 1.00 . A A . 37 LYS HB3 1 1 9 8154 1 1 37 LYS HD2 H 0.812 8.615 -3.869 1.00 . A A . 37 LYS HD2 1 1 9 8155 1 1 37 LYS HD3 H 1.690 7.175 -3.350 1.00 . A A . 37 LYS HD3 1 1 9 8156 1 1 37 LYS HE2 H 3.316 7.788 -5.313 1.00 . A A . 37 LYS HE2 1 1 9 8157 1 1 37 LYS HE3 H 2.593 9.391 -5.169 1.00 . A A . 37 LYS HE3 1 1 9 8158 1 1 37 LYS HG2 H 1.115 5.991 -5.226 1.00 . A A . 37 LYS HG2 1 1 9 8159 1 1 37 LYS HG3 H 1.241 7.410 -6.269 1.00 . A A . 37 LYS HG3 1 1 9 8160 1 1 37 LYS HZ1 H 3.074 9.079 -2.676 1.00 . A A . 37 LYS HZ1 1 1 9 8161 1 1 37 LYS HZ2 H 4.171 7.887 -3.188 1.00 . A A . 37 LYS HZ2 1 1 9 8162 1 1 37 LYS HZ3 H 4.357 9.490 -3.710 1.00 . A A . 37 LYS HZ3 1 1 9 8163 1 1 37 LYS N N -0.845 5.643 -3.403 1.00 . A A . 37 LYS N 1 1 9 8164 1 1 37 LYS NZ N 3.667 8.752 -3.466 1.00 . A A . 37 LYS NZ 1 1 9 8165 1 1 37 LYS O O -3.129 8.311 -3.459 1.00 . A A . 37 LYS O 1 1 9 8166 1 1 38 ASP C C -5.583 5.989 -3.229 1.00 . A A . 38 ASP C 1 1 9 8167 1 1 38 ASP CA C -4.891 6.580 -4.459 1.00 . A A . 38 ASP CA 1 1 9 8168 1 1 38 ASP CB C -5.426 5.931 -5.731 1.00 . A A . 38 ASP CB 1 1 9 8169 1 1 38 ASP CG C -6.921 6.224 -5.870 1.00 . A A . 38 ASP CG 1 1 9 8170 1 1 38 ASP H H -3.029 5.526 -4.755 1.00 . A A . 38 ASP H 1 1 9 8171 1 1 38 ASP HA H -5.084 7.642 -4.497 1.00 . A A . 38 ASP HA 1 1 9 8172 1 1 38 ASP HB2 H -4.896 6.329 -6.586 1.00 . A A . 38 ASP HB2 1 1 9 8173 1 1 38 ASP HB3 H -5.271 4.870 -5.681 1.00 . A A . 38 ASP HB3 1 1 9 8174 1 1 38 ASP N N -3.424 6.353 -4.392 1.00 . A A . 38 ASP N 1 1 9 8175 1 1 38 ASP O O -5.544 4.802 -2.988 1.00 . A A . 38 ASP O 1 1 9 8176 1 1 38 ASP OD1 O -7.514 6.655 -4.894 1.00 . A A . 38 ASP OD1 1 1 9 8177 1 1 38 ASP OD2 O -7.449 6.013 -6.950 1.00 . A A . 38 ASP OD2 1 1 9 8178 1 1 39 VAL C C -8.278 5.729 -1.644 1.00 . A A . 39 VAL C 1 1 9 8179 1 1 39 VAL CA C -6.924 6.317 -1.238 1.00 . A A . 39 VAL CA 1 1 9 8180 1 1 39 VAL CB C -7.143 7.475 -0.263 1.00 . A A . 39 VAL CB 1 1 9 8181 1 1 39 VAL CG1 C -5.818 8.205 -0.033 1.00 . A A . 39 VAL CG1 1 1 9 8182 1 1 39 VAL CG2 C -8.163 8.450 -0.856 1.00 . A A . 39 VAL CG2 1 1 9 8183 1 1 39 VAL H H -6.243 7.775 -2.667 1.00 . A A . 39 VAL H 1 1 9 8184 1 1 39 VAL HA H -6.325 5.553 -0.764 1.00 . A A . 39 VAL HA 1 1 9 8185 1 1 39 VAL HB H -7.512 7.090 0.676 1.00 . A A . 39 VAL HB 1 1 9 8186 1 1 39 VAL HG11 H -5.039 7.483 0.160 1.00 . A A . 39 VAL HG11 1 1 9 8187 1 1 39 VAL HG12 H -5.567 8.781 -0.911 1.00 . A A . 39 VAL HG12 1 1 9 8188 1 1 39 VAL HG13 H -5.915 8.866 0.816 1.00 . A A . 39 VAL HG13 1 1 9 8189 1 1 39 VAL HG21 H -8.068 8.460 -1.932 1.00 . A A . 39 VAL HG21 1 1 9 8190 1 1 39 VAL HG22 H -9.161 8.136 -0.586 1.00 . A A . 39 VAL HG22 1 1 9 8191 1 1 39 VAL HG23 H -7.980 9.441 -0.470 1.00 . A A . 39 VAL HG23 1 1 9 8192 1 1 39 VAL N N -6.223 6.819 -2.451 1.00 . A A . 39 VAL N 1 1 9 8193 1 1 39 VAL O O -8.894 4.992 -0.900 1.00 . A A . 39 VAL O 1 1 9 8194 1 1 40 GLU C C -9.826 4.376 -4.274 1.00 . A A . 40 GLU C 1 1 9 8195 1 1 40 GLU CA C -10.057 5.512 -3.275 1.00 . A A . 40 GLU CA 1 1 9 8196 1 1 40 GLU CB C -10.861 6.625 -3.947 1.00 . A A . 40 GLU CB 1 1 9 8197 1 1 40 GLU CD C -12.266 7.046 -1.925 1.00 . A A . 40 GLU CD 1 1 9 8198 1 1 40 GLU CG C -12.287 6.623 -3.395 1.00 . A A . 40 GLU CG 1 1 9 8199 1 1 40 GLU H H -8.230 6.647 -3.405 1.00 . A A . 40 GLU H 1 1 9 8200 1 1 40 GLU HA H -10.606 5.138 -2.426 1.00 . A A . 40 GLU HA 1 1 9 8201 1 1 40 GLU HB2 H -10.395 7.578 -3.745 1.00 . A A . 40 GLU HB2 1 1 9 8202 1 1 40 GLU HB3 H -10.889 6.454 -5.010 1.00 . A A . 40 GLU HB3 1 1 9 8203 1 1 40 GLU HG2 H -12.890 7.316 -3.961 1.00 . A A . 40 GLU HG2 1 1 9 8204 1 1 40 GLU HG3 H -12.703 5.631 -3.476 1.00 . A A . 40 GLU HG3 1 1 9 8205 1 1 40 GLU N N -8.744 6.051 -2.820 1.00 . A A . 40 GLU N 1 1 9 8206 1 1 40 GLU O O -10.759 3.814 -4.813 1.00 . A A . 40 GLU O 1 1 9 8207 1 1 40 GLU OE1 O -11.224 6.916 -1.306 1.00 . A A . 40 GLU OE1 1 1 9 8208 1 1 40 GLU OE2 O -13.294 7.494 -1.444 1.00 . A A . 40 GLU OE2 1 1 9 8209 1 1 41 GLY C C -8.544 1.581 -4.818 1.00 . A A . 41 GLY C 1 1 9 8210 1 1 41 GLY CA C -8.309 2.935 -5.493 1.00 . A A . 41 GLY CA 1 1 9 8211 1 1 41 GLY H H -7.853 4.498 -4.083 1.00 . A A . 41 GLY H 1 1 9 8212 1 1 41 GLY HA2 H -8.962 3.029 -6.348 1.00 . A A . 41 GLY HA2 1 1 9 8213 1 1 41 GLY HA3 H -7.281 2.996 -5.817 1.00 . A A . 41 GLY HA3 1 1 9 8214 1 1 41 GLY N N -8.593 4.033 -4.527 1.00 . A A . 41 GLY N 1 1 9 8215 1 1 41 GLY O O -8.506 0.547 -5.454 1.00 . A A . 41 GLY O 1 1 9 8216 1 1 42 ALA C C -9.978 0.513 -1.656 1.00 . A A . 42 ALA C 1 1 9 8217 1 1 42 ALA CA C -9.019 0.288 -2.828 1.00 . A A . 42 ALA CA 1 1 9 8218 1 1 42 ALA CB C -7.689 -0.253 -2.301 1.00 . A A . 42 ALA CB 1 1 9 8219 1 1 42 ALA H H -8.810 2.423 -3.039 1.00 . A A . 42 ALA H 1 1 9 8220 1 1 42 ALA HA H -9.451 -0.426 -3.514 1.00 . A A . 42 ALA HA 1 1 9 8221 1 1 42 ALA HB1 H -6.888 0.067 -2.950 1.00 . A A . 42 ALA HB1 1 1 9 8222 1 1 42 ALA HB2 H -7.517 0.123 -1.303 1.00 . A A . 42 ALA HB2 1 1 9 8223 1 1 42 ALA HB3 H -7.723 -1.332 -2.277 1.00 . A A . 42 ALA HB3 1 1 9 8224 1 1 42 ALA N N -8.785 1.578 -3.536 1.00 . A A . 42 ALA N 1 1 9 8225 1 1 42 ALA O O -9.771 1.378 -0.828 1.00 . A A . 42 ALA O 1 1 9 8226 1 1 43 SER C C -11.331 -0.493 0.857 1.00 . A A . 43 SER C 1 1 9 8227 1 1 43 SER CA C -11.998 -0.093 -0.461 1.00 . A A . 43 SER CA 1 1 9 8228 1 1 43 SER CB C -13.216 -0.985 -0.706 1.00 . A A . 43 SER CB 1 1 9 8229 1 1 43 SER H H -11.176 -0.953 -2.257 1.00 . A A . 43 SER H 1 1 9 8230 1 1 43 SER HA H -12.312 0.939 -0.409 1.00 . A A . 43 SER HA 1 1 9 8231 1 1 43 SER HB2 H -13.247 -1.767 0.035 1.00 . A A . 43 SER HB2 1 1 9 8232 1 1 43 SER HB3 H -14.115 -0.389 -0.635 1.00 . A A . 43 SER HB3 1 1 9 8233 1 1 43 SER HG H -13.874 -2.148 -2.120 1.00 . A A . 43 SER HG 1 1 9 8234 1 1 43 SER N N -11.027 -0.261 -1.579 1.00 . A A . 43 SER N 1 1 9 8235 1 1 43 SER O O -10.275 -1.095 0.872 1.00 . A A . 43 SER O 1 1 9 8236 1 1 43 SER OG O -13.118 -1.569 -1.999 1.00 . A A . 43 SER OG 1 1 9 8237 1 1 44 GLN C C -11.013 -2.013 3.296 1.00 . A A . 44 GLN C 1 1 9 8238 1 1 44 GLN CA C -11.345 -0.521 3.279 1.00 . A A . 44 GLN CA 1 1 9 8239 1 1 44 GLN CB C -12.344 -0.207 4.396 1.00 . A A . 44 GLN CB 1 1 9 8240 1 1 44 GLN CD C -12.087 2.267 4.171 1.00 . A A . 44 GLN CD 1 1 9 8241 1 1 44 GLN CG C -11.920 1.075 5.114 1.00 . A A . 44 GLN CG 1 1 9 8242 1 1 44 GLN H H -12.792 0.325 1.926 1.00 . A A . 44 GLN H 1 1 9 8243 1 1 44 GLN HA H -10.441 0.050 3.434 1.00 . A A . 44 GLN HA 1 1 9 8244 1 1 44 GLN HB2 H -13.329 -0.073 3.971 1.00 . A A . 44 GLN HB2 1 1 9 8245 1 1 44 GLN HB3 H -12.364 -1.024 5.102 1.00 . A A . 44 GLN HB3 1 1 9 8246 1 1 44 GLN HE21 H -13.332 3.231 5.380 1.00 . A A . 44 GLN HE21 1 1 9 8247 1 1 44 GLN HE22 H -12.977 4.023 3.921 1.00 . A A . 44 GLN HE22 1 1 9 8248 1 1 44 GLN HG2 H -12.537 1.218 5.991 1.00 . A A . 44 GLN HG2 1 1 9 8249 1 1 44 GLN HG3 H -10.886 0.997 5.412 1.00 . A A . 44 GLN HG3 1 1 9 8250 1 1 44 GLN N N -11.941 -0.161 1.963 1.00 . A A . 44 GLN N 1 1 9 8251 1 1 44 GLN NE2 N -12.863 3.257 4.520 1.00 . A A . 44 GLN NE2 1 1 9 8252 1 1 44 GLN O O -9.951 -2.417 3.722 1.00 . A A . 44 GLN O 1 1 9 8253 1 1 44 GLN OE1 O -11.506 2.298 3.104 1.00 . A A . 44 GLN OE1 1 1 9 8254 1 1 45 GLU C C -10.542 -4.618 1.826 1.00 . A A . 45 GLU C 1 1 9 8255 1 1 45 GLU CA C -11.655 -4.301 2.827 1.00 . A A . 45 GLU CA 1 1 9 8256 1 1 45 GLU CB C -12.931 -5.041 2.421 1.00 . A A . 45 GLU CB 1 1 9 8257 1 1 45 GLU CD C -13.809 -5.195 4.755 1.00 . A A . 45 GLU CD 1 1 9 8258 1 1 45 GLU CG C -14.075 -4.641 3.354 1.00 . A A . 45 GLU CG 1 1 9 8259 1 1 45 GLU H H -12.769 -2.487 2.498 1.00 . A A . 45 GLU H 1 1 9 8260 1 1 45 GLU HA H -11.354 -4.619 3.814 1.00 . A A . 45 GLU HA 1 1 9 8261 1 1 45 GLU HB2 H -13.188 -4.783 1.404 1.00 . A A . 45 GLU HB2 1 1 9 8262 1 1 45 GLU HB3 H -12.767 -6.106 2.491 1.00 . A A . 45 GLU HB3 1 1 9 8263 1 1 45 GLU HG2 H -14.143 -3.564 3.399 1.00 . A A . 45 GLU HG2 1 1 9 8264 1 1 45 GLU HG3 H -15.004 -5.046 2.979 1.00 . A A . 45 GLU HG3 1 1 9 8265 1 1 45 GLU N N -11.917 -2.834 2.837 1.00 . A A . 45 GLU N 1 1 9 8266 1 1 45 GLU O O -10.037 -5.722 1.773 1.00 . A A . 45 GLU O 1 1 9 8267 1 1 45 GLU OE1 O -13.678 -6.401 4.878 1.00 . A A . 45 GLU OE1 1 1 9 8268 1 1 45 GLU OE2 O -13.740 -4.403 5.680 1.00 . A A . 45 GLU OE2 1 1 9 8269 1 1 46 GLU C C -7.781 -3.336 0.687 1.00 . A A . 46 GLU C 1 1 9 8270 1 1 46 GLU CA C -9.043 -3.892 0.074 1.00 . A A . 46 GLU CA 1 1 9 8271 1 1 46 GLU CB C -9.347 -3.151 -1.226 1.00 . A A . 46 GLU CB 1 1 9 8272 1 1 46 GLU CD C -10.859 -3.300 -3.209 1.00 . A A . 46 GLU CD 1 1 9 8273 1 1 46 GLU CG C -10.754 -3.514 -1.698 1.00 . A A . 46 GLU CG 1 1 9 8274 1 1 46 GLU H H -10.527 -2.752 1.128 1.00 . A A . 46 GLU H 1 1 9 8275 1 1 46 GLU HA H -8.933 -4.950 -0.113 1.00 . A A . 46 GLU HA 1 1 9 8276 1 1 46 GLU HB2 H -9.287 -2.086 -1.055 1.00 . A A . 46 GLU HB2 1 1 9 8277 1 1 46 GLU HB3 H -8.629 -3.434 -1.977 1.00 . A A . 46 GLU HB3 1 1 9 8278 1 1 46 GLU HG2 H -10.955 -4.550 -1.465 1.00 . A A . 46 GLU HG2 1 1 9 8279 1 1 46 GLU HG3 H -11.472 -2.884 -1.196 1.00 . A A . 46 GLU HG3 1 1 9 8280 1 1 46 GLU N N -10.134 -3.650 1.049 1.00 . A A . 46 GLU N 1 1 9 8281 1 1 46 GLU O O -6.731 -3.946 0.683 1.00 . A A . 46 GLU O 1 1 9 8282 1 1 46 GLU OE1 O -9.983 -3.770 -3.916 1.00 . A A . 46 GLU OE1 1 1 9 8283 1 1 46 GLU OE2 O -11.812 -2.670 -3.634 1.00 . A A . 46 GLU OE2 1 1 9 8284 1 1 47 VAL C C -6.305 -2.470 3.045 1.00 . A A . 47 VAL C 1 1 9 8285 1 1 47 VAL CA C -6.754 -1.545 1.916 1.00 . A A . 47 VAL CA 1 1 9 8286 1 1 47 VAL CB C -7.184 -0.196 2.487 1.00 . A A . 47 VAL CB 1 1 9 8287 1 1 47 VAL CG1 C -5.964 0.700 2.607 1.00 . A A . 47 VAL CG1 1 1 9 8288 1 1 47 VAL CG2 C -8.199 0.461 1.549 1.00 . A A . 47 VAL CG2 1 1 9 8289 1 1 47 VAL H H -8.770 -1.741 1.248 1.00 . A A . 47 VAL H 1 1 9 8290 1 1 47 VAL HA H -5.948 -1.408 1.210 1.00 . A A . 47 VAL HA 1 1 9 8291 1 1 47 VAL HB H -7.625 -0.340 3.462 1.00 . A A . 47 VAL HB 1 1 9 8292 1 1 47 VAL HG11 H -5.313 0.530 1.762 1.00 . A A . 47 VAL HG11 1 1 9 8293 1 1 47 VAL HG12 H -6.280 1.731 2.620 1.00 . A A . 47 VAL HG12 1 1 9 8294 1 1 47 VAL HG13 H -5.439 0.468 3.520 1.00 . A A . 47 VAL HG13 1 1 9 8295 1 1 47 VAL HG21 H -8.201 -0.057 0.601 1.00 . A A . 47 VAL HG21 1 1 9 8296 1 1 47 VAL HG22 H -9.184 0.405 1.990 1.00 . A A . 47 VAL HG22 1 1 9 8297 1 1 47 VAL HG23 H -7.931 1.496 1.394 1.00 . A A . 47 VAL HG23 1 1 9 8298 1 1 47 VAL N N -7.908 -2.177 1.247 1.00 . A A . 47 VAL N 1 1 9 8299 1 1 47 VAL O O -5.128 -2.674 3.271 1.00 . A A . 47 VAL O 1 1 9 8300 1 1 48 GLU C C -6.458 -5.298 4.260 1.00 . A A . 48 GLU C 1 1 9 8301 1 1 48 GLU CA C -6.924 -3.962 4.843 1.00 . A A . 48 GLU CA 1 1 9 8302 1 1 48 GLU CB C -8.204 -4.158 5.633 1.00 . A A . 48 GLU CB 1 1 9 8303 1 1 48 GLU CD C -8.691 -4.514 8.056 1.00 . A A . 48 GLU CD 1 1 9 8304 1 1 48 GLU CG C -8.033 -3.586 7.032 1.00 . A A . 48 GLU CG 1 1 9 8305 1 1 48 GLU H H -8.185 -2.877 3.551 1.00 . A A . 48 GLU H 1 1 9 8306 1 1 48 GLU HA H -6.159 -3.540 5.475 1.00 . A A . 48 GLU HA 1 1 9 8307 1 1 48 GLU HB2 H -9.011 -3.642 5.133 1.00 . A A . 48 GLU HB2 1 1 9 8308 1 1 48 GLU HB3 H -8.431 -5.198 5.684 1.00 . A A . 48 GLU HB3 1 1 9 8309 1 1 48 GLU HG2 H -6.981 -3.490 7.250 1.00 . A A . 48 GLU HG2 1 1 9 8310 1 1 48 GLU HG3 H -8.499 -2.614 7.074 1.00 . A A . 48 GLU HG3 1 1 9 8311 1 1 48 GLU N N -7.246 -3.045 3.748 1.00 . A A . 48 GLU N 1 1 9 8312 1 1 48 GLU O O -5.442 -5.838 4.652 1.00 . A A . 48 GLU O 1 1 9 8313 1 1 48 GLU OE1 O -9.878 -4.765 7.921 1.00 . A A . 48 GLU OE1 1 1 9 8314 1 1 48 GLU OE2 O -7.998 -4.957 8.956 1.00 . A A . 48 GLU OE2 1 1 9 8315 1 1 49 GLU C C -5.340 -7.019 2.213 1.00 . A A . 49 GLU C 1 1 9 8316 1 1 49 GLU CA C -6.782 -7.133 2.710 1.00 . A A . 49 GLU CA 1 1 9 8317 1 1 49 GLU CB C -7.704 -7.460 1.533 1.00 . A A . 49 GLU CB 1 1 9 8318 1 1 49 GLU CD C -9.978 -8.285 0.911 1.00 . A A . 49 GLU CD 1 1 9 8319 1 1 49 GLU CG C -8.963 -8.160 2.050 1.00 . A A . 49 GLU CG 1 1 9 8320 1 1 49 GLU H H -8.005 -5.384 3.012 1.00 . A A . 49 GLU H 1 1 9 8321 1 1 49 GLU HA H -6.847 -7.916 3.451 1.00 . A A . 49 GLU HA 1 1 9 8322 1 1 49 GLU HB2 H -7.980 -6.547 1.028 1.00 . A A . 49 GLU HB2 1 1 9 8323 1 1 49 GLU HB3 H -7.190 -8.112 0.844 1.00 . A A . 49 GLU HB3 1 1 9 8324 1 1 49 GLU HG2 H -8.704 -9.144 2.413 1.00 . A A . 49 GLU HG2 1 1 9 8325 1 1 49 GLU HG3 H -9.394 -7.580 2.851 1.00 . A A . 49 GLU HG3 1 1 9 8326 1 1 49 GLU N N -7.192 -5.836 3.318 1.00 . A A . 49 GLU N 1 1 9 8327 1 1 49 GLU O O -4.486 -7.809 2.566 1.00 . A A . 49 GLU O 1 1 9 8328 1 1 49 GLU OE1 O -9.550 -8.436 -0.222 1.00 . A A . 49 GLU OE1 1 1 9 8329 1 1 49 GLU OE2 O -11.162 -8.228 1.191 1.00 . A A . 49 GLU OE2 1 1 9 8330 1 1 50 ALA C C -2.741 -5.564 2.069 1.00 . A A . 50 ALA C 1 1 9 8331 1 1 50 ALA CA C -3.668 -5.868 0.891 1.00 . A A . 50 ALA CA 1 1 9 8332 1 1 50 ALA CB C -3.625 -4.708 -0.106 1.00 . A A . 50 ALA CB 1 1 9 8333 1 1 50 ALA H H -5.758 -5.407 1.131 1.00 . A A . 50 ALA H 1 1 9 8334 1 1 50 ALA HA H -3.347 -6.778 0.404 1.00 . A A . 50 ALA HA 1 1 9 8335 1 1 50 ALA HB1 H -4.616 -4.527 -0.492 1.00 . A A . 50 ALA HB1 1 1 9 8336 1 1 50 ALA HB2 H -3.265 -3.819 0.392 1.00 . A A . 50 ALA HB2 1 1 9 8337 1 1 50 ALA HB3 H -2.961 -4.957 -0.921 1.00 . A A . 50 ALA HB3 1 1 9 8338 1 1 50 ALA N N -5.057 -6.037 1.400 1.00 . A A . 50 ALA N 1 1 9 8339 1 1 50 ALA O O -1.538 -5.703 1.981 1.00 . A A . 50 ALA O 1 1 9 8340 1 1 51 MET C C -2.052 -6.142 5.049 1.00 . A A . 51 MET C 1 1 9 8341 1 1 51 MET CA C -2.463 -4.837 4.364 1.00 . A A . 51 MET CA 1 1 9 8342 1 1 51 MET CB C -3.274 -3.978 5.338 1.00 . A A . 51 MET CB 1 1 9 8343 1 1 51 MET CE C -2.972 -0.767 6.495 1.00 . A A . 51 MET CE 1 1 9 8344 1 1 51 MET CG C -2.352 -3.415 6.420 1.00 . A A . 51 MET CG 1 1 9 8345 1 1 51 MET H H -4.273 -5.049 3.220 1.00 . A A . 51 MET H 1 1 9 8346 1 1 51 MET HA H -1.580 -4.297 4.055 1.00 . A A . 51 MET HA 1 1 9 8347 1 1 51 MET HB2 H -3.736 -3.164 4.799 1.00 . A A . 51 MET HB2 1 1 9 8348 1 1 51 MET HB3 H -4.040 -4.583 5.799 1.00 . A A . 51 MET HB3 1 1 9 8349 1 1 51 MET HE1 H -2.285 -0.990 5.694 1.00 . A A . 51 MET HE1 1 1 9 8350 1 1 51 MET HE2 H -3.904 -0.411 6.078 1.00 . A A . 51 MET HE2 1 1 9 8351 1 1 51 MET HE3 H -2.544 -0.007 7.134 1.00 . A A . 51 MET HE3 1 1 9 8352 1 1 51 MET HG2 H -1.972 -4.225 7.026 1.00 . A A . 51 MET HG2 1 1 9 8353 1 1 51 MET HG3 H -1.528 -2.894 5.956 1.00 . A A . 51 MET HG3 1 1 9 8354 1 1 51 MET N N -3.299 -5.151 3.174 1.00 . A A . 51 MET N 1 1 9 8355 1 1 51 MET O O -1.119 -6.180 5.827 1.00 . A A . 51 MET O 1 1 9 8356 1 1 51 MET SD S -3.281 -2.265 7.465 1.00 . A A . 51 MET SD 1 1 9 8357 1 1 52 ASP C C -1.691 -9.412 4.374 1.00 . A A . 52 ASP C 1 1 9 8358 1 1 52 ASP CA C -2.393 -8.516 5.397 1.00 . A A . 52 ASP CA 1 1 9 8359 1 1 52 ASP CB C -3.671 -9.204 5.879 1.00 . A A . 52 ASP CB 1 1 9 8360 1 1 52 ASP CG C -3.310 -10.312 6.869 1.00 . A A . 52 ASP CG 1 1 9 8361 1 1 52 ASP H H -3.492 -7.159 4.134 1.00 . A A . 52 ASP H 1 1 9 8362 1 1 52 ASP HA H -1.738 -8.344 6.238 1.00 . A A . 52 ASP HA 1 1 9 8363 1 1 52 ASP HB2 H -4.310 -8.479 6.364 1.00 . A A . 52 ASP HB2 1 1 9 8364 1 1 52 ASP HB3 H -4.189 -9.633 5.035 1.00 . A A . 52 ASP HB3 1 1 9 8365 1 1 52 ASP N N -2.742 -7.213 4.764 1.00 . A A . 52 ASP N 1 1 9 8366 1 1 52 ASP O O -0.955 -10.312 4.726 1.00 . A A . 52 ASP O 1 1 9 8367 1 1 52 ASP OD1 O -2.351 -10.135 7.602 1.00 . A A . 52 ASP OD1 1 1 9 8368 1 1 52 ASP OD2 O -3.999 -11.319 6.878 1.00 . A A . 52 ASP OD2 1 1 9 8369 1 1 53 THR C C 0.256 -9.871 2.155 1.00 . A A . 53 THR C 1 1 9 8370 1 1 53 THR CA C -1.266 -10.021 2.068 1.00 . A A . 53 THR CA 1 1 9 8371 1 1 53 THR CB C -1.745 -9.580 0.683 1.00 . A A . 53 THR CB 1 1 9 8372 1 1 53 THR CG2 C -1.746 -10.780 -0.266 1.00 . A A . 53 THR CG2 1 1 9 8373 1 1 53 THR H H -2.517 -8.449 2.847 1.00 . A A . 53 THR H 1 1 9 8374 1 1 53 THR HA H -1.533 -11.055 2.227 1.00 . A A . 53 THR HA 1 1 9 8375 1 1 53 THR HB H -1.082 -8.822 0.295 1.00 . A A . 53 THR HB 1 1 9 8376 1 1 53 THR HG1 H -3.451 -9.059 -0.094 1.00 . A A . 53 THR HG1 1 1 9 8377 1 1 53 THR HG21 H -1.111 -11.556 0.135 1.00 . A A . 53 THR HG21 1 1 9 8378 1 1 53 THR HG22 H -2.753 -11.157 -0.369 1.00 . A A . 53 THR HG22 1 1 9 8379 1 1 53 THR HG23 H -1.375 -10.476 -1.232 1.00 . A A . 53 THR HG23 1 1 9 8380 1 1 53 THR N N -1.916 -9.177 3.110 1.00 . A A . 53 THR N 1 1 9 8381 1 1 53 THR O O 0.984 -10.845 2.153 1.00 . A A . 53 THR O 1 1 9 8382 1 1 53 THR OG1 O -3.060 -9.054 0.784 1.00 . A A . 53 THR OG1 1 1 9 8383 1 1 54 CYS C C 2.802 -9.375 3.394 1.00 . A A . 54 CYS C 1 1 9 8384 1 1 54 CYS CA C 2.221 -8.463 2.311 1.00 . A A . 54 CYS CA 1 1 9 8385 1 1 54 CYS CB C 2.524 -7.002 2.658 1.00 . A A . 54 CYS CB 1 1 9 8386 1 1 54 CYS H H 0.145 -7.889 2.224 1.00 . A A . 54 CYS H 1 1 9 8387 1 1 54 CYS HA H 2.670 -8.705 1.359 1.00 . A A . 54 CYS HA 1 1 9 8388 1 1 54 CYS HB2 H 1.810 -6.357 2.172 1.00 . A A . 54 CYS HB2 1 1 9 8389 1 1 54 CYS HB3 H 2.457 -6.868 3.727 1.00 . A A . 54 CYS HB3 1 1 9 8390 1 1 54 CYS N N 0.745 -8.663 2.227 1.00 . A A . 54 CYS N 1 1 9 8391 1 1 54 CYS O O 2.157 -9.652 4.384 1.00 . A A . 54 CYS O 1 1 9 8392 1 1 54 CYS SG S 4.195 -6.449 2.157 1.00 . A A . 54 CYS SG 1 1 9 8393 1 1 55 PRO C C 5.145 -9.911 5.367 1.00 . A A . 55 PRO C 1 1 9 8394 1 1 55 PRO CA C 4.696 -10.704 4.136 1.00 . A A . 55 PRO CA 1 1 9 8395 1 1 55 PRO CB C 5.896 -11.240 3.354 1.00 . A A . 55 PRO CB 1 1 9 8396 1 1 55 PRO CD C 4.846 -9.520 1.994 1.00 . A A . 55 PRO CD 1 1 9 8397 1 1 55 PRO CG C 6.160 -10.213 2.293 1.00 . A A . 55 PRO CG 1 1 9 8398 1 1 55 PRO HA H 4.050 -11.519 4.423 1.00 . A A . 55 PRO HA 1 1 9 8399 1 1 55 PRO HB2 H 6.735 -11.356 4.029 1.00 . A A . 55 PRO HB2 1 1 9 8400 1 1 55 PRO HB3 H 5.647 -12.196 2.924 1.00 . A A . 55 PRO HB3 1 1 9 8401 1 1 55 PRO HD2 H 5.001 -8.456 1.885 1.00 . A A . 55 PRO HD2 1 1 9 8402 1 1 55 PRO HD3 H 4.398 -9.931 1.102 1.00 . A A . 55 PRO HD3 1 1 9 8403 1 1 55 PRO HG2 H 6.886 -9.497 2.652 1.00 . A A . 55 PRO HG2 1 1 9 8404 1 1 55 PRO HG3 H 6.526 -10.699 1.402 1.00 . A A . 55 PRO HG3 1 1 9 8405 1 1 55 PRO N N 4.012 -9.813 3.164 1.00 . A A . 55 PRO N 1 1 9 8406 1 1 55 PRO O O 4.670 -10.132 6.463 1.00 . A A . 55 PRO O 1 1 9 8407 1 1 56 VAL C C 5.481 -7.100 6.670 1.00 . A A . 56 VAL C 1 1 9 8408 1 1 56 VAL CA C 6.515 -8.182 6.363 1.00 . A A . 56 VAL CA 1 1 9 8409 1 1 56 VAL CB C 7.859 -7.531 6.033 1.00 . A A . 56 VAL CB 1 1 9 8410 1 1 56 VAL CG1 C 8.399 -6.820 7.275 1.00 . A A . 56 VAL CG1 1 1 9 8411 1 1 56 VAL CG2 C 8.852 -8.608 5.592 1.00 . A A . 56 VAL CG2 1 1 9 8412 1 1 56 VAL H H 6.419 -8.817 4.307 1.00 . A A . 56 VAL H 1 1 9 8413 1 1 56 VAL HA H 6.628 -8.827 7.222 1.00 . A A . 56 VAL HA 1 1 9 8414 1 1 56 VAL HB H 7.725 -6.813 5.236 1.00 . A A . 56 VAL HB 1 1 9 8415 1 1 56 VAL HG11 H 8.005 -7.295 8.161 1.00 . A A . 56 VAL HG11 1 1 9 8416 1 1 56 VAL HG12 H 9.477 -6.879 7.284 1.00 . A A . 56 VAL HG12 1 1 9 8417 1 1 56 VAL HG13 H 8.095 -5.784 7.258 1.00 . A A . 56 VAL HG13 1 1 9 8418 1 1 56 VAL HG21 H 8.341 -9.346 4.995 1.00 . A A . 56 VAL HG21 1 1 9 8419 1 1 56 VAL HG22 H 9.639 -8.153 5.009 1.00 . A A . 56 VAL HG22 1 1 9 8420 1 1 56 VAL HG23 H 9.279 -9.081 6.465 1.00 . A A . 56 VAL HG23 1 1 9 8421 1 1 56 VAL N N 6.049 -8.985 5.198 1.00 . A A . 56 VAL N 1 1 9 8422 1 1 56 VAL O O 5.373 -6.625 7.782 1.00 . A A . 56 VAL O 1 1 9 8423 1 1 57 GLN C C 4.356 -4.322 6.213 1.00 . A A . 57 GLN C 1 1 9 8424 1 1 57 GLN CA C 3.678 -5.663 5.919 1.00 . A A . 57 GLN CA 1 1 9 8425 1 1 57 GLN CB C 2.808 -6.065 7.114 1.00 . A A . 57 GLN CB 1 1 9 8426 1 1 57 GLN CD C 1.018 -7.804 7.199 1.00 . A A . 57 GLN CD 1 1 9 8427 1 1 57 GLN CG C 1.409 -6.442 6.625 1.00 . A A . 57 GLN CG 1 1 9 8428 1 1 57 GLN H H 4.814 -7.110 4.800 1.00 . A A . 57 GLN H 1 1 9 8429 1 1 57 GLN HA H 3.058 -5.570 5.037 1.00 . A A . 57 GLN HA 1 1 9 8430 1 1 57 GLN HB2 H 3.255 -6.910 7.615 1.00 . A A . 57 GLN HB2 1 1 9 8431 1 1 57 GLN HB3 H 2.736 -5.235 7.800 1.00 . A A . 57 GLN HB3 1 1 9 8432 1 1 57 GLN HE21 H 2.418 -8.788 6.194 1.00 . A A . 57 GLN HE21 1 1 9 8433 1 1 57 GLN HE22 H 1.436 -9.745 7.192 1.00 . A A . 57 GLN HE22 1 1 9 8434 1 1 57 GLN HG2 H 0.701 -5.695 6.953 1.00 . A A . 57 GLN HG2 1 1 9 8435 1 1 57 GLN HG3 H 1.405 -6.493 5.547 1.00 . A A . 57 GLN HG3 1 1 9 8436 1 1 57 GLN N N 4.712 -6.710 5.688 1.00 . A A . 57 GLN N 1 1 9 8437 1 1 57 GLN NE2 N 1.679 -8.867 6.832 1.00 . A A . 57 GLN NE2 1 1 9 8438 1 1 57 GLN O O 4.341 -3.842 7.330 1.00 . A A . 57 GLN O 1 1 9 8439 1 1 57 GLN OE1 O 0.103 -7.902 7.992 1.00 . A A . 57 GLN OE1 1 1 9 8440 1 1 58 CYS C C 4.598 -1.272 5.221 1.00 . A A . 58 CYS C 1 1 9 8441 1 1 58 CYS CA C 5.610 -2.396 5.451 1.00 . A A . 58 CYS CA 1 1 9 8442 1 1 58 CYS CB C 6.779 -2.235 4.475 1.00 . A A . 58 CYS CB 1 1 9 8443 1 1 58 CYS H H 4.941 -4.107 4.327 1.00 . A A . 58 CYS H 1 1 9 8444 1 1 58 CYS HA H 5.978 -2.349 6.466 1.00 . A A . 58 CYS HA 1 1 9 8445 1 1 58 CYS HB2 H 7.125 -3.209 4.164 1.00 . A A . 58 CYS HB2 1 1 9 8446 1 1 58 CYS HB3 H 6.451 -1.677 3.611 1.00 . A A . 58 CYS HB3 1 1 9 8447 1 1 58 CYS HG H 8.646 -1.984 5.786 1.00 . A A . 58 CYS HG 1 1 9 8448 1 1 58 CYS N N 4.943 -3.709 5.222 1.00 . A A . 58 CYS N 1 1 9 8449 1 1 58 CYS O O 4.957 -0.143 4.955 1.00 . A A . 58 CYS O 1 1 9 8450 1 1 58 CYS SG S 8.128 -1.346 5.291 1.00 . A A . 58 CYS SG 1 1 9 8451 1 1 59 ILE C C 1.629 -0.182 6.435 1.00 . A A . 59 ILE C 1 1 9 8452 1 1 59 ILE CA C 2.291 -0.535 5.098 1.00 . A A . 59 ILE CA 1 1 9 8453 1 1 59 ILE CB C 1.241 -1.078 4.126 1.00 . A A . 59 ILE CB 1 1 9 8454 1 1 59 ILE CD1 C -0.540 0.572 4.765 1.00 . A A . 59 ILE CD1 1 1 9 8455 1 1 59 ILE CG1 C 0.354 0.069 3.629 1.00 . A A . 59 ILE CG1 1 1 9 8456 1 1 59 ILE CG2 C 0.379 -2.128 4.831 1.00 . A A . 59 ILE CG2 1 1 9 8457 1 1 59 ILE H H 3.067 -2.496 5.529 1.00 . A A . 59 ILE H 1 1 9 8458 1 1 59 ILE HA H 2.748 0.348 4.678 1.00 . A A . 59 ILE HA 1 1 9 8459 1 1 59 ILE HB H 1.740 -1.536 3.285 1.00 . A A . 59 ILE HB 1 1 9 8460 1 1 59 ILE HD11 H -0.535 -0.140 5.576 1.00 . A A . 59 ILE HD11 1 1 9 8461 1 1 59 ILE HD12 H -0.169 1.520 5.118 1.00 . A A . 59 ILE HD12 1 1 9 8462 1 1 59 ILE HD13 H -1.549 0.694 4.402 1.00 . A A . 59 ILE HD13 1 1 9 8463 1 1 59 ILE HG12 H 0.979 0.877 3.279 1.00 . A A . 59 ILE HG12 1 1 9 8464 1 1 59 ILE HG13 H -0.265 -0.283 2.817 1.00 . A A . 59 ILE HG13 1 1 9 8465 1 1 59 ILE HG21 H -0.046 -1.703 5.727 1.00 . A A . 59 ILE HG21 1 1 9 8466 1 1 59 ILE HG22 H -0.413 -2.446 4.171 1.00 . A A . 59 ILE HG22 1 1 9 8467 1 1 59 ILE HG23 H 0.992 -2.979 5.092 1.00 . A A . 59 ILE HG23 1 1 9 8468 1 1 59 ILE N N 3.333 -1.577 5.317 1.00 . A A . 59 ILE N 1 1 9 8469 1 1 59 ILE O O 1.380 -1.038 7.260 1.00 . A A . 59 ILE O 1 1 9 8470 1 1 60 HIS C C -0.321 2.595 7.663 1.00 . A A . 60 HIS C 1 1 9 8471 1 1 60 HIS CA C 0.696 1.483 7.934 1.00 . A A . 60 HIS CA 1 1 9 8472 1 1 60 HIS CB C 1.762 1.995 8.905 1.00 . A A . 60 HIS CB 1 1 9 8473 1 1 60 HIS CD2 C 3.564 0.213 9.604 1.00 . A A . 60 HIS CD2 1 1 9 8474 1 1 60 HIS CE1 C 4.848 0.369 7.868 1.00 . A A . 60 HIS CE1 1 1 9 8475 1 1 60 HIS CG C 3.003 1.156 8.778 1.00 . A A . 60 HIS CG 1 1 9 8476 1 1 60 HIS H H 1.551 1.749 5.973 1.00 . A A . 60 HIS H 1 1 9 8477 1 1 60 HIS HA H 0.192 0.632 8.369 1.00 . A A . 60 HIS HA 1 1 9 8478 1 1 60 HIS HB2 H 1.996 3.023 8.672 1.00 . A A . 60 HIS HB2 1 1 9 8479 1 1 60 HIS HB3 H 1.388 1.931 9.915 1.00 . A A . 60 HIS HB3 1 1 9 8480 1 1 60 HIS HD1 H 3.719 1.824 6.900 1.00 . A A . 60 HIS HD1 1 1 9 8481 1 1 60 HIS HD2 H 3.160 -0.097 10.558 1.00 . A A . 60 HIS HD2 1 1 9 8482 1 1 60 HIS HE1 H 5.657 0.215 7.168 1.00 . A A . 60 HIS HE1 1 1 9 8483 1 1 60 HIS N N 1.342 1.075 6.653 1.00 . A A . 60 HIS N 1 1 9 8484 1 1 60 HIS ND1 N 3.841 1.238 7.677 1.00 . A A . 60 HIS ND1 1 1 9 8485 1 1 60 HIS NE2 N 4.729 -0.282 9.029 1.00 . A A . 60 HIS NE2 1 1 9 8486 1 1 60 HIS O O -0.540 2.990 6.535 1.00 . A A . 60 HIS O 1 1 9 8487 1 1 61 TRP C C -1.298 5.551 8.742 1.00 . A A . 61 TRP C 1 1 9 8488 1 1 61 TRP CA C -1.948 4.192 8.482 1.00 . A A . 61 TRP CA 1 1 9 8489 1 1 61 TRP CB C -3.124 3.988 9.438 1.00 . A A . 61 TRP CB 1 1 9 8490 1 1 61 TRP CD1 C -3.094 1.466 9.639 1.00 . A A . 61 TRP CD1 1 1 9 8491 1 1 61 TRP CD2 C -4.930 2.244 8.608 1.00 . A A . 61 TRP CD2 1 1 9 8492 1 1 61 TRP CE2 C -5.055 0.837 8.642 1.00 . A A . 61 TRP CE2 1 1 9 8493 1 1 61 TRP CE3 C -5.954 2.989 8.011 1.00 . A A . 61 TRP CE3 1 1 9 8494 1 1 61 TRP CG C -3.682 2.618 9.243 1.00 . A A . 61 TRP CG 1 1 9 8495 1 1 61 TRP CH2 C -7.180 0.949 7.503 1.00 . A A . 61 TRP CH2 1 1 9 8496 1 1 61 TRP CZ2 C -6.166 0.191 8.097 1.00 . A A . 61 TRP CZ2 1 1 9 8497 1 1 61 TRP CZ3 C -7.075 2.347 7.461 1.00 . A A . 61 TRP CZ3 1 1 9 8498 1 1 61 TRP H H -0.757 2.779 9.592 1.00 . A A . 61 TRP H 1 1 9 8499 1 1 61 TRP HA H -2.306 4.160 7.465 1.00 . A A . 61 TRP HA 1 1 9 8500 1 1 61 TRP HB2 H -2.793 4.102 10.454 1.00 . A A . 61 TRP HB2 1 1 9 8501 1 1 61 TRP HB3 H -3.890 4.719 9.225 1.00 . A A . 61 TRP HB3 1 1 9 8502 1 1 61 TRP HD1 H -2.146 1.387 10.150 1.00 . A A . 61 TRP HD1 1 1 9 8503 1 1 61 TRP HE1 H -3.714 -0.540 9.453 1.00 . A A . 61 TRP HE1 1 1 9 8504 1 1 61 TRP HE3 H -5.874 4.067 7.978 1.00 . A A . 61 TRP HE3 1 1 9 8505 1 1 61 TRP HH2 H -8.044 0.459 7.080 1.00 . A A . 61 TRP HH2 1 1 9 8506 1 1 61 TRP HZ2 H -6.241 -0.887 8.133 1.00 . A A . 61 TRP HZ2 1 1 9 8507 1 1 61 TRP HZ3 H -7.858 2.933 7.002 1.00 . A A . 61 TRP HZ3 1 1 9 8508 1 1 61 TRP N N -0.946 3.108 8.689 1.00 . A A . 61 TRP N 1 1 9 8509 1 1 61 TRP NE1 N -3.908 0.406 9.282 1.00 . A A . 61 TRP NE1 1 1 9 8510 1 1 61 TRP O O -0.125 5.644 9.045 1.00 . A A . 61 TRP O 1 1 9 8511 1 1 62 GLU C C -2.567 8.904 9.367 1.00 . A A . 62 GLU C 1 1 9 8512 1 1 62 GLU CA C -1.476 7.964 8.847 1.00 . A A . 62 GLU CA 1 1 9 8513 1 1 62 GLU CB C -0.920 8.504 7.525 1.00 . A A . 62 GLU CB 1 1 9 8514 1 1 62 GLU CD C 0.357 10.232 8.803 1.00 . A A . 62 GLU CD 1 1 9 8515 1 1 62 GLU CG C -0.633 10.001 7.661 1.00 . A A . 62 GLU CG 1 1 9 8516 1 1 62 GLU H H -2.993 6.513 8.367 1.00 . A A . 62 GLU H 1 1 9 8517 1 1 62 GLU HA H -0.680 7.899 9.573 1.00 . A A . 62 GLU HA 1 1 9 8518 1 1 62 GLU HB2 H -0.006 7.983 7.282 1.00 . A A . 62 GLU HB2 1 1 9 8519 1 1 62 GLU HB3 H -1.644 8.348 6.739 1.00 . A A . 62 GLU HB3 1 1 9 8520 1 1 62 GLU HG2 H -0.211 10.371 6.738 1.00 . A A . 62 GLU HG2 1 1 9 8521 1 1 62 GLU HG3 H -1.552 10.527 7.873 1.00 . A A . 62 GLU HG3 1 1 9 8522 1 1 62 GLU N N -2.051 6.609 8.617 1.00 . A A . 62 GLU N 1 1 9 8523 1 1 62 GLU O O -3.334 9.462 8.608 1.00 . A A . 62 GLU O 1 1 9 8524 1 1 62 GLU OE1 O 0.981 9.270 9.223 1.00 . A A . 62 GLU OE1 1 1 9 8525 1 1 62 GLU OE2 O 0.476 11.365 9.238 1.00 . A A . 62 GLU OE2 1 1 9 8526 1 1 63 ASP C C -2.995 11.232 11.814 1.00 . A A . 63 ASP C 1 1 9 8527 1 1 63 ASP CA C -3.674 9.993 11.226 1.00 . A A . 63 ASP CA 1 1 9 8528 1 1 63 ASP CB C -4.443 9.261 12.328 1.00 . A A . 63 ASP CB 1 1 9 8529 1 1 63 ASP CG C -3.455 8.654 13.325 1.00 . A A . 63 ASP CG 1 1 9 8530 1 1 63 ASP H H -2.008 8.629 11.252 1.00 . A A . 63 ASP H 1 1 9 8531 1 1 63 ASP HA H -4.360 10.292 10.447 1.00 . A A . 63 ASP HA 1 1 9 8532 1 1 63 ASP HB2 H -5.090 9.959 12.840 1.00 . A A . 63 ASP HB2 1 1 9 8533 1 1 63 ASP HB3 H -5.038 8.474 11.890 1.00 . A A . 63 ASP HB3 1 1 9 8534 1 1 63 ASP N N -2.639 9.087 10.657 1.00 . A A . 63 ASP N 1 1 9 8535 1 1 63 ASP O O -3.591 11.989 12.554 1.00 . A A . 63 ASP O 1 1 9 8536 1 1 63 ASP OD1 O -2.263 8.807 13.114 1.00 . A A . 63 ASP OD1 1 1 9 8537 1 1 63 ASP OD2 O -3.906 8.047 14.282 1.00 . A A . 63 ASP OD2 1 1 9 8538 1 1 64 GLU C C -0.968 12.545 13.554 1.00 . A A . 64 GLU C 1 1 9 8539 1 1 64 GLU CA C -1.025 12.630 12.029 1.00 . A A . 64 GLU CA 1 1 9 8540 1 1 64 GLU CB C -1.759 13.907 11.615 1.00 . A A . 64 GLU CB 1 1 9 8541 1 1 64 GLU CD C -1.567 15.106 9.431 1.00 . A A . 64 GLU CD 1 1 9 8542 1 1 64 GLU CG C -0.844 14.760 10.735 1.00 . A A . 64 GLU CG 1 1 9 8543 1 1 64 GLU H H -1.285 10.818 10.893 1.00 . A A . 64 GLU H 1 1 9 8544 1 1 64 GLU HA H -0.020 12.649 11.632 1.00 . A A . 64 GLU HA 1 1 9 8545 1 1 64 GLU HB2 H -2.651 13.646 11.063 1.00 . A A . 64 GLU HB2 1 1 9 8546 1 1 64 GLU HB3 H -2.032 14.467 12.496 1.00 . A A . 64 GLU HB3 1 1 9 8547 1 1 64 GLU HG2 H -0.587 15.670 11.258 1.00 . A A . 64 GLU HG2 1 1 9 8548 1 1 64 GLU HG3 H 0.056 14.208 10.509 1.00 . A A . 64 GLU HG3 1 1 9 8549 1 1 64 GLU N N -1.748 11.443 11.490 1.00 . A A . 64 GLU N 1 1 9 8550 1 1 64 GLU OE1 O -2.786 15.159 9.449 1.00 . A A . 64 GLU OE1 1 1 9 8551 1 1 64 GLU OE2 O -0.889 15.312 8.438 1.00 . A A . 64 GLU OE2 1 1 9 8552 2 2 1 SF4 FE1 FE 5.564 -4.815 -2.210 1.00 . B A . 65 SF4 FE1 1 1 9 8553 2 2 1 SF4 FE2 FE 4.137 -6.010 0.020 1.00 . B A . 65 SF4 FE2 1 1 9 8554 2 2 1 SF4 FE3 FE 2.967 -4.656 -2.177 1.00 . B A . 65 SF4 FE3 1 1 9 8555 2 2 1 SF4 FE4 FE 4.345 -7.268 -2.580 1.00 . B A . 65 SF4 FE4 1 1 9 8556 2 2 1 SF4 S1 S 2.369 -6.788 -1.068 1.00 . B A . 65 SF4 S1 1 1 9 8557 2 2 1 SF4 S2 S 4.381 -5.127 -3.805 1.00 . B A . 65 SF4 S2 1 1 9 8558 2 2 1 SF4 S3 S 6.037 -6.994 -1.173 1.00 . B A . 65 SF4 S3 1 1 9 8559 2 2 1 SF4 S4 S 4.350 -3.642 -0.783 1.00 . B A . 65 SF4 S4 1 1 10 8560 1 1 1 ALA C C -9.509 9.684 9.073 1.00 . A A . 1 ALA C 1 1 10 8561 1 1 1 ALA CA C -10.593 10.731 8.805 1.00 . A A . 1 ALA CA 1 1 10 8562 1 1 1 ALA CB C -10.466 11.867 9.822 1.00 . A A . 1 ALA CB 1 1 10 8563 1 1 1 ALA HA H -10.472 11.127 7.808 1.00 . A A . 1 ALA HA 1 1 10 8564 1 1 1 ALA HB1 H -10.936 11.574 10.750 1.00 . A A . 1 ALA HB1 1 1 10 8565 1 1 1 ALA HB2 H -9.422 12.078 9.997 1.00 . A A . 1 ALA HB2 1 1 10 8566 1 1 1 ALA HB3 H -10.953 12.752 9.437 1.00 . A A . 1 ALA HB3 1 1 10 8567 1 1 1 ALA N N -11.938 10.103 8.931 1.00 . A A . 1 ALA N 1 1 10 8568 1 1 1 ALA O O -8.695 9.834 9.962 1.00 . A A . 1 ALA O 1 1 10 8569 1 1 2 ARG C C -7.654 7.381 7.236 1.00 . A A . 2 ARG C 1 1 10 8570 1 1 2 ARG CA C -8.464 7.569 8.521 1.00 . A A . 2 ARG CA 1 1 10 8571 1 1 2 ARG CB C -9.151 6.252 8.889 1.00 . A A . 2 ARG CB 1 1 10 8572 1 1 2 ARG CD C -9.519 6.643 11.331 1.00 . A A . 2 ARG CD 1 1 10 8573 1 1 2 ARG CG C -8.731 5.832 10.299 1.00 . A A . 2 ARG CG 1 1 10 8574 1 1 2 ARG CZ C -9.348 6.245 13.714 1.00 . A A . 2 ARG CZ 1 1 10 8575 1 1 2 ARG H H -10.160 8.523 7.600 1.00 . A A . 2 ARG H 1 1 10 8576 1 1 2 ARG HA H -7.803 7.866 9.323 1.00 . A A . 2 ARG HA 1 1 10 8577 1 1 2 ARG HB2 H -10.223 6.386 8.856 1.00 . A A . 2 ARG HB2 1 1 10 8578 1 1 2 ARG HB3 H -8.860 5.487 8.185 1.00 . A A . 2 ARG HB3 1 1 10 8579 1 1 2 ARG HD2 H -8.959 7.527 11.597 1.00 . A A . 2 ARG HD2 1 1 10 8580 1 1 2 ARG HD3 H -10.471 6.932 10.911 1.00 . A A . 2 ARG HD3 1 1 10 8581 1 1 2 ARG HE H -10.188 4.943 12.472 1.00 . A A . 2 ARG HE 1 1 10 8582 1 1 2 ARG HG2 H -8.934 4.780 10.435 1.00 . A A . 2 ARG HG2 1 1 10 8583 1 1 2 ARG HG3 H -7.676 6.016 10.429 1.00 . A A . 2 ARG HG3 1 1 10 8584 1 1 2 ARG HH11 H -9.893 8.140 13.366 1.00 . A A . 2 ARG HH11 1 1 10 8585 1 1 2 ARG HH12 H -9.182 7.837 14.916 1.00 . A A . 2 ARG HH12 1 1 10 8586 1 1 2 ARG HH21 H -8.713 4.450 14.332 1.00 . A A . 2 ARG HH21 1 1 10 8587 1 1 2 ARG HH22 H -8.513 5.746 15.463 1.00 . A A . 2 ARG HH22 1 1 10 8588 1 1 2 ARG N N -9.493 8.625 8.311 1.00 . A A . 2 ARG N 1 1 10 8589 1 1 2 ARG NE N -9.743 5.813 12.548 1.00 . A A . 2 ARG NE 1 1 10 8590 1 1 2 ARG NH1 N -9.484 7.505 14.023 1.00 . A A . 2 ARG NH1 1 1 10 8591 1 1 2 ARG NH2 N -8.816 5.416 14.570 1.00 . A A . 2 ARG NH2 1 1 10 8592 1 1 2 ARG O O -8.141 6.852 6.257 1.00 . A A . 2 ARG O 1 1 10 8593 1 1 3 LYS C C -4.693 6.422 6.162 1.00 . A A . 3 LYS C 1 1 10 8594 1 1 3 LYS CA C -5.582 7.658 6.012 1.00 . A A . 3 LYS CA 1 1 10 8595 1 1 3 LYS CB C -4.707 8.901 5.848 1.00 . A A . 3 LYS CB 1 1 10 8596 1 1 3 LYS CD C -5.078 10.944 4.462 1.00 . A A . 3 LYS CD 1 1 10 8597 1 1 3 LYS CE C -5.894 11.368 3.240 1.00 . A A . 3 LYS CE 1 1 10 8598 1 1 3 LYS CG C -4.838 9.434 4.420 1.00 . A A . 3 LYS CG 1 1 10 8599 1 1 3 LYS H H -6.047 8.235 8.031 1.00 . A A . 3 LYS H 1 1 10 8600 1 1 3 LYS HA H -6.216 7.545 5.146 1.00 . A A . 3 LYS HA 1 1 10 8601 1 1 3 LYS HB2 H -5.028 9.660 6.547 1.00 . A A . 3 LYS HB2 1 1 10 8602 1 1 3 LYS HB3 H -3.679 8.645 6.042 1.00 . A A . 3 LYS HB3 1 1 10 8603 1 1 3 LYS HD2 H -5.619 11.197 5.362 1.00 . A A . 3 LYS HD2 1 1 10 8604 1 1 3 LYS HD3 H -4.129 11.459 4.456 1.00 . A A . 3 LYS HD3 1 1 10 8605 1 1 3 LYS HE2 H -5.930 10.554 2.531 1.00 . A A . 3 LYS HE2 1 1 10 8606 1 1 3 LYS HE3 H -6.898 11.622 3.548 1.00 . A A . 3 LYS HE3 1 1 10 8607 1 1 3 LYS HG2 H -3.930 9.226 3.872 1.00 . A A . 3 LYS HG2 1 1 10 8608 1 1 3 LYS HG3 H -5.672 8.954 3.932 1.00 . A A . 3 LYS HG3 1 1 10 8609 1 1 3 LYS HZ1 H -4.478 12.894 3.209 1.00 . A A . 3 LYS HZ1 1 1 10 8610 1 1 3 LYS HZ2 H -4.876 12.285 1.673 1.00 . A A . 3 LYS HZ2 1 1 10 8611 1 1 3 LYS HZ3 H -5.959 13.306 2.485 1.00 . A A . 3 LYS HZ3 1 1 10 8612 1 1 3 LYS N N -6.422 7.811 7.231 1.00 . A A . 3 LYS N 1 1 10 8613 1 1 3 LYS NZ N -5.254 12.552 2.603 1.00 . A A . 3 LYS NZ 1 1 10 8614 1 1 3 LYS O O -5.004 5.515 6.907 1.00 . A A . 3 LYS O 1 1 10 8615 1 1 4 PHE C C -1.562 5.362 4.531 1.00 . A A . 4 PHE C 1 1 10 8616 1 1 4 PHE CA C -2.671 5.214 5.570 1.00 . A A . 4 PHE CA 1 1 10 8617 1 1 4 PHE CB C -3.445 3.918 5.303 1.00 . A A . 4 PHE CB 1 1 10 8618 1 1 4 PHE CD1 C -5.295 4.514 3.697 1.00 . A A . 4 PHE CD1 1 1 10 8619 1 1 4 PHE CD2 C -3.312 3.416 2.835 1.00 . A A . 4 PHE CD2 1 1 10 8620 1 1 4 PHE CE1 C -5.840 4.542 2.409 1.00 . A A . 4 PHE CE1 1 1 10 8621 1 1 4 PHE CE2 C -3.858 3.445 1.546 1.00 . A A . 4 PHE CE2 1 1 10 8622 1 1 4 PHE CG C -4.031 3.951 3.911 1.00 . A A . 4 PHE CG 1 1 10 8623 1 1 4 PHE CZ C -5.122 4.009 1.332 1.00 . A A . 4 PHE CZ 1 1 10 8624 1 1 4 PHE H H -3.351 7.129 4.882 1.00 . A A . 4 PHE H 1 1 10 8625 1 1 4 PHE HA H -2.236 5.184 6.557 1.00 . A A . 4 PHE HA 1 1 10 8626 1 1 4 PHE HB2 H -2.777 3.076 5.391 1.00 . A A . 4 PHE HB2 1 1 10 8627 1 1 4 PHE HB3 H -4.241 3.816 6.024 1.00 . A A . 4 PHE HB3 1 1 10 8628 1 1 4 PHE HD1 H -5.849 4.925 4.528 1.00 . A A . 4 PHE HD1 1 1 10 8629 1 1 4 PHE HD2 H -2.337 2.981 2.998 1.00 . A A . 4 PHE HD2 1 1 10 8630 1 1 4 PHE HE1 H -6.815 4.977 2.245 1.00 . A A . 4 PHE HE1 1 1 10 8631 1 1 4 PHE HE2 H -3.304 3.033 0.714 1.00 . A A . 4 PHE HE2 1 1 10 8632 1 1 4 PHE HZ H -5.543 4.031 0.338 1.00 . A A . 4 PHE HZ 1 1 10 8633 1 1 4 PHE N N -3.586 6.383 5.468 1.00 . A A . 4 PHE N 1 1 10 8634 1 1 4 PHE O O -1.489 6.346 3.824 1.00 . A A . 4 PHE O 1 1 10 8635 1 1 5 TYR C C 1.222 3.236 3.641 1.00 . A A . 5 TYR C 1 1 10 8636 1 1 5 TYR CA C 0.377 4.457 3.428 1.00 . A A . 5 TYR CA 1 1 10 8637 1 1 5 TYR CB C 1.233 5.710 3.612 1.00 . A A . 5 TYR CB 1 1 10 8638 1 1 5 TYR CD1 C 1.289 6.140 6.094 1.00 . A A . 5 TYR CD1 1 1 10 8639 1 1 5 TYR CD2 C 3.238 5.161 5.033 1.00 . A A . 5 TYR CD2 1 1 10 8640 1 1 5 TYR CE1 C 1.947 6.107 7.330 1.00 . A A . 5 TYR CE1 1 1 10 8641 1 1 5 TYR CE2 C 3.894 5.128 6.269 1.00 . A A . 5 TYR CE2 1 1 10 8642 1 1 5 TYR CG C 1.935 5.668 4.947 1.00 . A A . 5 TYR CG 1 1 10 8643 1 1 5 TYR CZ C 3.249 5.600 7.417 1.00 . A A . 5 TYR CZ 1 1 10 8644 1 1 5 TYR H H -0.776 3.581 4.988 1.00 . A A . 5 TYR H 1 1 10 8645 1 1 5 TYR HA H -0.043 4.440 2.433 1.00 . A A . 5 TYR HA 1 1 10 8646 1 1 5 TYR HB2 H 1.971 5.754 2.823 1.00 . A A . 5 TYR HB2 1 1 10 8647 1 1 5 TYR HB3 H 0.608 6.578 3.560 1.00 . A A . 5 TYR HB3 1 1 10 8648 1 1 5 TYR HD1 H 0.285 6.531 6.028 1.00 . A A . 5 TYR HD1 1 1 10 8649 1 1 5 TYR HD2 H 3.736 4.796 4.147 1.00 . A A . 5 TYR HD2 1 1 10 8650 1 1 5 TYR HE1 H 1.448 6.471 8.217 1.00 . A A . 5 TYR HE1 1 1 10 8651 1 1 5 TYR HE2 H 4.900 4.737 6.335 1.00 . A A . 5 TYR HE2 1 1 10 8652 1 1 5 TYR HH H 3.336 6.004 9.280 1.00 . A A . 5 TYR HH 1 1 10 8653 1 1 5 TYR N N -0.706 4.386 4.420 1.00 . A A . 5 TYR N 1 1 10 8654 1 1 5 TYR O O 0.878 2.367 4.419 1.00 . A A . 5 TYR O 1 1 10 8655 1 1 5 TYR OH O 3.897 5.567 8.635 1.00 . A A . 5 TYR OH 1 1 10 8656 1 1 6 VAL C C 4.605 2.211 3.090 1.00 . A A . 6 VAL C 1 1 10 8657 1 1 6 VAL CA C 3.122 1.926 3.182 1.00 . A A . 6 VAL CA 1 1 10 8658 1 1 6 VAL CB C 2.763 0.899 2.126 1.00 . A A . 6 VAL CB 1 1 10 8659 1 1 6 VAL CG1 C 3.243 -0.447 2.622 1.00 . A A . 6 VAL CG1 1 1 10 8660 1 1 6 VAL CG2 C 1.246 0.865 1.914 1.00 . A A . 6 VAL CG2 1 1 10 8661 1 1 6 VAL H H 2.587 3.842 2.352 1.00 . A A . 6 VAL H 1 1 10 8662 1 1 6 VAL HA H 2.901 1.515 4.154 1.00 . A A . 6 VAL HA 1 1 10 8663 1 1 6 VAL HB H 3.260 1.142 1.198 1.00 . A A . 6 VAL HB 1 1 10 8664 1 1 6 VAL HG11 H 3.364 -0.402 3.690 1.00 . A A . 6 VAL HG11 1 1 10 8665 1 1 6 VAL HG12 H 2.518 -1.200 2.373 1.00 . A A . 6 VAL HG12 1 1 10 8666 1 1 6 VAL HG13 H 4.190 -0.678 2.161 1.00 . A A . 6 VAL HG13 1 1 10 8667 1 1 6 VAL HG21 H 0.745 1.066 2.846 1.00 . A A . 6 VAL HG21 1 1 10 8668 1 1 6 VAL HG22 H 0.967 1.613 1.187 1.00 . A A . 6 VAL HG22 1 1 10 8669 1 1 6 VAL HG23 H 0.953 -0.111 1.557 1.00 . A A . 6 VAL HG23 1 1 10 8670 1 1 6 VAL N N 2.312 3.137 2.977 1.00 . A A . 6 VAL N 1 1 10 8671 1 1 6 VAL O O 5.038 3.242 2.613 1.00 . A A . 6 VAL O 1 1 10 8672 1 1 7 ASP C C 7.358 0.554 2.328 1.00 . A A . 7 ASP C 1 1 10 8673 1 1 7 ASP CA C 6.847 1.428 3.455 1.00 . A A . 7 ASP CA 1 1 10 8674 1 1 7 ASP CB C 7.480 1.005 4.772 1.00 . A A . 7 ASP CB 1 1 10 8675 1 1 7 ASP CG C 8.757 1.812 5.013 1.00 . A A . 7 ASP CG 1 1 10 8676 1 1 7 ASP H H 5.004 0.442 3.885 1.00 . A A . 7 ASP H 1 1 10 8677 1 1 7 ASP HA H 7.084 2.458 3.246 1.00 . A A . 7 ASP HA 1 1 10 8678 1 1 7 ASP HB2 H 6.780 1.191 5.564 1.00 . A A . 7 ASP HB2 1 1 10 8679 1 1 7 ASP HB3 H 7.720 -0.047 4.739 1.00 . A A . 7 ASP HB3 1 1 10 8680 1 1 7 ASP N N 5.386 1.270 3.526 1.00 . A A . 7 ASP N 1 1 10 8681 1 1 7 ASP O O 7.951 -0.486 2.534 1.00 . A A . 7 ASP O 1 1 10 8682 1 1 7 ASP OD1 O 8.864 2.893 4.457 1.00 . A A . 7 ASP OD1 1 1 10 8683 1 1 7 ASP OD2 O 9.605 1.337 5.748 1.00 . A A . 7 ASP OD2 1 1 10 8684 1 1 8 GLN C C 9.091 -0.057 0.068 1.00 . A A . 8 GLN C 1 1 10 8685 1 1 8 GLN CA C 7.594 0.221 -0.060 1.00 . A A . 8 GLN CA 1 1 10 8686 1 1 8 GLN CB C 7.334 1.044 -1.324 1.00 . A A . 8 GLN CB 1 1 10 8687 1 1 8 GLN CD C 8.094 3.170 -0.245 1.00 . A A . 8 GLN CD 1 1 10 8688 1 1 8 GLN CG C 8.334 2.200 -1.405 1.00 . A A . 8 GLN CG 1 1 10 8689 1 1 8 GLN H H 6.655 1.834 1.014 1.00 . A A . 8 GLN H 1 1 10 8690 1 1 8 GLN HA H 7.056 -0.713 -0.119 1.00 . A A . 8 GLN HA 1 1 10 8691 1 1 8 GLN HB2 H 7.443 0.410 -2.193 1.00 . A A . 8 GLN HB2 1 1 10 8692 1 1 8 GLN HB3 H 6.331 1.440 -1.292 1.00 . A A . 8 GLN HB3 1 1 10 8693 1 1 8 GLN HE21 H 6.211 3.534 -0.755 1.00 . A A . 8 GLN HE21 1 1 10 8694 1 1 8 GLN HE22 H 6.762 4.358 0.623 1.00 . A A . 8 GLN HE22 1 1 10 8695 1 1 8 GLN HG2 H 9.340 1.810 -1.347 1.00 . A A . 8 GLN HG2 1 1 10 8696 1 1 8 GLN HG3 H 8.204 2.723 -2.339 1.00 . A A . 8 GLN HG3 1 1 10 8697 1 1 8 GLN N N 7.131 0.989 1.129 1.00 . A A . 8 GLN N 1 1 10 8698 1 1 8 GLN NE2 N 6.924 3.734 -0.114 1.00 . A A . 8 GLN NE2 1 1 10 8699 1 1 8 GLN O O 9.651 -0.846 -0.666 1.00 . A A . 8 GLN O 1 1 10 8700 1 1 8 GLN OE1 O 8.980 3.416 0.549 1.00 . A A . 8 GLN OE1 1 1 10 8701 1 1 9 ASP C C 11.402 -1.100 1.629 1.00 . A A . 9 ASP C 1 1 10 8702 1 1 9 ASP CA C 11.203 0.341 1.178 1.00 . A A . 9 ASP CA 1 1 10 8703 1 1 9 ASP CB C 11.754 1.296 2.241 1.00 . A A . 9 ASP CB 1 1 10 8704 1 1 9 ASP CG C 12.840 2.177 1.619 1.00 . A A . 9 ASP CG 1 1 10 8705 1 1 9 ASP H H 9.272 1.201 1.588 1.00 . A A . 9 ASP H 1 1 10 8706 1 1 9 ASP HA H 11.716 0.504 0.241 1.00 . A A . 9 ASP HA 1 1 10 8707 1 1 9 ASP HB2 H 10.954 1.917 2.616 1.00 . A A . 9 ASP HB2 1 1 10 8708 1 1 9 ASP HB3 H 12.178 0.725 3.053 1.00 . A A . 9 ASP HB3 1 1 10 8709 1 1 9 ASP N N 9.744 0.578 1.001 1.00 . A A . 9 ASP N 1 1 10 8710 1 1 9 ASP O O 12.375 -1.746 1.295 1.00 . A A . 9 ASP O 1 1 10 8711 1 1 9 ASP OD1 O 12.633 2.644 0.512 1.00 . A A . 9 ASP OD1 1 1 10 8712 1 1 9 ASP OD2 O 13.858 2.370 2.263 1.00 . A A . 9 ASP OD2 1 1 10 8713 1 1 10 GLU C C 9.863 -3.921 1.834 1.00 . A A . 10 GLU C 1 1 10 8714 1 1 10 GLU CA C 10.561 -3.013 2.849 1.00 . A A . 10 GLU CA 1 1 10 8715 1 1 10 GLU CB C 9.854 -3.139 4.198 1.00 . A A . 10 GLU CB 1 1 10 8716 1 1 10 GLU CD C 11.465 -3.543 6.064 1.00 . A A . 10 GLU CD 1 1 10 8717 1 1 10 GLU CG C 10.544 -4.212 5.042 1.00 . A A . 10 GLU CG 1 1 10 8718 1 1 10 GLU H H 9.687 -1.067 2.619 1.00 . A A . 10 GLU H 1 1 10 8719 1 1 10 GLU HA H 11.598 -3.300 2.949 1.00 . A A . 10 GLU HA 1 1 10 8720 1 1 10 GLU HB2 H 9.882 -2.192 4.719 1.00 . A A . 10 GLU HB2 1 1 10 8721 1 1 10 GLU HB3 H 8.832 -3.421 4.028 1.00 . A A . 10 GLU HB3 1 1 10 8722 1 1 10 GLU HG2 H 9.798 -4.799 5.558 1.00 . A A . 10 GLU HG2 1 1 10 8723 1 1 10 GLU HG3 H 11.128 -4.855 4.401 1.00 . A A . 10 GLU HG3 1 1 10 8724 1 1 10 GLU N N 10.466 -1.610 2.377 1.00 . A A . 10 GLU N 1 1 10 8725 1 1 10 GLU O O 10.034 -5.124 1.835 1.00 . A A . 10 GLU O 1 1 10 8726 1 1 10 GLU OE1 O 12.280 -2.733 5.657 1.00 . A A . 10 GLU OE1 1 1 10 8727 1 1 10 GLU OE2 O 11.338 -3.854 7.238 1.00 . A A . 10 GLU OE2 1 1 10 8728 1 1 11 CYS C C 9.271 -5.209 -0.641 1.00 . A A . 11 CYS C 1 1 10 8729 1 1 11 CYS CA C 8.333 -4.164 -0.035 1.00 . A A . 11 CYS CA 1 1 10 8730 1 1 11 CYS CB C 7.788 -3.252 -1.141 1.00 . A A . 11 CYS CB 1 1 10 8731 1 1 11 CYS H H 8.933 -2.376 1.003 1.00 . A A . 11 CYS H 1 1 10 8732 1 1 11 CYS HA H 7.508 -4.667 0.447 1.00 . A A . 11 CYS HA 1 1 10 8733 1 1 11 CYS HB2 H 6.948 -2.686 -0.762 1.00 . A A . 11 CYS HB2 1 1 10 8734 1 1 11 CYS HB3 H 8.563 -2.572 -1.465 1.00 . A A . 11 CYS HB3 1 1 10 8735 1 1 11 CYS N N 9.062 -3.347 0.975 1.00 . A A . 11 CYS N 1 1 10 8736 1 1 11 CYS O O 10.350 -4.899 -1.105 1.00 . A A . 11 CYS O 1 1 10 8737 1 1 11 CYS SG S 7.227 -4.150 -2.631 1.00 . A A . 11 CYS SG 1 1 10 8738 1 1 12 ILE C C 9.592 -7.497 -2.748 1.00 . A A . 12 ILE C 1 1 10 8739 1 1 12 ILE CA C 9.717 -7.522 -1.219 1.00 . A A . 12 ILE CA 1 1 10 8740 1 1 12 ILE CB C 9.262 -8.878 -0.674 1.00 . A A . 12 ILE CB 1 1 10 8741 1 1 12 ILE CD1 C 7.591 -10.614 -1.333 1.00 . A A . 12 ILE CD1 1 1 10 8742 1 1 12 ILE CG1 C 7.804 -9.122 -1.068 1.00 . A A . 12 ILE CG1 1 1 10 8743 1 1 12 ILE CG2 C 9.385 -8.882 0.850 1.00 . A A . 12 ILE CG2 1 1 10 8744 1 1 12 ILE H H 7.983 -6.673 -0.265 1.00 . A A . 12 ILE H 1 1 10 8745 1 1 12 ILE HA H 10.745 -7.348 -0.941 1.00 . A A . 12 ILE HA 1 1 10 8746 1 1 12 ILE HB H 9.885 -9.658 -1.087 1.00 . A A . 12 ILE HB 1 1 10 8747 1 1 12 ILE HD11 H 8.366 -11.182 -0.839 1.00 . A A . 12 ILE HD11 1 1 10 8748 1 1 12 ILE HD12 H 6.627 -10.912 -0.950 1.00 . A A . 12 ILE HD12 1 1 10 8749 1 1 12 ILE HD13 H 7.631 -10.800 -2.396 1.00 . A A . 12 ILE HD13 1 1 10 8750 1 1 12 ILE HG12 H 7.156 -8.801 -0.266 1.00 . A A . 12 ILE HG12 1 1 10 8751 1 1 12 ILE HG13 H 7.575 -8.564 -1.963 1.00 . A A . 12 ILE HG13 1 1 10 8752 1 1 12 ILE HG21 H 10.281 -8.354 1.141 1.00 . A A . 12 ILE HG21 1 1 10 8753 1 1 12 ILE HG22 H 8.523 -8.396 1.283 1.00 . A A . 12 ILE HG22 1 1 10 8754 1 1 12 ILE HG23 H 9.438 -9.902 1.204 1.00 . A A . 12 ILE HG23 1 1 10 8755 1 1 12 ILE N N 8.859 -6.449 -0.643 1.00 . A A . 12 ILE N 1 1 10 8756 1 1 12 ILE O O 9.653 -6.450 -3.361 1.00 . A A . 12 ILE O 1 1 10 8757 1 1 13 ALA C C 7.947 -9.221 -5.276 1.00 . A A . 13 ALA C 1 1 10 8758 1 1 13 ALA CA C 9.303 -8.639 -4.862 1.00 . A A . 13 ALA CA 1 1 10 8759 1 1 13 ALA CB C 10.426 -9.489 -5.460 1.00 . A A . 13 ALA CB 1 1 10 8760 1 1 13 ALA H H 9.378 -9.473 -2.880 1.00 . A A . 13 ALA H 1 1 10 8761 1 1 13 ALA HA H 9.385 -7.628 -5.233 1.00 . A A . 13 ALA HA 1 1 10 8762 1 1 13 ALA HB1 H 11.344 -9.302 -4.923 1.00 . A A . 13 ALA HB1 1 1 10 8763 1 1 13 ALA HB2 H 10.168 -10.535 -5.378 1.00 . A A . 13 ALA HB2 1 1 10 8764 1 1 13 ALA HB3 H 10.558 -9.231 -6.500 1.00 . A A . 13 ALA HB3 1 1 10 8765 1 1 13 ALA N N 9.423 -8.632 -3.377 1.00 . A A . 13 ALA N 1 1 10 8766 1 1 13 ALA O O 7.858 -10.010 -6.196 1.00 . A A . 13 ALA O 1 1 10 8767 1 1 14 CYS C C 4.596 -8.208 -5.271 1.00 . A A . 14 CYS C 1 1 10 8768 1 1 14 CYS CA C 5.548 -9.369 -4.988 1.00 . A A . 14 CYS CA 1 1 10 8769 1 1 14 CYS CB C 4.989 -10.227 -3.850 1.00 . A A . 14 CYS CB 1 1 10 8770 1 1 14 CYS H H 6.975 -8.195 -3.877 1.00 . A A . 14 CYS H 1 1 10 8771 1 1 14 CYS HA H 5.643 -9.976 -5.876 1.00 . A A . 14 CYS HA 1 1 10 8772 1 1 14 CYS HB2 H 4.644 -11.169 -4.250 1.00 . A A . 14 CYS HB2 1 1 10 8773 1 1 14 CYS HB3 H 5.767 -10.409 -3.125 1.00 . A A . 14 CYS HB3 1 1 10 8774 1 1 14 CYS N N 6.889 -8.836 -4.613 1.00 . A A . 14 CYS N 1 1 10 8775 1 1 14 CYS O O 4.793 -7.102 -4.809 1.00 . A A . 14 CYS O 1 1 10 8776 1 1 14 CYS SG S 3.581 -9.508 -2.924 1.00 . A A . 14 CYS SG 1 1 10 8777 1 1 15 GLU C C 1.223 -7.712 -5.797 1.00 . A A . 15 GLU C 1 1 10 8778 1 1 15 GLU CA C 2.604 -7.360 -6.354 1.00 . A A . 15 GLU CA 1 1 10 8779 1 1 15 GLU CB C 2.514 -7.192 -7.873 1.00 . A A . 15 GLU CB 1 1 10 8780 1 1 15 GLU CD C 3.337 -5.683 -9.687 1.00 . A A . 15 GLU CD 1 1 10 8781 1 1 15 GLU CG C 3.700 -6.361 -8.365 1.00 . A A . 15 GLU CG 1 1 10 8782 1 1 15 GLU H H 3.428 -9.349 -6.400 1.00 . A A . 15 GLU H 1 1 10 8783 1 1 15 GLU HA H 2.946 -6.438 -5.911 1.00 . A A . 15 GLU HA 1 1 10 8784 1 1 15 GLU HB2 H 2.533 -8.164 -8.345 1.00 . A A . 15 GLU HB2 1 1 10 8785 1 1 15 GLU HB3 H 1.593 -6.686 -8.125 1.00 . A A . 15 GLU HB3 1 1 10 8786 1 1 15 GLU HG2 H 3.942 -5.609 -7.629 1.00 . A A . 15 GLU HG2 1 1 10 8787 1 1 15 GLU HG3 H 4.553 -7.006 -8.515 1.00 . A A . 15 GLU HG3 1 1 10 8788 1 1 15 GLU N N 3.566 -8.450 -6.035 1.00 . A A . 15 GLU N 1 1 10 8789 1 1 15 GLU O O 0.224 -7.144 -6.194 1.00 . A A . 15 GLU O 1 1 10 8790 1 1 15 GLU OE1 O 3.234 -6.384 -10.680 1.00 . A A . 15 GLU OE1 1 1 10 8791 1 1 15 GLU OE2 O 3.169 -4.475 -9.684 1.00 . A A . 15 GLU OE2 1 1 10 8792 1 1 16 SER C C -0.954 -7.738 -3.996 1.00 . A A . 16 SER C 1 1 10 8793 1 1 16 SER CA C -0.164 -9.012 -4.301 1.00 . A A . 16 SER CA 1 1 10 8794 1 1 16 SER CB C 0.048 -9.807 -3.011 1.00 . A A . 16 SER CB 1 1 10 8795 1 1 16 SER H H 1.972 -9.082 -4.570 1.00 . A A . 16 SER H 1 1 10 8796 1 1 16 SER HA H -0.712 -9.614 -5.010 1.00 . A A . 16 SER HA 1 1 10 8797 1 1 16 SER HB2 H -0.508 -9.352 -2.209 1.00 . A A . 16 SER HB2 1 1 10 8798 1 1 16 SER HB3 H -0.298 -10.822 -3.155 1.00 . A A . 16 SER HB3 1 1 10 8799 1 1 16 SER HG H 1.567 -10.437 -1.971 1.00 . A A . 16 SER HG 1 1 10 8800 1 1 16 SER N N 1.156 -8.637 -4.880 1.00 . A A . 16 SER N 1 1 10 8801 1 1 16 SER O O -1.923 -7.424 -4.656 1.00 . A A . 16 SER O 1 1 10 8802 1 1 16 SER OG O 1.431 -9.806 -2.681 1.00 . A A . 16 SER OG 1 1 10 8803 1 1 17 CYS C C -1.579 -4.974 -3.951 1.00 . A A . 17 CYS C 1 1 10 8804 1 1 17 CYS CA C -1.260 -5.738 -2.665 1.00 . A A . 17 CYS CA 1 1 10 8805 1 1 17 CYS CB C -0.374 -4.871 -1.771 1.00 . A A . 17 CYS CB 1 1 10 8806 1 1 17 CYS H H 0.249 -7.263 -2.490 1.00 . A A . 17 CYS H 1 1 10 8807 1 1 17 CYS HA H -2.177 -5.973 -2.146 1.00 . A A . 17 CYS HA 1 1 10 8808 1 1 17 CYS HB2 H -0.986 -4.158 -1.239 1.00 . A A . 17 CYS HB2 1 1 10 8809 1 1 17 CYS HB3 H 0.147 -5.499 -1.063 1.00 . A A . 17 CYS HB3 1 1 10 8810 1 1 17 CYS N N -0.540 -6.996 -3.005 1.00 . A A . 17 CYS N 1 1 10 8811 1 1 17 CYS O O -2.704 -4.581 -4.190 1.00 . A A . 17 CYS O 1 1 10 8812 1 1 17 CYS SG S 0.898 -3.926 -2.686 1.00 . A A . 17 CYS SG 1 1 10 8813 1 1 18 VAL C C -2.035 -4.628 -6.777 1.00 . A A . 18 VAL C 1 1 10 8814 1 1 18 VAL CA C -0.836 -4.018 -6.046 1.00 . A A . 18 VAL CA 1 1 10 8815 1 1 18 VAL CB C 0.406 -4.114 -6.936 1.00 . A A . 18 VAL CB 1 1 10 8816 1 1 18 VAL CG1 C 0.204 -3.262 -8.191 1.00 . A A . 18 VAL CG1 1 1 10 8817 1 1 18 VAL CG2 C 1.625 -3.602 -6.164 1.00 . A A . 18 VAL CG2 1 1 10 8818 1 1 18 VAL H H 0.305 -5.082 -4.564 1.00 . A A . 18 VAL H 1 1 10 8819 1 1 18 VAL HA H -1.040 -2.980 -5.823 1.00 . A A . 18 VAL HA 1 1 10 8820 1 1 18 VAL HB H 0.565 -5.143 -7.222 1.00 . A A . 18 VAL HB 1 1 10 8821 1 1 18 VAL HG11 H -0.744 -3.510 -8.646 1.00 . A A . 18 VAL HG11 1 1 10 8822 1 1 18 VAL HG12 H 0.212 -2.216 -7.922 1.00 . A A . 18 VAL HG12 1 1 10 8823 1 1 18 VAL HG13 H 1.002 -3.459 -8.891 1.00 . A A . 18 VAL HG13 1 1 10 8824 1 1 18 VAL HG21 H 1.296 -3.012 -5.321 1.00 . A A . 18 VAL HG21 1 1 10 8825 1 1 18 VAL HG22 H 2.205 -4.441 -5.811 1.00 . A A . 18 VAL HG22 1 1 10 8826 1 1 18 VAL HG23 H 2.234 -2.992 -6.815 1.00 . A A . 18 VAL HG23 1 1 10 8827 1 1 18 VAL N N -0.595 -4.758 -4.778 1.00 . A A . 18 VAL N 1 1 10 8828 1 1 18 VAL O O -2.784 -3.939 -7.440 1.00 . A A . 18 VAL O 1 1 10 8829 1 1 19 GLU C C -4.622 -6.434 -6.485 1.00 . A A . 19 GLU C 1 1 10 8830 1 1 19 GLU CA C -3.378 -6.556 -7.355 1.00 . A A . 19 GLU CA 1 1 10 8831 1 1 19 GLU CB C -3.069 -8.032 -7.617 1.00 . A A . 19 GLU CB 1 1 10 8832 1 1 19 GLU CD C -2.387 -9.665 -9.381 1.00 . A A . 19 GLU CD 1 1 10 8833 1 1 19 GLU CG C -2.435 -8.185 -9.003 1.00 . A A . 19 GLU CG 1 1 10 8834 1 1 19 GLU H H -1.611 -6.457 -6.125 1.00 . A A . 19 GLU H 1 1 10 8835 1 1 19 GLU HA H -3.555 -6.050 -8.290 1.00 . A A . 19 GLU HA 1 1 10 8836 1 1 19 GLU HB2 H -2.384 -8.395 -6.865 1.00 . A A . 19 GLU HB2 1 1 10 8837 1 1 19 GLU HB3 H -3.983 -8.604 -7.578 1.00 . A A . 19 GLU HB3 1 1 10 8838 1 1 19 GLU HG2 H -3.024 -7.644 -9.729 1.00 . A A . 19 GLU HG2 1 1 10 8839 1 1 19 GLU HG3 H -1.431 -7.787 -8.985 1.00 . A A . 19 GLU HG3 1 1 10 8840 1 1 19 GLU N N -2.225 -5.915 -6.663 1.00 . A A . 19 GLU N 1 1 10 8841 1 1 19 GLU O O -5.728 -6.326 -6.977 1.00 . A A . 19 GLU O 1 1 10 8842 1 1 19 GLU OE1 O -1.890 -10.445 -8.584 1.00 . A A . 19 GLU OE1 1 1 10 8843 1 1 19 GLU OE2 O -2.849 -9.995 -10.462 1.00 . A A . 19 GLU OE2 1 1 10 8844 1 1 20 ILE C C -5.991 -4.792 -4.202 1.00 . A A . 20 ILE C 1 1 10 8845 1 1 20 ILE CA C -5.631 -6.277 -4.299 1.00 . A A . 20 ILE CA 1 1 10 8846 1 1 20 ILE CB C -5.292 -6.813 -2.911 1.00 . A A . 20 ILE CB 1 1 10 8847 1 1 20 ILE CD1 C -3.505 -8.518 -2.637 1.00 . A A . 20 ILE CD1 1 1 10 8848 1 1 20 ILE CG1 C -4.972 -8.282 -3.003 1.00 . A A . 20 ILE CG1 1 1 10 8849 1 1 20 ILE CG2 C -6.478 -6.612 -1.969 1.00 . A A . 20 ILE CG2 1 1 10 8850 1 1 20 ILE H H -3.553 -6.492 -4.814 1.00 . A A . 20 ILE H 1 1 10 8851 1 1 20 ILE HA H -6.466 -6.828 -4.706 1.00 . A A . 20 ILE HA 1 1 10 8852 1 1 20 ILE HB H -4.442 -6.313 -2.529 1.00 . A A . 20 ILE HB 1 1 10 8853 1 1 20 ILE HD11 H -3.076 -7.602 -2.261 1.00 . A A . 20 ILE HD11 1 1 10 8854 1 1 20 ILE HD12 H -3.442 -9.282 -1.879 1.00 . A A . 20 ILE HD12 1 1 10 8855 1 1 20 ILE HD13 H -2.964 -8.837 -3.514 1.00 . A A . 20 ILE HD13 1 1 10 8856 1 1 20 ILE HG12 H -5.600 -8.810 -2.321 1.00 . A A . 20 ILE HG12 1 1 10 8857 1 1 20 ILE HG13 H -5.148 -8.612 -4.000 1.00 . A A . 20 ILE HG13 1 1 10 8858 1 1 20 ILE HG21 H -7.398 -6.785 -2.507 1.00 . A A . 20 ILE HG21 1 1 10 8859 1 1 20 ILE HG22 H -6.407 -7.310 -1.147 1.00 . A A . 20 ILE HG22 1 1 10 8860 1 1 20 ILE HG23 H -6.469 -5.603 -1.586 1.00 . A A . 20 ILE HG23 1 1 10 8861 1 1 20 ILE N N -4.454 -6.423 -5.194 1.00 . A A . 20 ILE N 1 1 10 8862 1 1 20 ILE O O -6.816 -4.393 -3.403 1.00 . A A . 20 ILE O 1 1 10 8863 1 1 21 ALA C C -5.032 -1.816 -6.168 1.00 . A A . 21 ALA C 1 1 10 8864 1 1 21 ALA CA C -5.683 -2.508 -4.968 1.00 . A A . 21 ALA CA 1 1 10 8865 1 1 21 ALA CB C -5.129 -1.908 -3.673 1.00 . A A . 21 ALA CB 1 1 10 8866 1 1 21 ALA H H -4.714 -4.305 -5.655 1.00 . A A . 21 ALA H 1 1 10 8867 1 1 21 ALA HA H -6.753 -2.361 -5.004 1.00 . A A . 21 ALA HA 1 1 10 8868 1 1 21 ALA HB1 H -5.267 -2.608 -2.862 1.00 . A A . 21 ALA HB1 1 1 10 8869 1 1 21 ALA HB2 H -4.075 -1.701 -3.793 1.00 . A A . 21 ALA HB2 1 1 10 8870 1 1 21 ALA HB3 H -5.652 -0.990 -3.448 1.00 . A A . 21 ALA HB3 1 1 10 8871 1 1 21 ALA N N -5.377 -3.965 -5.014 1.00 . A A . 21 ALA N 1 1 10 8872 1 1 21 ALA O O -4.092 -1.056 -6.014 1.00 . A A . 21 ALA O 1 1 10 8873 1 1 22 PRO C C -5.399 -0.022 -8.655 1.00 . A A . 22 PRO C 1 1 10 8874 1 1 22 PRO CA C -5.031 -1.506 -8.582 1.00 . A A . 22 PRO CA 1 1 10 8875 1 1 22 PRO CB C -5.722 -2.303 -9.687 1.00 . A A . 22 PRO CB 1 1 10 8876 1 1 22 PRO CD C -6.693 -3.003 -7.580 1.00 . A A . 22 PRO CD 1 1 10 8877 1 1 22 PRO CG C -6.975 -2.826 -9.055 1.00 . A A . 22 PRO CG 1 1 10 8878 1 1 22 PRO HA H -3.963 -1.636 -8.644 1.00 . A A . 22 PRO HA 1 1 10 8879 1 1 22 PRO HB2 H -5.927 -1.647 -10.524 1.00 . A A . 22 PRO HB2 1 1 10 8880 1 1 22 PRO HB3 H -5.079 -3.104 -10.009 1.00 . A A . 22 PRO HB3 1 1 10 8881 1 1 22 PRO HD2 H -7.556 -2.711 -6.995 1.00 . A A . 22 PRO HD2 1 1 10 8882 1 1 22 PRO HD3 H -6.418 -4.024 -7.366 1.00 . A A . 22 PRO HD3 1 1 10 8883 1 1 22 PRO HG2 H -7.779 -2.118 -9.200 1.00 . A A . 22 PRO HG2 1 1 10 8884 1 1 22 PRO HG3 H -7.235 -3.778 -9.493 1.00 . A A . 22 PRO HG3 1 1 10 8885 1 1 22 PRO N N -5.561 -2.105 -7.328 1.00 . A A . 22 PRO N 1 1 10 8886 1 1 22 PRO O O -6.301 0.374 -9.365 1.00 . A A . 22 PRO O 1 1 10 8887 1 1 23 GLY C C -4.309 2.899 -6.723 1.00 . A A . 23 GLY C 1 1 10 8888 1 1 23 GLY CA C -4.999 2.254 -7.924 1.00 . A A . 23 GLY CA 1 1 10 8889 1 1 23 GLY H H -3.983 0.447 -7.351 1.00 . A A . 23 GLY H 1 1 10 8890 1 1 23 GLY HA2 H -4.627 2.695 -8.839 1.00 . A A . 23 GLY HA2 1 1 10 8891 1 1 23 GLY HA3 H -6.063 2.411 -7.850 1.00 . A A . 23 GLY HA3 1 1 10 8892 1 1 23 GLY N N -4.703 0.796 -7.917 1.00 . A A . 23 GLY N 1 1 10 8893 1 1 23 GLY O O -3.721 3.958 -6.823 1.00 . A A . 23 GLY O 1 1 10 8894 1 1 24 ALA C C -2.301 2.247 -4.264 1.00 . A A . 24 ALA C 1 1 10 8895 1 1 24 ALA CA C -3.712 2.823 -4.378 1.00 . A A . 24 ALA CA 1 1 10 8896 1 1 24 ALA CB C -4.522 2.450 -3.135 1.00 . A A . 24 ALA CB 1 1 10 8897 1 1 24 ALA H H -4.844 1.404 -5.534 1.00 . A A . 24 ALA H 1 1 10 8898 1 1 24 ALA HA H -3.656 3.897 -4.466 1.00 . A A . 24 ALA HA 1 1 10 8899 1 1 24 ALA HB1 H -5.558 2.717 -3.288 1.00 . A A . 24 ALA HB1 1 1 10 8900 1 1 24 ALA HB2 H -4.446 1.388 -2.960 1.00 . A A . 24 ALA HB2 1 1 10 8901 1 1 24 ALA HB3 H -4.136 2.986 -2.281 1.00 . A A . 24 ALA HB3 1 1 10 8902 1 1 24 ALA N N -4.370 2.260 -5.588 1.00 . A A . 24 ALA N 1 1 10 8903 1 1 24 ALA O O -1.338 2.968 -4.090 1.00 . A A . 24 ALA O 1 1 10 8904 1 1 25 PHE C C -0.268 0.128 -5.689 1.00 . A A . 25 PHE C 1 1 10 8905 1 1 25 PHE CA C -0.814 0.337 -4.276 1.00 . A A . 25 PHE CA 1 1 10 8906 1 1 25 PHE CB C -0.910 -1.016 -3.568 1.00 . A A . 25 PHE CB 1 1 10 8907 1 1 25 PHE CD1 C 1.350 -0.517 -2.562 1.00 . A A . 25 PHE CD1 1 1 10 8908 1 1 25 PHE CD2 C -0.303 -1.656 -1.204 1.00 . A A . 25 PHE CD2 1 1 10 8909 1 1 25 PHE CE1 C 2.256 -0.566 -1.496 1.00 . A A . 25 PHE CE1 1 1 10 8910 1 1 25 PHE CE2 C 0.605 -1.706 -0.140 1.00 . A A . 25 PHE CE2 1 1 10 8911 1 1 25 PHE CG C 0.069 -1.062 -2.417 1.00 . A A . 25 PHE CG 1 1 10 8912 1 1 25 PHE CZ C 1.886 -1.160 -0.288 1.00 . A A . 25 PHE CZ 1 1 10 8913 1 1 25 PHE H H -2.956 0.387 -4.517 1.00 . A A . 25 PHE H 1 1 10 8914 1 1 25 PHE HA H -0.155 0.993 -3.723 1.00 . A A . 25 PHE HA 1 1 10 8915 1 1 25 PHE HB2 H -1.913 -1.158 -3.196 1.00 . A A . 25 PHE HB2 1 1 10 8916 1 1 25 PHE HB3 H -0.673 -1.803 -4.269 1.00 . A A . 25 PHE HB3 1 1 10 8917 1 1 25 PHE HD1 H 1.639 -0.058 -3.497 1.00 . A A . 25 PHE HD1 1 1 10 8918 1 1 25 PHE HD2 H -1.292 -2.076 -1.091 1.00 . A A . 25 PHE HD2 1 1 10 8919 1 1 25 PHE HE1 H 3.243 -0.148 -1.606 1.00 . A A . 25 PHE HE1 1 1 10 8920 1 1 25 PHE HE2 H 0.318 -2.165 0.795 1.00 . A A . 25 PHE HE2 1 1 10 8921 1 1 25 PHE HZ H 2.587 -1.200 0.529 1.00 . A A . 25 PHE HZ 1 1 10 8922 1 1 25 PHE N N -2.168 0.952 -4.370 1.00 . A A . 25 PHE N 1 1 10 8923 1 1 25 PHE O O -0.979 -0.294 -6.580 1.00 . A A . 25 PHE O 1 1 10 8924 1 1 26 ALA C C 3.059 0.509 -7.236 1.00 . A A . 26 ALA C 1 1 10 8925 1 1 26 ALA CA C 1.558 0.228 -7.270 1.00 . A A . 26 ALA CA 1 1 10 8926 1 1 26 ALA CB C 0.881 1.191 -8.246 1.00 . A A . 26 ALA CB 1 1 10 8927 1 1 26 ALA H H 1.544 0.755 -5.180 1.00 . A A . 26 ALA H 1 1 10 8928 1 1 26 ALA HA H 1.389 -0.789 -7.594 1.00 . A A . 26 ALA HA 1 1 10 8929 1 1 26 ALA HB1 H 0.818 2.172 -7.799 1.00 . A A . 26 ALA HB1 1 1 10 8930 1 1 26 ALA HB2 H 1.460 1.247 -9.156 1.00 . A A . 26 ALA HB2 1 1 10 8931 1 1 26 ALA HB3 H -0.113 0.835 -8.473 1.00 . A A . 26 ALA HB3 1 1 10 8932 1 1 26 ALA N N 0.983 0.416 -5.908 1.00 . A A . 26 ALA N 1 1 10 8933 1 1 26 ALA O O 3.492 1.547 -6.789 1.00 . A A . 26 ALA O 1 1 10 8934 1 1 27 MET C C 5.661 1.057 -8.499 1.00 . A A . 27 MET C 1 1 10 8935 1 1 27 MET CA C 5.330 -0.197 -7.701 1.00 . A A . 27 MET CA 1 1 10 8936 1 1 27 MET CB C 6.026 -1.407 -8.331 1.00 . A A . 27 MET CB 1 1 10 8937 1 1 27 MET CE C 8.150 -4.049 -8.342 1.00 . A A . 27 MET CE 1 1 10 8938 1 1 27 MET CG C 6.175 -2.513 -7.284 1.00 . A A . 27 MET CG 1 1 10 8939 1 1 27 MET H H 3.483 -1.239 -8.062 1.00 . A A . 27 MET H 1 1 10 8940 1 1 27 MET HA H 5.666 -0.071 -6.696 1.00 . A A . 27 MET HA 1 1 10 8941 1 1 27 MET HB2 H 5.435 -1.772 -9.159 1.00 . A A . 27 MET HB2 1 1 10 8942 1 1 27 MET HB3 H 7.003 -1.116 -8.686 1.00 . A A . 27 MET HB3 1 1 10 8943 1 1 27 MET HE1 H 8.563 -3.262 -7.725 1.00 . A A . 27 MET HE1 1 1 10 8944 1 1 27 MET HE2 H 8.584 -4.993 -8.056 1.00 . A A . 27 MET HE2 1 1 10 8945 1 1 27 MET HE3 H 8.373 -3.852 -9.382 1.00 . A A . 27 MET HE3 1 1 10 8946 1 1 27 MET HG2 H 7.049 -2.321 -6.679 1.00 . A A . 27 MET HG2 1 1 10 8947 1 1 27 MET HG3 H 5.299 -2.532 -6.653 1.00 . A A . 27 MET HG3 1 1 10 8948 1 1 27 MET N N 3.855 -0.411 -7.706 1.00 . A A . 27 MET N 1 1 10 8949 1 1 27 MET O O 4.953 1.411 -9.422 1.00 . A A . 27 MET O 1 1 10 8950 1 1 27 MET SD S 6.356 -4.112 -8.114 1.00 . A A . 27 MET SD 1 1 10 8951 1 1 28 ASP C C 8.508 2.850 -9.344 1.00 . A A . 28 ASP C 1 1 10 8952 1 1 28 ASP CA C 7.053 2.955 -8.948 1.00 . A A . 28 ASP CA 1 1 10 8953 1 1 28 ASP CB C 6.853 4.175 -8.059 1.00 . A A . 28 ASP CB 1 1 10 8954 1 1 28 ASP CG C 6.170 5.294 -8.845 1.00 . A A . 28 ASP CG 1 1 10 8955 1 1 28 ASP H H 7.330 1.466 -7.422 1.00 . A A . 28 ASP H 1 1 10 8956 1 1 28 ASP HA H 6.426 3.021 -9.824 1.00 . A A . 28 ASP HA 1 1 10 8957 1 1 28 ASP HB2 H 6.240 3.903 -7.211 1.00 . A A . 28 ASP HB2 1 1 10 8958 1 1 28 ASP HB3 H 7.816 4.509 -7.711 1.00 . A A . 28 ASP HB3 1 1 10 8959 1 1 28 ASP N N 6.729 1.744 -8.173 1.00 . A A . 28 ASP N 1 1 10 8960 1 1 28 ASP O O 9.220 2.063 -8.763 1.00 . A A . 28 ASP O 1 1 10 8961 1 1 28 ASP OD1 O 5.558 4.993 -9.855 1.00 . A A . 28 ASP OD1 1 1 10 8962 1 1 28 ASP OD2 O 6.271 6.434 -8.420 1.00 . A A . 28 ASP OD2 1 1 10 8963 1 1 29 PRO C C 11.097 4.537 -9.800 1.00 . A A . 29 PRO C 1 1 10 8964 1 1 29 PRO CA C 10.305 3.650 -10.751 1.00 . A A . 29 PRO CA 1 1 10 8965 1 1 29 PRO CB C 10.235 4.242 -12.156 1.00 . A A . 29 PRO CB 1 1 10 8966 1 1 29 PRO CD C 8.101 4.637 -11.021 1.00 . A A . 29 PRO CD 1 1 10 8967 1 1 29 PRO CG C 8.983 5.073 -12.177 1.00 . A A . 29 PRO CG 1 1 10 8968 1 1 29 PRO HA H 10.704 2.649 -10.776 1.00 . A A . 29 PRO HA 1 1 10 8969 1 1 29 PRO HB2 H 11.122 4.835 -12.336 1.00 . A A . 29 PRO HB2 1 1 10 8970 1 1 29 PRO HB3 H 10.188 3.443 -12.878 1.00 . A A . 29 PRO HB3 1 1 10 8971 1 1 29 PRO HD2 H 7.877 5.484 -10.390 1.00 . A A . 29 PRO HD2 1 1 10 8972 1 1 29 PRO HD3 H 7.197 4.189 -11.383 1.00 . A A . 29 PRO HD3 1 1 10 8973 1 1 29 PRO HG2 H 9.243 6.117 -12.069 1.00 . A A . 29 PRO HG2 1 1 10 8974 1 1 29 PRO HG3 H 8.462 4.919 -13.109 1.00 . A A . 29 PRO HG3 1 1 10 8975 1 1 29 PRO N N 8.904 3.651 -10.297 1.00 . A A . 29 PRO N 1 1 10 8976 1 1 29 PRO O O 12.307 4.473 -9.714 1.00 . A A . 29 PRO O 1 1 10 8977 1 1 30 GLU C C 11.291 5.371 -6.807 1.00 . A A . 30 GLU C 1 1 10 8978 1 1 30 GLU CA C 11.057 6.216 -8.052 1.00 . A A . 30 GLU CA 1 1 10 8979 1 1 30 GLU CB C 10.150 7.402 -7.712 1.00 . A A . 30 GLU CB 1 1 10 8980 1 1 30 GLU CD C 10.117 9.650 -6.621 1.00 . A A . 30 GLU CD 1 1 10 8981 1 1 30 GLU CG C 11.007 8.593 -7.278 1.00 . A A . 30 GLU CG 1 1 10 8982 1 1 30 GLU H H 9.413 5.340 -9.124 1.00 . A A . 30 GLU H 1 1 10 8983 1 1 30 GLU HA H 12.001 6.569 -8.442 1.00 . A A . 30 GLU HA 1 1 10 8984 1 1 30 GLU HB2 H 9.570 7.672 -8.581 1.00 . A A . 30 GLU HB2 1 1 10 8985 1 1 30 GLU HB3 H 9.486 7.127 -6.906 1.00 . A A . 30 GLU HB3 1 1 10 8986 1 1 30 GLU HG2 H 11.754 8.260 -6.571 1.00 . A A . 30 GLU HG2 1 1 10 8987 1 1 30 GLU HG3 H 11.493 9.021 -8.141 1.00 . A A . 30 GLU HG3 1 1 10 8988 1 1 30 GLU N N 10.392 5.341 -9.050 1.00 . A A . 30 GLU N 1 1 10 8989 1 1 30 GLU O O 12.346 5.398 -6.205 1.00 . A A . 30 GLU O 1 1 10 8990 1 1 30 GLU OE1 O 9.478 10.392 -7.348 1.00 . A A . 30 GLU OE1 1 1 10 8991 1 1 30 GLU OE2 O 10.090 9.697 -5.402 1.00 . A A . 30 GLU OE2 1 1 10 8992 1 1 31 ILE C C 10.746 2.284 -5.748 1.00 . A A . 31 ILE C 1 1 10 8993 1 1 31 ILE CA C 10.471 3.697 -5.266 1.00 . A A . 31 ILE CA 1 1 10 8994 1 1 31 ILE CB C 9.213 3.706 -4.388 1.00 . A A . 31 ILE CB 1 1 10 8995 1 1 31 ILE CD1 C 8.014 5.627 -5.462 1.00 . A A . 31 ILE CD1 1 1 10 8996 1 1 31 ILE CG1 C 7.995 4.114 -5.218 1.00 . A A . 31 ILE CG1 1 1 10 8997 1 1 31 ILE CG2 C 9.405 4.693 -3.234 1.00 . A A . 31 ILE CG2 1 1 10 8998 1 1 31 ILE H H 9.485 4.565 -6.964 1.00 . A A . 31 ILE H 1 1 10 8999 1 1 31 ILE HA H 11.295 4.023 -4.696 1.00 . A A . 31 ILE HA 1 1 10 9000 1 1 31 ILE HB H 9.058 2.715 -3.986 1.00 . A A . 31 ILE HB 1 1 10 9001 1 1 31 ILE HD11 H 9.019 5.999 -5.335 1.00 . A A . 31 ILE HD11 1 1 10 9002 1 1 31 ILE HD12 H 7.676 5.837 -6.464 1.00 . A A . 31 ILE HD12 1 1 10 9003 1 1 31 ILE HD13 H 7.358 6.112 -4.754 1.00 . A A . 31 ILE HD13 1 1 10 9004 1 1 31 ILE HG12 H 8.020 3.592 -6.159 1.00 . A A . 31 ILE HG12 1 1 10 9005 1 1 31 ILE HG13 H 7.094 3.849 -4.684 1.00 . A A . 31 ILE HG13 1 1 10 9006 1 1 31 ILE HG21 H 9.591 5.679 -3.630 1.00 . A A . 31 ILE HG21 1 1 10 9007 1 1 31 ILE HG22 H 8.512 4.711 -2.626 1.00 . A A . 31 ILE HG22 1 1 10 9008 1 1 31 ILE HG23 H 10.245 4.382 -2.630 1.00 . A A . 31 ILE HG23 1 1 10 9009 1 1 31 ILE N N 10.312 4.586 -6.443 1.00 . A A . 31 ILE N 1 1 10 9010 1 1 31 ILE O O 10.900 1.377 -4.953 1.00 . A A . 31 ILE O 1 1 10 9011 1 1 32 GLU C C 10.357 -0.280 -6.706 1.00 . A A . 32 GLU C 1 1 10 9012 1 1 32 GLU CA C 11.045 0.727 -7.608 1.00 . A A . 32 GLU CA 1 1 10 9013 1 1 32 GLU CB C 12.548 0.441 -7.657 1.00 . A A . 32 GLU CB 1 1 10 9014 1 1 32 GLU CD C 13.727 0.694 -9.845 1.00 . A A . 32 GLU CD 1 1 10 9015 1 1 32 GLU CG C 13.229 1.432 -8.602 1.00 . A A . 32 GLU CG 1 1 10 9016 1 1 32 GLU H H 10.665 2.842 -7.658 1.00 . A A . 32 GLU H 1 1 10 9017 1 1 32 GLU HA H 10.623 0.669 -8.599 1.00 . A A . 32 GLU HA 1 1 10 9018 1 1 32 GLU HB2 H 12.965 0.542 -6.666 1.00 . A A . 32 GLU HB2 1 1 10 9019 1 1 32 GLU HB3 H 12.711 -0.564 -8.016 1.00 . A A . 32 GLU HB3 1 1 10 9020 1 1 32 GLU HG2 H 12.523 2.196 -8.894 1.00 . A A . 32 GLU HG2 1 1 10 9021 1 1 32 GLU HG3 H 14.068 1.891 -8.098 1.00 . A A . 32 GLU HG3 1 1 10 9022 1 1 32 GLU N N 10.801 2.089 -7.048 1.00 . A A . 32 GLU N 1 1 10 9023 1 1 32 GLU O O 10.840 -1.370 -6.480 1.00 . A A . 32 GLU O 1 1 10 9024 1 1 32 GLU OE1 O 12.919 0.041 -10.486 1.00 . A A . 32 GLU OE1 1 1 10 9025 1 1 32 GLU OE2 O 14.907 0.791 -10.136 1.00 . A A . 32 GLU OE2 1 1 10 9026 1 1 33 LYS C C 7.072 -0.333 -5.037 1.00 . A A . 33 LYS C 1 1 10 9027 1 1 33 LYS CA C 8.513 -0.802 -5.222 1.00 . A A . 33 LYS CA 1 1 10 9028 1 1 33 LYS CB C 9.212 -0.791 -3.858 1.00 . A A . 33 LYS CB 1 1 10 9029 1 1 33 LYS CD C 11.115 -1.759 -2.558 1.00 . A A . 33 LYS CD 1 1 10 9030 1 1 33 LYS CE C 12.434 -2.527 -2.662 1.00 . A A . 33 LYS CE 1 1 10 9031 1 1 33 LYS CG C 10.572 -1.483 -3.962 1.00 . A A . 33 LYS CG 1 1 10 9032 1 1 33 LYS H H 8.883 1.020 -6.369 1.00 . A A . 33 LYS H 1 1 10 9033 1 1 33 LYS HA H 8.516 -1.807 -5.616 1.00 . A A . 33 LYS HA 1 1 10 9034 1 1 33 LYS HB2 H 9.353 0.231 -3.536 1.00 . A A . 33 LYS HB2 1 1 10 9035 1 1 33 LYS HB3 H 8.601 -1.312 -3.137 1.00 . A A . 33 LYS HB3 1 1 10 9036 1 1 33 LYS HD2 H 11.285 -0.822 -2.047 1.00 . A A . 33 LYS HD2 1 1 10 9037 1 1 33 LYS HD3 H 10.401 -2.347 -2.004 1.00 . A A . 33 LYS HD3 1 1 10 9038 1 1 33 LYS HE2 H 12.761 -2.817 -1.674 1.00 . A A . 33 LYS HE2 1 1 10 9039 1 1 33 LYS HE3 H 12.290 -3.410 -3.267 1.00 . A A . 33 LYS HE3 1 1 10 9040 1 1 33 LYS HG2 H 10.462 -2.416 -4.497 1.00 . A A . 33 LYS HG2 1 1 10 9041 1 1 33 LYS HG3 H 11.261 -0.844 -4.492 1.00 . A A . 33 LYS HG3 1 1 10 9042 1 1 33 LYS HZ1 H 13.135 -1.345 -4.225 1.00 . A A . 33 LYS HZ1 1 1 10 9043 1 1 33 LYS HZ2 H 13.634 -0.827 -2.689 1.00 . A A . 33 LYS HZ2 1 1 10 9044 1 1 33 LYS HZ3 H 14.353 -2.194 -3.397 1.00 . A A . 33 LYS HZ3 1 1 10 9045 1 1 33 LYS N N 9.237 0.111 -6.165 1.00 . A A . 33 LYS N 1 1 10 9046 1 1 33 LYS NZ N 13.468 -1.657 -3.290 1.00 . A A . 33 LYS NZ 1 1 10 9047 1 1 33 LYS O O 6.769 0.838 -5.149 1.00 . A A . 33 LYS O 1 1 10 9048 1 1 34 ALA C C 4.610 0.140 -3.431 1.00 . A A . 34 ALA C 1 1 10 9049 1 1 34 ALA CA C 4.747 -0.867 -4.574 1.00 . A A . 34 ALA CA 1 1 10 9050 1 1 34 ALA CB C 3.935 -2.120 -4.238 1.00 . A A . 34 ALA CB 1 1 10 9051 1 1 34 ALA H H 6.450 -2.183 -4.681 1.00 . A A . 34 ALA H 1 1 10 9052 1 1 34 ALA HA H 4.366 -0.430 -5.483 1.00 . A A . 34 ALA HA 1 1 10 9053 1 1 34 ALA HB1 H 4.025 -2.834 -5.043 1.00 . A A . 34 ALA HB1 1 1 10 9054 1 1 34 ALA HB2 H 4.308 -2.558 -3.324 1.00 . A A . 34 ALA HB2 1 1 10 9055 1 1 34 ALA HB3 H 2.896 -1.852 -4.109 1.00 . A A . 34 ALA HB3 1 1 10 9056 1 1 34 ALA N N 6.179 -1.244 -4.760 1.00 . A A . 34 ALA N 1 1 10 9057 1 1 34 ALA O O 5.248 0.023 -2.405 1.00 . A A . 34 ALA O 1 1 10 9058 1 1 35 TYR C C 2.144 2.719 -2.664 1.00 . A A . 35 TYR C 1 1 10 9059 1 1 35 TYR CA C 3.552 2.133 -2.516 1.00 . A A . 35 TYR CA 1 1 10 9060 1 1 35 TYR CB C 4.597 3.251 -2.642 1.00 . A A . 35 TYR CB 1 1 10 9061 1 1 35 TYR CD1 C 4.152 3.545 -5.096 1.00 . A A . 35 TYR CD1 1 1 10 9062 1 1 35 TYR CD2 C 4.053 5.492 -3.661 1.00 . A A . 35 TYR CD2 1 1 10 9063 1 1 35 TYR CE1 C 3.825 4.339 -6.201 1.00 . A A . 35 TYR CE1 1 1 10 9064 1 1 35 TYR CE2 C 3.731 6.289 -4.765 1.00 . A A . 35 TYR CE2 1 1 10 9065 1 1 35 TYR CG C 4.263 4.120 -3.830 1.00 . A A . 35 TYR CG 1 1 10 9066 1 1 35 TYR CZ C 3.614 5.713 -6.036 1.00 . A A . 35 TYR CZ 1 1 10 9067 1 1 35 TYR H H 3.245 1.183 -4.427 1.00 . A A . 35 TYR H 1 1 10 9068 1 1 35 TYR HA H 3.645 1.659 -1.551 1.00 . A A . 35 TYR HA 1 1 10 9069 1 1 35 TYR HB2 H 4.594 3.851 -1.744 1.00 . A A . 35 TYR HB2 1 1 10 9070 1 1 35 TYR HB3 H 5.575 2.816 -2.780 1.00 . A A . 35 TYR HB3 1 1 10 9071 1 1 35 TYR HD1 H 4.320 2.488 -5.219 1.00 . A A . 35 TYR HD1 1 1 10 9072 1 1 35 TYR HD2 H 4.144 5.937 -2.681 1.00 . A A . 35 TYR HD2 1 1 10 9073 1 1 35 TYR HE1 H 3.738 3.893 -7.182 1.00 . A A . 35 TYR HE1 1 1 10 9074 1 1 35 TYR HE2 H 3.569 7.349 -4.637 1.00 . A A . 35 TYR HE2 1 1 10 9075 1 1 35 TYR HH H 2.793 7.256 -6.804 1.00 . A A . 35 TYR HH 1 1 10 9076 1 1 35 TYR N N 3.760 1.121 -3.596 1.00 . A A . 35 TYR N 1 1 10 9077 1 1 35 TYR O O 1.572 2.699 -3.736 1.00 . A A . 35 TYR O 1 1 10 9078 1 1 35 TYR OH O 3.290 6.499 -7.124 1.00 . A A . 35 TYR OH 1 1 10 9079 1 1 36 VAL C C 0.256 5.059 -2.607 1.00 . A A . 36 VAL C 1 1 10 9080 1 1 36 VAL CA C 0.199 3.813 -1.721 1.00 . A A . 36 VAL CA 1 1 10 9081 1 1 36 VAL CB C -0.337 4.180 -0.333 1.00 . A A . 36 VAL CB 1 1 10 9082 1 1 36 VAL CG1 C 0.526 5.278 0.290 1.00 . A A . 36 VAL CG1 1 1 10 9083 1 1 36 VAL CG2 C -1.775 4.685 -0.463 1.00 . A A . 36 VAL CG2 1 1 10 9084 1 1 36 VAL H H 2.041 3.244 -0.746 1.00 . A A . 36 VAL H 1 1 10 9085 1 1 36 VAL HA H -0.456 3.083 -2.177 1.00 . A A . 36 VAL HA 1 1 10 9086 1 1 36 VAL HB H -0.318 3.306 0.301 1.00 . A A . 36 VAL HB 1 1 10 9087 1 1 36 VAL HG11 H 1.162 5.709 -0.466 1.00 . A A . 36 VAL HG11 1 1 10 9088 1 1 36 VAL HG12 H -0.115 6.044 0.703 1.00 . A A . 36 VAL HG12 1 1 10 9089 1 1 36 VAL HG13 H 1.133 4.855 1.074 1.00 . A A . 36 VAL HG13 1 1 10 9090 1 1 36 VAL HG21 H -2.348 3.991 -1.060 1.00 . A A . 36 VAL HG21 1 1 10 9091 1 1 36 VAL HG22 H -2.219 4.765 0.519 1.00 . A A . 36 VAL HG22 1 1 10 9092 1 1 36 VAL HG23 H -1.776 5.654 -0.938 1.00 . A A . 36 VAL HG23 1 1 10 9093 1 1 36 VAL N N 1.572 3.237 -1.606 1.00 . A A . 36 VAL N 1 1 10 9094 1 1 36 VAL O O 0.048 6.169 -2.159 1.00 . A A . 36 VAL O 1 1 10 9095 1 1 37 LYS C C -0.623 6.895 -4.692 1.00 . A A . 37 LYS C 1 1 10 9096 1 1 37 LYS CA C 0.625 6.028 -4.803 1.00 . A A . 37 LYS CA 1 1 10 9097 1 1 37 LYS CB C 0.753 5.502 -6.236 1.00 . A A . 37 LYS CB 1 1 10 9098 1 1 37 LYS CD C -0.937 5.396 -8.071 1.00 . A A . 37 LYS CD 1 1 10 9099 1 1 37 LYS CE C -1.605 4.280 -8.875 1.00 . A A . 37 LYS CE 1 1 10 9100 1 1 37 LYS CG C -0.571 4.874 -6.682 1.00 . A A . 37 LYS CG 1 1 10 9101 1 1 37 LYS H H 0.705 3.966 -4.196 1.00 . A A . 37 LYS H 1 1 10 9102 1 1 37 LYS HA H 1.488 6.623 -4.561 1.00 . A A . 37 LYS HA 1 1 10 9103 1 1 37 LYS HB2 H 1.006 6.317 -6.897 1.00 . A A . 37 LYS HB2 1 1 10 9104 1 1 37 LYS HB3 H 1.529 4.753 -6.275 1.00 . A A . 37 LYS HB3 1 1 10 9105 1 1 37 LYS HD2 H -1.618 6.229 -7.975 1.00 . A A . 37 LYS HD2 1 1 10 9106 1 1 37 LYS HD3 H -0.042 5.718 -8.582 1.00 . A A . 37 LYS HD3 1 1 10 9107 1 1 37 LYS HE2 H -0.876 3.814 -9.521 1.00 . A A . 37 LYS HE2 1 1 10 9108 1 1 37 LYS HE3 H -2.009 3.540 -8.198 1.00 . A A . 37 LYS HE3 1 1 10 9109 1 1 37 LYS HG2 H -0.463 3.799 -6.718 1.00 . A A . 37 LYS HG2 1 1 10 9110 1 1 37 LYS HG3 H -1.352 5.133 -5.985 1.00 . A A . 37 LYS HG3 1 1 10 9111 1 1 37 LYS HZ1 H -2.471 5.831 -9.958 1.00 . A A . 37 LYS HZ1 1 1 10 9112 1 1 37 LYS HZ2 H -2.826 4.286 -10.561 1.00 . A A . 37 LYS HZ2 1 1 10 9113 1 1 37 LYS HZ3 H -3.590 4.843 -9.149 1.00 . A A . 37 LYS HZ3 1 1 10 9114 1 1 37 LYS N N 0.540 4.874 -3.866 1.00 . A A . 37 LYS N 1 1 10 9115 1 1 37 LYS NZ N -2.707 4.853 -9.698 1.00 . A A . 37 LYS NZ 1 1 10 9116 1 1 37 LYS O O -0.633 8.037 -5.107 1.00 . A A . 37 LYS O 1 1 10 9117 1 1 38 ASP C C -3.915 6.478 -3.119 1.00 . A A . 38 ASP C 1 1 10 9118 1 1 38 ASP CA C -2.921 7.176 -4.051 1.00 . A A . 38 ASP CA 1 1 10 9119 1 1 38 ASP CB C -3.514 7.314 -5.452 1.00 . A A . 38 ASP CB 1 1 10 9120 1 1 38 ASP CG C -4.899 7.958 -5.369 1.00 . A A . 38 ASP CG 1 1 10 9121 1 1 38 ASP H H -1.670 5.441 -3.839 1.00 . A A . 38 ASP H 1 1 10 9122 1 1 38 ASP HA H -2.685 8.154 -3.662 1.00 . A A . 38 ASP HA 1 1 10 9123 1 1 38 ASP HB2 H -2.860 7.930 -6.054 1.00 . A A . 38 ASP HB2 1 1 10 9124 1 1 38 ASP HB3 H -3.595 6.336 -5.902 1.00 . A A . 38 ASP HB3 1 1 10 9125 1 1 38 ASP N N -1.684 6.368 -4.156 1.00 . A A . 38 ASP N 1 1 10 9126 1 1 38 ASP O O -4.552 5.511 -3.485 1.00 . A A . 38 ASP O 1 1 10 9127 1 1 38 ASP OD1 O -5.026 8.958 -4.682 1.00 . A A . 38 ASP OD1 1 1 10 9128 1 1 38 ASP OD2 O -5.810 7.439 -5.993 1.00 . A A . 38 ASP OD2 1 1 10 9129 1 1 39 VAL C C -6.391 6.259 -1.560 1.00 . A A . 39 VAL C 1 1 10 9130 1 1 39 VAL CA C -4.985 6.320 -0.950 1.00 . A A . 39 VAL CA 1 1 10 9131 1 1 39 VAL CB C -5.011 7.129 0.355 1.00 . A A . 39 VAL CB 1 1 10 9132 1 1 39 VAL CG1 C -3.596 7.602 0.691 1.00 . A A . 39 VAL CG1 1 1 10 9133 1 1 39 VAL CG2 C -5.926 8.348 0.200 1.00 . A A . 39 VAL CG2 1 1 10 9134 1 1 39 VAL H H -3.514 7.737 -1.639 1.00 . A A . 39 VAL H 1 1 10 9135 1 1 39 VAL HA H -4.646 5.317 -0.739 1.00 . A A . 39 VAL HA 1 1 10 9136 1 1 39 VAL HB H -5.374 6.501 1.156 1.00 . A A . 39 VAL HB 1 1 10 9137 1 1 39 VAL HG11 H -2.891 6.816 0.468 1.00 . A A . 39 VAL HG11 1 1 10 9138 1 1 39 VAL HG12 H -3.359 8.476 0.103 1.00 . A A . 39 VAL HG12 1 1 10 9139 1 1 39 VAL HG13 H -3.540 7.849 1.741 1.00 . A A . 39 VAL HG13 1 1 10 9140 1 1 39 VAL HG21 H -6.150 8.501 -0.846 1.00 . A A . 39 VAL HG21 1 1 10 9141 1 1 39 VAL HG22 H -6.845 8.180 0.743 1.00 . A A . 39 VAL HG22 1 1 10 9142 1 1 39 VAL HG23 H -5.430 9.223 0.593 1.00 . A A . 39 VAL HG23 1 1 10 9143 1 1 39 VAL N N -4.043 6.959 -1.913 1.00 . A A . 39 VAL N 1 1 10 9144 1 1 39 VAL O O -7.200 5.431 -1.190 1.00 . A A . 39 VAL O 1 1 10 9145 1 1 40 GLU C C -8.032 6.207 -4.347 1.00 . A A . 40 GLU C 1 1 10 9146 1 1 40 GLU CA C -8.045 7.111 -3.112 1.00 . A A . 40 GLU CA 1 1 10 9147 1 1 40 GLU CB C -8.434 8.531 -3.529 1.00 . A A . 40 GLU CB 1 1 10 9148 1 1 40 GLU CD C -10.143 8.845 -1.733 1.00 . A A . 40 GLU CD 1 1 10 9149 1 1 40 GLU CG C -8.806 9.344 -2.288 1.00 . A A . 40 GLU CG 1 1 10 9150 1 1 40 GLU H H -6.025 7.789 -2.774 1.00 . A A . 40 GLU H 1 1 10 9151 1 1 40 GLU HA H -8.763 6.735 -2.399 1.00 . A A . 40 GLU HA 1 1 10 9152 1 1 40 GLU HB2 H -7.602 9.000 -4.032 1.00 . A A . 40 GLU HB2 1 1 10 9153 1 1 40 GLU HB3 H -9.282 8.489 -4.196 1.00 . A A . 40 GLU HB3 1 1 10 9154 1 1 40 GLU HG2 H -8.038 9.228 -1.537 1.00 . A A . 40 GLU HG2 1 1 10 9155 1 1 40 GLU HG3 H -8.897 10.386 -2.554 1.00 . A A . 40 GLU HG3 1 1 10 9156 1 1 40 GLU N N -6.689 7.127 -2.489 1.00 . A A . 40 GLU N 1 1 10 9157 1 1 40 GLU O O -9.035 6.033 -5.010 1.00 . A A . 40 GLU O 1 1 10 9158 1 1 40 GLU OE1 O -11.000 8.498 -2.529 1.00 . A A . 40 GLU OE1 1 1 10 9159 1 1 40 GLU OE2 O -10.287 8.821 -0.521 1.00 . A A . 40 GLU OE2 1 1 10 9160 1 1 41 GLY C C -7.483 3.391 -5.535 1.00 . A A . 41 GLY C 1 1 10 9161 1 1 41 GLY CA C -6.837 4.740 -5.858 1.00 . A A . 41 GLY CA 1 1 10 9162 1 1 41 GLY H H -6.105 5.780 -4.119 1.00 . A A . 41 GLY H 1 1 10 9163 1 1 41 GLY HA2 H -7.364 5.203 -6.681 1.00 . A A . 41 GLY HA2 1 1 10 9164 1 1 41 GLY HA3 H -5.806 4.585 -6.133 1.00 . A A . 41 GLY HA3 1 1 10 9165 1 1 41 GLY N N -6.906 5.628 -4.664 1.00 . A A . 41 GLY N 1 1 10 9166 1 1 41 GLY O O -7.805 2.619 -6.417 1.00 . A A . 41 GLY O 1 1 10 9167 1 1 42 ALA C C -9.244 2.018 -2.713 1.00 . A A . 42 ALA C 1 1 10 9168 1 1 42 ALA CA C -8.306 1.802 -3.902 1.00 . A A . 42 ALA CA 1 1 10 9169 1 1 42 ALA CB C -7.218 0.796 -3.517 1.00 . A A . 42 ALA CB 1 1 10 9170 1 1 42 ALA H H -7.414 3.736 -3.580 1.00 . A A . 42 ALA H 1 1 10 9171 1 1 42 ALA HA H -8.871 1.419 -4.740 1.00 . A A . 42 ALA HA 1 1 10 9172 1 1 42 ALA HB1 H -6.571 1.233 -2.772 1.00 . A A . 42 ALA HB1 1 1 10 9173 1 1 42 ALA HB2 H -7.679 -0.096 -3.117 1.00 . A A . 42 ALA HB2 1 1 10 9174 1 1 42 ALA HB3 H -6.640 0.541 -4.393 1.00 . A A . 42 ALA HB3 1 1 10 9175 1 1 42 ALA N N -7.678 3.100 -4.277 1.00 . A A . 42 ALA N 1 1 10 9176 1 1 42 ALA O O -9.155 3.008 -2.012 1.00 . A A . 42 ALA O 1 1 10 9177 1 1 43 SER C C -10.438 0.711 -0.061 1.00 . A A . 43 SER C 1 1 10 9178 1 1 43 SER CA C -11.083 1.259 -1.337 1.00 . A A . 43 SER CA 1 1 10 9179 1 1 43 SER CB C -12.369 0.484 -1.629 1.00 . A A . 43 SER CB 1 1 10 9180 1 1 43 SER H H -10.199 0.312 -3.055 1.00 . A A . 43 SER H 1 1 10 9181 1 1 43 SER HA H -11.316 2.305 -1.202 1.00 . A A . 43 SER HA 1 1 10 9182 1 1 43 SER HB2 H -12.551 -0.226 -0.839 1.00 . A A . 43 SER HB2 1 1 10 9183 1 1 43 SER HB3 H -13.198 1.175 -1.686 1.00 . A A . 43 SER HB3 1 1 10 9184 1 1 43 SER HG H -12.531 0.365 -3.565 1.00 . A A . 43 SER HG 1 1 10 9185 1 1 43 SER N N -10.141 1.102 -2.479 1.00 . A A . 43 SER N 1 1 10 9186 1 1 43 SER O O -9.366 0.133 -0.091 1.00 . A A . 43 SER O 1 1 10 9187 1 1 43 SER OG O -12.227 -0.213 -2.861 1.00 . A A . 43 SER OG 1 1 10 9188 1 1 44 GLN C C -10.571 -1.155 2.338 1.00 . A A . 44 GLN C 1 1 10 9189 1 1 44 GLN CA C -10.515 0.373 2.337 1.00 . A A . 44 GLN CA 1 1 10 9190 1 1 44 GLN CB C -11.322 0.915 3.518 1.00 . A A . 44 GLN CB 1 1 10 9191 1 1 44 GLN CD C -11.415 3.093 4.743 1.00 . A A . 44 GLN CD 1 1 10 9192 1 1 44 GLN CG C -10.497 1.969 4.260 1.00 . A A . 44 GLN CG 1 1 10 9193 1 1 44 GLN H H -11.948 1.350 1.061 1.00 . A A . 44 GLN H 1 1 10 9194 1 1 44 GLN HA H -9.487 0.694 2.424 1.00 . A A . 44 GLN HA 1 1 10 9195 1 1 44 GLN HB2 H -12.236 1.361 3.155 1.00 . A A . 44 GLN HB2 1 1 10 9196 1 1 44 GLN HB3 H -11.559 0.107 4.194 1.00 . A A . 44 GLN HB3 1 1 10 9197 1 1 44 GLN HE21 H -12.481 1.908 5.926 1.00 . A A . 44 GLN HE21 1 1 10 9198 1 1 44 GLN HE22 H -12.958 3.537 5.912 1.00 . A A . 44 GLN HE22 1 1 10 9199 1 1 44 GLN HG2 H -10.009 1.512 5.110 1.00 . A A . 44 GLN HG2 1 1 10 9200 1 1 44 GLN HG3 H -9.752 2.377 3.594 1.00 . A A . 44 GLN HG3 1 1 10 9201 1 1 44 GLN N N -11.086 0.884 1.060 1.00 . A A . 44 GLN N 1 1 10 9202 1 1 44 GLN NE2 N -12.363 2.824 5.597 1.00 . A A . 44 GLN NE2 1 1 10 9203 1 1 44 GLN O O -9.665 -1.816 2.798 1.00 . A A . 44 GLN O 1 1 10 9204 1 1 44 GLN OE1 O -11.268 4.230 4.337 1.00 . A A . 44 GLN OE1 1 1 10 9205 1 1 45 GLU C C -10.661 -3.757 0.838 1.00 . A A . 45 GLU C 1 1 10 9206 1 1 45 GLU CA C -11.727 -3.210 1.787 1.00 . A A . 45 GLU CA 1 1 10 9207 1 1 45 GLU CB C -13.117 -3.622 1.294 1.00 . A A . 45 GLU CB 1 1 10 9208 1 1 45 GLU CD C -14.392 -4.091 3.392 1.00 . A A . 45 GLU CD 1 1 10 9209 1 1 45 GLU CG C -14.181 -3.087 2.257 1.00 . A A . 45 GLU CG 1 1 10 9210 1 1 45 GLU H H -12.348 -1.173 1.446 1.00 . A A . 45 GLU H 1 1 10 9211 1 1 45 GLU HA H -11.564 -3.604 2.780 1.00 . A A . 45 GLU HA 1 1 10 9212 1 1 45 GLU HB2 H -13.286 -3.212 0.308 1.00 . A A . 45 GLU HB2 1 1 10 9213 1 1 45 GLU HB3 H -13.180 -4.698 1.253 1.00 . A A . 45 GLU HB3 1 1 10 9214 1 1 45 GLU HG2 H -13.852 -2.143 2.667 1.00 . A A . 45 GLU HG2 1 1 10 9215 1 1 45 GLU HG3 H -15.109 -2.946 1.726 1.00 . A A . 45 GLU HG3 1 1 10 9216 1 1 45 GLU N N -11.627 -1.724 1.819 1.00 . A A . 45 GLU N 1 1 10 9217 1 1 45 GLU O O -10.242 -4.896 0.937 1.00 . A A . 45 GLU O 1 1 10 9218 1 1 45 GLU OE1 O -13.738 -5.121 3.375 1.00 . A A . 45 GLU OE1 1 1 10 9219 1 1 45 GLU OE2 O -15.205 -3.814 4.259 1.00 . A A . 45 GLU OE2 1 1 10 9220 1 1 46 GLU C C -7.810 -3.058 -0.357 1.00 . A A . 46 GLU C 1 1 10 9221 1 1 46 GLU CA C -9.136 -3.378 -1.007 1.00 . A A . 46 GLU CA 1 1 10 9222 1 1 46 GLU CB C -9.259 -2.599 -2.315 1.00 . A A . 46 GLU CB 1 1 10 9223 1 1 46 GLU CD C -10.740 -2.207 -4.287 1.00 . A A . 46 GLU CD 1 1 10 9224 1 1 46 GLU CG C -10.685 -2.723 -2.848 1.00 . A A . 46 GLU CG 1 1 10 9225 1 1 46 GLU H H -10.522 -2.013 -0.098 1.00 . A A . 46 GLU H 1 1 10 9226 1 1 46 GLU HA H -9.216 -4.440 -1.192 1.00 . A A . 46 GLU HA 1 1 10 9227 1 1 46 GLU HB2 H -9.030 -1.559 -2.135 1.00 . A A . 46 GLU HB2 1 1 10 9228 1 1 46 GLU HB3 H -8.567 -2.999 -3.036 1.00 . A A . 46 GLU HB3 1 1 10 9229 1 1 46 GLU HG2 H -10.992 -3.759 -2.823 1.00 . A A . 46 GLU HG2 1 1 10 9230 1 1 46 GLU HG3 H -11.348 -2.135 -2.232 1.00 . A A . 46 GLU HG3 1 1 10 9231 1 1 46 GLU N N -10.195 -2.937 -0.063 1.00 . A A . 46 GLU N 1 1 10 9232 1 1 46 GLU O O -6.885 -3.843 -0.345 1.00 . A A . 46 GLU O 1 1 10 9233 1 1 46 GLU OE1 O -9.687 -2.076 -4.889 1.00 . A A . 46 GLU OE1 1 1 10 9234 1 1 46 GLU OE2 O -11.834 -1.954 -4.765 1.00 . A A . 46 GLU OE2 1 1 10 9235 1 1 47 VAL C C -6.222 -2.518 2.014 1.00 . A A . 47 VAL C 1 1 10 9236 1 1 47 VAL CA C -6.508 -1.485 0.918 1.00 . A A . 47 VAL CA 1 1 10 9237 1 1 47 VAL CB C -6.735 -0.102 1.534 1.00 . A A . 47 VAL CB 1 1 10 9238 1 1 47 VAL CG1 C -5.764 0.118 2.689 1.00 . A A . 47 VAL CG1 1 1 10 9239 1 1 47 VAL CG2 C -6.510 0.972 0.468 1.00 . A A . 47 VAL CG2 1 1 10 9240 1 1 47 VAL H H -8.516 -1.314 0.199 1.00 . A A . 47 VAL H 1 1 10 9241 1 1 47 VAL HA H -5.683 -1.448 0.222 1.00 . A A . 47 VAL HA 1 1 10 9242 1 1 47 VAL HB H -7.750 -0.036 1.902 1.00 . A A . 47 VAL HB 1 1 10 9243 1 1 47 VAL HG11 H -4.833 -0.384 2.473 1.00 . A A . 47 VAL HG11 1 1 10 9244 1 1 47 VAL HG12 H -5.588 1.175 2.811 1.00 . A A . 47 VAL HG12 1 1 10 9245 1 1 47 VAL HG13 H -6.191 -0.285 3.595 1.00 . A A . 47 VAL HG13 1 1 10 9246 1 1 47 VAL HG21 H -6.790 0.584 -0.500 1.00 . A A . 47 VAL HG21 1 1 10 9247 1 1 47 VAL HG22 H -7.114 1.838 0.697 1.00 . A A . 47 VAL HG22 1 1 10 9248 1 1 47 VAL HG23 H -5.468 1.255 0.455 1.00 . A A . 47 VAL HG23 1 1 10 9249 1 1 47 VAL N N -7.742 -1.899 0.215 1.00 . A A . 47 VAL N 1 1 10 9250 1 1 47 VAL O O -5.090 -2.873 2.272 1.00 . A A . 47 VAL O 1 1 10 9251 1 1 48 GLU C C -6.655 -5.332 3.106 1.00 . A A . 48 GLU C 1 1 10 9252 1 1 48 GLU CA C -7.091 -4.000 3.717 1.00 . A A . 48 GLU CA 1 1 10 9253 1 1 48 GLU CB C -8.448 -4.157 4.379 1.00 . A A . 48 GLU CB 1 1 10 9254 1 1 48 GLU CD C -9.154 -4.699 6.708 1.00 . A A . 48 GLU CD 1 1 10 9255 1 1 48 GLU CG C -8.354 -3.731 5.835 1.00 . A A . 48 GLU CG 1 1 10 9256 1 1 48 GLU H H -8.157 -2.710 2.436 1.00 . A A . 48 GLU H 1 1 10 9257 1 1 48 GLU HA H -6.365 -3.664 4.441 1.00 . A A . 48 GLU HA 1 1 10 9258 1 1 48 GLU HB2 H -9.164 -3.531 3.868 1.00 . A A . 48 GLU HB2 1 1 10 9259 1 1 48 GLU HB3 H -8.758 -5.174 4.311 1.00 . A A . 48 GLU HB3 1 1 10 9260 1 1 48 GLU HG2 H -7.320 -3.732 6.141 1.00 . A A . 48 GLU HG2 1 1 10 9261 1 1 48 GLU HG3 H -8.758 -2.736 5.935 1.00 . A A . 48 GLU HG3 1 1 10 9262 1 1 48 GLU N N -7.254 -3.002 2.655 1.00 . A A . 48 GLU N 1 1 10 9263 1 1 48 GLU O O -5.559 -5.803 3.336 1.00 . A A . 48 GLU O 1 1 10 9264 1 1 48 GLU OE1 O -10.121 -5.253 6.213 1.00 . A A . 48 GLU OE1 1 1 10 9265 1 1 48 GLU OE2 O -8.786 -4.869 7.859 1.00 . A A . 48 GLU OE2 1 1 10 9266 1 1 49 GLU C C -5.736 -7.119 1.085 1.00 . A A . 49 GLU C 1 1 10 9267 1 1 49 GLU CA C -7.133 -7.243 1.699 1.00 . A A . 49 GLU CA 1 1 10 9268 1 1 49 GLU CB C -8.149 -7.596 0.610 1.00 . A A . 49 GLU CB 1 1 10 9269 1 1 49 GLU CD C -10.646 -7.646 0.488 1.00 . A A . 49 GLU CD 1 1 10 9270 1 1 49 GLU CG C -9.423 -8.141 1.260 1.00 . A A . 49 GLU CG 1 1 10 9271 1 1 49 GLU H H -8.385 -5.548 2.149 1.00 . A A . 49 GLU H 1 1 10 9272 1 1 49 GLU HA H -7.127 -8.016 2.452 1.00 . A A . 49 GLU HA 1 1 10 9273 1 1 49 GLU HB2 H -8.385 -6.712 0.037 1.00 . A A . 49 GLU HB2 1 1 10 9274 1 1 49 GLU HB3 H -7.731 -8.348 -0.043 1.00 . A A . 49 GLU HB3 1 1 10 9275 1 1 49 GLU HG2 H -9.400 -9.221 1.246 1.00 . A A . 49 GLU HG2 1 1 10 9276 1 1 49 GLU HG3 H -9.481 -7.796 2.281 1.00 . A A . 49 GLU HG3 1 1 10 9277 1 1 49 GLU N N -7.506 -5.944 2.325 1.00 . A A . 49 GLU N 1 1 10 9278 1 1 49 GLU O O -4.909 -8.002 1.210 1.00 . A A . 49 GLU O 1 1 10 9279 1 1 49 GLU OE1 O -10.475 -7.206 -0.637 1.00 . A A . 49 GLU OE1 1 1 10 9280 1 1 49 GLU OE2 O -11.735 -7.717 1.033 1.00 . A A . 49 GLU OE2 1 1 10 9281 1 1 50 ALA C C -3.081 -5.669 0.929 1.00 . A A . 50 ALA C 1 1 10 9282 1 1 50 ALA CA C -4.121 -5.830 -0.184 1.00 . A A . 50 ALA CA 1 1 10 9283 1 1 50 ALA CB C -4.132 -4.564 -1.046 1.00 . A A . 50 ALA CB 1 1 10 9284 1 1 50 ALA H H -6.143 -5.321 0.350 1.00 . A A . 50 ALA H 1 1 10 9285 1 1 50 ALA HA H -3.876 -6.688 -0.799 1.00 . A A . 50 ALA HA 1 1 10 9286 1 1 50 ALA HB1 H -4.887 -4.655 -1.812 1.00 . A A . 50 ALA HB1 1 1 10 9287 1 1 50 ALA HB2 H -4.352 -3.708 -0.425 1.00 . A A . 50 ALA HB2 1 1 10 9288 1 1 50 ALA HB3 H -3.164 -4.434 -1.506 1.00 . A A . 50 ALA HB3 1 1 10 9289 1 1 50 ALA N N -5.465 -6.022 0.431 1.00 . A A . 50 ALA N 1 1 10 9290 1 1 50 ALA O O -1.916 -5.970 0.756 1.00 . A A . 50 ALA O 1 1 10 9291 1 1 51 MET C C -2.375 -6.299 3.971 1.00 . A A . 51 MET C 1 1 10 9292 1 1 51 MET CA C -2.548 -4.988 3.200 1.00 . A A . 51 MET CA 1 1 10 9293 1 1 51 MET CB C -3.103 -3.912 4.139 1.00 . A A . 51 MET CB 1 1 10 9294 1 1 51 MET CE C -2.909 -1.335 6.476 1.00 . A A . 51 MET CE 1 1 10 9295 1 1 51 MET CG C -2.092 -3.619 5.249 1.00 . A A . 51 MET CG 1 1 10 9296 1 1 51 MET H H -4.442 -4.946 2.179 1.00 . A A . 51 MET H 1 1 10 9297 1 1 51 MET HA H -1.591 -4.668 2.815 1.00 . A A . 51 MET HA 1 1 10 9298 1 1 51 MET HB2 H -3.293 -3.009 3.577 1.00 . A A . 51 MET HB2 1 1 10 9299 1 1 51 MET HB3 H -4.025 -4.261 4.580 1.00 . A A . 51 MET HB3 1 1 10 9300 1 1 51 MET HE1 H -2.345 -1.131 5.577 1.00 . A A . 51 MET HE1 1 1 10 9301 1 1 51 MET HE2 H -3.914 -0.952 6.371 1.00 . A A . 51 MET HE2 1 1 10 9302 1 1 51 MET HE3 H -2.431 -0.856 7.315 1.00 . A A . 51 MET HE3 1 1 10 9303 1 1 51 MET HG2 H -1.510 -4.506 5.451 1.00 . A A . 51 MET HG2 1 1 10 9304 1 1 51 MET HG3 H -1.435 -2.821 4.937 1.00 . A A . 51 MET HG3 1 1 10 9305 1 1 51 MET N N -3.499 -5.186 2.069 1.00 . A A . 51 MET N 1 1 10 9306 1 1 51 MET O O -1.434 -6.470 4.720 1.00 . A A . 51 MET O 1 1 10 9307 1 1 51 MET SD S -2.971 -3.123 6.752 1.00 . A A . 51 MET SD 1 1 10 9308 1 1 52 ASP C C -2.452 -9.554 3.644 1.00 . A A . 52 ASP C 1 1 10 9309 1 1 52 ASP CA C -3.155 -8.522 4.529 1.00 . A A . 52 ASP CA 1 1 10 9310 1 1 52 ASP CB C -4.549 -9.034 4.899 1.00 . A A . 52 ASP CB 1 1 10 9311 1 1 52 ASP CG C -4.421 -10.364 5.644 1.00 . A A . 52 ASP CG 1 1 10 9312 1 1 52 ASP H H -4.030 -7.075 3.193 1.00 . A A . 52 ASP H 1 1 10 9313 1 1 52 ASP HA H -2.579 -8.372 5.431 1.00 . A A . 52 ASP HA 1 1 10 9314 1 1 52 ASP HB2 H -5.042 -8.311 5.532 1.00 . A A . 52 ASP HB2 1 1 10 9315 1 1 52 ASP HB3 H -5.129 -9.181 4.000 1.00 . A A . 52 ASP HB3 1 1 10 9316 1 1 52 ASP N N -3.275 -7.228 3.798 1.00 . A A . 52 ASP N 1 1 10 9317 1 1 52 ASP O O -2.084 -10.620 4.094 1.00 . A A . 52 ASP O 1 1 10 9318 1 1 52 ASP OD1 O -4.284 -10.330 6.856 1.00 . A A . 52 ASP OD1 1 1 10 9319 1 1 52 ASP OD2 O -4.461 -11.393 4.991 1.00 . A A . 52 ASP OD2 1 1 10 9320 1 1 53 THR C C -0.083 -9.957 1.477 1.00 . A A . 53 THR C 1 1 10 9321 1 1 53 THR CA C -1.590 -10.221 1.481 1.00 . A A . 53 THR CA 1 1 10 9322 1 1 53 THR CB C -2.139 -10.064 0.062 1.00 . A A . 53 THR CB 1 1 10 9323 1 1 53 THR CG2 C -3.533 -10.687 -0.019 1.00 . A A . 53 THR CG2 1 1 10 9324 1 1 53 THR H H -2.575 -8.386 2.042 1.00 . A A . 53 THR H 1 1 10 9325 1 1 53 THR HA H -1.777 -11.226 1.828 1.00 . A A . 53 THR HA 1 1 10 9326 1 1 53 THR HB H -1.485 -10.565 -0.634 1.00 . A A . 53 THR HB 1 1 10 9327 1 1 53 THR HG1 H -1.319 -8.339 -0.312 1.00 . A A . 53 THR HG1 1 1 10 9328 1 1 53 THR HG21 H -3.654 -11.404 0.780 1.00 . A A . 53 THR HG21 1 1 10 9329 1 1 53 THR HG22 H -4.281 -9.913 0.076 1.00 . A A . 53 THR HG22 1 1 10 9330 1 1 53 THR HG23 H -3.650 -11.186 -0.970 1.00 . A A . 53 THR HG23 1 1 10 9331 1 1 53 THR N N -2.267 -9.249 2.388 1.00 . A A . 53 THR N 1 1 10 9332 1 1 53 THR O O 0.654 -10.534 0.702 1.00 . A A . 53 THR O 1 1 10 9333 1 1 53 THR OG1 O -2.214 -8.683 -0.266 1.00 . A A . 53 THR OG1 1 1 10 9334 1 1 54 CYS C C 2.508 -9.663 3.451 1.00 . A A . 54 CYS C 1 1 10 9335 1 1 54 CYS CA C 1.844 -8.797 2.378 1.00 . A A . 54 CYS CA 1 1 10 9336 1 1 54 CYS CB C 2.055 -7.322 2.722 1.00 . A A . 54 CYS CB 1 1 10 9337 1 1 54 CYS H H -0.228 -8.639 2.954 1.00 . A A . 54 CYS H 1 1 10 9338 1 1 54 CYS HA H 2.284 -9.010 1.416 1.00 . A A . 54 CYS HA 1 1 10 9339 1 1 54 CYS HB2 H 1.343 -6.718 2.182 1.00 . A A . 54 CYS HB2 1 1 10 9340 1 1 54 CYS HB3 H 1.908 -7.181 3.783 1.00 . A A . 54 CYS HB3 1 1 10 9341 1 1 54 CYS N N 0.382 -9.094 2.336 1.00 . A A . 54 CYS N 1 1 10 9342 1 1 54 CYS O O 1.957 -9.866 4.515 1.00 . A A . 54 CYS O 1 1 10 9343 1 1 54 CYS SG S 3.728 -6.681 2.337 1.00 . A A . 54 CYS SG 1 1 10 9344 1 1 55 PRO C C 5.035 -10.111 5.202 1.00 . A A . 55 PRO C 1 1 10 9345 1 1 55 PRO CA C 4.441 -10.983 4.093 1.00 . A A . 55 PRO CA 1 1 10 9346 1 1 55 PRO CB C 5.541 -11.607 3.235 1.00 . A A . 55 PRO CB 1 1 10 9347 1 1 55 PRO CD C 4.408 -9.937 1.878 1.00 . A A . 55 PRO CD 1 1 10 9348 1 1 55 PRO CG C 5.723 -10.659 2.088 1.00 . A A . 55 PRO CG 1 1 10 9349 1 1 55 PRO HA H 3.809 -11.754 4.508 1.00 . A A . 55 PRO HA 1 1 10 9350 1 1 55 PRO HB2 H 6.439 -11.709 3.830 1.00 . A A . 55 PRO HB2 1 1 10 9351 1 1 55 PRO HB3 H 5.224 -12.580 2.896 1.00 . A A . 55 PRO HB3 1 1 10 9352 1 1 55 PRO HD2 H 4.582 -8.885 1.697 1.00 . A A . 55 PRO HD2 1 1 10 9353 1 1 55 PRO HD3 H 3.864 -10.376 1.056 1.00 . A A . 55 PRO HD3 1 1 10 9354 1 1 55 PRO HG2 H 6.504 -9.949 2.325 1.00 . A A . 55 PRO HG2 1 1 10 9355 1 1 55 PRO HG3 H 5.982 -11.210 1.198 1.00 . A A . 55 PRO HG3 1 1 10 9356 1 1 55 PRO N N 3.683 -10.138 3.136 1.00 . A A . 55 PRO N 1 1 10 9357 1 1 55 PRO O O 4.759 -10.299 6.370 1.00 . A A . 55 PRO O 1 1 10 9358 1 1 56 VAL C C 5.451 -7.131 6.189 1.00 . A A . 56 VAL C 1 1 10 9359 1 1 56 VAL CA C 6.440 -8.253 5.869 1.00 . A A . 56 VAL CA 1 1 10 9360 1 1 56 VAL CB C 7.738 -7.652 5.329 1.00 . A A . 56 VAL CB 1 1 10 9361 1 1 56 VAL CG1 C 7.416 -6.665 4.207 1.00 . A A . 56 VAL CG1 1 1 10 9362 1 1 56 VAL CG2 C 8.468 -6.921 6.457 1.00 . A A . 56 VAL CG2 1 1 10 9363 1 1 56 VAL H H 6.040 -9.008 3.892 1.00 . A A . 56 VAL H 1 1 10 9364 1 1 56 VAL HA H 6.648 -8.818 6.766 1.00 . A A . 56 VAL HA 1 1 10 9365 1 1 56 VAL HB H 8.367 -8.442 4.944 1.00 . A A . 56 VAL HB 1 1 10 9366 1 1 56 VAL HG11 H 6.371 -6.746 3.945 1.00 . A A . 56 VAL HG11 1 1 10 9367 1 1 56 VAL HG12 H 7.625 -5.659 4.540 1.00 . A A . 56 VAL HG12 1 1 10 9368 1 1 56 VAL HG13 H 8.023 -6.891 3.342 1.00 . A A . 56 VAL HG13 1 1 10 9369 1 1 56 VAL HG21 H 8.614 -7.596 7.289 1.00 . A A . 56 VAL HG21 1 1 10 9370 1 1 56 VAL HG22 H 9.427 -6.575 6.103 1.00 . A A . 56 VAL HG22 1 1 10 9371 1 1 56 VAL HG23 H 7.877 -6.077 6.780 1.00 . A A . 56 VAL HG23 1 1 10 9372 1 1 56 VAL N N 5.839 -9.147 4.841 1.00 . A A . 56 VAL N 1 1 10 9373 1 1 56 VAL O O 5.488 -6.535 7.247 1.00 . A A . 56 VAL O 1 1 10 9374 1 1 57 GLN C C 4.181 -4.397 5.308 1.00 . A A . 57 GLN C 1 1 10 9375 1 1 57 GLN CA C 3.551 -5.777 5.511 1.00 . A A . 57 GLN CA 1 1 10 9376 1 1 57 GLN CB C 3.002 -5.888 6.933 1.00 . A A . 57 GLN CB 1 1 10 9377 1 1 57 GLN CD C 0.885 -5.665 8.242 1.00 . A A . 57 GLN CD 1 1 10 9378 1 1 57 GLN CG C 1.478 -6.007 6.873 1.00 . A A . 57 GLN CG 1 1 10 9379 1 1 57 GLN H H 4.549 -7.350 4.436 1.00 . A A . 57 GLN H 1 1 10 9380 1 1 57 GLN HA H 2.739 -5.898 4.812 1.00 . A A . 57 GLN HA 1 1 10 9381 1 1 57 GLN HB2 H 3.414 -6.765 7.412 1.00 . A A . 57 GLN HB2 1 1 10 9382 1 1 57 GLN HB3 H 3.271 -5.007 7.496 1.00 . A A . 57 GLN HB3 1 1 10 9383 1 1 57 GLN HE21 H -0.685 -4.715 7.483 1.00 . A A . 57 GLN HE21 1 1 10 9384 1 1 57 GLN HE22 H -0.620 -4.769 9.178 1.00 . A A . 57 GLN HE22 1 1 10 9385 1 1 57 GLN HG2 H 1.094 -5.321 6.131 1.00 . A A . 57 GLN HG2 1 1 10 9386 1 1 57 GLN HG3 H 1.205 -7.016 6.605 1.00 . A A . 57 GLN HG3 1 1 10 9387 1 1 57 GLN N N 4.559 -6.849 5.278 1.00 . A A . 57 GLN N 1 1 10 9388 1 1 57 GLN NE2 N -0.232 -4.994 8.307 1.00 . A A . 57 GLN NE2 1 1 10 9389 1 1 57 GLN O O 3.823 -3.681 4.395 1.00 . A A . 57 GLN O 1 1 10 9390 1 1 57 GLN OE1 O 1.445 -6.012 9.262 1.00 . A A . 57 GLN OE1 1 1 10 9391 1 1 58 CYS C C 4.656 -1.632 5.687 1.00 . A A . 58 CYS C 1 1 10 9392 1 1 58 CYS CA C 5.741 -2.671 5.994 1.00 . A A . 58 CYS CA 1 1 10 9393 1 1 58 CYS CB C 6.771 -2.729 4.853 1.00 . A A . 58 CYS CB 1 1 10 9394 1 1 58 CYS H H 5.375 -4.601 6.885 1.00 . A A . 58 CYS H 1 1 10 9395 1 1 58 CYS HA H 6.247 -2.403 6.911 1.00 . A A . 58 CYS HA 1 1 10 9396 1 1 58 CYS HB2 H 7.510 -1.959 5.000 1.00 . A A . 58 CYS HB2 1 1 10 9397 1 1 58 CYS HB3 H 7.253 -3.694 4.870 1.00 . A A . 58 CYS HB3 1 1 10 9398 1 1 58 CYS HG H 6.524 -1.899 2.721 1.00 . A A . 58 CYS HG 1 1 10 9399 1 1 58 CYS N N 5.105 -4.012 6.149 1.00 . A A . 58 CYS N 1 1 10 9400 1 1 58 CYS O O 4.910 -0.627 5.055 1.00 . A A . 58 CYS O 1 1 10 9401 1 1 58 CYS SG S 5.974 -2.491 3.237 1.00 . A A . 58 CYS SG 1 1 10 9402 1 1 59 ILE C C 1.641 -0.519 7.123 1.00 . A A . 59 ILE C 1 1 10 9403 1 1 59 ILE CA C 2.339 -0.929 5.826 1.00 . A A . 59 ILE CA 1 1 10 9404 1 1 59 ILE CB C 1.332 -1.613 4.898 1.00 . A A . 59 ILE CB 1 1 10 9405 1 1 59 ILE CD1 C -0.568 -1.103 3.360 1.00 . A A . 59 ILE CD1 1 1 10 9406 1 1 59 ILE CG1 C 0.147 -0.680 4.645 1.00 . A A . 59 ILE CG1 1 1 10 9407 1 1 59 ILE CG2 C 0.832 -2.901 5.551 1.00 . A A . 59 ILE CG2 1 1 10 9408 1 1 59 ILE H H 3.263 -2.707 6.610 1.00 . A A . 59 ILE H 1 1 10 9409 1 1 59 ILE HA H 2.733 -0.050 5.343 1.00 . A A . 59 ILE HA 1 1 10 9410 1 1 59 ILE HB H 1.812 -1.851 3.962 1.00 . A A . 59 ILE HB 1 1 10 9411 1 1 59 ILE HD11 H 0.020 -1.854 2.852 1.00 . A A . 59 ILE HD11 1 1 10 9412 1 1 59 ILE HD12 H -1.539 -1.511 3.605 1.00 . A A . 59 ILE HD12 1 1 10 9413 1 1 59 ILE HD13 H -0.691 -0.244 2.717 1.00 . A A . 59 ILE HD13 1 1 10 9414 1 1 59 ILE HG12 H -0.539 -0.737 5.477 1.00 . A A . 59 ILE HG12 1 1 10 9415 1 1 59 ILE HG13 H 0.502 0.331 4.539 1.00 . A A . 59 ILE HG13 1 1 10 9416 1 1 59 ILE HG21 H 1.672 -3.460 5.936 1.00 . A A . 59 ILE HG21 1 1 10 9417 1 1 59 ILE HG22 H 0.159 -2.657 6.361 1.00 . A A . 59 ILE HG22 1 1 10 9418 1 1 59 ILE HG23 H 0.309 -3.498 4.817 1.00 . A A . 59 ILE HG23 1 1 10 9419 1 1 59 ILE N N 3.446 -1.882 6.114 1.00 . A A . 59 ILE N 1 1 10 9420 1 1 59 ILE O O 1.793 -1.149 8.152 1.00 . A A . 59 ILE O 1 1 10 9421 1 1 60 HIS C C -0.800 2.126 7.937 1.00 . A A . 60 HIS C 1 1 10 9422 1 1 60 HIS CA C 0.160 0.996 8.306 1.00 . A A . 60 HIS CA 1 1 10 9423 1 1 60 HIS CB C 1.167 1.507 9.345 1.00 . A A . 60 HIS CB 1 1 10 9424 1 1 60 HIS CD2 C 2.798 2.832 7.766 1.00 . A A . 60 HIS CD2 1 1 10 9425 1 1 60 HIS CE1 C 4.610 1.716 8.174 1.00 . A A . 60 HIS CE1 1 1 10 9426 1 1 60 HIS CG C 2.469 1.859 8.676 1.00 . A A . 60 HIS CG 1 1 10 9427 1 1 60 HIS H H 0.766 1.028 6.240 1.00 . A A . 60 HIS H 1 1 10 9428 1 1 60 HIS HA H -0.401 0.172 8.724 1.00 . A A . 60 HIS HA 1 1 10 9429 1 1 60 HIS HB2 H 0.764 2.386 9.825 1.00 . A A . 60 HIS HB2 1 1 10 9430 1 1 60 HIS HB3 H 1.339 0.740 10.085 1.00 . A A . 60 HIS HB3 1 1 10 9431 1 1 60 HIS HD1 H 3.742 0.398 9.530 1.00 . A A . 60 HIS HD1 1 1 10 9432 1 1 60 HIS HD2 H 2.111 3.559 7.357 1.00 . A A . 60 HIS HD2 1 1 10 9433 1 1 60 HIS HE1 H 5.636 1.377 8.160 1.00 . A A . 60 HIS HE1 1 1 10 9434 1 1 60 HIS N N 0.873 0.537 7.080 1.00 . A A . 60 HIS N 1 1 10 9435 1 1 60 HIS ND1 N 3.640 1.158 8.922 1.00 . A A . 60 HIS ND1 1 1 10 9436 1 1 60 HIS NE2 N 4.150 2.740 7.450 1.00 . A A . 60 HIS NE2 1 1 10 9437 1 1 60 HIS O O -0.817 2.598 6.818 1.00 . A A . 60 HIS O 1 1 10 9438 1 1 61 TRP C C -1.989 4.997 9.046 1.00 . A A . 61 TRP C 1 1 10 9439 1 1 61 TRP CA C -2.559 3.664 8.559 1.00 . A A . 61 TRP CA 1 1 10 9440 1 1 61 TRP CB C -3.895 3.385 9.248 1.00 . A A . 61 TRP CB 1 1 10 9441 1 1 61 TRP CD1 C -3.976 0.862 9.053 1.00 . A A . 61 TRP CD1 1 1 10 9442 1 1 61 TRP CD2 C -5.564 1.888 7.842 1.00 . A A . 61 TRP CD2 1 1 10 9443 1 1 61 TRP CE2 C -5.734 0.501 7.634 1.00 . A A . 61 TRP CE2 1 1 10 9444 1 1 61 TRP CE3 C -6.435 2.770 7.195 1.00 . A A . 61 TRP CE3 1 1 10 9445 1 1 61 TRP CG C -4.447 2.093 8.743 1.00 . A A . 61 TRP CG 1 1 10 9446 1 1 61 TRP CH2 C -7.604 0.900 6.164 1.00 . A A . 61 TRP CH2 1 1 10 9447 1 1 61 TRP CZ2 C -6.741 0.006 6.805 1.00 . A A . 61 TRP CZ2 1 1 10 9448 1 1 61 TRP CZ3 C -7.453 2.281 6.359 1.00 . A A . 61 TRP CZ3 1 1 10 9449 1 1 61 TRP H H -1.578 2.172 9.764 1.00 . A A . 61 TRP H 1 1 10 9450 1 1 61 TRP HA H -2.715 3.713 7.492 1.00 . A A . 61 TRP HA 1 1 10 9451 1 1 61 TRP HB2 H -3.751 3.324 10.312 1.00 . A A . 61 TRP HB2 1 1 10 9452 1 1 61 TRP HB3 H -4.587 4.182 9.024 1.00 . A A . 61 TRP HB3 1 1 10 9453 1 1 61 TRP HD1 H -3.141 0.652 9.705 1.00 . A A . 61 TRP HD1 1 1 10 9454 1 1 61 TRP HE1 H -4.611 -1.055 8.445 1.00 . A A . 61 TRP HE1 1 1 10 9455 1 1 61 TRP HE3 H -6.317 3.834 7.343 1.00 . A A . 61 TRP HE3 1 1 10 9456 1 1 61 TRP HH2 H -8.388 0.527 5.520 1.00 . A A . 61 TRP HH2 1 1 10 9457 1 1 61 TRP HZ2 H -6.852 -1.058 6.660 1.00 . A A . 61 TRP HZ2 1 1 10 9458 1 1 61 TRP HZ3 H -8.120 2.971 5.863 1.00 . A A . 61 TRP HZ3 1 1 10 9459 1 1 61 TRP N N -1.603 2.565 8.867 1.00 . A A . 61 TRP N 1 1 10 9460 1 1 61 TRP NE1 N -4.740 -0.085 8.393 1.00 . A A . 61 TRP NE1 1 1 10 9461 1 1 61 TRP O O -1.055 5.041 9.823 1.00 . A A . 61 TRP O 1 1 10 9462 1 1 62 GLU C C -3.168 8.220 9.651 1.00 . A A . 62 GLU C 1 1 10 9463 1 1 62 GLU CA C -2.032 7.422 9.003 1.00 . A A . 62 GLU CA 1 1 10 9464 1 1 62 GLU CB C -1.508 8.164 7.766 1.00 . A A . 62 GLU CB 1 1 10 9465 1 1 62 GLU CD C -0.525 10.330 6.997 1.00 . A A . 62 GLU CD 1 1 10 9466 1 1 62 GLU CG C -1.408 9.664 8.055 1.00 . A A . 62 GLU CG 1 1 10 9467 1 1 62 GLU H H -3.286 6.024 7.955 1.00 . A A . 62 GLU H 1 1 10 9468 1 1 62 GLU HA H -1.230 7.296 9.714 1.00 . A A . 62 GLU HA 1 1 10 9469 1 1 62 GLU HB2 H -0.530 7.783 7.509 1.00 . A A . 62 GLU HB2 1 1 10 9470 1 1 62 GLU HB3 H -2.184 8.003 6.937 1.00 . A A . 62 GLU HB3 1 1 10 9471 1 1 62 GLU HG2 H -2.395 10.103 8.029 1.00 . A A . 62 GLU HG2 1 1 10 9472 1 1 62 GLU HG3 H -0.972 9.815 9.031 1.00 . A A . 62 GLU HG3 1 1 10 9473 1 1 62 GLU N N -2.540 6.086 8.584 1.00 . A A . 62 GLU N 1 1 10 9474 1 1 62 GLU O O -4.073 8.683 8.985 1.00 . A A . 62 GLU O 1 1 10 9475 1 1 62 GLU OE1 O -0.608 9.928 5.848 1.00 . A A . 62 GLU OE1 1 1 10 9476 1 1 62 GLU OE2 O 0.219 11.228 7.354 1.00 . A A . 62 GLU OE2 1 1 10 9477 1 1 63 ASP C C -3.635 10.476 12.151 1.00 . A A . 63 ASP C 1 1 10 9478 1 1 63 ASP CA C -4.202 9.151 11.636 1.00 . A A . 63 ASP CA 1 1 10 9479 1 1 63 ASP CB C -4.735 8.333 12.814 1.00 . A A . 63 ASP CB 1 1 10 9480 1 1 63 ASP CG C -5.571 7.164 12.290 1.00 . A A . 63 ASP CG 1 1 10 9481 1 1 63 ASP H H -2.388 8.002 11.463 1.00 . A A . 63 ASP H 1 1 10 9482 1 1 63 ASP HA H -5.006 9.349 10.942 1.00 . A A . 63 ASP HA 1 1 10 9483 1 1 63 ASP HB2 H -3.906 7.953 13.393 1.00 . A A . 63 ASP HB2 1 1 10 9484 1 1 63 ASP HB3 H -5.353 8.962 13.438 1.00 . A A . 63 ASP HB3 1 1 10 9485 1 1 63 ASP N N -3.127 8.383 10.945 1.00 . A A . 63 ASP N 1 1 10 9486 1 1 63 ASP O O -2.833 10.505 13.064 1.00 . A A . 63 ASP O 1 1 10 9487 1 1 63 ASP OD1 O -6.650 7.415 11.777 1.00 . A A . 63 ASP OD1 1 1 10 9488 1 1 63 ASP OD2 O -5.118 6.038 12.409 1.00 . A A . 63 ASP OD2 1 1 10 9489 1 1 64 GLU C C -4.697 13.767 12.487 1.00 . A A . 64 GLU C 1 1 10 9490 1 1 64 GLU CA C -3.527 12.893 12.031 1.00 . A A . 64 GLU CA 1 1 10 9491 1 1 64 GLU CB C -2.796 13.585 10.879 1.00 . A A . 64 GLU CB 1 1 10 9492 1 1 64 GLU CD C -1.068 14.912 12.102 1.00 . A A . 64 GLU CD 1 1 10 9493 1 1 64 GLU CG C -1.306 13.692 11.210 1.00 . A A . 64 GLU CG 1 1 10 9494 1 1 64 GLU H H -4.689 11.527 10.837 1.00 . A A . 64 GLU H 1 1 10 9495 1 1 64 GLU HA H -2.844 12.748 12.854 1.00 . A A . 64 GLU HA 1 1 10 9496 1 1 64 GLU HB2 H -2.924 13.010 9.974 1.00 . A A . 64 GLU HB2 1 1 10 9497 1 1 64 GLU HB3 H -3.203 14.575 10.738 1.00 . A A . 64 GLU HB3 1 1 10 9498 1 1 64 GLU HG2 H -0.988 12.799 11.728 1.00 . A A . 64 GLU HG2 1 1 10 9499 1 1 64 GLU HG3 H -0.741 13.800 10.297 1.00 . A A . 64 GLU HG3 1 1 10 9500 1 1 64 GLU N N -4.043 11.572 11.572 1.00 . A A . 64 GLU N 1 1 10 9501 1 1 64 GLU OE1 O -1.628 15.955 11.807 1.00 . A A . 64 GLU OE1 1 1 10 9502 1 1 64 GLU OE2 O -0.330 14.784 13.064 1.00 . A A . 64 GLU OE2 1 1 10 9503 2 2 1 SF4 FE1 FE 5.384 -5.088 -1.950 1.00 . B A . 65 SF4 FE1 1 1 10 9504 2 2 1 SF4 FE2 FE 3.811 -6.234 0.204 1.00 . B A . 65 SF4 FE2 1 1 10 9505 2 2 1 SF4 FE3 FE 2.785 -4.767 -1.992 1.00 . B A . 65 SF4 FE3 1 1 10 9506 2 2 1 SF4 FE4 FE 4.036 -7.434 -2.421 1.00 . B A . 65 SF4 FE4 1 1 10 9507 2 2 1 SF4 S1 S 2.041 -6.889 -0.957 1.00 . B A . 65 SF4 S1 1 1 10 9508 2 2 1 SF4 S2 S 4.228 -5.268 -3.584 1.00 . B A . 65 SF4 S2 1 1 10 9509 2 2 1 SF4 S3 S 5.686 -7.311 -0.945 1.00 . B A . 65 SF4 S3 1 1 10 9510 2 2 1 SF4 S4 S 4.191 -3.868 -0.544 1.00 . B A . 65 SF4 S4 1 1 11 9511 1 1 1 ALA C C -9.173 9.091 9.560 1.00 . A A . 1 ALA C 1 1 11 9512 1 1 1 ALA CA C -10.369 10.025 9.364 1.00 . A A . 1 ALA CA 1 1 11 9513 1 1 1 ALA CB C -10.165 11.291 10.201 1.00 . A A . 1 ALA CB 1 1 11 9514 1 1 1 ALA HA H -10.453 10.292 8.322 1.00 . A A . 1 ALA HA 1 1 11 9515 1 1 1 ALA HB1 H -10.953 11.367 10.936 1.00 . A A . 1 ALA HB1 1 1 11 9516 1 1 1 ALA HB2 H -9.210 11.243 10.700 1.00 . A A . 1 ALA HB2 1 1 11 9517 1 1 1 ALA HB3 H -10.191 12.157 9.555 1.00 . A A . 1 ALA HB3 1 1 11 9518 1 1 1 ALA N N -11.617 9.335 9.802 1.00 . A A . 1 ALA N 1 1 11 9519 1 1 1 ALA O O -8.633 8.978 10.642 1.00 . A A . 1 ALA O 1 1 11 9520 1 1 2 ARG C C -6.813 7.456 7.341 1.00 . A A . 2 ARG C 1 1 11 9521 1 1 2 ARG CA C -7.594 7.495 8.656 1.00 . A A . 2 ARG CA 1 1 11 9522 1 1 2 ARG CB C -8.098 6.090 8.990 1.00 . A A . 2 ARG CB 1 1 11 9523 1 1 2 ARG CD C -7.007 4.990 10.951 1.00 . A A . 2 ARG CD 1 1 11 9524 1 1 2 ARG CG C -6.924 5.219 9.441 1.00 . A A . 2 ARG CG 1 1 11 9525 1 1 2 ARG CZ C -8.960 4.840 12.374 1.00 . A A . 2 ARG CZ 1 1 11 9526 1 1 2 ARG H H -9.203 8.523 7.656 1.00 . A A . 2 ARG H 1 1 11 9527 1 1 2 ARG HA H -6.947 7.843 9.449 1.00 . A A . 2 ARG HA 1 1 11 9528 1 1 2 ARG HB2 H -8.829 6.149 9.783 1.00 . A A . 2 ARG HB2 1 1 11 9529 1 1 2 ARG HB3 H -8.553 5.653 8.113 1.00 . A A . 2 ARG HB3 1 1 11 9530 1 1 2 ARG HD2 H -6.242 4.291 11.252 1.00 . A A . 2 ARG HD2 1 1 11 9531 1 1 2 ARG HD3 H -6.861 5.929 11.466 1.00 . A A . 2 ARG HD3 1 1 11 9532 1 1 2 ARG HE H -8.769 3.775 10.710 1.00 . A A . 2 ARG HE 1 1 11 9533 1 1 2 ARG HG2 H -6.965 4.268 8.929 1.00 . A A . 2 ARG HG2 1 1 11 9534 1 1 2 ARG HG3 H -5.996 5.715 9.206 1.00 . A A . 2 ARG HG3 1 1 11 9535 1 1 2 ARG HH11 H -7.524 4.195 13.611 1.00 . A A . 2 ARG HH11 1 1 11 9536 1 1 2 ARG HH12 H -8.882 4.955 14.371 1.00 . A A . 2 ARG HH12 1 1 11 9537 1 1 2 ARG HH21 H -10.538 5.579 11.389 1.00 . A A . 2 ARG HH21 1 1 11 9538 1 1 2 ARG HH22 H -10.590 5.739 13.112 1.00 . A A . 2 ARG HH22 1 1 11 9539 1 1 2 ARG N N -8.755 8.419 8.522 1.00 . A A . 2 ARG N 1 1 11 9540 1 1 2 ARG NE N -8.349 4.438 11.294 1.00 . A A . 2 ARG NE 1 1 11 9541 1 1 2 ARG NH1 N -8.414 4.649 13.543 1.00 . A A . 2 ARG NH1 1 1 11 9542 1 1 2 ARG NH2 N -10.120 5.433 12.284 1.00 . A A . 2 ARG NH2 1 1 11 9543 1 1 2 ARG O O -7.238 6.857 6.373 1.00 . A A . 2 ARG O 1 1 11 9544 1 1 3 LYS C C -3.980 6.831 6.025 1.00 . A A . 3 LYS C 1 1 11 9545 1 1 3 LYS CA C -4.865 8.080 6.045 1.00 . A A . 3 LYS CA 1 1 11 9546 1 1 3 LYS CB C -3.991 9.335 5.999 1.00 . A A . 3 LYS CB 1 1 11 9547 1 1 3 LYS CD C -3.049 11.079 4.480 1.00 . A A . 3 LYS CD 1 1 11 9548 1 1 3 LYS CE C -1.861 10.488 3.722 1.00 . A A . 3 LYS CE 1 1 11 9549 1 1 3 LYS CG C -4.136 10.014 4.636 1.00 . A A . 3 LYS CG 1 1 11 9550 1 1 3 LYS H H -5.342 8.562 8.089 1.00 . A A . 3 LYS H 1 1 11 9551 1 1 3 LYS HA H -5.526 8.068 5.191 1.00 . A A . 3 LYS HA 1 1 11 9552 1 1 3 LYS HB2 H -4.302 10.018 6.776 1.00 . A A . 3 LYS HB2 1 1 11 9553 1 1 3 LYS HB3 H -2.961 9.062 6.154 1.00 . A A . 3 LYS HB3 1 1 11 9554 1 1 3 LYS HD2 H -3.445 11.921 3.931 1.00 . A A . 3 LYS HD2 1 1 11 9555 1 1 3 LYS HD3 H -2.722 11.406 5.457 1.00 . A A . 3 LYS HD3 1 1 11 9556 1 1 3 LYS HE2 H -1.809 9.424 3.908 1.00 . A A . 3 LYS HE2 1 1 11 9557 1 1 3 LYS HE3 H -1.986 10.662 2.663 1.00 . A A . 3 LYS HE3 1 1 11 9558 1 1 3 LYS HG2 H -4.033 9.275 3.854 1.00 . A A . 3 LYS HG2 1 1 11 9559 1 1 3 LYS HG3 H -5.106 10.480 4.567 1.00 . A A . 3 LYS HG3 1 1 11 9560 1 1 3 LYS HZ1 H -0.829 11.926 4.818 1.00 . A A . 3 LYS HZ1 1 1 11 9561 1 1 3 LYS HZ2 H -0.021 10.437 4.699 1.00 . A A . 3 LYS HZ2 1 1 11 9562 1 1 3 LYS HZ3 H -0.070 11.489 3.366 1.00 . A A . 3 LYS HZ3 1 1 11 9563 1 1 3 LYS N N -5.672 8.087 7.298 1.00 . A A . 3 LYS N 1 1 11 9564 1 1 3 LYS NZ N -0.601 11.133 4.186 1.00 . A A . 3 LYS NZ 1 1 11 9565 1 1 3 LYS O O -4.262 5.852 6.686 1.00 . A A . 3 LYS O 1 1 11 9566 1 1 4 PHE C C -0.857 5.929 4.260 1.00 . A A . 4 PHE C 1 1 11 9567 1 1 4 PHE CA C -2.016 5.662 5.219 1.00 . A A . 4 PHE CA 1 1 11 9568 1 1 4 PHE CB C -2.813 4.443 4.748 1.00 . A A . 4 PHE CB 1 1 11 9569 1 1 4 PHE CD1 C -4.266 5.529 3.008 1.00 . A A . 4 PHE CD1 1 1 11 9570 1 1 4 PHE CD2 C -2.591 3.931 2.292 1.00 . A A . 4 PHE CD2 1 1 11 9571 1 1 4 PHE CE1 C -4.659 5.713 1.680 1.00 . A A . 4 PHE CE1 1 1 11 9572 1 1 4 PHE CE2 C -2.982 4.115 0.961 1.00 . A A . 4 PHE CE2 1 1 11 9573 1 1 4 PHE CG C -3.233 4.638 3.314 1.00 . A A . 4 PHE CG 1 1 11 9574 1 1 4 PHE CZ C -4.016 5.007 0.654 1.00 . A A . 4 PHE CZ 1 1 11 9575 1 1 4 PHE H H -2.698 7.652 4.747 1.00 . A A . 4 PHE H 1 1 11 9576 1 1 4 PHE HA H -1.621 5.472 6.202 1.00 . A A . 4 PHE HA 1 1 11 9577 1 1 4 PHE HB2 H -2.200 3.558 4.828 1.00 . A A . 4 PHE HB2 1 1 11 9578 1 1 4 PHE HB3 H -3.692 4.327 5.365 1.00 . A A . 4 PHE HB3 1 1 11 9579 1 1 4 PHE HD1 H -4.762 6.073 3.798 1.00 . A A . 4 PHE HD1 1 1 11 9580 1 1 4 PHE HD2 H -1.792 3.243 2.530 1.00 . A A . 4 PHE HD2 1 1 11 9581 1 1 4 PHE HE1 H -5.455 6.401 1.444 1.00 . A A . 4 PHE HE1 1 1 11 9582 1 1 4 PHE HE2 H -2.487 3.570 0.171 1.00 . A A . 4 PHE HE2 1 1 11 9583 1 1 4 PHE HZ H -4.320 5.150 -0.372 1.00 . A A . 4 PHE HZ 1 1 11 9584 1 1 4 PHE N N -2.912 6.854 5.272 1.00 . A A . 4 PHE N 1 1 11 9585 1 1 4 PHE O O -0.528 7.063 3.972 1.00 . A A . 4 PHE O 1 1 11 9586 1 1 5 TYR C C 1.575 3.750 2.723 1.00 . A A . 5 TYR C 1 1 11 9587 1 1 5 TYR CA C 0.909 5.093 2.849 1.00 . A A . 5 TYR CA 1 1 11 9588 1 1 5 TYR CB C 1.905 6.103 3.418 1.00 . A A . 5 TYR CB 1 1 11 9589 1 1 5 TYR CD1 C 2.899 4.612 5.190 1.00 . A A . 5 TYR CD1 1 1 11 9590 1 1 5 TYR CD2 C 1.755 6.636 5.878 1.00 . A A . 5 TYR CD2 1 1 11 9591 1 1 5 TYR CE1 C 3.172 4.310 6.529 1.00 . A A . 5 TYR CE1 1 1 11 9592 1 1 5 TYR CE2 C 2.026 6.333 7.217 1.00 . A A . 5 TYR CE2 1 1 11 9593 1 1 5 TYR CG C 2.192 5.775 4.863 1.00 . A A . 5 TYR CG 1 1 11 9594 1 1 5 TYR CZ C 2.734 5.170 7.543 1.00 . A A . 5 TYR CZ 1 1 11 9595 1 1 5 TYR H H -0.485 3.976 4.004 1.00 . A A . 5 TYR H 1 1 11 9596 1 1 5 TYR HA H 0.551 5.421 1.885 1.00 . A A . 5 TYR HA 1 1 11 9597 1 1 5 TYR HB2 H 2.824 6.056 2.852 1.00 . A A . 5 TYR HB2 1 1 11 9598 1 1 5 TYR HB3 H 1.492 7.092 3.346 1.00 . A A . 5 TYR HB3 1 1 11 9599 1 1 5 TYR HD1 H 3.237 3.949 4.407 1.00 . A A . 5 TYR HD1 1 1 11 9600 1 1 5 TYR HD2 H 1.208 7.533 5.626 1.00 . A A . 5 TYR HD2 1 1 11 9601 1 1 5 TYR HE1 H 3.718 3.413 6.780 1.00 . A A . 5 TYR HE1 1 1 11 9602 1 1 5 TYR HE2 H 1.689 6.996 7.999 1.00 . A A . 5 TYR HE2 1 1 11 9603 1 1 5 TYR HH H 2.939 5.687 9.368 1.00 . A A . 5 TYR HH 1 1 11 9604 1 1 5 TYR N N -0.223 4.898 3.768 1.00 . A A . 5 TYR N 1 1 11 9605 1 1 5 TYR O O 1.131 2.774 3.310 1.00 . A A . 5 TYR O 1 1 11 9606 1 1 5 TYR OH O 3.002 4.874 8.863 1.00 . A A . 5 TYR OH 1 1 11 9607 1 1 6 VAL C C 4.680 2.335 2.329 1.00 . A A . 6 VAL C 1 1 11 9608 1 1 6 VAL CA C 3.239 2.327 1.874 1.00 . A A . 6 VAL CA 1 1 11 9609 1 1 6 VAL CB C 3.176 1.832 0.449 1.00 . A A . 6 VAL CB 1 1 11 9610 1 1 6 VAL CG1 C 3.177 0.333 0.510 1.00 . A A . 6 VAL CG1 1 1 11 9611 1 1 6 VAL CG2 C 1.889 2.282 -0.223 1.00 . A A . 6 VAL CG2 1 1 11 9612 1 1 6 VAL H H 2.987 4.441 1.509 1.00 . A A . 6 VAL H 1 1 11 9613 1 1 6 VAL HA H 2.687 1.639 2.496 1.00 . A A . 6 VAL HA 1 1 11 9614 1 1 6 VAL HB H 4.033 2.185 -0.106 1.00 . A A . 6 VAL HB 1 1 11 9615 1 1 6 VAL HG11 H 2.618 0.022 1.381 1.00 . A A . 6 VAL HG11 1 1 11 9616 1 1 6 VAL HG12 H 2.717 -0.051 -0.380 1.00 . A A . 6 VAL HG12 1 1 11 9617 1 1 6 VAL HG13 H 4.188 -0.016 0.587 1.00 . A A . 6 VAL HG13 1 1 11 9618 1 1 6 VAL HG21 H 1.155 2.535 0.528 1.00 . A A . 6 VAL HG21 1 1 11 9619 1 1 6 VAL HG22 H 2.089 3.135 -0.834 1.00 . A A . 6 VAL HG22 1 1 11 9620 1 1 6 VAL HG23 H 1.512 1.482 -0.842 1.00 . A A . 6 VAL HG23 1 1 11 9621 1 1 6 VAL N N 2.621 3.655 1.984 1.00 . A A . 6 VAL N 1 1 11 9622 1 1 6 VAL O O 5.416 3.278 2.126 1.00 . A A . 6 VAL O 1 1 11 9623 1 1 7 ASP C C 7.273 0.396 2.322 1.00 . A A . 7 ASP C 1 1 11 9624 1 1 7 ASP CA C 6.480 1.152 3.386 1.00 . A A . 7 ASP CA 1 1 11 9625 1 1 7 ASP CB C 6.540 0.403 4.719 1.00 . A A . 7 ASP CB 1 1 11 9626 1 1 7 ASP CG C 7.110 1.324 5.800 1.00 . A A . 7 ASP CG 1 1 11 9627 1 1 7 ASP H H 4.469 0.510 3.059 1.00 . A A . 7 ASP H 1 1 11 9628 1 1 7 ASP HA H 6.873 2.140 3.500 1.00 . A A . 7 ASP HA 1 1 11 9629 1 1 7 ASP HB2 H 5.546 0.088 5.000 1.00 . A A . 7 ASP HB2 1 1 11 9630 1 1 7 ASP HB3 H 7.176 -0.465 4.617 1.00 . A A . 7 ASP HB3 1 1 11 9631 1 1 7 ASP N N 5.086 1.257 2.929 1.00 . A A . 7 ASP N 1 1 11 9632 1 1 7 ASP O O 8.128 -0.415 2.619 1.00 . A A . 7 ASP O 1 1 11 9633 1 1 7 ASP OD1 O 8.321 1.372 5.931 1.00 . A A . 7 ASP OD1 1 1 11 9634 1 1 7 ASP OD2 O 6.324 1.963 6.479 1.00 . A A . 7 ASP OD2 1 1 11 9635 1 1 8 GLN C C 9.164 -0.189 0.291 1.00 . A A . 8 GLN C 1 1 11 9636 1 1 8 GLN CA C 7.682 -0.017 -0.044 1.00 . A A . 8 GLN CA 1 1 11 9637 1 1 8 GLN CB C 7.540 0.832 -1.305 1.00 . A A . 8 GLN CB 1 1 11 9638 1 1 8 GLN CD C 7.724 2.983 -0.050 1.00 . A A . 8 GLN CD 1 1 11 9639 1 1 8 GLN CG C 8.350 2.119 -1.146 1.00 . A A . 8 GLN CG 1 1 11 9640 1 1 8 GLN H H 6.278 1.321 0.880 1.00 . A A . 8 GLN H 1 1 11 9641 1 1 8 GLN HA H 7.236 -0.986 -0.212 1.00 . A A . 8 GLN HA 1 1 11 9642 1 1 8 GLN HB2 H 7.900 0.278 -2.159 1.00 . A A . 8 GLN HB2 1 1 11 9643 1 1 8 GLN HB3 H 6.499 1.082 -1.448 1.00 . A A . 8 GLN HB3 1 1 11 9644 1 1 8 GLN HE21 H 5.916 2.968 -0.872 1.00 . A A . 8 GLN HE21 1 1 11 9645 1 1 8 GLN HE22 H 6.046 3.841 0.578 1.00 . A A . 8 GLN HE22 1 1 11 9646 1 1 8 GLN HG2 H 9.367 1.873 -0.877 1.00 . A A . 8 GLN HG2 1 1 11 9647 1 1 8 GLN HG3 H 8.345 2.664 -2.077 1.00 . A A . 8 GLN HG3 1 1 11 9648 1 1 8 GLN N N 6.978 0.665 1.078 1.00 . A A . 8 GLN N 1 1 11 9649 1 1 8 GLN NE2 N 6.457 3.290 -0.121 1.00 . A A . 8 GLN NE2 1 1 11 9650 1 1 8 GLN O O 9.810 -1.108 -0.172 1.00 . A A . 8 GLN O 1 1 11 9651 1 1 8 GLN OE1 O 8.395 3.383 0.881 1.00 . A A . 8 GLN OE1 1 1 11 9652 1 1 9 ASP C C 11.428 -0.909 1.832 1.00 . A A . 9 ASP C 1 1 11 9653 1 1 9 ASP CA C 11.145 0.545 1.461 1.00 . A A . 9 ASP CA 1 1 11 9654 1 1 9 ASP CB C 11.461 1.447 2.655 1.00 . A A . 9 ASP CB 1 1 11 9655 1 1 9 ASP CG C 12.844 2.075 2.469 1.00 . A A . 9 ASP CG 1 1 11 9656 1 1 9 ASP H H 9.169 1.407 1.469 1.00 . A A . 9 ASP H 1 1 11 9657 1 1 9 ASP HA H 11.759 0.829 0.618 1.00 . A A . 9 ASP HA 1 1 11 9658 1 1 9 ASP HB2 H 10.716 2.227 2.725 1.00 . A A . 9 ASP HB2 1 1 11 9659 1 1 9 ASP HB3 H 11.454 0.859 3.561 1.00 . A A . 9 ASP HB3 1 1 11 9660 1 1 9 ASP N N 9.707 0.677 1.098 1.00 . A A . 9 ASP N 1 1 11 9661 1 1 9 ASP O O 12.542 -1.386 1.730 1.00 . A A . 9 ASP O 1 1 11 9662 1 1 9 ASP OD1 O 13.584 1.588 1.630 1.00 . A A . 9 ASP OD1 1 1 11 9663 1 1 9 ASP OD2 O 13.138 3.031 3.167 1.00 . A A . 9 ASP OD2 1 1 11 9664 1 1 10 GLU C C 9.965 -3.948 1.600 1.00 . A A . 10 GLU C 1 1 11 9665 1 1 10 GLU CA C 10.616 -3.039 2.650 1.00 . A A . 10 GLU CA 1 1 11 9666 1 1 10 GLU CB C 9.962 -3.277 4.012 1.00 . A A . 10 GLU CB 1 1 11 9667 1 1 10 GLU CD C 10.433 -4.643 6.049 1.00 . A A . 10 GLU CD 1 1 11 9668 1 1 10 GLU CG C 10.328 -4.672 4.523 1.00 . A A . 10 GLU CG 1 1 11 9669 1 1 10 GLU H H 9.536 -1.208 2.344 1.00 . A A . 10 GLU H 1 1 11 9670 1 1 10 GLU HA H 11.672 -3.255 2.714 1.00 . A A . 10 GLU HA 1 1 11 9671 1 1 10 GLU HB2 H 10.313 -2.533 4.713 1.00 . A A . 10 GLU HB2 1 1 11 9672 1 1 10 GLU HB3 H 8.890 -3.199 3.913 1.00 . A A . 10 GLU HB3 1 1 11 9673 1 1 10 GLU HG2 H 9.565 -5.376 4.226 1.00 . A A . 10 GLU HG2 1 1 11 9674 1 1 10 GLU HG3 H 11.278 -4.971 4.105 1.00 . A A . 10 GLU HG3 1 1 11 9675 1 1 10 GLU N N 10.422 -1.616 2.266 1.00 . A A . 10 GLU N 1 1 11 9676 1 1 10 GLU O O 10.222 -5.134 1.550 1.00 . A A . 10 GLU O 1 1 11 9677 1 1 10 GLU OE1 O 10.605 -3.563 6.591 1.00 . A A . 10 GLU OE1 1 1 11 9678 1 1 10 GLU OE2 O 10.339 -5.700 6.650 1.00 . A A . 10 GLU OE2 1 1 11 9679 1 1 11 CYS C C 9.474 -5.183 -0.913 1.00 . A A . 11 CYS C 1 1 11 9680 1 1 11 CYS CA C 8.451 -4.239 -0.276 1.00 . A A . 11 CYS CA 1 1 11 9681 1 1 11 CYS CB C 7.834 -3.337 -1.353 1.00 . A A . 11 CYS CB 1 1 11 9682 1 1 11 CYS H H 8.922 -2.445 0.824 1.00 . A A . 11 CYS H 1 1 11 9683 1 1 11 CYS HA H 7.670 -4.825 0.188 1.00 . A A . 11 CYS HA 1 1 11 9684 1 1 11 CYS HB2 H 7.084 -2.703 -0.907 1.00 . A A . 11 CYS HB2 1 1 11 9685 1 1 11 CYS HB3 H 8.605 -2.729 -1.805 1.00 . A A . 11 CYS HB3 1 1 11 9686 1 1 11 CYS N N 9.119 -3.403 0.765 1.00 . A A . 11 CYS N 1 1 11 9687 1 1 11 CYS O O 10.614 -4.822 -1.132 1.00 . A A . 11 CYS O 1 1 11 9688 1 1 11 CYS SG S 7.043 -4.245 -2.727 1.00 . A A . 11 CYS SG 1 1 11 9689 1 1 12 ILE C C 9.819 -7.404 -3.339 1.00 . A A . 12 ILE C 1 1 11 9690 1 1 12 ILE CA C 10.031 -7.360 -1.823 1.00 . A A . 12 ILE CA 1 1 11 9691 1 1 12 ILE CB C 9.802 -8.752 -1.226 1.00 . A A . 12 ILE CB 1 1 11 9692 1 1 12 ILE CD1 C 8.229 -10.689 -1.108 1.00 . A A . 12 ILE CD1 1 1 11 9693 1 1 12 ILE CG1 C 8.521 -9.359 -1.805 1.00 . A A . 12 ILE CG1 1 1 11 9694 1 1 12 ILE CG2 C 9.671 -8.641 0.294 1.00 . A A . 12 ILE CG2 1 1 11 9695 1 1 12 ILE H H 8.156 -6.666 -1.018 1.00 . A A . 12 ILE H 1 1 11 9696 1 1 12 ILE HA H 11.042 -7.045 -1.614 1.00 . A A . 12 ILE HA 1 1 11 9697 1 1 12 ILE HB H 10.643 -9.386 -1.467 1.00 . A A . 12 ILE HB 1 1 11 9698 1 1 12 ILE HD11 H 9.135 -11.271 -1.048 1.00 . A A . 12 ILE HD11 1 1 11 9699 1 1 12 ILE HD12 H 7.856 -10.500 -0.111 1.00 . A A . 12 ILE HD12 1 1 11 9700 1 1 12 ILE HD13 H 7.486 -11.235 -1.671 1.00 . A A . 12 ILE HD13 1 1 11 9701 1 1 12 ILE HG12 H 7.697 -8.679 -1.647 1.00 . A A . 12 ILE HG12 1 1 11 9702 1 1 12 ILE HG13 H 8.649 -9.531 -2.863 1.00 . A A . 12 ILE HG13 1 1 11 9703 1 1 12 ILE HG21 H 10.454 -8.005 0.678 1.00 . A A . 12 ILE HG21 1 1 11 9704 1 1 12 ILE HG22 H 8.709 -8.217 0.542 1.00 . A A . 12 ILE HG22 1 1 11 9705 1 1 12 ILE HG23 H 9.756 -9.623 0.735 1.00 . A A . 12 ILE HG23 1 1 11 9706 1 1 12 ILE N N 9.078 -6.393 -1.207 1.00 . A A . 12 ILE N 1 1 11 9707 1 1 12 ILE O O 10.759 -7.334 -4.105 1.00 . A A . 12 ILE O 1 1 11 9708 1 1 13 ALA C C 6.918 -8.036 -5.529 1.00 . A A . 13 ALA C 1 1 11 9709 1 1 13 ALA CA C 8.346 -7.560 -5.251 1.00 . A A . 13 ALA CA 1 1 11 9710 1 1 13 ALA CB C 9.338 -8.525 -5.906 1.00 . A A . 13 ALA CB 1 1 11 9711 1 1 13 ALA H H 7.846 -7.569 -3.154 1.00 . A A . 13 ALA H 1 1 11 9712 1 1 13 ALA HA H 8.482 -6.572 -5.667 1.00 . A A . 13 ALA HA 1 1 11 9713 1 1 13 ALA HB1 H 9.665 -9.252 -5.179 1.00 . A A . 13 ALA HB1 1 1 11 9714 1 1 13 ALA HB2 H 8.856 -9.030 -6.730 1.00 . A A . 13 ALA HB2 1 1 11 9715 1 1 13 ALA HB3 H 10.190 -7.972 -6.271 1.00 . A A . 13 ALA HB3 1 1 11 9716 1 1 13 ALA N N 8.596 -7.516 -3.782 1.00 . A A . 13 ALA N 1 1 11 9717 1 1 13 ALA O O 6.285 -7.602 -6.471 1.00 . A A . 13 ALA O 1 1 11 9718 1 1 14 CYS C C 4.082 -8.246 -5.210 1.00 . A A . 14 CYS C 1 1 11 9719 1 1 14 CYS CA C 5.021 -9.430 -4.967 1.00 . A A . 14 CYS CA 1 1 11 9720 1 1 14 CYS CB C 4.541 -10.236 -3.757 1.00 . A A . 14 CYS CB 1 1 11 9721 1 1 14 CYS H H 6.930 -9.275 -3.975 1.00 . A A . 14 CYS H 1 1 11 9722 1 1 14 CYS HA H 5.022 -10.066 -5.840 1.00 . A A . 14 CYS HA 1 1 11 9723 1 1 14 CYS HB2 H 4.135 -11.179 -4.096 1.00 . A A . 14 CYS HB2 1 1 11 9724 1 1 14 CYS HB3 H 5.378 -10.423 -3.100 1.00 . A A . 14 CYS HB3 1 1 11 9725 1 1 14 CYS N N 6.405 -8.930 -4.726 1.00 . A A . 14 CYS N 1 1 11 9726 1 1 14 CYS O O 4.380 -7.123 -4.856 1.00 . A A . 14 CYS O 1 1 11 9727 1 1 14 CYS SG S 3.244 -9.471 -2.715 1.00 . A A . 14 CYS SG 1 1 11 9728 1 1 15 GLU C C 0.648 -7.677 -5.452 1.00 . A A . 15 GLU C 1 1 11 9729 1 1 15 GLU CA C 2.002 -7.375 -6.098 1.00 . A A . 15 GLU CA 1 1 11 9730 1 1 15 GLU CB C 1.824 -7.226 -7.611 1.00 . A A . 15 GLU CB 1 1 11 9731 1 1 15 GLU CD C 3.914 -7.754 -8.877 1.00 . A A . 15 GLU CD 1 1 11 9732 1 1 15 GLU CG C 3.099 -6.638 -8.220 1.00 . A A . 15 GLU CG 1 1 11 9733 1 1 15 GLU H H 2.736 -9.400 -6.107 1.00 . A A . 15 GLU H 1 1 11 9734 1 1 15 GLU HA H 2.397 -6.454 -5.692 1.00 . A A . 15 GLU HA 1 1 11 9735 1 1 15 GLU HB2 H 1.630 -8.197 -8.046 1.00 . A A . 15 GLU HB2 1 1 11 9736 1 1 15 GLU HB3 H 0.992 -6.568 -7.814 1.00 . A A . 15 GLU HB3 1 1 11 9737 1 1 15 GLU HG2 H 2.835 -5.898 -8.962 1.00 . A A . 15 GLU HG2 1 1 11 9738 1 1 15 GLU HG3 H 3.689 -6.175 -7.443 1.00 . A A . 15 GLU HG3 1 1 11 9739 1 1 15 GLU N N 2.954 -8.488 -5.822 1.00 . A A . 15 GLU N 1 1 11 9740 1 1 15 GLU O O -0.371 -7.147 -5.849 1.00 . A A . 15 GLU O 1 1 11 9741 1 1 15 GLU OE1 O 4.271 -8.689 -8.180 1.00 . A A . 15 GLU OE1 1 1 11 9742 1 1 15 GLU OE2 O 4.167 -7.655 -10.067 1.00 . A A . 15 GLU OE2 1 1 11 9743 1 1 16 SER C C -1.424 -7.547 -3.516 1.00 . A A . 16 SER C 1 1 11 9744 1 1 16 SER CA C -0.663 -8.845 -3.789 1.00 . A A . 16 SER CA 1 1 11 9745 1 1 16 SER CB C -0.391 -9.561 -2.466 1.00 . A A . 16 SER CB 1 1 11 9746 1 1 16 SER H H 1.460 -8.935 -4.148 1.00 . A A . 16 SER H 1 1 11 9747 1 1 16 SER HA H -1.253 -9.482 -4.431 1.00 . A A . 16 SER HA 1 1 11 9748 1 1 16 SER HB2 H 0.597 -9.992 -2.485 1.00 . A A . 16 SER HB2 1 1 11 9749 1 1 16 SER HB3 H -0.456 -8.851 -1.653 1.00 . A A . 16 SER HB3 1 1 11 9750 1 1 16 SER HG H -1.077 -11.125 -1.533 1.00 . A A . 16 SER HG 1 1 11 9751 1 1 16 SER N N 0.628 -8.520 -4.458 1.00 . A A . 16 SER N 1 1 11 9752 1 1 16 SER O O -2.534 -7.358 -3.971 1.00 . A A . 16 SER O 1 1 11 9753 1 1 16 SER OG O -1.349 -10.596 -2.286 1.00 . A A . 16 SER OG 1 1 11 9754 1 1 17 CYS C C -1.980 -4.722 -3.789 1.00 . A A . 17 CYS C 1 1 11 9755 1 1 17 CYS CA C -1.511 -5.359 -2.481 1.00 . A A . 17 CYS CA 1 1 11 9756 1 1 17 CYS CB C -0.529 -4.418 -1.782 1.00 . A A . 17 CYS CB 1 1 11 9757 1 1 17 CYS H H 0.068 -6.821 -2.428 1.00 . A A . 17 CYS H 1 1 11 9758 1 1 17 CYS HA H -2.360 -5.536 -1.840 1.00 . A A . 17 CYS HA 1 1 11 9759 1 1 17 CYS HB2 H -1.061 -3.558 -1.406 1.00 . A A . 17 CYS HB2 1 1 11 9760 1 1 17 CYS HB3 H -0.056 -4.937 -0.962 1.00 . A A . 17 CYS HB3 1 1 11 9761 1 1 17 CYS N N -0.830 -6.649 -2.780 1.00 . A A . 17 CYS N 1 1 11 9762 1 1 17 CYS O O -3.150 -4.446 -3.971 1.00 . A A . 17 CYS O 1 1 11 9763 1 1 17 CYS SG S 0.799 -3.802 -2.879 1.00 . A A . 17 CYS SG 1 1 11 9764 1 1 18 VAL C C -2.741 -4.565 -6.513 1.00 . A A . 18 VAL C 1 1 11 9765 1 1 18 VAL CA C -1.480 -3.871 -5.996 1.00 . A A . 18 VAL CA 1 1 11 9766 1 1 18 VAL CB C -0.350 -4.027 -7.014 1.00 . A A . 18 VAL CB 1 1 11 9767 1 1 18 VAL CG1 C -0.802 -3.475 -8.366 1.00 . A A . 18 VAL CG1 1 1 11 9768 1 1 18 VAL CG2 C 0.876 -3.248 -6.532 1.00 . A A . 18 VAL CG2 1 1 11 9769 1 1 18 VAL H H -0.141 -4.718 -4.538 1.00 . A A . 18 VAL H 1 1 11 9770 1 1 18 VAL HA H -1.686 -2.821 -5.844 1.00 . A A . 18 VAL HA 1 1 11 9771 1 1 18 VAL HB H -0.099 -5.073 -7.117 1.00 . A A . 18 VAL HB 1 1 11 9772 1 1 18 VAL HG11 H -1.777 -3.869 -8.610 1.00 . A A . 18 VAL HG11 1 1 11 9773 1 1 18 VAL HG12 H -0.852 -2.397 -8.317 1.00 . A A . 18 VAL HG12 1 1 11 9774 1 1 18 VAL HG13 H -0.095 -3.767 -9.129 1.00 . A A . 18 VAL HG13 1 1 11 9775 1 1 18 VAL HG21 H 0.576 -2.530 -5.784 1.00 . A A . 18 VAL HG21 1 1 11 9776 1 1 18 VAL HG22 H 1.594 -3.935 -6.106 1.00 . A A . 18 VAL HG22 1 1 11 9777 1 1 18 VAL HG23 H 1.326 -2.732 -7.368 1.00 . A A . 18 VAL HG23 1 1 11 9778 1 1 18 VAL N N -1.079 -4.487 -4.702 1.00 . A A . 18 VAL N 1 1 11 9779 1 1 18 VAL O O -3.540 -3.977 -7.214 1.00 . A A . 18 VAL O 1 1 11 9780 1 1 19 GLU C C -5.309 -6.188 -5.710 1.00 . A A . 19 GLU C 1 1 11 9781 1 1 19 GLU CA C -4.152 -6.528 -6.634 1.00 . A A . 19 GLU CA 1 1 11 9782 1 1 19 GLU CB C -3.907 -8.039 -6.628 1.00 . A A . 19 GLU CB 1 1 11 9783 1 1 19 GLU CD C -5.752 -9.278 -7.768 1.00 . A A . 19 GLU CD 1 1 11 9784 1 1 19 GLU CG C -4.376 -8.638 -7.955 1.00 . A A . 19 GLU CG 1 1 11 9785 1 1 19 GLU H H -2.283 -6.268 -5.595 1.00 . A A . 19 GLU H 1 1 11 9786 1 1 19 GLU HA H -4.395 -6.198 -7.628 1.00 . A A . 19 GLU HA 1 1 11 9787 1 1 19 GLU HB2 H -2.852 -8.233 -6.496 1.00 . A A . 19 GLU HB2 1 1 11 9788 1 1 19 GLU HB3 H -4.461 -8.490 -5.818 1.00 . A A . 19 GLU HB3 1 1 11 9789 1 1 19 GLU HG2 H -4.439 -7.856 -8.700 1.00 . A A . 19 GLU HG2 1 1 11 9790 1 1 19 GLU HG3 H -3.672 -9.389 -8.280 1.00 . A A . 19 GLU HG3 1 1 11 9791 1 1 19 GLU N N -2.933 -5.810 -6.166 1.00 . A A . 19 GLU N 1 1 11 9792 1 1 19 GLU O O -6.428 -5.997 -6.143 1.00 . A A . 19 GLU O 1 1 11 9793 1 1 19 GLU OE1 O -6.684 -8.554 -7.462 1.00 . A A . 19 GLU OE1 1 1 11 9794 1 1 19 GLU OE2 O -5.851 -10.483 -7.934 1.00 . A A . 19 GLU OE2 1 1 11 9795 1 1 20 ILE C C -6.180 -4.167 -3.438 1.00 . A A . 20 ILE C 1 1 11 9796 1 1 20 ILE CA C -6.129 -5.693 -3.503 1.00 . A A . 20 ILE CA 1 1 11 9797 1 1 20 ILE CB C -5.836 -6.258 -2.116 1.00 . A A . 20 ILE CB 1 1 11 9798 1 1 20 ILE CD1 C -4.052 -7.910 -1.619 1.00 . A A . 20 ILE CD1 1 1 11 9799 1 1 20 ILE CG1 C -5.440 -7.706 -2.231 1.00 . A A . 20 ILE CG1 1 1 11 9800 1 1 20 ILE CG2 C -7.079 -6.142 -1.234 1.00 . A A . 20 ILE CG2 1 1 11 9801 1 1 20 ILE H H -4.132 -6.197 -4.116 1.00 . A A . 20 ILE H 1 1 11 9802 1 1 20 ILE HA H -7.072 -6.078 -3.861 1.00 . A A . 20 ILE HA 1 1 11 9803 1 1 20 ILE HB H -5.036 -5.729 -1.672 1.00 . A A . 20 ILE HB 1 1 11 9804 1 1 20 ILE HD11 H -3.520 -6.972 -1.613 1.00 . A A . 20 ILE HD11 1 1 11 9805 1 1 20 ILE HD12 H -4.156 -8.271 -0.606 1.00 . A A . 20 ILE HD12 1 1 11 9806 1 1 20 ILE HD13 H -3.502 -8.633 -2.203 1.00 . A A . 20 ILE HD13 1 1 11 9807 1 1 20 ILE HG12 H -6.152 -8.290 -1.703 1.00 . A A . 20 ILE HG12 1 1 11 9808 1 1 20 ILE HG13 H -5.421 -7.987 -3.265 1.00 . A A . 20 ILE HG13 1 1 11 9809 1 1 20 ILE HG21 H -7.942 -5.950 -1.854 1.00 . A A . 20 ILE HG21 1 1 11 9810 1 1 20 ILE HG22 H -7.222 -7.064 -0.693 1.00 . A A . 20 ILE HG22 1 1 11 9811 1 1 20 ILE HG23 H -6.950 -5.329 -0.534 1.00 . A A . 20 ILE HG23 1 1 11 9812 1 1 20 ILE N N -5.046 -6.069 -4.443 1.00 . A A . 20 ILE N 1 1 11 9813 1 1 20 ILE O O -6.732 -3.589 -2.523 1.00 . A A . 20 ILE O 1 1 11 9814 1 1 21 ALA C C -4.694 -1.534 -5.555 1.00 . A A . 21 ALA C 1 1 11 9815 1 1 21 ALA CA C -5.594 -2.022 -4.419 1.00 . A A . 21 ALA CA 1 1 11 9816 1 1 21 ALA CB C -5.057 -1.503 -3.083 1.00 . A A . 21 ALA CB 1 1 11 9817 1 1 21 ALA H H -5.152 -4.002 -5.142 1.00 . A A . 21 ALA H 1 1 11 9818 1 1 21 ALA HA H -6.599 -1.658 -4.572 1.00 . A A . 21 ALA HA 1 1 11 9819 1 1 21 ALA HB1 H -4.141 -2.022 -2.839 1.00 . A A . 21 ALA HB1 1 1 11 9820 1 1 21 ALA HB2 H -4.860 -0.444 -3.160 1.00 . A A . 21 ALA HB2 1 1 11 9821 1 1 21 ALA HB3 H -5.788 -1.679 -2.308 1.00 . A A . 21 ALA HB3 1 1 11 9822 1 1 21 ALA N N -5.596 -3.510 -4.412 1.00 . A A . 21 ALA N 1 1 11 9823 1 1 21 ALA O O -3.676 -0.912 -5.321 1.00 . A A . 21 ALA O 1 1 11 9824 1 1 22 PRO C C -4.493 0.067 -8.221 1.00 . A A . 22 PRO C 1 1 11 9825 1 1 22 PRO CA C -4.328 -1.432 -7.956 1.00 . A A . 22 PRO CA 1 1 11 9826 1 1 22 PRO CB C -4.949 -2.257 -9.083 1.00 . A A . 22 PRO CB 1 1 11 9827 1 1 22 PRO CD C -6.318 -2.587 -7.104 1.00 . A A . 22 PRO CD 1 1 11 9828 1 1 22 PRO CG C -6.339 -2.568 -8.617 1.00 . A A . 22 PRO CG 1 1 11 9829 1 1 22 PRO HA H -3.286 -1.688 -7.841 1.00 . A A . 22 PRO HA 1 1 11 9830 1 1 22 PRO HB2 H -4.943 -1.673 -9.994 1.00 . A A . 22 PRO HB2 1 1 11 9831 1 1 22 PRO HB3 H -4.372 -3.156 -9.229 1.00 . A A . 22 PRO HB3 1 1 11 9832 1 1 22 PRO HD2 H -7.197 -2.097 -6.710 1.00 . A A . 22 PRO HD2 1 1 11 9833 1 1 22 PRO HD3 H -6.252 -3.599 -6.740 1.00 . A A . 22 PRO HD3 1 1 11 9834 1 1 22 PRO HG2 H -7.018 -1.805 -8.970 1.00 . A A . 22 PRO HG2 1 1 11 9835 1 1 22 PRO HG3 H -6.640 -3.534 -8.989 1.00 . A A . 22 PRO HG3 1 1 11 9836 1 1 22 PRO N N -5.104 -1.840 -6.755 1.00 . A A . 22 PRO N 1 1 11 9837 1 1 22 PRO O O -3.971 0.598 -9.183 1.00 . A A . 22 PRO O 1 1 11 9838 1 1 23 GLY C C -4.720 2.982 -6.451 1.00 . A A . 23 GLY C 1 1 11 9839 1 1 23 GLY CA C -5.405 2.217 -7.584 1.00 . A A . 23 GLY CA 1 1 11 9840 1 1 23 GLY H H -5.625 0.310 -6.609 1.00 . A A . 23 GLY H 1 1 11 9841 1 1 23 GLY HA2 H -4.973 2.507 -8.532 1.00 . A A . 23 GLY HA2 1 1 11 9842 1 1 23 GLY HA3 H -6.460 2.446 -7.582 1.00 . A A . 23 GLY HA3 1 1 11 9843 1 1 23 GLY N N -5.212 0.755 -7.378 1.00 . A A . 23 GLY N 1 1 11 9844 1 1 23 GLY O O -4.384 4.141 -6.588 1.00 . A A . 23 GLY O 1 1 11 9845 1 1 24 ALA C C -2.455 2.447 -3.968 1.00 . A A . 24 ALA C 1 1 11 9846 1 1 24 ALA CA C -3.850 3.036 -4.187 1.00 . A A . 24 ALA CA 1 1 11 9847 1 1 24 ALA CB C -4.687 2.847 -2.922 1.00 . A A . 24 ALA CB 1 1 11 9848 1 1 24 ALA H H -4.793 1.410 -5.240 1.00 . A A . 24 ALA H 1 1 11 9849 1 1 24 ALA HA H -3.764 4.090 -4.406 1.00 . A A . 24 ALA HA 1 1 11 9850 1 1 24 ALA HB1 H -5.484 2.146 -3.120 1.00 . A A . 24 ALA HB1 1 1 11 9851 1 1 24 ALA HB2 H -4.060 2.464 -2.130 1.00 . A A . 24 ALA HB2 1 1 11 9852 1 1 24 ALA HB3 H -5.107 3.796 -2.621 1.00 . A A . 24 ALA HB3 1 1 11 9853 1 1 24 ALA N N -4.512 2.344 -5.330 1.00 . A A . 24 ALA N 1 1 11 9854 1 1 24 ALA O O -1.547 3.120 -3.527 1.00 . A A . 24 ALA O 1 1 11 9855 1 1 25 PHE C C -0.388 0.177 -5.473 1.00 . A A . 25 PHE C 1 1 11 9856 1 1 25 PHE CA C -0.942 0.559 -4.093 1.00 . A A . 25 PHE CA 1 1 11 9857 1 1 25 PHE CB C -1.097 -0.708 -3.243 1.00 . A A . 25 PHE CB 1 1 11 9858 1 1 25 PHE CD1 C -0.952 0.655 -1.118 1.00 . A A . 25 PHE CD1 1 1 11 9859 1 1 25 PHE CD2 C 0.310 -1.409 -1.274 1.00 . A A . 25 PHE CD2 1 1 11 9860 1 1 25 PHE CE1 C -0.459 0.857 0.180 1.00 . A A . 25 PHE CE1 1 1 11 9861 1 1 25 PHE CE2 C 0.803 -1.209 0.022 1.00 . A A . 25 PHE CE2 1 1 11 9862 1 1 25 PHE CG C -0.566 -0.478 -1.845 1.00 . A A . 25 PHE CG 1 1 11 9863 1 1 25 PHE CZ C 0.421 -0.075 0.749 1.00 . A A . 25 PHE CZ 1 1 11 9864 1 1 25 PHE H H -3.024 0.666 -4.634 1.00 . A A . 25 PHE H 1 1 11 9865 1 1 25 PHE HA H -0.273 1.257 -3.602 1.00 . A A . 25 PHE HA 1 1 11 9866 1 1 25 PHE HB2 H -2.143 -0.973 -3.187 1.00 . A A . 25 PHE HB2 1 1 11 9867 1 1 25 PHE HB3 H -0.549 -1.516 -3.705 1.00 . A A . 25 PHE HB3 1 1 11 9868 1 1 25 PHE HD1 H -1.631 1.373 -1.555 1.00 . A A . 25 PHE HD1 1 1 11 9869 1 1 25 PHE HD2 H 0.608 -2.282 -1.835 1.00 . A A . 25 PHE HD2 1 1 11 9870 1 1 25 PHE HE1 H -0.754 1.731 0.740 1.00 . A A . 25 PHE HE1 1 1 11 9871 1 1 25 PHE HE2 H 1.479 -1.929 0.458 1.00 . A A . 25 PHE HE2 1 1 11 9872 1 1 25 PHE HZ H 0.802 0.079 1.744 1.00 . A A . 25 PHE HZ 1 1 11 9873 1 1 25 PHE N N -2.278 1.193 -4.277 1.00 . A A . 25 PHE N 1 1 11 9874 1 1 25 PHE O O -1.065 -0.447 -6.265 1.00 . A A . 25 PHE O 1 1 11 9875 1 1 26 ALA C C 2.929 0.239 -7.074 1.00 . A A . 26 ALA C 1 1 11 9876 1 1 26 ALA CA C 1.396 0.197 -7.115 1.00 . A A . 26 ALA CA 1 1 11 9877 1 1 26 ALA CB C 0.890 1.199 -8.155 1.00 . A A . 26 ALA CB 1 1 11 9878 1 1 26 ALA H H 1.365 1.054 -5.131 1.00 . A A . 26 ALA H 1 1 11 9879 1 1 26 ALA HA H 1.074 -0.795 -7.391 1.00 . A A . 26 ALA HA 1 1 11 9880 1 1 26 ALA HB1 H 0.907 2.195 -7.735 1.00 . A A . 26 ALA HB1 1 1 11 9881 1 1 26 ALA HB2 H 1.527 1.166 -9.027 1.00 . A A . 26 ALA HB2 1 1 11 9882 1 1 26 ALA HB3 H -0.121 0.946 -8.437 1.00 . A A . 26 ALA HB3 1 1 11 9883 1 1 26 ALA N N 0.830 0.547 -5.776 1.00 . A A . 26 ALA N 1 1 11 9884 1 1 26 ALA O O 3.521 1.034 -6.375 1.00 . A A . 26 ALA O 1 1 11 9885 1 1 27 MET C C 5.567 0.587 -8.639 1.00 . A A . 27 MET C 1 1 11 9886 1 1 27 MET CA C 5.068 -0.626 -7.852 1.00 . A A . 27 MET CA 1 1 11 9887 1 1 27 MET CB C 5.549 -1.916 -8.529 1.00 . A A . 27 MET CB 1 1 11 9888 1 1 27 MET CE C 7.941 -4.272 -9.675 1.00 . A A . 27 MET CE 1 1 11 9889 1 1 27 MET CG C 7.078 -1.941 -8.589 1.00 . A A . 27 MET CG 1 1 11 9890 1 1 27 MET H H 3.073 -1.240 -8.394 1.00 . A A . 27 MET H 1 1 11 9891 1 1 27 MET HA H 5.436 -0.583 -6.847 1.00 . A A . 27 MET HA 1 1 11 9892 1 1 27 MET HB2 H 5.197 -2.768 -7.966 1.00 . A A . 27 MET HB2 1 1 11 9893 1 1 27 MET HB3 H 5.152 -1.962 -9.533 1.00 . A A . 27 MET HB3 1 1 11 9894 1 1 27 MET HE1 H 7.301 -4.521 -8.839 1.00 . A A . 27 MET HE1 1 1 11 9895 1 1 27 MET HE2 H 7.741 -4.948 -10.491 1.00 . A A . 27 MET HE2 1 1 11 9896 1 1 27 MET HE3 H 8.978 -4.362 -9.381 1.00 . A A . 27 MET HE3 1 1 11 9897 1 1 27 MET HG2 H 7.463 -0.944 -8.451 1.00 . A A . 27 MET HG2 1 1 11 9898 1 1 27 MET HG3 H 7.459 -2.582 -7.808 1.00 . A A . 27 MET HG3 1 1 11 9899 1 1 27 MET N N 3.574 -0.612 -7.832 1.00 . A A . 27 MET N 1 1 11 9900 1 1 27 MET O O 4.881 1.073 -9.517 1.00 . A A . 27 MET O 1 1 11 9901 1 1 27 MET SD S 7.610 -2.574 -10.200 1.00 . A A . 27 MET SD 1 1 11 9902 1 1 28 ASP C C 8.635 2.022 -9.563 1.00 . A A . 28 ASP C 1 1 11 9903 1 1 28 ASP CA C 7.203 2.271 -9.136 1.00 . A A . 28 ASP CA 1 1 11 9904 1 1 28 ASP CB C 7.139 3.505 -8.246 1.00 . A A . 28 ASP CB 1 1 11 9905 1 1 28 ASP CG C 6.535 4.676 -9.020 1.00 . A A . 28 ASP CG 1 1 11 9906 1 1 28 ASP H H 7.337 0.723 -7.645 1.00 . A A . 28 ASP H 1 1 11 9907 1 1 28 ASP HA H 6.576 2.409 -10.004 1.00 . A A . 28 ASP HA 1 1 11 9908 1 1 28 ASP HB2 H 6.527 3.290 -7.381 1.00 . A A . 28 ASP HB2 1 1 11 9909 1 1 28 ASP HB3 H 8.136 3.753 -7.925 1.00 . A A . 28 ASP HB3 1 1 11 9910 1 1 28 ASP N N 6.746 1.100 -8.360 1.00 . A A . 28 ASP N 1 1 11 9911 1 1 28 ASP O O 9.271 1.140 -9.030 1.00 . A A . 28 ASP O 1 1 11 9912 1 1 28 ASP OD1 O 5.929 4.430 -10.050 1.00 . A A . 28 ASP OD1 1 1 11 9913 1 1 28 ASP OD2 O 6.687 5.800 -8.570 1.00 . A A . 28 ASP OD2 1 1 11 9914 1 1 29 PRO C C 11.386 3.466 -10.024 1.00 . A A . 29 PRO C 1 1 11 9915 1 1 29 PRO CA C 10.488 2.684 -10.975 1.00 . A A . 29 PRO CA 1 1 11 9916 1 1 29 PRO CB C 10.449 3.317 -12.364 1.00 . A A . 29 PRO CB 1 1 11 9917 1 1 29 PRO CD C 8.396 3.905 -11.162 1.00 . A A . 29 PRO CD 1 1 11 9918 1 1 29 PRO CG C 9.288 4.271 -12.335 1.00 . A A . 29 PRO CG 1 1 11 9919 1 1 29 PRO HA H 10.785 1.649 -11.033 1.00 . A A . 29 PRO HA 1 1 11 9920 1 1 29 PRO HB2 H 11.388 3.822 -12.550 1.00 . A A . 29 PRO HB2 1 1 11 9921 1 1 29 PRO HB3 H 10.306 2.546 -13.104 1.00 . A A . 29 PRO HB3 1 1 11 9922 1 1 29 PRO HD2 H 8.290 4.753 -10.503 1.00 . A A . 29 PRO HD2 1 1 11 9923 1 1 29 PRO HD3 H 7.433 3.574 -11.505 1.00 . A A . 29 PRO HD3 1 1 11 9924 1 1 29 PRO HG2 H 9.655 5.281 -12.215 1.00 . A A . 29 PRO HG2 1 1 11 9925 1 1 29 PRO HG3 H 8.728 4.189 -13.254 1.00 . A A . 29 PRO HG3 1 1 11 9926 1 1 29 PRO N N 9.102 2.814 -10.492 1.00 . A A . 29 PRO N 1 1 11 9927 1 1 29 PRO O O 12.586 3.280 -9.971 1.00 . A A . 29 PRO O 1 1 11 9928 1 1 30 GLU C C 11.675 4.247 -7.002 1.00 . A A . 30 GLU C 1 1 11 9929 1 1 30 GLU CA C 11.549 5.109 -8.249 1.00 . A A . 30 GLU CA 1 1 11 9930 1 1 30 GLU CB C 10.790 6.394 -7.911 1.00 . A A . 30 GLU CB 1 1 11 9931 1 1 30 GLU CD C 11.600 8.689 -8.481 1.00 . A A . 30 GLU CD 1 1 11 9932 1 1 30 GLU CG C 11.787 7.494 -7.543 1.00 . A A . 30 GLU CG 1 1 11 9933 1 1 30 GLU H H 9.808 4.418 -9.298 1.00 . A A . 30 GLU H 1 1 11 9934 1 1 30 GLU HA H 12.529 5.345 -8.637 1.00 . A A . 30 GLU HA 1 1 11 9935 1 1 30 GLU HB2 H 10.207 6.705 -8.766 1.00 . A A . 30 GLU HB2 1 1 11 9936 1 1 30 GLU HB3 H 10.133 6.216 -7.074 1.00 . A A . 30 GLU HB3 1 1 11 9937 1 1 30 GLU HG2 H 11.617 7.806 -6.523 1.00 . A A . 30 GLU HG2 1 1 11 9938 1 1 30 GLU HG3 H 12.794 7.115 -7.642 1.00 . A A . 30 GLU HG3 1 1 11 9939 1 1 30 GLU N N 10.782 4.321 -9.245 1.00 . A A . 30 GLU N 1 1 11 9940 1 1 30 GLU O O 12.708 4.191 -6.363 1.00 . A A . 30 GLU O 1 1 11 9941 1 1 30 GLU OE1 O 11.391 8.463 -9.662 1.00 . A A . 30 GLU OE1 1 1 11 9942 1 1 30 GLU OE2 O 11.670 9.809 -8.003 1.00 . A A . 30 GLU OE2 1 1 11 9943 1 1 31 ILE C C 10.806 1.205 -5.990 1.00 . A A . 31 ILE C 1 1 11 9944 1 1 31 ILE CA C 10.676 2.638 -5.503 1.00 . A A . 31 ILE CA 1 1 11 9945 1 1 31 ILE CB C 9.414 2.783 -4.645 1.00 . A A . 31 ILE CB 1 1 11 9946 1 1 31 ILE CD1 C 8.124 4.634 -5.776 1.00 . A A . 31 ILE CD1 1 1 11 9947 1 1 31 ILE CG1 C 8.213 3.121 -5.538 1.00 . A A . 31 ILE CG1 1 1 11 9948 1 1 31 ILE CG2 C 9.632 3.883 -3.601 1.00 . A A . 31 ILE CG2 1 1 11 9949 1 1 31 ILE H H 9.821 3.581 -7.228 1.00 . A A . 31 ILE H 1 1 11 9950 1 1 31 ILE HA H 11.522 2.873 -4.919 1.00 . A A . 31 ILE HA 1 1 11 9951 1 1 31 ILE HB H 9.228 1.848 -4.136 1.00 . A A . 31 ILE HB 1 1 11 9952 1 1 31 ILE HD11 H 8.100 5.149 -4.826 1.00 . A A . 31 ILE HD11 1 1 11 9953 1 1 31 ILE HD12 H 8.984 4.962 -6.338 1.00 . A A . 31 ILE HD12 1 1 11 9954 1 1 31 ILE HD13 H 7.225 4.859 -6.329 1.00 . A A . 31 ILE HD13 1 1 11 9955 1 1 31 ILE HG12 H 8.325 2.614 -6.483 1.00 . A A . 31 ILE HG12 1 1 11 9956 1 1 31 ILE HG13 H 7.309 2.783 -5.057 1.00 . A A . 31 ILE HG13 1 1 11 9957 1 1 31 ILE HG21 H 10.336 4.608 -3.982 1.00 . A A . 31 ILE HG21 1 1 11 9958 1 1 31 ILE HG22 H 8.692 4.371 -3.390 1.00 . A A . 31 ILE HG22 1 1 11 9959 1 1 31 ILE HG23 H 10.022 3.446 -2.694 1.00 . A A . 31 ILE HG23 1 1 11 9960 1 1 31 ILE N N 10.628 3.539 -6.678 1.00 . A A . 31 ILE N 1 1 11 9961 1 1 31 ILE O O 10.851 0.285 -5.202 1.00 . A A . 31 ILE O 1 1 11 9962 1 1 32 GLU C C 10.178 -1.301 -6.970 1.00 . A A . 32 GLU C 1 1 11 9963 1 1 32 GLU CA C 10.972 -0.362 -7.857 1.00 . A A . 32 GLU CA 1 1 11 9964 1 1 32 GLU CB C 12.438 -0.798 -7.902 1.00 . A A . 32 GLU CB 1 1 11 9965 1 1 32 GLU CD C 14.797 0.005 -8.090 1.00 . A A . 32 GLU CD 1 1 11 9966 1 1 32 GLU CG C 13.326 0.418 -8.175 1.00 . A A . 32 GLU CG 1 1 11 9967 1 1 32 GLU H H 10.819 1.782 -7.897 1.00 . A A . 32 GLU H 1 1 11 9968 1 1 32 GLU HA H 10.551 -0.368 -8.851 1.00 . A A . 32 GLU HA 1 1 11 9969 1 1 32 GLU HB2 H 12.711 -1.238 -6.954 1.00 . A A . 32 GLU HB2 1 1 11 9970 1 1 32 GLU HB3 H 12.574 -1.524 -8.689 1.00 . A A . 32 GLU HB3 1 1 11 9971 1 1 32 GLU HG2 H 13.116 0.801 -9.163 1.00 . A A . 32 GLU HG2 1 1 11 9972 1 1 32 GLU HG3 H 13.125 1.183 -7.441 1.00 . A A . 32 GLU HG3 1 1 11 9973 1 1 32 GLU N N 10.861 1.015 -7.291 1.00 . A A . 32 GLU N 1 1 11 9974 1 1 32 GLU O O 10.553 -2.429 -6.723 1.00 . A A . 32 GLU O 1 1 11 9975 1 1 32 GLU OE1 O 15.088 -1.143 -8.383 1.00 . A A . 32 GLU OE1 1 1 11 9976 1 1 32 GLU OE2 O 15.608 0.845 -7.734 1.00 . A A . 32 GLU OE2 1 1 11 9977 1 1 33 LYS C C 6.960 -0.905 -5.239 1.00 . A A . 33 LYS C 1 1 11 9978 1 1 33 LYS CA C 8.255 -1.642 -5.548 1.00 . A A . 33 LYS CA 1 1 11 9979 1 1 33 LYS CB C 9.019 -1.894 -4.245 1.00 . A A . 33 LYS CB 1 1 11 9980 1 1 33 LYS CD C 11.140 -3.201 -4.046 1.00 . A A . 33 LYS CD 1 1 11 9981 1 1 33 LYS CE C 11.851 -4.272 -4.876 1.00 . A A . 33 LYS CE 1 1 11 9982 1 1 33 LYS CG C 9.631 -3.296 -4.280 1.00 . A A . 33 LYS CG 1 1 11 9983 1 1 33 LYS H H 8.824 0.127 -6.679 1.00 . A A . 33 LYS H 1 1 11 9984 1 1 33 LYS HA H 8.029 -2.586 -6.016 1.00 . A A . 33 LYS HA 1 1 11 9985 1 1 33 LYS HB2 H 9.803 -1.159 -4.138 1.00 . A A . 33 LYS HB2 1 1 11 9986 1 1 33 LYS HB3 H 8.339 -1.820 -3.411 1.00 . A A . 33 LYS HB3 1 1 11 9987 1 1 33 LYS HD2 H 11.490 -2.224 -4.344 1.00 . A A . 33 LYS HD2 1 1 11 9988 1 1 33 LYS HD3 H 11.354 -3.359 -3.000 1.00 . A A . 33 LYS HD3 1 1 11 9989 1 1 33 LYS HE2 H 11.159 -5.068 -5.106 1.00 . A A . 33 LYS HE2 1 1 11 9990 1 1 33 LYS HE3 H 12.214 -3.834 -5.795 1.00 . A A . 33 LYS HE3 1 1 11 9991 1 1 33 LYS HG2 H 9.185 -3.902 -3.506 1.00 . A A . 33 LYS HG2 1 1 11 9992 1 1 33 LYS HG3 H 9.446 -3.746 -5.243 1.00 . A A . 33 LYS HG3 1 1 11 9993 1 1 33 LYS HZ1 H 13.490 -4.044 -3.612 1.00 . A A . 33 LYS HZ1 1 1 11 9994 1 1 33 LYS HZ2 H 12.650 -5.505 -3.402 1.00 . A A . 33 LYS HZ2 1 1 11 9995 1 1 33 LYS HZ3 H 13.663 -5.289 -4.749 1.00 . A A . 33 LYS HZ3 1 1 11 9996 1 1 33 LYS N N 9.087 -0.810 -6.463 1.00 . A A . 33 LYS N 1 1 11 9997 1 1 33 LYS NZ N 13.000 -4.819 -4.101 1.00 . A A . 33 LYS NZ 1 1 11 9998 1 1 33 LYS O O 6.819 0.265 -5.534 1.00 . A A . 33 LYS O 1 1 11 9999 1 1 34 ALA C C 4.917 0.499 -3.887 1.00 . A A . 34 ALA C 1 1 11 10000 1 1 34 ALA CA C 4.701 -0.945 -4.345 1.00 . A A . 34 ALA CA 1 1 11 10001 1 1 34 ALA CB C 4.007 -1.729 -3.231 1.00 . A A . 34 ALA CB 1 1 11 10002 1 1 34 ALA H H 6.149 -2.534 -4.451 1.00 . A A . 34 ALA H 1 1 11 10003 1 1 34 ALA HA H 4.077 -0.949 -5.226 1.00 . A A . 34 ALA HA 1 1 11 10004 1 1 34 ALA HB1 H 4.574 -2.623 -3.013 1.00 . A A . 34 ALA HB1 1 1 11 10005 1 1 34 ALA HB2 H 3.945 -1.117 -2.344 1.00 . A A . 34 ALA HB2 1 1 11 10006 1 1 34 ALA HB3 H 3.013 -2.003 -3.550 1.00 . A A . 34 ALA HB3 1 1 11 10007 1 1 34 ALA N N 6.008 -1.588 -4.664 1.00 . A A . 34 ALA N 1 1 11 10008 1 1 34 ALA O O 5.980 0.868 -3.432 1.00 . A A . 34 ALA O 1 1 11 10009 1 1 35 TYR C C 2.609 3.297 -3.426 1.00 . A A . 35 TYR C 1 1 11 10010 1 1 35 TYR CA C 4.023 2.735 -3.581 1.00 . A A . 35 TYR CA 1 1 11 10011 1 1 35 TYR CB C 4.846 3.524 -4.620 1.00 . A A . 35 TYR CB 1 1 11 10012 1 1 35 TYR CD1 C 3.357 5.485 -5.180 1.00 . A A . 35 TYR CD1 1 1 11 10013 1 1 35 TYR CD2 C 3.746 3.796 -6.874 1.00 . A A . 35 TYR CD2 1 1 11 10014 1 1 35 TYR CE1 C 2.547 6.196 -6.074 1.00 . A A . 35 TYR CE1 1 1 11 10015 1 1 35 TYR CE2 C 2.935 4.505 -7.768 1.00 . A A . 35 TYR CE2 1 1 11 10016 1 1 35 TYR CG C 3.956 4.285 -5.580 1.00 . A A . 35 TYR CG 1 1 11 10017 1 1 35 TYR CZ C 2.337 5.705 -7.369 1.00 . A A . 35 TYR CZ 1 1 11 10018 1 1 35 TYR H H 3.063 0.986 -4.377 1.00 . A A . 35 TYR H 1 1 11 10019 1 1 35 TYR HA H 4.523 2.776 -2.622 1.00 . A A . 35 TYR HA 1 1 11 10020 1 1 35 TYR HB2 H 5.488 4.224 -4.106 1.00 . A A . 35 TYR HB2 1 1 11 10021 1 1 35 TYR HB3 H 5.458 2.832 -5.181 1.00 . A A . 35 TYR HB3 1 1 11 10022 1 1 35 TYR HD1 H 3.519 5.863 -4.180 1.00 . A A . 35 TYR HD1 1 1 11 10023 1 1 35 TYR HD2 H 4.208 2.870 -7.182 1.00 . A A . 35 TYR HD2 1 1 11 10024 1 1 35 TYR HE1 H 2.084 7.121 -5.765 1.00 . A A . 35 TYR HE1 1 1 11 10025 1 1 35 TYR HE2 H 2.772 4.127 -8.766 1.00 . A A . 35 TYR HE2 1 1 11 10026 1 1 35 TYR HH H 0.992 7.008 -7.742 1.00 . A A . 35 TYR HH 1 1 11 10027 1 1 35 TYR N N 3.908 1.313 -4.006 1.00 . A A . 35 TYR N 1 1 11 10028 1 1 35 TYR O O 1.685 2.848 -4.076 1.00 . A A . 35 TYR O 1 1 11 10029 1 1 35 TYR OH O 1.539 6.405 -8.252 1.00 . A A . 35 TYR OH 1 1 11 10030 1 1 36 VAL C C 0.565 5.464 -3.627 1.00 . A A . 36 VAL C 1 1 11 10031 1 1 36 VAL CA C 1.045 4.772 -2.353 1.00 . A A . 36 VAL CA 1 1 11 10032 1 1 36 VAL CB C 1.020 5.755 -1.179 1.00 . A A . 36 VAL CB 1 1 11 10033 1 1 36 VAL CG1 C -0.424 5.983 -0.757 1.00 . A A . 36 VAL CG1 1 1 11 10034 1 1 36 VAL CG2 C 1.765 5.188 0.003 1.00 . A A . 36 VAL CG2 1 1 11 10035 1 1 36 VAL H H 3.159 4.578 -2.012 1.00 . A A . 36 VAL H 1 1 11 10036 1 1 36 VAL HA H 0.380 3.945 -2.135 1.00 . A A . 36 VAL HA 1 1 11 10037 1 1 36 VAL HB H 1.477 6.681 -1.460 1.00 . A A . 36 VAL HB 1 1 11 10038 1 1 36 VAL HG11 H -1.082 5.653 -1.546 1.00 . A A . 36 VAL HG11 1 1 11 10039 1 1 36 VAL HG12 H -0.624 5.413 0.140 1.00 . A A . 36 VAL HG12 1 1 11 10040 1 1 36 VAL HG13 H -0.581 7.030 -0.564 1.00 . A A . 36 VAL HG13 1 1 11 10041 1 1 36 VAL HG21 H 2.720 4.802 -0.314 1.00 . A A . 36 VAL HG21 1 1 11 10042 1 1 36 VAL HG22 H 1.922 5.968 0.733 1.00 . A A . 36 VAL HG22 1 1 11 10043 1 1 36 VAL HG23 H 1.186 4.394 0.446 1.00 . A A . 36 VAL HG23 1 1 11 10044 1 1 36 VAL N N 2.416 4.242 -2.552 1.00 . A A . 36 VAL N 1 1 11 10045 1 1 36 VAL O O 0.721 6.656 -3.801 1.00 . A A . 36 VAL O 1 1 11 10046 1 1 37 LYS C C -1.487 6.462 -5.459 1.00 . A A . 37 LYS C 1 1 11 10047 1 1 37 LYS CA C -0.536 5.313 -5.781 1.00 . A A . 37 LYS CA 1 1 11 10048 1 1 37 LYS CB C -1.277 4.242 -6.585 1.00 . A A . 37 LYS CB 1 1 11 10049 1 1 37 LYS CD C -1.423 5.043 -8.945 1.00 . A A . 37 LYS CD 1 1 11 10050 1 1 37 LYS CE C -1.494 4.380 -10.322 1.00 . A A . 37 LYS CE 1 1 11 10051 1 1 37 LYS CG C -0.661 4.133 -7.980 1.00 . A A . 37 LYS CG 1 1 11 10052 1 1 37 LYS H H -0.149 3.759 -4.348 1.00 . A A . 37 LYS H 1 1 11 10053 1 1 37 LYS HA H 0.290 5.687 -6.359 1.00 . A A . 37 LYS HA 1 1 11 10054 1 1 37 LYS HB2 H -1.194 3.291 -6.079 1.00 . A A . 37 LYS HB2 1 1 11 10055 1 1 37 LYS HB3 H -2.317 4.515 -6.674 1.00 . A A . 37 LYS HB3 1 1 11 10056 1 1 37 LYS HD2 H -2.424 5.204 -8.571 1.00 . A A . 37 LYS HD2 1 1 11 10057 1 1 37 LYS HD3 H -0.913 5.989 -9.029 1.00 . A A . 37 LYS HD3 1 1 11 10058 1 1 37 LYS HE2 H -1.235 5.101 -11.083 1.00 . A A . 37 LYS HE2 1 1 11 10059 1 1 37 LYS HE3 H -0.802 3.553 -10.360 1.00 . A A . 37 LYS HE3 1 1 11 10060 1 1 37 LYS HG2 H 0.377 4.437 -7.942 1.00 . A A . 37 LYS HG2 1 1 11 10061 1 1 37 LYS HG3 H -0.724 3.112 -8.325 1.00 . A A . 37 LYS HG3 1 1 11 10062 1 1 37 LYS HZ1 H -3.549 4.672 -10.481 1.00 . A A . 37 LYS HZ1 1 1 11 10063 1 1 37 LYS HZ2 H -2.939 3.469 -11.514 1.00 . A A . 37 LYS HZ2 1 1 11 10064 1 1 37 LYS HZ3 H -3.111 3.153 -9.856 1.00 . A A . 37 LYS HZ3 1 1 11 10065 1 1 37 LYS N N -0.030 4.718 -4.517 1.00 . A A . 37 LYS N 1 1 11 10066 1 1 37 LYS NZ N -2.877 3.881 -10.562 1.00 . A A . 37 LYS NZ 1 1 11 10067 1 1 37 LYS O O -1.656 7.378 -6.238 1.00 . A A . 37 LYS O 1 1 11 10068 1 1 38 ASP C C -3.748 7.185 -2.628 1.00 . A A . 38 ASP C 1 1 11 10069 1 1 38 ASP CA C -3.056 7.517 -3.956 1.00 . A A . 38 ASP CA 1 1 11 10070 1 1 38 ASP CB C -4.095 7.666 -5.068 1.00 . A A . 38 ASP CB 1 1 11 10071 1 1 38 ASP CG C -5.208 8.611 -4.616 1.00 . A A . 38 ASP CG 1 1 11 10072 1 1 38 ASP H H -1.967 5.671 -3.700 1.00 . A A . 38 ASP H 1 1 11 10073 1 1 38 ASP HA H -2.507 8.442 -3.851 1.00 . A A . 38 ASP HA 1 1 11 10074 1 1 38 ASP HB2 H -3.619 8.068 -5.951 1.00 . A A . 38 ASP HB2 1 1 11 10075 1 1 38 ASP HB3 H -4.515 6.698 -5.299 1.00 . A A . 38 ASP HB3 1 1 11 10076 1 1 38 ASP N N -2.114 6.421 -4.317 1.00 . A A . 38 ASP N 1 1 11 10077 1 1 38 ASP O O -3.814 6.042 -2.223 1.00 . A A . 38 ASP O 1 1 11 10078 1 1 38 ASP OD1 O -4.912 9.527 -3.867 1.00 . A A . 38 ASP OD1 1 1 11 10079 1 1 38 ASP OD2 O -6.338 8.405 -5.028 1.00 . A A . 38 ASP OD2 1 1 11 10080 1 1 39 VAL C C -6.338 7.381 -0.867 1.00 . A A . 39 VAL C 1 1 11 10081 1 1 39 VAL CA C -4.923 7.924 -0.636 1.00 . A A . 39 VAL CA 1 1 11 10082 1 1 39 VAL CB C -5.002 9.230 0.158 1.00 . A A . 39 VAL CB 1 1 11 10083 1 1 39 VAL CG1 C -3.607 9.608 0.663 1.00 . A A . 39 VAL CG1 1 1 11 10084 1 1 39 VAL CG2 C -5.533 10.346 -0.745 1.00 . A A . 39 VAL CG2 1 1 11 10085 1 1 39 VAL H H -4.176 9.094 -2.286 1.00 . A A . 39 VAL H 1 1 11 10086 1 1 39 VAL HA H -4.350 7.201 -0.077 1.00 . A A . 39 VAL HA 1 1 11 10087 1 1 39 VAL HB H -5.665 9.099 1.000 1.00 . A A . 39 VAL HB 1 1 11 10088 1 1 39 VAL HG11 H -2.862 9.240 -0.028 1.00 . A A . 39 VAL HG11 1 1 11 10089 1 1 39 VAL HG12 H -3.530 10.682 0.736 1.00 . A A . 39 VAL HG12 1 1 11 10090 1 1 39 VAL HG13 H -3.444 9.168 1.635 1.00 . A A . 39 VAL HG13 1 1 11 10091 1 1 39 VAL HG21 H -6.099 9.913 -1.556 1.00 . A A . 39 VAL HG21 1 1 11 10092 1 1 39 VAL HG22 H -6.171 11.001 -0.170 1.00 . A A . 39 VAL HG22 1 1 11 10093 1 1 39 VAL HG23 H -4.705 10.911 -1.144 1.00 . A A . 39 VAL HG23 1 1 11 10094 1 1 39 VAL N N -4.251 8.178 -1.944 1.00 . A A . 39 VAL N 1 1 11 10095 1 1 39 VAL O O -6.917 6.748 -0.007 1.00 . A A . 39 VAL O 1 1 11 10096 1 1 40 GLU C C -8.230 6.132 -3.461 1.00 . A A . 40 GLU C 1 1 11 10097 1 1 40 GLU CA C -8.276 7.122 -2.295 1.00 . A A . 40 GLU CA 1 1 11 10098 1 1 40 GLU CB C -9.182 8.299 -2.663 1.00 . A A . 40 GLU CB 1 1 11 10099 1 1 40 GLU CD C -10.821 9.880 -1.635 1.00 . A A . 40 GLU CD 1 1 11 10100 1 1 40 GLU CG C -9.535 9.086 -1.399 1.00 . A A . 40 GLU CG 1 1 11 10101 1 1 40 GLU H H -6.420 8.138 -2.697 1.00 . A A . 40 GLU H 1 1 11 10102 1 1 40 GLU HA H -8.664 6.627 -1.416 1.00 . A A . 40 GLU HA 1 1 11 10103 1 1 40 GLU HB2 H -8.666 8.946 -3.358 1.00 . A A . 40 GLU HB2 1 1 11 10104 1 1 40 GLU HB3 H -10.087 7.928 -3.118 1.00 . A A . 40 GLU HB3 1 1 11 10105 1 1 40 GLU HG2 H -9.678 8.400 -0.576 1.00 . A A . 40 GLU HG2 1 1 11 10106 1 1 40 GLU HG3 H -8.732 9.769 -1.164 1.00 . A A . 40 GLU HG3 1 1 11 10107 1 1 40 GLU N N -6.900 7.625 -2.017 1.00 . A A . 40 GLU N 1 1 11 10108 1 1 40 GLU O O -9.230 5.855 -4.093 1.00 . A A . 40 GLU O 1 1 11 10109 1 1 40 GLU OE1 O -11.473 9.630 -2.636 1.00 . A A . 40 GLU OE1 1 1 11 10110 1 1 40 GLU OE2 O -11.133 10.723 -0.811 1.00 . A A . 40 GLU OE2 1 1 11 10111 1 1 41 GLY C C -7.700 3.340 -4.550 1.00 . A A . 41 GLY C 1 1 11 10112 1 1 41 GLY CA C -6.958 4.638 -4.884 1.00 . A A . 41 GLY CA 1 1 11 10113 1 1 41 GLY H H -6.279 5.844 -3.234 1.00 . A A . 41 GLY H 1 1 11 10114 1 1 41 GLY HA2 H -7.385 5.076 -5.774 1.00 . A A . 41 GLY HA2 1 1 11 10115 1 1 41 GLY HA3 H -5.916 4.417 -5.058 1.00 . A A . 41 GLY HA3 1 1 11 10116 1 1 41 GLY N N -7.074 5.603 -3.754 1.00 . A A . 41 GLY N 1 1 11 10117 1 1 41 GLY O O -7.976 2.536 -5.417 1.00 . A A . 41 GLY O 1 1 11 10118 1 1 42 ALA C C -9.659 2.136 -1.735 1.00 . A A . 42 ALA C 1 1 11 10119 1 1 42 ALA CA C -8.746 1.871 -2.935 1.00 . A A . 42 ALA CA 1 1 11 10120 1 1 42 ALA CB C -7.732 0.784 -2.576 1.00 . A A . 42 ALA CB 1 1 11 10121 1 1 42 ALA H H -7.793 3.780 -2.614 1.00 . A A . 42 ALA H 1 1 11 10122 1 1 42 ALA HA H -9.342 1.542 -3.774 1.00 . A A . 42 ALA HA 1 1 11 10123 1 1 42 ALA HB1 H -6.833 1.243 -2.194 1.00 . A A . 42 ALA HB1 1 1 11 10124 1 1 42 ALA HB2 H -8.152 0.134 -1.824 1.00 . A A . 42 ALA HB2 1 1 11 10125 1 1 42 ALA HB3 H -7.495 0.209 -3.459 1.00 . A A . 42 ALA HB3 1 1 11 10126 1 1 42 ALA N N -8.024 3.124 -3.304 1.00 . A A . 42 ALA N 1 1 11 10127 1 1 42 ALA O O -9.416 3.022 -0.941 1.00 . A A . 42 ALA O 1 1 11 10128 1 1 43 SER C C -11.043 0.995 0.816 1.00 . A A . 43 SER C 1 1 11 10129 1 1 43 SER CA C -11.645 1.579 -0.462 1.00 . A A . 43 SER CA 1 1 11 10130 1 1 43 SER CB C -12.969 0.878 -0.762 1.00 . A A . 43 SER CB 1 1 11 10131 1 1 43 SER H H -10.891 0.668 -2.257 1.00 . A A . 43 SER H 1 1 11 10132 1 1 43 SER HA H -11.823 2.636 -0.326 1.00 . A A . 43 SER HA 1 1 11 10133 1 1 43 SER HB2 H -13.117 0.070 -0.065 1.00 . A A . 43 SER HB2 1 1 11 10134 1 1 43 SER HB3 H -13.778 1.585 -0.663 1.00 . A A . 43 SER HB3 1 1 11 10135 1 1 43 SER HG H -13.523 -0.403 -2.117 1.00 . A A . 43 SER HG 1 1 11 10136 1 1 43 SER N N -10.712 1.374 -1.602 1.00 . A A . 43 SER N 1 1 11 10137 1 1 43 SER O O -10.203 0.114 0.777 1.00 . A A . 43 SER O 1 1 11 10138 1 1 43 SER OG O -12.937 0.356 -2.083 1.00 . A A . 43 SER OG 1 1 11 10139 1 1 44 GLN C C -10.967 -0.578 3.201 1.00 . A A . 44 GLN C 1 1 11 10140 1 1 44 GLN CA C -10.931 0.949 3.232 1.00 . A A . 44 GLN CA 1 1 11 10141 1 1 44 GLN CB C -11.786 1.456 4.395 1.00 . A A . 44 GLN CB 1 1 11 10142 1 1 44 GLN CD C -13.359 3.396 4.287 1.00 . A A . 44 GLN CD 1 1 11 10143 1 1 44 GLN CG C -11.887 2.982 4.329 1.00 . A A . 44 GLN CG 1 1 11 10144 1 1 44 GLN H H -12.150 2.181 1.958 1.00 . A A . 44 GLN H 1 1 11 10145 1 1 44 GLN HA H -9.912 1.282 3.359 1.00 . A A . 44 GLN HA 1 1 11 10146 1 1 44 GLN HB2 H -12.776 1.026 4.328 1.00 . A A . 44 GLN HB2 1 1 11 10147 1 1 44 GLN HB3 H -11.331 1.167 5.329 1.00 . A A . 44 GLN HB3 1 1 11 10148 1 1 44 GLN HE21 H -13.906 2.117 5.704 1.00 . A A . 44 GLN HE21 1 1 11 10149 1 1 44 GLN HE22 H -15.156 3.074 5.068 1.00 . A A . 44 GLN HE22 1 1 11 10150 1 1 44 GLN HG2 H -11.415 3.411 5.202 1.00 . A A . 44 GLN HG2 1 1 11 10151 1 1 44 GLN HG3 H -11.389 3.338 3.439 1.00 . A A . 44 GLN HG3 1 1 11 10152 1 1 44 GLN N N -11.471 1.476 1.950 1.00 . A A . 44 GLN N 1 1 11 10153 1 1 44 GLN NE2 N -14.211 2.814 5.085 1.00 . A A . 44 GLN NE2 1 1 11 10154 1 1 44 GLN O O -9.994 -1.233 3.513 1.00 . A A . 44 GLN O 1 1 11 10155 1 1 44 GLN OE1 O -13.739 4.257 3.518 1.00 . A A . 44 GLN OE1 1 1 11 10156 1 1 45 GLU C C -11.069 -3.167 1.844 1.00 . A A . 45 GLU C 1 1 11 10157 1 1 45 GLU CA C -12.159 -2.640 2.774 1.00 . A A . 45 GLU CA 1 1 11 10158 1 1 45 GLU CB C -13.530 -3.068 2.251 1.00 . A A . 45 GLU CB 1 1 11 10159 1 1 45 GLU CD C -15.506 -3.350 3.756 1.00 . A A . 45 GLU CD 1 1 11 10160 1 1 45 GLU CG C -14.625 -2.334 3.026 1.00 . A A . 45 GLU CG 1 1 11 10161 1 1 45 GLU H H -12.853 -0.608 2.568 1.00 . A A . 45 GLU H 1 1 11 10162 1 1 45 GLU HA H -12.009 -3.041 3.766 1.00 . A A . 45 GLU HA 1 1 11 10163 1 1 45 GLU HB2 H -13.606 -2.827 1.200 1.00 . A A . 45 GLU HB2 1 1 11 10164 1 1 45 GLU HB3 H -13.647 -4.133 2.386 1.00 . A A . 45 GLU HB3 1 1 11 10165 1 1 45 GLU HG2 H -14.170 -1.667 3.746 1.00 . A A . 45 GLU HG2 1 1 11 10166 1 1 45 GLU HG3 H -15.231 -1.762 2.340 1.00 . A A . 45 GLU HG3 1 1 11 10167 1 1 45 GLU N N -12.077 -1.153 2.823 1.00 . A A . 45 GLU N 1 1 11 10168 1 1 45 GLU O O -10.470 -4.195 2.092 1.00 . A A . 45 GLU O 1 1 11 10169 1 1 45 GLU OE1 O -14.956 -4.190 4.448 1.00 . A A . 45 GLU OE1 1 1 11 10170 1 1 45 GLU OE2 O -16.714 -3.270 3.609 1.00 . A A . 45 GLU OE2 1 1 11 10171 1 1 46 GLU C C -8.381 -2.682 0.512 1.00 . A A . 46 GLU C 1 1 11 10172 1 1 46 GLU CA C -9.732 -2.922 -0.153 1.00 . A A . 46 GLU CA 1 1 11 10173 1 1 46 GLU CB C -9.814 -2.132 -1.461 1.00 . A A . 46 GLU CB 1 1 11 10174 1 1 46 GLU CD C -11.286 -1.920 -3.469 1.00 . A A . 46 GLU CD 1 1 11 10175 1 1 46 GLU CG C -11.264 -2.107 -1.951 1.00 . A A . 46 GLU CG 1 1 11 10176 1 1 46 GLU H H -11.279 -1.632 0.602 1.00 . A A . 46 GLU H 1 1 11 10177 1 1 46 GLU HA H -9.854 -3.976 -0.354 1.00 . A A . 46 GLU HA 1 1 11 10178 1 1 46 GLU HB2 H -9.471 -1.121 -1.292 1.00 . A A . 46 GLU HB2 1 1 11 10179 1 1 46 GLU HB3 H -9.193 -2.604 -2.206 1.00 . A A . 46 GLU HB3 1 1 11 10180 1 1 46 GLU HG2 H -11.747 -3.038 -1.694 1.00 . A A . 46 GLU HG2 1 1 11 10181 1 1 46 GLU HG3 H -11.788 -1.288 -1.482 1.00 . A A . 46 GLU HG3 1 1 11 10182 1 1 46 GLU N N -10.795 -2.465 0.779 1.00 . A A . 46 GLU N 1 1 11 10183 1 1 46 GLU O O -7.598 -3.592 0.700 1.00 . A A . 46 GLU O 1 1 11 10184 1 1 46 GLU OE1 O -10.237 -2.052 -4.077 1.00 . A A . 46 GLU OE1 1 1 11 10185 1 1 46 GLU OE2 O -12.352 -1.649 -3.997 1.00 . A A . 46 GLU OE2 1 1 11 10186 1 1 47 VAL C C -6.627 -2.158 2.714 1.00 . A A . 47 VAL C 1 1 11 10187 1 1 47 VAL CA C -6.814 -1.168 1.554 1.00 . A A . 47 VAL CA 1 1 11 10188 1 1 47 VAL CB C -6.837 0.294 2.053 1.00 . A A . 47 VAL CB 1 1 11 10189 1 1 47 VAL CG1 C -6.505 0.386 3.548 1.00 . A A . 47 VAL CG1 1 1 11 10190 1 1 47 VAL CG2 C -5.811 1.110 1.265 1.00 . A A . 47 VAL CG2 1 1 11 10191 1 1 47 VAL H H -8.747 -0.750 0.733 1.00 . A A . 47 VAL H 1 1 11 10192 1 1 47 VAL HA H -6.008 -1.293 0.845 1.00 . A A . 47 VAL HA 1 1 11 10193 1 1 47 VAL HB H -7.821 0.708 1.885 1.00 . A A . 47 VAL HB 1 1 11 10194 1 1 47 VAL HG11 H -5.528 -0.039 3.725 1.00 . A A . 47 VAL HG11 1 1 11 10195 1 1 47 VAL HG12 H -6.510 1.421 3.855 1.00 . A A . 47 VAL HG12 1 1 11 10196 1 1 47 VAL HG13 H -7.244 -0.163 4.114 1.00 . A A . 47 VAL HG13 1 1 11 10197 1 1 47 VAL HG21 H -5.575 0.597 0.345 1.00 . A A . 47 VAL HG21 1 1 11 10198 1 1 47 VAL HG22 H -6.222 2.082 1.039 1.00 . A A . 47 VAL HG22 1 1 11 10199 1 1 47 VAL HG23 H -4.914 1.227 1.854 1.00 . A A . 47 VAL HG23 1 1 11 10200 1 1 47 VAL N N -8.107 -1.462 0.885 1.00 . A A . 47 VAL N 1 1 11 10201 1 1 47 VAL O O -5.523 -2.543 3.043 1.00 . A A . 47 VAL O 1 1 11 10202 1 1 48 GLU C C -7.091 -4.868 3.952 1.00 . A A . 48 GLU C 1 1 11 10203 1 1 48 GLU CA C -7.615 -3.519 4.452 1.00 . A A . 48 GLU CA 1 1 11 10204 1 1 48 GLU CB C -9.020 -3.679 5.001 1.00 . A A . 48 GLU CB 1 1 11 10205 1 1 48 GLU CD C -9.915 -4.187 7.275 1.00 . A A . 48 GLU CD 1 1 11 10206 1 1 48 GLU CG C -9.050 -3.230 6.454 1.00 . A A . 48 GLU CG 1 1 11 10207 1 1 48 GLU H H -8.586 -2.258 3.064 1.00 . A A . 48 GLU H 1 1 11 10208 1 1 48 GLU HA H -6.965 -3.129 5.219 1.00 . A A . 48 GLU HA 1 1 11 10209 1 1 48 GLU HB2 H -9.699 -3.069 4.424 1.00 . A A . 48 GLU HB2 1 1 11 10210 1 1 48 GLU HB3 H -9.317 -4.700 4.924 1.00 . A A . 48 GLU HB3 1 1 11 10211 1 1 48 GLU HG2 H -8.043 -3.224 6.841 1.00 . A A . 48 GLU HG2 1 1 11 10212 1 1 48 GLU HG3 H -9.462 -2.236 6.504 1.00 . A A . 48 GLU HG3 1 1 11 10213 1 1 48 GLU N N -7.703 -2.572 3.333 1.00 . A A . 48 GLU N 1 1 11 10214 1 1 48 GLU O O -5.963 -5.239 4.206 1.00 . A A . 48 GLU O 1 1 11 10215 1 1 48 GLU OE1 O -10.983 -4.541 6.804 1.00 . A A . 48 GLU OE1 1 1 11 10216 1 1 48 GLU OE2 O -9.496 -4.551 8.362 1.00 . A A . 48 GLU OE2 1 1 11 10217 1 1 49 GLU C C -6.065 -6.769 2.088 1.00 . A A . 49 GLU C 1 1 11 10218 1 1 49 GLU CA C -7.447 -6.926 2.726 1.00 . A A . 49 GLU CA 1 1 11 10219 1 1 49 GLU CB C -8.440 -7.435 1.681 1.00 . A A . 49 GLU CB 1 1 11 10220 1 1 49 GLU CD C -8.521 -9.814 2.437 1.00 . A A . 49 GLU CD 1 1 11 10221 1 1 49 GLU CG C -9.323 -8.518 2.302 1.00 . A A . 49 GLU CG 1 1 11 10222 1 1 49 GLU H H -8.810 -5.287 3.045 1.00 . A A . 49 GLU H 1 1 11 10223 1 1 49 GLU HA H -7.388 -7.631 3.541 1.00 . A A . 49 GLU HA 1 1 11 10224 1 1 49 GLU HB2 H -9.058 -6.615 1.342 1.00 . A A . 49 GLU HB2 1 1 11 10225 1 1 49 GLU HB3 H -7.902 -7.850 0.844 1.00 . A A . 49 GLU HB3 1 1 11 10226 1 1 49 GLU HG2 H -9.655 -8.195 3.278 1.00 . A A . 49 GLU HG2 1 1 11 10227 1 1 49 GLU HG3 H -10.180 -8.691 1.669 1.00 . A A . 49 GLU HG3 1 1 11 10228 1 1 49 GLU N N -7.903 -5.604 3.241 1.00 . A A . 49 GLU N 1 1 11 10229 1 1 49 GLU O O -5.201 -7.608 2.240 1.00 . A A . 49 GLU O 1 1 11 10230 1 1 49 GLU OE1 O -7.367 -9.816 2.040 1.00 . A A . 49 GLU OE1 1 1 11 10231 1 1 49 GLU OE2 O -9.074 -10.780 2.934 1.00 . A A . 49 GLU OE2 1 1 11 10232 1 1 50 ALA C C -3.451 -5.413 1.832 1.00 . A A . 50 ALA C 1 1 11 10233 1 1 50 ALA CA C -4.520 -5.477 0.743 1.00 . A A . 50 ALA CA 1 1 11 10234 1 1 50 ALA CB C -4.534 -4.159 -0.033 1.00 . A A . 50 ALA CB 1 1 11 10235 1 1 50 ALA H H -6.555 -5.026 1.276 1.00 . A A . 50 ALA H 1 1 11 10236 1 1 50 ALA HA H -4.304 -6.293 0.068 1.00 . A A . 50 ALA HA 1 1 11 10237 1 1 50 ALA HB1 H -5.410 -4.122 -0.664 1.00 . A A . 50 ALA HB1 1 1 11 10238 1 1 50 ALA HB2 H -4.557 -3.333 0.662 1.00 . A A . 50 ALA HB2 1 1 11 10239 1 1 50 ALA HB3 H -3.647 -4.091 -0.644 1.00 . A A . 50 ALA HB3 1 1 11 10240 1 1 50 ALA N N -5.848 -5.693 1.382 1.00 . A A . 50 ALA N 1 1 11 10241 1 1 50 ALA O O -2.363 -5.931 1.682 1.00 . A A . 50 ALA O 1 1 11 10242 1 1 51 MET C C -2.671 -6.033 4.745 1.00 . A A . 51 MET C 1 1 11 10243 1 1 51 MET CA C -2.767 -4.682 4.037 1.00 . A A . 51 MET CA 1 1 11 10244 1 1 51 MET CB C -3.219 -3.611 5.033 1.00 . A A . 51 MET CB 1 1 11 10245 1 1 51 MET CE C -2.329 -0.991 6.601 1.00 . A A . 51 MET CE 1 1 11 10246 1 1 51 MET CG C -2.356 -3.688 6.294 1.00 . A A . 51 MET CG 1 1 11 10247 1 1 51 MET H H -4.644 -4.372 3.030 1.00 . A A . 51 MET H 1 1 11 10248 1 1 51 MET HA H -1.801 -4.416 3.634 1.00 . A A . 51 MET HA 1 1 11 10249 1 1 51 MET HB2 H -3.115 -2.634 4.583 1.00 . A A . 51 MET HB2 1 1 11 10250 1 1 51 MET HB3 H -4.253 -3.779 5.296 1.00 . A A . 51 MET HB3 1 1 11 10251 1 1 51 MET HE1 H -2.567 -1.087 5.551 1.00 . A A . 51 MET HE1 1 1 11 10252 1 1 51 MET HE2 H -2.805 -0.108 6.996 1.00 . A A . 51 MET HE2 1 1 11 10253 1 1 51 MET HE3 H -1.258 -0.905 6.726 1.00 . A A . 51 MET HE3 1 1 11 10254 1 1 51 MET HG2 H -2.439 -4.673 6.728 1.00 . A A . 51 MET HG2 1 1 11 10255 1 1 51 MET HG3 H -1.325 -3.493 6.037 1.00 . A A . 51 MET HG3 1 1 11 10256 1 1 51 MET N N -3.758 -4.779 2.932 1.00 . A A . 51 MET N 1 1 11 10257 1 1 51 MET O O -1.641 -6.398 5.273 1.00 . A A . 51 MET O 1 1 11 10258 1 1 51 MET SD S -2.922 -2.452 7.489 1.00 . A A . 51 MET SD 1 1 11 10259 1 1 52 ASP C C -2.668 -8.994 4.738 1.00 . A A . 52 ASP C 1 1 11 10260 1 1 52 ASP CA C -3.713 -8.112 5.422 1.00 . A A . 52 ASP CA 1 1 11 10261 1 1 52 ASP CB C -5.091 -8.767 5.306 1.00 . A A . 52 ASP CB 1 1 11 10262 1 1 52 ASP CG C -5.025 -10.202 5.834 1.00 . A A . 52 ASP CG 1 1 11 10263 1 1 52 ASP H H -4.561 -6.469 4.320 1.00 . A A . 52 ASP H 1 1 11 10264 1 1 52 ASP HA H -3.457 -7.990 6.464 1.00 . A A . 52 ASP HA 1 1 11 10265 1 1 52 ASP HB2 H -5.807 -8.203 5.885 1.00 . A A . 52 ASP HB2 1 1 11 10266 1 1 52 ASP HB3 H -5.397 -8.782 4.270 1.00 . A A . 52 ASP HB3 1 1 11 10267 1 1 52 ASP N N -3.741 -6.782 4.755 1.00 . A A . 52 ASP N 1 1 11 10268 1 1 52 ASP O O -1.871 -9.644 5.385 1.00 . A A . 52 ASP O 1 1 11 10269 1 1 52 ASP OD1 O -4.512 -10.388 6.925 1.00 . A A . 52 ASP OD1 1 1 11 10270 1 1 52 ASP OD2 O -5.489 -11.090 5.140 1.00 . A A . 52 ASP OD2 1 1 11 10271 1 1 53 THR C C -0.269 -9.257 2.922 1.00 . A A . 53 THR C 1 1 11 10272 1 1 53 THR CA C -1.662 -9.853 2.711 1.00 . A A . 53 THR CA 1 1 11 10273 1 1 53 THR CB C -1.996 -9.872 1.214 1.00 . A A . 53 THR CB 1 1 11 10274 1 1 53 THR CG2 C -3.411 -10.414 1.013 1.00 . A A . 53 THR CG2 1 1 11 10275 1 1 53 THR H H -3.312 -8.482 2.929 1.00 . A A . 53 THR H 1 1 11 10276 1 1 53 THR HA H -1.687 -10.861 3.099 1.00 . A A . 53 THR HA 1 1 11 10277 1 1 53 THR HB H -1.297 -10.510 0.696 1.00 . A A . 53 THR HB 1 1 11 10278 1 1 53 THR HG1 H -1.396 -8.020 1.295 1.00 . A A . 53 THR HG1 1 1 11 10279 1 1 53 THR HG21 H -3.491 -11.392 1.464 1.00 . A A . 53 THR HG21 1 1 11 10280 1 1 53 THR HG22 H -4.123 -9.746 1.476 1.00 . A A . 53 THR HG22 1 1 11 10281 1 1 53 THR HG23 H -3.621 -10.488 -0.044 1.00 . A A . 53 THR HG23 1 1 11 10282 1 1 53 THR N N -2.663 -9.018 3.432 1.00 . A A . 53 THR N 1 1 11 10283 1 1 53 THR O O -0.012 -8.610 3.916 1.00 . A A . 53 THR O 1 1 11 10284 1 1 53 THR OG1 O -1.915 -8.553 0.689 1.00 . A A . 53 THR OG1 1 1 11 10285 1 1 54 CYS C C 2.769 -9.697 3.217 1.00 . A A . 54 CYS C 1 1 11 10286 1 1 54 CYS CA C 2.002 -8.906 2.153 1.00 . A A . 54 CYS CA 1 1 11 10287 1 1 54 CYS CB C 1.910 -7.440 2.591 1.00 . A A . 54 CYS CB 1 1 11 10288 1 1 54 CYS H H 0.403 -9.990 1.204 1.00 . A A . 54 CYS H 1 1 11 10289 1 1 54 CYS HA H 2.522 -8.966 1.210 1.00 . A A . 54 CYS HA 1 1 11 10290 1 1 54 CYS HB2 H 1.143 -6.931 2.028 1.00 . A A . 54 CYS HB2 1 1 11 10291 1 1 54 CYS HB3 H 1.661 -7.404 3.640 1.00 . A A . 54 CYS HB3 1 1 11 10292 1 1 54 CYS N N 0.630 -9.467 1.999 1.00 . A A . 54 CYS N 1 1 11 10293 1 1 54 CYS O O 2.343 -9.778 4.352 1.00 . A A . 54 CYS O 1 1 11 10294 1 1 54 CYS SG S 3.468 -6.503 2.378 1.00 . A A . 54 CYS SG 1 1 11 10295 1 1 55 PRO C C 5.431 -10.049 4.721 1.00 . A A . 55 PRO C 1 1 11 10296 1 1 55 PRO CA C 4.733 -11.018 3.765 1.00 . A A . 55 PRO CA 1 1 11 10297 1 1 55 PRO CB C 5.741 -11.726 2.860 1.00 . A A . 55 PRO CB 1 1 11 10298 1 1 55 PRO CD C 4.472 -10.191 1.472 1.00 . A A . 55 PRO CD 1 1 11 10299 1 1 55 PRO CG C 5.812 -10.877 1.629 1.00 . A A . 55 PRO CG 1 1 11 10300 1 1 55 PRO HA H 4.140 -11.738 4.307 1.00 . A A . 55 PRO HA 1 1 11 10301 1 1 55 PRO HB2 H 6.693 -11.791 3.372 1.00 . A A . 55 PRO HB2 1 1 11 10302 1 1 55 PRO HB3 H 5.385 -12.718 2.636 1.00 . A A . 55 PRO HB3 1 1 11 10303 1 1 55 PRO HD2 H 4.609 -9.168 1.149 1.00 . A A . 55 PRO HD2 1 1 11 10304 1 1 55 PRO HD3 H 3.852 -10.730 0.774 1.00 . A A . 55 PRO HD3 1 1 11 10305 1 1 55 PRO HG2 H 6.597 -10.141 1.741 1.00 . A A . 55 PRO HG2 1 1 11 10306 1 1 55 PRO HG3 H 6.006 -11.499 0.768 1.00 . A A . 55 PRO HG3 1 1 11 10307 1 1 55 PRO N N 3.889 -10.243 2.818 1.00 . A A . 55 PRO N 1 1 11 10308 1 1 55 PRO O O 5.473 -10.257 5.917 1.00 . A A . 55 PRO O 1 1 11 10309 1 1 56 VAL C C 5.615 -6.858 5.370 1.00 . A A . 56 VAL C 1 1 11 10310 1 1 56 VAL CA C 6.624 -7.966 5.059 1.00 . A A . 56 VAL CA 1 1 11 10311 1 1 56 VAL CB C 7.827 -7.368 4.326 1.00 . A A . 56 VAL CB 1 1 11 10312 1 1 56 VAL CG1 C 9.025 -8.309 4.450 1.00 . A A . 56 VAL CG1 1 1 11 10313 1 1 56 VAL CG2 C 7.478 -7.176 2.848 1.00 . A A . 56 VAL CG2 1 1 11 10314 1 1 56 VAL H H 5.886 -8.826 3.230 1.00 . A A . 56 VAL H 1 1 11 10315 1 1 56 VAL HA H 6.949 -8.431 5.978 1.00 . A A . 56 VAL HA 1 1 11 10316 1 1 56 VAL HB H 8.075 -6.413 4.765 1.00 . A A . 56 VAL HB 1 1 11 10317 1 1 56 VAL HG11 H 8.814 -9.065 5.191 1.00 . A A . 56 VAL HG11 1 1 11 10318 1 1 56 VAL HG12 H 9.211 -8.783 3.496 1.00 . A A . 56 VAL HG12 1 1 11 10319 1 1 56 VAL HG13 H 9.897 -7.745 4.748 1.00 . A A . 56 VAL HG13 1 1 11 10320 1 1 56 VAL HG21 H 6.411 -7.036 2.746 1.00 . A A . 56 VAL HG21 1 1 11 10321 1 1 56 VAL HG22 H 7.992 -6.306 2.467 1.00 . A A . 56 VAL HG22 1 1 11 10322 1 1 56 VAL HG23 H 7.782 -8.049 2.290 1.00 . A A . 56 VAL HG23 1 1 11 10323 1 1 56 VAL N N 5.954 -8.977 4.195 1.00 . A A . 56 VAL N 1 1 11 10324 1 1 56 VAL O O 5.782 -6.087 6.293 1.00 . A A . 56 VAL O 1 1 11 10325 1 1 57 GLN C C 3.942 -4.417 4.209 1.00 . A A . 57 GLN C 1 1 11 10326 1 1 57 GLN CA C 3.516 -5.751 4.818 1.00 . A A . 57 GLN CA 1 1 11 10327 1 1 57 GLN CB C 3.254 -5.584 6.315 1.00 . A A . 57 GLN CB 1 1 11 10328 1 1 57 GLN CD C 1.477 -5.640 8.073 1.00 . A A . 57 GLN CD 1 1 11 10329 1 1 57 GLN CG C 1.756 -5.749 6.572 1.00 . A A . 57 GLN CG 1 1 11 10330 1 1 57 GLN H H 4.458 -7.427 3.860 1.00 . A A . 57 GLN H 1 1 11 10331 1 1 57 GLN HA H 2.605 -6.068 4.342 1.00 . A A . 57 GLN HA 1 1 11 10332 1 1 57 GLN HB2 H 3.800 -6.335 6.866 1.00 . A A . 57 GLN HB2 1 1 11 10333 1 1 57 GLN HB3 H 3.566 -4.601 6.632 1.00 . A A . 57 GLN HB3 1 1 11 10334 1 1 57 GLN HE21 H 1.238 -3.669 8.031 1.00 . A A . 57 GLN HE21 1 1 11 10335 1 1 57 GLN HE22 H 1.057 -4.390 9.558 1.00 . A A . 57 GLN HE22 1 1 11 10336 1 1 57 GLN HG2 H 1.213 -4.978 6.044 1.00 . A A . 57 GLN HG2 1 1 11 10337 1 1 57 GLN HG3 H 1.435 -6.718 6.216 1.00 . A A . 57 GLN HG3 1 1 11 10338 1 1 57 GLN N N 4.563 -6.786 4.595 1.00 . A A . 57 GLN N 1 1 11 10339 1 1 57 GLN NE2 N 1.238 -4.469 8.598 1.00 . A A . 57 GLN NE2 1 1 11 10340 1 1 57 GLN O O 3.263 -3.893 3.350 1.00 . A A . 57 GLN O 1 1 11 10341 1 1 57 GLN OE1 O 1.479 -6.630 8.776 1.00 . A A . 57 GLN OE1 1 1 11 10342 1 1 58 CYS C C 4.288 -1.668 3.795 1.00 . A A . 58 CYS C 1 1 11 10343 1 1 58 CYS CA C 5.505 -2.552 4.090 1.00 . A A . 58 CYS CA 1 1 11 10344 1 1 58 CYS CB C 6.309 -2.776 2.801 1.00 . A A . 58 CYS CB 1 1 11 10345 1 1 58 CYS H H 5.572 -4.307 5.341 1.00 . A A . 58 CYS H 1 1 11 10346 1 1 58 CYS HA H 6.133 -2.059 4.819 1.00 . A A . 58 CYS HA 1 1 11 10347 1 1 58 CYS HB2 H 6.522 -1.822 2.341 1.00 . A A . 58 CYS HB2 1 1 11 10348 1 1 58 CYS HB3 H 7.239 -3.271 3.042 1.00 . A A . 58 CYS HB3 1 1 11 10349 1 1 58 CYS HG H 5.687 -4.702 1.715 1.00 . A A . 58 CYS HG 1 1 11 10350 1 1 58 CYS N N 5.047 -3.864 4.644 1.00 . A A . 58 CYS N 1 1 11 10351 1 1 58 CYS O O 4.217 -1.005 2.779 1.00 . A A . 58 CYS O 1 1 11 10352 1 1 58 CYS SG S 5.364 -3.800 1.646 1.00 . A A . 58 CYS SG 1 1 11 10353 1 1 59 ILE C C 1.562 -0.392 5.824 1.00 . A A . 59 ILE C 1 1 11 10354 1 1 59 ILE CA C 2.096 -0.841 4.463 1.00 . A A . 59 ILE CA 1 1 11 10355 1 1 59 ILE CB C 1.032 -1.693 3.748 1.00 . A A . 59 ILE CB 1 1 11 10356 1 1 59 ILE CD1 C -0.318 0.434 3.733 1.00 . A A . 59 ILE CD1 1 1 11 10357 1 1 59 ILE CG1 C -0.365 -1.081 3.940 1.00 . A A . 59 ILE CG1 1 1 11 10358 1 1 59 ILE CG2 C 1.032 -3.105 4.337 1.00 . A A . 59 ILE CG2 1 1 11 10359 1 1 59 ILE H H 3.403 -2.216 5.485 1.00 . A A . 59 ILE H 1 1 11 10360 1 1 59 ILE HA H 2.340 0.021 3.862 1.00 . A A . 59 ILE HA 1 1 11 10361 1 1 59 ILE HB H 1.264 -1.747 2.693 1.00 . A A . 59 ILE HB 1 1 11 10362 1 1 59 ILE HD11 H 0.686 0.735 3.477 1.00 . A A . 59 ILE HD11 1 1 11 10363 1 1 59 ILE HD12 H -0.990 0.709 2.933 1.00 . A A . 59 ILE HD12 1 1 11 10364 1 1 59 ILE HD13 H -0.621 0.931 4.643 1.00 . A A . 59 ILE HD13 1 1 11 10365 1 1 59 ILE HG12 H -1.045 -1.517 3.224 1.00 . A A . 59 ILE HG12 1 1 11 10366 1 1 59 ILE HG13 H -0.712 -1.294 4.940 1.00 . A A . 59 ILE HG13 1 1 11 10367 1 1 59 ILE HG21 H 1.824 -3.195 5.064 1.00 . A A . 59 ILE HG21 1 1 11 10368 1 1 59 ILE HG22 H 0.082 -3.293 4.814 1.00 . A A . 59 ILE HG22 1 1 11 10369 1 1 59 ILE HG23 H 1.183 -3.824 3.547 1.00 . A A . 59 ILE HG23 1 1 11 10370 1 1 59 ILE N N 3.323 -1.666 4.678 1.00 . A A . 59 ILE N 1 1 11 10371 1 1 59 ILE O O 1.524 -1.162 6.763 1.00 . A A . 59 ILE O 1 1 11 10372 1 1 60 HIS C C -0.323 2.475 7.112 1.00 . A A . 60 HIS C 1 1 11 10373 1 1 60 HIS CA C 0.628 1.290 7.282 1.00 . A A . 60 HIS CA 1 1 11 10374 1 1 60 HIS CB C 1.798 1.700 8.175 1.00 . A A . 60 HIS CB 1 1 11 10375 1 1 60 HIS CD2 C 3.041 -0.494 8.911 1.00 . A A . 60 HIS CD2 1 1 11 10376 1 1 60 HIS CE1 C 4.640 -0.458 7.448 1.00 . A A . 60 HIS CE1 1 1 11 10377 1 1 60 HIS CG C 2.851 0.627 8.142 1.00 . A A . 60 HIS CG 1 1 11 10378 1 1 60 HIS H H 1.183 1.464 5.197 1.00 . A A . 60 HIS H 1 1 11 10379 1 1 60 HIS HA H 0.097 0.473 7.747 1.00 . A A . 60 HIS HA 1 1 11 10380 1 1 60 HIS HB2 H 2.217 2.628 7.817 1.00 . A A . 60 HIS HB2 1 1 11 10381 1 1 60 HIS HB3 H 1.450 1.830 9.188 1.00 . A A . 60 HIS HB3 1 1 11 10382 1 1 60 HIS HD1 H 4.033 1.303 6.519 1.00 . A A . 60 HIS HD1 1 1 11 10383 1 1 60 HIS HD2 H 2.409 -0.800 9.731 1.00 . A A . 60 HIS HD2 1 1 11 10384 1 1 60 HIS HE1 H 5.518 -0.718 6.876 1.00 . A A . 60 HIS HE1 1 1 11 10385 1 1 60 HIS N N 1.148 0.843 5.955 1.00 . A A . 60 HIS N 1 1 11 10386 1 1 60 HIS ND1 N 3.882 0.630 7.215 1.00 . A A . 60 HIS ND1 1 1 11 10387 1 1 60 HIS NE2 N 4.171 -1.177 8.472 1.00 . A A . 60 HIS NE2 1 1 11 10388 1 1 60 HIS O O -0.350 3.125 6.086 1.00 . A A . 60 HIS O 1 1 11 10389 1 1 61 TRP C C -1.337 5.187 8.470 1.00 . A A . 61 TRP C 1 1 11 10390 1 1 61 TRP CA C -2.049 3.908 8.026 1.00 . A A . 61 TRP CA 1 1 11 10391 1 1 61 TRP CB C -3.261 3.666 8.929 1.00 . A A . 61 TRP CB 1 1 11 10392 1 1 61 TRP CD1 C -3.585 1.152 8.971 1.00 . A A . 61 TRP CD1 1 1 11 10393 1 1 61 TRP CD2 C -5.076 2.221 7.682 1.00 . A A . 61 TRP CD2 1 1 11 10394 1 1 61 TRP CE2 C -5.391 0.848 7.599 1.00 . A A . 61 TRP CE2 1 1 11 10395 1 1 61 TRP CE3 C -5.854 3.131 6.967 1.00 . A A . 61 TRP CE3 1 1 11 10396 1 1 61 TRP CG C -3.933 2.390 8.550 1.00 . A A . 61 TRP CG 1 1 11 10397 1 1 61 TRP CH2 C -7.231 1.316 6.109 1.00 . A A . 61 TRP CH2 1 1 11 10398 1 1 61 TRP CZ2 C -6.456 0.392 6.822 1.00 . A A . 61 TRP CZ2 1 1 11 10399 1 1 61 TRP CZ3 C -6.930 2.685 6.181 1.00 . A A . 61 TRP CZ3 1 1 11 10400 1 1 61 TRP H H -1.062 2.227 8.942 1.00 . A A . 61 TRP H 1 1 11 10401 1 1 61 TRP HA H -2.380 4.013 7.005 1.00 . A A . 61 TRP HA 1 1 11 10402 1 1 61 TRP HB2 H -2.950 3.615 9.952 1.00 . A A . 61 TRP HB2 1 1 11 10403 1 1 61 TRP HB3 H -3.959 4.482 8.811 1.00 . A A . 61 TRP HB3 1 1 11 10404 1 1 61 TRP HD1 H -2.769 0.920 9.639 1.00 . A A . 61 TRP HD1 1 1 11 10405 1 1 61 TRP HE1 H -4.421 -0.736 8.544 1.00 . A A . 61 TRP HE1 1 1 11 10406 1 1 61 TRP HE3 H -5.620 4.184 7.026 1.00 . A A . 61 TRP HE3 1 1 11 10407 1 1 61 TRP HH2 H -8.058 0.974 5.504 1.00 . A A . 61 TRP HH2 1 1 11 10408 1 1 61 TRP HZ2 H -6.681 -0.663 6.771 1.00 . A A . 61 TRP HZ2 1 1 11 10409 1 1 61 TRP HZ3 H -7.528 3.396 5.631 1.00 . A A . 61 TRP HZ3 1 1 11 10410 1 1 61 TRP N N -1.104 2.763 8.122 1.00 . A A . 61 TRP N 1 1 11 10411 1 1 61 TRP NE1 N -4.453 0.233 8.404 1.00 . A A . 61 TRP NE1 1 1 11 10412 1 1 61 TRP O O -0.157 5.182 8.762 1.00 . A A . 61 TRP O 1 1 11 10413 1 1 62 GLU C C -2.459 8.451 9.612 1.00 . A A . 62 GLU C 1 1 11 10414 1 1 62 GLU CA C -1.407 7.560 8.944 1.00 . A A . 62 GLU CA 1 1 11 10415 1 1 62 GLU CB C -0.828 8.267 7.712 1.00 . A A . 62 GLU CB 1 1 11 10416 1 1 62 GLU CD C 0.614 10.246 7.199 1.00 . A A . 62 GLU CD 1 1 11 10417 1 1 62 GLU CG C -0.574 9.744 8.024 1.00 . A A . 62 GLU CG 1 1 11 10418 1 1 62 GLU H H -2.994 6.263 8.282 1.00 . A A . 62 GLU H 1 1 11 10419 1 1 62 GLU HA H -0.614 7.352 9.647 1.00 . A A . 62 GLU HA 1 1 11 10420 1 1 62 GLU HB2 H 0.103 7.793 7.434 1.00 . A A . 62 GLU HB2 1 1 11 10421 1 1 62 GLU HB3 H -1.526 8.188 6.893 1.00 . A A . 62 GLU HB3 1 1 11 10422 1 1 62 GLU HG2 H -1.454 10.320 7.775 1.00 . A A . 62 GLU HG2 1 1 11 10423 1 1 62 GLU HG3 H -0.353 9.858 9.074 1.00 . A A . 62 GLU HG3 1 1 11 10424 1 1 62 GLU N N -2.044 6.282 8.522 1.00 . A A . 62 GLU N 1 1 11 10425 1 1 62 GLU O O -3.242 9.107 8.953 1.00 . A A . 62 GLU O 1 1 11 10426 1 1 62 GLU OE1 O 0.702 9.877 6.040 1.00 . A A . 62 GLU OE1 1 1 11 10427 1 1 62 GLU OE2 O 1.412 10.992 7.742 1.00 . A A . 62 GLU OE2 1 1 11 10428 1 1 63 ASP C C -2.893 10.716 11.872 1.00 . A A . 63 ASP C 1 1 11 10429 1 1 63 ASP CA C -3.481 9.325 11.628 1.00 . A A . 63 ASP CA 1 1 11 10430 1 1 63 ASP CB C -3.834 8.679 12.970 1.00 . A A . 63 ASP CB 1 1 11 10431 1 1 63 ASP CG C -3.950 7.163 12.792 1.00 . A A . 63 ASP CG 1 1 11 10432 1 1 63 ASP H H -1.842 7.942 11.428 1.00 . A A . 63 ASP H 1 1 11 10433 1 1 63 ASP HA H -4.373 9.413 11.026 1.00 . A A . 63 ASP HA 1 1 11 10434 1 1 63 ASP HB2 H -3.059 8.900 13.690 1.00 . A A . 63 ASP HB2 1 1 11 10435 1 1 63 ASP HB3 H -4.777 9.070 13.321 1.00 . A A . 63 ASP HB3 1 1 11 10436 1 1 63 ASP N N -2.482 8.479 10.917 1.00 . A A . 63 ASP N 1 1 11 10437 1 1 63 ASP O O -3.323 11.693 11.290 1.00 . A A . 63 ASP O 1 1 11 10438 1 1 63 ASP OD1 O -4.411 6.742 11.744 1.00 . A A . 63 ASP OD1 1 1 11 10439 1 1 63 ASP OD2 O -3.574 6.448 13.707 1.00 . A A . 63 ASP OD2 1 1 11 10440 1 1 64 GLU C C -0.002 11.957 13.791 1.00 . A A . 64 GLU C 1 1 11 10441 1 1 64 GLU CA C -1.299 12.144 13.001 1.00 . A A . 64 GLU CA 1 1 11 10442 1 1 64 GLU CB C -2.275 12.993 13.817 1.00 . A A . 64 GLU CB 1 1 11 10443 1 1 64 GLU CD C -1.924 15.458 14.033 1.00 . A A . 64 GLU CD 1 1 11 10444 1 1 64 GLU CG C -2.469 14.347 13.133 1.00 . A A . 64 GLU CG 1 1 11 10445 1 1 64 GLU H H -1.576 10.016 13.184 1.00 . A A . 64 GLU H 1 1 11 10446 1 1 64 GLU HA H -1.083 12.642 12.067 1.00 . A A . 64 GLU HA 1 1 11 10447 1 1 64 GLU HB2 H -3.224 12.483 13.884 1.00 . A A . 64 GLU HB2 1 1 11 10448 1 1 64 GLU HB3 H -1.876 13.147 14.809 1.00 . A A . 64 GLU HB3 1 1 11 10449 1 1 64 GLU HG2 H -1.940 14.354 12.191 1.00 . A A . 64 GLU HG2 1 1 11 10450 1 1 64 GLU HG3 H -3.521 14.514 12.958 1.00 . A A . 64 GLU HG3 1 1 11 10451 1 1 64 GLU N N -1.911 10.815 12.724 1.00 . A A . 64 GLU N 1 1 11 10452 1 1 64 GLU OE1 O -0.842 15.280 14.569 1.00 . A A . 64 GLU OE1 1 1 11 10453 1 1 64 GLU OE2 O -2.596 16.466 14.171 1.00 . A A . 64 GLU OE2 1 1 11 10454 2 2 1 SF4 FE1 FE 5.190 -5.057 -1.931 1.00 . B A . 65 SF4 FE1 1 1 11 10455 2 2 1 SF4 FE2 FE 3.546 -6.043 0.253 1.00 . B A . 65 SF4 FE2 1 1 11 10456 2 2 1 SF4 FE3 FE 2.620 -4.668 -2.054 1.00 . B A . 65 SF4 FE3 1 1 11 10457 2 2 1 SF4 FE4 FE 3.775 -7.397 -2.300 1.00 . B A . 65 SF4 FE4 1 1 11 10458 2 2 1 SF4 S1 S 1.776 -6.697 -0.911 1.00 . B A . 65 SF4 S1 1 1 11 10459 2 2 1 SF4 S2 S 4.075 -5.312 -3.582 1.00 . B A . 65 SF4 S2 1 1 11 10460 2 2 1 SF4 S3 S 5.406 -7.234 -0.806 1.00 . B A . 65 SF4 S3 1 1 11 10461 2 2 1 SF4 S4 S 4.008 -3.731 -0.613 1.00 . B A . 65 SF4 S4 1 1 12 10462 1 1 1 ALA C C -9.410 9.384 9.504 1.00 . A A . 1 ALA C 1 1 12 10463 1 1 1 ALA CA C -9.804 10.807 9.905 1.00 . A A . 1 ALA CA 1 1 12 10464 1 1 1 ALA CB C -11.152 10.780 10.629 1.00 . A A . 1 ALA CB 1 1 12 10465 1 1 1 ALA HA H -9.051 11.217 10.562 1.00 . A A . 1 ALA HA 1 1 12 10466 1 1 1 ALA HB1 H -11.847 11.432 10.121 1.00 . A A . 1 ALA HB1 1 1 12 10467 1 1 1 ALA HB2 H -11.540 9.772 10.631 1.00 . A A . 1 ALA HB2 1 1 12 10468 1 1 1 ALA HB3 H -11.021 11.117 11.647 1.00 . A A . 1 ALA HB3 1 1 12 10469 1 1 1 ALA N N -9.913 11.655 8.685 1.00 . A A . 1 ALA N 1 1 12 10470 1 1 1 ALA O O -9.992 8.794 8.616 1.00 . A A . 1 ALA O 1 1 12 10471 1 1 2 ARG C C -7.379 7.430 8.408 1.00 . A A . 2 ARG C 1 1 12 10472 1 1 2 ARG CA C -7.991 7.443 9.811 1.00 . A A . 2 ARG CA 1 1 12 10473 1 1 2 ARG CB C -9.199 6.506 9.853 1.00 . A A . 2 ARG CB 1 1 12 10474 1 1 2 ARG CD C -8.442 5.589 12.050 1.00 . A A . 2 ARG CD 1 1 12 10475 1 1 2 ARG CG C -8.829 5.231 10.614 1.00 . A A . 2 ARG CG 1 1 12 10476 1 1 2 ARG CZ C -10.312 4.689 13.300 1.00 . A A . 2 ARG CZ 1 1 12 10477 1 1 2 ARG H H -7.967 9.322 10.866 1.00 . A A . 2 ARG H 1 1 12 10478 1 1 2 ARG HA H -7.253 7.111 10.527 1.00 . A A . 2 ARG HA 1 1 12 10479 1 1 2 ARG HB2 H -10.020 7.000 10.353 1.00 . A A . 2 ARG HB2 1 1 12 10480 1 1 2 ARG HB3 H -9.492 6.250 8.846 1.00 . A A . 2 ARG HB3 1 1 12 10481 1 1 2 ARG HD2 H -7.367 5.566 12.149 1.00 . A A . 2 ARG HD2 1 1 12 10482 1 1 2 ARG HD3 H -8.804 6.579 12.285 1.00 . A A . 2 ARG HD3 1 1 12 10483 1 1 2 ARG HE H -8.497 3.889 13.371 1.00 . A A . 2 ARG HE 1 1 12 10484 1 1 2 ARG HG2 H -9.676 4.560 10.624 1.00 . A A . 2 ARG HG2 1 1 12 10485 1 1 2 ARG HG3 H -7.994 4.751 10.128 1.00 . A A . 2 ARG HG3 1 1 12 10486 1 1 2 ARG HH11 H -10.026 6.086 14.704 1.00 . A A . 2 ARG HH11 1 1 12 10487 1 1 2 ARG HH12 H -11.668 5.585 14.468 1.00 . A A . 2 ARG HH12 1 1 12 10488 1 1 2 ARG HH21 H -10.892 3.310 11.970 1.00 . A A . 2 ARG HH21 1 1 12 10489 1 1 2 ARG HH22 H -12.157 4.014 12.919 1.00 . A A . 2 ARG HH22 1 1 12 10490 1 1 2 ARG N N -8.423 8.828 10.153 1.00 . A A . 2 ARG N 1 1 12 10491 1 1 2 ARG NE N -9.048 4.603 12.989 1.00 . A A . 2 ARG NE 1 1 12 10492 1 1 2 ARG NH1 N -10.699 5.518 14.230 1.00 . A A . 2 ARG NH1 1 1 12 10493 1 1 2 ARG NH2 N -11.188 3.947 12.681 1.00 . A A . 2 ARG NH2 1 1 12 10494 1 1 2 ARG O O -8.078 7.349 7.417 1.00 . A A . 2 ARG O 1 1 12 10495 1 1 3 LYS C C -4.586 6.226 6.827 1.00 . A A . 3 LYS C 1 1 12 10496 1 1 3 LYS CA C -5.423 7.500 6.978 1.00 . A A . 3 LYS CA 1 1 12 10497 1 1 3 LYS CB C -4.522 8.729 6.844 1.00 . A A . 3 LYS CB 1 1 12 10498 1 1 3 LYS CD C -5.246 10.450 5.182 1.00 . A A . 3 LYS CD 1 1 12 10499 1 1 3 LYS CE C -4.777 11.145 3.904 1.00 . A A . 3 LYS CE 1 1 12 10500 1 1 3 LYS CG C -4.455 9.155 5.377 1.00 . A A . 3 LYS CG 1 1 12 10501 1 1 3 LYS H H -5.535 7.573 9.129 1.00 . A A . 3 LYS H 1 1 12 10502 1 1 3 LYS HA H -6.180 7.524 6.208 1.00 . A A . 3 LYS HA 1 1 12 10503 1 1 3 LYS HB2 H -4.925 9.538 7.439 1.00 . A A . 3 LYS HB2 1 1 12 10504 1 1 3 LYS HB3 H -3.529 8.488 7.192 1.00 . A A . 3 LYS HB3 1 1 12 10505 1 1 3 LYS HD2 H -6.300 10.221 5.102 1.00 . A A . 3 LYS HD2 1 1 12 10506 1 1 3 LYS HD3 H -5.083 11.104 6.025 1.00 . A A . 3 LYS HD3 1 1 12 10507 1 1 3 LYS HE2 H -4.182 10.459 3.318 1.00 . A A . 3 LYS HE2 1 1 12 10508 1 1 3 LYS HE3 H -5.635 11.459 3.329 1.00 . A A . 3 LYS HE3 1 1 12 10509 1 1 3 LYS HG2 H -3.425 9.316 5.095 1.00 . A A . 3 LYS HG2 1 1 12 10510 1 1 3 LYS HG3 H -4.881 8.380 4.757 1.00 . A A . 3 LYS HG3 1 1 12 10511 1 1 3 LYS HZ1 H -4.409 12.854 5.035 1.00 . A A . 3 LYS HZ1 1 1 12 10512 1 1 3 LYS HZ2 H -3.008 12.029 4.556 1.00 . A A . 3 LYS HZ2 1 1 12 10513 1 1 3 LYS HZ3 H -3.873 12.959 3.428 1.00 . A A . 3 LYS HZ3 1 1 12 10514 1 1 3 LYS N N -6.080 7.509 8.317 1.00 . A A . 3 LYS N 1 1 12 10515 1 1 3 LYS NZ N -3.955 12.337 4.257 1.00 . A A . 3 LYS NZ 1 1 12 10516 1 1 3 LYS O O -4.833 5.232 7.478 1.00 . A A . 3 LYS O 1 1 12 10517 1 1 4 PHE C C -1.720 5.296 4.672 1.00 . A A . 4 PHE C 1 1 12 10518 1 1 4 PHE CA C -2.750 5.038 5.777 1.00 . A A . 4 PHE CA 1 1 12 10519 1 1 4 PHE CB C -3.635 3.857 5.373 1.00 . A A . 4 PHE CB 1 1 12 10520 1 1 4 PHE CD1 C -3.548 4.148 2.869 1.00 . A A . 4 PHE CD1 1 1 12 10521 1 1 4 PHE CD2 C -5.670 4.444 4.005 1.00 . A A . 4 PHE CD2 1 1 12 10522 1 1 4 PHE CE1 C -4.165 4.427 1.644 1.00 . A A . 4 PHE CE1 1 1 12 10523 1 1 4 PHE CE2 C -6.287 4.723 2.779 1.00 . A A . 4 PHE CE2 1 1 12 10524 1 1 4 PHE CG C -4.300 4.156 4.050 1.00 . A A . 4 PHE CG 1 1 12 10525 1 1 4 PHE CZ C -5.535 4.714 1.598 1.00 . A A . 4 PHE CZ 1 1 12 10526 1 1 4 PHE H H -3.415 7.059 5.458 1.00 . A A . 4 PHE H 1 1 12 10527 1 1 4 PHE HA H -2.238 4.805 6.698 1.00 . A A . 4 PHE HA 1 1 12 10528 1 1 4 PHE HB2 H -3.028 2.968 5.279 1.00 . A A . 4 PHE HB2 1 1 12 10529 1 1 4 PHE HB3 H -4.390 3.698 6.127 1.00 . A A . 4 PHE HB3 1 1 12 10530 1 1 4 PHE HD1 H -2.491 3.926 2.904 1.00 . A A . 4 PHE HD1 1 1 12 10531 1 1 4 PHE HD2 H -6.251 4.450 4.915 1.00 . A A . 4 PHE HD2 1 1 12 10532 1 1 4 PHE HE1 H -3.584 4.420 0.733 1.00 . A A . 4 PHE HE1 1 1 12 10533 1 1 4 PHE HE2 H -7.343 4.944 2.744 1.00 . A A . 4 PHE HE2 1 1 12 10534 1 1 4 PHE HZ H -6.010 4.930 0.653 1.00 . A A . 4 PHE HZ 1 1 12 10535 1 1 4 PHE N N -3.598 6.249 5.972 1.00 . A A . 4 PHE N 1 1 12 10536 1 1 4 PHE O O -1.740 6.316 4.013 1.00 . A A . 4 PHE O 1 1 12 10537 1 1 5 TYR C C 1.099 3.310 3.470 1.00 . A A . 5 TYR C 1 1 12 10538 1 1 5 TYR CA C 0.197 4.518 3.400 1.00 . A A . 5 TYR CA 1 1 12 10539 1 1 5 TYR CB C 1.036 5.777 3.617 1.00 . A A . 5 TYR CB 1 1 12 10540 1 1 5 TYR CD1 C 1.349 5.309 6.076 1.00 . A A . 5 TYR CD1 1 1 12 10541 1 1 5 TYR CD2 C 3.306 5.742 4.711 1.00 . A A . 5 TYR CD2 1 1 12 10542 1 1 5 TYR CE1 C 2.170 5.149 7.200 1.00 . A A . 5 TYR CE1 1 1 12 10543 1 1 5 TYR CE2 C 4.126 5.581 5.833 1.00 . A A . 5 TYR CE2 1 1 12 10544 1 1 5 TYR CG C 1.918 5.605 4.832 1.00 . A A . 5 TYR CG 1 1 12 10545 1 1 5 TYR CZ C 3.558 5.285 7.079 1.00 . A A . 5 TYR CZ 1 1 12 10546 1 1 5 TYR H H -0.843 3.543 4.999 1.00 . A A . 5 TYR H 1 1 12 10547 1 1 5 TYR HA H -0.281 4.558 2.434 1.00 . A A . 5 TYR HA 1 1 12 10548 1 1 5 TYR HB2 H 1.656 5.946 2.748 1.00 . A A . 5 TYR HB2 1 1 12 10549 1 1 5 TYR HB3 H 0.390 6.617 3.756 1.00 . A A . 5 TYR HB3 1 1 12 10550 1 1 5 TYR HD1 H 0.278 5.205 6.169 1.00 . A A . 5 TYR HD1 1 1 12 10551 1 1 5 TYR HD2 H 3.744 5.970 3.750 1.00 . A A . 5 TYR HD2 1 1 12 10552 1 1 5 TYR HE1 H 1.731 4.919 8.160 1.00 . A A . 5 TYR HE1 1 1 12 10553 1 1 5 TYR HE2 H 5.197 5.687 5.740 1.00 . A A . 5 TYR HE2 1 1 12 10554 1 1 5 TYR HH H 5.252 4.913 7.878 1.00 . A A . 5 TYR HH 1 1 12 10555 1 1 5 TYR N N -0.831 4.365 4.461 1.00 . A A . 5 TYR N 1 1 12 10556 1 1 5 TYR O O 0.830 2.371 4.190 1.00 . A A . 5 TYR O 1 1 12 10557 1 1 5 TYR OH O 4.368 5.128 8.185 1.00 . A A . 5 TYR OH 1 1 12 10558 1 1 6 VAL C C 4.503 2.506 2.931 1.00 . A A . 6 VAL C 1 1 12 10559 1 1 6 VAL CA C 3.047 2.117 2.825 1.00 . A A . 6 VAL CA 1 1 12 10560 1 1 6 VAL CB C 2.891 1.240 1.593 1.00 . A A . 6 VAL CB 1 1 12 10561 1 1 6 VAL CG1 C 2.970 -0.205 2.048 1.00 . A A . 6 VAL CG1 1 1 12 10562 1 1 6 VAL CG2 C 1.537 1.477 0.918 1.00 . A A . 6 VAL CG2 1 1 12 10563 1 1 6 VAL H H 2.389 4.068 2.165 1.00 . A A . 6 VAL H 1 1 12 10564 1 1 6 VAL HA H 2.775 1.540 3.696 1.00 . A A . 6 VAL HA 1 1 12 10565 1 1 6 VAL HB H 3.700 1.449 0.898 1.00 . A A . 6 VAL HB 1 1 12 10566 1 1 6 VAL HG11 H 3.202 -0.231 3.102 1.00 . A A . 6 VAL HG11 1 1 12 10567 1 1 6 VAL HG12 H 2.021 -0.686 1.873 1.00 . A A . 6 VAL HG12 1 1 12 10568 1 1 6 VAL HG13 H 3.745 -0.710 1.496 1.00 . A A . 6 VAL HG13 1 1 12 10569 1 1 6 VAL HG21 H 0.882 2.010 1.586 1.00 . A A . 6 VAL HG21 1 1 12 10570 1 1 6 VAL HG22 H 1.679 2.055 0.018 1.00 . A A . 6 VAL HG22 1 1 12 10571 1 1 6 VAL HG23 H 1.091 0.528 0.666 1.00 . A A . 6 VAL HG23 1 1 12 10572 1 1 6 VAL N N 2.169 3.305 2.746 1.00 . A A . 6 VAL N 1 1 12 10573 1 1 6 VAL O O 4.874 3.663 2.874 1.00 . A A . 6 VAL O 1 1 12 10574 1 1 7 ASP C C 7.471 0.869 2.154 1.00 . A A . 7 ASP C 1 1 12 10575 1 1 7 ASP CA C 6.780 1.760 3.149 1.00 . A A . 7 ASP CA 1 1 12 10576 1 1 7 ASP CB C 7.279 1.453 4.553 1.00 . A A . 7 ASP CB 1 1 12 10577 1 1 7 ASP CG C 8.058 2.651 5.097 1.00 . A A . 7 ASP CG 1 1 12 10578 1 1 7 ASP H H 4.991 0.600 3.084 1.00 . A A . 7 ASP H 1 1 12 10579 1 1 7 ASP HA H 6.992 2.777 2.900 1.00 . A A . 7 ASP HA 1 1 12 10580 1 1 7 ASP HB2 H 6.435 1.255 5.183 1.00 . A A . 7 ASP HB2 1 1 12 10581 1 1 7 ASP HB3 H 7.924 0.587 4.528 1.00 . A A . 7 ASP HB3 1 1 12 10582 1 1 7 ASP N N 5.331 1.518 3.062 1.00 . A A . 7 ASP N 1 1 12 10583 1 1 7 ASP O O 7.802 -0.265 2.438 1.00 . A A . 7 ASP O 1 1 12 10584 1 1 7 ASP OD1 O 7.518 3.745 5.072 1.00 . A A . 7 ASP OD1 1 1 12 10585 1 1 7 ASP OD2 O 9.181 2.455 5.531 1.00 . A A . 7 ASP OD2 1 1 12 10586 1 1 8 GLN C C 9.813 0.272 0.333 1.00 . A A . 8 GLN C 1 1 12 10587 1 1 8 GLN CA C 8.371 0.575 -0.069 1.00 . A A . 8 GLN CA 1 1 12 10588 1 1 8 GLN CB C 8.409 1.349 -1.364 1.00 . A A . 8 GLN CB 1 1 12 10589 1 1 8 GLN CD C 7.017 3.418 -1.275 1.00 . A A . 8 GLN CD 1 1 12 10590 1 1 8 GLN CG C 7.035 1.940 -1.664 1.00 . A A . 8 GLN CG 1 1 12 10591 1 1 8 GLN H H 7.390 2.287 0.803 1.00 . A A . 8 GLN H 1 1 12 10592 1 1 8 GLN HA H 7.837 -0.350 -0.222 1.00 . A A . 8 GLN HA 1 1 12 10593 1 1 8 GLN HB2 H 9.140 2.142 -1.290 1.00 . A A . 8 GLN HB2 1 1 12 10594 1 1 8 GLN HB3 H 8.692 0.671 -2.139 1.00 . A A . 8 GLN HB3 1 1 12 10595 1 1 8 GLN HE21 H 5.544 3.196 0.039 1.00 . A A . 8 GLN HE21 1 1 12 10596 1 1 8 GLN HE22 H 6.144 4.776 -0.119 1.00 . A A . 8 GLN HE22 1 1 12 10597 1 1 8 GLN HG2 H 6.825 1.839 -2.719 1.00 . A A . 8 GLN HG2 1 1 12 10598 1 1 8 GLN HG3 H 6.285 1.411 -1.096 1.00 . A A . 8 GLN HG3 1 1 12 10599 1 1 8 GLN N N 7.688 1.375 0.986 1.00 . A A . 8 GLN N 1 1 12 10600 1 1 8 GLN NE2 N 6.163 3.831 -0.378 1.00 . A A . 8 GLN NE2 1 1 12 10601 1 1 8 GLN O O 10.731 0.387 -0.454 1.00 . A A . 8 GLN O 1 1 12 10602 1 1 8 GLN OE1 O 7.784 4.205 -1.793 1.00 . A A . 8 GLN OE1 1 1 12 10603 1 1 9 ASP C C 11.444 -1.972 2.247 1.00 . A A . 9 ASP C 1 1 12 10604 1 1 9 ASP CA C 11.374 -0.463 2.021 1.00 . A A . 9 ASP CA 1 1 12 10605 1 1 9 ASP CB C 11.652 0.270 3.335 1.00 . A A . 9 ASP CB 1 1 12 10606 1 1 9 ASP CG C 13.092 0.786 3.335 1.00 . A A . 9 ASP CG 1 1 12 10607 1 1 9 ASP H H 9.242 -0.216 2.128 1.00 . A A . 9 ASP H 1 1 12 10608 1 1 9 ASP HA H 12.102 -0.173 1.279 1.00 . A A . 9 ASP HA 1 1 12 10609 1 1 9 ASP HB2 H 10.970 1.102 3.434 1.00 . A A . 9 ASP HB2 1 1 12 10610 1 1 9 ASP HB3 H 11.515 -0.410 4.163 1.00 . A A . 9 ASP HB3 1 1 12 10611 1 1 9 ASP N N 10.005 -0.126 1.540 1.00 . A A . 9 ASP N 1 1 12 10612 1 1 9 ASP O O 12.381 -2.631 1.843 1.00 . A A . 9 ASP O 1 1 12 10613 1 1 9 ASP OD1 O 13.994 -0.034 3.402 1.00 . A A . 9 ASP OD1 1 1 12 10614 1 1 9 ASP OD2 O 13.269 1.991 3.269 1.00 . A A . 9 ASP OD2 1 1 12 10615 1 1 10 GLU C C 9.736 -4.668 1.911 1.00 . A A . 10 GLU C 1 1 12 10616 1 1 10 GLU CA C 10.420 -3.993 3.104 1.00 . A A . 10 GLU CA 1 1 12 10617 1 1 10 GLU CB C 9.632 -4.298 4.381 1.00 . A A . 10 GLU CB 1 1 12 10618 1 1 10 GLU CD C 11.636 -4.114 5.862 1.00 . A A . 10 GLU CD 1 1 12 10619 1 1 10 GLU CG C 10.528 -5.046 5.371 1.00 . A A . 10 GLU CG 1 1 12 10620 1 1 10 GLU H H 9.687 -1.972 3.170 1.00 . A A . 10 GLU H 1 1 12 10621 1 1 10 GLU HA H 11.431 -4.361 3.201 1.00 . A A . 10 GLU HA 1 1 12 10622 1 1 10 GLU HB2 H 9.292 -3.374 4.828 1.00 . A A . 10 GLU HB2 1 1 12 10623 1 1 10 GLU HB3 H 8.778 -4.913 4.137 1.00 . A A . 10 GLU HB3 1 1 12 10624 1 1 10 GLU HG2 H 9.936 -5.379 6.211 1.00 . A A . 10 GLU HG2 1 1 12 10625 1 1 10 GLU HG3 H 10.970 -5.900 4.881 1.00 . A A . 10 GLU HG3 1 1 12 10626 1 1 10 GLU N N 10.440 -2.524 2.870 1.00 . A A . 10 GLU N 1 1 12 10627 1 1 10 GLU O O 9.704 -5.878 1.801 1.00 . A A . 10 GLU O 1 1 12 10628 1 1 10 GLU OE1 O 11.513 -2.918 5.655 1.00 . A A . 10 GLU OE1 1 1 12 10629 1 1 10 GLU OE2 O 12.590 -4.611 6.439 1.00 . A A . 10 GLU OE2 1 1 12 10630 1 1 11 CYS C C 9.481 -5.242 -1.028 1.00 . A A . 11 CYS C 1 1 12 10631 1 1 11 CYS CA C 8.488 -4.466 -0.162 1.00 . A A . 11 CYS CA 1 1 12 10632 1 1 11 CYS CB C 7.865 -3.336 -0.987 1.00 . A A . 11 CYS CB 1 1 12 10633 1 1 11 CYS H H 9.214 -2.915 1.134 1.00 . A A . 11 CYS H 1 1 12 10634 1 1 11 CYS HA H 7.709 -5.135 0.171 1.00 . A A . 11 CYS HA 1 1 12 10635 1 1 11 CYS HB2 H 7.111 -2.831 -0.401 1.00 . A A . 11 CYS HB2 1 1 12 10636 1 1 11 CYS HB3 H 8.633 -2.631 -1.271 1.00 . A A . 11 CYS HB3 1 1 12 10637 1 1 11 CYS N N 9.181 -3.887 1.021 1.00 . A A . 11 CYS N 1 1 12 10638 1 1 11 CYS O O 10.627 -4.864 -1.172 1.00 . A A . 11 CYS O 1 1 12 10639 1 1 11 CYS SG S 7.094 -3.892 -2.546 1.00 . A A . 11 CYS SG 1 1 12 10640 1 1 12 ILE C C 9.638 -6.811 -3.947 1.00 . A A . 12 ILE C 1 1 12 10641 1 1 12 ILE CA C 9.955 -7.120 -2.477 1.00 . A A . 12 ILE CA 1 1 12 10642 1 1 12 ILE CB C 9.750 -8.611 -2.188 1.00 . A A . 12 ILE CB 1 1 12 10643 1 1 12 ILE CD1 C 7.999 -10.347 -2.604 1.00 . A A . 12 ILE CD1 1 1 12 10644 1 1 12 ILE CG1 C 8.249 -8.919 -2.116 1.00 . A A . 12 ILE CG1 1 1 12 10645 1 1 12 ILE CG2 C 10.407 -8.966 -0.853 1.00 . A A . 12 ILE CG2 1 1 12 10646 1 1 12 ILE H H 8.115 -6.606 -1.487 1.00 . A A . 12 ILE H 1 1 12 10647 1 1 12 ILE HA H 10.979 -6.849 -2.266 1.00 . A A . 12 ILE HA 1 1 12 10648 1 1 12 ILE HB H 10.202 -9.194 -2.976 1.00 . A A . 12 ILE HB 1 1 12 10649 1 1 12 ILE HD11 H 8.788 -10.993 -2.247 1.00 . A A . 12 ILE HD11 1 1 12 10650 1 1 12 ILE HD12 H 7.049 -10.695 -2.226 1.00 . A A . 12 ILE HD12 1 1 12 10651 1 1 12 ILE HD13 H 7.984 -10.361 -3.684 1.00 . A A . 12 ILE HD13 1 1 12 10652 1 1 12 ILE HG12 H 7.909 -8.822 -1.096 1.00 . A A . 12 ILE HG12 1 1 12 10653 1 1 12 ILE HG13 H 7.708 -8.227 -2.744 1.00 . A A . 12 ILE HG13 1 1 12 10654 1 1 12 ILE HG21 H 11.255 -8.318 -0.685 1.00 . A A . 12 ILE HG21 1 1 12 10655 1 1 12 ILE HG22 H 9.692 -8.836 -0.054 1.00 . A A . 12 ILE HG22 1 1 12 10656 1 1 12 ILE HG23 H 10.738 -9.993 -0.877 1.00 . A A . 12 ILE HG23 1 1 12 10657 1 1 12 ILE N N 9.046 -6.322 -1.613 1.00 . A A . 12 ILE N 1 1 12 10658 1 1 12 ILE O O 9.843 -5.705 -4.408 1.00 . A A . 12 ILE O 1 1 12 10659 1 1 13 ALA C C 7.422 -8.074 -6.425 1.00 . A A . 13 ALA C 1 1 12 10660 1 1 13 ALA CA C 8.799 -7.489 -6.112 1.00 . A A . 13 ALA CA 1 1 12 10661 1 1 13 ALA CB C 9.851 -8.139 -7.014 1.00 . A A . 13 ALA CB 1 1 12 10662 1 1 13 ALA H H 8.959 -8.645 -4.311 1.00 . A A . 13 ALA H 1 1 12 10663 1 1 13 ALA HA H 8.787 -6.423 -6.282 1.00 . A A . 13 ALA HA 1 1 12 10664 1 1 13 ALA HB1 H 10.833 -7.794 -6.727 1.00 . A A . 13 ALA HB1 1 1 12 10665 1 1 13 ALA HB2 H 9.801 -9.212 -6.909 1.00 . A A . 13 ALA HB2 1 1 12 10666 1 1 13 ALA HB3 H 9.659 -7.869 -8.042 1.00 . A A . 13 ALA HB3 1 1 12 10667 1 1 13 ALA N N 9.129 -7.760 -4.687 1.00 . A A . 13 ALA N 1 1 12 10668 1 1 13 ALA O O 7.125 -8.420 -7.551 1.00 . A A . 13 ALA O 1 1 12 10669 1 1 14 CYS C C 4.190 -7.636 -5.739 1.00 . A A . 14 CYS C 1 1 12 10670 1 1 14 CYS CA C 5.224 -8.761 -5.679 1.00 . A A . 14 CYS CA 1 1 12 10671 1 1 14 CYS CB C 4.860 -9.737 -4.559 1.00 . A A . 14 CYS CB 1 1 12 10672 1 1 14 CYS H H 6.838 -7.911 -4.532 1.00 . A A . 14 CYS H 1 1 12 10673 1 1 14 CYS HA H 5.228 -9.288 -6.621 1.00 . A A . 14 CYS HA 1 1 12 10674 1 1 14 CYS HB2 H 4.517 -10.665 -4.992 1.00 . A A . 14 CYS HB2 1 1 12 10675 1 1 14 CYS HB3 H 5.737 -9.926 -3.954 1.00 . A A . 14 CYS HB3 1 1 12 10676 1 1 14 CYS N N 6.579 -8.192 -5.435 1.00 . A A . 14 CYS N 1 1 12 10677 1 1 14 CYS O O 4.333 -6.609 -5.106 1.00 . A A . 14 CYS O 1 1 12 10678 1 1 14 CYS SG S 3.564 -9.210 -3.374 1.00 . A A . 14 CYS SG 1 1 12 10679 1 1 15 GLU C C 0.829 -7.241 -5.904 1.00 . A A . 15 GLU C 1 1 12 10680 1 1 15 GLU CA C 2.102 -6.776 -6.615 1.00 . A A . 15 GLU CA 1 1 12 10681 1 1 15 GLU CB C 1.796 -6.528 -8.094 1.00 . A A . 15 GLU CB 1 1 12 10682 1 1 15 GLU CD C 3.157 -8.222 -9.326 1.00 . A A . 15 GLU CD 1 1 12 10683 1 1 15 GLU CG C 1.753 -7.865 -8.836 1.00 . A A . 15 GLU CG 1 1 12 10684 1 1 15 GLU H H 3.059 -8.663 -7.004 1.00 . A A . 15 GLU H 1 1 12 10685 1 1 15 GLU HA H 2.455 -5.861 -6.162 1.00 . A A . 15 GLU HA 1 1 12 10686 1 1 15 GLU HB2 H 0.841 -6.032 -8.187 1.00 . A A . 15 GLU HB2 1 1 12 10687 1 1 15 GLU HB3 H 2.568 -5.905 -8.521 1.00 . A A . 15 GLU HB3 1 1 12 10688 1 1 15 GLU HG2 H 1.397 -8.635 -8.168 1.00 . A A . 15 GLU HG2 1 1 12 10689 1 1 15 GLU HG3 H 1.088 -7.785 -9.683 1.00 . A A . 15 GLU HG3 1 1 12 10690 1 1 15 GLU N N 3.150 -7.826 -6.502 1.00 . A A . 15 GLU N 1 1 12 10691 1 1 15 GLU O O -0.250 -6.741 -6.155 1.00 . A A . 15 GLU O 1 1 12 10692 1 1 15 GLU OE1 O 3.944 -7.312 -9.524 1.00 . A A . 15 GLU OE1 1 1 12 10693 1 1 15 GLU OE2 O 3.422 -9.402 -9.493 1.00 . A A . 15 GLU OE2 1 1 12 10694 1 1 16 SER C C -1.112 -7.492 -3.858 1.00 . A A . 16 SER C 1 1 12 10695 1 1 16 SER CA C -0.262 -8.685 -4.294 1.00 . A A . 16 SER CA 1 1 12 10696 1 1 16 SER CB C 0.170 -9.479 -3.059 1.00 . A A . 16 SER CB 1 1 12 10697 1 1 16 SER H H 1.824 -8.584 -4.829 1.00 . A A . 16 SER H 1 1 12 10698 1 1 16 SER HA H -0.840 -9.321 -4.948 1.00 . A A . 16 SER HA 1 1 12 10699 1 1 16 SER HB2 H 0.756 -8.849 -2.412 1.00 . A A . 16 SER HB2 1 1 12 10700 1 1 16 SER HB3 H -0.709 -9.820 -2.527 1.00 . A A . 16 SER HB3 1 1 12 10701 1 1 16 SER HG H 0.427 -11.385 -3.350 1.00 . A A . 16 SER HG 1 1 12 10702 1 1 16 SER N N 0.945 -8.193 -5.018 1.00 . A A . 16 SER N 1 1 12 10703 1 1 16 SER O O -2.211 -7.291 -4.338 1.00 . A A . 16 SER O 1 1 12 10704 1 1 16 SER OG O 0.954 -10.591 -3.467 1.00 . A A . 16 SER OG 1 1 12 10705 1 1 17 CYS C C -1.913 -4.748 -3.708 1.00 . A A . 17 CYS C 1 1 12 10706 1 1 17 CYS CA C -1.386 -5.512 -2.495 1.00 . A A . 17 CYS CA 1 1 12 10707 1 1 17 CYS CB C -0.472 -4.603 -1.671 1.00 . A A . 17 CYS CB 1 1 12 10708 1 1 17 CYS H H 0.279 -6.873 -2.586 1.00 . A A . 17 CYS H 1 1 12 10709 1 1 17 CYS HA H -2.212 -5.839 -1.885 1.00 . A A . 17 CYS HA 1 1 12 10710 1 1 17 CYS HB2 H -1.068 -3.850 -1.181 1.00 . A A . 17 CYS HB2 1 1 12 10711 1 1 17 CYS HB3 H 0.047 -5.190 -0.929 1.00 . A A . 17 CYS HB3 1 1 12 10712 1 1 17 CYS N N -0.610 -6.695 -2.957 1.00 . A A . 17 CYS N 1 1 12 10713 1 1 17 CYS O O -3.070 -4.373 -3.767 1.00 . A A . 17 CYS O 1 1 12 10714 1 1 17 CYS SG S 0.800 -3.726 -2.652 1.00 . A A . 17 CYS SG 1 1 12 10715 1 1 18 VAL C C -2.816 -4.416 -6.419 1.00 . A A . 18 VAL C 1 1 12 10716 1 1 18 VAL CA C -1.528 -3.780 -5.891 1.00 . A A . 18 VAL CA 1 1 12 10717 1 1 18 VAL CB C -0.445 -3.854 -6.967 1.00 . A A . 18 VAL CB 1 1 12 10718 1 1 18 VAL CG1 C -0.901 -3.079 -8.205 1.00 . A A . 18 VAL CG1 1 1 12 10719 1 1 18 VAL CG2 C 0.850 -3.241 -6.428 1.00 . A A . 18 VAL CG2 1 1 12 10720 1 1 18 VAL H H -0.149 -4.829 -4.614 1.00 . A A . 18 VAL H 1 1 12 10721 1 1 18 VAL HA H -1.714 -2.748 -5.636 1.00 . A A . 18 VAL HA 1 1 12 10722 1 1 18 VAL HB H -0.274 -4.887 -7.232 1.00 . A A . 18 VAL HB 1 1 12 10723 1 1 18 VAL HG11 H -1.919 -3.350 -8.444 1.00 . A A . 18 VAL HG11 1 1 12 10724 1 1 18 VAL HG12 H -0.848 -2.019 -8.006 1.00 . A A . 18 VAL HG12 1 1 12 10725 1 1 18 VAL HG13 H -0.259 -3.322 -9.039 1.00 . A A . 18 VAL HG13 1 1 12 10726 1 1 18 VAL HG21 H 0.612 -2.489 -5.691 1.00 . A A . 18 VAL HG21 1 1 12 10727 1 1 18 VAL HG22 H 1.451 -4.014 -5.973 1.00 . A A . 18 VAL HG22 1 1 12 10728 1 1 18 VAL HG23 H 1.399 -2.789 -7.241 1.00 . A A . 18 VAL HG23 1 1 12 10729 1 1 18 VAL N N -1.076 -4.516 -4.680 1.00 . A A . 18 VAL N 1 1 12 10730 1 1 18 VAL O O -3.660 -3.749 -6.985 1.00 . A A . 18 VAL O 1 1 12 10731 1 1 19 GLU C C -5.363 -6.071 -5.787 1.00 . A A . 19 GLU C 1 1 12 10732 1 1 19 GLU CA C -4.211 -6.366 -6.738 1.00 . A A . 19 GLU CA 1 1 12 10733 1 1 19 GLU CB C -3.989 -7.877 -6.832 1.00 . A A . 19 GLU CB 1 1 12 10734 1 1 19 GLU CD C -4.758 -8.590 -9.098 1.00 . A A . 19 GLU CD 1 1 12 10735 1 1 19 GLU CG C -3.536 -8.239 -8.247 1.00 . A A . 19 GLU CG 1 1 12 10736 1 1 19 GLU H H -2.284 -6.223 -5.782 1.00 . A A . 19 GLU H 1 1 12 10737 1 1 19 GLU HA H -4.454 -5.972 -7.709 1.00 . A A . 19 GLU HA 1 1 12 10738 1 1 19 GLU HB2 H -3.230 -8.175 -6.122 1.00 . A A . 19 GLU HB2 1 1 12 10739 1 1 19 GLU HB3 H -4.912 -8.391 -6.609 1.00 . A A . 19 GLU HB3 1 1 12 10740 1 1 19 GLU HG2 H -3.020 -7.398 -8.686 1.00 . A A . 19 GLU HG2 1 1 12 10741 1 1 19 GLU HG3 H -2.873 -9.089 -8.207 1.00 . A A . 19 GLU HG3 1 1 12 10742 1 1 19 GLU N N -2.975 -5.699 -6.240 1.00 . A A . 19 GLU N 1 1 12 10743 1 1 19 GLU O O -6.493 -5.902 -6.203 1.00 . A A . 19 GLU O 1 1 12 10744 1 1 19 GLU OE1 O -5.794 -7.979 -8.890 1.00 . A A . 19 GLU OE1 1 1 12 10745 1 1 19 GLU OE2 O -4.637 -9.463 -9.942 1.00 . A A . 19 GLU OE2 1 1 12 10746 1 1 20 ILE C C -6.427 -4.138 -3.612 1.00 . A A . 20 ILE C 1 1 12 10747 1 1 20 ILE CA C -6.179 -5.649 -3.563 1.00 . A A . 20 ILE CA 1 1 12 10748 1 1 20 ILE CB C -5.775 -6.059 -2.149 1.00 . A A . 20 ILE CB 1 1 12 10749 1 1 20 ILE CD1 C -4.201 -7.950 -1.808 1.00 . A A . 20 ILE CD1 1 1 12 10750 1 1 20 ILE CG1 C -5.656 -7.559 -2.068 1.00 . A A . 20 ILE CG1 1 1 12 10751 1 1 20 ILE CG2 C -6.829 -5.583 -1.150 1.00 . A A . 20 ILE CG2 1 1 12 10752 1 1 20 ILE H H -4.171 -6.088 -4.201 1.00 . A A . 20 ILE H 1 1 12 10753 1 1 20 ILE HA H -7.080 -6.173 -3.851 1.00 . A A . 20 ILE HA 1 1 12 10754 1 1 20 ILE HB H -4.835 -5.637 -1.906 1.00 . A A . 20 ILE HB 1 1 12 10755 1 1 20 ILE HD11 H -3.587 -7.064 -1.797 1.00 . A A . 20 ILE HD11 1 1 12 10756 1 1 20 ILE HD12 H -4.129 -8.450 -0.854 1.00 . A A . 20 ILE HD12 1 1 12 10757 1 1 20 ILE HD13 H -3.862 -8.616 -2.589 1.00 . A A . 20 ILE HD13 1 1 12 10758 1 1 20 ILE HG12 H -6.269 -7.906 -1.268 1.00 . A A . 20 ILE HG12 1 1 12 10759 1 1 20 ILE HG13 H -5.979 -7.982 -2.990 1.00 . A A . 20 ILE HG13 1 1 12 10760 1 1 20 ILE HG21 H -7.798 -5.578 -1.625 1.00 . A A . 20 ILE HG21 1 1 12 10761 1 1 20 ILE HG22 H -6.847 -6.250 -0.301 1.00 . A A . 20 ILE HG22 1 1 12 10762 1 1 20 ILE HG23 H -6.587 -4.585 -0.820 1.00 . A A . 20 ILE HG23 1 1 12 10763 1 1 20 ILE N N -5.090 -5.973 -4.519 1.00 . A A . 20 ILE N 1 1 12 10764 1 1 20 ILE O O -7.207 -3.600 -2.851 1.00 . A A . 20 ILE O 1 1 12 10765 1 1 21 ALA C C -5.208 -1.456 -5.846 1.00 . A A . 21 ALA C 1 1 12 10766 1 1 21 ALA CA C -5.957 -1.973 -4.614 1.00 . A A . 21 ALA CA 1 1 12 10767 1 1 21 ALA CB C -5.410 -1.291 -3.358 1.00 . A A . 21 ALA CB 1 1 12 10768 1 1 21 ALA H H -5.136 -3.901 -5.120 1.00 . A A . 21 ALA H 1 1 12 10769 1 1 21 ALA HA H -7.009 -1.754 -4.715 1.00 . A A . 21 ALA HA 1 1 12 10770 1 1 21 ALA HB1 H -4.654 -1.916 -2.907 1.00 . A A . 21 ALA HB1 1 1 12 10771 1 1 21 ALA HB2 H -4.978 -0.338 -3.626 1.00 . A A . 21 ALA HB2 1 1 12 10772 1 1 21 ALA HB3 H -6.215 -1.135 -2.655 1.00 . A A . 21 ALA HB3 1 1 12 10773 1 1 21 ALA N N -5.763 -3.448 -4.510 1.00 . A A . 21 ALA N 1 1 12 10774 1 1 21 ALA O O -4.261 -0.699 -5.732 1.00 . A A . 21 ALA O 1 1 12 10775 1 1 22 PRO C C -5.359 -0.019 -8.576 1.00 . A A . 22 PRO C 1 1 12 10776 1 1 22 PRO CA C -5.044 -1.485 -8.277 1.00 . A A . 22 PRO CA 1 1 12 10777 1 1 22 PRO CB C -5.697 -2.408 -9.306 1.00 . A A . 22 PRO CB 1 1 12 10778 1 1 22 PRO CD C -6.804 -2.800 -7.189 1.00 . A A . 22 PRO CD 1 1 12 10779 1 1 22 PRO CG C -7.002 -2.803 -8.688 1.00 . A A . 22 PRO CG 1 1 12 10780 1 1 22 PRO HA H -3.978 -1.650 -8.255 1.00 . A A . 22 PRO HA 1 1 12 10781 1 1 22 PRO HB2 H -5.830 -1.867 -10.235 1.00 . A A . 22 PRO HB2 1 1 12 10782 1 1 22 PRO HB3 H -5.064 -3.264 -9.475 1.00 . A A . 22 PRO HB3 1 1 12 10783 1 1 22 PRO HD2 H -7.689 -2.425 -6.693 1.00 . A A . 22 PRO HD2 1 1 12 10784 1 1 22 PRO HD3 H -6.560 -3.790 -6.836 1.00 . A A . 22 PRO HD3 1 1 12 10785 1 1 22 PRO HG2 H -7.766 -2.090 -8.965 1.00 . A A . 22 PRO HG2 1 1 12 10786 1 1 22 PRO HG3 H -7.279 -3.792 -9.017 1.00 . A A . 22 PRO HG3 1 1 12 10787 1 1 22 PRO N N -5.668 -1.894 -6.990 1.00 . A A . 22 PRO N 1 1 12 10788 1 1 22 PRO O O -6.112 0.298 -9.474 1.00 . A A . 22 PRO O 1 1 12 10789 1 1 23 GLY C C -4.282 3.121 -6.985 1.00 . A A . 23 GLY C 1 1 12 10790 1 1 23 GLY CA C -5.038 2.323 -8.045 1.00 . A A . 23 GLY CA 1 1 12 10791 1 1 23 GLY H H -4.182 0.589 -7.104 1.00 . A A . 23 GLY H 1 1 12 10792 1 1 23 GLY HA2 H -4.693 2.604 -9.030 1.00 . A A . 23 GLY HA2 1 1 12 10793 1 1 23 GLY HA3 H -6.095 2.525 -7.957 1.00 . A A . 23 GLY HA3 1 1 12 10794 1 1 23 GLY N N -4.785 0.874 -7.823 1.00 . A A . 23 GLY N 1 1 12 10795 1 1 23 GLY O O -3.650 4.116 -7.275 1.00 . A A . 23 GLY O 1 1 12 10796 1 1 24 ALA C C -2.223 2.774 -4.501 1.00 . A A . 24 ALA C 1 1 12 10797 1 1 24 ALA CA C -3.610 3.395 -4.673 1.00 . A A . 24 ALA CA 1 1 12 10798 1 1 24 ALA CB C -4.391 3.260 -3.365 1.00 . A A . 24 ALA CB 1 1 12 10799 1 1 24 ALA H H -4.841 1.865 -5.555 1.00 . A A . 24 ALA H 1 1 12 10800 1 1 24 ALA HA H -3.511 4.438 -4.931 1.00 . A A . 24 ALA HA 1 1 12 10801 1 1 24 ALA HB1 H -5.451 3.259 -3.576 1.00 . A A . 24 ALA HB1 1 1 12 10802 1 1 24 ALA HB2 H -4.120 2.335 -2.877 1.00 . A A . 24 ALA HB2 1 1 12 10803 1 1 24 ALA HB3 H -4.154 4.091 -2.718 1.00 . A A . 24 ALA HB3 1 1 12 10804 1 1 24 ALA N N -4.332 2.677 -5.759 1.00 . A A . 24 ALA N 1 1 12 10805 1 1 24 ALA O O -1.269 3.443 -4.160 1.00 . A A . 24 ALA O 1 1 12 10806 1 1 25 PHE C C -0.213 0.542 -5.985 1.00 . A A . 25 PHE C 1 1 12 10807 1 1 25 PHE CA C -0.781 0.830 -4.590 1.00 . A A . 25 PHE CA 1 1 12 10808 1 1 25 PHE CB C -0.967 -0.494 -3.838 1.00 . A A . 25 PHE CB 1 1 12 10809 1 1 25 PHE CD1 C 1.300 0.019 -2.811 1.00 . A A . 25 PHE CD1 1 1 12 10810 1 1 25 PHE CD2 C -0.173 -1.548 -1.695 1.00 . A A . 25 PHE CD2 1 1 12 10811 1 1 25 PHE CE1 C 2.260 -0.175 -1.805 1.00 . A A . 25 PHE CE1 1 1 12 10812 1 1 25 PHE CE2 C 0.789 -1.743 -0.697 1.00 . A A . 25 PHE CE2 1 1 12 10813 1 1 25 PHE CG C 0.080 -0.668 -2.755 1.00 . A A . 25 PHE CG 1 1 12 10814 1 1 25 PHE CZ C 2.006 -1.055 -0.752 1.00 . A A . 25 PHE CZ 1 1 12 10815 1 1 25 PHE H H -2.889 0.975 -5.013 1.00 . A A . 25 PHE H 1 1 12 10816 1 1 25 PHE HA H -0.110 1.479 -4.043 1.00 . A A . 25 PHE HA 1 1 12 10817 1 1 25 PHE HB2 H -1.948 -0.510 -3.387 1.00 . A A . 25 PHE HB2 1 1 12 10818 1 1 25 PHE HB3 H -0.887 -1.310 -4.540 1.00 . A A . 25 PHE HB3 1 1 12 10819 1 1 25 PHE HD1 H 1.502 0.700 -3.621 1.00 . A A . 25 PHE HD1 1 1 12 10820 1 1 25 PHE HD2 H -1.113 -2.075 -1.649 1.00 . A A . 25 PHE HD2 1 1 12 10821 1 1 25 PHE HE1 H 3.194 0.354 -1.842 1.00 . A A . 25 PHE HE1 1 1 12 10822 1 1 25 PHE HE2 H 0.591 -2.422 0.119 1.00 . A A . 25 PHE HE2 1 1 12 10823 1 1 25 PHE HZ H 2.748 -1.209 0.011 1.00 . A A . 25 PHE HZ 1 1 12 10824 1 1 25 PHE N N -2.106 1.497 -4.737 1.00 . A A . 25 PHE N 1 1 12 10825 1 1 25 PHE O O -0.934 0.181 -6.895 1.00 . A A . 25 PHE O 1 1 12 10826 1 1 26 ALA C C 3.203 0.564 -7.390 1.00 . A A . 26 ALA C 1 1 12 10827 1 1 26 ALA CA C 1.682 0.428 -7.496 1.00 . A A . 26 ALA CA 1 1 12 10828 1 1 26 ALA CB C 1.150 1.436 -8.516 1.00 . A A . 26 ALA CB 1 1 12 10829 1 1 26 ALA H H 1.630 0.985 -5.419 1.00 . A A . 26 ALA H 1 1 12 10830 1 1 26 ALA HA H 1.431 -0.574 -7.813 1.00 . A A . 26 ALA HA 1 1 12 10831 1 1 26 ALA HB1 H 0.752 2.295 -7.997 1.00 . A A . 26 ALA HB1 1 1 12 10832 1 1 26 ALA HB2 H 1.955 1.749 -9.165 1.00 . A A . 26 ALA HB2 1 1 12 10833 1 1 26 ALA HB3 H 0.371 0.977 -9.105 1.00 . A A . 26 ALA HB3 1 1 12 10834 1 1 26 ALA N N 1.069 0.696 -6.162 1.00 . A A . 26 ALA N 1 1 12 10835 1 1 26 ALA O O 3.714 1.574 -6.954 1.00 . A A . 26 ALA O 1 1 12 10836 1 1 27 MET C C 5.912 0.821 -8.510 1.00 . A A . 27 MET C 1 1 12 10837 1 1 27 MET CA C 5.416 -0.366 -7.695 1.00 . A A . 27 MET CA 1 1 12 10838 1 1 27 MET CB C 6.035 -1.654 -8.242 1.00 . A A . 27 MET CB 1 1 12 10839 1 1 27 MET CE C 6.027 -5.467 -8.004 1.00 . A A . 27 MET CE 1 1 12 10840 1 1 27 MET CG C 5.365 -2.866 -7.591 1.00 . A A . 27 MET CG 1 1 12 10841 1 1 27 MET H H 3.501 -1.254 -8.130 1.00 . A A . 27 MET H 1 1 12 10842 1 1 27 MET HA H 5.701 -0.234 -6.674 1.00 . A A . 27 MET HA 1 1 12 10843 1 1 27 MET HB2 H 5.892 -1.695 -9.312 1.00 . A A . 27 MET HB2 1 1 12 10844 1 1 27 MET HB3 H 7.092 -1.668 -8.020 1.00 . A A . 27 MET HB3 1 1 12 10845 1 1 27 MET HE1 H 7.053 -5.154 -7.866 1.00 . A A . 27 MET HE1 1 1 12 10846 1 1 27 MET HE2 H 5.574 -5.669 -7.044 1.00 . A A . 27 MET HE2 1 1 12 10847 1 1 27 MET HE3 H 6.003 -6.361 -8.605 1.00 . A A . 27 MET HE3 1 1 12 10848 1 1 27 MET HG2 H 5.999 -3.249 -6.806 1.00 . A A . 27 MET HG2 1 1 12 10849 1 1 27 MET HG3 H 4.413 -2.572 -7.174 1.00 . A A . 27 MET HG3 1 1 12 10850 1 1 27 MET N N 3.930 -0.445 -7.782 1.00 . A A . 27 MET N 1 1 12 10851 1 1 27 MET O O 5.268 1.240 -9.453 1.00 . A A . 27 MET O 1 1 12 10852 1 1 27 MET SD S 5.105 -4.152 -8.839 1.00 . A A . 27 MET SD 1 1 12 10853 1 1 28 ASP C C 8.941 2.167 -9.435 1.00 . A A . 28 ASP C 1 1 12 10854 1 1 28 ASP CA C 7.542 2.514 -8.982 1.00 . A A . 28 ASP CA 1 1 12 10855 1 1 28 ASP CB C 7.572 3.766 -8.117 1.00 . A A . 28 ASP CB 1 1 12 10856 1 1 28 ASP CG C 6.990 4.946 -8.896 1.00 . A A . 28 ASP CG 1 1 12 10857 1 1 28 ASP H H 7.610 1.040 -7.421 1.00 . A A . 28 ASP H 1 1 12 10858 1 1 28 ASP HA H 6.901 2.667 -9.838 1.00 . A A . 28 ASP HA 1 1 12 10859 1 1 28 ASP HB2 H 6.987 3.599 -7.223 1.00 . A A . 28 ASP HB2 1 1 12 10860 1 1 28 ASP HB3 H 8.591 3.978 -7.846 1.00 . A A . 28 ASP HB3 1 1 12 10861 1 1 28 ASP N N 7.056 1.376 -8.183 1.00 . A A . 28 ASP N 1 1 12 10862 1 1 28 ASP O O 9.539 1.273 -8.874 1.00 . A A . 28 ASP O 1 1 12 10863 1 1 28 ASP OD1 O 5.994 4.750 -9.572 1.00 . A A . 28 ASP OD1 1 1 12 10864 1 1 28 ASP OD2 O 7.552 6.025 -8.807 1.00 . A A . 28 ASP OD2 1 1 12 10865 1 1 29 PRO C C 11.762 3.408 -10.095 1.00 . A A . 29 PRO C 1 1 12 10866 1 1 29 PRO CA C 10.768 2.648 -10.959 1.00 . A A . 29 PRO CA 1 1 12 10867 1 1 29 PRO CB C 10.699 3.226 -12.369 1.00 . A A . 29 PRO CB 1 1 12 10868 1 1 29 PRO CD C 8.740 3.982 -11.109 1.00 . A A . 29 PRO CD 1 1 12 10869 1 1 29 PRO CG C 9.602 4.254 -12.327 1.00 . A A . 29 PRO CG 1 1 12 10870 1 1 29 PRO HA H 11.000 1.595 -10.989 1.00 . A A . 29 PRO HA 1 1 12 10871 1 1 29 PRO HB2 H 11.658 3.663 -12.619 1.00 . A A . 29 PRO HB2 1 1 12 10872 1 1 29 PRO HB3 H 10.473 2.438 -13.069 1.00 . A A . 29 PRO HB3 1 1 12 10873 1 1 29 PRO HD2 H 8.702 4.860 -10.478 1.00 . A A . 29 PRO HD2 1 1 12 10874 1 1 29 PRO HD3 H 7.751 3.689 -11.401 1.00 . A A . 29 PRO HD3 1 1 12 10875 1 1 29 PRO HG2 H 10.037 5.241 -12.258 1.00 . A A . 29 PRO HG2 1 1 12 10876 1 1 29 PRO HG3 H 9.002 4.178 -13.220 1.00 . A A . 29 PRO HG3 1 1 12 10877 1 1 29 PRO N N 9.413 2.882 -10.421 1.00 . A A . 29 PRO N 1 1 12 10878 1 1 29 PRO O O 12.948 3.149 -10.099 1.00 . A A . 29 PRO O 1 1 12 10879 1 1 30 GLU C C 12.225 4.337 -7.114 1.00 . A A . 30 GLU C 1 1 12 10880 1 1 30 GLU CA C 12.138 5.112 -8.419 1.00 . A A . 30 GLU CA 1 1 12 10881 1 1 30 GLU CB C 11.536 6.496 -8.168 1.00 . A A . 30 GLU CB 1 1 12 10882 1 1 30 GLU CD C 12.221 8.800 -7.489 1.00 . A A . 30 GLU CD 1 1 12 10883 1 1 30 GLU CG C 12.634 7.557 -8.276 1.00 . A A . 30 GLU CG 1 1 12 10884 1 1 30 GLU H H 10.291 4.493 -9.335 1.00 . A A . 30 GLU H 1 1 12 10885 1 1 30 GLU HA H 13.123 5.210 -8.854 1.00 . A A . 30 GLU HA 1 1 12 10886 1 1 30 GLU HB2 H 10.769 6.693 -8.902 1.00 . A A . 30 GLU HB2 1 1 12 10887 1 1 30 GLU HB3 H 11.105 6.526 -7.179 1.00 . A A . 30 GLU HB3 1 1 12 10888 1 1 30 GLU HG2 H 13.555 7.163 -7.872 1.00 . A A . 30 GLU HG2 1 1 12 10889 1 1 30 GLU HG3 H 12.779 7.820 -9.313 1.00 . A A . 30 GLU HG3 1 1 12 10890 1 1 30 GLU N N 11.261 4.334 -9.329 1.00 . A A . 30 GLU N 1 1 12 10891 1 1 30 GLU O O 13.254 4.272 -6.473 1.00 . A A . 30 GLU O 1 1 12 10892 1 1 30 GLU OE1 O 11.039 8.940 -7.218 1.00 . A A . 30 GLU OE1 1 1 12 10893 1 1 30 GLU OE2 O 13.093 9.591 -7.170 1.00 . A A . 30 GLU OE2 1 1 12 10894 1 1 31 ILE C C 11.164 1.426 -5.895 1.00 . A A . 31 ILE C 1 1 12 10895 1 1 31 ILE CA C 11.141 2.893 -5.506 1.00 . A A . 31 ILE CA 1 1 12 10896 1 1 31 ILE CB C 9.901 3.188 -4.660 1.00 . A A . 31 ILE CB 1 1 12 10897 1 1 31 ILE CD1 C 7.488 3.813 -4.724 1.00 . A A . 31 ILE CD1 1 1 12 10898 1 1 31 ILE CG1 C 8.733 3.547 -5.571 1.00 . A A . 31 ILE CG1 1 1 12 10899 1 1 31 ILE CG2 C 10.195 4.361 -3.723 1.00 . A A . 31 ILE CG2 1 1 12 10900 1 1 31 ILE H H 10.336 3.759 -7.295 1.00 . A A . 31 ILE H 1 1 12 10901 1 1 31 ILE HA H 12.007 3.106 -4.945 1.00 . A A . 31 ILE HA 1 1 12 10902 1 1 31 ILE HB H 9.651 2.315 -4.075 1.00 . A A . 31 ILE HB 1 1 12 10903 1 1 31 ILE HD11 H 7.594 3.329 -3.764 1.00 . A A . 31 ILE HD11 1 1 12 10904 1 1 31 ILE HD12 H 7.372 4.877 -4.579 1.00 . A A . 31 ILE HD12 1 1 12 10905 1 1 31 ILE HD13 H 6.618 3.422 -5.230 1.00 . A A . 31 ILE HD13 1 1 12 10906 1 1 31 ILE HG12 H 8.980 4.430 -6.134 1.00 . A A . 31 ILE HG12 1 1 12 10907 1 1 31 ILE HG13 H 8.537 2.729 -6.248 1.00 . A A . 31 ILE HG13 1 1 12 10908 1 1 31 ILE HG21 H 11.250 4.384 -3.495 1.00 . A A . 31 ILE HG21 1 1 12 10909 1 1 31 ILE HG22 H 9.909 5.286 -4.202 1.00 . A A . 31 ILE HG22 1 1 12 10910 1 1 31 ILE HG23 H 9.632 4.241 -2.809 1.00 . A A . 31 ILE HG23 1 1 12 10911 1 1 31 ILE N N 11.142 3.712 -6.741 1.00 . A A . 31 ILE N 1 1 12 10912 1 1 31 ILE O O 11.190 0.560 -5.046 1.00 . A A . 31 ILE O 1 1 12 10913 1 1 32 GLU C C 10.350 -1.097 -6.674 1.00 . A A . 32 GLU C 1 1 12 10914 1 1 32 GLU CA C 11.157 -0.266 -7.653 1.00 . A A . 32 GLU CA 1 1 12 10915 1 1 32 GLU CB C 12.592 -0.791 -7.725 1.00 . A A . 32 GLU CB 1 1 12 10916 1 1 32 GLU CD C 13.041 -2.171 -9.759 1.00 . A A . 32 GLU CD 1 1 12 10917 1 1 32 GLU CG C 13.077 -0.757 -9.176 1.00 . A A . 32 GLU CG 1 1 12 10918 1 1 32 GLU H H 11.130 1.873 -7.835 1.00 . A A . 32 GLU H 1 1 12 10919 1 1 32 GLU HA H 10.697 -0.312 -8.628 1.00 . A A . 32 GLU HA 1 1 12 10920 1 1 32 GLU HB2 H 13.234 -0.170 -7.115 1.00 . A A . 32 GLU HB2 1 1 12 10921 1 1 32 GLU HB3 H 12.623 -1.807 -7.361 1.00 . A A . 32 GLU HB3 1 1 12 10922 1 1 32 GLU HG2 H 12.432 -0.112 -9.756 1.00 . A A . 32 GLU HG2 1 1 12 10923 1 1 32 GLU HG3 H 14.088 -0.381 -9.211 1.00 . A A . 32 GLU HG3 1 1 12 10924 1 1 32 GLU N N 11.153 1.147 -7.179 1.00 . A A . 32 GLU N 1 1 12 10925 1 1 32 GLU O O 10.687 -2.220 -6.360 1.00 . A A . 32 GLU O 1 1 12 10926 1 1 32 GLU OE1 O 13.471 -3.084 -9.073 1.00 . A A . 32 GLU OE1 1 1 12 10927 1 1 32 GLU OE2 O 12.584 -2.318 -10.881 1.00 . A A . 32 GLU OE2 1 1 12 10928 1 1 33 LYS C C 7.091 -0.651 -5.010 1.00 . A A . 33 LYS C 1 1 12 10929 1 1 33 LYS CA C 8.476 -1.277 -5.156 1.00 . A A . 33 LYS CA 1 1 12 10930 1 1 33 LYS CB C 9.177 -1.243 -3.795 1.00 . A A . 33 LYS CB 1 1 12 10931 1 1 33 LYS CD C 11.175 -2.310 -2.744 1.00 . A A . 33 LYS CD 1 1 12 10932 1 1 33 LYS CE C 12.395 -2.436 -3.656 1.00 . A A . 33 LYS CE 1 1 12 10933 1 1 33 LYS CG C 9.902 -2.568 -3.552 1.00 . A A . 33 LYS CG 1 1 12 10934 1 1 33 LYS H H 9.058 0.406 -6.431 1.00 . A A . 33 LYS H 1 1 12 10935 1 1 33 LYS HA H 8.372 -2.304 -5.472 1.00 . A A . 33 LYS HA 1 1 12 10936 1 1 33 LYS HB2 H 9.889 -0.435 -3.777 1.00 . A A . 33 LYS HB2 1 1 12 10937 1 1 33 LYS HB3 H 8.443 -1.091 -3.018 1.00 . A A . 33 LYS HB3 1 1 12 10938 1 1 33 LYS HD2 H 11.139 -1.315 -2.324 1.00 . A A . 33 LYS HD2 1 1 12 10939 1 1 33 LYS HD3 H 11.248 -3.033 -1.946 1.00 . A A . 33 LYS HD3 1 1 12 10940 1 1 33 LYS HE2 H 12.592 -3.479 -3.854 1.00 . A A . 33 LYS HE2 1 1 12 10941 1 1 33 LYS HE3 H 12.204 -1.923 -4.587 1.00 . A A . 33 LYS HE3 1 1 12 10942 1 1 33 LYS HG2 H 9.254 -3.237 -3.001 1.00 . A A . 33 LYS HG2 1 1 12 10943 1 1 33 LYS HG3 H 10.163 -3.017 -4.498 1.00 . A A . 33 LYS HG3 1 1 12 10944 1 1 33 LYS HZ1 H 13.265 -1.291 -2.150 1.00 . A A . 33 LYS HZ1 1 1 12 10945 1 1 33 LYS HZ2 H 14.237 -2.574 -2.692 1.00 . A A . 33 LYS HZ2 1 1 12 10946 1 1 33 LYS HZ3 H 14.060 -1.184 -3.648 1.00 . A A . 33 LYS HZ3 1 1 12 10947 1 1 33 LYS N N 9.296 -0.525 -6.163 1.00 . A A . 33 LYS N 1 1 12 10948 1 1 33 LYS NZ N 13.578 -1.826 -2.986 1.00 . A A . 33 LYS NZ 1 1 12 10949 1 1 33 LYS O O 6.915 0.541 -5.161 1.00 . A A . 33 LYS O 1 1 12 10950 1 1 34 ALA C C 4.694 0.225 -3.566 1.00 . A A . 34 ALA C 1 1 12 10951 1 1 34 ALA CA C 4.713 -0.934 -4.564 1.00 . A A . 34 ALA CA 1 1 12 10952 1 1 34 ALA CB C 3.804 -2.053 -4.052 1.00 . A A . 34 ALA CB 1 1 12 10953 1 1 34 ALA H H 6.275 -2.416 -4.606 1.00 . A A . 34 ALA H 1 1 12 10954 1 1 34 ALA HA H 4.347 -0.590 -5.519 1.00 . A A . 34 ALA HA 1 1 12 10955 1 1 34 ALA HB1 H 4.366 -2.973 -3.989 1.00 . A A . 34 ALA HB1 1 1 12 10956 1 1 34 ALA HB2 H 3.429 -1.793 -3.072 1.00 . A A . 34 ALA HB2 1 1 12 10957 1 1 34 ALA HB3 H 2.976 -2.183 -4.732 1.00 . A A . 34 ALA HB3 1 1 12 10958 1 1 34 ALA N N 6.102 -1.458 -4.719 1.00 . A A . 34 ALA N 1 1 12 10959 1 1 34 ALA O O 5.428 0.237 -2.603 1.00 . A A . 34 ALA O 1 1 12 10960 1 1 35 TYR C C 2.297 2.880 -2.848 1.00 . A A . 35 TYR C 1 1 12 10961 1 1 35 TYR CA C 3.734 2.356 -2.854 1.00 . A A . 35 TYR CA 1 1 12 10962 1 1 35 TYR CB C 4.721 3.460 -3.276 1.00 . A A . 35 TYR CB 1 1 12 10963 1 1 35 TYR CD1 C 3.361 3.693 -5.410 1.00 . A A . 35 TYR CD1 1 1 12 10964 1 1 35 TYR CD2 C 4.588 5.611 -4.585 1.00 . A A . 35 TYR CD2 1 1 12 10965 1 1 35 TYR CE1 C 2.908 4.450 -6.496 1.00 . A A . 35 TYR CE1 1 1 12 10966 1 1 35 TYR CE2 C 4.132 6.370 -5.670 1.00 . A A . 35 TYR CE2 1 1 12 10967 1 1 35 TYR CG C 4.202 4.270 -4.451 1.00 . A A . 35 TYR CG 1 1 12 10968 1 1 35 TYR CZ C 3.292 5.788 -6.626 1.00 . A A . 35 TYR CZ 1 1 12 10969 1 1 35 TYR H H 3.249 1.131 -4.563 1.00 . A A . 35 TYR H 1 1 12 10970 1 1 35 TYR HA H 3.981 2.032 -1.847 1.00 . A A . 35 TYR HA 1 1 12 10971 1 1 35 TYR HB2 H 4.887 4.123 -2.440 1.00 . A A . 35 TYR HB2 1 1 12 10972 1 1 35 TYR HB3 H 5.658 3.003 -3.551 1.00 . A A . 35 TYR HB3 1 1 12 10973 1 1 35 TYR HD1 H 3.059 2.669 -5.314 1.00 . A A . 35 TYR HD1 1 1 12 10974 1 1 35 TYR HD2 H 5.236 6.062 -3.848 1.00 . A A . 35 TYR HD2 1 1 12 10975 1 1 35 TYR HE1 H 2.261 4.001 -7.235 1.00 . A A . 35 TYR HE1 1 1 12 10976 1 1 35 TYR HE2 H 4.429 7.404 -5.770 1.00 . A A . 35 TYR HE2 1 1 12 10977 1 1 35 TYR HH H 3.500 6.470 -8.398 1.00 . A A . 35 TYR HH 1 1 12 10978 1 1 35 TYR N N 3.837 1.187 -3.788 1.00 . A A . 35 TYR N 1 1 12 10979 1 1 35 TYR O O 1.587 2.812 -3.832 1.00 . A A . 35 TYR O 1 1 12 10980 1 1 35 TYR OH O 2.845 6.534 -7.699 1.00 . A A . 35 TYR OH 1 1 12 10981 1 1 36 VAL C C 0.470 5.379 -2.063 1.00 . A A . 36 VAL C 1 1 12 10982 1 1 36 VAL CA C 0.463 3.904 -1.648 1.00 . A A . 36 VAL CA 1 1 12 10983 1 1 36 VAL CB C -0.045 3.722 -0.204 1.00 . A A . 36 VAL CB 1 1 12 10984 1 1 36 VAL CG1 C -0.920 4.897 0.228 1.00 . A A . 36 VAL CG1 1 1 12 10985 1 1 36 VAL CG2 C -0.870 2.436 -0.121 1.00 . A A . 36 VAL CG2 1 1 12 10986 1 1 36 VAL H H 2.438 3.421 -0.948 1.00 . A A . 36 VAL H 1 1 12 10987 1 1 36 VAL HA H -0.168 3.345 -2.326 1.00 . A A . 36 VAL HA 1 1 12 10988 1 1 36 VAL HB H 0.800 3.646 0.463 1.00 . A A . 36 VAL HB 1 1 12 10989 1 1 36 VAL HG11 H -1.400 5.323 -0.637 1.00 . A A . 36 VAL HG11 1 1 12 10990 1 1 36 VAL HG12 H -1.669 4.545 0.923 1.00 . A A . 36 VAL HG12 1 1 12 10991 1 1 36 VAL HG13 H -0.305 5.643 0.707 1.00 . A A . 36 VAL HG13 1 1 12 10992 1 1 36 VAL HG21 H -0.307 1.619 -0.548 1.00 . A A . 36 VAL HG21 1 1 12 10993 1 1 36 VAL HG22 H -1.095 2.218 0.911 1.00 . A A . 36 VAL HG22 1 1 12 10994 1 1 36 VAL HG23 H -1.791 2.564 -0.671 1.00 . A A . 36 VAL HG23 1 1 12 10995 1 1 36 VAL N N 1.855 3.387 -1.734 1.00 . A A . 36 VAL N 1 1 12 10996 1 1 36 VAL O O 0.767 6.255 -1.275 1.00 . A A . 36 VAL O 1 1 12 10997 1 1 37 LYS C C -1.235 7.593 -3.988 1.00 . A A . 37 LYS C 1 1 12 10998 1 1 37 LYS CA C 0.187 7.068 -3.777 1.00 . A A . 37 LYS CA 1 1 12 10999 1 1 37 LYS CB C 0.949 7.145 -5.101 1.00 . A A . 37 LYS CB 1 1 12 11000 1 1 37 LYS CD C 0.165 7.072 -7.472 1.00 . A A . 37 LYS CD 1 1 12 11001 1 1 37 LYS CE C 0.352 6.107 -8.644 1.00 . A A . 37 LYS CE 1 1 12 11002 1 1 37 LYS CG C 0.235 6.296 -6.155 1.00 . A A . 37 LYS CG 1 1 12 11003 1 1 37 LYS H H -0.048 4.923 -3.928 1.00 . A A . 37 LYS H 1 1 12 11004 1 1 37 LYS HA H 0.688 7.682 -3.045 1.00 . A A . 37 LYS HA 1 1 12 11005 1 1 37 LYS HB2 H 0.993 8.172 -5.433 1.00 . A A . 37 LYS HB2 1 1 12 11006 1 1 37 LYS HB3 H 1.950 6.770 -4.959 1.00 . A A . 37 LYS HB3 1 1 12 11007 1 1 37 LYS HD2 H -0.798 7.556 -7.553 1.00 . A A . 37 LYS HD2 1 1 12 11008 1 1 37 LYS HD3 H 0.945 7.816 -7.493 1.00 . A A . 37 LYS HD3 1 1 12 11009 1 1 37 LYS HE2 H 1.139 6.471 -9.287 1.00 . A A . 37 LYS HE2 1 1 12 11010 1 1 37 LYS HE3 H 0.618 5.130 -8.269 1.00 . A A . 37 LYS HE3 1 1 12 11011 1 1 37 LYS HG2 H 0.780 5.377 -6.307 1.00 . A A . 37 LYS HG2 1 1 12 11012 1 1 37 LYS HG3 H -0.765 6.070 -5.821 1.00 . A A . 37 LYS HG3 1 1 12 11013 1 1 37 LYS HZ1 H -1.720 6.240 -8.797 1.00 . A A . 37 LYS HZ1 1 1 12 11014 1 1 37 LYS HZ2 H -0.894 6.686 -10.209 1.00 . A A . 37 LYS HZ2 1 1 12 11015 1 1 37 LYS HZ3 H -1.027 5.046 -9.788 1.00 . A A . 37 LYS HZ3 1 1 12 11016 1 1 37 LYS N N 0.169 5.653 -3.304 1.00 . A A . 37 LYS N 1 1 12 11017 1 1 37 LYS NZ N -0.919 6.012 -9.418 1.00 . A A . 37 LYS NZ 1 1 12 11018 1 1 37 LYS O O -1.484 8.778 -3.888 1.00 . A A . 37 LYS O 1 1 12 11019 1 1 38 ASP C C -4.526 6.526 -3.571 1.00 . A A . 38 ASP C 1 1 12 11020 1 1 38 ASP CA C -3.559 7.223 -4.527 1.00 . A A . 38 ASP CA 1 1 12 11021 1 1 38 ASP CB C -3.967 6.924 -5.970 1.00 . A A . 38 ASP CB 1 1 12 11022 1 1 38 ASP CG C -5.409 7.379 -6.197 1.00 . A A . 38 ASP CG 1 1 12 11023 1 1 38 ASP H H -1.957 5.786 -4.388 1.00 . A A . 38 ASP H 1 1 12 11024 1 1 38 ASP HA H -3.598 8.289 -4.360 1.00 . A A . 38 ASP HA 1 1 12 11025 1 1 38 ASP HB2 H -3.309 7.451 -6.646 1.00 . A A . 38 ASP HB2 1 1 12 11026 1 1 38 ASP HB3 H -3.894 5.862 -6.150 1.00 . A A . 38 ASP HB3 1 1 12 11027 1 1 38 ASP N N -2.170 6.738 -4.296 1.00 . A A . 38 ASP N 1 1 12 11028 1 1 38 ASP O O -5.230 5.609 -3.944 1.00 . A A . 38 ASP O 1 1 12 11029 1 1 38 ASP OD1 O -5.718 8.502 -5.835 1.00 . A A . 38 ASP OD1 1 1 12 11030 1 1 38 ASP OD2 O -6.180 6.597 -6.728 1.00 . A A . 38 ASP OD2 1 1 12 11031 1 1 39 VAL C C -6.873 6.136 -2.029 1.00 . A A . 39 VAL C 1 1 12 11032 1 1 39 VAL CA C -5.506 6.323 -1.370 1.00 . A A . 39 VAL CA 1 1 12 11033 1 1 39 VAL CB C -5.654 7.221 -0.142 1.00 . A A . 39 VAL CB 1 1 12 11034 1 1 39 VAL CG1 C -4.304 7.348 0.566 1.00 . A A . 39 VAL CG1 1 1 12 11035 1 1 39 VAL CG2 C -6.133 8.608 -0.579 1.00 . A A . 39 VAL CG2 1 1 12 11036 1 1 39 VAL H H -4.006 7.705 -2.062 1.00 . A A . 39 VAL H 1 1 12 11037 1 1 39 VAL HA H -5.114 5.362 -1.070 1.00 . A A . 39 VAL HA 1 1 12 11038 1 1 39 VAL HB H -6.375 6.787 0.535 1.00 . A A . 39 VAL HB 1 1 12 11039 1 1 39 VAL HG11 H -3.645 6.562 0.227 1.00 . A A . 39 VAL HG11 1 1 12 11040 1 1 39 VAL HG12 H -3.868 8.309 0.338 1.00 . A A . 39 VAL HG12 1 1 12 11041 1 1 39 VAL HG13 H -4.448 7.262 1.634 1.00 . A A . 39 VAL HG13 1 1 12 11042 1 1 39 VAL HG21 H -5.556 8.935 -1.432 1.00 . A A . 39 VAL HG21 1 1 12 11043 1 1 39 VAL HG22 H -7.177 8.560 -0.847 1.00 . A A . 39 VAL HG22 1 1 12 11044 1 1 39 VAL HG23 H -6.000 9.307 0.233 1.00 . A A . 39 VAL HG23 1 1 12 11045 1 1 39 VAL N N -4.575 6.960 -2.342 1.00 . A A . 39 VAL N 1 1 12 11046 1 1 39 VAL O O -7.475 5.084 -1.948 1.00 . A A . 39 VAL O 1 1 12 11047 1 1 40 GLU C C -8.660 5.892 -4.362 1.00 . A A . 40 GLU C 1 1 12 11048 1 1 40 GLU CA C -8.695 7.036 -3.349 1.00 . A A . 40 GLU CA 1 1 12 11049 1 1 40 GLU CB C -9.019 8.347 -4.070 1.00 . A A . 40 GLU CB 1 1 12 11050 1 1 40 GLU CD C -10.187 10.541 -3.827 1.00 . A A . 40 GLU CD 1 1 12 11051 1 1 40 GLU CG C -10.071 9.121 -3.273 1.00 . A A . 40 GLU CG 1 1 12 11052 1 1 40 GLU H H -6.865 7.991 -2.736 1.00 . A A . 40 GLU H 1 1 12 11053 1 1 40 GLU HA H -9.454 6.838 -2.606 1.00 . A A . 40 GLU HA 1 1 12 11054 1 1 40 GLU HB2 H -8.121 8.942 -4.156 1.00 . A A . 40 GLU HB2 1 1 12 11055 1 1 40 GLU HB3 H -9.403 8.131 -5.055 1.00 . A A . 40 GLU HB3 1 1 12 11056 1 1 40 GLU HG2 H -11.025 8.620 -3.358 1.00 . A A . 40 GLU HG2 1 1 12 11057 1 1 40 GLU HG3 H -9.777 9.164 -2.235 1.00 . A A . 40 GLU HG3 1 1 12 11058 1 1 40 GLU N N -7.367 7.151 -2.683 1.00 . A A . 40 GLU N 1 1 12 11059 1 1 40 GLU O O -9.676 5.317 -4.698 1.00 . A A . 40 GLU O 1 1 12 11060 1 1 40 GLU OE1 O -9.548 10.820 -4.827 1.00 . A A . 40 GLU OE1 1 1 12 11061 1 1 40 GLU OE2 O -10.915 11.327 -3.240 1.00 . A A . 40 GLU OE2 1 1 12 11062 1 1 41 GLY C C -8.056 3.194 -5.267 1.00 . A A . 41 GLY C 1 1 12 11063 1 1 41 GLY CA C -7.400 4.448 -5.843 1.00 . A A . 41 GLY CA 1 1 12 11064 1 1 41 GLY H H -6.690 6.033 -4.569 1.00 . A A . 41 GLY H 1 1 12 11065 1 1 41 GLY HA2 H -7.904 4.735 -6.756 1.00 . A A . 41 GLY HA2 1 1 12 11066 1 1 41 GLY HA3 H -6.361 4.243 -6.054 1.00 . A A . 41 GLY HA3 1 1 12 11067 1 1 41 GLY N N -7.498 5.557 -4.853 1.00 . A A . 41 GLY N 1 1 12 11068 1 1 41 GLY O O -8.519 2.334 -5.991 1.00 . A A . 41 GLY O 1 1 12 11069 1 1 42 ALA C C -9.434 2.290 -2.055 1.00 . A A . 42 ALA C 1 1 12 11070 1 1 42 ALA CA C -8.725 1.881 -3.346 1.00 . A A . 42 ALA CA 1 1 12 11071 1 1 42 ALA CB C -7.643 0.848 -3.027 1.00 . A A . 42 ALA CB 1 1 12 11072 1 1 42 ALA H H -7.719 3.784 -3.403 1.00 . A A . 42 ALA H 1 1 12 11073 1 1 42 ALA HA H -9.442 1.452 -4.030 1.00 . A A . 42 ALA HA 1 1 12 11074 1 1 42 ALA HB1 H -6.932 0.807 -3.840 1.00 . A A . 42 ALA HB1 1 1 12 11075 1 1 42 ALA HB2 H -7.133 1.130 -2.118 1.00 . A A . 42 ALA HB2 1 1 12 11076 1 1 42 ALA HB3 H -8.098 -0.123 -2.898 1.00 . A A . 42 ALA HB3 1 1 12 11077 1 1 42 ALA N N -8.099 3.080 -3.969 1.00 . A A . 42 ALA N 1 1 12 11078 1 1 42 ALA O O -8.983 3.161 -1.337 1.00 . A A . 42 ALA O 1 1 12 11079 1 1 43 SER C C -10.452 1.601 0.710 1.00 . A A . 43 SER C 1 1 12 11080 1 1 43 SER CA C -11.275 2.025 -0.507 1.00 . A A . 43 SER CA 1 1 12 11081 1 1 43 SER CB C -12.621 1.305 -0.486 1.00 . A A . 43 SER CB 1 1 12 11082 1 1 43 SER H H -10.889 0.971 -2.342 1.00 . A A . 43 SER H 1 1 12 11083 1 1 43 SER HA H -11.436 3.093 -0.477 1.00 . A A . 43 SER HA 1 1 12 11084 1 1 43 SER HB2 H -12.622 0.563 0.295 1.00 . A A . 43 SER HB2 1 1 12 11085 1 1 43 SER HB3 H -13.408 2.022 -0.297 1.00 . A A . 43 SER HB3 1 1 12 11086 1 1 43 SER HG H -13.293 1.285 -2.312 1.00 . A A . 43 SER HG 1 1 12 11087 1 1 43 SER N N -10.541 1.670 -1.751 1.00 . A A . 43 SER N 1 1 12 11088 1 1 43 SER O O -9.472 0.889 0.596 1.00 . A A . 43 SER O 1 1 12 11089 1 1 43 SER OG O -12.832 0.667 -1.738 1.00 . A A . 43 SER OG 1 1 12 11090 1 1 44 GLN C C -10.229 0.150 3.331 1.00 . A A . 44 GLN C 1 1 12 11091 1 1 44 GLN CA C -10.097 1.655 3.103 1.00 . A A . 44 GLN CA 1 1 12 11092 1 1 44 GLN CB C -10.669 2.407 4.307 1.00 . A A . 44 GLN CB 1 1 12 11093 1 1 44 GLN CD C -10.467 4.884 4.060 1.00 . A A . 44 GLN CD 1 1 12 11094 1 1 44 GLN CG C -9.795 3.625 4.608 1.00 . A A . 44 GLN CG 1 1 12 11095 1 1 44 GLN H H -11.642 2.603 1.944 1.00 . A A . 44 GLN H 1 1 12 11096 1 1 44 GLN HA H -9.055 1.912 2.981 1.00 . A A . 44 GLN HA 1 1 12 11097 1 1 44 GLN HB2 H -11.676 2.731 4.084 1.00 . A A . 44 GLN HB2 1 1 12 11098 1 1 44 GLN HB3 H -10.683 1.754 5.167 1.00 . A A . 44 GLN HB3 1 1 12 11099 1 1 44 GLN HE21 H -11.330 5.346 5.787 1.00 . A A . 44 GLN HE21 1 1 12 11100 1 1 44 GLN HE22 H -11.643 6.418 4.509 1.00 . A A . 44 GLN HE22 1 1 12 11101 1 1 44 GLN HG2 H -9.666 3.720 5.677 1.00 . A A . 44 GLN HG2 1 1 12 11102 1 1 44 GLN HG3 H -8.830 3.501 4.139 1.00 . A A . 44 GLN HG3 1 1 12 11103 1 1 44 GLN N N -10.849 2.033 1.876 1.00 . A A . 44 GLN N 1 1 12 11104 1 1 44 GLN NE2 N -11.208 5.610 4.851 1.00 . A A . 44 GLN NE2 1 1 12 11105 1 1 44 GLN O O -9.255 -0.533 3.571 1.00 . A A . 44 GLN O 1 1 12 11106 1 1 44 GLN OE1 O -10.315 5.211 2.899 1.00 . A A . 44 GLN OE1 1 1 12 11107 1 1 45 GLU C C -10.819 -2.606 2.395 1.00 . A A . 45 GLU C 1 1 12 11108 1 1 45 GLU CA C -11.607 -1.839 3.465 1.00 . A A . 45 GLU CA 1 1 12 11109 1 1 45 GLU CB C -13.091 -2.191 3.354 1.00 . A A . 45 GLU CB 1 1 12 11110 1 1 45 GLU CD C -13.760 -2.806 5.681 1.00 . A A . 45 GLU CD 1 1 12 11111 1 1 45 GLU CG C -13.820 -1.714 4.611 1.00 . A A . 45 GLU CG 1 1 12 11112 1 1 45 GLU H H -12.195 0.194 3.055 1.00 . A A . 45 GLU H 1 1 12 11113 1 1 45 GLU HA H -11.244 -2.107 4.449 1.00 . A A . 45 GLU HA 1 1 12 11114 1 1 45 GLU HB2 H -13.512 -1.707 2.485 1.00 . A A . 45 GLU HB2 1 1 12 11115 1 1 45 GLU HB3 H -13.200 -3.261 3.261 1.00 . A A . 45 GLU HB3 1 1 12 11116 1 1 45 GLU HG2 H -13.347 -0.817 4.983 1.00 . A A . 45 GLU HG2 1 1 12 11117 1 1 45 GLU HG3 H -14.852 -1.505 4.370 1.00 . A A . 45 GLU HG3 1 1 12 11118 1 1 45 GLU N N -11.422 -0.374 3.254 1.00 . A A . 45 GLU N 1 1 12 11119 1 1 45 GLU O O -10.522 -3.782 2.540 1.00 . A A . 45 GLU O 1 1 12 11120 1 1 45 GLU OE1 O -12.776 -2.846 6.402 1.00 . A A . 45 GLU OE1 1 1 12 11121 1 1 45 GLU OE2 O -14.697 -3.582 5.760 1.00 . A A . 45 GLU OE2 1 1 12 11122 1 1 46 GLU C C -8.192 -2.384 0.615 1.00 . A A . 46 GLU C 1 1 12 11123 1 1 46 GLU CA C -9.650 -2.611 0.277 1.00 . A A . 46 GLU CA 1 1 12 11124 1 1 46 GLU CB C -9.964 -1.986 -1.081 1.00 . A A . 46 GLU CB 1 1 12 11125 1 1 46 GLU CD C -11.780 -1.468 -2.717 1.00 . A A . 46 GLU CD 1 1 12 11126 1 1 46 GLU CG C -11.476 -1.975 -1.306 1.00 . A A . 46 GLU CG 1 1 12 11127 1 1 46 GLU H H -10.656 -0.984 1.259 1.00 . A A . 46 GLU H 1 1 12 11128 1 1 46 GLU HA H -9.867 -3.669 0.261 1.00 . A A . 46 GLU HA 1 1 12 11129 1 1 46 GLU HB2 H -9.589 -0.972 -1.105 1.00 . A A . 46 GLU HB2 1 1 12 11130 1 1 46 GLU HB3 H -9.489 -2.561 -1.858 1.00 . A A . 46 GLU HB3 1 1 12 11131 1 1 46 GLU HG2 H -11.865 -2.977 -1.191 1.00 . A A . 46 GLU HG2 1 1 12 11132 1 1 46 GLU HG3 H -11.940 -1.322 -0.583 1.00 . A A . 46 GLU HG3 1 1 12 11133 1 1 46 GLU N N -10.445 -1.939 1.338 1.00 . A A . 46 GLU N 1 1 12 11134 1 1 46 GLU O O -7.380 -3.287 0.611 1.00 . A A . 46 GLU O 1 1 12 11135 1 1 46 GLU OE1 O -10.853 -1.040 -3.383 1.00 . A A . 46 GLU OE1 1 1 12 11136 1 1 46 GLU OE2 O -12.935 -1.515 -3.107 1.00 . A A . 46 GLU OE2 1 1 12 11137 1 1 47 VAL C C -6.099 -1.798 2.485 1.00 . A A . 47 VAL C 1 1 12 11138 1 1 47 VAL CA C -6.488 -0.852 1.343 1.00 . A A . 47 VAL CA 1 1 12 11139 1 1 47 VAL CB C -6.444 0.608 1.807 1.00 . A A . 47 VAL CB 1 1 12 11140 1 1 47 VAL CG1 C -5.219 0.851 2.680 1.00 . A A . 47 VAL CG1 1 1 12 11141 1 1 47 VAL CG2 C -6.381 1.522 0.582 1.00 . A A . 47 VAL CG2 1 1 12 11142 1 1 47 VAL H H -8.561 -0.489 0.973 1.00 . A A . 47 VAL H 1 1 12 11143 1 1 47 VAL HA H -5.823 -0.995 0.504 1.00 . A A . 47 VAL HA 1 1 12 11144 1 1 47 VAL HB H -7.336 0.829 2.373 1.00 . A A . 47 VAL HB 1 1 12 11145 1 1 47 VAL HG11 H -4.621 -0.046 2.722 1.00 . A A . 47 VAL HG11 1 1 12 11146 1 1 47 VAL HG12 H -4.637 1.655 2.261 1.00 . A A . 47 VAL HG12 1 1 12 11147 1 1 47 VAL HG13 H -5.541 1.118 3.674 1.00 . A A . 47 VAL HG13 1 1 12 11148 1 1 47 VAL HG21 H -6.563 0.942 -0.311 1.00 . A A . 47 VAL HG21 1 1 12 11149 1 1 47 VAL HG22 H -7.133 2.293 0.670 1.00 . A A . 47 VAL HG22 1 1 12 11150 1 1 47 VAL HG23 H -5.404 1.978 0.523 1.00 . A A . 47 VAL HG23 1 1 12 11151 1 1 47 VAL N N -7.876 -1.174 0.951 1.00 . A A . 47 VAL N 1 1 12 11152 1 1 47 VAL O O -4.989 -2.286 2.556 1.00 . A A . 47 VAL O 1 1 12 11153 1 1 48 GLU C C -6.548 -4.423 3.953 1.00 . A A . 48 GLU C 1 1 12 11154 1 1 48 GLU CA C -6.741 -3.002 4.499 1.00 . A A . 48 GLU CA 1 1 12 11155 1 1 48 GLU CB C -7.904 -3.002 5.489 1.00 . A A . 48 GLU CB 1 1 12 11156 1 1 48 GLU CD C -10.089 -4.134 5.159 1.00 . A A . 48 GLU CD 1 1 12 11157 1 1 48 GLU CG C -9.196 -2.970 4.728 1.00 . A A . 48 GLU CG 1 1 12 11158 1 1 48 GLU H H -7.912 -1.670 3.273 1.00 . A A . 48 GLU H 1 1 12 11159 1 1 48 GLU HA H -5.848 -2.682 5.003 1.00 . A A . 48 GLU HA 1 1 12 11160 1 1 48 GLU HB2 H -7.866 -3.889 6.101 1.00 . A A . 48 GLU HB2 1 1 12 11161 1 1 48 GLU HB3 H -7.859 -2.126 6.112 1.00 . A A . 48 GLU HB3 1 1 12 11162 1 1 48 GLU HG2 H -9.678 -2.038 4.941 1.00 . A A . 48 GLU HG2 1 1 12 11163 1 1 48 GLU HG3 H -8.995 -3.034 3.680 1.00 . A A . 48 GLU HG3 1 1 12 11164 1 1 48 GLU N N -7.026 -2.071 3.366 1.00 . A A . 48 GLU N 1 1 12 11165 1 1 48 GLU O O -5.525 -5.040 4.169 1.00 . A A . 48 GLU O 1 1 12 11166 1 1 48 GLU OE1 O -10.736 -4.011 6.186 1.00 . A A . 48 GLU OE1 1 1 12 11167 1 1 48 GLU OE2 O -10.111 -5.131 4.454 1.00 . A A . 48 GLU OE2 1 1 12 11168 1 1 49 GLU C C -5.974 -6.489 2.113 1.00 . A A . 49 GLU C 1 1 12 11169 1 1 49 GLU CA C -7.381 -6.327 2.692 1.00 . A A . 49 GLU CA 1 1 12 11170 1 1 49 GLU CB C -8.420 -6.544 1.587 1.00 . A A . 49 GLU CB 1 1 12 11171 1 1 49 GLU CD C -9.539 -8.748 1.218 1.00 . A A . 49 GLU CD 1 1 12 11172 1 1 49 GLU CG C -8.255 -7.946 0.996 1.00 . A A . 49 GLU CG 1 1 12 11173 1 1 49 GLU H H -8.340 -4.446 3.077 1.00 . A A . 49 GLU H 1 1 12 11174 1 1 49 GLU HA H -7.533 -7.050 3.478 1.00 . A A . 49 GLU HA 1 1 12 11175 1 1 49 GLU HB2 H -9.412 -6.442 2.003 1.00 . A A . 49 GLU HB2 1 1 12 11176 1 1 49 GLU HB3 H -8.278 -5.808 0.810 1.00 . A A . 49 GLU HB3 1 1 12 11177 1 1 49 GLU HG2 H -8.056 -7.868 -0.064 1.00 . A A . 49 GLU HG2 1 1 12 11178 1 1 49 GLU HG3 H -7.431 -8.447 1.481 1.00 . A A . 49 GLU HG3 1 1 12 11179 1 1 49 GLU N N -7.525 -4.950 3.245 1.00 . A A . 49 GLU N 1 1 12 11180 1 1 49 GLU O O -5.282 -7.449 2.389 1.00 . A A . 49 GLU O 1 1 12 11181 1 1 49 GLU OE1 O -9.735 -9.219 2.325 1.00 . A A . 49 GLU OE1 1 1 12 11182 1 1 49 GLU OE2 O -10.303 -8.877 0.276 1.00 . A A . 49 GLU OE2 1 1 12 11183 1 1 50 ALA C C -3.155 -5.671 1.883 1.00 . A A . 50 ALA C 1 1 12 11184 1 1 50 ALA CA C -4.173 -5.639 0.740 1.00 . A A . 50 ALA CA 1 1 12 11185 1 1 50 ALA CB C -3.906 -4.413 -0.136 1.00 . A A . 50 ALA CB 1 1 12 11186 1 1 50 ALA H H -6.108 -4.774 1.120 1.00 . A A . 50 ALA H 1 1 12 11187 1 1 50 ALA HA H -4.089 -6.538 0.144 1.00 . A A . 50 ALA HA 1 1 12 11188 1 1 50 ALA HB1 H -4.780 -4.197 -0.731 1.00 . A A . 50 ALA HB1 1 1 12 11189 1 1 50 ALA HB2 H -3.683 -3.564 0.492 1.00 . A A . 50 ALA HB2 1 1 12 11190 1 1 50 ALA HB3 H -3.067 -4.610 -0.785 1.00 . A A . 50 ALA HB3 1 1 12 11191 1 1 50 ALA N N -5.539 -5.547 1.322 1.00 . A A . 50 ALA N 1 1 12 11192 1 1 50 ALA O O -2.180 -6.395 1.844 1.00 . A A . 50 ALA O 1 1 12 11193 1 1 51 MET C C -2.330 -6.260 4.657 1.00 . A A . 51 MET C 1 1 12 11194 1 1 51 MET CA C -2.434 -4.859 4.056 1.00 . A A . 51 MET CA 1 1 12 11195 1 1 51 MET CB C -2.953 -3.881 5.116 1.00 . A A . 51 MET CB 1 1 12 11196 1 1 51 MET CE C -2.918 -1.657 7.533 1.00 . A A . 51 MET CE 1 1 12 11197 1 1 51 MET CG C -2.095 -3.977 6.381 1.00 . A A . 51 MET CG 1 1 12 11198 1 1 51 MET H H -4.174 -4.310 2.910 1.00 . A A . 51 MET H 1 1 12 11199 1 1 51 MET HA H -1.461 -4.538 3.716 1.00 . A A . 51 MET HA 1 1 12 11200 1 1 51 MET HB2 H -2.907 -2.874 4.726 1.00 . A A . 51 MET HB2 1 1 12 11201 1 1 51 MET HB3 H -3.977 -4.125 5.358 1.00 . A A . 51 MET HB3 1 1 12 11202 1 1 51 MET HE1 H -2.775 -1.465 6.482 1.00 . A A . 51 MET HE1 1 1 12 11203 1 1 51 MET HE2 H -3.820 -1.164 7.868 1.00 . A A . 51 MET HE2 1 1 12 11204 1 1 51 MET HE3 H -2.069 -1.278 8.085 1.00 . A A . 51 MET HE3 1 1 12 11205 1 1 51 MET HG2 H -1.777 -4.999 6.527 1.00 . A A . 51 MET HG2 1 1 12 11206 1 1 51 MET HG3 H -1.228 -3.343 6.279 1.00 . A A . 51 MET HG3 1 1 12 11207 1 1 51 MET N N -3.380 -4.885 2.903 1.00 . A A . 51 MET N 1 1 12 11208 1 1 51 MET O O -1.271 -6.691 5.071 1.00 . A A . 51 MET O 1 1 12 11209 1 1 51 MET SD S -3.068 -3.440 7.810 1.00 . A A . 51 MET SD 1 1 12 11210 1 1 52 ASP C C -2.813 -9.313 4.238 1.00 . A A . 52 ASP C 1 1 12 11211 1 1 52 ASP CA C -3.377 -8.349 5.281 1.00 . A A . 52 ASP CA 1 1 12 11212 1 1 52 ASP CB C -4.793 -8.783 5.665 1.00 . A A . 52 ASP CB 1 1 12 11213 1 1 52 ASP CG C -4.720 -9.965 6.632 1.00 . A A . 52 ASP CG 1 1 12 11214 1 1 52 ASP H H -4.262 -6.611 4.368 1.00 . A A . 52 ASP H 1 1 12 11215 1 1 52 ASP HA H -2.747 -8.355 6.159 1.00 . A A . 52 ASP HA 1 1 12 11216 1 1 52 ASP HB2 H -5.305 -7.958 6.141 1.00 . A A . 52 ASP HB2 1 1 12 11217 1 1 52 ASP HB3 H -5.332 -9.079 4.779 1.00 . A A . 52 ASP HB3 1 1 12 11218 1 1 52 ASP N N -3.419 -6.976 4.708 1.00 . A A . 52 ASP N 1 1 12 11219 1 1 52 ASP O O -2.548 -10.465 4.523 1.00 . A A . 52 ASP O 1 1 12 11220 1 1 52 ASP OD1 O -3.619 -10.408 6.913 1.00 . A A . 52 ASP OD1 1 1 12 11221 1 1 52 ASP OD2 O -5.767 -10.408 7.075 1.00 . A A . 52 ASP OD2 1 1 12 11222 1 1 53 THR C C -0.710 -9.244 1.519 1.00 . A A . 53 THR C 1 1 12 11223 1 1 53 THR CA C -2.082 -9.748 1.971 1.00 . A A . 53 THR CA 1 1 12 11224 1 1 53 THR CB C -3.034 -9.766 0.775 1.00 . A A . 53 THR CB 1 1 12 11225 1 1 53 THR CG2 C -3.212 -11.204 0.288 1.00 . A A . 53 THR CG2 1 1 12 11226 1 1 53 THR H H -2.850 -7.923 2.818 1.00 . A A . 53 THR H 1 1 12 11227 1 1 53 THR HA H -1.984 -10.750 2.364 1.00 . A A . 53 THR HA 1 1 12 11228 1 1 53 THR HB H -2.621 -9.169 -0.022 1.00 . A A . 53 THR HB 1 1 12 11229 1 1 53 THR HG1 H -4.159 -8.319 1.427 1.00 . A A . 53 THR HG1 1 1 12 11230 1 1 53 THR HG21 H -2.525 -11.849 0.814 1.00 . A A . 53 THR HG21 1 1 12 11231 1 1 53 THR HG22 H -4.225 -11.525 0.479 1.00 . A A . 53 THR HG22 1 1 12 11232 1 1 53 THR HG23 H -3.013 -11.252 -0.772 1.00 . A A . 53 THR HG23 1 1 12 11233 1 1 53 THR N N -2.627 -8.854 3.030 1.00 . A A . 53 THR N 1 1 12 11234 1 1 53 THR O O -0.574 -8.631 0.479 1.00 . A A . 53 THR O 1 1 12 11235 1 1 53 THR OG1 O -4.293 -9.232 1.165 1.00 . A A . 53 THR OG1 1 1 12 11236 1 1 54 CYS C C 2.704 -10.029 2.487 1.00 . A A . 54 CYS C 1 1 12 11237 1 1 54 CYS CA C 1.678 -9.057 1.902 1.00 . A A . 54 CYS CA 1 1 12 11238 1 1 54 CYS CB C 1.932 -7.650 2.451 1.00 . A A . 54 CYS CB 1 1 12 11239 1 1 54 CYS H H 0.178 -10.010 3.120 1.00 . A A . 54 CYS H 1 1 12 11240 1 1 54 CYS HA H 1.763 -9.046 0.826 1.00 . A A . 54 CYS HA 1 1 12 11241 1 1 54 CYS HB2 H 1.236 -6.956 2.004 1.00 . A A . 54 CYS HB2 1 1 12 11242 1 1 54 CYS HB3 H 1.798 -7.653 3.522 1.00 . A A . 54 CYS HB3 1 1 12 11243 1 1 54 CYS N N 0.310 -9.508 2.288 1.00 . A A . 54 CYS N 1 1 12 11244 1 1 54 CYS O O 2.488 -10.597 3.540 1.00 . A A . 54 CYS O 1 1 12 11245 1 1 54 CYS SG S 3.618 -7.008 2.132 1.00 . A A . 54 CYS SG 1 1 12 11246 1 1 55 PRO C C 5.599 -10.513 3.441 1.00 . A A . 55 PRO C 1 1 12 11247 1 1 55 PRO CA C 4.860 -11.114 2.243 1.00 . A A . 55 PRO CA 1 1 12 11248 1 1 55 PRO CB C 5.781 -11.234 1.030 1.00 . A A . 55 PRO CB 1 1 12 11249 1 1 55 PRO CD C 4.123 -9.546 0.509 1.00 . A A . 55 PRO CD 1 1 12 11250 1 1 55 PRO CG C 5.548 -9.981 0.244 1.00 . A A . 55 PRO CG 1 1 12 11251 1 1 55 PRO HA H 4.449 -12.080 2.493 1.00 . A A . 55 PRO HA 1 1 12 11252 1 1 55 PRO HB2 H 6.806 -11.322 1.370 1.00 . A A . 55 PRO HB2 1 1 12 11253 1 1 55 PRO HB3 H 5.516 -12.112 0.463 1.00 . A A . 55 PRO HB3 1 1 12 11254 1 1 55 PRO HD2 H 4.068 -8.469 0.597 1.00 . A A . 55 PRO HD2 1 1 12 11255 1 1 55 PRO HD3 H 3.467 -9.896 -0.273 1.00 . A A . 55 PRO HD3 1 1 12 11256 1 1 55 PRO HG2 H 6.238 -9.214 0.569 1.00 . A A . 55 PRO HG2 1 1 12 11257 1 1 55 PRO HG3 H 5.679 -10.179 -0.808 1.00 . A A . 55 PRO HG3 1 1 12 11258 1 1 55 PRO N N 3.789 -10.193 1.782 1.00 . A A . 55 PRO N 1 1 12 11259 1 1 55 PRO O O 5.983 -11.210 4.359 1.00 . A A . 55 PRO O 1 1 12 11260 1 1 56 VAL C C 5.522 -7.702 5.357 1.00 . A A . 56 VAL C 1 1 12 11261 1 1 56 VAL CA C 6.507 -8.579 4.581 1.00 . A A . 56 VAL CA 1 1 12 11262 1 1 56 VAL CB C 7.652 -7.716 4.047 1.00 . A A . 56 VAL CB 1 1 12 11263 1 1 56 VAL CG1 C 8.838 -8.610 3.682 1.00 . A A . 56 VAL CG1 1 1 12 11264 1 1 56 VAL CG2 C 7.184 -6.962 2.800 1.00 . A A . 56 VAL CG2 1 1 12 11265 1 1 56 VAL H H 5.476 -8.678 2.693 1.00 . A A . 56 VAL H 1 1 12 11266 1 1 56 VAL HA H 6.905 -9.341 5.236 1.00 . A A . 56 VAL HA 1 1 12 11267 1 1 56 VAL HB H 7.954 -7.008 4.806 1.00 . A A . 56 VAL HB 1 1 12 11268 1 1 56 VAL HG11 H 9.092 -9.234 4.527 1.00 . A A . 56 VAL HG11 1 1 12 11269 1 1 56 VAL HG12 H 8.573 -9.234 2.841 1.00 . A A . 56 VAL HG12 1 1 12 11270 1 1 56 VAL HG13 H 9.685 -7.995 3.422 1.00 . A A . 56 VAL HG13 1 1 12 11271 1 1 56 VAL HG21 H 6.129 -6.743 2.884 1.00 . A A . 56 VAL HG21 1 1 12 11272 1 1 56 VAL HG22 H 7.737 -6.039 2.709 1.00 . A A . 56 VAL HG22 1 1 12 11273 1 1 56 VAL HG23 H 7.356 -7.572 1.925 1.00 . A A . 56 VAL HG23 1 1 12 11274 1 1 56 VAL N N 5.797 -9.224 3.441 1.00 . A A . 56 VAL N 1 1 12 11275 1 1 56 VAL O O 5.653 -7.508 6.550 1.00 . A A . 56 VAL O 1 1 12 11276 1 1 57 GLN C C 4.210 -5.027 5.867 1.00 . A A . 57 GLN C 1 1 12 11277 1 1 57 GLN CA C 3.536 -6.314 5.385 1.00 . A A . 57 GLN CA 1 1 12 11278 1 1 57 GLN CB C 2.959 -7.068 6.583 1.00 . A A . 57 GLN CB 1 1 12 11279 1 1 57 GLN CD C 1.284 -8.912 6.379 1.00 . A A . 57 GLN CD 1 1 12 11280 1 1 57 GLN CG C 1.488 -7.396 6.317 1.00 . A A . 57 GLN CG 1 1 12 11281 1 1 57 GLN H H 4.446 -7.347 3.729 1.00 . A A . 57 GLN H 1 1 12 11282 1 1 57 GLN HA H 2.737 -6.066 4.698 1.00 . A A . 57 GLN HA 1 1 12 11283 1 1 57 GLN HB2 H 3.513 -7.984 6.734 1.00 . A A . 57 GLN HB2 1 1 12 11284 1 1 57 GLN HB3 H 3.033 -6.452 7.467 1.00 . A A . 57 GLN HB3 1 1 12 11285 1 1 57 GLN HE21 H -0.567 -8.777 7.082 1.00 . A A . 57 GLN HE21 1 1 12 11286 1 1 57 GLN HE22 H 0.006 -10.357 6.847 1.00 . A A . 57 GLN HE22 1 1 12 11287 1 1 57 GLN HG2 H 0.871 -6.918 7.063 1.00 . A A . 57 GLN HG2 1 1 12 11288 1 1 57 GLN HG3 H 1.212 -7.038 5.336 1.00 . A A . 57 GLN HG3 1 1 12 11289 1 1 57 GLN N N 4.534 -7.174 4.689 1.00 . A A . 57 GLN N 1 1 12 11290 1 1 57 GLN NE2 N 0.146 -9.388 6.805 1.00 . A A . 57 GLN NE2 1 1 12 11291 1 1 57 GLN O O 4.501 -4.868 7.036 1.00 . A A . 57 GLN O 1 1 12 11292 1 1 57 GLN OE1 O 2.169 -9.670 6.036 1.00 . A A . 57 GLN OE1 1 1 12 11293 1 1 58 CYS C C 4.098 -1.684 5.227 1.00 . A A . 58 CYS C 1 1 12 11294 1 1 58 CYS CA C 5.103 -2.828 5.384 1.00 . A A . 58 CYS CA 1 1 12 11295 1 1 58 CYS CB C 6.320 -2.565 4.495 1.00 . A A . 58 CYS CB 1 1 12 11296 1 1 58 CYS H H 4.208 -4.254 4.040 1.00 . A A . 58 CYS H 1 1 12 11297 1 1 58 CYS HA H 5.419 -2.895 6.415 1.00 . A A . 58 CYS HA 1 1 12 11298 1 1 58 CYS HB2 H 6.872 -1.722 4.880 1.00 . A A . 58 CYS HB2 1 1 12 11299 1 1 58 CYS HB3 H 6.956 -3.439 4.487 1.00 . A A . 58 CYS HB3 1 1 12 11300 1 1 58 CYS HG H 6.349 -2.670 2.202 1.00 . A A . 58 CYS HG 1 1 12 11301 1 1 58 CYS N N 4.455 -4.106 4.977 1.00 . A A . 58 CYS N 1 1 12 11302 1 1 58 CYS O O 4.460 -0.525 5.187 1.00 . A A . 58 CYS O 1 1 12 11303 1 1 58 CYS SG S 5.769 -2.205 2.809 1.00 . A A . 58 CYS SG 1 1 12 11304 1 1 59 ILE C C 1.066 -0.741 6.295 1.00 . A A . 59 ILE C 1 1 12 11305 1 1 59 ILE CA C 1.802 -0.945 4.967 1.00 . A A . 59 ILE CA 1 1 12 11306 1 1 59 ILE CB C 0.818 -1.371 3.864 1.00 . A A . 59 ILE CB 1 1 12 11307 1 1 59 ILE CD1 C -0.870 0.458 4.176 1.00 . A A . 59 ILE CD1 1 1 12 11308 1 1 59 ILE CG1 C 0.183 -0.127 3.232 1.00 . A A . 59 ILE CG1 1 1 12 11309 1 1 59 ILE CG2 C -0.280 -2.271 4.442 1.00 . A A . 59 ILE CG2 1 1 12 11310 1 1 59 ILE H H 2.569 -2.948 5.160 1.00 . A A . 59 ILE H 1 1 12 11311 1 1 59 ILE HA H 2.279 -0.019 4.682 1.00 . A A . 59 ILE HA 1 1 12 11312 1 1 59 ILE HB H 1.357 -1.918 3.106 1.00 . A A . 59 ILE HB 1 1 12 11313 1 1 59 ILE HD11 H -1.564 -0.316 4.467 1.00 . A A . 59 ILE HD11 1 1 12 11314 1 1 59 ILE HD12 H -0.385 0.856 5.054 1.00 . A A . 59 ILE HD12 1 1 12 11315 1 1 59 ILE HD13 H -1.405 1.248 3.672 1.00 . A A . 59 ILE HD13 1 1 12 11316 1 1 59 ILE HG12 H 0.950 0.611 3.046 1.00 . A A . 59 ILE HG12 1 1 12 11317 1 1 59 ILE HG13 H -0.287 -0.399 2.299 1.00 . A A . 59 ILE HG13 1 1 12 11318 1 1 59 ILE HG21 H -0.813 -1.739 5.215 1.00 . A A . 59 ILE HG21 1 1 12 11319 1 1 59 ILE HG22 H -0.967 -2.550 3.656 1.00 . A A . 59 ILE HG22 1 1 12 11320 1 1 59 ILE HG23 H 0.167 -3.160 4.860 1.00 . A A . 59 ILE HG23 1 1 12 11321 1 1 59 ILE N N 2.836 -2.005 5.129 1.00 . A A . 59 ILE N 1 1 12 11322 1 1 59 ILE O O 0.602 -1.681 6.910 1.00 . A A . 59 ILE O 1 1 12 11323 1 1 60 HIS C C -0.658 1.964 7.871 1.00 . A A . 60 HIS C 1 1 12 11324 1 1 60 HIS CA C 0.248 0.742 8.028 1.00 . A A . 60 HIS CA 1 1 12 11325 1 1 60 HIS CB C 1.272 1.008 9.136 1.00 . A A . 60 HIS CB 1 1 12 11326 1 1 60 HIS CD2 C 2.995 -0.961 9.402 1.00 . A A . 60 HIS CD2 1 1 12 11327 1 1 60 HIS CE1 C 4.468 -0.283 7.966 1.00 . A A . 60 HIS CE1 1 1 12 11328 1 1 60 HIS CG C 2.525 0.217 8.875 1.00 . A A . 60 HIS CG 1 1 12 11329 1 1 60 HIS H H 1.334 1.226 6.231 1.00 . A A . 60 HIS H 1 1 12 11330 1 1 60 HIS HA H -0.351 -0.119 8.289 1.00 . A A . 60 HIS HA 1 1 12 11331 1 1 60 HIS HB2 H 1.509 2.061 9.160 1.00 . A A . 60 HIS HB2 1 1 12 11332 1 1 60 HIS HB3 H 0.853 0.713 10.088 1.00 . A A . 60 HIS HB3 1 1 12 11333 1 1 60 HIS HD1 H 3.447 1.442 7.413 1.00 . A A . 60 HIS HD1 1 1 12 11334 1 1 60 HIS HD2 H 2.490 -1.552 10.152 1.00 . A A . 60 HIS HD2 1 1 12 11335 1 1 60 HIS HE1 H 5.353 -0.223 7.348 1.00 . A A . 60 HIS HE1 1 1 12 11336 1 1 60 HIS N N 0.954 0.481 6.742 1.00 . A A . 60 HIS N 1 1 12 11337 1 1 60 HIS ND1 N 3.482 0.631 7.961 1.00 . A A . 60 HIS ND1 1 1 12 11338 1 1 60 HIS NE2 N 4.222 -1.275 8.826 1.00 . A A . 60 HIS NE2 1 1 12 11339 1 1 60 HIS O O -0.481 2.769 6.977 1.00 . A A . 60 HIS O 1 1 12 11340 1 1 61 TRP C C -1.765 4.556 8.968 1.00 . A A . 61 TRP C 1 1 12 11341 1 1 61 TRP CA C -2.541 3.281 8.636 1.00 . A A . 61 TRP CA 1 1 12 11342 1 1 61 TRP CB C -3.684 3.112 9.639 1.00 . A A . 61 TRP CB 1 1 12 11343 1 1 61 TRP CD1 C -6.094 2.379 9.466 1.00 . A A . 61 TRP CD1 1 1 12 11344 1 1 61 TRP CD2 C -4.826 1.545 7.805 1.00 . A A . 61 TRP CD2 1 1 12 11345 1 1 61 TRP CE2 C -6.141 1.061 7.598 1.00 . A A . 61 TRP CE2 1 1 12 11346 1 1 61 TRP CE3 C -3.830 1.161 6.888 1.00 . A A . 61 TRP CE3 1 1 12 11347 1 1 61 TRP CG C -4.824 2.381 9.001 1.00 . A A . 61 TRP CG 1 1 12 11348 1 1 61 TRP CH2 C -5.454 -0.143 5.624 1.00 . A A . 61 TRP CH2 1 1 12 11349 1 1 61 TRP CZ2 C -6.456 0.228 6.523 1.00 . A A . 61 TRP CZ2 1 1 12 11350 1 1 61 TRP CZ3 C -4.144 0.322 5.805 1.00 . A A . 61 TRP CZ3 1 1 12 11351 1 1 61 TRP H H -1.747 1.450 9.446 1.00 . A A . 61 TRP H 1 1 12 11352 1 1 61 TRP HA H -2.944 3.352 7.635 1.00 . A A . 61 TRP HA 1 1 12 11353 1 1 61 TRP HB2 H -3.332 2.551 10.491 1.00 . A A . 61 TRP HB2 1 1 12 11354 1 1 61 TRP HB3 H -4.020 4.085 9.966 1.00 . A A . 61 TRP HB3 1 1 12 11355 1 1 61 TRP HD1 H -6.441 2.902 10.344 1.00 . A A . 61 TRP HD1 1 1 12 11356 1 1 61 TRP HE1 H -7.834 1.432 8.753 1.00 . A A . 61 TRP HE1 1 1 12 11357 1 1 61 TRP HE3 H -2.819 1.513 7.015 1.00 . A A . 61 TRP HE3 1 1 12 11358 1 1 61 TRP HH2 H -5.688 -0.787 4.789 1.00 . A A . 61 TRP HH2 1 1 12 11359 1 1 61 TRP HZ2 H -7.467 -0.127 6.388 1.00 . A A . 61 TRP HZ2 1 1 12 11360 1 1 61 TRP HZ3 H -3.371 0.034 5.108 1.00 . A A . 61 TRP HZ3 1 1 12 11361 1 1 61 TRP N N -1.625 2.110 8.733 1.00 . A A . 61 TRP N 1 1 12 11362 1 1 61 TRP NE1 N -6.875 1.597 8.636 1.00 . A A . 61 TRP NE1 1 1 12 11363 1 1 61 TRP O O -0.555 4.547 9.074 1.00 . A A . 61 TRP O 1 1 12 11364 1 1 62 GLU C C -2.743 7.903 10.093 1.00 . A A . 62 GLU C 1 1 12 11365 1 1 62 GLU CA C -1.749 6.924 9.462 1.00 . A A . 62 GLU CA 1 1 12 11366 1 1 62 GLU CB C -1.170 7.533 8.182 1.00 . A A . 62 GLU CB 1 1 12 11367 1 1 62 GLU CD C 0.411 9.335 7.473 1.00 . A A . 62 GLU CD 1 1 12 11368 1 1 62 GLU CG C -0.691 8.958 8.466 1.00 . A A . 62 GLU CG 1 1 12 11369 1 1 62 GLU H H -3.426 5.640 9.046 1.00 . A A . 62 GLU H 1 1 12 11370 1 1 62 GLU HA H -0.949 6.724 10.160 1.00 . A A . 62 GLU HA 1 1 12 11371 1 1 62 GLU HB2 H -0.336 6.932 7.845 1.00 . A A . 62 GLU HB2 1 1 12 11372 1 1 62 GLU HB3 H -1.931 7.555 7.416 1.00 . A A . 62 GLU HB3 1 1 12 11373 1 1 62 GLU HG2 H -1.520 9.643 8.363 1.00 . A A . 62 GLU HG2 1 1 12 11374 1 1 62 GLU HG3 H -0.300 9.012 9.471 1.00 . A A . 62 GLU HG3 1 1 12 11375 1 1 62 GLU N N -2.451 5.652 9.134 1.00 . A A . 62 GLU N 1 1 12 11376 1 1 62 GLU O O -3.736 8.266 9.495 1.00 . A A . 62 GLU O 1 1 12 11377 1 1 62 GLU OE1 O 0.651 8.559 6.562 1.00 . A A . 62 GLU OE1 1 1 12 11378 1 1 62 GLU OE2 O 0.995 10.392 7.640 1.00 . A A . 62 GLU OE2 1 1 12 11379 1 1 63 ASP C C -3.395 10.616 11.225 1.00 . A A . 63 ASP C 1 1 12 11380 1 1 63 ASP CA C -3.415 9.281 11.969 1.00 . A A . 63 ASP CA 1 1 12 11381 1 1 63 ASP CB C -2.968 9.497 13.416 1.00 . A A . 63 ASP CB 1 1 12 11382 1 1 63 ASP CG C -3.950 10.435 14.121 1.00 . A A . 63 ASP CG 1 1 12 11383 1 1 63 ASP H H -1.678 8.023 11.766 1.00 . A A . 63 ASP H 1 1 12 11384 1 1 63 ASP HA H -4.416 8.875 11.957 1.00 . A A . 63 ASP HA 1 1 12 11385 1 1 63 ASP HB2 H -2.944 8.547 13.931 1.00 . A A . 63 ASP HB2 1 1 12 11386 1 1 63 ASP HB3 H -1.982 9.937 13.427 1.00 . A A . 63 ASP HB3 1 1 12 11387 1 1 63 ASP N N -2.484 8.329 11.299 1.00 . A A . 63 ASP N 1 1 12 11388 1 1 63 ASP O O -4.407 11.084 10.743 1.00 . A A . 63 ASP O 1 1 12 11389 1 1 63 ASP OD1 O -3.900 11.623 13.851 1.00 . A A . 63 ASP OD1 1 1 12 11390 1 1 63 ASP OD2 O -4.735 9.948 14.916 1.00 . A A . 63 ASP OD2 1 1 12 11391 1 1 64 GLU C C -2.912 12.442 9.084 1.00 . A A . 64 GLU C 1 1 12 11392 1 1 64 GLU CA C -2.162 12.537 10.415 1.00 . A A . 64 GLU CA 1 1 12 11393 1 1 64 GLU CB C -0.693 12.876 10.152 1.00 . A A . 64 GLU CB 1 1 12 11394 1 1 64 GLU CD C 0.854 14.774 9.657 1.00 . A A . 64 GLU CD 1 1 12 11395 1 1 64 GLU CG C -0.592 14.284 9.564 1.00 . A A . 64 GLU CG 1 1 12 11396 1 1 64 GLU H H -1.447 10.836 11.525 1.00 . A A . 64 GLU H 1 1 12 11397 1 1 64 GLU HA H -2.607 13.310 11.024 1.00 . A A . 64 GLU HA 1 1 12 11398 1 1 64 GLU HB2 H -0.142 12.832 11.080 1.00 . A A . 64 GLU HB2 1 1 12 11399 1 1 64 GLU HB3 H -0.279 12.166 9.452 1.00 . A A . 64 GLU HB3 1 1 12 11400 1 1 64 GLU HG2 H -0.900 14.265 8.529 1.00 . A A . 64 GLU HG2 1 1 12 11401 1 1 64 GLU HG3 H -1.233 14.953 10.118 1.00 . A A . 64 GLU HG3 1 1 12 11402 1 1 64 GLU N N -2.250 11.233 11.128 1.00 . A A . 64 GLU N 1 1 12 11403 1 1 64 GLU OE1 O 1.742 13.937 9.687 1.00 . A A . 64 GLU OE1 1 1 12 11404 1 1 64 GLU OE2 O 1.051 15.977 9.698 1.00 . A A . 64 GLU OE2 1 1 12 11405 2 2 1 SF4 FE1 FE 5.274 -4.898 -1.905 1.00 . B A . 65 SF4 FE1 1 1 12 11406 2 2 1 SF4 FE2 FE 3.676 -6.289 0.074 1.00 . B A . 65 SF4 FE2 1 1 12 11407 2 2 1 SF4 FE3 FE 2.677 -4.589 -1.957 1.00 . B A . 65 SF4 FE3 1 1 12 11408 2 2 1 SF4 FE4 FE 3.951 -7.184 -2.662 1.00 . B A . 65 SF4 FE4 1 1 12 11409 2 2 1 SF4 S1 S 1.927 -6.818 -1.181 1.00 . B A . 65 SF4 S1 1 1 12 11410 2 2 1 SF4 S2 S 4.150 -4.901 -3.570 1.00 . B A . 65 SF4 S2 1 1 12 11411 2 2 1 SF4 S3 S 5.578 -7.220 -1.154 1.00 . B A . 65 SF4 S3 1 1 12 11412 2 2 1 SF4 S4 S 4.050 -3.853 -0.391 1.00 . B A . 65 SF4 S4 1 1 13 11413 1 1 1 ALA C C -10.752 8.454 8.108 1.00 . A A . 1 ALA C 1 1 13 11414 1 1 1 ALA CA C -12.261 8.402 7.862 1.00 . A A . 1 ALA CA 1 1 13 11415 1 1 1 ALA CB C -12.965 7.926 9.135 1.00 . A A . 1 ALA CB 1 1 13 11416 1 1 1 ALA HA H -12.617 9.386 7.599 1.00 . A A . 1 ALA HA 1 1 13 11417 1 1 1 ALA HB1 H -12.691 6.901 9.336 1.00 . A A . 1 ALA HB1 1 1 13 11418 1 1 1 ALA HB2 H -12.667 8.548 9.965 1.00 . A A . 1 ALA HB2 1 1 13 11419 1 1 1 ALA HB3 H -14.034 7.993 9.001 1.00 . A A . 1 ALA HB3 1 1 13 11420 1 1 1 ALA N N -12.549 7.452 6.750 1.00 . A A . 1 ALA N 1 1 13 11421 1 1 1 ALA O O -10.099 9.437 7.820 1.00 . A A . 1 ALA O 1 1 13 11422 1 1 2 ARG C C -7.976 7.337 7.578 1.00 . A A . 2 ARG C 1 1 13 11423 1 1 2 ARG CA C -8.730 7.391 8.907 1.00 . A A . 2 ARG CA 1 1 13 11424 1 1 2 ARG CB C -8.373 6.163 9.747 1.00 . A A . 2 ARG CB 1 1 13 11425 1 1 2 ARG CD C -9.357 3.893 10.086 1.00 . A A . 2 ARG CD 1 1 13 11426 1 1 2 ARG CG C -8.873 4.902 9.042 1.00 . A A . 2 ARG CG 1 1 13 11427 1 1 2 ARG CZ C -10.276 1.656 9.989 1.00 . A A . 2 ARG CZ 1 1 13 11428 1 1 2 ARG H H -10.740 6.620 8.869 1.00 . A A . 2 ARG H 1 1 13 11429 1 1 2 ARG HA H -8.453 8.287 9.443 1.00 . A A . 2 ARG HA 1 1 13 11430 1 1 2 ARG HB2 H -7.300 6.109 9.867 1.00 . A A . 2 ARG HB2 1 1 13 11431 1 1 2 ARG HB3 H -8.841 6.242 10.717 1.00 . A A . 2 ARG HB3 1 1 13 11432 1 1 2 ARG HD2 H -8.505 3.461 10.591 1.00 . A A . 2 ARG HD2 1 1 13 11433 1 1 2 ARG HD3 H -9.986 4.395 10.806 1.00 . A A . 2 ARG HD3 1 1 13 11434 1 1 2 ARG HE H -10.541 2.981 8.534 1.00 . A A . 2 ARG HE 1 1 13 11435 1 1 2 ARG HG2 H -9.689 5.158 8.382 1.00 . A A . 2 ARG HG2 1 1 13 11436 1 1 2 ARG HG3 H -8.069 4.466 8.470 1.00 . A A . 2 ARG HG3 1 1 13 11437 1 1 2 ARG HH11 H -8.555 0.922 9.277 1.00 . A A . 2 ARG HH11 1 1 13 11438 1 1 2 ARG HH12 H -9.472 -0.155 10.277 1.00 . A A . 2 ARG HH12 1 1 13 11439 1 1 2 ARG HH21 H -12.029 2.121 10.838 1.00 . A A . 2 ARG HH21 1 1 13 11440 1 1 2 ARG HH22 H -11.440 0.525 11.161 1.00 . A A . 2 ARG HH22 1 1 13 11441 1 1 2 ARG N N -10.194 7.403 8.642 1.00 . A A . 2 ARG N 1 1 13 11442 1 1 2 ARG NE N -10.135 2.817 9.411 1.00 . A A . 2 ARG NE 1 1 13 11443 1 1 2 ARG NH1 N -9.363 0.736 9.836 1.00 . A A . 2 ARG NH1 1 1 13 11444 1 1 2 ARG NH2 N -11.331 1.415 10.720 1.00 . A A . 2 ARG NH2 1 1 13 11445 1 1 2 ARG O O -8.546 7.066 6.540 1.00 . A A . 2 ARG O 1 1 13 11446 1 1 3 LYS C C -5.097 6.270 6.281 1.00 . A A . 3 LYS C 1 1 13 11447 1 1 3 LYS CA C -5.908 7.563 6.341 1.00 . A A . 3 LYS CA 1 1 13 11448 1 1 3 LYS CB C -4.957 8.760 6.308 1.00 . A A . 3 LYS CB 1 1 13 11449 1 1 3 LYS CD C -5.915 10.612 4.934 1.00 . A A . 3 LYS CD 1 1 13 11450 1 1 3 LYS CE C -5.905 11.278 3.559 1.00 . A A . 3 LYS CE 1 1 13 11451 1 1 3 LYS CG C -4.988 9.395 4.918 1.00 . A A . 3 LYS CG 1 1 13 11452 1 1 3 LYS H H -6.260 7.815 8.451 1.00 . A A . 3 LYS H 1 1 13 11453 1 1 3 LYS HA H -6.573 7.610 5.492 1.00 . A A . 3 LYS HA 1 1 13 11454 1 1 3 LYS HB2 H -5.267 9.486 7.044 1.00 . A A . 3 LYS HB2 1 1 13 11455 1 1 3 LYS HB3 H -3.954 8.428 6.528 1.00 . A A . 3 LYS HB3 1 1 13 11456 1 1 3 LYS HD2 H -6.920 10.295 5.175 1.00 . A A . 3 LYS HD2 1 1 13 11457 1 1 3 LYS HD3 H -5.571 11.317 5.677 1.00 . A A . 3 LYS HD3 1 1 13 11458 1 1 3 LYS HE2 H -6.452 12.209 3.605 1.00 . A A . 3 LYS HE2 1 1 13 11459 1 1 3 LYS HE3 H -4.884 11.475 3.261 1.00 . A A . 3 LYS HE3 1 1 13 11460 1 1 3 LYS HG2 H -3.990 9.704 4.641 1.00 . A A . 3 LYS HG2 1 1 13 11461 1 1 3 LYS HG3 H -5.354 8.676 4.202 1.00 . A A . 3 LYS HG3 1 1 13 11462 1 1 3 LYS HZ1 H -7.117 9.660 3.067 1.00 . A A . 3 LYS HZ1 1 1 13 11463 1 1 3 LYS HZ2 H -7.160 10.924 1.936 1.00 . A A . 3 LYS HZ2 1 1 13 11464 1 1 3 LYS HZ3 H -5.810 9.895 2.006 1.00 . A A . 3 LYS HZ3 1 1 13 11465 1 1 3 LYS N N -6.699 7.596 7.602 1.00 . A A . 3 LYS N 1 1 13 11466 1 1 3 LYS NZ N -6.546 10.371 2.567 1.00 . A A . 3 LYS NZ 1 1 13 11467 1 1 3 LYS O O -5.468 5.268 6.855 1.00 . A A . 3 LYS O 1 1 13 11468 1 1 4 PHE C C -2.062 5.300 4.415 1.00 . A A . 4 PHE C 1 1 13 11469 1 1 4 PHE CA C -3.132 5.079 5.487 1.00 . A A . 4 PHE CA 1 1 13 11470 1 1 4 PHE CB C -3.989 3.869 5.099 1.00 . A A . 4 PHE CB 1 1 13 11471 1 1 4 PHE CD1 C -4.231 3.921 2.593 1.00 . A A . 4 PHE CD1 1 1 13 11472 1 1 4 PHE CD2 C -6.058 4.748 3.954 1.00 . A A . 4 PHE CD2 1 1 13 11473 1 1 4 PHE CE1 C -4.961 4.214 1.434 1.00 . A A . 4 PHE CE1 1 1 13 11474 1 1 4 PHE CE2 C -6.789 5.041 2.795 1.00 . A A . 4 PHE CE2 1 1 13 11475 1 1 4 PHE CG C -4.779 4.187 3.853 1.00 . A A . 4 PHE CG 1 1 13 11476 1 1 4 PHE CZ C -6.240 4.774 1.536 1.00 . A A . 4 PHE CZ 1 1 13 11477 1 1 4 PHE H H -3.713 7.121 5.150 1.00 . A A . 4 PHE H 1 1 13 11478 1 1 4 PHE HA H -2.653 4.894 6.436 1.00 . A A . 4 PHE HA 1 1 13 11479 1 1 4 PHE HB2 H -3.347 3.021 4.909 1.00 . A A . 4 PHE HB2 1 1 13 11480 1 1 4 PHE HB3 H -4.667 3.629 5.904 1.00 . A A . 4 PHE HB3 1 1 13 11481 1 1 4 PHE HD1 H -3.244 3.488 2.514 1.00 . A A . 4 PHE HD1 1 1 13 11482 1 1 4 PHE HD2 H -6.482 4.954 4.927 1.00 . A A . 4 PHE HD2 1 1 13 11483 1 1 4 PHE HE1 H -4.537 4.007 0.463 1.00 . A A . 4 PHE HE1 1 1 13 11484 1 1 4 PHE HE2 H -7.775 5.473 2.873 1.00 . A A . 4 PHE HE2 1 1 13 11485 1 1 4 PHE HZ H -6.803 5.000 0.642 1.00 . A A . 4 PHE HZ 1 1 13 11486 1 1 4 PHE N N -3.988 6.296 5.594 1.00 . A A . 4 PHE N 1 1 13 11487 1 1 4 PHE O O -2.100 6.260 3.672 1.00 . A A . 4 PHE O 1 1 13 11488 1 1 5 TYR C C 0.950 3.413 3.513 1.00 . A A . 5 TYR C 1 1 13 11489 1 1 5 TYR CA C -0.039 4.546 3.308 1.00 . A A . 5 TYR CA 1 1 13 11490 1 1 5 TYR CB C 0.686 5.884 3.464 1.00 . A A . 5 TYR CB 1 1 13 11491 1 1 5 TYR CD1 C 0.691 6.093 5.978 1.00 . A A . 5 TYR CD1 1 1 13 11492 1 1 5 TYR CD2 C 2.802 5.790 4.825 1.00 . A A . 5 TYR CD2 1 1 13 11493 1 1 5 TYR CE1 C 1.367 6.131 7.205 1.00 . A A . 5 TYR CE1 1 1 13 11494 1 1 5 TYR CE2 C 3.478 5.827 6.050 1.00 . A A . 5 TYR CE2 1 1 13 11495 1 1 5 TYR CG C 1.409 5.923 4.789 1.00 . A A . 5 TYR CG 1 1 13 11496 1 1 5 TYR CZ C 2.760 5.997 7.240 1.00 . A A . 5 TYR CZ 1 1 13 11497 1 1 5 TYR H H -1.104 3.639 4.937 1.00 . A A . 5 TYR H 1 1 13 11498 1 1 5 TYR HA H -0.469 4.477 2.320 1.00 . A A . 5 TYR HA 1 1 13 11499 1 1 5 TYR HB2 H 1.401 5.997 2.662 1.00 . A A . 5 TYR HB2 1 1 13 11500 1 1 5 TYR HB3 H -0.027 6.685 3.419 1.00 . A A . 5 TYR HB3 1 1 13 11501 1 1 5 TYR HD1 H -0.384 6.195 5.951 1.00 . A A . 5 TYR HD1 1 1 13 11502 1 1 5 TYR HD2 H 3.355 5.658 3.907 1.00 . A A . 5 TYR HD2 1 1 13 11503 1 1 5 TYR HE1 H 0.813 6.260 8.122 1.00 . A A . 5 TYR HE1 1 1 13 11504 1 1 5 TYR HE2 H 4.553 5.726 6.077 1.00 . A A . 5 TYR HE2 1 1 13 11505 1 1 5 TYR HH H 2.800 5.821 9.141 1.00 . A A . 5 TYR HH 1 1 13 11506 1 1 5 TYR N N -1.111 4.410 4.329 1.00 . A A . 5 TYR N 1 1 13 11507 1 1 5 TYR O O 0.681 2.470 4.232 1.00 . A A . 5 TYR O 1 1 13 11508 1 1 5 TYR OH O 3.428 6.035 8.447 1.00 . A A . 5 TYR OH 1 1 13 11509 1 1 6 VAL C C 4.456 2.884 3.284 1.00 . A A . 6 VAL C 1 1 13 11510 1 1 6 VAL CA C 3.056 2.367 3.082 1.00 . A A . 6 VAL CA 1 1 13 11511 1 1 6 VAL CB C 3.110 1.465 1.855 1.00 . A A . 6 VAL CB 1 1 13 11512 1 1 6 VAL CG1 C 3.063 0.024 2.331 1.00 . A A . 6 VAL CG1 1 1 13 11513 1 1 6 VAL CG2 C 1.934 1.735 0.921 1.00 . A A . 6 VAL CG2 1 1 13 11514 1 1 6 VAL H H 2.298 4.234 2.305 1.00 . A A . 6 VAL H 1 1 13 11515 1 1 6 VAL HA H 2.765 1.778 3.937 1.00 . A A . 6 VAL HA 1 1 13 11516 1 1 6 VAL HB H 4.046 1.639 1.328 1.00 . A A . 6 VAL HB 1 1 13 11517 1 1 6 VAL HG11 H 3.313 -0.012 3.379 1.00 . A A . 6 VAL HG11 1 1 13 11518 1 1 6 VAL HG12 H 2.068 -0.365 2.182 1.00 . A A . 6 VAL HG12 1 1 13 11519 1 1 6 VAL HG13 H 3.771 -0.561 1.768 1.00 . A A . 6 VAL HG13 1 1 13 11520 1 1 6 VAL HG21 H 1.677 2.778 0.953 1.00 . A A . 6 VAL HG21 1 1 13 11521 1 1 6 VAL HG22 H 2.209 1.470 -0.087 1.00 . A A . 6 VAL HG22 1 1 13 11522 1 1 6 VAL HG23 H 1.090 1.142 1.232 1.00 . A A . 6 VAL HG23 1 1 13 11523 1 1 6 VAL N N 2.089 3.475 2.894 1.00 . A A . 6 VAL N 1 1 13 11524 1 1 6 VAL O O 4.700 4.052 3.514 1.00 . A A . 6 VAL O 1 1 13 11525 1 1 7 ASP C C 7.571 1.365 2.435 1.00 . A A . 7 ASP C 1 1 13 11526 1 1 7 ASP CA C 6.793 2.330 3.285 1.00 . A A . 7 ASP CA 1 1 13 11527 1 1 7 ASP CB C 7.235 2.233 4.740 1.00 . A A . 7 ASP CB 1 1 13 11528 1 1 7 ASP CG C 7.444 3.639 5.308 1.00 . A A . 7 ASP CG 1 1 13 11529 1 1 7 ASP H H 5.124 1.062 2.946 1.00 . A A . 7 ASP H 1 1 13 11530 1 1 7 ASP HA H 6.955 3.315 2.912 1.00 . A A . 7 ASP HA 1 1 13 11531 1 1 7 ASP HB2 H 6.471 1.728 5.302 1.00 . A A . 7 ASP HB2 1 1 13 11532 1 1 7 ASP HB3 H 8.158 1.678 4.803 1.00 . A A . 7 ASP HB3 1 1 13 11533 1 1 7 ASP N N 5.376 1.986 3.156 1.00 . A A . 7 ASP N 1 1 13 11534 1 1 7 ASP O O 7.846 0.248 2.825 1.00 . A A . 7 ASP O 1 1 13 11535 1 1 7 ASP OD1 O 7.371 4.584 4.538 1.00 . A A . 7 ASP OD1 1 1 13 11536 1 1 7 ASP OD2 O 7.677 3.746 6.499 1.00 . A A . 7 ASP OD2 1 1 13 11537 1 1 8 GLN C C 10.067 0.610 0.903 1.00 . A A . 8 GLN C 1 1 13 11538 1 1 8 GLN CA C 8.684 0.917 0.335 1.00 . A A . 8 GLN CA 1 1 13 11539 1 1 8 GLN CB C 8.858 1.631 -0.985 1.00 . A A . 8 GLN CB 1 1 13 11540 1 1 8 GLN CD C 7.144 3.421 -1.277 1.00 . A A . 8 GLN CD 1 1 13 11541 1 1 8 GLN CG C 7.487 1.959 -1.572 1.00 . A A . 8 GLN CG 1 1 13 11542 1 1 8 GLN H H 7.653 2.688 0.992 1.00 . A A . 8 GLN H 1 1 13 11543 1 1 8 GLN HA H 8.145 -0.005 0.175 1.00 . A A . 8 GLN HA 1 1 13 11544 1 1 8 GLN HB2 H 9.418 2.543 -0.831 1.00 . A A . 8 GLN HB2 1 1 13 11545 1 1 8 GLN HB3 H 9.396 0.985 -1.645 1.00 . A A . 8 GLN HB3 1 1 13 11546 1 1 8 GLN HE21 H 5.507 2.975 -0.244 1.00 . A A . 8 GLN HE21 1 1 13 11547 1 1 8 GLN HE22 H 5.851 4.632 -0.379 1.00 . A A . 8 GLN HE22 1 1 13 11548 1 1 8 GLN HG2 H 7.502 1.797 -2.641 1.00 . A A . 8 GLN HG2 1 1 13 11549 1 1 8 GLN HG3 H 6.745 1.321 -1.118 1.00 . A A . 8 GLN HG3 1 1 13 11550 1 1 8 GLN N N 7.916 1.789 1.265 1.00 . A A . 8 GLN N 1 1 13 11551 1 1 8 GLN NE2 N 6.079 3.699 -0.575 1.00 . A A . 8 GLN NE2 1 1 13 11552 1 1 8 GLN O O 11.062 0.632 0.205 1.00 . A A . 8 GLN O 1 1 13 11553 1 1 8 GLN OE1 O 7.854 4.318 -1.685 1.00 . A A . 8 GLN OE1 1 1 13 11554 1 1 9 ASP C C 11.561 -1.526 2.913 1.00 . A A . 9 ASP C 1 1 13 11555 1 1 9 ASP CA C 11.433 -0.009 2.794 1.00 . A A . 9 ASP CA 1 1 13 11556 1 1 9 ASP CB C 11.491 0.609 4.191 1.00 . A A . 9 ASP CB 1 1 13 11557 1 1 9 ASP CG C 12.781 1.416 4.341 1.00 . A A . 9 ASP CG 1 1 13 11558 1 1 9 ASP H H 9.307 0.300 2.675 1.00 . A A . 9 ASP H 1 1 13 11559 1 1 9 ASP HA H 12.241 0.378 2.191 1.00 . A A . 9 ASP HA 1 1 13 11560 1 1 9 ASP HB2 H 10.640 1.259 4.334 1.00 . A A . 9 ASP HB2 1 1 13 11561 1 1 9 ASP HB3 H 11.474 -0.177 4.931 1.00 . A A . 9 ASP HB3 1 1 13 11562 1 1 9 ASP N N 10.129 0.317 2.155 1.00 . A A . 9 ASP N 1 1 13 11563 1 1 9 ASP O O 12.646 -2.067 2.979 1.00 . A A . 9 ASP O 1 1 13 11564 1 1 9 ASP OD1 O 12.798 2.556 3.905 1.00 . A A . 9 ASP OD1 1 1 13 11565 1 1 9 ASP OD2 O 13.731 0.882 4.888 1.00 . A A . 9 ASP OD2 1 1 13 11566 1 1 10 GLU C C 9.922 -4.320 1.787 1.00 . A A . 10 GLU C 1 1 13 11567 1 1 10 GLU CA C 10.500 -3.695 3.057 1.00 . A A . 10 GLU CA 1 1 13 11568 1 1 10 GLU CB C 9.670 -4.135 4.265 1.00 . A A . 10 GLU CB 1 1 13 11569 1 1 10 GLU CD C 11.420 -4.106 6.049 1.00 . A A . 10 GLU CD 1 1 13 11570 1 1 10 GLU CG C 10.526 -5.002 5.188 1.00 . A A . 10 GLU CG 1 1 13 11571 1 1 10 GLU H H 9.591 -1.753 2.887 1.00 . A A . 10 GLU H 1 1 13 11572 1 1 10 GLU HA H 11.524 -4.013 3.187 1.00 . A A . 10 GLU HA 1 1 13 11573 1 1 10 GLU HB2 H 9.327 -3.262 4.804 1.00 . A A . 10 GLU HB2 1 1 13 11574 1 1 10 GLU HB3 H 8.817 -4.706 3.927 1.00 . A A . 10 GLU HB3 1 1 13 11575 1 1 10 GLU HG2 H 9.884 -5.592 5.825 1.00 . A A . 10 GLU HG2 1 1 13 11576 1 1 10 GLU HG3 H 11.145 -5.658 4.593 1.00 . A A . 10 GLU HG3 1 1 13 11577 1 1 10 GLU N N 10.454 -2.214 2.942 1.00 . A A . 10 GLU N 1 1 13 11578 1 1 10 GLU O O 9.633 -5.499 1.740 1.00 . A A . 10 GLU O 1 1 13 11579 1 1 10 GLU OE1 O 10.881 -3.265 6.750 1.00 . A A . 10 GLU OE1 1 1 13 11580 1 1 10 GLU OE2 O 12.627 -4.275 5.992 1.00 . A A . 10 GLU OE2 1 1 13 11581 1 1 11 CYS C C 10.295 -4.723 -1.342 1.00 . A A . 11 CYS C 1 1 13 11582 1 1 11 CYS CA C 9.179 -4.093 -0.509 1.00 . A A . 11 CYS CA 1 1 13 11583 1 1 11 CYS CB C 8.506 -2.973 -1.310 1.00 . A A . 11 CYS CB 1 1 13 11584 1 1 11 CYS H H 9.981 -2.589 0.810 1.00 . A A . 11 CYS H 1 1 13 11585 1 1 11 CYS HA H 8.446 -4.847 -0.267 1.00 . A A . 11 CYS HA 1 1 13 11586 1 1 11 CYS HB2 H 7.755 -2.493 -0.699 1.00 . A A . 11 CYS HB2 1 1 13 11587 1 1 11 CYS HB3 H 9.247 -2.247 -1.608 1.00 . A A . 11 CYS HB3 1 1 13 11588 1 1 11 CYS N N 9.746 -3.539 0.754 1.00 . A A . 11 CYS N 1 1 13 11589 1 1 11 CYS O O 11.322 -4.122 -1.583 1.00 . A A . 11 CYS O 1 1 13 11590 1 1 11 CYS SG S 7.685 -3.559 -2.836 1.00 . A A . 11 CYS SG 1 1 13 11591 1 1 12 ILE C C 10.739 -6.568 -4.076 1.00 . A A . 12 ILE C 1 1 13 11592 1 1 12 ILE CA C 11.143 -6.611 -2.602 1.00 . A A . 12 ILE CA 1 1 13 11593 1 1 12 ILE CB C 11.285 -8.069 -2.160 1.00 . A A . 12 ILE CB 1 1 13 11594 1 1 12 ILE CD1 C 10.066 -10.214 -1.770 1.00 . A A . 12 ILE CD1 1 1 13 11595 1 1 12 ILE CG1 C 9.913 -8.747 -2.178 1.00 . A A . 12 ILE CG1 1 1 13 11596 1 1 12 ILE CG2 C 11.859 -8.120 -0.744 1.00 . A A . 12 ILE CG2 1 1 13 11597 1 1 12 ILE H H 9.261 -6.400 -1.576 1.00 . A A . 12 ILE H 1 1 13 11598 1 1 12 ILE HA H 12.086 -6.101 -2.473 1.00 . A A . 12 ILE HA 1 1 13 11599 1 1 12 ILE HB H 11.952 -8.584 -2.836 1.00 . A A . 12 ILE HB 1 1 13 11600 1 1 12 ILE HD11 H 11.063 -10.379 -1.391 1.00 . A A . 12 ILE HD11 1 1 13 11601 1 1 12 ILE HD12 H 9.345 -10.450 -1.001 1.00 . A A . 12 ILE HD12 1 1 13 11602 1 1 12 ILE HD13 H 9.898 -10.846 -2.629 1.00 . A A . 12 ILE HD13 1 1 13 11603 1 1 12 ILE HG12 H 9.253 -8.247 -1.485 1.00 . A A . 12 ILE HG12 1 1 13 11604 1 1 12 ILE HG13 H 9.499 -8.696 -3.174 1.00 . A A . 12 ILE HG13 1 1 13 11605 1 1 12 ILE HG21 H 11.456 -7.305 -0.161 1.00 . A A . 12 ILE HG21 1 1 13 11606 1 1 12 ILE HG22 H 11.593 -9.060 -0.283 1.00 . A A . 12 ILE HG22 1 1 13 11607 1 1 12 ILE HG23 H 12.934 -8.034 -0.790 1.00 . A A . 12 ILE HG23 1 1 13 11608 1 1 12 ILE N N 10.098 -5.936 -1.783 1.00 . A A . 12 ILE N 1 1 13 11609 1 1 12 ILE O O 11.553 -6.323 -4.944 1.00 . A A . 12 ILE O 1 1 13 11610 1 1 13 ALA C C 7.672 -7.458 -5.912 1.00 . A A . 13 ALA C 1 1 13 11611 1 1 13 ALA CA C 9.037 -6.775 -5.785 1.00 . A A . 13 ALA CA 1 1 13 11612 1 1 13 ALA CB C 10.055 -7.513 -6.657 1.00 . A A . 13 ALA CB 1 1 13 11613 1 1 13 ALA H H 8.848 -6.998 -3.649 1.00 . A A . 13 ALA H 1 1 13 11614 1 1 13 ALA HA H 8.958 -5.751 -6.116 1.00 . A A . 13 ALA HA 1 1 13 11615 1 1 13 ALA HB1 H 10.723 -8.082 -6.027 1.00 . A A . 13 ALA HB1 1 1 13 11616 1 1 13 ALA HB2 H 9.536 -8.182 -7.328 1.00 . A A . 13 ALA HB2 1 1 13 11617 1 1 13 ALA HB3 H 10.624 -6.797 -7.231 1.00 . A A . 13 ALA HB3 1 1 13 11618 1 1 13 ALA N N 9.488 -6.803 -4.365 1.00 . A A . 13 ALA N 1 1 13 11619 1 1 13 ALA O O 6.939 -7.219 -6.851 1.00 . A A . 13 ALA O 1 1 13 11620 1 1 14 CYS C C 4.902 -7.958 -5.293 1.00 . A A . 14 CYS C 1 1 13 11621 1 1 14 CYS CA C 6.005 -8.997 -5.078 1.00 . A A . 14 CYS CA 1 1 13 11622 1 1 14 CYS CB C 5.738 -9.797 -3.797 1.00 . A A . 14 CYS CB 1 1 13 11623 1 1 14 CYS H H 7.925 -8.496 -4.235 1.00 . A A . 14 CYS H 1 1 13 11624 1 1 14 CYS HA H 6.021 -9.673 -5.922 1.00 . A A . 14 CYS HA 1 1 13 11625 1 1 14 CYS HB2 H 5.415 -10.793 -4.064 1.00 . A A . 14 CYS HB2 1 1 13 11626 1 1 14 CYS HB3 H 6.652 -9.864 -3.225 1.00 . A A . 14 CYS HB3 1 1 13 11627 1 1 14 CYS N N 7.323 -8.309 -4.985 1.00 . A A . 14 CYS N 1 1 13 11628 1 1 14 CYS O O 4.919 -6.890 -4.716 1.00 . A A . 14 CYS O 1 1 13 11629 1 1 14 CYS SG S 4.480 -9.189 -2.609 1.00 . A A . 14 CYS SG 1 1 13 11630 1 1 15 GLU C C 1.596 -7.712 -5.622 1.00 . A A . 15 GLU C 1 1 13 11631 1 1 15 GLU CA C 2.849 -7.282 -6.386 1.00 . A A . 15 GLU CA 1 1 13 11632 1 1 15 GLU CB C 2.540 -7.234 -7.884 1.00 . A A . 15 GLU CB 1 1 13 11633 1 1 15 GLU CD C 4.158 -8.674 -9.127 1.00 . A A . 15 GLU CD 1 1 13 11634 1 1 15 GLU CG C 3.847 -7.245 -8.678 1.00 . A A . 15 GLU CG 1 1 13 11635 1 1 15 GLU H H 3.952 -9.120 -6.594 1.00 . A A . 15 GLU H 1 1 13 11636 1 1 15 GLU HA H 3.155 -6.302 -6.051 1.00 . A A . 15 GLU HA 1 1 13 11637 1 1 15 GLU HB2 H 1.944 -8.093 -8.156 1.00 . A A . 15 GLU HB2 1 1 13 11638 1 1 15 GLU HB3 H 1.994 -6.331 -8.110 1.00 . A A . 15 GLU HB3 1 1 13 11639 1 1 15 GLU HG2 H 3.748 -6.607 -9.544 1.00 . A A . 15 GLU HG2 1 1 13 11640 1 1 15 GLU HG3 H 4.651 -6.883 -8.055 1.00 . A A . 15 GLU HG3 1 1 13 11641 1 1 15 GLU N N 3.946 -8.257 -6.131 1.00 . A A . 15 GLU N 1 1 13 11642 1 1 15 GLU O O 0.495 -7.309 -5.939 1.00 . A A . 15 GLU O 1 1 13 11643 1 1 15 GLU OE1 O 3.237 -9.471 -9.180 1.00 . A A . 15 GLU OE1 1 1 13 11644 1 1 15 GLU OE2 O 5.313 -8.946 -9.410 1.00 . A A . 15 GLU OE2 1 1 13 11645 1 1 16 SER C C -0.334 -7.774 -3.555 1.00 . A A . 16 SER C 1 1 13 11646 1 1 16 SER CA C 0.571 -8.976 -3.827 1.00 . A A . 16 SER CA 1 1 13 11647 1 1 16 SER CB C 1.040 -9.573 -2.500 1.00 . A A . 16 SER CB 1 1 13 11648 1 1 16 SER H H 2.652 -8.838 -4.370 1.00 . A A . 16 SER H 1 1 13 11649 1 1 16 SER HA H 0.027 -9.721 -4.387 1.00 . A A . 16 SER HA 1 1 13 11650 1 1 16 SER HB2 H 1.385 -8.783 -1.851 1.00 . A A . 16 SER HB2 1 1 13 11651 1 1 16 SER HB3 H 0.215 -10.090 -2.027 1.00 . A A . 16 SER HB3 1 1 13 11652 1 1 16 SER HG H 2.390 -10.839 -1.900 1.00 . A A . 16 SER HG 1 1 13 11653 1 1 16 SER N N 1.755 -8.526 -4.613 1.00 . A A . 16 SER N 1 1 13 11654 1 1 16 SER O O -1.447 -7.699 -4.038 1.00 . A A . 16 SER O 1 1 13 11655 1 1 16 SER OG O 2.108 -10.478 -2.744 1.00 . A A . 16 SER OG 1 1 13 11656 1 1 17 CYS C C -1.160 -5.011 -3.810 1.00 . A A . 17 CYS C 1 1 13 11657 1 1 17 CYS CA C -0.682 -5.625 -2.494 1.00 . A A . 17 CYS CA 1 1 13 11658 1 1 17 CYS CB C 0.170 -4.606 -1.737 1.00 . A A . 17 CYS CB 1 1 13 11659 1 1 17 CYS H H 1.044 -6.909 -2.419 1.00 . A A . 17 CYS H 1 1 13 11660 1 1 17 CYS HA H -1.535 -5.906 -1.892 1.00 . A A . 17 CYS HA 1 1 13 11661 1 1 17 CYS HB2 H -0.467 -3.837 -1.325 1.00 . A A . 17 CYS HB2 1 1 13 11662 1 1 17 CYS HB3 H 0.702 -5.102 -0.938 1.00 . A A . 17 CYS HB3 1 1 13 11663 1 1 17 CYS N N 0.141 -6.829 -2.791 1.00 . A A . 17 CYS N 1 1 13 11664 1 1 17 CYS O O -2.335 -4.769 -4.004 1.00 . A A . 17 CYS O 1 1 13 11665 1 1 17 CYS SG S 1.415 -3.777 -2.792 1.00 . A A . 17 CYS SG 1 1 13 11666 1 1 18 VAL C C -1.844 -4.943 -6.587 1.00 . A A . 18 VAL C 1 1 13 11667 1 1 18 VAL CA C -0.656 -4.163 -6.022 1.00 . A A . 18 VAL CA 1 1 13 11668 1 1 18 VAL CB C 0.518 -4.236 -7.000 1.00 . A A . 18 VAL CB 1 1 13 11669 1 1 18 VAL CG1 C 0.153 -3.505 -8.293 1.00 . A A . 18 VAL CG1 1 1 13 11670 1 1 18 VAL CG2 C 1.745 -3.574 -6.370 1.00 . A A . 18 VAL CG2 1 1 13 11671 1 1 18 VAL H H 0.686 -4.964 -4.540 1.00 . A A . 18 VAL H 1 1 13 11672 1 1 18 VAL HA H -0.940 -3.131 -5.876 1.00 . A A . 18 VAL HA 1 1 13 11673 1 1 18 VAL HB H 0.738 -5.270 -7.221 1.00 . A A . 18 VAL HB 1 1 13 11674 1 1 18 VAL HG11 H -0.241 -2.528 -8.056 1.00 . A A . 18 VAL HG11 1 1 13 11675 1 1 18 VAL HG12 H 1.035 -3.397 -8.907 1.00 . A A . 18 VAL HG12 1 1 13 11676 1 1 18 VAL HG13 H -0.592 -4.074 -8.830 1.00 . A A . 18 VAL HG13 1 1 13 11677 1 1 18 VAL HG21 H 1.425 -2.844 -5.641 1.00 . A A . 18 VAL HG21 1 1 13 11678 1 1 18 VAL HG22 H 2.350 -4.325 -5.884 1.00 . A A . 18 VAL HG22 1 1 13 11679 1 1 18 VAL HG23 H 2.325 -3.085 -7.138 1.00 . A A . 18 VAL HG23 1 1 13 11680 1 1 18 VAL N N -0.256 -4.759 -4.717 1.00 . A A . 18 VAL N 1 1 13 11681 1 1 18 VAL O O -2.620 -4.429 -7.368 1.00 . A A . 18 VAL O 1 1 13 11682 1 1 19 GLU C C -4.360 -6.722 -5.832 1.00 . A A . 19 GLU C 1 1 13 11683 1 1 19 GLU CA C -3.142 -6.979 -6.709 1.00 . A A . 19 GLU CA 1 1 13 11684 1 1 19 GLU CB C -2.792 -8.467 -6.687 1.00 . A A . 19 GLU CB 1 1 13 11685 1 1 19 GLU CD C -3.265 -9.120 -9.056 1.00 . A A . 19 GLU CD 1 1 13 11686 1 1 19 GLU CG C -2.163 -8.864 -8.025 1.00 . A A . 19 GLU CG 1 1 13 11687 1 1 19 GLU H H -1.363 -6.576 -5.561 1.00 . A A . 19 GLU H 1 1 13 11688 1 1 19 GLU HA H -3.366 -6.670 -7.714 1.00 . A A . 19 GLU HA 1 1 13 11689 1 1 19 GLU HB2 H -2.091 -8.661 -5.888 1.00 . A A . 19 GLU HB2 1 1 13 11690 1 1 19 GLU HB3 H -3.689 -9.046 -6.528 1.00 . A A . 19 GLU HB3 1 1 13 11691 1 1 19 GLU HG2 H -1.524 -8.065 -8.373 1.00 . A A . 19 GLU HG2 1 1 13 11692 1 1 19 GLU HG3 H -1.578 -9.763 -7.897 1.00 . A A . 19 GLU HG3 1 1 13 11693 1 1 19 GLU N N -1.996 -6.179 -6.194 1.00 . A A . 19 GLU N 1 1 13 11694 1 1 19 GLU O O -5.480 -6.690 -6.301 1.00 . A A . 19 GLU O 1 1 13 11695 1 1 19 GLU OE1 O -4.413 -8.848 -8.746 1.00 . A A . 19 GLU OE1 1 1 13 11696 1 1 19 GLU OE2 O -2.942 -9.584 -10.136 1.00 . A A . 19 GLU OE2 1 1 13 11697 1 1 20 ILE C C -5.597 -4.710 -3.757 1.00 . A A . 20 ILE C 1 1 13 11698 1 1 20 ILE CA C -5.302 -6.208 -3.674 1.00 . A A . 20 ILE CA 1 1 13 11699 1 1 20 ILE CB C -4.952 -6.579 -2.236 1.00 . A A . 20 ILE CB 1 1 13 11700 1 1 20 ILE CD1 C -3.183 -8.265 -1.790 1.00 . A A . 20 ILE CD1 1 1 13 11701 1 1 20 ILE CG1 C -4.654 -8.052 -2.157 1.00 . A A . 20 ILE CG1 1 1 13 11702 1 1 20 ILE CG2 C -6.123 -6.246 -1.312 1.00 . A A . 20 ILE CG2 1 1 13 11703 1 1 20 ILE H H -3.241 -6.506 -4.207 1.00 . A A . 20 ILE H 1 1 13 11704 1 1 20 ILE HA H -6.165 -6.769 -3.997 1.00 . A A . 20 ILE HA 1 1 13 11705 1 1 20 ILE HB H -4.091 -6.047 -1.925 1.00 . A A . 20 ILE HB 1 1 13 11706 1 1 20 ILE HD11 H -2.596 -7.435 -2.156 1.00 . A A . 20 ILE HD11 1 1 13 11707 1 1 20 ILE HD12 H -3.085 -8.328 -0.717 1.00 . A A . 20 ILE HD12 1 1 13 11708 1 1 20 ILE HD13 H -2.830 -9.182 -2.238 1.00 . A A . 20 ILE HD13 1 1 13 11709 1 1 20 ILE HG12 H -5.279 -8.483 -1.409 1.00 . A A . 20 ILE HG12 1 1 13 11710 1 1 20 ILE HG13 H -4.853 -8.497 -3.106 1.00 . A A . 20 ILE HG13 1 1 13 11711 1 1 20 ILE HG21 H -7.051 -6.359 -1.854 1.00 . A A . 20 ILE HG21 1 1 13 11712 1 1 20 ILE HG22 H -6.117 -6.917 -0.466 1.00 . A A . 20 ILE HG22 1 1 13 11713 1 1 20 ILE HG23 H -6.031 -5.228 -0.966 1.00 . A A . 20 ILE HG23 1 1 13 11714 1 1 20 ILE N N -4.153 -6.502 -4.565 1.00 . A A . 20 ILE N 1 1 13 11715 1 1 20 ILE O O -6.340 -4.164 -2.966 1.00 . A A . 20 ILE O 1 1 13 11716 1 1 21 ALA C C -4.244 -2.021 -5.874 1.00 . A A . 21 ALA C 1 1 13 11717 1 1 21 ALA CA C -5.238 -2.578 -4.858 1.00 . A A . 21 ALA CA 1 1 13 11718 1 1 21 ALA CB C -5.028 -1.890 -3.508 1.00 . A A . 21 ALA CB 1 1 13 11719 1 1 21 ALA H H -4.408 -4.499 -5.344 1.00 . A A . 21 ALA H 1 1 13 11720 1 1 21 ALA HA H -6.246 -2.403 -5.204 1.00 . A A . 21 ALA HA 1 1 13 11721 1 1 21 ALA HB1 H -4.332 -2.464 -2.916 1.00 . A A . 21 ALA HB1 1 1 13 11722 1 1 21 ALA HB2 H -4.631 -0.897 -3.667 1.00 . A A . 21 ALA HB2 1 1 13 11723 1 1 21 ALA HB3 H -5.971 -1.821 -2.988 1.00 . A A . 21 ALA HB3 1 1 13 11724 1 1 21 ALA N N -5.008 -4.039 -4.715 1.00 . A A . 21 ALA N 1 1 13 11725 1 1 21 ALA O O -3.386 -1.229 -5.538 1.00 . A A . 21 ALA O 1 1 13 11726 1 1 22 PRO C C -3.764 -0.533 -8.510 1.00 . A A . 22 PRO C 1 1 13 11727 1 1 22 PRO CA C -3.501 -2.006 -8.186 1.00 . A A . 22 PRO CA 1 1 13 11728 1 1 22 PRO CB C -3.877 -2.912 -9.360 1.00 . A A . 22 PRO CB 1 1 13 11729 1 1 22 PRO CD C -5.412 -3.408 -7.562 1.00 . A A . 22 PRO CD 1 1 13 11730 1 1 22 PRO CG C -5.278 -3.354 -9.067 1.00 . A A . 22 PRO CG 1 1 13 11731 1 1 22 PRO HA H -2.468 -2.159 -7.918 1.00 . A A . 22 PRO HA 1 1 13 11732 1 1 22 PRO HB2 H -3.810 -2.346 -10.281 1.00 . A A . 22 PRO HB2 1 1 13 11733 1 1 22 PRO HB3 H -3.199 -3.748 -9.401 1.00 . A A . 22 PRO HB3 1 1 13 11734 1 1 22 PRO HD2 H -6.404 -3.099 -7.259 1.00 . A A . 22 PRO HD2 1 1 13 11735 1 1 22 PRO HD3 H -5.198 -4.400 -7.197 1.00 . A A . 22 PRO HD3 1 1 13 11736 1 1 22 PRO HG2 H -5.980 -2.643 -9.481 1.00 . A A . 22 PRO HG2 1 1 13 11737 1 1 22 PRO HG3 H -5.448 -4.334 -9.484 1.00 . A A . 22 PRO HG3 1 1 13 11738 1 1 22 PRO N N -4.397 -2.461 -7.091 1.00 . A A . 22 PRO N 1 1 13 11739 1 1 22 PRO O O -3.075 0.070 -9.308 1.00 . A A . 22 PRO O 1 1 13 11740 1 1 23 GLY C C -4.466 2.333 -7.015 1.00 . A A . 23 GLY C 1 1 13 11741 1 1 23 GLY CA C -5.052 1.486 -8.146 1.00 . A A . 23 GLY CA 1 1 13 11742 1 1 23 GLY H H -5.289 -0.453 -7.242 1.00 . A A . 23 GLY H 1 1 13 11743 1 1 23 GLY HA2 H -4.610 1.782 -9.087 1.00 . A A . 23 GLY HA2 1 1 13 11744 1 1 23 GLY HA3 H -6.120 1.630 -8.186 1.00 . A A . 23 GLY HA3 1 1 13 11745 1 1 23 GLY N N -4.750 0.051 -7.886 1.00 . A A . 23 GLY N 1 1 13 11746 1 1 23 GLY O O -3.928 3.398 -7.238 1.00 . A A . 23 GLY O 1 1 13 11747 1 1 24 ALA C C -2.528 2.304 -4.486 1.00 . A A . 24 ALA C 1 1 13 11748 1 1 24 ALA CA C -4.012 2.636 -4.651 1.00 . A A . 24 ALA CA 1 1 13 11749 1 1 24 ALA CB C -4.766 2.263 -3.373 1.00 . A A . 24 ALA CB 1 1 13 11750 1 1 24 ALA H H -5.002 1.000 -5.642 1.00 . A A . 24 ALA H 1 1 13 11751 1 1 24 ALA HA H -4.124 3.691 -4.839 1.00 . A A . 24 ALA HA 1 1 13 11752 1 1 24 ALA HB1 H -4.761 1.190 -3.252 1.00 . A A . 24 ALA HB1 1 1 13 11753 1 1 24 ALA HB2 H -4.283 2.723 -2.523 1.00 . A A . 24 ALA HB2 1 1 13 11754 1 1 24 ALA HB3 H -5.786 2.614 -3.441 1.00 . A A . 24 ALA HB3 1 1 13 11755 1 1 24 ALA N N -4.565 1.863 -5.799 1.00 . A A . 24 ALA N 1 1 13 11756 1 1 24 ALA O O -1.731 3.140 -4.106 1.00 . A A . 24 ALA O 1 1 13 11757 1 1 25 PHE C C -0.098 0.633 -6.040 1.00 . A A . 25 PHE C 1 1 13 11758 1 1 25 PHE CA C -0.723 0.694 -4.641 1.00 . A A . 25 PHE CA 1 1 13 11759 1 1 25 PHE CB C -0.652 -0.699 -4.002 1.00 . A A . 25 PHE CB 1 1 13 11760 1 1 25 PHE CD1 C 1.652 -0.539 -2.978 1.00 . A A . 25 PHE CD1 1 1 13 11761 1 1 25 PHE CD2 C -0.251 -0.889 -1.517 1.00 . A A . 25 PHE CD2 1 1 13 11762 1 1 25 PHE CE1 C 2.506 -0.564 -1.867 1.00 . A A . 25 PHE CE1 1 1 13 11763 1 1 25 PHE CE2 C 0.605 -0.919 -0.409 1.00 . A A . 25 PHE CE2 1 1 13 11764 1 1 25 PHE CG C 0.272 -0.700 -2.804 1.00 . A A . 25 PHE CG 1 1 13 11765 1 1 25 PHE CZ C 1.985 -0.755 -0.584 1.00 . A A . 25 PHE CZ 1 1 13 11766 1 1 25 PHE H H -2.815 0.435 -5.081 1.00 . A A . 25 PHE H 1 1 13 11767 1 1 25 PHE HA H -0.197 1.417 -4.029 1.00 . A A . 25 PHE HA 1 1 13 11768 1 1 25 PHE HB2 H -1.642 -0.994 -3.685 1.00 . A A . 25 PHE HB2 1 1 13 11769 1 1 25 PHE HB3 H -0.289 -1.406 -4.733 1.00 . A A . 25 PHE HB3 1 1 13 11770 1 1 25 PHE HD1 H 2.058 -0.392 -3.968 1.00 . A A . 25 PHE HD1 1 1 13 11771 1 1 25 PHE HD2 H -1.315 -1.012 -1.380 1.00 . A A . 25 PHE HD2 1 1 13 11772 1 1 25 PHE HE1 H 3.567 -0.440 -1.997 1.00 . A A . 25 PHE HE1 1 1 13 11773 1 1 25 PHE HE2 H 0.202 -1.065 0.582 1.00 . A A . 25 PHE HE2 1 1 13 11774 1 1 25 PHE HZ H 2.643 -0.783 0.263 1.00 . A A . 25 PHE HZ 1 1 13 11775 1 1 25 PHE N N -2.153 1.090 -4.773 1.00 . A A . 25 PHE N 1 1 13 11776 1 1 25 PHE O O -0.741 0.248 -6.996 1.00 . A A . 25 PHE O 1 1 13 11777 1 1 26 ALA C C 3.294 1.224 -7.381 1.00 . A A . 26 ALA C 1 1 13 11778 1 1 26 ALA CA C 1.792 0.961 -7.518 1.00 . A A . 26 ALA CA 1 1 13 11779 1 1 26 ALA CB C 1.169 2.027 -8.418 1.00 . A A . 26 ALA CB 1 1 13 11780 1 1 26 ALA H H 1.652 1.314 -5.394 1.00 . A A . 26 ALA H 1 1 13 11781 1 1 26 ALA HA H 1.637 -0.014 -7.956 1.00 . A A . 26 ALA HA 1 1 13 11782 1 1 26 ALA HB1 H 0.150 2.211 -8.109 1.00 . A A . 26 ALA HB1 1 1 13 11783 1 1 26 ALA HB2 H 1.738 2.942 -8.342 1.00 . A A . 26 ALA HB2 1 1 13 11784 1 1 26 ALA HB3 H 1.178 1.684 -9.442 1.00 . A A . 26 ALA HB3 1 1 13 11785 1 1 26 ALA N N 1.146 1.007 -6.173 1.00 . A A . 26 ALA N 1 1 13 11786 1 1 26 ALA O O 3.713 2.212 -6.813 1.00 . A A . 26 ALA O 1 1 13 11787 1 1 27 MET C C 5.953 1.870 -8.486 1.00 . A A . 27 MET C 1 1 13 11788 1 1 27 MET CA C 5.582 0.558 -7.806 1.00 . A A . 27 MET CA 1 1 13 11789 1 1 27 MET CB C 6.311 -0.600 -8.493 1.00 . A A . 27 MET CB 1 1 13 11790 1 1 27 MET CE C 8.704 -1.176 -10.579 1.00 . A A . 27 MET CE 1 1 13 11791 1 1 27 MET CG C 6.140 -0.487 -10.009 1.00 . A A . 27 MET CG 1 1 13 11792 1 1 27 MET H H 3.755 -0.438 -8.363 1.00 . A A . 27 MET H 1 1 13 11793 1 1 27 MET HA H 5.867 0.602 -6.777 1.00 . A A . 27 MET HA 1 1 13 11794 1 1 27 MET HB2 H 7.362 -0.561 -8.245 1.00 . A A . 27 MET HB2 1 1 13 11795 1 1 27 MET HB3 H 5.896 -1.538 -8.155 1.00 . A A . 27 MET HB3 1 1 13 11796 1 1 27 MET HE1 H 8.180 -2.057 -10.923 1.00 . A A . 27 MET HE1 1 1 13 11797 1 1 27 MET HE2 H 9.593 -1.021 -11.174 1.00 . A A . 27 MET HE2 1 1 13 11798 1 1 27 MET HE3 H 8.985 -1.309 -9.546 1.00 . A A . 27 MET HE3 1 1 13 11799 1 1 27 MET HG2 H 5.995 -1.471 -10.430 1.00 . A A . 27 MET HG2 1 1 13 11800 1 1 27 MET HG3 H 5.280 0.128 -10.230 1.00 . A A . 27 MET HG3 1 1 13 11801 1 1 27 MET N N 4.110 0.351 -7.904 1.00 . A A . 27 MET N 1 1 13 11802 1 1 27 MET O O 5.268 2.320 -9.384 1.00 . A A . 27 MET O 1 1 13 11803 1 1 27 MET SD S 7.620 0.265 -10.730 1.00 . A A . 27 MET SD 1 1 13 11804 1 1 28 ASP C C 8.821 3.566 -9.277 1.00 . A A . 28 ASP C 1 1 13 11805 1 1 28 ASP CA C 7.410 3.756 -8.758 1.00 . A A . 28 ASP CA 1 1 13 11806 1 1 28 ASP CB C 7.344 4.900 -7.744 1.00 . A A . 28 ASP CB 1 1 13 11807 1 1 28 ASP CG C 6.764 6.146 -8.412 1.00 . A A . 28 ASP CG 1 1 13 11808 1 1 28 ASP H H 7.619 2.131 -7.372 1.00 . A A . 28 ASP H 1 1 13 11809 1 1 28 ASP HA H 6.739 3.951 -9.582 1.00 . A A . 28 ASP HA 1 1 13 11810 1 1 28 ASP HB2 H 6.709 4.605 -6.916 1.00 . A A . 28 ASP HB2 1 1 13 11811 1 1 28 ASP HB3 H 8.335 5.116 -7.379 1.00 . A A . 28 ASP HB3 1 1 13 11812 1 1 28 ASP N N 7.035 2.495 -8.093 1.00 . A A . 28 ASP N 1 1 13 11813 1 1 28 ASP O O 9.504 2.680 -8.810 1.00 . A A . 28 ASP O 1 1 13 11814 1 1 28 ASP OD1 O 6.182 6.007 -9.476 1.00 . A A . 28 ASP OD1 1 1 13 11815 1 1 28 ASP OD2 O 6.910 7.218 -7.849 1.00 . A A . 28 ASP OD2 1 1 13 11816 1 1 29 PRO C C 11.524 5.068 -9.957 1.00 . A A . 29 PRO C 1 1 13 11817 1 1 29 PRO CA C 10.548 4.289 -10.826 1.00 . A A . 29 PRO CA 1 1 13 11818 1 1 29 PRO CB C 10.375 4.949 -12.191 1.00 . A A . 29 PRO CB 1 1 13 11819 1 1 29 PRO CD C 8.420 5.471 -10.811 1.00 . A A . 29 PRO CD 1 1 13 11820 1 1 29 PRO CG C 9.206 5.882 -12.041 1.00 . A A . 29 PRO CG 1 1 13 11821 1 1 29 PRO HA H 10.856 3.262 -10.936 1.00 . A A . 29 PRO HA 1 1 13 11822 1 1 29 PRO HB2 H 11.286 5.474 -12.449 1.00 . A A . 29 PRO HB2 1 1 13 11823 1 1 29 PRO HB3 H 10.180 4.190 -12.932 1.00 . A A . 29 PRO HB3 1 1 13 11824 1 1 29 PRO HD2 H 8.345 6.301 -10.122 1.00 . A A . 29 PRO HD2 1 1 13 11825 1 1 29 PRO HD3 H 7.443 5.124 -11.083 1.00 . A A . 29 PRO HD3 1 1 13 11826 1 1 29 PRO HG2 H 9.566 6.894 -11.925 1.00 . A A . 29 PRO HG2 1 1 13 11827 1 1 29 PRO HG3 H 8.574 5.814 -12.913 1.00 . A A . 29 PRO HG3 1 1 13 11828 1 1 29 PRO N N 9.199 4.383 -10.225 1.00 . A A . 29 PRO N 1 1 13 11829 1 1 29 PRO O O 12.726 4.895 -10.022 1.00 . A A . 29 PRO O 1 1 13 11830 1 1 30 GLU C C 11.949 5.877 -6.903 1.00 . A A . 30 GLU C 1 1 13 11831 1 1 30 GLU CA C 11.846 6.686 -8.186 1.00 . A A . 30 GLU CA 1 1 13 11832 1 1 30 GLU CB C 11.222 8.048 -7.894 1.00 . A A . 30 GLU CB 1 1 13 11833 1 1 30 GLU CD C 9.853 9.880 -8.908 1.00 . A A . 30 GLU CD 1 1 13 11834 1 1 30 GLU CG C 10.151 8.380 -8.940 1.00 . A A . 30 GLU CG 1 1 13 11835 1 1 30 GLU H H 10.014 5.984 -9.073 1.00 . A A . 30 GLU H 1 1 13 11836 1 1 30 GLU HA H 12.823 6.819 -8.608 1.00 . A A . 30 GLU HA 1 1 13 11837 1 1 30 GLU HB2 H 10.780 8.023 -6.919 1.00 . A A . 30 GLU HB2 1 1 13 11838 1 1 30 GLU HB3 H 11.990 8.806 -7.919 1.00 . A A . 30 GLU HB3 1 1 13 11839 1 1 30 GLU HG2 H 10.510 8.103 -9.920 1.00 . A A . 30 GLU HG2 1 1 13 11840 1 1 30 GLU HG3 H 9.249 7.830 -8.717 1.00 . A A . 30 GLU HG3 1 1 13 11841 1 1 30 GLU N N 10.991 5.900 -9.115 1.00 . A A . 30 GLU N 1 1 13 11842 1 1 30 GLU O O 12.931 5.924 -6.189 1.00 . A A . 30 GLU O 1 1 13 11843 1 1 30 GLU OE1 O 8.996 10.278 -8.137 1.00 . A A . 30 GLU OE1 1 1 13 11844 1 1 30 GLU OE2 O 10.487 10.606 -9.657 1.00 . A A . 30 GLU OE2 1 1 13 11845 1 1 31 ILE C C 11.108 2.782 -5.896 1.00 . A A . 31 ILE C 1 1 13 11846 1 1 31 ILE CA C 10.946 4.229 -5.442 1.00 . A A . 31 ILE CA 1 1 13 11847 1 1 31 ILE CB C 9.642 4.415 -4.653 1.00 . A A . 31 ILE CB 1 1 13 11848 1 1 31 ILE CD1 C 7.183 3.944 -4.673 1.00 . A A . 31 ILE CD1 1 1 13 11849 1 1 31 ILE CG1 C 8.545 3.505 -5.217 1.00 . A A . 31 ILE CG1 1 1 13 11850 1 1 31 ILE CG2 C 9.196 5.876 -4.751 1.00 . A A . 31 ILE CG2 1 1 13 11851 1 1 31 ILE H H 10.179 5.066 -7.257 1.00 . A A . 31 ILE H 1 1 13 11852 1 1 31 ILE HA H 11.768 4.486 -4.825 1.00 . A A . 31 ILE HA 1 1 13 11853 1 1 31 ILE HB H 9.816 4.166 -3.615 1.00 . A A . 31 ILE HB 1 1 13 11854 1 1 31 ILE HD11 H 7.020 4.985 -4.910 1.00 . A A . 31 ILE HD11 1 1 13 11855 1 1 31 ILE HD12 H 6.405 3.346 -5.122 1.00 . A A . 31 ILE HD12 1 1 13 11856 1 1 31 ILE HD13 H 7.168 3.812 -3.603 1.00 . A A . 31 ILE HD13 1 1 13 11857 1 1 31 ILE HG12 H 8.544 3.565 -6.293 1.00 . A A . 31 ILE HG12 1 1 13 11858 1 1 31 ILE HG13 H 8.737 2.487 -4.915 1.00 . A A . 31 ILE HG13 1 1 13 11859 1 1 31 ILE HG21 H 10.064 6.518 -4.747 1.00 . A A . 31 ILE HG21 1 1 13 11860 1 1 31 ILE HG22 H 8.643 6.023 -5.668 1.00 . A A . 31 ILE HG22 1 1 13 11861 1 1 31 ILE HG23 H 8.566 6.118 -3.908 1.00 . A A . 31 ILE HG23 1 1 13 11862 1 1 31 ILE N N 10.939 5.098 -6.640 1.00 . A A . 31 ILE N 1 1 13 11863 1 1 31 ILE O O 11.183 1.878 -5.088 1.00 . A A . 31 ILE O 1 1 13 11864 1 1 32 GLU C C 10.605 0.212 -6.824 1.00 . A A . 32 GLU C 1 1 13 11865 1 1 32 GLU CA C 11.286 1.197 -7.760 1.00 . A A . 32 GLU CA 1 1 13 11866 1 1 32 GLU CB C 12.765 0.836 -7.919 1.00 . A A . 32 GLU CB 1 1 13 11867 1 1 32 GLU CD C 12.436 -0.397 -10.070 1.00 . A A . 32 GLU CD 1 1 13 11868 1 1 32 GLU CG C 13.125 0.797 -9.405 1.00 . A A . 32 GLU CG 1 1 13 11869 1 1 32 GLU H H 11.082 3.331 -7.807 1.00 . A A . 32 GLU H 1 1 13 11870 1 1 32 GLU HA H 10.798 1.172 -8.722 1.00 . A A . 32 GLU HA 1 1 13 11871 1 1 32 GLU HB2 H 13.372 1.576 -7.418 1.00 . A A . 32 GLU HB2 1 1 13 11872 1 1 32 GLU HB3 H 12.946 -0.134 -7.481 1.00 . A A . 32 GLU HB3 1 1 13 11873 1 1 32 GLU HG2 H 12.798 1.712 -9.878 1.00 . A A . 32 GLU HG2 1 1 13 11874 1 1 32 GLU HG3 H 14.195 0.700 -9.515 1.00 . A A . 32 GLU HG3 1 1 13 11875 1 1 32 GLU N N 11.152 2.572 -7.194 1.00 . A A . 32 GLU N 1 1 13 11876 1 1 32 GLU O O 11.085 -0.877 -6.586 1.00 . A A . 32 GLU O 1 1 13 11877 1 1 32 GLU OE1 O 12.216 -1.384 -9.388 1.00 . A A . 32 GLU OE1 1 1 13 11878 1 1 32 GLU OE2 O 12.141 -0.303 -11.250 1.00 . A A . 32 GLU OE2 1 1 13 11879 1 1 33 LYS C C 7.328 0.176 -5.131 1.00 . A A . 33 LYS C 1 1 13 11880 1 1 33 LYS CA C 8.778 -0.285 -5.309 1.00 . A A . 33 LYS CA 1 1 13 11881 1 1 33 LYS CB C 9.482 -0.241 -3.947 1.00 . A A . 33 LYS CB 1 1 13 11882 1 1 33 LYS CD C 11.406 -1.174 -2.650 1.00 . A A . 33 LYS CD 1 1 13 11883 1 1 33 LYS CE C 12.930 -1.295 -2.716 1.00 . A A . 33 LYS CE 1 1 13 11884 1 1 33 LYS CG C 10.853 -0.913 -4.052 1.00 . A A . 33 LYS CG 1 1 13 11885 1 1 33 LYS H H 9.141 1.511 -6.483 1.00 . A A . 33 LYS H 1 1 13 11886 1 1 33 LYS HA H 8.788 -1.297 -5.682 1.00 . A A . 33 LYS HA 1 1 13 11887 1 1 33 LYS HB2 H 9.609 0.788 -3.642 1.00 . A A . 33 LYS HB2 1 1 13 11888 1 1 33 LYS HB3 H 8.884 -0.761 -3.214 1.00 . A A . 33 LYS HB3 1 1 13 11889 1 1 33 LYS HD2 H 11.137 -0.354 -1.998 1.00 . A A . 33 LYS HD2 1 1 13 11890 1 1 33 LYS HD3 H 10.990 -2.092 -2.263 1.00 . A A . 33 LYS HD3 1 1 13 11891 1 1 33 LYS HE2 H 13.199 -2.086 -3.401 1.00 . A A . 33 LYS HE2 1 1 13 11892 1 1 33 LYS HE3 H 13.351 -0.362 -3.060 1.00 . A A . 33 LYS HE3 1 1 13 11893 1 1 33 LYS HG2 H 10.755 -1.850 -4.580 1.00 . A A . 33 LYS HG2 1 1 13 11894 1 1 33 LYS HG3 H 11.531 -0.266 -4.588 1.00 . A A . 33 LYS HG3 1 1 13 11895 1 1 33 LYS HZ1 H 12.910 -2.390 -0.945 1.00 . A A . 33 LYS HZ1 1 1 13 11896 1 1 33 LYS HZ2 H 14.458 -1.891 -1.435 1.00 . A A . 33 LYS HZ2 1 1 13 11897 1 1 33 LYS HZ3 H 13.379 -0.771 -0.753 1.00 . A A . 33 LYS HZ3 1 1 13 11898 1 1 33 LYS N N 9.494 0.612 -6.272 1.00 . A A . 33 LYS N 1 1 13 11899 1 1 33 LYS NZ N 13.459 -1.611 -1.360 1.00 . A A . 33 LYS NZ 1 1 13 11900 1 1 33 LYS O O 7.021 1.347 -5.215 1.00 . A A . 33 LYS O 1 1 13 11901 1 1 34 ALA C C 4.814 0.627 -3.588 1.00 . A A . 34 ALA C 1 1 13 11902 1 1 34 ALA CA C 4.992 -0.393 -4.718 1.00 . A A . 34 ALA CA 1 1 13 11903 1 1 34 ALA CB C 4.207 -1.661 -4.377 1.00 . A A . 34 ALA CB 1 1 13 11904 1 1 34 ALA H H 6.711 -1.687 -4.837 1.00 . A A . 34 ALA H 1 1 13 11905 1 1 34 ALA HA H 4.607 0.022 -5.635 1.00 . A A . 34 ALA HA 1 1 13 11906 1 1 34 ALA HB1 H 4.792 -2.530 -4.640 1.00 . A A . 34 ALA HB1 1 1 13 11907 1 1 34 ALA HB2 H 3.992 -1.678 -3.319 1.00 . A A . 34 ALA HB2 1 1 13 11908 1 1 34 ALA HB3 H 3.279 -1.671 -4.931 1.00 . A A . 34 ALA HB3 1 1 13 11909 1 1 34 ALA N N 6.435 -0.748 -4.893 1.00 . A A . 34 ALA N 1 1 13 11910 1 1 34 ALA O O 5.530 0.620 -2.610 1.00 . A A . 34 ALA O 1 1 13 11911 1 1 35 TYR C C 2.075 2.887 -2.688 1.00 . A A . 35 TYR C 1 1 13 11912 1 1 35 TYR CA C 3.562 2.510 -2.655 1.00 . A A . 35 TYR CA 1 1 13 11913 1 1 35 TYR CB C 4.434 3.756 -2.882 1.00 . A A . 35 TYR CB 1 1 13 11914 1 1 35 TYR CD1 C 3.129 4.102 -5.034 1.00 . A A . 35 TYR CD1 1 1 13 11915 1 1 35 TYR CD2 C 4.092 6.027 -3.923 1.00 . A A . 35 TYR CD2 1 1 13 11916 1 1 35 TYR CE1 C 2.623 4.934 -6.039 1.00 . A A . 35 TYR CE1 1 1 13 11917 1 1 35 TYR CE2 C 3.583 6.860 -4.928 1.00 . A A . 35 TYR CE2 1 1 13 11918 1 1 35 TYR CG C 3.865 4.645 -3.972 1.00 . A A . 35 TYR CG 1 1 13 11919 1 1 35 TYR CZ C 2.849 6.312 -5.986 1.00 . A A . 35 TYR CZ 1 1 13 11920 1 1 35 TYR H H 3.272 1.450 -4.510 1.00 . A A . 35 TYR H 1 1 13 11921 1 1 35 TYR HA H 3.790 2.092 -1.681 1.00 . A A . 35 TYR HA 1 1 13 11922 1 1 35 TYR HB2 H 4.490 4.320 -1.963 1.00 . A A . 35 TYR HB2 1 1 13 11923 1 1 35 TYR HB3 H 5.426 3.441 -3.164 1.00 . A A . 35 TYR HB3 1 1 13 11924 1 1 35 TYR HD1 H 2.950 3.046 -5.078 1.00 . A A . 35 TYR HD1 1 1 13 11925 1 1 35 TYR HD2 H 4.659 6.451 -3.107 1.00 . A A . 35 TYR HD2 1 1 13 11926 1 1 35 TYR HE1 H 2.057 4.511 -6.856 1.00 . A A . 35 TYR HE1 1 1 13 11927 1 1 35 TYR HE2 H 3.757 7.924 -4.886 1.00 . A A . 35 TYR HE2 1 1 13 11928 1 1 35 TYR HH H 2.460 6.680 -7.818 1.00 . A A . 35 TYR HH 1 1 13 11929 1 1 35 TYR N N 3.838 1.488 -3.716 1.00 . A A . 35 TYR N 1 1 13 11930 1 1 35 TYR O O 1.415 2.777 -3.701 1.00 . A A . 35 TYR O 1 1 13 11931 1 1 35 TYR OH O 2.350 7.132 -6.978 1.00 . A A . 35 TYR OH 1 1 13 11932 1 1 36 VAL C C -0.049 5.178 -1.835 1.00 . A A . 36 VAL C 1 1 13 11933 1 1 36 VAL CA C 0.091 3.683 -1.551 1.00 . A A . 36 VAL CA 1 1 13 11934 1 1 36 VAL CB C -0.493 3.354 -0.174 1.00 . A A . 36 VAL CB 1 1 13 11935 1 1 36 VAL CG1 C -1.841 4.039 -0.001 1.00 . A A . 36 VAL CG1 1 1 13 11936 1 1 36 VAL CG2 C -0.688 1.846 -0.055 1.00 . A A . 36 VAL CG2 1 1 13 11937 1 1 36 VAL H H 2.077 3.385 -0.766 1.00 . A A . 36 VAL H 1 1 13 11938 1 1 36 VAL HA H -0.438 3.124 -2.309 1.00 . A A . 36 VAL HA 1 1 13 11939 1 1 36 VAL HB H 0.180 3.697 0.596 1.00 . A A . 36 VAL HB 1 1 13 11940 1 1 36 VAL HG11 H -2.514 3.702 -0.771 1.00 . A A . 36 VAL HG11 1 1 13 11941 1 1 36 VAL HG12 H -2.244 3.788 0.969 1.00 . A A . 36 VAL HG12 1 1 13 11942 1 1 36 VAL HG13 H -1.711 5.108 -0.073 1.00 . A A . 36 VAL HG13 1 1 13 11943 1 1 36 VAL HG21 H 0.127 1.341 -0.550 1.00 . A A . 36 VAL HG21 1 1 13 11944 1 1 36 VAL HG22 H -0.705 1.566 0.988 1.00 . A A . 36 VAL HG22 1 1 13 11945 1 1 36 VAL HG23 H -1.622 1.566 -0.518 1.00 . A A . 36 VAL HG23 1 1 13 11946 1 1 36 VAL N N 1.536 3.314 -1.580 1.00 . A A . 36 VAL N 1 1 13 11947 1 1 36 VAL O O 0.217 6.007 -0.988 1.00 . A A . 36 VAL O 1 1 13 11948 1 1 37 LYS C C -2.036 7.316 -3.730 1.00 . A A . 37 LYS C 1 1 13 11949 1 1 37 LYS CA C -0.588 6.982 -3.357 1.00 . A A . 37 LYS CA 1 1 13 11950 1 1 37 LYS CB C 0.334 7.332 -4.529 1.00 . A A . 37 LYS CB 1 1 13 11951 1 1 37 LYS CD C -0.209 7.709 -6.941 1.00 . A A . 37 LYS CD 1 1 13 11952 1 1 37 LYS CE C -1.486 8.544 -6.845 1.00 . A A . 37 LYS CE 1 1 13 11953 1 1 37 LYS CG C -0.183 6.675 -5.811 1.00 . A A . 37 LYS CG 1 1 13 11954 1 1 37 LYS H H -0.649 4.842 -3.702 1.00 . A A . 37 LYS H 1 1 13 11955 1 1 37 LYS HA H -0.301 7.569 -2.496 1.00 . A A . 37 LYS HA 1 1 13 11956 1 1 37 LYS HB2 H 0.357 8.404 -4.659 1.00 . A A . 37 LYS HB2 1 1 13 11957 1 1 37 LYS HB3 H 1.330 6.973 -4.321 1.00 . A A . 37 LYS HB3 1 1 13 11958 1 1 37 LYS HD2 H 0.651 8.357 -6.854 1.00 . A A . 37 LYS HD2 1 1 13 11959 1 1 37 LYS HD3 H -0.183 7.202 -7.893 1.00 . A A . 37 LYS HD3 1 1 13 11960 1 1 37 LYS HE2 H -2.063 8.224 -5.989 1.00 . A A . 37 LYS HE2 1 1 13 11961 1 1 37 LYS HE3 H -1.227 9.587 -6.733 1.00 . A A . 37 LYS HE3 1 1 13 11962 1 1 37 LYS HG2 H 0.470 5.859 -6.086 1.00 . A A . 37 LYS HG2 1 1 13 11963 1 1 37 LYS HG3 H -1.181 6.297 -5.649 1.00 . A A . 37 LYS HG3 1 1 13 11964 1 1 37 LYS HZ1 H -2.003 7.490 -8.567 1.00 . A A . 37 LYS HZ1 1 1 13 11965 1 1 37 LYS HZ2 H -3.303 8.303 -7.834 1.00 . A A . 37 LYS HZ2 1 1 13 11966 1 1 37 LYS HZ3 H -2.144 9.174 -8.718 1.00 . A A . 37 LYS HZ3 1 1 13 11967 1 1 37 LYS N N -0.451 5.530 -3.026 1.00 . A A . 37 LYS N 1 1 13 11968 1 1 37 LYS NZ N -2.295 8.365 -8.085 1.00 . A A . 37 LYS NZ 1 1 13 11969 1 1 37 LYS O O -2.461 8.450 -3.628 1.00 . A A . 37 LYS O 1 1 13 11970 1 1 38 ASP C C -5.162 5.959 -3.560 1.00 . A A . 38 ASP C 1 1 13 11971 1 1 38 ASP CA C -4.209 6.642 -4.545 1.00 . A A . 38 ASP CA 1 1 13 11972 1 1 38 ASP CB C -4.472 6.129 -5.963 1.00 . A A . 38 ASP CB 1 1 13 11973 1 1 38 ASP CG C -5.952 6.306 -6.306 1.00 . A A . 38 ASP CG 1 1 13 11974 1 1 38 ASP H H -2.441 5.441 -4.248 1.00 . A A . 38 ASP H 1 1 13 11975 1 1 38 ASP HA H -4.372 7.710 -4.516 1.00 . A A . 38 ASP HA 1 1 13 11976 1 1 38 ASP HB2 H -3.871 6.689 -6.664 1.00 . A A . 38 ASP HB2 1 1 13 11977 1 1 38 ASP HB3 H -4.214 5.084 -6.023 1.00 . A A . 38 ASP HB3 1 1 13 11978 1 1 38 ASP N N -2.796 6.351 -4.166 1.00 . A A . 38 ASP N 1 1 13 11979 1 1 38 ASP O O -5.451 4.784 -3.669 1.00 . A A . 38 ASP O 1 1 13 11980 1 1 38 ASP OD1 O -6.662 6.884 -5.500 1.00 . A A . 38 ASP OD1 1 1 13 11981 1 1 38 ASP OD2 O -6.350 5.858 -7.370 1.00 . A A . 38 ASP OD2 1 1 13 11982 1 1 39 VAL C C -7.869 5.639 -2.313 1.00 . A A . 39 VAL C 1 1 13 11983 1 1 39 VAL CA C -6.589 6.087 -1.605 1.00 . A A . 39 VAL CA 1 1 13 11984 1 1 39 VAL CB C -6.938 7.127 -0.540 1.00 . A A . 39 VAL CB 1 1 13 11985 1 1 39 VAL CG1 C -5.679 7.500 0.246 1.00 . A A . 39 VAL CG1 1 1 13 11986 1 1 39 VAL CG2 C -7.503 8.376 -1.221 1.00 . A A . 39 VAL CG2 1 1 13 11987 1 1 39 VAL H H -5.410 7.634 -2.527 1.00 . A A . 39 VAL H 1 1 13 11988 1 1 39 VAL HA H -6.118 5.235 -1.137 1.00 . A A . 39 VAL HA 1 1 13 11989 1 1 39 VAL HB H -7.675 6.718 0.136 1.00 . A A . 39 VAL HB 1 1 13 11990 1 1 39 VAL HG11 H -5.027 6.641 0.312 1.00 . A A . 39 VAL HG11 1 1 13 11991 1 1 39 VAL HG12 H -5.164 8.305 -0.258 1.00 . A A . 39 VAL HG12 1 1 13 11992 1 1 39 VAL HG13 H -5.957 7.818 1.240 1.00 . A A . 39 VAL HG13 1 1 13 11993 1 1 39 VAL HG21 H -7.093 8.458 -2.217 1.00 . A A . 39 VAL HG21 1 1 13 11994 1 1 39 VAL HG22 H -8.578 8.298 -1.280 1.00 . A A . 39 VAL HG22 1 1 13 11995 1 1 39 VAL HG23 H -7.236 9.252 -0.649 1.00 . A A . 39 VAL HG23 1 1 13 11996 1 1 39 VAL N N -5.654 6.688 -2.597 1.00 . A A . 39 VAL N 1 1 13 11997 1 1 39 VAL O O -8.526 4.706 -1.895 1.00 . A A . 39 VAL O 1 1 13 11998 1 1 40 GLU C C -9.172 4.730 -5.036 1.00 . A A . 40 GLU C 1 1 13 11999 1 1 40 GLU CA C -9.471 5.910 -4.110 1.00 . A A . 40 GLU CA 1 1 13 12000 1 1 40 GLU CB C -9.965 7.095 -4.940 1.00 . A A . 40 GLU CB 1 1 13 12001 1 1 40 GLU CD C -10.974 8.154 -2.914 1.00 . A A . 40 GLU CD 1 1 13 12002 1 1 40 GLU CG C -11.255 7.643 -4.328 1.00 . A A . 40 GLU CG 1 1 13 12003 1 1 40 GLU H H -7.689 7.049 -3.698 1.00 . A A . 40 GLU H 1 1 13 12004 1 1 40 GLU HA H -10.234 5.626 -3.399 1.00 . A A . 40 GLU HA 1 1 13 12005 1 1 40 GLU HB2 H -9.210 7.868 -4.945 1.00 . A A . 40 GLU HB2 1 1 13 12006 1 1 40 GLU HB3 H -10.158 6.771 -5.951 1.00 . A A . 40 GLU HB3 1 1 13 12007 1 1 40 GLU HG2 H -11.626 8.454 -4.938 1.00 . A A . 40 GLU HG2 1 1 13 12008 1 1 40 GLU HG3 H -11.995 6.858 -4.284 1.00 . A A . 40 GLU HG3 1 1 13 12009 1 1 40 GLU N N -8.231 6.297 -3.380 1.00 . A A . 40 GLU N 1 1 13 12010 1 1 40 GLU O O -10.068 4.080 -5.537 1.00 . A A . 40 GLU O 1 1 13 12011 1 1 40 GLU OE1 O -10.008 8.880 -2.749 1.00 . A A . 40 GLU OE1 1 1 13 12012 1 1 40 GLU OE2 O -11.729 7.808 -2.021 1.00 . A A . 40 GLU OE2 1 1 13 12013 1 1 41 GLY C C -7.984 2.001 -5.494 1.00 . A A . 41 GLY C 1 1 13 12014 1 1 41 GLY CA C -7.568 3.310 -6.161 1.00 . A A . 41 GLY CA 1 1 13 12015 1 1 41 GLY H H -7.213 4.984 -4.853 1.00 . A A . 41 GLY H 1 1 13 12016 1 1 41 GLY HA2 H -8.086 3.418 -7.103 1.00 . A A . 41 GLY HA2 1 1 13 12017 1 1 41 GLY HA3 H -6.503 3.302 -6.333 1.00 . A A . 41 GLY HA3 1 1 13 12018 1 1 41 GLY N N -7.921 4.449 -5.268 1.00 . A A . 41 GLY N 1 1 13 12019 1 1 41 GLY O O -8.100 0.974 -6.133 1.00 . A A . 41 GLY O 1 1 13 12020 1 1 42 ALA C C -9.473 1.169 -2.282 1.00 . A A . 42 ALA C 1 1 13 12021 1 1 42 ALA CA C -8.619 0.793 -3.493 1.00 . A A . 42 ALA CA 1 1 13 12022 1 1 42 ALA CB C -7.373 0.041 -3.023 1.00 . A A . 42 ALA CB 1 1 13 12023 1 1 42 ALA H H -8.108 2.872 -3.715 1.00 . A A . 42 ALA H 1 1 13 12024 1 1 42 ALA HA H -9.191 0.163 -4.158 1.00 . A A . 42 ALA HA 1 1 13 12025 1 1 42 ALA HB1 H -6.666 -0.028 -3.836 1.00 . A A . 42 ALA HB1 1 1 13 12026 1 1 42 ALA HB2 H -6.921 0.572 -2.198 1.00 . A A . 42 ALA HB2 1 1 13 12027 1 1 42 ALA HB3 H -7.652 -0.953 -2.702 1.00 . A A . 42 ALA HB3 1 1 13 12028 1 1 42 ALA N N -8.209 2.032 -4.209 1.00 . A A . 42 ALA N 1 1 13 12029 1 1 42 ALA O O -9.116 2.031 -1.503 1.00 . A A . 42 ALA O 1 1 13 12030 1 1 43 SER C C -10.736 0.510 0.344 1.00 . A A . 43 SER C 1 1 13 12031 1 1 43 SER CA C -11.468 0.855 -0.953 1.00 . A A . 43 SER CA 1 1 13 12032 1 1 43 SER CB C -12.758 0.042 -1.040 1.00 . A A . 43 SER CB 1 1 13 12033 1 1 43 SER H H -10.871 -0.160 -2.752 1.00 . A A . 43 SER H 1 1 13 12034 1 1 43 SER HA H -11.705 1.910 -0.963 1.00 . A A . 43 SER HA 1 1 13 12035 1 1 43 SER HB2 H -12.759 -0.720 -0.279 1.00 . A A . 43 SER HB2 1 1 13 12036 1 1 43 SER HB3 H -13.605 0.698 -0.890 1.00 . A A . 43 SER HB3 1 1 13 12037 1 1 43 SER HG H -13.771 -0.662 -2.545 1.00 . A A . 43 SER HG 1 1 13 12038 1 1 43 SER N N -10.598 0.531 -2.115 1.00 . A A . 43 SER N 1 1 13 12039 1 1 43 SER O O -9.719 -0.158 0.338 1.00 . A A . 43 SER O 1 1 13 12040 1 1 43 SER OG O -12.842 -0.573 -2.319 1.00 . A A . 43 SER OG 1 1 13 12041 1 1 44 GLN C C -10.492 -0.856 2.939 1.00 . A A . 44 GLN C 1 1 13 12042 1 1 44 GLN CA C -10.593 0.658 2.758 1.00 . A A . 44 GLN CA 1 1 13 12043 1 1 44 GLN CB C -11.423 1.254 3.896 1.00 . A A . 44 GLN CB 1 1 13 12044 1 1 44 GLN CD C -11.932 3.353 5.144 1.00 . A A . 44 GLN CD 1 1 13 12045 1 1 44 GLN CG C -10.960 2.685 4.170 1.00 . A A . 44 GLN CG 1 1 13 12046 1 1 44 GLN H H -12.071 1.493 1.435 1.00 . A A . 44 GLN H 1 1 13 12047 1 1 44 GLN HA H -9.603 1.090 2.770 1.00 . A A . 44 GLN HA 1 1 13 12048 1 1 44 GLN HB2 H -12.466 1.260 3.615 1.00 . A A . 44 GLN HB2 1 1 13 12049 1 1 44 GLN HB3 H -11.292 0.659 4.786 1.00 . A A . 44 GLN HB3 1 1 13 12050 1 1 44 GLN HE21 H -10.512 3.876 6.429 1.00 . A A . 44 GLN HE21 1 1 13 12051 1 1 44 GLN HE22 H -12.088 4.325 6.867 1.00 . A A . 44 GLN HE22 1 1 13 12052 1 1 44 GLN HG2 H -9.970 2.668 4.603 1.00 . A A . 44 GLN HG2 1 1 13 12053 1 1 44 GLN HG3 H -10.941 3.241 3.245 1.00 . A A . 44 GLN HG3 1 1 13 12054 1 1 44 GLN N N -11.251 0.958 1.456 1.00 . A A . 44 GLN N 1 1 13 12055 1 1 44 GLN NE2 N -11.472 3.897 6.237 1.00 . A A . 44 GLN NE2 1 1 13 12056 1 1 44 GLN O O -9.446 -1.383 3.263 1.00 . A A . 44 GLN O 1 1 13 12057 1 1 44 GLN OE1 O -13.123 3.380 4.908 1.00 . A A . 44 GLN OE1 1 1 13 12058 1 1 45 GLU C C -10.543 -3.625 1.865 1.00 . A A . 45 GLU C 1 1 13 12059 1 1 45 GLU CA C -11.523 -3.042 2.893 1.00 . A A . 45 GLU CA 1 1 13 12060 1 1 45 GLU CB C -12.919 -3.628 2.667 1.00 . A A . 45 GLU CB 1 1 13 12061 1 1 45 GLU CD C -14.576 -3.916 4.516 1.00 . A A . 45 GLU CD 1 1 13 12062 1 1 45 GLU CG C -13.929 -2.908 3.564 1.00 . A A . 45 GLU CG 1 1 13 12063 1 1 45 GLU H H -12.405 -1.123 2.469 1.00 . A A . 45 GLU H 1 1 13 12064 1 1 45 GLU HA H -11.187 -3.280 3.894 1.00 . A A . 45 GLU HA 1 1 13 12065 1 1 45 GLU HB2 H -13.200 -3.500 1.631 1.00 . A A . 45 GLU HB2 1 1 13 12066 1 1 45 GLU HB3 H -12.911 -4.680 2.911 1.00 . A A . 45 GLU HB3 1 1 13 12067 1 1 45 GLU HG2 H -13.422 -2.145 4.137 1.00 . A A . 45 GLU HG2 1 1 13 12068 1 1 45 GLU HG3 H -14.693 -2.452 2.953 1.00 . A A . 45 GLU HG3 1 1 13 12069 1 1 45 GLU N N -11.569 -1.563 2.732 1.00 . A A . 45 GLU N 1 1 13 12070 1 1 45 GLU O O -10.098 -4.756 1.971 1.00 . A A . 45 GLU O 1 1 13 12071 1 1 45 GLU OE1 O -13.965 -4.225 5.526 1.00 . A A . 45 GLU OE1 1 1 13 12072 1 1 45 GLU OE2 O -15.673 -4.361 4.220 1.00 . A A . 45 GLU OE2 1 1 13 12073 1 1 46 GLU C C -7.828 -2.974 0.369 1.00 . A A . 46 GLU C 1 1 13 12074 1 1 46 GLU CA C -9.206 -3.335 -0.131 1.00 . A A . 46 GLU CA 1 1 13 12075 1 1 46 GLU CB C -9.454 -2.632 -1.464 1.00 . A A . 46 GLU CB 1 1 13 12076 1 1 46 GLU CD C -11.091 -2.435 -3.338 1.00 . A A . 46 GLU CD 1 1 13 12077 1 1 46 GLU CG C -10.921 -2.783 -1.857 1.00 . A A . 46 GLU CG 1 1 13 12078 1 1 46 GLU H H -10.507 -1.925 0.838 1.00 . A A . 46 GLU H 1 1 13 12079 1 1 46 GLU HA H -9.292 -4.406 -0.249 1.00 . A A . 46 GLU HA 1 1 13 12080 1 1 46 GLU HB2 H -9.214 -1.583 -1.366 1.00 . A A . 46 GLU HB2 1 1 13 12081 1 1 46 GLU HB3 H -8.830 -3.074 -2.223 1.00 . A A . 46 GLU HB3 1 1 13 12082 1 1 46 GLU HG2 H -11.237 -3.802 -1.686 1.00 . A A . 46 GLU HG2 1 1 13 12083 1 1 46 GLU HG3 H -11.521 -2.113 -1.260 1.00 . A A . 46 GLU HG3 1 1 13 12084 1 1 46 GLU N N -10.174 -2.846 0.886 1.00 . A A . 46 GLU N 1 1 13 12085 1 1 46 GLU O O -6.904 -3.763 0.353 1.00 . A A . 46 GLU O 1 1 13 12086 1 1 46 GLU OE1 O -10.357 -1.586 -3.815 1.00 . A A . 46 GLU OE1 1 1 13 12087 1 1 46 GLU OE2 O -11.951 -3.026 -3.970 1.00 . A A . 46 GLU OE2 1 1 13 12088 1 1 47 VAL C C -6.026 -2.279 2.528 1.00 . A A . 47 VAL C 1 1 13 12089 1 1 47 VAL CA C -6.418 -1.322 1.397 1.00 . A A . 47 VAL CA 1 1 13 12090 1 1 47 VAL CB C -6.594 0.097 1.935 1.00 . A A . 47 VAL CB 1 1 13 12091 1 1 47 VAL CG1 C -5.485 0.409 2.929 1.00 . A A . 47 VAL CG1 1 1 13 12092 1 1 47 VAL CG2 C -6.534 1.092 0.776 1.00 . A A . 47 VAL CG2 1 1 13 12093 1 1 47 VAL H H -8.478 -1.188 0.863 1.00 . A A . 47 VAL H 1 1 13 12094 1 1 47 VAL HA H -5.663 -1.335 0.625 1.00 . A A . 47 VAL HA 1 1 13 12095 1 1 47 VAL HB H -7.551 0.176 2.429 1.00 . A A . 47 VAL HB 1 1 13 12096 1 1 47 VAL HG11 H -4.563 -0.034 2.586 1.00 . A A . 47 VAL HG11 1 1 13 12097 1 1 47 VAL HG12 H -5.366 1.478 3.008 1.00 . A A . 47 VAL HG12 1 1 13 12098 1 1 47 VAL HG13 H -5.746 0.000 3.894 1.00 . A A . 47 VAL HG13 1 1 13 12099 1 1 47 VAL HG21 H -5.822 0.748 0.041 1.00 . A A . 47 VAL HG21 1 1 13 12100 1 1 47 VAL HG22 H -7.509 1.173 0.320 1.00 . A A . 47 VAL HG22 1 1 13 12101 1 1 47 VAL HG23 H -6.229 2.060 1.147 1.00 . A A . 47 VAL HG23 1 1 13 12102 1 1 47 VAL N N -7.708 -1.777 0.845 1.00 . A A . 47 VAL N 1 1 13 12103 1 1 47 VAL O O -4.875 -2.629 2.692 1.00 . A A . 47 VAL O 1 1 13 12104 1 1 48 GLU C C -6.274 -5.009 3.852 1.00 . A A . 48 GLU C 1 1 13 12105 1 1 48 GLU CA C -6.685 -3.646 4.421 1.00 . A A . 48 GLU CA 1 1 13 12106 1 1 48 GLU CB C -7.912 -3.819 5.309 1.00 . A A . 48 GLU CB 1 1 13 12107 1 1 48 GLU CD C -9.888 -5.222 4.783 1.00 . A A . 48 GLU CD 1 1 13 12108 1 1 48 GLU CG C -9.138 -3.930 4.451 1.00 . A A . 48 GLU CG 1 1 13 12109 1 1 48 GLU H H -7.908 -2.410 3.148 1.00 . A A . 48 GLU H 1 1 13 12110 1 1 48 GLU HA H -5.882 -3.245 5.009 1.00 . A A . 48 GLU HA 1 1 13 12111 1 1 48 GLU HB2 H -7.809 -4.708 5.910 1.00 . A A . 48 GLU HB2 1 1 13 12112 1 1 48 GLU HB3 H -8.029 -2.960 5.945 1.00 . A A . 48 GLU HB3 1 1 13 12113 1 1 48 GLU HG2 H -9.755 -3.080 4.659 1.00 . A A . 48 GLU HG2 1 1 13 12114 1 1 48 GLU HG3 H -8.859 -3.923 3.417 1.00 . A A . 48 GLU HG3 1 1 13 12115 1 1 48 GLU N N -6.988 -2.707 3.304 1.00 . A A . 48 GLU N 1 1 13 12116 1 1 48 GLU O O -5.192 -5.493 4.118 1.00 . A A . 48 GLU O 1 1 13 12117 1 1 48 GLU OE1 O -10.277 -5.378 5.930 1.00 . A A . 48 GLU OE1 1 1 13 12118 1 1 48 GLU OE2 O -10.059 -6.035 3.891 1.00 . A A . 48 GLU OE2 1 1 13 12119 1 1 49 GLU C C -5.313 -6.894 1.984 1.00 . A A . 49 GLU C 1 1 13 12120 1 1 49 GLU CA C -6.754 -6.960 2.491 1.00 . A A . 49 GLU CA 1 1 13 12121 1 1 49 GLU CB C -7.698 -7.291 1.334 1.00 . A A . 49 GLU CB 1 1 13 12122 1 1 49 GLU CD C -8.009 -8.791 -0.638 1.00 . A A . 49 GLU CD 1 1 13 12123 1 1 49 GLU CG C -7.296 -8.626 0.705 1.00 . A A . 49 GLU CG 1 1 13 12124 1 1 49 GLU H H -7.985 -5.239 2.856 1.00 . A A . 49 GLU H 1 1 13 12125 1 1 49 GLU HA H -6.835 -7.722 3.255 1.00 . A A . 49 GLU HA 1 1 13 12126 1 1 49 GLU HB2 H -8.710 -7.359 1.703 1.00 . A A . 49 GLU HB2 1 1 13 12127 1 1 49 GLU HB3 H -7.640 -6.513 0.587 1.00 . A A . 49 GLU HB3 1 1 13 12128 1 1 49 GLU HG2 H -6.226 -8.645 0.551 1.00 . A A . 49 GLU HG2 1 1 13 12129 1 1 49 GLU HG3 H -7.579 -9.434 1.363 1.00 . A A . 49 GLU HG3 1 1 13 12130 1 1 49 GLU N N -7.122 -5.636 3.067 1.00 . A A . 49 GLU N 1 1 13 12131 1 1 49 GLU O O -4.470 -7.694 2.354 1.00 . A A . 49 GLU O 1 1 13 12132 1 1 49 GLU OE1 O -9.229 -8.780 -0.643 1.00 . A A . 49 GLU OE1 1 1 13 12133 1 1 49 GLU OE2 O -7.324 -8.925 -1.639 1.00 . A A . 49 GLU OE2 1 1 13 12134 1 1 50 ALA C C -2.678 -5.741 1.834 1.00 . A A . 50 ALA C 1 1 13 12135 1 1 50 ALA CA C -3.628 -5.801 0.640 1.00 . A A . 50 ALA CA 1 1 13 12136 1 1 50 ALA CB C -3.501 -4.519 -0.187 1.00 . A A . 50 ALA CB 1 1 13 12137 1 1 50 ALA H H -5.704 -5.288 0.879 1.00 . A A . 50 ALA H 1 1 13 12138 1 1 50 ALA HA H -3.387 -6.656 0.024 1.00 . A A . 50 ALA HA 1 1 13 12139 1 1 50 ALA HB1 H -4.468 -4.253 -0.588 1.00 . A A . 50 ALA HB1 1 1 13 12140 1 1 50 ALA HB2 H -3.139 -3.720 0.443 1.00 . A A . 50 ALA HB2 1 1 13 12141 1 1 50 ALA HB3 H -2.806 -4.681 -0.998 1.00 . A A . 50 ALA HB3 1 1 13 12142 1 1 50 ALA N N -5.017 -5.931 1.152 1.00 . A A . 50 ALA N 1 1 13 12143 1 1 50 ALA O O -1.634 -6.364 1.846 1.00 . A A . 50 ALA O 1 1 13 12144 1 1 51 MET C C -2.031 -6.320 4.650 1.00 . A A . 51 MET C 1 1 13 12145 1 1 51 MET CA C -2.176 -4.920 4.055 1.00 . A A . 51 MET CA 1 1 13 12146 1 1 51 MET CB C -2.820 -3.981 5.081 1.00 . A A . 51 MET CB 1 1 13 12147 1 1 51 MET CE C -2.724 -1.571 6.922 1.00 . A A . 51 MET CE 1 1 13 12148 1 1 51 MET CG C -2.172 -4.186 6.454 1.00 . A A . 51 MET CG 1 1 13 12149 1 1 51 MET H H -3.895 -4.524 2.824 1.00 . A A . 51 MET H 1 1 13 12150 1 1 51 MET HA H -1.204 -4.543 3.776 1.00 . A A . 51 MET HA 1 1 13 12151 1 1 51 MET HB2 H -2.679 -2.957 4.768 1.00 . A A . 51 MET HB2 1 1 13 12152 1 1 51 MET HB3 H -3.877 -4.194 5.150 1.00 . A A . 51 MET HB3 1 1 13 12153 1 1 51 MET HE1 H -1.657 -1.430 6.807 1.00 . A A . 51 MET HE1 1 1 13 12154 1 1 51 MET HE2 H -3.195 -1.531 5.954 1.00 . A A . 51 MET HE2 1 1 13 12155 1 1 51 MET HE3 H -3.129 -0.789 7.550 1.00 . A A . 51 MET HE3 1 1 13 12156 1 1 51 MET HG2 H -2.239 -5.229 6.729 1.00 . A A . 51 MET HG2 1 1 13 12157 1 1 51 MET HG3 H -1.135 -3.890 6.411 1.00 . A A . 51 MET HG3 1 1 13 12158 1 1 51 MET N N -3.043 -5.007 2.850 1.00 . A A . 51 MET N 1 1 13 12159 1 1 51 MET O O -1.027 -6.654 5.245 1.00 . A A . 51 MET O 1 1 13 12160 1 1 51 MET SD S -3.038 -3.181 7.685 1.00 . A A . 51 MET SD 1 1 13 12161 1 1 52 ASP C C -1.814 -9.268 4.321 1.00 . A A . 52 ASP C 1 1 13 12162 1 1 52 ASP CA C -2.952 -8.528 5.023 1.00 . A A . 52 ASP CA 1 1 13 12163 1 1 52 ASP CB C -4.273 -9.255 4.765 1.00 . A A . 52 ASP CB 1 1 13 12164 1 1 52 ASP CG C -4.258 -10.606 5.481 1.00 . A A . 52 ASP CG 1 1 13 12165 1 1 52 ASP H H -3.827 -6.855 3.991 1.00 . A A . 52 ASP H 1 1 13 12166 1 1 52 ASP HA H -2.759 -8.490 6.085 1.00 . A A . 52 ASP HA 1 1 13 12167 1 1 52 ASP HB2 H -5.092 -8.657 5.139 1.00 . A A . 52 ASP HB2 1 1 13 12168 1 1 52 ASP HB3 H -4.397 -9.414 3.705 1.00 . A A . 52 ASP HB3 1 1 13 12169 1 1 52 ASP N N -3.030 -7.145 4.481 1.00 . A A . 52 ASP N 1 1 13 12170 1 1 52 ASP O O -1.155 -10.108 4.901 1.00 . A A . 52 ASP O 1 1 13 12171 1 1 52 ASP OD1 O -3.205 -11.221 5.524 1.00 . A A . 52 ASP OD1 1 1 13 12172 1 1 52 ASP OD2 O -5.300 -11.005 5.975 1.00 . A A . 52 ASP OD2 1 1 13 12173 1 1 53 THR C C 0.873 -9.030 2.772 1.00 . A A . 53 THR C 1 1 13 12174 1 1 53 THR CA C -0.470 -9.633 2.339 1.00 . A A . 53 THR CA 1 1 13 12175 1 1 53 THR CB C -0.670 -9.437 0.833 1.00 . A A . 53 THR CB 1 1 13 12176 1 1 53 THR CG2 C -1.993 -10.075 0.409 1.00 . A A . 53 THR CG2 1 1 13 12177 1 1 53 THR H H -2.113 -8.268 2.631 1.00 . A A . 53 THR H 1 1 13 12178 1 1 53 THR HA H -0.480 -10.688 2.569 1.00 . A A . 53 THR HA 1 1 13 12179 1 1 53 THR HB H 0.138 -9.908 0.296 1.00 . A A . 53 THR HB 1 1 13 12180 1 1 53 THR HG1 H -0.978 -7.942 -0.374 1.00 . A A . 53 THR HG1 1 1 13 12181 1 1 53 THR HG21 H -2.074 -11.058 0.849 1.00 . A A . 53 THR HG21 1 1 13 12182 1 1 53 THR HG22 H -2.815 -9.460 0.747 1.00 . A A . 53 THR HG22 1 1 13 12183 1 1 53 THR HG23 H -2.025 -10.158 -0.667 1.00 . A A . 53 THR HG23 1 1 13 12184 1 1 53 THR N N -1.573 -8.954 3.077 1.00 . A A . 53 THR N 1 1 13 12185 1 1 53 THR O O 1.000 -8.504 3.859 1.00 . A A . 53 THR O 1 1 13 12186 1 1 53 THR OG1 O -0.691 -8.047 0.535 1.00 . A A . 53 THR OG1 1 1 13 12187 1 1 54 CYS C C 3.771 -9.320 3.501 1.00 . A A . 54 CYS C 1 1 13 12188 1 1 54 CYS CA C 3.202 -8.538 2.315 1.00 . A A . 54 CYS CA 1 1 13 12189 1 1 54 CYS CB C 3.042 -7.065 2.703 1.00 . A A . 54 CYS CB 1 1 13 12190 1 1 54 CYS H H 1.757 -9.535 1.067 1.00 . A A . 54 CYS H 1 1 13 12191 1 1 54 CYS HA H 3.877 -8.618 1.476 1.00 . A A . 54 CYS HA 1 1 13 12192 1 1 54 CYS HB2 H 2.239 -6.625 2.136 1.00 . A A . 54 CYS HB2 1 1 13 12193 1 1 54 CYS HB3 H 2.814 -6.996 3.755 1.00 . A A . 54 CYS HB3 1 1 13 12194 1 1 54 CYS N N 1.875 -9.106 1.938 1.00 . A A . 54 CYS N 1 1 13 12195 1 1 54 CYS O O 3.050 -9.688 4.407 1.00 . A A . 54 CYS O 1 1 13 12196 1 1 54 CYS SG S 4.530 -6.037 2.410 1.00 . A A . 54 CYS SG 1 1 13 12197 1 1 55 PRO C C 5.808 -9.434 5.804 1.00 . A A . 55 PRO C 1 1 13 12198 1 1 55 PRO CA C 5.736 -10.295 4.540 1.00 . A A . 55 PRO CA 1 1 13 12199 1 1 55 PRO CB C 7.128 -10.571 3.973 1.00 . A A . 55 PRO CB 1 1 13 12200 1 1 55 PRO CD C 5.985 -9.130 2.396 1.00 . A A . 55 PRO CD 1 1 13 12201 1 1 55 PRO CG C 7.343 -9.504 2.943 1.00 . A A . 55 PRO CG 1 1 13 12202 1 1 55 PRO HA H 5.226 -11.223 4.740 1.00 . A A . 55 PRO HA 1 1 13 12203 1 1 55 PRO HB2 H 7.854 -10.522 4.775 1.00 . A A . 55 PRO HB2 1 1 13 12204 1 1 55 PRO HB3 H 7.146 -11.554 3.532 1.00 . A A . 55 PRO HB3 1 1 13 12205 1 1 55 PRO HD2 H 5.927 -8.062 2.230 1.00 . A A . 55 PRO HD2 1 1 13 12206 1 1 55 PRO HD3 H 5.782 -9.668 1.484 1.00 . A A . 55 PRO HD3 1 1 13 12207 1 1 55 PRO HG2 H 7.812 -8.644 3.401 1.00 . A A . 55 PRO HG2 1 1 13 12208 1 1 55 PRO HG3 H 7.963 -9.885 2.148 1.00 . A A . 55 PRO HG3 1 1 13 12209 1 1 55 PRO N N 5.055 -9.547 3.452 1.00 . A A . 55 PRO N 1 1 13 12210 1 1 55 PRO O O 4.945 -9.495 6.656 1.00 . A A . 55 PRO O 1 1 13 12211 1 1 56 VAL C C 5.746 -6.790 7.156 1.00 . A A . 56 VAL C 1 1 13 12212 1 1 56 VAL CA C 6.930 -7.758 7.134 1.00 . A A . 56 VAL CA 1 1 13 12213 1 1 56 VAL CB C 8.240 -6.968 7.081 1.00 . A A . 56 VAL CB 1 1 13 12214 1 1 56 VAL CG1 C 8.499 -6.315 8.441 1.00 . A A . 56 VAL CG1 1 1 13 12215 1 1 56 VAL CG2 C 9.393 -7.916 6.744 1.00 . A A . 56 VAL CG2 1 1 13 12216 1 1 56 VAL H H 7.507 -8.581 5.229 1.00 . A A . 56 VAL H 1 1 13 12217 1 1 56 VAL HA H 6.912 -8.371 8.023 1.00 . A A . 56 VAL HA 1 1 13 12218 1 1 56 VAL HB H 8.167 -6.203 6.324 1.00 . A A . 56 VAL HB 1 1 13 12219 1 1 56 VAL HG11 H 7.557 -6.069 8.907 1.00 . A A . 56 VAL HG11 1 1 13 12220 1 1 56 VAL HG12 H 9.044 -7.001 9.072 1.00 . A A . 56 VAL HG12 1 1 13 12221 1 1 56 VAL HG13 H 9.078 -5.415 8.303 1.00 . A A . 56 VAL HG13 1 1 13 12222 1 1 56 VAL HG21 H 9.064 -8.939 6.858 1.00 . A A . 56 VAL HG21 1 1 13 12223 1 1 56 VAL HG22 H 9.707 -7.752 5.724 1.00 . A A . 56 VAL HG22 1 1 13 12224 1 1 56 VAL HG23 H 10.221 -7.729 7.411 1.00 . A A . 56 VAL HG23 1 1 13 12225 1 1 56 VAL N N 6.823 -8.625 5.928 1.00 . A A . 56 VAL N 1 1 13 12226 1 1 56 VAL O O 5.479 -6.140 8.148 1.00 . A A . 56 VAL O 1 1 13 12227 1 1 57 GLN C C 4.323 -4.343 6.317 1.00 . A A . 57 GLN C 1 1 13 12228 1 1 57 GLN CA C 3.859 -5.769 6.020 1.00 . A A . 57 GLN CA 1 1 13 12229 1 1 57 GLN CB C 2.831 -6.198 7.071 1.00 . A A . 57 GLN CB 1 1 13 12230 1 1 57 GLN CD C 0.961 -7.855 7.026 1.00 . A A . 57 GLN CD 1 1 13 12231 1 1 57 GLN CG C 1.524 -6.588 6.380 1.00 . A A . 57 GLN CG 1 1 13 12232 1 1 57 GLN H H 5.260 -7.225 5.279 1.00 . A A . 57 GLN H 1 1 13 12233 1 1 57 GLN HA H 3.407 -5.806 5.037 1.00 . A A . 57 GLN HA 1 1 13 12234 1 1 57 GLN HB2 H 3.214 -7.045 7.622 1.00 . A A . 57 GLN HB2 1 1 13 12235 1 1 57 GLN HB3 H 2.647 -5.380 7.751 1.00 . A A . 57 GLN HB3 1 1 13 12236 1 1 57 GLN HE21 H 1.877 -9.081 5.761 1.00 . A A . 57 GLN HE21 1 1 13 12237 1 1 57 GLN HE22 H 0.927 -9.839 6.947 1.00 . A A . 57 GLN HE22 1 1 13 12238 1 1 57 GLN HG2 H 0.810 -5.783 6.480 1.00 . A A . 57 GLN HG2 1 1 13 12239 1 1 57 GLN HG3 H 1.711 -6.773 5.333 1.00 . A A . 57 GLN HG3 1 1 13 12240 1 1 57 GLN N N 5.029 -6.691 6.067 1.00 . A A . 57 GLN N 1 1 13 12241 1 1 57 GLN NE2 N 1.282 -9.022 6.537 1.00 . A A . 57 GLN NE2 1 1 13 12242 1 1 57 GLN O O 4.197 -3.856 7.423 1.00 . A A . 57 GLN O 1 1 13 12243 1 1 57 GLN OE1 O 0.222 -7.782 7.988 1.00 . A A . 57 GLN OE1 1 1 13 12244 1 1 58 CYS C C 4.159 -1.303 5.359 1.00 . A A . 58 CYS C 1 1 13 12245 1 1 58 CYS CA C 5.325 -2.271 5.565 1.00 . A A . 58 CYS CA 1 1 13 12246 1 1 58 CYS CB C 6.442 -1.939 4.573 1.00 . A A . 58 CYS CB 1 1 13 12247 1 1 58 CYS H H 4.948 -4.077 4.451 1.00 . A A . 58 CYS H 1 1 13 12248 1 1 58 CYS HA H 5.699 -2.177 6.574 1.00 . A A . 58 CYS HA 1 1 13 12249 1 1 58 CYS HB2 H 6.860 -0.972 4.812 1.00 . A A . 58 CYS HB2 1 1 13 12250 1 1 58 CYS HB3 H 7.215 -2.691 4.635 1.00 . A A . 58 CYS HB3 1 1 13 12251 1 1 58 CYS HG H 6.307 -1.312 2.368 1.00 . A A . 58 CYS HG 1 1 13 12252 1 1 58 CYS N N 4.856 -3.666 5.337 1.00 . A A . 58 CYS N 1 1 13 12253 1 1 58 CYS O O 4.348 -0.113 5.201 1.00 . A A . 58 CYS O 1 1 13 12254 1 1 58 CYS SG S 5.765 -1.905 2.894 1.00 . A A . 58 CYS SG 1 1 13 12255 1 1 59 ILE C C 1.037 -0.720 6.482 1.00 . A A . 59 ILE C 1 1 13 12256 1 1 59 ILE CA C 1.776 -0.911 5.155 1.00 . A A . 59 ILE CA 1 1 13 12257 1 1 59 ILE CB C 0.831 -1.538 4.130 1.00 . A A . 59 ILE CB 1 1 13 12258 1 1 59 ILE CD1 C -1.306 -1.223 2.874 1.00 . A A . 59 ILE CD1 1 1 13 12259 1 1 59 ILE CG1 C -0.311 -0.565 3.829 1.00 . A A . 59 ILE CG1 1 1 13 12260 1 1 59 ILE CG2 C 0.254 -2.838 4.692 1.00 . A A . 59 ILE CG2 1 1 13 12261 1 1 59 ILE H H 2.820 -2.765 5.482 1.00 . A A . 59 ILE H 1 1 13 12262 1 1 59 ILE HA H 2.111 0.048 4.793 1.00 . A A . 59 ILE HA 1 1 13 12263 1 1 59 ILE HB H 1.375 -1.750 3.221 1.00 . A A . 59 ILE HB 1 1 13 12264 1 1 59 ILE HD11 H -0.771 -1.664 2.046 1.00 . A A . 59 ILE HD11 1 1 13 12265 1 1 59 ILE HD12 H -1.853 -1.992 3.399 1.00 . A A . 59 ILE HD12 1 1 13 12266 1 1 59 ILE HD13 H -1.995 -0.480 2.502 1.00 . A A . 59 ILE HD13 1 1 13 12267 1 1 59 ILE HG12 H -0.813 -0.304 4.751 1.00 . A A . 59 ILE HG12 1 1 13 12268 1 1 59 ILE HG13 H 0.088 0.329 3.371 1.00 . A A . 59 ILE HG13 1 1 13 12269 1 1 59 ILE HG21 H 0.752 -3.081 5.618 1.00 . A A . 59 ILE HG21 1 1 13 12270 1 1 59 ILE HG22 H -0.804 -2.716 4.870 1.00 . A A . 59 ILE HG22 1 1 13 12271 1 1 59 ILE HG23 H 0.410 -3.636 3.980 1.00 . A A . 59 ILE HG23 1 1 13 12272 1 1 59 ILE N N 2.952 -1.802 5.356 1.00 . A A . 59 ILE N 1 1 13 12273 1 1 59 ILE O O 1.097 -1.552 7.365 1.00 . A A . 59 ILE O 1 1 13 12274 1 1 60 HIS C C -1.382 1.793 7.660 1.00 . A A . 60 HIS C 1 1 13 12275 1 1 60 HIS CA C -0.410 0.632 7.886 1.00 . A A . 60 HIS CA 1 1 13 12276 1 1 60 HIS CB C 0.569 0.995 9.013 1.00 . A A . 60 HIS CB 1 1 13 12277 1 1 60 HIS CD2 C 2.338 2.766 8.205 1.00 . A A . 60 HIS CD2 1 1 13 12278 1 1 60 HIS CE1 C 3.869 1.391 7.526 1.00 . A A . 60 HIS CE1 1 1 13 12279 1 1 60 HIS CG C 1.863 1.498 8.431 1.00 . A A . 60 HIS CG 1 1 13 12280 1 1 60 HIS H H 0.307 1.027 5.893 1.00 . A A . 60 HIS H 1 1 13 12281 1 1 60 HIS HA H -0.966 -0.251 8.162 1.00 . A A . 60 HIS HA 1 1 13 12282 1 1 60 HIS HB2 H 0.132 1.765 9.632 1.00 . A A . 60 HIS HB2 1 1 13 12283 1 1 60 HIS HB3 H 0.762 0.119 9.615 1.00 . A A . 60 HIS HB3 1 1 13 12284 1 1 60 HIS HD1 H 2.827 -0.342 8.013 1.00 . A A . 60 HIS HD1 1 1 13 12285 1 1 60 HIS HD2 H 1.808 3.679 8.434 1.00 . A A . 60 HIS HD2 1 1 13 12286 1 1 60 HIS HE1 H 4.784 0.990 7.115 1.00 . A A . 60 HIS HE1 1 1 13 12287 1 1 60 HIS N N 0.339 0.373 6.622 1.00 . A A . 60 HIS N 1 1 13 12288 1 1 60 HIS ND1 N 2.857 0.638 7.991 1.00 . A A . 60 HIS ND1 1 1 13 12289 1 1 60 HIS NE2 N 3.605 2.697 7.634 1.00 . A A . 60 HIS NE2 1 1 13 12290 1 1 60 HIS O O -1.526 2.286 6.558 1.00 . A A . 60 HIS O 1 1 13 12291 1 1 61 TRP C C -2.401 4.649 9.084 1.00 . A A . 61 TRP C 1 1 13 12292 1 1 61 TRP CA C -3.010 3.366 8.518 1.00 . A A . 61 TRP CA 1 1 13 12293 1 1 61 TRP CB C -4.320 3.050 9.245 1.00 . A A . 61 TRP CB 1 1 13 12294 1 1 61 TRP CD1 C -4.392 0.522 9.131 1.00 . A A . 61 TRP CD1 1 1 13 12295 1 1 61 TRP CD2 C -5.920 1.509 7.819 1.00 . A A . 61 TRP CD2 1 1 13 12296 1 1 61 TRP CE2 C -6.083 0.117 7.643 1.00 . A A . 61 TRP CE2 1 1 13 12297 1 1 61 TRP CE3 C -6.758 2.374 7.109 1.00 . A A . 61 TRP CE3 1 1 13 12298 1 1 61 TRP CG C -4.846 1.741 8.761 1.00 . A A . 61 TRP CG 1 1 13 12299 1 1 61 TRP CH2 C -7.884 0.478 6.077 1.00 . A A . 61 TRP CH2 1 1 13 12300 1 1 61 TRP CZ2 C -7.053 -0.400 6.782 1.00 . A A . 61 TRP CZ2 1 1 13 12301 1 1 61 TRP CZ3 C -7.737 1.863 6.240 1.00 . A A . 61 TRP CZ3 1 1 13 12302 1 1 61 TRP H H -1.925 1.829 9.572 1.00 . A A . 61 TRP H 1 1 13 12303 1 1 61 TRP HA H -3.214 3.503 7.466 1.00 . A A . 61 TRP HA 1 1 13 12304 1 1 61 TRP HB2 H -4.148 3.001 10.303 1.00 . A A . 61 TRP HB2 1 1 13 12305 1 1 61 TRP HB3 H -5.042 3.824 9.034 1.00 . A A . 61 TRP HB3 1 1 13 12306 1 1 61 TRP HD1 H -3.589 0.334 9.829 1.00 . A A . 61 TRP HD1 1 1 13 12307 1 1 61 TRP HE1 H -5.001 -1.414 8.555 1.00 . A A . 61 TRP HE1 1 1 13 12308 1 1 61 TRP HE3 H -6.647 3.441 7.238 1.00 . A A . 61 TRP HE3 1 1 13 12309 1 1 61 TRP HH2 H -8.636 0.088 5.408 1.00 . A A . 61 TRP HH2 1 1 13 12310 1 1 61 TRP HZ2 H -7.159 -1.468 6.661 1.00 . A A . 61 TRP HZ2 1 1 13 12311 1 1 61 TRP HZ3 H -8.378 2.541 5.695 1.00 . A A . 61 TRP HZ3 1 1 13 12312 1 1 61 TRP N N -2.052 2.237 8.689 1.00 . A A . 61 TRP N 1 1 13 12313 1 1 61 TRP NE1 N -5.126 -0.447 8.466 1.00 . A A . 61 TRP NE1 1 1 13 12314 1 1 61 TRP O O -1.541 4.615 9.941 1.00 . A A . 61 TRP O 1 1 13 12315 1 1 62 GLU C C -3.422 7.932 9.651 1.00 . A A . 62 GLU C 1 1 13 12316 1 1 62 GLU CA C -2.285 7.071 9.098 1.00 . A A . 62 GLU CA 1 1 13 12317 1 1 62 GLU CB C -1.605 7.806 7.940 1.00 . A A . 62 GLU CB 1 1 13 12318 1 1 62 GLU CD C -0.017 9.718 7.665 1.00 . A A . 62 GLU CD 1 1 13 12319 1 1 62 GLU CG C -1.300 9.247 8.355 1.00 . A A . 62 GLU CG 1 1 13 12320 1 1 62 GLU H H -3.526 5.779 7.909 1.00 . A A . 62 GLU H 1 1 13 12321 1 1 62 GLU HA H -1.563 6.880 9.878 1.00 . A A . 62 GLU HA 1 1 13 12322 1 1 62 GLU HB2 H -0.685 7.301 7.684 1.00 . A A . 62 GLU HB2 1 1 13 12323 1 1 62 GLU HB3 H -2.264 7.812 7.082 1.00 . A A . 62 GLU HB3 1 1 13 12324 1 1 62 GLU HG2 H -2.121 9.886 8.067 1.00 . A A . 62 GLU HG2 1 1 13 12325 1 1 62 GLU HG3 H -1.167 9.292 9.426 1.00 . A A . 62 GLU HG3 1 1 13 12326 1 1 62 GLU N N -2.837 5.779 8.602 1.00 . A A . 62 GLU N 1 1 13 12327 1 1 62 GLU O O -4.104 8.620 8.919 1.00 . A A . 62 GLU O 1 1 13 12328 1 1 62 GLU OE1 O -0.012 9.776 6.446 1.00 . A A . 62 GLU OE1 1 1 13 12329 1 1 62 GLU OE2 O 0.936 10.014 8.367 1.00 . A A . 62 GLU OE2 1 1 13 12330 1 1 63 ASP C C -4.323 10.198 11.508 1.00 . A A . 63 ASP C 1 1 13 12331 1 1 63 ASP CA C -4.725 8.722 11.531 1.00 . A A . 63 ASP CA 1 1 13 12332 1 1 63 ASP CB C -4.968 8.282 12.978 1.00 . A A . 63 ASP CB 1 1 13 12333 1 1 63 ASP CG C -6.433 7.881 13.149 1.00 . A A . 63 ASP CG 1 1 13 12334 1 1 63 ASP H H -3.071 7.341 11.515 1.00 . A A . 63 ASP H 1 1 13 12335 1 1 63 ASP HA H -5.629 8.586 10.957 1.00 . A A . 63 ASP HA 1 1 13 12336 1 1 63 ASP HB2 H -4.333 7.439 13.208 1.00 . A A . 63 ASP HB2 1 1 13 12337 1 1 63 ASP HB3 H -4.739 9.099 13.646 1.00 . A A . 63 ASP HB3 1 1 13 12338 1 1 63 ASP N N -3.632 7.902 10.938 1.00 . A A . 63 ASP N 1 1 13 12339 1 1 63 ASP O O -3.811 10.728 12.475 1.00 . A A . 63 ASP O 1 1 13 12340 1 1 63 ASP OD1 O -7.267 8.450 12.464 1.00 . A A . 63 ASP OD1 1 1 13 12341 1 1 63 ASP OD2 O -6.697 7.011 13.964 1.00 . A A . 63 ASP OD2 1 1 13 12342 1 1 64 GLU C C -2.698 12.473 10.686 1.00 . A A . 64 GLU C 1 1 13 12343 1 1 64 GLU CA C -4.177 12.307 10.328 1.00 . A A . 64 GLU CA 1 1 13 12344 1 1 64 GLU CB C -5.033 13.111 11.308 1.00 . A A . 64 GLU CB 1 1 13 12345 1 1 64 GLU CD C -6.570 13.964 9.530 1.00 . A A . 64 GLU CD 1 1 13 12346 1 1 64 GLU CG C -5.563 14.366 10.611 1.00 . A A . 64 GLU CG 1 1 13 12347 1 1 64 GLU H H -4.960 10.422 9.641 1.00 . A A . 64 GLU H 1 1 13 12348 1 1 64 GLU HA H -4.346 12.665 9.323 1.00 . A A . 64 GLU HA 1 1 13 12349 1 1 64 GLU HB2 H -5.863 12.504 11.639 1.00 . A A . 64 GLU HB2 1 1 13 12350 1 1 64 GLU HB3 H -4.434 13.399 12.158 1.00 . A A . 64 GLU HB3 1 1 13 12351 1 1 64 GLU HG2 H -6.049 15.002 11.338 1.00 . A A . 64 GLU HG2 1 1 13 12352 1 1 64 GLU HG3 H -4.743 14.899 10.156 1.00 . A A . 64 GLU HG3 1 1 13 12353 1 1 64 GLU N N -4.547 10.867 10.410 1.00 . A A . 64 GLU N 1 1 13 12354 1 1 64 GLU OE1 O -7.651 13.527 9.888 1.00 . A A . 64 GLU OE1 1 1 13 12355 1 1 64 GLU OE2 O -6.242 14.102 8.364 1.00 . A A . 64 GLU OE2 1 1 13 12356 2 2 1 SF4 FE1 FE 5.931 -4.571 -2.039 1.00 . B A . 65 SF4 FE1 1 1 13 12357 2 2 1 SF4 FE2 FE 4.514 -5.629 0.270 1.00 . B A . 65 SF4 FE2 1 1 13 12358 2 2 1 SF4 FE3 FE 3.343 -4.443 -2.024 1.00 . B A . 65 SF4 FE3 1 1 13 12359 2 2 1 SF4 FE4 FE 4.757 -7.058 -2.238 1.00 . B A . 65 SF4 FE4 1 1 13 12360 2 2 1 SF4 S1 S 2.764 -6.503 -0.775 1.00 . B A . 65 SF4 S1 1 1 13 12361 2 2 1 SF4 S2 S 4.765 -5.011 -3.615 1.00 . B A . 65 SF4 S2 1 1 13 12362 2 2 1 SF4 S3 S 6.435 -6.660 -0.846 1.00 . B A . 65 SF4 S3 1 1 13 12363 2 2 1 SF4 S4 S 4.702 -3.319 -0.693 1.00 . B A . 65 SF4 S4 1 1 14 12364 1 1 1 ALA C C -7.746 10.790 9.582 1.00 . A A . 1 ALA C 1 1 14 12365 1 1 1 ALA CA C -8.599 12.056 9.679 1.00 . A A . 1 ALA CA 1 1 14 12366 1 1 1 ALA CB C -8.413 12.895 8.414 1.00 . A A . 1 ALA CB 1 1 14 12367 1 1 1 ALA HA H -9.639 11.782 9.780 1.00 . A A . 1 ALA HA 1 1 14 12368 1 1 1 ALA HB1 H -7.376 13.186 8.323 1.00 . A A . 1 ALA HB1 1 1 14 12369 1 1 1 ALA HB2 H -8.701 12.316 7.550 1.00 . A A . 1 ALA HB2 1 1 14 12370 1 1 1 ALA HB3 H -9.030 13.780 8.474 1.00 . A A . 1 ALA HB3 1 1 14 12371 1 1 1 ALA N N -8.175 12.849 10.867 1.00 . A A . 1 ALA N 1 1 14 12372 1 1 1 ALA O O -6.605 10.830 9.165 1.00 . A A . 1 ALA O 1 1 14 12373 1 1 2 ARG C C -6.906 8.249 8.498 1.00 . A A . 2 ARG C 1 1 14 12374 1 1 2 ARG CA C -7.503 8.402 9.897 1.00 . A A . 2 ARG CA 1 1 14 12375 1 1 2 ARG CB C -8.420 7.213 10.193 1.00 . A A . 2 ARG CB 1 1 14 12376 1 1 2 ARG CD C -10.492 6.020 9.468 1.00 . A A . 2 ARG CD 1 1 14 12377 1 1 2 ARG CG C -9.680 7.308 9.330 1.00 . A A . 2 ARG CG 1 1 14 12378 1 1 2 ARG CZ C -12.538 6.056 8.176 1.00 . A A . 2 ARG CZ 1 1 14 12379 1 1 2 ARG H H -9.208 9.655 10.300 1.00 . A A . 2 ARG H 1 1 14 12380 1 1 2 ARG HA H -6.707 8.433 10.626 1.00 . A A . 2 ARG HA 1 1 14 12381 1 1 2 ARG HB2 H -7.900 6.293 9.971 1.00 . A A . 2 ARG HB2 1 1 14 12382 1 1 2 ARG HB3 H -8.700 7.226 11.236 1.00 . A A . 2 ARG HB3 1 1 14 12383 1 1 2 ARG HD2 H -10.185 5.317 8.707 1.00 . A A . 2 ARG HD2 1 1 14 12384 1 1 2 ARG HD3 H -10.322 5.589 10.444 1.00 . A A . 2 ARG HD3 1 1 14 12385 1 1 2 ARG HE H -12.444 6.725 10.043 1.00 . A A . 2 ARG HE 1 1 14 12386 1 1 2 ARG HG2 H -10.277 8.149 9.656 1.00 . A A . 2 ARG HG2 1 1 14 12387 1 1 2 ARG HG3 H -9.400 7.445 8.297 1.00 . A A . 2 ARG HG3 1 1 14 12388 1 1 2 ARG HH11 H -11.178 7.006 7.055 1.00 . A A . 2 ARG HH11 1 1 14 12389 1 1 2 ARG HH12 H -12.485 6.272 6.186 1.00 . A A . 2 ARG HH12 1 1 14 12390 1 1 2 ARG HH21 H -14.034 5.038 9.033 1.00 . A A . 2 ARG HH21 1 1 14 12391 1 1 2 ARG HH22 H -14.103 5.160 7.307 1.00 . A A . 2 ARG HH22 1 1 14 12392 1 1 2 ARG N N -8.287 9.666 9.966 1.00 . A A . 2 ARG N 1 1 14 12393 1 1 2 ARG NE N -11.941 6.324 9.304 1.00 . A A . 2 ARG NE 1 1 14 12394 1 1 2 ARG NH1 N -12.028 6.478 7.051 1.00 . A A . 2 ARG NH1 1 1 14 12395 1 1 2 ARG NH2 N -13.645 5.364 8.171 1.00 . A A . 2 ARG NH2 1 1 14 12396 1 1 2 ARG O O -7.613 8.206 7.511 1.00 . A A . 2 ARG O 1 1 14 12397 1 1 3 LYS C C -4.116 6.750 7.051 1.00 . A A . 3 LYS C 1 1 14 12398 1 1 3 LYS CA C -4.970 8.018 7.068 1.00 . A A . 3 LYS CA 1 1 14 12399 1 1 3 LYS CB C -4.097 9.241 6.786 1.00 . A A . 3 LYS CB 1 1 14 12400 1 1 3 LYS CD C -2.975 9.912 4.657 1.00 . A A . 3 LYS CD 1 1 14 12401 1 1 3 LYS CE C -2.853 8.944 3.479 1.00 . A A . 3 LYS CE 1 1 14 12402 1 1 3 LYS CG C -4.325 9.709 5.348 1.00 . A A . 3 LYS CG 1 1 14 12403 1 1 3 LYS H H -5.052 8.206 9.207 1.00 . A A . 3 LYS H 1 1 14 12404 1 1 3 LYS HA H -5.730 7.940 6.309 1.00 . A A . 3 LYS HA 1 1 14 12405 1 1 3 LYS HB2 H -4.359 10.034 7.471 1.00 . A A . 3 LYS HB2 1 1 14 12406 1 1 3 LYS HB3 H -3.062 8.980 6.917 1.00 . A A . 3 LYS HB3 1 1 14 12407 1 1 3 LYS HD2 H -2.903 10.929 4.298 1.00 . A A . 3 LYS HD2 1 1 14 12408 1 1 3 LYS HD3 H -2.178 9.722 5.361 1.00 . A A . 3 LYS HD3 1 1 14 12409 1 1 3 LYS HE2 H -1.846 8.558 3.433 1.00 . A A . 3 LYS HE2 1 1 14 12410 1 1 3 LYS HE3 H -3.546 8.126 3.612 1.00 . A A . 3 LYS HE3 1 1 14 12411 1 1 3 LYS HG2 H -4.896 8.965 4.812 1.00 . A A . 3 LYS HG2 1 1 14 12412 1 1 3 LYS HG3 H -4.867 10.644 5.354 1.00 . A A . 3 LYS HG3 1 1 14 12413 1 1 3 LYS HZ1 H -4.124 10.069 2.270 1.00 . A A . 3 LYS HZ1 1 1 14 12414 1 1 3 LYS HZ2 H -2.479 10.426 2.066 1.00 . A A . 3 LYS HZ2 1 1 14 12415 1 1 3 LYS HZ3 H -3.123 8.994 1.415 1.00 . A A . 3 LYS HZ3 1 1 14 12416 1 1 3 LYS N N -5.608 8.167 8.402 1.00 . A A . 3 LYS N 1 1 14 12417 1 1 3 LYS NZ N -3.168 9.663 2.213 1.00 . A A . 3 LYS NZ 1 1 14 12418 1 1 3 LYS O O -4.405 5.788 7.733 1.00 . A A . 3 LYS O 1 1 14 12419 1 1 4 PHE C C -1.221 5.702 5.020 1.00 . A A . 4 PHE C 1 1 14 12420 1 1 4 PHE CA C -2.189 5.548 6.196 1.00 . A A . 4 PHE CA 1 1 14 12421 1 1 4 PHE CB C -3.039 4.293 5.975 1.00 . A A . 4 PHE CB 1 1 14 12422 1 1 4 PHE CD1 C -3.457 4.374 3.491 1.00 . A A . 4 PHE CD1 1 1 14 12423 1 1 4 PHE CD2 C -5.302 4.825 4.998 1.00 . A A . 4 PHE CD2 1 1 14 12424 1 1 4 PHE CE1 C -4.305 4.566 2.394 1.00 . A A . 4 PHE CE1 1 1 14 12425 1 1 4 PHE CE2 C -6.151 5.016 3.901 1.00 . A A . 4 PHE CE2 1 1 14 12426 1 1 4 PHE CG C -3.956 4.503 4.792 1.00 . A A . 4 PHE CG 1 1 14 12427 1 1 4 PHE CZ C -5.652 4.887 2.599 1.00 . A A . 4 PHE CZ 1 1 14 12428 1 1 4 PHE H H -2.865 7.531 5.745 1.00 . A A . 4 PHE H 1 1 14 12429 1 1 4 PHE HA H -1.628 5.451 7.112 1.00 . A A . 4 PHE HA 1 1 14 12430 1 1 4 PHE HB2 H -2.391 3.451 5.779 1.00 . A A . 4 PHE HB2 1 1 14 12431 1 1 4 PHE HB3 H -3.629 4.093 6.855 1.00 . A A . 4 PHE HB3 1 1 14 12432 1 1 4 PHE HD1 H -2.417 4.126 3.333 1.00 . A A . 4 PHE HD1 1 1 14 12433 1 1 4 PHE HD2 H -5.686 4.924 6.002 1.00 . A A . 4 PHE HD2 1 1 14 12434 1 1 4 PHE HE1 H -3.920 4.466 1.389 1.00 . A A . 4 PHE HE1 1 1 14 12435 1 1 4 PHE HE2 H -7.190 5.265 4.059 1.00 . A A . 4 PHE HE2 1 1 14 12436 1 1 4 PHE HZ H -6.307 5.036 1.753 1.00 . A A . 4 PHE HZ 1 1 14 12437 1 1 4 PHE N N -3.070 6.745 6.276 1.00 . A A . 4 PHE N 1 1 14 12438 1 1 4 PHE O O -1.241 6.688 4.310 1.00 . A A . 4 PHE O 1 1 14 12439 1 1 5 TYR C C 1.429 3.543 3.774 1.00 . A A . 5 TYR C 1 1 14 12440 1 1 5 TYR CA C 0.576 4.781 3.677 1.00 . A A . 5 TYR CA 1 1 14 12441 1 1 5 TYR CB C 1.470 6.016 3.771 1.00 . A A . 5 TYR CB 1 1 14 12442 1 1 5 TYR CD1 C 1.461 6.572 6.232 1.00 . A A . 5 TYR CD1 1 1 14 12443 1 1 5 TYR CD2 C 3.454 5.589 5.261 1.00 . A A . 5 TYR CD2 1 1 14 12444 1 1 5 TYR CE1 C 2.092 6.614 7.482 1.00 . A A . 5 TYR CE1 1 1 14 12445 1 1 5 TYR CE2 C 4.083 5.629 6.511 1.00 . A A . 5 TYR CE2 1 1 14 12446 1 1 5 TYR CG C 2.143 6.060 5.122 1.00 . A A . 5 TYR CG 1 1 14 12447 1 1 5 TYR CZ C 3.403 6.142 7.621 1.00 . A A . 5 TYR CZ 1 1 14 12448 1 1 5 TYR H H -0.393 3.927 5.384 1.00 . A A . 5 TYR H 1 1 14 12449 1 1 5 TYR HA H 0.040 4.783 2.739 1.00 . A A . 5 TYR HA 1 1 14 12450 1 1 5 TYR HB2 H 2.223 5.968 2.998 1.00 . A A . 5 TYR HB2 1 1 14 12451 1 1 5 TYR HB3 H 0.877 6.898 3.632 1.00 . A A . 5 TYR HB3 1 1 14 12452 1 1 5 TYR HD1 H 0.450 6.936 6.125 1.00 . A A . 5 TYR HD1 1 1 14 12453 1 1 5 TYR HD2 H 3.980 5.193 4.406 1.00 . A A . 5 TYR HD2 1 1 14 12454 1 1 5 TYR HE1 H 1.566 7.009 8.338 1.00 . A A . 5 TYR HE1 1 1 14 12455 1 1 5 TYR HE2 H 5.094 5.266 6.619 1.00 . A A . 5 TYR HE2 1 1 14 12456 1 1 5 TYR HH H 3.802 5.378 9.324 1.00 . A A . 5 TYR HH 1 1 14 12457 1 1 5 TYR N N -0.385 4.725 4.803 1.00 . A A . 5 TYR N 1 1 14 12458 1 1 5 TYR O O 1.204 2.697 4.617 1.00 . A A . 5 TYR O 1 1 14 12459 1 1 5 TYR OH O 4.023 6.183 8.853 1.00 . A A . 5 TYR OH 1 1 14 12460 1 1 6 VAL C C 4.694 2.494 3.054 1.00 . A A . 6 VAL C 1 1 14 12461 1 1 6 VAL CA C 3.217 2.176 3.053 1.00 . A A . 6 VAL CA 1 1 14 12462 1 1 6 VAL CB C 2.938 1.235 1.896 1.00 . A A . 6 VAL CB 1 1 14 12463 1 1 6 VAL CG1 C 3.022 -0.186 2.428 1.00 . A A . 6 VAL CG1 1 1 14 12464 1 1 6 VAL CG2 C 1.538 1.482 1.319 1.00 . A A . 6 VAL CG2 1 1 14 12465 1 1 6 VAL H H 2.588 4.078 2.252 1.00 . A A . 6 VAL H 1 1 14 12466 1 1 6 VAL HA H 2.967 1.673 3.976 1.00 . A A . 6 VAL HA 1 1 14 12467 1 1 6 VAL HB H 3.693 1.383 1.127 1.00 . A A . 6 VAL HB 1 1 14 12468 1 1 6 VAL HG11 H 2.985 -0.160 3.507 1.00 . A A . 6 VAL HG11 1 1 14 12469 1 1 6 VAL HG12 H 2.190 -0.759 2.052 1.00 . A A . 6 VAL HG12 1 1 14 12470 1 1 6 VAL HG13 H 3.949 -0.634 2.109 1.00 . A A . 6 VAL HG13 1 1 14 12471 1 1 6 VAL HG21 H 0.982 2.137 1.970 1.00 . A A . 6 VAL HG21 1 1 14 12472 1 1 6 VAL HG22 H 1.624 1.934 0.343 1.00 . A A . 6 VAL HG22 1 1 14 12473 1 1 6 VAL HG23 H 1.017 0.540 1.233 1.00 . A A . 6 VAL HG23 1 1 14 12474 1 1 6 VAL N N 2.403 3.400 2.941 1.00 . A A . 6 VAL N 1 1 14 12475 1 1 6 VAL O O 5.119 3.595 2.766 1.00 . A A . 6 VAL O 1 1 14 12476 1 1 7 ASP C C 7.512 0.954 2.183 1.00 . A A . 7 ASP C 1 1 14 12477 1 1 7 ASP CA C 6.937 1.695 3.358 1.00 . A A . 7 ASP CA 1 1 14 12478 1 1 7 ASP CB C 7.531 1.166 4.656 1.00 . A A . 7 ASP CB 1 1 14 12479 1 1 7 ASP CG C 8.839 1.898 4.958 1.00 . A A . 7 ASP CG 1 1 14 12480 1 1 7 ASP H H 5.099 0.628 3.563 1.00 . A A . 7 ASP H 1 1 14 12481 1 1 7 ASP HA H 7.167 2.733 3.249 1.00 . A A . 7 ASP HA 1 1 14 12482 1 1 7 ASP HB2 H 6.830 1.336 5.452 1.00 . A A . 7 ASP HB2 1 1 14 12483 1 1 7 ASP HB3 H 7.723 0.107 4.561 1.00 . A A . 7 ASP HB3 1 1 14 12484 1 1 7 ASP N N 5.479 1.507 3.355 1.00 . A A . 7 ASP N 1 1 14 12485 1 1 7 ASP O O 7.870 -0.203 2.272 1.00 . A A . 7 ASP O 1 1 14 12486 1 1 7 ASP OD1 O 8.904 3.088 4.692 1.00 . A A . 7 ASP OD1 1 1 14 12487 1 1 7 ASP OD2 O 9.753 1.257 5.451 1.00 . A A . 7 ASP OD2 1 1 14 12488 1 1 8 GLN C C 9.638 0.654 0.057 1.00 . A A . 8 GLN C 1 1 14 12489 1 1 8 GLN CA C 8.162 0.986 -0.147 1.00 . A A . 8 GLN CA 1 1 14 12490 1 1 8 GLN CB C 8.057 1.943 -1.313 1.00 . A A . 8 GLN CB 1 1 14 12491 1 1 8 GLN CD C 6.336 3.669 -0.763 1.00 . A A . 8 GLN CD 1 1 14 12492 1 1 8 GLN CG C 6.603 2.366 -1.518 1.00 . A A . 8 GLN CG 1 1 14 12493 1 1 8 GLN H H 7.287 2.545 1.055 1.00 . A A . 8 GLN H 1 1 14 12494 1 1 8 GLN HA H 7.615 0.081 -0.371 1.00 . A A . 8 GLN HA 1 1 14 12495 1 1 8 GLN HB2 H 8.666 2.815 -1.121 1.00 . A A . 8 GLN HB2 1 1 14 12496 1 1 8 GLN HB3 H 8.417 1.439 -2.185 1.00 . A A . 8 GLN HB3 1 1 14 12497 1 1 8 GLN HE21 H 4.822 2.918 0.279 1.00 . A A . 8 GLN HE21 1 1 14 12498 1 1 8 GLN HE22 H 5.190 4.543 0.602 1.00 . A A . 8 GLN HE22 1 1 14 12499 1 1 8 GLN HG2 H 6.419 2.516 -2.571 1.00 . A A . 8 GLN HG2 1 1 14 12500 1 1 8 GLN HG3 H 5.948 1.595 -1.144 1.00 . A A . 8 GLN HG3 1 1 14 12501 1 1 8 GLN N N 7.601 1.620 1.078 1.00 . A A . 8 GLN N 1 1 14 12502 1 1 8 GLN NE2 N 5.369 3.714 0.111 1.00 . A A . 8 GLN NE2 1 1 14 12503 1 1 8 GLN O O 10.471 0.909 -0.791 1.00 . A A . 8 GLN O 1 1 14 12504 1 1 8 GLN OE1 O 7.014 4.655 -0.971 1.00 . A A . 8 GLN OE1 1 1 14 12505 1 1 9 ASP C C 11.471 -1.818 1.486 1.00 . A A . 9 ASP C 1 1 14 12506 1 1 9 ASP CA C 11.372 -0.295 1.445 1.00 . A A . 9 ASP CA 1 1 14 12507 1 1 9 ASP CB C 11.800 0.284 2.795 1.00 . A A . 9 ASP CB 1 1 14 12508 1 1 9 ASP CG C 12.726 1.480 2.565 1.00 . A A . 9 ASP CG 1 1 14 12509 1 1 9 ASP H H 9.260 -0.118 1.809 1.00 . A A . 9 ASP H 1 1 14 12510 1 1 9 ASP HA H 12.012 0.089 0.664 1.00 . A A . 9 ASP HA 1 1 14 12511 1 1 9 ASP HB2 H 10.925 0.605 3.342 1.00 . A A . 9 ASP HB2 1 1 14 12512 1 1 9 ASP HB3 H 12.324 -0.470 3.363 1.00 . A A . 9 ASP HB3 1 1 14 12513 1 1 9 ASP N N 9.959 0.079 1.163 1.00 . A A . 9 ASP N 1 1 14 12514 1 1 9 ASP O O 12.364 -2.413 0.917 1.00 . A A . 9 ASP O 1 1 14 12515 1 1 9 ASP OD1 O 12.345 2.362 1.813 1.00 . A A . 9 ASP OD1 1 1 14 12516 1 1 9 ASP OD2 O 13.798 1.495 3.146 1.00 . A A . 9 ASP OD2 1 1 14 12517 1 1 10 GLU C C 9.722 -4.486 1.060 1.00 . A A . 10 GLU C 1 1 14 12518 1 1 10 GLU CA C 10.556 -3.936 2.216 1.00 . A A . 10 GLU CA 1 1 14 12519 1 1 10 GLU CB C 9.943 -4.392 3.544 1.00 . A A . 10 GLU CB 1 1 14 12520 1 1 10 GLU CD C 11.552 -6.299 3.652 1.00 . A A . 10 GLU CD 1 1 14 12521 1 1 10 GLU CG C 11.014 -5.076 4.396 1.00 . A A . 10 GLU CG 1 1 14 12522 1 1 10 GLU H H 9.826 -1.949 2.585 1.00 . A A . 10 GLU H 1 1 14 12523 1 1 10 GLU HA H 11.571 -4.297 2.139 1.00 . A A . 10 GLU HA 1 1 14 12524 1 1 10 GLU HB2 H 9.554 -3.535 4.074 1.00 . A A . 10 GLU HB2 1 1 14 12525 1 1 10 GLU HB3 H 9.142 -5.089 3.350 1.00 . A A . 10 GLU HB3 1 1 14 12526 1 1 10 GLU HG2 H 11.822 -4.382 4.584 1.00 . A A . 10 GLU HG2 1 1 14 12527 1 1 10 GLU HG3 H 10.582 -5.389 5.335 1.00 . A A . 10 GLU HG3 1 1 14 12528 1 1 10 GLU N N 10.542 -2.452 2.146 1.00 . A A . 10 GLU N 1 1 14 12529 1 1 10 GLU O O 9.299 -5.625 1.072 1.00 . A A . 10 GLU O 1 1 14 12530 1 1 10 GLU OE1 O 11.230 -6.447 2.485 1.00 . A A . 10 GLU OE1 1 1 14 12531 1 1 10 GLU OE2 O 12.275 -7.069 4.262 1.00 . A A . 10 GLU OE2 1 1 14 12532 1 1 11 CYS C C 9.512 -4.909 -2.081 1.00 . A A . 11 CYS C 1 1 14 12533 1 1 11 CYS CA C 8.644 -4.147 -1.081 1.00 . A A . 11 CYS CA 1 1 14 12534 1 1 11 CYS CB C 7.986 -2.950 -1.773 1.00 . A A . 11 CYS CB 1 1 14 12535 1 1 11 CYS H H 9.806 -2.755 0.082 1.00 . A A . 11 CYS H 1 1 14 12536 1 1 11 CYS HA H 7.873 -4.806 -0.712 1.00 . A A . 11 CYS HA 1 1 14 12537 1 1 11 CYS HB2 H 7.296 -2.469 -1.096 1.00 . A A . 11 CYS HB2 1 1 14 12538 1 1 11 CYS HB3 H 8.745 -2.245 -2.080 1.00 . A A . 11 CYS HB3 1 1 14 12539 1 1 11 CYS N N 9.467 -3.676 0.066 1.00 . A A . 11 CYS N 1 1 14 12540 1 1 11 CYS O O 10.356 -4.344 -2.749 1.00 . A A . 11 CYS O 1 1 14 12541 1 1 11 CYS SG S 7.085 -3.434 -3.287 1.00 . A A . 11 CYS SG 1 1 14 12542 1 1 12 ILE C C 9.540 -6.779 -4.574 1.00 . A A . 12 ILE C 1 1 14 12543 1 1 12 ILE CA C 10.094 -6.998 -3.162 1.00 . A A . 12 ILE CA 1 1 14 12544 1 1 12 ILE CB C 9.998 -8.481 -2.795 1.00 . A A . 12 ILE CB 1 1 14 12545 1 1 12 ILE CD1 C 8.443 -10.406 -2.455 1.00 . A A . 12 ILE CD1 1 1 14 12546 1 1 12 ILE CG1 C 8.530 -8.915 -2.790 1.00 . A A . 12 ILE CG1 1 1 14 12547 1 1 12 ILE CG2 C 10.595 -8.702 -1.404 1.00 . A A . 12 ILE CG2 1 1 14 12548 1 1 12 ILE H H 8.605 -6.623 -1.653 1.00 . A A . 12 ILE H 1 1 14 12549 1 1 12 ILE HA H 11.126 -6.683 -3.128 1.00 . A A . 12 ILE HA 1 1 14 12550 1 1 12 ILE HB H 10.546 -9.066 -3.519 1.00 . A A . 12 ILE HB 1 1 14 12551 1 1 12 ILE HD11 H 9.170 -10.647 -1.694 1.00 . A A . 12 ILE HD11 1 1 14 12552 1 1 12 ILE HD12 H 7.452 -10.636 -2.091 1.00 . A A . 12 ILE HD12 1 1 14 12553 1 1 12 ILE HD13 H 8.645 -10.986 -3.343 1.00 . A A . 12 ILE HD13 1 1 14 12554 1 1 12 ILE HG12 H 7.989 -8.346 -2.048 1.00 . A A . 12 ILE HG12 1 1 14 12555 1 1 12 ILE HG13 H 8.099 -8.741 -3.763 1.00 . A A . 12 ILE HG13 1 1 14 12556 1 1 12 ILE HG21 H 10.675 -7.754 -0.891 1.00 . A A . 12 ILE HG21 1 1 14 12557 1 1 12 ILE HG22 H 9.954 -9.363 -0.839 1.00 . A A . 12 ILE HG22 1 1 14 12558 1 1 12 ILE HG23 H 11.576 -9.144 -1.499 1.00 . A A . 12 ILE HG23 1 1 14 12559 1 1 12 ILE N N 9.297 -6.192 -2.197 1.00 . A A . 12 ILE N 1 1 14 12560 1 1 12 ILE O O 10.029 -7.337 -5.535 1.00 . A A . 12 ILE O 1 1 14 12561 1 1 13 ALA C C 7.027 -6.844 -6.468 1.00 . A A . 13 ALA C 1 1 14 12562 1 1 13 ALA CA C 7.941 -5.691 -6.046 1.00 . A A . 13 ALA CA 1 1 14 12563 1 1 13 ALA CB C 9.065 -5.531 -7.072 1.00 . A A . 13 ALA CB 1 1 14 12564 1 1 13 ALA H H 8.153 -5.518 -3.913 1.00 . A A . 13 ALA H 1 1 14 12565 1 1 13 ALA HA H 7.365 -4.778 -6.005 1.00 . A A . 13 ALA HA 1 1 14 12566 1 1 13 ALA HB1 H 9.953 -5.164 -6.579 1.00 . A A . 13 ALA HB1 1 1 14 12567 1 1 13 ALA HB2 H 9.275 -6.488 -7.526 1.00 . A A . 13 ALA HB2 1 1 14 12568 1 1 13 ALA HB3 H 8.760 -4.830 -7.835 1.00 . A A . 13 ALA HB3 1 1 14 12569 1 1 13 ALA N N 8.527 -5.961 -4.702 1.00 . A A . 13 ALA N 1 1 14 12570 1 1 13 ALA O O 7.140 -7.364 -7.561 1.00 . A A . 13 ALA O 1 1 14 12571 1 1 14 CYS C C 3.811 -7.788 -6.332 1.00 . A A . 14 CYS C 1 1 14 12572 1 1 14 CYS CA C 5.195 -8.357 -6.014 1.00 . A A . 14 CYS CA 1 1 14 12573 1 1 14 CYS CB C 5.082 -9.381 -4.881 1.00 . A A . 14 CYS CB 1 1 14 12574 1 1 14 CYS H H 6.021 -6.813 -4.750 1.00 . A A . 14 CYS H 1 1 14 12575 1 1 14 CYS HA H 5.586 -8.844 -6.895 1.00 . A A . 14 CYS HA 1 1 14 12576 1 1 14 CYS HB2 H 4.785 -10.334 -5.292 1.00 . A A . 14 CYS HB2 1 1 14 12577 1 1 14 CYS HB3 H 6.043 -9.486 -4.401 1.00 . A A . 14 CYS HB3 1 1 14 12578 1 1 14 CYS N N 6.111 -7.246 -5.625 1.00 . A A . 14 CYS N 1 1 14 12579 1 1 14 CYS O O 3.481 -6.681 -5.955 1.00 . A A . 14 CYS O 1 1 14 12580 1 1 14 CYS SG S 3.889 -9.015 -3.541 1.00 . A A . 14 CYS SG 1 1 14 12581 1 1 15 GLU C C 0.654 -8.389 -6.269 1.00 . A A . 15 GLU C 1 1 14 12582 1 1 15 GLU CA C 1.641 -8.038 -7.385 1.00 . A A . 15 GLU CA 1 1 14 12583 1 1 15 GLU CB C 1.186 -8.693 -8.689 1.00 . A A . 15 GLU CB 1 1 14 12584 1 1 15 GLU CD C 1.434 -8.677 -11.177 1.00 . A A . 15 GLU CD 1 1 14 12585 1 1 15 GLU CG C 1.831 -7.975 -9.876 1.00 . A A . 15 GLU CG 1 1 14 12586 1 1 15 GLU H H 3.290 -9.423 -7.331 1.00 . A A . 15 GLU H 1 1 14 12587 1 1 15 GLU HA H 1.673 -6.966 -7.514 1.00 . A A . 15 GLU HA 1 1 14 12588 1 1 15 GLU HB2 H 1.484 -9.731 -8.692 1.00 . A A . 15 GLU HB2 1 1 14 12589 1 1 15 GLU HB3 H 0.112 -8.626 -8.771 1.00 . A A . 15 GLU HB3 1 1 14 12590 1 1 15 GLU HG2 H 1.492 -6.948 -9.903 1.00 . A A . 15 GLU HG2 1 1 14 12591 1 1 15 GLU HG3 H 2.904 -7.997 -9.771 1.00 . A A . 15 GLU HG3 1 1 14 12592 1 1 15 GLU N N 3.001 -8.535 -7.032 1.00 . A A . 15 GLU N 1 1 14 12593 1 1 15 GLU O O -0.544 -8.387 -6.466 1.00 . A A . 15 GLU O 1 1 14 12594 1 1 15 GLU OE1 O 1.320 -9.891 -11.159 1.00 . A A . 15 GLU OE1 1 1 14 12595 1 1 15 GLU OE2 O 1.251 -7.988 -12.167 1.00 . A A . 15 GLU OE2 1 1 14 12596 1 1 16 SER C C -0.694 -7.858 -3.678 1.00 . A A . 16 SER C 1 1 14 12597 1 1 16 SER CA C 0.232 -9.041 -3.977 1.00 . A A . 16 SER CA 1 1 14 12598 1 1 16 SER CB C 1.060 -9.370 -2.733 1.00 . A A . 16 SER CB 1 1 14 12599 1 1 16 SER H H 2.116 -8.687 -4.961 1.00 . A A . 16 SER H 1 1 14 12600 1 1 16 SER HA H -0.361 -9.901 -4.251 1.00 . A A . 16 SER HA 1 1 14 12601 1 1 16 SER HB2 H 0.405 -9.529 -1.893 1.00 . A A . 16 SER HB2 1 1 14 12602 1 1 16 SER HB3 H 1.637 -10.267 -2.913 1.00 . A A . 16 SER HB3 1 1 14 12603 1 1 16 SER HG H 2.552 -8.569 -1.774 1.00 . A A . 16 SER HG 1 1 14 12604 1 1 16 SER N N 1.146 -8.690 -5.100 1.00 . A A . 16 SER N 1 1 14 12605 1 1 16 SER O O -1.761 -7.731 -4.245 1.00 . A A . 16 SER O 1 1 14 12606 1 1 16 SER OG O 1.931 -8.282 -2.446 1.00 . A A . 16 SER OG 1 1 14 12607 1 1 17 CYS C C -1.687 -5.166 -3.716 1.00 . A A . 17 CYS C 1 1 14 12608 1 1 17 CYS CA C -1.145 -5.816 -2.440 1.00 . A A . 17 CYS CA 1 1 14 12609 1 1 17 CYS CB C -0.298 -4.802 -1.667 1.00 . A A . 17 CYS CB 1 1 14 12610 1 1 17 CYS H H 0.569 -7.117 -2.341 1.00 . A A . 17 CYS H 1 1 14 12611 1 1 17 CYS HA H -1.970 -6.139 -1.823 1.00 . A A . 17 CYS HA 1 1 14 12612 1 1 17 CYS HB2 H -0.947 -4.116 -1.147 1.00 . A A . 17 CYS HB2 1 1 14 12613 1 1 17 CYS HB3 H 0.323 -5.323 -0.952 1.00 . A A . 17 CYS HB3 1 1 14 12614 1 1 17 CYS N N -0.294 -6.992 -2.787 1.00 . A A . 17 CYS N 1 1 14 12615 1 1 17 CYS O O -2.862 -4.870 -3.823 1.00 . A A . 17 CYS O 1 1 14 12616 1 1 17 CYS SG S 0.805 -3.772 -2.702 1.00 . A A . 17 CYS SG 1 1 14 12617 1 1 18 VAL C C -2.502 -5.068 -6.512 1.00 . A A . 18 VAL C 1 1 14 12618 1 1 18 VAL CA C -1.311 -4.292 -5.942 1.00 . A A . 18 VAL CA 1 1 14 12619 1 1 18 VAL CB C -0.174 -4.272 -6.964 1.00 . A A . 18 VAL CB 1 1 14 12620 1 1 18 VAL CG1 C -0.699 -3.742 -8.300 1.00 . A A . 18 VAL CG1 1 1 14 12621 1 1 18 VAL CG2 C 0.944 -3.359 -6.460 1.00 . A A . 18 VAL CG2 1 1 14 12622 1 1 18 VAL H H 0.103 -5.172 -4.575 1.00 . A A . 18 VAL H 1 1 14 12623 1 1 18 VAL HA H -1.617 -3.277 -5.732 1.00 . A A . 18 VAL HA 1 1 14 12624 1 1 18 VAL HB H 0.208 -5.275 -7.099 1.00 . A A . 18 VAL HB 1 1 14 12625 1 1 18 VAL HG11 H -1.777 -3.707 -8.275 1.00 . A A . 18 VAL HG11 1 1 14 12626 1 1 18 VAL HG12 H -0.310 -2.748 -8.469 1.00 . A A . 18 VAL HG12 1 1 14 12627 1 1 18 VAL HG13 H -0.377 -4.394 -9.098 1.00 . A A . 18 VAL HG13 1 1 14 12628 1 1 18 VAL HG21 H 0.823 -3.193 -5.400 1.00 . A A . 18 VAL HG21 1 1 14 12629 1 1 18 VAL HG22 H 1.900 -3.824 -6.645 1.00 . A A . 18 VAL HG22 1 1 14 12630 1 1 18 VAL HG23 H 0.897 -2.413 -6.980 1.00 . A A . 18 VAL HG23 1 1 14 12631 1 1 18 VAL N N -0.842 -4.933 -4.681 1.00 . A A . 18 VAL N 1 1 14 12632 1 1 18 VAL O O -3.367 -4.504 -7.151 1.00 . A A . 18 VAL O 1 1 14 12633 1 1 19 GLU C C -4.935 -6.912 -5.974 1.00 . A A . 19 GLU C 1 1 14 12634 1 1 19 GLU CA C -3.705 -7.138 -6.838 1.00 . A A . 19 GLU CA 1 1 14 12635 1 1 19 GLU CB C -3.358 -8.626 -6.871 1.00 . A A . 19 GLU CB 1 1 14 12636 1 1 19 GLU CD C -4.105 -9.288 -9.161 1.00 . A A . 19 GLU CD 1 1 14 12637 1 1 19 GLU CG C -2.889 -9.010 -8.275 1.00 . A A . 19 GLU CG 1 1 14 12638 1 1 19 GLU H H -1.856 -6.800 -5.778 1.00 . A A . 19 GLU H 1 1 14 12639 1 1 19 GLU HA H -3.921 -6.793 -7.832 1.00 . A A . 19 GLU HA 1 1 14 12640 1 1 19 GLU HB2 H -2.571 -8.829 -6.159 1.00 . A A . 19 GLU HB2 1 1 14 12641 1 1 19 GLU HB3 H -4.233 -9.207 -6.616 1.00 . A A . 19 GLU HB3 1 1 14 12642 1 1 19 GLU HG2 H -2.314 -8.197 -8.695 1.00 . A A . 19 GLU HG2 1 1 14 12643 1 1 19 GLU HG3 H -2.275 -9.895 -8.221 1.00 . A A . 19 GLU HG3 1 1 14 12644 1 1 19 GLU N N -2.560 -6.354 -6.293 1.00 . A A . 19 GLU N 1 1 14 12645 1 1 19 GLU O O -6.026 -6.719 -6.474 1.00 . A A . 19 GLU O 1 1 14 12646 1 1 19 GLU OE1 O -5.209 -9.015 -8.719 1.00 . A A . 19 GLU OE1 1 1 14 12647 1 1 19 GLU OE2 O -3.911 -9.767 -10.264 1.00 . A A . 19 GLU OE2 1 1 14 12648 1 1 20 ILE C C -6.129 -5.125 -3.696 1.00 . A A . 20 ILE C 1 1 14 12649 1 1 20 ILE CA C -5.950 -6.640 -3.818 1.00 . A A . 20 ILE CA 1 1 14 12650 1 1 20 ILE CB C -5.729 -7.255 -2.437 1.00 . A A . 20 ILE CB 1 1 14 12651 1 1 20 ILE CD1 C -3.853 -8.756 -1.810 1.00 . A A . 20 ILE CD1 1 1 14 12652 1 1 20 ILE CG1 C -5.164 -8.642 -2.589 1.00 . A A . 20 ILE CG1 1 1 14 12653 1 1 20 ILE CG2 C -7.055 -7.326 -1.682 1.00 . A A . 20 ILE CG2 1 1 14 12654 1 1 20 ILE H H -3.888 -7.028 -4.293 1.00 . A A . 20 ILE H 1 1 14 12655 1 1 20 ILE HA H -6.832 -7.072 -4.269 1.00 . A A . 20 ILE HA 1 1 14 12656 1 1 20 ILE HB H -5.040 -6.674 -1.887 1.00 . A A . 20 ILE HB 1 1 14 12657 1 1 20 ILE HD11 H -3.165 -7.997 -2.151 1.00 . A A . 20 ILE HD11 1 1 14 12658 1 1 20 ILE HD12 H -4.048 -8.619 -0.757 1.00 . A A . 20 ILE HD12 1 1 14 12659 1 1 20 ILE HD13 H -3.422 -9.733 -1.972 1.00 . A A . 20 ILE HD13 1 1 14 12660 1 1 20 ILE HG12 H -5.870 -9.334 -2.202 1.00 . A A . 20 ILE HG12 1 1 14 12661 1 1 20 ILE HG13 H -4.981 -8.838 -3.625 1.00 . A A . 20 ILE HG13 1 1 14 12662 1 1 20 ILE HG21 H -7.742 -6.599 -2.090 1.00 . A A . 20 ILE HG21 1 1 14 12663 1 1 20 ILE HG22 H -7.476 -8.316 -1.784 1.00 . A A . 20 ILE HG22 1 1 14 12664 1 1 20 ILE HG23 H -6.886 -7.112 -0.637 1.00 . A A . 20 ILE HG23 1 1 14 12665 1 1 20 ILE N N -4.777 -6.897 -4.686 1.00 . A A . 20 ILE N 1 1 14 12666 1 1 20 ILE O O -6.832 -4.639 -2.833 1.00 . A A . 20 ILE O 1 1 14 12667 1 1 21 ALA C C -4.608 -2.256 -5.458 1.00 . A A . 21 ALA C 1 1 14 12668 1 1 21 ALA CA C -5.621 -2.891 -4.503 1.00 . A A . 21 ALA CA 1 1 14 12669 1 1 21 ALA CB C -5.351 -2.409 -3.077 1.00 . A A . 21 ALA CB 1 1 14 12670 1 1 21 ALA H H -4.924 -4.788 -5.258 1.00 . A A . 21 ALA H 1 1 14 12671 1 1 21 ALA HA H -6.621 -2.606 -4.796 1.00 . A A . 21 ALA HA 1 1 14 12672 1 1 21 ALA HB1 H -4.475 -2.909 -2.688 1.00 . A A . 21 ALA HB1 1 1 14 12673 1 1 21 ALA HB2 H -5.182 -1.342 -3.084 1.00 . A A . 21 ALA HB2 1 1 14 12674 1 1 21 ALA HB3 H -6.201 -2.636 -2.453 1.00 . A A . 21 ALA HB3 1 1 14 12675 1 1 21 ALA N N -5.492 -4.374 -4.564 1.00 . A A . 21 ALA N 1 1 14 12676 1 1 21 ALA O O -3.717 -1.546 -5.038 1.00 . A A . 21 ALA O 1 1 14 12677 1 1 22 PRO C C -4.139 -0.510 -8.001 1.00 . A A . 22 PRO C 1 1 14 12678 1 1 22 PRO CA C -3.868 -1.999 -7.759 1.00 . A A . 22 PRO CA 1 1 14 12679 1 1 22 PRO CB C -4.208 -2.822 -9.001 1.00 . A A . 22 PRO CB 1 1 14 12680 1 1 22 PRO CD C -5.835 -3.389 -7.289 1.00 . A A . 22 PRO CD 1 1 14 12681 1 1 22 PRO CG C -5.616 -3.290 -8.783 1.00 . A A . 22 PRO CG 1 1 14 12682 1 1 22 PRO HA H -2.838 -2.158 -7.481 1.00 . A A . 22 PRO HA 1 1 14 12683 1 1 22 PRO HB2 H -4.115 -2.196 -9.878 1.00 . A A . 22 PRO HB2 1 1 14 12684 1 1 22 PRO HB3 H -3.524 -3.652 -9.078 1.00 . A A . 22 PRO HB3 1 1 14 12685 1 1 22 PRO HD2 H -6.816 -3.017 -7.027 1.00 . A A . 22 PRO HD2 1 1 14 12686 1 1 22 PRO HD3 H -5.715 -4.409 -6.956 1.00 . A A . 22 PRO HD3 1 1 14 12687 1 1 22 PRO HG2 H -6.305 -2.577 -9.214 1.00 . A A . 22 PRO HG2 1 1 14 12688 1 1 22 PRO HG3 H -5.752 -4.260 -9.236 1.00 . A A . 22 PRO HG3 1 1 14 12689 1 1 22 PRO N N -4.782 -2.542 -6.719 1.00 . A A . 22 PRO N 1 1 14 12690 1 1 22 PRO O O -3.317 0.198 -8.549 1.00 . A A . 22 PRO O 1 1 14 12691 1 1 23 GLY C C -4.906 2.262 -6.752 1.00 . A A . 23 GLY C 1 1 14 12692 1 1 23 GLY CA C -5.600 1.413 -7.821 1.00 . A A . 23 GLY CA 1 1 14 12693 1 1 23 GLY H H -5.939 -0.613 -7.167 1.00 . A A . 23 GLY H 1 1 14 12694 1 1 23 GLY HA2 H -5.251 1.712 -8.801 1.00 . A A . 23 GLY HA2 1 1 14 12695 1 1 23 GLY HA3 H -6.667 1.563 -7.758 1.00 . A A . 23 GLY HA3 1 1 14 12696 1 1 23 GLY N N -5.285 -0.028 -7.604 1.00 . A A . 23 GLY N 1 1 14 12697 1 1 23 GLY O O -4.372 3.316 -7.033 1.00 . A A . 23 GLY O 1 1 14 12698 1 1 24 ALA C C -2.774 2.225 -4.355 1.00 . A A . 24 ALA C 1 1 14 12699 1 1 24 ALA CA C -4.257 2.597 -4.439 1.00 . A A . 24 ALA CA 1 1 14 12700 1 1 24 ALA CB C -4.937 2.280 -3.106 1.00 . A A . 24 ALA CB 1 1 14 12701 1 1 24 ALA H H -5.351 0.961 -5.318 1.00 . A A . 24 ALA H 1 1 14 12702 1 1 24 ALA HA H -4.352 3.651 -4.648 1.00 . A A . 24 ALA HA 1 1 14 12703 1 1 24 ALA HB1 H -5.016 1.209 -2.989 1.00 . A A . 24 ALA HB1 1 1 14 12704 1 1 24 ALA HB2 H -4.350 2.689 -2.297 1.00 . A A . 24 ALA HB2 1 1 14 12705 1 1 24 ALA HB3 H -5.924 2.719 -3.092 1.00 . A A . 24 ALA HB3 1 1 14 12706 1 1 24 ALA N N -4.912 1.812 -5.526 1.00 . A A . 24 ALA N 1 1 14 12707 1 1 24 ALA O O -1.935 3.048 -4.049 1.00 . A A . 24 ALA O 1 1 14 12708 1 1 25 PHE C C -0.478 0.373 -5.970 1.00 . A A . 25 PHE C 1 1 14 12709 1 1 25 PHE CA C -1.022 0.561 -4.548 1.00 . A A . 25 PHE CA 1 1 14 12710 1 1 25 PHE CB C -0.938 -0.773 -3.796 1.00 . A A . 25 PHE CB 1 1 14 12711 1 1 25 PHE CD1 C 1.327 -0.116 -2.899 1.00 . A A . 25 PHE CD1 1 1 14 12712 1 1 25 PHE CD2 C -0.254 -1.187 -1.407 1.00 . A A . 25 PHE CD2 1 1 14 12713 1 1 25 PHE CE1 C 2.262 -0.048 -1.857 1.00 . A A . 25 PHE CE1 1 1 14 12714 1 1 25 PHE CE2 C 0.682 -1.121 -0.368 1.00 . A A . 25 PHE CE2 1 1 14 12715 1 1 25 PHE CG C 0.068 -0.683 -2.673 1.00 . A A . 25 PHE CG 1 1 14 12716 1 1 25 PHE CZ C 1.941 -0.551 -0.596 1.00 . A A . 25 PHE CZ 1 1 14 12717 1 1 25 PHE H H -3.143 0.342 -4.859 1.00 . A A . 25 PHE H 1 1 14 12718 1 1 25 PHE HA H -0.441 1.315 -4.031 1.00 . A A . 25 PHE HA 1 1 14 12719 1 1 25 PHE HB2 H -1.908 -1.013 -3.386 1.00 . A A . 25 PHE HB2 1 1 14 12720 1 1 25 PHE HB3 H -0.640 -1.552 -4.480 1.00 . A A . 25 PHE HB3 1 1 14 12721 1 1 25 PHE HD1 H 1.576 0.272 -3.875 1.00 . A A . 25 PHE HD1 1 1 14 12722 1 1 25 PHE HD2 H -1.226 -1.626 -1.231 1.00 . A A . 25 PHE HD2 1 1 14 12723 1 1 25 PHE HE1 H 3.229 0.388 -2.028 1.00 . A A . 25 PHE HE1 1 1 14 12724 1 1 25 PHE HE2 H 0.433 -1.509 0.609 1.00 . A A . 25 PHE HE2 1 1 14 12725 1 1 25 PHE HZ H 2.665 -0.502 0.200 1.00 . A A . 25 PHE HZ 1 1 14 12726 1 1 25 PHE N N -2.448 0.990 -4.618 1.00 . A A . 25 PHE N 1 1 14 12727 1 1 25 PHE O O -1.164 -0.119 -6.844 1.00 . A A . 25 PHE O 1 1 14 12728 1 1 26 ALA C C 2.827 0.883 -7.550 1.00 . A A . 26 ALA C 1 1 14 12729 1 1 26 ALA CA C 1.324 0.589 -7.577 1.00 . A A . 26 ALA CA 1 1 14 12730 1 1 26 ALA CB C 0.637 1.562 -8.537 1.00 . A A . 26 ALA CB 1 1 14 12731 1 1 26 ALA H H 1.288 1.148 -5.495 1.00 . A A . 26 ALA H 1 1 14 12732 1 1 26 ALA HA H 1.162 -0.423 -7.916 1.00 . A A . 26 ALA HA 1 1 14 12733 1 1 26 ALA HB1 H -0.107 2.131 -8.000 1.00 . A A . 26 ALA HB1 1 1 14 12734 1 1 26 ALA HB2 H 1.372 2.233 -8.956 1.00 . A A . 26 ALA HB2 1 1 14 12735 1 1 26 ALA HB3 H 0.161 1.007 -9.332 1.00 . A A . 26 ALA HB3 1 1 14 12736 1 1 26 ALA N N 0.748 0.755 -6.210 1.00 . A A . 26 ALA N 1 1 14 12737 1 1 26 ALA O O 3.260 1.907 -7.065 1.00 . A A . 26 ALA O 1 1 14 12738 1 1 27 MET C C 5.404 1.479 -8.904 1.00 . A A . 27 MET C 1 1 14 12739 1 1 27 MET CA C 5.102 0.239 -8.073 1.00 . A A . 27 MET CA 1 1 14 12740 1 1 27 MET CB C 5.828 -0.969 -8.671 1.00 . A A . 27 MET CB 1 1 14 12741 1 1 27 MET CE C 7.088 -0.177 -11.579 1.00 . A A . 27 MET CE 1 1 14 12742 1 1 27 MET CG C 5.195 -1.335 -10.016 1.00 . A A . 27 MET CG 1 1 14 12743 1 1 27 MET H H 3.268 -0.825 -8.463 1.00 . A A . 27 MET H 1 1 14 12744 1 1 27 MET HA H 5.433 0.399 -7.068 1.00 . A A . 27 MET HA 1 1 14 12745 1 1 27 MET HB2 H 6.871 -0.722 -8.819 1.00 . A A . 27 MET HB2 1 1 14 12746 1 1 27 MET HB3 H 5.749 -1.807 -7.997 1.00 . A A . 27 MET HB3 1 1 14 12747 1 1 27 MET HE1 H 7.044 0.446 -10.695 1.00 . A A . 27 MET HE1 1 1 14 12748 1 1 27 MET HE2 H 8.107 -0.234 -11.925 1.00 . A A . 27 MET HE2 1 1 14 12749 1 1 27 MET HE3 H 6.468 0.248 -12.356 1.00 . A A . 27 MET HE3 1 1 14 12750 1 1 27 MET HG2 H 4.502 -2.151 -9.876 1.00 . A A . 27 MET HG2 1 1 14 12751 1 1 27 MET HG3 H 4.669 -0.479 -10.412 1.00 . A A . 27 MET HG3 1 1 14 12752 1 1 27 MET N N 3.631 -0.005 -8.072 1.00 . A A . 27 MET N 1 1 14 12753 1 1 27 MET O O 4.652 1.829 -9.791 1.00 . A A . 27 MET O 1 1 14 12754 1 1 27 MET SD S 6.492 -1.836 -11.174 1.00 . A A . 27 MET SD 1 1 14 12755 1 1 28 ASP C C 8.248 3.325 -9.815 1.00 . A A . 28 ASP C 1 1 14 12756 1 1 28 ASP CA C 6.779 3.366 -9.442 1.00 . A A . 28 ASP CA 1 1 14 12757 1 1 28 ASP CB C 6.497 4.593 -8.586 1.00 . A A . 28 ASP CB 1 1 14 12758 1 1 28 ASP CG C 5.799 5.671 -9.419 1.00 . A A . 28 ASP CG 1 1 14 12759 1 1 28 ASP H H 7.122 1.896 -7.912 1.00 . A A . 28 ASP H 1 1 14 12760 1 1 28 ASP HA H 6.167 3.381 -10.331 1.00 . A A . 28 ASP HA 1 1 14 12761 1 1 28 ASP HB2 H 5.861 4.310 -7.757 1.00 . A A . 28 ASP HB2 1 1 14 12762 1 1 28 ASP HB3 H 7.432 4.970 -8.209 1.00 . A A . 28 ASP HB3 1 1 14 12763 1 1 28 ASP N N 6.490 2.164 -8.639 1.00 . A A . 28 ASP N 1 1 14 12764 1 1 28 ASP O O 8.990 2.572 -9.224 1.00 . A A . 28 ASP O 1 1 14 12765 1 1 28 ASP OD1 O 5.112 5.313 -10.361 1.00 . A A . 28 ASP OD1 1 1 14 12766 1 1 28 ASP OD2 O 5.963 6.837 -9.099 1.00 . A A . 28 ASP OD2 1 1 14 12767 1 1 29 PRO C C 10.771 5.134 -10.256 1.00 . A A . 29 PRO C 1 1 14 12768 1 1 29 PRO CA C 10.029 4.198 -11.200 1.00 . A A . 29 PRO CA 1 1 14 12769 1 1 29 PRO CB C 9.949 4.764 -12.616 1.00 . A A . 29 PRO CB 1 1 14 12770 1 1 29 PRO CD C 7.790 5.088 -11.504 1.00 . A A . 29 PRO CD 1 1 14 12771 1 1 29 PRO CG C 8.658 5.532 -12.667 1.00 . A A . 29 PRO CG 1 1 14 12772 1 1 29 PRO HA H 10.475 3.216 -11.207 1.00 . A A . 29 PRO HA 1 1 14 12773 1 1 29 PRO HB2 H 10.808 5.399 -12.793 1.00 . A A . 29 PRO HB2 1 1 14 12774 1 1 29 PRO HB3 H 9.952 3.953 -13.327 1.00 . A A . 29 PRO HB3 1 1 14 12775 1 1 29 PRO HD2 H 7.542 5.938 -10.888 1.00 . A A . 29 PRO HD2 1 1 14 12776 1 1 29 PRO HD3 H 6.897 4.607 -11.857 1.00 . A A . 29 PRO HD3 1 1 14 12777 1 1 29 PRO HG2 H 8.864 6.590 -12.589 1.00 . A A . 29 PRO HG2 1 1 14 12778 1 1 29 PRO HG3 H 8.150 5.325 -13.598 1.00 . A A . 29 PRO HG3 1 1 14 12779 1 1 29 PRO N N 8.623 4.140 -10.766 1.00 . A A . 29 PRO N 1 1 14 12780 1 1 29 PRO O O 11.982 5.116 -10.150 1.00 . A A . 29 PRO O 1 1 14 12781 1 1 30 GLU C C 10.846 6.058 -7.262 1.00 . A A . 30 GLU C 1 1 14 12782 1 1 30 GLU CA C 10.643 6.850 -8.548 1.00 . A A . 30 GLU CA 1 1 14 12783 1 1 30 GLU CB C 9.710 8.036 -8.290 1.00 . A A . 30 GLU CB 1 1 14 12784 1 1 30 GLU CD C 10.342 10.089 -7.014 1.00 . A A . 30 GLU CD 1 1 14 12785 1 1 30 GLU CG C 10.515 9.337 -8.334 1.00 . A A . 30 GLU CG 1 1 14 12786 1 1 30 GLU H H 9.049 5.890 -9.625 1.00 . A A . 30 GLU H 1 1 14 12787 1 1 30 GLU HA H 11.595 7.202 -8.919 1.00 . A A . 30 GLU HA 1 1 14 12788 1 1 30 GLU HB2 H 8.941 8.060 -9.050 1.00 . A A . 30 GLU HB2 1 1 14 12789 1 1 30 GLU HB3 H 9.253 7.930 -7.318 1.00 . A A . 30 GLU HB3 1 1 14 12790 1 1 30 GLU HG2 H 11.560 9.109 -8.484 1.00 . A A . 30 GLU HG2 1 1 14 12791 1 1 30 GLU HG3 H 10.159 9.953 -9.146 1.00 . A A . 30 GLU HG3 1 1 14 12792 1 1 30 GLU N N 10.026 5.928 -9.536 1.00 . A A . 30 GLU N 1 1 14 12793 1 1 30 GLU O O 11.858 6.170 -6.598 1.00 . A A . 30 GLU O 1 1 14 12794 1 1 30 GLU OE1 O 10.435 9.453 -5.976 1.00 . A A . 30 GLU OE1 1 1 14 12795 1 1 30 GLU OE2 O 10.120 11.287 -7.060 1.00 . A A . 30 GLU OE2 1 1 14 12796 1 1 31 ILE C C 10.385 2.962 -6.159 1.00 . A A . 31 ILE C 1 1 14 12797 1 1 31 ILE CA C 10.038 4.376 -5.724 1.00 . A A . 31 ILE CA 1 1 14 12798 1 1 31 ILE CB C 8.749 4.368 -4.895 1.00 . A A . 31 ILE CB 1 1 14 12799 1 1 31 ILE CD1 C 7.235 5.967 -6.127 1.00 . A A . 31 ILE CD1 1 1 14 12800 1 1 31 ILE CG1 C 7.529 4.493 -5.815 1.00 . A A . 31 ILE CG1 1 1 14 12801 1 1 31 ILE CG2 C 8.779 5.528 -3.894 1.00 . A A . 31 ILE CG2 1 1 14 12802 1 1 31 ILE H H 9.111 5.127 -7.506 1.00 . A A . 31 ILE H 1 1 14 12803 1 1 31 ILE HA H 10.831 4.747 -5.133 1.00 . A A . 31 ILE HA 1 1 14 12804 1 1 31 ILE HB H 8.689 3.437 -4.347 1.00 . A A . 31 ILE HB 1 1 14 12805 1 1 31 ILE HD11 H 7.061 6.502 -5.206 1.00 . A A . 31 ILE HD11 1 1 14 12806 1 1 31 ILE HD12 H 8.077 6.404 -6.642 1.00 . A A . 31 ILE HD12 1 1 14 12807 1 1 31 ILE HD13 H 6.358 6.035 -6.753 1.00 . A A . 31 ILE HD13 1 1 14 12808 1 1 31 ILE HG12 H 7.727 3.960 -6.731 1.00 . A A . 31 ILE HG12 1 1 14 12809 1 1 31 ILE HG13 H 6.669 4.055 -5.329 1.00 . A A . 31 ILE HG13 1 1 14 12810 1 1 31 ILE HG21 H 9.172 6.410 -4.378 1.00 . A A . 31 ILE HG21 1 1 14 12811 1 1 31 ILE HG22 H 7.778 5.727 -3.542 1.00 . A A . 31 ILE HG22 1 1 14 12812 1 1 31 ILE HG23 H 9.409 5.265 -3.057 1.00 . A A . 31 ILE HG23 1 1 14 12813 1 1 31 ILE N N 9.898 5.220 -6.935 1.00 . A A . 31 ILE N 1 1 14 12814 1 1 31 ILE O O 10.504 2.073 -5.341 1.00 . A A . 31 ILE O 1 1 14 12815 1 1 32 GLU C C 10.254 0.354 -7.084 1.00 . A A . 32 GLU C 1 1 14 12816 1 1 32 GLU CA C 10.894 1.402 -7.976 1.00 . A A . 32 GLU CA 1 1 14 12817 1 1 32 GLU CB C 12.412 1.216 -7.990 1.00 . A A . 32 GLU CB 1 1 14 12818 1 1 32 GLU CD C 13.728 1.181 -10.115 1.00 . A A . 32 GLU CD 1 1 14 12819 1 1 32 GLU CG C 13.022 2.078 -9.098 1.00 . A A . 32 GLU CG 1 1 14 12820 1 1 32 GLU H H 10.456 3.501 -8.075 1.00 . A A . 32 GLU H 1 1 14 12821 1 1 32 GLU HA H 10.502 1.305 -8.977 1.00 . A A . 32 GLU HA 1 1 14 12822 1 1 32 GLU HB2 H 12.818 1.515 -7.035 1.00 . A A . 32 GLU HB2 1 1 14 12823 1 1 32 GLU HB3 H 12.647 0.179 -8.173 1.00 . A A . 32 GLU HB3 1 1 14 12824 1 1 32 GLU HG2 H 12.240 2.637 -9.590 1.00 . A A . 32 GLU HG2 1 1 14 12825 1 1 32 GLU HG3 H 13.738 2.763 -8.666 1.00 . A A . 32 GLU HG3 1 1 14 12826 1 1 32 GLU N N 10.556 2.756 -7.449 1.00 . A A . 32 GLU N 1 1 14 12827 1 1 32 GLU O O 10.838 -0.665 -6.773 1.00 . A A . 32 GLU O 1 1 14 12828 1 1 32 GLU OE1 O 13.146 0.179 -10.496 1.00 . A A . 32 GLU OE1 1 1 14 12829 1 1 32 GLU OE2 O 14.838 1.510 -10.498 1.00 . A A . 32 GLU OE2 1 1 14 12830 1 1 33 LYS C C 6.944 0.079 -5.479 1.00 . A A . 33 LYS C 1 1 14 12831 1 1 33 LYS CA C 8.381 -0.355 -5.737 1.00 . A A . 33 LYS CA 1 1 14 12832 1 1 33 LYS CB C 9.129 -0.416 -4.404 1.00 . A A . 33 LYS CB 1 1 14 12833 1 1 33 LYS CD C 11.546 -1.048 -4.306 1.00 . A A . 33 LYS CD 1 1 14 12834 1 1 33 LYS CE C 12.522 -2.079 -4.873 1.00 . A A . 33 LYS CE 1 1 14 12835 1 1 33 LYS CG C 10.118 -1.582 -4.423 1.00 . A A . 33 LYS CG 1 1 14 12836 1 1 33 LYS H H 8.612 1.472 -6.907 1.00 . A A . 33 LYS H 1 1 14 12837 1 1 33 LYS HA H 8.383 -1.336 -6.190 1.00 . A A . 33 LYS HA 1 1 14 12838 1 1 33 LYS HB2 H 9.665 0.509 -4.249 1.00 . A A . 33 LYS HB2 1 1 14 12839 1 1 33 LYS HB3 H 8.423 -0.560 -3.600 1.00 . A A . 33 LYS HB3 1 1 14 12840 1 1 33 LYS HD2 H 11.632 -0.124 -4.860 1.00 . A A . 33 LYS HD2 1 1 14 12841 1 1 33 LYS HD3 H 11.779 -0.868 -3.267 1.00 . A A . 33 LYS HD3 1 1 14 12842 1 1 33 LYS HE2 H 12.103 -2.520 -5.766 1.00 . A A . 33 LYS HE2 1 1 14 12843 1 1 33 LYS HE3 H 13.456 -1.596 -5.115 1.00 . A A . 33 LYS HE3 1 1 14 12844 1 1 33 LYS HG2 H 9.911 -2.242 -3.593 1.00 . A A . 33 LYS HG2 1 1 14 12845 1 1 33 LYS HG3 H 10.014 -2.127 -5.349 1.00 . A A . 33 LYS HG3 1 1 14 12846 1 1 33 LYS HZ1 H 12.681 -2.741 -2.905 1.00 . A A . 33 LYS HZ1 1 1 14 12847 1 1 33 LYS HZ2 H 12.058 -3.902 -3.978 1.00 . A A . 33 LYS HZ2 1 1 14 12848 1 1 33 LYS HZ3 H 13.717 -3.536 -3.986 1.00 . A A . 33 LYS HZ3 1 1 14 12849 1 1 33 LYS N N 9.057 0.619 -6.647 1.00 . A A . 33 LYS N 1 1 14 12850 1 1 33 LYS NZ N 12.762 -3.145 -3.859 1.00 . A A . 33 LYS NZ 1 1 14 12851 1 1 33 LYS O O 6.611 1.246 -5.557 1.00 . A A . 33 LYS O 1 1 14 12852 1 1 34 ALA C C 4.582 0.593 -3.864 1.00 . A A . 34 ALA C 1 1 14 12853 1 1 34 ALA CA C 4.659 -0.511 -4.918 1.00 . A A . 34 ALA CA 1 1 14 12854 1 1 34 ALA CB C 3.920 -1.751 -4.408 1.00 . A A . 34 ALA CB 1 1 14 12855 1 1 34 ALA H H 6.376 -1.791 -5.128 1.00 . A A . 34 ALA H 1 1 14 12856 1 1 34 ALA HA H 4.196 -0.170 -5.831 1.00 . A A . 34 ALA HA 1 1 14 12857 1 1 34 ALA HB1 H 4.537 -2.268 -3.689 1.00 . A A . 34 ALA HB1 1 1 14 12858 1 1 34 ALA HB2 H 2.995 -1.450 -3.938 1.00 . A A . 34 ALA HB2 1 1 14 12859 1 1 34 ALA HB3 H 3.704 -2.408 -5.237 1.00 . A A . 34 ALA HB3 1 1 14 12860 1 1 34 ALA N N 6.084 -0.857 -5.178 1.00 . A A . 34 ALA N 1 1 14 12861 1 1 34 ALA O O 5.411 0.681 -2.985 1.00 . A A . 34 ALA O 1 1 14 12862 1 1 35 TYR C C 1.935 2.904 -2.845 1.00 . A A . 35 TYR C 1 1 14 12863 1 1 35 TYR CA C 3.415 2.522 -2.941 1.00 . A A . 35 TYR CA 1 1 14 12864 1 1 35 TYR CB C 4.271 3.737 -3.348 1.00 . A A . 35 TYR CB 1 1 14 12865 1 1 35 TYR CD1 C 2.802 3.928 -5.405 1.00 . A A . 35 TYR CD1 1 1 14 12866 1 1 35 TYR CD2 C 3.834 5.929 -4.516 1.00 . A A . 35 TYR CD2 1 1 14 12867 1 1 35 TYR CE1 C 2.216 4.683 -6.427 1.00 . A A . 35 TYR CE1 1 1 14 12868 1 1 35 TYR CE2 C 3.245 6.686 -5.536 1.00 . A A . 35 TYR CE2 1 1 14 12869 1 1 35 TYR CG C 3.611 4.548 -4.448 1.00 . A A . 35 TYR CG 1 1 14 12870 1 1 35 TYR CZ C 2.435 6.061 -6.492 1.00 . A A . 35 TYR CZ 1 1 14 12871 1 1 35 TYR H H 2.920 1.312 -4.656 1.00 . A A . 35 TYR H 1 1 14 12872 1 1 35 TYR HA H 3.743 2.172 -1.966 1.00 . A A . 35 TYR HA 1 1 14 12873 1 1 35 TYR HB2 H 4.417 4.370 -2.486 1.00 . A A . 35 TYR HB2 1 1 14 12874 1 1 35 TYR HB3 H 5.232 3.389 -3.695 1.00 . A A . 35 TYR HB3 1 1 14 12875 1 1 35 TYR HD1 H 2.624 2.872 -5.356 1.00 . A A . 35 TYR HD1 1 1 14 12876 1 1 35 TYR HD2 H 4.458 6.411 -3.779 1.00 . A A . 35 TYR HD2 1 1 14 12877 1 1 35 TYR HE1 H 1.591 4.201 -7.165 1.00 . A A . 35 TYR HE1 1 1 14 12878 1 1 35 TYR HE2 H 3.415 7.752 -5.586 1.00 . A A . 35 TYR HE2 1 1 14 12879 1 1 35 TYR HH H 2.526 7.393 -7.859 1.00 . A A . 35 TYR HH 1 1 14 12880 1 1 35 TYR N N 3.577 1.421 -3.942 1.00 . A A . 35 TYR N 1 1 14 12881 1 1 35 TYR O O 1.195 2.832 -3.806 1.00 . A A . 35 TYR O 1 1 14 12882 1 1 35 TYR OH O 1.857 6.806 -7.501 1.00 . A A . 35 TYR OH 1 1 14 12883 1 1 36 VAL C C -0.097 5.147 -1.856 1.00 . A A . 36 VAL C 1 1 14 12884 1 1 36 VAL CA C 0.061 3.661 -1.515 1.00 . A A . 36 VAL CA 1 1 14 12885 1 1 36 VAL CB C -0.358 3.372 -0.062 1.00 . A A . 36 VAL CB 1 1 14 12886 1 1 36 VAL CG1 C -1.444 4.345 0.399 1.00 . A A . 36 VAL CG1 1 1 14 12887 1 1 36 VAL CG2 C -0.902 1.945 0.027 1.00 . A A . 36 VAL CG2 1 1 14 12888 1 1 36 VAL H H 2.100 3.323 -0.915 1.00 . A A . 36 VAL H 1 1 14 12889 1 1 36 VAL HA H -0.544 3.074 -2.190 1.00 . A A . 36 VAL HA 1 1 14 12890 1 1 36 VAL HB H 0.502 3.466 0.584 1.00 . A A . 36 VAL HB 1 1 14 12891 1 1 36 VAL HG11 H -1.977 4.721 -0.460 1.00 . A A . 36 VAL HG11 1 1 14 12892 1 1 36 VAL HG12 H -2.133 3.829 1.053 1.00 . A A . 36 VAL HG12 1 1 14 12893 1 1 36 VAL HG13 H -0.988 5.165 0.931 1.00 . A A . 36 VAL HG13 1 1 14 12894 1 1 36 VAL HG21 H -0.210 1.264 -0.446 1.00 . A A . 36 VAL HG21 1 1 14 12895 1 1 36 VAL HG22 H -1.026 1.671 1.065 1.00 . A A . 36 VAL HG22 1 1 14 12896 1 1 36 VAL HG23 H -1.858 1.892 -0.475 1.00 . A A . 36 VAL HG23 1 1 14 12897 1 1 36 VAL N N 1.492 3.288 -1.682 1.00 . A A . 36 VAL N 1 1 14 12898 1 1 36 VAL O O 0.210 6.013 -1.061 1.00 . A A . 36 VAL O 1 1 14 12899 1 1 37 LYS C C -2.167 7.241 -3.676 1.00 . A A . 37 LYS C 1 1 14 12900 1 1 37 LYS CA C -0.695 6.881 -3.438 1.00 . A A . 37 LYS CA 1 1 14 12901 1 1 37 LYS CB C 0.105 7.139 -4.719 1.00 . A A . 37 LYS CB 1 1 14 12902 1 1 37 LYS CD C -0.802 7.416 -7.035 1.00 . A A . 37 LYS CD 1 1 14 12903 1 1 37 LYS CE C -1.920 8.382 -6.638 1.00 . A A . 37 LYS CE 1 1 14 12904 1 1 37 LYS CG C -0.555 6.420 -5.899 1.00 . A A . 37 LYS CG 1 1 14 12905 1 1 37 LYS H H -0.774 4.731 -3.682 1.00 . A A . 37 LYS H 1 1 14 12906 1 1 37 LYS HA H -0.304 7.504 -2.649 1.00 . A A . 37 LYS HA 1 1 14 12907 1 1 37 LYS HB2 H 0.135 8.201 -4.915 1.00 . A A . 37 LYS HB2 1 1 14 12908 1 1 37 LYS HB3 H 1.111 6.769 -4.593 1.00 . A A . 37 LYS HB3 1 1 14 12909 1 1 37 LYS HD2 H 0.104 7.973 -7.227 1.00 . A A . 37 LYS HD2 1 1 14 12910 1 1 37 LYS HD3 H -1.092 6.881 -7.926 1.00 . A A . 37 LYS HD3 1 1 14 12911 1 1 37 LYS HE2 H -2.550 7.916 -5.894 1.00 . A A . 37 LYS HE2 1 1 14 12912 1 1 37 LYS HE3 H -1.489 9.284 -6.230 1.00 . A A . 37 LYS HE3 1 1 14 12913 1 1 37 LYS HG2 H 0.094 5.631 -6.248 1.00 . A A . 37 LYS HG2 1 1 14 12914 1 1 37 LYS HG3 H -1.495 5.997 -5.586 1.00 . A A . 37 LYS HG3 1 1 14 12915 1 1 37 LYS HZ1 H -2.392 8.176 -8.656 1.00 . A A . 37 LYS HZ1 1 1 14 12916 1 1 37 LYS HZ2 H -3.733 8.483 -7.659 1.00 . A A . 37 LYS HZ2 1 1 14 12917 1 1 37 LYS HZ3 H -2.650 9.735 -8.042 1.00 . A A . 37 LYS HZ3 1 1 14 12918 1 1 37 LYS N N -0.550 5.448 -3.045 1.00 . A A . 37 LYS N 1 1 14 12919 1 1 37 LYS NZ N -2.735 8.719 -7.839 1.00 . A A . 37 LYS NZ 1 1 14 12920 1 1 37 LYS O O -2.559 8.382 -3.534 1.00 . A A . 37 LYS O 1 1 14 12921 1 1 38 ASP C C -5.299 5.936 -3.257 1.00 . A A . 38 ASP C 1 1 14 12922 1 1 38 ASP CA C -4.416 6.619 -4.301 1.00 . A A . 38 ASP CA 1 1 14 12923 1 1 38 ASP CB C -4.808 6.139 -5.702 1.00 . A A . 38 ASP CB 1 1 14 12924 1 1 38 ASP CG C -6.305 6.371 -5.918 1.00 . A A . 38 ASP CG 1 1 14 12925 1 1 38 ASP H H -2.655 5.379 -4.170 1.00 . A A . 38 ASP H 1 1 14 12926 1 1 38 ASP HA H -4.555 7.688 -4.240 1.00 . A A . 38 ASP HA 1 1 14 12927 1 1 38 ASP HB2 H -4.246 6.692 -6.441 1.00 . A A . 38 ASP HB2 1 1 14 12928 1 1 38 ASP HB3 H -4.591 5.086 -5.797 1.00 . A A . 38 ASP HB3 1 1 14 12929 1 1 38 ASP N N -2.982 6.295 -4.048 1.00 . A A . 38 ASP N 1 1 14 12930 1 1 38 ASP O O -5.714 4.805 -3.421 1.00 . A A . 38 ASP O 1 1 14 12931 1 1 38 ASP OD1 O -6.894 7.084 -5.122 1.00 . A A . 38 ASP OD1 1 1 14 12932 1 1 38 ASP OD2 O -6.834 5.833 -6.876 1.00 . A A . 38 ASP OD2 1 1 14 12933 1 1 39 VAL C C -7.828 5.691 -1.726 1.00 . A A . 39 VAL C 1 1 14 12934 1 1 39 VAL CA C -6.457 6.019 -1.131 1.00 . A A . 39 VAL CA 1 1 14 12935 1 1 39 VAL CB C -6.625 7.019 0.014 1.00 . A A . 39 VAL CB 1 1 14 12936 1 1 39 VAL CG1 C -5.250 7.394 0.571 1.00 . A A . 39 VAL CG1 1 1 14 12937 1 1 39 VAL CG2 C -7.321 8.277 -0.511 1.00 . A A . 39 VAL CG2 1 1 14 12938 1 1 39 VAL H H -5.254 7.531 -2.078 1.00 . A A . 39 VAL H 1 1 14 12939 1 1 39 VAL HA H -5.998 5.115 -0.758 1.00 . A A . 39 VAL HA 1 1 14 12940 1 1 39 VAL HB H -7.221 6.574 0.797 1.00 . A A . 39 VAL HB 1 1 14 12941 1 1 39 VAL HG11 H -4.588 7.650 -0.243 1.00 . A A . 39 VAL HG11 1 1 14 12942 1 1 39 VAL HG12 H -5.349 8.241 1.234 1.00 . A A . 39 VAL HG12 1 1 14 12943 1 1 39 VAL HG13 H -4.841 6.556 1.116 1.00 . A A . 39 VAL HG13 1 1 14 12944 1 1 39 VAL HG21 H -7.631 8.117 -1.532 1.00 . A A . 39 VAL HG21 1 1 14 12945 1 1 39 VAL HG22 H -8.187 8.490 0.099 1.00 . A A . 39 VAL HG22 1 1 14 12946 1 1 39 VAL HG23 H -6.637 9.111 -0.468 1.00 . A A . 39 VAL HG23 1 1 14 12947 1 1 39 VAL N N -5.595 6.619 -2.186 1.00 . A A . 39 VAL N 1 1 14 12948 1 1 39 VAL O O -8.546 4.847 -1.230 1.00 . A A . 39 VAL O 1 1 14 12949 1 1 40 GLU C C -9.351 5.044 -4.528 1.00 . A A . 40 GLU C 1 1 14 12950 1 1 40 GLU CA C -9.515 6.087 -3.419 1.00 . A A . 40 GLU CA 1 1 14 12951 1 1 40 GLU CB C -10.064 7.383 -4.021 1.00 . A A . 40 GLU CB 1 1 14 12952 1 1 40 GLU CD C -10.721 9.647 -3.193 1.00 . A A . 40 GLU CD 1 1 14 12953 1 1 40 GLU CG C -10.862 8.142 -2.960 1.00 . A A . 40 GLU CG 1 1 14 12954 1 1 40 GLU H H -7.597 7.033 -3.171 1.00 . A A . 40 GLU H 1 1 14 12955 1 1 40 GLU HA H -10.202 5.717 -2.674 1.00 . A A . 40 GLU HA 1 1 14 12956 1 1 40 GLU HB2 H -9.242 7.997 -4.362 1.00 . A A . 40 GLU HB2 1 1 14 12957 1 1 40 GLU HB3 H -10.709 7.148 -4.854 1.00 . A A . 40 GLU HB3 1 1 14 12958 1 1 40 GLU HG2 H -11.904 7.863 -3.027 1.00 . A A . 40 GLU HG2 1 1 14 12959 1 1 40 GLU HG3 H -10.484 7.895 -1.980 1.00 . A A . 40 GLU HG3 1 1 14 12960 1 1 40 GLU N N -8.193 6.356 -2.788 1.00 . A A . 40 GLU N 1 1 14 12961 1 1 40 GLU O O -10.297 4.686 -5.201 1.00 . A A . 40 GLU O 1 1 14 12962 1 1 40 GLU OE1 O -9.617 10.149 -3.045 1.00 . A A . 40 GLU OE1 1 1 14 12963 1 1 40 GLU OE2 O -11.717 10.274 -3.513 1.00 . A A . 40 GLU OE2 1 1 14 12964 1 1 41 GLY C C -8.203 2.136 -5.236 1.00 . A A . 41 GLY C 1 1 14 12965 1 1 41 GLY CA C -7.935 3.536 -5.793 1.00 . A A . 41 GLY CA 1 1 14 12966 1 1 41 GLY H H -7.404 4.855 -4.174 1.00 . A A . 41 GLY H 1 1 14 12967 1 1 41 GLY HA2 H -8.604 3.731 -6.618 1.00 . A A . 41 GLY HA2 1 1 14 12968 1 1 41 GLY HA3 H -6.913 3.592 -6.137 1.00 . A A . 41 GLY HA3 1 1 14 12969 1 1 41 GLY N N -8.156 4.553 -4.725 1.00 . A A . 41 GLY N 1 1 14 12970 1 1 41 GLY O O -8.086 1.149 -5.935 1.00 . A A . 41 GLY O 1 1 14 12971 1 1 42 ALA C C -9.628 0.861 -2.093 1.00 . A A . 42 ALA C 1 1 14 12972 1 1 42 ALA CA C -8.835 0.699 -3.392 1.00 . A A . 42 ALA CA 1 1 14 12973 1 1 42 ALA CB C -7.510 -0.005 -3.095 1.00 . A A . 42 ALA CB 1 1 14 12974 1 1 42 ALA H H -8.651 2.846 -3.435 1.00 . A A . 42 ALA H 1 1 14 12975 1 1 42 ALA HA H -9.408 0.108 -4.091 1.00 . A A . 42 ALA HA 1 1 14 12976 1 1 42 ALA HB1 H -6.909 0.615 -2.447 1.00 . A A . 42 ALA HB1 1 1 14 12977 1 1 42 ALA HB2 H -7.706 -0.950 -2.609 1.00 . A A . 42 ALA HB2 1 1 14 12978 1 1 42 ALA HB3 H -6.981 -0.179 -4.019 1.00 . A A . 42 ALA HB3 1 1 14 12979 1 1 42 ALA N N -8.562 2.039 -3.985 1.00 . A A . 42 ALA N 1 1 14 12980 1 1 42 ALA O O -9.286 1.654 -1.239 1.00 . A A . 42 ALA O 1 1 14 12981 1 1 43 SER C C -10.668 -0.153 0.519 1.00 . A A . 43 SER C 1 1 14 12982 1 1 43 SER CA C -11.512 0.223 -0.704 1.00 . A A . 43 SER CA 1 1 14 12983 1 1 43 SER CB C -12.707 -0.727 -0.805 1.00 . A A . 43 SER CB 1 1 14 12984 1 1 43 SER H H -10.947 -0.515 -2.645 1.00 . A A . 43 SER H 1 1 14 12985 1 1 43 SER HA H -11.868 1.236 -0.596 1.00 . A A . 43 SER HA 1 1 14 12986 1 1 43 SER HB2 H -12.603 -1.518 -0.081 1.00 . A A . 43 SER HB2 1 1 14 12987 1 1 43 SER HB3 H -13.619 -0.178 -0.606 1.00 . A A . 43 SER HB3 1 1 14 12988 1 1 43 SER HG H -13.354 -0.762 -2.640 1.00 . A A . 43 SER HG 1 1 14 12989 1 1 43 SER N N -10.689 0.116 -1.942 1.00 . A A . 43 SER N 1 1 14 12990 1 1 43 SER O O -9.555 -0.635 0.402 1.00 . A A . 43 SER O 1 1 14 12991 1 1 43 SER OG O -12.750 -1.288 -2.110 1.00 . A A . 43 SER OG 1 1 14 12992 1 1 44 GLN C C -10.385 -1.787 3.106 1.00 . A A . 44 GLN C 1 1 14 12993 1 1 44 GLN CA C -10.443 -0.268 2.932 1.00 . A A . 44 GLN CA 1 1 14 12994 1 1 44 GLN CB C -11.147 0.358 4.139 1.00 . A A . 44 GLN CB 1 1 14 12995 1 1 44 GLN CD C -10.823 1.295 6.432 1.00 . A A . 44 GLN CD 1 1 14 12996 1 1 44 GLN CG C -10.115 0.696 5.216 1.00 . A A . 44 GLN CG 1 1 14 12997 1 1 44 GLN H H -12.095 0.456 1.759 1.00 . A A . 44 GLN H 1 1 14 12998 1 1 44 GLN HA H -9.439 0.124 2.859 1.00 . A A . 44 GLN HA 1 1 14 12999 1 1 44 GLN HB2 H -11.655 1.262 3.829 1.00 . A A . 44 GLN HB2 1 1 14 13000 1 1 44 GLN HB3 H -11.867 -0.341 4.538 1.00 . A A . 44 GLN HB3 1 1 14 13001 1 1 44 GLN HE21 H -11.896 -0.337 6.786 1.00 . A A . 44 GLN HE21 1 1 14 13002 1 1 44 GLN HE22 H -12.157 0.950 7.861 1.00 . A A . 44 GLN HE22 1 1 14 13003 1 1 44 GLN HG2 H -9.593 -0.204 5.509 1.00 . A A . 44 GLN HG2 1 1 14 13004 1 1 44 GLN HG3 H -9.407 1.412 4.825 1.00 . A A . 44 GLN HG3 1 1 14 13005 1 1 44 GLN N N -11.198 0.068 1.693 1.00 . A A . 44 GLN N 1 1 14 13006 1 1 44 GLN NE2 N -11.698 0.576 7.080 1.00 . A A . 44 GLN NE2 1 1 14 13007 1 1 44 GLN O O -9.371 -2.338 3.479 1.00 . A A . 44 GLN O 1 1 14 13008 1 1 44 GLN OE1 O -10.578 2.428 6.796 1.00 . A A . 44 GLN OE1 1 1 14 13009 1 1 45 GLU C C -10.531 -4.570 1.949 1.00 . A A . 45 GLU C 1 1 14 13010 1 1 45 GLU CA C -11.460 -3.954 2.994 1.00 . A A . 45 GLU CA 1 1 14 13011 1 1 45 GLU CB C -12.873 -4.501 2.795 1.00 . A A . 45 GLU CB 1 1 14 13012 1 1 45 GLU CD C -14.151 -5.128 4.853 1.00 . A A . 45 GLU CD 1 1 14 13013 1 1 45 GLU CG C -13.786 -3.981 3.907 1.00 . A A . 45 GLU CG 1 1 14 13014 1 1 45 GLU H H -12.278 -2.011 2.540 1.00 . A A . 45 GLU H 1 1 14 13015 1 1 45 GLU HA H -11.111 -4.211 3.982 1.00 . A A . 45 GLU HA 1 1 14 13016 1 1 45 GLU HB2 H -13.252 -4.179 1.835 1.00 . A A . 45 GLU HB2 1 1 14 13017 1 1 45 GLU HB3 H -12.845 -5.580 2.828 1.00 . A A . 45 GLU HB3 1 1 14 13018 1 1 45 GLU HG2 H -13.273 -3.207 4.460 1.00 . A A . 45 GLU HG2 1 1 14 13019 1 1 45 GLU HG3 H -14.688 -3.575 3.472 1.00 . A A . 45 GLU HG3 1 1 14 13020 1 1 45 GLU N N -11.466 -2.471 2.839 1.00 . A A . 45 GLU N 1 1 14 13021 1 1 45 GLU O O -9.974 -5.633 2.147 1.00 . A A . 45 GLU O 1 1 14 13022 1 1 45 GLU OE1 O -13.606 -6.205 4.685 1.00 . A A . 45 GLU OE1 1 1 14 13023 1 1 45 GLU OE2 O -14.972 -4.909 5.729 1.00 . A A . 45 GLU OE2 1 1 14 13024 1 1 46 GLU C C -8.045 -3.892 0.134 1.00 . A A . 46 GLU C 1 1 14 13025 1 1 46 GLU CA C -9.421 -4.432 -0.189 1.00 . A A . 46 GLU CA 1 1 14 13026 1 1 46 GLU CB C -9.888 -3.977 -1.578 1.00 . A A . 46 GLU CB 1 1 14 13027 1 1 46 GLU CD C -9.581 -2.262 -3.367 1.00 . A A . 46 GLU CD 1 1 14 13028 1 1 46 GLU CG C -9.397 -2.558 -1.877 1.00 . A A . 46 GLU CG 1 1 14 13029 1 1 46 GLU H H -10.764 -3.027 0.722 1.00 . A A . 46 GLU H 1 1 14 13030 1 1 46 GLU HA H -9.405 -5.510 -0.142 1.00 . A A . 46 GLU HA 1 1 14 13031 1 1 46 GLU HB2 H -9.504 -4.655 -2.326 1.00 . A A . 46 GLU HB2 1 1 14 13032 1 1 46 GLU HB3 H -10.966 -3.989 -1.606 1.00 . A A . 46 GLU HB3 1 1 14 13033 1 1 46 GLU HG2 H -9.966 -1.849 -1.294 1.00 . A A . 46 GLU HG2 1 1 14 13034 1 1 46 GLU HG3 H -8.353 -2.478 -1.625 1.00 . A A . 46 GLU HG3 1 1 14 13035 1 1 46 GLU N N -10.335 -3.898 0.850 1.00 . A A . 46 GLU N 1 1 14 13036 1 1 46 GLU O O -7.036 -4.551 -0.015 1.00 . A A . 46 GLU O 1 1 14 13037 1 1 46 GLU OE1 O -8.735 -2.677 -4.142 1.00 . A A . 46 GLU OE1 1 1 14 13038 1 1 46 GLU OE2 O -10.564 -1.626 -3.708 1.00 . A A . 46 GLU OE2 1 1 14 13039 1 1 47 VAL C C -6.182 -2.908 2.182 1.00 . A A . 47 VAL C 1 1 14 13040 1 1 47 VAL CA C -6.737 -2.076 1.024 1.00 . A A . 47 VAL CA 1 1 14 13041 1 1 47 VAL CB C -6.994 -0.635 1.473 1.00 . A A . 47 VAL CB 1 1 14 13042 1 1 47 VAL CG1 C -5.866 -0.168 2.386 1.00 . A A . 47 VAL CG1 1 1 14 13043 1 1 47 VAL CG2 C -7.063 0.274 0.244 1.00 . A A . 47 VAL CG2 1 1 14 13044 1 1 47 VAL H H -8.859 -2.207 0.761 1.00 . A A . 47 VAL H 1 1 14 13045 1 1 47 VAL HA H -6.046 -2.090 0.194 1.00 . A A . 47 VAL HA 1 1 14 13046 1 1 47 VAL HB H -7.930 -0.589 2.012 1.00 . A A . 47 VAL HB 1 1 14 13047 1 1 47 VAL HG11 H -4.919 -0.354 1.905 1.00 . A A . 47 VAL HG11 1 1 14 13048 1 1 47 VAL HG12 H -5.977 0.888 2.579 1.00 . A A . 47 VAL HG12 1 1 14 13049 1 1 47 VAL HG13 H -5.913 -0.714 3.316 1.00 . A A . 47 VAL HG13 1 1 14 13050 1 1 47 VAL HG21 H -7.384 -0.303 -0.612 1.00 . A A . 47 VAL HG21 1 1 14 13051 1 1 47 VAL HG22 H -7.769 1.071 0.425 1.00 . A A . 47 VAL HG22 1 1 14 13052 1 1 47 VAL HG23 H -6.087 0.693 0.050 1.00 . A A . 47 VAL HG23 1 1 14 13053 1 1 47 VAL N N -8.020 -2.689 0.626 1.00 . A A . 47 VAL N 1 1 14 13054 1 1 47 VAL O O -4.988 -3.071 2.336 1.00 . A A . 47 VAL O 1 1 14 13055 1 1 48 GLU C C -6.103 -5.606 3.582 1.00 . A A . 48 GLU C 1 1 14 13056 1 1 48 GLU CA C -6.641 -4.280 4.119 1.00 . A A . 48 GLU CA 1 1 14 13057 1 1 48 GLU CB C -7.878 -4.523 4.964 1.00 . A A . 48 GLU CB 1 1 14 13058 1 1 48 GLU CD C -8.259 -4.818 7.414 1.00 . A A . 48 GLU CD 1 1 14 13059 1 1 48 GLU CG C -7.687 -3.894 6.337 1.00 . A A . 48 GLU CG 1 1 14 13060 1 1 48 GLU H H -8.012 -3.316 2.846 1.00 . A A . 48 GLU H 1 1 14 13061 1 1 48 GLU HA H -5.886 -3.775 4.702 1.00 . A A . 48 GLU HA 1 1 14 13062 1 1 48 GLU HB2 H -8.732 -4.071 4.479 1.00 . A A . 48 GLU HB2 1 1 14 13063 1 1 48 GLU HB3 H -8.041 -5.572 5.057 1.00 . A A . 48 GLU HB3 1 1 14 13064 1 1 48 GLU HG2 H -6.635 -3.736 6.511 1.00 . A A . 48 GLU HG2 1 1 14 13065 1 1 48 GLU HG3 H -8.202 -2.947 6.364 1.00 . A A . 48 GLU HG3 1 1 14 13066 1 1 48 GLU N N -7.059 -3.448 2.988 1.00 . A A . 48 GLU N 1 1 14 13067 1 1 48 GLU O O -4.960 -5.957 3.797 1.00 . A A . 48 GLU O 1 1 14 13068 1 1 48 GLU OE1 O -7.527 -5.676 7.881 1.00 . A A . 48 GLU OE1 1 1 14 13069 1 1 48 GLU OE2 O -9.419 -4.652 7.754 1.00 . A A . 48 GLU OE2 1 1 14 13070 1 1 49 GLU C C -5.150 -7.374 1.515 1.00 . A A . 49 GLU C 1 1 14 13071 1 1 49 GLU CA C -6.437 -7.632 2.303 1.00 . A A . 49 GLU CA 1 1 14 13072 1 1 49 GLU CB C -7.501 -8.213 1.369 1.00 . A A . 49 GLU CB 1 1 14 13073 1 1 49 GLU CD C -9.415 -8.206 2.975 1.00 . A A . 49 GLU CD 1 1 14 13074 1 1 49 GLU CG C -8.462 -9.092 2.172 1.00 . A A . 49 GLU CG 1 1 14 13075 1 1 49 GLU H H -7.836 -6.036 2.694 1.00 . A A . 49 GLU H 1 1 14 13076 1 1 49 GLU HA H -6.238 -8.328 3.105 1.00 . A A . 49 GLU HA 1 1 14 13077 1 1 49 GLU HB2 H -8.052 -7.407 0.906 1.00 . A A . 49 GLU HB2 1 1 14 13078 1 1 49 GLU HB3 H -7.024 -8.810 0.605 1.00 . A A . 49 GLU HB3 1 1 14 13079 1 1 49 GLU HG2 H -9.030 -9.715 1.497 1.00 . A A . 49 GLU HG2 1 1 14 13080 1 1 49 GLU HG3 H -7.898 -9.717 2.849 1.00 . A A . 49 GLU HG3 1 1 14 13081 1 1 49 GLU N N -6.917 -6.340 2.867 1.00 . A A . 49 GLU N 1 1 14 13082 1 1 49 GLU O O -4.216 -8.151 1.557 1.00 . A A . 49 GLU O 1 1 14 13083 1 1 49 GLU OE1 O -8.946 -7.529 3.876 1.00 . A A . 49 GLU OE1 1 1 14 13084 1 1 49 GLU OE2 O -10.597 -8.218 2.675 1.00 . A A . 49 GLU OE2 1 1 14 13085 1 1 50 ALA C C -2.750 -5.554 0.983 1.00 . A A . 50 ALA C 1 1 14 13086 1 1 50 ALA CA C -3.867 -5.954 0.019 1.00 . A A . 50 ALA CA 1 1 14 13087 1 1 50 ALA CB C -4.159 -4.781 -0.921 1.00 . A A . 50 ALA CB 1 1 14 13088 1 1 50 ALA H H -5.857 -5.666 0.791 1.00 . A A . 50 ALA H 1 1 14 13089 1 1 50 ALA HA H -3.565 -6.817 -0.561 1.00 . A A . 50 ALA HA 1 1 14 13090 1 1 50 ALA HB1 H -5.154 -4.883 -1.326 1.00 . A A . 50 ALA HB1 1 1 14 13091 1 1 50 ALA HB2 H -4.088 -3.854 -0.371 1.00 . A A . 50 ALA HB2 1 1 14 13092 1 1 50 ALA HB3 H -3.440 -4.777 -1.726 1.00 . A A . 50 ALA HB3 1 1 14 13093 1 1 50 ALA N N -5.093 -6.280 0.803 1.00 . A A . 50 ALA N 1 1 14 13094 1 1 50 ALA O O -1.585 -5.540 0.633 1.00 . A A . 50 ALA O 1 1 14 13095 1 1 51 MET C C -1.609 -6.013 3.998 1.00 . A A . 51 MET C 1 1 14 13096 1 1 51 MET CA C -2.075 -4.798 3.187 1.00 . A A . 51 MET CA 1 1 14 13097 1 1 51 MET CB C -2.686 -3.759 4.130 1.00 . A A . 51 MET CB 1 1 14 13098 1 1 51 MET CE C -2.570 -0.821 5.762 1.00 . A A . 51 MET CE 1 1 14 13099 1 1 51 MET CG C -1.633 -3.293 5.136 1.00 . A A . 51 MET CG 1 1 14 13100 1 1 51 MET H H -4.048 -5.226 2.443 1.00 . A A . 51 MET H 1 1 14 13101 1 1 51 MET HA H -1.231 -4.364 2.674 1.00 . A A . 51 MET HA 1 1 14 13102 1 1 51 MET HB2 H -3.033 -2.912 3.554 1.00 . A A . 51 MET HB2 1 1 14 13103 1 1 51 MET HB3 H -3.518 -4.198 4.660 1.00 . A A . 51 MET HB3 1 1 14 13104 1 1 51 MET HE1 H -2.739 -0.928 4.700 1.00 . A A . 51 MET HE1 1 1 14 13105 1 1 51 MET HE2 H -3.391 -0.279 6.202 1.00 . A A . 51 MET HE2 1 1 14 13106 1 1 51 MET HE3 H -1.651 -0.278 5.934 1.00 . A A . 51 MET HE3 1 1 14 13107 1 1 51 MET HG2 H -1.084 -4.147 5.503 1.00 . A A . 51 MET HG2 1 1 14 13108 1 1 51 MET HG3 H -0.953 -2.607 4.653 1.00 . A A . 51 MET HG3 1 1 14 13109 1 1 51 MET N N -3.102 -5.215 2.192 1.00 . A A . 51 MET N 1 1 14 13110 1 1 51 MET O O -0.572 -5.985 4.631 1.00 . A A . 51 MET O 1 1 14 13111 1 1 51 MET SD S -2.449 -2.460 6.521 1.00 . A A . 51 MET SD 1 1 14 13112 1 1 52 ASP C C -1.333 -9.319 3.823 1.00 . A A . 52 ASP C 1 1 14 13113 1 1 52 ASP CA C -1.953 -8.283 4.764 1.00 . A A . 52 ASP CA 1 1 14 13114 1 1 52 ASP CB C -3.178 -8.890 5.453 1.00 . A A . 52 ASP CB 1 1 14 13115 1 1 52 ASP CG C -2.929 -8.967 6.961 1.00 . A A . 52 ASP CG 1 1 14 13116 1 1 52 ASP H H -3.198 -7.085 3.473 1.00 . A A . 52 ASP H 1 1 14 13117 1 1 52 ASP HA H -1.228 -7.997 5.510 1.00 . A A . 52 ASP HA 1 1 14 13118 1 1 52 ASP HB2 H -4.043 -8.272 5.261 1.00 . A A . 52 ASP HB2 1 1 14 13119 1 1 52 ASP HB3 H -3.352 -9.883 5.069 1.00 . A A . 52 ASP HB3 1 1 14 13120 1 1 52 ASP N N -2.363 -7.078 3.988 1.00 . A A . 52 ASP N 1 1 14 13121 1 1 52 ASP O O -0.654 -10.231 4.253 1.00 . A A . 52 ASP O 1 1 14 13122 1 1 52 ASP OD1 O -1.818 -9.294 7.343 1.00 . A A . 52 ASP OD1 1 1 14 13123 1 1 52 ASP OD2 O -3.856 -8.697 7.708 1.00 . A A . 52 ASP OD2 1 1 14 13124 1 1 53 THR C C 0.536 -9.944 1.474 1.00 . A A . 53 THR C 1 1 14 13125 1 1 53 THR CA C -0.973 -10.175 1.588 1.00 . A A . 53 THR CA 1 1 14 13126 1 1 53 THR CB C -1.626 -10.006 0.214 1.00 . A A . 53 THR CB 1 1 14 13127 1 1 53 THR CG2 C -1.371 -8.593 -0.311 1.00 . A A . 53 THR CG2 1 1 14 13128 1 1 53 THR H H -2.104 -8.449 2.212 1.00 . A A . 53 THR H 1 1 14 13129 1 1 53 THR HA H -1.155 -11.176 1.951 1.00 . A A . 53 THR HA 1 1 14 13130 1 1 53 THR HB H -2.689 -10.167 0.299 1.00 . A A . 53 THR HB 1 1 14 13131 1 1 53 THR HG1 H -1.211 -11.830 -0.321 1.00 . A A . 53 THR HG1 1 1 14 13132 1 1 53 THR HG21 H -0.395 -8.259 0.012 1.00 . A A . 53 THR HG21 1 1 14 13133 1 1 53 THR HG22 H -1.411 -8.598 -1.391 1.00 . A A . 53 THR HG22 1 1 14 13134 1 1 53 THR HG23 H -2.126 -7.924 0.074 1.00 . A A . 53 THR HG23 1 1 14 13135 1 1 53 THR N N -1.555 -9.190 2.543 1.00 . A A . 53 THR N 1 1 14 13136 1 1 53 THR O O 1.256 -10.748 0.918 1.00 . A A . 53 THR O 1 1 14 13137 1 1 53 THR OG1 O -1.074 -10.955 -0.690 1.00 . A A . 53 THR OG1 1 1 14 13138 1 1 54 CYS C C 3.233 -9.532 2.850 1.00 . A A . 54 CYS C 1 1 14 13139 1 1 54 CYS CA C 2.482 -8.573 1.926 1.00 . A A . 54 CYS CA 1 1 14 13140 1 1 54 CYS CB C 2.750 -7.134 2.371 1.00 . A A . 54 CYS CB 1 1 14 13141 1 1 54 CYS H H 0.422 -8.217 2.447 1.00 . A A . 54 CYS H 1 1 14 13142 1 1 54 CYS HA H 2.824 -8.707 0.911 1.00 . A A . 54 CYS HA 1 1 14 13143 1 1 54 CYS HB2 H 2.015 -6.476 1.932 1.00 . A A . 54 CYS HB2 1 1 14 13144 1 1 54 CYS HB3 H 2.689 -7.073 3.447 1.00 . A A . 54 CYS HB3 1 1 14 13145 1 1 54 CYS N N 1.020 -8.853 2.001 1.00 . A A . 54 CYS N 1 1 14 13146 1 1 54 CYS O O 2.662 -10.074 3.777 1.00 . A A . 54 CYS O 1 1 14 13147 1 1 54 CYS SG S 4.399 -6.506 1.890 1.00 . A A . 54 CYS SG 1 1 14 13148 1 1 55 PRO C C 5.621 -9.945 4.758 1.00 . A A . 55 PRO C 1 1 14 13149 1 1 55 PRO CA C 5.339 -10.600 3.403 1.00 . A A . 55 PRO CA 1 1 14 13150 1 1 55 PRO CB C 6.621 -10.759 2.584 1.00 . A A . 55 PRO CB 1 1 14 13151 1 1 55 PRO CD C 5.254 -9.085 1.477 1.00 . A A . 55 PRO CD 1 1 14 13152 1 1 55 PRO CG C 6.679 -9.540 1.714 1.00 . A A . 55 PRO CG 1 1 14 13153 1 1 55 PRO HA H 4.861 -11.557 3.533 1.00 . A A . 55 PRO HA 1 1 14 13154 1 1 55 PRO HB2 H 7.467 -10.823 3.257 1.00 . A A . 55 PRO HB2 1 1 14 13155 1 1 55 PRO HB3 H 6.562 -11.661 1.997 1.00 . A A . 55 PRO HB3 1 1 14 13156 1 1 55 PRO HD2 H 5.193 -8.007 1.526 1.00 . A A . 55 PRO HD2 1 1 14 13157 1 1 55 PRO HD3 H 4.896 -9.442 0.525 1.00 . A A . 55 PRO HD3 1 1 14 13158 1 1 55 PRO HG2 H 7.241 -8.762 2.211 1.00 . A A . 55 PRO HG2 1 1 14 13159 1 1 55 PRO HG3 H 7.142 -9.787 0.772 1.00 . A A . 55 PRO HG3 1 1 14 13160 1 1 55 PRO N N 4.497 -9.703 2.573 1.00 . A A . 55 PRO N 1 1 14 13161 1 1 55 PRO O O 4.921 -10.175 5.724 1.00 . A A . 55 PRO O 1 1 14 13162 1 1 56 VAL C C 5.817 -7.452 6.447 1.00 . A A . 56 VAL C 1 1 14 13163 1 1 56 VAL CA C 6.935 -8.448 6.129 1.00 . A A . 56 VAL CA 1 1 14 13164 1 1 56 VAL CB C 8.267 -7.705 6.016 1.00 . A A . 56 VAL CB 1 1 14 13165 1 1 56 VAL CG1 C 8.236 -6.776 4.801 1.00 . A A . 56 VAL CG1 1 1 14 13166 1 1 56 VAL CG2 C 8.494 -6.878 7.282 1.00 . A A . 56 VAL CG2 1 1 14 13167 1 1 56 VAL H H 7.177 -8.938 4.046 1.00 . A A . 56 VAL H 1 1 14 13168 1 1 56 VAL HA H 6.997 -9.186 6.915 1.00 . A A . 56 VAL HA 1 1 14 13169 1 1 56 VAL HB H 9.069 -8.420 5.902 1.00 . A A . 56 VAL HB 1 1 14 13170 1 1 56 VAL HG11 H 7.228 -6.721 4.415 1.00 . A A . 56 VAL HG11 1 1 14 13171 1 1 56 VAL HG12 H 8.563 -5.790 5.093 1.00 . A A . 56 VAL HG12 1 1 14 13172 1 1 56 VAL HG13 H 8.893 -7.162 4.036 1.00 . A A . 56 VAL HG13 1 1 14 13173 1 1 56 VAL HG21 H 7.737 -7.122 8.013 1.00 . A A . 56 VAL HG21 1 1 14 13174 1 1 56 VAL HG22 H 9.471 -7.102 7.688 1.00 . A A . 56 VAL HG22 1 1 14 13175 1 1 56 VAL HG23 H 8.437 -5.827 7.042 1.00 . A A . 56 VAL HG23 1 1 14 13176 1 1 56 VAL N N 6.629 -9.121 4.837 1.00 . A A . 56 VAL N 1 1 14 13177 1 1 56 VAL O O 5.600 -7.089 7.586 1.00 . A A . 56 VAL O 1 1 14 13178 1 1 57 GLN C C 4.574 -4.691 6.097 1.00 . A A . 57 GLN C 1 1 14 13179 1 1 57 GLN CA C 3.996 -6.045 5.679 1.00 . A A . 57 GLN CA 1 1 14 13180 1 1 57 GLN CB C 3.085 -6.575 6.789 1.00 . A A . 57 GLN CB 1 1 14 13181 1 1 57 GLN CD C 0.700 -6.837 7.494 1.00 . A A . 57 GLN CD 1 1 14 13182 1 1 57 GLN CG C 1.629 -6.519 6.321 1.00 . A A . 57 GLN CG 1 1 14 13183 1 1 57 GLN H H 5.298 -7.324 4.536 1.00 . A A . 57 GLN H 1 1 14 13184 1 1 57 GLN HA H 3.424 -5.928 4.768 1.00 . A A . 57 GLN HA 1 1 14 13185 1 1 57 GLN HB2 H 3.353 -7.596 7.017 1.00 . A A . 57 GLN HB2 1 1 14 13186 1 1 57 GLN HB3 H 3.201 -5.965 7.672 1.00 . A A . 57 GLN HB3 1 1 14 13187 1 1 57 GLN HE21 H 1.387 -8.686 7.719 1.00 . A A . 57 GLN HE21 1 1 14 13188 1 1 57 GLN HE22 H 0.165 -8.229 8.806 1.00 . A A . 57 GLN HE22 1 1 14 13189 1 1 57 GLN HG2 H 1.410 -5.531 5.945 1.00 . A A . 57 GLN HG2 1 1 14 13190 1 1 57 GLN HG3 H 1.475 -7.245 5.536 1.00 . A A . 57 GLN HG3 1 1 14 13191 1 1 57 GLN N N 5.106 -7.013 5.445 1.00 . A A . 57 GLN N 1 1 14 13192 1 1 57 GLN NE2 N 0.755 -8.015 8.053 1.00 . A A . 57 GLN NE2 1 1 14 13193 1 1 57 GLN O O 4.117 -4.076 7.040 1.00 . A A . 57 GLN O 1 1 14 13194 1 1 57 GLN OE1 O -0.084 -6.005 7.908 1.00 . A A . 57 GLN OE1 1 1 14 13195 1 1 58 CYS C C 5.160 -1.789 5.463 1.00 . A A . 58 CYS C 1 1 14 13196 1 1 58 CYS CA C 6.170 -2.901 5.759 1.00 . A A . 58 CYS CA 1 1 14 13197 1 1 58 CYS CB C 7.440 -2.674 4.938 1.00 . A A . 58 CYS CB 1 1 14 13198 1 1 58 CYS H H 5.925 -4.727 4.642 1.00 . A A . 58 CYS H 1 1 14 13199 1 1 58 CYS HA H 6.417 -2.891 6.811 1.00 . A A . 58 CYS HA 1 1 14 13200 1 1 58 CYS HB2 H 7.707 -3.588 4.427 1.00 . A A . 58 CYS HB2 1 1 14 13201 1 1 58 CYS HB3 H 7.266 -1.894 4.211 1.00 . A A . 58 CYS HB3 1 1 14 13202 1 1 58 CYS HG H 9.323 -2.959 6.219 1.00 . A A . 58 CYS HG 1 1 14 13203 1 1 58 CYS N N 5.572 -4.217 5.401 1.00 . A A . 58 CYS N 1 1 14 13204 1 1 58 CYS O O 5.394 -0.926 4.640 1.00 . A A . 58 CYS O 1 1 14 13205 1 1 58 CYS SG S 8.789 -2.181 6.039 1.00 . A A . 58 CYS SG 1 1 14 13206 1 1 59 ILE C C 2.513 -0.205 7.224 1.00 . A A . 59 ILE C 1 1 14 13207 1 1 59 ILE CA C 3.002 -0.758 5.883 1.00 . A A . 59 ILE CA 1 1 14 13208 1 1 59 ILE CB C 1.827 -1.378 5.127 1.00 . A A . 59 ILE CB 1 1 14 13209 1 1 59 ILE CD1 C -0.018 -0.735 3.570 1.00 . A A . 59 ILE CD1 1 1 14 13210 1 1 59 ILE CG1 C 0.819 -0.285 4.768 1.00 . A A . 59 ILE CG1 1 1 14 13211 1 1 59 ILE CG2 C 1.151 -2.429 6.010 1.00 . A A . 59 ILE CG2 1 1 14 13212 1 1 59 ILE H H 3.867 -2.516 6.782 1.00 . A A . 59 ILE H 1 1 14 13213 1 1 59 ILE HA H 3.430 0.041 5.297 1.00 . A A . 59 ILE HA 1 1 14 13214 1 1 59 ILE HB H 2.190 -1.847 4.224 1.00 . A A . 59 ILE HB 1 1 14 13215 1 1 59 ILE HD11 H 0.383 -1.658 3.176 1.00 . A A . 59 ILE HD11 1 1 14 13216 1 1 59 ILE HD12 H -1.039 -0.891 3.883 1.00 . A A . 59 ILE HD12 1 1 14 13217 1 1 59 ILE HD13 H 0.012 0.027 2.804 1.00 . A A . 59 ILE HD13 1 1 14 13218 1 1 59 ILE HG12 H 0.173 -0.100 5.614 1.00 . A A . 59 ILE HG12 1 1 14 13219 1 1 59 ILE HG13 H 1.349 0.620 4.515 1.00 . A A . 59 ILE HG13 1 1 14 13220 1 1 59 ILE HG21 H 1.893 -2.905 6.635 1.00 . A A . 59 ILE HG21 1 1 14 13221 1 1 59 ILE HG22 H 0.408 -1.953 6.632 1.00 . A A . 59 ILE HG22 1 1 14 13222 1 1 59 ILE HG23 H 0.678 -3.172 5.386 1.00 . A A . 59 ILE HG23 1 1 14 13223 1 1 59 ILE N N 4.035 -1.807 6.126 1.00 . A A . 59 ILE N 1 1 14 13224 1 1 59 ILE O O 2.672 -0.831 8.253 1.00 . A A . 59 ILE O 1 1 14 13225 1 1 60 HIS C C 0.372 2.595 8.253 1.00 . A A . 60 HIS C 1 1 14 13226 1 1 60 HIS CA C 1.433 1.530 8.520 1.00 . A A . 60 HIS CA 1 1 14 13227 1 1 60 HIS CB C 2.602 2.168 9.277 1.00 . A A . 60 HIS CB 1 1 14 13228 1 1 60 HIS CD2 C 4.277 0.336 10.138 1.00 . A A . 60 HIS CD2 1 1 14 13229 1 1 60 HIS CE1 C 5.620 0.312 8.436 1.00 . A A . 60 HIS CE1 1 1 14 13230 1 1 60 HIS CG C 3.796 1.255 9.239 1.00 . A A . 60 HIS CG 1 1 14 13231 1 1 60 HIS H H 1.793 1.462 6.391 1.00 . A A . 60 HIS H 1 1 14 13232 1 1 60 HIS HA H 1.006 0.740 9.120 1.00 . A A . 60 HIS HA 1 1 14 13233 1 1 60 HIS HB2 H 2.856 3.111 8.814 1.00 . A A . 60 HIS HB2 1 1 14 13234 1 1 60 HIS HB3 H 2.314 2.338 10.304 1.00 . A A . 60 HIS HB3 1 1 14 13235 1 1 60 HIS HD1 H 4.604 1.765 7.347 1.00 . A A . 60 HIS HD1 1 1 14 13236 1 1 60 HIS HD2 H 3.831 0.109 11.095 1.00 . A A . 60 HIS HD2 1 1 14 13237 1 1 60 HIS HE1 H 6.438 0.070 7.774 1.00 . A A . 60 HIS HE1 1 1 14 13238 1 1 60 HIS N N 1.919 0.962 7.229 1.00 . A A . 60 HIS N 1 1 14 13239 1 1 60 HIS ND1 N 4.668 1.223 8.161 1.00 . A A . 60 HIS ND1 1 1 14 13240 1 1 60 HIS NE2 N 5.429 -0.259 9.629 1.00 . A A . 60 HIS NE2 1 1 14 13241 1 1 60 HIS O O 0.419 3.301 7.264 1.00 . A A . 60 HIS O 1 1 14 13242 1 1 61 TRP C C -1.118 5.095 9.467 1.00 . A A . 61 TRP C 1 1 14 13243 1 1 61 TRP CA C -1.635 3.757 8.944 1.00 . A A . 61 TRP CA 1 1 14 13244 1 1 61 TRP CB C -2.896 3.354 9.710 1.00 . A A . 61 TRP CB 1 1 14 13245 1 1 61 TRP CD1 C -2.954 0.870 9.226 1.00 . A A . 61 TRP CD1 1 1 14 13246 1 1 61 TRP CD2 C -4.651 1.991 8.278 1.00 . A A . 61 TRP CD2 1 1 14 13247 1 1 61 TRP CE2 C -4.817 0.635 7.917 1.00 . A A . 61 TRP CE2 1 1 14 13248 1 1 61 TRP CE3 C -5.586 2.923 7.813 1.00 . A A . 61 TRP CE3 1 1 14 13249 1 1 61 TRP CG C -3.468 2.116 9.103 1.00 . A A . 61 TRP CG 1 1 14 13250 1 1 61 TRP CH2 C -6.808 1.161 6.659 1.00 . A A . 61 TRP CH2 1 1 14 13251 1 1 61 TRP CZ2 C -5.882 0.218 7.115 1.00 . A A . 61 TRP CZ2 1 1 14 13252 1 1 61 TRP CZ3 C -6.661 2.511 7.007 1.00 . A A . 61 TRP CZ3 1 1 14 13253 1 1 61 TRP H H -0.592 2.154 9.931 1.00 . A A . 61 TRP H 1 1 14 13254 1 1 61 TRP HA H -1.867 3.851 7.894 1.00 . A A . 61 TRP HA 1 1 14 13255 1 1 61 TRP HB2 H -2.654 3.170 10.742 1.00 . A A . 61 TRP HB2 1 1 14 13256 1 1 61 TRP HB3 H -3.623 4.151 9.649 1.00 . A A . 61 TRP HB3 1 1 14 13257 1 1 61 TRP HD1 H -2.066 0.608 9.782 1.00 . A A . 61 TRP HD1 1 1 14 13258 1 1 61 TRP HE1 H -3.604 -0.977 8.446 1.00 . A A . 61 TRP HE1 1 1 14 13259 1 1 61 TRP HE3 H -5.474 3.963 8.081 1.00 . A A . 61 TRP HE3 1 1 14 13260 1 1 61 TRP HH2 H -7.635 0.849 6.040 1.00 . A A . 61 TRP HH2 1 1 14 13261 1 1 61 TRP HZ2 H -5.990 -0.823 6.849 1.00 . A A . 61 TRP HZ2 1 1 14 13262 1 1 61 TRP HZ3 H -7.376 3.239 6.654 1.00 . A A . 61 TRP HZ3 1 1 14 13263 1 1 61 TRP N N -0.580 2.726 9.135 1.00 . A A . 61 TRP N 1 1 14 13264 1 1 61 TRP NE1 N -3.755 -0.012 8.520 1.00 . A A . 61 TRP NE1 1 1 14 13265 1 1 61 TRP O O 0.026 5.216 9.859 1.00 . A A . 61 TRP O 1 1 14 13266 1 1 62 GLU C C -2.580 8.082 10.793 1.00 . A A . 62 GLU C 1 1 14 13267 1 1 62 GLU CA C -1.475 7.428 9.961 1.00 . A A . 62 GLU CA 1 1 14 13268 1 1 62 GLU CB C -1.120 8.307 8.757 1.00 . A A . 62 GLU CB 1 1 14 13269 1 1 62 GLU CD C 0.169 10.443 8.619 1.00 . A A . 62 GLU CD 1 1 14 13270 1 1 62 GLU CG C -1.096 9.781 9.171 1.00 . A A . 62 GLU CG 1 1 14 13271 1 1 62 GLU H H -2.856 5.992 9.143 1.00 . A A . 62 GLU H 1 1 14 13272 1 1 62 GLU HA H -0.596 7.293 10.576 1.00 . A A . 62 GLU HA 1 1 14 13273 1 1 62 GLU HB2 H -0.147 8.023 8.384 1.00 . A A . 62 GLU HB2 1 1 14 13274 1 1 62 GLU HB3 H -1.856 8.163 7.979 1.00 . A A . 62 GLU HB3 1 1 14 13275 1 1 62 GLU HG2 H -1.968 10.282 8.774 1.00 . A A . 62 GLU HG2 1 1 14 13276 1 1 62 GLU HG3 H -1.096 9.853 10.248 1.00 . A A . 62 GLU HG3 1 1 14 13277 1 1 62 GLU N N -1.939 6.104 9.469 1.00 . A A . 62 GLU N 1 1 14 13278 1 1 62 GLU O O -3.321 8.917 10.313 1.00 . A A . 62 GLU O 1 1 14 13279 1 1 62 GLU OE1 O 1.190 9.778 8.573 1.00 . A A . 62 GLU OE1 1 1 14 13280 1 1 62 GLU OE2 O 0.094 11.604 8.252 1.00 . A A . 62 GLU OE2 1 1 14 13281 1 1 63 ASP C C -3.158 9.517 13.646 1.00 . A A . 63 ASP C 1 1 14 13282 1 1 63 ASP CA C -3.741 8.310 12.907 1.00 . A A . 63 ASP CA 1 1 14 13283 1 1 63 ASP CB C -4.217 7.271 13.924 1.00 . A A . 63 ASP CB 1 1 14 13284 1 1 63 ASP CG C -5.084 7.952 14.983 1.00 . A A . 63 ASP CG 1 1 14 13285 1 1 63 ASP H H -2.080 7.038 12.404 1.00 . A A . 63 ASP H 1 1 14 13286 1 1 63 ASP HA H -4.575 8.627 12.299 1.00 . A A . 63 ASP HA 1 1 14 13287 1 1 63 ASP HB2 H -4.795 6.512 13.418 1.00 . A A . 63 ASP HB2 1 1 14 13288 1 1 63 ASP HB3 H -3.362 6.814 14.400 1.00 . A A . 63 ASP HB3 1 1 14 13289 1 1 63 ASP N N -2.691 7.711 12.039 1.00 . A A . 63 ASP N 1 1 14 13290 1 1 63 ASP O O -2.621 9.395 14.728 1.00 . A A . 63 ASP O 1 1 14 13291 1 1 63 ASP OD1 O -5.690 8.962 14.663 1.00 . A A . 63 ASP OD1 1 1 14 13292 1 1 63 ASP OD2 O -5.128 7.454 16.096 1.00 . A A . 63 ASP OD2 1 1 14 13293 1 1 64 GLU C C -1.173 11.859 13.663 1.00 . A A . 64 GLU C 1 1 14 13294 1 1 64 GLU CA C -2.700 11.893 13.733 1.00 . A A . 64 GLU CA 1 1 14 13295 1 1 64 GLU CB C -3.142 11.919 15.198 1.00 . A A . 64 GLU CB 1 1 14 13296 1 1 64 GLU CD C -5.250 13.253 15.356 1.00 . A A . 64 GLU CD 1 1 14 13297 1 1 64 GLU CG C -3.730 13.293 15.528 1.00 . A A . 64 GLU CG 1 1 14 13298 1 1 64 GLU H H -3.688 10.759 12.190 1.00 . A A . 64 GLU H 1 1 14 13299 1 1 64 GLU HA H -3.064 12.778 13.231 1.00 . A A . 64 GLU HA 1 1 14 13300 1 1 64 GLU HB2 H -3.890 11.157 15.363 1.00 . A A . 64 GLU HB2 1 1 14 13301 1 1 64 GLU HB3 H -2.290 11.732 15.834 1.00 . A A . 64 GLU HB3 1 1 14 13302 1 1 64 GLU HG2 H -3.489 13.550 16.550 1.00 . A A . 64 GLU HG2 1 1 14 13303 1 1 64 GLU HG3 H -3.314 14.032 14.862 1.00 . A A . 64 GLU HG3 1 1 14 13304 1 1 64 GLU N N -3.255 10.682 13.066 1.00 . A A . 64 GLU N 1 1 14 13305 1 1 64 GLU OE1 O -5.726 12.348 14.691 1.00 . A A . 64 GLU OE1 1 1 14 13306 1 1 64 GLU OE2 O -5.910 14.127 15.892 1.00 . A A . 64 GLU OE2 1 1 14 13307 2 2 1 SF4 FE1 FE 5.396 -4.503 -2.427 1.00 . B A . 65 SF4 FE1 1 1 14 13308 2 2 1 SF4 FE2 FE 4.201 -5.941 -0.204 1.00 . B A . 65 SF4 FE2 1 1 14 13309 2 2 1 SF4 FE3 FE 2.814 -4.413 -2.149 1.00 . B A . 65 SF4 FE3 1 1 14 13310 2 2 1 SF4 FE4 FE 4.186 -6.948 -2.919 1.00 . B A . 65 SF4 FE4 1 1 14 13311 2 2 1 SF4 S1 S 2.351 -6.650 -1.196 1.00 . B A . 65 SF4 S1 1 1 14 13312 2 2 1 SF4 S2 S 4.081 -4.700 -3.935 1.00 . B A . 65 SF4 S2 1 1 14 13313 2 2 1 SF4 S3 S 5.997 -6.759 -1.655 1.00 . B A . 65 SF4 S3 1 1 14 13314 2 2 1 SF4 S4 S 4.299 -3.501 -0.789 1.00 . B A . 65 SF4 S4 1 1 15 13315 1 1 1 ALA C C -9.878 9.183 8.086 1.00 . A A . 1 ALA C 1 1 15 13316 1 1 1 ALA CA C -10.391 10.614 8.262 1.00 . A A . 1 ALA CA 1 1 15 13317 1 1 1 ALA CB C -11.629 10.605 9.161 1.00 . A A . 1 ALA CB 1 1 15 13318 1 1 1 ALA HA H -9.620 11.218 8.719 1.00 . A A . 1 ALA HA 1 1 15 13319 1 1 1 ALA HB1 H -12.480 10.255 8.595 1.00 . A A . 1 ALA HB1 1 1 15 13320 1 1 1 ALA HB2 H -11.460 9.948 10.001 1.00 . A A . 1 ALA HB2 1 1 15 13321 1 1 1 ALA HB3 H -11.822 11.605 9.519 1.00 . A A . 1 ALA HB3 1 1 15 13322 1 1 1 ALA N N -10.746 11.183 6.932 1.00 . A A . 1 ALA N 1 1 15 13323 1 1 1 ALA O O -10.373 8.432 7.270 1.00 . A A . 1 ALA O 1 1 15 13324 1 1 2 ARG C C -7.722 7.233 7.339 1.00 . A A . 2 ARG C 1 1 15 13325 1 1 2 ARG CA C -8.345 7.420 8.725 1.00 . A A . 2 ARG CA 1 1 15 13326 1 1 2 ARG CB C -9.477 6.406 8.917 1.00 . A A . 2 ARG CB 1 1 15 13327 1 1 2 ARG CD C -11.465 5.842 10.321 1.00 . A A . 2 ARG CD 1 1 15 13328 1 1 2 ARG CG C -10.178 6.666 10.251 1.00 . A A . 2 ARG CG 1 1 15 13329 1 1 2 ARG CZ C -12.162 4.204 11.965 1.00 . A A . 2 ARG CZ 1 1 15 13330 1 1 2 ARG H H -8.506 9.423 9.500 1.00 . A A . 2 ARG H 1 1 15 13331 1 1 2 ARG HA H -7.591 7.264 9.482 1.00 . A A . 2 ARG HA 1 1 15 13332 1 1 2 ARG HB2 H -10.188 6.505 8.109 1.00 . A A . 2 ARG HB2 1 1 15 13333 1 1 2 ARG HB3 H -9.068 5.407 8.916 1.00 . A A . 2 ARG HB3 1 1 15 13334 1 1 2 ARG HD2 H -12.297 6.443 9.987 1.00 . A A . 2 ARG HD2 1 1 15 13335 1 1 2 ARG HD3 H -11.370 4.974 9.684 1.00 . A A . 2 ARG HD3 1 1 15 13336 1 1 2 ARG HE H -11.511 6.012 12.469 1.00 . A A . 2 ARG HE 1 1 15 13337 1 1 2 ARG HG2 H -9.523 6.384 11.063 1.00 . A A . 2 ARG HG2 1 1 15 13338 1 1 2 ARG HG3 H -10.421 7.716 10.332 1.00 . A A . 2 ARG HG3 1 1 15 13339 1 1 2 ARG HH11 H -10.548 3.272 11.235 1.00 . A A . 2 ARG HH11 1 1 15 13340 1 1 2 ARG HH12 H -11.801 2.239 11.837 1.00 . A A . 2 ARG HH12 1 1 15 13341 1 1 2 ARG HH21 H -13.885 4.856 12.748 1.00 . A A . 2 ARG HH21 1 1 15 13342 1 1 2 ARG HH22 H -13.689 3.136 12.696 1.00 . A A . 2 ARG HH22 1 1 15 13343 1 1 2 ARG N N -8.890 8.801 8.847 1.00 . A A . 2 ARG N 1 1 15 13344 1 1 2 ARG NE N -11.701 5.402 11.726 1.00 . A A . 2 ARG NE 1 1 15 13345 1 1 2 ARG NH1 N -11.448 3.157 11.655 1.00 . A A . 2 ARG NH1 1 1 15 13346 1 1 2 ARG NH2 N -13.337 4.054 12.512 1.00 . A A . 2 ARG NH2 1 1 15 13347 1 1 2 ARG O O -8.334 6.692 6.440 1.00 . A A . 2 ARG O 1 1 15 13348 1 1 3 LYS C C -4.835 6.365 5.918 1.00 . A A . 3 LYS C 1 1 15 13349 1 1 3 LYS CA C -5.838 7.515 5.838 1.00 . A A . 3 LYS CA 1 1 15 13350 1 1 3 LYS CB C -5.105 8.808 5.476 1.00 . A A . 3 LYS CB 1 1 15 13351 1 1 3 LYS CD C -6.058 10.329 3.738 1.00 . A A . 3 LYS CD 1 1 15 13352 1 1 3 LYS CE C -5.253 11.319 2.895 1.00 . A A . 3 LYS CE 1 1 15 13353 1 1 3 LYS CG C -5.232 9.064 3.972 1.00 . A A . 3 LYS CG 1 1 15 13354 1 1 3 LYS H H -6.027 8.101 7.903 1.00 . A A . 3 LYS H 1 1 15 13355 1 1 3 LYS HA H -6.576 7.295 5.084 1.00 . A A . 3 LYS HA 1 1 15 13356 1 1 3 LYS HB2 H -5.541 9.633 6.020 1.00 . A A . 3 LYS HB2 1 1 15 13357 1 1 3 LYS HB3 H -4.061 8.716 5.737 1.00 . A A . 3 LYS HB3 1 1 15 13358 1 1 3 LYS HD2 H -6.970 10.072 3.219 1.00 . A A . 3 LYS HD2 1 1 15 13359 1 1 3 LYS HD3 H -6.301 10.783 4.687 1.00 . A A . 3 LYS HD3 1 1 15 13360 1 1 3 LYS HE2 H -4.413 11.682 3.469 1.00 . A A . 3 LYS HE2 1 1 15 13361 1 1 3 LYS HE3 H -4.893 10.825 2.004 1.00 . A A . 3 LYS HE3 1 1 15 13362 1 1 3 LYS HG2 H -4.248 9.190 3.544 1.00 . A A . 3 LYS HG2 1 1 15 13363 1 1 3 LYS HG3 H -5.723 8.224 3.505 1.00 . A A . 3 LYS HG3 1 1 15 13364 1 1 3 LYS HZ1 H -6.555 12.875 3.363 1.00 . A A . 3 LYS HZ1 1 1 15 13365 1 1 3 LYS HZ2 H -5.553 13.188 2.027 1.00 . A A . 3 LYS HZ2 1 1 15 13366 1 1 3 LYS HZ3 H -6.872 12.132 1.868 1.00 . A A . 3 LYS HZ3 1 1 15 13367 1 1 3 LYS N N -6.505 7.672 7.163 1.00 . A A . 3 LYS N 1 1 15 13368 1 1 3 LYS NZ N -6.124 12.465 2.509 1.00 . A A . 3 LYS NZ 1 1 15 13369 1 1 3 LYS O O -4.980 5.457 6.710 1.00 . A A . 3 LYS O 1 1 15 13370 1 1 4 PHE C C -1.698 5.601 4.132 1.00 . A A . 4 PHE C 1 1 15 13371 1 1 4 PHE CA C -2.807 5.307 5.143 1.00 . A A . 4 PHE CA 1 1 15 13372 1 1 4 PHE CB C -3.484 3.974 4.807 1.00 . A A . 4 PHE CB 1 1 15 13373 1 1 4 PHE CD1 C -4.981 4.553 2.865 1.00 . A A . 4 PHE CD1 1 1 15 13374 1 1 4 PHE CD2 C -2.973 3.261 2.448 1.00 . A A . 4 PHE CD2 1 1 15 13375 1 1 4 PHE CE1 C -5.294 4.507 1.502 1.00 . A A . 4 PHE CE1 1 1 15 13376 1 1 4 PHE CE2 C -3.285 3.214 1.084 1.00 . A A . 4 PHE CE2 1 1 15 13377 1 1 4 PHE CG C -3.820 3.929 3.338 1.00 . A A . 4 PHE CG 1 1 15 13378 1 1 4 PHE CZ C -4.446 3.837 0.612 1.00 . A A . 4 PHE CZ 1 1 15 13379 1 1 4 PHE H H -3.718 7.138 4.475 1.00 . A A . 4 PHE H 1 1 15 13380 1 1 4 PHE HA H -2.380 5.249 6.132 1.00 . A A . 4 PHE HA 1 1 15 13381 1 1 4 PHE HB2 H -2.817 3.160 5.048 1.00 . A A . 4 PHE HB2 1 1 15 13382 1 1 4 PHE HB3 H -4.391 3.877 5.384 1.00 . A A . 4 PHE HB3 1 1 15 13383 1 1 4 PHE HD1 H -5.636 5.068 3.553 1.00 . A A . 4 PHE HD1 1 1 15 13384 1 1 4 PHE HD2 H -2.077 2.780 2.814 1.00 . A A . 4 PHE HD2 1 1 15 13385 1 1 4 PHE HE1 H -6.189 4.987 1.136 1.00 . A A . 4 PHE HE1 1 1 15 13386 1 1 4 PHE HE2 H -2.631 2.697 0.397 1.00 . A A . 4 PHE HE2 1 1 15 13387 1 1 4 PHE HZ H -4.687 3.802 -0.441 1.00 . A A . 4 PHE HZ 1 1 15 13388 1 1 4 PHE N N -3.818 6.397 5.106 1.00 . A A . 4 PHE N 1 1 15 13389 1 1 4 PHE O O -1.712 6.610 3.456 1.00 . A A . 4 PHE O 1 1 15 13390 1 1 5 TYR C C 1.267 3.737 3.213 1.00 . A A . 5 TYR C 1 1 15 13391 1 1 5 TYR CA C 0.368 4.930 3.067 1.00 . A A . 5 TYR CA 1 1 15 13392 1 1 5 TYR CB C 1.172 6.183 3.400 1.00 . A A . 5 TYR CB 1 1 15 13393 1 1 5 TYR CD1 C 2.954 5.390 4.990 1.00 . A A . 5 TYR CD1 1 1 15 13394 1 1 5 TYR CD2 C 1.069 6.628 5.883 1.00 . A A . 5 TYR CD2 1 1 15 13395 1 1 5 TYR CE1 C 3.492 5.278 6.277 1.00 . A A . 5 TYR CE1 1 1 15 13396 1 1 5 TYR CE2 C 1.608 6.515 7.170 1.00 . A A . 5 TYR CE2 1 1 15 13397 1 1 5 TYR CG C 1.744 6.065 4.792 1.00 . A A . 5 TYR CG 1 1 15 13398 1 1 5 TYR CZ C 2.819 5.840 7.368 1.00 . A A . 5 TYR CZ 1 1 15 13399 1 1 5 TYR H H -0.742 3.905 4.571 1.00 . A A . 5 TYR H 1 1 15 13400 1 1 5 TYR HA H -0.017 4.991 2.061 1.00 . A A . 5 TYR HA 1 1 15 13401 1 1 5 TYR HB2 H 1.981 6.284 2.690 1.00 . A A . 5 TYR HB2 1 1 15 13402 1 1 5 TYR HB3 H 0.540 7.040 3.337 1.00 . A A . 5 TYR HB3 1 1 15 13403 1 1 5 TYR HD1 H 3.473 4.955 4.149 1.00 . A A . 5 TYR HD1 1 1 15 13404 1 1 5 TYR HD2 H 0.135 7.149 5.730 1.00 . A A . 5 TYR HD2 1 1 15 13405 1 1 5 TYR HE1 H 4.427 4.758 6.429 1.00 . A A . 5 TYR HE1 1 1 15 13406 1 1 5 TYR HE2 H 1.089 6.948 8.012 1.00 . A A . 5 TYR HE2 1 1 15 13407 1 1 5 TYR HH H 2.713 6.090 9.257 1.00 . A A . 5 TYR HH 1 1 15 13408 1 1 5 TYR N N -0.739 4.725 4.022 1.00 . A A . 5 TYR N 1 1 15 13409 1 1 5 TYR O O 0.989 2.840 3.985 1.00 . A A . 5 TYR O 1 1 15 13410 1 1 5 TYR OH O 3.351 5.729 8.637 1.00 . A A . 5 TYR OH 1 1 15 13411 1 1 6 VAL C C 4.667 2.894 2.605 1.00 . A A . 6 VAL C 1 1 15 13412 1 1 6 VAL CA C 3.205 2.511 2.675 1.00 . A A . 6 VAL CA 1 1 15 13413 1 1 6 VAL CB C 2.940 1.475 1.600 1.00 . A A . 6 VAL CB 1 1 15 13414 1 1 6 VAL CG1 C 3.475 0.162 2.126 1.00 . A A . 6 VAL CG1 1 1 15 13415 1 1 6 VAL CG2 C 1.440 1.329 1.308 1.00 . A A . 6 VAL CG2 1 1 15 13416 1 1 6 VAL H H 2.570 4.412 1.890 1.00 . A A . 6 VAL H 1 1 15 13417 1 1 6 VAL HA H 3.008 2.066 3.639 1.00 . A A . 6 VAL HA 1 1 15 13418 1 1 6 VAL HB H 3.470 1.746 0.695 1.00 . A A . 6 VAL HB 1 1 15 13419 1 1 6 VAL HG11 H 3.680 0.268 3.179 1.00 . A A . 6 VAL HG11 1 1 15 13420 1 1 6 VAL HG12 H 2.739 -0.608 1.980 1.00 . A A . 6 VAL HG12 1 1 15 13421 1 1 6 VAL HG13 H 4.383 -0.088 1.602 1.00 . A A . 6 VAL HG13 1 1 15 13422 1 1 6 VAL HG21 H 0.899 2.142 1.750 1.00 . A A . 6 VAL HG21 1 1 15 13423 1 1 6 VAL HG22 H 1.280 1.333 0.242 1.00 . A A . 6 VAL HG22 1 1 15 13424 1 1 6 VAL HG23 H 1.085 0.396 1.719 1.00 . A A . 6 VAL HG23 1 1 15 13425 1 1 6 VAL N N 2.338 3.687 2.509 1.00 . A A . 6 VAL N 1 1 15 13426 1 1 6 VAL O O 5.040 3.927 2.084 1.00 . A A . 6 VAL O 1 1 15 13427 1 1 7 ASP C C 7.595 1.256 2.168 1.00 . A A . 7 ASP C 1 1 15 13428 1 1 7 ASP CA C 6.946 2.301 3.064 1.00 . A A . 7 ASP CA 1 1 15 13429 1 1 7 ASP CB C 7.531 2.215 4.470 1.00 . A A . 7 ASP CB 1 1 15 13430 1 1 7 ASP CG C 7.487 3.594 5.132 1.00 . A A . 7 ASP CG 1 1 15 13431 1 1 7 ASP H H 5.172 1.207 3.505 1.00 . A A . 7 ASP H 1 1 15 13432 1 1 7 ASP HA H 7.114 3.281 2.653 1.00 . A A . 7 ASP HA 1 1 15 13433 1 1 7 ASP HB2 H 6.948 1.517 5.050 1.00 . A A . 7 ASP HB2 1 1 15 13434 1 1 7 ASP HB3 H 8.554 1.875 4.417 1.00 . A A . 7 ASP HB3 1 1 15 13435 1 1 7 ASP N N 5.501 2.038 3.109 1.00 . A A . 7 ASP N 1 1 15 13436 1 1 7 ASP O O 8.182 0.298 2.626 1.00 . A A . 7 ASP O 1 1 15 13437 1 1 7 ASP OD1 O 7.827 4.559 4.468 1.00 . A A . 7 ASP OD1 1 1 15 13438 1 1 7 ASP OD2 O 7.111 3.661 6.291 1.00 . A A . 7 ASP OD2 1 1 15 13439 1 1 8 GLN C C 9.491 0.089 0.423 1.00 . A A . 8 GLN C 1 1 15 13440 1 1 8 GLN CA C 8.107 0.496 -0.079 1.00 . A A . 8 GLN CA 1 1 15 13441 1 1 8 GLN CB C 8.251 1.186 -1.436 1.00 . A A . 8 GLN CB 1 1 15 13442 1 1 8 GLN CD C 7.967 3.664 -1.271 1.00 . A A . 8 GLN CD 1 1 15 13443 1 1 8 GLN CG C 8.982 2.518 -1.254 1.00 . A A . 8 GLN CG 1 1 15 13444 1 1 8 GLN H H 7.018 2.237 0.557 1.00 . A A . 8 GLN H 1 1 15 13445 1 1 8 GLN HA H 7.481 -0.378 -0.179 1.00 . A A . 8 GLN HA 1 1 15 13446 1 1 8 GLN HB2 H 8.812 0.552 -2.106 1.00 . A A . 8 GLN HB2 1 1 15 13447 1 1 8 GLN HB3 H 7.273 1.372 -1.849 1.00 . A A . 8 GLN HB3 1 1 15 13448 1 1 8 GLN HE21 H 7.992 3.905 0.701 1.00 . A A . 8 GLN HE21 1 1 15 13449 1 1 8 GLN HE22 H 6.956 4.950 -0.145 1.00 . A A . 8 GLN HE22 1 1 15 13450 1 1 8 GLN HG2 H 9.508 2.515 -0.310 1.00 . A A . 8 GLN HG2 1 1 15 13451 1 1 8 GLN HG3 H 9.688 2.655 -2.059 1.00 . A A . 8 GLN HG3 1 1 15 13452 1 1 8 GLN N N 7.495 1.451 0.886 1.00 . A A . 8 GLN N 1 1 15 13453 1 1 8 GLN NE2 N 7.609 4.220 -0.145 1.00 . A A . 8 GLN NE2 1 1 15 13454 1 1 8 GLN O O 10.019 -0.944 0.064 1.00 . A A . 8 GLN O 1 1 15 13455 1 1 8 GLN OE1 O 7.494 4.057 -2.319 1.00 . A A . 8 GLN OE1 1 1 15 13456 1 1 9 ASP C C 11.445 -0.857 2.302 1.00 . A A . 9 ASP C 1 1 15 13457 1 1 9 ASP CA C 11.435 0.580 1.782 1.00 . A A . 9 ASP CA 1 1 15 13458 1 1 9 ASP CB C 11.778 1.538 2.925 1.00 . A A . 9 ASP CB 1 1 15 13459 1 1 9 ASP CG C 13.162 2.145 2.684 1.00 . A A . 9 ASP CG 1 1 15 13460 1 1 9 ASP H H 9.630 1.729 1.521 1.00 . A A . 9 ASP H 1 1 15 13461 1 1 9 ASP HA H 12.165 0.683 0.993 1.00 . A A . 9 ASP HA 1 1 15 13462 1 1 9 ASP HB2 H 11.041 2.327 2.967 1.00 . A A . 9 ASP HB2 1 1 15 13463 1 1 9 ASP HB3 H 11.781 0.997 3.859 1.00 . A A . 9 ASP HB3 1 1 15 13464 1 1 9 ASP N N 10.080 0.903 1.250 1.00 . A A . 9 ASP N 1 1 15 13465 1 1 9 ASP O O 12.378 -1.603 2.077 1.00 . A A . 9 ASP O 1 1 15 13466 1 1 9 ASP OD1 O 14.071 1.392 2.374 1.00 . A A . 9 ASP OD1 1 1 15 13467 1 1 9 ASP OD2 O 13.290 3.351 2.816 1.00 . A A . 9 ASP OD2 1 1 15 13468 1 1 10 GLU C C 9.835 -3.577 2.435 1.00 . A A . 10 GLU C 1 1 15 13469 1 1 10 GLU CA C 10.362 -2.640 3.525 1.00 . A A . 10 GLU CA 1 1 15 13470 1 1 10 GLU CB C 9.434 -2.679 4.742 1.00 . A A . 10 GLU CB 1 1 15 13471 1 1 10 GLU CD C 10.547 -4.658 5.788 1.00 . A A . 10 GLU CD 1 1 15 13472 1 1 10 GLU CG C 9.238 -4.127 5.201 1.00 . A A . 10 GLU CG 1 1 15 13473 1 1 10 GLU H H 9.671 -0.635 3.161 1.00 . A A . 10 GLU H 1 1 15 13474 1 1 10 GLU HA H 11.355 -2.950 3.818 1.00 . A A . 10 GLU HA 1 1 15 13475 1 1 10 GLU HB2 H 9.873 -2.105 5.546 1.00 . A A . 10 GLU HB2 1 1 15 13476 1 1 10 GLU HB3 H 8.478 -2.255 4.479 1.00 . A A . 10 GLU HB3 1 1 15 13477 1 1 10 GLU HG2 H 8.465 -4.162 5.956 1.00 . A A . 10 GLU HG2 1 1 15 13478 1 1 10 GLU HG3 H 8.948 -4.737 4.361 1.00 . A A . 10 GLU HG3 1 1 15 13479 1 1 10 GLU N N 10.414 -1.252 2.993 1.00 . A A . 10 GLU N 1 1 15 13480 1 1 10 GLU O O 9.950 -4.783 2.530 1.00 . A A . 10 GLU O 1 1 15 13481 1 1 10 GLU OE1 O 11.385 -5.096 5.017 1.00 . A A . 10 GLU OE1 1 1 15 13482 1 1 10 GLU OE2 O 10.690 -4.616 7.000 1.00 . A A . 10 GLU OE2 1 1 15 13483 1 1 11 CYS C C 9.856 -4.777 -0.242 1.00 . A A . 11 CYS C 1 1 15 13484 1 1 11 CYS CA C 8.733 -3.891 0.300 1.00 . A A . 11 CYS CA 1 1 15 13485 1 1 11 CYS CB C 8.180 -3.012 -0.826 1.00 . A A . 11 CYS CB 1 1 15 13486 1 1 11 CYS H H 9.184 -2.056 1.336 1.00 . A A . 11 CYS H 1 1 15 13487 1 1 11 CYS HA H 7.941 -4.515 0.687 1.00 . A A . 11 CYS HA 1 1 15 13488 1 1 11 CYS HB2 H 7.370 -2.405 -0.447 1.00 . A A . 11 CYS HB2 1 1 15 13489 1 1 11 CYS HB3 H 8.964 -2.372 -1.206 1.00 . A A . 11 CYS HB3 1 1 15 13490 1 1 11 CYS N N 9.263 -3.031 1.396 1.00 . A A . 11 CYS N 1 1 15 13491 1 1 11 CYS O O 10.982 -4.346 -0.387 1.00 . A A . 11 CYS O 1 1 15 13492 1 1 11 CYS SG S 7.545 -3.962 -2.252 1.00 . A A . 11 CYS SG 1 1 15 13493 1 1 12 ILE C C 10.481 -7.058 -2.579 1.00 . A A . 12 ILE C 1 1 15 13494 1 1 12 ILE CA C 10.621 -6.921 -1.060 1.00 . A A . 12 ILE CA 1 1 15 13495 1 1 12 ILE CB C 10.500 -8.298 -0.395 1.00 . A A . 12 ILE CB 1 1 15 13496 1 1 12 ILE CD1 C 9.696 -10.074 -1.961 1.00 . A A . 12 ILE CD1 1 1 15 13497 1 1 12 ILE CG1 C 9.266 -9.035 -0.925 1.00 . A A . 12 ILE CG1 1 1 15 13498 1 1 12 ILE CG2 C 10.368 -8.119 1.119 1.00 . A A . 12 ILE CG2 1 1 15 13499 1 1 12 ILE H H 8.649 -6.347 -0.408 1.00 . A A . 12 ILE H 1 1 15 13500 1 1 12 ILE HA H 11.589 -6.501 -0.832 1.00 . A A . 12 ILE HA 1 1 15 13501 1 1 12 ILE HB H 11.387 -8.877 -0.610 1.00 . A A . 12 ILE HB 1 1 15 13502 1 1 12 ILE HD11 H 10.302 -9.599 -2.717 1.00 . A A . 12 ILE HD11 1 1 15 13503 1 1 12 ILE HD12 H 10.268 -10.850 -1.475 1.00 . A A . 12 ILE HD12 1 1 15 13504 1 1 12 ILE HD13 H 8.821 -10.507 -2.421 1.00 . A A . 12 ILE HD13 1 1 15 13505 1 1 12 ILE HG12 H 8.765 -9.530 -0.105 1.00 . A A . 12 ILE HG12 1 1 15 13506 1 1 12 ILE HG13 H 8.591 -8.331 -1.382 1.00 . A A . 12 ILE HG13 1 1 15 13507 1 1 12 ILE HG21 H 9.502 -7.512 1.336 1.00 . A A . 12 ILE HG21 1 1 15 13508 1 1 12 ILE HG22 H 10.256 -9.087 1.587 1.00 . A A . 12 ILE HG22 1 1 15 13509 1 1 12 ILE HG23 H 11.253 -7.634 1.503 1.00 . A A . 12 ILE HG23 1 1 15 13510 1 1 12 ILE N N 9.562 -6.015 -0.536 1.00 . A A . 12 ILE N 1 1 15 13511 1 1 12 ILE O O 11.464 -7.181 -3.283 1.00 . A A . 12 ILE O 1 1 15 13512 1 1 13 ALA C C 7.655 -7.665 -4.850 1.00 . A A . 13 ALA C 1 1 15 13513 1 1 13 ALA CA C 9.066 -7.142 -4.564 1.00 . A A . 13 ALA CA 1 1 15 13514 1 1 13 ALA CB C 10.085 -8.115 -5.164 1.00 . A A . 13 ALA CB 1 1 15 13515 1 1 13 ALA H H 8.499 -6.909 -2.499 1.00 . A A . 13 ALA H 1 1 15 13516 1 1 13 ALA HA H 9.187 -6.170 -5.022 1.00 . A A . 13 ALA HA 1 1 15 13517 1 1 13 ALA HB1 H 10.439 -8.785 -4.394 1.00 . A A . 13 ALA HB1 1 1 15 13518 1 1 13 ALA HB2 H 9.617 -8.687 -5.951 1.00 . A A . 13 ALA HB2 1 1 15 13519 1 1 13 ALA HB3 H 10.918 -7.559 -5.569 1.00 . A A . 13 ALA HB3 1 1 15 13520 1 1 13 ALA N N 9.272 -7.024 -3.088 1.00 . A A . 13 ALA N 1 1 15 13521 1 1 13 ALA O O 6.997 -7.223 -5.771 1.00 . A A . 13 ALA O 1 1 15 13522 1 1 14 CYS C C 4.849 -8.022 -4.606 1.00 . A A . 14 CYS C 1 1 15 13523 1 1 14 CYS CA C 5.825 -9.164 -4.327 1.00 . A A . 14 CYS CA 1 1 15 13524 1 1 14 CYS CB C 5.355 -9.968 -3.108 1.00 . A A . 14 CYS CB 1 1 15 13525 1 1 14 CYS H H 7.737 -8.964 -3.347 1.00 . A A . 14 CYS H 1 1 15 13526 1 1 14 CYS HA H 5.861 -9.817 -5.188 1.00 . A A . 14 CYS HA 1 1 15 13527 1 1 14 CYS HB2 H 5.050 -10.953 -3.428 1.00 . A A . 14 CYS HB2 1 1 15 13528 1 1 14 CYS HB3 H 6.172 -10.059 -2.406 1.00 . A A . 14 CYS HB3 1 1 15 13529 1 1 14 CYS N N 7.189 -8.612 -4.080 1.00 . A A . 14 CYS N 1 1 15 13530 1 1 14 CYS O O 5.043 -6.905 -4.170 1.00 . A A . 14 CYS O 1 1 15 13531 1 1 14 CYS SG S 3.946 -9.298 -2.145 1.00 . A A . 14 CYS SG 1 1 15 13532 1 1 15 GLU C C 1.457 -7.585 -5.066 1.00 . A A . 15 GLU C 1 1 15 13533 1 1 15 GLU CA C 2.818 -7.220 -5.658 1.00 . A A . 15 GLU CA 1 1 15 13534 1 1 15 GLU CB C 2.691 -7.077 -7.175 1.00 . A A . 15 GLU CB 1 1 15 13535 1 1 15 GLU CD C 1.284 -8.076 -8.981 1.00 . A A . 15 GLU CD 1 1 15 13536 1 1 15 GLU CG C 2.164 -8.384 -7.769 1.00 . A A . 15 GLU CG 1 1 15 13537 1 1 15 GLU H H 3.669 -9.198 -5.688 1.00 . A A . 15 GLU H 1 1 15 13538 1 1 15 GLU HA H 3.155 -6.285 -5.235 1.00 . A A . 15 GLU HA 1 1 15 13539 1 1 15 GLU HB2 H 2.004 -6.274 -7.403 1.00 . A A . 15 GLU HB2 1 1 15 13540 1 1 15 GLU HB3 H 3.658 -6.855 -7.599 1.00 . A A . 15 GLU HB3 1 1 15 13541 1 1 15 GLU HG2 H 2.997 -9.001 -8.077 1.00 . A A . 15 GLU HG2 1 1 15 13542 1 1 15 GLU HG3 H 1.580 -8.909 -7.028 1.00 . A A . 15 GLU HG3 1 1 15 13543 1 1 15 GLU N N 3.803 -8.291 -5.341 1.00 . A A . 15 GLU N 1 1 15 13544 1 1 15 GLU O O 0.431 -7.100 -5.501 1.00 . A A . 15 GLU O 1 1 15 13545 1 1 15 GLU OE1 O 1.247 -6.924 -9.385 1.00 . A A . 15 GLU OE1 1 1 15 13546 1 1 15 GLU OE2 O 0.661 -8.996 -9.487 1.00 . A A . 15 GLU OE2 1 1 15 13547 1 1 16 SER C C -0.715 -7.571 -3.251 1.00 . A A . 16 SER C 1 1 15 13548 1 1 16 SER CA C 0.136 -8.824 -3.460 1.00 . A A . 16 SER CA 1 1 15 13549 1 1 16 SER CB C 0.393 -9.500 -2.111 1.00 . A A . 16 SER CB 1 1 15 13550 1 1 16 SER H H 2.273 -8.815 -3.737 1.00 . A A . 16 SER H 1 1 15 13551 1 1 16 SER HA H -0.383 -9.510 -4.113 1.00 . A A . 16 SER HA 1 1 15 13552 1 1 16 SER HB2 H 1.440 -9.739 -2.020 1.00 . A A . 16 SER HB2 1 1 15 13553 1 1 16 SER HB3 H 0.109 -8.825 -1.313 1.00 . A A . 16 SER HB3 1 1 15 13554 1 1 16 SER HG H -0.236 -11.186 -2.848 1.00 . A A . 16 SER HG 1 1 15 13555 1 1 16 SER N N 1.435 -8.436 -4.076 1.00 . A A . 16 SER N 1 1 15 13556 1 1 16 SER O O -1.834 -7.482 -3.713 1.00 . A A . 16 SER O 1 1 15 13557 1 1 16 SER OG O -0.370 -10.696 -2.033 1.00 . A A . 16 SER OG 1 1 15 13558 1 1 17 CYS C C -1.417 -4.776 -3.664 1.00 . A A . 17 CYS C 1 1 15 13559 1 1 17 CYS CA C -0.955 -5.346 -2.324 1.00 . A A . 17 CYS CA 1 1 15 13560 1 1 17 CYS CB C -0.053 -4.332 -1.620 1.00 . A A . 17 CYS CB 1 1 15 13561 1 1 17 CYS H H 0.721 -6.691 -2.201 1.00 . A A . 17 CYS H 1 1 15 13562 1 1 17 CYS HA H -1.812 -5.560 -1.705 1.00 . A A . 17 CYS HA 1 1 15 13563 1 1 17 CYS HB2 H -0.642 -3.481 -1.309 1.00 . A A . 17 CYS HB2 1 1 15 13564 1 1 17 CYS HB3 H 0.400 -4.792 -0.754 1.00 . A A . 17 CYS HB3 1 1 15 13565 1 1 17 CYS N N -0.186 -6.599 -2.561 1.00 . A A . 17 CYS N 1 1 15 13566 1 1 17 CYS O O -2.555 -4.379 -3.823 1.00 . A A . 17 CYS O 1 1 15 13567 1 1 17 CYS SG S 1.302 -3.690 -2.670 1.00 . A A . 17 CYS SG 1 1 15 13568 1 1 18 VAL C C -2.200 -4.898 -6.447 1.00 . A A . 18 VAL C 1 1 15 13569 1 1 18 VAL CA C -0.933 -4.193 -5.961 1.00 . A A . 18 VAL CA 1 1 15 13570 1 1 18 VAL CB C 0.199 -4.433 -6.961 1.00 . A A . 18 VAL CB 1 1 15 13571 1 1 18 VAL CG1 C -0.027 -3.568 -8.202 1.00 . A A . 18 VAL CG1 1 1 15 13572 1 1 18 VAL CG2 C 1.536 -4.059 -6.316 1.00 . A A . 18 VAL CG2 1 1 15 13573 1 1 18 VAL H H 0.368 -5.062 -4.483 1.00 . A A . 18 VAL H 1 1 15 13574 1 1 18 VAL HA H -1.121 -3.132 -5.877 1.00 . A A . 18 VAL HA 1 1 15 13575 1 1 18 VAL HB H 0.212 -5.475 -7.247 1.00 . A A . 18 VAL HB 1 1 15 13576 1 1 18 VAL HG11 H -0.900 -2.948 -8.056 1.00 . A A . 18 VAL HG11 1 1 15 13577 1 1 18 VAL HG12 H 0.837 -2.941 -8.367 1.00 . A A . 18 VAL HG12 1 1 15 13578 1 1 18 VAL HG13 H -0.179 -4.205 -9.062 1.00 . A A . 18 VAL HG13 1 1 15 13579 1 1 18 VAL HG21 H 1.401 -3.198 -5.680 1.00 . A A . 18 VAL HG21 1 1 15 13580 1 1 18 VAL HG22 H 1.896 -4.890 -5.727 1.00 . A A . 18 VAL HG22 1 1 15 13581 1 1 18 VAL HG23 H 2.256 -3.827 -7.088 1.00 . A A . 18 VAL HG23 1 1 15 13582 1 1 18 VAL N N -0.543 -4.735 -4.631 1.00 . A A . 18 VAL N 1 1 15 13583 1 1 18 VAL O O -2.967 -4.354 -7.216 1.00 . A A . 18 VAL O 1 1 15 13584 1 1 19 GLU C C -4.798 -6.539 -5.495 1.00 . A A . 19 GLU C 1 1 15 13585 1 1 19 GLU CA C -3.650 -6.837 -6.450 1.00 . A A . 19 GLU CA 1 1 15 13586 1 1 19 GLU CB C -3.375 -8.341 -6.482 1.00 . A A . 19 GLU CB 1 1 15 13587 1 1 19 GLU CD C -4.303 -8.560 -8.791 1.00 . A A . 19 GLU CD 1 1 15 13588 1 1 19 GLU CG C -3.066 -8.770 -7.916 1.00 . A A . 19 GLU CG 1 1 15 13589 1 1 19 GLU H H -1.801 -6.531 -5.384 1.00 . A A . 19 GLU H 1 1 15 13590 1 1 19 GLU HA H -3.922 -6.497 -7.435 1.00 . A A . 19 GLU HA 1 1 15 13591 1 1 19 GLU HB2 H -2.531 -8.566 -5.846 1.00 . A A . 19 GLU HB2 1 1 15 13592 1 1 19 GLU HB3 H -4.245 -8.873 -6.129 1.00 . A A . 19 GLU HB3 1 1 15 13593 1 1 19 GLU HG2 H -2.248 -8.177 -8.301 1.00 . A A . 19 GLU HG2 1 1 15 13594 1 1 19 GLU HG3 H -2.791 -9.814 -7.929 1.00 . A A . 19 GLU HG3 1 1 15 13595 1 1 19 GLU N N -2.429 -6.107 -6.005 1.00 . A A . 19 GLU N 1 1 15 13596 1 1 19 GLU O O -5.945 -6.476 -5.893 1.00 . A A . 19 GLU O 1 1 15 13597 1 1 19 GLU OE1 O -5.398 -8.612 -8.255 1.00 . A A . 19 GLU OE1 1 1 15 13598 1 1 19 GLU OE2 O -4.135 -8.350 -9.981 1.00 . A A . 19 GLU OE2 1 1 15 13599 1 1 20 ILE C C -5.864 -4.494 -3.364 1.00 . A A . 20 ILE C 1 1 15 13600 1 1 20 ILE CA C -5.597 -5.997 -3.291 1.00 . A A . 20 ILE CA 1 1 15 13601 1 1 20 ILE CB C -5.184 -6.377 -1.871 1.00 . A A . 20 ILE CB 1 1 15 13602 1 1 20 ILE CD1 C -3.385 -8.043 -1.480 1.00 . A A . 20 ILE CD1 1 1 15 13603 1 1 20 ILE CG1 C -4.863 -7.847 -1.819 1.00 . A A . 20 ILE CG1 1 1 15 13604 1 1 20 ILE CG2 C -6.326 -6.075 -0.901 1.00 . A A . 20 ILE CG2 1 1 15 13605 1 1 20 ILE H H -3.576 -6.356 -3.941 1.00 . A A . 20 ILE H 1 1 15 13606 1 1 20 ILE HA H -6.491 -6.539 -3.564 1.00 . A A . 20 ILE HA 1 1 15 13607 1 1 20 ILE HB H -4.320 -5.836 -1.588 1.00 . A A . 20 ILE HB 1 1 15 13608 1 1 20 ILE HD11 H -2.877 -7.091 -1.520 1.00 . A A . 20 ILE HD11 1 1 15 13609 1 1 20 ILE HD12 H -3.296 -8.457 -0.487 1.00 . A A . 20 ILE HD12 1 1 15 13610 1 1 20 ILE HD13 H -2.939 -8.720 -2.193 1.00 . A A . 20 ILE HD13 1 1 15 13611 1 1 20 ILE HG12 H -5.467 -8.298 -1.066 1.00 . A A . 20 ILE HG12 1 1 15 13612 1 1 20 ILE HG13 H -5.072 -8.284 -2.772 1.00 . A A . 20 ILE HG13 1 1 15 13613 1 1 20 ILE HG21 H -7.270 -6.178 -1.414 1.00 . A A . 20 ILE HG21 1 1 15 13614 1 1 20 ILE HG22 H -6.288 -6.769 -0.074 1.00 . A A . 20 ILE HG22 1 1 15 13615 1 1 20 ILE HG23 H -6.226 -5.066 -0.530 1.00 . A A . 20 ILE HG23 1 1 15 13616 1 1 20 ILE N N -4.507 -6.325 -4.245 1.00 . A A . 20 ILE N 1 1 15 13617 1 1 20 ILE O O -6.555 -3.934 -2.537 1.00 . A A . 20 ILE O 1 1 15 13618 1 1 21 ALA C C -5.035 -1.898 -5.848 1.00 . A A . 21 ALA C 1 1 15 13619 1 1 21 ALA CA C -5.534 -2.367 -4.480 1.00 . A A . 21 ALA CA 1 1 15 13620 1 1 21 ALA CB C -4.760 -1.640 -3.377 1.00 . A A . 21 ALA CB 1 1 15 13621 1 1 21 ALA H H -4.757 -4.304 -5.013 1.00 . A A . 21 ALA H 1 1 15 13622 1 1 21 ALA HA H -6.586 -2.149 -4.386 1.00 . A A . 21 ALA HA 1 1 15 13623 1 1 21 ALA HB1 H -3.946 -2.263 -3.037 1.00 . A A . 21 ALA HB1 1 1 15 13624 1 1 21 ALA HB2 H -4.365 -0.713 -3.766 1.00 . A A . 21 ALA HB2 1 1 15 13625 1 1 21 ALA HB3 H -5.424 -1.432 -2.551 1.00 . A A . 21 ALA HB3 1 1 15 13626 1 1 21 ALA N N -5.315 -3.834 -4.353 1.00 . A A . 21 ALA N 1 1 15 13627 1 1 21 ALA O O -4.079 -1.154 -5.941 1.00 . A A . 21 ALA O 1 1 15 13628 1 1 22 PRO C C -5.691 -0.518 -8.533 1.00 . A A . 22 PRO C 1 1 15 13629 1 1 22 PRO CA C -5.329 -1.981 -8.261 1.00 . A A . 22 PRO CA 1 1 15 13630 1 1 22 PRO CB C -6.165 -2.925 -9.127 1.00 . A A . 22 PRO CB 1 1 15 13631 1 1 22 PRO CD C -6.866 -3.252 -6.832 1.00 . A A . 22 PRO CD 1 1 15 13632 1 1 22 PRO CG C -7.334 -3.298 -8.270 1.00 . A A . 22 PRO CG 1 1 15 13633 1 1 22 PRO HA H -4.279 -2.153 -8.430 1.00 . A A . 22 PRO HA 1 1 15 13634 1 1 22 PRO HB2 H -6.464 -2.406 -10.029 1.00 . A A . 22 PRO HB2 1 1 15 13635 1 1 22 PRO HB3 H -5.575 -3.788 -9.388 1.00 . A A . 22 PRO HB3 1 1 15 13636 1 1 22 PRO HD2 H -7.645 -2.851 -6.197 1.00 . A A . 22 PRO HD2 1 1 15 13637 1 1 22 PRO HD3 H -6.572 -4.235 -6.499 1.00 . A A . 22 PRO HD3 1 1 15 13638 1 1 22 PRO HG2 H -8.137 -2.590 -8.423 1.00 . A A . 22 PRO HG2 1 1 15 13639 1 1 22 PRO HG3 H -7.664 -4.295 -8.515 1.00 . A A . 22 PRO HG3 1 1 15 13640 1 1 22 PRO N N -5.706 -2.356 -6.871 1.00 . A A . 22 PRO N 1 1 15 13641 1 1 22 PRO O O -6.729 -0.217 -9.088 1.00 . A A . 22 PRO O 1 1 15 13642 1 1 23 GLY C C -4.529 2.659 -7.236 1.00 . A A . 23 GLY C 1 1 15 13643 1 1 23 GLY CA C -5.130 1.834 -8.374 1.00 . A A . 23 GLY CA 1 1 15 13644 1 1 23 GLY H H -4.011 0.125 -7.695 1.00 . A A . 23 GLY H 1 1 15 13645 1 1 23 GLY HA2 H -4.696 2.142 -9.315 1.00 . A A . 23 GLY HA2 1 1 15 13646 1 1 23 GLY HA3 H -6.199 1.987 -8.401 1.00 . A A . 23 GLY HA3 1 1 15 13647 1 1 23 GLY N N -4.841 0.390 -8.143 1.00 . A A . 23 GLY N 1 1 15 13648 1 1 23 GLY O O -4.292 3.843 -7.371 1.00 . A A . 23 GLY O 1 1 15 13649 1 1 24 ALA C C -2.270 2.268 -4.709 1.00 . A A . 24 ALA C 1 1 15 13650 1 1 24 ALA CA C -3.687 2.784 -4.966 1.00 . A A . 24 ALA CA 1 1 15 13651 1 1 24 ALA CB C -4.546 2.557 -3.721 1.00 . A A . 24 ALA CB 1 1 15 13652 1 1 24 ALA H H -4.473 1.085 -6.030 1.00 . A A . 24 ALA H 1 1 15 13653 1 1 24 ALA HA H -3.652 3.839 -5.196 1.00 . A A . 24 ALA HA 1 1 15 13654 1 1 24 ALA HB1 H -4.881 1.531 -3.697 1.00 . A A . 24 ALA HB1 1 1 15 13655 1 1 24 ALA HB2 H -3.962 2.767 -2.838 1.00 . A A . 24 ALA HB2 1 1 15 13656 1 1 24 ALA HB3 H -5.402 3.215 -3.750 1.00 . A A . 24 ALA HB3 1 1 15 13657 1 1 24 ALA N N -4.276 2.040 -6.115 1.00 . A A . 24 ALA N 1 1 15 13658 1 1 24 ALA O O -1.404 2.992 -4.260 1.00 . A A . 24 ALA O 1 1 15 13659 1 1 25 PHE C C -0.044 0.095 -6.117 1.00 . A A . 25 PHE C 1 1 15 13660 1 1 25 PHE CA C -0.677 0.441 -4.769 1.00 . A A . 25 PHE CA 1 1 15 13661 1 1 25 PHE CB C -0.804 -0.830 -3.926 1.00 . A A . 25 PHE CB 1 1 15 13662 1 1 25 PHE CD1 C 1.543 -0.669 -3.030 1.00 . A A . 25 PHE CD1 1 1 15 13663 1 1 25 PHE CD2 C -0.293 -0.852 -1.459 1.00 . A A . 25 PHE CD2 1 1 15 13664 1 1 25 PHE CE1 C 2.450 -0.630 -1.965 1.00 . A A . 25 PHE CE1 1 1 15 13665 1 1 25 PHE CE2 C 0.616 -0.814 -0.394 1.00 . A A . 25 PHE CE2 1 1 15 13666 1 1 25 PHE CG C 0.172 -0.780 -2.778 1.00 . A A . 25 PHE CG 1 1 15 13667 1 1 25 PHE CZ C 1.988 -0.702 -0.650 1.00 . A A . 25 PHE CZ 1 1 15 13668 1 1 25 PHE H H -2.747 0.454 -5.355 1.00 . A A . 25 PHE H 1 1 15 13669 1 1 25 PHE HA H -0.048 1.158 -4.254 1.00 . A A . 25 PHE HA 1 1 15 13670 1 1 25 PHE HB2 H -1.810 -0.904 -3.540 1.00 . A A . 25 PHE HB2 1 1 15 13671 1 1 25 PHE HB3 H -0.591 -1.692 -4.540 1.00 . A A . 25 PHE HB3 1 1 15 13672 1 1 25 PHE HD1 H 1.902 -0.612 -4.048 1.00 . A A . 25 PHE HD1 1 1 15 13673 1 1 25 PHE HD2 H -1.351 -0.937 -1.263 1.00 . A A . 25 PHE HD2 1 1 15 13674 1 1 25 PHE HE1 H 3.505 -0.547 -2.157 1.00 . A A . 25 PHE HE1 1 1 15 13675 1 1 25 PHE HE2 H 0.258 -0.869 0.623 1.00 . A A . 25 PHE HE2 1 1 15 13676 1 1 25 PHE HZ H 2.688 -0.676 0.163 1.00 . A A . 25 PHE HZ 1 1 15 13677 1 1 25 PHE N N -2.032 1.018 -4.992 1.00 . A A . 25 PHE N 1 1 15 13678 1 1 25 PHE O O -0.700 -0.386 -7.020 1.00 . A A . 25 PHE O 1 1 15 13679 1 1 26 ALA C C 3.417 0.225 -7.321 1.00 . A A . 26 ALA C 1 1 15 13680 1 1 26 ALA CA C 1.920 0.032 -7.532 1.00 . A A . 26 ALA CA 1 1 15 13681 1 1 26 ALA CB C 1.428 0.986 -8.622 1.00 . A A . 26 ALA CB 1 1 15 13682 1 1 26 ALA H H 1.729 0.727 -5.507 1.00 . A A . 26 ALA H 1 1 15 13683 1 1 26 ALA HA H 1.720 -0.989 -7.821 1.00 . A A . 26 ALA HA 1 1 15 13684 1 1 26 ALA HB1 H 0.737 1.697 -8.195 1.00 . A A . 26 ALA HB1 1 1 15 13685 1 1 26 ALA HB2 H 2.271 1.514 -9.046 1.00 . A A . 26 ALA HB2 1 1 15 13686 1 1 26 ALA HB3 H 0.931 0.422 -9.398 1.00 . A A . 26 ALA HB3 1 1 15 13687 1 1 26 ALA N N 1.225 0.339 -6.253 1.00 . A A . 26 ALA N 1 1 15 13688 1 1 26 ALA O O 3.831 1.035 -6.525 1.00 . A A . 26 ALA O 1 1 15 13689 1 1 27 MET C C 6.172 0.841 -8.670 1.00 . A A . 27 MET C 1 1 15 13690 1 1 27 MET CA C 5.706 -0.338 -7.828 1.00 . A A . 27 MET CA 1 1 15 13691 1 1 27 MET CB C 6.437 -1.609 -8.269 1.00 . A A . 27 MET CB 1 1 15 13692 1 1 27 MET CE C 6.332 -4.218 -10.063 1.00 . A A . 27 MET CE 1 1 15 13693 1 1 27 MET CG C 5.642 -2.840 -7.827 1.00 . A A . 27 MET CG 1 1 15 13694 1 1 27 MET H H 3.892 -1.159 -8.656 1.00 . A A . 27 MET H 1 1 15 13695 1 1 27 MET HA H 5.912 -0.141 -6.795 1.00 . A A . 27 MET HA 1 1 15 13696 1 1 27 MET HB2 H 6.538 -1.611 -9.345 1.00 . A A . 27 MET HB2 1 1 15 13697 1 1 27 MET HB3 H 7.417 -1.636 -7.816 1.00 . A A . 27 MET HB3 1 1 15 13698 1 1 27 MET HE1 H 6.848 -4.885 -9.385 1.00 . A A . 27 MET HE1 1 1 15 13699 1 1 27 MET HE2 H 6.065 -4.757 -10.958 1.00 . A A . 27 MET HE2 1 1 15 13700 1 1 27 MET HE3 H 6.977 -3.391 -10.323 1.00 . A A . 27 MET HE3 1 1 15 13701 1 1 27 MET HG2 H 6.312 -3.558 -7.378 1.00 . A A . 27 MET HG2 1 1 15 13702 1 1 27 MET HG3 H 4.894 -2.545 -7.107 1.00 . A A . 27 MET HG3 1 1 15 13703 1 1 27 MET N N 4.237 -0.507 -8.016 1.00 . A A . 27 MET N 1 1 15 13704 1 1 27 MET O O 5.540 1.188 -9.647 1.00 . A A . 27 MET O 1 1 15 13705 1 1 27 MET SD S 4.836 -3.587 -9.266 1.00 . A A . 27 MET SD 1 1 15 13706 1 1 28 ASP C C 9.094 2.237 -9.673 1.00 . A A . 28 ASP C 1 1 15 13707 1 1 28 ASP CA C 7.715 2.593 -9.172 1.00 . A A . 28 ASP CA 1 1 15 13708 1 1 28 ASP CB C 7.763 3.866 -8.334 1.00 . A A . 28 ASP CB 1 1 15 13709 1 1 28 ASP CG C 7.185 5.032 -9.138 1.00 . A A . 28 ASP CG 1 1 15 13710 1 1 28 ASP H H 7.825 1.190 -7.548 1.00 . A A . 28 ASP H 1 1 15 13711 1 1 28 ASP HA H 7.040 2.721 -10.005 1.00 . A A . 28 ASP HA 1 1 15 13712 1 1 28 ASP HB2 H 7.181 3.723 -7.430 1.00 . A A . 28 ASP HB2 1 1 15 13713 1 1 28 ASP HB3 H 8.787 4.080 -8.077 1.00 . A A . 28 ASP HB3 1 1 15 13714 1 1 28 ASP N N 7.273 1.466 -8.335 1.00 . A A . 28 ASP N 1 1 15 13715 1 1 28 ASP O O 9.726 1.380 -9.096 1.00 . A A . 28 ASP O 1 1 15 13716 1 1 28 ASP OD1 O 6.582 4.775 -10.168 1.00 . A A . 28 ASP OD1 1 1 15 13717 1 1 28 ASP OD2 O 7.355 6.162 -8.711 1.00 . A A . 28 ASP OD2 1 1 15 13718 1 1 29 PRO C C 11.868 3.437 -10.528 1.00 . A A . 29 PRO C 1 1 15 13719 1 1 29 PRO CA C 10.837 2.639 -11.311 1.00 . A A . 29 PRO CA 1 1 15 13720 1 1 29 PRO CB C 10.699 3.153 -12.742 1.00 . A A . 29 PRO CB 1 1 15 13721 1 1 29 PRO CD C 8.792 3.953 -11.433 1.00 . A A . 29 PRO CD 1 1 15 13722 1 1 29 PRO CG C 9.605 4.182 -12.692 1.00 . A A . 29 PRO CG 1 1 15 13723 1 1 29 PRO HA H 11.068 1.585 -11.304 1.00 . A A . 29 PRO HA 1 1 15 13724 1 1 29 PRO HB2 H 11.643 3.577 -13.058 1.00 . A A . 29 PRO HB2 1 1 15 13725 1 1 29 PRO HB3 H 10.440 2.335 -13.392 1.00 . A A . 29 PRO HB3 1 1 15 13726 1 1 29 PRO HD2 H 8.761 4.857 -10.842 1.00 . A A . 29 PRO HD2 1 1 15 13727 1 1 29 PRO HD3 H 7.801 3.631 -11.673 1.00 . A A . 29 PRO HD3 1 1 15 13728 1 1 29 PRO HG2 H 10.040 5.170 -12.673 1.00 . A A . 29 PRO HG2 1 1 15 13729 1 1 29 PRO HG3 H 8.969 4.075 -13.558 1.00 . A A . 29 PRO HG3 1 1 15 13730 1 1 29 PRO N N 9.509 2.898 -10.720 1.00 . A A . 29 PRO N 1 1 15 13731 1 1 29 PRO O O 13.055 3.185 -10.582 1.00 . A A . 29 PRO O 1 1 15 13732 1 1 30 GLU C C 12.464 4.481 -7.604 1.00 . A A . 30 GLU C 1 1 15 13733 1 1 30 GLU CA C 12.315 5.203 -8.934 1.00 . A A . 30 GLU CA 1 1 15 13734 1 1 30 GLU CB C 11.715 6.592 -8.704 1.00 . A A . 30 GLU CB 1 1 15 13735 1 1 30 GLU CD C 12.117 9.023 -9.105 1.00 . A A . 30 GLU CD 1 1 15 13736 1 1 30 GLU CG C 12.787 7.659 -8.936 1.00 . A A . 30 GLU CG 1 1 15 13737 1 1 30 GLU H H 10.427 4.538 -9.734 1.00 . A A . 30 GLU H 1 1 15 13738 1 1 30 GLU HA H 13.278 5.289 -9.417 1.00 . A A . 30 GLU HA 1 1 15 13739 1 1 30 GLU HB2 H 10.896 6.748 -9.390 1.00 . A A . 30 GLU HB2 1 1 15 13740 1 1 30 GLU HB3 H 11.354 6.664 -7.689 1.00 . A A . 30 GLU HB3 1 1 15 13741 1 1 30 GLU HG2 H 13.457 7.687 -8.088 1.00 . A A . 30 GLU HG2 1 1 15 13742 1 1 30 GLU HG3 H 13.345 7.420 -9.829 1.00 . A A . 30 GLU HG3 1 1 15 13743 1 1 30 GLU N N 11.399 4.386 -9.771 1.00 . A A . 30 GLU N 1 1 15 13744 1 1 30 GLU O O 13.520 4.454 -7.003 1.00 . A A . 30 GLU O 1 1 15 13745 1 1 30 GLU OE1 O 11.061 9.071 -9.713 1.00 . A A . 30 GLU OE1 1 1 15 13746 1 1 30 GLU OE2 O 12.672 9.997 -8.622 1.00 . A A . 30 GLU OE2 1 1 15 13747 1 1 31 ILE C C 11.440 1.616 -6.216 1.00 . A A . 31 ILE C 1 1 15 13748 1 1 31 ILE CA C 11.457 3.099 -5.897 1.00 . A A . 31 ILE CA 1 1 15 13749 1 1 31 ILE CB C 10.267 3.456 -5.005 1.00 . A A . 31 ILE CB 1 1 15 13750 1 1 31 ILE CD1 C 7.783 3.299 -4.961 1.00 . A A . 31 ILE CD1 1 1 15 13751 1 1 31 ILE CG1 C 9.000 3.542 -5.847 1.00 . A A . 31 ILE CG1 1 1 15 13752 1 1 31 ILE CG2 C 10.521 4.806 -4.335 1.00 . A A . 31 ILE CG2 1 1 15 13753 1 1 31 ILE H H 10.577 3.884 -7.685 1.00 . A A . 31 ILE H 1 1 15 13754 1 1 31 ILE HA H 12.353 3.325 -5.390 1.00 . A A . 31 ILE HA 1 1 15 13755 1 1 31 ILE HB H 10.147 2.695 -4.247 1.00 . A A . 31 ILE HB 1 1 15 13756 1 1 31 ILE HD11 H 8.003 2.511 -4.256 1.00 . A A . 31 ILE HD11 1 1 15 13757 1 1 31 ILE HD12 H 7.542 4.205 -4.425 1.00 . A A . 31 ILE HD12 1 1 15 13758 1 1 31 ILE HD13 H 6.943 3.009 -5.575 1.00 . A A . 31 ILE HD13 1 1 15 13759 1 1 31 ILE HG12 H 8.932 4.525 -6.292 1.00 . A A . 31 ILE HG12 1 1 15 13760 1 1 31 ILE HG13 H 9.032 2.795 -6.627 1.00 . A A . 31 ILE HG13 1 1 15 13761 1 1 31 ILE HG21 H 11.120 5.424 -4.988 1.00 . A A . 31 ILE HG21 1 1 15 13762 1 1 31 ILE HG22 H 9.579 5.295 -4.141 1.00 . A A . 31 ILE HG22 1 1 15 13763 1 1 31 ILE HG23 H 11.047 4.653 -3.403 1.00 . A A . 31 ILE HG23 1 1 15 13764 1 1 31 ILE N N 11.405 3.864 -7.163 1.00 . A A . 31 ILE N 1 1 15 13765 1 1 31 ILE O O 11.464 0.792 -5.324 1.00 . A A . 31 ILE O 1 1 15 13766 1 1 32 GLU C C 10.610 -0.941 -6.844 1.00 . A A . 32 GLU C 1 1 15 13767 1 1 32 GLU CA C 11.358 -0.157 -7.905 1.00 . A A . 32 GLU CA 1 1 15 13768 1 1 32 GLU CB C 12.782 -0.696 -8.045 1.00 . A A . 32 GLU CB 1 1 15 13769 1 1 32 GLU CD C 14.901 -0.544 -9.361 1.00 . A A . 32 GLU CD 1 1 15 13770 1 1 32 GLU CG C 13.486 0.014 -9.203 1.00 . A A . 32 GLU CG 1 1 15 13771 1 1 32 GLU H H 11.375 1.974 -8.174 1.00 . A A . 32 GLU H 1 1 15 13772 1 1 32 GLU HA H 10.837 -0.238 -8.846 1.00 . A A . 32 GLU HA 1 1 15 13773 1 1 32 GLU HB2 H 13.326 -0.518 -7.129 1.00 . A A . 32 GLU HB2 1 1 15 13774 1 1 32 GLU HB3 H 12.748 -1.757 -8.244 1.00 . A A . 32 GLU HB3 1 1 15 13775 1 1 32 GLU HG2 H 12.929 -0.149 -10.115 1.00 . A A . 32 GLU HG2 1 1 15 13776 1 1 32 GLU HG3 H 13.538 1.072 -8.998 1.00 . A A . 32 GLU HG3 1 1 15 13777 1 1 32 GLU N N 11.395 1.277 -7.487 1.00 . A A . 32 GLU N 1 1 15 13778 1 1 32 GLU O O 10.978 -2.040 -6.479 1.00 . A A . 32 GLU O 1 1 15 13779 1 1 32 GLU OE1 O 15.024 -1.734 -9.600 1.00 . A A . 32 GLU OE1 1 1 15 13780 1 1 32 GLU OE2 O 15.837 0.228 -9.240 1.00 . A A . 32 GLU OE2 1 1 15 13781 1 1 33 LYS C C 7.402 -0.483 -5.111 1.00 . A A . 33 LYS C 1 1 15 13782 1 1 33 LYS CA C 8.823 -1.032 -5.219 1.00 . A A . 33 LYS CA 1 1 15 13783 1 1 33 LYS CB C 9.544 -0.797 -3.887 1.00 . A A . 33 LYS CB 1 1 15 13784 1 1 33 LYS CD C 11.571 -1.330 -2.528 1.00 . A A . 33 LYS CD 1 1 15 13785 1 1 33 LYS CE C 13.050 -1.704 -2.653 1.00 . A A . 33 LYS CE 1 1 15 13786 1 1 33 LYS CG C 10.872 -1.558 -3.871 1.00 . A A . 33 LYS CG 1 1 15 13787 1 1 33 LYS H H 9.323 0.561 -6.622 1.00 . A A . 33 LYS H 1 1 15 13788 1 1 33 LYS HA H 8.783 -2.092 -5.416 1.00 . A A . 33 LYS HA 1 1 15 13789 1 1 33 LYS HB2 H 9.733 0.260 -3.765 1.00 . A A . 33 LYS HB2 1 1 15 13790 1 1 33 LYS HB3 H 8.921 -1.145 -3.077 1.00 . A A . 33 LYS HB3 1 1 15 13791 1 1 33 LYS HD2 H 11.484 -0.289 -2.250 1.00 . A A . 33 LYS HD2 1 1 15 13792 1 1 33 LYS HD3 H 11.109 -1.946 -1.772 1.00 . A A . 33 LYS HD3 1 1 15 13793 1 1 33 LYS HE2 H 13.136 -2.707 -3.043 1.00 . A A . 33 LYS HE2 1 1 15 13794 1 1 33 LYS HE3 H 13.539 -1.012 -3.324 1.00 . A A . 33 LYS HE3 1 1 15 13795 1 1 33 LYS HG2 H 10.686 -2.613 -4.008 1.00 . A A . 33 LYS HG2 1 1 15 13796 1 1 33 LYS HG3 H 11.505 -1.197 -4.665 1.00 . A A . 33 LYS HG3 1 1 15 13797 1 1 33 LYS HZ1 H 12.984 -1.389 -0.596 1.00 . A A . 33 LYS HZ1 1 1 15 13798 1 1 33 LYS HZ2 H 14.114 -2.557 -1.080 1.00 . A A . 33 LYS HZ2 1 1 15 13799 1 1 33 LYS HZ3 H 14.442 -0.907 -1.324 1.00 . A A . 33 LYS HZ3 1 1 15 13800 1 1 33 LYS N N 9.579 -0.347 -6.314 1.00 . A A . 33 LYS N 1 1 15 13801 1 1 33 LYS NZ N 13.695 -1.634 -1.311 1.00 . A A . 33 LYS NZ 1 1 15 13802 1 1 33 LYS O O 7.150 0.683 -5.350 1.00 . A A . 33 LYS O 1 1 15 13803 1 1 34 ALA C C 4.953 0.333 -3.688 1.00 . A A . 34 ALA C 1 1 15 13804 1 1 34 ALA CA C 5.054 -0.888 -4.607 1.00 . A A . 34 ALA CA 1 1 15 13805 1 1 34 ALA CB C 4.235 -2.037 -4.014 1.00 . A A . 34 ALA CB 1 1 15 13806 1 1 34 ALA H H 6.712 -2.257 -4.556 1.00 . A A . 34 ALA H 1 1 15 13807 1 1 34 ALA HA H 4.659 -0.640 -5.577 1.00 . A A . 34 ALA HA 1 1 15 13808 1 1 34 ALA HB1 H 4.604 -2.977 -4.398 1.00 . A A . 34 ALA HB1 1 1 15 13809 1 1 34 ALA HB2 H 4.329 -2.028 -2.938 1.00 . A A . 34 ALA HB2 1 1 15 13810 1 1 34 ALA HB3 H 3.198 -1.920 -4.287 1.00 . A A . 34 ALA HB3 1 1 15 13811 1 1 34 ALA N N 6.473 -1.326 -4.745 1.00 . A A . 34 ALA N 1 1 15 13812 1 1 34 ALA O O 5.656 0.443 -2.707 1.00 . A A . 34 ALA O 1 1 15 13813 1 1 35 TYR C C 2.413 2.861 -3.224 1.00 . A A . 35 TYR C 1 1 15 13814 1 1 35 TYR CA C 3.872 2.444 -3.136 1.00 . A A . 35 TYR CA 1 1 15 13815 1 1 35 TYR CB C 4.801 3.575 -3.614 1.00 . A A . 35 TYR CB 1 1 15 13816 1 1 35 TYR CD1 C 4.143 3.818 -6.036 1.00 . A A . 35 TYR CD1 1 1 15 13817 1 1 35 TYR CD2 C 3.587 5.597 -4.491 1.00 . A A . 35 TYR CD2 1 1 15 13818 1 1 35 TYR CE1 C 3.545 4.533 -7.079 1.00 . A A . 35 TYR CE1 1 1 15 13819 1 1 35 TYR CE2 C 2.989 6.311 -5.532 1.00 . A A . 35 TYR CE2 1 1 15 13820 1 1 35 TYR CG C 4.163 4.349 -4.743 1.00 . A A . 35 TYR CG 1 1 15 13821 1 1 35 TYR CZ C 2.963 5.780 -6.827 1.00 . A A . 35 TYR CZ 1 1 15 13822 1 1 35 TYR H H 3.484 1.111 -4.777 1.00 . A A . 35 TYR H 1 1 15 13823 1 1 35 TYR HA H 4.094 2.211 -2.097 1.00 . A A . 35 TYR HA 1 1 15 13824 1 1 35 TYR HB2 H 5.001 4.244 -2.790 1.00 . A A . 35 TYR HB2 1 1 15 13825 1 1 35 TYR HB3 H 5.728 3.146 -3.955 1.00 . A A . 35 TYR HB3 1 1 15 13826 1 1 35 TYR HD1 H 4.598 2.863 -6.229 1.00 . A A . 35 TYR HD1 1 1 15 13827 1 1 35 TYR HD2 H 3.602 6.007 -3.491 1.00 . A A . 35 TYR HD2 1 1 15 13828 1 1 35 TYR HE1 H 3.526 4.119 -8.077 1.00 . A A . 35 TYR HE1 1 1 15 13829 1 1 35 TYR HE2 H 2.545 7.277 -5.336 1.00 . A A . 35 TYR HE2 1 1 15 13830 1 1 35 TYR HH H 2.011 5.856 -8.480 1.00 . A A . 35 TYR HH 1 1 15 13831 1 1 35 TYR N N 4.057 1.236 -3.989 1.00 . A A . 35 TYR N 1 1 15 13832 1 1 35 TYR O O 1.653 2.351 -4.022 1.00 . A A . 35 TYR O 1 1 15 13833 1 1 35 TYR OH O 2.372 6.488 -7.853 1.00 . A A . 35 TYR OH 1 1 15 13834 1 1 36 VAL C C 0.404 5.320 -3.398 1.00 . A A . 36 VAL C 1 1 15 13835 1 1 36 VAL CA C 0.596 4.192 -2.380 1.00 . A A . 36 VAL CA 1 1 15 13836 1 1 36 VAL CB C 0.248 4.668 -0.967 1.00 . A A . 36 VAL CB 1 1 15 13837 1 1 36 VAL CG1 C -1.187 4.277 -0.622 1.00 . A A . 36 VAL CG1 1 1 15 13838 1 1 36 VAL CG2 C 1.190 4.006 0.040 1.00 . A A . 36 VAL CG2 1 1 15 13839 1 1 36 VAL H H 2.644 4.134 -1.741 1.00 . A A . 36 VAL H 1 1 15 13840 1 1 36 VAL HA H -0.037 3.358 -2.644 1.00 . A A . 36 VAL HA 1 1 15 13841 1 1 36 VAL HB H 0.363 5.736 -0.913 1.00 . A A . 36 VAL HB 1 1 15 13842 1 1 36 VAL HG11 H -1.394 3.290 -1.007 1.00 . A A . 36 VAL HG11 1 1 15 13843 1 1 36 VAL HG12 H -1.307 4.276 0.452 1.00 . A A . 36 VAL HG12 1 1 15 13844 1 1 36 VAL HG13 H -1.870 4.988 -1.060 1.00 . A A . 36 VAL HG13 1 1 15 13845 1 1 36 VAL HG21 H 1.560 3.077 -0.367 1.00 . A A . 36 VAL HG21 1 1 15 13846 1 1 36 VAL HG22 H 2.019 4.667 0.235 1.00 . A A . 36 VAL HG22 1 1 15 13847 1 1 36 VAL HG23 H 0.661 3.805 0.956 1.00 . A A . 36 VAL HG23 1 1 15 13848 1 1 36 VAL N N 2.014 3.756 -2.388 1.00 . A A . 36 VAL N 1 1 15 13849 1 1 36 VAL O O 0.467 6.489 -3.073 1.00 . A A . 36 VAL O 1 1 15 13850 1 1 37 LYS C C -1.315 6.739 -5.501 1.00 . A A . 37 LYS C 1 1 15 13851 1 1 37 LYS CA C -0.004 5.993 -5.702 1.00 . A A . 37 LYS CA 1 1 15 13852 1 1 37 LYS CB C -0.024 5.305 -7.068 1.00 . A A . 37 LYS CB 1 1 15 13853 1 1 37 LYS CD C -1.379 3.850 -8.584 1.00 . A A . 37 LYS CD 1 1 15 13854 1 1 37 LYS CE C -1.831 4.951 -9.545 1.00 . A A . 37 LYS CE 1 1 15 13855 1 1 37 LYS CG C -1.269 4.420 -7.169 1.00 . A A . 37 LYS CG 1 1 15 13856 1 1 37 LYS H H 0.145 4.014 -4.870 1.00 . A A . 37 LYS H 1 1 15 13857 1 1 37 LYS HA H 0.803 6.700 -5.671 1.00 . A A . 37 LYS HA 1 1 15 13858 1 1 37 LYS HB2 H -0.047 6.052 -7.848 1.00 . A A . 37 LYS HB2 1 1 15 13859 1 1 37 LYS HB3 H 0.859 4.694 -7.178 1.00 . A A . 37 LYS HB3 1 1 15 13860 1 1 37 LYS HD2 H -0.417 3.471 -8.895 1.00 . A A . 37 LYS HD2 1 1 15 13861 1 1 37 LYS HD3 H -2.103 3.049 -8.592 1.00 . A A . 37 LYS HD3 1 1 15 13862 1 1 37 LYS HE2 H -2.904 5.058 -9.491 1.00 . A A . 37 LYS HE2 1 1 15 13863 1 1 37 LYS HE3 H -1.362 5.884 -9.271 1.00 . A A . 37 LYS HE3 1 1 15 13864 1 1 37 LYS HG2 H -1.192 3.610 -6.458 1.00 . A A . 37 LYS HG2 1 1 15 13865 1 1 37 LYS HG3 H -2.147 5.009 -6.951 1.00 . A A . 37 LYS HG3 1 1 15 13866 1 1 37 LYS HZ1 H -1.647 3.581 -11.102 1.00 . A A . 37 LYS HZ1 1 1 15 13867 1 1 37 LYS HZ2 H -1.975 5.166 -11.611 1.00 . A A . 37 LYS HZ2 1 1 15 13868 1 1 37 LYS HZ3 H -0.420 4.755 -11.062 1.00 . A A . 37 LYS HZ3 1 1 15 13869 1 1 37 LYS N N 0.181 4.965 -4.637 1.00 . A A . 37 LYS N 1 1 15 13870 1 1 37 LYS NZ N -1.439 4.586 -10.935 1.00 . A A . 37 LYS NZ 1 1 15 13871 1 1 37 LYS O O -1.569 7.733 -6.152 1.00 . A A . 37 LYS O 1 1 15 13872 1 1 38 ASP C C -4.303 6.284 -3.390 1.00 . A A . 38 ASP C 1 1 15 13873 1 1 38 ASP CA C -3.444 6.998 -4.434 1.00 . A A . 38 ASP CA 1 1 15 13874 1 1 38 ASP CB C -4.173 7.030 -5.775 1.00 . A A . 38 ASP CB 1 1 15 13875 1 1 38 ASP CG C -5.582 7.593 -5.586 1.00 . A A . 38 ASP CG 1 1 15 13876 1 1 38 ASP H H -1.952 5.473 -4.107 1.00 . A A . 38 ASP H 1 1 15 13877 1 1 38 ASP HA H -3.249 8.008 -4.109 1.00 . A A . 38 ASP HA 1 1 15 13878 1 1 38 ASP HB2 H -3.619 7.652 -6.467 1.00 . A A . 38 ASP HB2 1 1 15 13879 1 1 38 ASP HB3 H -4.234 6.026 -6.171 1.00 . A A . 38 ASP HB3 1 1 15 13880 1 1 38 ASP N N -2.158 6.282 -4.624 1.00 . A A . 38 ASP N 1 1 15 13881 1 1 38 ASP O O -4.354 5.073 -3.334 1.00 . A A . 38 ASP O 1 1 15 13882 1 1 38 ASP OD1 O -5.741 8.468 -4.751 1.00 . A A . 38 ASP OD1 1 1 15 13883 1 1 38 ASP OD2 O -6.478 7.141 -6.279 1.00 . A A . 38 ASP OD2 1 1 15 13884 1 1 39 VAL C C -7.207 6.064 -2.127 1.00 . A A . 39 VAL C 1 1 15 13885 1 1 39 VAL CA C -5.843 6.401 -1.521 1.00 . A A . 39 VAL CA 1 1 15 13886 1 1 39 VAL CB C -6.028 7.376 -0.356 1.00 . A A . 39 VAL CB 1 1 15 13887 1 1 39 VAL CG1 C -4.675 7.641 0.307 1.00 . A A . 39 VAL CG1 1 1 15 13888 1 1 39 VAL CG2 C -6.607 8.693 -0.879 1.00 . A A . 39 VAL CG2 1 1 15 13889 1 1 39 VAL H H -4.927 8.006 -2.626 1.00 . A A . 39 VAL H 1 1 15 13890 1 1 39 VAL HA H -5.374 5.496 -1.164 1.00 . A A . 39 VAL HA 1 1 15 13891 1 1 39 VAL HB H -6.704 6.945 0.368 1.00 . A A . 39 VAL HB 1 1 15 13892 1 1 39 VAL HG11 H -4.021 6.798 0.139 1.00 . A A . 39 VAL HG11 1 1 15 13893 1 1 39 VAL HG12 H -4.233 8.529 -0.119 1.00 . A A . 39 VAL HG12 1 1 15 13894 1 1 39 VAL HG13 H -4.815 7.781 1.368 1.00 . A A . 39 VAL HG13 1 1 15 13895 1 1 39 VAL HG21 H -6.505 8.731 -1.953 1.00 . A A . 39 VAL HG21 1 1 15 13896 1 1 39 VAL HG22 H -7.651 8.758 -0.614 1.00 . A A . 39 VAL HG22 1 1 15 13897 1 1 39 VAL HG23 H -6.072 9.521 -0.439 1.00 . A A . 39 VAL HG23 1 1 15 13898 1 1 39 VAL N N -4.982 7.030 -2.562 1.00 . A A . 39 VAL N 1 1 15 13899 1 1 39 VAL O O -7.831 5.085 -1.767 1.00 . A A . 39 VAL O 1 1 15 13900 1 1 40 GLU C C -8.865 5.372 -4.596 1.00 . A A . 40 GLU C 1 1 15 13901 1 1 40 GLU CA C -8.994 6.584 -3.673 1.00 . A A . 40 GLU CA 1 1 15 13902 1 1 40 GLU CB C -9.447 7.800 -4.484 1.00 . A A . 40 GLU CB 1 1 15 13903 1 1 40 GLU CD C -11.448 8.650 -3.249 1.00 . A A . 40 GLU CD 1 1 15 13904 1 1 40 GLU CG C -9.963 8.884 -3.534 1.00 . A A . 40 GLU CG 1 1 15 13905 1 1 40 GLU H H -7.155 7.647 -3.324 1.00 . A A . 40 GLU H 1 1 15 13906 1 1 40 GLU HA H -9.721 6.372 -2.902 1.00 . A A . 40 GLU HA 1 1 15 13907 1 1 40 GLU HB2 H -8.612 8.186 -5.052 1.00 . A A . 40 GLU HB2 1 1 15 13908 1 1 40 GLU HB3 H -10.238 7.510 -5.158 1.00 . A A . 40 GLU HB3 1 1 15 13909 1 1 40 GLU HG2 H -9.408 8.846 -2.607 1.00 . A A . 40 GLU HG2 1 1 15 13910 1 1 40 GLU HG3 H -9.834 9.855 -3.991 1.00 . A A . 40 GLU HG3 1 1 15 13911 1 1 40 GLU N N -7.674 6.864 -3.045 1.00 . A A . 40 GLU N 1 1 15 13912 1 1 40 GLU O O -9.844 4.772 -4.991 1.00 . A A . 40 GLU O 1 1 15 13913 1 1 40 GLU OE1 O -11.928 7.573 -3.559 1.00 . A A . 40 GLU OE1 1 1 15 13914 1 1 40 GLU OE2 O -12.079 9.553 -2.724 1.00 . A A . 40 GLU OE2 1 1 15 13915 1 1 41 GLY C C -7.842 2.553 -5.078 1.00 . A A . 41 GLY C 1 1 15 13916 1 1 41 GLY CA C -7.466 3.829 -5.832 1.00 . A A . 41 GLY CA 1 1 15 13917 1 1 41 GLY H H -6.883 5.501 -4.606 1.00 . A A . 41 GLY H 1 1 15 13918 1 1 41 GLY HA2 H -8.094 3.933 -6.706 1.00 . A A . 41 GLY HA2 1 1 15 13919 1 1 41 GLY HA3 H -6.431 3.773 -6.135 1.00 . A A . 41 GLY HA3 1 1 15 13920 1 1 41 GLY N N -7.661 5.005 -4.939 1.00 . A A . 41 GLY N 1 1 15 13921 1 1 41 GLY O O -8.235 1.565 -5.666 1.00 . A A . 41 GLY O 1 1 15 13922 1 1 42 ALA C C -9.010 1.763 -1.835 1.00 . A A . 42 ALA C 1 1 15 13923 1 1 42 ALA CA C -8.084 1.358 -2.982 1.00 . A A . 42 ALA CA 1 1 15 13924 1 1 42 ALA CB C -6.812 0.726 -2.416 1.00 . A A . 42 ALA CB 1 1 15 13925 1 1 42 ALA H H -7.414 3.377 -3.323 1.00 . A A . 42 ALA H 1 1 15 13926 1 1 42 ALA HA H -8.589 0.646 -3.618 1.00 . A A . 42 ALA HA 1 1 15 13927 1 1 42 ALA HB1 H -6.166 1.500 -2.029 1.00 . A A . 42 ALA HB1 1 1 15 13928 1 1 42 ALA HB2 H -7.072 0.044 -1.620 1.00 . A A . 42 ALA HB2 1 1 15 13929 1 1 42 ALA HB3 H -6.298 0.187 -3.199 1.00 . A A . 42 ALA HB3 1 1 15 13930 1 1 42 ALA N N -7.729 2.568 -3.778 1.00 . A A . 42 ALA N 1 1 15 13931 1 1 42 ALA O O -8.882 2.831 -1.270 1.00 . A A . 42 ALA O 1 1 15 13932 1 1 43 SER C C -10.303 0.805 0.958 1.00 . A A . 43 SER C 1 1 15 13933 1 1 43 SER CA C -10.881 1.268 -0.382 1.00 . A A . 43 SER CA 1 1 15 13934 1 1 43 SER CB C -12.225 0.580 -0.622 1.00 . A A . 43 SER CB 1 1 15 13935 1 1 43 SER H H -10.037 0.068 -1.958 1.00 . A A . 43 SER H 1 1 15 13936 1 1 43 SER HA H -11.026 2.337 -0.358 1.00 . A A . 43 SER HA 1 1 15 13937 1 1 43 SER HB2 H -12.491 -0.006 0.241 1.00 . A A . 43 SER HB2 1 1 15 13938 1 1 43 SER HB3 H -12.984 1.331 -0.793 1.00 . A A . 43 SER HB3 1 1 15 13939 1 1 43 SER HG H -12.831 -0.916 -1.708 1.00 . A A . 43 SER HG 1 1 15 13940 1 1 43 SER N N -9.945 0.922 -1.487 1.00 . A A . 43 SER N 1 1 15 13941 1 1 43 SER O O -9.463 -0.076 1.021 1.00 . A A . 43 SER O 1 1 15 13942 1 1 43 SER OG O -12.120 -0.272 -1.755 1.00 . A A . 43 SER OG 1 1 15 13943 1 1 44 GLN C C -10.389 -0.515 3.533 1.00 . A A . 44 GLN C 1 1 15 13944 1 1 44 GLN CA C -10.246 0.997 3.371 1.00 . A A . 44 GLN CA 1 1 15 13945 1 1 44 GLN CB C -11.049 1.712 4.461 1.00 . A A . 44 GLN CB 1 1 15 13946 1 1 44 GLN CD C -13.477 2.238 4.185 1.00 . A A . 44 GLN CD 1 1 15 13947 1 1 44 GLN CG C -12.468 1.139 4.519 1.00 . A A . 44 GLN CG 1 1 15 13948 1 1 44 GLN H H -11.433 2.098 1.957 1.00 . A A . 44 GLN H 1 1 15 13949 1 1 44 GLN HA H -9.204 1.270 3.455 1.00 . A A . 44 GLN HA 1 1 15 13950 1 1 44 GLN HB2 H -10.565 1.570 5.416 1.00 . A A . 44 GLN HB2 1 1 15 13951 1 1 44 GLN HB3 H -11.100 2.766 4.235 1.00 . A A . 44 GLN HB3 1 1 15 13952 1 1 44 GLN HE21 H -12.857 3.441 5.638 1.00 . A A . 44 GLN HE21 1 1 15 13953 1 1 44 GLN HE22 H -14.131 4.043 4.691 1.00 . A A . 44 GLN HE22 1 1 15 13954 1 1 44 GLN HG2 H -12.563 0.334 3.804 1.00 . A A . 44 GLN HG2 1 1 15 13955 1 1 44 GLN HG3 H -12.664 0.762 5.511 1.00 . A A . 44 GLN HG3 1 1 15 13956 1 1 44 GLN N N -10.755 1.394 2.033 1.00 . A A . 44 GLN N 1 1 15 13957 1 1 44 GLN NE2 N -13.490 3.332 4.897 1.00 . A A . 44 GLN NE2 1 1 15 13958 1 1 44 GLN O O -9.694 -1.131 4.313 1.00 . A A . 44 GLN O 1 1 15 13959 1 1 44 GLN OE1 O -14.264 2.102 3.270 1.00 . A A . 44 GLN OE1 1 1 15 13960 1 1 45 GLU C C -10.452 -3.284 1.987 1.00 . A A . 45 GLU C 1 1 15 13961 1 1 45 GLU CA C -11.467 -2.594 2.898 1.00 . A A . 45 GLU CA 1 1 15 13962 1 1 45 GLU CB C -12.885 -2.966 2.456 1.00 . A A . 45 GLU CB 1 1 15 13963 1 1 45 GLU CD C -13.605 -3.470 4.795 1.00 . A A . 45 GLU CD 1 1 15 13964 1 1 45 GLU CG C -13.877 -2.605 3.563 1.00 . A A . 45 GLU CG 1 1 15 13965 1 1 45 GLU H H -11.828 -0.600 2.167 1.00 . A A . 45 GLU H 1 1 15 13966 1 1 45 GLU HA H -11.311 -2.907 3.919 1.00 . A A . 45 GLU HA 1 1 15 13967 1 1 45 GLU HB2 H -13.135 -2.424 1.556 1.00 . A A . 45 GLU HB2 1 1 15 13968 1 1 45 GLU HB3 H -12.935 -4.026 2.264 1.00 . A A . 45 GLU HB3 1 1 15 13969 1 1 45 GLU HG2 H -13.762 -1.561 3.822 1.00 . A A . 45 GLU HG2 1 1 15 13970 1 1 45 GLU HG3 H -14.883 -2.782 3.216 1.00 . A A . 45 GLU HG3 1 1 15 13971 1 1 45 GLU N N -11.282 -1.118 2.794 1.00 . A A . 45 GLU N 1 1 15 13972 1 1 45 GLU O O -10.077 -4.423 2.199 1.00 . A A . 45 GLU O 1 1 15 13973 1 1 45 GLU OE1 O -13.818 -4.668 4.710 1.00 . A A . 45 GLU OE1 1 1 15 13974 1 1 45 GLU OE2 O -13.188 -2.920 5.800 1.00 . A A . 45 GLU OE2 1 1 15 13975 1 1 46 GLU C C -7.617 -2.883 0.711 1.00 . A A . 46 GLU C 1 1 15 13976 1 1 46 GLU CA C -8.961 -3.180 0.091 1.00 . A A . 46 GLU CA 1 1 15 13977 1 1 46 GLU CB C -9.051 -2.538 -1.295 1.00 . A A . 46 GLU CB 1 1 15 13978 1 1 46 GLU CD C -10.567 -2.051 -3.219 1.00 . A A . 46 GLU CD 1 1 15 13979 1 1 46 GLU CG C -10.495 -2.606 -1.796 1.00 . A A . 46 GLU CG 1 1 15 13980 1 1 46 GLU H H -10.258 -1.655 0.867 1.00 . A A . 46 GLU H 1 1 15 13981 1 1 46 GLU HA H -9.110 -4.248 0.018 1.00 . A A . 46 GLU HA 1 1 15 13982 1 1 46 GLU HB2 H -8.738 -1.506 -1.235 1.00 . A A . 46 GLU HB2 1 1 15 13983 1 1 46 GLU HB3 H -8.410 -3.070 -1.981 1.00 . A A . 46 GLU HB3 1 1 15 13984 1 1 46 GLU HG2 H -10.828 -3.634 -1.791 1.00 . A A . 46 GLU HG2 1 1 15 13985 1 1 46 GLU HG3 H -11.128 -2.018 -1.149 1.00 . A A . 46 GLU HG3 1 1 15 13986 1 1 46 GLU N N -9.975 -2.586 0.994 1.00 . A A . 46 GLU N 1 1 15 13987 1 1 46 GLU O O -6.839 -3.767 1.012 1.00 . A A . 46 GLU O 1 1 15 13988 1 1 46 GLU OE1 O -9.549 -2.066 -3.892 1.00 . A A . 46 GLU OE1 1 1 15 13989 1 1 46 GLU OE2 O -11.639 -1.621 -3.613 1.00 . A A . 46 GLU OE2 1 1 15 13990 1 1 47 VAL C C -5.918 -2.177 2.821 1.00 . A A . 47 VAL C 1 1 15 13991 1 1 47 VAL CA C -6.088 -1.261 1.601 1.00 . A A . 47 VAL CA 1 1 15 13992 1 1 47 VAL CB C -6.174 0.207 2.030 1.00 . A A . 47 VAL CB 1 1 15 13993 1 1 47 VAL CG1 C -5.229 0.467 3.196 1.00 . A A . 47 VAL CG1 1 1 15 13994 1 1 47 VAL CG2 C -5.788 1.104 0.852 1.00 . A A . 47 VAL CG2 1 1 15 13995 1 1 47 VAL H H -8.008 -0.946 0.724 1.00 . A A . 47 VAL H 1 1 15 13996 1 1 47 VAL HA H -5.264 -1.402 0.917 1.00 . A A . 47 VAL HA 1 1 15 13997 1 1 47 VAL HB H -7.186 0.429 2.335 1.00 . A A . 47 VAL HB 1 1 15 13998 1 1 47 VAL HG11 H -4.230 0.167 2.919 1.00 . A A . 47 VAL HG11 1 1 15 13999 1 1 47 VAL HG12 H -5.241 1.517 3.437 1.00 . A A . 47 VAL HG12 1 1 15 14000 1 1 47 VAL HG13 H -5.556 -0.105 4.052 1.00 . A A . 47 VAL HG13 1 1 15 14001 1 1 47 VAL HG21 H -6.047 0.614 -0.074 1.00 . A A . 47 VAL HG21 1 1 15 14002 1 1 47 VAL HG22 H -6.322 2.041 0.924 1.00 . A A . 47 VAL HG22 1 1 15 14003 1 1 47 VAL HG23 H -4.725 1.293 0.876 1.00 . A A . 47 VAL HG23 1 1 15 14004 1 1 47 VAL N N -7.357 -1.632 0.948 1.00 . A A . 47 VAL N 1 1 15 14005 1 1 47 VAL O O -4.819 -2.500 3.226 1.00 . A A . 47 VAL O 1 1 15 14006 1 1 48 GLU C C -6.478 -4.880 4.119 1.00 . A A . 48 GLU C 1 1 15 14007 1 1 48 GLU CA C -6.968 -3.503 4.559 1.00 . A A . 48 GLU CA 1 1 15 14008 1 1 48 GLU CB C -8.387 -3.617 5.080 1.00 . A A . 48 GLU CB 1 1 15 14009 1 1 48 GLU CD C -9.384 -3.915 7.346 1.00 . A A . 48 GLU CD 1 1 15 14010 1 1 48 GLU CG C -8.463 -3.047 6.488 1.00 . A A . 48 GLU CG 1 1 15 14011 1 1 48 GLU H H -7.890 -2.345 3.055 1.00 . A A . 48 GLU H 1 1 15 14012 1 1 48 GLU HA H -6.323 -3.097 5.323 1.00 . A A . 48 GLU HA 1 1 15 14013 1 1 48 GLU HB2 H -9.047 -3.065 4.431 1.00 . A A . 48 GLU HB2 1 1 15 14014 1 1 48 GLU HB3 H -8.677 -4.642 5.082 1.00 . A A . 48 GLU HB3 1 1 15 14015 1 1 48 GLU HG2 H -7.473 -3.031 6.916 1.00 . A A . 48 GLU HG2 1 1 15 14016 1 1 48 GLU HG3 H -8.852 -2.042 6.443 1.00 . A A . 48 GLU HG3 1 1 15 14017 1 1 48 GLU N N -7.015 -2.607 3.396 1.00 . A A . 48 GLU N 1 1 15 14018 1 1 48 GLU O O -5.389 -5.301 4.455 1.00 . A A . 48 GLU O 1 1 15 14019 1 1 48 GLU OE1 O -10.063 -4.759 6.784 1.00 . A A . 48 GLU OE1 1 1 15 14020 1 1 48 GLU OE2 O -9.396 -3.721 8.549 1.00 . A A . 48 GLU OE2 1 1 15 14021 1 1 49 GLU C C -5.421 -6.865 2.382 1.00 . A A . 49 GLU C 1 1 15 14022 1 1 49 GLU CA C -6.857 -6.940 2.904 1.00 . A A . 49 GLU CA 1 1 15 14023 1 1 49 GLU CB C -7.788 -7.413 1.786 1.00 . A A . 49 GLU CB 1 1 15 14024 1 1 49 GLU CD C -9.898 -8.653 1.284 1.00 . A A . 49 GLU CD 1 1 15 14025 1 1 49 GLU CG C -9.035 -8.055 2.396 1.00 . A A . 49 GLU CG 1 1 15 14026 1 1 49 GLU H H -8.154 -5.231 3.107 1.00 . A A . 49 GLU H 1 1 15 14027 1 1 49 GLU HA H -6.903 -7.634 3.731 1.00 . A A . 49 GLU HA 1 1 15 14028 1 1 49 GLU HB2 H -8.077 -6.569 1.178 1.00 . A A . 49 GLU HB2 1 1 15 14029 1 1 49 GLU HB3 H -7.274 -8.139 1.173 1.00 . A A . 49 GLU HB3 1 1 15 14030 1 1 49 GLU HG2 H -8.739 -8.835 3.083 1.00 . A A . 49 GLU HG2 1 1 15 14031 1 1 49 GLU HG3 H -9.603 -7.305 2.925 1.00 . A A . 49 GLU HG3 1 1 15 14032 1 1 49 GLU N N -7.279 -5.588 3.367 1.00 . A A . 49 GLU N 1 1 15 14033 1 1 49 GLU O O -4.586 -7.685 2.712 1.00 . A A . 49 GLU O 1 1 15 14034 1 1 49 GLU OE1 O -9.334 -9.100 0.298 1.00 . A A . 49 GLU OE1 1 1 15 14035 1 1 49 GLU OE2 O -11.109 -8.654 1.436 1.00 . A A . 49 GLU OE2 1 1 15 14036 1 1 50 ALA C C -2.755 -5.712 2.200 1.00 . A A . 50 ALA C 1 1 15 14037 1 1 50 ALA CA C -3.743 -5.756 1.034 1.00 . A A . 50 ALA CA 1 1 15 14038 1 1 50 ALA CB C -3.629 -4.463 0.221 1.00 . A A . 50 ALA CB 1 1 15 14039 1 1 50 ALA H H -5.811 -5.233 1.322 1.00 . A A . 50 ALA H 1 1 15 14040 1 1 50 ALA HA H -3.521 -6.603 0.400 1.00 . A A . 50 ALA HA 1 1 15 14041 1 1 50 ALA HB1 H -4.572 -4.259 -0.265 1.00 . A A . 50 ALA HB1 1 1 15 14042 1 1 50 ALA HB2 H -3.379 -3.645 0.880 1.00 . A A . 50 ALA HB2 1 1 15 14043 1 1 50 ALA HB3 H -2.858 -4.574 -0.524 1.00 . A A . 50 ALA HB3 1 1 15 14044 1 1 50 ALA N N -5.126 -5.886 1.572 1.00 . A A . 50 ALA N 1 1 15 14045 1 1 50 ALA O O -1.637 -6.178 2.101 1.00 . A A . 50 ALA O 1 1 15 14046 1 1 51 MET C C -1.992 -6.487 5.019 1.00 . A A . 51 MET C 1 1 15 14047 1 1 51 MET CA C -2.259 -5.076 4.488 1.00 . A A . 51 MET CA 1 1 15 14048 1 1 51 MET CB C -2.929 -4.237 5.580 1.00 . A A . 51 MET CB 1 1 15 14049 1 1 51 MET CE C -2.194 -1.211 7.081 1.00 . A A . 51 MET CE 1 1 15 14050 1 1 51 MET CG C -1.905 -3.884 6.662 1.00 . A A . 51 MET CG 1 1 15 14051 1 1 51 MET H H -4.069 -4.786 3.360 1.00 . A A . 51 MET H 1 1 15 14052 1 1 51 MET HA H -1.327 -4.615 4.199 1.00 . A A . 51 MET HA 1 1 15 14053 1 1 51 MET HB2 H -3.322 -3.329 5.146 1.00 . A A . 51 MET HB2 1 1 15 14054 1 1 51 MET HB3 H -3.737 -4.801 6.024 1.00 . A A . 51 MET HB3 1 1 15 14055 1 1 51 MET HE1 H -1.487 -1.409 6.289 1.00 . A A . 51 MET HE1 1 1 15 14056 1 1 51 MET HE2 H -3.069 -0.737 6.669 1.00 . A A . 51 MET HE2 1 1 15 14057 1 1 51 MET HE3 H -1.745 -0.558 7.817 1.00 . A A . 51 MET HE3 1 1 15 14058 1 1 51 MET HG2 H -1.579 -4.787 7.158 1.00 . A A . 51 MET HG2 1 1 15 14059 1 1 51 MET HG3 H -1.056 -3.397 6.209 1.00 . A A . 51 MET HG3 1 1 15 14060 1 1 51 MET N N -3.164 -5.154 3.307 1.00 . A A . 51 MET N 1 1 15 14061 1 1 51 MET O O -0.867 -6.940 5.064 1.00 . A A . 51 MET O 1 1 15 14062 1 1 51 MET SD S -2.665 -2.770 7.872 1.00 . A A . 51 MET SD 1 1 15 14063 1 1 52 ASP C C -1.894 -9.348 5.020 1.00 . A A . 52 ASP C 1 1 15 14064 1 1 52 ASP CA C -2.822 -8.564 5.952 1.00 . A A . 52 ASP CA 1 1 15 14065 1 1 52 ASP CB C -4.175 -9.274 6.034 1.00 . A A . 52 ASP CB 1 1 15 14066 1 1 52 ASP CG C -4.247 -10.094 7.323 1.00 . A A . 52 ASP CG 1 1 15 14067 1 1 52 ASP H H -3.920 -6.802 5.376 1.00 . A A . 52 ASP H 1 1 15 14068 1 1 52 ASP HA H -2.383 -8.512 6.936 1.00 . A A . 52 ASP HA 1 1 15 14069 1 1 52 ASP HB2 H -4.967 -8.540 6.029 1.00 . A A . 52 ASP HB2 1 1 15 14070 1 1 52 ASP HB3 H -4.288 -9.932 5.186 1.00 . A A . 52 ASP HB3 1 1 15 14071 1 1 52 ASP N N -3.019 -7.185 5.421 1.00 . A A . 52 ASP N 1 1 15 14072 1 1 52 ASP O O -1.197 -10.251 5.439 1.00 . A A . 52 ASP O 1 1 15 14073 1 1 52 ASP OD1 O -3.220 -10.608 7.736 1.00 . A A . 52 ASP OD1 1 1 15 14074 1 1 52 ASP OD2 O -5.330 -10.197 7.877 1.00 . A A . 52 ASP OD2 1 1 15 14075 1 1 53 THR C C 0.244 -8.913 2.501 1.00 . A A . 53 THR C 1 1 15 14076 1 1 53 THR CA C -1.001 -9.749 2.806 1.00 . A A . 53 THR CA 1 1 15 14077 1 1 53 THR CB C -1.765 -10.014 1.507 1.00 . A A . 53 THR CB 1 1 15 14078 1 1 53 THR CG2 C -1.624 -11.486 1.119 1.00 . A A . 53 THR CG2 1 1 15 14079 1 1 53 THR H H -2.455 -8.286 3.436 1.00 . A A . 53 THR H 1 1 15 14080 1 1 53 THR HA H -0.704 -10.690 3.244 1.00 . A A . 53 THR HA 1 1 15 14081 1 1 53 THR HB H -1.360 -9.398 0.719 1.00 . A A . 53 THR HB 1 1 15 14082 1 1 53 THR HG1 H -3.254 -8.762 1.526 1.00 . A A . 53 THR HG1 1 1 15 14083 1 1 53 THR HG21 H -1.919 -12.108 1.952 1.00 . A A . 53 THR HG21 1 1 15 14084 1 1 53 THR HG22 H -2.257 -11.698 0.271 1.00 . A A . 53 THR HG22 1 1 15 14085 1 1 53 THR HG23 H -0.596 -11.694 0.861 1.00 . A A . 53 THR HG23 1 1 15 14086 1 1 53 THR N N -1.882 -9.015 3.758 1.00 . A A . 53 THR N 1 1 15 14087 1 1 53 THR O O 0.212 -8.008 1.690 1.00 . A A . 53 THR O 1 1 15 14088 1 1 53 THR OG1 O -3.138 -9.699 1.695 1.00 . A A . 53 THR OG1 1 1 15 14089 1 1 54 CYS C C 3.705 -8.929 3.797 1.00 . A A . 54 CYS C 1 1 15 14090 1 1 54 CYS CA C 2.590 -8.441 2.875 1.00 . A A . 54 CYS CA 1 1 15 14091 1 1 54 CYS CB C 2.347 -6.953 3.137 1.00 . A A . 54 CYS CB 1 1 15 14092 1 1 54 CYS H H 1.350 -9.951 3.782 1.00 . A A . 54 CYS H 1 1 15 14093 1 1 54 CYS HA H 2.888 -8.579 1.846 1.00 . A A . 54 CYS HA 1 1 15 14094 1 1 54 CYS HB2 H 1.558 -6.589 2.500 1.00 . A A . 54 CYS HB2 1 1 15 14095 1 1 54 CYS HB3 H 2.065 -6.814 4.169 1.00 . A A . 54 CYS HB3 1 1 15 14096 1 1 54 CYS N N 1.343 -9.213 3.136 1.00 . A A . 54 CYS N 1 1 15 14097 1 1 54 CYS O O 3.459 -9.305 4.926 1.00 . A A . 54 CYS O 1 1 15 14098 1 1 54 CYS SG S 3.833 -5.933 2.831 1.00 . A A . 54 CYS SG 1 1 15 14099 1 1 55 PRO C C 6.420 -8.236 5.104 1.00 . A A . 55 PRO C 1 1 15 14100 1 1 55 PRO CA C 6.082 -9.318 4.078 1.00 . A A . 55 PRO CA 1 1 15 14101 1 1 55 PRO CB C 7.193 -9.457 3.038 1.00 . A A . 55 PRO CB 1 1 15 14102 1 1 55 PRO CD C 5.273 -8.449 1.936 1.00 . A A . 55 PRO CD 1 1 15 14103 1 1 55 PRO CG C 6.784 -8.553 1.913 1.00 . A A . 55 PRO CG 1 1 15 14104 1 1 55 PRO HA H 5.898 -10.265 4.560 1.00 . A A . 55 PRO HA 1 1 15 14105 1 1 55 PRO HB2 H 8.134 -9.159 3.482 1.00 . A A . 55 PRO HB2 1 1 15 14106 1 1 55 PRO HB3 H 7.256 -10.484 2.716 1.00 . A A . 55 PRO HB3 1 1 15 14107 1 1 55 PRO HD2 H 4.966 -7.427 1.767 1.00 . A A . 55 PRO HD2 1 1 15 14108 1 1 55 PRO HD3 H 4.838 -9.102 1.195 1.00 . A A . 55 PRO HD3 1 1 15 14109 1 1 55 PRO HG2 H 7.227 -7.576 2.053 1.00 . A A . 55 PRO HG2 1 1 15 14110 1 1 55 PRO HG3 H 7.106 -8.975 0.973 1.00 . A A . 55 PRO HG3 1 1 15 14111 1 1 55 PRO N N 4.904 -8.890 3.285 1.00 . A A . 55 PRO N 1 1 15 14112 1 1 55 PRO O O 6.959 -7.201 4.771 1.00 . A A . 55 PRO O 1 1 15 14113 1 1 56 VAL C C 5.315 -6.327 7.297 1.00 . A A . 56 VAL C 1 1 15 14114 1 1 56 VAL CA C 6.364 -7.439 7.394 1.00 . A A . 56 VAL CA 1 1 15 14115 1 1 56 VAL CB C 7.762 -6.843 7.189 1.00 . A A . 56 VAL CB 1 1 15 14116 1 1 56 VAL CG1 C 8.196 -6.118 8.464 1.00 . A A . 56 VAL CG1 1 1 15 14117 1 1 56 VAL CG2 C 8.761 -7.961 6.879 1.00 . A A . 56 VAL CG2 1 1 15 14118 1 1 56 VAL H H 5.636 -9.298 6.587 1.00 . A A . 56 VAL H 1 1 15 14119 1 1 56 VAL HA H 6.309 -7.902 8.368 1.00 . A A . 56 VAL HA 1 1 15 14120 1 1 56 VAL HB H 7.738 -6.140 6.370 1.00 . A A . 56 VAL HB 1 1 15 14121 1 1 56 VAL HG11 H 7.457 -6.275 9.237 1.00 . A A . 56 VAL HG11 1 1 15 14122 1 1 56 VAL HG12 H 9.148 -6.506 8.792 1.00 . A A . 56 VAL HG12 1 1 15 14123 1 1 56 VAL HG13 H 8.287 -5.061 8.263 1.00 . A A . 56 VAL HG13 1 1 15 14124 1 1 56 VAL HG21 H 8.239 -8.808 6.458 1.00 . A A . 56 VAL HG21 1 1 15 14125 1 1 56 VAL HG22 H 9.494 -7.602 6.171 1.00 . A A . 56 VAL HG22 1 1 15 14126 1 1 56 VAL HG23 H 9.257 -8.263 7.789 1.00 . A A . 56 VAL HG23 1 1 15 14127 1 1 56 VAL N N 6.086 -8.461 6.346 1.00 . A A . 56 VAL N 1 1 15 14128 1 1 56 VAL O O 5.365 -5.350 8.017 1.00 . A A . 56 VAL O 1 1 15 14129 1 1 57 GLN C C 3.964 -4.042 6.275 1.00 . A A . 57 GLN C 1 1 15 14130 1 1 57 GLN CA C 3.311 -5.425 6.268 1.00 . A A . 57 GLN CA 1 1 15 14131 1 1 57 GLN CB C 2.329 -5.526 7.436 1.00 . A A . 57 GLN CB 1 1 15 14132 1 1 57 GLN CD C 0.319 -6.734 8.302 1.00 . A A . 57 GLN CD 1 1 15 14133 1 1 57 GLN CG C 1.219 -6.518 7.083 1.00 . A A . 57 GLN CG 1 1 15 14134 1 1 57 GLN H H 4.339 -7.266 5.840 1.00 . A A . 57 GLN H 1 1 15 14135 1 1 57 GLN HA H 2.780 -5.570 5.334 1.00 . A A . 57 GLN HA 1 1 15 14136 1 1 57 GLN HB2 H 2.853 -5.867 8.317 1.00 . A A . 57 GLN HB2 1 1 15 14137 1 1 57 GLN HB3 H 1.894 -4.556 7.626 1.00 . A A . 57 GLN HB3 1 1 15 14138 1 1 57 GLN HE21 H 0.686 -4.941 9.071 1.00 . A A . 57 GLN HE21 1 1 15 14139 1 1 57 GLN HE22 H -0.372 -5.915 9.973 1.00 . A A . 57 GLN HE22 1 1 15 14140 1 1 57 GLN HG2 H 0.634 -6.124 6.267 1.00 . A A . 57 GLN HG2 1 1 15 14141 1 1 57 GLN HG3 H 1.658 -7.460 6.790 1.00 . A A . 57 GLN HG3 1 1 15 14142 1 1 57 GLN N N 4.363 -6.470 6.411 1.00 . A A . 57 GLN N 1 1 15 14143 1 1 57 GLN NE2 N 0.201 -5.785 9.189 1.00 . A A . 57 GLN NE2 1 1 15 14144 1 1 57 GLN O O 4.016 -3.374 7.289 1.00 . A A . 57 GLN O 1 1 15 14145 1 1 57 GLN OE1 O -0.283 -7.779 8.449 1.00 . A A . 57 GLN OE1 1 1 15 14146 1 1 58 CYS C C 4.032 -1.188 4.997 1.00 . A A . 58 CYS C 1 1 15 14147 1 1 58 CYS CA C 5.112 -2.267 5.097 1.00 . A A . 58 CYS CA 1 1 15 14148 1 1 58 CYS CB C 6.026 -2.186 3.869 1.00 . A A . 58 CYS CB 1 1 15 14149 1 1 58 CYS H H 4.411 -4.161 4.347 1.00 . A A . 58 CYS H 1 1 15 14150 1 1 58 CYS HA H 5.696 -2.112 5.992 1.00 . A A . 58 CYS HA 1 1 15 14151 1 1 58 CYS HB2 H 5.448 -1.871 3.012 1.00 . A A . 58 CYS HB2 1 1 15 14152 1 1 58 CYS HB3 H 6.812 -1.469 4.054 1.00 . A A . 58 CYS HB3 1 1 15 14153 1 1 58 CYS HG H 7.573 -3.673 3.047 1.00 . A A . 58 CYS HG 1 1 15 14154 1 1 58 CYS N N 4.463 -3.607 5.153 1.00 . A A . 58 CYS N 1 1 15 14155 1 1 58 CYS O O 4.298 -0.013 5.156 1.00 . A A . 58 CYS O 1 1 15 14156 1 1 58 CYS SG S 6.760 -3.810 3.536 1.00 . A A . 58 CYS SG 1 1 15 14157 1 1 59 ILE C C 1.160 -0.240 5.989 1.00 . A A . 59 ILE C 1 1 15 14158 1 1 59 ILE CA C 1.718 -0.580 4.605 1.00 . A A . 59 ILE CA 1 1 15 14159 1 1 59 ILE CB C 0.602 -1.163 3.735 1.00 . A A . 59 ILE CB 1 1 15 14160 1 1 59 ILE CD1 C -1.541 -0.632 2.564 1.00 . A A . 59 ILE CD1 1 1 15 14161 1 1 59 ILE CG1 C -0.517 -0.130 3.583 1.00 . A A . 59 ILE CG1 1 1 15 14162 1 1 59 ILE CG2 C 0.044 -2.423 4.397 1.00 . A A . 59 ILE CG2 1 1 15 14163 1 1 59 ILE H H 2.627 -2.532 4.597 1.00 . A A . 59 ILE H 1 1 15 14164 1 1 59 ILE HA H 2.097 0.318 4.142 1.00 . A A . 59 ILE HA 1 1 15 14165 1 1 59 ILE HB H 0.999 -1.415 2.762 1.00 . A A . 59 ILE HB 1 1 15 14166 1 1 59 ILE HD11 H -1.171 -1.532 2.094 1.00 . A A . 59 ILE HD11 1 1 15 14167 1 1 59 ILE HD12 H -2.474 -0.846 3.066 1.00 . A A . 59 ILE HD12 1 1 15 14168 1 1 59 ILE HD13 H -1.703 0.126 1.811 1.00 . A A . 59 ILE HD13 1 1 15 14169 1 1 59 ILE HG12 H -1.001 0.019 4.537 1.00 . A A . 59 ILE HG12 1 1 15 14170 1 1 59 ILE HG13 H -0.100 0.805 3.240 1.00 . A A . 59 ILE HG13 1 1 15 14171 1 1 59 ILE HG21 H 0.377 -2.468 5.423 1.00 . A A . 59 ILE HG21 1 1 15 14172 1 1 59 ILE HG22 H -1.035 -2.397 4.371 1.00 . A A . 59 ILE HG22 1 1 15 14173 1 1 59 ILE HG23 H 0.396 -3.296 3.867 1.00 . A A . 59 ILE HG23 1 1 15 14174 1 1 59 ILE N N 2.817 -1.579 4.726 1.00 . A A . 59 ILE N 1 1 15 14175 1 1 59 ILE O O 1.068 -1.083 6.859 1.00 . A A . 59 ILE O 1 1 15 14176 1 1 60 HIS C C -0.880 2.441 7.283 1.00 . A A . 60 HIS C 1 1 15 14177 1 1 60 HIS CA C 0.217 1.401 7.513 1.00 . A A . 60 HIS CA 1 1 15 14178 1 1 60 HIS CB C 1.323 2.010 8.378 1.00 . A A . 60 HIS CB 1 1 15 14179 1 1 60 HIS CD2 C 2.879 -0.078 8.724 1.00 . A A . 60 HIS CD2 1 1 15 14180 1 1 60 HIS CE1 C 4.619 0.647 7.657 1.00 . A A . 60 HIS CE1 1 1 15 14181 1 1 60 HIS CG C 2.567 1.175 8.259 1.00 . A A . 60 HIS CG 1 1 15 14182 1 1 60 HIS H H 0.860 1.652 5.473 1.00 . A A . 60 HIS H 1 1 15 14183 1 1 60 HIS HA H -0.199 0.539 8.011 1.00 . A A . 60 HIS HA 1 1 15 14184 1 1 60 HIS HB2 H 1.530 3.015 8.042 1.00 . A A . 60 HIS HB2 1 1 15 14185 1 1 60 HIS HB3 H 1.003 2.034 9.408 1.00 . A A . 60 HIS HB3 1 1 15 14186 1 1 60 HIS HD1 H 3.791 2.482 7.130 1.00 . A A . 60 HIS HD1 1 1 15 14187 1 1 60 HIS HD2 H 2.217 -0.711 9.297 1.00 . A A . 60 HIS HD2 1 1 15 14188 1 1 60 HIS HE1 H 5.602 0.714 7.216 1.00 . A A . 60 HIS HE1 1 1 15 14189 1 1 60 HIS N N 0.780 0.993 6.194 1.00 . A A . 60 HIS N 1 1 15 14190 1 1 60 HIS ND1 N 3.691 1.618 7.582 1.00 . A A . 60 HIS ND1 1 1 15 14191 1 1 60 HIS NE2 N 4.175 -0.409 8.344 1.00 . A A . 60 HIS NE2 1 1 15 14192 1 1 60 HIS O O -1.081 2.904 6.179 1.00 . A A . 60 HIS O 1 1 15 14193 1 1 61 TRP C C -2.156 5.217 8.447 1.00 . A A . 61 TRP C 1 1 15 14194 1 1 61 TRP CA C -2.681 3.817 8.125 1.00 . A A . 61 TRP CA 1 1 15 14195 1 1 61 TRP CB C -3.859 3.486 9.042 1.00 . A A . 61 TRP CB 1 1 15 14196 1 1 61 TRP CD1 C -3.806 0.960 9.213 1.00 . A A . 61 TRP CD1 1 1 15 14197 1 1 61 TRP CD2 C -5.462 1.730 7.911 1.00 . A A . 61 TRP CD2 1 1 15 14198 1 1 61 TRP CE2 C -5.569 0.324 7.900 1.00 . A A . 61 TRP CE2 1 1 15 14199 1 1 61 TRP CE3 C -6.381 2.478 7.174 1.00 . A A . 61 TRP CE3 1 1 15 14200 1 1 61 TRP CG C -4.344 2.110 8.745 1.00 . A A . 61 TRP CG 1 1 15 14201 1 1 61 TRP CH2 C -7.482 0.439 6.435 1.00 . A A . 61 TRP CH2 1 1 15 14202 1 1 61 TRP CZ2 C -6.566 -0.323 7.171 1.00 . A A . 61 TRP CZ2 1 1 15 14203 1 1 61 TRP CZ3 C -7.390 1.839 6.437 1.00 . A A . 61 TRP CZ3 1 1 15 14204 1 1 61 TRP H H -1.427 2.427 9.195 1.00 . A A . 61 TRP H 1 1 15 14205 1 1 61 TRP HA H -3.016 3.793 7.097 1.00 . A A . 61 TRP HA 1 1 15 14206 1 1 61 TRP HB2 H -3.552 3.546 10.067 1.00 . A A . 61 TRP HB2 1 1 15 14207 1 1 61 TRP HB3 H -4.658 4.191 8.866 1.00 . A A . 61 TRP HB3 1 1 15 14208 1 1 61 TRP HD1 H -2.952 0.885 9.870 1.00 . A A . 61 TRP HD1 1 1 15 14209 1 1 61 TRP HE1 H -4.355 -1.052 8.894 1.00 . A A . 61 TRP HE1 1 1 15 14210 1 1 61 TRP HE3 H -6.307 3.556 7.179 1.00 . A A . 61 TRP HE3 1 1 15 14211 1 1 61 TRP HH2 H -8.259 -0.051 5.867 1.00 . A A . 61 TRP HH2 1 1 15 14212 1 1 61 TRP HZ2 H -6.631 -1.399 7.173 1.00 . A A . 61 TRP HZ2 1 1 15 14213 1 1 61 TRP HZ3 H -8.096 2.426 5.869 1.00 . A A . 61 TRP HZ3 1 1 15 14214 1 1 61 TRP N N -1.598 2.811 8.309 1.00 . A A . 61 TRP N 1 1 15 14215 1 1 61 TRP NE1 N -4.535 -0.106 8.710 1.00 . A A . 61 TRP NE1 1 1 15 14216 1 1 61 TRP O O -1.007 5.397 8.797 1.00 . A A . 61 TRP O 1 1 15 14217 1 1 62 GLU C C -3.775 8.454 8.974 1.00 . A A . 62 GLU C 1 1 15 14218 1 1 62 GLU CA C -2.554 7.605 8.610 1.00 . A A . 62 GLU CA 1 1 15 14219 1 1 62 GLU CB C -1.876 8.189 7.365 1.00 . A A . 62 GLU CB 1 1 15 14220 1 1 62 GLU CD C -0.502 10.192 6.765 1.00 . A A . 62 GLU CD 1 1 15 14221 1 1 62 GLU CG C -1.741 9.707 7.520 1.00 . A A . 62 GLU CG 1 1 15 14222 1 1 62 GLU H H -3.914 6.040 8.035 1.00 . A A . 62 GLU H 1 1 15 14223 1 1 62 GLU HA H -1.856 7.601 9.434 1.00 . A A . 62 GLU HA 1 1 15 14224 1 1 62 GLU HB2 H -0.897 7.750 7.250 1.00 . A A . 62 GLU HB2 1 1 15 14225 1 1 62 GLU HB3 H -2.475 7.970 6.493 1.00 . A A . 62 GLU HB3 1 1 15 14226 1 1 62 GLU HG2 H -2.620 10.189 7.117 1.00 . A A . 62 GLU HG2 1 1 15 14227 1 1 62 GLU HG3 H -1.643 9.955 8.566 1.00 . A A . 62 GLU HG3 1 1 15 14228 1 1 62 GLU N N -2.993 6.211 8.322 1.00 . A A . 62 GLU N 1 1 15 14229 1 1 62 GLU O O -4.449 8.987 8.115 1.00 . A A . 62 GLU O 1 1 15 14230 1 1 62 GLU OE1 O 0.203 9.356 6.224 1.00 . A A . 62 GLU OE1 1 1 15 14231 1 1 62 GLU OE2 O -0.280 11.392 6.742 1.00 . A A . 62 GLU OE2 1 1 15 14232 1 1 63 ASP C C -5.042 10.850 10.198 1.00 . A A . 63 ASP C 1 1 15 14233 1 1 63 ASP CA C -5.243 9.401 10.650 1.00 . A A . 63 ASP CA 1 1 15 14234 1 1 63 ASP CB C -5.389 9.355 12.172 1.00 . A A . 63 ASP CB 1 1 15 14235 1 1 63 ASP CG C -5.585 7.905 12.621 1.00 . A A . 63 ASP CG 1 1 15 14236 1 1 63 ASP H H -3.509 8.149 10.918 1.00 . A A . 63 ASP H 1 1 15 14237 1 1 63 ASP HA H -6.135 9.001 10.190 1.00 . A A . 63 ASP HA 1 1 15 14238 1 1 63 ASP HB2 H -4.497 9.758 12.632 1.00 . A A . 63 ASP HB2 1 1 15 14239 1 1 63 ASP HB3 H -6.244 9.940 12.471 1.00 . A A . 63 ASP HB3 1 1 15 14240 1 1 63 ASP N N -4.065 8.586 10.239 1.00 . A A . 63 ASP N 1 1 15 14241 1 1 63 ASP O O -4.243 11.578 10.752 1.00 . A A . 63 ASP O 1 1 15 14242 1 1 63 ASP OD1 O -4.805 7.065 12.202 1.00 . A A . 63 ASP OD1 1 1 15 14243 1 1 63 ASP OD2 O -6.511 7.660 13.377 1.00 . A A . 63 ASP OD2 1 1 15 14244 1 1 64 GLU C C -6.992 13.302 8.521 1.00 . A A . 64 GLU C 1 1 15 14245 1 1 64 GLU CA C -5.610 12.672 8.703 1.00 . A A . 64 GLU CA 1 1 15 14246 1 1 64 GLU CB C -4.872 12.666 7.362 1.00 . A A . 64 GLU CB 1 1 15 14247 1 1 64 GLU CD C -3.790 14.871 7.817 1.00 . A A . 64 GLU CD 1 1 15 14248 1 1 64 GLU CG C -3.535 13.393 7.512 1.00 . A A . 64 GLU CG 1 1 15 14249 1 1 64 GLU H H -6.397 10.668 8.758 1.00 . A A . 64 GLU H 1 1 15 14250 1 1 64 GLU HA H -5.044 13.246 9.422 1.00 . A A . 64 GLU HA 1 1 15 14251 1 1 64 GLU HB2 H -4.697 11.646 7.052 1.00 . A A . 64 GLU HB2 1 1 15 14252 1 1 64 GLU HB3 H -5.472 13.170 6.619 1.00 . A A . 64 GLU HB3 1 1 15 14253 1 1 64 GLU HG2 H -2.972 12.949 8.321 1.00 . A A . 64 GLU HG2 1 1 15 14254 1 1 64 GLU HG3 H -2.973 13.308 6.594 1.00 . A A . 64 GLU HG3 1 1 15 14255 1 1 64 GLU N N -5.760 11.271 9.193 1.00 . A A . 64 GLU N 1 1 15 14256 1 1 64 GLU OE1 O -4.799 15.382 7.363 1.00 . A A . 64 GLU OE1 1 1 15 14257 1 1 64 GLU OE2 O -2.970 15.465 8.498 1.00 . A A . 64 GLU OE2 1 1 15 14258 2 2 1 SF4 FE1 FE 5.680 -4.801 -1.508 1.00 . B A . 65 SF4 FE1 1 1 15 14259 2 2 1 SF4 FE2 FE 3.971 -5.686 0.668 1.00 . B A . 65 SF4 FE2 1 1 15 14260 2 2 1 SF4 FE3 FE 3.117 -4.450 -1.735 1.00 . B A . 65 SF4 FE3 1 1 15 14261 2 2 1 SF4 FE4 FE 4.309 -7.179 -1.786 1.00 . B A . 65 SF4 FE4 1 1 15 14262 2 2 1 SF4 S1 S 2.250 -6.424 -0.517 1.00 . B A . 65 SF4 S1 1 1 15 14263 2 2 1 SF4 S2 S 4.626 -5.167 -3.178 1.00 . B A . 65 SF4 S2 1 1 15 14264 2 2 1 SF4 S3 S 5.885 -6.906 -0.253 1.00 . B A . 65 SF4 S3 1 1 15 14265 2 2 1 SF4 S4 S 4.445 -3.420 -0.301 1.00 . B A . 65 SF4 S4 1 1 16 14266 1 1 1 ALA C C -10.557 4.207 10.669 1.00 . A A . 1 ALA C 1 1 16 14267 1 1 1 ALA CA C -11.561 5.279 11.098 1.00 . A A . 1 ALA CA 1 1 16 14268 1 1 1 ALA CB C -12.075 6.019 9.862 1.00 . A A . 1 ALA CB 1 1 16 14269 1 1 1 ALA HA H -12.390 4.812 11.608 1.00 . A A . 1 ALA HA 1 1 16 14270 1 1 1 ALA HB1 H -12.529 6.952 10.164 1.00 . A A . 1 ALA HB1 1 1 16 14271 1 1 1 ALA HB2 H -11.252 6.221 9.194 1.00 . A A . 1 ALA HB2 1 1 16 14272 1 1 1 ALA HB3 H -12.809 5.409 9.356 1.00 . A A . 1 ALA HB3 1 1 16 14273 1 1 1 ALA N N -10.896 6.248 12.016 1.00 . A A . 1 ALA N 1 1 16 14274 1 1 1 ALA O O -10.605 3.704 9.564 1.00 . A A . 1 ALA O 1 1 16 14275 1 1 2 ARG C C -8.066 3.106 9.790 1.00 . A A . 2 ARG C 1 1 16 14276 1 1 2 ARG CA C -8.641 2.812 11.176 1.00 . A A . 2 ARG CA 1 1 16 14277 1 1 2 ARG CB C -9.313 1.437 11.166 1.00 . A A . 2 ARG CB 1 1 16 14278 1 1 2 ARG CD C -9.110 -0.196 13.047 1.00 . A A . 2 ARG CD 1 1 16 14279 1 1 2 ARG CG C -8.395 0.415 11.841 1.00 . A A . 2 ARG CG 1 1 16 14280 1 1 2 ARG CZ C -11.377 -0.874 13.560 1.00 . A A . 2 ARG CZ 1 1 16 14281 1 1 2 ARG H H -9.625 4.270 12.421 1.00 . A A . 2 ARG H 1 1 16 14282 1 1 2 ARG HA H -7.844 2.817 11.905 1.00 . A A . 2 ARG HA 1 1 16 14283 1 1 2 ARG HB2 H -10.249 1.490 11.703 1.00 . A A . 2 ARG HB2 1 1 16 14284 1 1 2 ARG HB3 H -9.499 1.133 10.148 1.00 . A A . 2 ARG HB3 1 1 16 14285 1 1 2 ARG HD2 H -8.554 -1.051 13.400 1.00 . A A . 2 ARG HD2 1 1 16 14286 1 1 2 ARG HD3 H -9.179 0.539 13.835 1.00 . A A . 2 ARG HD3 1 1 16 14287 1 1 2 ARG HE H -10.705 -0.720 11.698 1.00 . A A . 2 ARG HE 1 1 16 14288 1 1 2 ARG HG2 H -8.145 -0.364 11.137 1.00 . A A . 2 ARG HG2 1 1 16 14289 1 1 2 ARG HG3 H -7.492 0.907 12.171 1.00 . A A . 2 ARG HG3 1 1 16 14290 1 1 2 ARG HH11 H -10.543 -2.602 14.127 1.00 . A A . 2 ARG HH11 1 1 16 14291 1 1 2 ARG HH12 H -11.982 -2.151 14.976 1.00 . A A . 2 ARG HH12 1 1 16 14292 1 1 2 ARG HH21 H -12.420 0.799 13.206 1.00 . A A . 2 ARG HH21 1 1 16 14293 1 1 2 ARG HH22 H -13.045 -0.224 14.456 1.00 . A A . 2 ARG HH22 1 1 16 14294 1 1 2 ARG N N -9.647 3.852 11.534 1.00 . A A . 2 ARG N 1 1 16 14295 1 1 2 ARG NE N -10.480 -0.625 12.647 1.00 . A A . 2 ARG NE 1 1 16 14296 1 1 2 ARG NH1 N -11.294 -1.960 14.277 1.00 . A A . 2 ARG NH1 1 1 16 14297 1 1 2 ARG NH2 N -12.357 -0.035 13.756 1.00 . A A . 2 ARG NH2 1 1 16 14298 1 1 2 ARG O O -8.391 2.452 8.820 1.00 . A A . 2 ARG O 1 1 16 14299 1 1 3 LYS C C -5.469 3.437 8.075 1.00 . A A . 3 LYS C 1 1 16 14300 1 1 3 LYS CA C -6.604 4.414 8.368 1.00 . A A . 3 LYS CA 1 1 16 14301 1 1 3 LYS CB C -6.056 5.843 8.400 1.00 . A A . 3 LYS CB 1 1 16 14302 1 1 3 LYS CD C -5.909 8.001 7.152 1.00 . A A . 3 LYS CD 1 1 16 14303 1 1 3 LYS CE C -7.072 8.977 7.337 1.00 . A A . 3 LYS CE 1 1 16 14304 1 1 3 LYS CG C -6.445 6.569 7.112 1.00 . A A . 3 LYS CG 1 1 16 14305 1 1 3 LYS H H -6.951 4.596 10.485 1.00 . A A . 3 LYS H 1 1 16 14306 1 1 3 LYS HA H -7.354 4.334 7.595 1.00 . A A . 3 LYS HA 1 1 16 14307 1 1 3 LYS HB2 H -6.468 6.367 9.249 1.00 . A A . 3 LYS HB2 1 1 16 14308 1 1 3 LYS HB3 H -4.981 5.813 8.482 1.00 . A A . 3 LYS HB3 1 1 16 14309 1 1 3 LYS HD2 H -5.216 8.102 7.975 1.00 . A A . 3 LYS HD2 1 1 16 14310 1 1 3 LYS HD3 H -5.400 8.220 6.225 1.00 . A A . 3 LYS HD3 1 1 16 14311 1 1 3 LYS HE2 H -7.970 8.549 6.919 1.00 . A A . 3 LYS HE2 1 1 16 14312 1 1 3 LYS HE3 H -7.219 9.166 8.390 1.00 . A A . 3 LYS HE3 1 1 16 14313 1 1 3 LYS HG2 H -6.023 6.049 6.264 1.00 . A A . 3 LYS HG2 1 1 16 14314 1 1 3 LYS HG3 H -7.521 6.592 7.020 1.00 . A A . 3 LYS HG3 1 1 16 14315 1 1 3 LYS HZ1 H -5.733 10.405 6.628 1.00 . A A . 3 LYS HZ1 1 1 16 14316 1 1 3 LYS HZ2 H -7.116 10.216 5.664 1.00 . A A . 3 LYS HZ2 1 1 16 14317 1 1 3 LYS HZ3 H -7.220 11.044 7.144 1.00 . A A . 3 LYS HZ3 1 1 16 14318 1 1 3 LYS N N -7.206 4.083 9.690 1.00 . A A . 3 LYS N 1 1 16 14319 1 1 3 LYS NZ N -6.761 10.257 6.641 1.00 . A A . 3 LYS NZ 1 1 16 14320 1 1 3 LYS O O -5.458 2.323 8.557 1.00 . A A . 3 LYS O 1 1 16 14321 1 1 4 PHE C C -2.442 3.628 5.970 1.00 . A A . 4 PHE C 1 1 16 14322 1 1 4 PHE CA C -3.372 2.956 6.980 1.00 . A A . 4 PHE CA 1 1 16 14323 1 1 4 PHE CB C -3.895 1.640 6.395 1.00 . A A . 4 PHE CB 1 1 16 14324 1 1 4 PHE CD1 C -6.077 2.192 5.264 1.00 . A A . 4 PHE CD1 1 1 16 14325 1 1 4 PHE CD2 C -4.092 1.916 3.899 1.00 . A A . 4 PHE CD2 1 1 16 14326 1 1 4 PHE CE1 C -6.831 2.453 4.114 1.00 . A A . 4 PHE CE1 1 1 16 14327 1 1 4 PHE CE2 C -4.845 2.176 2.750 1.00 . A A . 4 PHE CE2 1 1 16 14328 1 1 4 PHE CG C -4.708 1.924 5.156 1.00 . A A . 4 PHE CG 1 1 16 14329 1 1 4 PHE CZ C -6.215 2.444 2.857 1.00 . A A . 4 PHE CZ 1 1 16 14330 1 1 4 PHE H H -4.532 4.746 6.934 1.00 . A A . 4 PHE H 1 1 16 14331 1 1 4 PHE HA H -2.827 2.758 7.881 1.00 . A A . 4 PHE HA 1 1 16 14332 1 1 4 PHE HB2 H -3.059 1.006 6.138 1.00 . A A . 4 PHE HB2 1 1 16 14333 1 1 4 PHE HB3 H -4.515 1.140 7.124 1.00 . A A . 4 PHE HB3 1 1 16 14334 1 1 4 PHE HD1 H -6.552 2.198 6.234 1.00 . A A . 4 PHE HD1 1 1 16 14335 1 1 4 PHE HD2 H -3.035 1.708 3.818 1.00 . A A . 4 PHE HD2 1 1 16 14336 1 1 4 PHE HE1 H -7.888 2.660 4.197 1.00 . A A . 4 PHE HE1 1 1 16 14337 1 1 4 PHE HE2 H -4.371 2.170 1.779 1.00 . A A . 4 PHE HE2 1 1 16 14338 1 1 4 PHE HZ H -6.797 2.645 1.969 1.00 . A A . 4 PHE HZ 1 1 16 14339 1 1 4 PHE N N -4.508 3.850 7.298 1.00 . A A . 4 PHE N 1 1 16 14340 1 1 4 PHE O O -2.709 4.704 5.474 1.00 . A A . 4 PHE O 1 1 16 14341 1 1 5 TYR C C 0.756 2.555 4.586 1.00 . A A . 5 TYR C 1 1 16 14342 1 1 5 TYR CA C -0.380 3.544 4.694 1.00 . A A . 5 TYR CA 1 1 16 14343 1 1 5 TYR CB C 0.174 4.879 5.184 1.00 . A A . 5 TYR CB 1 1 16 14344 1 1 5 TYR CD1 C -0.013 4.776 7.699 1.00 . A A . 5 TYR CD1 1 1 16 14345 1 1 5 TYR CD2 C 2.161 4.462 6.673 1.00 . A A . 5 TYR CD2 1 1 16 14346 1 1 5 TYR CE1 C 0.562 4.610 8.965 1.00 . A A . 5 TYR CE1 1 1 16 14347 1 1 5 TYR CE2 C 2.736 4.297 7.938 1.00 . A A . 5 TYR CE2 1 1 16 14348 1 1 5 TYR CG C 0.787 4.702 6.552 1.00 . A A . 5 TYR CG 1 1 16 14349 1 1 5 TYR CZ C 1.937 4.371 9.085 1.00 . A A . 5 TYR CZ 1 1 16 14350 1 1 5 TYR H H -1.164 2.113 6.077 1.00 . A A . 5 TYR H 1 1 16 14351 1 1 5 TYR HA H -0.853 3.670 3.730 1.00 . A A . 5 TYR HA 1 1 16 14352 1 1 5 TYR HB2 H 0.930 5.225 4.495 1.00 . A A . 5 TYR HB2 1 1 16 14353 1 1 5 TYR HB3 H -0.618 5.600 5.232 1.00 . A A . 5 TYR HB3 1 1 16 14354 1 1 5 TYR HD1 H -1.074 4.960 7.607 1.00 . A A . 5 TYR HD1 1 1 16 14355 1 1 5 TYR HD2 H 2.778 4.404 5.788 1.00 . A A . 5 TYR HD2 1 1 16 14356 1 1 5 TYR HE1 H -0.055 4.666 9.850 1.00 . A A . 5 TYR HE1 1 1 16 14357 1 1 5 TYR HE2 H 3.796 4.111 8.030 1.00 . A A . 5 TYR HE2 1 1 16 14358 1 1 5 TYR HH H 3.449 4.362 10.250 1.00 . A A . 5 TYR HH 1 1 16 14359 1 1 5 TYR N N -1.350 2.986 5.665 1.00 . A A . 5 TYR N 1 1 16 14360 1 1 5 TYR O O 0.720 1.498 5.181 1.00 . A A . 5 TYR O 1 1 16 14361 1 1 5 TYR OH O 2.504 4.208 10.332 1.00 . A A . 5 TYR OH 1 1 16 14362 1 1 6 VAL C C 4.212 2.572 3.865 1.00 . A A . 6 VAL C 1 1 16 14363 1 1 6 VAL CA C 2.872 1.886 3.742 1.00 . A A . 6 VAL CA 1 1 16 14364 1 1 6 VAL CB C 2.837 1.164 2.402 1.00 . A A . 6 VAL CB 1 1 16 14365 1 1 6 VAL CG1 C 3.260 -0.281 2.628 1.00 . A A . 6 VAL CG1 1 1 16 14366 1 1 6 VAL CG2 C 1.425 1.184 1.806 1.00 . A A . 6 VAL CG2 1 1 16 14367 1 1 6 VAL H H 1.795 3.719 3.359 1.00 . A A . 6 VAL H 1 1 16 14368 1 1 6 VAL HA H 2.773 1.158 4.534 1.00 . A A . 6 VAL HA 1 1 16 14369 1 1 6 VAL HB H 3.538 1.644 1.721 1.00 . A A . 6 VAL HB 1 1 16 14370 1 1 6 VAL HG11 H 3.695 -0.373 3.613 1.00 . A A . 6 VAL HG11 1 1 16 14371 1 1 6 VAL HG12 H 2.394 -0.921 2.557 1.00 . A A . 6 VAL HG12 1 1 16 14372 1 1 6 VAL HG13 H 3.984 -0.564 1.884 1.00 . A A . 6 VAL HG13 1 1 16 14373 1 1 6 VAL HG21 H 0.723 1.553 2.531 1.00 . A A . 6 VAL HG21 1 1 16 14374 1 1 6 VAL HG22 H 1.411 1.819 0.933 1.00 . A A . 6 VAL HG22 1 1 16 14375 1 1 6 VAL HG23 H 1.144 0.181 1.523 1.00 . A A . 6 VAL HG23 1 1 16 14376 1 1 6 VAL N N 1.767 2.863 3.843 1.00 . A A . 6 VAL N 1 1 16 14377 1 1 6 VAL O O 4.323 3.781 3.853 1.00 . A A . 6 VAL O 1 1 16 14378 1 1 7 ASP C C 7.374 1.887 2.842 1.00 . A A . 7 ASP C 1 1 16 14379 1 1 7 ASP CA C 6.593 2.346 4.043 1.00 . A A . 7 ASP CA 1 1 16 14380 1 1 7 ASP CB C 7.273 1.872 5.321 1.00 . A A . 7 ASP CB 1 1 16 14381 1 1 7 ASP CG C 8.114 3.007 5.906 1.00 . A A . 7 ASP CG 1 1 16 14382 1 1 7 ASP H H 5.109 0.815 3.937 1.00 . A A . 7 ASP H 1 1 16 14383 1 1 7 ASP HA H 6.544 3.413 4.030 1.00 . A A . 7 ASP HA 1 1 16 14384 1 1 7 ASP HB2 H 6.519 1.584 6.026 1.00 . A A . 7 ASP HB2 1 1 16 14385 1 1 7 ASP HB3 H 7.909 1.028 5.102 1.00 . A A . 7 ASP HB3 1 1 16 14386 1 1 7 ASP N N 5.237 1.786 3.952 1.00 . A A . 7 ASP N 1 1 16 14387 1 1 7 ASP O O 7.970 0.829 2.836 1.00 . A A . 7 ASP O 1 1 16 14388 1 1 7 ASP OD1 O 7.739 4.154 5.721 1.00 . A A . 7 ASP OD1 1 1 16 14389 1 1 7 ASP OD2 O 9.120 2.712 6.531 1.00 . A A . 7 ASP OD2 1 1 16 14390 1 1 8 GLN C C 9.606 2.240 0.828 1.00 . A A . 8 GLN C 1 1 16 14391 1 1 8 GLN CA C 8.100 2.332 0.570 1.00 . A A . 8 GLN CA 1 1 16 14392 1 1 8 GLN CB C 7.882 3.416 -0.458 1.00 . A A . 8 GLN CB 1 1 16 14393 1 1 8 GLN CD C 5.922 4.833 0.155 1.00 . A A . 8 GLN CD 1 1 16 14394 1 1 8 GLN CG C 6.388 3.639 -0.679 1.00 . A A . 8 GLN CG 1 1 16 14395 1 1 8 GLN H H 6.847 3.507 1.875 1.00 . A A . 8 GLN H 1 1 16 14396 1 1 8 GLN HA H 7.738 1.392 0.184 1.00 . A A . 8 GLN HA 1 1 16 14397 1 1 8 GLN HB2 H 8.339 4.334 -0.115 1.00 . A A . 8 GLN HB2 1 1 16 14398 1 1 8 GLN HB3 H 8.344 3.103 -1.368 1.00 . A A . 8 GLN HB3 1 1 16 14399 1 1 8 GLN HE21 H 4.756 3.739 1.333 1.00 . A A . 8 GLN HE21 1 1 16 14400 1 1 8 GLN HE22 H 4.778 5.401 1.675 1.00 . A A . 8 GLN HE22 1 1 16 14401 1 1 8 GLN HG2 H 6.207 3.838 -1.725 1.00 . A A . 8 GLN HG2 1 1 16 14402 1 1 8 GLN HG3 H 5.841 2.757 -0.379 1.00 . A A . 8 GLN HG3 1 1 16 14403 1 1 8 GLN N N 7.362 2.678 1.821 1.00 . A A . 8 GLN N 1 1 16 14404 1 1 8 GLN NE2 N 5.082 4.642 1.136 1.00 . A A . 8 GLN NE2 1 1 16 14405 1 1 8 GLN O O 10.412 2.701 0.044 1.00 . A A . 8 GLN O 1 1 16 14406 1 1 8 GLN OE1 O 6.326 5.952 -0.088 1.00 . A A . 8 GLN OE1 1 1 16 14407 1 1 9 ASP C C 11.852 0.058 1.947 1.00 . A A . 9 ASP C 1 1 16 14408 1 1 9 ASP CA C 11.431 1.499 2.229 1.00 . A A . 9 ASP CA 1 1 16 14409 1 1 9 ASP CB C 11.657 1.818 3.709 1.00 . A A . 9 ASP CB 1 1 16 14410 1 1 9 ASP CG C 12.664 2.961 3.843 1.00 . A A . 9 ASP CG 1 1 16 14411 1 1 9 ASP H H 9.314 1.283 2.499 1.00 . A A . 9 ASP H 1 1 16 14412 1 1 9 ASP HA H 12.011 2.175 1.618 1.00 . A A . 9 ASP HA 1 1 16 14413 1 1 9 ASP HB2 H 10.720 2.108 4.161 1.00 . A A . 9 ASP HB2 1 1 16 14414 1 1 9 ASP HB3 H 12.042 0.943 4.211 1.00 . A A . 9 ASP HB3 1 1 16 14415 1 1 9 ASP N N 9.985 1.645 1.905 1.00 . A A . 9 ASP N 1 1 16 14416 1 1 9 ASP O O 12.974 -0.213 1.569 1.00 . A A . 9 ASP O 1 1 16 14417 1 1 9 ASP OD1 O 13.379 3.210 2.887 1.00 . A A . 9 ASP OD1 1 1 16 14418 1 1 9 ASP OD2 O 12.703 3.568 4.901 1.00 . A A . 9 ASP OD2 1 1 16 14419 1 1 10 GLU C C 10.498 -2.768 0.631 1.00 . A A . 10 GLU C 1 1 16 14420 1 1 10 GLU CA C 11.275 -2.298 1.861 1.00 . A A . 10 GLU CA 1 1 16 14421 1 1 10 GLU CB C 10.866 -3.144 3.070 1.00 . A A . 10 GLU CB 1 1 16 14422 1 1 10 GLU CD C 12.980 -2.942 4.385 1.00 . A A . 10 GLU CD 1 1 16 14423 1 1 10 GLU CG C 12.085 -3.901 3.600 1.00 . A A . 10 GLU CG 1 1 16 14424 1 1 10 GLU H H 10.049 -0.621 2.421 1.00 . A A . 10 GLU H 1 1 16 14425 1 1 10 GLU HA H 12.335 -2.403 1.685 1.00 . A A . 10 GLU HA 1 1 16 14426 1 1 10 GLU HB2 H 10.474 -2.500 3.846 1.00 . A A . 10 GLU HB2 1 1 16 14427 1 1 10 GLU HB3 H 10.106 -3.851 2.773 1.00 . A A . 10 GLU HB3 1 1 16 14428 1 1 10 GLU HG2 H 11.757 -4.702 4.247 1.00 . A A . 10 GLU HG2 1 1 16 14429 1 1 10 GLU HG3 H 12.641 -4.311 2.771 1.00 . A A . 10 GLU HG3 1 1 16 14430 1 1 10 GLU N N 10.948 -0.868 2.122 1.00 . A A . 10 GLU N 1 1 16 14431 1 1 10 GLU O O 10.264 -3.945 0.444 1.00 . A A . 10 GLU O 1 1 16 14432 1 1 10 GLU OE1 O 12.446 -2.176 5.171 1.00 . A A . 10 GLU OE1 1 1 16 14433 1 1 10 GLU OE2 O 14.182 -2.989 4.188 1.00 . A A . 10 GLU OE2 1 1 16 14434 1 1 11 CYS C C 10.270 -2.659 -2.535 1.00 . A A . 11 CYS C 1 1 16 14435 1 1 11 CYS CA C 9.314 -2.245 -1.415 1.00 . A A . 11 CYS CA 1 1 16 14436 1 1 11 CYS CB C 8.460 -1.063 -1.880 1.00 . A A . 11 CYS CB 1 1 16 14437 1 1 11 CYS H H 10.280 -0.908 -0.030 1.00 . A A . 11 CYS H 1 1 16 14438 1 1 11 CYS HA H 8.669 -3.077 -1.172 1.00 . A A . 11 CYS HA 1 1 16 14439 1 1 11 CYS HB2 H 7.669 -0.886 -1.167 1.00 . A A . 11 CYS HB2 1 1 16 14440 1 1 11 CYS HB3 H 9.077 -0.180 -1.961 1.00 . A A . 11 CYS HB3 1 1 16 14441 1 1 11 CYS N N 10.087 -1.854 -0.205 1.00 . A A . 11 CYS N 1 1 16 14442 1 1 11 CYS O O 11.162 -1.925 -2.909 1.00 . A A . 11 CYS O 1 1 16 14443 1 1 11 CYS SG S 7.685 -1.302 -3.518 1.00 . A A . 11 CYS SG 1 1 16 14444 1 1 12 ILE C C 10.438 -3.783 -5.518 1.00 . A A . 12 ILE C 1 1 16 14445 1 1 12 ILE CA C 10.974 -4.296 -4.177 1.00 . A A . 12 ILE CA 1 1 16 14446 1 1 12 ILE CB C 11.028 -5.826 -4.190 1.00 . A A . 12 ILE CB 1 1 16 14447 1 1 12 ILE CD1 C 9.675 -7.921 -4.312 1.00 . A A . 12 ILE CD1 1 1 16 14448 1 1 12 ILE CG1 C 9.613 -6.393 -4.330 1.00 . A A . 12 ILE CG1 1 1 16 14449 1 1 12 ILE CG2 C 11.648 -6.324 -2.882 1.00 . A A . 12 ILE CG2 1 1 16 14450 1 1 12 ILE H H 9.354 -4.405 -2.762 1.00 . A A . 12 ILE H 1 1 16 14451 1 1 12 ILE HA H 11.968 -3.905 -4.019 1.00 . A A . 12 ILE HA 1 1 16 14452 1 1 12 ILE HB H 11.633 -6.156 -5.022 1.00 . A A . 12 ILE HB 1 1 16 14453 1 1 12 ILE HD11 H 10.696 -8.239 -4.156 1.00 . A A . 12 ILE HD11 1 1 16 14454 1 1 12 ILE HD12 H 9.055 -8.297 -3.511 1.00 . A A . 12 ILE HD12 1 1 16 14455 1 1 12 ILE HD13 H 9.318 -8.307 -5.255 1.00 . A A . 12 ILE HD13 1 1 16 14456 1 1 12 ILE HG12 H 9.003 -6.049 -3.509 1.00 . A A . 12 ILE HG12 1 1 16 14457 1 1 12 ILE HG13 H 9.183 -6.064 -5.263 1.00 . A A . 12 ILE HG13 1 1 16 14458 1 1 12 ILE HG21 H 12.643 -5.918 -2.779 1.00 . A A . 12 ILE HG21 1 1 16 14459 1 1 12 ILE HG22 H 11.039 -6.003 -2.050 1.00 . A A . 12 ILE HG22 1 1 16 14460 1 1 12 ILE HG23 H 11.698 -7.403 -2.896 1.00 . A A . 12 ILE HG23 1 1 16 14461 1 1 12 ILE N N 10.083 -3.832 -3.077 1.00 . A A . 12 ILE N 1 1 16 14462 1 1 12 ILE O O 10.999 -4.048 -6.563 1.00 . A A . 12 ILE O 1 1 16 14463 1 1 13 ALA C C 8.001 -3.566 -7.504 1.00 . A A . 13 ALA C 1 1 16 14464 1 1 13 ALA CA C 8.795 -2.490 -6.758 1.00 . A A . 13 ALA CA 1 1 16 14465 1 1 13 ALA CB C 9.931 -1.990 -7.654 1.00 . A A . 13 ALA CB 1 1 16 14466 1 1 13 ALA H H 8.935 -2.830 -4.637 1.00 . A A . 13 ALA H 1 1 16 14467 1 1 13 ALA HA H 8.139 -1.664 -6.524 1.00 . A A . 13 ALA HA 1 1 16 14468 1 1 13 ALA HB1 H 10.723 -1.587 -7.040 1.00 . A A . 13 ALA HB1 1 1 16 14469 1 1 13 ALA HB2 H 10.312 -2.810 -8.244 1.00 . A A . 13 ALA HB2 1 1 16 14470 1 1 13 ALA HB3 H 9.557 -1.218 -8.310 1.00 . A A . 13 ALA HB3 1 1 16 14471 1 1 13 ALA N N 9.363 -3.039 -5.493 1.00 . A A . 13 ALA N 1 1 16 14472 1 1 13 ALA O O 7.945 -3.568 -8.718 1.00 . A A . 13 ALA O 1 1 16 14473 1 1 14 CYS C C 5.152 -5.005 -7.721 1.00 . A A . 14 CYS C 1 1 16 14474 1 1 14 CYS CA C 6.578 -5.517 -7.509 1.00 . A A . 14 CYS CA 1 1 16 14475 1 1 14 CYS CB C 6.542 -6.808 -6.687 1.00 . A A . 14 CYS CB 1 1 16 14476 1 1 14 CYS H H 7.413 -4.455 -5.824 1.00 . A A . 14 CYS H 1 1 16 14477 1 1 14 CYS HA H 7.030 -5.717 -8.470 1.00 . A A . 14 CYS HA 1 1 16 14478 1 1 14 CYS HB2 H 6.403 -7.649 -7.351 1.00 . A A . 14 CYS HB2 1 1 16 14479 1 1 14 CYS HB3 H 7.477 -6.922 -6.159 1.00 . A A . 14 CYS HB3 1 1 16 14480 1 1 14 CYS N N 7.372 -4.470 -6.802 1.00 . A A . 14 CYS N 1 1 16 14481 1 1 14 CYS O O 4.654 -4.196 -6.964 1.00 . A A . 14 CYS O 1 1 16 14482 1 1 14 CYS SG S 5.222 -6.918 -5.426 1.00 . A A . 14 CYS SG 1 1 16 14483 1 1 15 GLU C C 2.097 -5.868 -8.277 1.00 . A A . 15 GLU C 1 1 16 14484 1 1 15 GLU CA C 3.105 -4.987 -9.018 1.00 . A A . 15 GLU CA 1 1 16 14485 1 1 15 GLU CB C 2.827 -5.053 -10.521 1.00 . A A . 15 GLU CB 1 1 16 14486 1 1 15 GLU CD C 3.821 -3.735 -12.394 1.00 . A A . 15 GLU CD 1 1 16 14487 1 1 15 GLU CG C 2.970 -3.656 -11.126 1.00 . A A . 15 GLU CG 1 1 16 14488 1 1 15 GLU H H 4.916 -6.106 -9.357 1.00 . A A . 15 GLU H 1 1 16 14489 1 1 15 GLU HA H 3.005 -3.967 -8.680 1.00 . A A . 15 GLU HA 1 1 16 14490 1 1 15 GLU HB2 H 3.532 -5.724 -10.989 1.00 . A A . 15 GLU HB2 1 1 16 14491 1 1 15 GLU HB3 H 1.823 -5.413 -10.685 1.00 . A A . 15 GLU HB3 1 1 16 14492 1 1 15 GLU HG2 H 1.992 -3.267 -11.372 1.00 . A A . 15 GLU HG2 1 1 16 14493 1 1 15 GLU HG3 H 3.449 -3.001 -10.413 1.00 . A A . 15 GLU HG3 1 1 16 14494 1 1 15 GLU N N 4.493 -5.461 -8.752 1.00 . A A . 15 GLU N 1 1 16 14495 1 1 15 GLU O O 1.002 -6.102 -8.749 1.00 . A A . 15 GLU O 1 1 16 14496 1 1 15 GLU OE1 O 4.099 -4.841 -12.829 1.00 . A A . 15 GLU OE1 1 1 16 14497 1 1 15 GLU OE2 O 4.181 -2.689 -12.909 1.00 . A A . 15 GLU OE2 1 1 16 14498 1 1 16 SER C C 0.419 -6.334 -5.722 1.00 . A A . 16 SER C 1 1 16 14499 1 1 16 SER CA C 1.499 -7.213 -6.357 1.00 . A A . 16 SER CA 1 1 16 14500 1 1 16 SER CB C 2.258 -7.967 -5.265 1.00 . A A . 16 SER CB 1 1 16 14501 1 1 16 SER H H 3.335 -6.153 -6.751 1.00 . A A . 16 SER H 1 1 16 14502 1 1 16 SER HA H 1.036 -7.922 -7.029 1.00 . A A . 16 SER HA 1 1 16 14503 1 1 16 SER HB2 H 1.619 -8.719 -4.831 1.00 . A A . 16 SER HB2 1 1 16 14504 1 1 16 SER HB3 H 3.128 -8.445 -5.697 1.00 . A A . 16 SER HB3 1 1 16 14505 1 1 16 SER HG H 2.848 -7.555 -3.456 1.00 . A A . 16 SER HG 1 1 16 14506 1 1 16 SER N N 2.449 -6.354 -7.119 1.00 . A A . 16 SER N 1 1 16 14507 1 1 16 SER O O -0.728 -6.358 -6.120 1.00 . A A . 16 SER O 1 1 16 14508 1 1 16 SER OG O 2.658 -7.052 -4.252 1.00 . A A . 16 SER OG 1 1 16 14509 1 1 17 CYS C C -0.847 -3.739 -5.123 1.00 . A A . 17 CYS C 1 1 16 14510 1 1 17 CYS CA C -0.227 -4.669 -4.081 1.00 . A A . 17 CYS CA 1 1 16 14511 1 1 17 CYS CB C 0.467 -3.831 -3.005 1.00 . A A . 17 CYS CB 1 1 16 14512 1 1 17 CYS H H 1.709 -5.547 -4.434 1.00 . A A . 17 CYS H 1 1 16 14513 1 1 17 CYS HA H -0.999 -5.272 -3.627 1.00 . A A . 17 CYS HA 1 1 16 14514 1 1 17 CYS HB2 H -0.274 -3.430 -2.328 1.00 . A A . 17 CYS HB2 1 1 16 14515 1 1 17 CYS HB3 H 1.157 -4.452 -2.454 1.00 . A A . 17 CYS HB3 1 1 16 14516 1 1 17 CYS N N 0.778 -5.554 -4.738 1.00 . A A . 17 CYS N 1 1 16 14517 1 1 17 CYS O O -2.049 -3.564 -5.181 1.00 . A A . 17 CYS O 1 1 16 14518 1 1 17 CYS SG S 1.427 -2.409 -3.649 1.00 . A A . 17 CYS SG 1 1 16 14519 1 1 18 VAL C C -1.657 -2.912 -7.792 1.00 . A A . 18 VAL C 1 1 16 14520 1 1 18 VAL CA C -0.567 -2.211 -6.979 1.00 . A A . 18 VAL CA 1 1 16 14521 1 1 18 VAL CB C 0.568 -1.783 -7.909 1.00 . A A . 18 VAL CB 1 1 16 14522 1 1 18 VAL CG1 C -0.008 -1.003 -9.092 1.00 . A A . 18 VAL CG1 1 1 16 14523 1 1 18 VAL CG2 C 1.545 -0.894 -7.138 1.00 . A A . 18 VAL CG2 1 1 16 14524 1 1 18 VAL H H 0.932 -3.290 -5.875 1.00 . A A . 18 VAL H 1 1 16 14525 1 1 18 VAL HA H -0.984 -1.338 -6.498 1.00 . A A . 18 VAL HA 1 1 16 14526 1 1 18 VAL HB H 1.084 -2.660 -8.273 1.00 . A A . 18 VAL HB 1 1 16 14527 1 1 18 VAL HG11 H -0.569 -0.156 -8.726 1.00 . A A . 18 VAL HG11 1 1 16 14528 1 1 18 VAL HG12 H 0.800 -0.656 -9.721 1.00 . A A . 18 VAL HG12 1 1 16 14529 1 1 18 VAL HG13 H -0.659 -1.647 -9.665 1.00 . A A . 18 VAL HG13 1 1 16 14530 1 1 18 VAL HG21 H 1.347 -0.974 -6.080 1.00 . A A . 18 VAL HG21 1 1 16 14531 1 1 18 VAL HG22 H 2.557 -1.214 -7.340 1.00 . A A . 18 VAL HG22 1 1 16 14532 1 1 18 VAL HG23 H 1.422 0.132 -7.451 1.00 . A A . 18 VAL HG23 1 1 16 14533 1 1 18 VAL N N -0.033 -3.136 -5.944 1.00 . A A . 18 VAL N 1 1 16 14534 1 1 18 VAL O O -2.675 -2.330 -8.108 1.00 . A A . 18 VAL O 1 1 16 14535 1 1 19 GLU C C -3.741 -5.059 -8.106 1.00 . A A . 19 GLU C 1 1 16 14536 1 1 19 GLU CA C -2.484 -4.874 -8.940 1.00 . A A . 19 GLU CA 1 1 16 14537 1 1 19 GLU CB C -1.946 -6.236 -9.378 1.00 . A A . 19 GLU CB 1 1 16 14538 1 1 19 GLU CD C -3.972 -7.556 -9.994 1.00 . A A . 19 GLU CD 1 1 16 14539 1 1 19 GLU CG C -2.785 -6.762 -10.541 1.00 . A A . 19 GLU CG 1 1 16 14540 1 1 19 GLU H H -0.626 -4.609 -7.885 1.00 . A A . 19 GLU H 1 1 16 14541 1 1 19 GLU HA H -2.731 -4.284 -9.803 1.00 . A A . 19 GLU HA 1 1 16 14542 1 1 19 GLU HB2 H -0.917 -6.134 -9.690 1.00 . A A . 19 GLU HB2 1 1 16 14543 1 1 19 GLU HB3 H -2.006 -6.928 -8.552 1.00 . A A . 19 GLU HB3 1 1 16 14544 1 1 19 GLU HG2 H -3.145 -5.928 -11.126 1.00 . A A . 19 GLU HG2 1 1 16 14545 1 1 19 GLU HG3 H -2.179 -7.404 -11.163 1.00 . A A . 19 GLU HG3 1 1 16 14546 1 1 19 GLU N N -1.454 -4.154 -8.141 1.00 . A A . 19 GLU N 1 1 16 14547 1 1 19 GLU O O -4.842 -4.848 -8.573 1.00 . A A . 19 GLU O 1 1 16 14548 1 1 19 GLU OE1 O -3.751 -8.404 -9.146 1.00 . A A . 19 GLU OE1 1 1 16 14549 1 1 19 GLU OE2 O -5.081 -7.303 -10.431 1.00 . A A . 19 GLU OE2 1 1 16 14550 1 1 20 ILE C C -5.197 -4.184 -5.506 1.00 . A A . 20 ILE C 1 1 16 14551 1 1 20 ILE CA C -4.795 -5.570 -6.013 1.00 . A A . 20 ILE CA 1 1 16 14552 1 1 20 ILE CB C -4.480 -6.477 -4.826 1.00 . A A . 20 ILE CB 1 1 16 14553 1 1 20 ILE CD1 C -2.578 -8.072 -4.844 1.00 . A A . 20 ILE CD1 1 1 16 14554 1 1 20 ILE CG1 C -4.010 -7.819 -5.319 1.00 . A A . 20 ILE CG1 1 1 16 14555 1 1 20 ILE CG2 C -5.728 -6.661 -3.963 1.00 . A A . 20 ILE CG2 1 1 16 14556 1 1 20 ILE H H -2.700 -5.561 -6.494 1.00 . A A . 20 ILE H 1 1 16 14557 1 1 20 ILE HA H -5.603 -5.993 -6.592 1.00 . A A . 20 ILE HA 1 1 16 14558 1 1 20 ILE HB H -3.707 -6.050 -4.248 1.00 . A A . 20 ILE HB 1 1 16 14559 1 1 20 ILE HD11 H -2.114 -7.132 -4.586 1.00 . A A . 20 ILE HD11 1 1 16 14560 1 1 20 ILE HD12 H -2.596 -8.715 -3.976 1.00 . A A . 20 ILE HD12 1 1 16 14561 1 1 20 ILE HD13 H -2.015 -8.547 -5.633 1.00 . A A . 20 ILE HD13 1 1 16 14562 1 1 20 ILE HG12 H -4.655 -8.570 -4.924 1.00 . A A . 20 ILE HG12 1 1 16 14563 1 1 20 ILE HG13 H -4.038 -7.829 -6.386 1.00 . A A . 20 ILE HG13 1 1 16 14564 1 1 20 ILE HG21 H -6.581 -6.236 -4.471 1.00 . A A . 20 ILE HG21 1 1 16 14565 1 1 20 ILE HG22 H -5.898 -7.714 -3.796 1.00 . A A . 20 ILE HG22 1 1 16 14566 1 1 20 ILE HG23 H -5.590 -6.165 -3.015 1.00 . A A . 20 ILE HG23 1 1 16 14567 1 1 20 ILE N N -3.595 -5.417 -6.867 1.00 . A A . 20 ILE N 1 1 16 14568 1 1 20 ILE O O -6.014 -4.049 -4.617 1.00 . A A . 20 ILE O 1 1 16 14569 1 1 21 ALA C C -4.230 -0.753 -6.482 1.00 . A A . 21 ALA C 1 1 16 14570 1 1 21 ALA CA C -4.965 -1.772 -5.610 1.00 . A A . 21 ALA CA 1 1 16 14571 1 1 21 ALA CB C -4.541 -1.597 -4.150 1.00 . A A . 21 ALA CB 1 1 16 14572 1 1 21 ALA H H -3.956 -3.270 -6.783 1.00 . A A . 21 ALA H 1 1 16 14573 1 1 21 ALA HA H -6.030 -1.618 -5.697 1.00 . A A . 21 ALA HA 1 1 16 14574 1 1 21 ALA HB1 H -3.558 -2.022 -4.006 1.00 . A A . 21 ALA HB1 1 1 16 14575 1 1 21 ALA HB2 H -4.519 -0.545 -3.903 1.00 . A A . 21 ALA HB2 1 1 16 14576 1 1 21 ALA HB3 H -5.248 -2.101 -3.507 1.00 . A A . 21 ALA HB3 1 1 16 14577 1 1 21 ALA N N -4.620 -3.146 -6.065 1.00 . A A . 21 ALA N 1 1 16 14578 1 1 21 ALA O O -3.334 -0.072 -6.024 1.00 . A A . 21 ALA O 1 1 16 14579 1 1 22 PRO C C -4.460 1.693 -8.388 1.00 . A A . 22 PRO C 1 1 16 14580 1 1 22 PRO CA C -4.010 0.257 -8.680 1.00 . A A . 22 PRO CA 1 1 16 14581 1 1 22 PRO CB C -4.531 -0.214 -10.038 1.00 . A A . 22 PRO CB 1 1 16 14582 1 1 22 PRO CD C -5.709 -1.480 -8.333 1.00 . A A . 22 PRO CD 1 1 16 14583 1 1 22 PRO CG C -5.817 -0.923 -9.736 1.00 . A A . 22 PRO CG 1 1 16 14584 1 1 22 PRO HA H -2.936 0.178 -8.647 1.00 . A A . 22 PRO HA 1 1 16 14585 1 1 22 PRO HB2 H -4.677 0.645 -10.680 1.00 . A A . 22 PRO HB2 1 1 16 14586 1 1 22 PRO HB3 H -3.812 -0.879 -10.488 1.00 . A A . 22 PRO HB3 1 1 16 14587 1 1 22 PRO HD2 H -6.642 -1.346 -7.803 1.00 . A A . 22 PRO HD2 1 1 16 14588 1 1 22 PRO HD3 H -5.436 -2.522 -8.361 1.00 . A A . 22 PRO HD3 1 1 16 14589 1 1 22 PRO HG2 H -6.639 -0.224 -9.797 1.00 . A A . 22 PRO HG2 1 1 16 14590 1 1 22 PRO HG3 H -5.962 -1.729 -10.438 1.00 . A A . 22 PRO HG3 1 1 16 14591 1 1 22 PRO N N -4.638 -0.688 -7.719 1.00 . A A . 22 PRO N 1 1 16 14592 1 1 22 PRO O O -4.059 2.626 -9.057 1.00 . A A . 22 PRO O 1 1 16 14593 1 1 23 GLY C C -5.214 3.670 -5.699 1.00 . A A . 23 GLY C 1 1 16 14594 1 1 23 GLY CA C -5.764 3.251 -7.064 1.00 . A A . 23 GLY CA 1 1 16 14595 1 1 23 GLY H H -5.601 1.110 -6.871 1.00 . A A . 23 GLY H 1 1 16 14596 1 1 23 GLY HA2 H -5.418 3.942 -7.820 1.00 . A A . 23 GLY HA2 1 1 16 14597 1 1 23 GLY HA3 H -6.843 3.262 -7.031 1.00 . A A . 23 GLY HA3 1 1 16 14598 1 1 23 GLY N N -5.290 1.876 -7.397 1.00 . A A . 23 GLY N 1 1 16 14599 1 1 23 GLY O O -4.932 4.828 -5.461 1.00 . A A . 23 GLY O 1 1 16 14600 1 1 24 ALA C C -2.996 2.977 -3.462 1.00 . A A . 24 ALA C 1 1 16 14601 1 1 24 ALA CA C -4.523 3.088 -3.451 1.00 . A A . 24 ALA CA 1 1 16 14602 1 1 24 ALA CB C -5.100 2.127 -2.409 1.00 . A A . 24 ALA CB 1 1 16 14603 1 1 24 ALA H H -5.288 1.810 -5.007 1.00 . A A . 24 ALA H 1 1 16 14604 1 1 24 ALA HA H -4.807 4.101 -3.203 1.00 . A A . 24 ALA HA 1 1 16 14605 1 1 24 ALA HB1 H -5.122 1.126 -2.815 1.00 . A A . 24 ALA HB1 1 1 16 14606 1 1 24 ALA HB2 H -4.483 2.142 -1.523 1.00 . A A . 24 ALA HB2 1 1 16 14607 1 1 24 ALA HB3 H -6.104 2.434 -2.153 1.00 . A A . 24 ALA HB3 1 1 16 14608 1 1 24 ALA N N -5.056 2.738 -4.799 1.00 . A A . 24 ALA N 1 1 16 14609 1 1 24 ALA O O -2.296 3.848 -2.988 1.00 . A A . 24 ALA O 1 1 16 14610 1 1 25 PHE C C -0.495 2.135 -5.444 1.00 . A A . 25 PHE C 1 1 16 14611 1 1 25 PHE CA C -0.996 1.738 -4.050 1.00 . A A . 25 PHE CA 1 1 16 14612 1 1 25 PHE CB C -0.652 0.265 -3.793 1.00 . A A . 25 PHE CB 1 1 16 14613 1 1 25 PHE CD1 C 1.506 0.888 -2.628 1.00 . A A . 25 PHE CD1 1 1 16 14614 1 1 25 PHE CD2 C 0.057 -0.761 -1.601 1.00 . A A . 25 PHE CD2 1 1 16 14615 1 1 25 PHE CE1 C 2.412 0.747 -1.568 1.00 . A A . 25 PHE CE1 1 1 16 14616 1 1 25 PHE CE2 C 0.967 -0.901 -0.544 1.00 . A A . 25 PHE CE2 1 1 16 14617 1 1 25 PHE CG C 0.326 0.134 -2.644 1.00 . A A . 25 PHE CG 1 1 16 14618 1 1 25 PHE CZ C 2.145 -0.145 -0.529 1.00 . A A . 25 PHE CZ 1 1 16 14619 1 1 25 PHE H H -3.060 1.219 -4.381 1.00 . A A . 25 PHE H 1 1 16 14620 1 1 25 PHE HA H -0.531 2.366 -3.299 1.00 . A A . 25 PHE HA 1 1 16 14621 1 1 25 PHE HB2 H -1.555 -0.274 -3.553 1.00 . A A . 25 PHE HB2 1 1 16 14622 1 1 25 PHE HB3 H -0.212 -0.156 -4.685 1.00 . A A . 25 PHE HB3 1 1 16 14623 1 1 25 PHE HD1 H 1.715 1.579 -3.431 1.00 . A A . 25 PHE HD1 1 1 16 14624 1 1 25 PHE HD2 H -0.852 -1.343 -1.611 1.00 . A A . 25 PHE HD2 1 1 16 14625 1 1 25 PHE HE1 H 3.318 1.325 -1.552 1.00 . A A . 25 PHE HE1 1 1 16 14626 1 1 25 PHE HE2 H 0.758 -1.591 0.260 1.00 . A A . 25 PHE HE2 1 1 16 14627 1 1 25 PHE HZ H 2.847 -0.254 0.286 1.00 . A A . 25 PHE HZ 1 1 16 14628 1 1 25 PHE N N -2.476 1.909 -4.002 1.00 . A A . 25 PHE N 1 1 16 14629 1 1 25 PHE O O -1.177 1.943 -6.432 1.00 . A A . 25 PHE O 1 1 16 14630 1 1 26 ALA C C 2.699 3.463 -6.753 1.00 . A A . 26 ALA C 1 1 16 14631 1 1 26 ALA CA C 1.218 3.084 -6.872 1.00 . A A . 26 ALA CA 1 1 16 14632 1 1 26 ALA CB C 0.429 4.286 -7.395 1.00 . A A . 26 ALA CB 1 1 16 14633 1 1 26 ALA H H 1.219 2.830 -4.731 1.00 . A A . 26 ALA H 1 1 16 14634 1 1 26 ALA HA H 1.114 2.260 -7.562 1.00 . A A . 26 ALA HA 1 1 16 14635 1 1 26 ALA HB1 H 0.351 5.031 -6.617 1.00 . A A . 26 ALA HB1 1 1 16 14636 1 1 26 ALA HB2 H 0.940 4.709 -8.247 1.00 . A A . 26 ALA HB2 1 1 16 14637 1 1 26 ALA HB3 H -0.560 3.968 -7.689 1.00 . A A . 26 ALA HB3 1 1 16 14638 1 1 26 ALA N N 0.686 2.683 -5.536 1.00 . A A . 26 ALA N 1 1 16 14639 1 1 26 ALA O O 3.072 4.314 -5.974 1.00 . A A . 26 ALA O 1 1 16 14640 1 1 27 MET C C 5.192 4.652 -7.775 1.00 . A A . 27 MET C 1 1 16 14641 1 1 27 MET CA C 4.999 3.171 -7.472 1.00 . A A . 27 MET CA 1 1 16 14642 1 1 27 MET CB C 5.753 2.339 -8.513 1.00 . A A . 27 MET CB 1 1 16 14643 1 1 27 MET CE C 8.991 2.777 -10.029 1.00 . A A . 27 MET CE 1 1 16 14644 1 1 27 MET CG C 7.208 2.165 -8.072 1.00 . A A . 27 MET CG 1 1 16 14645 1 1 27 MET H H 3.222 2.163 -8.159 1.00 . A A . 27 MET H 1 1 16 14646 1 1 27 MET HA H 5.377 2.954 -6.494 1.00 . A A . 27 MET HA 1 1 16 14647 1 1 27 MET HB2 H 5.286 1.369 -8.605 1.00 . A A . 27 MET HB2 1 1 16 14648 1 1 27 MET HB3 H 5.726 2.844 -9.465 1.00 . A A . 27 MET HB3 1 1 16 14649 1 1 27 MET HE1 H 8.293 3.594 -10.123 1.00 . A A . 27 MET HE1 1 1 16 14650 1 1 27 MET HE2 H 9.784 3.061 -9.352 1.00 . A A . 27 MET HE2 1 1 16 14651 1 1 27 MET HE3 H 9.405 2.548 -11.002 1.00 . A A . 27 MET HE3 1 1 16 14652 1 1 27 MET HG2 H 7.647 3.135 -7.888 1.00 . A A . 27 MET HG2 1 1 16 14653 1 1 27 MET HG3 H 7.242 1.577 -7.169 1.00 . A A . 27 MET HG3 1 1 16 14654 1 1 27 MET N N 3.545 2.841 -7.532 1.00 . A A . 27 MET N 1 1 16 14655 1 1 27 MET O O 4.401 5.248 -8.479 1.00 . A A . 27 MET O 1 1 16 14656 1 1 27 MET SD S 8.138 1.322 -9.377 1.00 . A A . 27 MET SD 1 1 16 14657 1 1 28 ASP C C 7.835 6.853 -8.112 1.00 . A A . 28 ASP C 1 1 16 14658 1 1 28 ASP CA C 6.425 6.696 -7.589 1.00 . A A . 28 ASP CA 1 1 16 14659 1 1 28 ASP CB C 6.246 7.527 -6.327 1.00 . A A . 28 ASP CB 1 1 16 14660 1 1 28 ASP CG C 5.307 8.699 -6.618 1.00 . A A . 28 ASP CG 1 1 16 14661 1 1 28 ASP H H 6.907 4.794 -6.710 1.00 . A A . 28 ASP H 1 1 16 14662 1 1 28 ASP HA H 5.715 7.005 -8.342 1.00 . A A . 28 ASP HA 1 1 16 14663 1 1 28 ASP HB2 H 5.826 6.911 -5.545 1.00 . A A . 28 ASP HB2 1 1 16 14664 1 1 28 ASP HB3 H 7.205 7.903 -6.016 1.00 . A A . 28 ASP HB3 1 1 16 14665 1 1 28 ASP N N 6.236 5.268 -7.276 1.00 . A A . 28 ASP N 1 1 16 14666 1 1 28 ASP O O 8.640 5.967 -7.921 1.00 . A A . 28 ASP O 1 1 16 14667 1 1 28 ASP OD1 O 4.590 8.626 -7.603 1.00 . A A . 28 ASP OD1 1 1 16 14668 1 1 28 ASP OD2 O 5.320 9.649 -5.852 1.00 . A A . 28 ASP OD2 1 1 16 14669 1 1 29 PRO C C 10.280 8.869 -8.218 1.00 . A A . 29 PRO C 1 1 16 14670 1 1 29 PRO CA C 9.415 8.254 -9.312 1.00 . A A . 29 PRO CA 1 1 16 14671 1 1 29 PRO CB C 9.120 9.261 -10.422 1.00 . A A . 29 PRO CB 1 1 16 14672 1 1 29 PRO CD C 7.145 9.064 -8.986 1.00 . A A . 29 PRO CD 1 1 16 14673 1 1 29 PRO CG C 7.829 9.926 -10.029 1.00 . A A . 29 PRO CG 1 1 16 14674 1 1 29 PRO HA H 9.868 7.363 -9.716 1.00 . A A . 29 PRO HA 1 1 16 14675 1 1 29 PRO HB2 H 9.938 9.966 -10.487 1.00 . A A . 29 PRO HB2 1 1 16 14676 1 1 29 PRO HB3 H 9.023 8.739 -11.359 1.00 . A A . 29 PRO HB3 1 1 16 14677 1 1 29 PRO HD2 H 6.984 9.632 -8.079 1.00 . A A . 29 PRO HD2 1 1 16 14678 1 1 29 PRO HD3 H 6.214 8.685 -9.359 1.00 . A A . 29 PRO HD3 1 1 16 14679 1 1 29 PRO HG2 H 8.038 10.904 -9.619 1.00 . A A . 29 PRO HG2 1 1 16 14680 1 1 29 PRO HG3 H 7.193 10.019 -10.895 1.00 . A A . 29 PRO HG3 1 1 16 14681 1 1 29 PRO N N 8.080 7.968 -8.749 1.00 . A A . 29 PRO N 1 1 16 14682 1 1 29 PRO O O 11.491 8.918 -8.308 1.00 . A A . 29 PRO O 1 1 16 14683 1 1 30 GLU C C 10.666 8.763 -5.045 1.00 . A A . 30 GLU C 1 1 16 14684 1 1 30 GLU CA C 10.399 9.896 -6.024 1.00 . A A . 30 GLU CA 1 1 16 14685 1 1 30 GLU CB C 9.562 10.983 -5.347 1.00 . A A . 30 GLU CB 1 1 16 14686 1 1 30 GLU CD C 9.631 13.262 -4.322 1.00 . A A . 30 GLU CD 1 1 16 14687 1 1 30 GLU CG C 10.440 12.207 -5.078 1.00 . A A . 30 GLU CG 1 1 16 14688 1 1 30 GLU H H 8.671 9.224 -7.121 1.00 . A A . 30 GLU H 1 1 16 14689 1 1 30 GLU HA H 11.335 10.309 -6.373 1.00 . A A . 30 GLU HA 1 1 16 14690 1 1 30 GLU HB2 H 8.741 11.261 -5.994 1.00 . A A . 30 GLU HB2 1 1 16 14691 1 1 30 GLU HB3 H 9.174 10.608 -4.412 1.00 . A A . 30 GLU HB3 1 1 16 14692 1 1 30 GLU HG2 H 11.293 11.913 -4.485 1.00 . A A . 30 GLU HG2 1 1 16 14693 1 1 30 GLU HG3 H 10.779 12.620 -6.017 1.00 . A A . 30 GLU HG3 1 1 16 14694 1 1 30 GLU N N 9.648 9.310 -7.167 1.00 . A A . 30 GLU N 1 1 16 14695 1 1 30 GLU O O 11.662 8.732 -4.350 1.00 . A A . 30 GLU O 1 1 16 14696 1 1 30 GLU OE1 O 8.419 13.132 -4.279 1.00 . A A . 30 GLU OE1 1 1 16 14697 1 1 30 GLU OE2 O 10.237 14.183 -3.800 1.00 . A A . 30 GLU OE2 1 1 16 14698 1 1 31 ILE C C 10.430 5.482 -5.036 1.00 . A A . 31 ILE C 1 1 16 14699 1 1 31 ILE CA C 9.964 6.621 -4.163 1.00 . A A . 31 ILE CA 1 1 16 14700 1 1 31 ILE CB C 8.648 6.193 -3.504 1.00 . A A . 31 ILE CB 1 1 16 14701 1 1 31 ILE CD1 C 7.904 8.231 -2.219 1.00 . A A . 31 ILE CD1 1 1 16 14702 1 1 31 ILE CG1 C 7.656 7.359 -3.456 1.00 . A A . 31 ILE CG1 1 1 16 14703 1 1 31 ILE CG2 C 8.933 5.688 -2.087 1.00 . A A . 31 ILE CG2 1 1 16 14704 1 1 31 ILE H H 9.018 7.848 -5.641 1.00 . A A . 31 ILE H 1 1 16 14705 1 1 31 ILE HA H 10.690 6.820 -3.419 1.00 . A A . 31 ILE HA 1 1 16 14706 1 1 31 ILE HB H 8.219 5.385 -4.082 1.00 . A A . 31 ILE HB 1 1 16 14707 1 1 31 ILE HD11 H 8.959 8.233 -1.986 1.00 . A A . 31 ILE HD11 1 1 16 14708 1 1 31 ILE HD12 H 7.577 9.241 -2.420 1.00 . A A . 31 ILE HD12 1 1 16 14709 1 1 31 ILE HD13 H 7.351 7.833 -1.380 1.00 . A A . 31 ILE HD13 1 1 16 14710 1 1 31 ILE HG12 H 7.763 7.959 -4.338 1.00 . A A . 31 ILE HG12 1 1 16 14711 1 1 31 ILE HG13 H 6.656 6.959 -3.419 1.00 . A A . 31 ILE HG13 1 1 16 14712 1 1 31 ILE HG21 H 9.482 6.439 -1.541 1.00 . A A . 31 ILE HG21 1 1 16 14713 1 1 31 ILE HG22 H 8.000 5.484 -1.583 1.00 . A A . 31 ILE HG22 1 1 16 14714 1 1 31 ILE HG23 H 9.519 4.782 -2.139 1.00 . A A . 31 ILE HG23 1 1 16 14715 1 1 31 ILE N N 9.785 7.805 -5.035 1.00 . A A . 31 ILE N 1 1 16 14716 1 1 31 ILE O O 10.878 4.459 -4.556 1.00 . A A . 31 ILE O 1 1 16 14717 1 1 32 GLU C C 10.105 3.274 -6.637 1.00 . A A . 32 GLU C 1 1 16 14718 1 1 32 GLU CA C 10.645 4.546 -7.254 1.00 . A A . 32 GLU CA 1 1 16 14719 1 1 32 GLU CB C 12.164 4.470 -7.409 1.00 . A A . 32 GLU CB 1 1 16 14720 1 1 32 GLU CD C 14.098 5.965 -7.932 1.00 . A A . 32 GLU CD 1 1 16 14721 1 1 32 GLU CG C 12.646 5.634 -8.278 1.00 . A A . 32 GLU CG 1 1 16 14722 1 1 32 GLU H H 9.876 6.456 -6.679 1.00 . A A . 32 GLU H 1 1 16 14723 1 1 32 GLU HA H 10.172 4.718 -8.210 1.00 . A A . 32 GLU HA 1 1 16 14724 1 1 32 GLU HB2 H 12.629 4.530 -6.434 1.00 . A A . 32 GLU HB2 1 1 16 14725 1 1 32 GLU HB3 H 12.433 3.536 -7.879 1.00 . A A . 32 GLU HB3 1 1 16 14726 1 1 32 GLU HG2 H 12.579 5.357 -9.320 1.00 . A A . 32 GLU HG2 1 1 16 14727 1 1 32 GLU HG3 H 12.027 6.500 -8.095 1.00 . A A . 32 GLU HG3 1 1 16 14728 1 1 32 GLU N N 10.276 5.636 -6.326 1.00 . A A . 32 GLU N 1 1 16 14729 1 1 32 GLU O O 10.678 2.209 -6.744 1.00 . A A . 32 GLU O 1 1 16 14730 1 1 32 GLU OE1 O 14.980 5.343 -8.502 1.00 . A A . 32 GLU OE1 1 1 16 14731 1 1 32 GLU OE2 O 14.305 6.837 -7.104 1.00 . A A . 32 GLU OE2 1 1 16 14732 1 1 33 LYS C C 6.940 2.437 -4.964 1.00 . A A . 33 LYS C 1 1 16 14733 1 1 33 LYS CA C 8.424 2.219 -5.246 1.00 . A A . 33 LYS CA 1 1 16 14734 1 1 33 LYS CB C 9.153 2.007 -3.918 1.00 . A A . 33 LYS CB 1 1 16 14735 1 1 33 LYS CD C 11.570 1.563 -3.474 1.00 . A A . 33 LYS CD 1 1 16 14736 1 1 33 LYS CE C 12.786 1.083 -4.267 1.00 . A A . 33 LYS CE 1 1 16 14737 1 1 33 LYS CG C 10.295 1.007 -4.110 1.00 . A A . 33 LYS CG 1 1 16 14738 1 1 33 LYS H H 8.579 4.314 -5.854 1.00 . A A . 33 LYS H 1 1 16 14739 1 1 33 LYS HA H 8.549 1.342 -5.863 1.00 . A A . 33 LYS HA 1 1 16 14740 1 1 33 LYS HB2 H 9.554 2.950 -3.573 1.00 . A A . 33 LYS HB2 1 1 16 14741 1 1 33 LYS HB3 H 8.460 1.622 -3.185 1.00 . A A . 33 LYS HB3 1 1 16 14742 1 1 33 LYS HD2 H 11.536 2.643 -3.482 1.00 . A A . 33 LYS HD2 1 1 16 14743 1 1 33 LYS HD3 H 11.647 1.212 -2.455 1.00 . A A . 33 LYS HD3 1 1 16 14744 1 1 33 LYS HE2 H 13.665 1.131 -3.642 1.00 . A A . 33 LYS HE2 1 1 16 14745 1 1 33 LYS HE3 H 12.627 0.065 -4.589 1.00 . A A . 33 LYS HE3 1 1 16 14746 1 1 33 LYS HG2 H 10.034 0.071 -3.638 1.00 . A A . 33 LYS HG2 1 1 16 14747 1 1 33 LYS HG3 H 10.460 0.846 -5.163 1.00 . A A . 33 LYS HG3 1 1 16 14748 1 1 33 LYS HZ1 H 13.067 2.947 -5.152 1.00 . A A . 33 LYS HZ1 1 1 16 14749 1 1 33 LYS HZ2 H 13.838 1.670 -5.965 1.00 . A A . 33 LYS HZ2 1 1 16 14750 1 1 33 LYS HZ3 H 12.156 1.868 -6.091 1.00 . A A . 33 LYS HZ3 1 1 16 14751 1 1 33 LYS N N 9.006 3.411 -5.940 1.00 . A A . 33 LYS N 1 1 16 14752 1 1 33 LYS NZ N 12.976 1.958 -5.458 1.00 . A A . 33 LYS NZ 1 1 16 14753 1 1 33 LYS O O 6.480 3.553 -4.818 1.00 . A A . 33 LYS O 1 1 16 14754 1 1 34 ALA C C 4.511 2.201 -3.271 1.00 . A A . 34 ALA C 1 1 16 14755 1 1 34 ALA CA C 4.727 1.500 -4.611 1.00 . A A . 34 ALA CA 1 1 16 14756 1 1 34 ALA CB C 4.099 0.106 -4.560 1.00 . A A . 34 ALA CB 1 1 16 14757 1 1 34 ALA H H 6.584 0.484 -5.005 1.00 . A A . 34 ALA H 1 1 16 14758 1 1 34 ALA HA H 4.259 2.072 -5.395 1.00 . A A . 34 ALA HA 1 1 16 14759 1 1 34 ALA HB1 H 4.847 -0.636 -4.797 1.00 . A A . 34 ALA HB1 1 1 16 14760 1 1 34 ALA HB2 H 3.709 -0.078 -3.570 1.00 . A A . 34 ALA HB2 1 1 16 14761 1 1 34 ALA HB3 H 3.294 0.047 -5.279 1.00 . A A . 34 ALA HB3 1 1 16 14762 1 1 34 ALA N N 6.187 1.373 -4.884 1.00 . A A . 34 ALA N 1 1 16 14763 1 1 34 ALA O O 5.296 2.069 -2.357 1.00 . A A . 34 ALA O 1 1 16 14764 1 1 35 TYR C C 1.612 3.783 -1.710 1.00 . A A . 35 TYR C 1 1 16 14765 1 1 35 TYR CA C 3.129 3.643 -1.868 1.00 . A A . 35 TYR CA 1 1 16 14766 1 1 35 TYR CB C 3.808 5.026 -1.863 1.00 . A A . 35 TYR CB 1 1 16 14767 1 1 35 TYR CD1 C 2.290 5.657 -3.801 1.00 . A A . 35 TYR CD1 1 1 16 14768 1 1 35 TYR CD2 C 3.067 7.394 -2.302 1.00 . A A . 35 TYR CD2 1 1 16 14769 1 1 35 TYR CE1 C 1.590 6.613 -4.546 1.00 . A A . 35 TYR CE1 1 1 16 14770 1 1 35 TYR CE2 C 2.367 8.349 -3.048 1.00 . A A . 35 TYR CE2 1 1 16 14771 1 1 35 TYR CG C 3.029 6.044 -2.676 1.00 . A A . 35 TYR CG 1 1 16 14772 1 1 35 TYR CZ C 1.627 7.957 -4.170 1.00 . A A . 35 TYR CZ 1 1 16 14773 1 1 35 TYR H H 2.819 2.997 -3.901 1.00 . A A . 35 TYR H 1 1 16 14774 1 1 35 TYR HA H 3.511 3.064 -1.035 1.00 . A A . 35 TYR HA 1 1 16 14775 1 1 35 TYR HB2 H 3.883 5.375 -0.846 1.00 . A A . 35 TYR HB2 1 1 16 14776 1 1 35 TYR HB3 H 4.802 4.932 -2.277 1.00 . A A . 35 TYR HB3 1 1 16 14777 1 1 35 TYR HD1 H 2.253 4.625 -4.091 1.00 . A A . 35 TYR HD1 1 1 16 14778 1 1 35 TYR HD2 H 3.637 7.697 -1.436 1.00 . A A . 35 TYR HD2 1 1 16 14779 1 1 35 TYR HE1 H 1.021 6.310 -5.413 1.00 . A A . 35 TYR HE1 1 1 16 14780 1 1 35 TYR HE2 H 2.396 9.389 -2.755 1.00 . A A . 35 TYR HE2 1 1 16 14781 1 1 35 TYR HH H 1.014 8.666 -5.833 1.00 . A A . 35 TYR HH 1 1 16 14782 1 1 35 TYR N N 3.435 2.930 -3.149 1.00 . A A . 35 TYR N 1 1 16 14783 1 1 35 TYR O O 0.881 3.913 -2.671 1.00 . A A . 35 TYR O 1 1 16 14784 1 1 35 TYR OH O 0.938 8.900 -4.904 1.00 . A A . 35 TYR OH 1 1 16 14785 1 1 36 VAL C C -0.677 5.346 -0.116 1.00 . A A . 36 VAL C 1 1 16 14786 1 1 36 VAL CA C -0.336 3.865 -0.281 1.00 . A A . 36 VAL CA 1 1 16 14787 1 1 36 VAL CB C -0.733 3.071 0.974 1.00 . A A . 36 VAL CB 1 1 16 14788 1 1 36 VAL CG1 C -1.979 3.676 1.627 1.00 . A A . 36 VAL CG1 1 1 16 14789 1 1 36 VAL CG2 C -1.035 1.625 0.576 1.00 . A A . 36 VAL CG2 1 1 16 14790 1 1 36 VAL H H 1.734 3.623 0.263 1.00 . A A . 36 VAL H 1 1 16 14791 1 1 36 VAL HA H -0.861 3.470 -1.139 1.00 . A A . 36 VAL HA 1 1 16 14792 1 1 36 VAL HB H 0.083 3.087 1.681 1.00 . A A . 36 VAL HB 1 1 16 14793 1 1 36 VAL HG11 H -2.723 3.870 0.870 1.00 . A A . 36 VAL HG11 1 1 16 14794 1 1 36 VAL HG12 H -2.376 2.983 2.354 1.00 . A A . 36 VAL HG12 1 1 16 14795 1 1 36 VAL HG13 H -1.714 4.601 2.119 1.00 . A A . 36 VAL HG13 1 1 16 14796 1 1 36 VAL HG21 H -0.350 1.315 -0.199 1.00 . A A . 36 VAL HG21 1 1 16 14797 1 1 36 VAL HG22 H -0.919 0.982 1.437 1.00 . A A . 36 VAL HG22 1 1 16 14798 1 1 36 VAL HG23 H -2.049 1.556 0.210 1.00 . A A . 36 VAL HG23 1 1 16 14799 1 1 36 VAL N N 1.131 3.741 -0.500 1.00 . A A . 36 VAL N 1 1 16 14800 1 1 36 VAL O O -0.523 5.918 0.945 1.00 . A A . 36 VAL O 1 1 16 14801 1 1 37 LYS C C -2.972 7.623 -1.116 1.00 . A A . 37 LYS C 1 1 16 14802 1 1 37 LYS CA C -1.458 7.425 -1.073 1.00 . A A . 37 LYS CA 1 1 16 14803 1 1 37 LYS CB C -0.825 8.164 -2.251 1.00 . A A . 37 LYS CB 1 1 16 14804 1 1 37 LYS CD C -1.651 8.804 -4.521 1.00 . A A . 37 LYS CD 1 1 16 14805 1 1 37 LYS CE C -1.435 8.332 -5.961 1.00 . A A . 37 LYS CE 1 1 16 14806 1 1 37 LYS CG C -1.412 7.636 -3.561 1.00 . A A . 37 LYS CG 1 1 16 14807 1 1 37 LYS H H -1.228 5.493 -2.017 1.00 . A A . 37 LYS H 1 1 16 14808 1 1 37 LYS HA H -1.069 7.824 -0.150 1.00 . A A . 37 LYS HA 1 1 16 14809 1 1 37 LYS HB2 H -1.028 9.222 -2.162 1.00 . A A . 37 LYS HB2 1 1 16 14810 1 1 37 LYS HB3 H 0.240 8.000 -2.245 1.00 . A A . 37 LYS HB3 1 1 16 14811 1 1 37 LYS HD2 H -2.664 9.162 -4.407 1.00 . A A . 37 LYS HD2 1 1 16 14812 1 1 37 LYS HD3 H -0.958 9.601 -4.298 1.00 . A A . 37 LYS HD3 1 1 16 14813 1 1 37 LYS HE2 H -1.001 9.134 -6.541 1.00 . A A . 37 LYS HE2 1 1 16 14814 1 1 37 LYS HE3 H -0.769 7.484 -5.965 1.00 . A A . 37 LYS HE3 1 1 16 14815 1 1 37 LYS HG2 H -0.722 6.936 -4.008 1.00 . A A . 37 LYS HG2 1 1 16 14816 1 1 37 LYS HG3 H -2.350 7.140 -3.361 1.00 . A A . 37 LYS HG3 1 1 16 14817 1 1 37 LYS HZ1 H -3.449 7.828 -5.802 1.00 . A A . 37 LYS HZ1 1 1 16 14818 1 1 37 LYS HZ2 H -3.057 8.678 -7.219 1.00 . A A . 37 LYS HZ2 1 1 16 14819 1 1 37 LYS HZ3 H -2.636 7.042 -7.070 1.00 . A A . 37 LYS HZ3 1 1 16 14820 1 1 37 LYS N N -1.123 5.974 -1.165 1.00 . A A . 37 LYS N 1 1 16 14821 1 1 37 LYS NZ N -2.743 7.941 -6.558 1.00 . A A . 37 LYS NZ 1 1 16 14822 1 1 37 LYS O O -3.488 8.621 -0.655 1.00 . A A . 37 LYS O 1 1 16 14823 1 1 38 ASP C C -5.851 5.721 -0.978 1.00 . A A . 38 ASP C 1 1 16 14824 1 1 38 ASP CA C -5.166 6.849 -1.753 1.00 . A A . 38 ASP CA 1 1 16 14825 1 1 38 ASP CB C -5.597 6.806 -3.219 1.00 . A A . 38 ASP CB 1 1 16 14826 1 1 38 ASP CG C -7.120 6.907 -3.308 1.00 . A A . 38 ASP CG 1 1 16 14827 1 1 38 ASP H H -3.257 5.896 -2.053 1.00 . A A . 38 ASP H 1 1 16 14828 1 1 38 ASP HA H -5.448 7.800 -1.326 1.00 . A A . 38 ASP HA 1 1 16 14829 1 1 38 ASP HB2 H -5.149 7.635 -3.749 1.00 . A A . 38 ASP HB2 1 1 16 14830 1 1 38 ASP HB3 H -5.270 5.877 -3.664 1.00 . A A . 38 ASP HB3 1 1 16 14831 1 1 38 ASP N N -3.689 6.692 -1.675 1.00 . A A . 38 ASP N 1 1 16 14832 1 1 38 ASP O O -5.622 4.553 -1.228 1.00 . A A . 38 ASP O 1 1 16 14833 1 1 38 ASP OD1 O -7.742 7.108 -2.278 1.00 . A A . 38 ASP OD1 1 1 16 14834 1 1 38 ASP OD2 O -7.640 6.783 -4.404 1.00 . A A . 38 ASP OD2 1 1 16 14835 1 1 39 VAL C C -8.663 4.578 0.011 1.00 . A A . 39 VAL C 1 1 16 14836 1 1 39 VAL CA C -7.395 5.010 0.751 1.00 . A A . 39 VAL CA 1 1 16 14837 1 1 39 VAL CB C -7.771 5.566 2.127 1.00 . A A . 39 VAL CB 1 1 16 14838 1 1 39 VAL CG1 C -6.524 6.129 2.810 1.00 . A A . 39 VAL CG1 1 1 16 14839 1 1 39 VAL CG2 C -8.808 6.682 1.961 1.00 . A A . 39 VAL CG2 1 1 16 14840 1 1 39 VAL H H -6.865 7.008 0.145 1.00 . A A . 39 VAL H 1 1 16 14841 1 1 39 VAL HA H -6.743 4.158 0.874 1.00 . A A . 39 VAL HA 1 1 16 14842 1 1 39 VAL HB H -8.186 4.773 2.733 1.00 . A A . 39 VAL HB 1 1 16 14843 1 1 39 VAL HG11 H -5.683 6.064 2.136 1.00 . A A . 39 VAL HG11 1 1 16 14844 1 1 39 VAL HG12 H -6.695 7.162 3.077 1.00 . A A . 39 VAL HG12 1 1 16 14845 1 1 39 VAL HG13 H -6.314 5.557 3.703 1.00 . A A . 39 VAL HG13 1 1 16 14846 1 1 39 VAL HG21 H -9.629 6.323 1.360 1.00 . A A . 39 VAL HG21 1 1 16 14847 1 1 39 VAL HG22 H -9.176 6.977 2.933 1.00 . A A . 39 VAL HG22 1 1 16 14848 1 1 39 VAL HG23 H -8.349 7.530 1.477 1.00 . A A . 39 VAL HG23 1 1 16 14849 1 1 39 VAL N N -6.693 6.061 -0.039 1.00 . A A . 39 VAL N 1 1 16 14850 1 1 39 VAL O O -9.056 3.429 0.053 1.00 . A A . 39 VAL O 1 1 16 14851 1 1 40 GLU C C -10.177 4.504 -2.753 1.00 . A A . 40 GLU C 1 1 16 14852 1 1 40 GLU CA C -10.549 5.127 -1.407 1.00 . A A . 40 GLU CA 1 1 16 14853 1 1 40 GLU CB C -11.387 6.384 -1.646 1.00 . A A . 40 GLU CB 1 1 16 14854 1 1 40 GLU CD C -10.196 8.577 -1.755 1.00 . A A . 40 GLU CD 1 1 16 14855 1 1 40 GLU CG C -10.615 7.343 -2.554 1.00 . A A . 40 GLU CG 1 1 16 14856 1 1 40 GLU H H -8.975 6.410 -0.688 1.00 . A A . 40 GLU H 1 1 16 14857 1 1 40 GLU HA H -11.121 4.418 -0.828 1.00 . A A . 40 GLU HA 1 1 16 14858 1 1 40 GLU HB2 H -12.319 6.110 -2.119 1.00 . A A . 40 GLU HB2 1 1 16 14859 1 1 40 GLU HB3 H -11.589 6.869 -0.703 1.00 . A A . 40 GLU HB3 1 1 16 14860 1 1 40 GLU HG2 H -9.736 6.845 -2.938 1.00 . A A . 40 GLU HG2 1 1 16 14861 1 1 40 GLU HG3 H -11.245 7.645 -3.377 1.00 . A A . 40 GLU HG3 1 1 16 14862 1 1 40 GLU N N -9.308 5.489 -0.666 1.00 . A A . 40 GLU N 1 1 16 14863 1 1 40 GLU O O -11.012 3.966 -3.450 1.00 . A A . 40 GLU O 1 1 16 14864 1 1 40 GLU OE1 O -9.985 8.442 -0.561 1.00 . A A . 40 GLU OE1 1 1 16 14865 1 1 40 GLU OE2 O -10.092 9.637 -2.351 1.00 . A A . 40 GLU OE2 1 1 16 14866 1 1 41 GLY C C -8.728 2.476 -4.400 1.00 . A A . 41 GLY C 1 1 16 14867 1 1 41 GLY CA C -8.506 3.989 -4.428 1.00 . A A . 41 GLY CA 1 1 16 14868 1 1 41 GLY H H -8.270 5.015 -2.548 1.00 . A A . 41 GLY H 1 1 16 14869 1 1 41 GLY HA2 H -9.090 4.426 -5.224 1.00 . A A . 41 GLY HA2 1 1 16 14870 1 1 41 GLY HA3 H -7.459 4.192 -4.592 1.00 . A A . 41 GLY HA3 1 1 16 14871 1 1 41 GLY N N -8.929 4.576 -3.124 1.00 . A A . 41 GLY N 1 1 16 14872 1 1 41 GLY O O -8.782 1.828 -5.426 1.00 . A A . 41 GLY O 1 1 16 14873 1 1 42 ALA C C -9.868 0.117 -1.869 1.00 . A A . 42 ALA C 1 1 16 14874 1 1 42 ALA CA C -9.080 0.438 -3.141 1.00 . A A . 42 ALA CA 1 1 16 14875 1 1 42 ALA CB C -7.729 -0.279 -3.103 1.00 . A A . 42 ALA CB 1 1 16 14876 1 1 42 ALA H H -8.815 2.449 -2.416 1.00 . A A . 42 ALA H 1 1 16 14877 1 1 42 ALA HA H -9.640 0.104 -4.004 1.00 . A A . 42 ALA HA 1 1 16 14878 1 1 42 ALA HB1 H -6.950 0.405 -3.411 1.00 . A A . 42 ALA HB1 1 1 16 14879 1 1 42 ALA HB2 H -7.531 -0.623 -2.099 1.00 . A A . 42 ALA HB2 1 1 16 14880 1 1 42 ALA HB3 H -7.751 -1.124 -3.775 1.00 . A A . 42 ALA HB3 1 1 16 14881 1 1 42 ALA N N -8.861 1.908 -3.233 1.00 . A A . 42 ALA N 1 1 16 14882 1 1 42 ALA O O -9.557 0.595 -0.796 1.00 . A A . 42 ALA O 1 1 16 14883 1 1 43 SER C C -10.823 -1.729 0.255 1.00 . A A . 43 SER C 1 1 16 14884 1 1 43 SER CA C -11.705 -1.034 -0.784 1.00 . A A . 43 SER CA 1 1 16 14885 1 1 43 SER CB C -12.841 -1.970 -1.194 1.00 . A A . 43 SER CB 1 1 16 14886 1 1 43 SER H H -11.126 -1.056 -2.858 1.00 . A A . 43 SER H 1 1 16 14887 1 1 43 SER HA H -12.119 -0.133 -0.357 1.00 . A A . 43 SER HA 1 1 16 14888 1 1 43 SER HB2 H -12.707 -2.930 -0.724 1.00 . A A . 43 SER HB2 1 1 16 14889 1 1 43 SER HB3 H -13.785 -1.546 -0.877 1.00 . A A . 43 SER HB3 1 1 16 14890 1 1 43 SER HG H -13.634 -2.592 -2.858 1.00 . A A . 43 SER HG 1 1 16 14891 1 1 43 SER N N -10.891 -0.685 -1.982 1.00 . A A . 43 SER N 1 1 16 14892 1 1 43 SER O O -9.811 -2.325 -0.070 1.00 . A A . 43 SER O 1 1 16 14893 1 1 43 SER OG O -12.829 -2.133 -2.605 1.00 . A A . 43 SER OG 1 1 16 14894 1 1 44 GLN C C -10.084 -3.752 2.171 1.00 . A A . 44 GLN C 1 1 16 14895 1 1 44 GLN CA C -10.392 -2.309 2.571 1.00 . A A . 44 GLN CA 1 1 16 14896 1 1 44 GLN CB C -11.179 -2.299 3.884 1.00 . A A . 44 GLN CB 1 1 16 14897 1 1 44 GLN CD C -13.582 -2.194 4.558 1.00 . A A . 44 GLN CD 1 1 16 14898 1 1 44 GLN CG C -12.567 -2.898 3.655 1.00 . A A . 44 GLN CG 1 1 16 14899 1 1 44 GLN H H -12.019 -1.172 1.739 1.00 . A A . 44 GLN H 1 1 16 14900 1 1 44 GLN HA H -9.467 -1.767 2.703 1.00 . A A . 44 GLN HA 1 1 16 14901 1 1 44 GLN HB2 H -10.650 -2.883 4.624 1.00 . A A . 44 GLN HB2 1 1 16 14902 1 1 44 GLN HB3 H -11.280 -1.282 4.234 1.00 . A A . 44 GLN HB3 1 1 16 14903 1 1 44 GLN HE21 H -15.125 -3.243 3.881 1.00 . A A . 44 GLN HE21 1 1 16 14904 1 1 44 GLN HE22 H -15.496 -2.094 5.075 1.00 . A A . 44 GLN HE22 1 1 16 14905 1 1 44 GLN HG2 H -12.851 -2.763 2.620 1.00 . A A . 44 GLN HG2 1 1 16 14906 1 1 44 GLN HG3 H -12.548 -3.950 3.889 1.00 . A A . 44 GLN HG3 1 1 16 14907 1 1 44 GLN N N -11.201 -1.657 1.503 1.00 . A A . 44 GLN N 1 1 16 14908 1 1 44 GLN NE2 N -14.838 -2.539 4.500 1.00 . A A . 44 GLN NE2 1 1 16 14909 1 1 44 GLN O O -8.970 -4.215 2.301 1.00 . A A . 44 GLN O 1 1 16 14910 1 1 44 GLN OE1 O -13.227 -1.321 5.326 1.00 . A A . 44 GLN OE1 1 1 16 14911 1 1 45 GLU C C -9.821 -5.890 0.107 1.00 . A A . 45 GLU C 1 1 16 14912 1 1 45 GLU CA C -10.813 -5.877 1.270 1.00 . A A . 45 GLU CA 1 1 16 14913 1 1 45 GLU CB C -12.130 -6.520 0.829 1.00 . A A . 45 GLU CB 1 1 16 14914 1 1 45 GLU CD C -12.939 -7.889 2.757 1.00 . A A . 45 GLU CD 1 1 16 14915 1 1 45 GLU CG C -13.100 -6.563 2.011 1.00 . A A . 45 GLU CG 1 1 16 14916 1 1 45 GLU H H -11.952 -4.075 1.582 1.00 . A A . 45 GLU H 1 1 16 14917 1 1 45 GLU HA H -10.402 -6.429 2.102 1.00 . A A . 45 GLU HA 1 1 16 14918 1 1 45 GLU HB2 H -12.563 -5.938 0.028 1.00 . A A . 45 GLU HB2 1 1 16 14919 1 1 45 GLU HB3 H -11.942 -7.525 0.483 1.00 . A A . 45 GLU HB3 1 1 16 14920 1 1 45 GLU HG2 H -12.886 -5.744 2.683 1.00 . A A . 45 GLU HG2 1 1 16 14921 1 1 45 GLU HG3 H -14.114 -6.478 1.649 1.00 . A A . 45 GLU HG3 1 1 16 14922 1 1 45 GLU N N -11.060 -4.466 1.682 1.00 . A A . 45 GLU N 1 1 16 14923 1 1 45 GLU O O -9.197 -6.895 -0.184 1.00 . A A . 45 GLU O 1 1 16 14924 1 1 45 GLU OE1 O -11.813 -8.345 2.880 1.00 . A A . 45 GLU OE1 1 1 16 14925 1 1 45 GLU OE2 O -13.943 -8.427 3.191 1.00 . A A . 45 GLU OE2 1 1 16 14926 1 1 46 GLU C C -7.350 -4.284 -1.098 1.00 . A A . 46 GLU C 1 1 16 14927 1 1 46 GLU CA C -8.689 -4.702 -1.674 1.00 . A A . 46 GLU CA 1 1 16 14928 1 1 46 GLU CB C -9.155 -3.657 -2.687 1.00 . A A . 46 GLU CB 1 1 16 14929 1 1 46 GLU CD C -11.005 -3.038 -4.244 1.00 . A A . 46 GLU CD 1 1 16 14930 1 1 46 GLU CG C -10.612 -3.925 -3.061 1.00 . A A . 46 GLU CG 1 1 16 14931 1 1 46 GLU H H -10.146 -3.968 -0.274 1.00 . A A . 46 GLU H 1 1 16 14932 1 1 46 GLU HA H -8.603 -5.668 -2.149 1.00 . A A . 46 GLU HA 1 1 16 14933 1 1 46 GLU HB2 H -9.069 -2.673 -2.250 1.00 . A A . 46 GLU HB2 1 1 16 14934 1 1 46 GLU HB3 H -8.539 -3.714 -3.569 1.00 . A A . 46 GLU HB3 1 1 16 14935 1 1 46 GLU HG2 H -10.729 -4.964 -3.333 1.00 . A A . 46 GLU HG2 1 1 16 14936 1 1 46 GLU HG3 H -11.244 -3.698 -2.216 1.00 . A A . 46 GLU HG3 1 1 16 14937 1 1 46 GLU N N -9.653 -4.772 -0.545 1.00 . A A . 46 GLU N 1 1 16 14938 1 1 46 GLU O O -6.325 -4.874 -1.367 1.00 . A A . 46 GLU O 1 1 16 14939 1 1 46 GLU OE1 O -10.597 -1.889 -4.259 1.00 . A A . 46 GLU OE1 1 1 16 14940 1 1 46 GLU OE2 O -11.706 -3.524 -5.115 1.00 . A A . 46 GLU OE2 1 1 16 14941 1 1 47 VAL C C -5.525 -4.004 1.135 1.00 . A A . 47 VAL C 1 1 16 14942 1 1 47 VAL CA C -6.117 -2.820 0.363 1.00 . A A . 47 VAL CA 1 1 16 14943 1 1 47 VAL CB C -6.451 -1.662 1.315 1.00 . A A . 47 VAL CB 1 1 16 14944 1 1 47 VAL CG1 C -5.460 -1.624 2.476 1.00 . A A . 47 VAL CG1 1 1 16 14945 1 1 47 VAL CG2 C -6.385 -0.341 0.548 1.00 . A A . 47 VAL CG2 1 1 16 14946 1 1 47 VAL H H -8.208 -2.842 -0.069 1.00 . A A . 47 VAL H 1 1 16 14947 1 1 47 VAL HA H -5.419 -2.486 -0.392 1.00 . A A . 47 VAL HA 1 1 16 14948 1 1 47 VAL HB H -7.449 -1.799 1.705 1.00 . A A . 47 VAL HB 1 1 16 14949 1 1 47 VAL HG11 H -4.479 -1.900 2.118 1.00 . A A . 47 VAL HG11 1 1 16 14950 1 1 47 VAL HG12 H -5.428 -0.627 2.887 1.00 . A A . 47 VAL HG12 1 1 16 14951 1 1 47 VAL HG13 H -5.776 -2.320 3.238 1.00 . A A . 47 VAL HG13 1 1 16 14952 1 1 47 VAL HG21 H -6.323 -0.541 -0.511 1.00 . A A . 47 VAL HG21 1 1 16 14953 1 1 47 VAL HG22 H -7.272 0.240 0.753 1.00 . A A . 47 VAL HG22 1 1 16 14954 1 1 47 VAL HG23 H -5.512 0.213 0.860 1.00 . A A . 47 VAL HG23 1 1 16 14955 1 1 47 VAL N N -7.369 -3.279 -0.277 1.00 . A A . 47 VAL N 1 1 16 14956 1 1 47 VAL O O -4.327 -4.208 1.162 1.00 . A A . 47 VAL O 1 1 16 14957 1 1 48 GLU C C -5.331 -6.998 1.559 1.00 . A A . 48 GLU C 1 1 16 14958 1 1 48 GLU CA C -5.896 -5.950 2.519 1.00 . A A . 48 GLU CA 1 1 16 14959 1 1 48 GLU CB C -7.104 -6.510 3.248 1.00 . A A . 48 GLU CB 1 1 16 14960 1 1 48 GLU CD C -7.356 -7.724 5.414 1.00 . A A . 48 GLU CD 1 1 16 14961 1 1 48 GLU CG C -6.872 -6.434 4.750 1.00 . A A . 48 GLU CG 1 1 16 14962 1 1 48 GLU H H -7.323 -4.614 1.727 1.00 . A A . 48 GLU H 1 1 16 14963 1 1 48 GLU HA H -5.144 -5.651 3.232 1.00 . A A . 48 GLU HA 1 1 16 14964 1 1 48 GLU HB2 H -7.976 -5.924 2.991 1.00 . A A . 48 GLU HB2 1 1 16 14965 1 1 48 GLU HB3 H -7.259 -7.522 2.950 1.00 . A A . 48 GLU HB3 1 1 16 14966 1 1 48 GLU HG2 H -5.819 -6.298 4.942 1.00 . A A . 48 GLU HG2 1 1 16 14967 1 1 48 GLU HG3 H -7.421 -5.594 5.146 1.00 . A A . 48 GLU HG3 1 1 16 14968 1 1 48 GLU N N -6.366 -4.787 1.758 1.00 . A A . 48 GLU N 1 1 16 14969 1 1 48 GLU O O -4.169 -7.349 1.626 1.00 . A A . 48 GLU O 1 1 16 14970 1 1 48 GLU OE1 O -7.911 -8.554 4.714 1.00 . A A . 48 GLU OE1 1 1 16 14971 1 1 48 GLU OE2 O -7.165 -7.858 6.612 1.00 . A A . 48 GLU OE2 1 1 16 14972 1 1 49 GLU C C -4.362 -7.991 -0.960 1.00 . A A . 49 GLU C 1 1 16 14973 1 1 49 GLU CA C -5.633 -8.523 -0.298 1.00 . A A . 49 GLU CA 1 1 16 14974 1 1 49 GLU CB C -6.690 -8.790 -1.372 1.00 . A A . 49 GLU CB 1 1 16 14975 1 1 49 GLU CD C -8.104 -10.847 -1.442 1.00 . A A . 49 GLU CD 1 1 16 14976 1 1 49 GLU CG C -7.889 -9.502 -0.745 1.00 . A A . 49 GLU CG 1 1 16 14977 1 1 49 GLU H H -7.073 -7.206 0.622 1.00 . A A . 49 GLU H 1 1 16 14978 1 1 49 GLU HA H -5.411 -9.438 0.230 1.00 . A A . 49 GLU HA 1 1 16 14979 1 1 49 GLU HB2 H -7.011 -7.852 -1.801 1.00 . A A . 49 GLU HB2 1 1 16 14980 1 1 49 GLU HB3 H -6.268 -9.414 -2.145 1.00 . A A . 49 GLU HB3 1 1 16 14981 1 1 49 GLU HG2 H -7.702 -9.665 0.307 1.00 . A A . 49 GLU HG2 1 1 16 14982 1 1 49 GLU HG3 H -8.772 -8.892 -0.864 1.00 . A A . 49 GLU HG3 1 1 16 14983 1 1 49 GLU N N -6.140 -7.502 0.663 1.00 . A A . 49 GLU N 1 1 16 14984 1 1 49 GLU O O -3.401 -8.710 -1.158 1.00 . A A . 49 GLU O 1 1 16 14985 1 1 49 GLU OE1 O -7.156 -11.613 -1.510 1.00 . A A . 49 GLU OE1 1 1 16 14986 1 1 49 GLU OE2 O -9.210 -11.087 -1.895 1.00 . A A . 49 GLU OE2 1 1 16 14987 1 1 50 ALA C C -2.020 -6.064 -0.915 1.00 . A A . 50 ALA C 1 1 16 14988 1 1 50 ALA CA C -3.150 -6.134 -1.940 1.00 . A A . 50 ALA CA 1 1 16 14989 1 1 50 ALA CB C -3.478 -4.717 -2.417 1.00 . A A . 50 ALA CB 1 1 16 14990 1 1 50 ALA H H -5.138 -6.176 -1.120 1.00 . A A . 50 ALA H 1 1 16 14991 1 1 50 ALA HA H -2.846 -6.743 -2.784 1.00 . A A . 50 ALA HA 1 1 16 14992 1 1 50 ALA HB1 H -4.479 -4.693 -2.820 1.00 . A A . 50 ALA HB1 1 1 16 14993 1 1 50 ALA HB2 H -3.410 -4.033 -1.584 1.00 . A A . 50 ALA HB2 1 1 16 14994 1 1 50 ALA HB3 H -2.775 -4.422 -3.181 1.00 . A A . 50 ALA HB3 1 1 16 14995 1 1 50 ALA N N -4.352 -6.732 -1.297 1.00 . A A . 50 ALA N 1 1 16 14996 1 1 50 ALA O O -0.858 -5.965 -1.256 1.00 . A A . 50 ALA O 1 1 16 14997 1 1 51 MET C C -0.730 -7.417 1.631 1.00 . A A . 51 MET C 1 1 16 14998 1 1 51 MET CA C -1.329 -6.029 1.403 1.00 . A A . 51 MET CA 1 1 16 14999 1 1 51 MET CB C -1.999 -5.539 2.684 1.00 . A A . 51 MET CB 1 1 16 15000 1 1 51 MET CE C -2.924 -2.486 4.177 1.00 . A A . 51 MET CE 1 1 16 15001 1 1 51 MET CG C -1.196 -4.383 3.279 1.00 . A A . 51 MET CG 1 1 16 15002 1 1 51 MET H H -3.303 -6.175 0.594 1.00 . A A . 51 MET H 1 1 16 15003 1 1 51 MET HA H -0.553 -5.338 1.110 1.00 . A A . 51 MET HA 1 1 16 15004 1 1 51 MET HB2 H -2.999 -5.200 2.455 1.00 . A A . 51 MET HB2 1 1 16 15005 1 1 51 MET HB3 H -2.050 -6.348 3.389 1.00 . A A . 51 MET HB3 1 1 16 15006 1 1 51 MET HE1 H -2.605 -3.126 4.987 1.00 . A A . 51 MET HE1 1 1 16 15007 1 1 51 MET HE2 H -2.813 -1.455 4.473 1.00 . A A . 51 MET HE2 1 1 16 15008 1 1 51 MET HE3 H -3.962 -2.682 3.943 1.00 . A A . 51 MET HE3 1 1 16 15009 1 1 51 MET HG2 H -1.237 -4.433 4.357 1.00 . A A . 51 MET HG2 1 1 16 15010 1 1 51 MET HG3 H -0.169 -4.451 2.953 1.00 . A A . 51 MET HG3 1 1 16 15011 1 1 51 MET N N -2.360 -6.103 0.342 1.00 . A A . 51 MET N 1 1 16 15012 1 1 51 MET O O 0.473 -7.595 1.627 1.00 . A A . 51 MET O 1 1 16 15013 1 1 51 MET SD S -1.905 -2.814 2.717 1.00 . A A . 51 MET SD 1 1 16 15014 1 1 52 ASP C C -0.169 -10.199 0.870 1.00 . A A . 52 ASP C 1 1 16 15015 1 1 52 ASP CA C -1.042 -9.782 2.055 1.00 . A A . 52 ASP CA 1 1 16 15016 1 1 52 ASP CB C -2.219 -10.750 2.183 1.00 . A A . 52 ASP CB 1 1 16 15017 1 1 52 ASP CG C -1.748 -12.042 2.852 1.00 . A A . 52 ASP CG 1 1 16 15018 1 1 52 ASP H H -2.527 -8.239 1.826 1.00 . A A . 52 ASP H 1 1 16 15019 1 1 52 ASP HA H -0.457 -9.803 2.962 1.00 . A A . 52 ASP HA 1 1 16 15020 1 1 52 ASP HB2 H -2.996 -10.296 2.783 1.00 . A A . 52 ASP HB2 1 1 16 15021 1 1 52 ASP HB3 H -2.608 -10.976 1.202 1.00 . A A . 52 ASP HB3 1 1 16 15022 1 1 52 ASP N N -1.561 -8.404 1.828 1.00 . A A . 52 ASP N 1 1 16 15023 1 1 52 ASP O O 0.781 -10.942 1.017 1.00 . A A . 52 ASP O 1 1 16 15024 1 1 52 ASP OD1 O -0.931 -12.729 2.259 1.00 . A A . 52 ASP OD1 1 1 16 15025 1 1 52 ASP OD2 O -2.210 -12.323 3.945 1.00 . A A . 52 ASP OD2 1 1 16 15026 1 1 53 THR C C 1.767 -9.632 -1.316 1.00 . A A . 53 THR C 1 1 16 15027 1 1 53 THR CA C 0.320 -10.097 -1.501 1.00 . A A . 53 THR CA 1 1 16 15028 1 1 53 THR CB C -0.275 -9.426 -2.740 1.00 . A A . 53 THR CB 1 1 16 15029 1 1 53 THR CG2 C -1.044 -10.460 -3.564 1.00 . A A . 53 THR CG2 1 1 16 15030 1 1 53 THR H H -1.257 -9.131 -0.399 1.00 . A A . 53 THR H 1 1 16 15031 1 1 53 THR HA H 0.302 -11.169 -1.630 1.00 . A A . 53 THR HA 1 1 16 15032 1 1 53 THR HB H 0.518 -9.010 -3.342 1.00 . A A . 53 THR HB 1 1 16 15033 1 1 53 THR HG1 H -0.887 -7.581 -2.775 1.00 . A A . 53 THR HG1 1 1 16 15034 1 1 53 THR HG21 H -0.660 -11.447 -3.353 1.00 . A A . 53 THR HG21 1 1 16 15035 1 1 53 THR HG22 H -2.092 -10.418 -3.307 1.00 . A A . 53 THR HG22 1 1 16 15036 1 1 53 THR HG23 H -0.923 -10.244 -4.616 1.00 . A A . 53 THR HG23 1 1 16 15037 1 1 53 THR N N -0.486 -9.728 -0.303 1.00 . A A . 53 THR N 1 1 16 15038 1 1 53 THR O O 2.693 -10.251 -1.800 1.00 . A A . 53 THR O 1 1 16 15039 1 1 53 THR OG1 O -1.158 -8.389 -2.335 1.00 . A A . 53 THR OG1 1 1 16 15040 1 1 54 CYS C C 4.190 -9.131 0.277 1.00 . A A . 54 CYS C 1 1 16 15041 1 1 54 CYS CA C 3.359 -8.047 -0.415 1.00 . A A . 54 CYS CA 1 1 16 15042 1 1 54 CYS CB C 3.333 -6.787 0.455 1.00 . A A . 54 CYS CB 1 1 16 15043 1 1 54 CYS H H 1.211 -8.056 -0.241 1.00 . A A . 54 CYS H 1 1 16 15044 1 1 54 CYS HA H 3.799 -7.812 -1.373 1.00 . A A . 54 CYS HA 1 1 16 15045 1 1 54 CYS HB2 H 2.546 -6.126 0.120 1.00 . A A . 54 CYS HB2 1 1 16 15046 1 1 54 CYS HB3 H 3.155 -7.065 1.484 1.00 . A A . 54 CYS HB3 1 1 16 15047 1 1 54 CYS N N 1.970 -8.544 -0.622 1.00 . A A . 54 CYS N 1 1 16 15048 1 1 54 CYS O O 3.789 -9.660 1.296 1.00 . A A . 54 CYS O 1 1 16 15049 1 1 54 CYS SG S 4.900 -5.841 0.420 1.00 . A A . 54 CYS SG 1 1 16 15050 1 1 55 PRO C C 6.874 -9.906 1.557 1.00 . A A . 55 PRO C 1 1 16 15051 1 1 55 PRO CA C 6.226 -10.451 0.285 1.00 . A A . 55 PRO CA 1 1 16 15052 1 1 55 PRO CB C 7.266 -10.689 -0.809 1.00 . A A . 55 PRO CB 1 1 16 15053 1 1 55 PRO CD C 5.882 -8.828 -1.518 1.00 . A A . 55 PRO CD 1 1 16 15054 1 1 55 PRO CG C 7.268 -9.428 -1.617 1.00 . A A . 55 PRO CG 1 1 16 15055 1 1 55 PRO HA H 5.684 -11.360 0.489 1.00 . A A . 55 PRO HA 1 1 16 15056 1 1 55 PRO HB2 H 8.226 -10.885 -0.350 1.00 . A A . 55 PRO HB2 1 1 16 15057 1 1 55 PRO HB3 H 6.973 -11.540 -1.405 1.00 . A A . 55 PRO HB3 1 1 16 15058 1 1 55 PRO HD2 H 5.944 -7.752 -1.431 1.00 . A A . 55 PRO HD2 1 1 16 15059 1 1 55 PRO HD3 H 5.287 -9.106 -2.374 1.00 . A A . 55 PRO HD3 1 1 16 15060 1 1 55 PRO HG2 H 8.002 -8.742 -1.218 1.00 . A A . 55 PRO HG2 1 1 16 15061 1 1 55 PRO HG3 H 7.494 -9.655 -2.647 1.00 . A A . 55 PRO HG3 1 1 16 15062 1 1 55 PRO N N 5.327 -9.422 -0.297 1.00 . A A . 55 PRO N 1 1 16 15063 1 1 55 PRO O O 6.787 -10.500 2.613 1.00 . A A . 55 PRO O 1 1 16 15064 1 1 56 VAL C C 7.049 -7.489 3.505 1.00 . A A . 56 VAL C 1 1 16 15065 1 1 56 VAL CA C 8.137 -8.175 2.677 1.00 . A A . 56 VAL CA 1 1 16 15066 1 1 56 VAL CB C 9.188 -7.147 2.254 1.00 . A A . 56 VAL CB 1 1 16 15067 1 1 56 VAL CG1 C 9.947 -6.653 3.487 1.00 . A A . 56 VAL CG1 1 1 16 15068 1 1 56 VAL CG2 C 10.174 -7.798 1.281 1.00 . A A . 56 VAL CG2 1 1 16 15069 1 1 56 VAL H H 7.550 -8.299 0.609 1.00 . A A . 56 VAL H 1 1 16 15070 1 1 56 VAL HA H 8.602 -8.953 3.262 1.00 . A A . 56 VAL HA 1 1 16 15071 1 1 56 VAL HB H 8.702 -6.311 1.772 1.00 . A A . 56 VAL HB 1 1 16 15072 1 1 56 VAL HG11 H 10.242 -7.498 4.090 1.00 . A A . 56 VAL HG11 1 1 16 15073 1 1 56 VAL HG12 H 10.825 -6.110 3.174 1.00 . A A . 56 VAL HG12 1 1 16 15074 1 1 56 VAL HG13 H 9.308 -6.002 4.067 1.00 . A A . 56 VAL HG13 1 1 16 15075 1 1 56 VAL HG21 H 10.176 -8.867 1.434 1.00 . A A . 56 VAL HG21 1 1 16 15076 1 1 56 VAL HG22 H 9.874 -7.581 0.266 1.00 . A A . 56 VAL HG22 1 1 16 15077 1 1 56 VAL HG23 H 11.164 -7.407 1.456 1.00 . A A . 56 VAL HG23 1 1 16 15078 1 1 56 VAL N N 7.505 -8.769 1.468 1.00 . A A . 56 VAL N 1 1 16 15079 1 1 56 VAL O O 7.239 -7.167 4.662 1.00 . A A . 56 VAL O 1 1 16 15080 1 1 57 GLN C C 5.321 -5.393 4.413 1.00 . A A . 57 GLN C 1 1 16 15081 1 1 57 GLN CA C 4.790 -6.608 3.653 1.00 . A A . 57 GLN CA 1 1 16 15082 1 1 57 GLN CB C 4.174 -7.599 4.642 1.00 . A A . 57 GLN CB 1 1 16 15083 1 1 57 GLN CD C 2.463 -9.420 4.636 1.00 . A A . 57 GLN CD 1 1 16 15084 1 1 57 GLN CG C 2.778 -8.000 4.160 1.00 . A A . 57 GLN CG 1 1 16 15085 1 1 57 GLN H H 5.774 -7.539 1.983 1.00 . A A . 57 GLN H 1 1 16 15086 1 1 57 GLN HA H 4.034 -6.290 2.950 1.00 . A A . 57 GLN HA 1 1 16 15087 1 1 57 GLN HB2 H 4.800 -8.477 4.709 1.00 . A A . 57 GLN HB2 1 1 16 15088 1 1 57 GLN HB3 H 4.097 -7.136 5.614 1.00 . A A . 57 GLN HB3 1 1 16 15089 1 1 57 GLN HE21 H 1.364 -8.809 6.173 1.00 . A A . 57 GLN HE21 1 1 16 15090 1 1 57 GLN HE22 H 1.508 -10.493 6.006 1.00 . A A . 57 GLN HE22 1 1 16 15091 1 1 57 GLN HG2 H 2.048 -7.313 4.563 1.00 . A A . 57 GLN HG2 1 1 16 15092 1 1 57 GLN HG3 H 2.747 -7.968 3.081 1.00 . A A . 57 GLN HG3 1 1 16 15093 1 1 57 GLN N N 5.903 -7.267 2.915 1.00 . A A . 57 GLN N 1 1 16 15094 1 1 57 GLN NE2 N 1.717 -9.588 5.692 1.00 . A A . 57 GLN NE2 1 1 16 15095 1 1 57 GLN O O 5.545 -5.444 5.605 1.00 . A A . 57 GLN O 1 1 16 15096 1 1 57 GLN OE1 O 2.899 -10.384 4.039 1.00 . A A . 57 GLN OE1 1 1 16 15097 1 1 58 CYS C C 4.831 -2.225 4.865 1.00 . A A . 58 CYS C 1 1 16 15098 1 1 58 CYS CA C 6.021 -3.076 4.419 1.00 . A A . 58 CYS CA 1 1 16 15099 1 1 58 CYS CB C 6.891 -2.269 3.453 1.00 . A A . 58 CYS CB 1 1 16 15100 1 1 58 CYS H H 5.322 -4.275 2.772 1.00 . A A . 58 CYS H 1 1 16 15101 1 1 58 CYS HA H 6.608 -3.361 5.280 1.00 . A A . 58 CYS HA 1 1 16 15102 1 1 58 CYS HB2 H 7.317 -2.929 2.712 1.00 . A A . 58 CYS HB2 1 1 16 15103 1 1 58 CYS HB3 H 6.285 -1.521 2.962 1.00 . A A . 58 CYS HB3 1 1 16 15104 1 1 58 CYS HG H 8.319 -0.566 4.031 1.00 . A A . 58 CYS HG 1 1 16 15105 1 1 58 CYS N N 5.515 -4.297 3.732 1.00 . A A . 58 CYS N 1 1 16 15106 1 1 58 CYS O O 4.971 -1.062 5.183 1.00 . A A . 58 CYS O 1 1 16 15107 1 1 58 CYS SG S 8.222 -1.457 4.373 1.00 . A A . 58 CYS SG 1 1 16 15108 1 1 59 ILE C C 2.599 -1.613 6.771 1.00 . A A . 59 ILE C 1 1 16 15109 1 1 59 ILE CA C 2.456 -2.023 5.303 1.00 . A A . 59 ILE CA 1 1 16 15110 1 1 59 ILE CB C 1.201 -2.884 5.121 1.00 . A A . 59 ILE CB 1 1 16 15111 1 1 59 ILE CD1 C -0.265 -0.858 4.972 1.00 . A A . 59 ILE CD1 1 1 16 15112 1 1 59 ILE CG1 C -0.009 -2.165 5.727 1.00 . A A . 59 ILE CG1 1 1 16 15113 1 1 59 ILE CG2 C 1.394 -4.227 5.826 1.00 . A A . 59 ILE CG2 1 1 16 15114 1 1 59 ILE H H 3.567 -3.738 4.620 1.00 . A A . 59 ILE H 1 1 16 15115 1 1 59 ILE HA H 2.375 -1.137 4.691 1.00 . A A . 59 ILE HA 1 1 16 15116 1 1 59 ILE HB H 1.033 -3.056 4.066 1.00 . A A . 59 ILE HB 1 1 16 15117 1 1 59 ILE HD11 H 0.649 -0.524 4.507 1.00 . A A . 59 ILE HD11 1 1 16 15118 1 1 59 ILE HD12 H -1.016 -1.020 4.214 1.00 . A A . 59 ILE HD12 1 1 16 15119 1 1 59 ILE HD13 H -0.612 -0.105 5.665 1.00 . A A . 59 ILE HD13 1 1 16 15120 1 1 59 ILE HG12 H -0.880 -2.800 5.649 1.00 . A A . 59 ILE HG12 1 1 16 15121 1 1 59 ILE HG13 H 0.185 -1.946 6.766 1.00 . A A . 59 ILE HG13 1 1 16 15122 1 1 59 ILE HG21 H 2.420 -4.319 6.150 1.00 . A A . 59 ILE HG21 1 1 16 15123 1 1 59 ILE HG22 H 0.740 -4.279 6.684 1.00 . A A . 59 ILE HG22 1 1 16 15124 1 1 59 ILE HG23 H 1.158 -5.029 5.143 1.00 . A A . 59 ILE HG23 1 1 16 15125 1 1 59 ILE N N 3.658 -2.798 4.885 1.00 . A A . 59 ILE N 1 1 16 15126 1 1 59 ILE O O 3.365 -2.191 7.516 1.00 . A A . 59 ILE O 1 1 16 15127 1 1 60 HIS C C 0.587 0.116 9.183 1.00 . A A . 60 HIS C 1 1 16 15128 1 1 60 HIS CA C 1.981 -0.146 8.604 1.00 . A A . 60 HIS CA 1 1 16 15129 1 1 60 HIS CB C 2.783 1.154 8.643 1.00 . A A . 60 HIS CB 1 1 16 15130 1 1 60 HIS CD2 C 4.953 0.523 9.985 1.00 . A A . 60 HIS CD2 1 1 16 15131 1 1 60 HIS CE1 C 6.357 0.552 8.334 1.00 . A A . 60 HIS CE1 1 1 16 15132 1 1 60 HIS CG C 4.238 0.847 8.859 1.00 . A A . 60 HIS CG 1 1 16 15133 1 1 60 HIS H H 1.276 -0.148 6.567 1.00 . A A . 60 HIS H 1 1 16 15134 1 1 60 HIS HA H 2.484 -0.897 9.194 1.00 . A A . 60 HIS HA 1 1 16 15135 1 1 60 HIS HB2 H 2.660 1.678 7.706 1.00 . A A . 60 HIS HB2 1 1 16 15136 1 1 60 HIS HB3 H 2.420 1.772 9.448 1.00 . A A . 60 HIS HB3 1 1 16 15137 1 1 60 HIS HD1 H 4.958 1.056 6.879 1.00 . A A . 60 HIS HD1 1 1 16 15138 1 1 60 HIS HD2 H 4.541 0.427 10.977 1.00 . A A . 60 HIS HD2 1 1 16 15139 1 1 60 HIS HE1 H 7.267 0.488 7.755 1.00 . A A . 60 HIS HE1 1 1 16 15140 1 1 60 HIS N N 1.877 -0.607 7.189 1.00 . A A . 60 HIS N 1 1 16 15141 1 1 60 HIS ND1 N 5.153 0.859 7.819 1.00 . A A . 60 HIS ND1 1 1 16 15142 1 1 60 HIS NE2 N 6.292 0.337 9.651 1.00 . A A . 60 HIS NE2 1 1 16 15143 1 1 60 HIS O O 0.360 -0.042 10.365 1.00 . A A . 60 HIS O 1 1 16 15144 1 1 61 TRP C C -1.667 2.058 9.779 1.00 . A A . 61 TRP C 1 1 16 15145 1 1 61 TRP CA C -1.715 0.840 8.855 1.00 . A A . 61 TRP CA 1 1 16 15146 1 1 61 TRP CB C -2.291 -0.357 9.619 1.00 . A A . 61 TRP CB 1 1 16 15147 1 1 61 TRP CD1 C -2.031 -2.330 8.054 1.00 . A A . 61 TRP CD1 1 1 16 15148 1 1 61 TRP CD2 C -4.137 -1.573 8.187 1.00 . A A . 61 TRP CD2 1 1 16 15149 1 1 61 TRP CE2 C -4.161 -2.659 7.284 1.00 . A A . 61 TRP CE2 1 1 16 15150 1 1 61 TRP CE3 C -5.332 -0.905 8.460 1.00 . A A . 61 TRP CE3 1 1 16 15151 1 1 61 TRP CG C -2.784 -1.383 8.657 1.00 . A A . 61 TRP CG 1 1 16 15152 1 1 61 TRP CH2 C -6.536 -2.391 6.951 1.00 . A A . 61 TRP CH2 1 1 16 15153 1 1 61 TRP CZ2 C -5.346 -3.070 6.670 1.00 . A A . 61 TRP CZ2 1 1 16 15154 1 1 61 TRP CZ3 C -6.530 -1.309 7.848 1.00 . A A . 61 TRP CZ3 1 1 16 15155 1 1 61 TRP H H -0.118 0.680 7.419 1.00 . A A . 61 TRP H 1 1 16 15156 1 1 61 TRP HA H -2.353 1.063 8.011 1.00 . A A . 61 TRP HA 1 1 16 15157 1 1 61 TRP HB2 H -1.540 -0.791 10.245 1.00 . A A . 61 TRP HB2 1 1 16 15158 1 1 61 TRP HB3 H -3.113 -0.023 10.232 1.00 . A A . 61 TRP HB3 1 1 16 15159 1 1 61 TRP HD1 H -0.968 -2.470 8.188 1.00 . A A . 61 TRP HD1 1 1 16 15160 1 1 61 TRP HE1 H -2.555 -3.846 6.685 1.00 . A A . 61 TRP HE1 1 1 16 15161 1 1 61 TRP HE3 H -5.324 -0.076 9.152 1.00 . A A . 61 TRP HE3 1 1 16 15162 1 1 61 TRP HH2 H -7.459 -2.699 6.482 1.00 . A A . 61 TRP HH2 1 1 16 15163 1 1 61 TRP HZ2 H -5.343 -3.901 5.981 1.00 . A A . 61 TRP HZ2 1 1 16 15164 1 1 61 TRP HZ3 H -7.450 -0.786 8.064 1.00 . A A . 61 TRP HZ3 1 1 16 15165 1 1 61 TRP N N -0.336 0.541 8.362 1.00 . A A . 61 TRP N 1 1 16 15166 1 1 61 TRP NE1 N -2.849 -3.092 7.235 1.00 . A A . 61 TRP NE1 1 1 16 15167 1 1 61 TRP O O -0.617 2.457 10.242 1.00 . A A . 61 TRP O 1 1 16 15168 1 1 62 GLU C C -4.076 3.822 11.791 1.00 . A A . 62 GLU C 1 1 16 15169 1 1 62 GLU CA C -2.817 3.855 10.923 1.00 . A A . 62 GLU CA 1 1 16 15170 1 1 62 GLU CB C -2.814 5.118 10.051 1.00 . A A . 62 GLU CB 1 1 16 15171 1 1 62 GLU CD C -2.978 7.614 10.102 1.00 . A A . 62 GLU CD 1 1 16 15172 1 1 62 GLU CG C -3.262 6.326 10.880 1.00 . A A . 62 GLU CG 1 1 16 15173 1 1 62 GLU H H -3.628 2.323 9.650 1.00 . A A . 62 GLU H 1 1 16 15174 1 1 62 GLU HA H -1.942 3.853 11.557 1.00 . A A . 62 GLU HA 1 1 16 15175 1 1 62 GLU HB2 H -1.816 5.290 9.675 1.00 . A A . 62 GLU HB2 1 1 16 15176 1 1 62 GLU HB3 H -3.493 4.981 9.220 1.00 . A A . 62 GLU HB3 1 1 16 15177 1 1 62 GLU HG2 H -4.320 6.252 11.081 1.00 . A A . 62 GLU HG2 1 1 16 15178 1 1 62 GLU HG3 H -2.718 6.344 11.813 1.00 . A A . 62 GLU HG3 1 1 16 15179 1 1 62 GLU N N -2.795 2.657 10.041 1.00 . A A . 62 GLU N 1 1 16 15180 1 1 62 GLU O O -5.137 4.247 11.379 1.00 . A A . 62 GLU O 1 1 16 15181 1 1 62 GLU OE1 O -1.858 7.771 9.644 1.00 . A A . 62 GLU OE1 1 1 16 15182 1 1 62 GLU OE2 O -3.885 8.419 9.978 1.00 . A A . 62 GLU OE2 1 1 16 15183 1 1 63 ASP C C -5.713 4.676 14.080 1.00 . A A . 63 ASP C 1 1 16 15184 1 1 63 ASP CA C -5.155 3.265 13.886 1.00 . A A . 63 ASP CA 1 1 16 15185 1 1 63 ASP CB C -4.744 2.690 15.243 1.00 . A A . 63 ASP CB 1 1 16 15186 1 1 63 ASP CG C -4.317 1.231 15.070 1.00 . A A . 63 ASP CG 1 1 16 15187 1 1 63 ASP H H -3.100 2.987 13.304 1.00 . A A . 63 ASP H 1 1 16 15188 1 1 63 ASP HA H -5.912 2.635 13.441 1.00 . A A . 63 ASP HA 1 1 16 15189 1 1 63 ASP HB2 H -3.920 3.263 15.642 1.00 . A A . 63 ASP HB2 1 1 16 15190 1 1 63 ASP HB3 H -5.581 2.740 15.923 1.00 . A A . 63 ASP HB3 1 1 16 15191 1 1 63 ASP N N -3.966 3.323 12.991 1.00 . A A . 63 ASP N 1 1 16 15192 1 1 63 ASP O O -6.908 4.891 14.055 1.00 . A A . 63 ASP O 1 1 16 15193 1 1 63 ASP OD1 O -4.483 0.711 13.979 1.00 . A A . 63 ASP OD1 1 1 16 15194 1 1 63 ASP OD2 O -3.832 0.659 16.033 1.00 . A A . 63 ASP OD2 1 1 16 15195 1 1 64 GLU C C -4.145 7.997 14.411 1.00 . A A . 64 GLU C 1 1 16 15196 1 1 64 GLU CA C -5.335 7.037 14.470 1.00 . A A . 64 GLU CA 1 1 16 15197 1 1 64 GLU CB C -6.018 7.152 15.833 1.00 . A A . 64 GLU CB 1 1 16 15198 1 1 64 GLU CD C -7.077 8.827 17.355 1.00 . A A . 64 GLU CD 1 1 16 15199 1 1 64 GLU CG C -6.822 8.451 15.894 1.00 . A A . 64 GLU CG 1 1 16 15200 1 1 64 GLU H H -3.895 5.446 14.290 1.00 . A A . 64 GLU H 1 1 16 15201 1 1 64 GLU HA H -6.040 7.289 13.691 1.00 . A A . 64 GLU HA 1 1 16 15202 1 1 64 GLU HB2 H -6.680 6.310 15.976 1.00 . A A . 64 GLU HB2 1 1 16 15203 1 1 64 GLU HB3 H -5.270 7.158 16.612 1.00 . A A . 64 GLU HB3 1 1 16 15204 1 1 64 GLU HG2 H -6.267 9.241 15.408 1.00 . A A . 64 GLU HG2 1 1 16 15205 1 1 64 GLU HG3 H -7.767 8.313 15.390 1.00 . A A . 64 GLU HG3 1 1 16 15206 1 1 64 GLU N N -4.854 5.640 14.273 1.00 . A A . 64 GLU N 1 1 16 15207 1 1 64 GLU OE1 O -6.136 8.777 18.131 1.00 . A A . 64 GLU OE1 1 1 16 15208 1 1 64 GLU OE2 O -8.207 9.156 17.673 1.00 . A A . 64 GLU OE2 1 1 16 15209 2 2 1 SF4 FE1 FE 6.098 -2.737 -3.133 1.00 . B A . 65 SF4 FE1 1 1 16 15210 2 2 1 SF4 FE2 FE 4.834 -4.736 -1.454 1.00 . B A . 65 SF4 FE2 1 1 16 15211 2 2 1 SF4 FE3 FE 3.484 -2.928 -3.152 1.00 . B A . 65 SF4 FE3 1 1 16 15212 2 2 1 SF4 FE4 FE 5.226 -5.042 -4.316 1.00 . B A . 65 SF4 FE4 1 1 16 15213 2 2 1 SF4 S1 S 3.209 -5.366 -2.820 1.00 . B A . 65 SF4 S1 1 1 16 15214 2 2 1 SF4 S2 S 4.949 -2.637 -4.779 1.00 . B A . 65 SF4 S2 1 1 16 15215 2 2 1 SF4 S3 S 6.848 -5.055 -2.806 1.00 . B A . 65 SF4 S3 1 1 16 15216 2 2 1 SF4 S4 S 4.734 -2.228 -1.469 1.00 . B A . 65 SF4 S4 1 1 17 15217 1 1 1 ALA C C -10.825 10.021 7.732 1.00 . A A . 1 ALA C 1 1 17 15218 1 1 1 ALA CA C -12.226 10.501 7.346 1.00 . A A . 1 ALA CA 1 1 17 15219 1 1 1 ALA CB C -12.665 11.614 8.301 1.00 . A A . 1 ALA CB 1 1 17 15220 1 1 1 ALA HA H -12.210 10.880 6.334 1.00 . A A . 1 ALA HA 1 1 17 15221 1 1 1 ALA HB1 H -13.510 11.277 8.883 1.00 . A A . 1 ALA HB1 1 1 17 15222 1 1 1 ALA HB2 H -11.848 11.864 8.962 1.00 . A A . 1 ALA HB2 1 1 17 15223 1 1 1 ALA HB3 H -12.947 12.487 7.730 1.00 . A A . 1 ALA HB3 1 1 17 15224 1 1 1 ALA N N -13.186 9.365 7.434 1.00 . A A . 1 ALA N 1 1 17 15225 1 1 1 ALA O O -9.984 10.797 8.142 1.00 . A A . 1 ALA O 1 1 17 15226 1 1 2 ARG C C -8.321 8.211 6.730 1.00 . A A . 2 ARG C 1 1 17 15227 1 1 2 ARG CA C -9.218 8.221 7.969 1.00 . A A . 2 ARG CA 1 1 17 15228 1 1 2 ARG CB C -9.354 6.796 8.511 1.00 . A A . 2 ARG CB 1 1 17 15229 1 1 2 ARG CD C -8.764 5.331 10.447 1.00 . A A . 2 ARG CD 1 1 17 15230 1 1 2 ARG CG C -8.389 6.602 9.682 1.00 . A A . 2 ARG CG 1 1 17 15231 1 1 2 ARG CZ C -10.580 4.704 11.924 1.00 . A A . 2 ARG CZ 1 1 17 15232 1 1 2 ARG H H -11.258 8.138 7.276 1.00 . A A . 2 ARG H 1 1 17 15233 1 1 2 ARG HA H -8.778 8.853 8.727 1.00 . A A . 2 ARG HA 1 1 17 15234 1 1 2 ARG HB2 H -10.367 6.634 8.846 1.00 . A A . 2 ARG HB2 1 1 17 15235 1 1 2 ARG HB3 H -9.115 6.090 7.729 1.00 . A A . 2 ARG HB3 1 1 17 15236 1 1 2 ARG HD2 H -9.144 4.594 9.754 1.00 . A A . 2 ARG HD2 1 1 17 15237 1 1 2 ARG HD3 H -7.889 4.939 10.946 1.00 . A A . 2 ARG HD3 1 1 17 15238 1 1 2 ARG HE H -9.924 6.572 11.771 1.00 . A A . 2 ARG HE 1 1 17 15239 1 1 2 ARG HG2 H -7.380 6.513 9.307 1.00 . A A . 2 ARG HG2 1 1 17 15240 1 1 2 ARG HG3 H -8.453 7.451 10.347 1.00 . A A . 2 ARG HG3 1 1 17 15241 1 1 2 ARG HH11 H -9.450 3.217 11.200 1.00 . A A . 2 ARG HH11 1 1 17 15242 1 1 2 ARG HH12 H -10.863 2.727 12.073 1.00 . A A . 2 ARG HH12 1 1 17 15243 1 1 2 ARG HH21 H -11.890 5.968 12.756 1.00 . A A . 2 ARG HH21 1 1 17 15244 1 1 2 ARG HH22 H -12.244 4.283 12.955 1.00 . A A . 2 ARG HH22 1 1 17 15245 1 1 2 ARG N N -10.566 8.747 7.607 1.00 . A A . 2 ARG N 1 1 17 15246 1 1 2 ARG NE N -9.812 5.650 11.456 1.00 . A A . 2 ARG NE 1 1 17 15247 1 1 2 ARG NH1 N -10.274 3.452 11.716 1.00 . A A . 2 ARG NH1 1 1 17 15248 1 1 2 ARG NH2 N -11.655 5.009 12.597 1.00 . A A . 2 ARG NH2 1 1 17 15249 1 1 2 ARG O O -8.745 8.542 5.640 1.00 . A A . 2 ARG O 1 1 17 15250 1 1 3 LYS C C -5.252 6.572 5.818 1.00 . A A . 3 LYS C 1 1 17 15251 1 1 3 LYS CA C -6.156 7.805 5.720 1.00 . A A . 3 LYS CA 1 1 17 15252 1 1 3 LYS CB C -5.300 9.076 5.716 1.00 . A A . 3 LYS CB 1 1 17 15253 1 1 3 LYS CD C -5.471 10.836 3.950 1.00 . A A . 3 LYS CD 1 1 17 15254 1 1 3 LYS CE C -6.534 10.727 2.856 1.00 . A A . 3 LYS CE 1 1 17 15255 1 1 3 LYS CG C -4.933 9.442 4.277 1.00 . A A . 3 LYS CG 1 1 17 15256 1 1 3 LYS H H -6.758 7.574 7.775 1.00 . A A . 3 LYS H 1 1 17 15257 1 1 3 LYS HA H -6.732 7.757 4.808 1.00 . A A . 3 LYS HA 1 1 17 15258 1 1 3 LYS HB2 H -5.858 9.884 6.163 1.00 . A A . 3 LYS HB2 1 1 17 15259 1 1 3 LYS HB3 H -4.399 8.904 6.283 1.00 . A A . 3 LYS HB3 1 1 17 15260 1 1 3 LYS HD2 H -5.910 11.270 4.837 1.00 . A A . 3 LYS HD2 1 1 17 15261 1 1 3 LYS HD3 H -4.663 11.462 3.603 1.00 . A A . 3 LYS HD3 1 1 17 15262 1 1 3 LYS HE2 H -6.233 9.981 2.135 1.00 . A A . 3 LYS HE2 1 1 17 15263 1 1 3 LYS HE3 H -7.476 10.440 3.298 1.00 . A A . 3 LYS HE3 1 1 17 15264 1 1 3 LYS HG2 H -3.858 9.436 4.168 1.00 . A A . 3 LYS HG2 1 1 17 15265 1 1 3 LYS HG3 H -5.369 8.722 3.600 1.00 . A A . 3 LYS HG3 1 1 17 15266 1 1 3 LYS HZ1 H -6.545 12.809 2.865 1.00 . A A . 3 LYS HZ1 1 1 17 15267 1 1 3 LYS HZ2 H -5.978 12.128 1.419 1.00 . A A . 3 LYS HZ2 1 1 17 15268 1 1 3 LYS HZ3 H -7.640 12.114 1.767 1.00 . A A . 3 LYS HZ3 1 1 17 15269 1 1 3 LYS N N -7.081 7.836 6.888 1.00 . A A . 3 LYS N 1 1 17 15270 1 1 3 LYS NZ N -6.686 12.044 2.175 1.00 . A A . 3 LYS NZ 1 1 17 15271 1 1 3 LYS O O -5.578 5.610 6.481 1.00 . A A . 3 LYS O 1 1 17 15272 1 1 4 PHE C C -2.109 5.608 4.134 1.00 . A A . 4 PHE C 1 1 17 15273 1 1 4 PHE CA C -3.187 5.434 5.207 1.00 . A A . 4 PHE CA 1 1 17 15274 1 1 4 PHE CB C -3.958 4.139 4.934 1.00 . A A . 4 PHE CB 1 1 17 15275 1 1 4 PHE CD1 C -4.085 4.055 2.421 1.00 . A A . 4 PHE CD1 1 1 17 15276 1 1 4 PHE CD2 C -6.083 4.635 3.669 1.00 . A A . 4 PHE CD2 1 1 17 15277 1 1 4 PHE CE1 C -4.795 4.187 1.222 1.00 . A A . 4 PHE CE1 1 1 17 15278 1 1 4 PHE CE2 C -6.793 4.767 2.469 1.00 . A A . 4 PHE CE2 1 1 17 15279 1 1 4 PHE CG C -4.728 4.278 3.643 1.00 . A A . 4 PHE CG 1 1 17 15280 1 1 4 PHE CZ C -6.150 4.543 1.246 1.00 . A A . 4 PHE CZ 1 1 17 15281 1 1 4 PHE H H -3.880 7.386 4.642 1.00 . A A . 4 PHE H 1 1 17 15282 1 1 4 PHE HA H -2.722 5.382 6.179 1.00 . A A . 4 PHE HA 1 1 17 15283 1 1 4 PHE HB2 H -3.260 3.318 4.848 1.00 . A A . 4 PHE HB2 1 1 17 15284 1 1 4 PHE HB3 H -4.642 3.941 5.744 1.00 . A A . 4 PHE HB3 1 1 17 15285 1 1 4 PHE HD1 H -3.041 3.780 2.402 1.00 . A A . 4 PHE HD1 1 1 17 15286 1 1 4 PHE HD2 H -6.579 4.807 4.613 1.00 . A A . 4 PHE HD2 1 1 17 15287 1 1 4 PHE HE1 H -4.299 4.013 0.279 1.00 . A A . 4 PHE HE1 1 1 17 15288 1 1 4 PHE HE2 H -7.836 5.042 2.487 1.00 . A A . 4 PHE HE2 1 1 17 15289 1 1 4 PHE HZ H -6.697 4.645 0.321 1.00 . A A . 4 PHE HZ 1 1 17 15290 1 1 4 PHE N N -4.120 6.598 5.163 1.00 . A A . 4 PHE N 1 1 17 15291 1 1 4 PHE O O -2.053 6.613 3.454 1.00 . A A . 4 PHE O 1 1 17 15292 1 1 5 TYR C C 0.769 3.573 3.265 1.00 . A A . 5 TYR C 1 1 17 15293 1 1 5 TYR CA C -0.182 4.700 2.961 1.00 . A A . 5 TYR CA 1 1 17 15294 1 1 5 TYR CB C 0.585 6.018 3.046 1.00 . A A . 5 TYR CB 1 1 17 15295 1 1 5 TYR CD1 C 2.369 5.456 4.734 1.00 . A A . 5 TYR CD1 1 1 17 15296 1 1 5 TYR CD2 C 0.602 6.990 5.372 1.00 . A A . 5 TYR CD2 1 1 17 15297 1 1 5 TYR CE1 C 2.940 5.584 6.004 1.00 . A A . 5 TYR CE1 1 1 17 15298 1 1 5 TYR CE2 C 1.175 7.118 6.643 1.00 . A A . 5 TYR CE2 1 1 17 15299 1 1 5 TYR CG C 1.199 6.158 4.417 1.00 . A A . 5 TYR CG 1 1 17 15300 1 1 5 TYR CZ C 2.344 6.415 6.958 1.00 . A A . 5 TYR CZ 1 1 17 15301 1 1 5 TYR H H -1.330 3.821 4.537 1.00 . A A . 5 TYR H 1 1 17 15302 1 1 5 TYR HA H -0.600 4.575 1.971 1.00 . A A . 5 TYR HA 1 1 17 15303 1 1 5 TYR HB2 H 1.369 6.021 2.302 1.00 . A A . 5 TYR HB2 1 1 17 15304 1 1 5 TYR HB3 H -0.079 6.835 2.860 1.00 . A A . 5 TYR HB3 1 1 17 15305 1 1 5 TYR HD1 H 2.830 4.815 3.997 1.00 . A A . 5 TYR HD1 1 1 17 15306 1 1 5 TYR HD2 H -0.300 7.530 5.128 1.00 . A A . 5 TYR HD2 1 1 17 15307 1 1 5 TYR HE1 H 3.843 5.042 6.248 1.00 . A A . 5 TYR HE1 1 1 17 15308 1 1 5 TYR HE2 H 0.715 7.759 7.379 1.00 . A A . 5 TYR HE2 1 1 17 15309 1 1 5 TYR HH H 2.305 7.052 8.757 1.00 . A A . 5 TYR HH 1 1 17 15310 1 1 5 TYR N N -1.260 4.629 3.978 1.00 . A A . 5 TYR N 1 1 17 15311 1 1 5 TYR O O 0.526 2.774 4.148 1.00 . A A . 5 TYR O 1 1 17 15312 1 1 5 TYR OH O 2.908 6.544 8.211 1.00 . A A . 5 TYR OH 1 1 17 15313 1 1 6 VAL C C 4.180 2.863 3.011 1.00 . A A . 6 VAL C 1 1 17 15314 1 1 6 VAL CA C 2.762 2.368 2.874 1.00 . A A . 6 VAL CA 1 1 17 15315 1 1 6 VAL CB C 2.723 1.322 1.779 1.00 . A A . 6 VAL CB 1 1 17 15316 1 1 6 VAL CG1 C 2.958 -0.028 2.428 1.00 . A A . 6 VAL CG1 1 1 17 15317 1 1 6 VAL CG2 C 1.351 1.314 1.095 1.00 . A A . 6 VAL CG2 1 1 17 15318 1 1 6 VAL H H 2.044 4.120 1.843 1.00 . A A . 6 VAL H 1 1 17 15319 1 1 6 VAL HA H 2.458 1.911 3.804 1.00 . A A . 6 VAL HA 1 1 17 15320 1 1 6 VAL HB H 3.509 1.526 1.055 1.00 . A A . 6 VAL HB 1 1 17 15321 1 1 6 VAL HG11 H 3.098 0.110 3.490 1.00 . A A . 6 VAL HG11 1 1 17 15322 1 1 6 VAL HG12 H 2.100 -0.660 2.258 1.00 . A A . 6 VAL HG12 1 1 17 15323 1 1 6 VAL HG13 H 3.837 -0.481 2.003 1.00 . A A . 6 VAL HG13 1 1 17 15324 1 1 6 VAL HG21 H 0.694 2.018 1.573 1.00 . A A . 6 VAL HG21 1 1 17 15325 1 1 6 VAL HG22 H 1.466 1.580 0.054 1.00 . A A . 6 VAL HG22 1 1 17 15326 1 1 6 VAL HG23 H 0.923 0.328 1.169 1.00 . A A . 6 VAL HG23 1 1 17 15327 1 1 6 VAL N N 1.845 3.477 2.563 1.00 . A A . 6 VAL N 1 1 17 15328 1 1 6 VAL O O 4.482 4.020 2.798 1.00 . A A . 6 VAL O 1 1 17 15329 1 1 7 ASP C C 7.317 1.436 2.675 1.00 . A A . 7 ASP C 1 1 17 15330 1 1 7 ASP CA C 6.465 2.362 3.502 1.00 . A A . 7 ASP CA 1 1 17 15331 1 1 7 ASP CB C 6.878 2.296 4.969 1.00 . A A . 7 ASP CB 1 1 17 15332 1 1 7 ASP CG C 6.680 3.668 5.617 1.00 . A A . 7 ASP CG 1 1 17 15333 1 1 7 ASP H H 4.782 1.048 3.513 1.00 . A A . 7 ASP H 1 1 17 15334 1 1 7 ASP HA H 6.595 3.354 3.132 1.00 . A A . 7 ASP HA 1 1 17 15335 1 1 7 ASP HB2 H 6.269 1.566 5.473 1.00 . A A . 7 ASP HB2 1 1 17 15336 1 1 7 ASP HB3 H 7.917 2.012 5.039 1.00 . A A . 7 ASP HB3 1 1 17 15337 1 1 7 ASP N N 5.056 1.976 3.358 1.00 . A A . 7 ASP N 1 1 17 15338 1 1 7 ASP O O 7.769 0.405 3.129 1.00 . A A . 7 ASP O 1 1 17 15339 1 1 7 ASP OD1 O 5.658 4.281 5.358 1.00 . A A . 7 ASP OD1 1 1 17 15340 1 1 7 ASP OD2 O 7.552 4.081 6.362 1.00 . A A . 7 ASP OD2 1 1 17 15341 1 1 8 GLN C C 9.819 0.907 1.058 1.00 . A A . 8 GLN C 1 1 17 15342 1 1 8 GLN CA C 8.382 0.995 0.540 1.00 . A A . 8 GLN CA 1 1 17 15343 1 1 8 GLN CB C 8.420 1.664 -0.821 1.00 . A A . 8 GLN CB 1 1 17 15344 1 1 8 GLN CD C 5.934 1.388 -0.632 1.00 . A A . 8 GLN CD 1 1 17 15345 1 1 8 GLN CG C 7.132 1.375 -1.590 1.00 . A A . 8 GLN CG 1 1 17 15346 1 1 8 GLN H H 7.142 2.649 1.139 1.00 . A A . 8 GLN H 1 1 17 15347 1 1 8 GLN HA H 7.965 0.004 0.445 1.00 . A A . 8 GLN HA 1 1 17 15348 1 1 8 GLN HB2 H 8.535 2.731 -0.695 1.00 . A A . 8 GLN HB2 1 1 17 15349 1 1 8 GLN HB3 H 9.260 1.274 -1.365 1.00 . A A . 8 GLN HB3 1 1 17 15350 1 1 8 GLN HE21 H 5.953 -0.579 -0.365 1.00 . A A . 8 GLN HE21 1 1 17 15351 1 1 8 GLN HE22 H 4.744 0.256 0.485 1.00 . A A . 8 GLN HE22 1 1 17 15352 1 1 8 GLN HG2 H 6.992 2.130 -2.350 1.00 . A A . 8 GLN HG2 1 1 17 15353 1 1 8 GLN HG3 H 7.207 0.405 -2.056 1.00 . A A . 8 GLN HG3 1 1 17 15354 1 1 8 GLN N N 7.541 1.813 1.457 1.00 . A A . 8 GLN N 1 1 17 15355 1 1 8 GLN NE2 N 5.508 0.261 -0.129 1.00 . A A . 8 GLN NE2 1 1 17 15356 1 1 8 GLN O O 10.766 1.032 0.310 1.00 . A A . 8 GLN O 1 1 17 15357 1 1 8 GLN OE1 O 5.384 2.431 -0.338 1.00 . A A . 8 GLN OE1 1 1 17 15358 1 1 9 ASP C C 11.692 -0.903 3.044 1.00 . A A . 9 ASP C 1 1 17 15359 1 1 9 ASP CA C 11.357 0.571 2.884 1.00 . A A . 9 ASP CA 1 1 17 15360 1 1 9 ASP CB C 11.409 1.241 4.254 1.00 . A A . 9 ASP CB 1 1 17 15361 1 1 9 ASP CG C 12.444 2.367 4.236 1.00 . A A . 9 ASP CG 1 1 17 15362 1 1 9 ASP H H 9.207 0.572 2.895 1.00 . A A . 9 ASP H 1 1 17 15363 1 1 9 ASP HA H 12.069 1.039 2.219 1.00 . A A . 9 ASP HA 1 1 17 15364 1 1 9 ASP HB2 H 10.437 1.647 4.495 1.00 . A A . 9 ASP HB2 1 1 17 15365 1 1 9 ASP HB3 H 11.690 0.507 4.997 1.00 . A A . 9 ASP HB3 1 1 17 15366 1 1 9 ASP N N 9.986 0.682 2.319 1.00 . A A . 9 ASP N 1 1 17 15367 1 1 9 ASP O O 12.840 -1.292 3.134 1.00 . A A . 9 ASP O 1 1 17 15368 1 1 9 ASP OD1 O 12.715 2.879 3.162 1.00 . A A . 9 ASP OD1 1 1 17 15369 1 1 9 ASP OD2 O 12.949 2.699 5.296 1.00 . A A . 9 ASP OD2 1 1 17 15370 1 1 10 GLU C C 10.311 -3.933 2.067 1.00 . A A . 10 GLU C 1 1 17 15371 1 1 10 GLU CA C 10.922 -3.180 3.252 1.00 . A A . 10 GLU CA 1 1 17 15372 1 1 10 GLU CB C 10.264 -3.651 4.550 1.00 . A A . 10 GLU CB 1 1 17 15373 1 1 10 GLU CD C 11.961 -5.434 4.969 1.00 . A A . 10 GLU CD 1 1 17 15374 1 1 10 GLU CG C 11.339 -4.149 5.518 1.00 . A A . 10 GLU CG 1 1 17 15375 1 1 10 GLU H H 9.770 -1.386 3.019 1.00 . A A . 10 GLU H 1 1 17 15376 1 1 10 GLU HA H 11.984 -3.365 3.297 1.00 . A A . 10 GLU HA 1 1 17 15377 1 1 10 GLU HB2 H 9.723 -2.829 5.000 1.00 . A A . 10 GLU HB2 1 1 17 15378 1 1 10 GLU HB3 H 9.581 -4.451 4.331 1.00 . A A . 10 GLU HB3 1 1 17 15379 1 1 10 GLU HG2 H 12.105 -3.395 5.625 1.00 . A A . 10 GLU HG2 1 1 17 15380 1 1 10 GLU HG3 H 10.893 -4.350 6.480 1.00 . A A . 10 GLU HG3 1 1 17 15381 1 1 10 GLU N N 10.685 -1.728 3.089 1.00 . A A . 10 GLU N 1 1 17 15382 1 1 10 GLU O O 10.491 -5.126 1.919 1.00 . A A . 10 GLU O 1 1 17 15383 1 1 10 GLU OE1 O 11.212 -6.345 4.655 1.00 . A A . 10 GLU OE1 1 1 17 15384 1 1 10 GLU OE2 O 13.176 -5.487 4.873 1.00 . A A . 10 GLU OE2 1 1 17 15385 1 1 11 CYS C C 10.024 -4.677 -0.743 1.00 . A A . 11 CYS C 1 1 17 15386 1 1 11 CYS CA C 8.953 -3.932 0.054 1.00 . A A . 11 CYS CA 1 1 17 15387 1 1 11 CYS CB C 8.263 -2.898 -0.844 1.00 . A A . 11 CYS CB 1 1 17 15388 1 1 11 CYS H H 9.442 -2.289 1.363 1.00 . A A . 11 CYS H 1 1 17 15389 1 1 11 CYS HA H 8.218 -4.640 0.411 1.00 . A A . 11 CYS HA 1 1 17 15390 1 1 11 CYS HB2 H 7.491 -2.389 -0.286 1.00 . A A . 11 CYS HB2 1 1 17 15391 1 1 11 CYS HB3 H 8.989 -2.178 -1.193 1.00 . A A . 11 CYS HB3 1 1 17 15392 1 1 11 CYS N N 9.581 -3.248 1.224 1.00 . A A . 11 CYS N 1 1 17 15393 1 1 11 CYS O O 10.888 -4.080 -1.352 1.00 . A A . 11 CYS O 1 1 17 15394 1 1 11 CYS SG S 7.484 -3.613 -2.338 1.00 . A A . 11 CYS SG 1 1 17 15395 1 1 12 ILE C C 10.708 -6.664 -2.999 1.00 . A A . 12 ILE C 1 1 17 15396 1 1 12 ILE CA C 10.990 -6.769 -1.499 1.00 . A A . 12 ILE CA 1 1 17 15397 1 1 12 ILE CB C 10.934 -8.236 -1.066 1.00 . A A . 12 ILE CB 1 1 17 15398 1 1 12 ILE CD1 C 9.487 -10.273 -0.951 1.00 . A A . 12 ILE CD1 1 1 17 15399 1 1 12 ILE CG1 C 9.605 -8.854 -1.511 1.00 . A A . 12 ILE CG1 1 1 17 15400 1 1 12 ILE CG2 C 11.053 -8.326 0.456 1.00 . A A . 12 ILE CG2 1 1 17 15401 1 1 12 ILE H H 9.269 -6.446 -0.244 1.00 . A A . 12 ILE H 1 1 17 15402 1 1 12 ILE HA H 11.973 -6.373 -1.292 1.00 . A A . 12 ILE HA 1 1 17 15403 1 1 12 ILE HB H 11.752 -8.774 -1.523 1.00 . A A . 12 ILE HB 1 1 17 15404 1 1 12 ILE HD11 H 10.328 -10.863 -1.283 1.00 . A A . 12 ILE HD11 1 1 17 15405 1 1 12 ILE HD12 H 9.479 -10.235 0.129 1.00 . A A . 12 ILE HD12 1 1 17 15406 1 1 12 ILE HD13 H 8.570 -10.723 -1.302 1.00 . A A . 12 ILE HD13 1 1 17 15407 1 1 12 ILE HG12 H 8.788 -8.251 -1.144 1.00 . A A . 12 ILE HG12 1 1 17 15408 1 1 12 ILE HG13 H 9.569 -8.892 -2.590 1.00 . A A . 12 ILE HG13 1 1 17 15409 1 1 12 ILE HG21 H 11.828 -7.655 0.797 1.00 . A A . 12 ILE HG21 1 1 17 15410 1 1 12 ILE HG22 H 10.112 -8.049 0.907 1.00 . A A . 12 ILE HG22 1 1 17 15411 1 1 12 ILE HG23 H 11.304 -9.339 0.738 1.00 . A A . 12 ILE HG23 1 1 17 15412 1 1 12 ILE N N 9.974 -5.983 -0.743 1.00 . A A . 12 ILE N 1 1 17 15413 1 1 12 ILE O O 11.598 -6.409 -3.786 1.00 . A A . 12 ILE O 1 1 17 15414 1 1 13 ALA C C 7.792 -7.384 -5.143 1.00 . A A . 13 ALA C 1 1 17 15415 1 1 13 ALA CA C 9.164 -6.763 -4.860 1.00 . A A . 13 ALA CA 1 1 17 15416 1 1 13 ALA CB C 10.234 -7.509 -5.660 1.00 . A A . 13 ALA CB 1 1 17 15417 1 1 13 ALA H H 8.773 -7.060 -2.760 1.00 . A A . 13 ALA H 1 1 17 15418 1 1 13 ALA HA H 9.154 -5.726 -5.158 1.00 . A A . 13 ALA HA 1 1 17 15419 1 1 13 ALA HB1 H 10.545 -8.388 -5.114 1.00 . A A . 13 ALA HB1 1 1 17 15420 1 1 13 ALA HB2 H 9.830 -7.804 -6.617 1.00 . A A . 13 ALA HB2 1 1 17 15421 1 1 13 ALA HB3 H 11.085 -6.861 -5.813 1.00 . A A . 13 ALA HB3 1 1 17 15422 1 1 13 ALA N N 9.480 -6.857 -3.407 1.00 . A A . 13 ALA N 1 1 17 15423 1 1 13 ALA O O 7.112 -6.999 -6.073 1.00 . A A . 13 ALA O 1 1 17 15424 1 1 14 CYS C C 4.999 -7.901 -4.855 1.00 . A A . 14 CYS C 1 1 17 15425 1 1 14 CYS CA C 6.053 -8.983 -4.612 1.00 . A A . 14 CYS CA 1 1 17 15426 1 1 14 CYS CB C 5.647 -9.842 -3.411 1.00 . A A . 14 CYS CB 1 1 17 15427 1 1 14 CYS H H 7.939 -8.652 -3.618 1.00 . A A . 14 CYS H 1 1 17 15428 1 1 14 CYS HA H 6.123 -9.611 -5.489 1.00 . A A . 14 CYS HA 1 1 17 15429 1 1 14 CYS HB2 H 5.367 -10.826 -3.754 1.00 . A A . 14 CYS HB2 1 1 17 15430 1 1 14 CYS HB3 H 6.484 -9.924 -2.732 1.00 . A A . 14 CYS HB3 1 1 17 15431 1 1 14 CYS N N 7.379 -8.347 -4.361 1.00 . A A . 14 CYS N 1 1 17 15432 1 1 14 CYS O O 5.150 -6.769 -4.439 1.00 . A A . 14 CYS O 1 1 17 15433 1 1 14 CYS SG S 4.241 -9.234 -2.407 1.00 . A A . 14 CYS SG 1 1 17 15434 1 1 15 GLU C C 1.546 -7.690 -5.201 1.00 . A A . 15 GLU C 1 1 17 15435 1 1 15 GLU CA C 2.874 -7.231 -5.811 1.00 . A A . 15 GLU CA 1 1 17 15436 1 1 15 GLU CB C 2.707 -7.074 -7.326 1.00 . A A . 15 GLU CB 1 1 17 15437 1 1 15 GLU CD C 3.262 -9.111 -8.665 1.00 . A A . 15 GLU CD 1 1 17 15438 1 1 15 GLU CG C 2.151 -8.372 -7.917 1.00 . A A . 15 GLU CG 1 1 17 15439 1 1 15 GLU H H 3.837 -9.158 -5.863 1.00 . A A . 15 GLU H 1 1 17 15440 1 1 15 GLU HA H 3.159 -6.283 -5.382 1.00 . A A . 15 GLU HA 1 1 17 15441 1 1 15 GLU HB2 H 2.024 -6.263 -7.529 1.00 . A A . 15 GLU HB2 1 1 17 15442 1 1 15 GLU HB3 H 3.665 -6.859 -7.773 1.00 . A A . 15 GLU HB3 1 1 17 15443 1 1 15 GLU HG2 H 1.774 -8.999 -7.122 1.00 . A A . 15 GLU HG2 1 1 17 15444 1 1 15 GLU HG3 H 1.350 -8.141 -8.603 1.00 . A A . 15 GLU HG3 1 1 17 15445 1 1 15 GLU N N 3.935 -8.241 -5.533 1.00 . A A . 15 GLU N 1 1 17 15446 1 1 15 GLU O O 0.487 -7.241 -5.594 1.00 . A A . 15 GLU O 1 1 17 15447 1 1 15 GLU OE1 O 4.242 -8.473 -9.012 1.00 . A A . 15 GLU OE1 1 1 17 15448 1 1 15 GLU OE2 O 3.114 -10.304 -8.879 1.00 . A A . 15 GLU OE2 1 1 17 15449 1 1 16 SER C C -0.593 -7.866 -3.347 1.00 . A A . 16 SER C 1 1 17 15450 1 1 16 SER CA C 0.329 -9.059 -3.615 1.00 . A A . 16 SER CA 1 1 17 15451 1 1 16 SER CB C 0.653 -9.760 -2.296 1.00 . A A . 16 SER CB 1 1 17 15452 1 1 16 SER H H 2.455 -8.928 -3.942 1.00 . A A . 16 SER H 1 1 17 15453 1 1 16 SER HA H -0.164 -9.753 -4.280 1.00 . A A . 16 SER HA 1 1 17 15454 1 1 16 SER HB2 H 1.661 -9.524 -1.998 1.00 . A A . 16 SER HB2 1 1 17 15455 1 1 16 SER HB3 H -0.033 -9.422 -1.531 1.00 . A A . 16 SER HB3 1 1 17 15456 1 1 16 SER HG H 1.314 -11.578 -2.094 1.00 . A A . 16 SER HG 1 1 17 15457 1 1 16 SER N N 1.591 -8.578 -4.245 1.00 . A A . 16 SER N 1 1 17 15458 1 1 16 SER O O -1.745 -7.858 -3.734 1.00 . A A . 16 SER O 1 1 17 15459 1 1 16 SER OG O 0.534 -11.165 -2.471 1.00 . A A . 16 SER OG 1 1 17 15460 1 1 17 CYS C C -1.425 -5.049 -3.704 1.00 . A A . 17 CYS C 1 1 17 15461 1 1 17 CYS CA C -0.932 -5.663 -2.392 1.00 . A A . 17 CYS CA 1 1 17 15462 1 1 17 CYS CB C -0.091 -4.639 -1.629 1.00 . A A . 17 CYS CB 1 1 17 15463 1 1 17 CYS H H 0.840 -6.887 -2.386 1.00 . A A . 17 CYS H 1 1 17 15464 1 1 17 CYS HA H -1.779 -5.956 -1.789 1.00 . A A . 17 CYS HA 1 1 17 15465 1 1 17 CYS HB2 H -0.731 -3.855 -1.253 1.00 . A A . 17 CYS HB2 1 1 17 15466 1 1 17 CYS HB3 H 0.407 -5.126 -0.802 1.00 . A A . 17 CYS HB3 1 1 17 15467 1 1 17 CYS N N -0.093 -6.859 -2.688 1.00 . A A . 17 CYS N 1 1 17 15468 1 1 17 CYS O O -2.606 -4.826 -3.896 1.00 . A A . 17 CYS O 1 1 17 15469 1 1 17 CYS SG S 1.210 -3.839 -2.638 1.00 . A A . 17 CYS SG 1 1 17 15470 1 1 18 VAL C C -2.141 -4.947 -6.466 1.00 . A A . 18 VAL C 1 1 17 15471 1 1 18 VAL CA C -0.948 -4.172 -5.909 1.00 . A A . 18 VAL CA 1 1 17 15472 1 1 18 VAL CB C 0.211 -4.245 -6.902 1.00 . A A . 18 VAL CB 1 1 17 15473 1 1 18 VAL CG1 C -0.082 -3.330 -8.093 1.00 . A A . 18 VAL CG1 1 1 17 15474 1 1 18 VAL CG2 C 1.497 -3.786 -6.214 1.00 . A A . 18 VAL CG2 1 1 17 15475 1 1 18 VAL H H 0.416 -4.958 -4.440 1.00 . A A . 18 VAL H 1 1 17 15476 1 1 18 VAL HA H -1.229 -3.141 -5.756 1.00 . A A . 18 VAL HA 1 1 17 15477 1 1 18 VAL HB H 0.326 -5.262 -7.248 1.00 . A A . 18 VAL HB 1 1 17 15478 1 1 18 VAL HG11 H -1.017 -3.621 -8.549 1.00 . A A . 18 VAL HG11 1 1 17 15479 1 1 18 VAL HG12 H -0.150 -2.308 -7.753 1.00 . A A . 18 VAL HG12 1 1 17 15480 1 1 18 VAL HG13 H 0.715 -3.416 -8.818 1.00 . A A . 18 VAL HG13 1 1 17 15481 1 1 18 VAL HG21 H 1.265 -3.020 -5.489 1.00 . A A . 18 VAL HG21 1 1 17 15482 1 1 18 VAL HG22 H 1.958 -4.626 -5.714 1.00 . A A . 18 VAL HG22 1 1 17 15483 1 1 18 VAL HG23 H 2.179 -3.390 -6.952 1.00 . A A . 18 VAL HG23 1 1 17 15484 1 1 18 VAL N N -0.530 -4.772 -4.612 1.00 . A A . 18 VAL N 1 1 17 15485 1 1 18 VAL O O -3.021 -4.386 -7.088 1.00 . A A . 18 VAL O 1 1 17 15486 1 1 19 GLU C C -4.560 -6.753 -5.944 1.00 . A A . 19 GLU C 1 1 17 15487 1 1 19 GLU CA C -3.320 -7.034 -6.780 1.00 . A A . 19 GLU CA 1 1 17 15488 1 1 19 GLU CB C -2.980 -8.525 -6.724 1.00 . A A . 19 GLU CB 1 1 17 15489 1 1 19 GLU CD C -3.864 -9.503 -8.849 1.00 . A A . 19 GLU CD 1 1 17 15490 1 1 19 GLU CG C -2.607 -9.017 -8.123 1.00 . A A . 19 GLU CG 1 1 17 15491 1 1 19 GLU H H -1.461 -6.672 -5.753 1.00 . A A . 19 GLU H 1 1 17 15492 1 1 19 GLU HA H -3.516 -6.741 -7.796 1.00 . A A . 19 GLU HA 1 1 17 15493 1 1 19 GLU HB2 H -2.146 -8.678 -6.054 1.00 . A A . 19 GLU HB2 1 1 17 15494 1 1 19 GLU HB3 H -3.836 -9.077 -6.366 1.00 . A A . 19 GLU HB3 1 1 17 15495 1 1 19 GLU HG2 H -2.159 -8.207 -8.682 1.00 . A A . 19 GLU HG2 1 1 17 15496 1 1 19 GLU HG3 H -1.904 -9.831 -8.043 1.00 . A A . 19 GLU HG3 1 1 17 15497 1 1 19 GLU N N -2.180 -6.235 -6.254 1.00 . A A . 19 GLU N 1 1 17 15498 1 1 19 GLU O O -5.663 -6.707 -6.451 1.00 . A A . 19 GLU O 1 1 17 15499 1 1 19 GLU OE1 O -4.801 -9.894 -8.171 1.00 . A A . 19 GLU OE1 1 1 17 15500 1 1 19 GLU OE2 O -3.868 -9.475 -10.068 1.00 . A A . 19 GLU OE2 1 1 17 15501 1 1 20 ILE C C -5.839 -4.717 -3.931 1.00 . A A . 20 ILE C 1 1 17 15502 1 1 20 ILE CA C -5.569 -6.219 -3.831 1.00 . A A . 20 ILE CA 1 1 17 15503 1 1 20 ILE CB C -5.284 -6.593 -2.379 1.00 . A A . 20 ILE CB 1 1 17 15504 1 1 20 ILE CD1 C -3.549 -8.284 -1.822 1.00 . A A . 20 ILE CD1 1 1 17 15505 1 1 20 ILE CG1 C -4.990 -8.068 -2.287 1.00 . A A . 20 ILE CG1 1 1 17 15506 1 1 20 ILE CG2 C -6.499 -6.262 -1.513 1.00 . A A . 20 ILE CG2 1 1 17 15507 1 1 20 ILE H H -3.493 -6.551 -4.284 1.00 . A A . 20 ILE H 1 1 17 15508 1 1 20 ILE HA H -6.428 -6.769 -4.186 1.00 . A A . 20 ILE HA 1 1 17 15509 1 1 20 ILE HB H -4.440 -6.063 -2.028 1.00 . A A . 20 ILE HB 1 1 17 15510 1 1 20 ILE HD11 H -2.965 -7.401 -2.034 1.00 . A A . 20 ILE HD11 1 1 17 15511 1 1 20 ILE HD12 H -3.539 -8.477 -0.760 1.00 . A A . 20 ILE HD12 1 1 17 15512 1 1 20 ILE HD13 H -3.125 -9.128 -2.346 1.00 . A A . 20 ILE HD13 1 1 17 15513 1 1 20 ILE HG12 H -5.663 -8.504 -1.585 1.00 . A A . 20 ILE HG12 1 1 17 15514 1 1 20 ILE HG13 H -5.125 -8.509 -3.249 1.00 . A A . 20 ILE HG13 1 1 17 15515 1 1 20 ILE HG21 H -7.402 -6.523 -2.045 1.00 . A A . 20 ILE HG21 1 1 17 15516 1 1 20 ILE HG22 H -6.447 -6.824 -0.594 1.00 . A A . 20 ILE HG22 1 1 17 15517 1 1 20 ILE HG23 H -6.505 -5.206 -1.290 1.00 . A A . 20 ILE HG23 1 1 17 15518 1 1 20 ILE N N -4.392 -6.534 -4.675 1.00 . A A . 20 ILE N 1 1 17 15519 1 1 20 ILE O O -6.622 -4.163 -3.183 1.00 . A A . 20 ILE O 1 1 17 15520 1 1 21 ALA C C -4.627 -2.088 -6.226 1.00 . A A . 21 ALA C 1 1 17 15521 1 1 21 ALA CA C -5.401 -2.586 -5.003 1.00 . A A . 21 ALA CA 1 1 17 15522 1 1 21 ALA CB C -4.893 -1.868 -3.749 1.00 . A A . 21 ALA CB 1 1 17 15523 1 1 21 ALA H H -4.556 -4.518 -5.450 1.00 . A A . 21 ALA H 1 1 17 15524 1 1 21 ALA HA H -6.454 -2.383 -5.134 1.00 . A A . 21 ALA HA 1 1 17 15525 1 1 21 ALA HB1 H -4.034 -2.394 -3.356 1.00 . A A . 21 ALA HB1 1 1 17 15526 1 1 21 ALA HB2 H -4.611 -0.857 -4.002 1.00 . A A . 21 ALA HB2 1 1 17 15527 1 1 21 ALA HB3 H -5.675 -1.848 -3.005 1.00 . A A . 21 ALA HB3 1 1 17 15528 1 1 21 ALA N N -5.189 -4.051 -4.853 1.00 . A A . 21 ALA N 1 1 17 15529 1 1 21 ALA O O -3.691 -1.320 -6.103 1.00 . A A . 21 ALA O 1 1 17 15530 1 1 22 PRO C C -4.724 -0.700 -8.987 1.00 . A A . 22 PRO C 1 1 17 15531 1 1 22 PRO CA C -4.395 -2.155 -8.648 1.00 . A A . 22 PRO CA 1 1 17 15532 1 1 22 PRO CB C -4.993 -3.112 -9.678 1.00 . A A . 22 PRO CB 1 1 17 15533 1 1 22 PRO CD C -6.174 -3.471 -7.593 1.00 . A A . 22 PRO CD 1 1 17 15534 1 1 22 PRO CG C -6.311 -3.527 -9.098 1.00 . A A . 22 PRO CG 1 1 17 15535 1 1 22 PRO HA H -3.328 -2.299 -8.586 1.00 . A A . 22 PRO HA 1 1 17 15536 1 1 22 PRO HB2 H -5.105 -2.592 -10.622 1.00 . A A . 22 PRO HB2 1 1 17 15537 1 1 22 PRO HB3 H -4.336 -3.956 -9.810 1.00 . A A . 22 PRO HB3 1 1 17 15538 1 1 22 PRO HD2 H -7.081 -3.088 -7.146 1.00 . A A . 22 PRO HD2 1 1 17 15539 1 1 22 PRO HD3 H -5.940 -4.447 -7.197 1.00 . A A . 22 PRO HD3 1 1 17 15540 1 1 22 PRO HG2 H -7.085 -2.846 -9.429 1.00 . A A . 22 PRO HG2 1 1 17 15541 1 1 22 PRO HG3 H -6.544 -4.533 -9.406 1.00 . A A . 22 PRO HG3 1 1 17 15542 1 1 22 PRO N N -5.052 -2.551 -7.374 1.00 . A A . 22 PRO N 1 1 17 15543 1 1 22 PRO O O -5.235 -0.394 -10.047 1.00 . A A . 22 PRO O 1 1 17 15544 1 1 23 GLY C C -3.989 2.460 -7.272 1.00 . A A . 23 GLY C 1 1 17 15545 1 1 23 GLY CA C -4.711 1.636 -8.335 1.00 . A A . 23 GLY CA 1 1 17 15546 1 1 23 GLY H H -4.016 -0.080 -7.245 1.00 . A A . 23 GLY H 1 1 17 15547 1 1 23 GLY HA2 H -4.354 1.912 -9.318 1.00 . A A . 23 GLY HA2 1 1 17 15548 1 1 23 GLY HA3 H -5.773 1.815 -8.269 1.00 . A A . 23 GLY HA3 1 1 17 15549 1 1 23 GLY N N -4.430 0.196 -8.089 1.00 . A A . 23 GLY N 1 1 17 15550 1 1 23 GLY O O -3.209 3.340 -7.577 1.00 . A A . 23 GLY O 1 1 17 15551 1 1 24 ALA C C -2.130 2.401 -4.778 1.00 . A A . 24 ALA C 1 1 17 15552 1 1 24 ALA CA C -3.556 2.925 -4.935 1.00 . A A . 24 ALA CA 1 1 17 15553 1 1 24 ALA CB C -4.319 2.728 -3.625 1.00 . A A . 24 ALA CB 1 1 17 15554 1 1 24 ALA H H -4.861 1.449 -5.802 1.00 . A A . 24 ALA H 1 1 17 15555 1 1 24 ALA HA H -3.530 3.976 -5.185 1.00 . A A . 24 ALA HA 1 1 17 15556 1 1 24 ALA HB1 H -5.346 2.476 -3.840 1.00 . A A . 24 ALA HB1 1 1 17 15557 1 1 24 ALA HB2 H -3.862 1.928 -3.060 1.00 . A A . 24 ALA HB2 1 1 17 15558 1 1 24 ALA HB3 H -4.285 3.641 -3.048 1.00 . A A . 24 ALA HB3 1 1 17 15559 1 1 24 ALA N N -4.235 2.171 -6.023 1.00 . A A . 24 ALA N 1 1 17 15560 1 1 24 ALA O O -1.203 3.153 -4.553 1.00 . A A . 24 ALA O 1 1 17 15561 1 1 25 PHE C C 0.027 0.358 -6.155 1.00 . A A . 25 PHE C 1 1 17 15562 1 1 25 PHE CA C -0.571 0.550 -4.760 1.00 . A A . 25 PHE CA 1 1 17 15563 1 1 25 PHE CB C -0.639 -0.807 -4.057 1.00 . A A . 25 PHE CB 1 1 17 15564 1 1 25 PHE CD1 C 1.570 -0.370 -2.905 1.00 . A A . 25 PHE CD1 1 1 17 15565 1 1 25 PHE CD2 C -0.264 -1.278 -1.605 1.00 . A A . 25 PHE CD2 1 1 17 15566 1 1 25 PHE CE1 C 2.385 -0.395 -1.765 1.00 . A A . 25 PHE CE1 1 1 17 15567 1 1 25 PHE CE2 C 0.553 -1.297 -0.468 1.00 . A A . 25 PHE CE2 1 1 17 15568 1 1 25 PHE CG C 0.243 -0.812 -2.827 1.00 . A A . 25 PHE CG 1 1 17 15569 1 1 25 PHE CZ C 1.880 -0.855 -0.549 1.00 . A A . 25 PHE CZ 1 1 17 15570 1 1 25 PHE H H -2.701 0.522 -5.082 1.00 . A A . 25 PHE H 1 1 17 15571 1 1 25 PHE HA H 0.044 1.229 -4.188 1.00 . A A . 25 PHE HA 1 1 17 15572 1 1 25 PHE HB2 H -1.658 -1.012 -3.769 1.00 . A A . 25 PHE HB2 1 1 17 15573 1 1 25 PHE HB3 H -0.299 -1.572 -4.740 1.00 . A A . 25 PHE HB3 1 1 17 15574 1 1 25 PHE HD1 H 1.963 -0.012 -3.845 1.00 . A A . 25 PHE HD1 1 1 17 15575 1 1 25 PHE HD2 H -1.287 -1.619 -1.541 1.00 . A A . 25 PHE HD2 1 1 17 15576 1 1 25 PHE HE1 H 3.403 -0.056 -1.824 1.00 . A A . 25 PHE HE1 1 1 17 15577 1 1 25 PHE HE2 H 0.160 -1.655 0.474 1.00 . A A . 25 PHE HE2 1 1 17 15578 1 1 25 PHE HZ H 2.511 -0.875 0.325 1.00 . A A . 25 PHE HZ 1 1 17 15579 1 1 25 PHE N N -1.942 1.114 -4.897 1.00 . A A . 25 PHE N 1 1 17 15580 1 1 25 PHE O O -0.617 -0.152 -7.050 1.00 . A A . 25 PHE O 1 1 17 15581 1 1 26 ALA C C 3.402 0.750 -7.566 1.00 . A A . 26 ALA C 1 1 17 15582 1 1 26 ALA CA C 1.883 0.596 -7.688 1.00 . A A . 26 ALA CA 1 1 17 15583 1 1 26 ALA CB C 1.338 1.660 -8.644 1.00 . A A . 26 ALA CB 1 1 17 15584 1 1 26 ALA H H 1.749 1.167 -5.615 1.00 . A A . 26 ALA H 1 1 17 15585 1 1 26 ALA HA H 1.652 -0.386 -8.076 1.00 . A A . 26 ALA HA 1 1 17 15586 1 1 26 ALA HB1 H 0.412 2.056 -8.251 1.00 . A A . 26 ALA HB1 1 1 17 15587 1 1 26 ALA HB2 H 2.058 2.458 -8.744 1.00 . A A . 26 ALA HB2 1 1 17 15588 1 1 26 ALA HB3 H 1.157 1.214 -9.611 1.00 . A A . 26 ALA HB3 1 1 17 15589 1 1 26 ALA N N 1.250 0.759 -6.349 1.00 . A A . 26 ALA N 1 1 17 15590 1 1 26 ALA O O 3.900 1.761 -7.112 1.00 . A A . 26 ALA O 1 1 17 15591 1 1 27 MET C C 6.107 1.029 -8.725 1.00 . A A . 27 MET C 1 1 17 15592 1 1 27 MET CA C 5.627 -0.152 -7.890 1.00 . A A . 27 MET CA 1 1 17 15593 1 1 27 MET CB C 6.245 -1.445 -8.428 1.00 . A A . 27 MET CB 1 1 17 15594 1 1 27 MET CE C 7.864 -3.812 -7.661 1.00 . A A . 27 MET CE 1 1 17 15595 1 1 27 MET CG C 7.754 -1.264 -8.590 1.00 . A A . 27 MET CG 1 1 17 15596 1 1 27 MET H H 3.721 -1.045 -8.343 1.00 . A A . 27 MET H 1 1 17 15597 1 1 27 MET HA H 5.920 -0.009 -6.871 1.00 . A A . 27 MET HA 1 1 17 15598 1 1 27 MET HB2 H 6.049 -2.251 -7.736 1.00 . A A . 27 MET HB2 1 1 17 15599 1 1 27 MET HB3 H 5.807 -1.680 -9.387 1.00 . A A . 27 MET HB3 1 1 17 15600 1 1 27 MET HE1 H 7.883 -3.207 -6.765 1.00 . A A . 27 MET HE1 1 1 17 15601 1 1 27 MET HE2 H 6.848 -4.119 -7.873 1.00 . A A . 27 MET HE2 1 1 17 15602 1 1 27 MET HE3 H 8.478 -4.686 -7.514 1.00 . A A . 27 MET HE3 1 1 17 15603 1 1 27 MET HG2 H 7.949 -0.535 -9.362 1.00 . A A . 27 MET HG2 1 1 17 15604 1 1 27 MET HG3 H 8.178 -0.924 -7.657 1.00 . A A . 27 MET HG3 1 1 17 15605 1 1 27 MET N N 4.142 -0.242 -7.975 1.00 . A A . 27 MET N 1 1 17 15606 1 1 27 MET O O 5.499 1.373 -9.719 1.00 . A A . 27 MET O 1 1 17 15607 1 1 27 MET SD S 8.503 -2.846 -9.051 1.00 . A A . 27 MET SD 1 1 17 15608 1 1 28 ASP C C 9.114 2.513 -9.516 1.00 . A A . 28 ASP C 1 1 17 15609 1 1 28 ASP CA C 7.666 2.797 -9.168 1.00 . A A . 28 ASP CA 1 1 17 15610 1 1 28 ASP CB C 7.545 4.080 -8.346 1.00 . A A . 28 ASP CB 1 1 17 15611 1 1 28 ASP CG C 7.142 5.244 -9.252 1.00 . A A . 28 ASP CG 1 1 17 15612 1 1 28 ASP H H 7.715 1.384 -7.550 1.00 . A A . 28 ASP H 1 1 17 15613 1 1 28 ASP HA H 7.077 2.875 -10.070 1.00 . A A . 28 ASP HA 1 1 17 15614 1 1 28 ASP HB2 H 6.791 3.942 -7.585 1.00 . A A . 28 ASP HB2 1 1 17 15615 1 1 28 ASP HB3 H 8.490 4.296 -7.879 1.00 . A A . 28 ASP HB3 1 1 17 15616 1 1 28 ASP N N 7.195 1.660 -8.354 1.00 . A A . 28 ASP N 1 1 17 15617 1 1 28 ASP O O 9.730 1.703 -8.859 1.00 . A A . 28 ASP O 1 1 17 15618 1 1 28 ASP OD1 O 6.282 5.043 -10.094 1.00 . A A . 28 ASP OD1 1 1 17 15619 1 1 28 ASP OD2 O 7.700 6.316 -9.089 1.00 . A A . 28 ASP OD2 1 1 17 15620 1 1 29 PRO C C 11.900 3.877 -10.131 1.00 . A A . 29 PRO C 1 1 17 15621 1 1 29 PRO CA C 11.000 2.980 -10.971 1.00 . A A . 29 PRO CA 1 1 17 15622 1 1 29 PRO CB C 10.978 3.411 -12.437 1.00 . A A . 29 PRO CB 1 1 17 15623 1 1 29 PRO CD C 8.915 4.172 -11.353 1.00 . A A . 29 PRO CD 1 1 17 15624 1 1 29 PRO CG C 9.815 4.355 -12.562 1.00 . A A . 29 PRO CG 1 1 17 15625 1 1 29 PRO HA H 11.291 1.945 -10.884 1.00 . A A . 29 PRO HA 1 1 17 15626 1 1 29 PRO HB2 H 11.918 3.888 -12.680 1.00 . A A . 29 PRO HB2 1 1 17 15627 1 1 29 PRO HB3 H 10.846 2.542 -13.063 1.00 . A A . 29 PRO HB3 1 1 17 15628 1 1 29 PRO HD2 H 8.822 5.107 -10.821 1.00 . A A . 29 PRO HD2 1 1 17 15629 1 1 29 PRO HD3 H 7.951 3.810 -11.650 1.00 . A A . 29 PRO HD3 1 1 17 15630 1 1 29 PRO HG2 H 10.180 5.373 -12.598 1.00 . A A . 29 PRO HG2 1 1 17 15631 1 1 29 PRO HG3 H 9.262 4.131 -13.461 1.00 . A A . 29 PRO HG3 1 1 17 15632 1 1 29 PRO N N 9.603 3.176 -10.533 1.00 . A A . 29 PRO N 1 1 17 15633 1 1 29 PRO O O 13.095 3.679 -10.034 1.00 . A A . 29 PRO O 1 1 17 15634 1 1 30 GLU C C 12.053 5.132 -7.217 1.00 . A A . 30 GLU C 1 1 17 15635 1 1 30 GLU CA C 12.082 5.751 -8.607 1.00 . A A . 30 GLU CA 1 1 17 15636 1 1 30 GLU CB C 11.431 7.135 -8.573 1.00 . A A . 30 GLU CB 1 1 17 15637 1 1 30 GLU CD C 12.528 8.710 -10.171 1.00 . A A . 30 GLU CD 1 1 17 15638 1 1 30 GLU CG C 12.508 8.210 -8.726 1.00 . A A . 30 GLU CG 1 1 17 15639 1 1 30 GLU H H 10.332 4.948 -9.569 1.00 . A A . 30 GLU H 1 1 17 15640 1 1 30 GLU HA H 13.102 5.826 -8.956 1.00 . A A . 30 GLU HA 1 1 17 15641 1 1 30 GLU HB2 H 10.720 7.218 -9.383 1.00 . A A . 30 GLU HB2 1 1 17 15642 1 1 30 GLU HB3 H 10.922 7.271 -7.631 1.00 . A A . 30 GLU HB3 1 1 17 15643 1 1 30 GLU HG2 H 12.290 9.034 -8.061 1.00 . A A . 30 GLU HG2 1 1 17 15644 1 1 30 GLU HG3 H 13.472 7.792 -8.478 1.00 . A A . 30 GLU HG3 1 1 17 15645 1 1 30 GLU N N 11.306 4.843 -9.491 1.00 . A A . 30 GLU N 1 1 17 15646 1 1 30 GLU O O 12.979 5.247 -6.438 1.00 . A A . 30 GLU O 1 1 17 15647 1 1 30 GLU OE1 O 12.738 7.897 -11.056 1.00 . A A . 30 GLU OE1 1 1 17 15648 1 1 30 GLU OE2 O 12.333 9.898 -10.369 1.00 . A A . 30 GLU OE2 1 1 17 15649 1 1 31 ILE C C 11.033 2.252 -5.850 1.00 . A A . 31 ILE C 1 1 17 15650 1 1 31 ILE CA C 10.857 3.749 -5.624 1.00 . A A . 31 ILE CA 1 1 17 15651 1 1 31 ILE CB C 9.485 4.054 -5.006 1.00 . A A . 31 ILE CB 1 1 17 15652 1 1 31 ILE CD1 C 7.026 3.636 -5.271 1.00 . A A . 31 ILE CD1 1 1 17 15653 1 1 31 ILE CG1 C 8.427 3.080 -5.543 1.00 . A A . 31 ILE CG1 1 1 17 15654 1 1 31 ILE CG2 C 9.089 5.491 -5.354 1.00 . A A . 31 ILE CG2 1 1 17 15655 1 1 31 ILE H H 10.280 4.346 -7.597 1.00 . A A . 31 ILE H 1 1 17 15656 1 1 31 ILE HA H 11.619 4.086 -4.970 1.00 . A A . 31 ILE HA 1 1 17 15657 1 1 31 ILE HB H 9.552 3.955 -3.930 1.00 . A A . 31 ILE HB 1 1 17 15658 1 1 31 ILE HD11 H 6.927 3.855 -4.219 1.00 . A A . 31 ILE HD11 1 1 17 15659 1 1 31 ILE HD12 H 6.882 4.543 -5.841 1.00 . A A . 31 ILE HD12 1 1 17 15660 1 1 31 ILE HD13 H 6.285 2.907 -5.560 1.00 . A A . 31 ILE HD13 1 1 17 15661 1 1 31 ILE HG12 H 8.566 2.947 -6.605 1.00 . A A . 31 ILE HG12 1 1 17 15662 1 1 31 ILE HG13 H 8.534 2.128 -5.047 1.00 . A A . 31 ILE HG13 1 1 17 15663 1 1 31 ILE HG21 H 9.910 6.156 -5.127 1.00 . A A . 31 ILE HG21 1 1 17 15664 1 1 31 ILE HG22 H 8.855 5.554 -6.406 1.00 . A A . 31 ILE HG22 1 1 17 15665 1 1 31 ILE HG23 H 8.224 5.777 -4.774 1.00 . A A . 31 ILE HG23 1 1 17 15666 1 1 31 ILE N N 10.987 4.437 -6.930 1.00 . A A . 31 ILE N 1 1 17 15667 1 1 31 ILE O O 10.975 1.469 -4.926 1.00 . A A . 31 ILE O 1 1 17 15668 1 1 32 GLU C C 10.685 -0.449 -6.454 1.00 . A A . 32 GLU C 1 1 17 15669 1 1 32 GLU CA C 11.431 0.428 -7.444 1.00 . A A . 32 GLU CA 1 1 17 15670 1 1 32 GLU CB C 12.919 0.074 -7.434 1.00 . A A . 32 GLU CB 1 1 17 15671 1 1 32 GLU CD C 15.080 1.207 -7.971 1.00 . A A . 32 GLU CD 1 1 17 15672 1 1 32 GLU CG C 13.654 0.943 -8.456 1.00 . A A . 32 GLU CG 1 1 17 15673 1 1 32 GLU H H 11.289 2.535 -7.799 1.00 . A A . 32 GLU H 1 1 17 15674 1 1 32 GLU HA H 11.026 0.265 -8.431 1.00 . A A . 32 GLU HA 1 1 17 15675 1 1 32 GLU HB2 H 13.325 0.253 -6.449 1.00 . A A . 32 GLU HB2 1 1 17 15676 1 1 32 GLU HB3 H 13.044 -0.967 -7.693 1.00 . A A . 32 GLU HB3 1 1 17 15677 1 1 32 GLU HG2 H 13.684 0.431 -9.408 1.00 . A A . 32 GLU HG2 1 1 17 15678 1 1 32 GLU HG3 H 13.135 1.882 -8.569 1.00 . A A . 32 GLU HG3 1 1 17 15679 1 1 32 GLU N N 11.251 1.866 -7.088 1.00 . A A . 32 GLU N 1 1 17 15680 1 1 32 GLU O O 11.188 -1.451 -5.990 1.00 . A A . 32 GLU O 1 1 17 15681 1 1 32 GLU OE1 O 15.878 0.285 -8.013 1.00 . A A . 32 GLU OE1 1 1 17 15682 1 1 32 GLU OE2 O 15.350 2.325 -7.565 1.00 . A A . 32 GLU OE2 1 1 17 15683 1 1 33 LYS C C 7.252 -0.408 -5.094 1.00 . A A . 33 LYS C 1 1 17 15684 1 1 33 LYS CA C 8.704 -0.881 -5.134 1.00 . A A . 33 LYS CA 1 1 17 15685 1 1 33 LYS CB C 9.318 -0.732 -3.738 1.00 . A A . 33 LYS CB 1 1 17 15686 1 1 33 LYS CD C 11.354 -1.571 -2.557 1.00 . A A . 33 LYS CD 1 1 17 15687 1 1 33 LYS CE C 12.638 -2.050 -3.236 1.00 . A A . 33 LYS CE 1 1 17 15688 1 1 33 LYS CG C 10.147 -1.976 -3.407 1.00 . A A . 33 LYS CG 1 1 17 15689 1 1 33 LYS H H 9.108 0.757 -6.512 1.00 . A A . 33 LYS H 1 1 17 15690 1 1 33 LYS HA H 8.732 -1.920 -5.420 1.00 . A A . 33 LYS HA 1 1 17 15691 1 1 33 LYS HB2 H 9.953 0.140 -3.713 1.00 . A A . 33 LYS HB2 1 1 17 15692 1 1 33 LYS HB3 H 8.530 -0.624 -3.008 1.00 . A A . 33 LYS HB3 1 1 17 15693 1 1 33 LYS HD2 H 11.378 -0.496 -2.454 1.00 . A A . 33 LYS HD2 1 1 17 15694 1 1 33 LYS HD3 H 11.275 -2.025 -1.581 1.00 . A A . 33 LYS HD3 1 1 17 15695 1 1 33 LYS HE2 H 12.537 -3.090 -3.504 1.00 . A A . 33 LYS HE2 1 1 17 15696 1 1 33 LYS HE3 H 12.815 -1.463 -4.126 1.00 . A A . 33 LYS HE3 1 1 17 15697 1 1 33 LYS HG2 H 9.538 -2.679 -2.859 1.00 . A A . 33 LYS HG2 1 1 17 15698 1 1 33 LYS HG3 H 10.490 -2.435 -4.318 1.00 . A A . 33 LYS HG3 1 1 17 15699 1 1 33 LYS HZ1 H 13.871 -0.888 -2.023 1.00 . A A . 33 LYS HZ1 1 1 17 15700 1 1 33 LYS HZ2 H 13.624 -2.466 -1.449 1.00 . A A . 33 LYS HZ2 1 1 17 15701 1 1 33 LYS HZ3 H 14.661 -2.194 -2.766 1.00 . A A . 33 LYS HZ3 1 1 17 15702 1 1 33 LYS N N 9.488 -0.068 -6.119 1.00 . A A . 33 LYS N 1 1 17 15703 1 1 33 LYS NZ N 13.785 -1.887 -2.298 1.00 . A A . 33 LYS NZ 1 1 17 15704 1 1 33 LYS O O 6.964 0.763 -5.255 1.00 . A A . 33 LYS O 1 1 17 15705 1 1 34 ALA C C 4.692 0.116 -3.730 1.00 . A A . 34 ALA C 1 1 17 15706 1 1 34 ALA CA C 4.891 -0.930 -4.824 1.00 . A A . 34 ALA CA 1 1 17 15707 1 1 34 ALA CB C 4.045 -2.164 -4.500 1.00 . A A . 34 ALA CB 1 1 17 15708 1 1 34 ALA H H 6.592 -2.251 -4.753 1.00 . A A . 34 ALA H 1 1 17 15709 1 1 34 ALA HA H 4.583 -0.522 -5.774 1.00 . A A . 34 ALA HA 1 1 17 15710 1 1 34 ALA HB1 H 4.484 -2.692 -3.667 1.00 . A A . 34 ALA HB1 1 1 17 15711 1 1 34 ALA HB2 H 3.042 -1.855 -4.243 1.00 . A A . 34 ALA HB2 1 1 17 15712 1 1 34 ALA HB3 H 4.011 -2.814 -5.361 1.00 . A A . 34 ALA HB3 1 1 17 15713 1 1 34 ALA N N 6.332 -1.314 -4.879 1.00 . A A . 34 ALA N 1 1 17 15714 1 1 34 ALA O O 5.277 0.032 -2.677 1.00 . A A . 34 ALA O 1 1 17 15715 1 1 35 TYR C C 2.160 2.628 -3.013 1.00 . A A . 35 TYR C 1 1 17 15716 1 1 35 TYR CA C 3.612 2.151 -2.938 1.00 . A A . 35 TYR CA 1 1 17 15717 1 1 35 TYR CB C 4.582 3.326 -3.152 1.00 . A A . 35 TYR CB 1 1 17 15718 1 1 35 TYR CD1 C 3.428 3.712 -5.386 1.00 . A A . 35 TYR CD1 1 1 17 15719 1 1 35 TYR CD2 C 4.495 5.582 -4.276 1.00 . A A . 35 TYR CD2 1 1 17 15720 1 1 35 TYR CE1 C 3.056 4.550 -6.442 1.00 . A A . 35 TYR CE1 1 1 17 15721 1 1 35 TYR CE2 C 4.120 6.420 -5.332 1.00 . A A . 35 TYR CE2 1 1 17 15722 1 1 35 TYR CG C 4.148 4.224 -4.299 1.00 . A A . 35 TYR CG 1 1 17 15723 1 1 35 TYR CZ C 3.401 5.903 -6.415 1.00 . A A . 35 TYR CZ 1 1 17 15724 1 1 35 TYR H H 3.394 1.122 -4.825 1.00 . A A . 35 TYR H 1 1 17 15725 1 1 35 TYR HA H 3.779 1.740 -1.948 1.00 . A A . 35 TYR HA 1 1 17 15726 1 1 35 TYR HB2 H 4.629 3.913 -2.248 1.00 . A A . 35 TYR HB2 1 1 17 15727 1 1 35 TYR HB3 H 5.564 2.932 -3.365 1.00 . A A . 35 TYR HB3 1 1 17 15728 1 1 35 TYR HD1 H 3.155 2.676 -5.410 1.00 . A A . 35 TYR HD1 1 1 17 15729 1 1 35 TYR HD2 H 5.051 5.982 -3.441 1.00 . A A . 35 TYR HD2 1 1 17 15730 1 1 35 TYR HE1 H 2.502 4.152 -7.278 1.00 . A A . 35 TYR HE1 1 1 17 15731 1 1 35 TYR HE2 H 4.386 7.467 -5.311 1.00 . A A . 35 TYR HE2 1 1 17 15732 1 1 35 TYR HH H 2.806 6.176 -8.207 1.00 . A A . 35 TYR HH 1 1 17 15733 1 1 35 TYR N N 3.860 1.092 -3.970 1.00 . A A . 35 TYR N 1 1 17 15734 1 1 35 TYR O O 1.551 2.668 -4.063 1.00 . A A . 35 TYR O 1 1 17 15735 1 1 35 TYR OH O 3.036 6.730 -7.457 1.00 . A A . 35 TYR OH 1 1 17 15736 1 1 36 VAL C C 0.171 4.945 -2.172 1.00 . A A . 36 VAL C 1 1 17 15737 1 1 36 VAL CA C 0.189 3.444 -1.870 1.00 . A A . 36 VAL CA 1 1 17 15738 1 1 36 VAL CB C -0.406 3.157 -0.484 1.00 . A A . 36 VAL CB 1 1 17 15739 1 1 36 VAL CG1 C -1.552 4.121 -0.177 1.00 . A A . 36 VAL CG1 1 1 17 15740 1 1 36 VAL CG2 C -0.939 1.723 -0.451 1.00 . A A . 36 VAL CG2 1 1 17 15741 1 1 36 VAL H H 2.110 2.927 -1.056 1.00 . A A . 36 VAL H 1 1 17 15742 1 1 36 VAL HA H -0.378 2.918 -2.624 1.00 . A A . 36 VAL HA 1 1 17 15743 1 1 36 VAL HB H 0.364 3.271 0.263 1.00 . A A . 36 VAL HB 1 1 17 15744 1 1 36 VAL HG11 H -2.225 4.159 -1.020 1.00 . A A . 36 VAL HG11 1 1 17 15745 1 1 36 VAL HG12 H -2.086 3.775 0.696 1.00 . A A . 36 VAL HG12 1 1 17 15746 1 1 36 VAL HG13 H -1.151 5.105 0.012 1.00 . A A . 36 VAL HG13 1 1 17 15747 1 1 36 VAL HG21 H -0.158 1.043 -0.764 1.00 . A A . 36 VAL HG21 1 1 17 15748 1 1 36 VAL HG22 H -1.250 1.477 0.554 1.00 . A A . 36 VAL HG22 1 1 17 15749 1 1 36 VAL HG23 H -1.780 1.636 -1.121 1.00 . A A . 36 VAL HG23 1 1 17 15750 1 1 36 VAL N N 1.600 2.977 -1.891 1.00 . A A . 36 VAL N 1 1 17 15751 1 1 36 VAL O O 0.453 5.764 -1.321 1.00 . A A . 36 VAL O 1 1 17 15752 1 1 37 LYS C C -1.577 7.176 -4.140 1.00 . A A . 37 LYS C 1 1 17 15753 1 1 37 LYS CA C -0.161 6.749 -3.753 1.00 . A A . 37 LYS CA 1 1 17 15754 1 1 37 LYS CB C 0.770 6.974 -4.946 1.00 . A A . 37 LYS CB 1 1 17 15755 1 1 37 LYS CD C -0.608 7.066 -7.031 1.00 . A A . 37 LYS CD 1 1 17 15756 1 1 37 LYS CE C 0.286 7.994 -7.857 1.00 . A A . 37 LYS CE 1 1 17 15757 1 1 37 LYS CG C 0.261 6.171 -6.145 1.00 . A A . 37 LYS CG 1 1 17 15758 1 1 37 LYS H H -0.355 4.623 -4.059 1.00 . A A . 37 LYS H 1 1 17 15759 1 1 37 LYS HA H 0.179 7.340 -2.915 1.00 . A A . 37 LYS HA 1 1 17 15760 1 1 37 LYS HB2 H 0.786 8.025 -5.195 1.00 . A A . 37 LYS HB2 1 1 17 15761 1 1 37 LYS HB3 H 1.766 6.648 -4.692 1.00 . A A . 37 LYS HB3 1 1 17 15762 1 1 37 LYS HD2 H -1.199 6.451 -7.694 1.00 . A A . 37 LYS HD2 1 1 17 15763 1 1 37 LYS HD3 H -1.264 7.660 -6.412 1.00 . A A . 37 LYS HD3 1 1 17 15764 1 1 37 LYS HE2 H -0.193 8.957 -7.960 1.00 . A A . 37 LYS HE2 1 1 17 15765 1 1 37 LYS HE3 H 1.236 8.116 -7.358 1.00 . A A . 37 LYS HE3 1 1 17 15766 1 1 37 LYS HG2 H 1.099 5.803 -6.716 1.00 . A A . 37 LYS HG2 1 1 17 15767 1 1 37 LYS HG3 H -0.328 5.336 -5.795 1.00 . A A . 37 LYS HG3 1 1 17 15768 1 1 37 LYS HZ1 H 0.004 6.491 -9.270 1.00 . A A . 37 LYS HZ1 1 1 17 15769 1 1 37 LYS HZ2 H 0.142 8.049 -9.933 1.00 . A A . 37 LYS HZ2 1 1 17 15770 1 1 37 LYS HZ3 H 1.522 7.250 -9.357 1.00 . A A . 37 LYS HZ3 1 1 17 15771 1 1 37 LYS N N -0.144 5.305 -3.385 1.00 . A A . 37 LYS N 1 1 17 15772 1 1 37 LYS NZ N 0.505 7.401 -9.206 1.00 . A A . 37 LYS NZ 1 1 17 15773 1 1 37 LYS O O -1.984 8.295 -3.899 1.00 . A A . 37 LYS O 1 1 17 15774 1 1 38 ASP C C -4.722 6.032 -4.215 1.00 . A A . 38 ASP C 1 1 17 15775 1 1 38 ASP CA C -3.708 6.674 -5.162 1.00 . A A . 38 ASP CA 1 1 17 15776 1 1 38 ASP CB C -3.957 6.184 -6.589 1.00 . A A . 38 ASP CB 1 1 17 15777 1 1 38 ASP CG C -5.414 6.451 -6.973 1.00 . A A . 38 ASP CG 1 1 17 15778 1 1 38 ASP H H -1.980 5.407 -4.944 1.00 . A A . 38 ASP H 1 1 17 15779 1 1 38 ASP HA H -3.815 7.747 -5.127 1.00 . A A . 38 ASP HA 1 1 17 15780 1 1 38 ASP HB2 H -3.302 6.710 -7.269 1.00 . A A . 38 ASP HB2 1 1 17 15781 1 1 38 ASP HB3 H -3.760 5.125 -6.646 1.00 . A A . 38 ASP HB3 1 1 17 15782 1 1 38 ASP N N -2.326 6.302 -4.749 1.00 . A A . 38 ASP N 1 1 17 15783 1 1 38 ASP O O -5.247 4.969 -4.479 1.00 . A A . 38 ASP O 1 1 17 15784 1 1 38 ASP OD1 O -5.965 7.422 -6.484 1.00 . A A . 38 ASP OD1 1 1 17 15785 1 1 38 ASP OD2 O -5.952 5.679 -7.750 1.00 . A A . 38 ASP OD2 1 1 17 15786 1 1 39 VAL C C -7.295 5.789 -2.897 1.00 . A A . 39 VAL C 1 1 17 15787 1 1 39 VAL CA C -5.991 6.101 -2.157 1.00 . A A . 39 VAL CA 1 1 17 15788 1 1 39 VAL CB C -6.269 7.113 -1.043 1.00 . A A . 39 VAL CB 1 1 17 15789 1 1 39 VAL CG1 C -5.040 7.227 -0.141 1.00 . A A . 39 VAL CG1 1 1 17 15790 1 1 39 VAL CG2 C -6.574 8.479 -1.661 1.00 . A A . 39 VAL CG2 1 1 17 15791 1 1 39 VAL H H -4.575 7.531 -2.922 1.00 . A A . 39 VAL H 1 1 17 15792 1 1 39 VAL HA H -5.594 5.194 -1.729 1.00 . A A . 39 VAL HA 1 1 17 15793 1 1 39 VAL HB H -7.116 6.782 -0.460 1.00 . A A . 39 VAL HB 1 1 17 15794 1 1 39 VAL HG11 H -4.341 6.441 -0.383 1.00 . A A . 39 VAL HG11 1 1 17 15795 1 1 39 VAL HG12 H -4.569 8.187 -0.295 1.00 . A A . 39 VAL HG12 1 1 17 15796 1 1 39 VAL HG13 H -5.342 7.136 0.892 1.00 . A A . 39 VAL HG13 1 1 17 15797 1 1 39 VAL HG21 H -6.337 8.460 -2.714 1.00 . A A . 39 VAL HG21 1 1 17 15798 1 1 39 VAL HG22 H -7.622 8.706 -1.531 1.00 . A A . 39 VAL HG22 1 1 17 15799 1 1 39 VAL HG23 H -5.978 9.236 -1.172 1.00 . A A . 39 VAL HG23 1 1 17 15800 1 1 39 VAL N N -5.006 6.673 -3.116 1.00 . A A . 39 VAL N 1 1 17 15801 1 1 39 VAL O O -8.025 4.889 -2.533 1.00 . A A . 39 VAL O 1 1 17 15802 1 1 40 GLU C C -8.687 4.987 -5.516 1.00 . A A . 40 GLU C 1 1 17 15803 1 1 40 GLU CA C -8.843 6.271 -4.698 1.00 . A A . 40 GLU CA 1 1 17 15804 1 1 40 GLU CB C -9.113 7.447 -5.639 1.00 . A A . 40 GLU CB 1 1 17 15805 1 1 40 GLU CD C -10.687 9.348 -6.027 1.00 . A A . 40 GLU CD 1 1 17 15806 1 1 40 GLU CG C -10.548 7.939 -5.447 1.00 . A A . 40 GLU CG 1 1 17 15807 1 1 40 GLU H H -6.986 7.246 -4.210 1.00 . A A . 40 GLU H 1 1 17 15808 1 1 40 GLU HA H -9.668 6.162 -4.011 1.00 . A A . 40 GLU HA 1 1 17 15809 1 1 40 GLU HB2 H -8.423 8.250 -5.417 1.00 . A A . 40 GLU HB2 1 1 17 15810 1 1 40 GLU HB3 H -8.977 7.128 -6.661 1.00 . A A . 40 GLU HB3 1 1 17 15811 1 1 40 GLU HG2 H -11.228 7.271 -5.957 1.00 . A A . 40 GLU HG2 1 1 17 15812 1 1 40 GLU HG3 H -10.784 7.960 -4.394 1.00 . A A . 40 GLU HG3 1 1 17 15813 1 1 40 GLU N N -7.590 6.525 -3.933 1.00 . A A . 40 GLU N 1 1 17 15814 1 1 40 GLU O O -9.649 4.435 -6.014 1.00 . A A . 40 GLU O 1 1 17 15815 1 1 40 GLU OE1 O -10.373 10.292 -5.319 1.00 . A A . 40 GLU OE1 1 1 17 15816 1 1 40 GLU OE2 O -11.105 9.459 -7.167 1.00 . A A . 40 GLU OE2 1 1 17 15817 1 1 41 GLY C C -7.789 2.059 -5.657 1.00 . A A . 41 GLY C 1 1 17 15818 1 1 41 GLY CA C -7.263 3.259 -6.446 1.00 . A A . 41 GLY CA 1 1 17 15819 1 1 41 GLY H H -6.720 4.968 -5.251 1.00 . A A . 41 GLY H 1 1 17 15820 1 1 41 GLY HA2 H -7.789 3.331 -7.388 1.00 . A A . 41 GLY HA2 1 1 17 15821 1 1 41 GLY HA3 H -6.208 3.129 -6.630 1.00 . A A . 41 GLY HA3 1 1 17 15822 1 1 41 GLY N N -7.482 4.507 -5.660 1.00 . A A . 41 GLY N 1 1 17 15823 1 1 41 GLY O O -8.146 1.042 -6.220 1.00 . A A . 41 GLY O 1 1 17 15824 1 1 42 ALA C C -9.164 1.591 -2.367 1.00 . A A . 42 ALA C 1 1 17 15825 1 1 42 ALA CA C -8.345 1.037 -3.531 1.00 . A A . 42 ALA CA 1 1 17 15826 1 1 42 ALA CB C -7.162 0.234 -2.987 1.00 . A A . 42 ALA CB 1 1 17 15827 1 1 42 ALA H H -7.551 2.999 -3.925 1.00 . A A . 42 ALA H 1 1 17 15828 1 1 42 ALA HA H -8.968 0.396 -4.138 1.00 . A A . 42 ALA HA 1 1 17 15829 1 1 42 ALA HB1 H -6.237 0.703 -3.290 1.00 . A A . 42 ALA HB1 1 1 17 15830 1 1 42 ALA HB2 H -7.213 0.206 -1.907 1.00 . A A . 42 ALA HB2 1 1 17 15831 1 1 42 ALA HB3 H -7.199 -0.773 -3.375 1.00 . A A . 42 ALA HB3 1 1 17 15832 1 1 42 ALA N N -7.841 2.169 -4.358 1.00 . A A . 42 ALA N 1 1 17 15833 1 1 42 ALA O O -8.985 2.719 -1.952 1.00 . A A . 42 ALA O 1 1 17 15834 1 1 43 SER C C -10.283 0.847 0.622 1.00 . A A . 43 SER C 1 1 17 15835 1 1 43 SER CA C -10.893 1.304 -0.703 1.00 . A A . 43 SER CA 1 1 17 15836 1 1 43 SER CB C -12.305 0.739 -0.825 1.00 . A A . 43 SER CB 1 1 17 15837 1 1 43 SER H H -10.203 -0.091 -2.183 1.00 . A A . 43 SER H 1 1 17 15838 1 1 43 SER HA H -10.934 2.384 -0.727 1.00 . A A . 43 SER HA 1 1 17 15839 1 1 43 SER HB2 H -12.292 -0.123 -1.467 1.00 . A A . 43 SER HB2 1 1 17 15840 1 1 43 SER HB3 H -12.658 0.446 0.152 1.00 . A A . 43 SER HB3 1 1 17 15841 1 1 43 SER HG H -13.499 2.266 -0.657 1.00 . A A . 43 SER HG 1 1 17 15842 1 1 43 SER N N -10.067 0.813 -1.835 1.00 . A A . 43 SER N 1 1 17 15843 1 1 43 SER O O -9.157 0.386 0.678 1.00 . A A . 43 SER O 1 1 17 15844 1 1 43 SER OG O -13.163 1.728 -1.378 1.00 . A A . 43 SER OG 1 1 17 15845 1 1 44 GLN C C -10.472 -0.984 3.072 1.00 . A A . 44 GLN C 1 1 17 15846 1 1 44 GLN CA C -10.512 0.542 3.015 1.00 . A A . 44 GLN CA 1 1 17 15847 1 1 44 GLN CB C -11.437 1.071 4.114 1.00 . A A . 44 GLN CB 1 1 17 15848 1 1 44 GLN CD C -12.128 0.700 6.486 1.00 . A A . 44 GLN CD 1 1 17 15849 1 1 44 GLN CG C -11.004 0.504 5.467 1.00 . A A . 44 GLN CG 1 1 17 15850 1 1 44 GLN H H -11.931 1.337 1.608 1.00 . A A . 44 GLN H 1 1 17 15851 1 1 44 GLN HA H -9.516 0.935 3.160 1.00 . A A . 44 GLN HA 1 1 17 15852 1 1 44 GLN HB2 H -11.385 2.149 4.139 1.00 . A A . 44 GLN HB2 1 1 17 15853 1 1 44 GLN HB3 H -12.452 0.764 3.907 1.00 . A A . 44 GLN HB3 1 1 17 15854 1 1 44 GLN HE21 H -12.658 -1.212 6.482 1.00 . A A . 44 GLN HE21 1 1 17 15855 1 1 44 GLN HE22 H -13.567 -0.210 7.508 1.00 . A A . 44 GLN HE22 1 1 17 15856 1 1 44 GLN HG2 H -10.787 -0.549 5.365 1.00 . A A . 44 GLN HG2 1 1 17 15857 1 1 44 GLN HG3 H -10.118 1.022 5.807 1.00 . A A . 44 GLN HG3 1 1 17 15858 1 1 44 GLN N N -11.027 0.968 1.686 1.00 . A A . 44 GLN N 1 1 17 15859 1 1 44 GLN NE2 N -12.843 -0.326 6.856 1.00 . A A . 44 GLN NE2 1 1 17 15860 1 1 44 GLN O O -9.454 -1.574 3.363 1.00 . A A . 44 GLN O 1 1 17 15861 1 1 44 GLN OE1 O -12.359 1.800 6.949 1.00 . A A . 44 GLN OE1 1 1 17 15862 1 1 45 GLU C C -10.639 -3.657 1.757 1.00 . A A . 45 GLU C 1 1 17 15863 1 1 45 GLU CA C -11.599 -3.116 2.817 1.00 . A A . 45 GLU CA 1 1 17 15864 1 1 45 GLU CB C -13.019 -3.607 2.522 1.00 . A A . 45 GLU CB 1 1 17 15865 1 1 45 GLU CD C -13.433 -3.280 4.964 1.00 . A A . 45 GLU CD 1 1 17 15866 1 1 45 GLU CG C -13.985 -3.033 3.560 1.00 . A A . 45 GLU CG 1 1 17 15867 1 1 45 GLU H H -12.382 -1.128 2.552 1.00 . A A . 45 GLU H 1 1 17 15868 1 1 45 GLU HA H -11.292 -3.464 3.794 1.00 . A A . 45 GLU HA 1 1 17 15869 1 1 45 GLU HB2 H -13.313 -3.281 1.534 1.00 . A A . 45 GLU HB2 1 1 17 15870 1 1 45 GLU HB3 H -13.043 -4.685 2.569 1.00 . A A . 45 GLU HB3 1 1 17 15871 1 1 45 GLU HG2 H -14.097 -1.970 3.398 1.00 . A A . 45 GLU HG2 1 1 17 15872 1 1 45 GLU HG3 H -14.946 -3.515 3.463 1.00 . A A . 45 GLU HG3 1 1 17 15873 1 1 45 GLU N N -11.573 -1.626 2.789 1.00 . A A . 45 GLU N 1 1 17 15874 1 1 45 GLU O O -10.195 -4.788 1.822 1.00 . A A . 45 GLU O 1 1 17 15875 1 1 45 GLU OE1 O -13.594 -4.384 5.457 1.00 . A A . 45 GLU OE1 1 1 17 15876 1 1 45 GLU OE2 O -12.859 -2.361 5.524 1.00 . A A . 45 GLU OE2 1 1 17 15877 1 1 46 GLU C C -7.948 -3.005 0.253 1.00 . A A . 46 GLU C 1 1 17 15878 1 1 46 GLU CA C -9.342 -3.304 -0.254 1.00 . A A . 46 GLU CA 1 1 17 15879 1 1 46 GLU CB C -9.587 -2.530 -1.547 1.00 . A A . 46 GLU CB 1 1 17 15880 1 1 46 GLU CD C -11.251 -2.186 -3.377 1.00 . A A . 46 GLU CD 1 1 17 15881 1 1 46 GLU CG C -11.067 -2.613 -1.920 1.00 . A A . 46 GLU CG 1 1 17 15882 1 1 46 GLU H H -10.634 -1.927 0.776 1.00 . A A . 46 GLU H 1 1 17 15883 1 1 46 GLU HA H -9.458 -4.365 -0.426 1.00 . A A . 46 GLU HA 1 1 17 15884 1 1 46 GLU HB2 H -9.309 -1.496 -1.400 1.00 . A A . 46 GLU HB2 1 1 17 15885 1 1 46 GLU HB3 H -8.991 -2.953 -2.338 1.00 . A A . 46 GLU HB3 1 1 17 15886 1 1 46 GLU HG2 H -11.413 -3.629 -1.795 1.00 . A A . 46 GLU HG2 1 1 17 15887 1 1 46 GLU HG3 H -11.634 -1.955 -1.280 1.00 . A A . 46 GLU HG3 1 1 17 15888 1 1 46 GLU N N -10.292 -2.847 0.794 1.00 . A A . 46 GLU N 1 1 17 15889 1 1 46 GLU O O -7.055 -3.828 0.215 1.00 . A A . 46 GLU O 1 1 17 15890 1 1 46 GLU OE1 O -11.060 -3.020 -4.248 1.00 . A A . 46 GLU OE1 1 1 17 15891 1 1 46 GLU OE2 O -11.580 -1.033 -3.599 1.00 . A A . 46 GLU OE2 1 1 17 15892 1 1 47 VAL C C -6.186 -2.384 2.507 1.00 . A A . 47 VAL C 1 1 17 15893 1 1 47 VAL CA C -6.466 -1.448 1.326 1.00 . A A . 47 VAL CA 1 1 17 15894 1 1 47 VAL CB C -6.529 0.014 1.788 1.00 . A A . 47 VAL CB 1 1 17 15895 1 1 47 VAL CG1 C -5.557 0.245 2.942 1.00 . A A . 47 VAL CG1 1 1 17 15896 1 1 47 VAL CG2 C -6.156 0.931 0.619 1.00 . A A . 47 VAL CG2 1 1 17 15897 1 1 47 VAL H H -8.526 -1.207 0.802 1.00 . A A . 47 VAL H 1 1 17 15898 1 1 47 VAL HA H -5.698 -1.565 0.575 1.00 . A A . 47 VAL HA 1 1 17 15899 1 1 47 VAL HB H -7.533 0.243 2.116 1.00 . A A . 47 VAL HB 1 1 17 15900 1 1 47 VAL HG11 H -4.786 -0.509 2.912 1.00 . A A . 47 VAL HG11 1 1 17 15901 1 1 47 VAL HG12 H -5.114 1.223 2.846 1.00 . A A . 47 VAL HG12 1 1 17 15902 1 1 47 VAL HG13 H -6.092 0.179 3.877 1.00 . A A . 47 VAL HG13 1 1 17 15903 1 1 47 VAL HG21 H -6.113 0.353 -0.291 1.00 . A A . 47 VAL HG21 1 1 17 15904 1 1 47 VAL HG22 H -6.900 1.707 0.518 1.00 . A A . 47 VAL HG22 1 1 17 15905 1 1 47 VAL HG23 H -5.192 1.379 0.807 1.00 . A A . 47 VAL HG23 1 1 17 15906 1 1 47 VAL N N -7.778 -1.827 0.765 1.00 . A A . 47 VAL N 1 1 17 15907 1 1 47 VAL O O -5.053 -2.664 2.842 1.00 . A A . 47 VAL O 1 1 17 15908 1 1 48 GLU C C -6.567 -5.144 3.759 1.00 . A A . 48 GLU C 1 1 17 15909 1 1 48 GLU CA C -7.075 -3.794 4.264 1.00 . A A . 48 GLU CA 1 1 17 15910 1 1 48 GLU CB C -8.453 -3.962 4.876 1.00 . A A . 48 GLU CB 1 1 17 15911 1 1 48 GLU CD C -9.257 -4.350 7.206 1.00 . A A . 48 GLU CD 1 1 17 15912 1 1 48 GLU CG C -8.451 -3.419 6.298 1.00 . A A . 48 GLU CG 1 1 17 15913 1 1 48 GLU H H -8.129 -2.649 2.843 1.00 . A A . 48 GLU H 1 1 17 15914 1 1 48 GLU HA H -6.394 -3.383 4.992 1.00 . A A . 48 GLU HA 1 1 17 15915 1 1 48 GLU HB2 H -9.173 -3.415 4.286 1.00 . A A . 48 GLU HB2 1 1 17 15916 1 1 48 GLU HB3 H -8.715 -4.994 4.877 1.00 . A A . 48 GLU HB3 1 1 17 15917 1 1 48 GLU HG2 H -7.433 -3.353 6.651 1.00 . A A . 48 GLU HG2 1 1 17 15918 1 1 48 GLU HG3 H -8.897 -2.437 6.299 1.00 . A A . 48 GLU HG3 1 1 17 15919 1 1 48 GLU N N -7.227 -2.877 3.128 1.00 . A A . 48 GLU N 1 1 17 15920 1 1 48 GLU O O -5.464 -5.554 4.057 1.00 . A A . 48 GLU O 1 1 17 15921 1 1 48 GLU OE1 O -9.896 -5.248 6.683 1.00 . A A . 48 GLU OE1 1 1 17 15922 1 1 48 GLU OE2 O -9.221 -4.148 8.410 1.00 . A A . 48 GLU OE2 1 1 17 15923 1 1 49 GLU C C -5.505 -7.015 1.898 1.00 . A A . 49 GLU C 1 1 17 15924 1 1 49 GLU CA C -6.920 -7.156 2.463 1.00 . A A . 49 GLU CA 1 1 17 15925 1 1 49 GLU CB C -7.874 -7.621 1.361 1.00 . A A . 49 GLU CB 1 1 17 15926 1 1 49 GLU CD C -8.421 -10.054 1.253 1.00 . A A . 49 GLU CD 1 1 17 15927 1 1 49 GLU CG C -8.786 -8.720 1.906 1.00 . A A . 49 GLU CG 1 1 17 15928 1 1 49 GLU H H -8.252 -5.488 2.756 1.00 . A A . 49 GLU H 1 1 17 15929 1 1 49 GLU HA H -6.917 -7.880 3.266 1.00 . A A . 49 GLU HA 1 1 17 15930 1 1 49 GLU HB2 H -8.472 -6.785 1.026 1.00 . A A . 49 GLU HB2 1 1 17 15931 1 1 49 GLU HB3 H -7.302 -8.011 0.533 1.00 . A A . 49 GLU HB3 1 1 17 15932 1 1 49 GLU HG2 H -8.659 -8.794 2.977 1.00 . A A . 49 GLU HG2 1 1 17 15933 1 1 49 GLU HG3 H -9.814 -8.480 1.680 1.00 . A A . 49 GLU HG3 1 1 17 15934 1 1 49 GLU N N -7.366 -5.837 2.989 1.00 . A A . 49 GLU N 1 1 17 15935 1 1 49 GLU O O -4.623 -7.792 2.207 1.00 . A A . 49 GLU O 1 1 17 15936 1 1 49 GLU OE1 O -8.311 -10.086 0.038 1.00 . A A . 49 GLU OE1 1 1 17 15937 1 1 49 GLU OE2 O -8.256 -11.021 1.979 1.00 . A A . 49 GLU OE2 1 1 17 15938 1 1 50 ALA C C -2.919 -5.676 1.656 1.00 . A A . 50 ALA C 1 1 17 15939 1 1 50 ALA CA C -3.916 -5.829 0.508 1.00 . A A . 50 ALA CA 1 1 17 15940 1 1 50 ALA CB C -3.896 -4.561 -0.349 1.00 . A A . 50 ALA CB 1 1 17 15941 1 1 50 ALA H H -6.000 -5.401 0.848 1.00 . A A . 50 ALA H 1 1 17 15942 1 1 50 ALA HA H -3.651 -6.685 -0.100 1.00 . A A . 50 ALA HA 1 1 17 15943 1 1 50 ALA HB1 H -4.817 -4.491 -0.908 1.00 . A A . 50 ALA HB1 1 1 17 15944 1 1 50 ALA HB2 H -3.795 -3.696 0.289 1.00 . A A . 50 ALA HB2 1 1 17 15945 1 1 50 ALA HB3 H -3.062 -4.604 -1.035 1.00 . A A . 50 ALA HB3 1 1 17 15946 1 1 50 ALA N N -5.278 -6.023 1.079 1.00 . A A . 50 ALA N 1 1 17 15947 1 1 50 ALA O O -1.820 -6.193 1.617 1.00 . A A . 50 ALA O 1 1 17 15948 1 1 51 MET C C -2.225 -6.101 4.584 1.00 . A A . 51 MET C 1 1 17 15949 1 1 51 MET CA C -2.390 -4.771 3.846 1.00 . A A . 51 MET CA 1 1 17 15950 1 1 51 MET CB C -2.996 -3.726 4.788 1.00 . A A . 51 MET CB 1 1 17 15951 1 1 51 MET CE C -2.749 -1.097 6.079 1.00 . A A . 51 MET CE 1 1 17 15952 1 1 51 MET CG C -2.291 -3.780 6.145 1.00 . A A . 51 MET CG 1 1 17 15953 1 1 51 MET H H -4.195 -4.562 2.691 1.00 . A A . 51 MET H 1 1 17 15954 1 1 51 MET HA H -1.428 -4.429 3.496 1.00 . A A . 51 MET HA 1 1 17 15955 1 1 51 MET HB2 H -2.872 -2.742 4.359 1.00 . A A . 51 MET HB2 1 1 17 15956 1 1 51 MET HB3 H -4.047 -3.929 4.923 1.00 . A A . 51 MET HB3 1 1 17 15957 1 1 51 MET HE1 H -1.823 -1.214 5.535 1.00 . A A . 51 MET HE1 1 1 17 15958 1 1 51 MET HE2 H -3.572 -1.077 5.383 1.00 . A A . 51 MET HE2 1 1 17 15959 1 1 51 MET HE3 H -2.730 -0.172 6.639 1.00 . A A . 51 MET HE3 1 1 17 15960 1 1 51 MET HG2 H -2.458 -4.746 6.598 1.00 . A A . 51 MET HG2 1 1 17 15961 1 1 51 MET HG3 H -1.232 -3.626 6.008 1.00 . A A . 51 MET HG3 1 1 17 15962 1 1 51 MET N N -3.301 -4.966 2.683 1.00 . A A . 51 MET N 1 1 17 15963 1 1 51 MET O O -1.342 -6.263 5.403 1.00 . A A . 51 MET O 1 1 17 15964 1 1 51 MET SD S -2.956 -2.484 7.223 1.00 . A A . 51 MET SD 1 1 17 15965 1 1 52 ASP C C -2.247 -9.367 4.057 1.00 . A A . 52 ASP C 1 1 17 15966 1 1 52 ASP CA C -2.960 -8.375 4.978 1.00 . A A . 52 ASP CA 1 1 17 15967 1 1 52 ASP CB C -4.362 -8.897 5.300 1.00 . A A . 52 ASP CB 1 1 17 15968 1 1 52 ASP CG C -4.256 -10.151 6.171 1.00 . A A . 52 ASP CG 1 1 17 15969 1 1 52 ASP H H -3.771 -6.903 3.632 1.00 . A A . 52 ASP H 1 1 17 15970 1 1 52 ASP HA H -2.399 -8.264 5.893 1.00 . A A . 52 ASP HA 1 1 17 15971 1 1 52 ASP HB2 H -4.917 -8.136 5.830 1.00 . A A . 52 ASP HB2 1 1 17 15972 1 1 52 ASP HB3 H -4.875 -9.141 4.382 1.00 . A A . 52 ASP HB3 1 1 17 15973 1 1 52 ASP N N -3.068 -7.055 4.297 1.00 . A A . 52 ASP N 1 1 17 15974 1 1 52 ASP O O -1.982 -10.493 4.429 1.00 . A A . 52 ASP O 1 1 17 15975 1 1 52 ASP OD1 O -3.617 -10.077 7.207 1.00 . A A . 52 ASP OD1 1 1 17 15976 1 1 52 ASP OD2 O -4.814 -11.165 5.784 1.00 . A A . 52 ASP OD2 1 1 17 15977 1 1 53 THR C C 0.174 -9.368 1.631 1.00 . A A . 53 THR C 1 1 17 15978 1 1 53 THR CA C -1.240 -9.884 1.915 1.00 . A A . 53 THR CA 1 1 17 15979 1 1 53 THR CB C -2.029 -9.965 0.605 1.00 . A A . 53 THR CB 1 1 17 15980 1 1 53 THR CG2 C -1.664 -11.254 -0.133 1.00 . A A . 53 THR CG2 1 1 17 15981 1 1 53 THR H H -2.157 -8.050 2.571 1.00 . A A . 53 THR H 1 1 17 15982 1 1 53 THR HA H -1.179 -10.867 2.359 1.00 . A A . 53 THR HA 1 1 17 15983 1 1 53 THR HB H -1.784 -9.118 -0.016 1.00 . A A . 53 THR HB 1 1 17 15984 1 1 53 THR HG1 H -3.891 -10.182 0.086 1.00 . A A . 53 THR HG1 1 1 17 15985 1 1 53 THR HG21 H -1.216 -11.952 0.559 1.00 . A A . 53 THR HG21 1 1 17 15986 1 1 53 THR HG22 H -2.557 -11.691 -0.557 1.00 . A A . 53 THR HG22 1 1 17 15987 1 1 53 THR HG23 H -0.963 -11.030 -0.924 1.00 . A A . 53 THR HG23 1 1 17 15988 1 1 53 THR N N -1.934 -8.961 2.855 1.00 . A A . 53 THR N 1 1 17 15989 1 1 53 THR O O 0.615 -9.329 0.499 1.00 . A A . 53 THR O 1 1 17 15990 1 1 53 THR OG1 O -3.419 -9.958 0.893 1.00 . A A . 53 THR OG1 1 1 17 15991 1 1 54 CYS C C 3.250 -9.308 3.272 1.00 . A A . 54 CYS C 1 1 17 15992 1 1 54 CYS CA C 2.278 -8.471 2.438 1.00 . A A . 54 CYS CA 1 1 17 15993 1 1 54 CYS CB C 2.363 -6.999 2.867 1.00 . A A . 54 CYS CB 1 1 17 15994 1 1 54 CYS H H 0.520 -9.021 3.555 1.00 . A A . 54 CYS H 1 1 17 15995 1 1 54 CYS HA H 2.535 -8.557 1.392 1.00 . A A . 54 CYS HA 1 1 17 15996 1 1 54 CYS HB2 H 1.667 -6.411 2.287 1.00 . A A . 54 CYS HB2 1 1 17 15997 1 1 54 CYS HB3 H 2.116 -6.918 3.915 1.00 . A A . 54 CYS HB3 1 1 17 15998 1 1 54 CYS N N 0.890 -8.977 2.650 1.00 . A A . 54 CYS N 1 1 17 15999 1 1 54 CYS O O 2.933 -9.709 4.374 1.00 . A A . 54 CYS O 1 1 17 16000 1 1 54 CYS SG S 4.014 -6.235 2.653 1.00 . A A . 54 CYS SG 1 1 17 16001 1 1 55 PRO C C 6.022 -9.548 4.589 1.00 . A A . 55 PRO C 1 1 17 16002 1 1 55 PRO CA C 5.440 -10.350 3.422 1.00 . A A . 55 PRO CA 1 1 17 16003 1 1 55 PRO CB C 6.497 -10.605 2.348 1.00 . A A . 55 PRO CB 1 1 17 16004 1 1 55 PRO CD C 4.863 -9.093 1.396 1.00 . A A . 55 PRO CD 1 1 17 16005 1 1 55 PRO CG C 6.324 -9.484 1.369 1.00 . A A . 55 PRO CG 1 1 17 16006 1 1 55 PRO HA H 5.027 -11.284 3.766 1.00 . A A . 55 PRO HA 1 1 17 16007 1 1 55 PRO HB2 H 7.478 -10.602 2.806 1.00 . A A . 55 PRO HB2 1 1 17 16008 1 1 55 PRO HB3 H 6.319 -11.562 1.888 1.00 . A A . 55 PRO HB3 1 1 17 16009 1 1 55 PRO HD2 H 4.758 -8.021 1.296 1.00 . A A . 55 PRO HD2 1 1 17 16010 1 1 55 PRO HD3 H 4.320 -9.603 0.616 1.00 . A A . 55 PRO HD3 1 1 17 16011 1 1 55 PRO HG2 H 6.940 -8.645 1.662 1.00 . A A . 55 PRO HG2 1 1 17 16012 1 1 55 PRO HG3 H 6.595 -9.817 0.379 1.00 . A A . 55 PRO HG3 1 1 17 16013 1 1 55 PRO N N 4.407 -9.545 2.715 1.00 . A A . 55 PRO N 1 1 17 16014 1 1 55 PRO O O 6.340 -10.088 5.630 1.00 . A A . 55 PRO O 1 1 17 16015 1 1 56 VAL C C 5.704 -6.303 5.841 1.00 . A A . 56 VAL C 1 1 17 16016 1 1 56 VAL CA C 6.701 -7.419 5.519 1.00 . A A . 56 VAL CA 1 1 17 16017 1 1 56 VAL CB C 8.031 -6.805 5.074 1.00 . A A . 56 VAL CB 1 1 17 16018 1 1 56 VAL CG1 C 8.646 -6.019 6.234 1.00 . A A . 56 VAL CG1 1 1 17 16019 1 1 56 VAL CG2 C 8.989 -7.921 4.650 1.00 . A A . 56 VAL CG2 1 1 17 16020 1 1 56 VAL H H 5.883 -7.849 3.576 1.00 . A A . 56 VAL H 1 1 17 16021 1 1 56 VAL HA H 6.860 -8.026 6.398 1.00 . A A . 56 VAL HA 1 1 17 16022 1 1 56 VAL HB H 7.858 -6.139 4.241 1.00 . A A . 56 VAL HB 1 1 17 16023 1 1 56 VAL HG11 H 8.657 -6.636 7.121 1.00 . A A . 56 VAL HG11 1 1 17 16024 1 1 56 VAL HG12 H 9.656 -5.736 5.980 1.00 . A A . 56 VAL HG12 1 1 17 16025 1 1 56 VAL HG13 H 8.059 -5.132 6.419 1.00 . A A . 56 VAL HG13 1 1 17 16026 1 1 56 VAL HG21 H 8.436 -8.838 4.515 1.00 . A A . 56 VAL HG21 1 1 17 16027 1 1 56 VAL HG22 H 9.468 -7.649 3.721 1.00 . A A . 56 VAL HG22 1 1 17 16028 1 1 56 VAL HG23 H 9.739 -8.060 5.414 1.00 . A A . 56 VAL HG23 1 1 17 16029 1 1 56 VAL N N 6.153 -8.263 4.423 1.00 . A A . 56 VAL N 1 1 17 16030 1 1 56 VAL O O 5.924 -5.494 6.720 1.00 . A A . 56 VAL O 1 1 17 16031 1 1 57 GLN C C 4.218 -3.821 5.160 1.00 . A A . 57 GLN C 1 1 17 16032 1 1 57 GLN CA C 3.591 -5.195 5.396 1.00 . A A . 57 GLN CA 1 1 17 16033 1 1 57 GLN CB C 3.104 -5.301 6.843 1.00 . A A . 57 GLN CB 1 1 17 16034 1 1 57 GLN CD C 2.088 -7.079 8.278 1.00 . A A . 57 GLN CD 1 1 17 16035 1 1 57 GLN CG C 2.000 -6.357 6.932 1.00 . A A . 57 GLN CG 1 1 17 16036 1 1 57 GLN H H 4.447 -6.916 4.430 1.00 . A A . 57 GLN H 1 1 17 16037 1 1 57 GLN HA H 2.755 -5.327 4.726 1.00 . A A . 57 GLN HA 1 1 17 16038 1 1 57 GLN HB2 H 3.929 -5.586 7.480 1.00 . A A . 57 GLN HB2 1 1 17 16039 1 1 57 GLN HB3 H 2.714 -4.347 7.162 1.00 . A A . 57 GLN HB3 1 1 17 16040 1 1 57 GLN HE21 H 1.042 -5.698 9.248 1.00 . A A . 57 GLN HE21 1 1 17 16041 1 1 57 GLN HE22 H 1.570 -7.005 10.193 1.00 . A A . 57 GLN HE22 1 1 17 16042 1 1 57 GLN HG2 H 1.036 -5.878 6.841 1.00 . A A . 57 GLN HG2 1 1 17 16043 1 1 57 GLN HG3 H 2.122 -7.073 6.133 1.00 . A A . 57 GLN HG3 1 1 17 16044 1 1 57 GLN N N 4.605 -6.255 5.134 1.00 . A A . 57 GLN N 1 1 17 16045 1 1 57 GLN NE2 N 1.520 -6.550 9.326 1.00 . A A . 57 GLN NE2 1 1 17 16046 1 1 57 GLN O O 4.035 -3.217 4.122 1.00 . A A . 57 GLN O 1 1 17 16047 1 1 57 GLN OE1 O 2.681 -8.136 8.376 1.00 . A A . 57 GLN OE1 1 1 17 16048 1 1 58 CYS C C 4.500 -0.962 5.594 1.00 . A A . 58 CYS C 1 1 17 16049 1 1 58 CYS CA C 5.590 -1.981 5.925 1.00 . A A . 58 CYS CA 1 1 17 16050 1 1 58 CYS CB C 6.601 -2.025 4.768 1.00 . A A . 58 CYS CB 1 1 17 16051 1 1 58 CYS H H 5.097 -3.817 6.943 1.00 . A A . 58 CYS H 1 1 17 16052 1 1 58 CYS HA H 6.096 -1.691 6.835 1.00 . A A . 58 CYS HA 1 1 17 16053 1 1 58 CYS HB2 H 6.124 -1.681 3.863 1.00 . A A . 58 CYS HB2 1 1 17 16054 1 1 58 CYS HB3 H 7.435 -1.378 4.999 1.00 . A A . 58 CYS HB3 1 1 17 16055 1 1 58 CYS HG H 7.289 -3.864 3.574 1.00 . A A . 58 CYS HG 1 1 17 16056 1 1 58 CYS N N 4.958 -3.318 6.111 1.00 . A A . 58 CYS N 1 1 17 16057 1 1 58 CYS O O 4.754 0.061 4.989 1.00 . A A . 58 CYS O 1 1 17 16058 1 1 58 CYS SG S 7.204 -3.717 4.520 1.00 . A A . 58 CYS SG 1 1 17 16059 1 1 59 ILE C C 1.453 0.110 6.957 1.00 . A A . 59 ILE C 1 1 17 16060 1 1 59 ILE CA C 2.172 -0.292 5.667 1.00 . A A . 59 ILE CA 1 1 17 16061 1 1 59 ILE CB C 1.180 -0.971 4.719 1.00 . A A . 59 ILE CB 1 1 17 16062 1 1 59 ILE CD1 C -0.823 -0.612 3.269 1.00 . A A . 59 ILE CD1 1 1 17 16063 1 1 59 ILE CG1 C 0.224 0.076 4.145 1.00 . A A . 59 ILE CG1 1 1 17 16064 1 1 59 ILE CG2 C 0.377 -2.023 5.486 1.00 . A A . 59 ILE CG2 1 1 17 16065 1 1 59 ILE H H 3.096 -2.073 6.453 1.00 . A A . 59 ILE H 1 1 17 16066 1 1 59 ILE HA H 2.574 0.591 5.194 1.00 . A A . 59 ILE HA 1 1 17 16067 1 1 59 ILE HB H 1.720 -1.450 3.913 1.00 . A A . 59 ILE HB 1 1 17 16068 1 1 59 ILE HD11 H -0.646 -1.678 3.267 1.00 . A A . 59 ILE HD11 1 1 17 16069 1 1 59 ILE HD12 H -1.809 -0.412 3.663 1.00 . A A . 59 ILE HD12 1 1 17 16070 1 1 59 ILE HD13 H -0.755 -0.234 2.260 1.00 . A A . 59 ILE HD13 1 1 17 16071 1 1 59 ILE HG12 H -0.268 0.597 4.954 1.00 . A A . 59 ILE HG12 1 1 17 16072 1 1 59 ILE HG13 H 0.781 0.782 3.547 1.00 . A A . 59 ILE HG13 1 1 17 16073 1 1 59 ILE HG21 H -0.130 -1.555 6.316 1.00 . A A . 59 ILE HG21 1 1 17 16074 1 1 59 ILE HG22 H -0.350 -2.473 4.826 1.00 . A A . 59 ILE HG22 1 1 17 16075 1 1 59 ILE HG23 H 1.046 -2.785 5.858 1.00 . A A . 59 ILE HG23 1 1 17 16076 1 1 59 ILE N N 3.281 -1.239 5.974 1.00 . A A . 59 ILE N 1 1 17 16077 1 1 59 ILE O O 1.451 -0.614 7.933 1.00 . A A . 59 ILE O 1 1 17 16078 1 1 60 HIS C C -0.942 2.753 7.779 1.00 . A A . 60 HIS C 1 1 17 16079 1 1 60 HIS CA C 0.113 1.721 8.180 1.00 . A A . 60 HIS CA 1 1 17 16080 1 1 60 HIS CB C 1.103 2.357 9.160 1.00 . A A . 60 HIS CB 1 1 17 16081 1 1 60 HIS CD2 C 2.788 0.515 9.979 1.00 . A A . 60 HIS CD2 1 1 17 16082 1 1 60 HIS CE1 C 4.401 0.922 8.592 1.00 . A A . 60 HIS CE1 1 1 17 16083 1 1 60 HIS CG C 2.376 1.556 9.185 1.00 . A A . 60 HIS CG 1 1 17 16084 1 1 60 HIS H H 0.853 1.827 6.162 1.00 . A A . 60 HIS H 1 1 17 16085 1 1 60 HIS HA H -0.370 0.877 8.652 1.00 . A A . 60 HIS HA 1 1 17 16086 1 1 60 HIS HB2 H 1.320 3.368 8.846 1.00 . A A . 60 HIS HB2 1 1 17 16087 1 1 60 HIS HB3 H 0.669 2.374 10.149 1.00 . A A . 60 HIS HB3 1 1 17 16088 1 1 60 HIS HD1 H 3.441 2.484 7.608 1.00 . A A . 60 HIS HD1 1 1 17 16089 1 1 60 HIS HD2 H 2.207 0.073 10.775 1.00 . A A . 60 HIS HD2 1 1 17 16090 1 1 60 HIS HE1 H 5.344 0.877 8.067 1.00 . A A . 60 HIS HE1 1 1 17 16091 1 1 60 HIS N N 0.839 1.263 6.963 1.00 . A A . 60 HIS N 1 1 17 16092 1 1 60 HIS ND1 N 3.421 1.799 8.308 1.00 . A A . 60 HIS ND1 1 1 17 16093 1 1 60 HIS NE2 N 4.067 0.116 9.603 1.00 . A A . 60 HIS NE2 1 1 17 16094 1 1 60 HIS O O -0.842 3.384 6.745 1.00 . A A . 60 HIS O 1 1 17 16095 1 1 61 TRP C C -2.544 5.327 8.673 1.00 . A A . 61 TRP C 1 1 17 16096 1 1 61 TRP CA C -3.004 3.935 8.242 1.00 . A A . 61 TRP CA 1 1 17 16097 1 1 61 TRP CB C -4.306 3.581 8.961 1.00 . A A . 61 TRP CB 1 1 17 16098 1 1 61 TRP CD1 C -4.107 1.059 9.064 1.00 . A A . 61 TRP CD1 1 1 17 16099 1 1 61 TRP CD2 C -5.781 1.757 7.741 1.00 . A A . 61 TRP CD2 1 1 17 16100 1 1 61 TRP CE2 C -5.797 0.345 7.695 1.00 . A A . 61 TRP CE2 1 1 17 16101 1 1 61 TRP CE3 C -6.734 2.459 6.995 1.00 . A A . 61 TRP CE3 1 1 17 16102 1 1 61 TRP CG C -4.704 2.185 8.612 1.00 . A A . 61 TRP CG 1 1 17 16103 1 1 61 TRP CH2 C -7.681 0.366 6.188 1.00 . A A . 61 TRP CH2 1 1 17 16104 1 1 61 TRP CZ2 C -6.734 -0.349 6.930 1.00 . A A . 61 TRP CZ2 1 1 17 16105 1 1 61 TRP CZ3 C -7.681 1.769 6.222 1.00 . A A . 61 TRP CZ3 1 1 17 16106 1 1 61 TRP H H -2.015 2.421 9.417 1.00 . A A . 61 TRP H 1 1 17 16107 1 1 61 TRP HA H -3.172 3.929 7.174 1.00 . A A . 61 TRP HA 1 1 17 16108 1 1 61 TRP HB2 H -4.168 3.658 10.024 1.00 . A A . 61 TRP HB2 1 1 17 16109 1 1 61 TRP HB3 H -5.083 4.262 8.650 1.00 . A A . 61 TRP HB3 1 1 17 16110 1 1 61 TRP HD1 H -3.263 1.020 9.738 1.00 . A A . 61 TRP HD1 1 1 17 16111 1 1 61 TRP HE1 H -4.521 -0.974 8.686 1.00 . A A . 61 TRP HE1 1 1 17 16112 1 1 61 TRP HE3 H -6.738 3.539 7.020 1.00 . A A . 61 TRP HE3 1 1 17 16113 1 1 61 TRP HH2 H -8.411 -0.160 5.591 1.00 . A A . 61 TRP HH2 1 1 17 16114 1 1 61 TRP HZ2 H -6.728 -1.429 6.907 1.00 . A A . 61 TRP HZ2 1 1 17 16115 1 1 61 TRP HZ3 H -8.412 2.320 5.650 1.00 . A A . 61 TRP HZ3 1 1 17 16116 1 1 61 TRP N N -1.951 2.937 8.586 1.00 . A A . 61 TRP N 1 1 17 16117 1 1 61 TRP NE1 N -4.756 -0.037 8.519 1.00 . A A . 61 TRP NE1 1 1 17 16118 1 1 61 TRP O O -1.470 5.497 9.214 1.00 . A A . 61 TRP O 1 1 17 16119 1 1 62 GLU C C -4.212 8.514 9.165 1.00 . A A . 62 GLU C 1 1 17 16120 1 1 62 GLU CA C -2.957 7.707 8.827 1.00 . A A . 62 GLU CA 1 1 17 16121 1 1 62 GLU CB C -2.213 8.365 7.660 1.00 . A A . 62 GLU CB 1 1 17 16122 1 1 62 GLU CD C -0.649 10.304 7.822 1.00 . A A . 62 GLU CD 1 1 17 16123 1 1 62 GLU CG C -2.115 9.873 7.893 1.00 . A A . 62 GLU CG 1 1 17 16124 1 1 62 GLU H H -4.209 6.166 7.996 1.00 . A A . 62 GLU H 1 1 17 16125 1 1 62 GLU HA H -2.309 7.668 9.691 1.00 . A A . 62 GLU HA 1 1 17 16126 1 1 62 GLU HB2 H -1.219 7.946 7.589 1.00 . A A . 62 GLU HB2 1 1 17 16127 1 1 62 GLU HB3 H -2.749 8.178 6.741 1.00 . A A . 62 GLU HB3 1 1 17 16128 1 1 62 GLU HG2 H -2.682 10.393 7.133 1.00 . A A . 62 GLU HG2 1 1 17 16129 1 1 62 GLU HG3 H -2.512 10.115 8.867 1.00 . A A . 62 GLU HG3 1 1 17 16130 1 1 62 GLU N N -3.348 6.325 8.436 1.00 . A A . 62 GLU N 1 1 17 16131 1 1 62 GLU O O -4.984 8.874 8.299 1.00 . A A . 62 GLU O 1 1 17 16132 1 1 62 GLU OE1 O 0.060 9.788 6.972 1.00 . A A . 62 GLU OE1 1 1 17 16133 1 1 62 GLU OE2 O -0.259 11.142 8.617 1.00 . A A . 62 GLU OE2 1 1 17 16134 1 1 63 ASP C C -5.223 11.016 11.155 1.00 . A A . 63 ASP C 1 1 17 16135 1 1 63 ASP CA C -5.631 9.580 10.816 1.00 . A A . 63 ASP CA 1 1 17 16136 1 1 63 ASP CB C -6.277 8.932 12.042 1.00 . A A . 63 ASP CB 1 1 17 16137 1 1 63 ASP CG C -7.751 9.335 12.119 1.00 . A A . 63 ASP CG 1 1 17 16138 1 1 63 ASP H H -3.791 8.498 11.105 1.00 . A A . 63 ASP H 1 1 17 16139 1 1 63 ASP HA H -6.337 9.589 9.998 1.00 . A A . 63 ASP HA 1 1 17 16140 1 1 63 ASP HB2 H -6.201 7.857 11.963 1.00 . A A . 63 ASP HB2 1 1 17 16141 1 1 63 ASP HB3 H -5.768 9.264 12.935 1.00 . A A . 63 ASP HB3 1 1 17 16142 1 1 63 ASP N N -4.425 8.799 10.422 1.00 . A A . 63 ASP N 1 1 17 16143 1 1 63 ASP O O -5.720 11.963 10.580 1.00 . A A . 63 ASP O 1 1 17 16144 1 1 63 ASP OD1 O -8.189 10.072 11.251 1.00 . A A . 63 ASP OD1 1 1 17 16145 1 1 63 ASP OD2 O -8.416 8.901 13.045 1.00 . A A . 63 ASP OD2 1 1 17 16146 1 1 64 GLU C C -2.586 12.898 11.735 1.00 . A A . 64 GLU C 1 1 17 16147 1 1 64 GLU CA C -3.889 12.559 12.460 1.00 . A A . 64 GLU CA 1 1 17 16148 1 1 64 GLU CB C -3.666 12.628 13.972 1.00 . A A . 64 GLU CB 1 1 17 16149 1 1 64 GLU CD C -3.228 14.672 15.340 1.00 . A A . 64 GLU CD 1 1 17 16150 1 1 64 GLU CG C -4.277 13.918 14.522 1.00 . A A . 64 GLU CG 1 1 17 16151 1 1 64 GLU H H -3.935 10.406 12.538 1.00 . A A . 64 GLU H 1 1 17 16152 1 1 64 GLU HA H -4.653 13.267 12.175 1.00 . A A . 64 GLU HA 1 1 17 16153 1 1 64 GLU HB2 H -4.138 11.777 14.443 1.00 . A A . 64 GLU HB2 1 1 17 16154 1 1 64 GLU HB3 H -2.608 12.615 14.181 1.00 . A A . 64 GLU HB3 1 1 17 16155 1 1 64 GLU HG2 H -4.608 14.538 13.700 1.00 . A A . 64 GLU HG2 1 1 17 16156 1 1 64 GLU HG3 H -5.118 13.677 15.154 1.00 . A A . 64 GLU HG3 1 1 17 16157 1 1 64 GLU N N -4.324 11.183 12.085 1.00 . A A . 64 GLU N 1 1 17 16158 1 1 64 GLU OE1 O -2.462 15.413 14.747 1.00 . A A . 64 GLU OE1 1 1 17 16159 1 1 64 GLU OE2 O -3.207 14.494 16.546 1.00 . A A . 64 GLU OE2 1 1 17 16160 2 2 1 SF4 FE1 FE 5.701 -4.641 -1.629 1.00 . B A . 65 SF4 FE1 1 1 17 16161 2 2 1 SF4 FE2 FE 4.132 -5.774 0.529 1.00 . B A . 65 SF4 FE2 1 1 17 16162 2 2 1 SF4 FE3 FE 3.097 -4.509 -1.774 1.00 . B A . 65 SF4 FE3 1 1 17 16163 2 2 1 SF4 FE4 FE 4.532 -7.112 -2.003 1.00 . B A . 65 SF4 FE4 1 1 17 16164 2 2 1 SF4 S1 S 2.451 -6.615 -0.646 1.00 . B A . 65 SF4 S1 1 1 17 16165 2 2 1 SF4 S2 S 4.625 -5.007 -3.287 1.00 . B A . 65 SF4 S2 1 1 17 16166 2 2 1 SF4 S3 S 6.118 -6.778 -0.490 1.00 . B A . 65 SF4 S3 1 1 17 16167 2 2 1 SF4 S4 S 4.379 -3.432 -0.334 1.00 . B A . 65 SF4 S4 1 1 18 16168 1 1 1 ALA C C -8.459 9.681 10.743 1.00 . A A . 1 ALA C 1 1 18 16169 1 1 1 ALA CA C -8.849 11.152 10.901 1.00 . A A . 1 ALA CA 1 1 18 16170 1 1 1 ALA CB C -10.364 11.260 11.087 1.00 . A A . 1 ALA CB 1 1 18 16171 1 1 1 ALA HA H -8.349 11.566 11.763 1.00 . A A . 1 ALA HA 1 1 18 16172 1 1 1 ALA HB1 H -10.726 12.139 10.575 1.00 . A A . 1 ALA HB1 1 1 18 16173 1 1 1 ALA HB2 H -10.840 10.382 10.677 1.00 . A A . 1 ALA HB2 1 1 18 16174 1 1 1 ALA HB3 H -10.593 11.337 12.139 1.00 . A A . 1 ALA HB3 1 1 18 16175 1 1 1 ALA N N -8.443 11.905 9.682 1.00 . A A . 1 ALA N 1 1 18 16176 1 1 1 ALA O O -8.150 9.005 11.704 1.00 . A A . 1 ALA O 1 1 18 16177 1 1 2 ARG C C -7.301 7.622 8.023 1.00 . A A . 2 ARG C 1 1 18 16178 1 1 2 ARG CA C -8.099 7.755 9.322 1.00 . A A . 2 ARG CA 1 1 18 16179 1 1 2 ARG CB C -9.364 6.894 9.233 1.00 . A A . 2 ARG CB 1 1 18 16180 1 1 2 ARG CD C -10.632 6.901 7.081 1.00 . A A . 2 ARG CD 1 1 18 16181 1 1 2 ARG CG C -10.434 7.621 8.415 1.00 . A A . 2 ARG CG 1 1 18 16182 1 1 2 ARG CZ C -12.514 5.379 7.034 1.00 . A A . 2 ARG CZ 1 1 18 16183 1 1 2 ARG H H -8.723 9.744 8.775 1.00 . A A . 2 ARG H 1 1 18 16184 1 1 2 ARG HA H -7.494 7.415 10.149 1.00 . A A . 2 ARG HA 1 1 18 16185 1 1 2 ARG HB2 H -9.123 5.955 8.753 1.00 . A A . 2 ARG HB2 1 1 18 16186 1 1 2 ARG HB3 H -9.740 6.702 10.225 1.00 . A A . 2 ARG HB3 1 1 18 16187 1 1 2 ARG HD2 H -10.288 7.534 6.276 1.00 . A A . 2 ARG HD2 1 1 18 16188 1 1 2 ARG HD3 H -10.070 5.980 7.081 1.00 . A A . 2 ARG HD3 1 1 18 16189 1 1 2 ARG HE H -12.703 7.319 6.660 1.00 . A A . 2 ARG HE 1 1 18 16190 1 1 2 ARG HG2 H -11.365 7.624 8.965 1.00 . A A . 2 ARG HG2 1 1 18 16191 1 1 2 ARG HG3 H -10.123 8.637 8.230 1.00 . A A . 2 ARG HG3 1 1 18 16192 1 1 2 ARG HH11 H -11.882 5.214 8.927 1.00 . A A . 2 ARG HH11 1 1 18 16193 1 1 2 ARG HH12 H -12.678 3.819 8.278 1.00 . A A . 2 ARG HH12 1 1 18 16194 1 1 2 ARG HH21 H -13.244 5.260 5.175 1.00 . A A . 2 ARG HH21 1 1 18 16195 1 1 2 ARG HH22 H -13.451 3.846 6.154 1.00 . A A . 2 ARG HH22 1 1 18 16196 1 1 2 ARG N N -8.471 9.180 9.538 1.00 . A A . 2 ARG N 1 1 18 16197 1 1 2 ARG NE N -12.079 6.600 6.892 1.00 . A A . 2 ARG NE 1 1 18 16198 1 1 2 ARG NH1 N -12.345 4.756 8.168 1.00 . A A . 2 ARG NH1 1 1 18 16199 1 1 2 ARG NH2 N -13.117 4.782 6.044 1.00 . A A . 2 ARG NH2 1 1 18 16200 1 1 2 ARG O O -7.807 7.173 7.014 1.00 . A A . 2 ARG O 1 1 18 16201 1 1 3 LYS C C -4.385 6.615 6.887 1.00 . A A . 3 LYS C 1 1 18 16202 1 1 3 LYS CA C -5.219 7.896 6.813 1.00 . A A . 3 LYS CA 1 1 18 16203 1 1 3 LYS CB C -4.292 9.110 6.715 1.00 . A A . 3 LYS CB 1 1 18 16204 1 1 3 LYS CD C -2.903 10.034 4.855 1.00 . A A . 3 LYS CD 1 1 18 16205 1 1 3 LYS CE C -2.952 10.775 3.518 1.00 . A A . 3 LYS CE 1 1 18 16206 1 1 3 LYS CG C -4.323 9.665 5.289 1.00 . A A . 3 LYS CG 1 1 18 16207 1 1 3 LYS H H -5.663 8.360 8.871 1.00 . A A . 3 LYS H 1 1 18 16208 1 1 3 LYS HA H -5.860 7.858 5.945 1.00 . A A . 3 LYS HA 1 1 18 16209 1 1 3 LYS HB2 H -4.624 9.873 7.405 1.00 . A A . 3 LYS HB2 1 1 18 16210 1 1 3 LYS HB3 H -3.283 8.814 6.962 1.00 . A A . 3 LYS HB3 1 1 18 16211 1 1 3 LYS HD2 H -2.453 10.669 5.604 1.00 . A A . 3 LYS HD2 1 1 18 16212 1 1 3 LYS HD3 H -2.315 9.135 4.745 1.00 . A A . 3 LYS HD3 1 1 18 16213 1 1 3 LYS HE2 H -2.964 10.059 2.709 1.00 . A A . 3 LYS HE2 1 1 18 16214 1 1 3 LYS HE3 H -3.844 11.382 3.475 1.00 . A A . 3 LYS HE3 1 1 18 16215 1 1 3 LYS HG2 H -4.721 8.916 4.620 1.00 . A A . 3 LYS HG2 1 1 18 16216 1 1 3 LYS HG3 H -4.948 10.545 5.257 1.00 . A A . 3 LYS HG3 1 1 18 16217 1 1 3 LYS HZ1 H -0.995 11.288 4.007 1.00 . A A . 3 LYS HZ1 1 1 18 16218 1 1 3 LYS HZ2 H -1.424 11.646 2.404 1.00 . A A . 3 LYS HZ2 1 1 18 16219 1 1 3 LYS HZ3 H -1.994 12.617 3.674 1.00 . A A . 3 LYS HZ3 1 1 18 16220 1 1 3 LYS N N -6.053 8.006 8.043 1.00 . A A . 3 LYS N 1 1 18 16221 1 1 3 LYS NZ N -1.751 11.648 3.391 1.00 . A A . 3 LYS NZ 1 1 18 16222 1 1 3 LYS O O -4.677 5.721 7.655 1.00 . A A . 3 LYS O 1 1 18 16223 1 1 4 PHE C C -1.552 5.323 4.919 1.00 . A A . 4 PHE C 1 1 18 16224 1 1 4 PHE CA C -2.489 5.305 6.126 1.00 . A A . 4 PHE CA 1 1 18 16225 1 1 4 PHE CB C -3.364 4.050 6.071 1.00 . A A . 4 PHE CB 1 1 18 16226 1 1 4 PHE CD1 C -3.978 4.090 3.627 1.00 . A A . 4 PHE CD1 1 1 18 16227 1 1 4 PHE CD2 C -5.728 4.417 5.274 1.00 . A A . 4 PHE CD2 1 1 18 16228 1 1 4 PHE CE1 C -4.920 4.217 2.600 1.00 . A A . 4 PHE CE1 1 1 18 16229 1 1 4 PHE CE2 C -6.671 4.544 4.245 1.00 . A A . 4 PHE CE2 1 1 18 16230 1 1 4 PHE CG C -4.381 4.190 4.965 1.00 . A A . 4 PHE CG 1 1 18 16231 1 1 4 PHE CZ C -6.267 4.445 2.909 1.00 . A A . 4 PHE CZ 1 1 18 16232 1 1 4 PHE H H -3.126 7.253 5.500 1.00 . A A . 4 PHE H 1 1 18 16233 1 1 4 PHE HA H -1.902 5.302 7.028 1.00 . A A . 4 PHE HA 1 1 18 16234 1 1 4 PHE HB2 H -2.741 3.187 5.879 1.00 . A A . 4 PHE HB2 1 1 18 16235 1 1 4 PHE HB3 H -3.872 3.920 7.014 1.00 . A A . 4 PHE HB3 1 1 18 16236 1 1 4 PHE HD1 H -2.939 3.914 3.389 1.00 . A A . 4 PHE HD1 1 1 18 16237 1 1 4 PHE HD2 H -6.040 4.494 6.306 1.00 . A A . 4 PHE HD2 1 1 18 16238 1 1 4 PHE HE1 H -4.608 4.141 1.570 1.00 . A A . 4 PHE HE1 1 1 18 16239 1 1 4 PHE HE2 H -7.710 4.720 4.484 1.00 . A A . 4 PHE HE2 1 1 18 16240 1 1 4 PHE HZ H -6.994 4.542 2.116 1.00 . A A . 4 PHE HZ 1 1 18 16241 1 1 4 PHE N N -3.346 6.522 6.102 1.00 . A A . 4 PHE N 1 1 18 16242 1 1 4 PHE O O -1.581 6.232 4.113 1.00 . A A . 4 PHE O 1 1 18 16243 1 1 5 TYR C C 1.134 3.080 3.777 1.00 . A A . 5 TYR C 1 1 18 16244 1 1 5 TYR CA C 0.218 4.288 3.638 1.00 . A A . 5 TYR CA 1 1 18 16245 1 1 5 TYR CB C 1.071 5.555 3.623 1.00 . A A . 5 TYR CB 1 1 18 16246 1 1 5 TYR CD1 C 1.387 6.185 6.046 1.00 . A A . 5 TYR CD1 1 1 18 16247 1 1 5 TYR CD2 C 3.203 5.080 4.879 1.00 . A A . 5 TYR CD2 1 1 18 16248 1 1 5 TYR CE1 C 2.163 6.231 7.210 1.00 . A A . 5 TYR CE1 1 1 18 16249 1 1 5 TYR CE2 C 3.979 5.126 6.043 1.00 . A A . 5 TYR CE2 1 1 18 16250 1 1 5 TYR CG C 1.907 5.609 4.879 1.00 . A A . 5 TYR CG 1 1 18 16251 1 1 5 TYR CZ C 3.458 5.701 7.209 1.00 . A A . 5 TYR CZ 1 1 18 16252 1 1 5 TYR H H -0.712 3.602 5.450 1.00 . A A . 5 TYR H 1 1 18 16253 1 1 5 TYR HA H -0.339 4.216 2.715 1.00 . A A . 5 TYR HA 1 1 18 16254 1 1 5 TYR HB2 H 1.720 5.543 2.760 1.00 . A A . 5 TYR HB2 1 1 18 16255 1 1 5 TYR HB3 H 0.433 6.420 3.579 1.00 . A A . 5 TYR HB3 1 1 18 16256 1 1 5 TYR HD1 H 0.387 6.594 6.046 1.00 . A A . 5 TYR HD1 1 1 18 16257 1 1 5 TYR HD2 H 3.604 4.635 3.981 1.00 . A A . 5 TYR HD2 1 1 18 16258 1 1 5 TYR HE1 H 1.761 6.675 8.110 1.00 . A A . 5 TYR HE1 1 1 18 16259 1 1 5 TYR HE2 H 4.978 4.716 6.041 1.00 . A A . 5 TYR HE2 1 1 18 16260 1 1 5 TYR HH H 5.139 5.886 8.096 1.00 . A A . 5 TYR HH 1 1 18 16261 1 1 5 TYR N N -0.720 4.327 4.789 1.00 . A A . 5 TYR N 1 1 18 16262 1 1 5 TYR O O 0.952 2.239 4.635 1.00 . A A . 5 TYR O 1 1 18 16263 1 1 5 TYR OH O 4.225 5.746 8.356 1.00 . A A . 5 TYR OH 1 1 18 16264 1 1 6 VAL C C 4.477 2.380 2.761 1.00 . A A . 6 VAL C 1 1 18 16265 1 1 6 VAL CA C 3.068 1.847 3.013 1.00 . A A . 6 VAL CA 1 1 18 16266 1 1 6 VAL CB C 2.713 0.784 1.961 1.00 . A A . 6 VAL CB 1 1 18 16267 1 1 6 VAL CG1 C 2.675 -0.585 2.632 1.00 . A A . 6 VAL CG1 1 1 18 16268 1 1 6 VAL CG2 C 1.336 1.062 1.339 1.00 . A A . 6 VAL CG2 1 1 18 16269 1 1 6 VAL H H 2.249 3.690 2.259 1.00 . A A . 6 VAL H 1 1 18 16270 1 1 6 VAL HA H 3.022 1.408 4.000 1.00 . A A . 6 VAL HA 1 1 18 16271 1 1 6 VAL HB H 3.467 0.783 1.186 1.00 . A A . 6 VAL HB 1 1 18 16272 1 1 6 VAL HG11 H 2.304 -0.479 3.640 1.00 . A A . 6 VAL HG11 1 1 18 16273 1 1 6 VAL HG12 H 2.020 -1.239 2.075 1.00 . A A . 6 VAL HG12 1 1 18 16274 1 1 6 VAL HG13 H 3.669 -1.004 2.655 1.00 . A A . 6 VAL HG13 1 1 18 16275 1 1 6 VAL HG21 H 0.751 1.680 1.996 1.00 . A A . 6 VAL HG21 1 1 18 16276 1 1 6 VAL HG22 H 1.463 1.563 0.391 1.00 . A A . 6 VAL HG22 1 1 18 16277 1 1 6 VAL HG23 H 0.819 0.129 1.184 1.00 . A A . 6 VAL HG23 1 1 18 16278 1 1 6 VAL N N 2.123 2.994 2.940 1.00 . A A . 6 VAL N 1 1 18 16279 1 1 6 VAL O O 4.652 3.387 2.104 1.00 . A A . 6 VAL O 1 1 18 16280 1 1 7 ASP C C 7.571 1.540 1.978 1.00 . A A . 7 ASP C 1 1 18 16281 1 1 7 ASP CA C 6.860 2.277 3.069 1.00 . A A . 7 ASP CA 1 1 18 16282 1 1 7 ASP CB C 7.663 2.222 4.370 1.00 . A A . 7 ASP CB 1 1 18 16283 1 1 7 ASP CG C 9.014 2.909 4.169 1.00 . A A . 7 ASP CG 1 1 18 16284 1 1 7 ASP H H 5.342 0.942 3.834 1.00 . A A . 7 ASP H 1 1 18 16285 1 1 7 ASP HA H 6.774 3.255 2.743 1.00 . A A . 7 ASP HA 1 1 18 16286 1 1 7 ASP HB2 H 7.116 2.726 5.153 1.00 . A A . 7 ASP HB2 1 1 18 16287 1 1 7 ASP HB3 H 7.824 1.191 4.651 1.00 . A A . 7 ASP HB3 1 1 18 16288 1 1 7 ASP N N 5.486 1.744 3.289 1.00 . A A . 7 ASP N 1 1 18 16289 1 1 7 ASP O O 8.696 1.846 1.635 1.00 . A A . 7 ASP O 1 1 18 16290 1 1 7 ASP OD1 O 9.171 3.578 3.161 1.00 . A A . 7 ASP OD1 1 1 18 16291 1 1 7 ASP OD2 O 9.870 2.755 5.025 1.00 . A A . 7 ASP OD2 1 1 18 16292 1 1 8 GLN C C 8.981 -0.526 0.619 1.00 . A A . 8 GLN C 1 1 18 16293 1 1 8 GLN CA C 7.522 -0.182 0.314 1.00 . A A . 8 GLN CA 1 1 18 16294 1 1 8 GLN CB C 7.430 0.642 -0.962 1.00 . A A . 8 GLN CB 1 1 18 16295 1 1 8 GLN CD C 7.925 3.057 -0.470 1.00 . A A . 8 GLN CD 1 1 18 16296 1 1 8 GLN CG C 8.509 1.739 -0.994 1.00 . A A . 8 GLN CG 1 1 18 16297 1 1 8 GLN H H 6.013 0.419 1.714 1.00 . A A . 8 GLN H 1 1 18 16298 1 1 8 GLN HA H 6.959 -1.082 0.193 1.00 . A A . 8 GLN HA 1 1 18 16299 1 1 8 GLN HB2 H 7.544 -0.003 -1.820 1.00 . A A . 8 GLN HB2 1 1 18 16300 1 1 8 GLN HB3 H 6.465 1.100 -0.984 1.00 . A A . 8 GLN HB3 1 1 18 16301 1 1 8 GLN HE21 H 6.190 2.841 -1.409 1.00 . A A . 8 GLN HE21 1 1 18 16302 1 1 8 GLN HE22 H 6.340 4.250 -0.480 1.00 . A A . 8 GLN HE22 1 1 18 16303 1 1 8 GLN HG2 H 9.347 1.452 -0.381 1.00 . A A . 8 GLN HG2 1 1 18 16304 1 1 8 GLN HG3 H 8.845 1.881 -2.011 1.00 . A A . 8 GLN HG3 1 1 18 16305 1 1 8 GLN N N 6.921 0.600 1.418 1.00 . A A . 8 GLN N 1 1 18 16306 1 1 8 GLN NE2 N 6.719 3.412 -0.816 1.00 . A A . 8 GLN NE2 1 1 18 16307 1 1 8 GLN O O 9.735 -0.910 -0.254 1.00 . A A . 8 GLN O 1 1 18 16308 1 1 8 GLN OE1 O 8.579 3.772 0.264 1.00 . A A . 8 GLN OE1 1 1 18 16309 1 1 9 ASP C C 10.986 -2.192 2.268 1.00 . A A . 9 ASP C 1 1 18 16310 1 1 9 ASP CA C 10.800 -0.681 2.202 1.00 . A A . 9 ASP CA 1 1 18 16311 1 1 9 ASP CB C 11.125 -0.061 3.562 1.00 . A A . 9 ASP CB 1 1 18 16312 1 1 9 ASP CG C 12.583 0.402 3.576 1.00 . A A . 9 ASP CG 1 1 18 16313 1 1 9 ASP H H 8.758 -0.057 2.523 1.00 . A A . 9 ASP H 1 1 18 16314 1 1 9 ASP HA H 11.458 -0.269 1.451 1.00 . A A . 9 ASP HA 1 1 18 16315 1 1 9 ASP HB2 H 10.476 0.785 3.737 1.00 . A A . 9 ASP HB2 1 1 18 16316 1 1 9 ASP HB3 H 10.975 -0.796 4.339 1.00 . A A . 9 ASP HB3 1 1 18 16317 1 1 9 ASP N N 9.386 -0.378 1.843 1.00 . A A . 9 ASP N 1 1 18 16318 1 1 9 ASP O O 11.886 -2.747 1.668 1.00 . A A . 9 ASP O 1 1 18 16319 1 1 9 ASP OD1 O 12.877 1.385 2.915 1.00 . A A . 9 ASP OD1 1 1 18 16320 1 1 9 ASP OD2 O 13.380 -0.233 4.246 1.00 . A A . 9 ASP OD2 1 1 18 16321 1 1 10 GLU C C 9.517 -4.979 1.906 1.00 . A A . 10 GLU C 1 1 18 16322 1 1 10 GLU CA C 10.247 -4.340 3.088 1.00 . A A . 10 GLU CA 1 1 18 16323 1 1 10 GLU CB C 9.603 -4.802 4.394 1.00 . A A . 10 GLU CB 1 1 18 16324 1 1 10 GLU CD C 11.424 -5.727 5.830 1.00 . A A . 10 GLU CD 1 1 18 16325 1 1 10 GLU CG C 10.285 -6.083 4.874 1.00 . A A . 10 GLU CG 1 1 18 16326 1 1 10 GLU H H 9.413 -2.395 3.454 1.00 . A A . 10 GLU H 1 1 18 16327 1 1 10 GLU HA H 11.288 -4.628 3.073 1.00 . A A . 10 GLU HA 1 1 18 16328 1 1 10 GLU HB2 H 9.714 -4.029 5.144 1.00 . A A . 10 GLU HB2 1 1 18 16329 1 1 10 GLU HB3 H 8.553 -4.992 4.228 1.00 . A A . 10 GLU HB3 1 1 18 16330 1 1 10 GLU HG2 H 9.565 -6.705 5.386 1.00 . A A . 10 GLU HG2 1 1 18 16331 1 1 10 GLU HG3 H 10.685 -6.619 4.025 1.00 . A A . 10 GLU HG3 1 1 18 16332 1 1 10 GLU N N 10.134 -2.863 2.986 1.00 . A A . 10 GLU N 1 1 18 16333 1 1 10 GLU O O 9.275 -6.170 1.883 1.00 . A A . 10 GLU O 1 1 18 16334 1 1 10 GLU OE1 O 11.938 -4.626 5.723 1.00 . A A . 10 GLU OE1 1 1 18 16335 1 1 10 GLU OE2 O 11.764 -6.562 6.652 1.00 . A A . 10 GLU OE2 1 1 18 16336 1 1 11 CYS C C 9.344 -5.705 -1.020 1.00 . A A . 11 CYS C 1 1 18 16337 1 1 11 CYS CA C 8.429 -4.756 -0.246 1.00 . A A . 11 CYS CA 1 1 18 16338 1 1 11 CYS CB C 7.966 -3.620 -1.163 1.00 . A A . 11 CYS CB 1 1 18 16339 1 1 11 CYS H H 9.350 -3.236 0.967 1.00 . A A . 11 CYS H 1 1 18 16340 1 1 11 CYS HA H 7.565 -5.304 0.102 1.00 . A A . 11 CYS HA 1 1 18 16341 1 1 11 CYS HB2 H 7.216 -3.026 -0.659 1.00 . A A . 11 CYS HB2 1 1 18 16342 1 1 11 CYS HB3 H 8.808 -2.995 -1.424 1.00 . A A . 11 CYS HB3 1 1 18 16343 1 1 11 CYS N N 9.153 -4.194 0.926 1.00 . A A . 11 CYS N 1 1 18 16344 1 1 11 CYS O O 10.305 -5.293 -1.640 1.00 . A A . 11 CYS O 1 1 18 16345 1 1 11 CYS SG S 7.249 -4.238 -2.725 1.00 . A A . 11 CYS SG 1 1 18 16346 1 1 12 ILE C C 9.626 -7.828 -3.227 1.00 . A A . 12 ILE C 1 1 18 16347 1 1 12 ILE CA C 9.889 -7.959 -1.723 1.00 . A A . 12 ILE CA 1 1 18 16348 1 1 12 ILE CB C 9.541 -9.374 -1.251 1.00 . A A . 12 ILE CB 1 1 18 16349 1 1 12 ILE CD1 C 7.680 -11.014 -0.953 1.00 . A A . 12 ILE CD1 1 1 18 16350 1 1 12 ILE CG1 C 8.082 -9.687 -1.597 1.00 . A A . 12 ILE CG1 1 1 18 16351 1 1 12 ILE CG2 C 9.735 -9.470 0.264 1.00 . A A . 12 ILE CG2 1 1 18 16352 1 1 12 ILE H H 8.264 -7.282 -0.486 1.00 . A A . 12 ILE H 1 1 18 16353 1 1 12 ILE HA H 10.931 -7.758 -1.522 1.00 . A A . 12 ILE HA 1 1 18 16354 1 1 12 ILE HB H 10.191 -10.086 -1.741 1.00 . A A . 12 ILE HB 1 1 18 16355 1 1 12 ILE HD11 H 8.500 -11.713 -1.027 1.00 . A A . 12 ILE HD11 1 1 18 16356 1 1 12 ILE HD12 H 7.439 -10.851 0.087 1.00 . A A . 12 ILE HD12 1 1 18 16357 1 1 12 ILE HD13 H 6.819 -11.416 -1.464 1.00 . A A . 12 ILE HD13 1 1 18 16358 1 1 12 ILE HG12 H 7.447 -8.897 -1.224 1.00 . A A . 12 ILE HG12 1 1 18 16359 1 1 12 ILE HG13 H 7.973 -9.762 -2.669 1.00 . A A . 12 ILE HG13 1 1 18 16360 1 1 12 ILE HG21 H 10.682 -9.028 0.535 1.00 . A A . 12 ILE HG21 1 1 18 16361 1 1 12 ILE HG22 H 8.935 -8.943 0.763 1.00 . A A . 12 ILE HG22 1 1 18 16362 1 1 12 ILE HG23 H 9.722 -10.508 0.562 1.00 . A A . 12 ILE HG23 1 1 18 16363 1 1 12 ILE N N 9.046 -6.976 -0.991 1.00 . A A . 12 ILE N 1 1 18 16364 1 1 12 ILE O O 9.502 -6.737 -3.749 1.00 . A A . 12 ILE O 1 1 18 16365 1 1 13 ALA C C 7.829 -9.189 -5.699 1.00 . A A . 13 ALA C 1 1 18 16366 1 1 13 ALA CA C 9.292 -8.847 -5.399 1.00 . A A . 13 ALA CA 1 1 18 16367 1 1 13 ALA CB C 10.206 -9.840 -6.121 1.00 . A A . 13 ALA CB 1 1 18 16368 1 1 13 ALA H H 9.649 -9.798 -3.505 1.00 . A A . 13 ALA H 1 1 18 16369 1 1 13 ALA HA H 9.504 -7.847 -5.747 1.00 . A A . 13 ALA HA 1 1 18 16370 1 1 13 ALA HB1 H 10.199 -10.782 -5.595 1.00 . A A . 13 ALA HB1 1 1 18 16371 1 1 13 ALA HB2 H 9.852 -9.988 -7.131 1.00 . A A . 13 ALA HB2 1 1 18 16372 1 1 13 ALA HB3 H 11.212 -9.449 -6.146 1.00 . A A . 13 ALA HB3 1 1 18 16373 1 1 13 ALA N N 9.543 -8.925 -3.934 1.00 . A A . 13 ALA N 1 1 18 16374 1 1 13 ALA O O 7.506 -9.675 -6.765 1.00 . A A . 13 ALA O 1 1 18 16375 1 1 14 CYS C C 4.700 -7.954 -5.141 1.00 . A A . 14 CYS C 1 1 18 16376 1 1 14 CYS CA C 5.501 -9.250 -5.037 1.00 . A A . 14 CYS CA 1 1 18 16377 1 1 14 CYS CB C 4.929 -10.112 -3.907 1.00 . A A . 14 CYS CB 1 1 18 16378 1 1 14 CYS H H 7.207 -8.539 -3.923 1.00 . A A . 14 CYS H 1 1 18 16379 1 1 14 CYS HA H 5.420 -9.790 -5.970 1.00 . A A . 14 CYS HA 1 1 18 16380 1 1 14 CYS HB2 H 4.613 -11.063 -4.307 1.00 . A A . 14 CYS HB2 1 1 18 16381 1 1 14 CYS HB3 H 5.693 -10.274 -3.160 1.00 . A A . 14 CYS HB3 1 1 18 16382 1 1 14 CYS N N 6.936 -8.937 -4.777 1.00 . A A . 14 CYS N 1 1 18 16383 1 1 14 CYS O O 5.114 -6.913 -4.670 1.00 . A A . 14 CYS O 1 1 18 16384 1 1 14 CYS SG S 3.482 -9.419 -3.018 1.00 . A A . 14 CYS SG 1 1 18 16385 1 1 15 GLU C C 1.258 -7.136 -5.593 1.00 . A A . 15 GLU C 1 1 18 16386 1 1 15 GLU CA C 2.716 -6.790 -5.897 1.00 . A A . 15 GLU CA 1 1 18 16387 1 1 15 GLU CB C 2.827 -6.260 -7.328 1.00 . A A . 15 GLU CB 1 1 18 16388 1 1 15 GLU CD C 1.489 -7.136 -9.245 1.00 . A A . 15 GLU CD 1 1 18 16389 1 1 15 GLU CG C 2.670 -7.418 -8.314 1.00 . A A . 15 GLU CG 1 1 18 16390 1 1 15 GLU H H 3.240 -8.863 -6.128 1.00 . A A . 15 GLU H 1 1 18 16391 1 1 15 GLU HA H 3.061 -6.035 -5.206 1.00 . A A . 15 GLU HA 1 1 18 16392 1 1 15 GLU HB2 H 2.053 -5.529 -7.502 1.00 . A A . 15 GLU HB2 1 1 18 16393 1 1 15 GLU HB3 H 3.795 -5.801 -7.467 1.00 . A A . 15 GLU HB3 1 1 18 16394 1 1 15 GLU HG2 H 3.573 -7.521 -8.897 1.00 . A A . 15 GLU HG2 1 1 18 16395 1 1 15 GLU HG3 H 2.485 -8.332 -7.771 1.00 . A A . 15 GLU HG3 1 1 18 16396 1 1 15 GLU N N 3.553 -8.012 -5.756 1.00 . A A . 15 GLU N 1 1 18 16397 1 1 15 GLU O O 0.350 -6.430 -5.985 1.00 . A A . 15 GLU O 1 1 18 16398 1 1 15 GLU OE1 O 1.551 -6.154 -9.967 1.00 . A A . 15 GLU OE1 1 1 18 16399 1 1 15 GLU OE2 O 0.543 -7.906 -9.220 1.00 . A A . 15 GLU OE2 1 1 18 16400 1 1 16 SER C C -1.165 -7.374 -4.159 1.00 . A A . 16 SER C 1 1 18 16401 1 1 16 SER CA C -0.368 -8.616 -4.564 1.00 . A A . 16 SER CA 1 1 18 16402 1 1 16 SER CB C -0.352 -9.613 -3.404 1.00 . A A . 16 SER CB 1 1 18 16403 1 1 16 SER H H 1.780 -8.772 -4.594 1.00 . A A . 16 SER H 1 1 18 16404 1 1 16 SER HA H -0.829 -9.074 -5.427 1.00 . A A . 16 SER HA 1 1 18 16405 1 1 16 SER HB2 H -1.329 -10.052 -3.290 1.00 . A A . 16 SER HB2 1 1 18 16406 1 1 16 SER HB3 H 0.368 -10.394 -3.613 1.00 . A A . 16 SER HB3 1 1 18 16407 1 1 16 SER HG H -0.686 -8.290 -2.018 1.00 . A A . 16 SER HG 1 1 18 16408 1 1 16 SER N N 1.030 -8.220 -4.897 1.00 . A A . 16 SER N 1 1 18 16409 1 1 16 SER O O -2.286 -7.177 -4.583 1.00 . A A . 16 SER O 1 1 18 16410 1 1 16 SER OG O 0.000 -8.934 -2.205 1.00 . A A . 16 SER OG 1 1 18 16411 1 1 17 CYS C C -1.673 -4.481 -4.164 1.00 . A A . 17 CYS C 1 1 18 16412 1 1 17 CYS CA C -1.306 -5.296 -2.924 1.00 . A A . 17 CYS CA 1 1 18 16413 1 1 17 CYS CB C -0.392 -4.466 -2.021 1.00 . A A . 17 CYS CB 1 1 18 16414 1 1 17 CYS H H 0.318 -6.706 -3.022 1.00 . A A . 17 CYS H 1 1 18 16415 1 1 17 CYS HA H -2.204 -5.564 -2.386 1.00 . A A . 17 CYS HA 1 1 18 16416 1 1 17 CYS HB2 H -0.969 -3.688 -1.543 1.00 . A A . 17 CYS HB2 1 1 18 16417 1 1 17 CYS HB3 H 0.045 -5.104 -1.267 1.00 . A A . 17 CYS HB3 1 1 18 16418 1 1 17 CYS N N -0.589 -6.530 -3.347 1.00 . A A . 17 CYS N 1 1 18 16419 1 1 17 CYS O O -2.765 -3.958 -4.280 1.00 . A A . 17 CYS O 1 1 18 16420 1 1 17 CYS SG S 0.988 -3.653 -2.906 1.00 . A A . 17 CYS SG 1 1 18 16421 1 1 18 VAL C C -2.294 -4.158 -7.014 1.00 . A A . 18 VAL C 1 1 18 16422 1 1 18 VAL CA C -1.051 -3.590 -6.329 1.00 . A A . 18 VAL CA 1 1 18 16423 1 1 18 VAL CB C 0.143 -3.683 -7.279 1.00 . A A . 18 VAL CB 1 1 18 16424 1 1 18 VAL CG1 C -0.098 -2.783 -8.492 1.00 . A A . 18 VAL CG1 1 1 18 16425 1 1 18 VAL CG2 C 1.410 -3.223 -6.552 1.00 . A A . 18 VAL CG2 1 1 18 16426 1 1 18 VAL H H 0.109 -4.800 -4.978 1.00 . A A . 18 VAL H 1 1 18 16427 1 1 18 VAL HA H -1.224 -2.556 -6.070 1.00 . A A . 18 VAL HA 1 1 18 16428 1 1 18 VAL HB H 0.265 -4.706 -7.607 1.00 . A A . 18 VAL HB 1 1 18 16429 1 1 18 VAL HG11 H -1.136 -2.841 -8.783 1.00 . A A . 18 VAL HG11 1 1 18 16430 1 1 18 VAL HG12 H 0.146 -1.762 -8.235 1.00 . A A . 18 VAL HG12 1 1 18 16431 1 1 18 VAL HG13 H 0.526 -3.107 -9.312 1.00 . A A . 18 VAL HG13 1 1 18 16432 1 1 18 VAL HG21 H 1.199 -2.319 -6.001 1.00 . A A . 18 VAL HG21 1 1 18 16433 1 1 18 VAL HG22 H 1.733 -3.995 -5.868 1.00 . A A . 18 VAL HG22 1 1 18 16434 1 1 18 VAL HG23 H 2.190 -3.030 -7.274 1.00 . A A . 18 VAL HG23 1 1 18 16435 1 1 18 VAL N N -0.765 -4.369 -5.094 1.00 . A A . 18 VAL N 1 1 18 16436 1 1 18 VAL O O -3.035 -3.448 -7.664 1.00 . A A . 18 VAL O 1 1 18 16437 1 1 19 GLU C C -4.951 -5.782 -6.650 1.00 . A A . 19 GLU C 1 1 18 16438 1 1 19 GLU CA C -3.730 -6.036 -7.521 1.00 . A A . 19 GLU CA 1 1 18 16439 1 1 19 GLU CB C -3.521 -7.541 -7.702 1.00 . A A . 19 GLU CB 1 1 18 16440 1 1 19 GLU CD C -5.461 -8.503 -8.949 1.00 . A A . 19 GLU CD 1 1 18 16441 1 1 19 GLU CG C -4.034 -7.965 -9.080 1.00 . A A . 19 GLU CG 1 1 18 16442 1 1 19 GLU H H -1.924 -5.993 -6.346 1.00 . A A . 19 GLU H 1 1 18 16443 1 1 19 GLU HA H -3.885 -5.571 -8.477 1.00 . A A . 19 GLU HA 1 1 18 16444 1 1 19 GLU HB2 H -2.468 -7.769 -7.622 1.00 . A A . 19 GLU HB2 1 1 18 16445 1 1 19 GLU HB3 H -4.065 -8.074 -6.937 1.00 . A A . 19 GLU HB3 1 1 18 16446 1 1 19 GLU HG2 H -4.027 -7.113 -9.743 1.00 . A A . 19 GLU HG2 1 1 18 16447 1 1 19 GLU HG3 H -3.395 -8.739 -9.478 1.00 . A A . 19 GLU HG3 1 1 18 16448 1 1 19 GLU N N -2.531 -5.434 -6.875 1.00 . A A . 19 GLU N 1 1 18 16449 1 1 19 GLU O O -6.025 -5.496 -7.140 1.00 . A A . 19 GLU O 1 1 18 16450 1 1 19 GLU OE1 O -5.613 -9.611 -8.465 1.00 . A A . 19 GLU OE1 1 1 18 16451 1 1 19 GLU OE2 O -6.375 -7.795 -9.336 1.00 . A A . 19 GLU OE2 1 1 18 16452 1 1 20 ILE C C -6.211 -4.075 -4.446 1.00 . A A . 20 ILE C 1 1 18 16453 1 1 20 ILE CA C -5.951 -5.585 -4.472 1.00 . A A . 20 ILE CA 1 1 18 16454 1 1 20 ILE CB C -5.627 -6.094 -3.076 1.00 . A A . 20 ILE CB 1 1 18 16455 1 1 20 ILE CD1 C -6.853 -8.100 -2.115 1.00 . A A . 20 ILE CD1 1 1 18 16456 1 1 20 ILE CG1 C -5.784 -7.608 -3.103 1.00 . A A . 20 ILE CG1 1 1 18 16457 1 1 20 ILE CG2 C -6.550 -5.441 -2.038 1.00 . A A . 20 ILE CG2 1 1 18 16458 1 1 20 ILE H H -3.921 -6.071 -4.976 1.00 . A A . 20 ILE H 1 1 18 16459 1 1 20 ILE HA H -6.817 -6.106 -4.843 1.00 . A A . 20 ILE HA 1 1 18 16460 1 1 20 ILE HB H -4.610 -5.864 -2.853 1.00 . A A . 20 ILE HB 1 1 18 16461 1 1 20 ILE HD11 H -6.637 -7.714 -1.130 1.00 . A A . 20 ILE HD11 1 1 18 16462 1 1 20 ILE HD12 H -7.824 -7.751 -2.434 1.00 . A A . 20 ILE HD12 1 1 18 16463 1 1 20 ILE HD13 H -6.849 -9.179 -2.089 1.00 . A A . 20 ILE HD13 1 1 18 16464 1 1 20 ILE HG12 H -6.056 -7.890 -4.094 1.00 . A A . 20 ILE HG12 1 1 18 16465 1 1 20 ILE HG13 H -4.841 -8.053 -2.865 1.00 . A A . 20 ILE HG13 1 1 18 16466 1 1 20 ILE HG21 H -7.576 -5.532 -2.359 1.00 . A A . 20 ILE HG21 1 1 18 16467 1 1 20 ILE HG22 H -6.426 -5.936 -1.086 1.00 . A A . 20 ILE HG22 1 1 18 16468 1 1 20 ILE HG23 H -6.294 -4.396 -1.935 1.00 . A A . 20 ILE HG23 1 1 18 16469 1 1 20 ILE N N -4.798 -5.856 -5.360 1.00 . A A . 20 ILE N 1 1 18 16470 1 1 20 ILE O O -7.079 -3.596 -3.743 1.00 . A A . 20 ILE O 1 1 18 16471 1 1 21 ALA C C -5.021 -1.256 -6.487 1.00 . A A . 21 ALA C 1 1 18 16472 1 1 21 ALA CA C -5.667 -1.843 -5.231 1.00 . A A . 21 ALA CA 1 1 18 16473 1 1 21 ALA CB C -5.023 -1.224 -3.990 1.00 . A A . 21 ALA CB 1 1 18 16474 1 1 21 ALA H H -4.763 -3.719 -5.777 1.00 . A A . 21 ALA H 1 1 18 16475 1 1 21 ALA HA H -6.726 -1.626 -5.234 1.00 . A A . 21 ALA HA 1 1 18 16476 1 1 21 ALA HB1 H -4.173 -1.818 -3.691 1.00 . A A . 21 ALA HB1 1 1 18 16477 1 1 21 ALA HB2 H -4.698 -0.219 -4.216 1.00 . A A . 21 ALA HB2 1 1 18 16478 1 1 21 ALA HB3 H -5.742 -1.198 -3.186 1.00 . A A . 21 ALA HB3 1 1 18 16479 1 1 21 ALA N N -5.462 -3.317 -5.213 1.00 . A A . 21 ALA N 1 1 18 16480 1 1 21 ALA O O -4.014 -0.580 -6.409 1.00 . A A . 21 ALA O 1 1 18 16481 1 1 22 PRO C C -5.329 0.475 -9.017 1.00 . A A . 22 PRO C 1 1 18 16482 1 1 22 PRO CA C -5.106 -1.036 -8.906 1.00 . A A . 22 PRO CA 1 1 18 16483 1 1 22 PRO CB C -5.931 -1.795 -9.945 1.00 . A A . 22 PRO CB 1 1 18 16484 1 1 22 PRO CD C -6.845 -2.343 -7.771 1.00 . A A . 22 PRO CD 1 1 18 16485 1 1 22 PRO CG C -7.195 -2.168 -9.232 1.00 . A A . 22 PRO CG 1 1 18 16486 1 1 22 PRO HA H -4.062 -1.277 -9.016 1.00 . A A . 22 PRO HA 1 1 18 16487 1 1 22 PRO HB2 H -6.114 -1.151 -10.794 1.00 . A A . 22 PRO HB2 1 1 18 16488 1 1 22 PRO HB3 H -5.388 -2.669 -10.266 1.00 . A A . 22 PRO HB3 1 1 18 16489 1 1 22 PRO HD2 H -7.643 -1.968 -7.144 1.00 . A A . 22 PRO HD2 1 1 18 16490 1 1 22 PRO HD3 H -6.643 -3.380 -7.552 1.00 . A A . 22 PRO HD3 1 1 18 16491 1 1 22 PRO HG2 H -7.925 -1.378 -9.349 1.00 . A A . 22 PRO HG2 1 1 18 16492 1 1 22 PRO HG3 H -7.581 -3.094 -9.628 1.00 . A A . 22 PRO HG3 1 1 18 16493 1 1 22 PRO N N -5.628 -1.540 -7.608 1.00 . A A . 22 PRO N 1 1 18 16494 1 1 22 PRO O O -6.113 0.942 -9.818 1.00 . A A . 22 PRO O 1 1 18 16495 1 1 23 GLY C C -4.170 3.323 -7.006 1.00 . A A . 23 GLY C 1 1 18 16496 1 1 23 GLY CA C -4.801 2.717 -8.258 1.00 . A A . 23 GLY CA 1 1 18 16497 1 1 23 GLY H H -4.015 0.834 -7.576 1.00 . A A . 23 GLY H 1 1 18 16498 1 1 23 GLY HA2 H -4.310 3.107 -9.140 1.00 . A A . 23 GLY HA2 1 1 18 16499 1 1 23 GLY HA3 H -5.851 2.968 -8.287 1.00 . A A . 23 GLY HA3 1 1 18 16500 1 1 23 GLY N N -4.640 1.237 -8.214 1.00 . A A . 23 GLY N 1 1 18 16501 1 1 23 GLY O O -3.588 4.387 -7.041 1.00 . A A . 23 GLY O 1 1 18 16502 1 1 24 ALA C C -2.260 2.614 -4.490 1.00 . A A . 24 ALA C 1 1 18 16503 1 1 24 ALA CA C -3.680 3.162 -4.636 1.00 . A A . 24 ALA CA 1 1 18 16504 1 1 24 ALA CB C -4.529 2.706 -3.449 1.00 . A A . 24 ALA CB 1 1 18 16505 1 1 24 ALA H H -4.748 1.783 -5.897 1.00 . A A . 24 ALA H 1 1 18 16506 1 1 24 ALA HA H -3.650 4.240 -4.667 1.00 . A A . 24 ALA HA 1 1 18 16507 1 1 24 ALA HB1 H -4.596 1.629 -3.446 1.00 . A A . 24 ALA HB1 1 1 18 16508 1 1 24 ALA HB2 H -4.071 3.042 -2.530 1.00 . A A . 24 ALA HB2 1 1 18 16509 1 1 24 ALA HB3 H -5.520 3.128 -3.532 1.00 . A A . 24 ALA HB3 1 1 18 16510 1 1 24 ALA N N -4.278 2.642 -5.898 1.00 . A A . 24 ALA N 1 1 18 16511 1 1 24 ALA O O -1.329 3.339 -4.197 1.00 . A A . 24 ALA O 1 1 18 16512 1 1 25 PHE C C -0.144 0.553 -5.979 1.00 . A A . 25 PHE C 1 1 18 16513 1 1 25 PHE CA C -0.730 0.738 -4.576 1.00 . A A . 25 PHE CA 1 1 18 16514 1 1 25 PHE CB C -0.844 -0.631 -3.896 1.00 . A A . 25 PHE CB 1 1 18 16515 1 1 25 PHE CD1 C 1.398 -0.186 -2.814 1.00 . A A . 25 PHE CD1 1 1 18 16516 1 1 25 PHE CD2 C -0.292 -1.385 -1.556 1.00 . A A . 25 PHE CD2 1 1 18 16517 1 1 25 PHE CE1 C 2.278 -0.295 -1.728 1.00 . A A . 25 PHE CE1 1 1 18 16518 1 1 25 PHE CE2 C 0.588 -1.494 -0.473 1.00 . A A . 25 PHE CE2 1 1 18 16519 1 1 25 PHE CG C 0.112 -0.730 -2.727 1.00 . A A . 25 PHE CG 1 1 18 16520 1 1 25 PHE CZ C 1.875 -0.948 -0.559 1.00 . A A . 25 PHE CZ 1 1 18 16521 1 1 25 PHE H H -2.852 0.773 -4.935 1.00 . A A . 25 PHE H 1 1 18 16522 1 1 25 PHE HA H -0.093 1.392 -3.993 1.00 . A A . 25 PHE HA 1 1 18 16523 1 1 25 PHE HB2 H -1.855 -0.769 -3.541 1.00 . A A . 25 PHE HB2 1 1 18 16524 1 1 25 PHE HB3 H -0.610 -1.405 -4.613 1.00 . A A . 25 PHE HB3 1 1 18 16525 1 1 25 PHE HD1 H 1.713 0.318 -3.716 1.00 . A A . 25 PHE HD1 1 1 18 16526 1 1 25 PHE HD2 H -1.284 -1.804 -1.488 1.00 . A A . 25 PHE HD2 1 1 18 16527 1 1 25 PHE HE1 H 3.267 0.121 -1.789 1.00 . A A . 25 PHE HE1 1 1 18 16528 1 1 25 PHE HE2 H 0.275 -1.999 0.428 1.00 . A A . 25 PHE HE2 1 1 18 16529 1 1 25 PHE HZ H 2.555 -1.032 0.275 1.00 . A A . 25 PHE HZ 1 1 18 16530 1 1 25 PHE N N -2.088 1.339 -4.696 1.00 . A A . 25 PHE N 1 1 18 16531 1 1 25 PHE O O -0.831 0.155 -6.899 1.00 . A A . 25 PHE O 1 1 18 16532 1 1 26 ALA C C 3.254 0.807 -7.390 1.00 . A A . 26 ALA C 1 1 18 16533 1 1 26 ALA CA C 1.733 0.672 -7.498 1.00 . A A . 26 ALA CA 1 1 18 16534 1 1 26 ALA CB C 1.193 1.750 -8.441 1.00 . A A . 26 ALA CB 1 1 18 16535 1 1 26 ALA H H 1.654 1.156 -5.400 1.00 . A A . 26 ALA H 1 1 18 16536 1 1 26 ALA HA H 1.487 -0.303 -7.891 1.00 . A A . 26 ALA HA 1 1 18 16537 1 1 26 ALA HB1 H 1.041 2.666 -7.891 1.00 . A A . 26 ALA HB1 1 1 18 16538 1 1 26 ALA HB2 H 1.904 1.921 -9.236 1.00 . A A . 26 ALA HB2 1 1 18 16539 1 1 26 ALA HB3 H 0.254 1.422 -8.861 1.00 . A A . 26 ALA HB3 1 1 18 16540 1 1 26 ALA N N 1.116 0.836 -6.152 1.00 . A A . 26 ALA N 1 1 18 16541 1 1 26 ALA O O 3.768 1.798 -6.913 1.00 . A A . 26 ALA O 1 1 18 16542 1 1 27 MET C C 5.936 1.094 -8.588 1.00 . A A . 27 MET C 1 1 18 16543 1 1 27 MET CA C 5.466 -0.098 -7.763 1.00 . A A . 27 MET CA 1 1 18 16544 1 1 27 MET CB C 6.079 -1.384 -8.321 1.00 . A A . 27 MET CB 1 1 18 16545 1 1 27 MET CE C 5.872 -4.428 -9.679 1.00 . A A . 27 MET CE 1 1 18 16546 1 1 27 MET CG C 5.368 -1.763 -9.620 1.00 . A A . 27 MET CG 1 1 18 16547 1 1 27 MET H H 3.551 -0.967 -8.223 1.00 . A A . 27 MET H 1 1 18 16548 1 1 27 MET HA H 5.768 0.035 -6.743 1.00 . A A . 27 MET HA 1 1 18 16549 1 1 27 MET HB2 H 7.130 -1.228 -8.516 1.00 . A A . 27 MET HB2 1 1 18 16550 1 1 27 MET HB3 H 5.960 -2.182 -7.603 1.00 . A A . 27 MET HB3 1 1 18 16551 1 1 27 MET HE1 H 6.796 -3.871 -9.603 1.00 . A A . 27 MET HE1 1 1 18 16552 1 1 27 MET HE2 H 5.861 -5.220 -8.942 1.00 . A A . 27 MET HE2 1 1 18 16553 1 1 27 MET HE3 H 5.794 -4.857 -10.664 1.00 . A A . 27 MET HE3 1 1 18 16554 1 1 27 MET HG2 H 4.670 -0.983 -9.888 1.00 . A A . 27 MET HG2 1 1 18 16555 1 1 27 MET HG3 H 6.097 -1.880 -10.409 1.00 . A A . 27 MET HG3 1 1 18 16556 1 1 27 MET N N 3.982 -0.179 -7.836 1.00 . A A . 27 MET N 1 1 18 16557 1 1 27 MET O O 5.283 1.491 -9.532 1.00 . A A . 27 MET O 1 1 18 16558 1 1 27 MET SD S 4.473 -3.319 -9.387 1.00 . A A . 27 MET SD 1 1 18 16559 1 1 28 ASP C C 8.952 2.553 -9.452 1.00 . A A . 28 ASP C 1 1 18 16560 1 1 28 ASP CA C 7.516 2.832 -9.055 1.00 . A A . 28 ASP CA 1 1 18 16561 1 1 28 ASP CB C 7.420 4.090 -8.191 1.00 . A A . 28 ASP CB 1 1 18 16562 1 1 28 ASP CG C 7.005 5.286 -9.051 1.00 . A A . 28 ASP CG 1 1 18 16563 1 1 28 ASP H H 7.611 1.366 -7.492 1.00 . A A . 28 ASP H 1 1 18 16564 1 1 28 ASP HA H 6.902 2.939 -9.938 1.00 . A A . 28 ASP HA 1 1 18 16565 1 1 28 ASP HB2 H 6.680 3.930 -7.418 1.00 . A A . 28 ASP HB2 1 1 18 16566 1 1 28 ASP HB3 H 8.376 4.285 -7.736 1.00 . A A . 28 ASP HB3 1 1 18 16567 1 1 28 ASP N N 7.058 1.681 -8.259 1.00 . A A . 28 ASP N 1 1 18 16568 1 1 28 ASP O O 9.593 1.735 -8.823 1.00 . A A . 28 ASP O 1 1 18 16569 1 1 28 ASP OD1 O 6.110 5.125 -9.862 1.00 . A A . 28 ASP OD1 1 1 18 16570 1 1 28 ASP OD2 O 7.589 6.343 -8.879 1.00 . A A . 28 ASP OD2 1 1 18 16571 1 1 29 PRO C C 11.713 3.924 -10.130 1.00 . A A . 29 PRO C 1 1 18 16572 1 1 29 PRO CA C 10.793 3.038 -10.957 1.00 . A A . 29 PRO CA 1 1 18 16573 1 1 29 PRO CB C 10.732 3.491 -12.413 1.00 . A A . 29 PRO CB 1 1 18 16574 1 1 29 PRO CD C 8.697 4.230 -11.265 1.00 . A A . 29 PRO CD 1 1 18 16575 1 1 29 PRO CG C 9.569 4.440 -12.491 1.00 . A A . 29 PRO CG 1 1 18 16576 1 1 29 PRO HA H 11.087 2.002 -10.894 1.00 . A A . 29 PRO HA 1 1 18 16577 1 1 29 PRO HB2 H 11.668 3.970 -12.673 1.00 . A A . 29 PRO HB2 1 1 18 16578 1 1 29 PRO HB3 H 10.583 2.634 -13.049 1.00 . A A . 29 PRO HB3 1 1 18 16579 1 1 29 PRO HD2 H 8.605 5.155 -10.715 1.00 . A A . 29 PRO HD2 1 1 18 16580 1 1 29 PRO HD3 H 7.728 3.865 -11.546 1.00 . A A . 29 PRO HD3 1 1 18 16581 1 1 29 PRO HG2 H 9.934 5.457 -12.513 1.00 . A A . 29 PRO HG2 1 1 18 16582 1 1 29 PRO HG3 H 8.995 4.236 -13.382 1.00 . A A . 29 PRO HG3 1 1 18 16583 1 1 29 PRO N N 9.410 3.227 -10.476 1.00 . A A . 29 PRO N 1 1 18 16584 1 1 29 PRO O O 12.912 3.737 -10.079 1.00 . A A . 29 PRO O 1 1 18 16585 1 1 30 GLU C C 11.929 5.131 -7.182 1.00 . A A . 30 GLU C 1 1 18 16586 1 1 30 GLU CA C 11.926 5.765 -8.567 1.00 . A A . 30 GLU CA 1 1 18 16587 1 1 30 GLU CB C 11.276 7.150 -8.506 1.00 . A A . 30 GLU CB 1 1 18 16588 1 1 30 GLU CD C 11.685 9.604 -8.783 1.00 . A A . 30 GLU CD 1 1 18 16589 1 1 30 GLU CG C 12.340 8.222 -8.750 1.00 . A A . 30 GLU CG 1 1 18 16590 1 1 30 GLU H H 10.154 4.963 -9.489 1.00 . A A . 30 GLU H 1 1 18 16591 1 1 30 GLU HA H 12.937 5.844 -8.940 1.00 . A A . 30 GLU HA 1 1 18 16592 1 1 30 GLU HB2 H 10.512 7.221 -9.266 1.00 . A A . 30 GLU HB2 1 1 18 16593 1 1 30 GLU HB3 H 10.833 7.299 -7.534 1.00 . A A . 30 GLU HB3 1 1 18 16594 1 1 30 GLU HG2 H 13.071 8.189 -7.954 1.00 . A A . 30 GLU HG2 1 1 18 16595 1 1 30 GLU HG3 H 12.829 8.035 -9.694 1.00 . A A . 30 GLU HG3 1 1 18 16596 1 1 30 GLU N N 11.130 4.869 -9.446 1.00 . A A . 30 GLU N 1 1 18 16597 1 1 30 GLU O O 12.852 5.278 -6.407 1.00 . A A . 30 GLU O 1 1 18 16598 1 1 30 GLU OE1 O 10.552 9.713 -8.341 1.00 . A A . 30 GLU OE1 1 1 18 16599 1 1 30 GLU OE2 O 12.328 10.530 -9.249 1.00 . A A . 30 GLU OE2 1 1 18 16600 1 1 31 ILE C C 10.948 2.186 -5.847 1.00 . A A . 31 ILE C 1 1 18 16601 1 1 31 ILE CA C 10.802 3.685 -5.594 1.00 . A A . 31 ILE CA 1 1 18 16602 1 1 31 ILE CB C 9.459 4.009 -4.923 1.00 . A A . 31 ILE CB 1 1 18 16603 1 1 31 ILE CD1 C 7.001 3.562 -4.988 1.00 . A A . 31 ILE CD1 1 1 18 16604 1 1 31 ILE CG1 C 8.378 3.028 -5.388 1.00 . A A . 31 ILE CG1 1 1 18 16605 1 1 31 ILE CG2 C 9.045 5.436 -5.291 1.00 . A A . 31 ILE CG2 1 1 18 16606 1 1 31 ILE H H 10.187 4.272 -7.558 1.00 . A A . 31 ILE H 1 1 18 16607 1 1 31 ILE HA H 11.594 4.000 -4.965 1.00 . A A . 31 ILE HA 1 1 18 16608 1 1 31 ILE HB H 9.572 3.938 -3.849 1.00 . A A . 31 ILE HB 1 1 18 16609 1 1 31 ILE HD11 H 7.032 3.896 -3.962 1.00 . A A . 31 ILE HD11 1 1 18 16610 1 1 31 ILE HD12 H 6.735 4.388 -5.628 1.00 . A A . 31 ILE HD12 1 1 18 16611 1 1 31 ILE HD13 H 6.267 2.776 -5.087 1.00 . A A . 31 ILE HD13 1 1 18 16612 1 1 31 ILE HG12 H 8.428 2.919 -6.460 1.00 . A A . 31 ILE HG12 1 1 18 16613 1 1 31 ILE HG13 H 8.539 2.070 -4.921 1.00 . A A . 31 ILE HG13 1 1 18 16614 1 1 31 ILE HG21 H 9.903 5.973 -5.669 1.00 . A A . 31 ILE HG21 1 1 18 16615 1 1 31 ILE HG22 H 8.277 5.404 -6.050 1.00 . A A . 31 ILE HG22 1 1 18 16616 1 1 31 ILE HG23 H 8.664 5.938 -4.414 1.00 . A A . 31 ILE HG23 1 1 18 16617 1 1 31 ILE N N 10.896 4.389 -6.895 1.00 . A A . 31 ILE N 1 1 18 16618 1 1 31 ILE O O 10.860 1.386 -4.938 1.00 . A A . 31 ILE O 1 1 18 16619 1 1 32 GLU C C 10.583 -0.502 -6.505 1.00 . A A . 32 GLU C 1 1 18 16620 1 1 32 GLU CA C 11.322 0.393 -7.486 1.00 . A A . 32 GLU CA 1 1 18 16621 1 1 32 GLU CB C 12.804 0.014 -7.508 1.00 . A A . 32 GLU CB 1 1 18 16622 1 1 32 GLU CD C 13.199 -1.246 -9.631 1.00 . A A . 32 GLU CD 1 1 18 16623 1 1 32 GLU CG C 13.336 0.112 -8.940 1.00 . A A . 32 GLU CG 1 1 18 16624 1 1 32 GLU H H 11.230 2.509 -7.787 1.00 . A A . 32 GLU H 1 1 18 16625 1 1 32 GLU HA H 10.898 0.260 -8.469 1.00 . A A . 32 GLU HA 1 1 18 16626 1 1 32 GLU HB2 H 13.357 0.688 -6.870 1.00 . A A . 32 GLU HB2 1 1 18 16627 1 1 32 GLU HB3 H 12.921 -0.998 -7.152 1.00 . A A . 32 GLU HB3 1 1 18 16628 1 1 32 GLU HG2 H 12.769 0.853 -9.483 1.00 . A A . 32 GLU HG2 1 1 18 16629 1 1 32 GLU HG3 H 14.377 0.399 -8.917 1.00 . A A . 32 GLU HG3 1 1 18 16630 1 1 32 GLU N N 11.169 1.823 -7.092 1.00 . A A . 32 GLU N 1 1 18 16631 1 1 32 GLU O O 11.087 -1.515 -6.069 1.00 . A A . 32 GLU O 1 1 18 16632 1 1 32 GLU OE1 O 13.509 -2.244 -9.001 1.00 . A A . 32 GLU OE1 1 1 18 16633 1 1 32 GLU OE2 O 12.787 -1.264 -10.779 1.00 . A A . 32 GLU OE2 1 1 18 16634 1 1 33 LYS C C 7.198 -0.428 -5.044 1.00 . A A . 33 LYS C 1 1 18 16635 1 1 33 LYS CA C 8.626 -0.954 -5.169 1.00 . A A . 33 LYS CA 1 1 18 16636 1 1 33 LYS CB C 9.306 -0.895 -3.798 1.00 . A A . 33 LYS CB 1 1 18 16637 1 1 33 LYS CD C 11.735 -1.461 -3.584 1.00 . A A . 33 LYS CD 1 1 18 16638 1 1 33 LYS CE C 12.083 -1.195 -2.118 1.00 . A A . 33 LYS CE 1 1 18 16639 1 1 33 LYS CG C 10.319 -2.037 -3.676 1.00 . A A . 33 LYS CG 1 1 18 16640 1 1 33 LYS H H 9.013 0.711 -6.513 1.00 . A A . 33 LYS H 1 1 18 16641 1 1 33 LYS HA H 8.602 -1.978 -5.510 1.00 . A A . 33 LYS HA 1 1 18 16642 1 1 33 LYS HB2 H 9.813 0.052 -3.688 1.00 . A A . 33 LYS HB2 1 1 18 16643 1 1 33 LYS HB3 H 8.561 -0.997 -3.025 1.00 . A A . 33 LYS HB3 1 1 18 16644 1 1 33 LYS HD2 H 12.438 -2.168 -3.999 1.00 . A A . 33 LYS HD2 1 1 18 16645 1 1 33 LYS HD3 H 11.784 -0.535 -4.137 1.00 . A A . 33 LYS HD3 1 1 18 16646 1 1 33 LYS HE2 H 11.838 -0.173 -1.870 1.00 . A A . 33 LYS HE2 1 1 18 16647 1 1 33 LYS HE3 H 11.516 -1.863 -1.487 1.00 . A A . 33 LYS HE3 1 1 18 16648 1 1 33 LYS HG2 H 10.106 -2.611 -2.787 1.00 . A A . 33 LYS HG2 1 1 18 16649 1 1 33 LYS HG3 H 10.248 -2.677 -4.543 1.00 . A A . 33 LYS HG3 1 1 18 16650 1 1 33 LYS HZ1 H 14.030 -1.427 -2.820 1.00 . A A . 33 LYS HZ1 1 1 18 16651 1 1 33 LYS HZ2 H 13.925 -0.667 -1.305 1.00 . A A . 33 LYS HZ2 1 1 18 16652 1 1 33 LYS HZ3 H 13.681 -2.340 -1.431 1.00 . A A . 33 LYS HZ3 1 1 18 16653 1 1 33 LYS N N 9.394 -0.122 -6.147 1.00 . A A . 33 LYS N 1 1 18 16654 1 1 33 LYS NZ N 13.540 -1.425 -1.903 1.00 . A A . 33 LYS NZ 1 1 18 16655 1 1 33 LYS O O 6.941 0.750 -5.193 1.00 . A A . 33 LYS O 1 1 18 16656 1 1 34 ALA C C 4.716 0.211 -3.563 1.00 . A A . 34 ALA C 1 1 18 16657 1 1 34 ALA CA C 4.842 -0.872 -4.638 1.00 . A A . 34 ALA CA 1 1 18 16658 1 1 34 ALA CB C 3.992 -2.081 -4.240 1.00 . A A . 34 ALA CB 1 1 18 16659 1 1 34 ALA H H 6.499 -2.244 -4.658 1.00 . A A . 34 ALA H 1 1 18 16660 1 1 34 ALA HA H 4.488 -0.484 -5.580 1.00 . A A . 34 ALA HA 1 1 18 16661 1 1 34 ALA HB1 H 4.587 -2.979 -4.313 1.00 . A A . 34 ALA HB1 1 1 18 16662 1 1 34 ALA HB2 H 3.647 -1.959 -3.224 1.00 . A A . 34 ALA HB2 1 1 18 16663 1 1 34 ALA HB3 H 3.141 -2.157 -4.903 1.00 . A A . 34 ALA HB3 1 1 18 16664 1 1 34 ALA N N 6.264 -1.300 -4.772 1.00 . A A . 34 ALA N 1 1 18 16665 1 1 34 ALA O O 5.397 0.184 -2.557 1.00 . A A . 34 ALA O 1 1 18 16666 1 1 35 TYR C C 2.182 2.704 -2.744 1.00 . A A . 35 TYR C 1 1 18 16667 1 1 35 TYR CA C 3.639 2.228 -2.741 1.00 . A A . 35 TYR CA 1 1 18 16668 1 1 35 TYR CB C 4.599 3.400 -3.014 1.00 . A A . 35 TYR CB 1 1 18 16669 1 1 35 TYR CD1 C 3.363 3.778 -5.203 1.00 . A A . 35 TYR CD1 1 1 18 16670 1 1 35 TYR CD2 C 4.469 5.650 -4.139 1.00 . A A . 35 TYR CD2 1 1 18 16671 1 1 35 TYR CE1 C 2.949 4.614 -6.245 1.00 . A A . 35 TYR CE1 1 1 18 16672 1 1 35 TYR CE2 C 4.053 6.487 -5.179 1.00 . A A . 35 TYR CE2 1 1 18 16673 1 1 35 TYR CG C 4.121 4.292 -4.146 1.00 . A A . 35 TYR CG 1 1 18 16674 1 1 35 TYR CZ C 3.294 5.969 -6.234 1.00 . A A . 35 TYR CZ 1 1 18 16675 1 1 35 TYR H H 3.288 1.140 -4.572 1.00 . A A . 35 TYR H 1 1 18 16676 1 1 35 TYR HA H 3.863 1.824 -1.764 1.00 . A A . 35 TYR HA 1 1 18 16677 1 1 35 TYR HB2 H 4.687 3.994 -2.117 1.00 . A A . 35 TYR HB2 1 1 18 16678 1 1 35 TYR HB3 H 5.568 3.000 -3.263 1.00 . A A . 35 TYR HB3 1 1 18 16679 1 1 35 TYR HD1 H 3.089 2.741 -5.212 1.00 . A A . 35 TYR HD1 1 1 18 16680 1 1 35 TYR HD2 H 5.055 6.051 -3.326 1.00 . A A . 35 TYR HD2 1 1 18 16681 1 1 35 TYR HE1 H 2.364 4.213 -7.060 1.00 . A A . 35 TYR HE1 1 1 18 16682 1 1 35 TYR HE2 H 4.320 7.534 -5.170 1.00 . A A . 35 TYR HE2 1 1 18 16683 1 1 35 TYR HH H 3.325 7.643 -7.150 1.00 . A A . 35 TYR HH 1 1 18 16684 1 1 35 TYR N N 3.832 1.152 -3.761 1.00 . A A . 35 TYR N 1 1 18 16685 1 1 35 TYR O O 1.549 2.822 -3.773 1.00 . A A . 35 TYR O 1 1 18 16686 1 1 35 TYR OH O 2.888 6.796 -7.262 1.00 . A A . 35 TYR OH 1 1 18 16687 1 1 36 VAL C C 0.221 4.956 -1.665 1.00 . A A . 36 VAL C 1 1 18 16688 1 1 36 VAL CA C 0.227 3.435 -1.518 1.00 . A A . 36 VAL CA 1 1 18 16689 1 1 36 VAL CB C -0.386 3.019 -0.171 1.00 . A A . 36 VAL CB 1 1 18 16690 1 1 36 VAL CG1 C -1.538 3.955 0.206 1.00 . A A . 36 VAL CG1 1 1 18 16691 1 1 36 VAL CG2 C -0.923 1.590 -0.286 1.00 . A A . 36 VAL CG2 1 1 18 16692 1 1 36 VAL H H 2.162 2.862 -0.765 1.00 . A A . 36 VAL H 1 1 18 16693 1 1 36 VAL HA H -0.338 2.993 -2.327 1.00 . A A . 36 VAL HA 1 1 18 16694 1 1 36 VAL HB H 0.373 3.058 0.596 1.00 . A A . 36 VAL HB 1 1 18 16695 1 1 36 VAL HG11 H -1.907 4.447 -0.681 1.00 . A A . 36 VAL HG11 1 1 18 16696 1 1 36 VAL HG12 H -2.334 3.381 0.657 1.00 . A A . 36 VAL HG12 1 1 18 16697 1 1 36 VAL HG13 H -1.185 4.695 0.909 1.00 . A A . 36 VAL HG13 1 1 18 16698 1 1 36 VAL HG21 H -1.628 1.536 -1.103 1.00 . A A . 36 VAL HG21 1 1 18 16699 1 1 36 VAL HG22 H -0.105 0.911 -0.475 1.00 . A A . 36 VAL HG22 1 1 18 16700 1 1 36 VAL HG23 H -1.416 1.315 0.634 1.00 . A A . 36 VAL HG23 1 1 18 16701 1 1 36 VAL N N 1.639 2.969 -1.587 1.00 . A A . 36 VAL N 1 1 18 16702 1 1 36 VAL O O 0.327 5.685 -0.698 1.00 . A A . 36 VAL O 1 1 18 16703 1 1 37 LYS C C -1.279 7.446 -3.303 1.00 . A A . 37 LYS C 1 1 18 16704 1 1 37 LYS CA C 0.139 6.918 -3.080 1.00 . A A . 37 LYS CA 1 1 18 16705 1 1 37 LYS CB C 0.995 7.247 -4.303 1.00 . A A . 37 LYS CB 1 1 18 16706 1 1 37 LYS CD C 0.176 7.762 -6.607 1.00 . A A . 37 LYS CD 1 1 18 16707 1 1 37 LYS CE C -0.417 7.163 -7.885 1.00 . A A . 37 LYS CE 1 1 18 16708 1 1 37 LYS CG C 0.339 6.663 -5.555 1.00 . A A . 37 LYS CG 1 1 18 16709 1 1 37 LYS H H 0.054 4.829 -3.640 1.00 . A A . 37 LYS H 1 1 18 16710 1 1 37 LYS HA H 0.565 7.395 -2.210 1.00 . A A . 37 LYS HA 1 1 18 16711 1 1 37 LYS HB2 H 1.079 8.319 -4.405 1.00 . A A . 37 LYS HB2 1 1 18 16712 1 1 37 LYS HB3 H 1.976 6.818 -4.179 1.00 . A A . 37 LYS HB3 1 1 18 16713 1 1 37 LYS HD2 H -0.484 8.529 -6.226 1.00 . A A . 37 LYS HD2 1 1 18 16714 1 1 37 LYS HD3 H 1.140 8.195 -6.828 1.00 . A A . 37 LYS HD3 1 1 18 16715 1 1 37 LYS HE2 H -0.209 6.103 -7.914 1.00 . A A . 37 LYS HE2 1 1 18 16716 1 1 37 LYS HE3 H -1.485 7.321 -7.894 1.00 . A A . 37 LYS HE3 1 1 18 16717 1 1 37 LYS HG2 H 0.961 5.874 -5.953 1.00 . A A . 37 LYS HG2 1 1 18 16718 1 1 37 LYS HG3 H -0.632 6.263 -5.302 1.00 . A A . 37 LYS HG3 1 1 18 16719 1 1 37 LYS HZ1 H 1.190 8.051 -8.869 1.00 . A A . 37 LYS HZ1 1 1 18 16720 1 1 37 LYS HZ2 H 0.146 7.180 -9.889 1.00 . A A . 37 LYS HZ2 1 1 18 16721 1 1 37 LYS HZ3 H -0.325 8.696 -9.291 1.00 . A A . 37 LYS HZ3 1 1 18 16722 1 1 37 LYS N N 0.122 5.440 -2.871 1.00 . A A . 37 LYS N 1 1 18 16723 1 1 37 LYS NZ N 0.195 7.823 -9.073 1.00 . A A . 37 LYS NZ 1 1 18 16724 1 1 37 LYS O O -1.498 8.640 -3.359 1.00 . A A . 37 LYS O 1 1 18 16725 1 1 38 ASP C C -4.613 6.240 -2.833 1.00 . A A . 38 ASP C 1 1 18 16726 1 1 38 ASP CA C -3.630 7.065 -3.665 1.00 . A A . 38 ASP CA 1 1 18 16727 1 1 38 ASP CB C -3.974 6.932 -5.150 1.00 . A A . 38 ASP CB 1 1 18 16728 1 1 38 ASP CG C -5.416 7.382 -5.385 1.00 . A A . 38 ASP CG 1 1 18 16729 1 1 38 ASP H H -2.053 5.620 -3.397 1.00 . A A . 38 ASP H 1 1 18 16730 1 1 38 ASP HA H -3.699 8.103 -3.375 1.00 . A A . 38 ASP HA 1 1 18 16731 1 1 38 ASP HB2 H -3.304 7.550 -5.731 1.00 . A A . 38 ASP HB2 1 1 18 16732 1 1 38 ASP HB3 H -3.867 5.903 -5.454 1.00 . A A . 38 ASP HB3 1 1 18 16733 1 1 38 ASP N N -2.242 6.581 -3.438 1.00 . A A . 38 ASP N 1 1 18 16734 1 1 38 ASP O O -5.082 5.202 -3.256 1.00 . A A . 38 ASP O 1 1 18 16735 1 1 38 ASP OD1 O -6.104 7.633 -4.408 1.00 . A A . 38 ASP OD1 1 1 18 16736 1 1 38 ASP OD2 O -5.809 7.468 -6.536 1.00 . A A . 38 ASP OD2 1 1 18 16737 1 1 39 VAL C C -7.221 5.795 -1.557 1.00 . A A . 39 VAL C 1 1 18 16738 1 1 39 VAL CA C -5.901 5.948 -0.802 1.00 . A A . 39 VAL CA 1 1 18 16739 1 1 39 VAL CB C -6.141 6.718 0.497 1.00 . A A . 39 VAL CB 1 1 18 16740 1 1 39 VAL CG1 C -4.803 6.986 1.189 1.00 . A A . 39 VAL CG1 1 1 18 16741 1 1 39 VAL CG2 C -6.824 8.049 0.177 1.00 . A A . 39 VAL CG2 1 1 18 16742 1 1 39 VAL H H -4.556 7.544 -1.335 1.00 . A A . 39 VAL H 1 1 18 16743 1 1 39 VAL HA H -5.497 4.972 -0.576 1.00 . A A . 39 VAL HA 1 1 18 16744 1 1 39 VAL HB H -6.773 6.134 1.150 1.00 . A A . 39 VAL HB 1 1 18 16745 1 1 39 VAL HG11 H -4.072 6.268 0.847 1.00 . A A . 39 VAL HG11 1 1 18 16746 1 1 39 VAL HG12 H -4.466 7.985 0.948 1.00 . A A . 39 VAL HG12 1 1 18 16747 1 1 39 VAL HG13 H -4.926 6.895 2.258 1.00 . A A . 39 VAL HG13 1 1 18 16748 1 1 39 VAL HG21 H -6.557 8.360 -0.822 1.00 . A A . 39 VAL HG21 1 1 18 16749 1 1 39 VAL HG22 H -7.896 7.928 0.242 1.00 . A A . 39 VAL HG22 1 1 18 16750 1 1 39 VAL HG23 H -6.503 8.799 0.887 1.00 . A A . 39 VAL HG23 1 1 18 16751 1 1 39 VAL N N -4.938 6.701 -1.655 1.00 . A A . 39 VAL N 1 1 18 16752 1 1 39 VAL O O -7.949 4.840 -1.374 1.00 . A A . 39 VAL O 1 1 18 16753 1 1 40 GLU C C -8.640 5.621 -4.309 1.00 . A A . 40 GLU C 1 1 18 16754 1 1 40 GLU CA C -8.802 6.648 -3.187 1.00 . A A . 40 GLU CA 1 1 18 16755 1 1 40 GLU CB C -9.123 8.017 -3.790 1.00 . A A . 40 GLU CB 1 1 18 16756 1 1 40 GLU CD C -11.297 9.250 -3.619 1.00 . A A . 40 GLU CD 1 1 18 16757 1 1 40 GLU CG C -10.059 8.783 -2.849 1.00 . A A . 40 GLU CG 1 1 18 16758 1 1 40 GLU H H -6.929 7.493 -2.544 1.00 . A A . 40 GLU H 1 1 18 16759 1 1 40 GLU HA H -9.606 6.345 -2.531 1.00 . A A . 40 GLU HA 1 1 18 16760 1 1 40 GLU HB2 H -8.207 8.575 -3.921 1.00 . A A . 40 GLU HB2 1 1 18 16761 1 1 40 GLU HB3 H -9.603 7.884 -4.746 1.00 . A A . 40 GLU HB3 1 1 18 16762 1 1 40 GLU HG2 H -10.362 8.135 -2.040 1.00 . A A . 40 GLU HG2 1 1 18 16763 1 1 40 GLU HG3 H -9.542 9.642 -2.449 1.00 . A A . 40 GLU HG3 1 1 18 16764 1 1 40 GLU N N -7.533 6.732 -2.411 1.00 . A A . 40 GLU N 1 1 18 16765 1 1 40 GLU O O -9.606 5.143 -4.872 1.00 . A A . 40 GLU O 1 1 18 16766 1 1 40 GLU OE1 O -11.443 8.858 -4.766 1.00 . A A . 40 GLU OE1 1 1 18 16767 1 1 40 GLU OE2 O -12.079 9.992 -3.048 1.00 . A A . 40 GLU OE2 1 1 18 16768 1 1 41 GLY C C -7.663 2.897 -5.251 1.00 . A A . 41 GLY C 1 1 18 16769 1 1 41 GLY CA C -7.204 4.278 -5.725 1.00 . A A . 41 GLY CA 1 1 18 16770 1 1 41 GLY H H -6.658 5.670 -4.174 1.00 . A A . 41 GLY H 1 1 18 16771 1 1 41 GLY HA2 H -7.771 4.565 -6.599 1.00 . A A . 41 GLY HA2 1 1 18 16772 1 1 41 GLY HA3 H -6.154 4.239 -5.973 1.00 . A A . 41 GLY HA3 1 1 18 16773 1 1 41 GLY N N -7.425 5.275 -4.640 1.00 . A A . 41 GLY N 1 1 18 16774 1 1 41 GLY O O -7.724 1.955 -6.015 1.00 . A A . 41 GLY O 1 1 18 16775 1 1 42 ALA C C -9.312 1.673 -2.231 1.00 . A A . 42 ALA C 1 1 18 16776 1 1 42 ALA CA C -8.439 1.452 -3.469 1.00 . A A . 42 ALA CA 1 1 18 16777 1 1 42 ALA CB C -7.222 0.606 -3.093 1.00 . A A . 42 ALA CB 1 1 18 16778 1 1 42 ALA H H -7.928 3.542 -3.392 1.00 . A A . 42 ALA H 1 1 18 16779 1 1 42 ALA HA H -9.013 0.941 -4.228 1.00 . A A . 42 ALA HA 1 1 18 16780 1 1 42 ALA HB1 H -6.395 0.859 -3.741 1.00 . A A . 42 ALA HB1 1 1 18 16781 1 1 42 ALA HB2 H -6.950 0.803 -2.067 1.00 . A A . 42 ALA HB2 1 1 18 16782 1 1 42 ALA HB3 H -7.461 -0.440 -3.209 1.00 . A A . 42 ALA HB3 1 1 18 16783 1 1 42 ALA N N -7.985 2.771 -3.993 1.00 . A A . 42 ALA N 1 1 18 16784 1 1 42 ALA O O -8.876 2.229 -1.243 1.00 . A A . 42 ALA O 1 1 18 16785 1 1 43 SER C C -10.747 0.959 0.167 1.00 . A A . 43 SER C 1 1 18 16786 1 1 43 SER CA C -11.446 1.433 -1.111 1.00 . A A . 43 SER CA 1 1 18 16787 1 1 43 SER CB C -12.728 0.625 -1.321 1.00 . A A . 43 SER CB 1 1 18 16788 1 1 43 SER H H -10.875 0.801 -3.088 1.00 . A A . 43 SER H 1 1 18 16789 1 1 43 SER HA H -11.694 2.480 -1.016 1.00 . A A . 43 SER HA 1 1 18 16790 1 1 43 SER HB2 H -12.776 -0.170 -0.597 1.00 . A A . 43 SER HB2 1 1 18 16791 1 1 43 SER HB3 H -13.584 1.275 -1.199 1.00 . A A . 43 SER HB3 1 1 18 16792 1 1 43 SER HG H -13.108 -0.809 -2.579 1.00 . A A . 43 SER HG 1 1 18 16793 1 1 43 SER N N -10.543 1.244 -2.280 1.00 . A A . 43 SER N 1 1 18 16794 1 1 43 SER O O -9.654 0.425 0.129 1.00 . A A . 43 SER O 1 1 18 16795 1 1 43 SER OG O -12.721 0.067 -2.629 1.00 . A A . 43 SER OG 1 1 18 16796 1 1 44 GLN C C -10.706 -0.808 2.633 1.00 . A A . 44 GLN C 1 1 18 16797 1 1 44 GLN CA C -10.757 0.720 2.581 1.00 . A A . 44 GLN CA 1 1 18 16798 1 1 44 GLN CB C -11.593 1.246 3.750 1.00 . A A . 44 GLN CB 1 1 18 16799 1 1 44 GLN CD C -11.816 -0.255 5.735 1.00 . A A . 44 GLN CD 1 1 18 16800 1 1 44 GLN CG C -10.952 0.818 5.072 1.00 . A A . 44 GLN CG 1 1 18 16801 1 1 44 GLN H H -12.252 1.587 1.299 1.00 . A A . 44 GLN H 1 1 18 16802 1 1 44 GLN HA H -9.754 1.116 2.650 1.00 . A A . 44 GLN HA 1 1 18 16803 1 1 44 GLN HB2 H -11.639 2.324 3.704 1.00 . A A . 44 GLN HB2 1 1 18 16804 1 1 44 GLN HB3 H -12.592 0.840 3.690 1.00 . A A . 44 GLN HB3 1 1 18 16805 1 1 44 GLN HE21 H -10.262 -1.334 6.337 1.00 . A A . 44 GLN HE21 1 1 18 16806 1 1 44 GLN HE22 H -11.785 -1.961 6.749 1.00 . A A . 44 GLN HE22 1 1 18 16807 1 1 44 GLN HG2 H -9.965 0.421 4.881 1.00 . A A . 44 GLN HG2 1 1 18 16808 1 1 44 GLN HG3 H -10.876 1.673 5.729 1.00 . A A . 44 GLN HG3 1 1 18 16809 1 1 44 GLN N N -11.374 1.153 1.296 1.00 . A A . 44 GLN N 1 1 18 16810 1 1 44 GLN NE2 N -11.240 -1.267 6.322 1.00 . A A . 44 GLN NE2 1 1 18 16811 1 1 44 GLN O O -9.722 -1.389 3.041 1.00 . A A . 44 GLN O 1 1 18 16812 1 1 44 GLN OE1 O -13.029 -0.172 5.717 1.00 . A A . 44 GLN OE1 1 1 18 16813 1 1 45 GLU C C -10.716 -3.463 1.232 1.00 . A A . 45 GLU C 1 1 18 16814 1 1 45 GLU CA C -11.746 -2.956 2.242 1.00 . A A . 45 GLU CA 1 1 18 16815 1 1 45 GLU CB C -13.133 -3.483 1.867 1.00 . A A . 45 GLU CB 1 1 18 16816 1 1 45 GLU CD C -14.014 -3.209 4.189 1.00 . A A . 45 GLU CD 1 1 18 16817 1 1 45 GLU CG C -14.193 -2.794 2.727 1.00 . A A . 45 GLU CG 1 1 18 16818 1 1 45 GLU H H -12.539 -0.983 1.887 1.00 . A A . 45 GLU H 1 1 18 16819 1 1 45 GLU HA H -11.483 -3.301 3.231 1.00 . A A . 45 GLU HA 1 1 18 16820 1 1 45 GLU HB2 H -13.325 -3.277 0.822 1.00 . A A . 45 GLU HB2 1 1 18 16821 1 1 45 GLU HB3 H -13.172 -4.549 2.036 1.00 . A A . 45 GLU HB3 1 1 18 16822 1 1 45 GLU HG2 H -14.086 -1.722 2.641 1.00 . A A . 45 GLU HG2 1 1 18 16823 1 1 45 GLU HG3 H -15.176 -3.086 2.389 1.00 . A A . 45 GLU HG3 1 1 18 16824 1 1 45 GLU N N -11.754 -1.466 2.219 1.00 . A A . 45 GLU N 1 1 18 16825 1 1 45 GLU O O -10.320 -4.614 1.250 1.00 . A A . 45 GLU O 1 1 18 16826 1 1 45 GLU OE1 O -14.059 -4.399 4.456 1.00 . A A . 45 GLU OE1 1 1 18 16827 1 1 45 GLU OE2 O -13.837 -2.330 5.016 1.00 . A A . 45 GLU OE2 1 1 18 16828 1 1 46 GLU C C -7.891 -2.614 -0.066 1.00 . A A . 46 GLU C 1 1 18 16829 1 1 46 GLU CA C -9.236 -3.008 -0.630 1.00 . A A . 46 GLU CA 1 1 18 16830 1 1 46 GLU CB C -9.475 -2.258 -1.938 1.00 . A A . 46 GLU CB 1 1 18 16831 1 1 46 GLU CD C -11.054 -2.167 -3.874 1.00 . A A . 46 GLU CD 1 1 18 16832 1 1 46 GLU CG C -10.928 -2.443 -2.374 1.00 . A A . 46 GLU CG 1 1 18 16833 1 1 46 GLU H H -10.563 -1.667 0.394 1.00 . A A . 46 GLU H 1 1 18 16834 1 1 46 GLU HA H -9.276 -4.074 -0.795 1.00 . A A . 46 GLU HA 1 1 18 16835 1 1 46 GLU HB2 H -9.275 -1.206 -1.790 1.00 . A A . 46 GLU HB2 1 1 18 16836 1 1 46 GLU HB3 H -8.818 -2.644 -2.697 1.00 . A A . 46 GLU HB3 1 1 18 16837 1 1 46 GLU HG2 H -11.239 -3.456 -2.165 1.00 . A A . 46 GLU HG2 1 1 18 16838 1 1 46 GLU HG3 H -11.553 -1.754 -1.828 1.00 . A A . 46 GLU HG3 1 1 18 16839 1 1 46 GLU N N -10.256 -2.599 0.368 1.00 . A A . 46 GLU N 1 1 18 16840 1 1 46 GLU O O -6.932 -3.360 -0.090 1.00 . A A . 46 GLU O 1 1 18 16841 1 1 46 GLU OE1 O -10.031 -2.126 -4.537 1.00 . A A . 46 GLU OE1 1 1 18 16842 1 1 46 GLU OE2 O -12.172 -2.003 -4.333 1.00 . A A . 46 GLU OE2 1 1 18 16843 1 1 47 VAL C C -6.195 -1.938 2.194 1.00 . A A . 47 VAL C 1 1 18 16844 1 1 47 VAL CA C -6.593 -0.952 1.096 1.00 . A A . 47 VAL CA 1 1 18 16845 1 1 47 VAL CB C -6.854 0.420 1.708 1.00 . A A . 47 VAL CB 1 1 18 16846 1 1 47 VAL CG1 C -5.667 0.816 2.570 1.00 . A A . 47 VAL CG1 1 1 18 16847 1 1 47 VAL CG2 C -7.048 1.449 0.594 1.00 . A A . 47 VAL CG2 1 1 18 16848 1 1 47 VAL H H -8.642 -0.891 0.493 1.00 . A A . 47 VAL H 1 1 18 16849 1 1 47 VAL HA H -5.810 -0.887 0.355 1.00 . A A . 47 VAL HA 1 1 18 16850 1 1 47 VAL HB H -7.742 0.376 2.322 1.00 . A A . 47 VAL HB 1 1 18 16851 1 1 47 VAL HG11 H -5.441 0.011 3.254 1.00 . A A . 47 VAL HG11 1 1 18 16852 1 1 47 VAL HG12 H -4.814 1.005 1.938 1.00 . A A . 47 VAL HG12 1 1 18 16853 1 1 47 VAL HG13 H -5.912 1.708 3.126 1.00 . A A . 47 VAL HG13 1 1 18 16854 1 1 47 VAL HG21 H -7.473 0.966 -0.273 1.00 . A A . 47 VAL HG21 1 1 18 16855 1 1 47 VAL HG22 H -7.714 2.227 0.935 1.00 . A A . 47 VAL HG22 1 1 18 16856 1 1 47 VAL HG23 H -6.093 1.881 0.333 1.00 . A A . 47 VAL HG23 1 1 18 16857 1 1 47 VAL N N -7.843 -1.439 0.475 1.00 . A A . 47 VAL N 1 1 18 16858 1 1 47 VAL O O -5.083 -2.424 2.242 1.00 . A A . 47 VAL O 1 1 18 16859 1 1 48 GLU C C -6.593 -4.578 3.579 1.00 . A A . 48 GLU C 1 1 18 16860 1 1 48 GLU CA C -6.845 -3.186 4.160 1.00 . A A . 48 GLU CA 1 1 18 16861 1 1 48 GLU CB C -8.090 -3.204 5.030 1.00 . A A . 48 GLU CB 1 1 18 16862 1 1 48 GLU CD C -8.474 -3.632 7.456 1.00 . A A . 48 GLU CD 1 1 18 16863 1 1 48 GLU CG C -7.733 -2.761 6.440 1.00 . A A . 48 GLU CG 1 1 18 16864 1 1 48 GLU H H -8.001 -1.847 3.016 1.00 . A A . 48 GLU H 1 1 18 16865 1 1 48 GLU HA H -5.996 -2.860 4.740 1.00 . A A . 48 GLU HA 1 1 18 16866 1 1 48 GLU HB2 H -8.820 -2.522 4.616 1.00 . A A . 48 GLU HB2 1 1 18 16867 1 1 48 GLU HB3 H -8.498 -4.190 5.045 1.00 . A A . 48 GLU HB3 1 1 18 16868 1 1 48 GLU HG2 H -6.668 -2.858 6.583 1.00 . A A . 48 GLU HG2 1 1 18 16869 1 1 48 GLU HG3 H -8.022 -1.730 6.568 1.00 . A A . 48 GLU HG3 1 1 18 16870 1 1 48 GLU N N -7.113 -2.241 3.072 1.00 . A A . 48 GLU N 1 1 18 16871 1 1 48 GLU O O -5.596 -5.212 3.869 1.00 . A A . 48 GLU O 1 1 18 16872 1 1 48 GLU OE1 O -9.675 -3.461 7.588 1.00 . A A . 48 GLU OE1 1 1 18 16873 1 1 48 GLU OE2 O -7.829 -4.455 8.084 1.00 . A A . 48 GLU OE2 1 1 18 16874 1 1 49 GLU C C -5.869 -6.519 1.614 1.00 . A A . 49 GLU C 1 1 18 16875 1 1 49 GLU CA C -7.293 -6.412 2.161 1.00 . A A . 49 GLU CA 1 1 18 16876 1 1 49 GLU CB C -8.300 -6.624 1.029 1.00 . A A . 49 GLU CB 1 1 18 16877 1 1 49 GLU CD C -10.525 -7.602 0.449 1.00 . A A . 49 GLU CD 1 1 18 16878 1 1 49 GLU CG C -9.585 -7.230 1.597 1.00 . A A . 49 GLU CG 1 1 18 16879 1 1 49 GLU H H -8.285 -4.536 2.536 1.00 . A A . 49 GLU H 1 1 18 16880 1 1 49 GLU HA H -7.441 -7.165 2.921 1.00 . A A . 49 GLU HA 1 1 18 16881 1 1 49 GLU HB2 H -8.524 -5.675 0.564 1.00 . A A . 49 GLU HB2 1 1 18 16882 1 1 49 GLU HB3 H -7.882 -7.296 0.295 1.00 . A A . 49 GLU HB3 1 1 18 16883 1 1 49 GLU HG2 H -9.344 -8.115 2.168 1.00 . A A . 49 GLU HG2 1 1 18 16884 1 1 49 GLU HG3 H -10.072 -6.510 2.238 1.00 . A A . 49 GLU HG3 1 1 18 16885 1 1 49 GLU N N -7.489 -5.062 2.758 1.00 . A A . 49 GLU N 1 1 18 16886 1 1 49 GLU O O -5.163 -7.471 1.880 1.00 . A A . 49 GLU O 1 1 18 16887 1 1 49 GLU OE1 O -10.784 -6.745 -0.379 1.00 . A A . 49 GLU OE1 1 1 18 16888 1 1 49 GLU OE2 O -10.966 -8.738 0.417 1.00 . A A . 49 GLU OE2 1 1 18 16889 1 1 50 ALA C C -3.053 -5.499 1.460 1.00 . A A . 50 ALA C 1 1 18 16890 1 1 50 ALA CA C -4.053 -5.595 0.307 1.00 . A A . 50 ALA CA 1 1 18 16891 1 1 50 ALA CB C -3.834 -4.419 -0.649 1.00 . A A . 50 ALA CB 1 1 18 16892 1 1 50 ALA H H -6.018 -4.783 0.659 1.00 . A A . 50 ALA H 1 1 18 16893 1 1 50 ALA HA H -3.906 -6.524 -0.223 1.00 . A A . 50 ALA HA 1 1 18 16894 1 1 50 ALA HB1 H -4.070 -3.495 -0.143 1.00 . A A . 50 ALA HB1 1 1 18 16895 1 1 50 ALA HB2 H -2.801 -4.402 -0.966 1.00 . A A . 50 ALA HB2 1 1 18 16896 1 1 50 ALA HB3 H -4.472 -4.532 -1.511 1.00 . A A . 50 ALA HB3 1 1 18 16897 1 1 50 ALA N N -5.436 -5.546 0.859 1.00 . A A . 50 ALA N 1 1 18 16898 1 1 50 ALA O O -1.920 -5.926 1.351 1.00 . A A . 50 ALA O 1 1 18 16899 1 1 51 MET C C -2.397 -6.168 4.416 1.00 . A A . 51 MET C 1 1 18 16900 1 1 51 MET CA C -2.539 -4.811 3.725 1.00 . A A . 51 MET CA 1 1 18 16901 1 1 51 MET CB C -3.101 -3.789 4.718 1.00 . A A . 51 MET CB 1 1 18 16902 1 1 51 MET CE C -3.205 -0.906 6.083 1.00 . A A . 51 MET CE 1 1 18 16903 1 1 51 MET CG C -1.975 -3.283 5.622 1.00 . A A . 51 MET CG 1 1 18 16904 1 1 51 MET H H -4.382 -4.599 2.630 1.00 . A A . 51 MET H 1 1 18 16905 1 1 51 MET HA H -1.571 -4.480 3.379 1.00 . A A . 51 MET HA 1 1 18 16906 1 1 51 MET HB2 H -3.529 -2.959 4.175 1.00 . A A . 51 MET HB2 1 1 18 16907 1 1 51 MET HB3 H -3.863 -4.257 5.322 1.00 . A A . 51 MET HB3 1 1 18 16908 1 1 51 MET HE1 H -2.552 -0.769 5.235 1.00 . A A . 51 MET HE1 1 1 18 16909 1 1 51 MET HE2 H -4.218 -1.043 5.736 1.00 . A A . 51 MET HE2 1 1 18 16910 1 1 51 MET HE3 H -3.150 -0.036 6.722 1.00 . A A . 51 MET HE3 1 1 18 16911 1 1 51 MET HG2 H -1.408 -4.123 5.995 1.00 . A A . 51 MET HG2 1 1 18 16912 1 1 51 MET HG3 H -1.326 -2.631 5.057 1.00 . A A . 51 MET HG3 1 1 18 16913 1 1 51 MET N N -3.464 -4.938 2.565 1.00 . A A . 51 MET N 1 1 18 16914 1 1 51 MET O O -1.503 -6.379 5.212 1.00 . A A . 51 MET O 1 1 18 16915 1 1 51 MET SD S -2.685 -2.368 7.014 1.00 . A A . 51 MET SD 1 1 18 16916 1 1 52 ASP C C -2.477 -9.411 3.818 1.00 . A A . 52 ASP C 1 1 18 16917 1 1 52 ASP CA C -3.182 -8.433 4.761 1.00 . A A . 52 ASP CA 1 1 18 16918 1 1 52 ASP CB C -4.591 -8.946 5.067 1.00 . A A . 52 ASP CB 1 1 18 16919 1 1 52 ASP CG C -4.505 -10.350 5.670 1.00 . A A . 52 ASP CG 1 1 18 16920 1 1 52 ASP H H -3.986 -6.902 3.476 1.00 . A A . 52 ASP H 1 1 18 16921 1 1 52 ASP HA H -2.621 -8.355 5.682 1.00 . A A . 52 ASP HA 1 1 18 16922 1 1 52 ASP HB2 H -5.072 -8.280 5.769 1.00 . A A . 52 ASP HB2 1 1 18 16923 1 1 52 ASP HB3 H -5.166 -8.983 4.154 1.00 . A A . 52 ASP HB3 1 1 18 16924 1 1 52 ASP N N -3.271 -7.092 4.119 1.00 . A A . 52 ASP N 1 1 18 16925 1 1 52 ASP O O -1.898 -10.389 4.245 1.00 . A A . 52 ASP O 1 1 18 16926 1 1 52 ASP OD1 O -3.927 -10.479 6.735 1.00 . A A . 52 ASP OD1 1 1 18 16927 1 1 52 ASP OD2 O -5.018 -11.269 5.054 1.00 . A A . 52 ASP OD2 1 1 18 16928 1 1 53 THR C C -0.347 -9.889 1.620 1.00 . A A . 53 THR C 1 1 18 16929 1 1 53 THR CA C -1.866 -10.085 1.573 1.00 . A A . 53 THR CA 1 1 18 16930 1 1 53 THR CB C -2.371 -9.795 0.157 1.00 . A A . 53 THR CB 1 1 18 16931 1 1 53 THR CG2 C -2.722 -11.110 -0.539 1.00 . A A . 53 THR CG2 1 1 18 16932 1 1 53 THR H H -3.006 -8.370 2.210 1.00 . A A . 53 THR H 1 1 18 16933 1 1 53 THR HA H -2.103 -11.105 1.835 1.00 . A A . 53 THR HA 1 1 18 16934 1 1 53 THR HB H -1.599 -9.291 -0.403 1.00 . A A . 53 THR HB 1 1 18 16935 1 1 53 THR HG1 H -4.254 -9.504 0.550 1.00 . A A . 53 THR HG1 1 1 18 16936 1 1 53 THR HG21 H -2.685 -11.917 0.178 1.00 . A A . 53 THR HG21 1 1 18 16937 1 1 53 THR HG22 H -3.716 -11.043 -0.955 1.00 . A A . 53 THR HG22 1 1 18 16938 1 1 53 THR HG23 H -2.013 -11.298 -1.331 1.00 . A A . 53 THR HG23 1 1 18 16939 1 1 53 THR N N -2.528 -9.161 2.537 1.00 . A A . 53 THR N 1 1 18 16940 1 1 53 THR O O 0.408 -10.740 1.192 1.00 . A A . 53 THR O 1 1 18 16941 1 1 53 THR OG1 O -3.525 -8.968 0.228 1.00 . A A . 53 THR OG1 1 1 18 16942 1 1 54 CYS C C 2.208 -9.467 3.236 1.00 . A A . 54 CYS C 1 1 18 16943 1 1 54 CYS CA C 1.581 -8.542 2.192 1.00 . A A . 54 CYS CA 1 1 18 16944 1 1 54 CYS CB C 1.859 -7.087 2.583 1.00 . A A . 54 CYS CB 1 1 18 16945 1 1 54 CYS H H -0.512 -8.100 2.468 1.00 . A A . 54 CYS H 1 1 18 16946 1 1 54 CYS HA H 2.019 -8.743 1.226 1.00 . A A . 54 CYS HA 1 1 18 16947 1 1 54 CYS HB2 H 1.193 -6.430 2.047 1.00 . A A . 54 CYS HB2 1 1 18 16948 1 1 54 CYS HB3 H 1.703 -6.965 3.646 1.00 . A A . 54 CYS HB3 1 1 18 16949 1 1 54 CYS N N 0.110 -8.778 2.130 1.00 . A A . 54 CYS N 1 1 18 16950 1 1 54 CYS O O 1.612 -9.746 4.258 1.00 . A A . 54 CYS O 1 1 18 16951 1 1 54 CYS SG S 3.572 -6.549 2.233 1.00 . A A . 54 CYS SG 1 1 18 16952 1 1 55 PRO C C 4.620 -9.987 5.085 1.00 . A A . 55 PRO C 1 1 18 16953 1 1 55 PRO CA C 4.134 -10.796 3.882 1.00 . A A . 55 PRO CA 1 1 18 16954 1 1 55 PRO CB C 5.306 -11.315 3.049 1.00 . A A . 55 PRO CB 1 1 18 16955 1 1 55 PRO CD C 4.182 -9.607 1.738 1.00 . A A . 55 PRO CD 1 1 18 16956 1 1 55 PRO CG C 5.516 -10.278 1.986 1.00 . A A . 55 PRO CG 1 1 18 16957 1 1 55 PRO HA H 3.508 -11.615 4.197 1.00 . A A . 55 PRO HA 1 1 18 16958 1 1 55 PRO HB2 H 6.173 -11.429 3.688 1.00 . A A . 55 PRO HB2 1 1 18 16959 1 1 55 PRO HB3 H 5.047 -12.270 2.622 1.00 . A A . 55 PRO HB3 1 1 18 16960 1 1 55 PRO HD2 H 4.315 -8.540 1.616 1.00 . A A . 55 PRO HD2 1 1 18 16961 1 1 55 PRO HD3 H 3.701 -10.030 0.871 1.00 . A A . 55 PRO HD3 1 1 18 16962 1 1 55 PRO HG2 H 6.241 -9.552 2.324 1.00 . A A . 55 PRO HG2 1 1 18 16963 1 1 55 PRO HG3 H 5.859 -10.751 1.079 1.00 . A A . 55 PRO HG3 1 1 18 16964 1 1 55 PRO N N 3.404 -9.903 2.946 1.00 . A A . 55 PRO N 1 1 18 16965 1 1 55 PRO O O 3.944 -9.889 6.090 1.00 . A A . 55 PRO O 1 1 18 16966 1 1 56 VAL C C 5.213 -7.511 6.455 1.00 . A A . 56 VAL C 1 1 18 16967 1 1 56 VAL CA C 6.271 -8.567 6.129 1.00 . A A . 56 VAL CA 1 1 18 16968 1 1 56 VAL CB C 7.583 -7.882 5.736 1.00 . A A . 56 VAL CB 1 1 18 16969 1 1 56 VAL CG1 C 8.659 -8.941 5.486 1.00 . A A . 56 VAL CG1 1 1 18 16970 1 1 56 VAL CG2 C 7.367 -7.064 4.462 1.00 . A A . 56 VAL CG2 1 1 18 16971 1 1 56 VAL H H 6.302 -9.458 4.169 1.00 . A A . 56 VAL H 1 1 18 16972 1 1 56 VAL HA H 6.432 -9.199 6.990 1.00 . A A . 56 VAL HA 1 1 18 16973 1 1 56 VAL HB H 7.901 -7.229 6.537 1.00 . A A . 56 VAL HB 1 1 18 16974 1 1 56 VAL HG11 H 8.189 -9.887 5.258 1.00 . A A . 56 VAL HG11 1 1 18 16975 1 1 56 VAL HG12 H 9.275 -8.636 4.651 1.00 . A A . 56 VAL HG12 1 1 18 16976 1 1 56 VAL HG13 H 9.274 -9.046 6.366 1.00 . A A . 56 VAL HG13 1 1 18 16977 1 1 56 VAL HG21 H 6.673 -7.582 3.816 1.00 . A A . 56 VAL HG21 1 1 18 16978 1 1 56 VAL HG22 H 6.967 -6.095 4.719 1.00 . A A . 56 VAL HG22 1 1 18 16979 1 1 56 VAL HG23 H 8.310 -6.941 3.950 1.00 . A A . 56 VAL HG23 1 1 18 16980 1 1 56 VAL N N 5.775 -9.384 4.990 1.00 . A A . 56 VAL N 1 1 18 16981 1 1 56 VAL O O 5.042 -7.112 7.589 1.00 . A A . 56 VAL O 1 1 18 16982 1 1 57 GLN C C 4.042 -4.706 6.059 1.00 . A A . 57 GLN C 1 1 18 16983 1 1 57 GLN CA C 3.423 -6.055 5.686 1.00 . A A . 57 GLN CA 1 1 18 16984 1 1 57 GLN CB C 2.511 -6.524 6.821 1.00 . A A . 57 GLN CB 1 1 18 16985 1 1 57 GLN CD C 0.130 -6.917 7.474 1.00 . A A . 57 GLN CD 1 1 18 16986 1 1 57 GLN CG C 1.052 -6.249 6.451 1.00 . A A . 57 GLN CG 1 1 18 16987 1 1 57 GLN H H 4.644 -7.421 4.556 1.00 . A A . 57 GLN H 1 1 18 16988 1 1 57 GLN HA H 2.838 -5.946 4.782 1.00 . A A . 57 GLN HA 1 1 18 16989 1 1 57 GLN HB2 H 2.650 -7.584 6.980 1.00 . A A . 57 GLN HB2 1 1 18 16990 1 1 57 GLN HB3 H 2.757 -5.990 7.725 1.00 . A A . 57 GLN HB3 1 1 18 16991 1 1 57 GLN HE21 H -0.298 -8.458 6.296 1.00 . A A . 57 GLN HE21 1 1 18 16992 1 1 57 GLN HE22 H -1.044 -8.481 7.819 1.00 . A A . 57 GLN HE22 1 1 18 16993 1 1 57 GLN HG2 H 0.877 -5.183 6.449 1.00 . A A . 57 GLN HG2 1 1 18 16994 1 1 57 GLN HG3 H 0.848 -6.649 5.469 1.00 . A A . 57 GLN HG3 1 1 18 16995 1 1 57 GLN N N 4.491 -7.071 5.459 1.00 . A A . 57 GLN N 1 1 18 16996 1 1 57 GLN NE2 N -0.453 -8.046 7.171 1.00 . A A . 57 GLN NE2 1 1 18 16997 1 1 57 GLN O O 3.676 -4.100 7.046 1.00 . A A . 57 GLN O 1 1 18 16998 1 1 57 GLN OE1 O -0.061 -6.408 8.560 1.00 . A A . 57 GLN OE1 1 1 18 16999 1 1 58 CYS C C 4.524 -1.804 5.401 1.00 . A A . 58 CYS C 1 1 18 17000 1 1 58 CYS CA C 5.579 -2.899 5.589 1.00 . A A . 58 CYS CA 1 1 18 17001 1 1 58 CYS CB C 6.753 -2.643 4.640 1.00 . A A . 58 CYS CB 1 1 18 17002 1 1 58 CYS H H 5.240 -4.713 4.474 1.00 . A A . 58 CYS H 1 1 18 17003 1 1 58 CYS HA H 5.931 -2.897 6.609 1.00 . A A . 58 CYS HA 1 1 18 17004 1 1 58 CYS HB2 H 7.125 -3.585 4.265 1.00 . A A . 58 CYS HB2 1 1 18 17005 1 1 58 CYS HB3 H 6.422 -2.033 3.814 1.00 . A A . 58 CYS HB3 1 1 18 17006 1 1 58 CYS HG H 8.196 -0.923 5.125 1.00 . A A . 58 CYS HG 1 1 18 17007 1 1 58 CYS N N 4.963 -4.219 5.273 1.00 . A A . 58 CYS N 1 1 18 17008 1 1 58 CYS O O 4.633 -0.968 4.527 1.00 . A A . 58 CYS O 1 1 18 17009 1 1 58 CYS SG S 8.075 -1.785 5.531 1.00 . A A . 58 CYS SG 1 1 18 17010 1 1 59 ILE C C 2.104 -0.157 7.425 1.00 . A A . 59 ILE C 1 1 18 17011 1 1 59 ILE CA C 2.427 -0.780 6.063 1.00 . A A . 59 ILE CA 1 1 18 17012 1 1 59 ILE CB C 1.166 -1.440 5.500 1.00 . A A . 59 ILE CB 1 1 18 17013 1 1 59 ILE CD1 C -0.403 -0.268 3.947 1.00 . A A . 59 ILE CD1 1 1 18 17014 1 1 59 ILE CG1 C 0.042 -0.406 5.403 1.00 . A A . 59 ILE CG1 1 1 18 17015 1 1 59 ILE CG2 C 0.733 -2.574 6.431 1.00 . A A . 59 ILE CG2 1 1 18 17016 1 1 59 ILE H H 3.420 -2.501 6.901 1.00 . A A . 59 ILE H 1 1 18 17017 1 1 59 ILE HA H 2.761 -0.009 5.386 1.00 . A A . 59 ILE HA 1 1 18 17018 1 1 59 ILE HB H 1.376 -1.844 4.518 1.00 . A A . 59 ILE HB 1 1 18 17019 1 1 59 ILE HD11 H -0.470 -1.249 3.497 1.00 . A A . 59 ILE HD11 1 1 18 17020 1 1 59 ILE HD12 H -1.369 0.212 3.908 1.00 . A A . 59 ILE HD12 1 1 18 17021 1 1 59 ILE HD13 H 0.318 0.327 3.405 1.00 . A A . 59 ILE HD13 1 1 18 17022 1 1 59 ILE HG12 H -0.796 -0.728 6.006 1.00 . A A . 59 ILE HG12 1 1 18 17023 1 1 59 ILE HG13 H 0.395 0.548 5.761 1.00 . A A . 59 ILE HG13 1 1 18 17024 1 1 59 ILE HG21 H 1.578 -2.901 7.017 1.00 . A A . 59 ILE HG21 1 1 18 17025 1 1 59 ILE HG22 H -0.047 -2.219 7.089 1.00 . A A . 59 ILE HG22 1 1 18 17026 1 1 59 ILE HG23 H 0.360 -3.399 5.843 1.00 . A A . 59 ILE HG23 1 1 18 17027 1 1 59 ILE N N 3.495 -1.811 6.208 1.00 . A A . 59 ILE N 1 1 18 17028 1 1 59 ILE O O 2.188 -0.804 8.451 1.00 . A A . 59 ILE O 1 1 18 17029 1 1 60 HIS C C 0.316 2.826 8.487 1.00 . A A . 60 HIS C 1 1 18 17030 1 1 60 HIS CA C 1.393 1.764 8.729 1.00 . A A . 60 HIS CA 1 1 18 17031 1 1 60 HIS CB C 2.643 2.433 9.303 1.00 . A A . 60 HIS CB 1 1 18 17032 1 1 60 HIS CD2 C 4.685 0.848 9.763 1.00 . A A . 60 HIS CD2 1 1 18 17033 1 1 60 HIS CE1 C 5.417 0.677 7.732 1.00 . A A . 60 HIS CE1 1 1 18 17034 1 1 60 HIS CG C 3.852 1.603 8.976 1.00 . A A . 60 HIS CG 1 1 18 17035 1 1 60 HIS H H 1.667 1.596 6.600 1.00 . A A . 60 HIS H 1 1 18 17036 1 1 60 HIS HA H 1.023 1.030 9.430 1.00 . A A . 60 HIS HA 1 1 18 17037 1 1 60 HIS HB2 H 2.753 3.417 8.872 1.00 . A A . 60 HIS HB2 1 1 18 17038 1 1 60 HIS HB3 H 2.543 2.518 10.375 1.00 . A A . 60 HIS HB3 1 1 18 17039 1 1 60 HIS HD1 H 3.963 1.900 6.881 1.00 . A A . 60 HIS HD1 1 1 18 17040 1 1 60 HIS HD2 H 4.590 0.727 10.831 1.00 . A A . 60 HIS HD2 1 1 18 17041 1 1 60 HIS HE1 H 6.004 0.400 6.869 1.00 . A A . 60 HIS HE1 1 1 18 17042 1 1 60 HIS N N 1.729 1.096 7.440 1.00 . A A . 60 HIS N 1 1 18 17043 1 1 60 HIS ND1 N 4.338 1.480 7.683 1.00 . A A . 60 HIS ND1 1 1 18 17044 1 1 60 HIS NE2 N 5.673 0.264 8.975 1.00 . A A . 60 HIS NE2 1 1 18 17045 1 1 60 HIS O O 0.441 3.660 7.612 1.00 . A A . 60 HIS O 1 1 18 17046 1 1 61 TRP C C -1.292 5.197 9.471 1.00 . A A . 61 TRP C 1 1 18 17047 1 1 61 TRP CA C -1.818 3.816 9.071 1.00 . A A . 61 TRP CA 1 1 18 17048 1 1 61 TRP CB C -3.022 3.436 9.936 1.00 . A A . 61 TRP CB 1 1 18 17049 1 1 61 TRP CD1 C -3.167 0.958 9.430 1.00 . A A . 61 TRP CD1 1 1 18 17050 1 1 61 TRP CD2 C -4.906 2.125 8.622 1.00 . A A . 61 TRP CD2 1 1 18 17051 1 1 61 TRP CE2 C -5.126 0.778 8.259 1.00 . A A . 61 TRP CE2 1 1 18 17052 1 1 61 TRP CE3 C -5.852 3.082 8.241 1.00 . A A . 61 TRP CE3 1 1 18 17053 1 1 61 TRP CG C -3.663 2.216 9.361 1.00 . A A . 61 TRP CG 1 1 18 17054 1 1 61 TRP CH2 C -7.193 1.361 7.157 1.00 . A A . 61 TRP CH2 1 1 18 17055 1 1 61 TRP CZ2 C -6.255 0.393 7.532 1.00 . A A . 61 TRP CZ2 1 1 18 17056 1 1 61 TRP CZ3 C -6.992 2.704 7.511 1.00 . A A . 61 TRP CZ3 1 1 18 17057 1 1 61 TRP H H -0.817 2.126 9.958 1.00 . A A . 61 TRP H 1 1 18 17058 1 1 61 TRP HA H -2.121 3.837 8.033 1.00 . A A . 61 TRP HA 1 1 18 17059 1 1 61 TRP HB2 H -2.702 3.238 10.943 1.00 . A A . 61 TRP HB2 1 1 18 17060 1 1 61 TRP HB3 H -3.734 4.248 9.938 1.00 . A A . 61 TRP HB3 1 1 18 17061 1 1 61 TRP HD1 H -2.247 0.669 9.915 1.00 . A A . 61 TRP HD1 1 1 18 17062 1 1 61 TRP HE1 H -3.911 -0.866 8.675 1.00 . A A . 61 TRP HE1 1 1 18 17063 1 1 61 TRP HE3 H -5.700 4.115 8.514 1.00 . A A . 61 TRP HE3 1 1 18 17064 1 1 61 TRP HH2 H -8.071 1.075 6.597 1.00 . A A . 61 TRP HH2 1 1 18 17065 1 1 61 TRP HZ2 H -6.403 -0.642 7.260 1.00 . A A . 61 TRP HZ2 1 1 18 17066 1 1 61 TRP HZ3 H -7.717 3.451 7.221 1.00 . A A . 61 TRP HZ3 1 1 18 17067 1 1 61 TRP N N -0.737 2.805 9.257 1.00 . A A . 61 TRP N 1 1 18 17068 1 1 61 TRP NE1 N -4.035 0.101 8.773 1.00 . A A . 61 TRP NE1 1 1 18 17069 1 1 61 TRP O O -0.299 5.318 10.160 1.00 . A A . 61 TRP O 1 1 18 17070 1 1 62 GLU C C -2.634 8.436 9.926 1.00 . A A . 62 GLU C 1 1 18 17071 1 1 62 GLU CA C -1.469 7.611 9.375 1.00 . A A . 62 GLU CA 1 1 18 17072 1 1 62 GLU CB C -0.911 8.278 8.111 1.00 . A A . 62 GLU CB 1 1 18 17073 1 1 62 GLU CD C 0.174 10.374 7.289 1.00 . A A . 62 GLU CD 1 1 18 17074 1 1 62 GLU CG C -0.781 9.787 8.329 1.00 . A A . 62 GLU CG 1 1 18 17075 1 1 62 GLU H H -2.736 6.123 8.471 1.00 . A A . 62 GLU H 1 1 18 17076 1 1 62 GLU HA H -0.690 7.547 10.120 1.00 . A A . 62 GLU HA 1 1 18 17077 1 1 62 GLU HB2 H 0.061 7.863 7.887 1.00 . A A . 62 GLU HB2 1 1 18 17078 1 1 62 GLU HB3 H -1.579 8.091 7.283 1.00 . A A . 62 GLU HB3 1 1 18 17079 1 1 62 GLU HG2 H -1.753 10.249 8.229 1.00 . A A . 62 GLU HG2 1 1 18 17080 1 1 62 GLU HG3 H -0.393 9.976 9.318 1.00 . A A . 62 GLU HG3 1 1 18 17081 1 1 62 GLU N N -1.942 6.240 9.033 1.00 . A A . 62 GLU N 1 1 18 17082 1 1 62 GLU O O -3.628 8.651 9.259 1.00 . A A . 62 GLU O 1 1 18 17083 1 1 62 GLU OE1 O 0.932 9.611 6.711 1.00 . A A . 62 GLU OE1 1 1 18 17084 1 1 62 GLU OE2 O 0.132 11.576 7.086 1.00 . A A . 62 GLU OE2 1 1 18 17085 1 1 63 ASP C C -3.129 11.158 11.926 1.00 . A A . 63 ASP C 1 1 18 17086 1 1 63 ASP CA C -3.614 9.718 11.735 1.00 . A A . 63 ASP CA 1 1 18 17087 1 1 63 ASP CB C -4.009 9.131 13.092 1.00 . A A . 63 ASP CB 1 1 18 17088 1 1 63 ASP CG C -4.966 7.956 12.880 1.00 . A A . 63 ASP CG 1 1 18 17089 1 1 63 ASP H H -1.707 8.719 11.658 1.00 . A A . 63 ASP H 1 1 18 17090 1 1 63 ASP HA H -4.469 9.709 11.076 1.00 . A A . 63 ASP HA 1 1 18 17091 1 1 63 ASP HB2 H -3.123 8.787 13.609 1.00 . A A . 63 ASP HB2 1 1 18 17092 1 1 63 ASP HB3 H -4.500 9.889 13.684 1.00 . A A . 63 ASP HB3 1 1 18 17093 1 1 63 ASP N N -2.518 8.903 11.139 1.00 . A A . 63 ASP N 1 1 18 17094 1 1 63 ASP O O -3.553 11.851 12.829 1.00 . A A . 63 ASP O 1 1 18 17095 1 1 63 ASP OD1 O -6.134 8.206 12.633 1.00 . A A . 63 ASP OD1 1 1 18 17096 1 1 63 ASP OD2 O -4.513 6.826 12.968 1.00 . A A . 63 ASP OD2 1 1 18 17097 1 1 64 GLU C C -1.552 13.618 9.824 1.00 . A A . 64 GLU C 1 1 18 17098 1 1 64 GLU CA C -1.727 13.004 11.216 1.00 . A A . 64 GLU CA 1 1 18 17099 1 1 64 GLU CB C -0.379 12.983 11.938 1.00 . A A . 64 GLU CB 1 1 18 17100 1 1 64 GLU CD C 1.252 11.098 11.755 1.00 . A A . 64 GLU CD 1 1 18 17101 1 1 64 GLU CG C 0.671 12.321 11.043 1.00 . A A . 64 GLU CG 1 1 18 17102 1 1 64 GLU H H -1.911 11.034 10.362 1.00 . A A . 64 GLU H 1 1 18 17103 1 1 64 GLU HA H -2.431 13.595 11.784 1.00 . A A . 64 GLU HA 1 1 18 17104 1 1 64 GLU HB2 H -0.074 13.995 12.164 1.00 . A A . 64 GLU HB2 1 1 18 17105 1 1 64 GLU HB3 H -0.471 12.422 12.856 1.00 . A A . 64 GLU HB3 1 1 18 17106 1 1 64 GLU HG2 H 0.211 12.014 10.116 1.00 . A A . 64 GLU HG2 1 1 18 17107 1 1 64 GLU HG3 H 1.464 13.024 10.836 1.00 . A A . 64 GLU HG3 1 1 18 17108 1 1 64 GLU N N -2.241 11.610 11.083 1.00 . A A . 64 GLU N 1 1 18 17109 1 1 64 GLU OE1 O 0.560 10.097 11.830 1.00 . A A . 64 GLU OE1 1 1 18 17110 1 1 64 GLU OE2 O 2.380 11.185 12.213 1.00 . A A . 64 GLU OE2 1 1 18 17111 2 2 1 SF4 FE1 FE 5.357 -5.054 -2.024 1.00 . B A . 65 SF4 FE1 1 1 18 17112 2 2 1 SF4 FE2 FE 3.680 -6.098 0.102 1.00 . B A . 65 SF4 FE2 1 1 18 17113 2 2 1 SF4 FE3 FE 2.794 -4.597 -2.131 1.00 . B A . 65 SF4 FE3 1 1 18 17114 2 2 1 SF4 FE4 FE 3.897 -7.338 -2.509 1.00 . B A . 65 SF4 FE4 1 1 18 17115 2 2 1 SF4 S1 S 1.904 -6.662 -1.096 1.00 . B A . 65 SF4 S1 1 1 18 17116 2 2 1 SF4 S2 S 4.239 -5.198 -3.688 1.00 . B A . 65 SF4 S2 1 1 18 17117 2 2 1 SF4 S3 S 5.521 -7.282 -0.999 1.00 . B A . 65 SF4 S3 1 1 18 17118 2 2 1 SF4 S4 S 4.204 -3.762 -0.651 1.00 . B A . 65 SF4 S4 1 1 19 17119 1 1 1 ALA C C -7.309 9.510 11.021 1.00 . A A . 1 ALA C 1 1 19 17120 1 1 1 ALA CA C -7.757 10.919 11.417 1.00 . A A . 1 ALA CA 1 1 19 17121 1 1 1 ALA CB C -6.528 11.808 11.615 1.00 . A A . 1 ALA CB 1 1 19 17122 1 1 1 ALA HA H -8.379 11.332 10.637 1.00 . A A . 1 ALA HA 1 1 19 17123 1 1 1 ALA HB1 H -6.757 12.583 12.331 1.00 . A A . 1 ALA HB1 1 1 19 17124 1 1 1 ALA HB2 H -5.706 11.212 11.980 1.00 . A A . 1 ALA HB2 1 1 19 17125 1 1 1 ALA HB3 H -6.255 12.260 10.672 1.00 . A A . 1 ALA HB3 1 1 19 17126 1 1 1 ALA N N -8.533 10.855 12.689 1.00 . A A . 1 ALA N 1 1 19 17127 1 1 1 ALA O O -6.174 9.290 10.651 1.00 . A A . 1 ALA O 1 1 19 17128 1 1 2 ARG C C -7.351 7.132 9.266 1.00 . A A . 2 ARG C 1 1 19 17129 1 1 2 ARG CA C -7.818 7.160 10.723 1.00 . A A . 2 ARG CA 1 1 19 17130 1 1 2 ARG CB C -9.031 6.244 10.891 1.00 . A A . 2 ARG CB 1 1 19 17131 1 1 2 ARG CD C -10.562 5.177 12.553 1.00 . A A . 2 ARG CD 1 1 19 17132 1 1 2 ARG CG C -9.320 6.052 12.380 1.00 . A A . 2 ARG CG 1 1 19 17133 1 1 2 ARG CZ C -12.910 5.704 12.822 1.00 . A A . 2 ARG CZ 1 1 19 17134 1 1 2 ARG H H -9.106 8.751 11.396 1.00 . A A . 2 ARG H 1 1 19 17135 1 1 2 ARG HA H -7.018 6.820 11.363 1.00 . A A . 2 ARG HA 1 1 19 17136 1 1 2 ARG HB2 H -9.890 6.689 10.410 1.00 . A A . 2 ARG HB2 1 1 19 17137 1 1 2 ARG HB3 H -8.824 5.284 10.441 1.00 . A A . 2 ARG HB3 1 1 19 17138 1 1 2 ARG HD2 H -10.857 4.776 11.593 1.00 . A A . 2 ARG HD2 1 1 19 17139 1 1 2 ARG HD3 H -10.340 4.364 13.229 1.00 . A A . 2 ARG HD3 1 1 19 17140 1 1 2 ARG HE H -11.473 6.759 13.695 1.00 . A A . 2 ARG HE 1 1 19 17141 1 1 2 ARG HG2 H -8.474 5.575 12.853 1.00 . A A . 2 ARG HG2 1 1 19 17142 1 1 2 ARG HG3 H -9.494 7.013 12.839 1.00 . A A . 2 ARG HG3 1 1 19 17143 1 1 2 ARG HH11 H -12.685 3.746 13.173 1.00 . A A . 2 ARG HH11 1 1 19 17144 1 1 2 ARG HH12 H -14.268 4.241 12.674 1.00 . A A . 2 ARG HH12 1 1 19 17145 1 1 2 ARG HH21 H -13.421 7.594 12.403 1.00 . A A . 2 ARG HH21 1 1 19 17146 1 1 2 ARG HH22 H -14.685 6.420 12.237 1.00 . A A . 2 ARG HH22 1 1 19 17147 1 1 2 ARG N N -8.195 8.553 11.096 1.00 . A A . 2 ARG N 1 1 19 17148 1 1 2 ARG NE N -11.672 5.998 13.111 1.00 . A A . 2 ARG NE 1 1 19 17149 1 1 2 ARG NH1 N -13.319 4.467 12.896 1.00 . A A . 2 ARG NH1 1 1 19 17150 1 1 2 ARG NH2 N -13.736 6.646 12.460 1.00 . A A . 2 ARG NH2 1 1 19 17151 1 1 2 ARG O O -8.145 7.193 8.348 1.00 . A A . 2 ARG O 1 1 19 17152 1 1 3 LYS C C -4.660 5.785 7.457 1.00 . A A . 3 LYS C 1 1 19 17153 1 1 3 LYS CA C -5.552 7.012 7.650 1.00 . A A . 3 LYS CA 1 1 19 17154 1 1 3 LYS CB C -4.742 8.283 7.379 1.00 . A A . 3 LYS CB 1 1 19 17155 1 1 3 LYS CD C -5.162 10.189 5.817 1.00 . A A . 3 LYS CD 1 1 19 17156 1 1 3 LYS CE C -6.668 10.450 5.864 1.00 . A A . 3 LYS CE 1 1 19 17157 1 1 3 LYS CG C -4.898 8.685 5.911 1.00 . A A . 3 LYS CG 1 1 19 17158 1 1 3 LYS H H -5.444 6.995 9.800 1.00 . A A . 3 LYS H 1 1 19 17159 1 1 3 LYS HA H -6.380 6.962 6.960 1.00 . A A . 3 LYS HA 1 1 19 17160 1 1 3 LYS HB2 H -5.104 9.081 8.011 1.00 . A A . 3 LYS HB2 1 1 19 17161 1 1 3 LYS HB3 H -3.701 8.099 7.591 1.00 . A A . 3 LYS HB3 1 1 19 17162 1 1 3 LYS HD2 H -4.682 10.690 6.645 1.00 . A A . 3 LYS HD2 1 1 19 17163 1 1 3 LYS HD3 H -4.762 10.567 4.887 1.00 . A A . 3 LYS HD3 1 1 19 17164 1 1 3 LYS HE2 H -7.145 9.696 6.474 1.00 . A A . 3 LYS HE2 1 1 19 17165 1 1 3 LYS HE3 H -6.851 11.426 6.289 1.00 . A A . 3 LYS HE3 1 1 19 17166 1 1 3 LYS HG2 H -3.991 8.442 5.374 1.00 . A A . 3 LYS HG2 1 1 19 17167 1 1 3 LYS HG3 H -5.727 8.147 5.476 1.00 . A A . 3 LYS HG3 1 1 19 17168 1 1 3 LYS HZ1 H -6.832 9.574 3.982 1.00 . A A . 3 LYS HZ1 1 1 19 17169 1 1 3 LYS HZ2 H -8.261 10.312 4.531 1.00 . A A . 3 LYS HZ2 1 1 19 17170 1 1 3 LYS HZ3 H -6.970 11.265 3.971 1.00 . A A . 3 LYS HZ3 1 1 19 17171 1 1 3 LYS N N -6.068 7.041 9.046 1.00 . A A . 3 LYS N 1 1 19 17172 1 1 3 LYS NZ N -7.225 10.396 4.483 1.00 . A A . 3 LYS NZ 1 1 19 17173 1 1 3 LYS O O -4.815 4.780 8.122 1.00 . A A . 3 LYS O 1 1 19 17174 1 1 4 PHE C C -1.897 5.064 5.117 1.00 . A A . 4 PHE C 1 1 19 17175 1 1 4 PHE CA C -2.811 4.717 6.295 1.00 . A A . 4 PHE CA 1 1 19 17176 1 1 4 PHE CB C -3.631 3.467 5.960 1.00 . A A . 4 PHE CB 1 1 19 17177 1 1 4 PHE CD1 C -5.419 4.479 4.502 1.00 . A A . 4 PHE CD1 1 1 19 17178 1 1 4 PHE CD2 C -3.796 2.987 3.493 1.00 . A A . 4 PHE CD2 1 1 19 17179 1 1 4 PHE CE1 C -6.037 4.648 3.256 1.00 . A A . 4 PHE CE1 1 1 19 17180 1 1 4 PHE CE2 C -4.414 3.155 2.248 1.00 . A A . 4 PHE CE2 1 1 19 17181 1 1 4 PHE CG C -4.299 3.649 4.619 1.00 . A A . 4 PHE CG 1 1 19 17182 1 1 4 PHE CZ C -5.534 3.986 2.129 1.00 . A A . 4 PHE CZ 1 1 19 17183 1 1 4 PHE H H -3.623 6.689 6.036 1.00 . A A . 4 PHE H 1 1 19 17184 1 1 4 PHE HA H -2.210 4.532 7.173 1.00 . A A . 4 PHE HA 1 1 19 17185 1 1 4 PHE HB2 H -2.978 2.608 5.925 1.00 . A A . 4 PHE HB2 1 1 19 17186 1 1 4 PHE HB3 H -4.384 3.314 6.718 1.00 . A A . 4 PHE HB3 1 1 19 17187 1 1 4 PHE HD1 H -5.807 4.989 5.371 1.00 . A A . 4 PHE HD1 1 1 19 17188 1 1 4 PHE HD2 H -2.932 2.346 3.584 1.00 . A A . 4 PHE HD2 1 1 19 17189 1 1 4 PHE HE1 H -6.902 5.288 3.165 1.00 . A A . 4 PHE HE1 1 1 19 17190 1 1 4 PHE HE2 H -4.026 2.645 1.380 1.00 . A A . 4 PHE HE2 1 1 19 17191 1 1 4 PHE HZ H -6.011 4.117 1.170 1.00 . A A . 4 PHE HZ 1 1 19 17192 1 1 4 PHE N N -3.726 5.866 6.551 1.00 . A A . 4 PHE N 1 1 19 17193 1 1 4 PHE O O -2.021 6.111 4.515 1.00 . A A . 4 PHE O 1 1 19 17194 1 1 5 TYR C C 0.966 3.368 3.698 1.00 . A A . 5 TYR C 1 1 19 17195 1 1 5 TYR CA C -0.053 4.470 3.664 1.00 . A A . 5 TYR CA 1 1 19 17196 1 1 5 TYR CB C 0.657 5.812 3.850 1.00 . A A . 5 TYR CB 1 1 19 17197 1 1 5 TYR CD1 C 0.870 5.842 6.368 1.00 . A A . 5 TYR CD1 1 1 19 17198 1 1 5 TYR CD2 C 2.885 5.704 5.026 1.00 . A A . 5 TYR CD2 1 1 19 17199 1 1 5 TYR CE1 C 1.646 5.819 7.534 1.00 . A A . 5 TYR CE1 1 1 19 17200 1 1 5 TYR CE2 C 3.659 5.681 6.193 1.00 . A A . 5 TYR CE2 1 1 19 17201 1 1 5 TYR CG C 1.490 5.784 5.113 1.00 . A A . 5 TYR CG 1 1 19 17202 1 1 5 TYR CZ C 3.040 5.738 7.446 1.00 . A A . 5 TYR CZ 1 1 19 17203 1 1 5 TYR H H -0.879 3.349 5.279 1.00 . A A . 5 TYR H 1 1 19 17204 1 1 5 TYR HA H -0.590 4.454 2.726 1.00 . A A . 5 TYR HA 1 1 19 17205 1 1 5 TYR HB2 H 1.301 5.995 3.001 1.00 . A A . 5 TYR HB2 1 1 19 17206 1 1 5 TYR HB3 H -0.071 6.596 3.916 1.00 . A A . 5 TYR HB3 1 1 19 17207 1 1 5 TYR HD1 H -0.203 5.907 6.439 1.00 . A A . 5 TYR HD1 1 1 19 17208 1 1 5 TYR HD2 H 3.365 5.660 4.060 1.00 . A A . 5 TYR HD2 1 1 19 17209 1 1 5 TYR HE1 H 1.167 5.862 8.502 1.00 . A A . 5 TYR HE1 1 1 19 17210 1 1 5 TYR HE2 H 4.736 5.619 6.125 1.00 . A A . 5 TYR HE2 1 1 19 17211 1 1 5 TYR HH H 3.563 4.933 9.098 1.00 . A A . 5 TYR HH 1 1 19 17212 1 1 5 TYR N N -0.975 4.198 4.785 1.00 . A A . 5 TYR N 1 1 19 17213 1 1 5 TYR O O 0.799 2.393 4.404 1.00 . A A . 5 TYR O 1 1 19 17214 1 1 5 TYR OH O 3.803 5.716 8.597 1.00 . A A . 5 TYR OH 1 1 19 17215 1 1 6 VAL C C 4.412 2.863 2.888 1.00 . A A . 6 VAL C 1 1 19 17216 1 1 6 VAL CA C 2.989 2.372 3.048 1.00 . A A . 6 VAL CA 1 1 19 17217 1 1 6 VAL CB C 2.681 1.356 1.973 1.00 . A A . 6 VAL CB 1 1 19 17218 1 1 6 VAL CG1 C 3.431 0.095 2.319 1.00 . A A . 6 VAL CG1 1 1 19 17219 1 1 6 VAL CG2 C 1.182 1.060 1.960 1.00 . A A . 6 VAL CG2 1 1 19 17220 1 1 6 VAL H H 2.171 4.257 2.393 1.00 . A A . 6 VAL H 1 1 19 17221 1 1 6 VAL HA H 2.893 1.893 4.010 1.00 . A A . 6 VAL HA 1 1 19 17222 1 1 6 VAL HB H 3.003 1.729 1.010 1.00 . A A . 6 VAL HB 1 1 19 17223 1 1 6 VAL HG11 H 3.641 0.095 3.380 1.00 . A A . 6 VAL HG11 1 1 19 17224 1 1 6 VAL HG12 H 2.825 -0.758 2.070 1.00 . A A . 6 VAL HG12 1 1 19 17225 1 1 6 VAL HG13 H 4.354 0.068 1.766 1.00 . A A . 6 VAL HG13 1 1 19 17226 1 1 6 VAL HG21 H 0.634 1.981 1.889 1.00 . A A . 6 VAL HG21 1 1 19 17227 1 1 6 VAL HG22 H 0.944 0.435 1.115 1.00 . A A . 6 VAL HG22 1 1 19 17228 1 1 6 VAL HG23 H 0.909 0.551 2.870 1.00 . A A . 6 VAL HG23 1 1 19 17229 1 1 6 VAL N N 2.021 3.475 2.973 1.00 . A A . 6 VAL N 1 1 19 17230 1 1 6 VAL O O 4.673 3.928 2.365 1.00 . A A . 6 VAL O 1 1 19 17231 1 1 7 ASP C C 7.386 1.600 2.125 1.00 . A A . 7 ASP C 1 1 19 17232 1 1 7 ASP CA C 6.757 2.444 3.217 1.00 . A A . 7 ASP CA 1 1 19 17233 1 1 7 ASP CB C 7.470 2.204 4.542 1.00 . A A . 7 ASP CB 1 1 19 17234 1 1 7 ASP CG C 8.925 2.663 4.436 1.00 . A A . 7 ASP CG 1 1 19 17235 1 1 7 ASP H H 5.093 1.213 3.743 1.00 . A A . 7 ASP H 1 1 19 17236 1 1 7 ASP HA H 6.827 3.486 2.949 1.00 . A A . 7 ASP HA 1 1 19 17237 1 1 7 ASP HB2 H 6.970 2.766 5.312 1.00 . A A . 7 ASP HB2 1 1 19 17238 1 1 7 ASP HB3 H 7.440 1.153 4.785 1.00 . A A . 7 ASP HB3 1 1 19 17239 1 1 7 ASP N N 5.337 2.069 3.336 1.00 . A A . 7 ASP N 1 1 19 17240 1 1 7 ASP O O 8.080 0.637 2.377 1.00 . A A . 7 ASP O 1 1 19 17241 1 1 7 ASP OD1 O 9.139 3.842 4.212 1.00 . A A . 7 ASP OD1 1 1 19 17242 1 1 7 ASP OD2 O 9.801 1.826 4.581 1.00 . A A . 7 ASP OD2 1 1 19 17243 1 1 8 GLN C C 9.179 0.880 0.026 1.00 . A A . 8 GLN C 1 1 19 17244 1 1 8 GLN CA C 7.712 1.225 -0.247 1.00 . A A . 8 GLN CA 1 1 19 17245 1 1 8 GLN CB C 7.632 2.099 -1.502 1.00 . A A . 8 GLN CB 1 1 19 17246 1 1 8 GLN CD C 6.421 4.237 -1.026 1.00 . A A . 8 GLN CD 1 1 19 17247 1 1 8 GLN CG C 6.279 2.808 -1.551 1.00 . A A . 8 GLN CG 1 1 19 17248 1 1 8 GLN H H 6.577 2.757 0.757 1.00 . A A . 8 GLN H 1 1 19 17249 1 1 8 GLN HA H 7.149 0.318 -0.403 1.00 . A A . 8 GLN HA 1 1 19 17250 1 1 8 GLN HB2 H 8.425 2.834 -1.479 1.00 . A A . 8 GLN HB2 1 1 19 17251 1 1 8 GLN HB3 H 7.743 1.479 -2.377 1.00 . A A . 8 GLN HB3 1 1 19 17252 1 1 8 GLN HE21 H 4.574 4.296 -0.298 1.00 . A A . 8 GLN HE21 1 1 19 17253 1 1 8 GLN HE22 H 5.488 5.708 -0.073 1.00 . A A . 8 GLN HE22 1 1 19 17254 1 1 8 GLN HG2 H 5.927 2.833 -2.572 1.00 . A A . 8 GLN HG2 1 1 19 17255 1 1 8 GLN HG3 H 5.569 2.272 -0.940 1.00 . A A . 8 GLN HG3 1 1 19 17256 1 1 8 GLN N N 7.141 1.974 0.909 1.00 . A A . 8 GLN N 1 1 19 17257 1 1 8 GLN NE2 N 5.411 4.794 -0.415 1.00 . A A . 8 GLN NE2 1 1 19 17258 1 1 8 GLN O O 9.743 -0.002 -0.591 1.00 . A A . 8 GLN O 1 1 19 17259 1 1 8 GLN OE1 O 7.457 4.853 -1.175 1.00 . A A . 8 GLN OE1 1 1 19 17260 1 1 9 ASP C C 11.365 -0.194 1.632 1.00 . A A . 9 ASP C 1 1 19 17261 1 1 9 ASP CA C 11.231 1.277 1.253 1.00 . A A . 9 ASP CA 1 1 19 17262 1 1 9 ASP CB C 11.686 2.148 2.426 1.00 . A A . 9 ASP CB 1 1 19 17263 1 1 9 ASP CG C 12.874 3.009 1.993 1.00 . A A . 9 ASP CG 1 1 19 17264 1 1 9 ASP H H 9.331 2.268 1.430 1.00 . A A . 9 ASP H 1 1 19 17265 1 1 9 ASP HA H 11.840 1.486 0.388 1.00 . A A . 9 ASP HA 1 1 19 17266 1 1 9 ASP HB2 H 10.872 2.788 2.736 1.00 . A A . 9 ASP HB2 1 1 19 17267 1 1 9 ASP HB3 H 11.983 1.517 3.251 1.00 . A A . 9 ASP HB3 1 1 19 17268 1 1 9 ASP N N 9.802 1.566 0.945 1.00 . A A . 9 ASP N 1 1 19 17269 1 1 9 ASP O O 12.343 -0.844 1.320 1.00 . A A . 9 ASP O 1 1 19 17270 1 1 9 ASP OD1 O 12.640 4.105 1.511 1.00 . A A . 9 ASP OD1 1 1 19 17271 1 1 9 ASP OD2 O 13.997 2.557 2.149 1.00 . A A . 9 ASP OD2 1 1 19 17272 1 1 10 GLU C C 9.991 -3.016 1.516 1.00 . A A . 10 GLU C 1 1 19 17273 1 1 10 GLU CA C 10.431 -2.151 2.700 1.00 . A A . 10 GLU CA 1 1 19 17274 1 1 10 GLU CB C 9.479 -2.365 3.876 1.00 . A A . 10 GLU CB 1 1 19 17275 1 1 10 GLU CD C 9.818 -4.843 3.723 1.00 . A A . 10 GLU CD 1 1 19 17276 1 1 10 GLU CG C 9.880 -3.626 4.648 1.00 . A A . 10 GLU CG 1 1 19 17277 1 1 10 GLU H H 9.602 -0.175 2.533 1.00 . A A . 10 GLU H 1 1 19 17278 1 1 10 GLU HA H 11.436 -2.415 2.991 1.00 . A A . 10 GLU HA 1 1 19 17279 1 1 10 GLU HB2 H 9.528 -1.509 4.535 1.00 . A A . 10 GLU HB2 1 1 19 17280 1 1 10 GLU HB3 H 8.474 -2.472 3.504 1.00 . A A . 10 GLU HB3 1 1 19 17281 1 1 10 GLU HG2 H 10.885 -3.512 5.025 1.00 . A A . 10 GLU HG2 1 1 19 17282 1 1 10 GLU HG3 H 9.200 -3.771 5.475 1.00 . A A . 10 GLU HG3 1 1 19 17283 1 1 10 GLU N N 10.382 -0.722 2.299 1.00 . A A . 10 GLU N 1 1 19 17284 1 1 10 GLU O O 10.443 -4.130 1.345 1.00 . A A . 10 GLU O 1 1 19 17285 1 1 10 GLU OE1 O 8.722 -5.296 3.443 1.00 . A A . 10 GLU OE1 1 1 19 17286 1 1 10 GLU OE2 O 10.872 -5.302 3.313 1.00 . A A . 10 GLU OE2 1 1 19 17287 1 1 11 CYS C C 9.828 -3.992 -1.140 1.00 . A A . 11 CYS C 1 1 19 17288 1 1 11 CYS CA C 8.637 -3.292 -0.479 1.00 . A A . 11 CYS CA 1 1 19 17289 1 1 11 CYS CB C 7.956 -2.350 -1.477 1.00 . A A . 11 CYS CB 1 1 19 17290 1 1 11 CYS H H 8.762 -1.605 0.853 1.00 . A A . 11 CYS H 1 1 19 17291 1 1 11 CYS HA H 7.927 -4.035 -0.148 1.00 . A A . 11 CYS HA 1 1 19 17292 1 1 11 CYS HB2 H 7.060 -1.943 -1.031 1.00 . A A . 11 CYS HB2 1 1 19 17293 1 1 11 CYS HB3 H 8.630 -1.544 -1.726 1.00 . A A . 11 CYS HB3 1 1 19 17294 1 1 11 CYS N N 9.111 -2.506 0.696 1.00 . A A . 11 CYS N 1 1 19 17295 1 1 11 CYS O O 10.917 -3.457 -1.205 1.00 . A A . 11 CYS O 1 1 19 17296 1 1 11 CYS SG S 7.456 -3.121 -3.060 1.00 . A A . 11 CYS SG 1 1 19 17297 1 1 12 ILE C C 10.670 -5.765 -3.791 1.00 . A A . 12 ILE C 1 1 19 17298 1 1 12 ILE CA C 10.759 -5.921 -2.270 1.00 . A A . 12 ILE CA 1 1 19 17299 1 1 12 ILE CB C 10.709 -7.412 -1.903 1.00 . A A . 12 ILE CB 1 1 19 17300 1 1 12 ILE CD1 C 8.759 -7.550 -0.303 1.00 . A A . 12 ILE CD1 1 1 19 17301 1 1 12 ILE CG1 C 9.249 -7.868 -1.721 1.00 . A A . 12 ILE CG1 1 1 19 17302 1 1 12 ILE CG2 C 11.495 -7.648 -0.608 1.00 . A A . 12 ILE CG2 1 1 19 17303 1 1 12 ILE H H 8.747 -5.604 -1.558 1.00 . A A . 12 ILE H 1 1 19 17304 1 1 12 ILE HA H 11.693 -5.502 -1.926 1.00 . A A . 12 ILE HA 1 1 19 17305 1 1 12 ILE HB H 11.164 -7.984 -2.698 1.00 . A A . 12 ILE HB 1 1 19 17306 1 1 12 ILE HD11 H 9.225 -6.639 0.043 1.00 . A A . 12 ILE HD11 1 1 19 17307 1 1 12 ILE HD12 H 7.687 -7.426 -0.312 1.00 . A A . 12 ILE HD12 1 1 19 17308 1 1 12 ILE HD13 H 9.021 -8.362 0.359 1.00 . A A . 12 ILE HD13 1 1 19 17309 1 1 12 ILE HG12 H 8.622 -7.359 -2.437 1.00 . A A . 12 ILE HG12 1 1 19 17310 1 1 12 ILE HG13 H 9.185 -8.934 -1.889 1.00 . A A . 12 ILE HG13 1 1 19 17311 1 1 12 ILE HG21 H 11.281 -6.855 0.094 1.00 . A A . 12 ILE HG21 1 1 19 17312 1 1 12 ILE HG22 H 11.207 -8.597 -0.179 1.00 . A A . 12 ILE HG22 1 1 19 17313 1 1 12 ILE HG23 H 12.554 -7.659 -0.826 1.00 . A A . 12 ILE HG23 1 1 19 17314 1 1 12 ILE N N 9.631 -5.189 -1.623 1.00 . A A . 12 ILE N 1 1 19 17315 1 1 12 ILE O O 11.654 -5.497 -4.451 1.00 . A A . 12 ILE O 1 1 19 17316 1 1 13 ALA C C 8.047 -6.432 -6.280 1.00 . A A . 13 ALA C 1 1 19 17317 1 1 13 ALA CA C 9.357 -5.785 -5.829 1.00 . A A . 13 ALA CA 1 1 19 17318 1 1 13 ALA CB C 10.529 -6.480 -6.529 1.00 . A A . 13 ALA CB 1 1 19 17319 1 1 13 ALA H H 8.719 -6.139 -3.805 1.00 . A A . 13 ALA H 1 1 19 17320 1 1 13 ALA HA H 9.351 -4.737 -6.092 1.00 . A A . 13 ALA HA 1 1 19 17321 1 1 13 ALA HB1 H 10.858 -7.318 -5.932 1.00 . A A . 13 ALA HB1 1 1 19 17322 1 1 13 ALA HB2 H 10.210 -6.832 -7.499 1.00 . A A . 13 ALA HB2 1 1 19 17323 1 1 13 ALA HB3 H 11.343 -5.781 -6.649 1.00 . A A . 13 ALA HB3 1 1 19 17324 1 1 13 ALA N N 9.501 -5.926 -4.352 1.00 . A A . 13 ALA N 1 1 19 17325 1 1 13 ALA O O 7.456 -6.036 -7.266 1.00 . A A . 13 ALA O 1 1 19 17326 1 1 14 CYS C C 5.198 -7.060 -6.057 1.00 . A A . 14 CYS C 1 1 19 17327 1 1 14 CYS CA C 6.318 -8.098 -5.972 1.00 . A A . 14 CYS CA 1 1 19 17328 1 1 14 CYS CB C 5.955 -9.177 -4.945 1.00 . A A . 14 CYS CB 1 1 19 17329 1 1 14 CYS H H 8.080 -7.738 -4.783 1.00 . A A . 14 CYS H 1 1 19 17330 1 1 14 CYS HA H 6.450 -8.559 -6.940 1.00 . A A . 14 CYS HA 1 1 19 17331 1 1 14 CYS HB2 H 5.742 -10.101 -5.461 1.00 . A A . 14 CYS HB2 1 1 19 17332 1 1 14 CYS HB3 H 6.791 -9.324 -4.274 1.00 . A A . 14 CYS HB3 1 1 19 17333 1 1 14 CYS N N 7.588 -7.428 -5.572 1.00 . A A . 14 CYS N 1 1 19 17334 1 1 14 CYS O O 5.261 -6.013 -5.447 1.00 . A A . 14 CYS O 1 1 19 17335 1 1 14 CYS SG S 4.508 -8.843 -3.874 1.00 . A A . 14 CYS SG 1 1 19 17336 1 1 15 GLU C C 1.767 -6.985 -6.407 1.00 . A A . 15 GLU C 1 1 19 17337 1 1 15 GLU CA C 3.056 -6.366 -6.952 1.00 . A A . 15 GLU CA 1 1 19 17338 1 1 15 GLU CB C 2.864 -6.009 -8.426 1.00 . A A . 15 GLU CB 1 1 19 17339 1 1 15 GLU CD C 4.044 -5.472 -10.562 1.00 . A A . 15 GLU CD 1 1 19 17340 1 1 15 GLU CG C 4.226 -5.743 -9.068 1.00 . A A . 15 GLU CG 1 1 19 17341 1 1 15 GLU H H 4.147 -8.188 -7.310 1.00 . A A . 15 GLU H 1 1 19 17342 1 1 15 GLU HA H 3.290 -5.472 -6.393 1.00 . A A . 15 GLU HA 1 1 19 17343 1 1 15 GLU HB2 H 2.379 -6.831 -8.935 1.00 . A A . 15 GLU HB2 1 1 19 17344 1 1 15 GLU HB3 H 2.250 -5.124 -8.507 1.00 . A A . 15 GLU HB3 1 1 19 17345 1 1 15 GLU HG2 H 4.682 -4.883 -8.598 1.00 . A A . 15 GLU HG2 1 1 19 17346 1 1 15 GLU HG3 H 4.861 -6.606 -8.935 1.00 . A A . 15 GLU HG3 1 1 19 17347 1 1 15 GLU N N 4.175 -7.340 -6.820 1.00 . A A . 15 GLU N 1 1 19 17348 1 1 15 GLU O O 0.679 -6.556 -6.734 1.00 . A A . 15 GLU O 1 1 19 17349 1 1 15 GLU OE1 O 3.256 -6.170 -11.179 1.00 . A A . 15 GLU OE1 1 1 19 17350 1 1 15 GLU OE2 O 4.694 -4.570 -11.064 1.00 . A A . 15 GLU OE2 1 1 19 17351 1 1 16 SER C C -0.322 -7.527 -4.579 1.00 . A A . 16 SER C 1 1 19 17352 1 1 16 SER CA C 0.653 -8.621 -5.013 1.00 . A A . 16 SER CA 1 1 19 17353 1 1 16 SER CB C 1.034 -9.475 -3.804 1.00 . A A . 16 SER CB 1 1 19 17354 1 1 16 SER H H 2.765 -8.317 -5.323 1.00 . A A . 16 SER H 1 1 19 17355 1 1 16 SER HA H 0.189 -9.243 -5.765 1.00 . A A . 16 SER HA 1 1 19 17356 1 1 16 SER HB2 H 1.605 -8.883 -3.108 1.00 . A A . 16 SER HB2 1 1 19 17357 1 1 16 SER HB3 H 0.135 -9.831 -3.318 1.00 . A A . 16 SER HB3 1 1 19 17358 1 1 16 SER HG H 1.267 -11.359 -4.230 1.00 . A A . 16 SER HG 1 1 19 17359 1 1 16 SER N N 1.878 -7.986 -5.577 1.00 . A A . 16 SER N 1 1 19 17360 1 1 16 SER O O -1.407 -7.396 -5.112 1.00 . A A . 16 SER O 1 1 19 17361 1 1 16 SER OG O 1.823 -10.577 -4.236 1.00 . A A . 16 SER OG 1 1 19 17362 1 1 17 CYS C C -1.344 -4.858 -4.361 1.00 . A A . 17 CYS C 1 1 19 17363 1 1 17 CYS CA C -0.835 -5.640 -3.151 1.00 . A A . 17 CYS CA 1 1 19 17364 1 1 17 CYS CB C -0.045 -4.704 -2.238 1.00 . A A . 17 CYS CB 1 1 19 17365 1 1 17 CYS H H 0.942 -6.854 -3.207 1.00 . A A . 17 CYS H 1 1 19 17366 1 1 17 CYS HA H -1.669 -6.059 -2.609 1.00 . A A . 17 CYS HA 1 1 19 17367 1 1 17 CYS HB2 H -0.724 -4.024 -1.744 1.00 . A A . 17 CYS HB2 1 1 19 17368 1 1 17 CYS HB3 H 0.488 -5.283 -1.499 1.00 . A A . 17 CYS HB3 1 1 19 17369 1 1 17 CYS N N 0.061 -6.734 -3.618 1.00 . A A . 17 CYS N 1 1 19 17370 1 1 17 CYS O O -2.533 -4.693 -4.554 1.00 . A A . 17 CYS O 1 1 19 17371 1 1 17 CYS SG S 1.173 -3.687 -3.147 1.00 . A A . 17 CYS SG 1 1 19 17372 1 1 18 VAL C C -2.050 -4.319 -7.046 1.00 . A A . 18 VAL C 1 1 19 17373 1 1 18 VAL CA C -0.870 -3.609 -6.383 1.00 . A A . 18 VAL CA 1 1 19 17374 1 1 18 VAL CB C 0.296 -3.528 -7.370 1.00 . A A . 18 VAL CB 1 1 19 17375 1 1 18 VAL CG1 C -0.111 -2.680 -8.576 1.00 . A A . 18 VAL CG1 1 1 19 17376 1 1 18 VAL CG2 C 1.502 -2.888 -6.680 1.00 . A A . 18 VAL CG2 1 1 19 17377 1 1 18 VAL H H 0.505 -4.526 -5.005 1.00 . A A . 18 VAL H 1 1 19 17378 1 1 18 VAL HA H -1.167 -2.612 -6.090 1.00 . A A . 18 VAL HA 1 1 19 17379 1 1 18 VAL HB H 0.555 -4.523 -7.702 1.00 . A A . 18 VAL HB 1 1 19 17380 1 1 18 VAL HG11 H -0.819 -1.927 -8.265 1.00 . A A . 18 VAL HG11 1 1 19 17381 1 1 18 VAL HG12 H 0.765 -2.201 -8.990 1.00 . A A . 18 VAL HG12 1 1 19 17382 1 1 18 VAL HG13 H -0.562 -3.313 -9.326 1.00 . A A . 18 VAL HG13 1 1 19 17383 1 1 18 VAL HG21 H 1.395 -2.978 -5.610 1.00 . A A . 18 VAL HG21 1 1 19 17384 1 1 18 VAL HG22 H 2.405 -3.389 -6.996 1.00 . A A . 18 VAL HG22 1 1 19 17385 1 1 18 VAL HG23 H 1.557 -1.843 -6.949 1.00 . A A . 18 VAL HG23 1 1 19 17386 1 1 18 VAL N N -0.448 -4.379 -5.181 1.00 . A A . 18 VAL N 1 1 19 17387 1 1 18 VAL O O -3.036 -3.705 -7.403 1.00 . A A . 18 VAL O 1 1 19 17388 1 1 19 GLU C C -4.320 -6.237 -6.968 1.00 . A A . 19 GLU C 1 1 19 17389 1 1 19 GLU CA C -3.085 -6.350 -7.849 1.00 . A A . 19 GLU CA 1 1 19 17390 1 1 19 GLU CB C -2.706 -7.820 -8.031 1.00 . A A . 19 GLU CB 1 1 19 17391 1 1 19 GLU CD C -4.652 -8.973 -9.088 1.00 . A A . 19 GLU CD 1 1 19 17392 1 1 19 GLU CG C -3.285 -8.338 -9.347 1.00 . A A . 19 GLU CG 1 1 19 17393 1 1 19 GLU H H -1.160 -6.091 -6.916 1.00 . A A . 19 GLU H 1 1 19 17394 1 1 19 GLU HA H -3.300 -5.906 -8.805 1.00 . A A . 19 GLU HA 1 1 19 17395 1 1 19 GLU HB2 H -1.630 -7.915 -8.047 1.00 . A A . 19 GLU HB2 1 1 19 17396 1 1 19 GLU HB3 H -3.105 -8.399 -7.211 1.00 . A A . 19 GLU HB3 1 1 19 17397 1 1 19 GLU HG2 H -3.394 -7.516 -10.040 1.00 . A A . 19 GLU HG2 1 1 19 17398 1 1 19 GLU HG3 H -2.620 -9.079 -9.767 1.00 . A A . 19 GLU HG3 1 1 19 17399 1 1 19 GLU N N -1.962 -5.611 -7.212 1.00 . A A . 19 GLU N 1 1 19 17400 1 1 19 GLU O O -5.431 -6.140 -7.450 1.00 . A A . 19 GLU O 1 1 19 17401 1 1 19 GLU OE1 O -4.701 -9.945 -8.352 1.00 . A A . 19 GLU OE1 1 1 19 17402 1 1 19 GLU OE2 O -5.626 -8.475 -9.626 1.00 . A A . 19 GLU OE2 1 1 19 17403 1 1 20 ILE C C -5.562 -4.564 -4.596 1.00 . A A . 20 ILE C 1 1 19 17404 1 1 20 ILE CA C -5.304 -6.060 -4.779 1.00 . A A . 20 ILE CA 1 1 19 17405 1 1 20 ILE CB C -5.005 -6.701 -3.425 1.00 . A A . 20 ILE CB 1 1 19 17406 1 1 20 ILE CD1 C -4.725 -8.932 -2.327 1.00 . A A . 20 ILE CD1 1 1 19 17407 1 1 20 ILE CG1 C -4.609 -8.143 -3.635 1.00 . A A . 20 ILE CG1 1 1 19 17408 1 1 20 ILE CG2 C -6.243 -6.617 -2.529 1.00 . A A . 20 ILE CG2 1 1 19 17409 1 1 20 ILE H H -3.231 -6.263 -5.311 1.00 . A A . 20 ILE H 1 1 19 17410 1 1 20 ILE HA H -6.169 -6.528 -5.223 1.00 . A A . 20 ILE HA 1 1 19 17411 1 1 20 ILE HB H -4.199 -6.198 -2.971 1.00 . A A . 20 ILE HB 1 1 19 17412 1 1 20 ILE HD11 H -4.464 -8.292 -1.497 1.00 . A A . 20 ILE HD11 1 1 19 17413 1 1 20 ILE HD12 H -5.740 -9.281 -2.206 1.00 . A A . 20 ILE HD12 1 1 19 17414 1 1 20 ILE HD13 H -4.054 -9.777 -2.355 1.00 . A A . 20 ILE HD13 1 1 19 17415 1 1 20 ILE HG12 H -5.254 -8.547 -4.359 1.00 . A A . 20 ILE HG12 1 1 19 17416 1 1 20 ILE HG13 H -3.591 -8.190 -3.993 1.00 . A A . 20 ILE HG13 1 1 19 17417 1 1 20 ILE HG21 H -6.988 -5.995 -3.003 1.00 . A A . 20 ILE HG21 1 1 19 17418 1 1 20 ILE HG22 H -6.646 -7.606 -2.377 1.00 . A A . 20 ILE HG22 1 1 19 17419 1 1 20 ILE HG23 H -5.970 -6.189 -1.577 1.00 . A A . 20 ILE HG23 1 1 19 17420 1 1 20 ILE N N -4.136 -6.211 -5.680 1.00 . A A . 20 ILE N 1 1 19 17421 1 1 20 ILE O O -6.287 -4.150 -3.712 1.00 . A A . 20 ILE O 1 1 19 17422 1 1 21 ALA C C -4.555 -1.581 -6.527 1.00 . A A . 21 ALA C 1 1 19 17423 1 1 21 ALA CA C -5.170 -2.277 -5.311 1.00 . A A . 21 ALA CA 1 1 19 17424 1 1 21 ALA CB C -4.494 -1.768 -4.036 1.00 . A A . 21 ALA CB 1 1 19 17425 1 1 21 ALA H H -4.383 -4.105 -6.141 1.00 . A A . 21 ALA H 1 1 19 17426 1 1 21 ALA HA H -6.228 -2.061 -5.270 1.00 . A A . 21 ALA HA 1 1 19 17427 1 1 21 ALA HB1 H -3.467 -2.102 -4.014 1.00 . A A . 21 ALA HB1 1 1 19 17428 1 1 21 ALA HB2 H -4.521 -0.689 -4.019 1.00 . A A . 21 ALA HB2 1 1 19 17429 1 1 21 ALA HB3 H -5.016 -2.154 -3.172 1.00 . A A . 21 ALA HB3 1 1 19 17430 1 1 21 ALA N N -4.967 -3.748 -5.432 1.00 . A A . 21 ALA N 1 1 19 17431 1 1 21 ALA O O -3.606 -0.830 -6.401 1.00 . A A . 21 ALA O 1 1 19 17432 1 1 22 PRO C C -4.979 0.238 -8.977 1.00 . A A . 22 PRO C 1 1 19 17433 1 1 22 PRO CA C -4.636 -1.251 -8.936 1.00 . A A . 22 PRO CA 1 1 19 17434 1 1 22 PRO CB C -5.389 -2.021 -10.021 1.00 . A A . 22 PRO CB 1 1 19 17435 1 1 22 PRO CD C -6.275 -2.742 -7.886 1.00 . A A . 22 PRO CD 1 1 19 17436 1 1 22 PRO CG C -6.625 -2.527 -9.341 1.00 . A A . 22 PRO CG 1 1 19 17437 1 1 22 PRO HA H -3.574 -1.402 -9.045 1.00 . A A . 22 PRO HA 1 1 19 17438 1 1 22 PRO HB2 H -5.616 -1.352 -10.841 1.00 . A A . 22 PRO HB2 1 1 19 17439 1 1 22 PRO HB3 H -4.775 -2.832 -10.379 1.00 . A A . 22 PRO HB3 1 1 19 17440 1 1 22 PRO HD2 H -7.106 -2.458 -7.254 1.00 . A A . 22 PRO HD2 1 1 19 17441 1 1 22 PRO HD3 H -5.997 -3.768 -7.711 1.00 . A A . 22 PRO HD3 1 1 19 17442 1 1 22 PRO HG2 H -7.415 -1.794 -9.433 1.00 . A A . 22 PRO HG2 1 1 19 17443 1 1 22 PRO HG3 H -6.930 -3.462 -9.786 1.00 . A A . 22 PRO HG3 1 1 19 17444 1 1 22 PRO N N -5.127 -1.855 -7.669 1.00 . A A . 22 PRO N 1 1 19 17445 1 1 22 PRO O O -5.629 0.716 -9.886 1.00 . A A . 22 PRO O 1 1 19 17446 1 1 23 GLY C C -4.163 3.036 -6.724 1.00 . A A . 23 GLY C 1 1 19 17447 1 1 23 GLY CA C -4.836 2.431 -7.954 1.00 . A A . 23 GLY CA 1 1 19 17448 1 1 23 GLY H H -4.023 0.562 -7.271 1.00 . A A . 23 GLY H 1 1 19 17449 1 1 23 GLY HA2 H -4.452 2.900 -8.849 1.00 . A A . 23 GLY HA2 1 1 19 17450 1 1 23 GLY HA3 H -5.902 2.586 -7.891 1.00 . A A . 23 GLY HA3 1 1 19 17451 1 1 23 GLY N N -4.545 0.972 -7.992 1.00 . A A . 23 GLY N 1 1 19 17452 1 1 23 GLY O O -3.279 3.863 -6.832 1.00 . A A . 23 GLY O 1 1 19 17453 1 1 24 ALA C C -2.496 2.703 -4.265 1.00 . A A . 24 ALA C 1 1 19 17454 1 1 24 ALA CA C -3.941 3.163 -4.315 1.00 . A A . 24 ALA CA 1 1 19 17455 1 1 24 ALA CB C -4.686 2.631 -3.089 1.00 . A A . 24 ALA CB 1 1 19 17456 1 1 24 ALA H H -5.271 1.948 -5.489 1.00 . A A . 24 ALA H 1 1 19 17457 1 1 24 ALA HA H -3.972 4.243 -4.324 1.00 . A A . 24 ALA HA 1 1 19 17458 1 1 24 ALA HB1 H -5.733 2.515 -3.326 1.00 . A A . 24 ALA HB1 1 1 19 17459 1 1 24 ALA HB2 H -4.274 1.674 -2.804 1.00 . A A . 24 ALA HB2 1 1 19 17460 1 1 24 ALA HB3 H -4.577 3.328 -2.271 1.00 . A A . 24 ALA HB3 1 1 19 17461 1 1 24 ALA N N -4.565 2.622 -5.553 1.00 . A A . 24 ALA N 1 1 19 17462 1 1 24 ALA O O -1.604 3.459 -3.933 1.00 . A A . 24 ALA O 1 1 19 17463 1 1 25 PHE C C -0.304 0.984 -6.001 1.00 . A A . 25 PHE C 1 1 19 17464 1 1 25 PHE CA C -0.850 0.996 -4.576 1.00 . A A . 25 PHE CA 1 1 19 17465 1 1 25 PHE CB C -0.776 -0.413 -3.991 1.00 . A A . 25 PHE CB 1 1 19 17466 1 1 25 PHE CD1 C 1.333 0.376 -2.853 1.00 . A A . 25 PHE CD1 1 1 19 17467 1 1 25 PHE CD2 C -0.030 -1.297 -1.749 1.00 . A A . 25 PHE CD2 1 1 19 17468 1 1 25 PHE CE1 C 2.237 0.341 -1.784 1.00 . A A . 25 PHE CE1 1 1 19 17469 1 1 25 PHE CE2 C 0.877 -1.332 -0.681 1.00 . A A . 25 PHE CE2 1 1 19 17470 1 1 25 PHE CG C 0.198 -0.442 -2.835 1.00 . A A . 25 PHE CG 1 1 19 17471 1 1 25 PHE CZ C 2.012 -0.512 -0.699 1.00 . A A . 25 PHE CZ 1 1 19 17472 1 1 25 PHE H H -2.973 0.872 -4.876 1.00 . A A . 25 PHE H 1 1 19 17473 1 1 25 PHE HA H -0.272 1.675 -3.974 1.00 . A A . 25 PHE HA 1 1 19 17474 1 1 25 PHE HB2 H -1.755 -0.714 -3.646 1.00 . A A . 25 PHE HB2 1 1 19 17475 1 1 25 PHE HB3 H -0.438 -1.094 -4.756 1.00 . A A . 25 PHE HB3 1 1 19 17476 1 1 25 PHE HD1 H 1.511 1.035 -3.689 1.00 . A A . 25 PHE HD1 1 1 19 17477 1 1 25 PHE HD2 H -0.905 -1.928 -1.734 1.00 . A A . 25 PHE HD2 1 1 19 17478 1 1 25 PHE HE1 H 3.108 0.970 -1.796 1.00 . A A . 25 PHE HE1 1 1 19 17479 1 1 25 PHE HE2 H 0.700 -1.991 0.156 1.00 . A A . 25 PHE HE2 1 1 19 17480 1 1 25 PHE HZ H 2.711 -0.538 0.123 1.00 . A A . 25 PHE HZ 1 1 19 17481 1 1 25 PHE N N -2.248 1.472 -4.602 1.00 . A A . 25 PHE N 1 1 19 17482 1 1 25 PHE O O -0.939 0.502 -6.918 1.00 . A A . 25 PHE O 1 1 19 17483 1 1 26 ALA C C 2.966 1.769 -7.449 1.00 . A A . 26 ALA C 1 1 19 17484 1 1 26 ALA CA C 1.460 1.538 -7.556 1.00 . A A . 26 ALA CA 1 1 19 17485 1 1 26 ALA CB C 0.825 2.669 -8.367 1.00 . A A . 26 ALA CB 1 1 19 17486 1 1 26 ALA H H 1.355 1.896 -5.434 1.00 . A A . 26 ALA H 1 1 19 17487 1 1 26 ALA HA H 1.274 0.594 -8.048 1.00 . A A . 26 ALA HA 1 1 19 17488 1 1 26 ALA HB1 H -0.100 2.972 -7.897 1.00 . A A . 26 ALA HB1 1 1 19 17489 1 1 26 ALA HB2 H 1.501 3.510 -8.404 1.00 . A A . 26 ALA HB2 1 1 19 17490 1 1 26 ALA HB3 H 0.622 2.325 -9.370 1.00 . A A . 26 ALA HB3 1 1 19 17491 1 1 26 ALA N N 0.867 1.512 -6.192 1.00 . A A . 26 ALA N 1 1 19 17492 1 1 26 ALA O O 3.419 2.662 -6.761 1.00 . A A . 26 ALA O 1 1 19 17493 1 1 27 MET C C 5.623 2.406 -8.813 1.00 . A A . 27 MET C 1 1 19 17494 1 1 27 MET CA C 5.225 1.147 -8.050 1.00 . A A . 27 MET CA 1 1 19 17495 1 1 27 MET CB C 5.917 -0.067 -8.676 1.00 . A A . 27 MET CB 1 1 19 17496 1 1 27 MET CE C 5.657 -1.140 -12.644 1.00 . A A . 27 MET CE 1 1 19 17497 1 1 27 MET CG C 5.355 -0.307 -10.079 1.00 . A A . 27 MET CG 1 1 19 17498 1 1 27 MET H H 3.365 0.254 -8.669 1.00 . A A . 27 MET H 1 1 19 17499 1 1 27 MET HA H 5.522 1.242 -7.027 1.00 . A A . 27 MET HA 1 1 19 17500 1 1 27 MET HB2 H 6.979 0.117 -8.740 1.00 . A A . 27 MET HB2 1 1 19 17501 1 1 27 MET HB3 H 5.738 -0.938 -8.064 1.00 . A A . 27 MET HB3 1 1 19 17502 1 1 27 MET HE1 H 4.989 -0.291 -12.679 1.00 . A A . 27 MET HE1 1 1 19 17503 1 1 27 MET HE2 H 6.322 -1.107 -13.493 1.00 . A A . 27 MET HE2 1 1 19 17504 1 1 27 MET HE3 H 5.086 -2.058 -12.674 1.00 . A A . 27 MET HE3 1 1 19 17505 1 1 27 MET HG2 H 4.495 -0.957 -10.015 1.00 . A A . 27 MET HG2 1 1 19 17506 1 1 27 MET HG3 H 5.062 0.636 -10.515 1.00 . A A . 27 MET HG3 1 1 19 17507 1 1 27 MET N N 3.749 0.970 -8.121 1.00 . A A . 27 MET N 1 1 19 17508 1 1 27 MET O O 4.961 2.800 -9.752 1.00 . A A . 27 MET O 1 1 19 17509 1 1 27 MET SD S 6.621 -1.082 -11.113 1.00 . A A . 27 MET SD 1 1 19 17510 1 1 28 ASP C C 8.553 4.010 -9.609 1.00 . A A . 28 ASP C 1 1 19 17511 1 1 28 ASP CA C 7.120 4.247 -9.183 1.00 . A A . 28 ASP CA 1 1 19 17512 1 1 28 ASP CB C 7.025 5.466 -8.264 1.00 . A A . 28 ASP CB 1 1 19 17513 1 1 28 ASP CG C 6.535 6.677 -9.060 1.00 . A A . 28 ASP CG 1 1 19 17514 1 1 28 ASP H H 7.272 2.714 -7.688 1.00 . A A . 28 ASP H 1 1 19 17515 1 1 28 ASP HA H 6.492 4.382 -10.051 1.00 . A A . 28 ASP HA 1 1 19 17516 1 1 28 ASP HB2 H 6.329 5.257 -7.464 1.00 . A A . 28 ASP HB2 1 1 19 17517 1 1 28 ASP HB3 H 7.996 5.678 -7.848 1.00 . A A . 28 ASP HB3 1 1 19 17518 1 1 28 ASP N N 6.708 3.040 -8.442 1.00 . A A . 28 ASP N 1 1 19 17519 1 1 28 ASP O O 9.195 3.151 -9.045 1.00 . A A . 28 ASP O 1 1 19 17520 1 1 28 ASP OD1 O 5.660 6.500 -9.891 1.00 . A A . 28 ASP OD1 1 1 19 17521 1 1 28 ASP OD2 O 7.043 7.761 -8.824 1.00 . A A . 28 ASP OD2 1 1 19 17522 1 1 29 PRO C C 11.312 5.441 -10.221 1.00 . A A . 29 PRO C 1 1 19 17523 1 1 29 PRO CA C 10.381 4.607 -11.091 1.00 . A A . 29 PRO CA 1 1 19 17524 1 1 29 PRO CB C 10.298 5.155 -12.514 1.00 . A A . 29 PRO CB 1 1 19 17525 1 1 29 PRO CD C 8.278 5.813 -11.290 1.00 . A A . 29 PRO CD 1 1 19 17526 1 1 29 PRO CG C 9.129 6.101 -12.514 1.00 . A A . 29 PRO CG 1 1 19 17527 1 1 29 PRO HA H 10.680 3.571 -11.101 1.00 . A A . 29 PRO HA 1 1 19 17528 1 1 29 PRO HB2 H 11.227 5.655 -12.754 1.00 . A A . 29 PRO HB2 1 1 19 17529 1 1 29 PRO HB3 H 10.145 4.340 -13.202 1.00 . A A . 29 PRO HB3 1 1 19 17530 1 1 29 PRO HD2 H 8.201 6.699 -10.677 1.00 . A A . 29 PRO HD2 1 1 19 17531 1 1 29 PRO HD3 H 7.303 5.470 -11.578 1.00 . A A . 29 PRO HD3 1 1 19 17532 1 1 29 PRO HG2 H 9.490 7.119 -12.482 1.00 . A A . 29 PRO HG2 1 1 19 17533 1 1 29 PRO HG3 H 8.542 5.947 -13.407 1.00 . A A . 29 PRO HG3 1 1 19 17534 1 1 29 PRO N N 9.001 4.758 -10.584 1.00 . A A . 29 PRO N 1 1 19 17535 1 1 29 PRO O O 12.509 5.236 -10.180 1.00 . A A . 29 PRO O 1 1 19 17536 1 1 30 GLU C C 11.578 6.484 -7.236 1.00 . A A . 30 GLU C 1 1 19 17537 1 1 30 GLU CA C 11.553 7.203 -8.576 1.00 . A A . 30 GLU CA 1 1 19 17538 1 1 30 GLU CB C 10.923 8.584 -8.416 1.00 . A A . 30 GLU CB 1 1 19 17539 1 1 30 GLU CD C 10.158 10.368 -9.994 1.00 . A A . 30 GLU CD 1 1 19 17540 1 1 30 GLU CG C 10.014 8.893 -9.610 1.00 . A A . 30 GLU CG 1 1 19 17541 1 1 30 GLU H H 9.770 6.468 -9.532 1.00 . A A . 30 GLU H 1 1 19 17542 1 1 30 GLU HA H 12.550 7.305 -8.950 1.00 . A A . 30 GLU HA 1 1 19 17543 1 1 30 GLU HB2 H 10.352 8.598 -7.513 1.00 . A A . 30 GLU HB2 1 1 19 17544 1 1 30 GLU HB3 H 11.703 9.329 -8.359 1.00 . A A . 30 GLU HB3 1 1 19 17545 1 1 30 GLU HG2 H 10.297 8.275 -10.450 1.00 . A A . 30 GLU HG2 1 1 19 17546 1 1 30 GLU HG3 H 8.987 8.691 -9.345 1.00 . A A . 30 GLU HG3 1 1 19 17547 1 1 30 GLU N N 10.745 6.360 -9.496 1.00 . A A . 30 GLU N 1 1 19 17548 1 1 30 GLU O O 12.523 6.566 -6.477 1.00 . A A . 30 GLU O 1 1 19 17549 1 1 30 GLU OE1 O 9.812 11.209 -9.181 1.00 . A A . 30 GLU OE1 1 1 19 17550 1 1 30 GLU OE2 O 10.612 10.630 -11.096 1.00 . A A . 30 GLU OE2 1 1 19 17551 1 1 31 ILE C C 10.676 3.474 -6.082 1.00 . A A . 31 ILE C 1 1 19 17552 1 1 31 ILE CA C 10.473 4.945 -5.725 1.00 . A A . 31 ILE CA 1 1 19 17553 1 1 31 ILE CB C 9.113 5.165 -5.042 1.00 . A A . 31 ILE CB 1 1 19 17554 1 1 31 ILE CD1 C 6.665 4.655 -5.199 1.00 . A A . 31 ILE CD1 1 1 19 17555 1 1 31 ILE CG1 C 8.067 4.199 -5.612 1.00 . A A . 31 ILE CG1 1 1 19 17556 1 1 31 ILE CG2 C 8.658 6.606 -5.278 1.00 . A A . 31 ILE CG2 1 1 19 17557 1 1 31 ILE H H 9.819 5.671 -7.628 1.00 . A A . 31 ILE H 1 1 19 17558 1 1 31 ILE HA H 11.249 5.249 -5.070 1.00 . A A . 31 ILE HA 1 1 19 17559 1 1 31 ILE HB H 9.218 4.995 -3.978 1.00 . A A . 31 ILE HB 1 1 19 17560 1 1 31 ILE HD11 H 6.618 4.736 -4.123 1.00 . A A . 31 ILE HD11 1 1 19 17561 1 1 31 ILE HD12 H 6.454 5.616 -5.642 1.00 . A A . 31 ILE HD12 1 1 19 17562 1 1 31 ILE HD13 H 5.937 3.934 -5.538 1.00 . A A . 31 ILE HD13 1 1 19 17563 1 1 31 ILE HG12 H 8.141 4.184 -6.689 1.00 . A A . 31 ILE HG12 1 1 19 17564 1 1 31 ILE HG13 H 8.249 3.208 -5.226 1.00 . A A . 31 ILE HG13 1 1 19 17565 1 1 31 ILE HG21 H 9.523 7.240 -5.407 1.00 . A A . 31 ILE HG21 1 1 19 17566 1 1 31 ILE HG22 H 8.045 6.649 -6.166 1.00 . A A . 31 ILE HG22 1 1 19 17567 1 1 31 ILE HG23 H 8.085 6.948 -4.428 1.00 . A A . 31 ILE HG23 1 1 19 17568 1 1 31 ILE N N 10.543 5.736 -6.975 1.00 . A A . 31 ILE N 1 1 19 17569 1 1 31 ILE O O 10.728 2.621 -5.220 1.00 . A A . 31 ILE O 1 1 19 17570 1 1 32 GLU C C 10.265 0.838 -6.894 1.00 . A A . 32 GLU C 1 1 19 17571 1 1 32 GLU CA C 10.969 1.791 -7.845 1.00 . A A . 32 GLU CA 1 1 19 17572 1 1 32 GLU CB C 12.460 1.453 -7.912 1.00 . A A . 32 GLU CB 1 1 19 17573 1 1 32 GLU CD C 14.338 3.080 -8.174 1.00 . A A . 32 GLU CD 1 1 19 17574 1 1 32 GLU CG C 13.157 2.411 -8.881 1.00 . A A . 32 GLU CG 1 1 19 17575 1 1 32 GLU H H 10.732 3.912 -8.023 1.00 . A A . 32 GLU H 1 1 19 17576 1 1 32 GLU HA H 10.528 1.701 -8.826 1.00 . A A . 32 GLU HA 1 1 19 17577 1 1 32 GLU HB2 H 12.897 1.550 -6.930 1.00 . A A . 32 GLU HB2 1 1 19 17578 1 1 32 GLU HB3 H 12.584 0.438 -8.263 1.00 . A A . 32 GLU HB3 1 1 19 17579 1 1 32 GLU HG2 H 13.515 1.859 -9.738 1.00 . A A . 32 GLU HG2 1 1 19 17580 1 1 32 GLU HG3 H 12.458 3.167 -9.204 1.00 . A A . 32 GLU HG3 1 1 19 17581 1 1 32 GLU N N 10.784 3.191 -7.363 1.00 . A A . 32 GLU N 1 1 19 17582 1 1 32 GLU O O 10.747 -0.237 -6.605 1.00 . A A . 32 GLU O 1 1 19 17583 1 1 32 GLU OE1 O 15.077 2.377 -7.505 1.00 . A A . 32 GLU OE1 1 1 19 17584 1 1 32 GLU OE2 O 14.483 4.283 -8.315 1.00 . A A . 32 GLU OE2 1 1 19 17585 1 1 33 LYS C C 6.930 0.789 -5.310 1.00 . A A . 33 LYS C 1 1 19 17586 1 1 33 LYS CA C 8.395 0.363 -5.424 1.00 . A A . 33 LYS CA 1 1 19 17587 1 1 33 LYS CB C 9.037 0.476 -4.035 1.00 . A A . 33 LYS CB 1 1 19 17588 1 1 33 LYS CD C 10.368 -1.613 -4.448 1.00 . A A . 33 LYS CD 1 1 19 17589 1 1 33 LYS CE C 11.785 -2.183 -4.540 1.00 . A A . 33 LYS CE 1 1 19 17590 1 1 33 LYS CG C 10.439 -0.140 -4.028 1.00 . A A . 33 LYS CG 1 1 19 17591 1 1 33 LYS H H 8.770 2.128 -6.654 1.00 . A A . 33 LYS H 1 1 19 17592 1 1 33 LYS HA H 8.443 -0.660 -5.759 1.00 . A A . 33 LYS HA 1 1 19 17593 1 1 33 LYS HB2 H 9.108 1.520 -3.761 1.00 . A A . 33 LYS HB2 1 1 19 17594 1 1 33 LYS HB3 H 8.419 -0.038 -3.314 1.00 . A A . 33 LYS HB3 1 1 19 17595 1 1 33 LYS HD2 H 9.803 -2.169 -3.714 1.00 . A A . 33 LYS HD2 1 1 19 17596 1 1 33 LYS HD3 H 9.888 -1.696 -5.409 1.00 . A A . 33 LYS HD3 1 1 19 17597 1 1 33 LYS HE2 H 11.754 -3.250 -4.383 1.00 . A A . 33 LYS HE2 1 1 19 17598 1 1 33 LYS HE3 H 12.194 -1.975 -5.518 1.00 . A A . 33 LYS HE3 1 1 19 17599 1 1 33 LYS HG2 H 11.077 0.403 -4.707 1.00 . A A . 33 LYS HG2 1 1 19 17600 1 1 33 LYS HG3 H 10.850 -0.077 -3.030 1.00 . A A . 33 LYS HG3 1 1 19 17601 1 1 33 LYS HZ1 H 12.151 -1.577 -2.582 1.00 . A A . 33 LYS HZ1 1 1 19 17602 1 1 33 LYS HZ2 H 13.541 -2.070 -3.427 1.00 . A A . 33 LYS HZ2 1 1 19 17603 1 1 33 LYS HZ3 H 12.836 -0.564 -3.760 1.00 . A A . 33 LYS HZ3 1 1 19 17604 1 1 33 LYS N N 9.131 1.242 -6.395 1.00 . A A . 33 LYS N 1 1 19 17605 1 1 33 LYS NZ N 12.643 -1.551 -3.498 1.00 . A A . 33 LYS NZ 1 1 19 17606 1 1 33 LYS O O 6.597 1.951 -5.433 1.00 . A A . 33 LYS O 1 1 19 17607 1 1 34 ALA C C 4.377 1.132 -3.759 1.00 . A A . 34 ALA C 1 1 19 17608 1 1 34 ALA CA C 4.599 0.176 -4.935 1.00 . A A . 34 ALA CA 1 1 19 17609 1 1 34 ALA CB C 3.810 -1.112 -4.690 1.00 . A A . 34 ALA CB 1 1 19 17610 1 1 34 ALA H H 6.350 -1.079 -4.964 1.00 . A A . 34 ALA H 1 1 19 17611 1 1 34 ALA HA H 4.250 0.640 -5.843 1.00 . A A . 34 ALA HA 1 1 19 17612 1 1 34 ALA HB1 H 4.408 -1.961 -4.986 1.00 . A A . 34 ALA HB1 1 1 19 17613 1 1 34 ALA HB2 H 3.566 -1.191 -3.641 1.00 . A A . 34 ALA HB2 1 1 19 17614 1 1 34 ALA HB3 H 2.900 -1.092 -5.271 1.00 . A A . 34 ALA HB3 1 1 19 17615 1 1 34 ALA N N 6.051 -0.151 -5.066 1.00 . A A . 34 ALA N 1 1 19 17616 1 1 34 ALA O O 4.963 0.981 -2.707 1.00 . A A . 34 ALA O 1 1 19 17617 1 1 35 TYR C C 1.724 3.298 -2.685 1.00 . A A . 35 TYR C 1 1 19 17618 1 1 35 TYR CA C 3.242 3.096 -2.846 1.00 . A A . 35 TYR CA 1 1 19 17619 1 1 35 TYR CB C 3.958 4.427 -3.149 1.00 . A A . 35 TYR CB 1 1 19 17620 1 1 35 TYR CD1 C 2.436 4.572 -5.200 1.00 . A A . 35 TYR CD1 1 1 19 17621 1 1 35 TYR CD2 C 3.712 6.516 -4.525 1.00 . A A . 35 TYR CD2 1 1 19 17622 1 1 35 TYR CE1 C 1.890 5.299 -6.263 1.00 . A A . 35 TYR CE1 1 1 19 17623 1 1 35 TYR CE2 C 3.169 7.241 -5.589 1.00 . A A . 35 TYR CE2 1 1 19 17624 1 1 35 TYR CG C 3.348 5.180 -4.323 1.00 . A A . 35 TYR CG 1 1 19 17625 1 1 35 TYR CZ C 2.252 6.634 -6.455 1.00 . A A . 35 TYR CZ 1 1 19 17626 1 1 35 TYR H H 3.076 2.190 -4.800 1.00 . A A . 35 TYR H 1 1 19 17627 1 1 35 TYR HA H 3.627 2.708 -1.906 1.00 . A A . 35 TYR HA 1 1 19 17628 1 1 35 TYR HB2 H 3.910 5.056 -2.274 1.00 . A A . 35 TYR HB2 1 1 19 17629 1 1 35 TYR HB3 H 4.995 4.219 -3.370 1.00 . A A . 35 TYR HB3 1 1 19 17630 1 1 35 TYR HD1 H 2.160 3.548 -5.069 1.00 . A A . 35 TYR HD1 1 1 19 17631 1 1 35 TYR HD2 H 4.413 6.990 -3.853 1.00 . A A . 35 TYR HD2 1 1 19 17632 1 1 35 TYR HE1 H 1.183 4.830 -6.931 1.00 . A A . 35 TYR HE1 1 1 19 17633 1 1 35 TYR HE2 H 3.453 8.271 -5.741 1.00 . A A . 35 TYR HE2 1 1 19 17634 1 1 35 TYR HH H 0.970 7.851 -7.173 1.00 . A A . 35 TYR HH 1 1 19 17635 1 1 35 TYR N N 3.528 2.110 -3.940 1.00 . A A . 35 TYR N 1 1 19 17636 1 1 35 TYR O O 0.963 3.253 -3.625 1.00 . A A . 35 TYR O 1 1 19 17637 1 1 35 TYR OH O 1.716 7.349 -7.507 1.00 . A A . 35 TYR OH 1 1 19 17638 1 1 36 VAL C C -0.560 5.141 -1.451 1.00 . A A . 36 VAL C 1 1 19 17639 1 1 36 VAL CA C -0.194 3.666 -1.262 1.00 . A A . 36 VAL CA 1 1 19 17640 1 1 36 VAL CB C -0.532 3.189 0.155 1.00 . A A . 36 VAL CB 1 1 19 17641 1 1 36 VAL CG1 C -1.755 3.921 0.705 1.00 . A A . 36 VAL CG1 1 1 19 17642 1 1 36 VAL CG2 C -0.826 1.689 0.115 1.00 . A A . 36 VAL CG2 1 1 19 17643 1 1 36 VAL H H 1.886 3.504 -0.721 1.00 . A A . 36 VAL H 1 1 19 17644 1 1 36 VAL HA H -0.738 3.070 -1.979 1.00 . A A . 36 VAL HA 1 1 19 17645 1 1 36 VAL HB H 0.312 3.373 0.800 1.00 . A A . 36 VAL HB 1 1 19 17646 1 1 36 VAL HG11 H -2.463 4.085 -0.091 1.00 . A A . 36 VAL HG11 1 1 19 17647 1 1 36 VAL HG12 H -2.211 3.320 1.477 1.00 . A A . 36 VAL HG12 1 1 19 17648 1 1 36 VAL HG13 H -1.449 4.869 1.119 1.00 . A A . 36 VAL HG13 1 1 19 17649 1 1 36 VAL HG21 H 0.014 1.170 -0.323 1.00 . A A . 36 VAL HG21 1 1 19 17650 1 1 36 VAL HG22 H -0.989 1.326 1.118 1.00 . A A . 36 VAL HG22 1 1 19 17651 1 1 36 VAL HG23 H -1.708 1.511 -0.480 1.00 . A A . 36 VAL HG23 1 1 19 17652 1 1 36 VAL N N 1.270 3.491 -1.482 1.00 . A A . 36 VAL N 1 1 19 17653 1 1 36 VAL O O -0.487 5.933 -0.533 1.00 . A A . 36 VAL O 1 1 19 17654 1 1 37 LYS C C -2.792 7.106 -3.084 1.00 . A A . 37 LYS C 1 1 19 17655 1 1 37 LYS CA C -1.289 6.937 -2.908 1.00 . A A . 37 LYS CA 1 1 19 17656 1 1 37 LYS CB C -0.640 7.388 -4.207 1.00 . A A . 37 LYS CB 1 1 19 17657 1 1 37 LYS CD C 1.190 8.263 -2.737 1.00 . A A . 37 LYS CD 1 1 19 17658 1 1 37 LYS CE C 1.551 7.270 -1.633 1.00 . A A . 37 LYS CE 1 1 19 17659 1 1 37 LYS CG C 0.863 7.504 -4.029 1.00 . A A . 37 LYS CG 1 1 19 17660 1 1 37 LYS H H -0.978 4.857 -3.371 1.00 . A A . 37 LYS H 1 1 19 17661 1 1 37 LYS HA H -0.938 7.553 -2.103 1.00 . A A . 37 LYS HA 1 1 19 17662 1 1 37 LYS HB2 H -0.854 6.668 -4.982 1.00 . A A . 37 LYS HB2 1 1 19 17663 1 1 37 LYS HB3 H -1.040 8.349 -4.491 1.00 . A A . 37 LYS HB3 1 1 19 17664 1 1 37 LYS HD2 H 2.025 8.924 -2.914 1.00 . A A . 37 LYS HD2 1 1 19 17665 1 1 37 LYS HD3 H 0.332 8.844 -2.433 1.00 . A A . 37 LYS HD3 1 1 19 17666 1 1 37 LYS HE2 H 0.927 7.449 -0.769 1.00 . A A . 37 LYS HE2 1 1 19 17667 1 1 37 LYS HE3 H 1.394 6.263 -1.989 1.00 . A A . 37 LYS HE3 1 1 19 17668 1 1 37 LYS HG2 H 1.297 6.512 -3.994 1.00 . A A . 37 LYS HG2 1 1 19 17669 1 1 37 LYS HG3 H 1.257 8.048 -4.866 1.00 . A A . 37 LYS HG3 1 1 19 17670 1 1 37 LYS HZ1 H 3.229 8.452 -1.280 1.00 . A A . 37 LYS HZ1 1 1 19 17671 1 1 37 LYS HZ2 H 3.133 7.072 -0.295 1.00 . A A . 37 LYS HZ2 1 1 19 17672 1 1 37 LYS HZ3 H 3.582 6.919 -1.923 1.00 . A A . 37 LYS HZ3 1 1 19 17673 1 1 37 LYS N N -0.939 5.514 -2.644 1.00 . A A . 37 LYS N 1 1 19 17674 1 1 37 LYS NZ N 2.982 7.442 -1.254 1.00 . A A . 37 LYS NZ 1 1 19 17675 1 1 37 LYS O O -3.412 7.950 -2.467 1.00 . A A . 37 LYS O 1 1 19 17676 1 1 38 ASP C C -5.650 5.678 -3.242 1.00 . A A . 38 ASP C 1 1 19 17677 1 1 38 ASP CA C -4.826 6.500 -4.232 1.00 . A A . 38 ASP CA 1 1 19 17678 1 1 38 ASP CB C -5.112 6.048 -5.662 1.00 . A A . 38 ASP CB 1 1 19 17679 1 1 38 ASP CG C -6.616 6.123 -5.935 1.00 . A A . 38 ASP CG 1 1 19 17680 1 1 38 ASP H H -2.835 5.690 -4.476 1.00 . A A . 38 ASP H 1 1 19 17681 1 1 38 ASP HA H -5.093 7.541 -4.133 1.00 . A A . 38 ASP HA 1 1 19 17682 1 1 38 ASP HB2 H -4.583 6.692 -6.352 1.00 . A A . 38 ASP HB2 1 1 19 17683 1 1 38 ASP HB3 H -4.773 5.036 -5.791 1.00 . A A . 38 ASP HB3 1 1 19 17684 1 1 38 ASP N N -3.370 6.345 -3.964 1.00 . A A . 38 ASP N 1 1 19 17685 1 1 38 ASP O O -6.185 4.639 -3.572 1.00 . A A . 38 ASP O 1 1 19 17686 1 1 38 ASP OD1 O -7.320 6.682 -5.110 1.00 . A A . 38 ASP OD1 1 1 19 17687 1 1 38 ASP OD2 O -7.037 5.621 -6.963 1.00 . A A . 38 ASP OD2 1 1 19 17688 1 1 39 VAL C C -7.941 5.061 -1.608 1.00 . A A . 39 VAL C 1 1 19 17689 1 1 39 VAL CA C -6.573 5.412 -1.017 1.00 . A A . 39 VAL CA 1 1 19 17690 1 1 39 VAL CB C -6.763 6.299 0.215 1.00 . A A . 39 VAL CB 1 1 19 17691 1 1 39 VAL CG1 C -5.406 6.572 0.863 1.00 . A A . 39 VAL CG1 1 1 19 17692 1 1 39 VAL CG2 C -7.399 7.625 -0.208 1.00 . A A . 39 VAL CG2 1 1 19 17693 1 1 39 VAL H H -5.343 6.997 -1.792 1.00 . A A . 39 VAL H 1 1 19 17694 1 1 39 VAL HA H -6.057 4.507 -0.735 1.00 . A A . 39 VAL HA 1 1 19 17695 1 1 39 VAL HB H -7.407 5.798 0.923 1.00 . A A . 39 VAL HB 1 1 19 17696 1 1 39 VAL HG11 H -4.718 5.781 0.604 1.00 . A A . 39 VAL HG11 1 1 19 17697 1 1 39 VAL HG12 H -5.019 7.516 0.505 1.00 . A A . 39 VAL HG12 1 1 19 17698 1 1 39 VAL HG13 H -5.520 6.614 1.936 1.00 . A A . 39 VAL HG13 1 1 19 17699 1 1 39 VAL HG21 H -7.308 7.742 -1.278 1.00 . A A . 39 VAL HG21 1 1 19 17700 1 1 39 VAL HG22 H -8.443 7.629 0.066 1.00 . A A . 39 VAL HG22 1 1 19 17701 1 1 39 VAL HG23 H -6.892 8.441 0.286 1.00 . A A . 39 VAL HG23 1 1 19 17702 1 1 39 VAL N N -5.772 6.149 -2.032 1.00 . A A . 39 VAL N 1 1 19 17703 1 1 39 VAL O O -8.533 4.054 -1.271 1.00 . A A . 39 VAL O 1 1 19 17704 1 1 40 GLU C C -9.612 4.557 -4.207 1.00 . A A . 40 GLU C 1 1 19 17705 1 1 40 GLU CA C -9.775 5.597 -3.095 1.00 . A A . 40 GLU CA 1 1 19 17706 1 1 40 GLU CB C -10.355 6.886 -3.685 1.00 . A A . 40 GLU CB 1 1 19 17707 1 1 40 GLU CD C -10.910 9.157 -2.800 1.00 . A A . 40 GLU CD 1 1 19 17708 1 1 40 GLU CG C -11.107 7.653 -2.597 1.00 . A A . 40 GLU CG 1 1 19 17709 1 1 40 GLU H H -7.953 6.690 -2.741 1.00 . A A . 40 GLU H 1 1 19 17710 1 1 40 GLU HA H -10.444 5.215 -2.339 1.00 . A A . 40 GLU HA 1 1 19 17711 1 1 40 GLU HB2 H -9.551 7.498 -4.070 1.00 . A A . 40 GLU HB2 1 1 19 17712 1 1 40 GLU HB3 H -11.035 6.641 -4.486 1.00 . A A . 40 GLU HB3 1 1 19 17713 1 1 40 GLU HG2 H -12.160 7.417 -2.652 1.00 . A A . 40 GLU HG2 1 1 19 17714 1 1 40 GLU HG3 H -10.726 7.370 -1.627 1.00 . A A . 40 GLU HG3 1 1 19 17715 1 1 40 GLU N N -8.447 5.884 -2.485 1.00 . A A . 40 GLU N 1 1 19 17716 1 1 40 GLU O O -10.578 4.074 -4.763 1.00 . A A . 40 GLU O 1 1 19 17717 1 1 40 GLU OE1 O -10.849 9.577 -3.944 1.00 . A A . 40 GLU OE1 1 1 19 17718 1 1 40 GLU OE2 O -10.823 9.864 -1.809 1.00 . A A . 40 GLU OE2 1 1 19 17719 1 1 41 GLY C C -8.242 1.789 -5.023 1.00 . A A . 41 GLY C 1 1 19 17720 1 1 41 GLY CA C -8.176 3.200 -5.612 1.00 . A A . 41 GLY CA 1 1 19 17721 1 1 41 GLY H H -7.631 4.608 -4.075 1.00 . A A . 41 GLY H 1 1 19 17722 1 1 41 GLY HA2 H -8.940 3.312 -6.369 1.00 . A A . 41 GLY HA2 1 1 19 17723 1 1 41 GLY HA3 H -7.204 3.356 -6.055 1.00 . A A . 41 GLY HA3 1 1 19 17724 1 1 41 GLY N N -8.397 4.207 -4.535 1.00 . A A . 41 GLY N 1 1 19 17725 1 1 41 GLY O O -7.995 0.812 -5.702 1.00 . A A . 41 GLY O 1 1 19 17726 1 1 42 ALA C C -9.642 0.350 -1.973 1.00 . A A . 42 ALA C 1 1 19 17727 1 1 42 ALA CA C -8.653 0.320 -3.141 1.00 . A A . 42 ALA CA 1 1 19 17728 1 1 42 ALA CB C -7.270 -0.087 -2.628 1.00 . A A . 42 ALA CB 1 1 19 17729 1 1 42 ALA H H -8.771 2.470 -3.233 1.00 . A A . 42 ALA H 1 1 19 17730 1 1 42 ALA HA H -8.989 -0.397 -3.877 1.00 . A A . 42 ALA HA 1 1 19 17731 1 1 42 ALA HB1 H -6.691 0.799 -2.414 1.00 . A A . 42 ALA HB1 1 1 19 17732 1 1 42 ALA HB2 H -7.378 -0.673 -1.728 1.00 . A A . 42 ALA HB2 1 1 19 17733 1 1 42 ALA HB3 H -6.766 -0.674 -3.382 1.00 . A A . 42 ALA HB3 1 1 19 17734 1 1 42 ALA N N -8.574 1.672 -3.766 1.00 . A A . 42 ALA N 1 1 19 17735 1 1 42 ALA O O -9.437 1.038 -0.993 1.00 . A A . 42 ALA O 1 1 19 17736 1 1 43 SER C C -11.073 -0.991 0.300 1.00 . A A . 43 SER C 1 1 19 17737 1 1 43 SER CA C -11.711 -0.403 -0.961 1.00 . A A . 43 SER CA 1 1 19 17738 1 1 43 SER CB C -12.914 -1.256 -1.365 1.00 . A A . 43 SER CB 1 1 19 17739 1 1 43 SER H H -10.859 -0.940 -2.867 1.00 . A A . 43 SER H 1 1 19 17740 1 1 43 SER HA H -12.038 0.606 -0.761 1.00 . A A . 43 SER HA 1 1 19 17741 1 1 43 SER HB2 H -12.967 -2.130 -0.737 1.00 . A A . 43 SER HB2 1 1 19 17742 1 1 43 SER HB3 H -13.821 -0.676 -1.247 1.00 . A A . 43 SER HB3 1 1 19 17743 1 1 43 SER HG H -13.341 -2.422 -2.863 1.00 . A A . 43 SER HG 1 1 19 17744 1 1 43 SER N N -10.712 -0.391 -2.068 1.00 . A A . 43 SER N 1 1 19 17745 1 1 43 SER O O -10.037 -1.626 0.245 1.00 . A A . 43 SER O 1 1 19 17746 1 1 43 SER OG O -12.770 -1.663 -2.719 1.00 . A A . 43 SER OG 1 1 19 17747 1 1 44 GLN C C -10.790 -2.811 2.514 1.00 . A A . 44 GLN C 1 1 19 17748 1 1 44 GLN CA C -11.117 -1.330 2.701 1.00 . A A . 44 GLN CA 1 1 19 17749 1 1 44 GLN CB C -12.137 -1.170 3.830 1.00 . A A . 44 GLN CB 1 1 19 17750 1 1 44 GLN CD C -11.882 -0.519 6.230 1.00 . A A . 44 GLN CD 1 1 19 17751 1 1 44 GLN CG C -11.485 -1.543 5.163 1.00 . A A . 44 GLN CG 1 1 19 17752 1 1 44 GLN H H -12.518 -0.271 1.456 1.00 . A A . 44 GLN H 1 1 19 17753 1 1 44 GLN HA H -10.215 -0.791 2.951 1.00 . A A . 44 GLN HA 1 1 19 17754 1 1 44 GLN HB2 H -12.475 -0.145 3.867 1.00 . A A . 44 GLN HB2 1 1 19 17755 1 1 44 GLN HB3 H -12.979 -1.820 3.649 1.00 . A A . 44 GLN HB3 1 1 19 17756 1 1 44 GLN HE21 H -13.550 -1.475 6.726 1.00 . A A . 44 GLN HE21 1 1 19 17757 1 1 44 GLN HE22 H -13.247 -0.045 7.591 1.00 . A A . 44 GLN HE22 1 1 19 17758 1 1 44 GLN HG2 H -11.820 -2.526 5.464 1.00 . A A . 44 GLN HG2 1 1 19 17759 1 1 44 GLN HG3 H -10.412 -1.545 5.052 1.00 . A A . 44 GLN HG3 1 1 19 17760 1 1 44 GLN N N -11.684 -0.785 1.435 1.00 . A A . 44 GLN N 1 1 19 17761 1 1 44 GLN NE2 N -12.985 -0.695 6.905 1.00 . A A . 44 GLN NE2 1 1 19 17762 1 1 44 GLN O O -9.744 -3.280 2.914 1.00 . A A . 44 GLN O 1 1 19 17763 1 1 44 GLN OE1 O -11.181 0.447 6.452 1.00 . A A . 44 GLN OE1 1 1 19 17764 1 1 45 GLU C C -10.262 -5.159 0.688 1.00 . A A . 45 GLU C 1 1 19 17765 1 1 45 GLU CA C -11.408 -5.002 1.689 1.00 . A A . 45 GLU CA 1 1 19 17766 1 1 45 GLU CB C -12.666 -5.674 1.135 1.00 . A A . 45 GLU CB 1 1 19 17767 1 1 45 GLU CD C -13.471 -6.088 3.464 1.00 . A A . 45 GLU CD 1 1 19 17768 1 1 45 GLU CG C -13.825 -5.468 2.111 1.00 . A A . 45 GLU CG 1 1 19 17769 1 1 45 GLU H H -12.512 -3.156 1.586 1.00 . A A . 45 GLU H 1 1 19 17770 1 1 45 GLU HA H -11.134 -5.463 2.626 1.00 . A A . 45 GLU HA 1 1 19 17771 1 1 45 GLU HB2 H -12.916 -5.236 0.179 1.00 . A A . 45 GLU HB2 1 1 19 17772 1 1 45 GLU HB3 H -12.485 -6.732 1.011 1.00 . A A . 45 GLU HB3 1 1 19 17773 1 1 45 GLU HG2 H -14.008 -4.411 2.235 1.00 . A A . 45 GLU HG2 1 1 19 17774 1 1 45 GLU HG3 H -14.713 -5.945 1.722 1.00 . A A . 45 GLU HG3 1 1 19 17775 1 1 45 GLU N N -11.674 -3.553 1.905 1.00 . A A . 45 GLU N 1 1 19 17776 1 1 45 GLU O O -9.738 -6.240 0.489 1.00 . A A . 45 GLU O 1 1 19 17777 1 1 45 GLU OE1 O -12.551 -6.890 3.503 1.00 . A A . 45 GLU OE1 1 1 19 17778 1 1 45 GLU OE2 O -14.125 -5.753 4.436 1.00 . A A . 45 GLU OE2 1 1 19 17779 1 1 46 GLU C C -7.489 -3.702 -0.161 1.00 . A A . 46 GLU C 1 1 19 17780 1 1 46 GLU CA C -8.727 -4.160 -0.894 1.00 . A A . 46 GLU CA 1 1 19 17781 1 1 46 GLU CB C -9.000 -3.215 -2.061 1.00 . A A . 46 GLU CB 1 1 19 17782 1 1 46 GLU CD C -10.461 -3.008 -4.078 1.00 . A A . 46 GLU CD 1 1 19 17783 1 1 46 GLU CG C -10.391 -3.496 -2.630 1.00 . A A . 46 GLU CG 1 1 19 17784 1 1 46 GLU H H -10.257 -3.212 0.273 1.00 . A A . 46 GLU H 1 1 19 17785 1 1 46 GLU HA H -8.603 -5.172 -1.248 1.00 . A A . 46 GLU HA 1 1 19 17786 1 1 46 GLU HB2 H -8.954 -2.193 -1.713 1.00 . A A . 46 GLU HB2 1 1 19 17787 1 1 46 GLU HB3 H -8.259 -3.367 -2.825 1.00 . A A . 46 GLU HB3 1 1 19 17788 1 1 46 GLU HG2 H -10.586 -4.558 -2.597 1.00 . A A . 46 GLU HG2 1 1 19 17789 1 1 46 GLU HG3 H -11.131 -2.975 -2.041 1.00 . A A . 46 GLU HG3 1 1 19 17790 1 1 46 GLU N N -9.848 -4.083 0.075 1.00 . A A . 46 GLU N 1 1 19 17791 1 1 46 GLU O O -6.428 -4.288 -0.244 1.00 . A A . 46 GLU O 1 1 19 17792 1 1 46 GLU OE1 O -9.450 -3.080 -4.756 1.00 . A A . 46 GLU OE1 1 1 19 17793 1 1 46 GLU OE2 O -11.526 -2.571 -4.484 1.00 . A A . 46 GLU OE2 1 1 19 17794 1 1 47 VAL C C -6.101 -3.209 2.377 1.00 . A A . 47 VAL C 1 1 19 17795 1 1 47 VAL CA C -6.524 -2.130 1.382 1.00 . A A . 47 VAL CA 1 1 19 17796 1 1 47 VAL CB C -6.990 -0.883 2.131 1.00 . A A . 47 VAL CB 1 1 19 17797 1 1 47 VAL CG1 C -5.788 -0.006 2.430 1.00 . A A . 47 VAL CG1 1 1 19 17798 1 1 47 VAL CG2 C -7.980 -0.097 1.266 1.00 . A A . 47 VAL CG2 1 1 19 17799 1 1 47 VAL H H -8.518 -2.240 0.637 1.00 . A A . 47 VAL H 1 1 19 17800 1 1 47 VAL HA H -5.697 -1.882 0.733 1.00 . A A . 47 VAL HA 1 1 19 17801 1 1 47 VAL HB H -7.467 -1.173 3.056 1.00 . A A . 47 VAL HB 1 1 19 17802 1 1 47 VAL HG11 H -4.911 -0.439 1.974 1.00 . A A . 47 VAL HG11 1 1 19 17803 1 1 47 VAL HG12 H -5.959 0.980 2.025 1.00 . A A . 47 VAL HG12 1 1 19 17804 1 1 47 VAL HG13 H -5.651 0.058 3.496 1.00 . A A . 47 VAL HG13 1 1 19 17805 1 1 47 VAL HG21 H -7.955 -0.479 0.255 1.00 . A A . 47 VAL HG21 1 1 19 17806 1 1 47 VAL HG22 H -8.975 -0.206 1.667 1.00 . A A . 47 VAL HG22 1 1 19 17807 1 1 47 VAL HG23 H -7.704 0.947 1.262 1.00 . A A . 47 VAL HG23 1 1 19 17808 1 1 47 VAL N N -7.648 -2.658 0.585 1.00 . A A . 47 VAL N 1 1 19 17809 1 1 47 VAL O O -4.931 -3.462 2.582 1.00 . A A . 47 VAL O 1 1 19 17810 1 1 48 GLU C C -6.278 -6.164 3.199 1.00 . A A . 48 GLU C 1 1 19 17811 1 1 48 GLU CA C -6.762 -4.921 3.951 1.00 . A A . 48 GLU CA 1 1 19 17812 1 1 48 GLU CB C -8.058 -5.223 4.678 1.00 . A A . 48 GLU CB 1 1 19 17813 1 1 48 GLU CD C -8.572 -5.948 7.010 1.00 . A A . 48 GLU CD 1 1 19 17814 1 1 48 GLU CG C -7.905 -4.873 6.150 1.00 . A A . 48 GLU CG 1 1 19 17815 1 1 48 GLU H H -7.993 -3.647 2.811 1.00 . A A . 48 GLU H 1 1 19 17816 1 1 48 GLU HA H -6.012 -4.593 4.653 1.00 . A A . 48 GLU HA 1 1 19 17817 1 1 48 GLU HB2 H -8.851 -4.626 4.250 1.00 . A A . 48 GLU HB2 1 1 19 17818 1 1 48 GLU HB3 H -8.295 -6.255 4.565 1.00 . A A . 48 GLU HB3 1 1 19 17819 1 1 48 GLU HG2 H -6.855 -4.810 6.393 1.00 . A A . 48 GLU HG2 1 1 19 17820 1 1 48 GLU HG3 H -8.375 -3.921 6.334 1.00 . A A . 48 GLU HG3 1 1 19 17821 1 1 48 GLU N N -7.059 -3.857 2.987 1.00 . A A . 48 GLU N 1 1 19 17822 1 1 48 GLU O O -5.253 -6.732 3.519 1.00 . A A . 48 GLU O 1 1 19 17823 1 1 48 GLU OE1 O -9.489 -6.586 6.519 1.00 . A A . 48 GLU OE1 1 1 19 17824 1 1 48 GLU OE2 O -8.154 -6.115 8.144 1.00 . A A . 48 GLU OE2 1 1 19 17825 1 1 49 GLU C C -5.122 -7.573 0.965 1.00 . A A . 49 GLU C 1 1 19 17826 1 1 49 GLU CA C -6.563 -7.785 1.426 1.00 . A A . 49 GLU CA 1 1 19 17827 1 1 49 GLU CB C -7.472 -7.979 0.210 1.00 . A A . 49 GLU CB 1 1 19 17828 1 1 49 GLU CD C -8.192 -10.318 0.726 1.00 . A A . 49 GLU CD 1 1 19 17829 1 1 49 GLU CG C -8.657 -8.866 0.598 1.00 . A A . 49 GLU CG 1 1 19 17830 1 1 49 GLU H H -7.823 -6.111 1.942 1.00 . A A . 49 GLU H 1 1 19 17831 1 1 49 GLU HA H -6.612 -8.658 2.061 1.00 . A A . 49 GLU HA 1 1 19 17832 1 1 49 GLU HB2 H -7.835 -7.019 -0.125 1.00 . A A . 49 GLU HB2 1 1 19 17833 1 1 49 GLU HB3 H -6.915 -8.453 -0.584 1.00 . A A . 49 GLU HB3 1 1 19 17834 1 1 49 GLU HG2 H -9.062 -8.533 1.543 1.00 . A A . 49 GLU HG2 1 1 19 17835 1 1 49 GLU HG3 H -9.420 -8.800 -0.163 1.00 . A A . 49 GLU HG3 1 1 19 17836 1 1 49 GLU N N -7.002 -6.586 2.194 1.00 . A A . 49 GLU N 1 1 19 17837 1 1 49 GLU O O -4.282 -8.440 1.099 1.00 . A A . 49 GLU O 1 1 19 17838 1 1 49 GLU OE1 O -7.029 -10.573 0.460 1.00 . A A . 49 GLU OE1 1 1 19 17839 1 1 49 GLU OE2 O -9.008 -11.150 1.086 1.00 . A A . 49 GLU OE2 1 1 19 17840 1 1 50 ALA C C -2.534 -6.008 1.213 1.00 . A A . 50 ALA C 1 1 19 17841 1 1 50 ALA CA C -3.438 -6.140 -0.017 1.00 . A A . 50 ALA CA 1 1 19 17842 1 1 50 ALA CB C -3.412 -4.834 -0.814 1.00 . A A . 50 ALA CB 1 1 19 17843 1 1 50 ALA H H -5.518 -5.728 0.348 1.00 . A A . 50 ALA H 1 1 19 17844 1 1 50 ALA HA H -3.089 -6.952 -0.638 1.00 . A A . 50 ALA HA 1 1 19 17845 1 1 50 ALA HB1 H -4.351 -4.710 -1.331 1.00 . A A . 50 ALA HB1 1 1 19 17846 1 1 50 ALA HB2 H -3.260 -4.004 -0.139 1.00 . A A . 50 ALA HB2 1 1 19 17847 1 1 50 ALA HB3 H -2.607 -4.866 -1.531 1.00 . A A . 50 ALA HB3 1 1 19 17848 1 1 50 ALA N N -4.827 -6.418 0.437 1.00 . A A . 50 ALA N 1 1 19 17849 1 1 50 ALA O O -1.324 -6.020 1.114 1.00 . A A . 50 ALA O 1 1 19 17850 1 1 51 MET C C -1.843 -7.132 4.070 1.00 . A A . 51 MET C 1 1 19 17851 1 1 51 MET CA C -2.313 -5.748 3.616 1.00 . A A . 51 MET CA 1 1 19 17852 1 1 51 MET CB C -3.174 -5.115 4.715 1.00 . A A . 51 MET CB 1 1 19 17853 1 1 51 MET CE C -3.094 -1.976 7.027 1.00 . A A . 51 MET CE 1 1 19 17854 1 1 51 MET CG C -2.342 -4.101 5.504 1.00 . A A . 51 MET CG 1 1 19 17855 1 1 51 MET H H -4.099 -5.874 2.428 1.00 . A A . 51 MET H 1 1 19 17856 1 1 51 MET HA H -1.455 -5.121 3.424 1.00 . A A . 51 MET HA 1 1 19 17857 1 1 51 MET HB2 H -4.019 -4.614 4.263 1.00 . A A . 51 MET HB2 1 1 19 17858 1 1 51 MET HB3 H -3.528 -5.885 5.382 1.00 . A A . 51 MET HB3 1 1 19 17859 1 1 51 MET HE1 H -2.502 -1.664 6.178 1.00 . A A . 51 MET HE1 1 1 19 17860 1 1 51 MET HE2 H -4.103 -1.598 6.928 1.00 . A A . 51 MET HE2 1 1 19 17861 1 1 51 MET HE3 H -2.655 -1.586 7.931 1.00 . A A . 51 MET HE3 1 1 19 17862 1 1 51 MET HG2 H -1.351 -4.497 5.665 1.00 . A A . 51 MET HG2 1 1 19 17863 1 1 51 MET HG3 H -2.276 -3.179 4.947 1.00 . A A . 51 MET HG3 1 1 19 17864 1 1 51 MET N N -3.122 -5.881 2.374 1.00 . A A . 51 MET N 1 1 19 17865 1 1 51 MET O O -0.879 -7.264 4.795 1.00 . A A . 51 MET O 1 1 19 17866 1 1 51 MET SD S -3.133 -3.785 7.103 1.00 . A A . 51 MET SD 1 1 19 17867 1 1 52 ASP C C -1.236 -10.164 2.963 1.00 . A A . 52 ASP C 1 1 19 17868 1 1 52 ASP CA C -2.109 -9.541 4.057 1.00 . A A . 52 ASP CA 1 1 19 17869 1 1 52 ASP CB C -3.357 -10.404 4.266 1.00 . A A . 52 ASP CB 1 1 19 17870 1 1 52 ASP CG C -3.050 -11.505 5.283 1.00 . A A . 52 ASP CG 1 1 19 17871 1 1 52 ASP H H -3.297 -8.041 3.062 1.00 . A A . 52 ASP H 1 1 19 17872 1 1 52 ASP HA H -1.548 -9.490 4.978 1.00 . A A . 52 ASP HA 1 1 19 17873 1 1 52 ASP HB2 H -4.161 -9.785 4.635 1.00 . A A . 52 ASP HB2 1 1 19 17874 1 1 52 ASP HB3 H -3.647 -10.852 3.329 1.00 . A A . 52 ASP HB3 1 1 19 17875 1 1 52 ASP N N -2.519 -8.167 3.648 1.00 . A A . 52 ASP N 1 1 19 17876 1 1 52 ASP O O -0.322 -10.917 3.238 1.00 . A A . 52 ASP O 1 1 19 17877 1 1 52 ASP OD1 O -2.862 -11.179 6.443 1.00 . A A . 52 ASP OD1 1 1 19 17878 1 1 52 ASP OD2 O -3.010 -12.657 4.883 1.00 . A A . 52 ASP OD2 1 1 19 17879 1 1 53 THR C C 0.790 -10.211 0.896 1.00 . A A . 53 THR C 1 1 19 17880 1 1 53 THR CA C -0.698 -10.430 0.614 1.00 . A A . 53 THR CA 1 1 19 17881 1 1 53 THR CB C -1.072 -9.736 -0.698 1.00 . A A . 53 THR CB 1 1 19 17882 1 1 53 THR CG2 C -2.016 -10.628 -1.505 1.00 . A A . 53 THR CG2 1 1 19 17883 1 1 53 THR H H -2.252 -9.248 1.525 1.00 . A A . 53 THR H 1 1 19 17884 1 1 53 THR HA H -0.899 -11.488 0.530 1.00 . A A . 53 THR HA 1 1 19 17885 1 1 53 THR HB H -0.179 -9.549 -1.274 1.00 . A A . 53 THR HB 1 1 19 17886 1 1 53 THR HG1 H -1.224 -7.802 -0.849 1.00 . A A . 53 THR HG1 1 1 19 17887 1 1 53 THR HG21 H -1.632 -11.638 -1.518 1.00 . A A . 53 THR HG21 1 1 19 17888 1 1 53 THR HG22 H -2.995 -10.622 -1.050 1.00 . A A . 53 THR HG22 1 1 19 17889 1 1 53 THR HG23 H -2.086 -10.256 -2.517 1.00 . A A . 53 THR HG23 1 1 19 17890 1 1 53 THR N N -1.511 -9.857 1.725 1.00 . A A . 53 THR N 1 1 19 17891 1 1 53 THR O O 1.576 -11.138 0.897 1.00 . A A . 53 THR O 1 1 19 17892 1 1 53 THR OG1 O -1.714 -8.502 -0.410 1.00 . A A . 53 THR OG1 1 1 19 17893 1 1 54 CYS C C 3.168 -9.709 2.415 1.00 . A A . 54 CYS C 1 1 19 17894 1 1 54 CYS CA C 2.624 -8.706 1.398 1.00 . A A . 54 CYS CA 1 1 19 17895 1 1 54 CYS CB C 2.772 -7.290 1.959 1.00 . A A . 54 CYS CB 1 1 19 17896 1 1 54 CYS H H 0.536 -8.255 1.112 1.00 . A A . 54 CYS H 1 1 19 17897 1 1 54 CYS HA H 3.185 -8.787 0.478 1.00 . A A . 54 CYS HA 1 1 19 17898 1 1 54 CYS HB2 H 2.030 -6.643 1.516 1.00 . A A . 54 CYS HB2 1 1 19 17899 1 1 54 CYS HB3 H 2.632 -7.314 3.029 1.00 . A A . 54 CYS HB3 1 1 19 17900 1 1 54 CYS N N 1.186 -8.989 1.125 1.00 . A A . 54 CYS N 1 1 19 17901 1 1 54 CYS O O 2.496 -10.060 3.364 1.00 . A A . 54 CYS O 1 1 19 17902 1 1 54 CYS SG S 4.418 -6.547 1.664 1.00 . A A . 54 CYS SG 1 1 19 17903 1 1 55 PRO C C 5.518 -10.367 4.363 1.00 . A A . 55 PRO C 1 1 19 17904 1 1 55 PRO CA C 5.042 -11.091 3.100 1.00 . A A . 55 PRO CA 1 1 19 17905 1 1 55 PRO CB C 6.225 -11.612 2.283 1.00 . A A . 55 PRO CB 1 1 19 17906 1 1 55 PRO CD C 5.246 -9.745 1.061 1.00 . A A . 55 PRO CD 1 1 19 17907 1 1 55 PRO CG C 6.520 -10.533 1.284 1.00 . A A . 55 PRO CG 1 1 19 17908 1 1 55 PRO HA H 4.375 -11.900 3.348 1.00 . A A . 55 PRO HA 1 1 19 17909 1 1 55 PRO HB2 H 7.059 -11.796 2.947 1.00 . A A . 55 PRO HB2 1 1 19 17910 1 1 55 PRO HB3 H 5.944 -12.533 1.797 1.00 . A A . 55 PRO HB3 1 1 19 17911 1 1 55 PRO HD2 H 5.455 -8.684 1.078 1.00 . A A . 55 PRO HD2 1 1 19 17912 1 1 55 PRO HD3 H 4.789 -10.025 0.125 1.00 . A A . 55 PRO HD3 1 1 19 17913 1 1 55 PRO HG2 H 7.295 -9.885 1.669 1.00 . A A . 55 PRO HG2 1 1 19 17914 1 1 55 PRO HG3 H 6.839 -10.977 0.354 1.00 . A A . 55 PRO HG3 1 1 19 17915 1 1 55 PRO N N 4.383 -10.126 2.184 1.00 . A A . 55 PRO N 1 1 19 17916 1 1 55 PRO O O 5.061 -10.639 5.456 1.00 . A A . 55 PRO O 1 1 19 17917 1 1 56 VAL C C 5.843 -7.693 5.845 1.00 . A A . 56 VAL C 1 1 19 17918 1 1 56 VAL CA C 6.919 -8.687 5.404 1.00 . A A . 56 VAL CA 1 1 19 17919 1 1 56 VAL CB C 8.197 -7.932 5.029 1.00 . A A . 56 VAL CB 1 1 19 17920 1 1 56 VAL CG1 C 8.508 -6.882 6.097 1.00 . A A . 56 VAL CG1 1 1 19 17921 1 1 56 VAL CG2 C 9.363 -8.919 4.931 1.00 . A A . 56 VAL CG2 1 1 19 17922 1 1 56 VAL H H 6.771 -9.229 3.326 1.00 . A A . 56 VAL H 1 1 19 17923 1 1 56 VAL HA H 7.127 -9.376 6.209 1.00 . A A . 56 VAL HA 1 1 19 17924 1 1 56 VAL HB H 8.057 -7.443 4.075 1.00 . A A . 56 VAL HB 1 1 19 17925 1 1 56 VAL HG11 H 8.262 -7.276 7.072 1.00 . A A . 56 VAL HG11 1 1 19 17926 1 1 56 VAL HG12 H 9.559 -6.633 6.063 1.00 . A A . 56 VAL HG12 1 1 19 17927 1 1 56 VAL HG13 H 7.922 -5.993 5.910 1.00 . A A . 56 VAL HG13 1 1 19 17928 1 1 56 VAL HG21 H 9.079 -9.859 5.380 1.00 . A A . 56 VAL HG21 1 1 19 17929 1 1 56 VAL HG22 H 9.615 -9.077 3.892 1.00 . A A . 56 VAL HG22 1 1 19 17930 1 1 56 VAL HG23 H 10.220 -8.515 5.451 1.00 . A A . 56 VAL HG23 1 1 19 17931 1 1 56 VAL N N 6.423 -9.439 4.218 1.00 . A A . 56 VAL N 1 1 19 17932 1 1 56 VAL O O 5.826 -7.236 6.970 1.00 . A A . 56 VAL O 1 1 19 17933 1 1 57 GLN C C 4.475 -5.026 5.617 1.00 . A A . 57 GLN C 1 1 19 17934 1 1 57 GLN CA C 3.862 -6.394 5.321 1.00 . A A . 57 GLN CA 1 1 19 17935 1 1 57 GLN CB C 3.117 -6.900 6.558 1.00 . A A . 57 GLN CB 1 1 19 17936 1 1 57 GLN CD C 0.773 -7.311 7.317 1.00 . A A . 57 GLN CD 1 1 19 17937 1 1 57 GLN CG C 1.744 -7.429 6.140 1.00 . A A . 57 GLN CG 1 1 19 17938 1 1 57 GLN H H 4.974 -7.740 4.060 1.00 . A A . 57 GLN H 1 1 19 17939 1 1 57 GLN HA H 3.170 -6.307 4.497 1.00 . A A . 57 GLN HA 1 1 19 17940 1 1 57 GLN HB2 H 3.686 -7.693 7.021 1.00 . A A . 57 GLN HB2 1 1 19 17941 1 1 57 GLN HB3 H 2.992 -6.089 7.260 1.00 . A A . 57 GLN HB3 1 1 19 17942 1 1 57 GLN HE21 H -0.635 -6.410 6.247 1.00 . A A . 57 GLN HE21 1 1 19 17943 1 1 57 GLN HE22 H -1.020 -6.670 7.879 1.00 . A A . 57 GLN HE22 1 1 19 17944 1 1 57 GLN HG2 H 1.373 -6.849 5.307 1.00 . A A . 57 GLN HG2 1 1 19 17945 1 1 57 GLN HG3 H 1.830 -8.465 5.849 1.00 . A A . 57 GLN HG3 1 1 19 17946 1 1 57 GLN N N 4.941 -7.358 4.962 1.00 . A A . 57 GLN N 1 1 19 17947 1 1 57 GLN NE2 N -0.390 -6.751 7.132 1.00 . A A . 57 GLN NE2 1 1 19 17948 1 1 57 GLN O O 4.894 -4.746 6.722 1.00 . A A . 57 GLN O 1 1 19 17949 1 1 57 GLN OE1 O 1.077 -7.734 8.415 1.00 . A A . 57 GLN OE1 1 1 19 17950 1 1 58 CYS C C 3.969 -1.812 5.045 1.00 . A A . 58 CYS C 1 1 19 17951 1 1 58 CYS CA C 5.108 -2.813 4.858 1.00 . A A . 58 CYS CA 1 1 19 17952 1 1 58 CYS CB C 5.951 -2.387 3.648 1.00 . A A . 58 CYS CB 1 1 19 17953 1 1 58 CYS H H 4.180 -4.413 3.752 1.00 . A A . 58 CYS H 1 1 19 17954 1 1 58 CYS HA H 5.727 -2.827 5.744 1.00 . A A . 58 CYS HA 1 1 19 17955 1 1 58 CYS HB2 H 5.354 -1.767 2.997 1.00 . A A . 58 CYS HB2 1 1 19 17956 1 1 58 CYS HB3 H 6.805 -1.822 3.991 1.00 . A A . 58 CYS HB3 1 1 19 17957 1 1 58 CYS HG H 5.751 -4.354 2.474 1.00 . A A . 58 CYS HG 1 1 19 17958 1 1 58 CYS N N 4.526 -4.168 4.635 1.00 . A A . 58 CYS N 1 1 19 17959 1 1 58 CYS O O 4.114 -0.801 5.704 1.00 . A A . 58 CYS O 1 1 19 17960 1 1 58 CYS SG S 6.523 -3.840 2.726 1.00 . A A . 58 CYS SG 1 1 19 17961 1 1 59 ILE C C 1.280 -1.021 6.057 1.00 . A A . 59 ILE C 1 1 19 17962 1 1 59 ILE CA C 1.680 -1.159 4.588 1.00 . A A . 59 ILE CA 1 1 19 17963 1 1 59 ILE CB C 0.498 -1.717 3.795 1.00 . A A . 59 ILE CB 1 1 19 17964 1 1 59 ILE CD1 C -1.656 -0.941 2.794 1.00 . A A . 59 ILE CD1 1 1 19 17965 1 1 59 ILE CG1 C -0.728 -0.826 4.005 1.00 . A A . 59 ILE CG1 1 1 19 17966 1 1 59 ILE CG2 C 0.185 -3.133 4.281 1.00 . A A . 59 ILE CG2 1 1 19 17967 1 1 59 ILE H H 2.748 -2.907 3.931 1.00 . A A . 59 ILE H 1 1 19 17968 1 1 59 ILE HA H 1.951 -0.192 4.196 1.00 . A A . 59 ILE HA 1 1 19 17969 1 1 59 ILE HB H 0.751 -1.747 2.745 1.00 . A A . 59 ILE HB 1 1 19 17970 1 1 59 ILE HD11 H -1.077 -0.850 1.887 1.00 . A A . 59 ILE HD11 1 1 19 17971 1 1 59 ILE HD12 H -2.151 -1.901 2.811 1.00 . A A . 59 ILE HD12 1 1 19 17972 1 1 59 ILE HD13 H -2.394 -0.154 2.830 1.00 . A A . 59 ILE HD13 1 1 19 17973 1 1 59 ILE HG12 H -1.255 -1.143 4.894 1.00 . A A . 59 ILE HG12 1 1 19 17974 1 1 59 ILE HG13 H -0.415 0.201 4.120 1.00 . A A . 59 ILE HG13 1 1 19 17975 1 1 59 ILE HG21 H 0.134 -3.138 5.360 1.00 . A A . 59 ILE HG21 1 1 19 17976 1 1 59 ILE HG22 H -0.763 -3.451 3.874 1.00 . A A . 59 ILE HG22 1 1 19 17977 1 1 59 ILE HG23 H 0.963 -3.807 3.954 1.00 . A A . 59 ILE HG23 1 1 19 17978 1 1 59 ILE N N 2.836 -2.087 4.461 1.00 . A A . 59 ILE N 1 1 19 17979 1 1 59 ILE O O 1.456 -1.924 6.850 1.00 . A A . 59 ILE O 1 1 19 17980 1 1 60 HIS C C -0.713 1.451 7.879 1.00 . A A . 60 HIS C 1 1 19 17981 1 1 60 HIS CA C 0.308 0.314 7.832 1.00 . A A . 60 HIS CA 1 1 19 17982 1 1 60 HIS CB C 1.519 0.675 8.695 1.00 . A A . 60 HIS CB 1 1 19 17983 1 1 60 HIS CD2 C 2.357 2.536 7.038 1.00 . A A . 60 HIS CD2 1 1 19 17984 1 1 60 HIS CE1 C 4.469 2.056 7.070 1.00 . A A . 60 HIS CE1 1 1 19 17985 1 1 60 HIS CG C 2.509 1.463 7.882 1.00 . A A . 60 HIS CG 1 1 19 17986 1 1 60 HIS H H 0.598 0.817 5.760 1.00 . A A . 60 HIS H 1 1 19 17987 1 1 60 HIS HA H -0.145 -0.591 8.207 1.00 . A A . 60 HIS HA 1 1 19 17988 1 1 60 HIS HB2 H 1.195 1.267 9.538 1.00 . A A . 60 HIS HB2 1 1 19 17989 1 1 60 HIS HB3 H 1.988 -0.229 9.052 1.00 . A A . 60 HIS HB3 1 1 19 17990 1 1 60 HIS HD1 H 4.302 0.458 8.392 1.00 . A A . 60 HIS HD1 1 1 19 17991 1 1 60 HIS HD2 H 1.418 3.017 6.807 1.00 . A A . 60 HIS HD2 1 1 19 17992 1 1 60 HIS HE1 H 5.533 2.074 6.878 1.00 . A A . 60 HIS HE1 1 1 19 17993 1 1 60 HIS N N 0.735 0.107 6.420 1.00 . A A . 60 HIS N 1 1 19 17994 1 1 60 HIS ND1 N 3.864 1.174 7.886 1.00 . A A . 60 HIS ND1 1 1 19 17995 1 1 60 HIS NE2 N 3.596 2.909 6.527 1.00 . A A . 60 HIS NE2 1 1 19 17996 1 1 60 HIS O O -1.079 2.011 6.864 1.00 . A A . 60 HIS O 1 1 19 17997 1 1 61 TRP C C -1.491 4.181 9.598 1.00 . A A . 61 TRP C 1 1 19 17998 1 1 61 TRP CA C -2.180 2.894 9.142 1.00 . A A . 61 TRP CA 1 1 19 17999 1 1 61 TRP CB C -3.268 2.508 10.144 1.00 . A A . 61 TRP CB 1 1 19 18000 1 1 61 TRP CD1 C -3.433 -0.007 9.880 1.00 . A A . 61 TRP CD1 1 1 19 18001 1 1 61 TRP CD2 C -5.181 1.094 9.006 1.00 . A A . 61 TRP CD2 1 1 19 18002 1 1 61 TRP CE2 C -5.422 -0.279 8.780 1.00 . A A . 61 TRP CE2 1 1 19 18003 1 1 61 TRP CE3 C -6.125 2.020 8.558 1.00 . A A . 61 TRP CE3 1 1 19 18004 1 1 61 TRP CG C -3.921 1.242 9.701 1.00 . A A . 61 TRP CG 1 1 19 18005 1 1 61 TRP CH2 C -7.511 0.222 7.680 1.00 . A A . 61 TRP CH2 1 1 19 18006 1 1 61 TRP CZ2 C -6.573 -0.717 8.124 1.00 . A A . 61 TRP CZ2 1 1 19 18007 1 1 61 TRP CZ3 C -7.287 1.591 7.897 1.00 . A A . 61 TRP CZ3 1 1 19 18008 1 1 61 TRP H H -0.879 1.333 9.853 1.00 . A A . 61 TRP H 1 1 19 18009 1 1 61 TRP HA H -2.630 3.057 8.173 1.00 . A A . 61 TRP HA 1 1 19 18010 1 1 61 TRP HB2 H -2.837 2.368 11.115 1.00 . A A . 61 TRP HB2 1 1 19 18011 1 1 61 TRP HB3 H -4.007 3.293 10.189 1.00 . A A . 61 TRP HB3 1 1 19 18012 1 1 61 TRP HD1 H -2.501 -0.255 10.369 1.00 . A A . 61 TRP HD1 1 1 19 18013 1 1 61 TRP HE1 H -4.212 -1.888 9.327 1.00 . A A . 61 TRP HE1 1 1 19 18014 1 1 61 TRP HE3 H -5.950 3.073 8.727 1.00 . A A . 61 TRP HE3 1 1 19 18015 1 1 61 TRP HH2 H -8.405 -0.105 7.171 1.00 . A A . 61 TRP HH2 1 1 19 18016 1 1 61 TRP HZ2 H -6.738 -1.772 7.960 1.00 . A A . 61 TRP HZ2 1 1 19 18017 1 1 61 TRP HZ3 H -8.010 2.316 7.553 1.00 . A A . 61 TRP HZ3 1 1 19 18018 1 1 61 TRP N N -1.181 1.796 9.044 1.00 . A A . 61 TRP N 1 1 19 18019 1 1 61 TRP NE1 N -4.325 -0.915 9.333 1.00 . A A . 61 TRP NE1 1 1 19 18020 1 1 61 TRP O O -0.372 4.166 10.074 1.00 . A A . 61 TRP O 1 1 19 18021 1 1 62 GLU C C -2.530 7.343 10.762 1.00 . A A . 62 GLU C 1 1 19 18022 1 1 62 GLU CA C -1.545 6.591 9.860 1.00 . A A . 62 GLU CA 1 1 19 18023 1 1 62 GLU CB C -1.239 7.419 8.606 1.00 . A A . 62 GLU CB 1 1 19 18024 1 1 62 GLU CD C -0.732 9.702 7.721 1.00 . A A . 62 GLU CD 1 1 19 18025 1 1 62 GLU CG C -1.076 8.896 8.976 1.00 . A A . 62 GLU CG 1 1 19 18026 1 1 62 GLU H H -3.049 5.279 9.058 1.00 . A A . 62 GLU H 1 1 19 18027 1 1 62 GLU HA H -0.630 6.404 10.403 1.00 . A A . 62 GLU HA 1 1 19 18028 1 1 62 GLU HB2 H -0.322 7.061 8.157 1.00 . A A . 62 GLU HB2 1 1 19 18029 1 1 62 GLU HB3 H -2.049 7.313 7.899 1.00 . A A . 62 GLU HB3 1 1 19 18030 1 1 62 GLU HG2 H -2.001 9.264 9.398 1.00 . A A . 62 GLU HG2 1 1 19 18031 1 1 62 GLU HG3 H -0.283 9.003 9.699 1.00 . A A . 62 GLU HG3 1 1 19 18032 1 1 62 GLU N N -2.151 5.295 9.448 1.00 . A A . 62 GLU N 1 1 19 18033 1 1 62 GLU O O -3.538 7.850 10.309 1.00 . A A . 62 GLU O 1 1 19 18034 1 1 62 GLU OE1 O -0.675 9.107 6.657 1.00 . A A . 62 GLU OE1 1 1 19 18035 1 1 62 GLU OE2 O -0.529 10.899 7.846 1.00 . A A . 62 GLU OE2 1 1 19 18036 1 1 63 ASP C C -2.579 9.506 13.302 1.00 . A A . 63 ASP C 1 1 19 18037 1 1 63 ASP CA C -3.165 8.134 12.961 1.00 . A A . 63 ASP CA 1 1 19 18038 1 1 63 ASP CB C -3.334 7.319 14.245 1.00 . A A . 63 ASP CB 1 1 19 18039 1 1 63 ASP CG C -4.469 7.911 15.082 1.00 . A A . 63 ASP CG 1 1 19 18040 1 1 63 ASP H H -1.430 7.001 12.377 1.00 . A A . 63 ASP H 1 1 19 18041 1 1 63 ASP HA H -4.128 8.263 12.487 1.00 . A A . 63 ASP HA 1 1 19 18042 1 1 63 ASP HB2 H -3.567 6.294 13.993 1.00 . A A . 63 ASP HB2 1 1 19 18043 1 1 63 ASP HB3 H -2.416 7.349 14.814 1.00 . A A . 63 ASP HB3 1 1 19 18044 1 1 63 ASP N N -2.247 7.418 12.033 1.00 . A A . 63 ASP N 1 1 19 18045 1 1 63 ASP O O -2.269 9.793 14.442 1.00 . A A . 63 ASP O 1 1 19 18046 1 1 63 ASP OD1 O -4.305 9.017 15.570 1.00 . A A . 63 ASP OD1 1 1 19 18047 1 1 63 ASP OD2 O -5.485 7.249 15.221 1.00 . A A . 63 ASP OD2 1 1 19 18048 1 1 64 GLU C C -2.719 12.770 11.909 1.00 . A A . 64 GLU C 1 1 19 18049 1 1 64 GLU CA C -1.858 11.709 12.598 1.00 . A A . 64 GLU CA 1 1 19 18050 1 1 64 GLU CB C -0.428 11.782 12.057 1.00 . A A . 64 GLU CB 1 1 19 18051 1 1 64 GLU CD C 1.895 12.526 12.604 1.00 . A A . 64 GLU CD 1 1 19 18052 1 1 64 GLU CG C 0.416 12.678 12.966 1.00 . A A . 64 GLU CG 1 1 19 18053 1 1 64 GLU H H -2.682 10.107 11.412 1.00 . A A . 64 GLU H 1 1 19 18054 1 1 64 GLU HA H -1.850 11.887 13.662 1.00 . A A . 64 GLU HA 1 1 19 18055 1 1 64 GLU HB2 H -0.002 10.790 12.031 1.00 . A A . 64 GLU HB2 1 1 19 18056 1 1 64 GLU HB3 H -0.440 12.196 11.060 1.00 . A A . 64 GLU HB3 1 1 19 18057 1 1 64 GLU HG2 H 0.116 13.709 12.836 1.00 . A A . 64 GLU HG2 1 1 19 18058 1 1 64 GLU HG3 H 0.268 12.387 13.996 1.00 . A A . 64 GLU HG3 1 1 19 18059 1 1 64 GLU N N -2.425 10.357 12.325 1.00 . A A . 64 GLU N 1 1 19 18060 1 1 64 GLU OE1 O 2.184 12.358 11.431 1.00 . A A . 64 GLU OE1 1 1 19 18061 1 1 64 GLU OE2 O 2.715 12.582 13.507 1.00 . A A . 64 GLU OE2 1 1 19 18062 2 2 1 SF4 FE1 FE 5.743 -4.334 -2.476 1.00 . B A . 65 SF4 FE1 1 1 19 18063 2 2 1 SF4 FE2 FE 4.392 -5.858 -0.404 1.00 . B A . 65 SF4 FE2 1 1 19 18064 2 2 1 SF4 FE3 FE 3.129 -4.360 -2.462 1.00 . B A . 65 SF4 FE3 1 1 19 18065 2 2 1 SF4 FE4 FE 4.694 -6.802 -3.132 1.00 . B A . 65 SF4 FE4 1 1 19 18066 2 2 1 SF4 S1 S 2.689 -6.637 -1.591 1.00 . B A . 65 SF4 S1 1 1 19 18067 2 2 1 SF4 S2 S 4.589 -4.538 -4.108 1.00 . B A . 65 SF4 S2 1 1 19 18068 2 2 1 SF4 S3 S 6.354 -6.579 -1.678 1.00 . B A . 65 SF4 S3 1 1 19 18069 2 2 1 SF4 S4 S 4.434 -3.409 -0.954 1.00 . B A . 65 SF4 S4 1 1 stop_ save_
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